USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1080 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 THR OG1 : rot 161:sc= 0.871 USER MOD Set 1.2: A 67 THR OG1 : rot 80:sc= 0.854 USER MOD Set 2.1: A 62 HIS : no HE2:sc= -4.02! C(o=-7.9!,f=-14!) USER MOD Set 2.2: A 68 MET CE :methyl -143:sc= -1.43 (180deg=-3.55!) USER MOD Set 2.3: A 118 GLN : amide:sc= -2.45! C(o=-7.9!,f=-9.2!) USER MOD Single : A 1 GLY N :NH3+ 142:sc= 1.17 (180deg=0.999) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 167:sc= 1.41 (180deg=1.12) USER MOD Single : A 11 TYR OH : rot 30:sc= 0 USER MOD Single : A 12 SER OG : rot 39:sc= 0.0555 USER MOD Single : A 13 GLN : amide:sc= -1.79! K(o=-1.8!,f=-0.17) USER MOD Single : A 16 LYS NZ :NH3+ 166:sc= 1.24 (180deg=1.03) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -6.96! C(o=-7!,f=-6.3!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.552) USER MOD Single : A 40 ASN : amide:sc= -0.23 X(o=-0.23,f=-0.2) USER MOD Single : A 43 ASN : amide:sc= -0.246 K(o=-0.25,f=-2.1) USER MOD Single : A 45 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.108) USER MOD Single : A 48 MET CE :methyl 173:sc= -1.91 (180deg=-2.23) USER MOD Single : A 50 MET CE :methyl -169:sc= -0.838 (180deg=-1.12) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 57 LYS NZ :NH3+ -165:sc= 0.32 (180deg=-0.348) USER MOD Single : A 59 CYS SG : rot 43:sc= 0.665 USER MOD Single : A 61 ASN : amide:sc= 0.8 K(o=0.8,f=-7!) USER MOD Single : A 66 THR OG1 : rot -85:sc= 1.4 USER MOD Single : A 69 ASN : amide:sc= -0.0249 X(o=-0.025,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 150:sc= -0.0708 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0.121 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 177:sc= 1.28 (180deg=1.19) USER MOD Single : A 96 GLN : amide:sc= -1.03 K(o=-1,f=-0.0037) USER MOD Single : A 100 LYS NZ :NH3+ -94:sc= 1.32 (180deg=0.255) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.162 USER MOD Single : A 111 LYS NZ :NH3+ -160:sc= 1.09 (180deg=0.243) USER MOD Single : A 112 GLN : amide:sc= -0.0106 X(o=-0.011,f=-0.019) USER MOD Single : A 113 LYS NZ :NH3+ -170:sc= -0.0209 (180deg=-0.23) USER MOD Single : A 117 CYS SG : rot 84:sc= 1.01 USER MOD Single : A 127 GLN : amide:sc= -0.0103 X(o=-0.01,f=-0.01) USER MOD Single : A 128 THR OG1 : rot -44:sc= 1.22 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.083 -10.463 -12.056 1.00 0.00 N ATOM 2 CA GLY A 1 -14.284 -11.144 -10.794 1.00 0.00 C ATOM 3 C GLY A 1 -14.811 -10.195 -9.762 1.00 0.00 C ATOM 4 O GLY A 1 -15.712 -9.403 -10.048 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.220 -10.823 -12.511 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.899 -10.635 -12.677 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.985 -9.441 -11.887 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.983 -11.970 -10.927 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.343 -11.575 -10.453 1.00 0.00 H new ATOM 10 N SER A 2 -14.282 -10.268 -8.565 1.00 0.00 N ATOM 11 CA SER A 2 -14.675 -9.375 -7.508 1.00 0.00 C ATOM 12 C SER A 2 -13.443 -8.817 -6.809 1.00 0.00 C ATOM 13 O SER A 2 -12.859 -9.464 -5.936 1.00 0.00 O ATOM 14 CB SER A 2 -15.578 -10.091 -6.504 1.00 0.00 C ATOM 15 OG SER A 2 -16.718 -10.662 -7.149 1.00 0.00 O ATOM 0 H SER A 2 -13.569 -10.947 -8.299 1.00 0.00 H new ATOM 0 HA SER A 2 -15.237 -8.549 -7.944 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.014 -10.874 -5.997 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.905 -9.387 -5.738 1.00 0.00 H new ATOM 0 HG SER A 2 -17.277 -11.115 -6.484 1.00 0.00 H new ATOM 21 N GLY A 3 -13.006 -7.679 -7.256 1.00 0.00 N ATOM 22 CA GLY A 3 -11.881 -7.026 -6.653 1.00 0.00 C ATOM 23 C GLY A 3 -10.616 -7.375 -7.376 1.00 0.00 C ATOM 24 O GLY A 3 -9.571 -7.593 -6.756 1.00 0.00 O ATOM 0 H GLY A 3 -13.415 -7.178 -8.044 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -12.029 -5.946 -6.670 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -11.801 -7.321 -5.607 1.00 0.00 H new ATOM 28 N GLU A 4 -10.718 -7.485 -8.675 1.00 0.00 N ATOM 29 CA GLU A 4 -9.592 -7.791 -9.525 1.00 0.00 C ATOM 30 C GLU A 4 -9.751 -6.973 -10.812 1.00 0.00 C ATOM 31 O GLU A 4 -9.189 -7.292 -11.878 1.00 0.00 O ATOM 32 CB GLU A 4 -9.598 -9.290 -9.820 1.00 0.00 C ATOM 33 CG GLU A 4 -8.317 -9.811 -10.453 1.00 0.00 C ATOM 34 CD GLU A 4 -8.363 -11.286 -10.714 1.00 0.00 C ATOM 35 OE1 GLU A 4 -8.812 -11.700 -11.797 1.00 0.00 O ATOM 36 OE2 GLU A 4 -7.952 -12.064 -9.847 1.00 0.00 O ATOM 0 H GLU A 4 -11.595 -7.363 -9.181 1.00 0.00 H new ATOM 0 HA GLU A 4 -8.643 -7.539 -9.051 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -9.775 -9.830 -8.890 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -10.434 -9.514 -10.483 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.139 -9.285 -11.391 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.475 -9.588 -9.798 1.00 0.00 H new ATOM 43 N GLU A 5 -10.455 -5.878 -10.673 1.00 0.00 N ATOM 44 CA GLU A 5 -10.821 -5.026 -11.670 1.00 0.00 C ATOM 45 C GLU A 5 -11.271 -3.791 -11.013 1.00 0.00 C ATOM 46 O GLU A 5 -11.695 -3.827 -9.830 1.00 0.00 O ATOM 47 CB GLU A 5 -11.876 -5.605 -12.588 1.00 0.00 C ATOM 48 CG GLU A 5 -13.180 -5.846 -11.923 1.00 0.00 C ATOM 49 CD GLU A 5 -13.170 -7.042 -11.006 1.00 0.00 C ATOM 50 OE1 GLU A 5 -13.007 -8.168 -11.503 1.00 0.00 O ATOM 51 OE2 GLU A 5 -13.295 -6.868 -9.775 1.00 0.00 O ATOM 0 H GLU A 5 -10.795 -5.573 -9.761 1.00 0.00 H new ATOM 0 HA GLU A 5 -9.975 -4.833 -12.330 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -12.027 -4.926 -13.427 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -11.510 -6.545 -13.000 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -13.457 -4.961 -11.351 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -13.947 -5.987 -12.684 1.00 0.00 H new ATOM 58 N ASP A 6 -11.039 -2.725 -11.730 1.00 0.00 N ATOM 59 CA ASP A 6 -11.442 -1.341 -11.399 1.00 0.00 C ATOM 60 C ASP A 6 -10.327 -0.542 -10.780 1.00 0.00 C ATOM 61 O ASP A 6 -10.424 0.660 -10.595 1.00 0.00 O ATOM 62 CB ASP A 6 -12.755 -1.339 -10.624 1.00 0.00 C ATOM 63 CG ASP A 6 -13.225 -0.016 -10.043 1.00 0.00 C ATOM 64 OD1 ASP A 6 -12.828 0.332 -8.911 1.00 0.00 O ATOM 65 OD2 ASP A 6 -14.058 0.657 -10.697 1.00 0.00 O ATOM 0 H ASP A 6 -10.536 -2.778 -12.616 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.645 -0.804 -12.325 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -13.537 -1.712 -11.286 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.663 -2.052 -9.805 1.00 0.00 H new ATOM 70 N GLU A 7 -9.240 -1.173 -10.596 1.00 0.00 N ATOM 71 CA GLU A 7 -8.120 -0.567 -10.046 1.00 0.00 C ATOM 72 C GLU A 7 -7.119 -0.366 -11.107 1.00 0.00 C ATOM 73 O GLU A 7 -6.927 -1.203 -12.007 1.00 0.00 O ATOM 74 CB GLU A 7 -7.587 -1.352 -8.845 1.00 0.00 C ATOM 75 CG GLU A 7 -6.957 -2.705 -9.180 1.00 0.00 C ATOM 76 CD GLU A 7 -7.891 -3.738 -9.682 1.00 0.00 C ATOM 77 OE1 GLU A 7 -8.124 -3.786 -10.920 1.00 0.00 O ATOM 78 OE2 GLU A 7 -8.360 -4.547 -8.880 1.00 0.00 O ATOM 0 H GLU A 7 -9.109 -2.156 -10.834 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.385 0.412 -9.646 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -6.845 -0.741 -8.332 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.406 -1.514 -8.144 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.180 -2.549 -9.928 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -6.466 -3.088 -8.286 1.00 0.00 H new ATOM 85 N LYS A 8 -6.500 0.729 -11.018 1.00 0.00 N ATOM 86 CA LYS A 8 -5.594 1.106 -12.024 1.00 0.00 C ATOM 87 C LYS A 8 -4.216 1.436 -11.473 1.00 0.00 C ATOM 88 O LYS A 8 -4.082 1.761 -10.287 1.00 0.00 O ATOM 89 CB LYS A 8 -6.151 2.251 -12.844 1.00 0.00 C ATOM 90 CG LYS A 8 -6.331 3.537 -12.074 1.00 0.00 C ATOM 91 CD LYS A 8 -7.079 4.526 -12.908 1.00 0.00 C ATOM 92 CE LYS A 8 -7.204 5.854 -12.222 1.00 0.00 C ATOM 93 NZ LYS A 8 -8.129 6.722 -12.948 1.00 0.00 N ATOM 0 H LYS A 8 -6.600 1.394 -10.251 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.464 0.245 -12.680 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.485 2.436 -13.687 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -7.114 1.951 -13.258 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -6.873 3.344 -11.148 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -5.359 3.944 -11.795 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -6.568 4.657 -13.862 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.073 4.137 -13.129 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.557 5.710 -11.201 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.225 6.330 -12.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.374 7.541 -12.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -7.679 7.052 -13.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.993 6.192 -13.180 1.00 0.00 H new ATOM 107 N VAL A 9 -3.206 1.380 -12.342 1.00 0.00 N ATOM 108 CA VAL A 9 -1.851 1.657 -11.969 1.00 0.00 C ATOM 109 C VAL A 9 -1.633 3.132 -12.097 1.00 0.00 C ATOM 110 O VAL A 9 -1.788 3.709 -13.181 1.00 0.00 O ATOM 111 CB VAL A 9 -0.808 0.948 -12.898 1.00 0.00 C ATOM 112 CG1 VAL A 9 0.614 1.174 -12.396 1.00 0.00 C ATOM 113 CG2 VAL A 9 -1.084 -0.530 -13.036 1.00 0.00 C ATOM 0 H VAL A 9 -3.324 1.138 -13.326 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.706 1.290 -10.953 1.00 0.00 H new ATOM 0 HB VAL A 9 -0.908 1.398 -13.886 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.318 0.671 -13.059 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.829 2.242 -12.381 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.713 0.770 -11.388 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -0.336 -0.980 -13.689 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.040 -1.002 -12.054 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -2.075 -0.677 -13.465 1.00 0.00 H new ATOM 123 N LEU A 10 -1.317 3.732 -11.016 1.00 0.00 N ATOM 124 CA LEU A 10 -0.991 5.150 -11.013 1.00 0.00 C ATOM 125 C LEU A 10 0.525 5.345 -11.028 1.00 0.00 C ATOM 126 O LEU A 10 1.033 6.361 -11.505 1.00 0.00 O ATOM 127 CB LEU A 10 -1.608 5.862 -9.807 1.00 0.00 C ATOM 128 CG LEU A 10 -1.498 7.390 -9.819 1.00 0.00 C ATOM 129 CD1 LEU A 10 -2.318 7.988 -10.953 1.00 0.00 C ATOM 130 CD2 LEU A 10 -1.914 7.974 -8.489 1.00 0.00 C ATOM 0 H LEU A 10 -1.270 3.282 -10.102 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.414 5.593 -11.914 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.662 5.591 -9.747 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.130 5.487 -8.902 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.452 7.647 -9.988 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -2.222 9.074 -10.938 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.954 7.605 -11.906 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.366 7.715 -10.828 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -1.826 9.060 -8.525 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.948 7.700 -8.279 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.268 7.584 -7.702 1.00 0.00 H new ATOM 142 N TYR A 11 1.233 4.365 -10.496 1.00 0.00 N ATOM 143 CA TYR A 11 2.682 4.389 -10.452 1.00 0.00 C ATOM 144 C TYR A 11 3.230 2.992 -10.245 1.00 0.00 C ATOM 145 O TYR A 11 2.622 2.173 -9.532 1.00 0.00 O ATOM 146 CB TYR A 11 3.237 5.397 -9.405 1.00 0.00 C ATOM 147 CG TYR A 11 2.794 5.209 -7.955 1.00 0.00 C ATOM 148 CD1 TYR A 11 1.523 5.582 -7.545 1.00 0.00 C ATOM 149 CD2 TYR A 11 3.665 4.703 -6.995 1.00 0.00 C ATOM 150 CE1 TYR A 11 1.125 5.455 -6.230 1.00 0.00 C ATOM 151 CE2 TYR A 11 3.272 4.569 -5.673 1.00 0.00 C ATOM 152 CZ TYR A 11 2.000 4.951 -5.296 1.00 0.00 C ATOM 153 OH TYR A 11 1.598 4.823 -3.973 1.00 0.00 O ATOM 0 H TYR A 11 0.818 3.530 -10.082 1.00 0.00 H new ATOM 0 HA TYR A 11 3.031 4.750 -11.420 1.00 0.00 H new ATOM 0 HB2 TYR A 11 4.326 5.351 -9.435 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.952 6.401 -9.718 1.00 0.00 H new ATOM 0 HD1 TYR A 11 0.830 5.981 -8.271 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.663 4.410 -7.285 1.00 0.00 H new ATOM 0 HE1 TYR A 11 0.129 5.751 -5.935 1.00 0.00 H new ATOM 0 HE2 TYR A 11 3.957 4.168 -4.941 1.00 0.00 H new ATOM 0 HH TYR A 11 0.632 4.662 -3.939 1.00 0.00 H new ATOM 163 N SER A 12 4.307 2.705 -10.930 1.00 0.00 N ATOM 164 CA SER A 12 4.966 1.466 -10.890 1.00 0.00 C ATOM 165 C SER A 12 6.471 1.679 -10.634 1.00 0.00 C ATOM 166 O SER A 12 7.115 2.468 -11.341 1.00 0.00 O ATOM 167 CB SER A 12 4.723 0.817 -12.240 1.00 0.00 C ATOM 168 OG SER A 12 4.945 1.735 -13.312 1.00 0.00 O ATOM 0 H SER A 12 4.754 3.376 -11.555 1.00 0.00 H new ATOM 0 HA SER A 12 4.595 0.831 -10.085 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.382 -0.044 -12.355 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.700 0.443 -12.286 1.00 0.00 H new ATOM 0 HG SER A 12 5.718 2.301 -13.104 1.00 0.00 H new ATOM 174 N GLN A 13 7.028 1.017 -9.625 1.00 0.00 N ATOM 175 CA GLN A 13 8.463 1.158 -9.350 1.00 0.00 C ATOM 176 C GLN A 13 9.076 -0.098 -8.764 1.00 0.00 C ATOM 177 O GLN A 13 8.430 -0.812 -8.046 1.00 0.00 O ATOM 178 CB GLN A 13 8.748 2.398 -8.507 1.00 0.00 C ATOM 179 CG GLN A 13 10.211 2.633 -8.209 1.00 0.00 C ATOM 180 CD GLN A 13 10.431 3.791 -7.295 1.00 0.00 C ATOM 181 OE1 GLN A 13 9.679 4.746 -7.293 1.00 0.00 O ATOM 182 NE2 GLN A 13 11.460 3.717 -6.515 1.00 0.00 N ATOM 0 H GLN A 13 6.527 0.391 -8.995 1.00 0.00 H new ATOM 0 HA GLN A 13 8.957 1.302 -10.311 1.00 0.00 H new ATOM 0 HB2 GLN A 13 8.351 3.272 -9.024 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.208 2.312 -7.564 1.00 0.00 H new ATOM 0 HG2 GLN A 13 10.635 1.735 -7.760 1.00 0.00 H new ATOM 0 HG3 GLN A 13 10.745 2.806 -9.143 1.00 0.00 H new ATOM 0 HE21 GLN A 13 12.067 2.898 -6.548 1.00 0.00 H new ATOM 0 HE22 GLN A 13 11.665 4.478 -5.867 1.00 0.00 H new ATOM 191 N ARG A 14 10.353 -0.317 -9.045 1.00 0.00 N ATOM 192 CA ARG A 14 11.025 -1.507 -8.618 1.00 0.00 C ATOM 193 C ARG A 14 11.374 -1.400 -7.148 1.00 0.00 C ATOM 194 O ARG A 14 12.063 -0.474 -6.703 1.00 0.00 O ATOM 195 CB ARG A 14 12.279 -1.752 -9.441 1.00 0.00 C ATOM 196 CG ARG A 14 12.877 -3.137 -9.246 1.00 0.00 C ATOM 197 CD ARG A 14 14.147 -3.318 -10.050 1.00 0.00 C ATOM 198 NE ARG A 14 13.961 -3.027 -11.485 1.00 0.00 N ATOM 199 CZ ARG A 14 14.882 -3.256 -12.426 1.00 0.00 C ATOM 200 NH1 ARG A 14 15.947 -4.000 -12.149 1.00 0.00 N ATOM 201 NH2 ARG A 14 14.699 -2.805 -13.653 1.00 0.00 N ATOM 0 H ARG A 14 10.938 0.330 -9.574 1.00 0.00 H new ATOM 0 HA ARG A 14 10.355 -2.354 -8.768 1.00 0.00 H new ATOM 0 HB2 ARG A 14 12.043 -1.613 -10.496 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.027 -1.003 -9.180 1.00 0.00 H new ATOM 0 HG2 ARG A 14 13.090 -3.296 -8.189 1.00 0.00 H new ATOM 0 HG3 ARG A 14 12.149 -3.892 -9.541 1.00 0.00 H new ATOM 0 HD2 ARG A 14 14.922 -2.665 -9.649 1.00 0.00 H new ATOM 0 HD3 ARG A 14 14.502 -4.342 -9.935 1.00 0.00 H new ATOM 0 HE ARG A 14 13.071 -2.625 -11.778 1.00 0.00 H new ATOM 0 HH11 ARG A 14 16.063 -4.398 -11.217 1.00 0.00 H new ATOM 0 HH12 ARG A 14 16.649 -4.174 -12.868 1.00 0.00 H new ATOM 0 HH21 ARG A 14 13.854 -2.281 -13.883 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.402 -2.980 -14.371 1.00 0.00 H new ATOM 215 N VAL A 15 10.875 -2.339 -6.437 1.00 0.00 N ATOM 216 CA VAL A 15 10.981 -2.433 -5.033 1.00 0.00 C ATOM 217 C VAL A 15 11.525 -3.834 -4.701 1.00 0.00 C ATOM 218 O VAL A 15 11.681 -4.676 -5.601 1.00 0.00 O ATOM 219 CB VAL A 15 9.542 -2.279 -4.426 1.00 0.00 C ATOM 220 CG1 VAL A 15 8.697 -3.537 -4.641 1.00 0.00 C ATOM 221 CG2 VAL A 15 9.560 -1.852 -2.969 1.00 0.00 C ATOM 0 H VAL A 15 10.349 -3.111 -6.847 1.00 0.00 H new ATOM 0 HA VAL A 15 11.639 -1.664 -4.628 1.00 0.00 H new ATOM 0 HB VAL A 15 9.064 -1.468 -4.975 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.708 -3.390 -4.206 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.599 -3.731 -5.709 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.181 -4.387 -4.161 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.537 -1.762 -2.604 1.00 0.00 H new ATOM 0 HG22 VAL A 15 10.092 -2.597 -2.378 1.00 0.00 H new ATOM 0 HG23 VAL A 15 10.064 -0.890 -2.878 1.00 0.00 H new ATOM 231 N LYS A 16 11.809 -4.065 -3.460 1.00 0.00 N ATOM 232 CA LYS A 16 12.177 -5.365 -2.975 1.00 0.00 C ATOM 233 C LYS A 16 11.023 -5.824 -2.128 1.00 0.00 C ATOM 234 O LYS A 16 10.526 -5.031 -1.313 1.00 0.00 O ATOM 235 CB LYS A 16 13.407 -5.266 -2.073 1.00 0.00 C ATOM 236 CG LYS A 16 14.659 -4.733 -2.739 1.00 0.00 C ATOM 237 CD LYS A 16 15.762 -4.469 -1.722 1.00 0.00 C ATOM 238 CE LYS A 16 16.209 -5.723 -0.961 1.00 0.00 C ATOM 239 NZ LYS A 16 16.845 -6.744 -1.823 1.00 0.00 N ATOM 0 H LYS A 16 11.793 -3.345 -2.738 1.00 0.00 H new ATOM 0 HA LYS A 16 12.399 -6.039 -3.802 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.165 -4.624 -1.226 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.623 -6.256 -1.671 1.00 0.00 H new ATOM 0 HG2 LYS A 16 15.011 -5.449 -3.481 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.425 -3.811 -3.271 1.00 0.00 H new ATOM 0 HD2 LYS A 16 16.623 -4.040 -2.235 1.00 0.00 H new ATOM 0 HD3 LYS A 16 15.414 -3.725 -1.006 1.00 0.00 H new ATOM 0 HE2 LYS A 16 16.910 -5.432 -0.179 1.00 0.00 H new ATOM 0 HE3 LYS A 16 15.344 -6.165 -0.