USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1152 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 50 ASN : amide:sc= -0.291 K(o=-0.46,f=-1.9) USER MOD Set 1.2: A 129 HIS : no HD1:sc= -0.171 X(o=-0.46,f=-0.34) USER MOD Set 2.1: A 49 TYR OH : rot 59:sc= 1.38 USER MOD Set 2.2: A 131 HIS : no HD1:sc= 1.07 K(o=2.5,f=-5.6!) USER MOD Single : A 1 MET CE :methyl -179:sc= -0.867 (180deg=-0.877) USER MOD Single : A 1 MET N :NH3+ 174:sc= 1.66 (180deg=1.56) USER MOD Single : A 2 ASN : amide:sc= 0.481 K(o=0.48,f=-2.7!) USER MOD Single : A 9 SER OG : rot -88:sc= 0.298 USER MOD Single : A 10 THR OG1 : rot 77:sc= 0.429 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 162:sc= -0.0411 (180deg=-0.341) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 163:sc= -0.0426 (180deg=-0.283) USER MOD Single : A 25 ASN : amide:sc= -1.17 X(o=-1.2,f=-1.4) USER MOD Single : A 28 LYS NZ :NH3+ -122:sc= -0.0233 (180deg=-0.221) USER MOD Single : A 31 THR OG1 : rot 41:sc= 0.309 USER MOD Single : A 34 SER OG : rot -71:sc= -0.027 USER MOD Single : A 36 GLN : amide:sc= 0.4 K(o=0.4,f=-0.46) USER MOD Single : A 39 LYS NZ :NH3+ -167:sc= 1.26 (180deg=1) USER MOD Single : A 41 SER OG : rot -68:sc= 0.153 USER MOD Single : A 47 LYS NZ :NH3+ -133:sc= 1.06 (180deg=-0.0969) USER MOD Single : A 48 LYS NZ :NH3+ 167:sc= -0.0252 (180deg=-0.214) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 147:sc= 1.13 (180deg=0.587) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -166:sc= 1.22 (180deg=1) USER MOD Single : A 73 SER OG : rot -26:sc= 0.356 USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 94 SER OG : rot 77:sc= -0.0273 USER MOD Single : A 106 THR OG1 : rot 27:sc= 0.376 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 172:sc= 1.06 (180deg=0.938) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 SER OG : rot -120:sc= 0.536 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 130 HIS : no HD1:sc= -0.998 K(o=-1,f=-4.4!) USER MOD Single : A 132 HIS : no HD1:sc= -0.508 X(o=-0.51,f=-0.091) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HD1:sc= -0.0131 X(o=-0.013,f=-0.32) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.271 5.425 8.449 1.00 35.10 N ATOM 2 CA MET A 1 5.080 6.301 8.637 1.00 32.24 C ATOM 3 C MET A 1 3.788 5.486 8.484 1.00 21.11 C ATOM 4 O MET A 1 3.792 4.441 7.841 1.00 31.10 O ATOM 5 CB MET A 1 5.119 7.456 7.622 1.00 11.11 C ATOM 6 CG MET A 1 3.992 8.471 7.782 1.00 74.12 C ATOM 7 SD MET A 1 4.136 9.859 6.640 1.00 24.12 S ATOM 8 CE MET A 1 5.668 10.611 7.188 1.00 61.04 C ATOM 0 H1 MET A 1 7.134 6.006 8.454 1.00 35.10 H new ATOM 0 H2 MET A 1 6.317 4.731 9.222 1.00 35.10 H new ATOM 0 H3 MET A 1 6.195 4.926 7.540 1.00 35.10 H new ATOM 0 HA MET A 1 5.099 6.719 9.644 1.00 32.24 H new ATOM 0 HB2 MET A 1 6.074 7.973 7.715 1.00 11.11 H new ATOM 0 HB3 MET A 1 5.078 7.041 6.615 1.00 11.11 H new ATOM 0 HG2 MET A 1 3.035 7.973 7.623 1.00 74.12 H new ATOM 0 HG3 MET A 1 3.990 8.847 8.805 1.00 74.12 H new ATOM 0 HE1 MET A 1 5.876 11.494 6.584 1.00 61.04 H new ATOM 0 HE2 MET A 1 5.577 10.901 8.235 1.00 61.04 H new ATOM 0 HE3 MET A 1 6.484 9.896 7.079 1.00 61.04 H new ATOM 20 N ASN A 2 2.695 5.956 9.091 1.00 42.13 N ATOM 21 CA ASN A 2 1.398 5.264 9.015 1.00 2.51 C ATOM 22 C ASN A 2 0.809 5.280 7.591 1.00 5.04 C ATOM 23 O ASN A 2 -0.130 6.024 7.302 1.00 14.12 O ATOM 24 CB ASN A 2 0.404 5.901 9.995 1.00 0.42 C ATOM 25 CG ASN A 2 0.814 5.730 11.446 1.00 12.34 C ATOM 26 OD1 ASN A 2 1.992 5.620 11.763 1.00 32.11 O ATOM 27 ND2 ASN A 2 -0.156 5.713 12.336 1.00 20.00 N ATOM 0 H ASN A 2 2.679 6.814 9.642 1.00 42.13 H new ATOM 0 HA ASN A 2 1.571 4.223 9.287 1.00 2.51 H new ATOM 0 HB2 ASN A 2 0.312 6.964 9.772 1.00 0.42 H new ATOM 0 HB3 ASN A 2 -0.580 5.457 9.846 1.00 0.42 H new ATOM 0 HD21 ASN A 2 0.063 5.606 13.327 1.00 20.00 H new ATOM 0 HD22 ASN A 2 -1.126 5.807 12.035 1.00 20.00 H new ATOM 34 N ILE A 3 1.378 4.470 6.702 1.00 42.40 N ATOM 35 CA ILE A 3 0.892 4.375 5.322 1.00 53.11 C ATOM 36 C ILE A 3 1.210 3.000 4.697 1.00 40.41 C ATOM 37 O ILE A 3 2.342 2.514 4.772 1.00 23.11 O ATOM 38 CB ILE A 3 1.475 5.516 4.448 1.00 44.21 C ATOM 39 CG1 ILE A 3 0.966 5.415 2.998 1.00 53.43 C ATOM 40 CG2 ILE A 3 3.003 5.512 4.496 1.00 15.30 C ATOM 41 CD1 ILE A 3 1.330 6.610 2.144 1.00 74.33 C ATOM 0 H ILE A 3 2.176 3.869 6.909 1.00 42.40 H new ATOM 0 HA ILE A 3 -0.192 4.482 5.354 1.00 53.11 H new ATOM 0 HB ILE A 3 1.129 6.465 4.857 1.00 44.21 H new ATOM 0 HG12 ILE A 3 1.374 4.514 2.540 1.00 53.43 H new ATOM 0 HG13 ILE A 3 -0.118 5.304 3.009 1.00 53.43 H new ATOM 0 HG21 ILE A 3 3.389 6.321 3.876 1.00 15.30 H new ATOM 0 HG22 ILE A 3 3.335 5.654 5.524 1.00 15.30 H new ATOM 0 HG23 ILE A 3 3.376 4.559 4.122 1.00 15.30 H new ATOM 0 HD11 ILE A 3 0.939 6.470 1.136 1.00 74.33 H new ATOM 0 HD12 ILE A 3 0.899 7.512 2.578 1.00 74.33 H new ATOM 0 HD13 ILE A 3 2.415 6.710 2.102 1.00 74.33 H new ATOM 53 N VAL A 4 0.194 2.378 4.095 1.00 3.00 N ATOM 54 CA VAL A 4 0.338 1.064 3.450 1.00 35.41 C ATOM 55 C VAL A 4 -0.095 1.130 1.977 1.00 62.21 C ATOM 56 O VAL A 4 -1.204 1.557 1.667 1.00 23.30 O ATOM 57 CB VAL A 4 -0.512 -0.017 4.171 1.00 33.23 C ATOM 58 CG1 VAL A 4 -0.287 -1.394 3.546 1.00 64.01 C ATOM 59 CG2 VAL A 4 -0.211 -0.039 5.670 1.00 14.15 C ATOM 0 H VAL A 4 -0.748 2.765 4.039 1.00 3.00 H new ATOM 0 HA VAL A 4 1.391 0.791 3.513 1.00 35.41 H new ATOM 0 HB VAL A 4 -1.563 0.241 4.045 1.00 33.23 H new ATOM 0 HG11 VAL A 4 -0.893 -2.134 4.068 1.00 64.01 H new ATOM 0 HG12 VAL A 4 -0.573 -1.367 2.495 1.00 64.01 H new ATOM 0 HG13 VAL A 4 0.766 -1.664 3.629 1.00 64.01 H new ATOM 0 HG21 VAL A 4 -0.819 -0.805 6.152 1.00 14.15 H new ATOM 0 HG22 VAL A 4 0.844 -0.262 5.826 1.00 14.15 H new ATOM 0 HG23 VAL A 4 -0.443 0.934 6.102 1.00 14.15 H new ATOM 69 N ILE A 5 0.780 0.709 1.068 1.00 44.23 N ATOM 70 CA ILE A 5 0.474 0.737 -0.369 1.00 11.14 C ATOM 71 C ILE A 5 0.222 -0.679 -0.921 1.00 0.00 C ATOM 72 O ILE A 5 1.095 -1.541 -0.867 1.00 20.02 O ATOM 73 CB ILE A 5 1.626 1.403 -1.163 1.00 43.31 C ATOM 74 CG1 ILE A 5 1.928 2.803 -0.592 1.00 14.43 C ATOM 75 CG2 ILE A 5 1.281 1.488 -2.652 1.00 0.32 C ATOM 76 CD1 ILE A 5 3.126 3.483 -1.224 1.00 23.55 C ATOM 0 H ILE A 5 1.705 0.344 1.295 1.00 44.23 H new ATOM 0 HA ILE A 5 -0.436 1.324 -0.493 1.00 11.14 H new ATOM 0 HB ILE A 5 2.519 0.786 -1.059 1.00 43.31 H new ATOM 0 HG12 ILE A 5 1.051 3.436 -0.727 1.00 14.43 H new ATOM 0 HG13 ILE A 5 2.097 2.717 0.481 1.00 14.43 H new ATOM 0 HG21 ILE A 5 2.104 1.959 -3.190 1.00 0.32 H new ATOM 0 HG22 ILE A 5 1.117 0.485 -3.045 1.00 0.32 H new ATOM 0 HG23 ILE A 5 0.376 2.081 -2.782 1.00 0.32 H new ATOM 0 HD11 ILE A 5 3.271 4.462 -0.768 1.00 23.55 H new ATOM 0 HD12 ILE A 5 4.016 2.873 -1.066 1.00 23.55 H new ATOM 0 HD13 ILE A 5 2.954 3.603 -2.294 1.00 23.55 H new ATOM 88 N VAL A 6 -0.979 -0.912 -1.448 1.00 33.12 N ATOM 89 CA VAL A 6 -1.353 -2.219 -2.009 1.00 12.40 C ATOM 90 C VAL A 6 -1.353 -2.182 -3.549 1.00 4.31 C ATOM 91 O VAL A 6 -2.180 -1.508 -4.164 1.00 34.04 O ATOM 92 CB VAL A 6 -2.751 -2.663 -1.504 1.00 72.13 C ATOM 93 CG1 VAL A 6 -3.117 -4.045 -2.046 1.00 24.40 C ATOM 94 CG2 VAL A 6 -2.802 -2.650 0.024 1.00 60.51 C ATOM 0 H VAL A 6 -1.718 -0.210 -1.500 1.00 33.12 H new ATOM 0 HA VAL A 6 -0.608 -2.940 -1.672 1.00 12.40 H new ATOM 0 HB VAL A 6 -3.486 -1.950 -1.878 1.00 72.13 H new ATOM 0 HG11 VAL A 6 -4.102 -4.332 -1.676 1.00 24.40 H new ATOM 0 HG12 VAL A 6 -3.133 -4.016 -3.136 1.00 24.40 H new ATOM 0 HG13 VAL A 6 -2.378 -4.774 -1.713 1.00 24.40 H new ATOM 0 HG21 VAL A 6 -3.791 -2.964 0.358 1.00 60.51 H new ATOM 0 HG22 VAL A 6 -2.051 -3.334 0.419 1.00 60.51 H new ATOM 0 HG23 VAL A 6 -2.600 -1.642 0.386 1.00 60.51 H new ATOM 104 N VAL A 7 -0.425 -2.909 -4.168 1.00 63.02 N ATOM 105 CA VAL A 7 -0.268 -2.891 -5.631 1.00 31.53 C ATOM 106 C VAL A 7 -0.776 -4.191 -6.281 1.00 14.33 C ATOM 107 O VAL A 7 -0.258 -5.269 -6.007 1.00 72.43 O ATOM 108 CB VAL A 7 1.219 -2.686 -6.021 1.00 22.41 C ATOM 109 CG1 VAL A 7 1.386 -2.580 -7.537 1.00 74.20 C ATOM 110 CG2 VAL A 7 1.795 -1.457 -5.324 1.00 33.42 C ATOM 0 H VAL A 7 0.233 -3.520 -3.684 1.00 63.02 H new ATOM 0 HA VAL A 7 -0.868 -2.059 -5.999 1.00 31.53 H new ATOM 0 HB VAL A 7 1.776 -3.562 -5.687 1.00 22.41 H new ATOM 0 HG11 VAL A 7 2.439 -2.437 -7.778 1.00 74.20 H new ATOM 0 HG12 VAL A 7 1.027 -3.496 -8.007 1.00 74.20 H new ATOM 0 HG13 VAL A 7 0.810 -1.732 -7.908 1.00 74.20 H new ATOM 0 HG21 VAL A 7 2.839 -1.332 -5.611 1.00 33.42 H new ATOM 0 HG22 VAL A 7 1.229 -0.573 -5.618 1.00 33.42 H new ATOM 0 HG23 VAL A 7 1.729 -1.587 -4.244 1.00 33.42 H new ATOM 120 N PHE A 8 -1.771 -4.079 -7.162 1.00 15.31 N ATOM 121 CA PHE A 8 -2.316 -5.246 -7.880 1.00 2.13 C ATOM 122 C PHE A 8 -1.528 -5.555 -9.172 1.00 32.13 C ATOM 123 O PHE A 8 -2.099 -5.983 -10.180 1.00 73.05 O ATOM 124 CB PHE A 8 -3.801 -5.018 -8.205 1.00 73.41 C ATOM 125 CG PHE A 8 -4.715 -5.188 -7.015 1.00 25.51 C ATOM 126 CD1 PHE A 8 -4.786 -4.219 -6.023 1.00 31.12 C ATOM 127 CD2 PHE A 8 -5.502 -6.325 -6.887 1.00 21.24 C ATOM 128 CE1 PHE A 8 -5.624 -4.384 -4.934 1.00 64.42 C ATOM 129 CE2 PHE A 8 -6.338 -6.492 -5.803 1.00 35.41 C ATOM 130 CZ PHE A 8 -6.400 -5.521 -4.825 1.00 73.01 C ATOM 0 H PHE A 8 -2.220 -3.195 -7.400 1.00 15.31 H new ATOM 0 HA PHE A 8 -2.215 -6.111 -7.224 1.00 2.13 H new ATOM 0 HB2 PHE A 8 -3.926 -4.013 -8.607 1.00 73.41 H new ATOM 0 HB3 PHE A 8 -4.104 -5.714 -8.987 1.00 73.41 H new ATOM 0 HD1 PHE A 8 -4.181 -3.328 -6.102 1.00 31.12 H new ATOM 0 HD2 PHE A 8 -5.459 -7.090 -7.648 1.00 21.24 H new ATOM 0 HE1 PHE A 8 -5.671 -3.623 -4.169 1.00 64.42 H new ATOM 0 HE2 PHE A 8 -6.944 -7.382 -5.720 1.00 35.41 H new ATOM 0 HZ PHE A 8 -7.054 -5.650 -3.976 1.00 73.01 H new ATOM 140 N SER A 9 -0.207 -5.368 -9.126 1.00 60.24 N ATOM 141 CA SER A 9 0.666 -5.643 -10.280 1.00 40.11 C ATOM 142 C SER A 9 1.554 -6.865 -10.017 1.00 21.35 C ATOM 143 O SER A 9 2.504 -6.798 -9.239 1.00 1.02 O ATOM 144 CB SER A 9 1.548 -4.427 -10.599 1.00 51.42 C ATOM 145 OG SER A 9 2.450 -4.701 -11.664 1.00 25.42 O ATOM 0 H SER A 9 0.287 -5.026 -8.302 1.00 60.24 H new ATOM 0 HA SER A 9 0.024 -5.851 -11.136 1.00 40.11 H new ATOM 0 HB2 SER A 9 0.917 -3.579 -10.864 1.00 51.42 H new ATOM 0 HB3 SER A 9 2.110 -4.141 -9.710 1.00 51.42 H new ATOM 0 HG SER A 9 3.272 -5.095 -11.304 1.00 25.42 H new ATOM 151 N THR A 10 1.238 -7.975 -10.678 1.00 12.20 N ATOM 152 CA THR A 10 1.960 -9.246 -10.488 1.00 33.00 C ATOM 153 C THR A 10 3.464 -9.129 -10.777 1.00 30.33 C ATOM 154 O THR A 10 4.292 -9.703 -10.066 1.00 25.42 O ATOM 155 CB THR A 10 1.376 -10.358 -11.393 1.00 31.20 C ATOM 156 OG1 THR A 10 1.414 -9.943 -12.772 1.00 33.55 O ATOM 157 CG2 THR A 10 -0.062 -10.687 -10.998 1.00 2.41 C ATOM 0 H THR A 10 0.480 -8.027 -11.358 1.00 12.20 H new ATOM 0 HA THR A 10 1.829 -9.503 -9.437 1.00 33.00 H new ATOM 0 HB THR A 10 1.985 -11.253 -11.264 1.00 31.20 H new ATOM 0 HG1 THR A 10 2.329 -10.024 -13.113 1.00 33.55 H new ATOM 0 HG21 THR A 10 -0.448 -11.471 -11.650 1.00 2.41 H new ATOM 0 HG22 THR A 10 -0.086 -11.030 -9.964 1.00 2.41 H new ATOM 0 HG23 THR A 10 -0.680 -9.795 -11.098 1.00 2.41 H new ATOM 165 N ASP A 11 3.817 -8.401 -11.832 1.00 61.32 N ATOM 166 CA ASP A 11 5.219 -8.249 -12.233 1.00 4.15 C ATOM 167 C ASP A 11 5.834 -6.944 -11.693 1.00 23.50 C ATOM 168 O ASP A 11 5.147 -5.929 -11.534 1.00 3.44 O ATOM 169 CB ASP A 11 5.331 -8.319 -13.756 1.00 74.33 C ATOM 170 CG ASP A 11 4.864 -9.667 -14.285 1.00 72.14 C ATOM 171 OD1 ASP A 11 5.682 -10.611 -14.331 1.00 34.41 O ATOM 172 OD2 ASP A 11 3.671 -9.796 -14.626 1.00 74.02 O ATOM 0 H ASP A 11 3.154 -7.905 -12.428 1.00 61.32 H new ATOM 0 HA ASP A 11 5.788 -9.069 -11.795 1.00 4.15 H new ATOM 0 HB2 ASP A 11 4.734 -7.524 -14.203 1.00 74.33 H new ATOM 0 HB3 ASP A 11 6.365 -8.148 -14.055 1.00 74.33 H new ATOM 177 N GLU A 12 7.141 -6.981 -11.434 1.00 12.31 N ATOM 178 CA GLU A 12 7.854 -5.877 -10.778 1.00 72.41 C ATOM 179 C GLU A 12 8.049 -4.665 -11.705 1.00 3.20 C ATOM 180 O GLU A 12 8.360 -3.569 -11.236 1.00 4.01 O ATOM 181 CB GLU A 12 9.227 -6.352 -10.261 1.00 51.40 C ATOM 182 CG GLU A 12 9.184 -7.606 -9.377 1.00 10.34 C ATOM 183 CD GLU A 12 9.302 -8.908 -10.164 1.00 21.05 C ATOM 184 OE1 GLU A 12 8.290 -9.372 -10.731 1.00 53.32 O ATOM 185 OE2 GLU A 12 10.415 -9.473 -10.228 1.00 11.21 O ATOM 0 H GLU A 12 7.737 -7.774 -11.671 1.00 12.31 H new ATOM 0 HA GLU A 12 7.231 -5.559 -9.942 1.00 72.41 H new ATOM 0 HB2 GLU A 12 9.873 -6.550 -11.116 1.00 51.40 H new ATOM 0 HB3 GLU A 12 9.687 -5.542 -9.695 1.00 51.40 H new ATOM 0 HG2 GLU A 12 9.994 -7.556 -8.649 1.00 10.34 H new ATOM 0 HG3 GLU A 12 8.250 -7.613 -8.815 1.00 10.34 H new ATOM 192 N GLU A 13 7.864 -4.866 -13.009 1.00 24.25 N ATOM 193 CA GLU A 13 8.049 -3.802 -14.012 1.00 5.45 C ATOM 194 C GLU A 13 7.343 -2.492 -13.612 1.00 75.34 C ATOM 195 O GLU A 13 7.953 -1.421 -13.605 1.00 61.41 O ATOM 196 CB GLU A 13 7.530 -4.281 -15.377 1.00 74.04 C ATOM 197 CG GLU A 13 8.258 -5.508 -15.925 1.00 42.30 C ATOM 198 CD GLU A 13 9.721 -5.232 -16.255 1.00 45.31 C ATOM 199 OE1 GLU A 13 9.992 -4.660 -17.332 1.00 43.33 O ATOM 200 OE2 GLU A 13 10.604 -5.588 -15.445 1.00 1.53 O ATOM 0 H GLU A 13 7.583 -5.763 -13.405 1.00 24.25 H new ATOM 0 HA GLU A 13 9.116 -3.589 -14.072 1.00 5.45 H new ATOM 0 HB2 GLU A 13 6.468 -4.511 -15.290 1.00 74.04 H new ATOM 0 HB3 GLU A 13 7.622 -3.466 -16.095 1.00 74.04 H new ATOM 0 HG2 GLU A 13 8.202 -6.314 -15.194 1.00 42.30 H new ATOM 0 HG3 GLU A 13 7.748 -5.856 -16.823 1.00 42.30 H new ATOM 207 N THR A 14 6.056 -2.582 -13.280 1.00 12.34 N ATOM 208 CA THR A 14 5.286 -1.406 -12.842 1.00 75.51 C ATOM 209 C THR A 14 5.704 -0.953 -11.433 1.00 1.33 C ATOM 210 O THR A 14 5.869 0.241 -11.176 1.00 44.44 O ATOM 211 CB THR A 14 3.759 -1.690 -12.862 1.00 44.20 C ATOM 212 OG1 THR A 14 3.320 -1.916 -14.212 1.00 51.33 O ATOM 213 CG2 THR A 14 2.961 -0.537 -12.260 1.00 43.13 C ATOM 0 H THR A 14 5.521 -3.450 -13.304 1.00 12.34 H new ATOM 0 HA THR A 14 5.505 -0.605 -13.548 1.00 75.51 H new ATOM 0 HB THR A 14 3.583 -2.579 -12.257 1.00 44.20 H new ATOM 0 HG1 THR A 14 2.357 -2.096 -14.217 1.00 51.33 H new ATOM 0 HG21 THR A 14 1.898 -0.774 -12.293 1.00 43.13 H new ATOM 0 HG22 THR A 14 3.267 -0.384 -11.225 1.00 43.13 H new ATOM 0 HG23 THR A 14 3.147 0.372 -12.832 1.00 43.13 H new ATOM 221 N LEU A 15 5.897 -1.918 -10.533 1.00 31.54 N ATOM 222 CA LEU A 15 6.291 -1.638 -9.142 1.00 10.43 C ATOM 223 C LEU A 15 7.590 -0.810 -9.073 1.00 64.23 C ATOM 224 O LEU A 15 7.761 0.034 -8.188 1.00 62.15 O ATOM 225 CB LEU A 15 6.470 -2.961 -8.381 1.00 60.33 C ATOM 226 CG LEU A 15 6.862 -2.831 -6.898 1.00 61.20 C ATOM 227 CD1 LEU A 15 5.760 -2.130 -6.104 1.00 23.01 C ATOM 228 CD2 LEU A 15 7.173 -4.206 -6.306 1.00 64.34 C ATOM 0 H LEU A 15 5.787 -2.911 -10.740 1.00 31.54 H new ATOM 0 HA LEU A 15 5.499 -1.049 -8.679 1.00 10.43 H new ATOM 0 HB2 LEU A 15 5.538 -3.524 -8.443 1.00 60.33 H new ATOM 0 HB3 LEU A 15 7.233 -3.551 -8.889 1.00 60.33 H new ATOM 0 HG LEU A 15 7.762 -2.219 -6.832 1.00 61.20 H new ATOM 0 HD11 LEU A 15 6.059 -2.050 -5.059 1.00 23.01 H new ATOM 0 HD12 LEU A 15 5.596 -1.133 -6.512 1.00 23.01 H new ATOM 0 HD13 LEU A 15 4.838 -2.707 -6.174 1.00 23.01 H new ATOM 0 HD21 LEU A 15 7.448 -4.097 -5.257 1.00 64.34 H new ATOM 0 HD22 LEU A 15 6.293 -4.844 -6.385 1.00 64.34 H new ATOM 0 HD23 LEU A 15 8.000 -4.659 -6.853 1.00 64.34 H new ATOM 240 N ARG A 16 8.497 -1.063 -10.016 1.00 51.30 N ATOM 241 CA ARG A 16 9.772 -0.340 -10.106 1.00 23.10 C ATOM 242 C ARG A 16 9.561 1.186 -10.156 1.00 52.31 C ATOM 243 O ARG A 16 10.298 1.948 -9.523 1.00 4.45 O ATOM 244 CB ARG A 16 10.538 -0.811 -11.355 1.00 60.32 C ATOM 245 CG ARG A 16 11.876 -0.107 -11.579 1.00 52.43 C ATOM 246 CD ARG A 16 12.909 -0.462 -10.510 1.00 65.31 C ATOM 247 NE ARG A 16 14.128 0.333 -10.657 1.00 72.44 N ATOM 248 CZ ARG A 16 15.277 0.043 -10.108 1.00 5.14 C ATOM 249 NH1 ARG A 16 15.440 -1.056 -9.437 1.00 43.43 N ATOM 250 NH2 ARG A 16 16.277 0.851 -10.261 1.00 62.42 N ATOM 0 H ARG A 16 8.372 -1.772 -10.739 1.00 51.30 H new ATOM 0 HA ARG A 16 10.353 -0.559 -9.210 1.00 23.10 H new ATOM 0 HB2 ARG A 16 10.715 -1.884 -11.275 1.00 60.32 H new ATOM 0 HB3 ARG A 16 9.909 -0.656 -12.232 1.00 60.32 H new ATOM 0 HG2 ARG A 16 12.266 -0.377 -12.560 1.00 52.43 H new ATOM 0 HG3 ARG A 16 11.719 0.972 -11.584 1.00 52.43 H new ATOM 0 HD2 ARG A 16 12.482 -0.296 -9.521 1.00 65.31 H new ATOM 0 HD3 ARG A 16 13.154 -1.522 -10.577 1.00 65.31 H new ATOM 0 HE ARG A 16 14.077 1.175 -11.230 1.00 72.44 H new ATOM 0 HH11 ARG A 16 14.664 -1.709 -9.332 1.00 43.43 H new ATOM 0 HH12 ARG A 16 16.344 -1.266 -9.015 1.00 43.43 H new ATOM 0 HH21 ARG A 16 16.163 1.705 -10.806 1.00 62.42 H new ATOM 0 HH22 ARG A 16 17.178 0.633 -9.836 1.00 62.42 H new ATOM 264 N LYS A 17 8.543 1.620 -10.898 1.00 