USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1088 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: B 120 SER OG : rot 180:sc= 1.08 USER MOD Set 1.2: B 123 THR OG1 : rot 80:sc= 1.25 USER MOD Set 2.1: B 117 SER OG : rot 92:sc= 1.43 USER MOD Set 2.2: B 119 HIS : no HD1:sc= 0 X(o=1.4,f=1.4) USER MOD Set 3.1: A 21 THR OG1 : rot 68:sc= 0.983 USER MOD Set 3.2: B 84 THR OG1 : rot 180:sc= 0.0526 USER MOD Set 3.3: B 88 CYS SG : rot 71:sc= 0.505 USER MOD Set 3.4: B 133 LYS NZ :NH3+ -165:sc= 1.98 (180deg=0.37) USER MOD Set 4.1: B 77 HIS : no HD1:sc= 0.883 K(o=2,f=-2.4) USER MOD Set 4.2: B 137 TYR OH : rot 41:sc= 1.12 USER MOD Set 5.1: B 76 LYS NZ :NH3+ 138:sc= 0.999 (180deg=0.257) USER MOD Set 5.2: B 114 CYS SG : rot 17:sc= -1.74! USER MOD Set 6.1: A 54 THR OG1 : rot 180:sc= 1.01 USER MOD Set 6.2: A 57 THR OG1 : rot 82:sc= 0.833 USER MOD Set 7.1: A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 38 SER OG : rot 180:sc= 0 USER MOD Set 8.1: A 16 ASN : amide:sc= 0.795 K(o=0.79,f=0.0078) USER MOD Set 8.2: A 17 SER OG : rot 180:sc= 0 USER MOD Set 9.1: A 7 THR OG1 : rot 180:sc= 0.701 USER MOD Set 9.2: A 73 ASN : amide:sc= 0.786 K(o=1.5,f=0.83) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 161:sc=0.000463 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= -0.197 X(o=-0.2,f=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl -134:sc=-0.000226 (180deg=-0.115) USER MOD Single : A 14 THR OG1 : rot 30:sc= 1.26 USER MOD Single : A 24 GLN : amide:sc=-0.00138 X(o=-0.0014,f=-0.0014) USER MOD Single : A 25 GLN : amide:sc= -0.184 K(o=-0.18,f=-0.78) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 42 LYS NZ :NH3+ 145:sc= 0.995 (180deg=0.258) USER MOD Single : A 43 ASN : amide:sc= 0.577 K(o=0.58,f=-0.2) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 168:sc= 0.388 (180deg=-0.106) USER MOD Single : A 53 GLN : amide:sc= -0.867 K(o=-0.87,f=-8.4!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 0.381 K(o=0.38,f=-3.8!) USER MOD Single : A 65 MET CE :methyl -174:sc= -0.0942 (180deg=-0.133) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 74 MET CE :methyl 178:sc= 0 (180deg=-0.00748) USER MOD Single : B 80 SER OG : rot 27:sc= 0.00446 USER MOD Single : B 83 MET CE :methyl 178:sc= -0.638 (180deg=-0.643) USER MOD Single : B 93 SER OG : rot -48:sc= 1.31 USER MOD Single : B 97 ASN : amide:sc= -0.0143 X(o=-0.014,f=-0.014) USER MOD Single : B 98 LYS NZ :NH3+ 157:sc= 1.22 (180deg=0.786) USER MOD Single : B 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 104 TYR OH : rot 130:sc= 0 USER MOD Single : B 110 ASN : amide:sc= -1.05 K(o=-1.1,f=-4.5!) USER MOD Single : B 111 LYS NZ :NH3+ -176:sc= 1.66 (180deg=1.64) USER MOD Single : B 112 LYS NZ :NH3+ -176:sc= 1.25 (180deg=1.23) USER MOD Single : B 121 MET CE :methyl -134:sc= 0 (180deg=-0.0184) USER MOD Single : B 127 THR OG1 : rot 83:sc= 1.13 USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 131 THR OG1 : rot -72:sc= 1.24 USER MOD Single : B 134 THR OG1 : rot 180:sc= 0 USER MOD Single : B 136 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.016 -7.451 27.683 1.00 0.00 N ATOM 2 CA MET A 1 -10.838 -6.563 27.589 1.00 0.00 C ATOM 3 C MET A 1 -9.539 -7.364 27.632 1.00 0.00 C ATOM 4 O MET A 1 -9.454 -8.379 28.323 1.00 0.00 O ATOM 5 CB MET A 1 -10.872 -5.455 28.656 1.00 0.00 C ATOM 6 CG MET A 1 -10.690 -4.073 28.017 1.00 0.00 C ATOM 7 SD MET A 1 -9.095 -3.789 27.201 1.00 0.00 S ATOM 8 CE MET A 1 -8.023 -3.585 28.650 1.00 0.00 C ATOM 0 H1 MET A 1 -12.847 -6.896 27.972 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.197 -7.887 26.756 1.00 0.00 H new ATOM 0 H3 MET A 1 -11.835 -8.195 28.387 1.00 0.00 H new ATOM 0 HA MET A 1 -10.877 -6.063 26.621 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.820 -5.490 29.192 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.085 -5.627 29.390 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.484 -3.924 27.285 1.00 0.00 H new ATOM 0 HG3 MET A 1 -10.822 -3.315 28.789 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.000 -3.402 28.323 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.371 -2.740 29.244 1.00 0.00 H new ATOM 0 HE3 MET A 1 -8.053 -4.491 29.255 1.00 0.00 H new ATOM 20 N GLY A 2 -8.522 -6.909 26.893 1.00 0.00 N ATOM 21 CA GLY A 2 -7.247 -7.604 26.663 1.00 0.00 C ATOM 22 C GLY A 2 -7.058 -7.991 25.193 1.00 0.00 C ATOM 23 O GLY A 2 -7.849 -7.591 24.340 1.00 0.00 O ATOM 0 H GLY A 2 -8.565 -6.008 26.417 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -6.423 -6.963 26.977 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -7.207 -8.501 27.281 1.00 0.00 H new ATOM 27 N VAL A 3 -6.011 -8.762 24.889 1.00 0.00 N ATOM 28 CA VAL A 3 -5.620 -9.085 23.502 1.00 0.00 C ATOM 29 C VAL A 3 -6.738 -9.788 22.717 1.00 0.00 C ATOM 30 O VAL A 3 -7.300 -10.796 23.149 1.00 0.00 O ATOM 31 CB VAL A 3 -4.303 -9.898 23.391 1.00 0.00 C ATOM 32 CG1 VAL A 3 -3.086 -9.019 23.725 1.00 0.00 C ATOM 33 CG2 VAL A 3 -4.256 -11.182 24.234 1.00 0.00 C ATOM 0 H VAL A 3 -5.406 -9.183 25.594 1.00 0.00 H new ATOM 0 HA VAL A 3 -5.437 -8.112 23.047 1.00 0.00 H new ATOM 0 HB VAL A 3 -4.270 -10.221 22.351 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -2.175 -9.611 23.640 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -3.040 -8.181 23.029 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.179 -8.640 24.743 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.296 -11.678 24.088 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.378 -10.930 25.287 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.060 -11.850 23.925 1.00 0.00 H new ATOM 43 N ASN A 4 -7.048 -9.232 21.545 1.00 0.00 N ATOM 44 CA ASN A 4 -7.874 -9.821 20.487 1.00 0.00 C ATOM 45 C ASN A 4 -6.966 -10.199 19.295 1.00 0.00 C ATOM 46 O ASN A 4 -5.864 -9.668 19.153 1.00 0.00 O ATOM 47 CB ASN A 4 -8.943 -8.802 20.042 1.00 0.00 C ATOM 48 CG ASN A 4 -10.136 -8.650 20.985 1.00 0.00 C ATOM 49 OD1 ASN A 4 -11.284 -8.697 20.554 1.00 0.00 O ATOM 50 ND2 ASN A 4 -9.935 -8.456 22.274 1.00 0.00 N ATOM 0 H ASN A 4 -6.710 -8.303 21.293 1.00 0.00 H new ATOM 0 HA ASN A 4 -8.375 -10.716 20.857 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -8.467 -7.828 19.926 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -9.313 -9.095 19.059 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -10.730 -8.347 22.903 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -8.984 -8.415 22.641 1.00 0.00 H new ATOM 57 N SER A 5 -7.396 -11.090 18.402 1.00 0.00 N ATOM 58 CA SER A 5 -6.590 -11.480 17.235 1.00 0.00 C ATOM 59 C SER A 5 -7.425 -11.962 16.040 1.00 0.00 C ATOM 60 O SER A 5 -8.576 -12.384 16.194 1.00 0.00 O ATOM 61 CB SER A 5 -5.515 -12.516 17.617 1.00 0.00 C ATOM 62 OG SER A 5 -6.045 -13.798 17.916 1.00 0.00 O ATOM 0 H SER A 5 -8.300 -11.559 18.461 1.00 0.00 H new ATOM 0 HA SER A 5 -6.092 -10.569 16.903 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.803 -12.608 16.797 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.960 -12.150 18.481 1.00 0.00 H new ATOM 0 HG SER A 5 -5.314 -14.408 18.148 1.00 0.00 H new ATOM 68 N VAL A 6 -6.850 -11.883 14.835 1.00 0.00 N ATOM 69 CA VAL A 6 -7.500 -12.311 13.582 1.00 0.00 C ATOM 70 C VAL A 6 -6.455 -12.618 12.496 1.00 0.00 C ATOM 71 O VAL A 6 -5.314 -12.155 12.592 1.00 0.00 O ATOM 72 CB VAL A 6 -8.566 -11.273 13.131 1.00 0.00 C ATOM 73 CG1 VAL A 6 -7.939 -10.013 12.522 1.00 0.00 C ATOM 74 CG2 VAL A 6 -9.610 -11.854 12.164 1.00 0.00 C ATOM 0 H VAL A 6 -5.908 -11.516 14.696 1.00 0.00 H new ATOM 0 HA VAL A 6 -8.034 -13.244 13.762 1.00 0.00 H new ATOM 0 HB VAL A 6 -9.084 -10.994 14.049 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -8.727 -9.322 12.224 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -7.296 -9.534 13.260 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -7.347 -10.287 11.648 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -10.323 -11.077 11.889 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -9.111 -12.222 11.268 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -10.137 -12.676 12.649 1.00 0.00 H new ATOM 84 N THR A 7 -6.857 -13.381 11.469 1.00 0.00 N ATOM 85 CA THR A 7 -6.057 -13.716 10.284 1.00 0.00 C ATOM 86 C THR A 7 -6.778 -13.224 9.034 1.00 0.00 C ATOM 87 O THR A 7 -8.001 -13.329 8.923 1.00 0.00 O ATOM 88 CB THR A 7 -5.779 -15.226 10.166 1.00 0.00 C ATOM 89 OG1 THR A 7 -5.624 -15.804 11.443 1.00 0.00 O ATOM 90 CG2 THR A 7 -4.473 -15.470 9.409 1.00 0.00 C ATOM 0 H THR A 7 -7.787 -13.798 11.441 1.00 0.00 H new ATOM 0 HA THR A 7 -5.092 -13.220 10.387 1.00 0.00 H new ATOM 0 HB THR A 7 -6.625 -15.670 9.640 1.00 0.00 H new ATOM 0 HG1 THR A 7 -5.450 -16.764 11.349 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.291 -16.542 9.334 1.00 0.00 H new ATOM 0 HG22 THR A 7 -4.547 -15.044 8.409 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.649 -14.998 9.944 1.00 0.00 H new ATOM 98 N ILE A 8 -6.025 -12.652 8.101 1.00 0.00 N ATOM 99 CA ILE A 8 -6.502 -12.031 6.863 1.00 0.00 C ATOM 100 C ILE A 8 -5.688 -12.586 5.684 1.00 0.00 C ATOM 101 O ILE A 8 -4.490 -12.340 5.534 1.00 0.00 O ATOM 102 CB ILE A 8 -6.445 -10.482 6.994 1.00 0.00 C ATOM 103 CG1 ILE A 8 -7.269 -10.023 8.227 1.00 0.00 C ATOM 104 CG2 ILE A 8 -6.950 -9.790 5.713 1.00 0.00 C ATOM 105 CD1 ILE A 8 -7.447 -8.510 8.401 1.00 0.00 C ATOM 0 H ILE A 8 -5.010 -12.605 8.189 1.00 0.00 H new ATOM 0 HA ILE A 8 -7.547 -12.278 6.673 1.00 0.00 H new ATOM 0 HB ILE A 8 -5.404 -10.190 7.135 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.257 -10.479 8.167 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -6.790 -10.416 9.124 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.897 -8.709 5.838 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -6.328 -10.088 4.869 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.983 -10.083 5.524 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -8.039 -8.314 9.295 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.470 -8.038 8.502 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.959 -8.101 7.530 1.00 0.00 H new ATOM 117 N SER A 9 -6.337 -13.334 4.801 1.00 0.00 N ATOM 118 CA SER A 9 -5.742 -13.850 3.571 1.00 0.00 C ATOM 119 C SER A 9 -5.500 -12.686 2.603 1.00 0.00 C ATOM 120 O SER A 9 -6.357 -12.355 1.791 1.00 0.00 O ATOM 121 CB SER A 9 -6.624 -14.948 2.949 1.00 0.00 C ATOM 122 OG SER A 9 -6.703 -16.066 3.822 1.00 0.00 O ATOM 0 H SER A 9 -7.313 -13.606 4.921 1.00 0.00 H new ATOM 0 HA SER A 9 -4.783 -14.316 3.796 1.00 0.00 H new ATOM 0 HB2 SER A 9 -7.623 -14.557 2.756 1.00 0.00 H new ATOM 0 HB3 SER A 9 -6.211 -15.256 1.988 1.00 0.00 H new ATOM 0 HG SER A 9 -7.268 -16.758 3.418 1.00 0.00 H new ATOM 128 N VAL A 10 -4.350 -12.021 2.736 1.00 0.00 N ATOM 129 CA VAL A 10 -3.795 -11.016 1.822 1.00 0.00 C ATOM 130 C VAL A 10 -3.325 -11.651 0.502 1.00 0.00 C ATOM 131 O VAL A 10 -2.135 -11.770 0.213 1.00 0.00 O ATOM 132 CB VAL A 10 -2.669 -10.211 2.503 1.00 0.00 C ATOM 133 CG1 VAL A 10 -3.257 -9.217 3.516 1.00 0.00 C ATOM 134 CG2 VAL A 10 -1.632 -11.103 3.188 1.00 0.00 C ATOM 0 H VAL A 10 -3.740 -12.180 3.538 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.593 -10.317 1.572 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.152 -9.667 1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -2.449 -8.657 3.987 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -3.925 -8.526 3.002 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.814 -9.761 4.278 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -0.865 -10.481 3.649 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.120 -11.706 3.954 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -1.171 -11.759 2.449 1.00 0.00 H new ATOM 144 N GLU A 11 -4.285 -12.064 -0.321 1.00 0.00 N ATOM 145 CA GLU A 11 -4.042 -12.822 -1.567 1.00 0.00 C ATOM 146 C GLU A 11 -3.276 -12.041 -2.667 1.00 0.00 C ATOM 147 O GLU A 11 -2.994 -12.594 -3.730 1.00 0.00 O ATOM 148 CB GLU A 11 -5.344 -13.431 -2.126 1.00 0.00 C ATOM 149 CG GLU A 11 -6.110 -14.288 -1.107 1.00 0.00 C ATOM 150 CD GLU A 11 -7.011 -15.307 -1.801 1.00 0.00 C ATOM 151 OE1 GLU A 11 -8.082 -14.932 -2.334 1.00 0.00 O ATOM 152 OE2 GLU A 11 -6.622 -16.499 -1.834 1.00 0.00 O ATOM 0 H GLU A 11 -5.274 -11.883 -0.147 1.00 0.00 H new ATOM 0 HA GLU A 11 -3.373 -13.629 -1.270 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.993 -12.626 -2.471 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.105 -14.043 -2.996 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -5.402 -14.807 -0.461 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -6.713 -13.643 -0.467 1.00 0.00 H new ATOM 159 N GLY A 12 -2.897 -10.778 -2.423 1.00 0.00 N ATOM 160 CA GLY A 12 -2.065 -9.953 -3.318 1.00 0.00 C ATOM 161 C GLY A 12 -0.619 -9.718 -2.856 1.00 0.00 C ATOM 162 O GLY A 12 0.067 -8.890 -3.450 1.00 0.00 O ATOM 0 H GLY A 12 -3.168 -10.285 -1.572 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -2.041 -10.426 -4.300 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.549 -8.984 -3.443 1.00 0.00 H new ATOM 166 N MET A 13 -0.173 -10.379 -1.783 1.00 0.00 N ATOM 167 CA MET A 13 1.148 -10.208 -1.151 1.00 0.00 C ATOM 168 C MET A 13 1.919 -11.540 -1.145 1.00 0.00 C ATOM 169 O MET A 13 1.354 -12.544 -0.704 1.00 0.00 O ATOM 170 CB MET A 13 0.891 -9.719 0.282 1.00 0.00 C ATOM 171 CG MET A 13 2.163 -9.441 1.091 1.00 0.00 C ATOM 172 SD MET A 13 1.935 -9.656 2.871 1.00 0.00 S ATOM 173 CE MET A 13 1.946 -11.465 2.940 1.00 0.00 C ATOM 0 H MET A 13 -0.743 -11.078 -1.308 1.00 0.00 H new ATOM 0 HA MET A 13 1.757 -9.490 -1.701 1.00 0.00 H new ATOM 0 HB2 MET A 13 0.294 -8.808 0.241 1.00 0.00 H new ATOM 0 HB3 MET A 13 0.296 -10.466 0.807 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.956 -10.107 0.750 1.00 0.00 H new ATOM 0 HG3 MET A 13 2.496 -8.422 0.894 1.00 0.00 H new ATOM 0 HE1 MET A 13 1.123 -11.810 3.566 1.00 0.00 H new ATOM 0 HE2 MET A 13 1.830 -11.868 1.934 1.00 0.00 H new ATOM 0 HE3 MET A 13 2.891 -11.807 3.361 1.00 0.00 H new ATOM 183 N THR A 14 3.189 -11.568 -1.593 1.00 0.00 N ATOM 184 CA THR A 14 4.003 -12.806 -1.696 1.00 0.00 C ATOM 185 C THR A 14 5.507 -12.623 -1.934 1.00 0.00 C ATOM 186 O THR A 14 6.271 -13.522 -1.588 1.00 0.00 O ATOM 187 CB THR A 14 3.384 -13.761 -2.727 1.00 0.00 C ATOM 188 OG1 THR A 14 3.863 -15.076 -2.544 1.00 0.00 O ATOM 189 CG2 THR A 14 3.672 -13.302 -4.144 1.00 0.00 C ATOM 0 H THR A 14 3.686 -10.731 -1.896 1.00 0.00 H new ATOM 0 HA THR A 14 3.964 -13.242 -0.698 1.00 0.00 H new ATOM 0 HB THR A 14 2.305 -13.753 -2.573 1.00 0.00 H new ATOM 0 HG1 THR A 14 4.070 -15.220 -1.597 1.00 0.00 H new ATOM 0 HG21 THR A 14 3.221 -13.998 -4.851 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.253 -12.308 -4.297 1.00 0.00 H new ATOM 0 HG23 THR A 14 4.750 -13.270 -4.304 1.00 0.00 H new ATOM 197 N CYS A 15 5.947 -11.527 -2.554 1.00 0.00 N ATOM 198 CA CYS A 15 7.242 -11.461 -3.217 1.00 0.00 C ATOM 199 C CYS A 15 8.444 -11.158 -2.274 1.00 0.00 C ATOM 200 O CYS A 15 9.073 -12.093 -1.762 1.00 0.00 O ATOM 201 CB CYS A 15 7.055 -10.548 -4.442 1.00 0.00 C ATOM 202 SG CYS A 15 6.558 -8.849 -4.021 1.00 0.00 S ATOM 0 H CYS A 15 5.411 -10.661 -2.608 1.00 0.00 H new ATOM 0 HA CYS A 15 7.558 -12.443 -3.567 1.00 0.00 H new ATOM 0 HB2 CYS A 15 7.988 -10.515 -5.005 1.00 0.00 H new ATOM 0 HB3 CYS A 15 6.302 -10.985 -5.098 1.00 0.00 H new ATOM 207 N ASN A 16 8.790 -9.878 -2.091 1.00 0.00 N ATOM 208 CA ASN A 16 9.850 -9.394 -1.195 1.00 0.00 C ATOM 209 C ASN A 16 9.377 -8.356 -0.153 1.00 0.00 C ATOM 210 O ASN A 16 9.636 -8.561 1.033 1.00 0.00 O ATOM 211 CB ASN A 16 11.028 -8.855 -2.030 1.00 0.00 C ATOM 212 CG ASN A 16 12.135 -8.262 -1.155 1.00 0.00 C ATOM 213 OD1 ASN A 16 12.555 -8.862 -0.173 1.00 0.00 O ATOM 214 ND2 ASN A 16 12.626 -7.078 -1.461 1.00 0.00 N ATOM 0 H ASN A 16 8.320 -9.118 -2.583 1.00 0.00 H new ATOM 0 HA ASN A 16 10.175 -10.251 -0.605 1.00 0.00 H new ATOM 0 HB2 ASN A 16 11.440 -9.662 -2.637 1.00 0.00 H new ATOM 0 HB3 ASN A 16 10.664 -8.092 -2.718 1.00 0.00 H new ATOM 0 HD21 ASN A 16 13.355 -6.663 -0.881 1.00 0.00 H new ATOM 0 HD22 ASN A 16 12.277 -6.577 -2.278 1.00 0.00 H new ATOM 221 N SER A 17 8.706 -7.265 -0.550 1.00 0.00 N ATOM 222 CA SER A 17 8.494 -6.091 0.329 1.00 0.00 C ATOM 223 C SER A 17 7.090 -5.445 0.281 1.00 0.00 C ATOM 224 O SER A 17 