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 17.330 -7.446 -1.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 16.117 -7.218 -2.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 17.536 -6.286 -2.452 1.00 0.00 H new ATOM 253 N LEU A 17 10.594 -7.064 -2.262 1.00 0.00 N ATOM 254 CA LEU A 17 9.515 -7.518 -1.443 1.00 0.00 C ATOM 255 C LEU A 17 10.112 -8.356 -0.386 1.00 0.00 C ATOM 256 O LEU A 17 11.131 -8.973 -0.605 1.00 0.00 O ATOM 257 CB LEU A 17 8.505 -8.349 -2.247 1.00 0.00 C ATOM 258 CG LEU A 17 7.416 -9.072 -1.441 1.00 0.00 C ATOM 259 CD1 LEU A 17 6.487 -8.087 -0.749 1.00 0.00 C ATOM 260 CD2 LEU A 17 6.644 -10.034 -2.322 1.00 0.00 C ATOM 0 H LEU A 17 10.971 -7.751 -2.915 1.00 0.00 H new ATOM 0 HA LEU A 17 8.974 -6.665 -1.033 1.00 0.00 H new ATOM 0 HB2 LEU A 17 8.017 -7.691 -2.966 1.00 0.00 H new ATOM 0 HB3 LEU A 17 9.056 -9.094 -2.821 1.00 0.00 H new ATOM 0 HG LEU A 17 7.909 -9.652 -0.661 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.729 -8.634 -0.188 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.063 -7.462 -0.066 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.002 -7.458 -1.496 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.878 -10.535 -1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 17 6.172 -9.483 -3.135 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.327 -10.777 -2.735 1.00 0.00 H new ATOM 272 N PHE A 18 9.536 -8.319 0.746 1.00 0.00 N ATOM 273 CA PHE A 18 9.959 -9.084 1.876 1.00 0.00 C ATOM 274 C PHE A 18 8.756 -9.714 2.493 1.00 0.00 C ATOM 275 O PHE A 18 7.743 -9.056 2.646 1.00 0.00 O ATOM 276 CB PHE A 18 10.558 -8.171 2.945 1.00 0.00 C ATOM 277 CG PHE A 18 11.887 -7.530 2.663 1.00 0.00 C ATOM 278 CD1 PHE A 18 12.021 -6.555 1.698 1.00 0.00 C ATOM 279 CD2 PHE A 18 13.000 -7.882 3.403 1.00 0.00 C ATOM 280 CE1 PHE A 18 13.230 -5.954 1.470 1.00 0.00 C ATOM 281 CE2 PHE A 18 14.216 -7.282 3.177 1.00 0.00 C ATOM 282 CZ PHE A 18 14.331 -6.316 2.208 1.00 0.00 C ATOM 0 H PHE A 18 8.721 -7.735 0.934 1.00 0.00 H new ATOM 0 HA PHE A 18 10.693 -9.818 1.543 1.00 0.00 H new ATOM 0 HB2 PHE A 18 9.840 -7.376 3.145 1.00 0.00 H new ATOM 0 HB3 PHE A 18 10.655 -8.751 3.863 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.161 -6.261 1.114 1.00 0.00 H new ATOM 0 HD2 PHE A 18 12.913 -8.638 4.169 1.00 0.00 H new ATOM 0 HE1 PHE A 18 13.318 -5.194 0.708 1.00 0.00 H new ATOM 0 HE2 PHE A 18 15.078 -7.570 3.760 1.00 0.00 H new ATOM 0 HZ PHE A 18 15.284 -5.842 2.026 1.00 0.00 H new ATOM 292 N ARG A 19 8.840 -10.957 2.831 1.00 0.00 N ATOM 293 CA ARG A 19 7.808 -11.558 3.600 1.00 0.00 C ATOM 294 C ARG A 19 8.409 -12.209 4.759 1.00 0.00 C ATOM 295 O ARG A 19 9.544 -12.680 4.735 1.00 0.00 O ATOM 296 CB ARG A 19 6.895 -12.492 2.844 1.00 0.00 C ATOM 297 CG ARG A 19 5.684 -13.037 3.620 1.00 0.00 C ATOM 298 CD ARG A 19 4.839 -13.971 2.764 1.00 0.00 C ATOM 299 NE ARG A 19 4.183 -13.288 1.639 1.00 0.00 N ATOM 300 CZ ARG A 19 4.317 -13.597 0.342 1.00 0.00 C ATOM 301 NH1 ARG A 19 5.209 -14.505 -0.055 1.00 0.00 N ATOM 302 NH2 ARG A 19 3.557 -12.989 -0.550 1.00 0.00 N ATOM 0 H ARG A 19 9.614 -11.575 2.586 1.00 0.00 H new ATOM 0 HA ARG A 19 7.140 -10.754 3.910 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.528 -11.971 1.960 1.00 0.00 H new ATOM 0 HB3 ARG A 19 7.486 -13.338 2.493 1.00 0.00 H new ATOM 0 HG2 ARG A 19 6.030 -13.569 4.506 1.00 0.00 H new ATOM 0 HG3 ARG A 19 5.070 -12.206 3.966 1.00 0.00 H new ATOM 0 HD2 ARG A 19 5.471 -14.771 2.377 1.00 0.00 H new ATOM 0 HD3 ARG A 19 4.079 -14.440 3.390 1.00 0.00 H new ATOM 0 HE ARG A 19 3.569 -12.506 1.867 1.00 0.00 H new ATOM 0 HH11 ARG A 19 5.800 -14.974 0.632 1.00 0.00 H new ATOM 0 HH12 ARG A 19 5.301 -14.731 -1.045 1.00 0.00 H new ATOM 0 HH21 ARG A 19 2.876 -12.292 -0.249 1.00 0.00 H new ATOM 0 HH22 ARG A 19 3.651 -13.217 -1.540 1.00 0.00 H new ATOM 316 N PHE A 20 7.671 -12.181 5.726 1.00 0.00 N ATOM 317 CA PHE A 20 8.007 -12.642 7.020 1.00 0.00 C ATOM 318 C PHE A 20 7.988 -14.118 6.987 1.00 0.00 C ATOM 319 O PHE A 20 6.966 -14.754 6.701 1.00 0.00 O ATOM 320 CB PHE A 20 7.009 -12.173 8.041 1.00 0.00 C ATOM 321 CG PHE A 20 7.435 -12.309 9.479 1.00 0.00 C ATOM 322 CD1 PHE A 20 8.118 -11.284 10.109 1.00 0.00 C ATOM 323 CD2 PHE A 20 7.134 -13.451 10.204 1.00 0.00 C ATOM 324 CE1 PHE A 20 8.495 -11.395 11.431 1.00 0.00 C ATOM 325 CE2 PHE A 20 7.505 -13.569 11.523 1.00 0.00 C ATOM 326 CZ PHE A 20 8.187 -12.539 12.138 1.00 0.00 C ATOM 0 H PHE A 20 6.722 -11.810 5.674 1.00 0.00 H new ATOM 0 HA PHE A 20 8.987 -12.254 7.297 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.782 -11.125 7.846 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.083 -12.731 7.901 1.00 0.00 H new ATOM 0 HD1 PHE A 20 8.359 -10.386 9.559 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.601 -14.260 9.727 1.00 0.00 H new ATOM 0 HE1 PHE A 20 9.030 -10.589 11.911 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.263 -14.465 12.076 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.480 -12.628 13.174 1.00 0.00 H new ATOM 336 N ASP A 21 9.082 -14.626 7.217 1.00 0.00 N ATOM 337 CA ASP A 21 9.278 -16.024 7.295 1.00 0.00 C ATOM 338 C ASP A 21 9.052 -16.422 8.668 1.00 0.00 C ATOM 339 O ASP A 21 9.627 -15.896 9.543 1.00 0.00 O ATOM 340 CB ASP A 21 10.646 -16.501 6.915 1.00 0.00 C ATOM 341 CG ASP A 21 10.551 -17.904 6.367 1.00 0.00 C ATOM 342 OD1 ASP A 21 10.154 -18.808 7.105 1.00 0.00 O ATOM 343 OD2 ASP A 21 10.879 -18.119 5.195 1.00 0.00 O ATOM 0 H ASP A 21 9.931 -14.082 7.369 1.00 0.00 H new ATOM 0 HA ASP A 21 8.586 -16.467 6.579 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.081 -15.836 6.169 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.305 -16.481 7.783 1.00 0.00 H new ATOM 348 N ALA A 22 8.175 -17.254 8.826 1.00 0.00 N ATOM 349 CA ALA A 22 7.828 -17.820 10.104 1.00 0.00 C ATOM 350 C ALA A 22 8.981 -18.676 10.598 1.00 0.00 C ATOM 351 O ALA A 22 9.322 -18.654 11.768 1.00 0.00 O ATOM 352 CB ALA A 22 6.571 -18.650 9.985 1.00 0.00 C ATOM 0 H ALA A 22 7.613 -17.618 8.056 1.00 0.00 H new ATOM 0 HA ALA A 22 7.641 -17.018 10.818 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.320 -19.072 10.958 1.00 0.00 H new ATOM 0 HB2 ALA A 22 5.751 -18.021 9.640 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.734 -19.457 9.271 1.00 0.00 H new ATOM 358 N GLU A 23 9.638 -19.353 9.676 1.00 0.00 N ATOM 359 CA GLU A 23 10.739 -20.202 10.011 1.00 0.00 C ATOM 360 C GLU A 23 12.003 -19.410 10.178 1.00 0.00 C ATOM 361 O GLU A 23 12.920 -19.841 10.858 1.00 0.00 O ATOM 362 CB GLU A 23 10.921 -21.307 8.993 1.00 0.00 C ATOM 363 CG GLU A 23 9.772 -22.287 8.989 1.00 0.00 C ATOM 364 CD GLU A 23 9.440 -22.786 10.377 1.00 0.00 C ATOM 365 OE1 GLU A 23 10.256 -23.534 10.973 1.00 0.00 O ATOM 366 OE2 GLU A 23 8.353 -22.451 10.896 1.00 0.00 O ATOM 0 H GLU A 23 9.416 -19.323 8.681 1.00 0.00 H new ATOM 0 HA GLU A 23 10.508 -20.672 10.967 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.023 -20.868 8.000 1.00 0.00 H new ATOM 0 HB3 GLU A 23 11.848 -21.840 9.203 1.00 0.00 H new ATOM 0 HG2 GLU A 23 8.892 -21.811 8.556 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.022 -23.134 8.351 1.00 0.00 H new ATOM 373 N VAL A 24 12.067 -18.230 9.564 1.00 0.00 N ATOM 374 CA VAL A 24 13.235 -17.385 9.794 1.00 0.00 C ATOM 375 C VAL A 24 12.917 -16.435 10.888 1.00 0.00 C ATOM 376 O VAL A 24 13.791 -15.782 11.474 1.00 0.00 O ATOM 377 CB VAL A 24 13.667 -16.557 8.557 1.00 0.00 C ATOM 378 CG1 VAL A 24 15.036 -15.907 8.744 1.00 0.00 C ATOM 379 CG2 VAL A 24 13.675 -17.422 7.388 1.00 0.00 C ATOM 0 H VAL A 24 11.361 -17.851 8.933 1.00 0.00 H new ATOM 0 HA VAL A 24 14.060 -18.053 10.039 1.00 0.00 H new ATOM 0 HB VAL A 24 12.950 -15.747 8.423 1.00 0.00 H new ATOM 0 HG11 VAL A 24 15.294 -15.338 7.851 1.00 0.00 H new ATOM 0 HG12 VAL A 24 15.007 -15.238 9.604 1.00 0.00 H new ATOM 0 HG13 VAL A 24 15.786 -16.680 8.911 1.00 0.00 H new ATOM 0 HG21 VAL A 24 13.978 -16.848 6.512 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.377 -18.241 7.546 1.00 0.00 H new ATOM 0 HG23 VAL A 24 12.676 -17.827 7.228 1.00 0.00 H new ATOM 389 N SER A 25 11.639 -16.442 11.216 1.00 0.00 N ATOM 390 CA SER A 25 11.014 -15.455 12.033 1.00 0.00 C ATOM 391 C SER A 25 11.349 -14.122 11.503 1.00 0.00 C ATOM 392 O SER A 25 11.435 -13.147 12.265 1.00 0.00 O ATOM 393 CB SER A 25 11.478 -15.604 13.411 1.00 0.00 C ATOM 394 OG SER A 25 10.891 -16.724 14.069 1.00 0.00 O ATOM 0 H SER A 25 10.995 -17.168 10.902 1.00 0.00 H new ATOM 0 HA SER A 25 9.931 -15.577 12.022 1.00 0.00 H new ATOM 0 HB2 SER A 25 12.563 -15.712 13.416 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.246 -14.697 13.969 1.00 0.00 H new ATOM 0 HG SER A 25 11.234 -16.782 14.985 1.00 0.00 H new ATOM 400 N GLN A 26 11.488 -14.003 10.188 1.00 0.00 N ATOM 401 CA GLN A 26 11.989 -12.744 9.804 1.00 0.00 C ATOM 402 C GLN A 26 11.461 -12.258 8.468 1.00 0.00 C ATOM 403 O GLN A 26 11.146 -13.052 7.605 1.00 0.00 O ATOM 404 CB GLN A 26 13.525 -12.761 9.790 1.00 0.00 C ATOM 405 CG GLN A 26 14.184 -11.418 9.497 1.00 0.00 C ATOM 406 CD GLN A 26 15.694 -11.483 9.431 1.00 0.00 C ATOM 407 OE1 GLN A 26 16.269 -11.730 8.375 1.00 0.00 O ATOM 408 NE2 GLN A 26 16.346 -11.228 10.524 1.00 0.00 N ATOM 0 H GLN A 26 11.282 -14.689 9.462 1.00 0.00 H new ATOM 0 HA GLN A 26 11.631 -12.036 10.552 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.878 -13.118 10.758 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.858 -13.482 9.044 1.00 0.00 H new ATOM 0 HG2 GLN A 26 13.804 -11.036 8.550 1.00 0.00 H new ATOM 0 HG3 GLN A 26 13.893 -10.705 10.268 1.00 0.00 H new ATOM 0 HE21 GLN A 26 15.838 -11.026 11.385 1.00 0.00 H new ATOM 0 HE22 GLN A 26 17.366 -11.229 10.521 1.00 0.00 H new ATOM 417 N TRP A 27 11.393 -10.950 8.320 1.00 0.00 N ATOM 418 CA TRP A 27 11.087 -10.293 7.124 1.00 0.00 C ATOM 419 C TRP A 27 12.206 -10.574 6.102 1.00 0.00 C ATOM 420 O TRP A 27 13.284 -10.003 6.161 1.00 0.00 O ATOM 421 CB TRP A 27 10.971 -8.793 7.461 1.00 0.00 C ATOM 422 CG TRP A 27 12.053 -8.257 8.406 1.00 0.00 C ATOM 423 CD1 TRP A 27 13.298 -7.792 8.067 1.00 0.00 C ATOM 424 CD2 TRP A 27 11.968 -8.134 9.833 1.00 0.00 C ATOM 425 NE1 TRP A 27 13.989 -7.413 9.188 1.00 0.00 N ATOM 426 CE2 TRP A 27 13.196 -7.605 10.285 1.00 0.00 C ATOM 427 CE3 TRP A 27 10.978 -8.422 10.771 1.00 0.00 C ATOM 428 CZ2 TRP A 27 13.453 -7.362 11.630 1.00 0.00 C ATOM 429 CZ3 TRP A 27 11.235 -8.177 12.100 1.00 0.00 C ATOM 430 CH2 TRP A 27 12.462 -7.653 12.521 1.00 0.00 C ATOM 0 H TRP A 27 11.564 -10.306 9.092 1.00 0.00 H new ATOM 0 HA TRP A 27 10.152 -10.638 6.682 1.00 0.00 H new ATOM 0 HB2 TRP A 27 11.006 -8.223 6.532 1.00 0.00 H new ATOM 0 HB3 TRP A 27 9.995 -8.611 7.910 1.00 0.00 H new ATOM 0 HD1 TRP A 27 13.680 -7.733 7.059 1.00 0.00 H new ATOM 0 HE1 TRP A 27 14.941 -7.047 9.202 1.00 0.00 H new ATOM 0 HE3 TRP A 27 10.027 -8.830 10.460 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 14.400 -6.959 11.956 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 10.473 -8.394 12.834 1.00 0.00 H new ATOM 0 HH2 TRP A 27 12.628 -7.475 13.573 1.00 0.00 H new ATOM 441 N LYS A 28 11.986 -11.495 5.230 1.00 0.00 N ATOM 442 CA LYS A 28 13.016 -11.869 4.315 1.00 0.00 C ATOM 443 C LYS A 28 12.622 -11.526 2.943 1.00 0.00 C ATOM 444 O LYS A 28 11.475 -11.760 2.536 1.00 0.00 O ATOM 445 CB LYS A 28 13.380 -13.352 4.469 1.00 0.00 C ATOM 446 CG LYS A 28 14.642 -13.787 3.737 1.00 0.00 C ATOM 447 CD LYS A 28 15.859 -13.039 4.258 1.00 0.00 C ATOM 448 CE LYS A 28 17.144 -13.549 3.644 1.00 0.00 C ATOM 449 NZ LYS A 28 18.326 -12.855 4.184 1.00 0.00 N ATOM 0 H LYS A 28 11.108 -12.003 5.128 1.00 0.00 H new ATOM 0 HA LYS A 28 13.919 -11.304 4.547 1.00 0.00 H new ATOM 0 HB2 LYS A 28 13.500 -13.572 5.530 1.00 0.00 H new ATOM 0 HB3 LYS A 28 12.545 -13.954 4.111 1.00 0.00 H new ATOM 0 HG2 LYS A 28 14.788 -14.860 3.863 1.00 0.00 H new ATOM 0 HG3 LYS A 28 14.528 -13.604 2.668 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.751 -11.976 4.042 1.00 0.00 H new ATOM 0 HD3 LYS A 28 15.910 -13.140 5.342 1.00 0.00 H new ATOM 0 HE2 LYS A 28 17.235 -14.619 3.830 1.00 0.00 H new ATOM 0 HE3 LYS A 28 17.107 -13.415 2.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 19.185 -13.234 3.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 18.252 -11.837 3.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 18.376 -13.003 5.212 1.00 0.00 H new ATOM 463 N GLU A 29 13.563 -10.923 2.238 1.00 0.00 N ATOM 464 CA GLU A 29 13.385 -10.526 0.938 1.00 0.00 C ATOM 465 C GLU A 29 12.945 -11.669 0.109 1.00 0.00 C ATOM 466 O GLU A 29 13.476 -12.782 0.188 1.00 0.00 O ATOM 467 CB GLU A 29 14.595 -9.811 0.343 1.00 0.00 C ATOM 468 CG GLU A 29 15.910 -10.560 0.468 1.00 0.00 C ATOM 469 CD GLU A 29 16.998 -9.903 -0.332 1.00 0.00 C ATOM 470 OE1 GLU A 29 17.323 -8.743 -0.081 1.00 0.00 O ATOM 471 OE2 GLU A 29 17.501 -10.522 -1.294 1.00 0.00 O ATOM 0 H GLU A 29 14.489 -10.709 2.609 1.00 0.00 H new ATOM 0 HA GLU A 29 12.595 -9.775 0.941 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.402 -9.620 -0.713 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.700 -8.841 0.829 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.205 -10.606 1.516 1.00 0.00 H new ATOM 0 HG3 GLU A 29 15.778 -11.587 0.129 1.00 0.00 H new ATOM 478 N ARG A 30 11.938 -11.423 -0.576 1.00 0.00 N ATOM 479 CA ARG A 30 11.339 -12.396 -1.406 1.00 0.00 C ATOM 480 C ARG A 30 11.863 -12.249 -2.796 1.00 0.00 C ATOM 481 O ARG A 30 11.987 -13.209 -3.544 1.00 0.00 O ATOM 482 CB ARG A 30 9.821 -12.311 -1.374 1.00 0.00 C ATOM 483 CG ARG A 30 9.200 -12.655 -0.016 1.00 0.00 C ATOM 484 CD ARG A 30 9.516 -14.094 0.464 1.00 0.00 C ATOM 485 NE ARG A 30 10.938 -14.319 0.813 1.00 0.00 N ATOM 486 CZ ARG A 30 11.457 -15.484 1.243 1.00 0.00 C ATOM 487 NH1 ARG A 30 10.672 -16.531 1.463 1.00 0.00 N ATOM 488 NH2 ARG A 30 12.768 -15.592 1.438 1.00 0.00 N ATOM 0 H ARG A 30 11.473 -10.515 -0.593 1.00 0.00 H new ATOM 0 HA ARG A 30 11.600 -13.384 -1.028 1.00 0.00 H new ATOM 0 HB2 ARG A 30 9.519 -11.302 -1.653 1.00 0.00 H new ATOM 0 HB3 ARG A 30 9.415 -12.985 -2.128 1.00 0.00 H new ATOM 0 HG2 ARG A 30 9.560 -11.945 0.729 1.00 0.00 H new ATOM 0 HG3 ARG A 30 8.119 -12.531 -0.078 1.00 0.00 H new ATOM 0 HD2 ARG A 30 8.900 -14.318 1.335 1.00 0.00 H new ATOM 0 HD3 ARG A 30 9.230 -14.797 -0.318 1.00 0.00 H new ATOM 0 HE ARG A 30 11.575 -13.528 0.720 1.00 0.00 H new ATOM 0 HH11 ARG A 30 9.667 -16.457 1.306 1.00 0.00 H new ATOM 0 HH12 ARG A 30 11.074 -17.410 1.789 1.00 0.00 H new ATOM 0 HH21 ARG A 30 13.377 -14.793 1.262 1.00 0.00 H new ATOM 0 HH22 ARG A 30 13.164 -16.474 1.764 1.00 0.00 H new ATOM 502 N GLY A 31 12.199 -11.039 -3.127 1.00 0.00 N ATOM 503 CA GLY A 31 12.731 -10.756 -4.389 1.00 0.00 C ATOM 504 C GLY A 31 12.642 -9.303 -4.685 1.00 0.00 C ATOM 505 O GLY A 31 12.584 -8.471 -3.777 1.00 0.00 O ATOM 0 H GLY A 31 12.104 -10.229 -2.514 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.772 -11.077 -4.430 1.00 0.00 H new ATOM 0 HA3 GLY A 31 12.193 -11.321 -5.150 1.00 0.00 H new ATOM 509 N LEU A 32 12.517 -9.030 -5.922 1.00 0.00 N ATOM 510 CA LEU A 32 12.529 -7.712 -6.491 1.00 0.00 C ATOM 511 C LEU A 32 11.336 -7.631 -7.378 1.00 0.00 C ATOM 512 O LEU A 32 10.716 -8.663 -7.670 1.00 0.00 O ATOM 513 CB LEU A 32 13.783 -7.467 -7.387 1.00 0.00 C ATOM 514 CG