51.34 N ATOM 265 CA LYS A 17 8.242 3.052 -11.043 1.00 63.10 C ATOM 266 C LYS A 17 7.750 3.671 -9.725 1.00 21.43 C ATOM 267 O LYS A 17 7.973 4.856 -9.467 1.00 64.34 O ATOM 268 CB LYS A 17 7.206 3.276 -12.158 1.00 2.44 C ATOM 269 CG LYS A 17 7.794 3.244 -13.572 1.00 12.24 C ATOM 270 CD LYS A 17 8.448 1.904 -13.903 1.00 32.52 C ATOM 271 CE LYS A 17 9.186 1.948 -15.238 1.00 25.11 C ATOM 272 NZ LYS A 17 10.305 2.931 -15.226 1.00 65.34 N ATOM 0 H LYS A 17 7.911 1.005 -11.409 1.00 51.34 H new ATOM 0 HA LYS A 17 9.171 3.553 -11.315 1.00 63.10 H new ATOM 0 HB2 LYS A 17 6.433 2.512 -12.080 1.00 2.44 H new ATOM 0 HB3 LYS A 17 6.720 4.239 -12.000 1.00 2.44 H new ATOM 0 HG2 LYS A 17 7.004 3.448 -14.295 1.00 12.24 H new ATOM 0 HG3 LYS A 17 8.532 4.040 -13.673 1.00 12.24 H new ATOM 0 HD2 LYS A 17 9.146 1.635 -13.110 1.00 32.52 H new ATOM 0 HD3 LYS A 17 7.686 1.125 -13.935 1.00 32.52 H new ATOM 0 HE2 LYS A 17 9.577 0.957 -15.469 1.00 25.11 H new ATOM 0 HE3 LYS A 17 8.485 2.207 -16.031 1.00 25.11 H new ATOM 0 HZ1 LYS A 17 10.957 2.724 -16.009 1.00 65.34 H new ATOM 0 HZ2 LYS A 17 9.924 3.892 -15.338 1.00 65.34 H new ATOM 0 HZ3 LYS A 17 10.816 2.864 -14.323 1.00 65.34 H new ATOM 286 N PHE A 18 7.084 2.869 -8.898 1.00 62.41 N ATOM 287 CA PHE A 18 6.616 3.333 -7.586 1.00 32.30 C ATOM 288 C PHE A 18 7.781 3.500 -6.605 1.00 61.42 C ATOM 289 O PHE A 18 7.809 4.445 -5.813 1.00 1.43 O ATOM 290 CB PHE A 18 5.570 2.366 -7.020 1.00 52.32 C ATOM 291 CG PHE A 18 4.262 2.419 -7.767 1.00 12.13 C ATOM 292 CD1 PHE A 18 4.127 1.805 -9.003 1.00 45.13 C ATOM 293 CD2 PHE A 18 3.172 3.100 -7.240 1.00 30.31 C ATOM 294 CE1 PHE A 18 2.935 1.870 -9.696 1.00 62.42 C ATOM 295 CE2 PHE A 18 1.978 3.163 -7.929 1.00 4.32 C ATOM 296 CZ PHE A 18 1.860 2.548 -9.158 1.00 24.50 C ATOM 0 H PHE A 18 6.855 1.898 -9.108 1.00 62.41 H new ATOM 0 HA PHE A 18 6.153 4.311 -7.721 1.00 32.30 H new ATOM 0 HB2 PHE A 18 5.963 1.350 -7.057 1.00 52.32 H new ATOM 0 HB3 PHE A 18 5.394 2.602 -5.971 1.00 52.32 H new ATOM 0 HD1 PHE A 18 4.964 1.270 -9.428 1.00 45.13 H new ATOM 0 HD2 PHE A 18 3.260 3.586 -6.280 1.00 30.31 H new ATOM 0 HE1 PHE A 18 2.844 1.390 -10.659 1.00 62.42 H new ATOM 0 HE2 PHE A 18 1.137 3.693 -7.507 1.00 4.32 H new ATOM 0 HZ PHE A 18 0.927 2.597 -9.699 1.00 24.50 H new ATOM 306 N LYS A 19 8.744 2.580 -6.664 1.00 2.24 N ATOM 307 CA LYS A 19 9.970 2.697 -5.868 1.00 30.41 C ATOM 308 C LYS A 19 10.683 4.024 -6.166 1.00 54.52 C ATOM 309 O LYS A 19 11.090 4.745 -5.254 1.00 1.13 O ATOM 310 CB LYS A 19 10.921 1.526 -6.155 1.00 45.24 C ATOM 311 CG LYS A 19 10.390 0.163 -5.721 1.00 30.42 C ATOM 312 CD LYS A 19 11.427 -0.934 -5.952 1.00 25.12 C ATOM 313 CE LYS A 19 10.993 -2.271 -5.367 1.00 30.55 C ATOM 314 NZ LYS A 19 12.061 -3.297 -5.481 1.00 60.01 N ATOM 0 H LYS A 19 8.701 1.748 -7.252 1.00 2.24 H new ATOM 0 HA LYS A 19 9.688 2.672 -4.815 1.00 30.41 H new ATOM 0 HB2 LYS A 19 11.130 1.497 -7.224 1.00 45.24 H new ATOM 0 HB3 LYS A 19 11.869 1.711 -5.650 1.00 45.24 H new ATOM 0 HG2 LYS A 19 10.120 0.195 -4.666 1.00 30.42 H new ATOM 0 HG3 LYS A 19 9.481 -0.070 -6.276 1.00 30.42 H new ATOM 0 HD2 LYS A 19 11.601 -1.047 -7.022 1.00 25.12 H new ATOM 0 HD3 LYS A 19 12.375 -0.635 -5.505 1.00 25.12 H new ATOM 0 HE2 LYS A 19 10.726 -2.139 -4.318 1.00 30.55 H new ATOM 0 HE3 LYS A 19 10.098 -2.620 -5.882 1.00 30.55 H new ATOM 0 HZ1 LYS A 19 11.727 -4.193 -5.072 1.00 60.01 H new ATOM 0 HZ2 LYS A 19 12.298 -3.441 -6.483 1.00 60.01 H new ATOM 0 HZ3 LYS A 19 12.907 -2.976 -4.968 1.00 60.01 H new ATOM 328 N ASP A 20 10.814 4.337 -7.455 1.00 73.22 N ATOM 329 CA ASP A 20 11.444 5.583 -7.901 1.00 24.45 C ATOM 330 C ASP A 20 10.752 6.817 -7.294 1.00 72.11 C ATOM 331 O ASP A 20 11.417 7.743 -6.821 1.00 11.20 O ATOM 332 CB ASP A 20 11.415 5.648 -9.433 1.00 72.22 C ATOM 333 CG ASP A 20 12.022 6.928 -9.982 1.00 64.10 C ATOM 334 OD1 ASP A 20 13.255 7.099 -9.877 1.00 14.11 O ATOM 335 OD2 ASP A 20 11.275 7.767 -10.527 1.00 33.32 O ATOM 0 H ASP A 20 10.490 3.740 -8.216 1.00 73.22 H new ATOM 0 HA ASP A 20 12.478 5.590 -7.555 1.00 24.45 H new ATOM 0 HB2 ASP A 20 11.956 4.793 -9.838 1.00 72.22 H new ATOM 0 HB3 ASP A 20 10.384 5.565 -9.776 1.00 72.22 H new ATOM 340 N ILE A 21 9.419 6.816 -7.299 1.00 55.41 N ATOM 341 CA ILE A 21 8.636 7.926 -6.737 1.00 20.34 C ATOM 342 C ILE A 21 8.910 8.116 -5.231 1.00 3.41 C ATOM 343 O ILE A 21 9.291 9.205 -4.793 1.00 3.23 O ATOM 344 CB ILE A 21 7.115 7.703 -6.962 1.00 74.35 C ATOM 345 CG1 ILE A 21 6.800 7.669 -8.469 1.00 54.21 C ATOM 346 CG2 ILE A 21 6.292 8.785 -6.262 1.00 55.35 C ATOM 347 CD1 ILE A 21 5.344 7.388 -8.791 1.00 14.33 C ATOM 0 H ILE A 21 8.855 6.060 -7.686 1.00 55.41 H new ATOM 0 HA ILE A 21 8.949 8.829 -7.260 1.00 20.34 H new ATOM 0 HB ILE A 21 6.841 6.742 -6.526 1.00 74.35 H new ATOM 0 HG12 ILE A 21 7.080 8.626 -8.910 1.00 54.21 H new ATOM 0 HG13 ILE A 21 7.419 6.907 -8.942 1.00 54.21 H new ATOM 0 HG21 ILE A 21 5.231 8.605 -6.436 1.00 55.35 H new ATOM 0 HG22 ILE A 21 6.494 8.760 -5.191 1.00 55.35 H new ATOM 0 HG23 ILE A 21 6.564 9.763 -6.659 1.00 55.35 H new ATOM 0 HD11 ILE A 21 5.205 7.381 -9.872 1.00 14.33 H new ATOM 0 HD12 ILE A 21 5.062 6.418 -8.382 1.00 14.33 H new ATOM 0 HD13 ILE A 21 4.718 8.163 -8.350 1.00 14.33 H new ATOM 359 N ILE A 22 8.730 7.052 -4.449 1.00 63.31 N ATOM 360 CA ILE A 22 8.938 7.113 -2.994 1.00 45.03 C ATOM 361 C ILE A 22 10.373 7.557 -2.640 1.00 64.11 C ATOM 362 O ILE A 22 10.587 8.359 -1.723 1.00 52.02 O ATOM 363 CB ILE A 22 8.644 5.743 -2.332 1.00 23.43 C ATOM 364 CG1 ILE A 22 7.209 5.290 -2.658 1.00 25.14 C ATOM 365 CG2 ILE A 22 8.854 5.815 -0.818 1.00 13.11 C ATOM 366 CD1 ILE A 22 6.851 3.926 -2.100 1.00 15.33 C ATOM 0 H ILE A 22 8.441 6.136 -4.794 1.00 63.31 H new ATOM 0 HA ILE A 22 8.241 7.856 -2.607 1.00 45.03 H new ATOM 0 HB ILE A 22 9.341 5.009 -2.736 1.00 23.43 H new ATOM 0 HG12 ILE A 22 6.508 6.027 -2.266 1.00 25.14 H new ATOM 0 HG13 ILE A 22 7.081 5.273 -3.740 1.00 25.14 H new ATOM 0 HG21 ILE A 22 8.642 4.842 -0.375 1.00 13.11 H new ATOM 0 HG22 ILE A 22 9.887 6.093 -0.607 1.00 13.11 H new ATOM 0 HG23 ILE A 22 8.183 6.562 -0.393 1.00 13.11 H new ATOM 0 HD11 ILE A 22 5.825 3.679 -2.373 1.00 15.33 H new ATOM 0 HD12 ILE A 22 7.526 3.176 -2.512 1.00 15.33 H new ATOM 0 HD13 ILE A 22 6.944 3.941 -1.014 1.00 15.33 H new ATOM 378 N LYS A 23 11.358 7.034 -3.375 1.00 10.51 N ATOM 379 CA LYS A 23 12.760 7.436 -3.191 1.00 51.15 C ATOM 380 C LYS A 23 12.964 8.917 -3.540 1.00 32.33 C ATOM 381 O LYS A 23 13.757 9.616 -2.904 1.00 44.30 O ATOM 382 CB LYS A 23 13.691 6.577 -4.056 1.00 1.12 C ATOM 383 CG LYS A 23 13.675 5.094 -3.706 1.00 24.41 C ATOM 384 CD LYS A 23 14.587 4.297 -4.633 1.00 31.13 C ATOM 385 CE LYS A 23 14.505 2.801 -4.367 1.00 51.40 C ATOM 386 NZ LYS A 23 15.442 2.038 -5.231 1.00 41.11 N ATOM 0 H LYS A 23 11.214 6.333 -4.102 1.00 10.51 H new ATOM 0 HA LYS A 23 13.005 7.285 -2.140 1.00 51.15 H new ATOM 0 HB2 LYS A 23 13.409 6.695 -5.102 1.00 1.12 H new ATOM 0 HB3 LYS A 23 14.710 6.952 -3.956 1.00 1.12 H new ATOM 0 HG2 LYS A 23 13.995 4.958 -2.673 1.00 24.41 H new ATOM 0 HG3 LYS A 23 12.657 4.712 -3.777 1.00 24.41 H new ATOM 0 HD2 LYS A 23 14.314 4.496 -5.669 1.00 31.13 H new ATOM 0 HD3 LYS A 23 15.616 4.632 -4.505 1.00 31.13 H new ATOM 0 HE2 LYS A 23 14.734 2.604 -3.320 1.00 51.40 H new ATOM 0 HE3 LYS A 23 13.486 2.456 -4.541 1.00 51.40 H new ATOM 0 HZ1 LYS A 23 15.358 1.023 -5.022 1.00 41.11 H new ATOM 0 HZ2 LYS A 23 15.208 2.206 -6.230 1.00 41.11 H new ATOM 0 HZ3 LYS A 23 16.417 2.350 -5.047 1.00 41.11 H new ATOM 400 N LYS A 24 12.241 9.384 -4.557 1.00 35.32 N ATOM 401 CA LYS A 24 12.330 10.776 -5.007 1.00 61.42 C ATOM 402 C LYS A 24 11.714 11.734 -3.971 1.00 24.15 C ATOM 403 O LYS A 24 12.160 12.872 -3.816 1.00 12.13 O ATOM 404 CB LYS A 24 11.621 10.935 -6.359 1.00 11.11 C ATOM 405 CG LYS A 24 11.882 12.269 -7.052 1.00 62.11 C ATOM 406 CD LYS A 24 11.141 12.368 -8.382 1.00 23.21 C ATOM 407 CE LYS A 24 11.605 13.568 -9.202 1.00 70.55 C ATOM 408 NZ LYS A 24 13.026 13.438 -9.631 1.00 33.25 N ATOM 0 H LYS A 24 11.582 8.816 -5.089 1.00 35.32 H new ATOM 0 HA LYS A 24 13.384 11.032 -5.120 1.00 61.42 H new ATOM 0 HB2 LYS A 24 11.938 10.128 -7.019 1.00 11.11 H new ATOM 0 HB3 LYS A 24 10.547 10.821 -6.209 1.00 11.11 H new ATOM 0 HG2 LYS A 24 11.570 13.085 -6.400 1.00 62.11 H new ATOM 0 HG3 LYS A 24 12.952 12.388 -7.222 1.00 62.11 H