6.827 -4.480 1.006 1.00 0.00 O ATOM 225 CB SER A 17 9.608 -5.050 0.124 1.00 0.00 C ATOM 226 OG SER A 17 10.787 -5.455 0.803 1.00 0.00 O ATOM 0 H SER A 17 8.296 -7.165 -1.479 1.00 0.00 H new ATOM 0 HA SER A 17 8.548 -6.494 1.340 1.00 0.00 H new ATOM 0 HB2 SER A 17 9.814 -4.932 -0.940 1.00 0.00 H new ATOM 0 HB3 SER A 17 9.281 -4.079 0.495 1.00 0.00 H new ATOM 0 HG SER A 17 11.490 -4.787 0.665 1.00 0.00 H new ATOM 232 N CYS A 18 6.131 -6.016 -0.457 1.00 0.00 N ATOM 233 CA CYS A 18 4.712 -5.890 -0.134 1.00 0.00 C ATOM 234 C CYS A 18 4.467 -6.303 1.343 1.00 0.00 C ATOM 235 O CYS A 18 3.897 -5.553 2.137 1.00 0.00 O ATOM 236 CB CYS A 18 3.979 -6.765 -1.168 1.00 0.00 C ATOM 237 SG CYS A 18 4.606 -8.463 -1.210 1.00 0.00 S ATOM 0 H CYS A 18 6.319 -6.575 -1.290 1.00 0.00 H new ATOM 0 HA CYS A 18 4.337 -4.869 -0.199 1.00 0.00 H new ATOM 0 HB2 CYS A 18 2.914 -6.780 -0.936 1.00 0.00 H new ATOM 0 HB3 CYS A 18 4.084 -6.318 -2.157 1.00 0.00 H new ATOM 242 N VAL A 19 5.038 -7.455 1.690 1.00 0.00 N ATOM 243 CA VAL A 19 5.282 -8.008 3.038 1.00 0.00 C ATOM 244 C VAL A 19 5.716 -6.913 4.035 1.00 0.00 C ATOM 245 O VAL A 19 5.032 -6.653 5.025 1.00 0.00 O ATOM 246 CB VAL A 19 6.356 -9.129 2.970 1.00 0.00 C ATOM 247 CG1 VAL A 19 6.536 -9.850 4.314 1.00 0.00 C ATOM 248 CG2 VAL A 19 6.040 -10.193 1.901 1.00 0.00 C ATOM 0 H VAL A 19 5.378 -8.093 0.970 1.00 0.00 H new ATOM 0 HA VAL A 19 4.344 -8.429 3.399 1.00 0.00 H new ATOM 0 HB VAL A 19 7.277 -8.610 2.704 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.297 -10.624 4.213 1.00 0.00 H new ATOM 0 HG12 VAL A 19 6.847 -9.132 5.073 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.592 -10.307 4.611 1.00 0.00 H new ATOM 0 HG21 VAL A 19 6.824 -10.950 1.899 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.082 -10.662 2.127 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.990 -9.720 0.920 1.00 0.00 H new ATOM 258 N TRP A 20 6.822 -6.216 3.744 1.00 0.00 N ATOM 259 CA TRP A 20 7.347 -5.115 4.560 1.00 0.00 C ATOM 260 C TRP A 20 6.381 -3.918 4.652 1.00 0.00 C ATOM 261 O TRP A 20 6.207 -3.356 5.736 1.00 0.00 O ATOM 262 CB TRP A 20 8.707 -4.700 3.980 1.00 0.00 C ATOM 263 CG TRP A 20 9.290 -3.446 4.547 1.00 0.00 C ATOM 264 CD1 TRP A 20 9.951 -3.343 5.721 1.00 0.00 C ATOM 265 CD2 TRP A 20 9.222 -2.087 4.008 1.00 0.00 C ATOM 266 NE1 TRP A 20 10.339 -2.034 5.920 1.00 0.00 N ATOM 267 CE2 TRP A 20 9.911 -1.212 4.900 1.00 0.00 C ATOM 268 CE3 TRP A 20 8.622 -1.502 2.870 1.00 0.00 C ATOM 269 CZ2 TRP A 20 10.017 0.166 4.667 1.00 0.00 C ATOM 270 CZ3 TRP A 20 8.701 -0.115 2.640 1.00 0.00 C ATOM 271 CH2 TRP A 20 9.401 0.718 3.531 1.00 0.00 C ATOM 0 H TRP A 20 7.388 -6.406 2.917 1.00 0.00 H new ATOM 0 HA TRP A 20 7.463 -5.464 5.586 1.00 0.00 H new ATOM 0 HB2 TRP A 20 9.414 -5.514 4.139 1.00 0.00 H new ATOM 0 HB3 TRP A 20 8.601 -4.576 2.902 1.00 0.00 H new ATOM 0 HD1 TRP A 20 10.146 -4.160 6.400 1.00 0.00 H new ATOM 0 HE1 TRP A 20 10.878 -1.713 6.725 1.00 0.00 H new ATOM 0 HE3 TRP A 20 8.095 -2.128 2.166 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 10.565 0.796 5.352 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 8.220 0.312 1.773 1.00 0.00 H new ATOM 0 HH2 TRP A 20 9.465 1.780 3.343 1.00 0.00 H new ATOM 282 N THR A 21 5.697 -3.571 3.548 1.00 0.00 N ATOM 283 CA THR A 21 4.698 -2.483 3.505 1.00 0.00 C ATOM 284 C THR A 21 3.580 -2.715 4.518 1.00 0.00 C ATOM 285 O THR A 21 3.162 -1.761 5.170 1.00 0.00 O ATOM 286 CB THR A 21 4.117 -2.282 2.097 1.00 0.00 C ATOM 287 OG1 THR A 21 5.160 -2.078 1.168 1.00 0.00 O ATOM 288 CG2 THR A 21 3.208 -1.047 2.045 1.00 0.00 C ATOM 0 H THR A 21 5.821 -4.041 2.651 1.00 0.00 H new ATOM 0 HA THR A 21 5.223 -1.567 3.775 1.00 0.00 H new ATOM 0 HB THR A 21 3.544 -3.176 1.852 1.00 0.00 H new ATOM 0 HG1 THR A 21 5.678 -2.904 1.071 1.00 0.00 H new ATOM 0 HG21 THR A 21 2.811 -0.930 1.037 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.384 -1.172 2.747 1.00 0.00 H new ATOM 0 HG23 THR A 21 3.783 -0.161 2.314 1.00 0.00 H new ATOM 296 N ILE A 22 3.140 -3.963 4.726 1.00 0.00 N ATOM 297 CA ILE A 22 2.166 -4.285 5.790 1.00 0.00 C ATOM 298 C ILE A 22 2.683 -3.825 7.156 1.00 0.00 C ATOM 299 O ILE A 22 1.976 -3.112 7.861 1.00 0.00 O ATOM 300 CB ILE A 22 1.839 -5.803 5.862 1.00 0.00 C ATOM 301 CG1 ILE A 22 1.588 -6.522 4.518 1.00 0.00 C ATOM 302 CG2 ILE A 22 0.658 -6.025 6.828 1.00 0.00 C ATOM 303 CD1 ILE A 22 0.558 -5.905 3.573 1.00 0.00 C ATOM 0 H ILE A 22 3.439 -4.768 4.176 1.00 0.00 H new ATOM 0 HA ILE A 22 1.250 -3.751 5.536 1.00 0.00 H new ATOM 0 HB ILE A 22 2.752 -6.270 6.231 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.538 -6.585 3.987 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.276 -7.544 4.735 1.00 0.00 H new ATOM 0 HG21 ILE A 22 0.426 -7.089 6.881 1.00 0.00 H new ATOM 0 HG22 ILE A 22 0.926 -5.662 7.820 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.215 -5.481 6.467 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.483 -6.511 2.670 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -0.413 -5.868 4.067 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.868 -4.894 3.307 1.00 0.00 H new ATOM 315 N GLU A 23 3.910 -4.200 7.526 1.00 0.00 N ATOM 316 CA GLU A 23 4.461 -3.904 8.851 1.00 0.00 C ATOM 317 C GLU A 23 4.716 -2.406 9.066 1.00 0.00 C ATOM 318 O GLU A 23 4.603 -1.927 10.194 1.00 0.00 O ATOM 319 CB GLU A 23 5.750 -4.705 9.078 1.00 0.00 C ATOM 320 CG GLU A 23 6.050 -4.881 10.578 1.00 0.00 C ATOM 321 CD GLU A 23 7.466 -4.448 10.929 1.00 0.00 C ATOM 322 OE1 GLU A 23 8.387 -5.300 10.852 1.00 0.00 O ATOM 323 OE2 GLU A 23 7.677 -3.260 11.269 1.00 0.00 O ATOM 0 H GLU A 23 4.547 -4.715 6.919 1.00 0.00 H new ATOM 0 HA GLU A 23 3.712 -4.204 9.584 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.659 -5.684 8.607 1.00 0.00 H new ATOM 0 HB3 GLU A 23 6.585 -4.196 8.596 1.00 0.00 H new ATOM 0 HG2 GLU A 23 5.337 -4.298 11.161 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.911 -5.926 10.856 1.00 0.00 H new ATOM 330 N GLN A 24 5.012 -1.657 7.998 1.00 0.00 N ATOM 331 CA GLN A 24 5.043 -0.193 8.031 1.00 0.00 C ATOM 332 C GLN A 24 3.644 0.375 8.321 1.00 0.00 C ATOM 333 O GLN A 24 3.479 1.128 9.284 1.00 0.00 O ATOM 334 CB GLN A 24 5.566 0.371 6.694 1.00 0.00 C ATOM 335 CG GLN A 24 7.060 0.149 6.419 1.00 0.00 C ATOM 336 CD GLN A 24 7.968 1.004 7.305 1.00 0.00 C ATOM 337 OE1 GLN A 24 8.062 2.222 7.175 1.00 0.00 O ATOM 338 NE2 GLN A 24 8.645 0.418 8.262 1.00 0.00 N ATOM 0 H GLN A 24 5.237 -2.051 7.085 1.00 0.00 H new ATOM 0 HA GLN A 24 5.719 0.109 8.831 1.00 0.00 H new ATOM 0 HB2 GLN A 24 4.995 -0.079 5.882 1.00 0.00 H new ATOM 0 HB3 GLN A 24 5.366 1.442 6.669 1.00 0.00 H new ATOM 0 HG2 GLN A 24 7.299 -0.903 6.573 1.00 0.00 H new ATOM 0 HG3 GLN A 24 7.268 0.373 5.373 1.00 0.00 H new ATOM 0 HE21 GLN A 24 8.581 -0.592 8.387 1.00 0.00 H new ATOM 0 HE22 GLN A 24 9.236 0.972 8.882 1.00 0.00 H new ATOM 347 N GLN A 25 2.640 0.053 7.497 1.00 0.00 N ATOM 348 CA GLN A 25 1.320 0.692 7.578 1.00 0.00 C ATOM 349 C GLN A 25 0.498 0.252 8.790 1.00 0.00 C ATOM 350 O GLN A 25 -0.192 1.083 9.380 1.00 0.00 O ATOM 351 CB GLN A 25 0.537 0.497 6.266 1.00 0.00 C ATOM 352 CG GLN A 25 1.257 1.095 5.035 1.00 0.00 C ATOM 353 CD GLN A 25 1.635 2.572 5.189 1.00 0.00 C ATOM 354 OE1 GLN A 25 2.592 2.934 5.864 1.00 0.00 O ATOM 355 NE2 GLN A 25 0.917 3.488 4.581 1.00 0.00 N ATOM 0 H GLN A 25 2.717 -0.650 6.762 1.00 0.00 H new ATOM 0 HA GLN A 25 1.505 1.757 7.721 1.00 0.00 H new ATOM 0 HB2 GLN A 25 0.374 -0.568 6.102 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -0.446 0.958 6.364 1.00 0.00 H new ATOM 0 HG2 GLN A 25 2.161 0.518 4.840 1.00 0.00 H new ATOM 0 HG3 GLN A 25 0.614 0.985 4.162 1.00 0.00 H new ATOM 0 HE21 GLN A 25 0.115 3.214 4.013 1.00 0.00 H new ATOM 0 HE22 GLN A 25 1.161 4.474 4.677 1.00 0.00 H new ATOM 364 N ILE A 26 0.574 -1.024 9.181 1.00 0.00 N ATOM 365 CA ILE A 26 -0.130 -1.571 10.350 1.00 0.00 C ATOM 366 C ILE A 26 0.475 -1.041 11.651 1.00 0.00 C ATOM 367 O ILE A 26 -0.261 -0.507 12.483 1.00 0.00 O ATOM 368 CB ILE A 26 -0.121 -3.119 10.275 1.00 0.00 C ATOM 369 CG1 ILE A 26 -0.969 -3.656 9.094 1.00 0.00 C ATOM 370 CG2 ILE A 26 -0.564 -3.800 11.576 1.00 0.00 C ATOM 371 CD1 ILE A 26 -2.484 -3.431 9.199 1.00 0.00 C ATOM 0 H ILE A 26 1.135 -1.719 8.688 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.169 -1.240 10.342 1.00 0.00 H new ATOM 0 HB ILE A 26 0.925 -3.378 10.108 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -0.615 -3.188 8.175 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.786 -4.726 8.998 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.533 -4.882 11.449 1.00 0.00 H new ATOM 0 HG22 ILE A 26 0.106 -3.510 12.385 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.581 -3.492 11.820 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -2.975 -3.847 8.319 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -2.864 -3.924 10.094 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.690 -2.362 9.259 1.00 0.00 H new ATOM 383 N GLY A 27 1.803 -1.124 11.811 1.00 0.00 N ATOM 384 CA GLY A 27 2.526 -0.820 13.058 1.00 0.00 C ATOM 385 C GLY A 27 2.347 0.600 13.614 1.00 0.00 C ATOM 386 O GLY A 27 2.732 0.859 14.754 1.00 0.00 O ATOM 0 H GLY A 27 2.424 -1.413 11.055 1.00 0.00 H new ATOM 0 HA2 GLY A 27 2.207 -1.530 13.821 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.589 -0.990 12.888 1.00 0.00 H new ATOM 390 N LYS A 28 1.748 1.511 12.837 1.00 0.00 N ATOM 391 CA LYS A 28 1.423 2.900 13.195 1.00 0.00 C ATOM 392 C LYS A 28 -0.093 3.135 13.402 1.00 0.00 C ATOM 393 O LYS A 28 -0.507 4.252 13.719 1.00 0.00 O ATOM 394 CB LYS A 28 2.037 3.782 12.088 1.00 0.00 C ATOM 395 CG LYS A 28 2.107 5.303 12.333 1.00 0.00 C ATOM 396 CD LYS A 28 2.770 5.724 13.654 1.00 0.00 C ATOM 397 CE LYS A 28 4.200 5.181 13.817 1.00 0.00 C ATOM 398 NZ LYS A 28 4.660 5.299 15.220 1.00 0.00 N ATOM 0 H LYS A 28 1.460 1.286 11.885 1.00 0.00 H new ATOM 0 HA LYS A 28 1.846 3.159 14.166 1.00 0.00 H new ATOM 0 HB2 LYS A 28 3.050 3.426 11.901 1.00 0.00 H new ATOM 0 HB3 LYS A 28 1.467 3.616 11.174 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.652 5.763 11.509 1.00 0.00 H new ATOM 0 HG3 LYS A 28 1.094 5.706 12.309 1.00 0.00 H new ATOM 0 HD2 LYS A 28 2.793 6.812 13.710 1.00 0.00 H new ATOM 0 HD3 LYS A 28 2.159 5.375 14.487 1.00 0.00 H new ATOM 0 HE2 LYS A 28 4.233 4.136 13.507 1.00 0.00 H new ATOM 0 HE3 LYS A 28 4.877 5.729 13.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 5.627 4.925 15.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 4.650 6.299 15.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 4.026 4.756 15.840 1.00 0.00 H new ATOM 412 N VAL A 29 -0.933 2.104 13.266 1.00 0.00 N ATOM 413 CA VAL A 29 -2.333 2.145 13.719 1.00 0.00 C ATOM 414 C VAL A 29 -2.341 1.801 15.210 1.00 0.00 C ATOM 415 O VAL A 29 -2.178 0.648 15.598 1.00 0.00 O ATOM 416 CB VAL A 29 -3.260 1.204 12.920 1.00 0.00 C ATOM 417 CG1 VAL A 29 -4.727 1.424 13.317 1.00 0.00 C ATOM 418 CG2 VAL A 29 -3.130 1.401 11.401 1.00 0.00 C ATOM 0 H VAL A 29 -0.665 1.217 12.840 1.00 0.00 H new ATOM 0 HA VAL A 29 -2.733 3.144 13.546 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.948 0.188 13.164 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.364 0.751 12.743 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.850 1.221 14.381 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.009 2.456 13.110 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.803 0.715 10.886 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.391 2.427 11.144 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.103 1.200 11.095 1.00 0.00 H new ATOM 428 N ASN A 30 -2.475 2.835 16.037 1.00 0.00 N ATOM 429 CA ASN A 30 -2.263 2.854 17.496 1.00 0.00 C ATOM 430 C ASN A 30 -2.675 1.576 18.269 1.00 0.00 C ATOM 431 O ASN A 30 -1.932 1.114 19.136 1.00 0.00 O ATOM 432 CB ASN A 30 -3.001 4.085 18.051 1.00 0.00 C ATOM 433 CG ASN A 30 -2.721 4.355 19.526 1.00 0.00 C ATOM 434 OD1 ASN A 30 -1.641 4.097 20.046 1.00 0.00 O ATOM 435 ND2 ASN A 30 -3.685 4.895 20.242 1.00 0.00 N ATOM 0 H ASN A 30 -2.755 3.751 15.687 1.00 0.00 H new ATOM 0 HA ASN A 30 -1.185 2.900 17.653 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -2.715 4.962 17.470 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -4.073 3.947 17.913 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -3.534 5.099 21.230 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -4.583 5.109 19.809 1.00 0.00 H new ATOM 442 N GLY A 31 -3.811 0.948 17.936 1.00 0.00 N ATOM 443 CA GLY A 31 -4.336 -0.242 18.628 1.00 0.00 C ATOM 444 C GLY A 31 -3.666 -1.579 18.299 1.00 0.00 C ATOM 445 O GLY A 31 -4.053 -2.587 18.877 1.00 0.00 O ATOM 0 H GLY A 31 -4.403 1.257 17.165 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.254 -0.075 19.702 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.398 -0.328 18.399 1.00 0.00 H new ATOM 449 N VAL A 32 -2.705 -1.639 17.378 1.00 0.00 N ATOM 450 CA VAL A 32 -1.985 -2.893 17.052 1.00 0.00 C ATOM 451 C VAL A 32 -1.032 -3.305 18.183 1.00 0.00 C ATOM 452 O VAL A 32 -0.379 -2.450 18.782 1.00 0.00 O ATOM 453 CB VAL A 32 -1.223 -2.809 15.716 1.00 0.00 C ATOM 454 CG1 VAL A 32 -2.227 -2.493 14.594 1.00 0.00 C ATOM 455 CG2 VAL A 32 -0.043 -1.825 15.748 1.00 0.00 C ATOM 0 H VAL A 32 -2.397 -0.833 16.834 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.750 -3.661 16.944 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.759 -3.776 15.522 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.701 -2.431 13.642 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.976 -3.283 14.543 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.716 -1.541 14.801 1.00 0.00 H new ATOM 0 HG21 VAL A 32 0.449 -1.815 14.775 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.409 -0.825 15.979 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.669 -2.136 16.512 1.00 0.00 H new ATOM 465 N HIS A 33 -0.926 -4.605 18.474 1.00 0.00 N ATOM 466 CA HIS A 33 -0.021 -5.123 19.510 1.00 0.00 C ATOM 467 C HIS A 33 1.099 -6.018 18.939 1.00 0.00 C ATOM 468 O HIS A 33 2.252 -5.895 19.366 1.00 0.00 O ATOM 469 CB HIS A 33 -0.854 -5.852 20.575 1.00 0.00 C ATOM 470 CG HIS A 33 -0.108 -6.015 21.874 1.00 0.00 C ATOM 471 ND1 HIS A 33 0.365 -7.189 22.411 1.00 0.00 N ATOM 472 CD2 HIS A 33 0.231 -5.012 22.744 1.00 0.00 C ATOM 473 CE1 HIS A 33 0.968 -6.903 23.574 1.00 0.00 C ATOM 474 NE2 HIS A 33 0.910 -5.582 23.828 1.00 0.00 N ATOM 0 H HIS A 33 -1.464 -5.330 17.999 1.00 0.00 H new ATOM 0 HA HIS A 33 0.498 -4.281 19.968 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -1.775 -5.297 20.755 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -1.142 -6.834 20.198 1.00 0.00 H new ATOM 0 HD2 HIS A 33 0.012 -3.962 22.616 1.00 0.00 H new ATOM 0 HE1 HIS A 33 1.436 -7.632 24.219 1.00 0.00 H new ATOM 0 HE2 HIS A 33 1.284 -5.096 24.643 1.00 0.00 H new ATOM 482 N HIS A 34 0.802 -6.870 17.949 1.00 0.00 N ATOM 483 CA HIS A 34 1.813 -7.670 17.247 1.00 0.00 C ATOM 484 C HIS A 34 1.361 -8.095 15.834 1.00 0.00 C ATOM 485 O HIS A 34 0.361 -8.804 15.708 1.00 0.00 O ATOM 486 CB HIS A 34 2.179 -8.891 18.107 1.00 0.00 C ATOM 487 CG HIS A 34 3.471 -9.545 17.694 1.00 0.00 C ATOM 488 ND1 HIS A 34 4.727 -8.998 17.821 1.00 0.00 N ATOM 489 CD2 HIS A 34 3.632 -10.812 17.198 1.00 0.00 C ATOM 490 CE1 HIS A 34 5.623 -9.910 17.419 1.00 0.00 C ATOM 491 NE2 HIS A 34 5.005 -11.044 17.042 1.00 0.00 N ATOM 0 H HIS A 34 -0.148 -7.024 17.612 1.00 0.00 H new ATOM 0 HA HIS A 34 2.696 -7.047 17.102 1.00 0.00 H new ATOM 0 HB2 HIS A 34 2.253 -8.583 19.150 1.00 0.00 H new ATOM 0 HB3 HIS A 34 1.374 -9.623 18.047 1.00 0.00 H new ATOM 0 HD2 HIS A 34 2.840 -11.509 16.968 1.00 0.00 H new ATOM 0 HE1 HIS A 34 6.692 -9.756 17.400 1.00 0.00 H new ATOM 0 HE2 HIS A 34 5.447 -11.901 16.709 1.00 0.00 H new ATOM 499 N ILE A 35 2.086 -7.688 14.779 1.00 0.00 N ATOM 500 CA ILE A 35 1.867 -8.113 13.376 1.00 0.00 C ATOM 501 C ILE A 35 2.832 -9.236 12.954 1.00 0.00 C ATOM 502 O ILE A 35 4.022 -9.233 13.283 1.00 0.00 O ATOM 503 CB ILE A 35 1.862 -6.895 12.396 1.00 0.00 C ATOM 504 CG1 ILE A 35 1.662 -7.262 10.902 1.00 0.00 C ATOM 505 CG2 ILE A 35 3.051 -5.938 12.585 1.00 0.00 C ATOM 506 CD1 ILE A 35 2.925 -7.546 10.070 1.00 0.00 C ATOM 0 H ILE A 35 2.864 -7.036 14.876 1.00 0.00 H new ATOM 0 HA ILE A 35 0.869 -8.548 13.317 1.00 0.00 H new ATOM 0 HB ILE A 35 0.965 -6.350 12.691 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.021 -8.142 10.854 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.119 -6.446 10.424 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.977 -5.119 11.869 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.037 -5.536 13.598 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.983 -6.479 12.422 1.00 0.00 H new ATOM 0 HD11 ILE A 35 2.639 -7.789 9.046 1.00 0.00 H new ATOM 0 HD12 ILE A 35 3.566 -6.664 10.068 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.466 -8.387 10.505 1.00 0.00 H new ATOM 518 N LYS A 36 2.301 -10.182 12.178 1.00 0.00 N ATOM 519 CA LYS A 36 3.026 -11.251 11.475 1.00 0.00 C ATOM 520 C LYS A 36 2.474 -11.389 10.043 1.00 0.00 C ATOM 521 O LYS A 36 1.265 -11.326 9.842 1.00 0.00 O ATOM 522 CB LYS A 36 2.857 -12.549 12.294 1.00 0.00 C ATOM 523 CG LYS A 36 3.186 -13.885 11.598 1.00 0.00 C ATOM 524 CD LYS A 36 4.648 -14.029 11.146 1.00 0.00 C ATOM 525 CE LYS A 36 5.065 -15.498 10.986 1.00 0.00 C ATOM 526 NZ LYS A 36 4.252 -16.219 9.977 1.00 0.00 N ATOM 0 H LYS A 36 1.296 -10.229 12.011 1.00 0.00 H new ATOM 0 HA LYS A 36 4.089 -11.026 11.387 1.00 0.00 H new ATOM 0 HB2 LYS A 36 3.485 -12.470 13.181 1.00 0.00 H new ATOM 0 HB3 LYS A 36 1.824 -12.596 12.638 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.948 -14.702 12.279 1.00 0.00 H new ATOM 0 HG3 LYS A 36 2.538 -13.996 10.728 1.00 0.00 H new ATOM 0 HD2 LYS A 36 4.786 -13.509 10.198 1.00 0.00 H new ATOM 0 HD3 LYS A 36 5.300 -13.545 11.873 1.00 0.00 H new ATOM 0 HE2 LYS A 36 6.116 -15.544 10.699 1.00 0.00 H new ATOM 0 HE3 LYS A 36 4.975 -16.003 11.