LEU A 32 15.188 -7.577 -6.773 1.00 0.00 C ATOM 515 CD1 LEU A 32 15.321 -6.718 -5.541 1.00 0.00 C ATOM 516 CD2 LEU A 32 15.594 -9.028 -6.513 1.00 0.00 C ATOM 0 H LEU A 32 12.394 -9.758 -6.625 1.00 0.00 H new ATOM 0 HA LEU A 32 12.535 -6.977 -5.686 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.734 -8.172 -8.217 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.690 -6.468 -7.812 1.00 0.00 H new ATOM 0 HG LEU A 32 15.891 -7.191 -7.511 1.00 0.00 H new ATOM 0 HD11 LEU A 32 16.327 -6.820 -5.133 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.140 -5.676 -5.803 1.00 0.00 H new ATOM 0 HD13 LEU A 32 14.593 -7.036 -4.795 1.00 0.00 H new ATOM 0 HD21 LEU A 32 16.594 -9.054 -6.079 1.00 0.00 H new ATOM 0 HD22 LEU A 32 14.886 -9.486 -5.822 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.592 -9.580 -7.453 1.00 0.00 H new ATOM 528 N GLY A 33 10.972 -6.467 -7.762 1.00 0.00 N ATOM 529 CA GLY A 33 9.924 -6.339 -8.702 1.00 0.00 C ATOM 530 C GLY A 33 9.364 -4.973 -8.726 1.00 0.00 C ATOM 531 O GLY A 33 9.620 -4.187 -7.847 1.00 0.00 O ATOM 0 H GLY A 33 11.382 -5.590 -7.442 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.294 -6.596 -9.694 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.134 -7.050 -8.462 1.00 0.00 H new ATOM 535 N ASN A 34 8.610 -4.701 -9.717 1.00 0.00 N ATOM 536 CA ASN A 34 7.955 -3.469 -9.883 1.00 0.00 C ATOM 537 C ASN A 34 6.709 -3.532 -9.159 1.00 0.00 C ATOM 538 O ASN A 34 5.868 -4.438 -9.346 1.00 0.00 O ATOM 539 CB ASN A 34 7.710 -3.210 -11.316 1.00 0.00 C ATOM 540 CG ASN A 34 6.925 -1.978 -11.578 1.00 0.00 C ATOM 541 OD1 ASN A 34 7.476 -0.915 -11.744 1.00 0.00 O ATOM 542 ND2 ASN A 34 5.640 -2.128 -11.672 1.00 0.00 N ATOM 0 H ASN A 34 8.424 -5.364 -10.470 1.00 0.00 H new ATOM 0 HA ASN A 34 8.571 -2.655 -9.500 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.668 -3.135 -11.831 1.00 0.00 H new ATOM 0 HB3 ASN A 34 7.184 -4.063 -11.745 1.00 0.00 H new ATOM 0 HD21 ASN A 34 5.048 -1.328 -11.895 1.00 0.00 H new ATOM 0 HD22 ASN A 34 5.221 -3.046 -11.523 1.00 0.00 H new ATOM 549 N LEU A 35 6.609 -2.631 -8.326 1.00 0.00 N ATOM 550 CA LEU A 35 5.529 -2.482 -7.522 1.00 0.00 C ATOM 551 C LEU A 35 4.545 -1.645 -8.252 1.00 0.00 C ATOM 552 O LEU A 35 4.840 -0.526 -8.654 1.00 0.00 O ATOM 553 CB LEU A 35 5.949 -1.882 -6.155 1.00 0.00 C ATOM 554 CG LEU A 35 4.933 -1.805 -4.985 1.00 0.00 C ATOM 555 CD1 LEU A 35 5.642 -1.311 -3.737 1.00 0.00 C ATOM 556 CD2 LEU A 35 3.783 -0.866 -5.279 1.00 0.00 C ATOM 0 H LEU A 35 7.331 -1.927 -8.176 1.00 0.00 H new ATOM 0 HA LEU A 35 5.067 -3.441 -7.289 1.00 0.00 H new ATOM 0 HB2 LEU A 35 6.805 -2.456 -5.801 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.301 -0.868 -6.343 1.00 0.00 H new ATOM 0 HG LEU A 35 4.528 -2.807 -4.844 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.931 -1.256 -2.913 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.445 -2.001 -3.478 1.00 0.00 H new ATOM 0 HD13 LEU A 35 6.059 -0.321 -3.923 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.101 -0.849 -4.429 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.169 0.138 -5.455 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.250 -1.210 -6.165 1.00 0.00 H new ATOM 568 N LYS A 36 3.422 -2.204 -8.463 1.00 0.00 N ATOM 569 CA LYS A 36 2.367 -1.521 -9.050 1.00 0.00 C ATOM 570 C LYS A 36 1.367 -1.194 -7.995 1.00 0.00 C ATOM 571 O LYS A 36 1.066 -2.021 -7.124 1.00 0.00 O ATOM 572 CB LYS A 36 1.696 -2.313 -10.181 1.00 0.00 C ATOM 573 CG LYS A 36 2.584 -2.538 -11.383 1.00 0.00 C ATOM 574 CD LYS A 36 1.879 -3.277 -12.512 1.00 0.00 C ATOM 575 CE LYS A 36 1.498 -4.700 -12.134 1.00 0.00 C ATOM 576 NZ LYS A 36 0.883 -5.418 -13.264 1.00 0.00 N ATOM 0 H LYS A 36 3.215 -3.173 -8.223 1.00 0.00 H new ATOM 0 HA LYS A 36 2.767 -0.614 -9.504 1.00 0.00 H new ATOM 0 HB2 LYS A 36 1.375 -3.280 -9.793 1.00 0.00 H new ATOM 0 HB3 LYS A 36 0.798 -1.783 -10.499 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.938 -1.575 -11.752 1.00 0.00 H new ATOM 0 HG3 LYS A 36 3.463 -3.106 -11.078 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.981 -2.728 -12.795 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.528 -3.299 -13.387 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.385 -5.238 -11.801 1.00 0.00 H new ATOM 0 HE3 LYS A 36 0.803 -4.680 -11.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.637 -6.384 -12.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.022 -4.918 -13.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.555 -5.459 -14.056 1.00 0.00 H new ATOM 590 N ILE A 37 0.846 -0.040 -8.068 1.00 0.00 N ATOM 591 CA ILE A 37 -0.157 0.361 -7.175 1.00 0.00 C ATOM 592 C ILE A 37 -1.388 0.430 -7.920 1.00 0.00 C ATOM 593 O ILE A 37 -1.476 1.139 -8.938 1.00 0.00 O ATOM 594 CB ILE A 37 0.125 1.753 -6.599 1.00 0.00 C ATOM 595 CG1 ILE A 37 1.255 1.667 -5.609 1.00 0.00 C ATOM 596 CG2 ILE A 37 -1.143 2.373 -5.958 1.00 0.00 C ATOM 597 CD1 ILE A 37 0.859 1.092 -4.273 1.00 0.00 C ATOM 0 H ILE A 37 1.107 0.664 -8.759 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.205 -0.349 -6.350 1.00 0.00 H new ATOM 0 HB ILE A 37 0.419 2.415 -7.413 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.051 1.056 -6.034 1.00 0.00 H new ATOM 0 HG13 ILE A 37 1.667 2.665 -5.456 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.904 3.359 -5.560 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -1.924 2.465 -6.713 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.493 1.731 -5.150 1.00 0.00 H new ATOM 0 HD11 ILE A 37 1.729 1.064 -3.617 1.00 0.00 H new ATOM 0 HD12 ILE A 37 0.085 1.715 -3.824 1.00 0.00 H new ATOM 0 HD13 ILE A 37 0.476 0.081 -4.411 1.00 0.00 H new ATOM 609 N LEU A 38 -2.326 -0.297 -7.462 1.00 0.00 N ATOM 610 CA LEU A 38 -3.573 -0.238 -8.061 1.00 0.00 C ATOM 611 C LEU A 38 -4.498 0.432 -7.086 1.00 0.00 C ATOM 612 O LEU A 38 -4.517 0.121 -5.898 1.00 0.00 O ATOM 613 CB LEU A 38 -4.045 -1.648 -8.395 1.00 0.00 C ATOM 614 CG LEU A 38 -3.157 -2.453 -9.362 1.00 0.00 C ATOM 615 CD1 LEU A 38 -3.590 -3.906 -9.431 1.00 0.00 C ATOM 616 CD2 LEU A 38 -3.215 -1.854 -10.736 1.00 0.00 C ATOM 0 H LEU A 38 -2.244 -0.938 -6.673 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.546 0.326 -8.993 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.133 -2.209 -7.464 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.045 -1.582 -8.824 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.136 -2.413 -8.984 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.943 -4.446 -10.122 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.518 -4.355 -8.440 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.621 -3.962 -9.780 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.583 -2.431 -11.411 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.243 -1.871 -11.097 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.860 -0.824 -10.699 1.00 0.00 H new ATOM 628 N LYS A 39 -5.205 1.366 -7.574 1.00 0.00 N ATOM 629 CA LYS A 39 -6.190 2.077 -6.812 1.00 0.00 C ATOM 630 C LYS A 39 -7.497 1.896 -7.512 1.00 0.00 C ATOM 631 O LYS A 39 -7.580 2.170 -8.719 1.00 0.00 O ATOM 632 CB LYS A 39 -5.850 3.580 -6.776 1.00 0.00 C ATOM 633 CG LYS A 39 -4.497 3.928 -6.163 1.00 0.00 C ATOM 634 CD LYS A 39 -4.161 5.395 -6.402 1.00 0.00 C ATOM 635 CE LYS A 39 -2.754 5.766 -5.925 1.00 0.00 C ATOM 636 NZ LYS A 39 -2.625 5.854 -4.453 1.00 0.00 N ATOM 0 H LYS A 39 -5.127 1.681 -8.541 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.224 1.702 -5.789 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.879 3.967 -7.795 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.628 4.098 -6.216 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.513 3.723 -5.093 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -3.722 3.296 -6.597 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.249 5.615 -7.466 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -4.891 6.019 -5.886 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.047 5.025 -6.298 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.473 6.724 -6.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -1.633 5.702 -4.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -2.931 6.795 -4.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.221 5.127 -4.008 1.00 0.00 H new ATOM 650 N ASN A 40 -8.484 1.367 -6.822 1.00 0.00 N ATOM 651 CA ASN A 40 -9.808 1.252 -7.417 1.00 0.00 C ATOM 652 C ASN A 40 -10.415 2.606 -7.680 1.00 0.00 C ATOM 653 O ASN A 40 -10.240 3.531 -6.902 1.00 0.00 O ATOM 654 CB ASN A 40 -10.769 0.404 -6.571 1.00 0.00 C ATOM 655 CG ASN A 40 -10.564 -1.084 -6.769 1.00 0.00 C ATOM 656 OD1 ASN A 40 -9.788 -1.725 -6.085 1.00 0.00 O ATOM 657 ND2 ASN A 40 -11.295 -1.634 -7.689 1.00 0.00 N ATOM 0 H ASN A 40 -8.404 1.015 -5.868 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.664 0.737 -8.367 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -10.632 0.649 -5.518 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -11.797 0.662 -6.827 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.231 -2.638 -7.859 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.934 -1.063 -8.242 1.00 0.00 H new ATOM 664 N GLU A 41 -11.136 2.714 -8.774 1.00 0.00 N ATOM 665 CA GLU A 41 -11.813 3.861 -9.190 1.00 0.00 C ATOM 666 C GLU A 41 -13.002 4.112 -8.276 1.00 0.00 C ATOM 667 O GLU A 41 -13.469 5.235 -8.114 1.00 0.00 O ATOM 668 CB GLU A 41 -12.255 3.555 -10.583 1.00 0.00 C ATOM 669 CG GLU A 41 -11.140 3.563 -11.610 1.00 0.00 C ATOM 670 CD GLU A 41 -10.651 4.959 -11.948 1.00 0.00 C ATOM 671 OE1 GLU A 41 -10.202 5.694 -11.054 1.00 0.00 O ATOM 672 OE2 GLU A 41 -10.661 5.335 -13.145 1.00 0.00 O ATOM 0 H GLU A 41 -11.255 1.934 -9.421 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.196 4.759 -9.155 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.734 2.576 -10.592 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.011 4.282 -10.879 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -10.304 2.973 -11.234 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.490 3.077 -12.521 1.00 0.00 H new ATOM 679 N VAL A 42 -13.446 3.052 -7.651 1.00 0.00 N ATOM 680 CA VAL A 42 -14.483 3.063 -6.705 1.00 0.00 C ATOM 681 C VAL A 42 -13.925 3.576 -5.375 1.00 0.00 C ATOM 682 O VAL A 42 -14.656 4.091 -4.519 1.00 0.00 O ATOM 683 CB VAL A 42 -14.943 1.600 -6.589 1.00 0.00 C ATOM 684 CG1 VAL A 42 -15.531 1.290 -5.268 1.00 0.00 C ATOM 685 CG2 VAL A 42 -15.909 1.243 -7.700 1.00 0.00 C ATOM 0 H VAL A 42 -13.061 2.121 -7.811 1.00 0.00 H new ATOM 0 HA VAL A 42 -15.315 3.709 -6.985 1.00 0.00 H new ATOM 0 HB VAL A 42 -14.049 0.985 -6.692 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.838 0.244 -5.243 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -14.790 1.470 -4.489 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -16.399 1.927 -5.097 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -16.218 0.203 -7.593 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -16.785 1.889 -7.642 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -15.420 1.379 -8.665 1.00 0.00 H new ATOM 695 N ASN A 43 -12.603 3.474 -5.271 1.00 0.00 N ATOM 696 CA ASN A 43 -11.830 3.787 -4.085 1.00 0.00 C ATOM 697 C ASN A 43 -12.290 2.849 -2.977 1.00 0.00 C ATOM 698 O ASN A 43 -12.365 3.186 -1.798 1.00 0.00 O ATOM 699 CB ASN A 43 -11.981 5.279 -3.749 1.00 0.00 C ATOM 700 CG ASN A 43 -11.197 5.744 -2.511 1.00 0.00 C ATOM 701 OD1 ASN A 43 -10.176 5.165 -2.163 1.00 0.00 O ATOM 702 ND2 ASN A 43 -11.650 6.799 -1.865 1.00 0.00 N ATOM 0 H ASN A 43 -12.022 3.157 -6.047 1.00 0.00 H new ATOM 0 HA ASN A 43 -10.762 3.628 -4.232 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.656 5.865 -4.609 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -13.038 5.497 -3.595 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -11.147 7.154 -1.052 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.504 7.261 -2.178 1.00 0.00 H new ATOM 709 N GLY A 44 -12.563 1.624 -3.393 1.00 0.00 N ATOM 710 CA GLY A 44 -13.030 0.632 -2.463 1.00 0.00 C ATOM 711 C GLY A 44 -11.877 0.008 -1.759 1.00 0.00 C ATOM 712 O GLY A 44 -11.801 0.016 -0.532 1.00 0.00 O ATOM 0 H GLY A 44 -12.469 1.303 -4.357 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -13.704 1.090 -1.739 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.601 -0.132 -2.991 1.00 0.00 H new ATOM 716 N LYS A 45 -10.980 -0.527 -2.526 1.00 0.00 N ATOM 717 CA LYS A 45 -9.765 -1.078 -2.013 1.00 0.00 C ATOM 718 C LYS A 45 -8.615 -0.464 -2.760 1.00 0.00 C ATOM 719 O LYS A 45 -8.751 -0.101 -3.938 1.00 0.00 O ATOM 720 CB LYS A 45 -9.688 -2.610 -2.171 1.00 0.00 C ATOM 721 CG LYS A 45 -10.661 -3.453 -1.343 1.00 0.00 C ATOM 722 CD LYS A 45 -12.070 -3.472 -1.904 1.00 0.00 C ATOM 723 CE LYS A 45 -12.970 -4.367 -1.072 1.00 0.00 C ATOM 724 NZ LYS A 45 -13.179 -3.849 0.291 1.00 0.00 N ATOM 0 H LYS A 45 -11.072 -0.594 -3.540 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.726 -0.856 -0.947 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.846 -2.849 -3.223 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.674 -2.924 -1.922 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -10.287 -4.475 -1.286 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -10.689 -3.067 -0.324 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -12.473 -2.459 -1.922 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -12.051 -3.825 -2.935 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -13.934 -4.470 -1.570 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -12.533 -5.364 -1.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -13.928 -4.398 0.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.296 -3.934 0.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -13.461 -2.849 0.243 1.00 0.00 H new ATOM 738 N LEU A 46 -7.518 -0.283 -2.095 1.00 0.00 N ATOM 739 CA LEU A 46 -6.359 0.158 -2.705 1.00 0.00 C ATOM 740 C LEU A 46 -5.336 -0.894 -2.465 1.00 0.00 C ATOM 741 O LEU A 46 -5.371 -1.570 -1.452 1.00 0.00 O ATOM 742 CB LEU A 46 -5.848 1.429 -2.112 1.00 0.00 C ATOM 743 CG LEU A 46 -6.800 2.650 -1.967 1.00 0.00 C ATOM 744 CD1 LEU A 46 -7.527 2.964 -3.268 1.00 0.00 C ATOM 745 CD2 LEU A 46 -7.770 2.513 -0.788 1.00 0.00 C ATOM 0 H LEU A 46 -7.428 -0.448 -1.093 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.561 0.343 -3.760 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.466 1.194 -1.118 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.997 1.749 -2.713 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.163 3.505 -1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.181 3.824 -3.121 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -6.798 3.191 -4.046 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -8.123 2.102 -3.569 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -8.409 3.395 -0.738 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -8.387 1.625 -0.926 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.205 2.421 0.139 1.00 0.00 H new ATOM 757 N ARG A 47 -4.428 -1.007 -3.341 1.00 0.00 N ATOM 758 CA ARG A 47 -3.440 -2.088 -3.281 1.00 0.00 C ATOM 759 C ARG A 47 -2.090 -1.642 -3.754 1.00 0.00 C ATOM 760 O ARG A 47 -1.944 -0.718 -4.550 1.00 0.00 O ATOM 761 CB ARG A 47 -3.817 -3.240 -4.216 1.00 0.00 C ATOM 762 CG ARG A 47 -5.085 -2.982 -5.061 1.00 0.00 C ATOM 763 CD ARG A 47 -5.362 -4.048 -6.116 1.00 0.00 C ATOM 764 NE ARG A 47 -5.447 -5.390 -5.582 1.00 0.00 N ATOM 765 CZ ARG A 47 -6.383 -6.292 -5.901 1.00 0.00 C ATOM 766 NH1 ARG A 47 -7.353 -6.007 -6.773 1.00 0.00 N ATOM 767 NH2 ARG A 47 -6.328 -7.499 -5.356 1.00 0.00 N ATOM 0 H ARG A 47 -4.316 -0.374 -4.133 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.419 -2.394 -2.235 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -2.981 -3.437 -4.887 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -3.967 -4.141 -3.621 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -5.945 -2.915 -4.394 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.988 -2.015 -5.555 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.296 -3.809 -6.624 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.573 -4.015 -6.868 1.00 0.00 H new ATOM 0 HE ARG A 47 -4.736 -5.672 -4.907 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -7.391 -5.087 -7.211 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.056 -6.710 -7.001 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -5.579 -7.730 -4.703 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.034 -8.197 -5.590 1.00 0.00 H new ATOM 781 N MET A 48 -1.154 -2.338 -3.267 1.00 0.00 N ATOM 782 CA MET A 48 0.198 -2.318 -3.626 1.00 0.00 C ATOM 783 C MET A 48 0.522 -3.759 -3.931 1.00 0.00 C ATOM 784 O MET A 48 0.391 -4.616 -3.065 1.00 0.00 O ATOM 785 CB MET A 48 1.059 -1.919 -2.397 1.00 0.00 C ATOM 786 CG MET A 48 0.587 -0.684 -1.628 1.00 0.00 C ATOM 787 SD MET A 48 1.694 -0.179 -0.294 1.00 0.00 S ATOM 788 CE MET A 48 3.266 -0.176 -1.129 1.00 0.00 C ATOM 0 H MET A 48 -1.335 -3.012 -2.523 1.00 0.00 H new ATOM 0 HA MET A 48 0.389 -1.626 -4.447 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.089 -2.763 -1.708 1.00 0.00 H new ATOM 0 HB3 MET A 48 2.081 -1.746 -2.734 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.475 0.145 -2.327 1.00 0.00 H new ATOM 0 HG3 MET A 48 -0.400 -0.884 -1.211 1.00 0.00 H new ATOM 0 HE1 MET A 48 4.029 0.235 -0.468 1.00 0.00 H new ATOM 0 HE2 MET A 48 3.535 -1.196 -1.402 1.00 0.00 H new ATOM 0 HE3 MET A 48 3.199 0.435 -2.029 1.00 0.00 H new ATOM 798 N LEU A 49 0.897 -4.032 -5.110 1.00 0.00 N ATOM 799 CA LEU A 49 1.378 -5.357 -5.448 1.00 0.00 C ATOM 800 C LEU A 49 2.647 -5.316 -6.203 1.00 0.00 C ATOM 801 O LEU A 49 2.934 -4.371 -6.924 1.00 0.00 O ATOM 802 CB LEU A 49 0.365 -6.246 -6.143 1.00 0.00 C ATOM 803 CG LEU A 49 -0.296 -5.774 -7.469 1.00 0.00 C ATOM 804 CD1 LEU A 49 0.635 -5.882 -8.672 1.00 0.00 C ATOM 805 CD2 LEU A 49 -1.585 -6.542 -7.716 1.00 0.00 C ATOM 0 H LEU A 49 0.891 -3.368 -5.885 1.00 0.00 H new ATOM 0 HA LEU A 49 1.563 -5.824 -4.481 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.853 -7.199 -6.344 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.437 -6.443 -5.432 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.522 -4.714 -7.350 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.115 -5.538 -9.566 1.00 0.00 H new ATOM 0 HD12 LEU A 49 1.518 -5.265 -8.505 1.00 0.00 H new ATOM 0 HD13 LEU A 49 0.938 -6.920 -8.806 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.038 -6.202 -8.647 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.366 -7.607 -7.786 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.276 -6.368 -6.891 1.00 0.00 H new ATOM 817 N MET A 50 3.394 -6.330 -6.058 1.00 0.00 N ATOM 818 CA MET A 50 4.598 -6.447 -6.610 1.00 0.00 C ATOM 819 C MET A 50 4.691 -7.760 -7.250 1.00 0.00 C ATOM 820 O MET A 50 4.435 -8.812 -6.668 1.00 0.00 O ATOM 821 CB MET A 50 5.670 -6.307 -5.598 1.00 0.00 C ATOM 822 CG MET A 50 5.359 -6.994 -4.271 1.00 0.00 C ATOM 823 SD MET A 50 4.433 -5.989 -3.085 1.00 0.00 S ATOM 824 CE MET A 50 5.638 -4.739 -2.674 1.00 0.00 C ATOM 0 H MET A 50 3.124 -7.141 -5.501 1.00 0.00 H new ATOM 0 HA MET A 50 4.729 -5.653 -7.345 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.594 -6.720 -6.002 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.848 -5.247 -5.415 1.00 0.00 H new ATOM 0 HG2 MET A 50 4.792 -7.903 -4.474 1.00 0.00 H new ATOM 0 HG3 MET A 50 6.298 -7.300 -3.809 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.289 -4.165 -1.816 1.00 0.00 H new ATOM 0 HE2 MET A 50 6.588 -5.215 -2.430 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.775 -4.072 -3.525 1.00 0.00 H new ATOM 834 N ARG A 51 5.008 -7.650 -8.388 1.00 0.00 N ATOM 835 CA ARG A 51 5.276 -8.707 -9.323 1.00 0.00 C ATOM 836 C ARG A 51 6.717 -8.626 -9.611 1.00 0.00 C ATOM 837 O ARG A 51 7.271 -7.536 -9.743 1.00 0.00 O ATOM 838 CB ARG A 51 4.441 -8.469 -10.579 1.00 0.00 C ATOM 839 CG ARG A 51 4.421 -9.472 -11.734 1.00 0.00 C ATOM 840 CD ARG A 51 5.541 -9.264 -12.735 1.00 0.00 C ATOM 841 NE ARG A 51 5.601 -7.937 -13.323 1.00 0.00 N ATOM 842 CZ ARG A 51 5.017 -7.559 -14.464 1.00 0.00 C ATOM 843 NH1 ARG A 51 4.080 -8.314 -15.047 1.00 0.00 N ATOM 844 NH2 ARG A 51 5.357 -6.402 -14.996 1.00 0.00 N ATOM 0 H ARG A 51 5.121 -6.731 -8.815 1.00 0.00 H new ATOM 0 HA ARG A 51 5.020 -9.695 -8.940 1.00 0.00 H new ATOM 0 HB2 ARG A 51 3.409 -8.343 -10.253 1.00 0.00 H new ATOM 0 HB3 ARG A 51 4.762 -7.514 -10.995 1.00 0.00 H new ATOM 0 HG2 ARG A 51 4.489 -10.482 -11.329 1.00 0.00 H new ATOM 0 HG3 ARG A 51 3.464 -9.400 -12.251 1.00 0.00 H new ATOM 0 HD2 ARG A 51 6.491 -9.470 -12.242 1.00 0.00 H new ATOM 0 HD3 ARG A 51 5.432 -9.995 -13.536 1.00 0.00 H new ATOM 0 HE ARG A 51 6.137 -7.230 -12.820 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.799 -9.197 -14.621 1.00 0.00 H new ATOM 0 HH12 ARG A 51 3.647 -8.007 -15.918 1.00 0.00 H new ATOM 0 HH21 ARG A 51 6.053 -5.815 -14.537 1.00 0.00 H new ATOM 0 HH22 ARG A 51 4.924 -6.094 -15.867 1.00 0.00 H new ATOM 858 N ARG A 52 7.309 -9.742 -9.718 1.00 0.00 N ATOM 859 CA ARG A 52 8.659 -9.826 -9.966 1.00 0.00 C ATOM 860 C ARG A 52 8.746 -9.700 -11.419 1.00 0.00 C ATOM 861 O ARG A 52 8.176 -10.481 -12.134 1.00 0.00 O ATOM 862 CB ARG A 52 9.179 -11.150 -9.436 1.00 0.00 C ATOM 863 CG ARG A 52 8.999 -11.368 -7.941 1.00 0.00 C ATOM 864 CD ARG A 52 9.697 -12.647 -7.497 1.00 0.00 C ATOM 865 NE ARG A 52 9.313 -13.076 -6.150 1.00 0.00 N ATOM 866 CZ ARG A 52 9.765 -14.189 -5.550 1.00 0.00 C ATOM 867 NH1 ARG A 52 10.793 -14.852 -6.065 1.00 0.00 N ATOM 868 NH2 ARG A 52 9.200 -14.635 -4.434 1.00 0.00 N ATOM 0 H ARG A 52 6.841 -10.644 -9.631 1.00 0.00 H new ATOM 0 HA ARG A 52 9.268 -9.065 -9.478 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.676 -11.958 -9.967 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.240 -11.225 -9.672 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.404 -10.517 -7.393 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.937 -11.425 -7.702 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.467 -13.443 -8.205 1.00 0.00 H new ATOM 0 HD3 ARG A 52 10.776 -12.494 -7.529 1.00 0.00 H new ATOM 0 HE ARG A 52 8.658 -12.490 -5.633 1.00 0.00 H new ATOM 0 HH11 ARG A 52 11.241 -14.516 -6.918 1.00 0.00 H new ATOM 0 HH12 ARG A 52 11.135 -15.697 -5.608 1.00 0.00 H new ATOM 0 HH21 ARG A 52 8.414 -14.131 -4.024 1.00 0.00 H new ATOM 0 HH22 ARG A 52 9.552 -15.482 -3.987 1.00 0.00 H new ATOM 882 N GLU A 53 9.457 -8.726 -11.821 1.00 0.00 N ATOM 883 CA GLU A 53 9.523 -8.259 -13.211 1.00 0.00 C ATOM 884 C GLU A 53 9.850 -9.267 -14.181 1.00 0.00 C ATOM 885 O GLU A 53 9.023 -9.581 -15.049 1.00 0.00 O ATOM 886 CB GLU A 53 10.358 -7.001 -13.362 1.00 0.00 C ATOM 887 CG GLU A 53 9.681 -5.765 -12.843 1.00 0.00 C ATOM 888 CD GLU A 53 8.377 -5.477 -13.556 1.00 0.00 C ATOM 889 OE1 GLU A 53 8.406 -4.849 -14.635 1.00 0.00 O ATOM 890 OE2 GLU A 53 7.298 -5.845 -13.032 1.00 0.00 O ATOM 0 H GLU A 53 10.048 -8.184 -11.191 1.00 0.00 H new ATOM 0 HA GLU A 53 8.494 -7.991 -13.453 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.303 -7.136 -12.835 1.00 0.00 H new ATOM 0 HB3 GLU A 53 10.598 -6.859 -14.416 1.00 0.00 H new ATOM 0 HG2 GLU A 53 9.491 -5.880 -11.776 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.350 -4.912 -12.958 1.00 0.00 H new ATOM 897 N GLN A 54 10.973 -9.817 -14.075 1.00 0.00 N ATOM 898 CA GLN A 54 11.323 -10.743 -15.056 1.00 0.00 C ATOM 899 C GLN A 54 10.711 -12.101 -14.738 1.00 0.00 C ATOM 900 O GLN A 54 10.560 -12.958 -15.607 1.00 0.00 O ATOM 901 CB GLN A 54 12.811 -10.787 -15.283 1.00 0.00 C ATOM 902 CG GLN A 54 13.385 -9.430 -15.644 1.00 0.00 C ATOM 903 CD GLN A 54 14.878 -9.446 -15.800 1.00 0.00 C ATOM 904 OE1 GLN A 54 15.467 -10.459 -16.191 1.00 0.00 O ATOM 905 NE2 GLN A 54 15.505 -8.350 -15.485 1.00 0.00 N ATOM 0 H GLN A 54 11.659 -9.652 -13.338 1.00 0.00 H new ATOM 0 HA GLN A 54 10.904 -10.422 -16.010 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.302 -11.157 -14.383 1.00 0.00 H new ATOM 0 HB3 GLN A 54 13.033 -11.495 -16.081 1.00 0.00 H new ATOM 0 HG2 GLN A 54 12.932 -9.086 -16.574 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.114 -8.710 -14.872 1.00 0.00 H new ATOM 0 HE21 GLN A 54 14.980 -7.536 -15.166 1.00 0.00 H new ATOM 0 HE22 GLN A 54 16.521 -8.305 -15.557 1.00 0.00 H new ATOM 914 N VAL A 55 10.299 -12.241 -13.501 1.00 0.00 N ATOM 915 CA VAL A 55 9.740 -13.444 -12.980 1.00 0.00 C ATOM 916 C VAL A 55 8.205 -13.531 -13.272 1.00 0.00 C ATOM 917 O VAL A 55 7.572 -14.574 -13.064 1.00 0.00 O ATOM 918 CB VAL A 55 10.028 -13.385 -11.453 1.00 0.00 C ATOM 919 CG1 VAL A 55 9.207 -14.373 -10.667 1.00 0.00 C ATOM 920 CG2 VAL A 55 11.505 -13.627 -11.187 1.00 0.00 C ATOM 0 H VAL A 55 10.350 -11.489 -12.814 1.00 0.00 H new ATOM 0 HA VAL A 55 10.173 -14.331 -13.442 1.00 0.00 H new ATOM 0 HB VAL A 55 9.746 -12.386 -11.119 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.450 -14.287 -9.608 1.00 0.00 H new ATOM 0 HG12 VAL A 55 8.147 -14.164 -10.814 1.00 0.00 H new ATOM 0 HG13 VAL A 55 9.429 -15.384 -11.009 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.693 -13.583 -10.114 1.00 0.00 H new ATOM 0 HG22 VAL A 55 11.787 -14.610 -11.565 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.096 -12.862 -11.691 1.00 0.00 H new ATOM 930 N LEU A 56 7.669 -12.453 -13.870 1.00 0.00 N ATOM 931 CA LEU A 56 6.313 -12.253 -14.297 1.00 0.00 C ATOM 932 C LEU A 56 5.242 -12.523 -13.191 1.00 0.00 C ATOM 933 O LEU A 56 4.036 -12.437 -13.420 1.00 0.00 O ATOM 934 CB LEU A 56 6.174 -13.270 -15.341 1.00 0.00 C ATOM 935 CG LEU A 56 4.823 -13.475 -15.871 1.00 0.00 C ATOM 936 CD1 LEU A 56 4.363 -12.330 -16.782 1.00 0.00 C ATOM 937 CD2 LEU A 56 4.605 -14.855 -16.448 1.00 0.00 C ATOM 0 H LEU A 56 8.245 -11.636 -14.076 1.00 0.00 H new ATOM 0 HA LEU A 56 6.144 -11.219 -14.597 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.830 -13.002 -16.169 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.534 -14.219 -14.944 1.00 0.00 H new ATOM 0 HG LEU A 56 4.154 -13.438 -15.011 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.356 -12.536 -17.145 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.362 -11.396 -16.220 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.043 -12.243 -17.629 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.584 -14.936 -16.822 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.305 -15.022 -17.266 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.768 -15.604 -15.673 1.00 0.00 H new ATOM 949 N LYS A 57 5.658 -12.671 -12.018 1.00 0.00 N ATOM 950 CA LYS A 57 4.711 -13.047 -11.008 1.00 0.00 C ATOM 951 C LYS A 57 4.596 -12.161 -9.733 1.00 0.00 C ATOM 952 O LYS A 57 5.506 -12.120 -8.900 1.00 0.00 O ATOM 953 CB LYS A 57 4.990 -14.472 -10.706 1.00 0.00 C ATOM 954 CG LYS A 57 3.930 -15.201 -9.914 1.00 0.00 C ATOM 955 CD LYS A 57 4.355 -16.639 -9.648 1.00 0.00 C ATOM 956 CE LYS A 57 3.221 -17.442 -9.054 1.00 0.00 C ATOM 957 NZ LYS A 57 2.115 -17.614 -10.022 1.00 0.00 N ATOM 0 H LYS A 57 6.621 -12.548 -11.707 1.00 0.00 H new ATOM 0 HA LYS A 57 3.715 -12.880 -11.418 1.00 0.00 H new ATOM 0 HB2 LYS A 57 5.139 -15.000 -11.648 1.00 0.00 H new ATOM 0 HB3 LYS A 57 5.930 -14.529 -10.156 1.00 0.00 H new ATOM 0 HG2 LYS A 57 3.756 -14.687 -8.969 1.00 0.00 H new ATOM 0 HG3 LYS A 57 2.987 -15.190 -10.461 1.00 0.00 H new ATOM 0 HD2 LYS A 57 4.684 -17.102 -10.578 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.207 -16.650 -8.968 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.589 -18.420 -8.743 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.849 -16.942 -8.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 1.263 -17.938 -9.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 1.918 -16.706 -10.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 2.386 -18.319 -10.737 1.00 0.00 H new ATOM 971 N VAL A 58 3.526 -11.357 -9.687 1.00 0.00 N ATOM 972 CA VAL A 58 2.948 -10.784 -8.450 1.00 0.00 C ATOM 973 C VAL A 58 2.942 -11.771 -7.288 1.00 0.00 C ATOM 974 O VAL A 58 2.372 -12.860 -7.357 1.00 0.00 O ATOM 975 CB VAL A 58 1.511 -10.219 -8.717 1.00 0.00 C ATOM 976 CG1 VAL A 58 0.564 -11.274 -9.291 1.00 0.00 C ATOM 977 CG2 VAL A 58 0.939 -9.600 -7.458 1.00 0.00 C ATOM 0 H VAL A 58 3.020 -11.076 -10.527 1.00 0.00 H new ATOM 0 HA VAL A 58 3.597 -9.960 -8.152 1.00 0.00 H new ATOM 0 HB VAL A 58 1.607 -9.442 -9.475 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.418 -10.830 -9.457 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.960 -11.643 -10.237 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.473 -12.102 -8.588 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.059 -9.213 -7.664 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.881 -10.356 -6.675 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.583 -8.785 -7.128 1.00 0.00 H new ATOM 987 N CYS A 59 3.600 -11.385 -6.237 1.00 0.00 N ATOM 988 CA CYS A 59 3.727 -12.215 -5.089 1.00 0.00 C ATOM 989 C CYS A 59 2.953 -11.674 -3.898 1.00 0.00 C ATOM 990 O CYS A 59 2.505 -12.454 -3.071 1.00 0.00 O ATOM 991 CB CYS A 59 5.195 -12.381 -4.729 1.00 0.00 C ATOM 992 SG CYS A 59 6.207 -13.035 -6.070 1.00 0.00 S ATOM 0 H CYS A 59 4.064 -10.480 -6.156 1.00 0.00 H new ATOM 0 HA CYS A 59 3.298 -13.186 -5.338 1.00 0.00 H new ATOM 0 HB2 CYS A 59 5.595 -11.414 -4.423 1.00 0.00 H new ATOM 0 HB3 CYS A 59 5.275 -13.046 -3.869 1.00 0.00 H new ATOM 0 HG CYS A 59 5.884 -12.447 -7.184 1.00 0.00 H new ATOM 998 N ALA A 60 2.717 -10.360 -3.838 1.00 0.00 N ATOM 999 CA ALA A 60 2.133 -9.797 -2.704 1.00 0.00 C ATOM 1000 C ALA A 60 1.231 -8.775 -3.138 1.00 0.00 C ATOM 1001 O ALA A 60 1.510 -8.073 -4.092 1.00 0.00 O ATOM 1002 CB ALA A 60 3.142 -9.147 -1.805 1.00 0.00 C ATOM 0 H ALA A 60 2.936 -9.698 -4.583 1.00 0.00 H new ATOM 0 HA ALA A 60 1.639 -10.595 -2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.637 -8.724 -0.937 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.868 -9.890 -1.476 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.656 -8.354 -2.348 1.00 0.00 H new ATOM 1008 N ASN A 61 0.154 -8.773 -2.526 1.00 0.00 N ATOM 1009 CA ASN A 61 -0.829 -7.751 -2.649 1.00 0.00 C ATOM 1010 C ASN A 61 -1.148 -7.193 -1.298 1.00 0.00 C ATOM 1011 O ASN A 61 -1.824 -7.813 -0.497 1.00 0.00 O ATOM 1012 CB ASN A 61 -2.070 -8.252 -3.302 1.00 0.00 C ATOM 1013 CG ASN A 61 -3.230 -7.247 -3.300 1.00 0.00 C ATOM 1014 OD1 ASN A 61 -3.395 -6.479 -4.229 1.00 0.00 O ATOM 1015 ND2 ASN A 61 -4.028 -7.240 -2.254 1.00 0.00 N ATOM 0 H ASN A 61 -0.114 -9.514 -1.878 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.419 -6.966 -3.284 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.841 -8.524 -4.332 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -2.392 -9.162 -2.796 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -4.805 -6.581 -2.210 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -3.869 -7.894 -1.487 1.00 0.00 H new ATOM 1022 N HIS A 62 -0.616 -6.095 -1.043 1.00 0.00 N ATOM 1023 CA HIS A 62 -0.876 -5.352 0.170 1.00 0.00 C ATOM 1024 C HIS A 62 -1.862 -4.203 -0.081 1.00 0.00 C ATOM 1025 O HIS A 62 -1.652 -3.384 -0.924 1.00 0.00 O ATOM 1026 CB HIS A 62 0.461 -4.837 0.763 1.00 0.00 C ATOM 1027 CG HIS A 62 0.366 -3.690 1.750 1.00 0.00 C ATOM 1028 ND1 HIS A 62 0.974 -2.498 1.528 1.00 0.00 N ATOM 1029 CD2 HIS A 62 -0.224 -3.572 2.960 1.00 0.00 C ATOM 1030 CE1 HIS A 62 0.776 -1.691 2.543 1.00 0.00 C ATOM 1031 NE2 HIS A 62 0.055 -2.321 3.427 1.00 0.00 N ATOM 0 H HIS A 62 0.044 -5.636 -1.671 1.00 0.00 H new ATOM 0 HA HIS A 62 -1.344 -6.016 0.896 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.959 -5.671 1.257 1.00 0.00 H new ATOM 0 HB3 HIS A 62 1.102 -4.525 -0.061 1.00 0.00 H new ATOM 0 HD1 HIS A 62 1.509 -2.263 0.692 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -0.808 -4.328 3.464 1.00 0.00 H new ATOM 0 HE1 HIS A 62 1.146 -0.680 2.631 1.00 0.00 H new ATOM 1039 N TRP A 63 -2.917 -4.178 0.671 1.00 0.00 N ATOM 1040 CA TRP A 63 -3.862 -3.084 0.666 1.00 0.00 C ATOM 1041 C TRP A 63 -3.310 -2.031 1.604 1.00 0.00 C ATOM 1042 O TRP A 63 -2.946 -2.340 2.743 1.00 0.00 O ATOM 1043 CB TRP A 63 -5.200 -3.523 1.280 1.00 0.00 C ATOM 1044 CG TRP A 63 -5.744 -4.850 0.820 1.00 0.00 C ATOM 1045 CD1 TRP A 63 -5.736 -6.012 1.536 1.00 0.00 C ATOM 1046 CD2 TRP A 63 -6.374 -5.162 -0.430 1.00 0.00 C ATOM 1047 NE1 TRP A 63 -6.332 -7.013 0.821 1.00 0.00 N ATOM 1048 CE2 TRP A 63 -6.728 -6.526 -0.386 1.00 0.00 C ATOM 1049 CE3 TRP A 63 -6.678 -4.432 -1.574 1.00 0.00 C ATOM 1050 CZ2 TRP A 63 -7.368 -7.166 -1.440 1.00 0.00 C ATOM 1051 CZ3 TRP A 63 -7.312 -5.071 -2.619 1.00 0.00 C ATOM 1052 CH2 TRP A 63 -7.651 -6.424 -2.543 1.00 0.00 C ATOM 0 H TRP A 63 -3.158 -4.926 1.321 1.00 0.00 H new ATOM 0 HA TRP A 63 -4.009 -2.737 -0.357 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.084 -3.558 2.363 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -5.943 -2.756 1.064 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -5.319 -6.124 2.526 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -6.460 -7.973 1.142 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -6.423 -3.385 -1.643 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.630 -8.212 -1.385 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -7.551 -4.515 -3.513 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -8.149 -6.891 -3.380 1.00 0.00 H new ATOM 1063 N ILE A 64 -3.252 -0.818 1.164 1.00 0.00 N ATOM 1064 CA ILE A 64 -2.722 0.218 1.947 1.00 0.00 C ATOM 1065 C ILE A 64 -3.881 0.872 2.697 1.00 0.00 C ATOM 1066 O ILE A 64 -4.791 1.450 2.094 1.00 0.00 O ATOM 1067 CB ILE A 64 -1.834 1.186 1.041 1.00 0.00 C ATOM 1068 CG1 ILE A 64 -1.442 2.513 1.727 1.00 0.00 C ATOM 1069 CG2 ILE A 64 -2.467 1.436 -0.334 1.00 0.00 C ATOM 1070 CD1 ILE A 64 -2.559 3.515 1.757 1.00 0.00 C ATOM 0 H ILE A 64 -3.577 -0.528 0.242 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.027 -0.137 2.708 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.901 0.644 0.890 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.121 2.306 2.748 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.588 2.946 1.206 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.826 2.100 -0.914 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.579 0.488 -0.861 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.446 1.897 -0.205 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -2.219 4.425 2.252 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.865 3.749 0.737 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.406 3.100 2.303 1.00 0.00 H new ATOM 1082 N THR A 65 -3.908 0.673 3.987 1.00 0.00 N ATOM 1083 CA THR A 65 -4.970 1.187 4.787 1.00 0.00 C ATOM 1084 C THR A 65 -4.499 1.668 6.125 1.00 0.00 C ATOM 1085 O THR A 65 -3.472 1.243 6.630 1.00 0.00 O ATOM 1086 CB THR A 65 -6.101 0.132 4.938 1.00 0.00 C ATOM 1087 OG1 THR A 65 -7.160 0.600 5.784 1.00 0.00 O ATOM 1088 CG2 THR A 65 -5.568 -1.204 5.445 1.00 0.00 C ATOM 0 H THR A 65 -3.198 0.154 4.503 1.00 0.00 H new ATOM 0 HA THR A 65 -5.372 2.057 4.267 1.00 0.00 H new ATOM 0 HB THR A 65 -6.511 -0.024 3.940 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.968 0.070 5.621 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.391 -1.913 5.536 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.831 -1.592 4.742 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.101 -1.063 6.420 1.00 0.00 H new ATOM 1096 N THR A 66 -5.304 2.521 6.700 1.00 0.00 N ATOM 1097 CA THR A 66 -5.117 3.075 8.025 1.00 0.00 C ATOM 1098 C THR A 66 -5.499 2.043 9.084 1.00 0.00 C ATOM 1099 O THR A 66 -5.312 2.244 10.286 1.00 0.00 O ATOM 1100 CB THR A 66 -6.008 4.280 8.178 1.00 0.00 C ATOM 1101 OG1 THR A 66 -6.805 4.450 6.973 1.00 0.00 O ATOM 1102 CG2 THR A 66 -5.211 5.521 8.484 1.00 0.00 C ATOM 0 H THR A 66 -6.147 2.867 6.242 1.00 0.00 H new ATOM 0 HA THR A 66 -4.071 3.353 8.154 1.00 0.00 H new ATOM 0 HB THR A 66 -6.675 4.116 9.024 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.293 4.960 6.311 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.886 6.371 8.588 1.00 0.00 H new ATOM 0 HG22 THR A 66 -4.660 5.380 9.414 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.509 5.712 7.672 1.00 0.00 H new ATOM 1110 N THR A 67 -6.004 0.927 8.603 1.00 0.00 N ATOM 1111 CA THR A 67 -6.445 -0.182 9.413 1.00 0.00 C ATOM 1112 C THR A 67 -5.214 -1.015 9.780 1.00 0.00 C ATOM 1113 O THR A 67 -5.240 -1.910 10.632 1.00 0.00 O ATOM 1114 CB THR A 67 -7.420 -1.018 8.547 1.00 0.00 C ATOM 1115 OG1 THR A 67 -8.472 -0.160 8.074 1.00 0.00 O ATOM 1116 CG2 THR A 67 -8.014 -2.184 9.311 1.00 0.00 C ATOM 0 H THR A 67 -6.122 0.764 7.603 1.00 0.00 H new ATOM 0 HA THR A 67 -6.943 0.144 10.326 1.00 0.00 H new ATOM 0 HB THR A 67 -6.858 -1.436 7.712 1.00 0.00 H new ATOM 0 HG1 THR A 67 -8.154 0.352 7.301 1.00 0.00 H new ATOM 0 HG21 THR A 67 -8.690 -2.739 8.660 1.00 0.00 H new ATOM 0 HG22 THR A 67 -7.214 -2.843 9.649 1.00 0.00 H new ATOM 0 HG23 THR A 67 -8.565 -1.811 10.174 1.00 0.00 H new ATOM 1124 N MET A 68 -4.140 -0.648 9.176 1.00 0.00 N ATOM 1125 CA MET A 68 -2.935 -1.235 9.307 1.00 0.00 C ATOM 1126 C MET A 68 -1.965 -0.133 9.600 1.00 0.00 C ATOM 1127 O MET A 68 -2.263 1.046 9.416 1.00 0.00 O ATOM 1128 CB MET A 68 -2.658 -1.930 8.001 1.00 0.00 C ATOM 1129 CG MET A 68 -1.275 -2.499 7.794 1.00 0.00 C ATOM 1130 SD MET A 68 -0.047 -1.299 7.191 1.00 0.00 S ATOM 1131 CE MET A 68 -0.912 -0.457 5.868 1.00 0.00 C ATOM 0 H MET A 68 -4.124 0.142 8.532 1.00 0.00 H new ATOM 0 HA MET A 68 -2.870 -1.973 10.106 1.00 0.00 H new ATOM 0 HB2 MET A 68 -3.376 -2.743 7.894 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.855 -1.223 7.195 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.923 -2.917 8.737 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.338 -3.323 7.084 1.00 0.00 H new ATOM 0 HE1 MET A 68 -0.215 -0.239 5.059 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.714 -1.094 5.495 1.00 0.00 H new ATOM 0 HE3 MET A 68 -1.334 0.475 6.244 1.00 0.00 H new ATOM 1141 N ASN A 69 -0.877 -0.521 10.035 1.00 0.00 N ATOM 1142 CA ASN A 69 0.182 0.324 10.460 1.00 0.00 C ATOM 1143 C ASN A 69 1.494 -0.230 9.957 1.00 0.00 C ATOM 1144 O ASN A 69 1.735 -1.439 10.035 1.00 0.00 O ATOM 1145 CB ASN A 69 0.184 0.305 11.965 1.00 0.00 C ATOM 1146 CG ASN A 69 1.381 0.977 12.610 1.00 0.00 C ATOM 1147 OD1 ASN A 69 1.390 2.185 12.839 1.00 0.00 O ATOM 1148 ND2 ASN A 69 2.371 0.195 12.963 1.00 0.00 N ATOM 0 H ASN A 69 -0.651 -1.512 10.124 1.00 0.00 H new ATOM 0 HA ASN A 69 0.053 1.337 10.078 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.724 0.792 12.321 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.143 -0.731 12.301 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.182 0.584 13.444 1.00 0.00 H new ATOM 0 HD22 ASN A 69 2.331 -0.803 12.757 1.00 0.00 H new ATOM 1155 N LEU A 70 2.307 0.621 9.433 1.00 0.00 N ATOM 1156 CA LEU A 70 3.563 0.319 9.022 1.00 0.00 C ATOM 1157 C LEU A 70 4.561 0.494 10.158 1.00 0.00 C ATOM 1158 O LEU A 70 4.535 1.443 10.942 1.00 0.00 O ATOM 1159 CB LEU A 70 3.879 1.021 7.717 1.00 0.00 C ATOM 1160 CG LEU A 70 3.512 2.482 7.544 1.00 0.00 C ATOM 1161 CD1 LEU A 70 4.137 3.306 8.610 1.00 0.00 C ATOM 1162 CD2 LEU A 70 3.989 2.884 6.186 1.00 0.00 C ATOM 0 H LEU A 70 2.060 1.600 9.287 1.00 0.00 H new ATOM 0 HA LEU A 70 3.645 -0.739 8.773 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.953 0.933 7.551 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.386 0.464 6.920 1.00 0.00 H new ATOM 0 HG LEU A 70 2.436 2.635 7.628 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.863 4.352 8.470 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.787 2.967 9.585 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.221 3.205 8.559 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.748 3.933 6.011 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.068 2.745 6.123 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.499 2.269 5.431 1.00 0.00 H new ATOM 1174 N LYS A 71 5.348 -0.453 10.253 1.00 0.00 N ATOM 1175 CA LYS A 71 6.271 -0.663 11.362 1.00 0.00 C ATOM 1176 C LYS A 71 7.703 -0.746 10.838 1.00 0.00 C ATOM 1177 O LYS A 71 7.940 -1.427 9.847 1.00 0.00 O ATOM 1178 CB LYS A 71 5.910 -2.008 12.033 1.00 0.00 C ATOM 1179 CG LYS A 71 6.714 -2.360 13.289 1.00 0.00 C ATOM 1180 CD LYS A 71 6.284 -1.555 14.514 1.00 0.00 C ATOM 1181 CE LYS A 71 4.875 -1.930 14.966 1.00 0.00 C ATOM 1182 NZ LYS A 71 4.481 -1.235 16.204 1.00 0.00 N ATOM 0 H LYS A 71 5.413 -1.181 9.541 1.00 0.00 H new ATOM 0 HA LYS A 71 6.196 0.162 12.070 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.852 -1.990 12.294 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.045 -2.805 11.302 1.00 0.00 H new ATOM 0 HG2 LYS A 71 6.601 -3.423 13.501 1.00 0.00 H new ATOM 0 HG3 LYS A 71 7.773 -2.184 13.098 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.987 -1.728 15.329 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.321 -0.491 14.282 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.166 -1.688 14.175 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.821 -3.007 15.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.518 -1.521 16.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.141 -1.485 16.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.506 -0.207 16.048 1.00 0.00 H new ATOM 1196 N PRO A 72 8.660 -0.058 11.458 1.00 0.00 N ATOM 1197 CA PRO A 72 10.053 -0.142 11.055 1.00 0.00 C ATOM 1198 C PRO A 72 10.747 -1.396 11.599 1.00 0.00 C ATOM 1199 O PRO A 72 10.638 -1.719 12.789 1.00 0.00 O ATOM 1200 CB PRO A 72 10.700 1.120 11.658 1.00 0.00 C ATOM 1201 CG PRO A 72 9.593 1.862 12.346 1.00 0.00 C ATOM 1202 CD PRO A 72 8.483 0.883 12.565 1.00 0.00 C ATOM 0 HA PRO A 72 10.145 -0.204 9.971 1.00 0.00 H new ATOM 0 HB2 PRO A 72 11.489 0.856 12.362 1.00 0.00 H new ATOM 0 HB3 PRO A 72 11.157 1.733 10.882 1.00 0.00 H new ATOM 0 HG2 PRO A 72 9.936 2.275 13.295 1.00 0.00 H new ATOM 0 HG3 PRO A 72 9.254 2.700 11.738 1.00 0.00 H new ATOM 0 HD2 PRO A 72 8.564 0.389 13.533 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.506 1.365 12.534 1.00 0.00 H new ATOM 1210 N LEU A 73 11.447 -2.092 10.729 1.00 0.00 N ATOM 1211 CA LEU A 73 12.202 -3.233 11.070 1.00 0.00 C ATOM 1212 C LEU A 73 13.607 -2.845 11.496 1.00 0.00 C ATOM 1213 O LEU A 73 13.951 -1.662 11.571 1.00 0.00 O ATOM 1214 CB LEU A 73 12.308 -4.156 9.859 1.00 0.00 C ATOM 1215 CG LEU A 73 12.255 -3.540 8.454 1.00 0.00 C ATOM 1216 CD1 LEU A 73 13.046 -4.392 7.479 1.00 0.00 C ATOM 1217 CD2 LEU A 73 10.825 -3.482 7.974 1.00 0.00 C ATOM 0 H LEU A 73 11.494 -1.855 9.738 1.00 0.00 H new ATOM 0 HA LEU A 73 11.699 -3.736 11.896 1.00 0.00 H new ATOM 0 HB2 LEU A 73 13.246 -4.705 9.944 1.00 0.00 H new ATOM 0 HB3 LEU A 73 11.503 -4.887 9.930 1.00 0.00 H new ATOM 0 HG LEU A 73 12.680 -2.537 8.503 1.00 0.00 H new ATOM 0 HD11 LEU A 73 13.001 -3.945 6.486 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.085 -4.449 7.805 1.00 0.00 H new ATOM 0 HD13 LEU A 73 12.621 -5.395 7.445 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.794 -3.044 6.976 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.411 -4.490 7.941 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.236 -2.870 8.658 1.00 0.00 H new ATOM 1229 N SER A 74 14.405 -3.841 11.766 1.00 0.00 N ATOM 1230 CA SER A 74 15.787 -3.649 12.056 1.00 0.00 C ATOM 1231 C SER A 74 16.569 -3.631 10.793 1.00 0.00 C ATOM 1232 O SER A 74 16.232 -4.349 9.836 1.00 0.00 O ATOM 1233 CB SER A 74 16.327 -4.795 12.861 1.00 0.00 C ATOM 1234 OG SER A 74 15.785 -4.837 14.177 1.00 0.00 O ATOM 0 H SER A 74 14.105 -4.816 11.789 1.00 0.00 H new ATOM 0 HA SER A 74 15.876 -2.711 12.604 1.00 0.00 H new ATOM 0 HB2 SER A 74 16.105 -5.731 12.349 1.00 0.00 H new ATOM 0 HB3 SER A 74 17.412 -4.714 12.920 1.00 0.00 H new ATOM 0 HG SER A 74 16.164 -5.599 14.663 1.00 0.00 H new ATOM 1240 N GLY A 75 17.577 -2.813 10.758 1.00 0.00 N ATOM 1241 CA GLY A 75 18.493 -2.878 9.678 1.00 0.00 C ATOM 1242 C GLY A 75 18.031 -2.146 8.422 1.00 0.00 C ATOM 1243 O GLY A 75 18.793 -1.987 7.463 1.00 0.00 O ATOM 0 H GLY A 75 17.779 -2.102 11.461 1.00 0.00 H new ATOM 0 HA2 GLY A 75 19.447 -2.459 9.999 1.00 0.00 H new ATOM 0 HA3 GLY A 75 18.672 -3.924 9.430 1.00 0.00 H new ATOM 1247 N SER A 76 16.809 -1.682 8.431 1.00 0.00 N ATOM 1248 CA SER A 76 16.240 -0.961 7.368 1.00 0.00 C ATOM 1249 C SER A 76 16.702 0.469 7.370 1.00 0.00 C ATOM 1250 O SER A 76 16.928 1.086 8.421 1.00 0.00 O ATOM 1251 CB SER A 76 14.752 -1.080 7.552 1.00 0.00 C ATOM 1252 OG SER A 76 14.392 -0.844 8.896 1.00 0.00 O ATOM 0 H SER A 76 16.174 -1.811 9.219 1.00 0.00 H new ATOM 0 HA SER A 76 16.545 -1.356 6.399 1.00 0.00 H new ATOM 0 HB2 SER A 76 14.243 -0.367 6.904 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.422 -2.075 7.252 1.00 0.00 H new ATOM 0 HG SER A 76 13.493 -0.456 8.931 1.00 0.00 H new ATOM 1258 N ASP A 77 16.867 0.970 6.191 1.00 0.00 N ATOM 1259 CA ASP A 77 17.241 2.305 5.952 1.00 0.00 C ATOM 1260 C ASP A 77 16.027 3.082 6.064 1.00 0.00 C ATOM 1261 O ASP A 77 15.972 4.092 6.766 1.00 0.00 O ATOM 1262 CB ASP A 77 17.864 2.518 4.558 1.00 0.00 C ATOM 1263 CG ASP A 77 17.260 1.703 3.401 1.00 0.00 C ATOM 1264 OD1 ASP A 77 16.197 1.033 3.582 1.00 0.00 O ATOM 1265 OD2 ASP A 77 17.873 1.679 2.310 1.00 0.00 O ATOM 0 H ASP A 77 16.737 0.428 5.337 1.00 0.00 H new ATOM 0 HA ASP A 77 18.006 2.603 6.669 1.00 0.00 H new ATOM 0 HB2 ASP A 77 17.784 3.576 4.307 1.00 0.00 H new ATOM 0 HB3 ASP A 77 18.927 2.284 4.621 1.00 0.00 H new ATOM 1270 N ARG A 78 15.031 2.569 5.392 1.00 0.00 N ATOM 1271 CA ARG A 78 13.727 3.090 5.453 1.00 0.00 C ATOM 1272 C ARG A 78 12.740 2.143 4.768 1.00 0.00 C ATOM 1273 O ARG A 78 11.874 2.512 3.954 1.00 0.00 O ATOM 1274 CB ARG A 78 13.623 4.529 4.984 1.00 0.00 C ATOM 1275 CG ARG A 78 12.453 5.268 5.642 1.00 0.00 C ATOM 1276 CD ARG A 78 12.675 5.528 7.125 1.00 0.00 C ATOM 1277 NE ARG A 78 13.621 6.627 7.365 1.00 0.00 N ATOM 1278 CZ ARG A 78 14.509 6.681 8.358 1.00 0.00 C ATOM 1279 NH1 ARG A 78 14.761 5.612 9.110 1.00 0.00 N ATOM 1280 NH2 ARG A 78 15.175 7.802 8.564 1.00 0.00 N ATOM 0 H ARG A 78 15.125 1.759 4.779 1.00 0.00 H new ATOM 0 HA ARG A 78 13.446 3.144 6.505 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.553 5.051 5.209 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.500 4.549 3.901 1.00 0.00 H new ATOM 0 HG2 ARG A 78 12.297 6.218 5.131 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.542 4.683 5.513 1.00 0.00 H new ATOM 0 HD2 ARG A 78 11.721 5.764 7.597 1.00 0.00 H new ATOM 0 HD3 ARG A 78 13.049 4.620 7.598 1.00 0.00 H new ATOM 0 HE ARG A 78 13.596 7.415 6.717 1.00 0.00 H new ATOM 0 HH11 ARG A 78 14.272 4.735 8.930 1.00 0.00 H new ATOM 0 HH12 ARG A 78 15.443 5.670 9.866 1.00 0.00 H new ATOM 0 HH21 ARG A 78 15.007 8.612 7.967 1.00 0.00 H new ATOM 0 HH22 ARG A 78 15.858 7.858 9.320 1.00 0.00 H new ATOM 1294 N ALA A 79 12.859 0.941 5.149 1.00 0.00 N ATOM 1295 CA ALA A 79 11.998 -0.102 4.727 1.00 0.00 C ATOM 1296 C ALA A 79 11.144 -0.409 5.930 1.00 0.00 C ATOM 1297 O ALA A 79 11.672 -0.527 7.031 1.00 0.00 O ATOM 1298 CB ALA A 79 12.818 -1.333 4.405 1.00 0.00 C ATOM 0 H ALA A 79 13.588 0.632 5.792 1.00 0.00 H new ATOM 0 HA ALA A 79 11.418 0.177 3.848 1.00 0.00 H new ATOM 0 HB1 ALA A 79 12.156 -2.136 4.080 1.00 0.00 H new ATOM 0 HB2 ALA A 79 13.525 -1.101 3.609 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.364 -1.650 5.294 1.00 0.00 H new ATOM 1304 N TRP A 80 9.864 -0.544 5.738 1.00 0.00 N ATOM 1305 CA TRP A 80 8.931 -0.734 6.811 1.00 0.00 C ATOM 1306 C TRP A 80 8.056 -1.875 6.415 1.00 0.00 C ATOM 1307 O TRP A 80 8.009 -2.235 5.208 1.00 0.00 O ATOM 1308 CB TRP A 80 8.090 0.546 7.162 1.00 0.00 C ATOM 1309 CG TRP A 80 8.898 1.731 7.708 1.00 0.00 C ATOM 1310 CD1 TRP A 80 10.159 1.701 8.218 1.00 0.00 C ATOM 1311 CD2 TRP A 80 8.469 3.099 7.843 1.00 0.00 C ATOM 1312 NE1 TRP A 80 10.544 2.940 8.633 1.00 0.00 N ATOM 1313 CE2 TRP A 80 9.532 3.816 8.425 1.00 0.00 C ATOM 1314 CE3 TRP A 80 7.309 3.784 7.529 1.00 0.00 C ATOM 1315 CZ2 TRP A 80 9.457 5.179 8.696 1.00 0.00 C ATOM 1316 CZ3 TRP A 80 7.232 5.140 7.798 1.00 0.00 C ATOM 1317 CH2 TRP A 80 8.302 5.821 8.377 1.00 0.00 C ATOM 0 H TRP A 80 9.431 -0.525 4.815 1.00 0.00 H new ATOM 0 HA TRP A 80 9.479 -0.946 7.729 1.00 0.00 H new ATOM 0 HB2 TRP A 80 7.561 0.870 6.266 1.00 0.00 H new ATOM 0 HB3 TRP A 80 7.333 0.273 7.898 1.00 0.00 H new ATOM 0 HD1 TRP A 80 10.772 0.814 8.285 1.00 0.00 H new ATOM 0 HE1 TRP A 80 11.452 3.172 9.037 1.00 0.00 H new ATOM 0 HE3 TRP A 80 6.474 3.268 7.080 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 10.286 5.707 9.143 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 6.328 5.679 7.555 1.00 0.00 H new ATOM 0 HH2 TRP A 80 8.212 6.879 8.576 1.00 0.00 H new ATOM 1328 N MET A 81 7.399 -2.445 7.367 1.00 0.00 N ATOM 1329 CA MET A 81 6.648 -3.584 7.188 1.00 0.00 C ATOM 1330 C MET A 81 5.301 -3.309 7.620 1.00 0.00 C ATOM 1331 O MET A 81 5.058 -2.554 8.565 1.00 0.00 O ATOM 1332 CB MET A 81 7.210 -4.793 7.917 1.00 0.00 C ATOM 1333 CG MET A 81 7.447 -4.626 9.410 1.00 0.00 C ATOM 1334 SD MET A 81 8.150 -6.105 10.166 1.00 0.00 S ATOM 1335 CE MET A 81 8.398 -5.536 11.845 1.00 0.00 C ATOM 0 H MET A 81 7.387 -2.093 8.324 1.00 0.00 H new ATOM 0 HA MET A 81 6.670 -3.843 6.130 1.00 0.00 H new ATOM 0 HB2 MET A 81 6.527 -5.630 7.770 1.00 0.00 H new ATOM 0 HB3 MET A 81 8.155 -5.067 7.448 1.00 0.00 H new ATOM 0 HG2 MET A 81 8.117 -3.783 9.576 1.00 0.00 H new ATOM 0 HG3 MET A 81 6.504 -4.385 9.900 1.00 0.00 H new ATOM 0 HE1 MET A 81 8.829 -6.340 12.442 1.00 0.00 H new ATOM 0 HE2 MET A 81 9.075 -4.682 11.843 1.00 0.00 H new ATOM 0 HE3 MET A 81 7.441 -5.239 12.274 1.00 0.00 H new ATOM 1345 N TRP A 82 4.463 -3.885 6.972 1.00 0.00 N ATOM 1346 CA TRP A 82 3.117 -3.664 7.116 1.00 0.00 C ATOM 1347 C TRP A 82 2.434 -4.989 7.146 1.00 0.00 C ATOM 1348 O TRP A 82 2.932 -5.952 6.553 1.00 0.00 O ATOM 1349 CB TRP A 82 2.607 -2.776 5.982 1.00 0.00 C ATOM 1350 CG TRP A 82 3.239 -3.041 4.643 1.00 0.00 C ATOM 1351 CD1 TRP A 82 3.142 -4.168 3.884 1.00 0.00 C ATOM 1352 CD2 TRP A 82 4.053 -2.132 3.904 1.00 0.00 C ATOM 1353 NE1 TRP A 82 3.853 -4.016 2.727 1.00 0.00 N ATOM 1354 CE2 TRP A 82 4.419 -2.774 2.712 1.00 0.00 C ATOM 1355 CE3 TRP A 82 4.508 -0.833 4.138 1.00 0.00 C ATOM 1356 CZ2 TRP A 82 5.218 -2.164 1.756 1.00 0.00 C ATOM 1357 CZ3 TRP A 82 5.300 -0.228 3.189 1.00 0.00 C ATOM 1358 CH2 TRP A 82 5.648 -0.892 2.011 1.00 0.00 C ATOM 0 H TRP A 82 4.689 -4.584 6.264 1.00 0.00 H new ATOM 0 HA TRP A 82 2.904 -3.137 8.046 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.529 -2.908 5.892 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.779 -1.733 6.250 1.00 0.00 H new ATOM 0 HD1 TRP A 82 2.585 -5.052 4.157 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.946 -4.718 1.993 1.00 0.00 H new ATOM 0 HE3 TRP A 82 4.243 -0.313 5.