new ATOM 0 HD2 LYS A 24 11.298 11.454 -8.955 1.00 23.21 H new ATOM 0 HD3 LYS A 24 10.070 12.447 -8.196 1.00 23.21 H new ATOM 0 HE2 LYS A 24 10.970 13.673 -10.081 1.00 70.55 H new ATOM 0 HE3 LYS A 24 11.486 14.477 -8.612 1.00 70.55 H new ATOM 0 HZ1 LYS A 24 13.217 14.105 -10.405 1.00 33.25 H new ATOM 0 HZ2 LYS A 24 13.652 13.651 -8.828 1.00 33.25 H new ATOM 0 HZ3 LYS A 24 13.202 12.467 -9.959 1.00 33.25 H new ATOM 422 N ASN A 25 10.677 11.262 -3.276 1.00 55.01 N ATOM 423 CA ASN A 25 10.040 12.031 -2.199 1.00 55.23 C ATOM 424 C ASN A 25 10.920 12.052 -0.935 1.00 24.32 C ATOM 425 O ASN A 25 10.929 13.031 -0.187 1.00 31.13 O ATOM 426 CB ASN A 25 8.662 11.439 -1.872 1.00 65.00 C ATOM 427 CG ASN A 25 7.727 11.412 -3.075 1.00 54.24 C ATOM 428 OD1 ASN A 25 6.886 10.533 -3.198 1.00 54.14 O ATOM 429 ND2 ASN A 25 7.852 12.377 -3.968 1.00 52.31 N ATOM 0 H ASN A 25 10.257 10.347 -3.439 1.00 55.01 H new ATOM 0 HA ASN A 25 9.917 13.058 -2.543 1.00 55.23 H new ATOM 0 HB2 ASN A 25 8.789 10.425 -1.494 1.00 65.00 H new ATOM 0 HB3 ASN A 25 8.202 12.022 -1.074 1.00 65.00 H new ATOM 0 HD21 ASN A 25 7.239 12.400 -4.783 1.00 52.31 H new ATOM 0 HD22 ASN A 25 8.562 13.099 -3.843 1.00 52.31 H new ATOM 436 N GLY A 26 11.656 10.963 -0.702 1.00 30.24 N ATOM 437 CA GLY A 26 12.589 10.905 0.425 1.00 43.14 C ATOM 438 C GLY A 26 12.170 9.942 1.535 1.00 70.42 C ATOM 439 O GLY A 26 12.284 10.264 2.721 1.00 11.45 O ATOM 0 H GLY A 26 11.625 10.118 -1.272 1.00 30.24 H new ATOM 0 HA2 GLY A 26 13.571 10.610 0.055 1.00 43.14 H new ATOM 0 HA3 GLY A 26 12.694 11.904 0.847 1.00 43.14 H new ATOM 443 N PHE A 27 11.699 8.754 1.158 1.00 35.13 N ATOM 444 CA PHE A 27 11.292 7.734 2.137 1.00 21.02 C ATOM 445 C PHE A 27 11.899 6.359 1.815 1.00 14.23 C ATOM 446 O PHE A 27 12.535 6.169 0.777 1.00 74.03 O ATOM 447 CB PHE A 27 9.763 7.633 2.201 1.00 11.14 C ATOM 448 CG PHE A 27 9.105 8.834 2.830 1.00 33.44 C ATOM 449 CD1 PHE A 27 8.761 9.941 2.067 1.00 62.32 C ATOM 450 CD2 PHE A 27 8.837 8.857 4.191 1.00 43.54 C ATOM 451 CE1 PHE A 27 8.167 11.043 2.649 1.00 72.13 C ATOM 452 CE2 PHE A 27 8.242 9.956 4.777 1.00 51.14 C ATOM 453 CZ PHE A 27 7.906 11.050 4.005 1.00 2.42 C ATOM 0 H PHE A 27 11.588 8.470 0.185 1.00 35.13 H new ATOM 0 HA PHE A 27 11.672 8.046 3.110 1.00 21.02 H new ATOM 0 HB2 PHE A 27 9.373 7.503 1.191 1.00 11.14 H new ATOM 0 HB3 PHE A 27 9.489 6.742 2.766 1.00 11.14 H new ATOM 0 HD1 PHE A 27 8.960 9.940 1.006 1.00 62.32 H new ATOM 0 HD2 PHE A 27 9.097 8.004 4.800 1.00 43.54 H new ATOM 0 HE1 PHE A 27 7.907 11.899 2.044 1.00 72.13 H new ATOM 0 HE2 PHE A 27 8.040 9.960 5.838 1.00 51.14 H new ATOM 0 HZ PHE A 27 7.439 11.911 4.461 1.00 2.42 H new ATOM 463 N LYS A 28 11.704 5.405 2.724 1.00 34.52 N ATOM 464 CA LYS A 28 12.236 4.044 2.559 1.00 11.03 C ATOM 465 C LYS A 28 11.146 3.067 2.090 1.00 45.51 C ATOM 466 O LYS A 28 10.045 3.048 2.632 1.00 61.33 O ATOM 467 CB LYS A 28 12.855 3.561 3.881 1.00 35.41 C ATOM 468 CG LYS A 28 14.056 4.385 4.365 1.00 21.14 C ATOM 469 CD LYS A 28 15.329 4.147 3.534 1.00 35.23 C ATOM 470 CE LYS A 28 15.350 4.941 2.227 1.00 51.15 C ATOM 471 NZ LYS A 28 15.420 6.411 2.461 1.00 1.40 N ATOM 0 H LYS A 28 11.180 5.546 3.588 1.00 34.52 H new ATOM 0 HA LYS A 28 13.007 4.072 1.789 1.00 11.03 H new ATOM 0 HB2 LYS A 28 12.086 3.576 4.653 1.00 35.41 H new ATOM 0 HB3 LYS A 28 13.167 2.523 3.763 1.00 35.41 H new ATOM 0 HG2 LYS A 28 13.800 5.444 4.330 1.00 21.14 H new ATOM 0 HG3 LYS A 28 14.260 4.141 5.408 1.00 21.14 H new ATOM 0 HD2 LYS A 28 16.201 4.417 4.130 1.00 35.23 H new ATOM 0 HD3 LYS A 28 15.415 3.084 3.308 1.00 35.23 H new ATOM 0 HE2 LYS A 28 16.206 4.629 1.628 1.00 51.15 H new ATOM 0 HE3 LYS A 28 14.455 4.709 1.649 1.00 51.15 H new ATOM 0 HZ1 LYS A 28 14.604 6.873 2.012 1.00 1.40 H new ATOM 0 HZ2 LYS A 28 15.407 6.601 3.483 1.00 1.40 H new ATOM 0 HZ3 LYS A 28 16.299 6.786 2.051 1.00 1.40 H new ATOM 485 N VAL A 29 11.468 2.247 1.090 1.00 33.54 N ATOM 486 CA VAL A 29 10.486 1.338 0.478 1.00 41.33 C ATOM 487 C VAL A 29 10.600 -0.099 1.020 1.00 3.41 C ATOM 488 O VAL A 29 11.700 -0.629 1.185 1.00 64.14 O ATOM 489 CB VAL A 29 10.658 1.301 -1.063 1.00 22.11 C ATOM 490 CG1 VAL A 29 9.559 0.463 -1.718 1.00 52.24 C ATOM 491 CG2 VAL A 29 10.687 2.714 -1.643 1.00 45.33 C ATOM 0 H VAL A 29 12.401 2.190 0.683 1.00 33.54 H new ATOM 0 HA VAL A 29 9.503 1.729 0.738 1.00 41.33 H new ATOM 0 HB VAL A 29 11.615 0.828 -1.282 1.00 22.11 H new ATOM 0 HG11 VAL A 29 9.704 0.454 -2.798 1.00 52.24 H new ATOM 0 HG12 VAL A 29 9.604 -0.557 -1.337 1.00 52.24 H new ATOM 0 HG13 VAL A 29 8.585 0.894 -1.486 1.00 52.24 H new ATOM 0 HG21 VAL A 29 10.808 2.661 -2.725 1.00 45.33 H new ATOM 0 HG22 VAL A 29 9.753 3.223 -1.407 1.00 45.33 H new ATOM 0 HG23 VAL A 29 11.521 3.268 -1.211 1.00 45.33 H new ATOM 501 N ARG A 30 9.452 -0.717 1.307 1.00 54.32 N ATOM 502 CA ARG A 30 9.387 -2.141 1.671 1.00 71.22 C ATOM 503 C ARG A 30 8.435 -2.891 0.729 1.00 42.13 C ATOM 504 O ARG A 30 7.272 -2.525 0.607 1.00 0.32 O ATOM 505 CB ARG A 30 8.908 -2.299 3.123 1.00 33.34 C ATOM 506 CG ARG A 30 9.875 -1.741 4.160 1.00 54.33 C ATOM 507 CD ARG A 30 11.202 -2.490 4.155 1.00 64.24 C ATOM 508 NE ARG A 30 12.140 -1.951 5.135 1.00 12.21 N ATOM 509 CZ ARG A 30 12.965 -2.678 5.838 1.00 34.34 C ATOM 510 NH1 ARG A 30 12.987 -3.967 5.709 1.00 23.23 N ATOM 511 NH2 ARG A 30 13.770 -2.104 6.670 1.00 2.22 N ATOM 0 H ARG A 30 8.545 -0.251 1.295 1.00 54.32 H new ATOM 0 HA ARG A 30 10.387 -2.565 1.577 1.00 71.22 H new ATOM 0 HB2 ARG A 30 7.945 -1.800 3.233 1.00 33.34 H new ATOM 0 HB3 ARG A 30 8.743 -3.357 3.327 1.00 33.34 H new ATOM 0 HG2 ARG A 30 10.053 -0.684 3.960 1.00 54.33 H new ATOM 0 HG3 ARG A 30 9.424 -1.806 5.150 1.00 54.33 H new ATOM 0 HD2 ARG A 30 11.024 -3.544 4.366 1.00 64.24 H new ATOM 0 HD3 ARG A 30 11.645 -2.435 3.161 1.00 64.24 H new ATOM 0 HE ARG A 30 12.151 -0.941 5.280 1.00 12.21 H new ATOM 0 HH11 ARG A 30 12.355 -4.425 5.052 1.00 23.23 H new ATOM 0 HH12 ARG A 30 13.636 -4.524 6.264 1.00 23.23 H new ATOM 0 HH21 ARG A 30 13.758 -1.089 6.774 1.00 2.22 H new ATOM 0 HH22 ARG A 30 14.418 -2.666 7.223 1.00 2.22 H new ATOM 525 N THR A 31 8.922 -3.937 0.065 1.00 74.01 N ATOM 526 CA THR A 31 8.092 -4.702 -0.882 1.00 1.10 C ATOM 527 C THR A 31 7.789 -6.115 -0.368 1.00 3.23 C ATOM 528 O THR A 31 8.647 -6.998 -0.398 1.00 3.13 O ATOM 529 CB THR A 31 8.759 -4.801 -2.274 1.00 31.21 C ATOM 530 OG1 THR A 31 10.104 -5.293 -2.155 1.00 14.10 O ATOM 531 CG2 THR A 31 8.769 -3.442 -2.964 1.00 53.53 C ATOM 0 H THR A 31 9.879 -4.278 0.159 1.00 74.01 H new ATOM 0 HA THR A 31 7.154 -4.154 -0.974 1.00 1.10 H new ATOM 0 HB THR A 31 8.178 -5.499 -2.877 1.00 31.21 H new ATOM 0 HG1 THR A 31 10.132 -6.012 -1.489 1.00 14.10 H new ATOM 0 HG21 THR A 31 9.242 -3.534 -3.942 1.00 53.53 H new ATOM 0 HG22 THR A 31 7.745 -3.090 -3.088 1.00 53.53 H new ATOM 0 HG23 THR A 31 9.327 -2.729 -2.356 1.00 53.53 H new ATOM 539 N VAL A 32 6.563 -6.315 0.105 1.00 23.01 N ATOM 540 CA VAL A 32 6.124 -7.604 0.650 1.00 10.25 C ATOM 541 C VAL A 32 5.323 -8.418 -0.382 1.00 60.44 C ATOM 542 O VAL A 32 4.441 -7.886 -1.056 1.00 31.21 O ATOM 543 CB VAL A 32 5.244 -7.386 1.904 1.00 62.10 C ATOM 544 CG1 VAL A 32 4.689 -8.709 2.427 1.00 64.00 C ATOM 545 CG2 VAL A 32 6.027 -6.654 2.993 1.00 21.52 C ATOM 0 H VAL A 32 5.844 -5.592 0.123 1.00 23.01 H new ATOM 0 HA VAL A 32 7.022 -8.162 0.913 1.00 10.25 H new ATOM 0 HB VAL A 32 4.397 -6.763 1.615 1.00 62.10 H new ATOM 0 HG11 VAL A 32 4.075 -8.523 3.308 1.00 64.00 H new ATOM 0 HG12 VAL A 32 4.081 -9.180 1.654 1.00 64.00 H new ATOM 0 HG13 VAL A 32 5.514 -9.370 2.693 1.00 64.00 H new ATOM 0 HG21 VAL A 32 5.390 -6.511 3.866 1.00 21.52 H new ATOM 0 HG22 VAL A 32 6.899 -7.245 3.273 1.00 21.52 H new ATOM 0 HG23 VAL A 32 6.352 -5.683 2.618 1.00 21.52 H new ATOM 555 N ARG A 33 5.630 -9.711 -0.494 1.00 3.10 N ATOM 556 CA ARG A 33 4.889 -10.613 -1.389 1.00 15.44 C ATOM 557 C ARG A 33 4.423 -11.881 -0.639 1.00 54.22 C ATOM 558 O ARG A 33 3.898 -12.818 -1.239 1.00 13.44 O ATOM 559 CB ARG A 33 5.773 -10.983 -2.593 1.00 2.13 C ATOM 560 CG ARG A 33 5.031 -11.689 -3.730 1.00 14.23 C ATOM 561 CD ARG A 33 5.962 -12.017 -4.891 1.00 12.21 C ATOM 562 NE ARG A 33 7.045 -12.914 -4.488 1.00 13.33 N ATOM 563 CZ ARG A 33 8.089 -13.171 -5.223 1.00 33.42 C ATOM 564 NH1 ARG A 33 8.249 -12.591 -6.369 1.00 12.13 N ATOM 565 NH2 ARG A 33 8.982 -14.003 -4.802 