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.576 -17.205 9.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 3.252 -16.202 10.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 4.357 -15.756 9.051 1.00 0.00 H new ATOM 540 N VAL A 37 3.328 -11.605 9.047 1.00 0.00 N ATOM 541 CA VAL A 37 2.917 -11.883 7.658 1.00 0.00 C ATOM 542 C VAL A 37 3.648 -13.103 7.105 1.00 0.00 C ATOM 543 O VAL A 37 4.837 -13.292 7.344 1.00 0.00 O ATOM 544 CB VAL A 37 3.095 -10.658 6.728 1.00 0.00 C ATOM 545 CG1 VAL A 37 1.859 -9.757 6.831 1.00 0.00 C ATOM 546 CG2 VAL A 37 4.354 -9.824 7.017 1.00 0.00 C ATOM 0 H VAL A 37 4.340 -11.594 9.175 1.00 0.00 H new ATOM 0 HA VAL A 37 1.850 -12.103 7.684 1.00 0.00 H new ATOM 0 HB VAL A 37 3.216 -11.057 5.721 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.982 -8.894 6.177 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.974 -10.317 6.529 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.740 -9.418 7.860 1.00 0.00 H new ATOM 0 HG21 VAL A 37 4.403 -8.986 6.322 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.313 -9.446 8.039 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.239 -10.448 6.896 1.00 0.00 H new ATOM 556 N SER A 38 2.902 -13.947 6.393 1.00 0.00 N ATOM 557 CA SER A 38 3.372 -15.198 5.789 1.00 0.00 C ATOM 558 C SER A 38 3.325 -15.105 4.254 1.00 0.00 C ATOM 559 O SER A 38 2.246 -14.984 3.663 1.00 0.00 O ATOM 560 CB SER A 38 2.494 -16.367 6.258 1.00 0.00 C ATOM 561 OG SER A 38 2.364 -16.438 7.672 1.00 0.00 O ATOM 0 H SER A 38 1.913 -13.773 6.213 1.00 0.00 H new ATOM 0 HA SER A 38 4.402 -15.368 6.102 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.504 -16.270 5.813 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.918 -17.302 5.891 1.00 0.00 H new ATOM 0 HG SER A 38 1.794 -17.199 7.910 1.00 0.00 H new ATOM 567 N LEU A 39 4.490 -15.145 3.596 1.00 0.00 N ATOM 568 CA LEU A 39 4.643 -14.800 2.173 1.00 0.00 C ATOM 569 C LEU A 39 4.343 -15.953 1.202 1.00 0.00 C ATOM 570 O LEU A 39 3.905 -15.711 0.077 1.00 0.00 O ATOM 571 CB LEU A 39 6.054 -14.203 1.976 1.00 0.00 C ATOM 572 CG LEU A 39 7.228 -15.209 2.084 1.00 0.00 C ATOM 573 CD1 LEU A 39 7.687 -15.716 0.710 1.00 0.00 C ATOM 574 CD2 LEU A 39 8.426 -14.562 2.794 1.00 0.00 C ATOM 0 H LEU A 39 5.366 -15.421 4.041 1.00 0.00 H new ATOM 0 HA LEU A 39 3.884 -14.061 1.917 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.095 -13.729 0.995 1.00 0.00 H new ATOM 0 HB3 LEU A 39 6.203 -13.417 2.717 1.00 0.00 H new ATOM 0 HG LEU A 39 6.859 -16.058 2.660 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.511 -16.418 0.838 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.857 -16.217 0.211 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.019 -14.873 0.104 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.241 -15.282 2.861 1.00 0.00 H new ATOM 0 HD22 LEU A 39 8.757 -13.691 2.229 1.00 0.00 H new ATOM 0 HD23 LEU A 39 8.131 -14.253 3.797 1.00 0.00 H new ATOM 586 N GLU A 40 4.555 -17.199 1.628 1.00 0.00 N ATOM 587 CA GLU A 40 4.344 -18.414 0.828 1.00 0.00 C ATOM 588 C GLU A 40 2.982 -19.060 1.123 1.00 0.00 C ATOM 589 O GLU A 40 2.311 -19.555 0.213 1.00 0.00 O ATOM 590 CB GLU A 40 5.500 -19.417 1.030 1.00 0.00 C ATOM 591 CG GLU A 40 5.607 -20.090 2.410 1.00 0.00 C ATOM 592 CD GLU A 40 5.866 -19.080 3.523 1.00 0.00 C ATOM 593 OE1 GLU A 40 7.040 -18.736 3.767 1.00 0.00 O ATOM 594 OE2 GLU A 40 4.891 -18.533 4.091 1.00 0.00 O ATOM 0 H GLU A 40 4.889 -17.401 2.570 1.00 0.00 H new ATOM 0 HA GLU A 40 4.337 -18.119 -0.221 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.405 -20.200 0.278 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.438 -18.898 0.833 1.00 0.00 H new ATOM 0 HG2 GLU A 40 4.685 -20.632 2.621 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.412 -20.824 2.393 1.00 0.00 H new ATOM 601 N GLU A 41 2.546 -18.993 2.385 1.00 0.00 N ATOM 602 CA GLU A 41 1.184 -19.316 2.829 1.00 0.00 C ATOM 603 C GLU A 41 0.195 -18.155 2.548 1.00 0.00 C ATOM 604 O GLU A 41 -0.984 -18.261 2.896 1.00 0.00 O ATOM 605 CB GLU A 41 1.216 -19.702 4.325 1.00 0.00 C ATOM 606 CG GLU A 41 2.031 -20.989 4.589 1.00 0.00 C ATOM 607 CD GLU A 41 2.191 -21.347 6.072 1.00 0.00 C ATOM 608 OE1 GLU A 41 2.475 -20.441 6.889 1.00 0.00 O ATOM 609 OE2 GLU A 41 2.117 -22.545 6.437 1.00 0.00 O ATOM 0 H GLU A 41 3.152 -18.703 3.153 1.00 0.00 H new ATOM 0 HA GLU A 41 0.816 -20.167 2.255 1.00 0.00 H new ATOM 0 HB2 GLU A 41 1.645 -18.881 4.899 1.00 0.00 H new ATOM 0 HB3 GLU A 41 0.196 -19.843 4.682 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.548 -21.821 4.077 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.021 -20.874 4.147 1.00 0.00 H new ATOM 616 N LYS A 42 0.668 -17.059 1.929 1.00 0.00 N ATOM 617 CA LYS A 42 -0.060 -15.851 1.499 1.00 0.00 C ATOM 618 C LYS A 42 -1.201 -15.420 2.443 1.00 0.00 C ATOM 619 O LYS A 42 -2.383 -15.452 2.081 1.00 0.00 O ATOM 620 CB LYS A 42 -0.500 -15.976 0.025 1.00 0.00 C ATOM 621 CG LYS A 42 0.677 -15.968 -0.965 1.00 0.00 C ATOM 622 CD LYS A 42 0.222 -15.821 -2.428 1.00 0.00 C ATOM 623 CE LYS A 42 -0.352 -14.421 -2.708 1.00 0.00 C ATOM 624 NZ LYS A 42 -0.693 -14.228 -4.135 1.00 0.00 N ATOM 0 H LYS A 42 1.659 -16.989 1.696 1.00 0.00 H new ATOM 0 HA LYS A 42 0.647 -15.024 1.567 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.065 -16.899 -0.101 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.174 -15.154 -0.216 1.00 0.00 H new ATOM 0 HG2 LYS A 42 1.351 -15.149 -0.715 1.00 0.00 H new ATOM 0 HG3 LYS A 42 1.244 -16.893 -0.856 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.066 -16.008 -3.092 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -0.533 -16.575 -2.652 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.244 -14.268 -2.100 1.00 0.00 H new ATOM 0 HE3 LYS A 42 0.374 -13.666 -2.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -1.540 -13.629 -4.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.102 -13.768 -4.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.881 -15.151 -4.575 1.00 0.00 H new ATOM 638 N ASN A 43 -0.838 -15.001 3.657 1.00 0.00 N ATOM 639 CA ASN A 43 -1.763 -14.496 4.676 1.00 0.00 C ATOM 640 C ASN A 43 -1.074 -13.568 5.697 1.00 0.00 C ATOM 641 O ASN A 43 0.153 -13.495 5.764 1.00 0.00 O ATOM 642 CB ASN A 43 -2.504 -15.655 5.364 1.00 0.00 C ATOM 643 CG ASN A 43 -1.590 -16.461 6.271 1.00 0.00 C ATOM 644 OD1 ASN A 43 -1.368 -16.101 7.418 1.00 0.00 O ATOM 645 ND2 ASN A 43 -0.994 -17.525 5.776 1.00 0.00 N ATOM 0 H ASN A 43 0.134 -15.003 3.968 1.00 0.00 H new ATOM 0 HA ASN A 43 -2.502 -13.881 4.162 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -3.334 -15.258 5.948 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -2.932 -16.311 4.606 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -0.340 -18.057 6.351 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -1.186 -17.818 4.818 1.00 0.00 H new ATOM 652 N ALA A 44 -1.883 -12.852 6.478 1.00 0.00 N ATOM 653 CA ALA A 44 -1.478 -11.830 7.437 1.00 0.00 C ATOM 654 C ALA A 44 -2.166 -12.087 8.790 1.00 0.00 C ATOM 655 O ALA A 44 -3.394 -12.165 8.846 1.00 0.00 O ATOM 656 CB ALA A 44 -1.879 -10.476 6.821 1.00 0.00 C ATOM 0 H ALA A 44 -2.895 -12.979 6.455 1.00 0.00 H new ATOM 0 HA ALA A 44 -0.406 -11.842 7.631 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.598 -9.670 7.499 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.366 -10.344 5.868 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -2.957 -10.455 6.659 1.00 0.00 H new ATOM 662 N THR A 45 -1.395 -12.218 9.873 1.00 0.00 N ATOM 663 CA THR A 45 -1.871 -12.489 11.242 1.00 0.00 C ATOM 664 C THR A 45 -1.613 -11.269 12.114 1.00 0.00 C ATOM 665 O THR A 45 -0.559 -10.643 12.013 1.00 0.00 O ATOM 666 CB THR A 45 -1.139 -13.698 11.841 1.00 0.00 C ATOM 667 OG1 THR A 45 -1.216 -14.789 10.959 1.00 0.00 O ATOM 668 CG2 THR A 45 -1.751 -14.157 13.167 1.00 0.00 C ATOM 0 H THR A 45 -0.380 -12.136 9.823 1.00 0.00 H new ATOM 0 HA THR A 45 -2.938 -12.707 11.204 1.00 0.00 H new ATOM 0 HB THR A 45 -0.110 -13.379 12.009 1.00 0.00 H new ATOM 0 HG1 THR A 45 -0.746 -15.557 11.346 1.00 0.00 H new ATOM 0 HG21 THR A 45 -1.195 -15.014 13.547 1.00 0.00 H new ATOM 0 HG22 THR A 45 -1.702 -13.344 13.891 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.792 -14.440 13.009 1.00 0.00 H new ATOM 676 N ILE A 46 -2.529 -10.935 13.022 1.00 0.00 N ATOM 677 CA ILE A 46 -2.301 -9.834 13.967 1.00 0.00 C ATOM 678 C ILE A 46 -3.023 -10.010 15.305 1.00 0.00 C ATOM 679 O ILE A 46 -4.169 -10.473 15.367 1.00 0.00 O ATOM 680 CB ILE A 46 -2.584 -8.478 13.276 1.00 0.00 C ATOM 681 CG1 ILE A 46 -1.981 -7.304 14.072 1.00 0.00 C ATOM 682 CG2 ILE A 46 -4.084 -8.266 13.008 1.00 0.00 C ATOM 683 CD1 ILE A 46 -2.283 -5.929 13.491 1.00 0.00 C ATOM 0 H ILE A 46 -3.429 -11.404 13.126 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.248 -9.849 14.247 1.00 0.00 H new ATOM 0 HB ILE A 46 -2.090 -8.507 12.305 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -2.356 -7.343 15.095 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -0.900 -7.434 14.124 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -4.234 -7.302 12.522 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -4.454 -9.060 12.360 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.629 -8.285 13.952 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.821 -5.162 14.113 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.883 -5.866 12.479 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.362 -5.774 13.465 1.00 0.00 H new ATOM 695 N ILE A 47 -2.325 -9.601 16.368 1.00 0.00 N ATOM 696 CA ILE A 47 -2.860 -9.345 17.712 1.00 0.00 C ATOM 697 C ILE A 47 -3.029 -7.831 17.905 1.00 0.00 C ATOM 698 O ILE A 47 -2.108 -7.051 17.635 1.00 0.00 O ATOM 699 CB ILE A 47 -1.948 -9.960 18.802 1.00 0.00 C ATOM 700 CG1 ILE A 47 -1.745 -11.476 18.554 1.00 0.00 C ATOM 701 CG2 ILE A 47 -2.566 -9.712 20.190 1.00 0.00 C ATOM 702 CD1 ILE A 47 -1.004 -12.225 19.668 1.00 0.00 C ATOM 0 H ILE A 47 -1.321 -9.430 16.314 1.00 0.00 H new ATOM 0 HA ILE A 47 -3.834 -9.824 17.811 1.00 0.00 H new ATOM 0 HB ILE A 47 -0.970 -9.482 18.759 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -2.722 -11.939 18.414 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.194 -11.605 17.622 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.924 -10.145 20.957 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.661 -8.639 20.360 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.551 -10.176 20.238 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.913 -13.278 19.400 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.010 -11.796 19.797 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.562 -12.135 20.600 1.00 0.00 H new ATOM 714 N TYR A 48 -4.197 -7.420 18.395 1.00 0.00 N ATOM 715 CA TYR A 48 -4.639 -6.030 18.520 1.00 0.00 C ATOM 716 C TYR A 48 -5.499 -5.792 19.780 1.00 0.00 C ATOM 717 O TYR A 48 -6.046 -6.725 20.367 1.00 0.00 O ATOM 718 CB TYR A 48 -5.395 -5.631 17.244 1.00 0.00 C ATOM 719 CG TYR A 48 -6.713 -6.356 17.022 1.00 0.00 C ATOM 720 CD1 TYR A 48 -7.909 -5.844 17.564 1.00 0.00 C ATOM 721 CD2 TYR A 48 -6.741 -7.551 16.275 1.00 0.00 C ATOM 722 CE1 TYR A 48 -9.126 -6.527 17.377 1.00 0.00 C ATOM 723 CE2 TYR A 48 -7.955 -8.233 16.074 1.00 0.00 C ATOM 724 CZ TYR A 48 -9.147 -7.730 16.636 1.00 0.00 C ATOM 725 OH TYR A 48 -10.304 -8.428 16.488 1.00 0.00 O ATOM 0 H TYR A 48 -4.897 -8.080 18.733 1.00 0.00 H new ATOM 0 HA TYR A 48 -3.758 -5.399 18.638 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -5.589 -4.559 17.275 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -4.749 -5.813 16.385 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -7.892 -4.922 18.126 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -5.827 -7.945 15.855 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -10.039 -6.133 17.798 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -7.974 -9.141 15.490 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.136 -9.229 15.949 1.00 0.00 H new ATOM 735 N ASP A 49 -5.635 -4.529 20.184 1.00 0.00 N ATOM 736 CA ASP A 49 -6.433 -4.079 21.327 1.00 0.00 C ATOM 737 C ASP A 49 -7.871 -3.681 20.903 1.00 0.00 C ATOM 738 O ASP A 49 -8.031 -2.903 19.954 1.00 0.00 O ATOM 739 CB ASP A 49 -5.700 -2.901 21.981 1.00 0.00 C ATOM 740 CG ASP A 49 -6.511 -2.301 23.124 1.00 0.00 C ATOM 741 OD1 ASP A 49 -6.422 -2.807 24.264 1.00 0.00 O ATOM 742 OD2 ASP A 49 -7.255 -1.331 22.856 1.00 0.00 O ATOM 0 H ASP A 49 -5.172 -3.757 19.703 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.542 -4.895 22.041 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.733 -3.236 22.357 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.502 -2.134 21.232 1.00 0.00 H new ATOM 747 N PRO A 50 -8.924 -4.162 21.598 1.00 0.00 N ATOM 748 CA PRO A 50 -10.323 -3.969 21.203 1.00 0.00 C ATOM 749 C PRO A 50 -10.859 -2.553 21.454 1.00 0.00 C ATOM 750 O PRO A 50 -11.926 -2.209 20.944 1.00 0.00 O ATOM 751 CB PRO A 50 -11.110 -4.996 22.023 1.00 0.00 C ATOM 752 CG PRO A 50 -10.278 -5.138 23.295 1.00 0.00 C ATOM 753 CD PRO A 50 -8.853 -5.027 22.766 1.00 0.00 C ATOM 0 HA PRO A 50 -10.424 -4.103 20.126 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -12.121 -4.649 22.239 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -11.205 -5.945 21.496 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -10.505 -4.355 24.019 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.454 -6.092 23.792 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -8.188 -4.608 23.521 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -8.458 -6.008 22.502 1.00 0.00 H new ATOM 761 N LYS A 51 -10.142 -1.712 22.206 1.00 0.00 N ATOM 762 CA LYS A 51 -10.530 -0.320 22.471 1.00 0.00 C ATOM 763 C LYS A 51 -10.098 0.627 21.332 1.00 0.00 C ATOM 764 O LYS A 51 -10.625 1.739 21.207 1.00 0.00 O ATOM 765 CB LYS A 51 -9.897 0.146 23.793 1.00 0.00 C ATOM 766 CG LYS A 51 -10.004 -0.837 24.975 1.00 0.00 C ATOM 767 CD LYS A 51 -9.266 -0.337 26.228 1.00 0.00 C ATOM 768 CE LYS A 51 -7.767 -0.696 26.281 1.00 0.00 C ATOM 769 NZ LYS A 51 -6.938 0.025 25.292 1.00 0.00 N ATOM 0 H LYS A 51 -9.266 -1.980 22.654 1.00 0.00 H new ATOM 0 HA LYS A 51 -11.617 -0.285 22.538 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -8.842 0.355 23.614 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.364 1.087 24.085 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -11.055 -0.997 25.216 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -9.595 -1.803 24.678 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.368 0.747 26.285 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -9.756 -0.750 27.110 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -7.389 -0.483 27.281 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.655 -1.768 26.