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 5.490 -2.675 0.844 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 5.658 0.777 3.358 1.00 0.00 H new ATOM 0 HH2 TRP A 82 6.271 -0.389 1.286 1.00 0.00 H new ATOM 1369 N LEU A 83 1.353 -5.094 7.810 1.00 0.00 N ATOM 1370 CA LEU A 83 0.710 -6.347 7.795 1.00 0.00 C ATOM 1371 C LEU A 83 -0.475 -6.328 6.850 1.00 0.00 C ATOM 1372 O LEU A 83 -1.262 -5.395 6.854 1.00 0.00 O ATOM 1373 CB LEU A 83 0.428 -6.897 9.204 1.00 0.00 C ATOM 1374 CG LEU A 83 -0.381 -6.029 10.195 1.00 0.00 C ATOM 1375 CD1 LEU A 83 -1.877 -6.040 9.897 1.00 0.00 C ATOM 1376 CD2 LEU A 83 -0.105 -6.475 11.624 1.00 0.00 C ATOM 0 H LEU A 83 0.904 -4.357 8.354 1.00 0.00 H new ATOM 0 HA LEU A 83 1.399 -7.085 7.384 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -0.099 -7.844 9.089 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.388 -7.121 9.669 1.00 0.00 H new ATOM 0 HG LEU A 83 -0.051 -4.998 10.072 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -2.397 -5.415 10.623 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -2.051 -5.652 8.893 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -2.253 -7.061 9.962 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.679 -5.858 12.315 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -0.396 -7.519 11.742 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.958 -6.368 11.840 1.00 0.00 H new ATOM 1388 N ALA A 84 -0.540 -7.290 5.995 1.00 0.00 N ATOM 1389 CA ALA A 84 -1.559 -7.322 4.983 1.00 0.00 C ATOM 1390 C ALA A 84 -2.014 -8.695 4.707 1.00 0.00 C ATOM 1391 O ALA A 84 -1.332 -9.655 5.050 1.00 0.00 O ATOM 1392 CB ALA A 84 -1.031 -6.759 3.694 1.00 0.00 C ATOM 0 H ALA A 84 0.106 -8.079 5.971 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.392 -6.729 5.361 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.814 -6.789 2.936 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.716 -5.727 3.850 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.179 -7.352 3.360 1.00 0.00 H new ATOM 1398 N SER A 85 -3.147 -8.800 4.102 1.00 0.00 N ATOM 1399 CA SER A 85 -3.553 -9.976 3.531 1.00 0.00 C ATOM 1400 C SER A 85 -3.021 -10.026 2.175 1.00 0.00 C ATOM 1401 O SER A 85 -3.496 -9.376 1.236 1.00 0.00 O ATOM 1402 CB SER A 85 -4.993 -10.090 3.609 1.00 0.00 C ATOM 1403 OG SER A 85 -5.587 -8.828 3.929 1.00 0.00 O ATOM 0 H SER A 85 -3.813 -8.033 4.004 1.00 0.00 H new ATOM 0 HA SER A 85 -3.165 -10.843 4.065 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.386 -10.451 2.658 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.263 -10.826 4.366 1.00 0.00 H new ATOM 0 HG SER A 85 -6.561 -8.927 3.975 1.00 0.00 H new ATOM 1409 N ASP A 86 -2.029 -10.795 2.108 1.00 0.00 N ATOM 1410 CA ASP A 86 -1.176 -10.836 1.053 1.00 0.00 C ATOM 1411 C ASP A 86 -1.074 -12.198 0.355 1.00 0.00 C ATOM 1412 O ASP A 86 -0.896 -13.238 1.019 1.00 0.00 O ATOM 1413 CB ASP A 86 0.193 -10.315 1.512 1.00 0.00 C ATOM 1414 CG ASP A 86 1.368 -11.178 1.083 1.00 0.00 C ATOM 1415 OD1 ASP A 86 1.679 -11.217 -0.104 1.00 0.00 O ATOM 1416 OD2 ASP A 86 2.006 -11.823 1.950 1.00 0.00 O ATOM 0 H ASP A 86 -1.788 -11.453 2.849 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.588 -10.189 0.278 1.00 0.00 H new ATOM 0 HB2 ASP A 86 0.335 -9.308 1.120 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.193 -10.237 2.599 1.00 0.00 H new ATOM 1421 N PHE A 87 -1.390 -12.160 -0.962 1.00 0.00 N ATOM 1422 CA PHE A 87 -1.057 -13.125 -1.987 1.00 0.00 C ATOM 1423 C PHE A 87 -2.125 -13.043 -3.080 1.00 0.00 C ATOM 1424 O PHE A 87 -3.236 -13.461 -2.920 1.00 0.00 O ATOM 1425 CB PHE A 87 -0.941 -14.515 -1.512 1.00 0.00 C ATOM 1426 CG PHE A 87 0.286 -15.222 -2.024 1.00 0.00 C ATOM 1427 CD1 PHE A 87 0.629 -15.179 -3.368 1.00 0.00 C ATOM 1428 CD2 PHE A 87 1.106 -15.916 -1.155 1.00 0.00 C ATOM 1429 CE1 PHE A 87 1.763 -15.810 -3.829 1.00 0.00 C ATOM 1430 CE2 PHE A 87 2.240 -16.552 -1.611 1.00 0.00 C ATOM 1431 CZ PHE A 87 2.570 -16.499 -2.950 1.00 0.00 C ATOM 0 H PHE A 87 -1.928 -11.383 -1.345 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.065 -12.865 -2.357 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -0.925 -14.518 -0.422 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -1.827 -15.071 -1.819 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -0.002 -14.643 -4.062 1.00 0.00 H new ATOM 0 HD2 PHE A 87 0.855 -15.960 -0.106 1.00 0.00 H new ATOM 0 HE1 PHE A 87 2.019 -15.765 -4.877 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.871 -17.092 -0.920 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.459 -16.997 -3.308 1.00 0.00 H new ATOM 1441 N SER A 88 -1.780 -12.409 -4.118 1.00 0.00 N ATOM 1442 CA SER A 88 -2.645 -12.108 -5.213 1.00 0.00 C ATOM 1443 C SER A 88 -2.917 -13.341 -6.005 1.00 0.00 C ATOM 1444 O SER A 88 -4.026 -13.591 -6.453 1.00 0.00 O ATOM 1445 CB SER A 88 -2.042 -10.994 -6.078 1.00 0.00 C ATOM 1446 OG SER A 88 -2.927 -10.573 -7.103 1.00 0.00 O ATOM 0 H SER A 88 -0.832 -12.057 -4.252 1.00 0.00 H new ATOM 0 HA SER A 88 -3.598 -11.744 -4.830 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.789 -10.142 -5.446 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.112 -11.346 -6.525 1.00 0.00 H new ATOM 0 HG SER A 88 -2.504 -9.862 -7.629 1.00 0.00 H new ATOM 1452 N ASP A 89 -1.884 -14.156 -6.099 1.00 0.00 N ATOM 1453 CA ASP A 89 -1.877 -15.213 -7.035 1.00 0.00 C ATOM 1454 C ASP A 89 -2.047 -16.491 -6.297 1.00 0.00 C ATOM 1455 O ASP A 89 -2.396 -17.537 -6.853 1.00 0.00 O ATOM 1456 CB ASP A 89 -0.536 -15.190 -7.775 1.00 0.00 C ATOM 1457 CG ASP A 89 -0.403 -16.207 -8.883 1.00 0.00 C ATOM 1458 OD1 ASP A 89 -0.119 -17.393 -8.605 1.00 0.00 O ATOM 1459 OD2 ASP A 89 -0.500 -15.825 -10.064 1.00 0.00 O ATOM 0 H ASP A 89 -1.044 -14.088 -5.525 1.00 0.00 H new ATOM 0 HA ASP A 89 -2.686 -15.110 -7.759 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.387 -14.195 -8.195 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.264 -15.355 -7.053 1.00 0.00 H new ATOM 1464 N GLY A 90 -1.871 -16.371 -5.023 1.00 0.00 N ATOM 1465 CA GLY A 90 -1.833 -17.452 -4.189 1.00 0.00 C ATOM 1466 C GLY A 90 -2.808 -17.335 -3.113 1.00 0.00 C ATOM 1467 O GLY A 90 -2.852 -18.188 -2.224 1.00 0.00 O ATOM 0 H GLY A 90 -1.749 -15.475 -4.551 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -2.028 -18.360 -4.760 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -0.833 -17.550 -3.766 1.00 0.00 H new ATOM 1471 N ASP A 91 -3.554 -16.230 -3.157 1.00 0.00 N ATOM 1472 CA ASP A 91 -4.688 -15.988 -2.241 1.00 0.00 C ATOM 1473 C ASP A 91 -4.213 -15.457 -0.906 1.00 0.00 C ATOM 1474 O ASP A 91 -3.276 -15.982 -0.303 1.00 0.00 O ATOM 1475 CB ASP A 91 -5.569 -17.209 -2.109 1.00 0.00 C ATOM 1476 CG ASP A 91 -6.599 -17.113 -0.999 1.00 0.00 C ATOM 1477 OD1 ASP A 91 -7.635 -16.437 -1.192 1.00 0.00 O ATOM 1478 OD2 ASP A 91 -6.399 -17.705 0.084 1.00 0.00 O ATOM 0 H ASP A 91 -3.396 -15.475 -3.824 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.313 -15.210 -2.679 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -6.084 -17.376 -3.055 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.939 -18.081 -1.931 1.00 0.00 H new ATOM 1483 N ALA A 92 -4.887 -14.456 -0.441 1.00 0.00 N ATOM 1484 CA ALA A 92 -4.404 -13.639 0.623 1.00 0.00 C ATOM 1485 C ALA A 92 -4.453 -14.272 2.000 1.00 0.00 C ATOM 1486 O ALA A 92 -5.518 -14.581 2.537 1.00 0.00 O ATOM 1487 CB ALA A 92 -5.146 -12.327 0.612 1.00 0.00 C ATOM 0 H ALA A 92 -5.802 -14.179 -0.795 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.341 -13.491 0.433 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -4.782 -11.696 1.423 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -4.981 -11.824 -0.341 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.212 -12.511 0.746 1.00 0.00 H new ATOM 1493 N LYS A 93 -3.286 -14.467 2.541 1.00 0.00 N ATOM 1494 CA LYS A 93 -3.097 -14.869 3.911 1.00 0.00 C ATOM 1495 C LYS A 93 -2.652 -13.596 4.569 1.00 0.00 C ATOM 1496 O LYS A 93 -2.200 -12.713 3.885 1.00 0.00 O ATOM 1497 CB LYS A 93 -1.928 -15.824 4.018 1.00 0.00 C ATOM 1498 CG LYS A 93 -1.736 -16.498 5.370 1.00 0.00 C ATOM 1499 CD LYS A 93 -0.360 -17.138 5.434 1.00 0.00 C ATOM 1500 CE LYS A 93 -0.038 -17.677 6.815 1.00 0.00 C ATOM 1501 NZ LYS A 93 1.376 -18.107 6.907 1.00 0.00 N ATOM 0 H LYS A 93 -2.412 -14.348 2.029 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.986 -15.340 4.330 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.048 -16.600 3.262 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.016 -15.279 3.774 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.844 -15.766 6.170 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -2.506 -17.254 5.523 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -0.305 -17.949 4.708 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.393 -16.404 5.149 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.237 -16.909 7.563 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.692 -18.519 7.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.580 -18.423 7.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.544 -18.891 6.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 1.998 -17.309 6.665 1.00 0.00 H new ATOM 1515 N LEU A 94 -2.718 -13.483 5.827 1.00 0.00 N ATOM 1516 CA LEU A 94 -2.244 -12.254 6.405 1.00 0.00 C ATOM 1517 C LEU A 94 -0.890 -12.467 6.975 1.00 0.00 C ATOM 1518 O LEU A 94 -0.663 -13.378 7.766 1.00 0.00 O ATOM 1519 CB LEU A 94 -3.220 -11.532 7.365 1.00 0.00 C ATOM 1520 CG LEU A 94 -3.405 -12.076 8.800 1.00 0.00 C ATOM 1521 CD1 LEU A 94 -4.341 -11.173 9.579 1.00 0.00 C ATOM 1522 CD2 LEU A 94 -3.939 -13.494 8.808 1.00 0.00 C ATOM 0 H LEU A 94 -3.077 -14.183 6.477 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.179 -11.534 5.589 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.894 -10.495 7.446 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.201 -11.521 6.889 1.00 0.00 H new ATOM 0 HG LEU A 94 -2.423 -12.090 9.273 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -4.466 -11.563 10.589 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.921 -10.168 9.628 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.310 -11.137 9.081 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.053 -13.834 9.837 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.907 -13.521 8.308 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.242 -14.148 8.285 1.00 0.00 H new ATOM 1534 N GLU A 95 -0.005 -11.671 6.529 1.00 0.00 N ATOM 1535 CA GLU A 95 1.333 -11.750 6.776 1.00 0.00 C ATOM 1536 C GLU A 95 1.812 -10.401 6.926 1.00 0.00 C ATOM 1537 O GLU A 95 1.159 -9.420 6.560 1.00 0.00 O ATOM 1538 CB GLU A 95 2.047 -12.453 5.621 1.00 0.00 C ATOM 1539 CG GLU A 95 1.778 -13.948 5.497 1.00 0.00 C ATOM 1540 CD GLU A 95 2.460 -14.796 6.551 1.00 0.00 C ATOM 1541 OE1 GLU A 95 2.558 -14.385 7.717 1.00 0.00 O ATOM 1542 OE2 GLU A 95 2.892 -15.934 6.224 1.00 0.00 O ATOM 0 H GLU A 95 -0.244 -10.882 5.928 1.00 0.00 H new ATOM 0 HA GLU A 95 1.530 -12.330 7.678 1.00 0.00 H new ATOM 0 HB2 GLU A 95 1.755 -11.970 4.688 1.00 0.00 H new ATOM 0 HB3 GLU A 95 3.121 -12.303 5.735 1.00 0.00 H new ATOM 0 HG2 GLU A 95 0.703 -14.117 5.552 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.103 -14.283 4.512 1.00 0.00 H new ATOM 1549 N GLN A 96 2.893 -10.348 7.465 1.00 0.00 N ATOM 1550 CA GLN A 96 3.530 -9.194 7.677 1.00 0.00 C ATOM 1551 C GLN A 96 4.607 -9.167 6.644 1.00 0.00 C ATOM 1552 O GLN A 96 5.487 -10.016 6.608 1.00 0.00 O ATOM 1553 CB GLN A 96 4.093 -9.092 9.099 1.00 0.00 C ATOM 1554 CG GLN A 96 3.055 -9.353 10.195 1.00 0.00 C ATOM 1555 CD GLN A 96 3.557 -9.085 11.605 1.00 0.00 C ATOM 1556 OE1 GLN A 96 3.125 -9.726 12.560 1.00 0.00 O ATOM 1557 NE2 GLN A 96 4.437 -8.130 11.760 1.00 0.00 N ATOM 0 H GLN A 96 3.399 -11.169 7.797 1.00 0.00 H new ATOM 0 HA GLN A 96 2.859 -8.339 7.593 1.00 0.00 H new ATOM 0 HB2 GLN A 96 4.910 -9.805 9.208 1.00 0.00 H new ATOM 0 HB3 GLN A 96 4.516 -8.098 9.242 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.181 -8.729 10.008 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.727 -10.390 10.129 1.00 0.00 H new ATOM 0 HE21 GLN A 96 4.778 -7.614 10.949 1.00 0.00 H new ATOM 0 HE22 GLN A 96 4.782 -7.901 12.692 1.00 0.00 H new ATOM 1566 N LEU A 97 4.489 -8.278 5.809 1.00 0.00 N ATOM 1567 CA LEU A 97 5.414 -8.112 4.733 1.00 0.00 C ATOM 1568 C LEU A 97 6.061 -6.786 4.789 1.00 0.00 C ATOM 1569 O LEU A 97 5.550 -5.860 5.398 1.00 0.00 O ATOM 1570 CB LEU A 97 4.794 -8.355 3.344 1.00 0.00 C ATOM 1571 CG LEU A 97 3.579 -7.510 2.920 1.00 0.00 C ATOM 1572 CD1 LEU A 97 3.361 -7.637 1.432 1.00 0.00 C ATOM 1573 CD2 LEU A 97 2.317 -7.956 3.636 1.00 0.00 C ATOM 0 H LEU A 97 3.731 -7.595 5.815 1.00 0.00 H new ATOM 0 HA LEU A 97 6.171 -8.884 4.870 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.577 -8.204 2.601 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.502 -9.404 3.291 1.00 0.00 H new ATOM 0 HG LEU A 97 3.788 -6.474 3.187 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.500 -7.037 1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.247 -7.285 0.903 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.179 -8.681 1.179 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.478 -7.339 3.314 1.00 0.00 H new ATOM 0 HD22 LEU A 97 2.112 -9.000 3.397 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.453 -7.850 4.712 1.00 0.00 H new ATOM 1585 N ALA A 98 7.156 -6.690 4.152 1.00 0.00 N ATOM 1586 CA ALA A 98 7.930 -5.491 4.160 1.00 0.00 C ATOM 1587 C ALA A 98 8.366 -5.171 2.770 1.00 0.00 C ATOM 1588 O ALA A 98 8.336 -6.043 1.894 1.00 0.00 O ATOM 1589 CB ALA A 98 9.146 -5.633 5.079 1.00 0.00 C ATOM 0 H ALA A 98 7.558 -7.446 3.597 1.00 0.00 H new ATOM 0 HA ALA A 98 7.313 -4.677 4.542 1.00 0.00 H new ATOM 0 HB1 ALA A 98 9.720 -4.707 5.068 1.00 0.00 H new ATOM 0 HB2 ALA A 98 8.812 -5.841 6.095 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.773 -6.453 4.728 1.00 0.00 H new ATOM 1595 N ALA A 99 8.738 -3.949 2.542 1.00 0.00 N ATOM 1596 CA ALA A 99 9.274 -3.579 1.254 1.00 0.00 C ATOM 1597 C ALA A 99 10.322 -2.513 1.397 1.00 0.00 C ATOM 1598 O ALA A 99 10.136 -1.498 2.119 1.00 0.00 O ATOM 1599 CB ALA A 99 8.193 -3.163 0.274 1.00 0.00 C ATOM 0 H ALA A 99 8.684 -3.190 3.221 1.00 0.00 H new ATOM 0 HA ALA A 99 9.746 -4.468 0.836 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.649 -2.895 -0.679 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.500 -3.991 0.124 1.00 0.00 H new ATOM 0 HB3 ALA A 99 7.652 -2.304 0.672 1.00 0.00 H new ATOM 1605 N LYS A 100 11.398 -2.702 0.709 1.00 0.00 N ATOM 1606 CA LYS A 100 12.480 -1.853 0.767 1.00 0.00 C ATOM 1607 C LYS A 100 12.716 -1.366 -0.577 1.00 0.00 C ATOM 1608 O LYS A 100 12.511 -2.051 -1.569 1.00 0.00 O ATOM 1609 CB LYS A 100 13.735 -2.551 1.250 1.00 0.00 C ATOM 1610 CG LYS A 100 14.965 -1.659 1.423 1.00 0.00 C ATOM 1611 CD LYS A 100 16.228 -2.455 1.700 1.00 0.00 C ATOM 1612 CE LYS A 100 17.403 -1.524 1.978 1.00 0.00 C ATOM 1613 NZ LYS A 100 17.640 -0.553 0.883 1.00 0.00 N ATOM 0 H LYS A 100 11.526 -3.490 0.074 1.00 0.00 H new ATOM 0 HA LYS A 100 12.258 -1.051 1.471 1.00 0.00 H new ATOM 0 HB2 LYS A 100 13.518 -3.029 2.205 1.00 0.00 H new ATOM 0 HB3 LYS A 100 13.981 -3.345 0.545 1.00 0.00 H new ATOM 0 HG2 LYS A 100 15.106 -1.062 0.522 1.00 0.00 H new ATOM 0 HG3 LYS A 100 14.792 -0.962 2.243 1.00 0.00 H new ATOM 0 HD2 LYS A 100 16.069 -3.113 2.555 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.457 -3.092 0.846 1.00 0.00 H new ATOM 0 HE2 LYS A 100 17.219 -0.981 2.905 1.00 0.00 H new ATOM 0 HE3 LYS A 100 18.303 -2.119 2.