1.00 25.53 N ATOM 0 H ARG A 33 6.386 -10.161 0.022 1.00 3.10 H new ATOM 0 HA ARG A 33 3.997 -10.099 -1.747 1.00 15.44 H new ATOM 0 HB2 ARG A 33 6.232 -10.075 -2.984 1.00 2.13 H new ATOM 0 HB3 ARG A 33 6.583 -11.627 -2.249 1.00 2.13 H new ATOM 0 HG2 ARG A 33 4.579 -12.607 -3.355 1.00 14.23 H new ATOM 0 HG3 ARG A 33 4.218 -11.055 -4.083 1.00 14.23 H new ATOM 0 HD2 ARG A 33 5.390 -12.478 -5.696 1.00 12.21 H new ATOM 0 HD3 ARG A 33 6.384 -11.094 -5.289 1.00 12.21 H new ATOM 0 HE ARG A 33 6.978 -13.366 -3.576 1.00 13.33 H new ATOM 0 HH11 ARG A 33 7.553 -11.925 -6.705 1.00 12.13 H new ATOM 0 HH12 ARG A 33 9.071 -12.800 -6.936 1.00 12.13 H new ATOM 0 HH21 ARG A 33 8.869 -14.457 -3.896 1.00 25.53 H new ATOM 0 HH22 ARG A 33 9.801 -14.206 -5.376 1.00 25.53 H new ATOM 579 N SER A 34 4.614 -11.894 0.680 1.00 61.23 N ATOM 580 CA SER A 34 4.199 -13.031 1.523 1.00 34.55 C ATOM 581 C SER A 34 3.979 -12.588 2.982 1.00 54.02 C ATOM 582 O SER A 34 4.634 -11.657 3.455 1.00 63.41 O ATOM 583 CB SER A 34 5.254 -14.149 1.481 1.00 42.31 C ATOM 584 OG SER A 34 6.496 -13.706 2.007 1.00 2.33 O ATOM 0 H SER A 34 5.054 -11.131 1.195 1.00 61.23 H new ATOM 0 HA SER A 34 3.257 -13.409 1.125 1.00 34.55 H new ATOM 0 HB2 SER A 34 4.900 -15.007 2.052 1.00 42.31 H new ATOM 0 HB3 SER A 34 5.391 -14.484 0.453 1.00 42.31 H new ATOM 0 HG SER A 34 6.909 -13.074 1.382 1.00 2.33 H new ATOM 590 N PRO A 35 3.057 -13.249 3.723 1.00 32.33 N ATOM 591 CA PRO A 35 2.757 -12.892 5.127 1.00 11.15 C ATOM 592 C PRO A 35 4.007 -12.893 6.028 1.00 61.01 C ATOM 593 O PRO A 35 4.111 -12.096 6.961 1.00 1.13 O ATOM 594 CB PRO A 35 1.751 -13.972 5.577 1.00 50.02 C ATOM 595 CG PRO A 35 1.851 -15.059 4.555 1.00 60.22 C ATOM 596 CD PRO A 35 2.233 -14.384 3.267 1.00 71.43 C ATOM 0 HA PRO A 35 2.367 -11.877 5.205 1.00 11.15 H new ATOM 0 HB2 PRO A 35 1.994 -14.345 6.572 1.00 50.02 H new ATOM 0 HB3 PRO A 35 0.739 -13.570 5.625 1.00 50.02 H new ATOM 0 HG2 PRO A 35 2.598 -15.799 4.844 1.00 60.22 H new ATOM 0 HG3 PRO A 35 0.903 -15.587 4.453 1.00 60.22 H new ATOM 0 HD2 PRO A 35 2.792 -15.051 2.611 1.00 71.43 H new ATOM 0 HD3 PRO A 35 1.357 -14.050 2.711 1.00 71.43 H new ATOM 604 N GLN A 36 4.952 -13.788 5.739 1.00 0.01 N ATOM 605 CA GLN A 36 6.227 -13.836 6.466 1.00 2.14 C ATOM 606 C GLN A 36 6.991 -12.507 6.333 1.00 1.21 C ATOM 607 O GLN A 36 7.371 -11.900 7.335 1.00 74.51 O ATOM 608 CB GLN A 36 7.084 -14.997 5.938 1.00 71.32 C ATOM 609 CG GLN A 36 8.457 -15.106 6.590 1.00 2.32 C ATOM 610 CD GLN A 36 8.401 -15.466 8.065 1.00 51.22 C ATOM 611 OE1 GLN A 36 7.508 -16.179 8.515 1.00 41.05 O ATOM 612 NE2 GLN A 36 9.340 -14.960 8.829 1.00 20.22 N ATOM 0 H GLN A 36 4.861 -14.492 5.006 1.00 0.01 H new ATOM 0 HA GLN A 36 6.014 -13.997 7.523 1.00 2.14 H new ATOM 0 HB2 GLN A 36 6.545 -15.932 6.093 1.00 71.32 H new ATOM 0 HB3 GLN A 36 7.213 -14.879 4.862 1.00 71.32 H new ATOM 0 HG2 GLN A 36 9.042 -15.859 6.062 1.00 2.32 H new ATOM 0 HG3 GLN A 36 8.981 -14.157 6.475 1.00 2.32 H new ATOM 0 HE21 GLN A 36 10.067 -14.372 8.422 1.00 20.22 H new ATOM 0 HE22 GLN A 36 9.343 -15.155 9.830 1.00 20.22 H new ATOM 621 N GLU A 37 7.198 -12.054 5.092 1.00 54.51 N ATOM 622 CA GLU A 37 7.846 -10.757 4.835 1.00 15.24 C ATOM 623 C GLU A 37 7.072 -9.619 5.510 1.00 4.32 C ATOM 624 O GLU A 37 7.658 -8.686 6.067 1.00 73.22 O ATOM 625 CB GLU A 37 7.930 -10.489 3.326 1.00 72.23 C ATOM 626 CG GLU A 37 8.732 -11.523 2.551 1.00 64.33 C ATOM 627 CD GLU A 37 8.722 -11.260 1.053 1.00 35.14 C ATOM 628 OE1 GLU A 37 7.717 -11.604 0.394 1.00 55.45 O ATOM 629 OE2 GLU A 37 9.713 -10.709 0.530 1.00 14.52 O ATOM 0 H GLU A 37 6.928 -12.562 4.250 1.00 54.51 H new ATOM 0 HA GLU A 37 8.853 -10.798 5.251 1.00 15.24 H new ATOM 0 HB2 GLU A 37 6.920 -10.450 2.919 1.00 72.23 H new ATOM 0 HB3 GLU A 37 8.376 -9.507 3.167 1.00 72.23 H new ATOM 0 HG2 GLU A 37 9.761 -11.524 2.910 1.00 64.33 H new ATOM 0 HG3 GLU A 37 8.325 -12.515 2.746 1.00 64.33 H new ATOM 636 N LEU A 38 5.745 -9.713 5.456 1.00 25.54 N ATOM 637 CA LEU A 38 4.866 -8.728 6.090 1.00 25.35 C ATOM 638 C LEU A 38 5.129 -8.653 7.603 1.00 1.44 C ATOM 639 O LEU A 38 5.038 -7.588 8.209 1.00 63.42 O ATOM 640 CB LEU A 38 3.400 -9.089 5.816 1.00 31.35 C ATOM 641 CG LEU A 38 2.359 -8.040 6.241 1.00 0.24 C ATOM 642 CD1 LEU A 38 2.627 -6.701 5.557 1.00 60.34 C ATOM 643 CD2 LEU A 38 0.948 -8.537 5.929 1.00 45.40 C ATOM 0 H LEU A 38 5.251 -10.466 4.977 1.00 25.54 H new ATOM 0 HA LEU A 38 5.076 -7.747 5.664 1.00 25.35 H new ATOM 0 HB2 LEU A 38 3.285 -9.274 4.748 1.00 31.35 H new ATOM 0 HB3 LEU A 38 3.175 -10.024 6.328 1.00 31.35 H new ATOM 0 HG LEU A 38 2.441 -7.889 7.317 1.00 0.24 H new ATOM 0 HD11 LEU A 38 1.878 -5.975 5.873 1.00 60.34 H new ATOM 0 HD12 LEU A 38 3.619 -6.343 5.834 1.00 60.34 H new ATOM 0 HD13 LEU A 38 2.576 -6.828 4.476 1.00 60.34 H new ATOM 0 HD21 LEU A 38 0.221 -7.785 6.235 1.00 45.40 H new ATOM 0 HD22 LEU A 38 0.854 -8.718 4.858 1.00 45.40 H new ATOM 0 HD23 LEU A 38 0.761 -9.464 6.471 1.00 45.40 H new ATOM 655 N LYS A 39 5.467 -9.792 8.199 1.00 44.30 N ATOM 656 CA LYS A 39 5.818 -9.845 9.619 1.00 61.01 C ATOM 657 C LYS A 39 7.250 -9.330 9.855 1.00 64.12 C ATOM 658 O LYS A 39 7.487 -8.522 10.754 1.00 4.24 O ATOM 659 CB LYS A 39 5.671 -11.280 10.150 1.00 1.14 C ATOM 660 CG LYS A 39 5.927 -11.411 11.648 1.00 44.22 C ATOM 661 CD LYS A 39 5.683 -12.834 12.151 1.00 13.03 C ATOM 662 CE LYS A 39 5.794 -12.926 13.670 1.00 40.13 C ATOM 663 NZ LYS A 39 7.133 -12.508 14.165 1.00 21.24 N ATOM 0 H LYS A 39 5.506 -10.693 7.723 1.00 44.30 H new ATOM 0 HA LYS A 39 5.132 -9.196 10.163 1.00 61.01 H new ATOM 0 HB2 LYS A 39 4.665 -11.638 9.930 1.00 1.14 H new ATOM 0 HB3 LYS A 39 6.364 -11.929 9.614 1.00 1.14 H new ATOM 0 HG2 LYS A 39 6.955 -11.121 11.866 1.00 44.22 H new ATOM 0 HG3 LYS A 39 5.279 -10.720 12.188 1.00 44.22 H new ATOM 0 HD2 LYS A 39 4.693 -13.165 11.838 1.00 13.03 H new ATOM 0 HD3 LYS A 39 6.405 -13.510 11.692 1.00 13.03 H new ATOM 0 HE2 LYS A 39 5.028 -12.299 14.127 1.00 40.13 H new ATOM 0 HE3 LYS A 39 5.596 -13.951 13.985 1.00 40.13 H new ATOM 0 HZ1 LYS A 39 7.239 -12.791 15.160 1.00 21.24 H new ATOM 0 HZ2 LYS A 39 7.872 -12.965 13.594 1.00 21.24 H new ATOM 0 HZ3 LYS A 39 7.225 -11.475 14.087 1.00 21.24 H new ATOM 677 N ASP A 40 8.196 -9.787 9.031 1.00 54.45 N ATOM 678 CA ASP A 40 9.605 -9.389 9.163 1.00 4.31 C ATOM 679 C ASP A 40 9.805 -7.873 9.010 1.00 33.30 C ATOM 680 O ASP A 40 10.739 -7.305 9.587 1.00 13.42 O ATOM 681 CB ASP A 40 10.479 -10.144 8.157 1.00 44.22 C ATOM 682 CG ASP A 40 10.632 -11.610 8.521 1.00 70.02 C ATOM 683 OD1 ASP A 40 11.039 -11.901 9.669 1.00 52.23 O ATOM 684 OD2 ASP A 40 10.347 -12.481 7.676 1.00 22.04 O ATOM 0 H ASP A 40 8.014 -10.434 8.264 1.00 54.45 H new ATOM 0 HA ASP A 40 9.913 -9.655 10.174 1.00 4.31 H new ATOM 0 HB2 ASP A 40 10.040 -10.062 7.163 1.00 44.22 H new ATOM 0 HB3 ASP A 40 11.463 -9.678 8.111 1.00 44.22 H new ATOM 689 N SER A 41 8.938 -7.219 8.236 1.00 51.12 N ATOM 690 CA SER A 41 8.971 -5.754 8.114 1.00 11.15 C ATOM 691 C SER A 41 8.758 -5.097 9.486 1.00 52.15 C ATOM 692 O SER A 41 9.565 -4.275 9.924 1.00 24.23 O ATOM 693 CB SER A 41 7.905 -5.259 7.124 1.00 24.40 C ATOM 694 OG SER A 41 6.597 -5.458 7.630 1.00 14.34 O ATOM 0 H SER A 41 8.208 -7.673 7.687 1.00 51.12 H new ATOM 0 HA SER A 41 9.952 -5.471 7.733 1.00 11.15 H new ATOM 0 HB2 SER A 41 8.060 -4.200 6.920 1.00 24.40 H new ATOM 0 HB3 SER A 41 8.014 -5.786 6.176 1.00 24.40 H new ATOM 0 HG SER A 41 6.406 -6.418 7.673 1.00 14.34 H new ATOM 700 N ILE A 42 7.675 -5.480 10.168 1.00 54.54 N ATOM 701 CA ILE A 42 7.416 -5.027 11.542 1.00 64.22 C ATOM 702 C ILE A 42 8.574 -5.418 12.479 1.00 3.21 C ATOM 703 O ILE A 42 8.970 -4.643 13.358 1.00 14.42 O ATOM 704 CB ILE A 42 6.069 -5.589 12.099 1.00 73.43 C ATOM 705 CG1 ILE A 42 4.861 -4.820 11.520 1.00 22.51 C ATOM 706 CG2 ILE A 42 6.040 -5.539 13.630 1.00 4.12 C ATOM 707 CD1 ILE A 42 4.699 -4.937 10.019 1.00 62.32 C ATOM 0 H ILE A 42 6.961 -6.104 9.792 1.00 54.54 H new ATOM 0 HA ILE A 42 7.338 -3.940 11.507 1.00 64.22 H new ATOM 0 HB ILE A 42 5.997 -6.631 11.786 1.00 73.43 H new ATOM 0 HG12 ILE A 42 3.952 -5.183 12.000 1.00 22.51 H new ATOM 0 HG13 ILE A 42 4.959 -3.766 11.780 1.00 22.51 H new ATOM 0 HG21 ILE A 42 5.091 -5.936 13.989 1.00 4.12 H new ATOM 0 HG22 ILE A 42 6.858 -6.138 14.029 1.00 4.12 H new ATOM 0 HG23 ILE A 42 6.150 -4.507 13.962 