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.932 -0.110 25.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -7.132 -0.346 24.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.166 1.039 25.321 1.00 0.00 H new ATOM 783 N LEU A 52 -9.098 0.202 20.547 1.00 0.00 N ATOM 784 CA LEU A 52 -8.371 1.001 19.552 1.00 0.00 C ATOM 785 C LEU A 52 -8.304 0.386 18.135 1.00 0.00 C ATOM 786 O LEU A 52 -7.946 1.097 17.198 1.00 0.00 O ATOM 787 CB LEU A 52 -6.940 1.189 20.097 1.00 0.00 C ATOM 788 CG LEU A 52 -6.801 2.011 21.394 1.00 0.00 C ATOM 789 CD1 LEU A 52 -5.352 1.927 21.894 1.00 0.00 C ATOM 790 CD2 LEU A 52 -7.198 3.474 21.167 1.00 0.00 C ATOM 0 H LEU A 52 -8.757 -0.758 20.592 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.914 1.937 19.422 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.508 0.203 20.270 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.340 1.668 19.323 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.474 1.596 22.145 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.249 2.507 22.811 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -5.095 0.886 22.092 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -4.681 2.328 21.134 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -7.090 4.029 22.099 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.552 3.912 20.406 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -8.235 3.522 20.834 1.00 0.00 H new ATOM 802 N GLN A 53 -8.605 -0.901 17.940 1.00 0.00 N ATOM 803 CA GLN A 53 -8.482 -1.600 16.649 1.00 0.00 C ATOM 804 C GLN A 53 -9.674 -2.545 16.392 1.00 0.00 C ATOM 805 O GLN A 53 -10.385 -2.908 17.331 1.00 0.00 O ATOM 806 CB GLN A 53 -7.149 -2.384 16.632 1.00 0.00 C ATOM 807 CG GLN A 53 -6.050 -1.758 15.756 1.00 0.00 C ATOM 808 CD GLN A 53 -6.295 -1.957 14.263 1.00 0.00 C ATOM 809 OE1 GLN A 53 -7.395 -2.245 13.829 1.00 0.00 O ATOM 810 NE2 GLN A 53 -5.297 -1.837 13.418 1.00 0.00 N ATOM 0 H GLN A 53 -8.949 -1.503 18.689 1.00 0.00 H new ATOM 0 HA GLN A 53 -8.489 -0.861 15.848 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -6.778 -2.467 17.654 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -7.343 -3.397 16.280 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -5.986 -0.691 15.969 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -5.087 -2.195 16.022 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -4.366 -1.596 13.759 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -5.453 -1.984 12.421 1.00 0.00 H new ATOM 819 N THR A 54 -9.878 -2.956 15.127 1.00 0.00 N ATOM 820 CA THR A 54 -10.903 -3.929 14.683 1.00 0.00 C ATOM 821 C THR A 54 -10.466 -4.644 13.395 1.00 0.00 C ATOM 822 O THR A 54 -9.691 -4.062 12.634 1.00 0.00 O ATOM 823 CB THR A 54 -12.283 -3.298 14.420 1.00 0.00 C ATOM 824 OG1 THR A 54 -12.196 -2.335 13.397 1.00 0.00 O ATOM 825 CG2 THR A 54 -12.934 -2.664 15.643 1.00 0.00 C ATOM 0 H THR A 54 -9.313 -2.608 14.353 1.00 0.00 H new ATOM 0 HA THR A 54 -10.997 -4.631 15.511 1.00 0.00 H new ATOM 0 HB THR A 54 -12.922 -4.130 14.123 1.00 0.00 H new ATOM 0 HG1 THR A 54 -13.081 -1.944 13.240 1.00 0.00 H new ATOM 0 HG21 THR A 54 -13.901 -2.245 15.364 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.075 -3.422 16.414 1.00 0.00 H new ATOM 0 HG23 THR A 54 -12.292 -1.871 16.027 1.00 0.00 H new ATOM 833 N PRO A 55 -11.006 -5.839 13.072 1.00 0.00 N ATOM 834 CA PRO A 55 -10.794 -6.486 11.776 1.00 0.00 C ATOM 835 C PRO A 55 -11.193 -5.595 10.593 1.00 0.00 C ATOM 836 O PRO A 55 -10.497 -5.563 9.581 1.00 0.00 O ATOM 837 CB PRO A 55 -11.616 -7.779 11.814 1.00 0.00 C ATOM 838 CG PRO A 55 -11.731 -8.076 13.307 1.00 0.00 C ATOM 839 CD PRO A 55 -11.839 -6.680 13.917 1.00 0.00 C ATOM 0 HA PRO A 55 -9.734 -6.688 11.620 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -12.595 -7.647 11.353 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -11.118 -8.588 11.280 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -12.606 -8.686 13.533 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -10.861 -8.616 13.681 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -12.872 -6.331 13.926 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -11.490 -6.672 14.950 1.00 0.00 H new ATOM 847 N LYS A 56 -12.265 -4.807 10.738 1.00 0.00 N ATOM 848 CA LYS A 56 -12.664 -3.811 9.739 1.00 0.00 C ATOM 849 C LYS A 56 -11.561 -2.759 9.502 1.00 0.00 C ATOM 850 O LYS A 56 -11.194 -2.500 8.357 1.00 0.00 O ATOM 851 CB LYS A 56 -14.003 -3.201 10.191 1.00 0.00 C ATOM 852 CG LYS A 56 -14.646 -2.333 9.100 1.00 0.00 C ATOM 853 CD LYS A 56 -16.068 -1.921 9.502 1.00 0.00 C ATOM 854 CE LYS A 56 -16.726 -1.141 8.360 1.00 0.00 C ATOM 855 NZ LYS A 56 -18.145 -0.832 8.647 1.00 0.00 N ATOM 0 H LYS A 56 -12.880 -4.843 11.551 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.803 -4.283 8.766 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.690 -4.001 10.467 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -13.842 -2.597 11.084 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -14.039 -1.444 8.931 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -14.674 -2.884 8.160 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.659 -2.806 9.738 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -16.038 -1.308 10.403 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -16.179 -0.213 8.192 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -16.660 -1.721 7.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -18.553 -0.304 7.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -18.673 -1.718 8.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -18.207 -0.257 9.511 1.00 0.00 H new ATOM 869 N THR A 57 -10.956 -2.220 10.571 1.00 0.00 N ATOM 870 CA THR A 57 -9.818 -1.277 10.512 1.00 0.00 C ATOM 871 C THR A 57 -8.585 -1.910 9.865 1.00 0.00 C ATOM 872 O THR A 57 -7.908 -1.229 9.098 1.00 0.00 O ATOM 873 CB THR A 57 -9.494 -0.760 11.917 1.00 0.00 C ATOM 874 OG1 THR A 57 -10.637 -0.128 12.441 1.00 0.00 O ATOM 875 CG2 THR A 57 -8.344 0.248 11.972 1.00 0.00 C ATOM 0 H THR A 57 -11.248 -2.430 11.526 1.00 0.00 H new ATOM 0 HA THR A 57 -10.110 -0.436 9.883 1.00 0.00 H new ATOM 0 HB THR A 57 -9.186 -1.632 12.493 1.00 0.00 H new ATOM 0 HG1 THR A 57 -11.242 -0.803 12.814 1.00 0.00 H new ATOM 0 HG21 THR A 57 -8.183 0.561 13.004 1.00 0.00 H new ATOM 0 HG22 THR A 57 -7.435 -0.215 11.587 1.00 0.00 H new ATOM 0 HG23 THR A 57 -8.593 1.118 11.364 1.00 0.00 H new ATOM 883 N LEU A 58 -8.316 -3.207 10.076 1.00 0.00 N ATOM 884 CA LEU A 58 -7.234 -3.902 9.363 1.00 0.00 C ATOM 885 C LEU A 58 -7.481 -3.892 7.852 1.00 0.00 C ATOM 886 O LEU A 58 -6.584 -3.529 7.095 1.00 0.00 O ATOM 887 CB LEU A 58 -7.075 -5.352 9.858 1.00 0.00 C ATOM 888 CG LEU A 58 -6.655 -5.539 11.325 1.00 0.00 C ATOM 889 CD1 LEU A 58 -6.728 -7.017 11.692 1.00 0.00 C ATOM 890 CD2 LEU A 58 -5.278 -4.939 11.619 1.00 0.00 C ATOM 0 H LEU A 58 -8.831 -3.794 10.732 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.310 -3.364 9.573 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.023 -5.869 9.707 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -6.337 -5.848 9.227 1.00 0.00 H new ATOM 0 HG LEU A 58 -7.354 -4.989 11.955 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -6.430 -7.149 12.732 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -7.749 -7.375 11.559 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -6.057 -7.585 11.048 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -5.028 -5.098 12.668 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.529 -5.422 10.991 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.294 -3.870 11.408 1.00 0.00 H new ATOM 902 N GLN A 59 -8.701 -4.223 7.420 1.00 0.00 N ATOM 903 CA GLN A 59 -9.081 -4.205 6.006 1.00 0.00 C ATOM 904 C GLN A 59 -8.962 -2.789 5.395 1.00 0.00 C ATOM 905 O GLN A 59 -8.682 -2.682 4.201 1.00 0.00 O ATOM 906 CB GLN A 59 -10.517 -4.745 5.842 1.00 0.00 C ATOM 907 CG GLN A 59 -10.660 -6.245 6.153 1.00 0.00 C ATOM 908 CD GLN A 59 -10.027 -7.111 5.067 1.00 0.00 C ATOM 909 OE1 GLN A 59 -8.818 -7.249 5.000 1.00 0.00 O ATOM 910 NE2 GLN A 59 -10.799 -7.683 4.169 1.00 0.00 N ATOM 0 H GLN A 59 -9.455 -4.512 8.044 1.00 0.00 H new ATOM 0 HA GLN A 59 -8.388 -4.850 5.465 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.183 -4.183 6.497 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.848 -4.563 4.820 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -10.191 -6.464 7.112 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -11.716 -6.497 6.250 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -11.811 -7.570 4.221 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -10.385 -8.239 3.421 1.00 0.00 H new ATOM 919 N GLU A 60 -9.137 -1.705 6.172 1.00 0.00 N ATOM 920 CA GLU A 60 -8.856 -0.325 5.724 1.00 0.00 C ATOM 921 C GLU A 60 -7.353 -0.046 5.569 1.00 0.00 C ATOM 922 O GLU A 60 -6.954 0.631 4.622 1.00 0.00 O ATOM 923 CB GLU A 60 -9.458 0.744 6.659 1.00 0.00 C ATOM 924 CG GLU A 60 -10.974 0.613 6.823 1.00 0.00 C ATOM 925 CD GLU A 60 -11.647 1.865 7.392 1.00 0.00 C ATOM 926 OE1 GLU A 60 -11.137 2.485 8.358 1.00 0.00 O ATOM 927 OE2 GLU A 60 -12.752 2.201 6.897 1.00 0.00 O ATOM 0 H GLU A 60 -9.478 -1.759 7.132 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.336 -0.254 4.748 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -8.985 0.670 7.638 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.225 1.734 6.267 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -11.416 0.384 5.853 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.187 -0.232 7.478 1.00 0.00 H new ATOM 934 N ALA A 61 -6.508 -0.562 6.469 1.00 0.00 N ATOM 935 CA ALA A 61 -5.055 -0.370 6.378 1.00 0.00 C ATOM 936 C ALA A 61 -4.407 -1.131 5.212 1.00 0.00 C ATOM 937 O ALA A 61 -3.396 -0.664 4.699 1.00 0.00 O ATOM 938 CB ALA A 61 -4.379 -0.743 7.702 1.00 0.00 C ATOM 0 H ALA A 61 -6.806 -1.117 7.271 1.00 0.00 H new ATOM 0 HA ALA A 61 -4.901 0.690 6.175 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -3.303 -0.594 7.616 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -4.769 -0.112 8.500 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -4.583 -1.788 7.933 1.00 0.00 H new ATOM 944 N ILE A 62 -4.950 -2.278 4.781 1.00 0.00 N ATOM 945 CA ILE A 62 -4.490 -2.943 3.542 1.00 0.00 C ATOM 946 C ILE A 62 -4.946 -2.191 2.282 1.00 0.00 C ATOM 947 O ILE A 62 -4.296 -2.259 1.239 1.00 0.00 O ATOM 948 CB ILE A 62 -4.895 -4.441 3.492 1.00 0.00 C ATOM 949 CG1 ILE A 62 -4.678 -5.234 4.802 1.00 0.00 C ATOM 950 CG2 ILE A 62 -4.107 -5.138 2.367 1.00 0.00 C ATOM 951 CD1 ILE A 62 -3.305 -5.059 5.462 1.00 0.00 C ATOM 0 H ILE A 62 -5.704 -2.766 5.265 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.401 -2.910 3.561 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.971 -4.441 3.317 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -5.445 -4.937 5.517 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -4.829 -6.293 4.594 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.386 -6.191 2.326 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -4.338 -4.664 1.413 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.038 -5.053 2.565 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.260 -5.658 6.372 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.526 -5.386 4.773 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.152 -4.009 5.711 1.00 0.00 H new ATOM 963 N ASP A 63 -6.073 -1.485 2.352 1.00 0.00 N ATOM 964 CA ASP A 63 -6.642 -0.702 1.248 1.00 0.00 C ATOM 965 C ASP A 63 -5.885 0.615 0.950 1.00 0.00 C ATOM 966 O ASP A 63 -6.189 1.289 -0.032 1.00 0.00 O ATOM 967 CB ASP A 63 -8.133 -0.484 1.545 1.00 0.00 C ATOM 968 CG ASP A 63 -8.961 -0.134 0.311 1.00 0.00 C ATOM 969 OD1 ASP A 63 -9.049 -0.973 -0.618 1.00 0.00 O ATOM 970 OD2 ASP A 63 -9.585 0.955 0.311 1.00 0.00 O ATOM 0 H ASP A 63 -6.635 -1.438 3.202 1.00 0.00 H new ATOM 0 HA ASP A 63 -6.526 -1.267 0.323 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -8.539 -1.387 2.000 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -8.235 0.316 2.279 1.00 0.00 H new ATOM 975 N ASP A 64 -4.884 0.967 1.768 1.00 0.00 N ATOM 976 CA ASP A 64 -3.838 1.963 1.463 1.00 0.00 C ATOM 977 C ASP A 64 -2.817 1.472 0.411 1.00 0.00 C ATOM 978 O ASP A 64 -2.007 2.262 -0.080 1.00 0.00 O ATOM 979 CB ASP A 64 -3.107 2.348 2.770 1.00 0.00 C ATOM 980 CG ASP A 64 -3.622 3.633 3.434 1.00 0.00 C ATOM 981 OD1 ASP A 64 -4.797 4.029 3.250 1.00 0.00 O ATOM 982 OD2 ASP A 64 -2.854 4.241 4.218 1.00 0.00 O ATOM 0 H ASP A 64 -4.773 0.554 2.694 1.00 0.00 H new ATOM 0 HA ASP A 64 -4.334 2.831 1.029 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -3.200 1.525 3.479 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -2.045 2.466 2.556 1.00 0.00 H new ATOM 987 N MET A 65 -2.843 0.176 0.074 1.00 0.00 N ATOM 988 CA MET A 65 -1.982 -0.454 -0.930 1.00 0.00 C ATOM 989 C MET A 65 -2.827 -0.997 -2.099 1.00 0.00 C ATOM 990 O MET A 65 -3.660 -0.275 -2.647 1.00 0.00 O ATOM 991 CB MET A 65 -1.086 -1.520 -0.261 1.00 0.00 C ATOM 992 CG MET A 65 -0.113 -0.939 0.772 1.00 0.00 C ATOM 993 SD MET A 65 -0.770 -0.689 2.439 1.00 0.00 S ATOM 994 CE MET A 65 -0.697 -2.380 3.073 1.00 0.00 C ATOM 0 H MET A 65 -3.487 -0.484 0.509 1.00 0.00 H new ATOM 0 HA MET A 65 -1.310 0.286 -1.365 1.00 0.00 H new ATOM 0 HB2 MET A 65 -1.719 -2.262 0.225 1.00 0.00 H new ATOM 0 HB3 MET A 65 -0.517 -2.041 -1.031 1.00 0.00 H new ATOM 0 HG2 MET A 65 0.750 -1.602 0.840 1.00 0.00 H new ATOM 0 HG3 MET A 65 0.249 0.019 0.400 1.00 0.00 H new ATOM 0 HE1 MET A 65 -1.167 -2.421 4.056 1.00 0.00 H new ATOM 0 HE2 MET A 65 -1.224 -3.047 2.391 1.00 0.00 H new ATOM 0 HE3 MET A 65 0.344 -2.693 3.155 1.00 0.00 H new ATOM 1004 N GLY A 66 -2.602 -2.245 -2.524 1.00 0.00 N ATOM 1005 CA GLY A 66 -3.416 -2.924 -3.533 1.00 0.00 C ATOM 1006 C GLY A 66 -3.324 -4.440 -3.428 1.00 0.00 C ATOM 1007 O GLY A 66 -2.859 -5.085 -4.366 1.00 0.00 O ATOM 0 H GLY A 66 -1.837 -2.819 -2.170 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.456 -2.617 -3.423 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.094 -2.611 -4.526 1.00 0.00 H new ATOM 1011 N PHE A 67 -3.713 -4.986 -2.273 1.00 0.00 N ATOM 1012 CA PHE A 67 -3.604 -6.414 -1.953 1.00 0.00 C ATOM 1013 C PHE A 67 -4.976 -7.014 -1.615 1.00 0.00 C ATOM 1014 O PHE A 67 -5.831 -6.359 -1.021 1.00 0.00 O ATOM 1015 CB PHE A 67 -2.598 -6.633 -0.807 1.00 0.00 C ATOM 1016 CG PHE A 67 -1.250 -5.944 -0.961 1.00 0.00 C ATOM 1017 CD1 PHE A 67 -0.566 -5.977 -2.191 1.00 0.00 C ATOM 1018 CD2 PHE A 67 -0.669 -5.267 0.131 1.00 0.00 C ATOM 1019 CE1 PHE A 67 0.666 -5.322 -2.335 1.00 0.00 C ATOM 1020 CE2 PHE A 67 0.573 -4.621 -0.011 1.00 0.00 C ATOM 1021 CZ PHE A 67 1.237 -4.637 -1.250 1.00 0.00 C ATOM 0 H PHE A 67 -4.122 -4.437 -1.517 1.00 0.00 H new ATOM 0 HA PHE A 67 -3.231 -6.934 -2.835 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.055 -6.290 0.121 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -2.426 -7.704 -0.701 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -0.992 -6.510 -3.028 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -1.180 -5.244 1.082 1.00 0.00 H new ATOM 0 HE1 PHE A 67 1.178 -5.345 -3.285 1.00 0.00 H new ATOM 0 HE2 PHE A 67 1.016 -4.113 0.832 1.00 0.00 H new ATOM 0 HZ PHE A 67 2.181 -4.125 -1.367 1.00 0.00 H new ATOM 1031 N ASP A 68 -5.181 -8.277 -1.994 1.00 0.00 N ATOM 1032 CA ASP A 68 -6.512 -8.890 -2.105 1.00 0.00 C ATOM 1033 C ASP A 68 -6.928 -9.576 -0.795 1.00 0.00 C ATOM 1034 O ASP A 68 -6.968 -10.801 -0.683 1.00 0.00 O ATOM 1035 CB ASP A 68 -6.531 -9.809 -3.336 1.00 0.00 C ATOM 1036 CG ASP A 68 -6.473 -8.991 -4.623 1.00 0.00 C ATOM 1037 OD1 ASP A 68 -7.446 -8.256 -4.918 1.00 0.00 O ATOM 1038 OD2 ASP A 68 -5.447 -9.045 -5.340 1.00 0.00 O ATOM 0 H ASP A 68 -4.421 -8.913 -2.236 1.00 0.00 H new ATOM 0 HA ASP A 68 -7.272 -8.124 -2.260 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -5.684 -10.495 -3.297 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -7.435 -10.418 -3.327 1.00 0.00 H new ATOM 1043 N ALA A 69 -7.169 -8.740 0.216 1.00 0.00 N ATOM 1044 