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.353 -0.934 0.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 16.752 -0.387 0.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.981 0.344 1.283 1.00 0.00 H new ATOM 1627 N PHE A 101 13.090 -0.229 -0.578 1.00 0.00 N ATOM 1628 CA PHE A 101 13.503 0.459 -1.737 1.00 0.00 C ATOM 1629 C PHE A 101 14.994 0.624 -1.657 1.00 0.00 C ATOM 1630 O PHE A 101 15.568 0.542 -0.574 1.00 0.00 O ATOM 1631 CB PHE A 101 12.822 1.806 -1.864 1.00 0.00 C ATOM 1632 CG PHE A 101 11.341 1.750 -2.151 1.00 0.00 C ATOM 1633 CD1 PHE A 101 10.420 1.595 -1.125 1.00 0.00 C ATOM 1634 CD2 PHE A 101 10.872 1.871 -3.451 1.00 0.00 C ATOM 1635 CE1 PHE A 101 9.067 1.560 -1.388 1.00 0.00 C ATOM 1636 CE2 PHE A 101 9.516 1.835 -3.722 1.00 0.00 C ATOM 1637 CZ PHE A 101 8.613 1.679 -2.689 1.00 0.00 C ATOM 0 H PHE A 101 13.140 0.338 0.269 1.00 0.00 H new ATOM 0 HA PHE A 101 13.224 -0.112 -2.622 1.00 0.00 H new ATOM 0 HB2 PHE A 101 12.976 2.362 -0.940 1.00 0.00 H new ATOM 0 HB3 PHE A 101 13.310 2.369 -2.660 1.00 0.00 H new ATOM 0 HD1 PHE A 101 10.768 1.501 -0.107 1.00 0.00 H new ATOM 0 HD2 PHE A 101 11.575 1.995 -4.262 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.362 1.440 -0.579 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.164 1.929 -4.739 1.00 0.00 H new ATOM 0 HZ PHE A 101 7.554 1.650 -2.897 1.00 0.00 H new ATOM 1647 N LYS A 102 15.568 0.856 -2.785 1.00 0.00 N ATOM 1648 CA LYS A 102 17.007 1.002 -3.022 1.00 0.00 C ATOM 1649 C LYS A 102 17.755 1.763 -1.915 1.00 0.00 C ATOM 1650 O LYS A 102 18.665 1.228 -1.285 1.00 0.00 O ATOM 1651 CB LYS A 102 17.135 1.735 -4.331 1.00 0.00 C ATOM 1652 CG LYS A 102 16.488 0.980 -5.474 1.00 0.00 C ATOM 1653 CD LYS A 102 15.911 1.911 -6.509 1.00 0.00 C ATOM 1654 CE LYS A 102 16.972 2.790 -7.157 1.00 0.00 C ATOM 1655 NZ LYS A 102 16.438 3.575 -8.293 1.00 0.00 N ATOM 0 H LYS A 102 15.027 0.960 -3.643 1.00 0.00 H new ATOM 0 HA LYS A 102 17.467 0.014 -3.036 1.00 0.00 H new ATOM 0 HB2 LYS A 102 16.675 2.719 -4.241 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.190 1.895 -4.554 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.226 0.329 -5.943 1.00 0.00 H new ATOM 0 HG3 LYS A 102 15.699 0.338 -5.084 1.00 0.00 H new ATOM 0 HD2 LYS A 102 15.408 1.326 -7.279 1.00 0.00 H new ATOM 0 HD3 LYS A 102 15.155 2.543 -6.044 1.00 0.00 H new ATOM 0 HE2 LYS A 102 17.382 3.470 -6.410 1.00 0.00 H new ATOM 0 HE3 LYS A 102 17.794 2.165 -7.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 17.198 4.157 -8.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 16.070 2.928 -9.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.671 4.192 -7.958 1.00 0.00 H new ATOM 1669 N THR A 103 17.353 2.979 -1.676 1.00 0.00 N ATOM 1670 CA THR A 103 18.007 3.849 -0.723 1.00 0.00 C ATOM 1671 C THR A 103 16.941 4.449 0.140 1.00 0.00 C ATOM 1672 O THR A 103 15.766 4.380 -0.252 1.00 0.00 O ATOM 1673 CB THR A 103 18.707 4.995 -1.484 1.00 0.00 C ATOM 1674 OG1 THR A 103 17.726 5.717 -2.254 1.00 0.00 O ATOM 1675 CG2 THR A 103 19.744 4.447 -2.430 1.00 0.00 C ATOM 0 H THR A 103 16.551 3.406 -2.141 1.00 0.00 H new ATOM 0 HA THR A 103 18.736 3.293 -0.133 1.00 0.00 H new ATOM 0 HB THR A 103 19.190 5.650 -0.759 1.00 0.00 H new ATOM 0 HG1 THR A 103 18.164 6.448 -2.739 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.227 5.270 -2.957 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.492 3.889 -1.867 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.265 3.785 -3.151 1.00 0.00 H new ATOM 1683 N PRO A 104 17.283 5.086 1.303 1.00 0.00 N ATOM 1684 CA PRO A 104 16.295 5.779 2.122 1.00 0.00 C ATOM 1685 C PRO A 104 15.614 6.902 1.382 1.00 0.00 C ATOM 1686 O PRO A 104 14.762 7.487 1.867 1.00 0.00 O ATOM 1687 CB PRO A 104 17.049 6.373 3.292 1.00 0.00 C ATOM 1688 CG PRO A 104 18.428 5.795 3.259 1.00 0.00 C ATOM 1689 CD PRO A 104 18.629 5.119 1.916 1.00 0.00 C ATOM 0 HA PRO A 104 15.522 5.071 2.420 1.00 0.00 H new ATOM 0 HB2 PRO A 104 17.084 7.460 3.217 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.553 6.134 4.233 1.00 0.00 H new ATOM 0 HG2 PRO A 104 19.172 6.578 3.405 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.558 5.077 4.069 1.00 0.00 H new ATOM 0 HD2 PRO A 104 19.333 5.674 1.295 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.034 4.114 2.036 1.00 0.00 H new ATOM 1697 N GLU A 105 16.059 7.223 0.250 1.00 0.00 N ATOM 1698 CA GLU A 105 15.386 8.200 -0.555 1.00 0.00 C ATOM 1699 C GLU A 105 14.100 7.594 -1.054 1.00 0.00 C ATOM 1700 O GLU A 105 13.020 8.085 -0.787 1.00 0.00 O ATOM 1701 CB GLU A 105 16.248 8.713 -1.700 1.00 0.00 C ATOM 1702 CG GLU A 105 15.530 9.714 -2.590 1.00 0.00 C ATOM 1703 CD GLU A 105 16.395 10.250 -3.685 1.00 0.00 C ATOM 1704 OE1 GLU A 105 16.615 9.543 -4.694 1.00 0.00 O ATOM 1705 OE2 GLU A 105 16.850 11.399 -3.578 1.00 0.00 O ATOM 0 H GLU A 105 16.901 6.830 -0.170 1.00 0.00 H new ATOM 0 HA GLU A 105 15.172 9.076 0.057 1.00 0.00 H new ATOM 0 HB2 GLU A 105 17.144 9.179 -1.291 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.576 7.868 -2.306 1.00 0.00 H new ATOM 0 HG2 GLU A 105 14.653 9.238 -3.028 1.00 0.00 H new ATOM 0 HG3 GLU A 105 15.172 10.543 -1.979 1.00 0.00 H new ATOM 1712 N LEU A 106 14.243 6.449 -1.693 1.00 0.00 N ATOM 1713 CA LEU A 106 13.129 5.769 -2.287 1.00 0.00 C ATOM 1714 C LEU A 106 12.329 5.145 -1.208 1.00 0.00 C ATOM 1715 O LEU A 106 11.096 5.202 -1.179 1.00 0.00 O ATOM 1716 CB LEU A 106 13.581 4.755 -3.367 1.00 0.00 C ATOM 1717 CG LEU A 106 14.108 5.342 -4.697 1.00 0.00 C ATOM 1718 CD1 LEU A 106 13.181 6.425 -5.230 1.00 0.00 C ATOM 1719 CD2 LEU A 106 15.531 5.850 -4.578 1.00 0.00 C ATOM 0 H LEU A 106 15.137 5.972 -1.810 1.00 0.00 H new ATOM 0 HA LEU A 106 12.500 6.485 -2.817 1.00 0.00 H new ATOM 0 HB2 LEU A 106 14.363 4.128 -2.939 1.00 0.00 H new ATOM 0 HB3 LEU A 106 12.738 4.102 -3.594 1.00 0.00 H new ATOM 0 HG LEU A 106 14.121 4.525 -5.418 1.00 0.00 H new ATOM 0 HD11 LEU A 106 13.580 6.817 -6.166 1.00 0.00 H new ATOM 0 HD12 LEU A 106 12.192 6.003 -5.406 1.00 0.00 H new ATOM 0 HD13 LEU A 106 13.107 7.232 -4.501 1.00 0.00 H new ATOM 0 HD21 LEU A 106 15.855 6.252 -5.538 1.00 0.00 H new ATOM 0 HD22 LEU A 106 15.575 6.634 -3.822 1.00 0.00 H new ATOM 0 HD23 LEU A 106 16.187 5.029 -4.288 1.00 0.00 H new ATOM 1731 N ALA A 107 13.053 4.624 -0.270 1.00 0.00 N ATOM 1732 CA ALA A 107 12.509 3.993 0.852 1.00 0.00 C ATOM 1733 C ALA A 107 11.806 5.010 1.718 1.00 0.00 C ATOM 1734 O ALA A 107 10.652 4.789 2.074 1.00 0.00 O ATOM 1735 CB ALA A 107 13.628 3.293 1.590 1.00 0.00 C ATOM 0 H ALA A 107 14.073 4.635 -0.280 1.00 0.00 H new ATOM 0 HA ALA A 107 11.765 3.251 0.562 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.226 2.793 2.471 1.00 0.00 H new ATOM 0 HB2 ALA A 107 14.091 2.556 0.934 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.375 4.025 1.898 1.00 0.00 H new ATOM 1741 N GLU A 108 12.446 6.147 2.009 1.00 0.00 N ATOM 1742 CA GLU A 108 11.789 7.106 2.923 1.00 0.00 C ATOM 1743 C GLU A 108 10.614 7.823 2.297 1.00 0.00 C ATOM 1744 O GLU A 108 9.515 7.824 2.871 1.00 0.00 O ATOM 1745 CB GLU A 108 12.764 8.064 3.622 1.00 0.00 C ATOM 1746 CG GLU A 108 12.153 8.915 4.712 1.00 0.00 C ATOM 1747 CD GLU A 108 13.179 9.776 5.364 1.00 0.00 C ATOM 1748 OE1 GLU A 108 13.824 9.317 6.352 1.00 0.00 O ATOM 1749 OE2 GLU A 108 13.398 10.908 4.895 1.00 0.00 O ATOM 0 H GLU A 108 13.362 6.422 1.654 1.00 0.00 H new ATOM 0 HA GLU A 108 11.373 6.487 3.717 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.578 7.480 4.051 1.00 0.00 H new ATOM 0 HB3 GLU A 108 13.204 8.722 2.872 1.00 0.00 H new ATOM 0 HG2 GLU A 108 11.365 9.540 4.291 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.686 8.273 5.459 1.00 0.00 H new ATOM 1756 N GLU A 109 10.821 8.362 1.108 1.00 0.00 N ATOM 1757 CA GLU A 109 9.789 9.144 0.420 1.00 0.00 C ATOM 1758 C GLU A 109 8.517 8.360 0.230 1.00 0.00 C ATOM 1759 O GLU A 109 7.410 8.888 0.445 1.00 0.00 O ATOM 1760 CB GLU A 109 10.265 9.683 -0.931 1.00 0.00 C ATOM 1761 CG GLU A 109 11.343 10.746 -0.839 1.00 0.00 C ATOM 1762 CD GLU A 109 10.924 11.903 0.023 1.00 0.00 C ATOM 1763 OE1 GLU A 109 9.795 12.423 -0.156 1.00 0.00 O ATOM 1764 OE2 GLU A 109 11.726 12.334 0.883 1.00 0.00 O ATOM 0 H GLU A 109 11.696 8.276 0.591 1.00 0.00 H new ATOM 0 HA GLU A 109 9.583 9.992 1.073 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.642 8.852 -1.527 1.00 0.00 H new ATOM 0 HB3 GLU A 109 9.409 10.096 -1.465 1.00 0.00 H new ATOM 0 HG2 GLU A 109 12.254 10.304 -0.434 1.00 0.00 H new ATOM 0 HG3 GLU A 109 11.581 11.107 -1.839 1.00 0.00 H new ATOM 1771 N PHE A 110 8.651 7.109 -0.155 1.00 0.00 N ATOM 1772 CA PHE A 110 7.546 6.304 -0.356 1.00 0.00 C ATOM 1773 C PHE A 110 6.843 5.886 0.923 1.00 0.00 C ATOM 1774 O PHE A 110 5.637 5.845 0.942 1.00 0.00 O ATOM 1775 CB PHE A 110 7.904 5.157 -1.245 1.00 0.00 C ATOM 1776 CG PHE A 110 7.855 5.528 -2.694 1.00 0.00 C ATOM 1777 CD1 PHE A 110 6.666 5.439 -3.395 1.00 0.00 C ATOM 1778 CD2 PHE A 110 8.980 5.997 -3.350 1.00 0.00 C ATOM 1779 CE1 PHE A 110 6.598 5.803 -4.721 1.00 0.00 C ATOM 1780 CE2 PHE A 110 8.917 6.368 -4.673 1.00 0.00 C ATOM 1781 CZ PHE A 110 7.722 6.269 -5.360 1.00 0.00 C ATOM 0 H PHE A 110 9.547 6.654 -0.328 1.00 0.00 H new ATOM 0 HA PHE A 110 6.794 6.904 -0.869 1.00 0.00 H new ATOM 0 HB2 PHE A 110 8.905 4.805 -0.996 1.00 0.00 H new ATOM 0 HB3 PHE A 110 7.220 4.329 -1.060 1.00 0.00 H new ATOM 0 HD1 PHE A 110 5.779 5.079 -2.895 1.00 0.00 H new ATOM 0 HD2 PHE A 110 9.917 6.072 -2.818 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.664 5.723 -5.257 1.00 0.00 H new ATOM 0 HE2 PHE A 110 9.800 6.736 -5.174 1.00 0.00 H new ATOM 0 HZ PHE A 110 7.671 6.558 -6.399 1.00 0.00 H new ATOM 1791 N LYS A 111 7.577 5.632 2.011 1.00 0.00 N ATOM 1792 CA LYS A 111 6.919 5.198 3.267 1.00 0.00 C ATOM 1793 C LYS A 111 5.999 6.266 3.807 1.00 0.00 C ATOM 1794 O LYS A 111 4.882 5.980 4.239 1.00 0.00 O ATOM 1795 CB LYS A 111 7.912 4.781 4.342 1.00 0.00 C ATOM 1796 CG LYS A 111 8.742 3.572 3.999 1.00 0.00 C ATOM 1797 CD LYS A 111 7.884 2.419 3.529 1.00 0.00 C ATOM 1798 CE LYS A 111 8.725 1.213 3.219 1.00 0.00 C ATOM 1799 NZ LYS A 111 9.809 1.516 2.259 1.00 0.00 N ATOM 0 H LYS A 111 8.593 5.713 2.059 1.00 0.00 H new ATOM 0 HA LYS A 111 6.330 4.319 3.004 1.00 0.00 H new ATOM 0 HB2 LYS A 111 8.580 5.618 4.544 1.00 0.00 H new ATOM 0 HB3 LYS A 111 7.366 4.580 5.263 1.00 0.00 H new ATOM 0 HG2 LYS A 111 9.460 3.832 3.221 1.00 0.00 H new ATOM 0 HG3 LYS A 111 9.317 3.265 4.873 1.00 0.00 H new ATOM 0 HD2 LYS A 111 7.152 2.169 4.297 1.00 0.00 H new ATOM 0 HD3 LYS A 111 7.325 2.715 2.641 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.158 0.827 4.142 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.091 0.426 2.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 10.140 0.634 1.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 9.451 2.157 1.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 10.599 1.970 2.760 1.00 0.00 H new ATOM 1813 N GLN A 112 6.475 7.484 3.744 1.00 0.00 N ATOM 1814 CA GLN A 112 5.724 8.663 4.144 1.00 0.00 C ATOM 1815 C GLN A 112 4.465 8.748 3.343 1.00 0.00 C ATOM 1816 O GLN A 112 3.385 8.912 3.876 1.00 0.00 O ATOM 1817 CB GLN A 112 6.514 9.846 3.760 1.00 0.00 C ATOM 1818 CG GLN A 112 7.859 9.975 4.460 1.00 0.00 C ATOM 1819 CD GLN A 112 7.715 10.137 5.959 1.00 0.00 C ATOM 1820 OE1 GLN A 112 7.685 9.164 6.707 1.00 0.00 O ATOM 1821 NE2 GLN A 112 7.617 11.357 6.404 1.00 0.00 N ATOM 0 H GLN A 112 7.414 7.696 3.407 1.00 0.00 H new ATOM 0 HA GLN A 112 5.514 8.614 5.213 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.683 9.818 2.683 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.926 10.740 3.967 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.462 9.092 4.249 1.00 0.00 H new ATOM 0 HG3 GLN A 112 8.396 10.832 4.054 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.646 12.141 5.753 1.00 0.00 H new ATOM 0 HE22 GLN A 112 7.511 11.528 7.404 1.00 0.00 H new ATOM 1830 N LYS A 113 4.644 8.600 2.036 1.00 0.00 N ATOM 1831 CA LYS A 113 3.591 8.702 1.065 1.00 0.00 C ATOM 1832 C LYS A 113 2.548 7.644 1.359 1.00 0.00 C ATOM 1833 O LYS A 113 1.358 7.869 1.193 1.00 0.00 O ATOM 1834 CB LYS A 113 4.189 8.430 -0.317 1.00 0.00 C ATOM 1835 CG LYS A 113 3.815 9.408 -1.421 1.00 0.00 C ATOM 1836 CD LYS A 113 2.320 9.516 -1.657 1.00 0.00 C ATOM 1837 CE LYS A 113 2.036 10.392 -2.871 1.00 0.00 C ATOM 1838 NZ LYS A 113 2.641 11.739 -2.756 1.00 0.00 N ATOM 0 H LYS A 113 5.555 8.401 1.623 1.00 0.00 H new ATOM 0 HA LYS A 113 3.136 9.692 1.099 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.275 8.420 -0.223 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.887 7.430 -0.629 1.00 0.00 H new ATOM 0 HG2 LYS A 113 4.207 10.394 -1.170 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.299 9.099 -2.348 1.00 0.00 H new ATOM 0 HD2 LYS A 113 1.897 8.523 -1.810 1.00 0.00 H new ATOM 0 HD3 LYS A 113 1.836 9.937 -0.776 1.00 0.00 H new ATOM 0 HE2 LYS A 113 2.419 9.901 -3.766 1.00 0.00 H new ATOM 0 HE3 LYS A 113 0.958 10.492 -2.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 2.281 12.347 -3.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 2.392 12.154 -1.