1.00 4.12 H new ATOM 0 HD11 ILE A 42 3.826 -4.366 9.702 1.00 62.32 H new ATOM 0 HD12 ILE A 42 5.588 -4.545 9.525 1.00 62.32 H new ATOM 0 HD13 ILE A 42 4.565 -5.984 9.748 1.00 62.32 H new ATOM 719 N GLU A 43 9.126 -6.616 12.274 1.00 54.54 N ATOM 720 CA GLU A 43 10.284 -7.075 13.051 1.00 22.12 C ATOM 721 C GLU A 43 11.463 -6.094 12.932 1.00 21.12 C ATOM 722 O GLU A 43 12.254 -5.958 13.862 1.00 52.32 O ATOM 723 CB GLU A 43 10.726 -8.476 12.606 1.00 11.14 C ATOM 724 CG GLU A 43 9.672 -9.566 12.800 1.00 44.00 C ATOM 725 CD GLU A 43 9.247 -9.749 14.250 1.00 24.13 C ATOM 726 OE1 GLU A 43 10.120 -9.695 15.146 1.00 74.10 O ATOM 727 OE2 GLU A 43 8.044 -9.977 14.500 1.00 62.01 O ATOM 0 H GLU A 43 8.793 -7.285 11.580 1.00 54.54 H new ATOM 0 HA GLU A 43 9.975 -7.119 14.095 1.00 22.12 H new ATOM 0 HB2 GLU A 43 11.001 -8.438 11.552 1.00 11.14 H new ATOM 0 HB3 GLU A 43 11.623 -8.753 13.160 1.00 11.14 H new ATOM 0 HG2 GLU A 43 8.795 -9.323 12.201 1.00 44.00 H new ATOM 0 HG3 GLU A 43 10.064 -10.511 12.423 1.00 44.00 H new ATOM 734 N GLU A 44 11.587 -5.419 11.784 1.00 41.11 N ATOM 735 CA GLU A 44 12.588 -4.351 11.628 1.00 22.41 C ATOM 736 C GLU A 44 12.078 -3.012 12.182 1.00 11.33 C ATOM 737 O GLU A 44 12.854 -2.241 12.746 1.00 72.12 O ATOM 738 CB GLU A 44 13.012 -4.173 10.158 1.00 21.21 C ATOM 739 CG GLU A 44 14.079 -5.161 9.690 1.00 55.03 C ATOM 740 CD GLU A 44 14.739 -4.733 8.384 1.00 73.21 C ATOM 741 OE1 GLU A 44 15.379 -3.658 8.360 1.00 20.55 O ATOM 742 OE2 GLU A 44 14.633 -5.465 7.379 1.00 51.23 O ATOM 0 H GLU A 44 11.015 -5.588 10.956 1.00 41.11 H new ATOM 0 HA GLU A 44 13.459 -4.661 12.205 1.00 22.41 H new ATOM 0 HB2 GLU A 44 12.132 -4.277 9.523 1.00 21.21 H new ATOM 0 HB3 GLU A 44 13.386 -3.159 10.020 1.00 21.21 H new ATOM 0 HG2 GLU A 44 14.841 -5.261 10.463 1.00 55.03 H new ATOM 0 HG3 GLU A 44 13.627 -6.144 9.560 1.00 55.03 H new ATOM 749 N LEU A 45 10.779 -2.741 12.030 1.00 33.41 N ATOM 750 CA LEU A 45 10.183 -1.478 12.503 1.00 40.21 C ATOM 751 C LEU A 45 10.385 -1.270 14.014 1.00 22.41 C ATOM 752 O LEU A 45 10.508 -0.139 14.484 1.00 21.31 O ATOM 753 CB LEU A 45 8.683 -1.430 12.167 1.00 15.43 C ATOM 754 CG LEU A 45 8.344 -1.368 10.667 1.00 12.11 C ATOM 755 CD1 LEU A 45 6.829 -1.353 10.455 1.00 14.45 C ATOM 756 CD2 LEU A 45 8.991 -0.144 10.022 1.00 24.14 C ATOM 0 H LEU A 45 10.116 -3.375 11.584 1.00 33.41 H new ATOM 0 HA LEU A 45 10.698 -0.670 11.984 1.00 40.21 H new ATOM 0 HB2 LEU A 45 8.204 -2.311 12.594 1.00 15.43 H new ATOM 0 HB3 LEU A 45 8.246 -0.560 12.657 1.00 15.43 H new ATOM 0 HG LEU A 45 8.745 -2.261 10.188 1.00 12.11 H new ATOM 0 HD11 LEU A 45 6.611 -1.309 9.388 1.00 14.45 H new ATOM 0 HD12 LEU A 45 6.394 -2.259 10.877 1.00 14.45 H new ATOM 0 HD13 LEU A 45 6.401 -0.481 10.949 1.00 14.45 H new ATOM 0 HD21 LEU A 45 8.741 -0.116 8.962 1.00 24.14 H new ATOM 0 HD22 LEU A 45 8.622 0.760 10.506 1.00 24.14 H new ATOM 0 HD23 LEU A 45 10.073 -0.201 10.138 1.00 24.14 H new ATOM 768 N VAL A 46 10.423 -2.364 14.773 1.00 21.40 N ATOM 769 CA VAL A 46 10.655 -2.288 16.221 1.00 24.13 C ATOM 770 C VAL A 46 12.101 -1.841 16.542 1.00 53.32 C ATOM 771 O VAL A 46 12.430 -1.525 17.691 1.00 55.34 O ATOM 772 CB VAL A 46 10.330 -3.641 16.913 1.00 13.45 C ATOM 773 CG1 VAL A 46 11.309 -4.725 16.486 1.00 32.44 C ATOM 774 CG2 VAL A 46 10.299 -3.493 18.435 1.00 34.13 C ATOM 0 H VAL A 46 10.297 -3.311 14.415 1.00 21.40 H new ATOM 0 HA VAL A 46 9.978 -1.532 16.619 1.00 24.13 H new ATOM 0 HB VAL A 46 9.334 -3.946 16.591 1.00 13.45 H new ATOM 0 HG11 VAL A 46 11.057 -5.660 16.986 1.00 32.44 H new ATOM 0 HG12 VAL A 46 11.250 -4.863 15.406 1.00 32.44 H new ATOM 0 HG13 VAL A 46 12.322 -4.429 16.759 1.00 32.44 H new ATOM 0 HG21 VAL A 46 10.069 -4.457 18.890 1.00 34.13 H new ATOM 0 HG22 VAL A 46 11.271 -3.148 18.787 1.00 34.13 H new ATOM 0 HG23 VAL A 46 9.534 -2.768 18.715 1.00 34.13 H new ATOM 784 N LYS A 47 12.963 -1.816 15.518 1.00 42.31 N ATOM 785 CA LYS A 47 14.308 -1.236 15.644 1.00 40.45 C ATOM 786 C LYS A 47 14.405 0.090 14.860 1.00 41.12 C ATOM 787 O LYS A 47 14.694 1.144 15.434 1.00 42.33 O ATOM 788 CB LYS A 47 15.402 -2.201 15.144 1.00 60.44 C ATOM 789 CG LYS A 47 15.492 -3.532 15.894 1.00 22.25 C ATOM 790 CD LYS A 47 14.644 -4.618 15.237 1.00 63.03 C ATOM 791 CE LYS A 47 14.848 -5.978 15.900 1.00 43.11 C ATOM 792 NZ LYS A 47 14.071 -7.050 15.223 1.00 62.24 N ATOM 0 H LYS A 47 12.754 -2.190 14.593 1.00 42.31 H new ATOM 0 HA LYS A 47 14.473 -1.050 16.705 1.00 40.45 H new ATOM 0 HB2 LYS A 47 15.226 -2.409 14.089 1.00 60.44 H new ATOM 0 HB3 LYS A 47 16.366 -1.698 15.213 1.00 60.44 H new ATOM 0 HG2 LYS A 47 16.532 -3.857 15.932 1.00 22.25 H new ATOM 0 HG3 LYS A 47 15.165 -3.390 16.924 1.00 22.25 H new ATOM 0 HD2 LYS A 47 13.591 -4.341 15.294 1.00 63.03 H new ATOM 0 HD3 LYS A 47 14.899 -4.688 14.180 1.00 63.03 H new ATOM 0 HE2 LYS A 47 15.908 -6.233 15.885 1.00 43.11 H new ATOM 0 HE3 LYS A 47 14.549 -5.920 16.947 1.00 43.11 H new ATOM 0 HZ1 LYS A 47 13.571 -7.619 15.936 1.00 62.24 H new ATOM 0 HZ2 LYS A 47 13.379 -6.621 14.575 1.00 62.24 H new ATOM 0 HZ3 LYS A 47 14.718 -7.660 14.684 1.00 62.24 H new ATOM 806 N LYS A 48 14.180 0.026 13.543 1.00 1.01 N ATOM 807 CA LYS A 48 14.223 1.215 12.673 1.00 5.14 C ATOM 808 C LYS A 48 12.808 1.633 12.241 1.00 33.13 C ATOM 809 O LYS A 48 12.081 0.848 11.636 1.00 64.25 O ATOM 810 CB LYS A 48 15.073 0.956 11.413 1.00 21.04 C ATOM 811 CG LYS A 48 16.538 0.600 11.679 1.00 22.44 C ATOM 812 CD LYS A 48 16.713 -0.847 12.134 1.00 3.41 C ATOM 813 CE LYS A 48 18.180 -1.199 12.361 1.00 42.32 C ATOM 814 NZ LYS A 48 18.810 -0.314 13.374 1.00 2.02 N ATOM 0 H LYS A 48 13.965 -0.841 13.050 1.00 1.01 H new ATOM 0 HA LYS A 48 14.678 2.018 13.253 1.00 5.14 H new ATOM 0 HB2 LYS A 48 14.616 0.145 10.846 1.00 21.04 H new ATOM 0 HB3 LYS A 48 15.040 1.845 10.783 1.00 21.04 H new ATOM 0 HG2 LYS A 48 17.120 0.765 10.772 1.00 22.44 H new ATOM 0 HG3 LYS A 48 16.939 1.268 12.441 1.00 22.44 H new ATOM 0 HD2 LYS A 48 16.154 -1.008 13.056 1.00 3.41 H new ATOM 0 HD3 LYS A 48 16.291 -1.517 11.385 1.00 3.41 H new ATOM 0 HE2 LYS A 48 18.259 -2.237 12.686 1.00 42.32 H new ATOM 0 HE3 LYS A 48 18.723 -1.118 11.419 1.00 42.32 H new ATOM 0 HZ1 LYS A 48 19.726 -0.713 13.662 1.00 2.02 H new ATOM 0 HZ2 LYS A 48 18.957 0.631 12.966 1.00 2.02 H new ATOM 0 HZ3 LYS A 48 18.188 -0.239 14.204 1.00 2.02 H new ATOM 828 N TYR A 49 12.436 2.878 12.526 1.00 1.00 N ATOM 829 CA TYR A 49 11.089 3.379 12.208 1.00 40.34 C ATOM 830 C TYR A 49 11.124 4.780 11.556 1.00 53.32 C ATOM 831 O TYR A 49 12.136 5.177 10.979 1.00 51.33 O ATOM 832 CB TYR A 49 10.221 3.377 13.483 1.00 41.53 C ATOM 833 CG TYR A 49 10.912 3.928 14.724 1.00 2.33 C ATOM 834 CD1 TYR A 49 10.843 5.278 15.048 1.00 54.04 C ATOM 835 CD2 TYR A 49 11.624 3.088 15.580 1.00 43.52 C ATOM 836 CE1 TYR A 49 11.459 5.777 16.181 1.00 13.22 C ATOM 837 CE2 TYR A 49 12.244 3.581 16.714 1.00 51.02 C ATOM 838 CZ TYR A 49 12.158 4.925 17.011 1.00 35.32 C ATOM 839 OH TYR A 49 12.770 5.419 18.143 1.00 23.44 O ATOM 0 H TYR A 49 13.043 3.563 12.976 1.00 1.00 H new ATOM 0 HA TYR A 49 10.644 2.709 11.472 1.00 40.34 H new ATOM 0 HB2 TYR A 49 9.321 3.963 13.295 1.00 41.53 H new ATOM 0 HB3 TYR A 49 9.900 2.355 13.686 1.00 41.53 H new ATOM 0 HD1 TYR A 49 10.298 5.950 14.402 1.00 54.04 H new ATOM 0 HD2 TYR A 49 11.692 2.034 15.353 1.00 43.52 H new ATOM 0 HE1 TYR A 49 11.393 6.829 16.415 1.00 13.22 H new ATOM 0 HE2 TYR A 49 12.793 2.916 17.364 1.00 51.02 H new ATOM 0 HH TYR A 49 12.099 5.840 18.720 1.00 23.44 H new ATOM 849 N ASN A 50 9.992 5.499 11.627 1.00 11.11 N ATOM 850 CA ASN A 50 9.840 6.855 11.054 1.00 61.21 C ATOM 851 C ASN A 50 9.645 6.849 9.521 1.00 70.42 C ATOM 852 O ASN A 50 8.515 6.763 9.034 1.00 75.13 O ATOM 853 CB ASN A 50 11.012 7.778 11.433 1.00 43.42 C ATOM 854 CG ASN A 50 11.095 8.043 12.924 1.00 72.13 C ATOM 855 OD1 ASN A 50 10.091 8.035 13.626 1.00 51.53 O ATOM 856 ND2 ASN A 50 12.292 8.289 13.415 1.00 22.31 N ATOM 0 H ASN A 50 9.148 5.157 12.086 1.00 11.11 H new ATOM 0 HA ASN A 50 8.927 7.252 11.498 1.00 61.21 H new ATOM 0 HB2 ASN A 50 11.946 7.328 11.096 1.00 43.42 H new ATOM 0 HB3 ASN A 50 10.907 8.726 10.906 1.00 43.42 H new ATOM 0 HD21 ASN A 50 12.405 8.481 14.410 1.00 22.31 H new ATOM 0 HD22 ASN A 50 13.106 8.287 12.800 1.00 22.31 H new ATOM 863 N ALA A 51 10.746 6.902 8.767 1.00 55.12 N ATOM 864 CA ALA A 51 10.687 