CA ALA A 69 -7.360 -9.117 1.612 1.00 0.00 C ATOM 1045 C ALA A 69 -8.795 -9.572 1.938 1.00 0.00 C ATOM 1046 O ALA A 69 -9.751 -8.847 1.658 1.00 0.00 O ATOM 1047 CB ALA A 69 -6.946 -7.904 2.450 1.00 0.00 C ATOM 0 H ALA A 69 -7.239 -7.732 0.073 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.748 -9.989 1.841 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.070 -8.133 3.508 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -5.902 -7.664 2.251 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -7.571 -7.050 2.188 1.00 0.00 H new ATOM 1053 N VAL A 70 -8.929 -10.737 2.583 1.00 0.00 N ATOM 1054 CA VAL A 70 -10.197 -11.357 3.019 1.00 0.00 C ATOM 1055 C VAL A 70 -10.008 -11.950 4.419 1.00 0.00 C ATOM 1056 O VAL A 70 -8.992 -12.588 4.683 1.00 0.00 O ATOM 1057 CB VAL A 70 -10.622 -12.478 2.037 1.00 0.00 C ATOM 1058 CG1 VAL A 70 -11.802 -13.325 2.549 1.00 0.00 C ATOM 1059 CG2 VAL A 70 -10.994 -11.903 0.661 1.00 0.00 C ATOM 0 H VAL A 70 -8.119 -11.305 2.830 1.00 0.00 H new ATOM 0 HA VAL A 70 -10.977 -10.596 3.036 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.751 -13.128 1.953 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -12.047 -14.090 1.813 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -11.527 -13.802 3.490 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -12.669 -12.683 2.707 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -11.288 -12.714 -0.005 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -11.824 -11.205 0.771 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.134 -11.381 0.240 1.00 0.00 H new ATOM 1069 N ILE A 71 -10.967 -11.755 5.325 1.00 0.00 N ATOM 1070 CA ILE A 71 -10.865 -12.209 6.726 1.00 0.00 C ATOM 1071 C ILE A 71 -11.099 -13.726 6.855 1.00 0.00 C ATOM 1072 O ILE A 71 -12.090 -14.255 6.350 1.00 0.00 O ATOM 1073 CB ILE A 71 -11.825 -11.374 7.611 1.00 0.00 C ATOM 1074 CG1 ILE A 71 -11.270 -9.940 7.782 1.00 0.00 C ATOM 1075 CG2 ILE A 71 -12.041 -12.045 8.979 1.00 0.00 C ATOM 1076 CD1 ILE A 71 -12.291 -8.923 8.304 1.00 0.00 C ATOM 0 H ILE A 71 -11.843 -11.276 5.114 1.00 0.00 H new ATOM 0 HA ILE A 71 -9.848 -12.041 7.082 1.00 0.00 H new ATOM 0 HB ILE A 71 -12.794 -11.319 7.115 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -10.423 -9.971 8.468 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -10.890 -9.594 6.821 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -12.719 -11.438 9.579 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -12.473 -13.035 8.834 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -11.085 -12.138 9.494 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -11.818 -7.945 8.394 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -13.128 -8.858 7.609 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -12.654 -9.241 9.281 1.00 0.00 H new ATOM 1088 N HIS A 72 -10.219 -14.443 7.560 1.00 0.00 N ATOM 1089 CA HIS A 72 -10.147 -15.909 7.488 1.00 0.00 C ATOM 1090 C HIS A 72 -9.454 -16.556 8.715 1.00 0.00 C ATOM 1091 O HIS A 72 -8.508 -17.334 8.568 1.00 0.00 O ATOM 1092 CB HIS A 72 -9.470 -16.266 6.150 1.00 0.00 C ATOM 1093 CG HIS A 72 -9.735 -17.670 5.679 1.00 0.00 C ATOM 1094 ND1 HIS A 72 -8.883 -18.744 5.757 1.00 0.00 N ATOM 1095 CD2 HIS A 72 -10.867 -18.095 5.044 1.00 0.00 C ATOM 1096 CE1 HIS A 72 -9.477 -19.793 5.171 1.00 0.00 C ATOM 1097 NE2 HIS A 72 -10.696 -19.451 4.708 1.00 0.00 N ATOM 0 H HIS A 72 -9.538 -14.027 8.195 1.00 0.00 H new ATOM 0 HA HIS A 72 -11.153 -16.328 7.521 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -9.811 -15.568 5.386 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -8.394 -16.126 6.252 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -11.741 -17.495 4.836 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -9.039 -20.776 5.082 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -11.358 -20.051 4.216 1.00 0.00 H new ATOM 1105 N ASN A 73 -9.890 -16.225 9.940 1.00 0.00 N ATOM 1106 CA ASN A 73 -9.358 -16.808 11.188 1.00 0.00 C ATOM 1107 C ASN A 73 -9.993 -18.162 11.542 1.00 0.00 C ATOM 1108 O ASN A 73 -11.240 -18.283 11.464 1.00 0.00 O ATOM 1109 CB ASN A 73 -9.517 -15.773 12.324 1.00 0.00 C ATOM 1110 CG ASN A 73 -8.812 -16.160 13.615 1.00 0.00 C ATOM 1111 OD1 ASN A 73 -9.426 -16.366 14.656 1.00 0.00 O ATOM 1112 ND2 ASN A 73 -7.506 -16.249 13.612 1.00 0.00 N ATOM 1113 OXT ASN A 73 -9.239 -19.072 11.954 1.00 0.00 O ATOM 0 H ASN A 73 -10.628 -15.539 10.097 1.00 0.00 H new ATOM 0 HA ASN A 73 -8.301 -17.030 11.043 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -9.129 -14.813 11.984 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -10.578 -15.634 12.529 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.009 -16.488 14.470 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -6.985 -16.080 12.751 1.00 0.00 H new TER 1120 ASN A 73 ATOM 1121 N MET B 74 -0.366 18.497 -22.556 1.00 0.00 N ATOM 1122 CA MET B 74 -0.715 17.518 -21.499 1.00 0.00 C ATOM 1123 C MET B 74 0.378 17.462 -20.418 1.00 0.00 C ATOM 1124 O MET B 74 1.563 17.584 -20.749 1.00 0.00 O ATOM 1125 CB MET B 74 -1.049 16.122 -22.062 1.00 0.00 C ATOM 1126 CG MET B 74 0.162 15.276 -22.483 1.00 0.00 C ATOM 1127 SD MET B 74 1.149 15.957 -23.840 1.00 0.00 S ATOM 1128 CE MET B 74 2.629 14.920 -23.713 1.00 0.00 C ATOM 0 HA MET B 74 -1.632 17.872 -21.027 1.00 0.00 H new ATOM 0 HB2 MET B 74 -1.613 15.570 -21.309 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.704 16.244 -22.925 1.00 0.00 H new ATOM 0 HG2 MET B 74 0.810 15.142 -21.616 1.00 0.00 H new ATOM 0 HG3 MET B 74 -0.191 14.286 -22.773 1.00 0.00 H new ATOM 0 HE1 MET B 74 3.329 15.186 -24.505 1.00 0.00 H new ATOM 0 HE2 MET B 74 3.101 15.077 -22.743 1.00 0.00 H new ATOM 0 HE3 MET B 74 2.348 13.872 -23.814 1.00 0.00 H new ATOM 1140 N PRO B 75 0.024 17.261 -19.133 1.00 0.00 N ATOM 1141 CA PRO B 75 0.946 17.386 -18.007 1.00 0.00 C ATOM 1142 C PRO B 75 1.637 16.051 -17.672 1.00 0.00 C ATOM 1143 O PRO B 75 1.414 15.485 -16.608 1.00 0.00 O ATOM 1144 CB PRO B 75 0.061 17.926 -16.874 1.00 0.00 C ATOM 1145 CG PRO B 75 -1.261 17.201 -17.107 1.00 0.00 C ATOM 1146 CD PRO B 75 -1.341 17.157 -18.631 1.00 0.00 C ATOM 0 HA PRO B 75 1.785 18.051 -18.211 1.00 0.00 H new ATOM 0 HB2 PRO B 75 0.478 17.702 -15.892 1.00 0.00 H new ATOM 0 HB3 PRO B 75 -0.055 19.008 -16.931 1.00 0.00 H new ATOM 0 HG2 PRO B 75 -1.260 16.202 -16.670 1.00 0.00 H new ATOM 0 HG3 PRO B 75 -2.103 17.739 -16.671 1.00 0.00 H new ATOM 0 HD2 PRO B 75 -1.805 16.230 -18.966 1.00 0.00 H new ATOM 0 HD3 PRO B 75 -1.954 17.975 -19.009 1.00 0.00 H new ATOM 1154 N LYS B 76 2.479 15.520 -18.568 1.00 0.00 N ATOM 1155 CA LYS B 76 3.353 14.370 -18.256 1.00 0.00 C ATOM 1156 C LYS B 76 4.434 14.718 -17.204 1.00 0.00 C ATOM 1157 O LYS B 76 5.505 15.238 -17.540 1.00 0.00 O ATOM 1158 CB LYS B 76 3.954 13.794 -19.554 1.00 0.00 C ATOM 1159 CG LYS B 76 2.962 12.953 -20.375 1.00 0.00 C ATOM 1160 CD LYS B 76 3.050 11.443 -20.112 1.00 0.00 C ATOM 1161 CE LYS B 76 2.852 11.028 -18.647 1.00 0.00 C ATOM 1162 NZ LYS B 76 2.576 9.574 -18.555 1.00 0.00 N ATOM 0 H LYS B 76 2.577 15.868 -19.522 1.00 0.00 H new ATOM 0 HA LYS B 76 2.741 13.594 -17.796 1.00 0.00 H new ATOM 0 HB2 LYS B 76 4.318 14.615 -20.171 1.00 0.00 H new ATOM 0 HB3 LYS B 76 4.817 13.178 -19.302 1.00 0.00 H new ATOM 0 HG2 LYS B 76 1.949 13.290 -20.156 1.00 0.00 H new ATOM 0 HG3 LYS B 76 3.137 13.137 -21.435 1.00 0.00 H new ATOM 0 HD2 LYS B 76 2.300 10.939 -20.722 1.00 0.00 H new ATOM 0 HD3 LYS B 76 4.024 11.087 -20.446 1.00 0.00 H new ATOM 0 HE2 LYS B 76 3.743 11.273 -18.069 1.00 0.00 H new ATOM 0 HE3 LYS B 76 2.026 11.590 -18.212 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 3.104 9.170 -17.755 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 1.558 9.423 -18.409 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 2.872 9.108 -19.436 1.00 0.00 H new ATOM 1176 N HIS B 77 4.150 14.406 -15.940 1.00 0.00 N ATOM 1177 CA HIS B 77 5.012 14.577 -14.763 1.00 0.00 C ATOM 1178 C HIS B 77 5.680 13.251 -14.347 1.00 0.00 C ATOM 1179 O HIS B 77 5.063 12.188 -14.443 1.00 0.00 O ATOM 1180 CB HIS B 77 4.147 15.084 -13.597 1.00 0.00 C ATOM 1181 CG HIS B 77 3.717 16.526 -13.700 1.00 0.00 C ATOM 1182 ND1 HIS B 77 4.458 17.639 -13.369 1.00 0.00 N ATOM 1183 CD2 HIS B 77 2.471 16.968 -14.051 1.00 0.00 C ATOM 1184 CE1 HIS B 77 3.678 18.721 -13.523 1.00 0.00 C ATOM 1185 NE2 HIS B 77 2.450 18.366 -13.943 1.00 0.00 N ATOM 0 H HIS B 77 3.249 13.998 -15.690 1.00 0.00 H new ATOM 0 HA HIS B 77 5.800 15.288 -15.012 1.00 0.00 H new ATOM 0 HB2 HIS B 77 3.256 14.459 -13.527 1.00 0.00 H new ATOM 0 HB3 HIS B 77 4.703 14.952 -12.669 1.00 0.00 H new ATOM 0 HD2 HIS B 77 1.644 16.346 -14.359 1.00 0.00 H new ATOM 0 HE1 HIS B 77 3.993 19.737 -13.335 1.00 0.00 H new ATOM 0 HE2 HIS B 77 1.665 18.986 -14.142 1.00 0.00 H new ATOM 1193 N GLU B 78 6.913 13.312 -13.833 1.00 0.00 N ATOM 1194 CA GLU B 78 7.692 12.141 -13.419 1.00 0.00 C ATOM 1195 C GLU B 78 7.837 12.083 -11.885 1.00 0.00 C ATOM 1196 O GLU B 78 8.198 13.069 -11.238 1.00 0.00 O ATOM 1197 CB GLU B 78 9.070 12.153 -14.108 1.00 0.00 C ATOM 1198 CG GLU B 78 8.992 12.187 -15.645 1.00 0.00 C ATOM 1199 CD GLU B 78 10.331 11.866 -16.315 1.00 0.00 C ATOM 1200 OE1 GLU B 78 11.340 12.575 -16.080 1.00 0.00 O ATOM 1201 OE2 GLU B 78 10.401 10.886 -17.095 1.00 0.00 O ATOM 0 H GLU B 78 7.406 14.193 -13.691 1.00 0.00 H new ATOM 0 HA GLU B 78 7.158 11.243 -13.729 1.00 0.00 H new ATOM 0 HB2 GLU B 78 9.632 13.021 -13.762 1.00 0.00 H new ATOM 0 HB3 GLU B 78 9.628 11.269 -13.801 1.00 0.00 H new ATOM 0 HG2 GLU B 78 8.242 11.472 -15.982 1.00 0.00 H new ATOM 0 HG3 GLU B 78 8.658 13.174 -15.965 1.00 0.00 H new ATOM 1208 N PHE B 79 7.556 10.913 -11.302 1.00 0.00 N ATOM 1209 CA PHE B 79 7.649 10.629 -9.866 1.00 0.00 C ATOM 1210 C PHE B 79 8.454 9.341 -9.643 1.00 0.00 C ATOM 1211 O PHE B 79 8.248 8.352 -10.352 1.00 0.00 O ATOM 1212 CB PHE B 79 6.239 10.441 -9.271 1.00 0.00 C ATOM 1213 CG PHE B 79 5.278 11.614 -9.388 1.00 0.00 C ATOM 1214 CD1 PHE B 79 4.574 11.837 -10.589 1.00 0.00 C ATOM 1215 CD2 PHE B 79 5.022 12.435 -8.271 1.00 0.00 C ATOM 1216 CE1 PHE B 79 3.627 12.873 -10.673 1.00 0.00 C ATOM 1217 CE2 PHE B 79 4.067 13.466 -8.355 1.00 0.00 C ATOM 1218 CZ PHE B 79 3.367 13.682 -9.554 1.00 0.00 C ATOM 0 H PHE B 79 7.245 10.104 -11.840 1.00 0.00 H new ATOM 0 HA PHE B 79 8.145 11.467 -9.377 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.780 9.578 -9.753 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.347 10.196 -8.214 1.00 0.00 H new ATOM 0 HD1 PHE B 79 4.763 11.210 -11.448 1.00 0.00 H new ATOM 0 HD2 PHE B 79 5.560 12.273 -7.349 1.00 0.00 H new ATOM 0 HE1 PHE B 79 3.099 13.047 -11.599 1.00 0.00 H new ATOM 0 HE2 PHE B 79 3.872 14.092 -7.497 1.00 0.00 H new ATOM 0 HZ PHE B 79 2.630 14.469 -9.615 1.00 0.00 H new ATOM 1228 N SER B 80 9.314 9.303 -8.624 1.00 0.00 N ATOM 1229 CA SER B 80 10.071 8.102 -8.240 1.00 0.00 C ATOM 1230 C SER B 80 9.677 7.606 -6.842 1.00 0.00 C ATOM 1231 O SER B 80 9.599 8.390 -5.893 1.00 0.00 O ATOM 1232 CB SER B 80 11.576 8.366 -8.321 1.00 0.00 C ATOM 1233 OG SER B 80 12.302 7.161 -8.140 1.00 0.00 O ATOM 0 H SER B 80 9.509 10.112 -8.034 1.00 0.00 H new ATOM 0 HA SER B 80 9.819 7.312 -8.948 1.00 0.00 H new ATOM 0 HB2 SER B 80 11.823 8.804 -9.288 1.00 0.00 H new ATOM 0 HB3 SER B 80 11.866 9.090 -7.559 1.00 0.00 H new ATOM 0 HG SER B 80 11.755 6.402 -8.432 1.00 0.00 H new ATOM 1239 N VAL B 81 9.461 6.295 -6.699 1.00 0.00 N ATOM 1240 CA VAL B 81 8.953 5.637 -5.479 1.00 0.00 C ATOM 1241 C VAL B 81 9.734 4.347 -5.227 1.00 0.00 C ATOM 1242 O VAL B 81 10.150 3.691 -6.176 1.00 0.00 O ATOM 1243 CB VAL B 81 7.421 5.393 -5.539 1.00 0.00 C ATOM 1244 CG1 VAL B 81 6.958 4.686 -6.822 1.00 0.00 C ATOM 1245 CG2 VAL B 81 6.892 4.589 -4.336 1.00 0.00 C ATOM 0 H VAL B 81 9.640 5.633 -7.454 1.00 0.00 H new ATOM 0 HA VAL B 81 9.112 6.307 -4.634 1.00 0.00 H new ATOM 0 HB VAL B 81 7.004 6.400 -5.520 1.00 0.00 H new ATOM 0 HG11 VAL B 81 5.877 4.550 -6.792 1.00 0.00 H new ATOM 0 HG12 VAL B 81 7.224 5.292 -7.688 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.444 3.713 -6.897 1.00 0.00 H new ATOM 0 HG21 VAL B 81 5.815 4.451 -4.436 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.381 3.615 -4.306 1.00 0.00 H new ATOM 0 HG23 VAL B 81 7.105 5.131 -3.414 1.00 0.00 H new ATOM 1255 N ASP B 82 9.943 4.003 -3.954 1.00 0.00 N ATOM 1256 CA ASP B 82 10.778 2.892 -3.473 1.00 0.00 C ATOM 1257 C ASP B 82 10.240 1.483 -3.833 1.00 0.00 C ATOM 1258 O ASP B 82 9.777 0.734 -2.974 1.00 0.00 O ATOM 1259 CB ASP B 82 10.966 3.091 -1.957 1.00 0.00 C ATOM 1260 CG ASP B 82 12.016 2.169 -1.335 1.00 0.00 C ATOM 1261 OD1 ASP B 82 13.107 2.014 -1.934 1.00 0.00 O ATOM 1262 OD2 ASP B 82 11.800 1.692 -0.195 1.00 0.00 O ATOM 0 H ASP B 82 9.512 4.518 -3.187 1.00 0.00 H new ATOM 0 HA ASP B 82 11.738 2.921 -3.988 1.00 0.00 H new ATOM 0 HB2 ASP B 82 11.249 4.127 -1.769 1.00 0.00 H new ATOM 0 HB3 ASP B 82 10.011 2.926 -1.458 1.00 0.00 H new ATOM 1267 N MET B 83 10.289 1.107 -5.117 1.00 0.00 N ATOM 1268 CA MET B 83 9.820 -0.188 -5.638 1.00 0.00 C ATOM 1269 C MET B 83 10.807 -1.333 -5.331 1.00 0.00 C ATOM 1270 O MET B 83 11.375 -1.945 -6.244 1.00 0.00 O ATOM 1271 CB MET B 83 9.520 -0.114 -7.146 1.00 0.00 C ATOM 1272 CG MET B 83 8.518 0.957 -7.579 1.00 0.00 C ATOM 1273 SD MET B 83 8.343 1.025 -9.377 1.00 0.00 S ATOM 1274 CE MET B 83 7.423 2.570 -9.508 1.00 0.00 C ATOM 0 H MET B 83 10.667 1.712 -5.846 1.00 0.00 H new ATOM 0 HA MET B 83 8.889 -0.414 -5.118 1.00 0.00 H new ATOM 0 HB2 MET B 83 10.457 0.059 -7.675 1.00 0.00 H new ATOM 0 HB3 MET B 83 9.146 -1.085 -7.470 1.00 0.00 H new ATOM 0 HG2 MET B 83 7.548 0.751 -7.127 1.00 0.00 H new ATOM 0 HG3 MET B 83 8.842 1.929 -7.208 1.00 0.00 H new ATOM 0 HE1 MET B 83 7.249 2.802 -10.559 1.00 0.00 H new ATOM 0 HE2 MET B 83 6.466 2.468 -8.996 1.00 0.00 H new ATOM 0 HE3 MET B 83 7.997 3.375 -9.049 1.00 0.00 H new ATOM 1284 N THR B 84 10.972 -1.652 -4.044 1.00 0.00 N ATOM 1285 CA THR B 84 11.738 -2.795 -3.505 1.00 0.00 C ATOM 1286 C THR B 84 11.127 -4.162 -3.801 1.00 0.00 C ATOM 1287 O THR B 84 11.722 -5.181 -3.451 1.00 0.00 O ATOM 1288 CB THR B 84 11.915 -2.624 -1.991 1.00 0.00 C ATOM 1289 OG1 THR B 84 10.689 -2.233 -1.402 1.00 0.00 O ATOM 1290 CG2 THR B 84 12.955 -1.542 -1.724 1.00 0.00 C ATOM 0 H THR B 84 10.553 -1.091 -3.302 1.00 0.00 H new ATOM 0 HA THR B 84 12.700 -2.782 -4.018 1.00 0.00 H new ATOM 0 HB THR B 84 12.240 -3.572 -1.562 1.00 0.00 H new ATOM 0 HG1 THR B 84 10.810 -2.127 -0.435 1.00 0.00 H new ATOM 0 HG21 THR B 84 13.083 -1.418 -0.649 1.00 0.00 H new ATOM 0 HG22 THR B 84 13.905 -1.833 -2.172 1.00 0.00 H new ATOM 0 HG23 THR B 84 12.621 -0.601 -2.161 1.00 0.00 H new ATOM 1298 N CYS B 85 9.975 -4.193 -4.467 1.00 0.00 N ATOM 1299 CA CYS B 85 9.186 -5.376 -4.770 1.00 0.00 C ATOM 1300 C CYS B 85 8.104 -5.046 -5.828 1.00 0.00 C ATOM 1301 O CYS B 85 7.592 -3.922 -5.876 1.00 0.00 O ATOM 1302 CB CYS B 85 8.689 -5.912 -3.411 1.00 0.00 C ATOM 1303 SG CYS B 85 7.331 -7.111 -3.514 1.00 0.00 S ATOM 0 H CYS B 85 9.546 -3.341 -4.829 1.00 0.00 H new ATOM 0 HA CYS B 85 9.749 -6.177 -5.249 1.00 0.00 H new ATOM 0 HB2 CYS B 85 9.527 -6.377 -2.892 1.00 0.00 H new ATOM 0 HB3 CYS B 85 8.365 -5.069 -2.801 1.00 0.00 H new ATOM 1308 N GLY B 86 7.752 -6.024 -6.668 1.00 0.00 N ATOM 1309 CA GLY B 86 6.720 -5.891 -7.702 1.00 0.00 C ATOM 1310 C GLY B 86 5.323 -5.728 -7.103 1.00 0.00 C ATOM 1311 O GLY B 86 4.550 -4.909 -7.594 1.00 0.00 O ATOM 0 H GLY B 86 8.184 -6.948 -6.648 1.00 0.00 H new ATOM 0 HA2 GLY B 86 6.947 -5.030 -8.331 1.00 0.00 H new ATOM 0 HA3 GLY B 86 6.737 -6.770 -8.346 1.00 0.00 H new ATOM 1315 N GLY B 87 5.027 -6.401 -5.982 1.00 0.00 N ATOM 1316 CA GLY B 87 3.782 -6.195 -5.231 1.00 0.00 C ATOM 1317 C GLY B 87 3.790 -4.830 -4.541 1.00 0.00 C ATOM 1318 O GLY B 87 2.826 -4.069 -4.632 1.00 0.00 O ATOM 0 H GLY B 87 5.643 -7.102 -5.571 1.00 0.00 H new ATOM 0 HA2 GLY B 87 2.928 -6.263 -5.906 1.00 0.00 H new ATOM 0 HA3 GLY B 87 3.664 -6.984 -4.488 1.00 0.00 H new ATOM 1322 N CYS B 88 4.922 -4.479 -3.920 1.00 0.00 N ATOM 1323 CA CYS B 88 5.163 -3.171 -3.295 1.00 0.00 C ATOM 1324 C CYS B 88 4.963 -1.993 -4.275 1.00 0.00 C ATOM 1325 O CYS B 88 4.449 -0.944 -3.875 1.00 0.00 O ATOM 1326 CB CYS B 88 6.582 -3.233 -2.718 1.00 0.00 C ATOM 