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 3.675 11.663 -2.832 1.00 0.00 H new ATOM 1852 N PHE A 114 3.014 6.511 1.825 1.00 0.00 N ATOM 1853 CA PHE A 114 2.109 5.365 2.081 1.00 0.00 C ATOM 1854 C PHE A 114 1.214 5.592 3.293 1.00 0.00 C ATOM 1855 O PHE A 114 -0.011 5.506 3.190 1.00 0.00 O ATOM 1856 CB PHE A 114 2.841 4.009 2.190 1.00 0.00 C ATOM 1857 CG PHE A 114 3.588 3.588 0.945 1.00 0.00 C ATOM 1858 CD1 PHE A 114 3.092 3.875 -0.324 1.00 0.00 C ATOM 1859 CD2 PHE A 114 4.787 2.905 1.048 1.00 0.00 C ATOM 1860 CE1 PHE A 114 3.784 3.494 -1.456 1.00 0.00 C ATOM 1861 CE2 PHE A 114 5.482 2.520 -0.082 1.00 0.00 C ATOM 1862 CZ PHE A 114 4.981 2.818 -1.336 1.00 0.00 C ATOM 0 H PHE A 114 3.996 6.337 2.039 1.00 0.00 H new ATOM 0 HA PHE A 114 1.475 5.309 1.196 1.00 0.00 H new ATOM 0 HB2 PHE A 114 3.546 4.059 3.020 1.00 0.00 H new ATOM 0 HB3 PHE A 114 2.112 3.238 2.437 1.00 0.00 H new ATOM 0 HD1 PHE A 114 2.155 4.402 -0.424 1.00 0.00 H new ATOM 0 HD2 PHE A 114 5.184 2.670 2.024 1.00 0.00 H new ATOM 0 HE1 PHE A 114 3.389 3.725 -2.434 1.00 0.00 H new ATOM 0 HE2 PHE A 114 6.416 1.987 0.014 1.00 0.00 H new ATOM 0 HZ PHE A 114 5.526 2.522 -2.220 1.00 0.00 H new ATOM 1872 N GLU A 115 1.816 5.930 4.420 1.00 0.00 N ATOM 1873 CA GLU A 115 1.066 6.191 5.649 1.00 0.00 C ATOM 1874 C GLU A 115 0.225 7.465 5.503 1.00 0.00 C ATOM 1875 O GLU A 115 -0.844 7.599 6.130 1.00 0.00 O ATOM 1876 CB GLU A 115 2.005 6.186 6.885 1.00 0.00 C ATOM 1877 CG GLU A 115 3.163 7.180 6.868 1.00 0.00 C ATOM 1878 CD GLU A 115 2.865 8.442 7.629 1.00 0.00 C ATOM 1879 OE1 GLU A 115 2.115 9.285 7.142 1.00 0.00 O ATOM 1880 OE2 GLU A 115 3.376 8.596 8.773 1.00 0.00 O ATOM 0 H GLU A 115 2.826 6.032 4.515 1.00 0.00 H new ATOM 0 HA GLU A 115 0.357 5.382 5.822 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.402 6.381 7.772 1.00 0.00 H new ATOM 0 HB3 GLU A 115 2.418 5.183 6.995 1.00 0.00 H new ATOM 0 HG2 GLU A 115 4.048 6.706 7.293 1.00 0.00 H new ATOM 0 HG3 GLU A 115 3.402 7.433 5.835 1.00 0.00 H new ATOM 1887 N GLU A 116 0.710 8.405 4.675 1.00 0.00 N ATOM 1888 CA GLU A 116 -0.030 9.594 4.333 1.00 0.00 C ATOM 1889 C GLU A 116 -1.328 9.191 3.683 1.00 0.00 C ATOM 1890 O GLU A 116 -2.405 9.596 4.121 1.00 0.00 O ATOM 1891 CB GLU A 116 0.742 10.500 3.369 1.00 0.00 C ATOM 1892 CG GLU A 116 0.062 11.842 3.102 1.00 0.00 C ATOM 1893 CD GLU A 116 0.189 12.792 4.276 1.00 0.00 C ATOM 1894 OE1 GLU A 116 -0.135 12.421 5.418 1.00 0.00 O ATOM 1895 OE2 GLU A 116 0.694 13.924 4.085 1.00 0.00 O ATOM 0 H GLU A 116 1.627 8.346 4.233 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.204 10.153 5.252 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.737 10.682 3.775 1.00 0.00 H new ATOM 0 HB3 GLU A 116 0.875 9.977 2.422 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.502 12.301 2.217 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -0.993 11.676 2.884 1.00 0.00 H new ATOM 1902 N CYS A 117 -1.224 8.337 2.666 1.00 0.00 N ATOM 1903 CA CYS A 117 -2.308 7.839 1.973 1.00 0.00 C ATOM 1904 C CYS A 117 -3.244 7.098 2.879 1.00 0.00 C ATOM 1905 O CYS A 117 -4.425 7.156 2.686 1.00 0.00 O ATOM 1906 CB CYS A 117 -1.835 6.984 0.871 1.00 0.00 C ATOM 1907 SG CYS A 117 -1.011 7.863 -0.473 1.00 0.00 S ATOM 0 H CYS A 117 -0.328 7.988 2.325 1.00 0.00 H new ATOM 0 HA CYS A 117 -2.871 8.673 1.554 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -1.147 6.242 1.276 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -2.686 6.440 0.462 1.00 0.00 H new ATOM 0 HG CYS A 117 0.237 8.055 -0.165 1.00 0.00 H new ATOM 1913 N GLN A 118 -2.719 6.422 3.892 1.00 0.00 N ATOM 1914 CA GLN A 118 -3.580 5.698 4.808 1.00 0.00 C ATOM 1915 C GLN A 118 -4.599 6.661 5.404 1.00 0.00 C ATOM 1916 O GLN A 118 -5.781 6.376 5.417 1.00 0.00 O ATOM 1917 CB GLN A 118 -2.770 5.054 5.926 1.00 0.00 C ATOM 1918 CG GLN A 118 -1.863 3.939 5.475 1.00 0.00 C ATOM 1919 CD GLN A 118 -0.889 3.451 6.550 1.00 0.00 C ATOM 1920 OE1 GLN A 118 0.191 2.968 6.238 1.00 0.00 O ATOM 1921 NE2 GLN A 118 -1.237 3.600 7.803 1.00 0.00 N ATOM 0 H GLN A 118 -1.721 6.361 4.096 1.00 0.00 H new ATOM 0 HA GLN A 118 -4.089 4.907 4.257 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -2.168 5.822 6.411 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -3.457 4.666 6.678 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.474 3.099 5.146 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.293 4.277 4.610 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -2.143 4.006 8.036 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -0.602 3.311 8.547 1.00 0.00 H new ATOM 1930 N ARG A 119 -4.138 7.793 5.900 1.00 0.00 N ATOM 1931 CA ARG A 119 -5.056 8.823 6.394 1.00 0.00 C ATOM 1932 C ARG A 119 -5.830 9.552 5.305 1.00 0.00 C ATOM 1933 O ARG A 119 -7.034 9.794 5.394 1.00 0.00 O ATOM 1934 CB ARG A 119 -4.397 9.827 7.351 1.00 0.00 C ATOM 1935 CG ARG A 119 -4.092 9.305 8.749 1.00 0.00 C ATOM 1936 CD ARG A 119 -2.898 8.350 8.825 1.00 0.00 C ATOM 1937 NE ARG A 119 -1.621 8.974 8.424 1.00 0.00 N ATOM 1938 CZ ARG A 119 -0.971 9.946 9.110 1.00 0.00 C ATOM 1939 NH1 ARG A 119 -1.510 10.488 10.207 1.00 0.00 N ATOM 1940 NH2 ARG A 119 0.228 10.344 8.718 1.00 0.00 N ATOM 0 H ARG A 119 -3.149 8.029 5.975 1.00 0.00 H new ATOM 0 HA ARG A 119 -5.785 8.250 6.966 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -3.466 10.172 6.901 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -5.049 10.696 7.442 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -3.904 10.154 9.407 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -4.975 8.794 9.132 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -2.806 7.975 9.844 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -3.090 7.489 8.185 1.00 0.00 H new ATOM 0 HE ARG A 119 -1.192 8.646 7.559 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -2.421 10.171 10.537 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -1.010 11.219 10.713 1.00 0.00 H new ATOM 0 HH21 ARG A 119 0.664 9.920 7.899 1.00 0.00 H new ATOM 0 HH22 ARG A 119 0.717 11.075 9.234 1.00 0.00 H new ATOM 1954 N LEU A 120 -5.118 9.927 4.363 1.00 0.00 N ATOM 1955 CA LEU A 120 -5.565 10.782 3.289 1.00 0.00 C ATOM 1956 C LEU A 120 -6.453 10.184 2.212 1.00 0.00 C ATOM 1957 O LEU A 120 -7.528 10.736 1.960 1.00 0.00 O ATOM 1958 CB LEU A 120 -4.442 11.678 2.721 1.00 0.00 C ATOM 1959 CG LEU A 120 -4.145 12.993 3.465 1.00 0.00 C ATOM 1960 CD1 LEU A 120 -3.587 12.754 4.862 1.00 0.00 C ATOM 1961 CD2 LEU A 120 -3.205 13.862 2.641 1.00 0.00 C ATOM 0 H LEU A 120 -4.140 9.653 4.274 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.276 11.421 3.813 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.524 11.091 2.693 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.695 11.923 1.690 1.00 0.00 H new ATOM 0 HG LEU A 120 -5.091 13.519 3.593 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -3.394 13.712 5.345 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.310 12.189 5.451 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.657 12.190 4.791 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.002 14.789 3.177 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.270 13.328 2.473 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.669 14.092 1.682 1.00 0.00 H new ATOM 1973 N LEU A 121 -6.089 8.997 1.718 1.00 0.00 N ATOM 1974 CA LEU A 121 -6.666 8.344 0.488 1.00 0.00 C ATOM 1975 C LEU A 121 -8.167 8.097 0.679 1.00 0.00 C ATOM 1976 O LEU A 121 -8.958 8.022 -0.251 1.00 0.00 O ATOM 1977 CB LEU A 121 -5.894 7.015 0.209 1.00 0.00 C ATOM 1978 CG LEU A 121 -5.773 6.486 -1.235 1.00 0.00 C ATOM 1979 CD1 LEU A 121 -7.105 6.244 -1.893 1.00 0.00 C ATOM 1980 CD2 LEU A 121 -4.898 7.396 -2.073 1.00 0.00 C ATOM 0 H LEU A 121 -5.366 8.429 2.159 1.00 0.00 H new ATOM 0 HA LEU A 121 -6.550 9.000 -0.375 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.882 7.140 0.595 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -6.368 6.233 0.803 1.00 0.00 H new ATOM 0 HG LEU A 121 -5.292 5.510 -1.168 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -6.948 5.873 -2.906 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -7.666 5.506 -1.319 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -7.667 7.177 -1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -4.828 7.001 -3.087 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -5.334 8.395 -2.101 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.901 7.447 -1.634 1.00 0.00 H new ATOM 1992 N LEU A 122 -8.505 8.069 1.886 1.00 0.00 N ATOM 1993 CA LEU A 122 -9.805 7.764 2.384 1.00 0.00 C ATOM 1994 C LEU A 122 -10.910 8.751 1.989 1.00 0.00 C ATOM 1995 O LEU A 122 -12.004 8.341 1.599 1.00 0.00 O ATOM 1996 CB LEU A 122 -9.624 7.992 3.810 1.00 0.00 C ATOM 1997 CG LEU A 122 -8.784 6.970 4.596 1.00 0.00 C ATOM 1998 CD1 LEU A 122 -8.814 7.289 6.080 1.00 0.00 C ATOM 1999 CD2 LEU A 122 -9.274 5.546 4.357 1.00 0.00 C ATOM 0 H LEU A 122 -7.841 8.272 2.633 1.00 0.00 H new ATOM 0 HA LEU A 122 -10.111 6.782 2.023 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -9.165 8.972 3.937 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -10.611 8.040 4.270 1.00 0.00 H new ATOM 0 HG LEU A 122 -7.757 7.039 4.237 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.215 6.557 6.622 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.406 8.286 6.246 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -9.843 7.253 6.439 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -8.659 4.849 4.927 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.312 5.460 4.678 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.201 5.310 3.295 1.00 0.00 H new ATOM 2011 N ASP A 123 -10.624 10.022 2.047 1.00 0.00 N ATOM 2012 CA ASP A 123 -11.671 11.042 1.812 1.00 0.00 C ATOM 2013 C ASP A 123 -11.547 11.601 0.452 1.00 0.00 C ATOM 2014 O ASP A 123 -12.531 11.899 -0.227 1.00 0.00 O ATOM 2015 CB ASP A 123 -11.519 12.205 2.807 1.00 0.00 C ATOM 2016 CG ASP A 123 -12.551 13.319 2.610 1.00 0.00 C ATOM 2017 OD1 ASP A 123 -12.313 14.263 1.830 1.00 0.00 O ATOM 2018 OD2 ASP A 123 -13.610 13.291 3.260 1.00 0.00 O ATOM 0 H ASP A 123 -9.697 10.397 2.250 1.00 0.00 H new ATOM 0 HA ASP A 123 -12.639 10.557 1.938 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -11.605 11.817 3.822 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -10.519 12.627 2.710 1.00 0.00 H new ATOM 2023 N ILE A 124 -10.346 11.651 0.036 1.00 0.00 N ATOM 2024 CA ILE A 124 -9.943 12.372 -1.096 1.00 0.00 C ATOM 2025 C ILE A 124 -10.426 11.765 -2.413 1.00 0.00 C ATOM 2026 O ILE A 124 -10.616 10.544 -2.522 1.00 0.00 O ATOM 2027 CB ILE A 124 -8.405 12.584 -1.044 1.00 0.00 C ATOM 2028 CG1 ILE A 124 -7.620 11.249 -0.909 1.00 0.00 C ATOM 2029 CG2 ILE A 124 -8.068 13.496 0.124 1.00 0.00 C ATOM 2030 CD1 ILE A 124 -7.547 10.422 -2.188 1.00 0.00 C ATOM 0 H ILE A 124 -9.579 11.165 0.501 1.00 0.00 H new ATOM 0 HA ILE A 124 -10.429 13.347 -1.070 1.00 0.00 H new ATOM 0 HB ILE A 124 -8.103 13.038 -1.988 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.606 11.471 -0.578 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -8.085 10.647 -0.129 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.990 13.649 0.167 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -8.566 14.456 -0.009 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -8.406 13.037 1.053 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -6.981 9.510 -2.000 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.555 10.164 -2.512 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -7.052 11.001 -2.968 1.00 0.00 H new ATOM 2042 N PRO A 125 -10.739 12.609 -3.390 1.00 0.00 N ATOM 2043 CA PRO A 125 -11.111 12.156 -4.709 1.00 0.00 C ATOM 2044 C PRO A 125 -9.906 11.563 -5.431 1.00 0.00 C ATOM 2045 O PRO A 125 -8.808 12.149 -5.416 1.00 0.00 O ATOM 2046 CB PRO A 125 -11.583 13.433 -5.427 1.00 0.00 C ATOM 2047 CG PRO A 125 -11.755 14.447 -4.352 1.00 0.00 C ATOM 2048 CD PRO A 125 -10.774 14.075 -3.288 1.00 0.00 C ATOM 0 HA PRO A 125 -11.875 11.379 -4.682 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -10.852 13.762 -6.165 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -12.518 13.262 -5.960 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -11.564 15.452 -4.727 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -12.774 14.439 -3.965 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -9.794 14.518 -3.466 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -11.099 14.406 -2.302 1.00 0.00 H new ATOM 2056 N LEU A 126 -10.079 10.421 -6.034 1.00 0.00 N ATOM 2057 CA LEU A 126 -9.033 9.839 -6.798 1.00 0.00 C ATOM 2058 C LEU A 126 -9.083 10.396 -8.177 1.00 0.00 C ATOM 2059 O LEU A 126 -10.090 10.989 -8.585 1.00 0.00 O ATOM 2060 CB LEU A 126 -9.087 8.311 -6.803 1.00 0.00 C ATOM 2061 CG LEU A 126 -8.734 7.633 -5.477 1.00 0.00 C ATOM 2062 CD1 LEU A 126 -8.853 6.132 -5.603 1.00 0.00 C ATOM 2063 CD2 LEU A 126 -7.321 8.008 -5.058 1.00 0.00 C ATOM 0 H LEU A 126 -10.942 9.879 -6.006 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.080 10.094 -6.334 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -10.091 8.002 -7.093 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -8.406 7.944 -7.571 1.00 0.00 H new ATOM 0 HG LEU A 126 -9.434 7.976 -4.715 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -8.598 5.666 -4.651 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -9.876 5.870 -5.874 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -8.171 5.776 -6.375 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -7.080 7.520 -4.113 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -6.616 7.684 -5.824 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -7.252 9.089 -4.936 1.00 0.00 H new ATOM 2075 N GLN A 127 -8.036 10.214 -8.891 1.00 0.00 N ATOM 2076 CA GLN A 127 -7.900 10.794 -10.206 1.00 0.00 C ATOM 2077 C GLN A 127 -8.590 9.923 -11.245 1.00 0.00 C ATOM 2078 O GLN A 127 -7.963 9.255 -12.057 1.00 0.00 O ATOM 2079 CB GLN A 127 -6.431 11.030 -10.545 1.00 0.00 C ATOM 2080 CG GLN A 127 -5.674 11.767 -9.444 1.00 0.00 C ATOM 2081 CD GLN A 127 -6.215 13.156 -9.134 1.00 0.00 C ATOM 2082 OE1 GLN A 127 -7.088 13.329 -8.273 1.00 0.00 O ATOM 2083 NE2 GLN A 127 -5.700 14.142 -9.800 1.00 0.00 N ATOM 0 H GLN A 127 -7.235 9.658 -8.593 1.00 0.00 H new ATOM 0 HA GLN A 127 -8.392 11.766 -10.213 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -5.948 10.070 -10.730 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -6.365 11.603 -11.470 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -5.704 11.167 -8.535 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -4.627 11.854 -9.735 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -4.982 13.963 -10.502 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -6.012 15.096 -9.621 1.00 0.00 H new ATOM 2092 N THR A 128 -9.868 9.869 -11.122 1.00 0.00 N ATOM 2093 CA THR A 128 -10.729 9.143 -11.997 1.00 0.00 C ATOM 2094 C THR A 128 -11.165 10.087 -13.132 1.00 0.00 C ATOM 2095 O THR A 128 -11.663 11.179 -12.860 1.00 0.00 O ATOM 2096 CB THR A 128 -11.943 8.647 -11.178 1.00 0.00 C ATOM 2097 OG1 THR A 128 -11.460 7.863 -10.067 1.00 0.00 O ATOM 2098 CG2 THR A 128 -12.877 7.798 -12.016 1.00 0.00 C ATOM 0 H THR A 128 -10.369 10.351 -10.375 1.00 0.00 H new ATOM 0 HA THR A 128 -10.228 8.279 -12.434 1.00 0.00 H new ATOM 0 HB THR A 128 -12.502 9.516 -10.831 1.00 0.00 H new ATOM 0 HG1 THR A 128 -10.759 7.253 -10.378 1.00 0.00 H new ATOM 0 HG21 THR A 128 -13.717 7.469 -11.404 1.00 0.00 H new ATOM 0 HG22 THR A 128 -13.248 8.386 -12.856 1.00 0.00 H new ATOM 0 HG23 THR A 128 -12.339 6.928 -12.392 1.00 0.00 H new ATOM 2106 N PRO A 129 -10.965 9.697 -14.409 1.00 0.00 N ATOM 2107 CA PRO A 129 -11.248 10.558 -15.556 1.00 0.00 C ATOM 2108 C PRO A 129 -12.705 10.975 -15.628 1.00 0.00 C ATOM 2109 O PRO A 129 -13.630 10.154 -15.453 1.00 0.00 O ATOM 2110 CB PRO A 129 -10.878 9.704 -16.760 1.00 0.00 C ATOM 2111 CG PRO A 129 -10.989 8.336 -16.257 1.00 0.00 C ATOM 2112 CD PRO A 129 -10.491 8.386 -14.848 1.00 0.00 C ATOM 0 HA PRO A 129 -10.689 11.492 -15.498 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -11.552 9.879 -17.598 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -9.869 9.922 -17.111 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -12.021 7.986 -16.296 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -10.396 7.647 -16.859 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -10.901 7.579 -14.241 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -9.405 8.305 -14.795 1.00 0.00 H new ATOM 2120 N LYS A 130 -12.897 12.221 -15.866 1.00 0.00 N ATOM 2121 CA LYS A 130 -14.198 12.806 -15.935 1.00 0.00 C ATOM 2122 C LYS A 130 -14.365 13.272 -17.368 1.00 0.00 C ATOM 2123 O LYS A 130 -13.857 14.355 -17.707 1.00 0.00 O ATOM 2124 CB LYS A 130 -14.284 14.001 -14.954 1.00 0.00 C ATOM 2125 CG LYS A 130 -15.695 14.429 -14.441 1.00 0.00 C ATOM 2126 CD LYS A 130 -16.698 14.833 -15.533 1.00 0.00 C ATOM 2127 CE LYS A 130 -17.424 13.630 -16.132 1.00 0.00 C ATOM 2128 NZ LYS A 130 -18.310 14.009 -17.248 1.00 0.00 N ATOM 2129 OXT LYS A 130 -14.947 12.530 -18.171 1.00 0.00 O ATOM 0 H LYS A 130 -12.138 12.884 -16.023 1.00 0.00 H new ATOM 0 HA LYS A 130 -14.982 12.102 -15.658 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -13.671 13.764 -14.085 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -13.829 14.865 -15.439 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -16.120 13.605 -13.868 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -15.575 15.267 -13.754 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -17.430 15.523 -15.113 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -16.173 15.368 -16.324 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -16.691 12.904 -16.484 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -18.011 13.139 -15.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -18.780 13.160 -17.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -19.027 14.681 -16.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -17.748 14.453 -18.002 1.00 0.00 H new TER 2143 LYS A 130