7.164 7.314 1.00 12.02 C ATOM 865 C ALA A 51 10.380 5.911 6.471 1.00 15.45 C ATOM 866 O ALA A 51 10.340 5.979 5.242 1.00 15.12 O ATOM 867 CB ALA A 51 11.998 7.797 6.851 1.00 71.02 C ATOM 0 H ALA A 51 11.690 6.768 9.131 1.00 55.12 H new ATOM 0 HA ALA A 51 9.855 7.850 7.155 1.00 12.02 H new ATOM 0 HB1 ALA A 51 11.951 7.989 5.779 1.00 71.02 H new ATOM 0 HB2 ALA A 51 12.156 8.736 7.381 1.00 71.02 H new ATOM 0 HB3 ALA A 51 12.824 7.118 7.062 1.00 71.02 H new ATOM 873 N THR A 52 10.165 4.775 7.124 1.00 15.52 N ATOM 874 CA THR A 52 9.869 3.522 6.416 1.00 53.23 C ATOM 875 C THR A 52 8.397 3.439 5.965 1.00 44.53 C ATOM 876 O THR A 52 7.477 3.764 6.726 1.00 24.11 O ATOM 877 CB THR A 52 10.204 2.289 7.296 1.00 34.55 C ATOM 878 OG1 THR A 52 11.580 2.343 7.716 1.00 4.11 O ATOM 879 CG2 THR A 52 9.957 0.985 6.544 1.00 35.44 C ATOM 0 H THR A 52 10.189 4.689 8.140 1.00 15.52 H new ATOM 0 HA THR A 52 10.500 3.517 5.527 1.00 53.23 H new ATOM 0 HB THR A 52 9.549 2.315 8.167 1.00 34.55 H new ATOM 0 HG1 THR A 52 11.783 1.562 8.272 1.00 4.11 H new ATOM 0 HG21 THR A 52 10.202 0.141 7.189 1.00 35.44 H new ATOM 0 HG22 THR A 52 8.909 0.926 6.252 1.00 35.44 H new ATOM 0 HG23 THR A 52 10.584 0.954 5.653 1.00 35.44 H new ATOM 887 N ILE A 53 8.191 3.011 4.714 1.00 24.33 N ATOM 888 CA ILE A 53 6.850 2.799 4.144 1.00 12.35 C ATOM 889 C ILE A 53 6.701 1.350 3.637 1.00 22.42 C ATOM 890 O ILE A 53 7.626 0.801 3.032 1.00 20.52 O ATOM 891 CB ILE A 53 6.569 3.776 2.968 1.00 20.21 C ATOM 892 CG1 ILE A 53 6.628 5.238 3.451 1.00 64.44 C ATOM 893 CG2 ILE A 53 5.216 3.474 2.319 1.00 50.01 C ATOM 894 CD1 ILE A 53 6.328 6.255 2.368 1.00 65.23 C ATOM 0 H ILE A 53 8.949 2.801 4.065 1.00 24.33 H new ATOM 0 HA ILE A 53 6.129 2.989 4.939 1.00 12.35 H new ATOM 0 HB ILE A 53 7.344 3.633 2.215 1.00 20.21 H new ATOM 0 HG12 ILE A 53 5.917 5.370 4.267 1.00 64.44 H new ATOM 0 HG13 ILE A 53 7.620 5.436 3.857 1.00 64.44 H new ATOM 0 HG21 ILE A 53 5.042 4.171 1.499 1.00 50.01 H new ATOM 0 HG22 ILE A 53 5.216 2.454 1.935 1.00 50.01 H new ATOM 0 HG23 ILE A 53 4.425 3.582 3.061 1.00 50.01 H new ATOM 0 HD11 ILE A 53 6.389 7.260 2.786 1.00 65.23 H new ATOM 0 HD12 ILE A 53 7.054 6.152 1.561 1.00 65.23 H new ATOM 0 HD13 ILE A 53 5.325 6.085 1.977 1.00 65.23 H new ATOM 906 N VAL A 54 5.544 0.733 3.883 1.00 42.21 N ATOM 907 CA VAL A 54 5.318 -0.664 3.489 1.00 33.02 C ATOM 908 C VAL A 54 4.418 -0.782 2.240 1.00 10.34 C ATOM 909 O VAL A 54 3.373 -0.136 2.138 1.00 12.22 O ATOM 910 CB VAL A 54 4.712 -1.489 4.656 1.00 64.41 C ATOM 911 CG1 VAL A 54 3.373 -0.908 5.106 1.00 14.22 C ATOM 912 CG2 VAL A 54 4.574 -2.963 4.267 1.00 15.24 C ATOM 0 H VAL A 54 4.751 1.173 4.350 1.00 42.21 H new ATOM 0 HA VAL A 54 6.296 -1.074 3.237 1.00 33.02 H new ATOM 0 HB VAL A 54 5.397 -1.428 5.502 1.00 64.41 H new ATOM 0 HG11 VAL A 54 2.973 -1.507 5.924 1.00 14.22 H new ATOM 0 HG12 VAL A 54 3.517 0.118 5.444 1.00 14.22 H new ATOM 0 HG13 VAL A 54 2.672 -0.920 4.271 1.00 14.22 H new ATOM 0 HG21 VAL A 54 4.147 -3.521 5.101 1.00 15.24 H new ATOM 0 HG22 VAL A 54 3.920 -3.051 3.399 1.00 15.24 H new ATOM 0 HG23 VAL A 54 5.556 -3.369 4.024 1.00 15.24 H new ATOM 922 N VAL A 55 4.846 -1.615 1.292 1.00 13.01 N ATOM 923 CA VAL A 55 4.112 -1.849 0.041 1.00 10.23 C ATOM 924 C VAL A 55 3.879 -3.354 -0.177 1.00 53.22 C ATOM 925 O VAL A 55 4.829 -4.133 -0.235 1.00 10.42 O ATOM 926 CB VAL A 55 4.890 -1.282 -1.181 1.00 30.40 C ATOM 927 CG1 VAL A 55 4.111 -1.499 -2.478 1.00 63.50 C ATOM 928 CG2 VAL A 55 5.218 0.200 -0.984 1.00 22.42 C ATOM 0 H VAL A 55 5.712 -2.149 1.366 1.00 13.01 H new ATOM 0 HA VAL A 55 3.154 -1.336 0.127 1.00 10.23 H new ATOM 0 HB VAL A 55 5.830 -1.828 -1.259 1.00 30.40 H new ATOM 0 HG11 VAL A 55 4.678 -1.093 -3.315 1.00 63.50 H new ATOM 0 HG12 VAL A 55 3.950 -2.566 -2.632 1.00 63.50 H new ATOM 0 HG13 VAL A 55 3.148 -0.993 -2.413 1.00 63.50 H new ATOM 0 HG21 VAL A 55 5.762 0.571 -1.853 1.00 22.42 H new ATOM 0 HG22 VAL A 55 4.293 0.765 -0.867 1.00 22.42 H new ATOM 0 HG23 VAL A 55 5.833 0.321 -0.092 1.00 22.42 H new ATOM 938 N VAL A 56 2.617 -3.765 -0.287 1.00 52.42 N ATOM 939 CA VAL A 56 2.277 -5.181 -0.490 1.00 14.52 C ATOM 940 C VAL A 56 1.833 -5.452 -1.938 1.00 14.00 C ATOM 941 O VAL A 56 0.926 -4.797 -2.454 1.00 32.02 O ATOM 942 CB VAL A 56 1.158 -5.636 0.482 1.00 42.31 C ATOM 943 CG1 VAL A 56 0.888 -7.133 0.334 1.00 52.32 C ATOM 944 CG2 VAL A 56 1.522 -5.289 1.927 1.00 44.24 C ATOM 0 H VAL A 56 1.811 -3.142 -0.240 1.00 52.42 H new ATOM 0 HA VAL A 56 3.181 -5.754 -0.285 1.00 14.52 H new ATOM 0 HB VAL A 56 0.244 -5.100 0.224 1.00 42.31 H new ATOM 0 HG11 VAL A 56 0.100 -7.431 1.025 1.00 52.32 H new ATOM 0 HG12 VAL A 56 0.575 -7.347 -0.688 1.00 52.32 H new ATOM 0 HG13 VAL A 56 1.797 -7.691 0.559 1.00 52.32 H new ATOM 0 HG21 VAL A 56 0.723 -5.617 2.592 1.00 44.24 H new ATOM 0 HG22 VAL A 56 2.450 -5.792 2.199 1.00 44.24 H new ATOM 0 HG23 VAL A 56 1.652 -4.211 2.021 1.00 44.24 H new ATOM 954 N VAL A 57 2.476 -6.424 -2.584 1.00 40.54 N ATOM 955 CA VAL A 57 2.152 -6.786 -3.970 1.00 12.51 C ATOM 956 C VAL A 57 1.133 -7.938 -4.018 1.00 21.53 C ATOM 957 O VAL A 57 1.392 -9.041 -3.527 1.00 61.45 O ATOM 958 CB VAL A 57 3.424 -7.189 -4.755 1.00 73.32 C ATOM 959 CG1 VAL A 57 3.099 -7.432 -6.228 1.00 33.42 C ATOM 960 CG2 VAL A 57 4.510 -6.122 -4.607 1.00 63.12 C ATOM 0 H VAL A 57 3.227 -6.978 -2.172 1.00 40.54 H new ATOM 0 HA VAL A 57 1.713 -5.905 -4.438 1.00 12.51 H new ATOM 0 HB VAL A 57 3.802 -8.121 -4.335 1.00 73.32 H new ATOM 0 HG11 VAL A 57 4.008 -7.714 -6.759 1.00 33.42 H new ATOM 0 HG12 VAL A 57 2.366 -8.235 -6.311 1.00 33.42 H new ATOM 0 HG13 VAL A 57 2.691 -6.521 -6.666 1.00 33.42 H new ATOM 0 HG21 VAL A 57 5.396 -6.424 -5.166 1.00 63.12 H new ATOM 0 HG22 VAL A 57 4.142 -5.172 -4.995 1.00 63.12 H new ATOM 0 HG23 VAL A 57 4.767 -6.008 -3.554 1.00 63.12 H new ATOM 970 N VAL A 58 -0.023 -7.678 -4.623 1.00 53.13 N ATOM 971 CA VAL A 58 -1.131 -8.638 -4.640 1.00 33.43 C ATOM 972 C VAL A 58 -1.733 -8.798 -6.045 1.00 62.14 C ATOM 973 O VAL A 58 -1.370 -8.080 -6.974 1.00 1.32 O ATOM 974 CB VAL A 58 -2.249 -8.198 -3.660 1.00 22.31 C ATOM 975 CG1 VAL A 58 -1.707 -8.079 -2.237 1.00 62.24 C ATOM 976 CG2 VAL A 58 -2.876 -6.882 -4.111 1.00 0.52 C ATOM 0 H VAL A 58 -0.221 -6.805 -5.112 1.00 53.13 H new ATOM 0 HA VAL A 58 -0.720 -9.598 -4.329 1.00 33.43 H new ATOM 0 HB VAL A 58 -3.025 -8.964 -3.665 1.00 22.31 H new ATOM 0 HG11 VAL A 58 -2.509 -7.769 -1.567 1.00 62.24 H new ATOM 0 HG12 VAL A 58 -1.317 -9.044 -1.914 1.00 62.24 H new ATOM 0 HG13 VAL A 58 -0.908 -7.338 -2.213 1.00 62.24 H new ATOM 0 HG21 VAL A 58 -3.658 -6.592 -3.409 1.00 0.52 H new ATOM 0 HG22 VAL A 58 -2.111 -6.106 -4.143 1.00 0.52 H new ATOM 0 HG23 VAL A 58 -3.308 -7.006 -5.104 1.00 0.52 H new ATOM 986 N ASP A 59 -2.661 -9.750 -6.193 1.00 50.43 N ATOM 987 CA ASP A 59 -3.359 -9.966 -7.471 1.00 72.22 C ATOM 988 C ASP A 59 -4.895 -9.891 -7.313 1.00 33.54 C ATOM 989 O ASP A 59 -5.577 -9.229 -8.099 1.00 12.14 O ATOM 990 CB ASP A 59 -2.945 -11.316 -8.078 1.00 24.51 C ATOM 991 CG ASP A 59 -3.217 -12.484 -7.145 1.00 14.11 C ATOM 992 OD1 ASP A 59 -2.387 -12.736 -6.247 1.00 64.53 O ATOM 993 OD2 ASP A 59 -4.259 -13.152 -7.303 1.00 15.12 O ATOM 0 H ASP A 59 -2.948 -10.383 -5.447 1.00 50.43 H new ATOM 0 HA ASP A 59 -3.065 -9.163 -8.147 1.00 72.22 H new ATOM 0 HB2 ASP A 59 -3.483 -11.470 -9.013 1.00 24.51 H new ATOM 0 HB3 ASP A 59 -1.883 -11.290 -8.322 1.00 24.51 H new ATOM 998 N ASP A 60 -5.438 -10.567 -6.298 1.00 21.21 N ATOM 999 CA ASP A 60 -6.890 -10.596 -6.080 1.00 21.03 C ATOM 1000 C ASP A 60 -7.263 -10.296 -4.613 1.00 13.41 C ATOM 1001 O ASP A 60 -6.420 -10.373 -3.717 1.00 74.21 O ATOM 1002 CB ASP A 60 -7.450 -11.957 -6.512 1.00 1.22 C ATOM 1003 CG ASP A 60 -8.967 -12.004 -6.458 1.00 42.22 C ATOM 1004 OD1 ASP A 60 -9.614 -11.249 -7.217 1.00 35.20 O ATOM 1005 OD2 ASP A 60 -9.519 -12.782 -5.656 1.00 61.15 O ATOM 0 H ASP A 60 -4.899 -11.100 -5.616 1.00 21.21 H new ATOM 0 HA ASP A 60 -7.336 -9.809 -6.688 1.00 21.03 H new ATOM 0 HB2 ASP A 60 -7.119 -12.177 -7.527 1.00 1.22 H new ATOM 0 HB3 ASP A 60 -7.042 -12.736 -5.867 1.00 1.22 H new ATOM 1010 N LYS A 61 -8.539 -9.963 -4.392 1.00 21.45 N ATOM 1011 CA LYS A 61 -9.060 -9.561 -3.073 1.00 64.23 C ATOM 1012 C LYS A 61 -8.682 -10.530 -1.933 1.00 33.14 C ATOM 1013 O LYS A 61 -8.260 -10.086 -0.868 1.00 74.02 O ATOM 1014 CB LYS A 