1327 SG CYS B 88 6.966 -1.813 -1.672 1.00 0.00 S ATOM 0 H CYS B 88 5.717 -5.112 -3.835 1.00 0.00 H new ATOM 0 HA CYS B 88 4.434 -2.977 -2.508 1.00 0.00 H new ATOM 0 HB2 CYS B 88 6.695 -4.149 -2.138 1.00 0.00 H new ATOM 0 HB3 CYS B 88 7.301 -3.283 -3.536 1.00 0.00 H new ATOM 0 HG CYS B 88 6.297 -1.899 -0.561 1.00 0.00 H new ATOM 1333 N ALA B 89 5.330 -2.188 -5.548 1.00 0.00 N ATOM 1334 CA ALA B 89 5.040 -1.300 -6.674 1.00 0.00 C ATOM 1335 C ALA B 89 3.557 -1.319 -7.077 1.00 0.00 C ATOM 1336 O ALA B 89 2.919 -0.270 -7.038 1.00 0.00 O ATOM 1337 CB ALA B 89 5.951 -1.688 -7.848 1.00 0.00 C ATOM 0 H ALA B 89 5.863 -3.010 -5.831 1.00 0.00 H new ATOM 0 HA ALA B 89 5.244 -0.273 -6.371 1.00 0.00 H new ATOM 0 HB1 ALA B 89 5.748 -1.035 -8.697 1.00 0.00 H new ATOM 0 HB2 ALA B 89 6.994 -1.582 -7.550 1.00 0.00 H new ATOM 0 HB3 ALA B 89 5.758 -2.723 -8.131 1.00 0.00 H new ATOM 1343 N GLU B 90 2.998 -2.482 -7.442 1.00 0.00 N ATOM 1344 CA GLU B 90 1.666 -2.625 -8.060 1.00 0.00 C ATOM 1345 C GLU B 90 0.544 -1.908 -7.290 1.00 0.00 C ATOM 1346 O GLU B 90 -0.374 -1.364 -7.908 1.00 0.00 O ATOM 1347 CB GLU B 90 1.353 -4.121 -8.249 1.00 0.00 C ATOM 1348 CG GLU B 90 0.058 -4.363 -9.041 1.00 0.00 C ATOM 1349 CD GLU B 90 -0.079 -5.823 -9.470 1.00 0.00 C ATOM 1350 OE1 GLU B 90 0.814 -6.317 -10.197 1.00 0.00 O ATOM 1351 OE2 GLU B 90 -1.087 -6.494 -9.133 1.00 0.00 O ATOM 0 H GLU B 90 3.471 -3.376 -7.313 1.00 0.00 H new ATOM 0 HA GLU B 90 1.702 -2.128 -9.029 1.00 0.00 H new ATOM 0 HB2 GLU B 90 2.185 -4.599 -8.767 1.00 0.00 H new ATOM 0 HB3 GLU B 90 1.270 -4.597 -7.272 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -0.800 -4.081 -8.430 1.00 0.00 H new ATOM 0 HG3 GLU B 90 0.046 -3.722 -9.923 1.00 0.00 H new ATOM 1358 N ALA B 91 0.671 -1.797 -5.963 1.00 0.00 N ATOM 1359 CA ALA B 91 -0.149 -0.952 -5.092 1.00 0.00 C ATOM 1360 C ALA B 91 -0.421 0.471 -5.634 1.00 0.00 C ATOM 1361 O ALA B 91 -1.529 0.983 -5.442 1.00 0.00 O ATOM 1362 CB ALA B 91 0.572 -0.894 -3.739 1.00 0.00 C ATOM 0 H ALA B 91 1.380 -2.317 -5.446 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.142 -1.395 -5.018 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.001 -0.274 -3.049 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.663 -1.901 -3.332 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.565 -0.466 -3.874 1.00 0.00 H new ATOM 1368 N VAL B 92 0.539 1.089 -6.342 1.00 0.00 N ATOM 1369 CA VAL B 92 0.366 2.436 -6.928 1.00 0.00 C ATOM 1370 C VAL B 92 -0.799 2.488 -7.926 1.00 0.00 C ATOM 1371 O VAL B 92 -1.453 3.519 -8.044 1.00 0.00 O ATOM 1372 CB VAL B 92 1.635 3.027 -7.589 1.00 0.00 C ATOM 1373 CG1 VAL B 92 2.801 3.109 -6.590 1.00 0.00 C ATOM 1374 CG2 VAL B 92 2.043 2.324 -8.895 1.00 0.00 C ATOM 0 H VAL B 92 1.453 0.675 -6.526 1.00 0.00 H new ATOM 0 HA VAL B 92 0.141 3.063 -6.065 1.00 0.00 H new ATOM 0 HB VAL B 92 1.371 4.043 -7.883 1.00 0.00 H new ATOM 0 HG11 VAL B 92 3.676 3.528 -7.086 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.518 3.747 -5.752 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.036 2.110 -6.222 1.00 0.00 H new ATOM 0 HG21 VAL B 92 2.940 2.795 -9.297 1.00 0.00 H new ATOM 0 HG22 VAL B 92 2.245 1.272 -8.694 1.00 0.00 H new ATOM 0 HG23 VAL B 92 1.234 2.406 -9.621 1.00 0.00 H new ATOM 1384 N SER B 93 -1.107 1.375 -8.604 1.00 0.00 N ATOM 1385 CA SER B 93 -2.231 1.312 -9.546 1.00 0.00 C ATOM 1386 C SER B 93 -3.574 1.491 -8.827 1.00 0.00 C ATOM 1387 O SER B 93 -4.376 2.341 -9.213 1.00 0.00 O ATOM 1388 CB SER B 93 -2.193 0.000 -10.352 1.00 0.00 C ATOM 1389 OG SER B 93 -2.405 -1.160 -9.557 1.00 0.00 O ATOM 0 H SER B 93 -0.589 0.501 -8.516 1.00 0.00 H new ATOM 0 HA SER B 93 -2.129 2.140 -10.248 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.953 0.040 -11.132 1.00 0.00 H new ATOM 0 HB3 SER B 93 -1.228 -0.083 -10.851 1.00 0.00 H new ATOM 0 HG SER B 93 -1.839 -1.117 -8.758 1.00 0.00 H new ATOM 1395 N ARG B 94 -3.798 0.756 -7.729 1.00 0.00 N ATOM 1396 CA ARG B 94 -5.070 0.786 -7.005 1.00 0.00 C ATOM 1397 C ARG B 94 -5.299 2.106 -6.263 1.00 0.00 C ATOM 1398 O ARG B 94 -6.430 2.594 -6.280 1.00 0.00 O ATOM 1399 CB ARG B 94 -5.208 -0.429 -6.078 1.00 0.00 C ATOM 1400 CG ARG B 94 -5.200 -1.751 -6.870 1.00 0.00 C ATOM 1401 CD ARG B 94 -5.882 -2.874 -6.081 1.00 0.00 C ATOM 1402 NE ARG B 94 -5.411 -4.203 -6.496 1.00 0.00 N ATOM 1403 CZ ARG B 94 -5.864 -5.373 -6.066 1.00 0.00 C ATOM 1404 NH1 ARG B 94 -6.794 -5.501 -5.150 1.00 0.00 N ATOM 1405 NH2 ARG B 94 -5.347 -6.468 -6.561 1.00 0.00 N ATOM 0 H ARG B 94 -3.105 0.128 -7.322 1.00 0.00 H new ATOM 0 HA ARG B 94 -5.861 0.724 -7.752 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -4.391 -0.432 -5.357 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -6.135 -0.350 -5.510 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -5.711 -1.610 -7.823 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -4.173 -2.035 -7.098 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -5.690 -2.737 -5.017 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -6.961 -2.812 -6.221 1.00 0.00 H new ATOM 0 HE ARG B 94 -4.659 -4.228 -7.185 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -7.211 -4.672 -4.727 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -7.101 -6.430 -4.861 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -4.610 -6.412 -7.264 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -5.681 -7.378 -6.244 1.00 0.00 H new ATOM 1419 N VAL B 95 -4.263 2.733 -5.690 1.00 0.00 N ATOM 1420 CA VAL B 95 -4.425 4.072 -5.077 1.00 0.00 C ATOM 1421 C VAL B 95 -4.667 5.173 -6.124 1.00 0.00 C ATOM 1422 O VAL B 95 -5.491 6.052 -5.884 1.00 0.00 O ATOM 1423 CB VAL B 95 -3.288 4.482 -4.112 1.00 0.00 C ATOM 1424 CG1 VAL B 95 -3.186 3.500 -2.936 1.00 0.00 C ATOM 1425 CG2 VAL B 95 -1.926 4.600 -4.805 1.00 0.00 C ATOM 0 H VAL B 95 -3.319 2.350 -5.634 1.00 0.00 H new ATOM 0 HA VAL B 95 -5.321 3.972 -4.464 1.00 0.00 H new ATOM 0 HB VAL B 95 -3.551 5.472 -3.741 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -2.379 3.810 -2.272 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -4.127 3.493 -2.385 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -2.980 2.499 -3.315 1.00 0.00 H new ATOM 0 HG21 VAL B 95 -1.170 4.890 -4.075 1.00 0.00 H new ATOM 0 HG22 VAL B 95 -1.657 3.639 -5.244 1.00 0.00 H new ATOM 0 HG23 VAL B 95 -1.981 5.354 -5.590 1.00 0.00 H new ATOM 1435 N LEU B 96 -4.033 5.120 -7.307 1.00 0.00 N ATOM 1436 CA LEU B 96 -4.332 6.066 -8.392 1.00 0.00 C ATOM 1437 C LEU B 96 -5.736 5.835 -8.966 1.00 0.00 C ATOM 1438 O LEU B 96 -6.441 6.802 -9.246 1.00 0.00 O ATOM 1439 CB LEU B 96 -3.243 6.001 -9.482 1.00 0.00 C ATOM 1440 CG LEU B 96 -1.873 6.584 -9.064 1.00 0.00 C ATOM 1441 CD1 LEU B 96 -0.861 6.363 -10.198 1.00 0.00 C ATOM 1442 CD2 LEU B 96 -1.933 8.084 -8.727 1.00 0.00 C ATOM 0 H LEU B 96 -3.313 4.434 -7.535 1.00 0.00 H new ATOM 0 HA LEU B 96 -4.325 7.074 -7.978 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -3.105 4.961 -9.777 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -3.597 6.537 -10.362 1.00 0.00 H new ATOM 0 HG LEU B 96 -1.567 6.062 -8.157 1.00 0.00 H new ATOM 0 HD11 LEU B 96 0.106 6.773 -9.907 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -0.759 5.295 -10.392 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -1.211 6.864 -11.101 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -0.941 8.433 -8.441 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -2.276 8.640 -9.600 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -2.626 8.244 -7.901 1.00 0.00 H new ATOM 1454 N ASN B 97 -6.205 4.587 -9.040 1.00 0.00 N ATOM 1455 CA ASN B 97 -7.593 4.284 -9.394 1.00 0.00 C ATOM 1456 C ASN B 97 -8.622 4.836 -8.382 1.00 0.00 C ATOM 1457 O ASN B 97 -9.751 5.112 -8.785 1.00 0.00 O ATOM 1458 CB ASN B 97 -7.756 2.775 -9.609 1.00 0.00 C ATOM 1459 CG ASN B 97 -9.180 2.418 -10.029 1.00 0.00 C ATOM 1460 OD1 ASN B 97 -9.633 2.733 -11.123 1.00 0.00 O ATOM 1461 ND2 ASN B 97 -9.946 1.800 -9.151 1.00 0.00 N ATOM 0 H ASN B 97 -5.635 3.761 -8.857 1.00 0.00 H new ATOM 0 HA ASN B 97 -7.810 4.803 -10.328 1.00 0.00 H new ATOM 0 HB2 ASN B 97 -7.055 2.438 -10.373 1.00 0.00 H new ATOM 0 HB3 ASN B 97 -7.504 2.246 -8.690 1.00 0.00 H new ATOM 0 HD21 ASN B 97 -10.916 1.584 -9.383 1.00 0.00 H new ATOM 0 HD22 ASN B 97 -9.569 1.538 -8.240 1.00 0.00 H new ATOM 1468 N LYS B 98 -8.266 5.092 -7.109 1.00 0.00 N ATOM 1469 CA LYS B 98 -9.172 5.806 -6.190 1.00 0.00 C ATOM 1470 C LYS B 98 -9.462 7.244 -6.661 1.00 0.00 C ATOM 1471 O LYS B 98 -10.594 7.703 -6.500 1.00 0.00 O ATOM 1472 CB LYS B 98 -8.652 5.817 -4.741 1.00 0.00 C ATOM 1473 CG LYS B 98 -8.619 4.438 -4.064 1.00 0.00 C ATOM 1474 CD LYS B 98 -8.420 4.600 -2.550 1.00 0.00 C ATOM 1475 CE LYS B 98 -8.465 3.247 -1.835 1.00 0.00 C ATOM 1476 NZ LYS B 98 -8.395 3.394 -0.361 1.00 0.00 N ATOM 0 H LYS B 98 -7.373 4.820 -6.699 1.00 0.00 H new ATOM 0 HA LYS B 98 -10.108 5.247 -6.205 1.00 0.00 H new ATOM 0 HB2 LYS B 98 -7.646 6.236 -4.733 1.00 0.00 H new ATOM 0 HB3 LYS B 98 -9.279 6.483 -4.149 1.00 0.00 H new ATOM 0 HG2 LYS B 98 -9.549 3.904 -4.262 1.00 0.00 H new ATOM 0 HG3 LYS B 98 -7.812 3.837 -4.483 1.00 0.00 H new ATOM 0 HD2 LYS B 98 -7.463 5.084 -2.357 1.00 0.00 H new ATOM 0 HD3 LYS B 98 -9.194 5.253 -2.147 1.00 0.00 H new ATOM 0 HE2 LYS B 98 -9.384 2.725 -2.104 1.00 0.00 H new ATOM 0 HE3 LYS B 98 -7.635 2.628 -2.177 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 -8.807 2.553 0.092 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 -7.402 3.493 -0.069 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 -8.927 4.239 -0.071 1.00 0.00 H new ATOM 1490 N LEU B 99 -8.485 7.927 -7.280 1.00 0.00 N ATOM 1491 CA LEU B 99 -8.707 9.181 -8.017 1.00 0.00 C ATOM 1492 C LEU B 99 -9.451 8.919 -9.337 1.00 0.00 C ATOM 1493 O LEU B 99 -10.414 9.619 -9.660 1.00 0.00 O ATOM 1494 CB LEU B 99 -7.366 9.897 -8.292 1.00 0.00 C ATOM 1495 CG LEU B 99 -6.567 10.367 -7.059 1.00 0.00 C ATOM 1496 CD1 LEU B 99 -5.209 10.901 -7.540 1.00 0.00 C ATOM 1497 CD2 LEU B 99 -7.301 11.464 -6.274 1.00 0.00 C ATOM 0 H LEU B 99 -7.512 7.622 -7.283 1.00 0.00 H new ATOM 0 HA LEU B 99 -9.327 9.829 -7.397 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -6.734 9.224 -8.871 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -7.566 10.766 -8.919 1.00 0.00 H new ATOM 0 HG LEU B 99 -6.442 9.519 -6.386 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -4.627 11.239 -6.683 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -4.668 10.108 -8.056 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -5.367 11.736 -8.223 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -6.699 11.762 -5.416 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -7.464 12.327 -6.920 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -8.262 11.083 -5.929 1.00 0.00 H new ATOM 1509 N GLY B 100 -9.013 7.910 -10.098 1.00 0.00 N ATOM 1510 CA GLY B 100 -9.671 7.393 -11.305 1.00 0.00 C ATOM 1511 C GLY B 100 -9.326 8.173 -12.573 1.00 0.00 C ATOM 1512 O GLY B 100 -8.857 7.584 -13.553 1.00 0.00 O ATOM 0 H GLY B 100 -8.152 7.409 -9.880 1.00 0.00 H new ATOM 0 HA2 GLY B 100 -9.389 6.349 -11.443 1.00 0.00 H new ATOM 0 HA3 GLY B 100 -10.751 7.415 -11.158 1.00 0.00 H new ATOM 1516 N GLY B 101 -9.503 9.500 -12.546 1.00 0.00 N ATOM 1517 CA GLY B 101 -9.251 10.433 -13.657 1.00 0.00 C ATOM 1518 C GLY B 101 -7.769 10.712 -13.888 1.00 0.00 C ATOM 1519 O GLY B 101 -7.332 11.863 -13.845 1.00 0.00 O ATOM 0 H GLY B 101 -9.842 9.977 -11.711 1.00 0.00 H new ATOM 0 HA2 GLY B 101 -9.683 10.024 -14.570 1.00 0.00 H new ATOM 0 HA3 GLY B 101 -9.763 11.374 -13.455 1.00 0.00 H new ATOM 1523 N VAL B 102 -6.993 9.649 -14.082 1.00 0.00 N ATOM 1524 CA VAL B 102 -5.528 9.659 -14.140 1.00 0.00 C ATOM 1525 C VAL B 102 -5.053 8.687 -15.221 1.00 0.00 C ATOM 1526 O VAL B 102 -5.565 7.573 -15.346 1.00 0.00 O ATOM 1527 CB VAL B 102 -4.892 9.249 -12.787 1.00 0.00 C ATOM 1528 CG1 VAL B 102 -3.373 9.481 -12.760 1.00 0.00 C ATOM 1529 CG2 VAL B 102 -5.500 9.978 -11.573 1.00 0.00 C ATOM 0 H VAL B 102 -7.382 8.715 -14.209 1.00 0.00 H new ATOM 0 HA VAL B 102 -5.215 10.677 -14.371 1.00 0.00 H new ATOM 0 HB VAL B 102 -5.112 8.184 -12.706 1.00 0.00 H new ATOM 0 HG11 VAL B 102 -2.976 9.178 -11.791 1.00 0.00 H new ATOM 0 HG12 VAL B 102 -2.901 8.892 -13.546 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -3.163 10.538 -12.924 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -5.006 9.641 -10.662 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -5.359 11.053 -11.686 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -6.565 9.756 -11.512 1.00 0.00 H new ATOM 1539 N LYS B 103 -4.032 9.118 -15.954 1.00 0.00 N ATOM 1540 CA LYS B 103 -3.211 8.304 -16.852 1.00 0.00 C ATOM 1541 C LYS B 103 -1.809 8.122 -16.256 1.00 0.00 C ATOM 1542 O LYS B 103 -1.227 9.078 -15.741 1.00 0.00 O ATOM 1543 CB LYS B 103 -3.122 8.994 -18.223 1.00 0.00 C ATOM 1544 CG LYS B 103 -4.085 8.367 -19.241 1.00 0.00 C ATOM 1545 CD LYS B 103 -3.950 9.008 -20.627 1.00 0.00 C ATOM 1546 CE LYS B 103 -2.611 8.639 -21.278 1.00 0.00 C ATOM 1547 NZ LYS B 103 -2.456 9.294 -22.594 1.00 0.00 N ATOM 0 H LYS B 103 -3.737 10.094 -15.939 1.00 0.00 H new ATOM 0 HA LYS B 103 -3.667 7.321 -16.974 1.00 0.00 H new ATOM 0 HB2 LYS B 103 -3.350 10.054 -18.112 1.00 0.00 H new ATOM 0 HB3 LYS B 103 -2.101 8.926 -18.599 1.00 0.00 H new ATOM 0 HG2 LYS B 103 -3.889 7.297 -19.315 1.00 0.00 H new ATOM 0 HG3 LYS B 103 -5.110 8.479 -18.888 1.00 0.00 H new ATOM 0 HD2 LYS B 103 -4.771 8.679 -21.265 1.00 0.00 H new ATOM 0 HD3 LYS B 103 -4.029 10.092 -20.539 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -1.792 8.935 -20.623 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -2.548 7.557 -21.398 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -1.541 9.026 -23.010 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 -3.225 8.991 -23.225 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -2.492 10.326 -22.474 1.00 0.00 H new ATOM 1561 N TYR B 104 -1.259 6.907 -16.301 1.00 0.00 N ATOM 1562 CA TYR B 104 0.058 6.608 -15.725 1.00 0.00 C ATOM 1563 C TYR B 104 0.744 5.378 -16.338 1.00 0.00 C ATOM 1564 O TYR B 104 0.084 4.454 -16.816 1.00 0.00 O ATOM 1565 CB TYR B 104 -0.041 6.486 -14.194 1.00 0.00 C ATOM 1566 CG TYR B 104 -0.912 5.346 -13.705 1.00 0.00 C ATOM 1567 CD1 TYR B 104 -2.299 5.539 -13.557 1.00 0.00 C ATOM 1568 CD2 TYR B 104 -0.341 4.091 -13.412 1.00 0.00 C ATOM 1569 CE1 TYR B 104 -3.123 4.477 -13.147 1.00 0.00 C ATOM 1570 CE2 TYR B 104 -1.159 3.024 -12.998 1.00 0.00 C ATOM 1571 CZ TYR B 104 -2.555 3.211 -12.881 1.00 0.00 C ATOM 1572 OH TYR B 104 -3.350 2.169 -12.522 1.00 0.00 O ATOM 0 H TYR B 104 -1.711 6.103 -16.736 1.00 0.00 H new ATOM 0 HA TYR B 104 0.700 7.452 -15.979 1.00 0.00 H new ATOM 0 HB2 TYR B 104 0.962 6.359 -13.788 1.00 0.00 H new ATOM 0 HB3 TYR B 104 -0.431 7.421 -13.793 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -2.732 6.508 -13.760 1.00 0.00 H new ATOM 0 HD2 TYR B 104 0.725 3.948 -13.505 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -4.187 4.628 -13.036 1.00 0.00 H new ATOM 0 HE2 TYR B 104 -0.721 2.064 -12.770 1.00 0.00 H new ATOM 0 HH TYR B 104 -3.140 1.390 -13.079 1.00 0.00 H new ATOM 1582 N ASP B 105 2.080 5.350 -16.279 1.00 0.00 N ATOM 1583 CA ASP B 105 2.908 4.252 -16.787 1.00 0.00 C ATOM 1584 C ASP B 105 4.132 3.999 -15.882 1.00 0.00 C ATOM 1585 O ASP B 105 4.876 4.930 -15.556 1.00 0.00 O ATOM 1586 CB ASP B 105 3.312 4.572 -18.235 1.00 0.00 C ATOM 1587 CG ASP B 105 3.725 3.317 -18.999 1.00 0.00 C ATOM 1588 OD1 ASP B 105 4.894 2.887 -18.851 1.00 0.00 O ATOM 1589 OD2 ASP B 105 2.888 2.777 -19.757 1.00 0.00 O ATOM 0 H ASP B 105 2.627 6.107 -15.868 1.00 0.00 H new ATOM 0 HA ASP B 105 2.334 3.325 -16.776 1.00 0.00 H new ATOM 0 HB2 ASP B 105 2.478 5.051 -18.747 1.00 0.00 H new ATOM 0 HB3 ASP B 105 4.137 5.284 -18.233 1.00 0.00 H new ATOM 1594 N ILE B 106 4.327 2.743 -15.462 1.00 0.00 N ATOM 1595 CA ILE B 106 5.337 2.319 -14.465 1.00 0.00 C ATOM 1596 C ILE B 106 6.622 1.811 -15.145 1.00 0.00 C ATOM 1597 O ILE B 106 6.564 1.088 -16.145 1.00 0.00 O ATOM 1598 CB ILE B 106 4.726 1.235 -13.527 1.00 0.00 C ATOM 1599 CG1 ILE B 106 3.408 1.733 -12.876 1.00 0.00 C ATOM 1600 CG2 ILE B 106 5.724 0.802 -12.431 1.00 0.00 C ATOM 1601 CD1 ILE B 106 2.720 0.715 -11.956 1.00 0.00 C ATOM 0 H ILE B 106 3.772 1.963 -15.814 1.00 0.00 H new ATOM 0 HA ILE B 106 5.618 3.184 -13.865 1.00 0.00 H new ATOM 0 HB ILE B 106 4.503 0.368 -14.148 1.00 0.00 H new ATOM 0 HG12 ILE B 106 3.621 2.635 -12.302 1.00 0.00 H new ATOM 0 HG13 ILE B 106 2.713 2.015 -13.667 1.00 0.00 H new ATOM 0 HG21 ILE B 106 5.262 0.045 -11.797 1.00 0.00 H new ATOM 0 HG22 ILE B 106 6.619 0.389 -12.896 1.00 0.00 H new ATOM 0 HG23 ILE B 106 5.997 1.666 -11.825 1.00 0.00 H new ATOM 0 HD11 ILE B 106 1.809 1.151 -11.548 1.00 0.00 H new ATOM 0 HD12 ILE B 106 2.470 -0.180 -12.526 1.00 0.00 H new ATOM 0 HD13 ILE B 106 3.392 0.449 -11.140 1.00 0.00 H new ATOM 1613 N ASP B 107 7.793 2.147 -14.601 1.00 0.00 N ATOM 1614 CA ASP B 107 9.089 1.542 -14.952 1.00 0.00 C ATOM 1615 C ASP B 107 9.731 0.920 -13.699 1.00 0.00 C ATOM 1616 O ASP B 107 10.304 1.625 -12.863 1.00 0.00 O ATOM 1617 CB ASP B 107 10.006 2.592 -15.603 1.00 0.00 C ATOM 1618 CG ASP B 107 11.105 1.941 -16.449 1.00 0.00 C ATOM 1619 OD1 ASP B 107 12.084 1.417 -15.875 1.00 0.00 O ATOM 1620 OD2 ASP B 107 10.961 1.955 -17.699 1.00 0.00 O ATOM 0 H ASP B 107 7.873 2.867 -13.883 1.00 0.00 H new ATOM 0 HA ASP B 107 8.935 0.745 -15.680 1.00 0.00 H new ATOM 0 HB2 ASP B 107 9.411 3.256 -16.229 1.00 0.00 H new ATOM 0 HB3 ASP B 107 10.461 3.208 -14.827 1.00 0.00 H new ATOM 1625 N LEU B 108 9.596 -0.403 -13.548 1.00 0.00 N ATOM 1626 CA LEU B 108 10.029 -1.129 -12.348 1.00 0.00 C ATOM 1627 C LEU B 108 11.557 -1.089 -12.096 1.00 0.00 C ATOM 1628 O LEU B 108 11.921 -0.929 -10.926 1.00 0.00 O ATOM 1629 CB LEU B 108 9.428 -2.554 -12.382 1.00 0.00 C ATOM 1630 CG LEU B 108 9.661 -3.402 -11.111 1.00 0.00 C ATOM 1631 CD1 LEU B 108 9.048 -2.756 -9.860 1.00 0.00 C ATOM 1632 CD2 LEU B 108 9.050 -4.796 -11.309 1.00 0.00 C ATOM 0 H LEU B 108 9.180 -1.004 -14.260 1.00 0.00 H new ATOM 0 HA LEU B 108 9.637 -0.611 -11.473 1.00 0.00 H new ATOM 0 HB2 LEU B 108 8.354 -2.473 -12.553 1.00 0.00 H new ATOM 0 HB3 LEU B 108 9.847 -3.087 -13.236 1.00 0.00 H new ATOM 0 HG LEU B 108 10.738 -3.471 -10.956 1.00 0.00 H new ATOM 0 HD11 LEU B 108 9.238 -3.389 -8.993 1.00 0.00 H new ATOM 0 HD12 LEU B 108 9.497 -1.776 -9.699 1.00 0.00 H new ATOM 0 HD13 LEU B 108 7.973 -2.644 -9.998 1.00 0.00 H new ATOM 0 HD21 LEU B 108 9.213 -5.395 -10.413 1.00 0.00 H new ATOM 0 HD22 LEU B 108 7.980 -4.701 -11.492 1.00 0.00 H new ATOM 0 HD23 LEU B 108 9.522 -5.282 -12.162 1.00 0.00 H new ATOM 1644 N PRO B 109 12.448 -1.173 -13.113 1.00 0.00 N ATOM 1645 CA PRO B 109 13.885 -0.948 -12.934 1.00 0.00 C ATOM 1646 C PRO B 109 14.229 0.488 -12.515 1.00 0.00 C ATOM 1647 O PRO B 109 14.966 0.672 -11.548 1.00 0.00 O ATOM 1648 CB PRO B 109 14.547 -1.302 -14.273 1.00 0.00 C ATOM 1649 CG PRO B 109 13.545 -2.238 -14.938 1.00 0.00 C ATOM 1650 CD PRO B 109 12.202 -1.700 -14.450 1.00 0.00 C ATOM 0 HA PRO B 109 14.253 -1.571 -12.119 1.00 0.00 H new ATOM 0 HB2 PRO B 109 14.726 -0.413 -14.878 1.00 0.00 H new ATOM 0 HB3 PRO B 109 15.512 -1.788 -14.126 1.00 0.00 H new ATOM 0 HG2 PRO B 109 13.622 -2.207 -16.025 1.00 0.00 H new ATOM 0 HG3 PRO B 109 13.699 -3.274 -14.637 1.00 0.00 H new ATOM 0 HD2 PRO B 109 11.828 -0.921 -15.115 1.00 0.00 H new ATOM 0 HD3 PRO B 109 11.450 -2.488 -14.427 1.00 0.00 H new ATOM 1658 N ASN B 110 13.705 1.507 -13.213 1.00 0.00 N ATOM 1659 CA ASN B 110 14.041 2.919 -12.953 1.00 0.00 C ATOM 1660 C ASN B 110 13.389 3.480 -11.669 1.00 0.00 C ATOM 1661 O ASN B 110 13.807 4.523 -11.161 1.00 0.00 O ATOM 1662 CB ASN B 110 13.629 3.739 -14.185 1.00 0.00 C ATOM 1663 CG ASN B 110 14.212 5.146 -14.195 1.00 0.00 C ATOM 1664 OD1 ASN B 110 13.563 6.106 -13.804 1.00 0.00 O ATOM 1665 ND2 ASN B 110 15.435 5.321 -14.657 1.00 0.00 N ATOM 0 H ASN B 110 13.037 1.378 -13.973 1.00 0.00 H new ATOM 0 HA ASN B 110 15.115 2.990 -12.780 1.00 0.00 H new ATOM 0 HB2 ASN B 110 13.949 3.214 -15.085 1.00 0.00 H new ATOM 0 HB3 ASN B 110 12.542 3.804 -14.223 1.00 0.00 H new ATOM 0 HD21 ASN B 110 15.839 6.257 -14.688 1.00 0.00 H new ATOM 0 HD22 ASN B 110 15.976 4.520 -14.983 1.00 0.00 H new ATOM 1672 N LYS B 111 12.346 2.802 -11.165 1.00 0.00 N ATOM 1673 CA LYS B 111 11.579 3.093 -9.937 1.00 0.00 C ATOM 1674 C LYS B 111 10.576 4.251 -10.138 1.00 0.00 C ATOM 1675 O LYS B 111 10.108 4.884 -9.184 1.00 0.00 O ATOM 1676 CB LYS B 111 12.507 3.252 -8.700 1.00 0.00 C ATOM 1677 CG LYS B 111 13.605 2.193 -8.518 1.00 0.00 C ATOM 1678 CD LYS B 111 12.967 0.842 -8.248 1.00 0.00 C ATOM 1679 CE LYS B 111 13.966 -0.306 -8.377 1.00 0.00 C ATOM 1680 NZ LYS B 111 13.258 -1.600 -8.482 1.00 0.00 N ATOM 0 H LYS B 111 11.987 1.973 -11.639 1.00 0.00 H new ATOM 0 HA LYS B 111 10.959 2.224 -9.717 1.00 0.00 H new ATOM 0 HB2 LYS B 111 12.984 4.230 -8.757 1.00 0.00 H new ATOM 0 HB3 LYS B 111 11.884 3.253 -7.806 1.00 0.00 H new ATOM 0 HG2 LYS B 111 14.227 2.141 -9.412 1.00 0.00 H new ATOM 0 HG3 LYS B 111 14.259 2.470 -7.691 1.00 0.00 H new ATOM 0 HD2 LYS B 111 12.540 0.838 -7.245 1.00 0.00 H new ATOM 0 HD3 LYS B 111 12.144 0.685 -8.946 1.00 0.00 H new ATOM 0 HE2 LYS B 111 14.591 -0.155 -9.257 1.00 0.00 H new ATOM 0 HE3 LYS B 111 14.630 -0.317 -7.512 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 13.952 -2.375 -8.501 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 12.628 -1.719 -7.663 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 12.695 -1.618 -9.356 1.00 0.00 H new ATOM 1694 N LYS B 112 10.244 4.533 -11.403 1.00 0.00 N ATOM 1695 CA LYS B 112 9.446 5.660 -11.867 1.00 0.00 C ATOM 1696 C LYS B 112 7.961 5.297 -12.049 1.00 0.00 C ATOM 1697 O LYS B 112 7.637 4.225 -12.560 1.00 0.00 O ATOM 1698 CB LYS B 112 10.073 6.108 -13.198 1.00 0.00 C ATOM 1699 CG LYS B 112 9.366 7.316 -13.818 1.00 0.00 C ATOM 1700 CD LYS B 112 9.892 7.676 -15.207 1.00 0.00 C ATOM 1701 CE LYS B 112 11.377 8.040 -15.210 1.00 0.00 C ATOM 1702 NZ LYS B 112 11.792 8.523 -16.542 1.00 0.00 N ATOM 0 H LYS B 112 10.548 3.939 -12.174 1.00 0.00 H new ATOM 0 HA LYS B 112 9.456 6.460 -11.126 1.00 0.00 H new ATOM 0 HB2 LYS B 112 11.122 6.353 -13.034 1.00 0.00 H new ATOM 0 HB3 LYS B 112 10.046 5.277 -13.903 1.00 0.00 H new ATOM 0 HG2 LYS B 112 8.298 7.109 -13.884 1.00 0.00 H new ATOM 0 HG3 LYS B 112 9.484 8.176 -13.158 1.00 0.00 H new ATOM 0 HD2 LYS B 112 9.729 6.834 -15.880 1.00 0.00 H new ATOM 0 HD3 LYS B 112 9.318 8.515 -15.600 1.00 0.00 H new ATOM 0 HE2 LYS B 112 11.570 8.809 -14.462 1.00 0.00 H new ATOM 0 HE3 LYS B 112 11.971 7.169 -14.932 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 12.817 8.701 -16.543 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 11.564 7.804 -17.258 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 11.288 9.405 -16.764 1.00 0.00 H new ATOM 1716 N VAL B 113 7.070 6.237 -11.736 1.00 0.00 N ATOM 1717 CA VAL B 113 5.715 6.310 -12.302 1.00 0.00 C ATOM 1718 C VAL B 113 5.604 7.652 -13.031 1.00 0.00 C ATOM 1719 O VAL B 113 5.832 8.697 -12.424 1.00 0.00 O ATOM 1720 CB VAL B 113 4.609 6.186 -11.226 1.00 0.00 C ATOM 1721 CG1 VAL B 113 3.231 6.050 -11.897 1.00 0.00 C ATOM 1722 CG2 VAL B 113 4.827 4.979 -10.297 1.00 0.00 C ATOM 0 H VAL B 113 7.269 6.984 -11.071 1.00 0.00 H new ATOM 0 HA VAL B 113 5.564 5.471 -12.981 1.00 0.00 H new ATOM 0 HB VAL B 113 4.654 7.093 -10.623 1.00 0.00 H new ATOM 0 HG11 VAL B 113 2.460 5.963 -11.131 1.00 0.00 H new ATOM 0 HG12 VAL B 113 3.036 6.930 -12.510 1.00 0.00 H new ATOM 0 HG13 VAL B 113 3.219 5.160 -12.526 1.00 0.00 H new ATOM 0 HG21 VAL B 113 4.024 4.937 -9.561 1.00 0.00 H new ATOM 0 HG22 VAL B 113 4.827 4.062 -10.886 1.00 0.00 H new ATOM 0 HG23 VAL B 113 5.784 5.082 -9.785 1.00 0.00 H new ATOM 1732 N CYS B 114 5.302 7.630 -14.333 1.00 0.00 N ATOM 1733 CA CYS B 114 5.113 8.838 -15.144 1.00 0.00 C ATOM 1734 C CYS B 114 3.617 9.069 -15.381 1.00 0.00 C ATOM 1735 O CYS B 114 2.943 8.209 -15.949 1.00 0.00 O ATOM 1736 CB CYS B 114 5.900 8.683 -16.450 1.00 0.00 C ATOM 1737 SG CYS B 114 5.958 10.282 -17.302 1.00 0.00 S ATOM 0 H CYS B 114 5.181 6.765 -14.859 1.00 0.00 H new ATOM 0 HA CYS B 114 5.493 9.719 -14.627 1.00 0.00 H new ATOM 0 HB2 CYS B 114 6.910 8.332 -16.241 1.00 0.00 H new ATOM 0 HB3 CYS B 114 5.428 7.935 -17.087 1.00 0.00 H new ATOM 0 HG CYS B 114 5.656 11.230 -16.466 1.00 0.00 H new ATOM 1743 N ILE B 115 3.085 10.213 -14.954 1.00 0.00 N ATOM 1744 CA ILE B 115 1.639 10.467 -14.794 1.00 0.00 C ATOM 1745 C ILE B 115 1.204 11.668 -15.630 1.00 0.00 C ATOM 1746 O ILE B 115 1.962 12.632 -15.738 1.00 0.00 O ATOM 1747 CB ILE B 115 1.307 10.712 -13.293 1.00 0.00 C ATOM 1748 CG1 ILE B 115 1.777 9.519 -12.421 1.00 0.00 C ATOM 1749 CG2 ILE B 115 -0.199 10.988 -13.098 1.00 0.00 C ATOM 1750 CD1 ILE B 115 1.466 9.617 -10.921 1.00 0.00 C ATOM 0 H ILE B 115 3.658 11.018 -14.700 1.00 0.00 H new ATOM 0 HA ILE B 115 1.093 9.591 -15.144 1.00 0.00 H new ATOM 0 HB ILE B 115 1.851 11.598 -12.967 1.00 0.00 H new ATOM 0 HG12 ILE B 115 1.318 8.609 -12.808 1.00 0.00 H new ATOM 0 HG13 ILE B 115 2.855 9.409 -12.542 1.00 0.00 H new ATOM 0 HG21 ILE B 115 -0.404 11.156 -12.041 1.00 0.00 H new ATOM 0 HG22 ILE B 115 -0.484 11.873 -13.668 1.00 0.00 H new ATOM 0 HG23 ILE B 115 -0.774 10.131 -13.448 1.00 0.00 H new ATOM 0 HD11 ILE B 115 1.841 8.728 -10.413 1.00 0.00 H new ATOM 0 HD12 ILE B 115 1.948 10.502 -10.507 1.00 0.00 H new ATOM 0 HD13 ILE B 115 0.388 9.690 -10.777 1.00 0.00 H new ATOM 1762 N GLU B 116 -0.025 11.650 -16.149 1.00 0.00 N ATOM 1763 CA GLU B 116 -0.725 12.846 -16.592 1.00 0.00 C ATOM 1764 C GLU B 116 -2.206 12.874 -16.175 1.00 0.00 C ATOM 1765 O GLU B 116 -3.010 12.006 -16.507 1.00 0.00 O ATOM 1766 CB GLU B 116 -0.468 13.176 -18.072 1.00 0.00 C ATOM 1767 CG GLU B 116 -1.136 12.348 -19.175 1.00 0.00 C ATOM 1768 CD GLU B 116 -0.453 11.016 -19.496 1.00 0.00 C ATOM 1769 OE1 GLU B 116 -0.030 10.264 -18.600 1.00 0.00 O ATOM 1770 OE2 GLU B 116 -0.302 10.711 -20.697 1.00 0.00 O ATOM 0 H GLU B 116 -0.564 10.793 -16.273 1.00 0.00 H new ATOM 0 HA GLU B 116 -0.281 13.678 -16.046 1.00 0.00 H new ATOM 0 HB2 GLU B 116 -0.760 14.215 -18.227 1.00 0.00 H new ATOM 0 HB3 GLU B 116 0.609 13.120 -18.233 1.00 0.00 H new ATOM 0 HG2 GLU B 116 -2.167 12.148 -18.883 1.00 0.00 H new ATOM 0 HG3 GLU B 116 -1.173 12.947 -20.085 1.00 0.00 H new ATOM 1777 N SER B 117 -2.578 13.910 -15.428 1.00 0.00 N ATOM 1778 CA SER B 117 -3.949 14.175 -14.968 1.00 0.00 C ATOM 1779 C SER B 117 -4.206 15.682 -14.793 1.00 0.00 C ATOM 1780 O SER B 117 -3.269 16.449 -14.540 1.00 0.00 O ATOM 1781 CB SER B 117 -4.171 13.454 -13.630 1.00 0.00 C ATOM 1782 OG SER B 117 -5.451 13.714 -13.081 1.00 0.00 O ATOM 0 H SER B 117 -1.914 14.616 -15.112 1.00 0.00 H new ATOM 0 HA SER B 117 -4.645 13.805 -15.721 1.00 0.00 H new ATOM 0 HB2 SER B 117 -4.052 12.380 -13.775 1.00 0.00 H new ATOM 0 HB3 SER B 117 -3.404 13.766 -12.921 1.00 0.00 H new ATOM 0 HG SER B 117 -6.082 13.029 -13.384 1.00 0.00 H new ATOM 1788 N GLU B 118 -5.474 16.104 -14.871 1.00 0.00 N ATOM 1789 CA GLU B 118 -5.936 17.458 -14.533 1.00 0.00 C ATOM 1790 C GLU B 118 -6.034 17.719 -13.018 1.00 0.00 C ATOM 1791 O GLU B 118 -6.185 18.870 -12.601 1.00 0.00 O ATOM 1792 CB GLU B 118 -7.279 17.753 -15.222 1.00 0.00 C ATOM 1793 CG GLU B 118 -7.119 17.929 -16.736 1.00 0.00 C ATOM 1794 CD GLU B 118 -8.439 18.344 -17.375 1.00 0.00 C ATOM 1795 OE1 GLU B 118 -8.900 19.486 -17.141 1.00 0.00 O ATOM 1796 OE2 GLU B 118 -9.033 17.543 -18.132 1.00 0.00 O ATOM 0 H GLU B 118 -6.231 15.495 -15.181 1.00 0.00 H new ATOM 0 HA GLU B 118 -5.175 18.143 -14.907 1.00 0.00 H new ATOM 0 HB2 GLU B 118 -7.976 16.939 -15.023 1.00 0.00 H new ATOM 0 HB3 GLU B 118 -7.715 18.657 -14.796 1.00 0.00 H new ATOM 0 HG2 GLU B 118 -6.358 18.682 -16.941 1.00 0.00 H new ATOM 0 HG3 GLU B 118 -6.772 16.996 -17.180 1.00 0.00 H new ATOM 1803 N HIS B 119 -5.887 16.685 -12.190 1.00 0.00 N ATOM 1804 CA HIS B 119 -5.650 16.819 -10.748 1.00 0.00 C ATOM 1805 C HIS B 119 -4.232 17.380 -10.461 1.00 0.00 C ATOM 1806 O HIS B 119 -3.332 17.304 -11.302 1.00 0.00 O ATOM 1807 CB HIS B 119 -5.892 15.459 -10.059 1.00 0.00 C ATOM 1808 CG HIS B 119 -7.316 14.950 -10.173 1.00 0.00 C ATOM 1809 ND1 HIS B 119 -8.435 15.554 -9.651 1.00 0.00 N ATOM 1810 CD2 HIS B 119 -7.746 13.804 -10.791 1.00 0.00 C ATOM 1811 CE1 HIS B 119 -9.510 14.816 -9.965 1.00 0.00 C ATOM 1812 NE2 HIS B 119 -9.143 13.732 -10.673 1.00 0.00 N ATOM 0 H HIS B 119 -5.929 15.716 -12.504 1.00 0.00 H new ATOM 0 HA HIS B 119 -6.354 17.541 -10.333 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -5.218 14.720 -10.492 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -5.633 15.547 -9.004 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -7.116 13.079 -11.285 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -10.526 15.057 -9.689 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -9.755 13.007 -11.047 1.00 0.00 H new ATOM 1820 N SER B 120 -4.003 17.971 -9.287 1.00 0.00 N ATOM 1821 CA SER B 120 -2.712 18.585 -8.933 1.00 0.00 C ATOM 1822 C SER B 120 -1.601 17.562 -8.615 1.00 0.00 C ATOM 1823 O SER B 120 -1.862 16.460 -8.122 1.00 0.00 O ATOM 1824 CB SER B 120 -2.899 19.562 -7.755 1.00 0.00 C ATOM 1825 OG SER B 120 -3.175 18.880 -6.539 1.00 0.00 O ATOM 0 H SER B 120 -4.705 18.040 -8.551 1.00 0.00 H new ATOM 0 HA SER B 120 -2.375 19.126 -9.817 1.00 0.00 H new ATOM 0 HB2 SER B 120 -1.998 20.165 -7.637 1.00 0.00 H new ATOM 0 HB3 SER B 120 -3.715 20.249 -7.979 1.00 0.00 H new ATOM 0 HG SER B 120 -3.286 19.532 -5.816 1.00 0.00 H new ATOM 1831 N MET B 121 -0.335 17.957 -8.817 1.00 0.00 N ATOM 1832 CA MET B 121 0.852 17.190 -8.415 1.00 0.00 C ATOM 1833 C MET B 121 0.808 16.806 -6.932 1.00 0.00 C ATOM 1834 O MET B 121 1.144 15.683 -6.572 1.00 0.00 O ATOM 1835 CB MET B 121 2.085 18.043 -8.765 1.00 0.00 C ATOM 1836 CG MET B 121 3.434 17.426 -8.382 1.00 0.00 C ATOM 1837 SD MET B 121 3.954 17.593 -6.648 1.00 0.00 S ATOM 1838 CE MET B 121 4.422 19.343 -6.630 1.00 0.00 C ATOM 0 H MET B 121 -0.104 18.839 -9.275 1.00 0.00 H new ATOM 0 HA MET B 121 0.893 16.242 -8.951 1.00 0.00 H new ATOM 0 HB2 MET B 121 2.082 18.234 -9.838 1.00 0.00 H new ATOM 0 HB3 MET B 121 1.991 19.009 -8.269 1.00 0.00 H new ATOM 0 HG2 MET B 121 3.402 16.364 -8.626 1.00 0.00 H new ATOM 0 HG3 MET B 121 4.203 17.875 -9.011 1.00 0.00 H new ATOM 0 HE1 MET B 121 5.382 19.458 -6.126 1.00 0.00 H new ATOM 0 HE2 MET B 121 4.504 19.708 -7.654 1.00 0.00 H new ATOM 0 HE3 MET B 121 3.663 19.917 -6.099 1.00 0.00 H new ATOM 1848 N ASP B 122 0.320 17.707 -6.077 1.00 0.00 N ATOM 1849 CA ASP B 122 0.179 17.484 -4.639 1.00 0.00 C ATOM 1850 C ASP B 122 -0.913 16.452 -4.286 1.00 0.00 C ATOM 1851 O ASP B 122 -0.786 15.763 -3.269 1.00 0.00 O ATOM 1852 CB ASP B 122 -0.086 18.846 -3.983 1.00 0.00 C ATOM 1853 CG ASP B 122 -0.062 18.757 -2.460 1.00 0.00 C ATOM 1854 OD1 ASP B 122 1.045 18.579 -1.899 1.00 0.00 O ATOM 1855 OD2 ASP B 122 -1.155 18.839 -1.855 1.00 0.00 O ATOM 0 H ASP B 122 0.006 18.631 -6.373 1.00 0.00 H new ATOM 0 HA ASP B 122 1.101 17.047 -4.254 1.00 0.00 H new ATOM 0 HB2 ASP B 122 0.665 19.562 -4.317 1.00 0.00 H new ATOM 0 HB3 ASP B 122 -1.055 19.224 -4.310 1.00 0.00 H new ATOM 1860 N THR B 123 -1.956 16.311 -5.119 1.00 0.00 N ATOM 1861 CA THR B 123 -2.986 15.259 -4.995 1.00 0.00 C ATOM 1862 C THR B 123 -2.395 13.901 -5.355 1.00 0.00 C ATOM 1863 O THR B 123 -2.566 12.934 -4.610 1.00 0.00 O ATOM 1864 CB THR B 123 -4.200 15.567 -5.885 1.00 0.00 C ATOM 1865 OG1 THR B 123 -4.714 16.826 -5.538 1.00 0.00 O ATOM 1866 CG2 THR B 123 -5.335 14.563 -5.688 1.00 0.00 C ATOM 0 H THR B 123 -2.113 16.933 -5.912 1.00 0.00 H new ATOM 0 HA THR B 123 -3.325 15.234 -3.959 1.00 0.00 H new ATOM 0 HB THR B 123 -3.855 15.524 -6.918 1.00 0.00 H new ATOM 0 HG1 THR B 123 -4.167 17.527 -5.950 1.00 0.00 H new ATOM 0 HG21 THR B 123 -6.169 14.824 -6.339 1.00 0.00 H new ATOM 0 HG22 THR B 123 -4.982 13.562 -5.935 1.00 0.00 H new ATOM 0 HG23 THR B 123 -5.665 14.586 -4.649 1.00 0.00 H new ATOM 1874 N LEU B 124 -1.659 13.840 -6.469 1.00 0.00 N ATOM 1875 CA LEU B 124 -0.960 12.637 -6.933 1.00 0.00 C ATOM 1876 C LEU B 124 0.086 12.171 -5.911 1.00 0.00 C ATOM 1877 O LEU B 124 0.081 11.004 -5.524 1.00 0.00 O ATOM 1878 CB LEU B 124 -0.315 12.927 -8.304 1.00 0.00 C ATOM 1879 CG LEU B 124 -1.309 13.230 -9.446 1.00 0.00 C ATOM 1880 CD1 LEU B 124 -0.527 13.714 -10.675 1.00 0.00 C ATOM 1881 CD2 LEU B 124 -2.162 12.000 -9.797 1.00 0.00 C ATOM 0 H LEU B 124 -1.530 14.642 -7.086 1.00 0.00 H new ATOM 0 HA LEU B 124 -1.678 11.824 -7.041 1.00 0.00 H new ATOM 0 HB2 LEU B 124 0.361 13.775 -8.198 1.00 0.00 H new ATOM 0 HB3 LEU B 124 0.293 12.069 -8.591 1.00 0.00 H new ATOM 0 HG LEU B 124 -1.994 14.010 -9.115 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -1.222 13.930 -11.486 1.00 0.00 H new ATOM 0 HD12 LEU B 124 0.027 14.618 -10.421 1.00 0.00 H new ATOM 0 HD13 LEU B 124 0.170 12.938 -10.991 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -2.849 12.252 -10.605 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -1.512 11.185 -10.115 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -2.731 11.689 -8.920 1.00 0.00 H new ATOM 1893 N LEU B 125 0.935 13.083 -5.425 1.00 0.00 N ATOM 1894 CA LEU B 125 1.982 12.809 -4.438 1.00 0.00 C ATOM 1895 C LEU B 125 1.402 12.262 -3.125 1.00 0.00 C ATOM 1896 O LEU B 125 1.873 11.238 -2.633 1.00 0.00 O ATOM 1897 CB LEU B 125 2.792 14.108 -4.237 1.00 0.00 C ATOM 1898 CG LEU B 125 4.014 13.992 -3.305 1.00 0.00 C ATOM 1899 CD1 LEU B 125 5.037 12.969 -3.824 1.00 0.00 C ATOM 1900 CD2 LEU B 125 4.685 15.366 -3.170 1.00 0.00 C ATOM 0 H LEU B 125 0.911 14.060 -5.717 1.00 0.00 H new ATOM 0 HA LEU B 125 2.645 12.024 -4.801 1.00 0.00 H new ATOM 0 HB2 LEU B 125 3.133 14.457 -5.212 1.00 0.00 H new ATOM 0 HB3 LEU B 125 2.125 14.873 -3.839 1.00 0.00 H new ATOM 0 HG LEU B 125 3.662 13.645 -2.333 1.00 0.00 H new ATOM 0 HD11 LEU B 125 5.882 12.919 -3.137 1.00 0.00 H new ATOM 0 HD12 LEU B 125 4.567 11.988 -3.894 1.00 0.00 H new ATOM 0 HD13 LEU B 125 5.388 13.274 -4.810 1.00 0.00 H new ATOM 0 HD21 LEU B 125 5.550 15.286 -2.511 1.00 0.00 H new ATOM 0 HD22 LEU B 125 5.008 15.711 -4.152 1.00 0.00 H new ATOM 0 HD23 LEU B 125 3.974 16.078 -2.751 1.00 0.00 H new ATOM 1912 N ALA B 126 0.343 12.884 -2.594 1.00 0.00 N ATOM 1913 CA ALA B 126 -0.338 12.417 -1.382 1.00 0.00 C ATOM 1914 C ALA B 126 -0.963 11.023 -1.555 1.00 0.00 C ATOM 1915 O ALA B 126 -0.905 10.210 -0.627 1.00 0.00 O ATOM 1916 CB ALA B 126 -1.405 13.447 -0.991 1.00 0.00 C ATOM 0 H ALA B 126 -0.067 13.728 -2.994 1.00 0.00 H new ATOM 0 HA ALA B 126 0.402 12.320 -0.588 1.00 0.00 H new ATOM 0 HB1 ALA B 126 -1.920 13.113 -0.090 1.00 0.00 H new ATOM 0 HB2 ALA B 126 -0.930 14.409 -0.801 1.00 0.00 H new ATOM 0 HB3 ALA B 126 -2.125 13.552 -1.803 1.00 0.00 H new ATOM 1922 N THR B 127 -1.527 10.751 -2.743 1.00 0.00 N ATOM 1923 CA THR B 127 -2.138 9.467 -3.121 1.00 0.00 C ATOM 1924 C THR B 127 -1.089 8.362 -3.196 1.00 0.00 C ATOM 1925 O THR B 127 -1.293 7.307 -2.605 1.00 0.00 O ATOM 1926 CB THR B 127 -2.907 9.618 -4.440 1.00 0.00 C ATOM 1927 OG1 THR B 127 -3.943 10.553 -4.242 1.00 0.00 O ATOM 1928 CG2 THR B 127 -3.551 8.313 -4.900 1.00 0.00 C ATOM 0 H THR B 127 -1.571 11.442 -3.492 1.00 0.00 H new ATOM 0 HA THR B 127 -2.850 9.175 -2.349 1.00 0.00 H new ATOM 0 HB THR B 127 -2.193 9.934 -5.201 1.00 0.00 H new ATOM 0 HG1 THR B 127 -3.588 11.461 -4.343 1.00 0.00 H new ATOM 0 HG21 THR B 127 -4.081 8.480 -5.838 1.00 0.00 H new ATOM 0 HG22 THR B 127 -2.778 7.559 -5.049 1.00 0.00 H new ATOM 0 HG23 THR B 127 -4.254 7.967 -4.142 1.00 0.00 H new ATOM 1936 N LEU B 128 0.055 8.601 -3.846 1.00 0.00 N ATOM 1937 CA LEU B 128 1.175 7.649 -3.882 1.00 0.00 C ATOM 1938 C LEU B 128 1.707 7.345 -2.472 1.00 0.00 C ATOM 1939 O LEU B 128 1.973 6.187 -2.144 1.00 0.00 O ATOM 1940 CB LEU B 128 2.294 8.216 -4.779 1.00 0.00 C ATOM 1941 CG LEU B 128 1.967 8.271 -6.287 1.00 0.00 C ATOM 1942 CD1 LEU B 128 3.060 9.070 -7.014 1.00 0.00 C ATOM 1943 CD2 LEU B 128 1.860 6.867 -6.904 1.00 0.00 C ATOM 0 H LEU B 128 0.233 9.462 -4.364 1.00 0.00 H new ATOM 0 HA LEU B 128 0.818 6.707 -4.297 1.00 0.00 H new ATOM 0 HB2 LEU B 128 2.534 9.223 -4.439 1.00 0.00 H new ATOM 0 HB3 LEU B 128 3.190 7.611 -4.640 1.00 0.00 H new ATOM 0 HG LEU B 128 0.999 8.758 -6.403 1.00 0.00 H new ATOM 0 HD11 LEU B 128 2.833 9.111 -8.079 1.00 0.00 H new ATOM 0 HD12 LEU B 128 3.099 10.082 -6.612 1.00 0.00 H new ATOM 0 HD13 LEU B 128 4.025 8.584 -6.867 1.00 0.00 H new ATOM 0 HD21 LEU B 128 1.629 6.953 -7.966 1.00 0.00 H new ATOM 0 HD22 LEU B 128 2.807 6.342 -6.780 1.00 0.00 H new ATOM 0 HD23 LEU B 128 1.068 6.309 -6.404 1.00 0.00 H new ATOM 1955 N LYS B 129 1.814 8.358 -1.607 1.00 0.00 N ATOM 1956 CA LYS B 129 2.310 8.217 -0.228 1.00 0.00 C ATOM 1957 C LYS B 129 1.356 7.441 0.708 1.00 0.00 C ATOM 1958 O LYS B 129 1.782 7.006 1.782 1.00 0.00 O ATOM 1959 CB LYS B 129 2.719 9.608 0.301 1.00 0.00 C ATOM 1960 CG LYS B 129 4.014 10.068 -0.397 1.00 0.00 C ATOM 1961 CD LYS B 129 4.312 11.566 -0.289 1.00 0.00 C ATOM 1962 CE LYS B 129 4.777 12.025 1.096 1.00 0.00 C ATOM 1963 NZ LYS B 129 5.041 13.484 1.086 1.00 0.00 N ATOM 0 H LYS B 129 1.555 9.315 -1.846 1.00 0.00 H new ATOM 0 HA LYS B 129 3.195 7.581 -0.243 1.00 0.00 H new ATOM 0 HB2 LYS B 129 1.920 10.327 0.118 1.00 0.00 H new ATOM 0 HB3 LYS B 129 2.870 9.568 1.380 1.00 0.00 H new ATOM 0 HG2 LYS B 129 4.853 9.515 0.026 1.00 0.00 H new ATOM 0 HG3 LYS B 129 3.955 9.800 -1.452 1.00 0.00 H new ATOM 0 HD2 LYS B 129 5.079 11.824 -1.019 1.00 0.00 H new ATOM 0 HD3 LYS B 129 3.414 12.122 -0.559 1.00 0.00 H new ATOM 0 HE2 LYS B 129 4.016 11.790 1.840 1.00 0.00 H new ATOM 0 HE3 LYS B 129 5.680 11.486 1.382 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 5.356 13.786 2.030 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 5.782 13.698 0.389 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 4.170 13.993 0.832 1.00 0.00 H new ATOM 1977 N LYS B 130 0.123 7.117 0.286 1.00 0.00 N ATOM 1978 CA LYS B 130 -0.710 6.097 0.958 1.00 0.00 C ATOM 1979 C LYS B 130 -0.036 4.709 0.962 1.00 0.00 C ATOM 1980 O LYS B 130 -0.131 3.996 1.958 1.00 0.00 O ATOM 1981 CB LYS B 130 -2.115 6.035 0.325 1.00 0.00 C ATOM 1982 CG LYS B 130 -2.918 7.317 0.597 1.00 0.00 C ATOM 1983 CD LYS B 130 -4.270 7.357 -0.126 1.00 0.00 C ATOM 1984 CE LYS B 130 -5.029 8.605 0.346 1.00 0.00 C ATOM 1985 NZ LYS B 130 -6.362 8.739 -0.281 1.00 0.00 N ATOM 0 H LYS B 130 -0.325 7.548 -0.523 1.00 0.00 H new ATOM 0 HA LYS B 130 -0.818 6.399 2.000 1.00 0.00 H new ATOM 0 HB2 LYS B 130 -2.023 5.884 -0.751 1.00 0.00 H new ATOM 0 HB3 LYS B 130 -2.656 5.176 0.722 1.00 0.00 H new ATOM 0 HG2 LYS B 130 -3.086 7.410 1.670 1.00 0.00 H new ATOM 0 HG3 LYS B 130 -2.326 8.179 0.291 1.00 0.00 H new ATOM 0 HD2 LYS B 130 -4.123 7.387 -1.206 1.00 0.00 H new ATOM 0 HD3 LYS B 130 -4.845 6.457 0.093 1.00 0.00 H new ATOM 0 HE2 LYS B 130 -5.145 8.566 1.429 1.00 0.00 H new ATOM 0 HE3 LYS B 130 -4.436 9.492 0.121 1.00 0.00 H new ATOM 0 HZ1 LYS B 130 -6.828 9.598 0.074 1.00 0.00 H new ATOM 0 HZ2 LYS B 130 -6.255 8.805 -1.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 130 -6.942 7.908 -0.046 1.00 0.00 H new ATOM 1999 N THR B 131 0.745 4.378 -0.082 1.00 0.00 N ATOM 2000 CA THR B 131 1.488 3.105 -0.224 1.00 0.00 C ATOM 2001 C THR B 131 2.692 2.934 0.717 1.00 0.00 C ATOM 2002 O THR B 131 3.370 1.910 0.624 1.00 0.00 O ATOM 2003 CB THR B 131 1.889 2.826 -1.680 1.00 0.00 C ATOM 2004 OG1 THR B 131 2.947 3.670 -2.065 1.00 0.00 O ATOM 2005 CG2 THR B 131 0.737 2.975 -2.673 1.00 0.00 C ATOM 0 H THR B 131 0.883 5.004 -0.875 1.00 0.00 H new ATOM 0 HA THR B 131 0.767 2.352 0.095 1.00 0.00 H new ATOM 0 HB THR B 131 2.201 1.782 -1.709 1.00 0.00 H new ATOM 0 HG1 THR B 131 2.614 4.586 -2.168 1.00 0.00 H new ATOM 0 HG21 THR B 131 1.095 2.763 -3.680 1.00 0.00 H new ATOM 0 HG22 THR B 131 -0.058 2.275 -2.416 1.00 0.00 H new ATOM 0 HG23 THR B 131 0.351 3.994 -2.632 1.00 0.00 H new ATOM 2013 N GLY B 132 2.979 3.900 1.602 1.00 0.00 N ATOM 2014 CA GLY B 132 3.867 3.709 2.760 1.00 0.00 C ATOM 2015 C GLY B 132 5.367 3.835 2.487 1.00 0.00 C ATOM 2016 O GLY B 132 6.154 3.202 3.187 1.00 0.00 O ATOM 0 H GLY B 132 2.598 4.844 1.534 1.00 0.00 H new ATOM 0 HA2 GLY B 132 3.595 4.437 3.524 1.00 0.00 H new ATOM 0 HA3 GLY B 132 3.677 2.721 3.179 1.00 0.00 H new ATOM 2020 N LYS B 133 5.780 4.631 1.497 1.00 0.00 N ATOM 2021 CA LYS B 133 7.166 4.671 0.991 1.00 0.00 C ATOM 2022 C LYS B 133 7.799 6.066 0.900 1.00 0.00 C ATOM 2023 O LYS B 133 7.097 7.084 0.923 1.00 0.00 O ATOM 2024 CB LYS B 133 7.162 3.998 -0.395 1.00 0.00 C ATOM 2025 CG LYS B 133 7.185 2.472 -0.261 1.00 0.00 C ATOM 2026 CD LYS B 133 7.131 1.799 -1.636 1.00 0.00 C ATOM 2027 CE LYS B 133 5.716 1.644 -2.211 1.00 0.00 C ATOM 2028 NZ LYS B 133 4.900 0.678 -1.436 1.00 0.00 N ATOM 0 H LYS B 133 5.156 5.277 1.014 1.00 0.00 H new ATOM 0 HA LYS B 133 7.789 4.147 1.716 1.00 0.00 H new ATOM 0 HB2 LYS B 133 6.276 4.305 -0.950 1.00 0.00 H new ATOM 0 HB3 LYS B 133 8.028 4.330 -0.968 1.00 0.00 H new ATOM 0 HG2 LYS B 133 8.089 2.163 0.264 1.00 0.00 H new ATOM 0 HG3 LYS B 133 6.338 2.144 0.342 1.00 0.00 H new ATOM 0 HD2 LYS B 133 7.733 2.380 -2.335 1.00 0.00 H new ATOM 0 HD3 LYS B 133 7.590 0.813 -1.563 1.00 0.00 H new ATOM 0 HE2 LYS B 133 5.219 2.614 -2.217 1.00 0.00 H new ATOM 0 HE3 LYS B 133 5.781 1.313 -3.248 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 4.060 0.411 -1.988 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 5.466 -0.171 -1.234 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 4.601 1.115 -0.541 1.00 0.00 H new ATOM 2042 N THR B 134 9.124 6.086 0.687 1.00 0.00 N ATOM 2043 CA THR B 134 9.864 7.217 0.110 1.00 0.00 C ATOM 2044 C THR B 134 9.326 7.481 -1.294 1.00 0.00 C ATOM 2045 O THR B 134 9.608 6.709 -2.212 1.00 0.00 O ATOM 2046 CB THR B 134 11.370 6.915 0.028 1.00 0.00 C ATOM 2047 OG1 THR B 134 11.832 6.394 1.246 1.00 0.00 O ATOM 2048 CG2 THR B 134 12.177 8.180 -0.259 1.00 0.00 C ATOM 0 H THR B 134 9.725 5.295 0.918 1.00 0.00 H new ATOM 0 HA THR B 134 9.729 8.090 0.749 1.00 0.00 H new ATOM 0 HB THR B 134 11.504 6.196 -0.780 1.00 0.00 H new ATOM 0 HG1 THR B 134 12.791 6.205 1.178 1.00 0.00 H new ATOM 0 HG21 THR B 134 13.237 7.931 -0.311 1.00 0.00 H new ATOM 0 HG22 THR B 134 11.858 8.607 -1.210 1.00 0.00 H new ATOM 0 HG23 THR B 134 12.013 8.905 0.538 1.00 0.00 H new ATOM 2056 N VAL B 135 8.564 8.558 -1.455 1.00 0.00 N ATOM 2057 CA VAL B 135 8.077 9.062 -2.757 1.00 0.00 C ATOM 2058 C VAL B 135 8.608 10.478 -3.004 1.00 0.00 C ATOM 2059 O VAL B 135 8.436 11.371 -2.174 1.00 0.00 O ATOM 2060 CB VAL B 135 6.532 9.094 -2.852 1.00 0.00 C ATOM 2061 CG1 VAL B 135 6.070 9.458 -4.277 1.00 0.00 C ATOM 2062 CG2 VAL B 135 5.874 7.756 -2.475 1.00 0.00 C ATOM 0 H VAL B 135 8.253 9.128 -0.668 1.00 0.00 H new ATOM 0 HA VAL B 135 8.447 8.369 -3.512 1.00 0.00 H new ATOM 0 HB VAL B 135 6.218 9.853 -2.135 1.00 0.00 H new ATOM 0 HG11 VAL B 135 4.981 9.473 -4.314 1.00 0.00 H new ATOM 0 HG12 VAL B 135 6.456 10.442 -4.544 1.00 0.00 H new ATOM 0 HG13 VAL B 135 6.447 8.717 -4.982 1.00 0.00 H new ATOM 0 HG21 VAL B 135 4.791 7.846 -2.562 1.00 0.00 H new ATOM 0 HG22 VAL B 135 6.229 6.974 -3.147 1.00 0.00 H new ATOM 0 HG23 VAL B 135 6.135 7.499 -1.449 1.00 0.00 H new ATOM 2072 N SER B 136 9.209 10.700 -4.173 1.00 0.00 N ATOM 2073 CA SER B 136 9.722 12.010 -4.594 1.00 0.00 C ATOM 2074 C SER B 136 9.202 12.384 -5.994 1.00 0.00 C ATOM 2075 O SER B 136 9.381 11.639 -6.959 1.00 0.00 O ATOM 2076 CB SER B 136 11.261 12.009 -4.582 1.00 0.00 C ATOM 2077 OG SER B 136 11.792 11.809 -3.275 1.00 0.00 O ATOM 0 H SER B 136 9.357 9.966 -4.866 1.00 0.00 H new ATOM 0 HA SER B 136 9.362 12.757 -3.887 1.00 0.00 H new ATOM 0 HB2 SER B 136 11.627 11.224 -5.244 1.00 0.00 H new ATOM 0 HB3 SER B 136 11.626 12.956 -4.979 1.00 0.00 H new ATOM 0 HG SER B 136 12.771 11.814 -3.315 1.00 0.00 H new ATOM 2083 N TYR B 137 8.591 13.567 -6.127 1.00 0.00 N ATOM 2084 CA TYR B 137 8.313 14.192 -7.427 1.00 0.00 C ATOM 2085 C TYR B 137 9.622 14.710 -8.048 1.00 0.00 C ATOM 2086 O TYR B 137 10.329 15.504 -7.413 1.00 0.00 O ATOM 2087 CB TYR B 137 7.294 15.333 -7.244 1.00 0.00 C ATOM 2088 CG TYR B 137 7.126 16.221 -8.467 1.00 0.00 C ATOM 2089 CD1 TYR B 137 6.737 15.658 -9.696 1.00 0.00 C ATOM 2090 CD2 TYR B 137 7.416 17.600 -8.396 1.00 0.00 C ATOM 2091 CE1 TYR B 137 6.653 16.462 -10.845 1.00 0.00 C ATOM 2092 CE2 TYR B 137 7.315 18.413 -9.544 1.00 0.00 C ATOM 2093 CZ TYR B 137 6.935 17.844 -10.779 1.00 0.00 C ATOM 2094 OH TYR B 137 6.842 18.602 -11.908 1.00 0.00 O ATOM 0 H TYR B 137 8.273 14.121 -5.332 1.00 0.00 H new ATOM 0 HA TYR B 137 7.885 13.455 -8.106 1.00 0.00 H new ATOM 0 HB2 TYR B 137 6.326 14.903 -6.986 1.00 0.00 H new ATOM 0 HB3 TYR B 137 7.604 15.950 -6.401 1.00 0.00 H new ATOM 0 HD1 TYR B 137 6.502 14.606 -9.756 1.00 0.00 H new ATOM 0 HD2 TYR B 137 7.718 18.036 -7.455 1.00 0.00 H new ATOM 0 HE1 TYR B 137 6.370 16.019 -11.788 1.00 0.00 H new ATOM 0 HE2 TYR B 137 7.528 19.470 -9.478 1.00 0.00 H new ATOM 0 HH TYR B 137 6.053 18.329 -12.421 1.00 0.00 H new ATOM 2104 N LEU B 138 9.938 14.276 -9.275 1.00 0.00 N ATOM 2105 CA LEU B 138 11.189 14.577 -9.980 1.00 0.00 C ATOM 2106 C LEU B 138 10.903 15.114 -11.393 1.00 0.00 C ATOM 2107 O LEU B 138 11.444 14.621 -12.387 1.00 0.00 O ATOM 2108 CB LEU B 138 12.085 13.316 -10.000 1.00 0.00 C ATOM 2109 CG LEU B 138 12.560 12.791 -8.628 1.00 0.00 C ATOM 2110 CD1 LEU B 138 13.378 11.509 -8.837 1.00 0.00 C ATOM 2111 CD2 LEU B 138 13.422 13.808 -7.863 1.00 0.00 C ATOM 0 H LEU B 138 9.309 13.687 -9.821 1.00 0.00 H new ATOM 0 HA LEU B 138 11.727 15.364 -9.452 1.00 0.00 H new ATOM 0 HB2 LEU B 138 11.539 12.517 -10.502 1.00 0.00 H new ATOM 0 HB3 LEU B 138 12.964 13.531 -10.607 1.00 0.00 H new ATOM 0 HG LEU B 138 11.668 12.602 -8.030 1.00 0.00 H new ATOM 0 HD11 LEU B 138 13.717 11.132 -7.872 1.00 0.00 H new ATOM 0 HD12 LEU B 138 12.757 10.756 -9.323 1.00 0.00 H new ATOM 0 HD13 LEU B 138 14.242 11.727 -9.465 1.00 0.00 H new ATOM 0 HD21 LEU B 138 13.725 13.382 -6.907 1.00 0.00 H new ATOM 0 HD22 LEU B 138 14.308 14.049 -8.450 1.00 0.00 H new ATOM 0 HD23 LEU B 138 12.845 14.716 -7.688 1.00 0.00 H new ATOM 2123 N GLY B 139 10.116 16.191 -11.471 1.00 0.00 N ATOM 2124 CA GLY B 139 10.054 17.073 -12.638 1.00 0.00 C ATOM 2125 C GLY B 139 9.180 16.581 -13.794 1.00 0.00 C ATOM 2126 O GLY B 139 8.149 15.927 -13.609 1.00 0.00 O ATOM 0 H GLY B 139 9.496 16.478 -10.714 1.00 0.00 H new ATOM 0 HA2 GLY B 139 9.685 18.047 -12.316 1.00 0.00 H new ATOM 0 HA3 GLY B 139 11.067 17.224 -13.011 1.00 0.00 H new ATOM 2130 N LEU B 140 9.559 16.989 -15.006 1.00 0.00 N ATOM 2131 CA LEU B 140 8.700 16.977 -16.193 1.00 0.00 C ATOM 2132 C LEU B 140 9.373 16.227 -17.353 1.00 0.00 C ATOM 2133 O LEU B 140 10.590 16.316 -17.525 1.00 0.00 O ATOM 2134 CB LEU B 140 8.403 18.458 -16.529 1.00 0.00 C ATOM 2135 CG LEU B 140 7.127 18.718 -17.351 1.00 0.00 C ATOM 2136 CD1 LEU B 140 5.853 18.409 -16.545 1.00 0.00 C ATOM 2137 CD2 LEU B 140 7.076 20.194 -17.775 1.00 0.00 C ATOM 0 H LEU B 140 10.496 17.346 -15.195 1.00 0.00 H new ATOM 0 HA LEU B 140 7.768 16.442 -16.012 1.00 0.00 H new ATOM 0 HB2 LEU B 140 8.330 19.015 -15.595 1.00 0.00 H new ATOM 0 HB3 LEU B 140 9.254 18.864 -17.076 1.00 0.00 H new ATOM 0 HG LEU B 140 7.163 18.061 -18.220 1.00 0.00 H new ATOM 0 HD11 LEU B 140 4.976 18.606 -17.161 1.00 0.00 H new ATOM 0 HD12 LEU B 140 5.858 17.361 -16.244 1.00 0.00 H new ATOM 0 HD13 LEU B 140 5.822 19.041 -15.657 1.00 0.00 H new ATOM 0 HD21 LEU B 140 6.172 20.374 -18.356 1.00 0.00 H new ATOM 0 HD22 LEU B 140 7.069 20.827 -16.888 1.00 0.00 H new ATOM 0 HD23 LEU B 140 7.951 20.429 -18.382 1.00 0.00 H new ATOM 2149 N GLU B 141 8.597 15.482 -18.149 1.00 0.00 N ATOM 2150 CA GLU B 141 9.071 14.828 -19.390 1.00 0.00 C ATOM 2151 C GLU B 141 9.116 15.824 -20.556 1.00 0.00 C ATOM 2152 O GLU B 141 8.048 16.361 -20.935 1.00 0.00 O ATOM 2153 CB GLU B 141 8.193 13.594 -19.690 1.00 0.00 C ATOM 2154 CG GLU B 141 8.592 12.763 -20.929 1.00 0.00 C ATOM 2155 CD GLU B 141 9.787 11.813 -20.710 1.00 0.00 C ATOM 2156 OE1 GLU B 141 10.938 12.278 -20.515 1.00 0.00 O ATOM 2157 OE2 GLU B 141 9.625 10.569 -20.775 1.00 0.00 O ATOM 2158 OXT GLU B 141 10.218 16.092 -21.082 1.00 0.00 O ATOM 0 H GLU B 141 7.611 15.310 -17.954 1.00 0.00 H new ATOM 0 HA GLU B 141 10.095 14.481 -19.252 1.00 0.00 H new ATOM 0 HB2 GLU B 141 8.210 12.940 -18.818 1.00 0.00 H new ATOM 0 HB3 GLU B 141 7.163 13.928 -19.818 1.00 0.00 H new ATOM 0 HG2 GLU B 141 7.731 12.175 -21.248 1.00 0.00 H new ATOM 0 HG3 GLU B 141 8.832 13.445 -21.745 1.00 0.00 H new TER 2165 GLU B 141 HETATM 2166 CU CU A 142 6.595 -8.422 -1.933 1.00 0.00 CU