61 -10.588 -9.401 -3.144 1.00 44.01 C ATOM 1015 CG LYS A 61 -11.308 -10.625 -3.705 1.00 23.33 C ATOM 1016 CD LYS A 61 -12.820 -10.427 -3.780 1.00 1.24 C ATOM 1017 CE LYS A 61 -13.207 -9.244 -4.661 1.00 14.24 C ATOM 1018 NZ LYS A 61 -14.681 -9.136 -4.814 1.00 31.42 N ATOM 0 H LYS A 61 -9.247 -9.964 -5.126 1.00 21.45 H new ATOM 0 HA LYS A 61 -8.588 -8.609 -2.831 1.00 64.23 H new ATOM 0 HB2 LYS A 61 -10.969 -9.193 -2.144 1.00 44.01 H new ATOM 0 HB3 LYS A 61 -10.825 -8.536 -3.763 1.00 44.01 H new ATOM 0 HG2 LYS A 61 -10.923 -10.845 -4.701 1.00 23.33 H new ATOM 0 HG3 LYS A 61 -11.088 -11.491 -3.080 1.00 23.33 H new ATOM 0 HD2 LYS A 61 -13.284 -11.334 -4.169 1.00 1.24 H new ATOM 0 HD3 LYS A 61 -13.214 -10.273 -2.775 1.00 1.24 H new ATOM 0 HE2 LYS A 61 -12.817 -8.323 -4.227 1.00 14.24 H new ATOM 0 HE3 LYS A 61 -12.746 -9.354 -5.642 1.00 14.24 H new ATOM 0 HZ1 LYS A 61 -14.949 -8.134 -4.896 1.00 31.42 H new ATOM 0 HZ2 LYS A 61 -14.979 -9.645 -5.670 1.00 31.42 H new ATOM 0 HZ3 LYS A 61 -15.148 -9.553 -3.983 1.00 31.42 H new ATOM 1032 N GLU A 62 -8.833 -11.841 -2.146 1.00 74.02 N ATOM 1033 CA GLU A 62 -8.507 -12.830 -1.100 1.00 4.21 C ATOM 1034 C GLU A 62 -7.055 -12.692 -0.607 1.00 63.41 C ATOM 1035 O GLU A 62 -6.814 -12.512 0.590 1.00 22.32 O ATOM 1036 CB GLU A 62 -8.768 -14.264 -1.598 1.00 2.53 C ATOM 1037 CG GLU A 62 -10.172 -14.792 -1.298 1.00 65.11 C ATOM 1038 CD GLU A 62 -11.279 -13.918 -1.867 1.00 62.23 C ATOM 1039 OE1 GLU A 62 -11.586 -14.050 -3.071 1.00 50.21 O ATOM 1040 OE2 GLU A 62 -11.854 -13.105 -1.112 1.00 14.53 O ATOM 0 H GLU A 62 -9.174 -12.243 -3.019 1.00 74.02 H new ATOM 0 HA GLU A 62 -9.164 -12.626 -0.254 1.00 4.21 H new ATOM 0 HB2 GLU A 62 -8.603 -14.297 -2.675 1.00 2.53 H new ATOM 0 HB3 GLU A 62 -8.037 -14.932 -1.143 1.00 2.53 H new ATOM 0 HG2 GLU A 62 -10.268 -15.799 -1.705 1.00 65.11 H new ATOM 0 HG3 GLU A 62 -10.300 -14.871 -0.218 1.00 65.11 H new ATOM 1047 N TRP A 63 -6.094 -12.789 -1.526 1.00 3.54 N ATOM 1048 CA TRP A 63 -4.679 -12.581 -1.184 1.00 41.12 C ATOM 1049 C TRP A 63 -4.446 -11.167 -0.614 1.00 70.14 C ATOM 1050 O TRP A 63 -3.733 -10.993 0.374 1.00 71.03 O ATOM 1051 CB TRP A 63 -3.788 -12.832 -2.418 1.00 63.25 C ATOM 1052 CG TRP A 63 -2.363 -12.352 -2.270 1.00 54.22 C ATOM 1053 CD1 TRP A 63 -1.649 -11.630 -3.184 1.00 43.22 C ATOM 1054 CD2 TRP A 63 -1.482 -12.551 -1.151 1.00 3.44 C ATOM 1055 NE1 TRP A 63 -0.393 -11.355 -2.701 1.00 1.25 N ATOM 1056 CE2 TRP A 63 -0.265 -11.911 -1.460 1.00 72.04 C ATOM 1057 CE3 TRP A 63 -1.602 -13.204 0.080 1.00 11.14 C ATOM 1058 CZ2 TRP A 63 0.814 -11.901 -0.583 1.00 4.54 C ATOM 1059 CZ3 TRP A 63 -0.528 -13.191 0.948 1.00 21.11 C ATOM 1060 CH2 TRP A 63 0.668 -12.544 0.613 1.00 50.11 C ATOM 0 H TRP A 63 -6.263 -13.009 -2.508 1.00 3.54 H new ATOM 0 HA TRP A 63 -4.406 -13.297 -0.409 1.00 41.12 H new ATOM 0 HB2 TRP A 63 -3.778 -13.901 -2.632 1.00 63.25 H new ATOM 0 HB3 TRP A 63 -4.236 -12.339 -3.281 1.00 63.25 H new ATOM 0 HD1 TRP A 63 -2.020 -11.319 -4.150 1.00 43.22 H new ATOM 0 HE1 TRP A 63 0.327 -10.822 -3.189 1.00 1.25 H new ATOM 0 HE3 TRP A 63 -2.518 -13.709 0.347 1.00 11.14 H new ATOM 0 HZ2 TRP A 63 1.737 -11.401 -0.839 1.00 4.54 H new ATOM 0 HZ3 TRP A 63 -0.612 -13.689 1.903 1.00 21.11 H new ATOM 0 HH2 TRP A 63 1.490 -12.554 1.313 1.00 50.11 H new ATOM 1071 N ALA A 64 -5.077 -10.168 -1.221 1.00 35.12 N ATOM 1072 CA ALA A 64 -4.952 -8.780 -0.768 1.00 45.30 C ATOM 1073 C ALA A 64 -5.445 -8.602 0.679 1.00 75.21 C ATOM 1074 O ALA A 64 -4.893 -7.803 1.442 1.00 74.24 O ATOM 1075 CB ALA A 64 -5.709 -7.860 -1.717 1.00 3.34 C ATOM 0 H ALA A 64 -5.684 -10.290 -2.032 1.00 35.12 H new ATOM 0 HA ALA A 64 -3.895 -8.514 -0.777 1.00 45.30 H new ATOM 0 HB1 ALA A 64 -5.614 -6.829 -1.377 1.00 3.34 H new ATOM 0 HB2 ALA A 64 -5.294 -7.951 -2.721 1.00 3.34 H new ATOM 0 HB3 ALA A 64 -6.762 -8.141 -1.733 1.00 3.34 H new ATOM 1081 N GLU A 65 -6.473 -9.362 1.056 1.00 43.31 N ATOM 1082 CA GLU A 65 -7.004 -9.324 2.422 1.00 62.41 C ATOM 1083 C GLU A 65 -5.966 -9.809 3.441 1.00 53.31 C ATOM 1084 O GLU A 65 -5.911 -9.311 4.563 1.00 20.23 O ATOM 1085 CB GLU A 65 -8.270 -10.184 2.540 1.00 42.13 C ATOM 1086 CG GLU A 65 -8.844 -10.230 3.954 1.00 1.33 C ATOM 1087 CD GLU A 65 -10.007 -11.196 4.093 1.00 13.03 C ATOM 1088 OE1 GLU A 65 -9.767 -12.423 4.080 1.00 43.23 O ATOM 1089 OE2 GLU A 65 -11.158 -10.734 4.236 1.00 34.45 O ATOM 0 H GLU A 65 -6.956 -10.012 0.436 1.00 43.31 H new ATOM 0 HA GLU A 65 -7.251 -8.285 2.641 1.00 62.41 H new ATOM 0 HB2 GLU A 65 -9.029 -9.795 1.861 1.00 42.13 H new ATOM 0 HB3 GLU A 65 -8.042 -11.199 2.216 1.00 42.13 H new ATOM 0 HG2 GLU A 65 -8.056 -10.517 4.651 1.00 1.33 H new ATOM 0 HG3 GLU A 65 -9.173 -9.231 4.239 1.00 1.33 H new ATOM 1096 N LYS A 66 -5.141 -10.779 3.043 1.00 11.42 N ATOM 1097 CA LYS A 66 -4.116 -11.344 3.932 1.00 70.52 C ATOM 1098 C LYS A 66 -3.183 -10.252 4.484 1.00 24.23 C ATOM 1099 O LYS A 66 -2.676 -10.362 5.604 1.00 22.11 O ATOM 1100 CB LYS A 66 -3.297 -12.408 3.193 1.00 21.23 C ATOM 1101 CG LYS A 66 -4.123 -13.579 2.663 1.00 12.24 C ATOM 1102 CD LYS A 66 -4.796 -14.364 3.787 1.00 60.42 C ATOM 1103 CE LYS A 66 -5.568 -15.562 3.248 1.00 70.44 C ATOM 1104 NZ LYS A 66 -6.205 -16.353 4.333 1.00 43.43 N ATOM 0 H LYS A 66 -5.160 -11.192 2.111 1.00 11.42 H new ATOM 0 HA LYS A 66 -4.629 -11.807 4.775 1.00 70.52 H new ATOM 0 HB2 LYS A 66 -2.779 -11.936 2.358 1.00 21.23 H new ATOM 0 HB3 LYS A 66 -2.531 -12.793 3.866 1.00 21.23 H new ATOM 0 HG2 LYS A 66 -4.883 -13.205 1.978 1.00 12.24 H new ATOM 0 HG3 LYS A 66 -3.479 -14.247 2.091 1.00 12.24 H new ATOM 0 HD2 LYS A 66 -4.042 -14.705 4.496 1.00 60.42 H new ATOM 0 HD3 LYS A 66 -5.474 -13.709 4.334 1.00 60.42 H new ATOM 0 HE2 LYS A 66 -6.335 -15.216 2.555 1.00 70.44 H new ATOM 0 HE3 LYS A 66 -4.892 -16.203 2.682 1.00 70.44 H new ATOM 0 HZ1 LYS A 66 -6.719 -17.157 3.920 1.00 43.43 H new ATOM 0 HZ2 LYS A 66 -5.472 -16.706 4.981 1.00 43.43 H new ATOM 0 HZ3 LYS A 66 -6.870 -15.750 4.858 1.00 43.43 H new ATOM 1118 N ALA A 67 -2.965 -9.200 3.696 1.00 2.35 N ATOM 1119 CA ALA A 67 -2.169 -8.052 4.141 1.00 11.33 C ATOM 1120 C ALA A 67 -2.876 -7.302 5.280 1.00 21.22 C ATOM 1121 O ALA A 67 -2.345 -7.178 6.387 1.00 72.55 O ATOM 1122 CB ALA A 67 -1.901 -7.118 2.968 1.00 11.01 C ATOM 0 H ALA A 67 -3.327 -9.117 2.746 1.00 2.35 H new ATOM 0 HA ALA A 67 -1.216 -8.419 4.523 1.00 11.33 H new ATOM 0 HB1 ALA A 67 -1.309 -6.268 3.308 1.00 11.01 H new ATOM 0 HB2 ALA A 67 -1.354 -7.655 2.193 1.00 11.01 H new ATOM 0 HB3 ALA A 67 -2.848 -6.762 2.563 1.00 11.01 H new ATOM 1128 N ILE A 68 -4.089 -6.826 5.009 1.00 14.53 N ATOM 1129 CA ILE A 68 -4.892 -6.114 6.013 1.00 33.22 C ATOM 1130 C ILE A 68 -5.212 -7.025 7.214 1.00 51.24 C ATOM 1131 O ILE A 68 -5.413 -6.558 8.336 1.00 20.24 O ATOM 1132 CB ILE A 68 -6.216 -5.589 5.395 1.00 44.32 C ATOM 1133 CG1 ILE A 68 -5.929 -4.771 4.122 1.00 2.03 C ATOM 1134 CG2 ILE A 68 -6.999 -4.755 6.410 1.00 50.13 C ATOM 1135 CD1 ILE A 68 -5.021 -3.574 4.345 1.00 3.32 C ATOM 0 H ILE A 68 -4.543 -6.919 4.100 1.00 14.53 H new ATOM 0 HA ILE A 68 -4.301 -5.266 6.360 1.00 33.22 H new ATOM 0 HB ILE A 68 -6.829 -6.448 5.121 1.00 44.32 H new ATOM 0 HG12 ILE A 68 -5.474 -5.425 3.378 1.00 2.03 H new ATOM 0 HG13 ILE A 68 -6.874 -4.424 3.706 1.00 2.03 H new ATOM 0 HG21 ILE A 68 -7.922 -4.399 5.953 1.00 50.13 H new ATOM 0 HG22 ILE A 68 -7.237 -5.369 7.279 1.00 50.13 H new ATOM 0 HG23 ILE A 68 -6.396 -3.902 6.723 1.00 50.13 H new ATOM 0 HD11 ILE A 68 -4.869 -3.052 3.400 1.00 3.32 H new ATOM 0 HD12 ILE A 68 -5.482 -2.897 5.064 1.00 3.32 H new ATOM 0 HD13 ILE A 68 -4.060 -3.913 4.731 1.00 3.32 H new ATOM 1147 N ARG A 69 -5.235 -8.332 6.960 1.00 4.02 N ATOM 1148 CA ARG A 69 -5.498 -9.337 7.994 1.00 43.04 C ATOM 1149 C ARG A 69 -4.417 -9.294 9.088 1.00 71.35 C ATOM 1150 O ARG A 69 -4.680 -9.606 10.249 1.00 75.41 O ATOM 1151 CB ARG A 69 -5.540 -10.735 7.353 1.00 22.02 C ATOM 1152 CG ARG A 69 -6.137 -11.824 8.238 1.00 73.23 C ATOM 1153 CD ARG A 69 -7.647 -11.667 8.384 1.00 54.33 C ATOM 1154 NE ARG A 69 -8.235 -12.721 9.209 1.00 75.13 N ATOM 1155 CZ ARG A 69 -9.257 -13.455 8.856 1.00 31.30 C ATOM 1156 NH1 ARG A 69 -9.800 -13.319 7.689 1.00 72.04 N ATOM 1157 NH2 ARG A 69 -9.727 -14.341 9.666 1.00 2.41 N ATOM 0 H ARG A 69 -5.072 -8.726 6.033 1.00 4.02 H new ATOM 0 HA ARG A 69 -6.460 -9.117 8.457 1.00 43.04 H new ATOM 0 HB2 ARG A 69 -6.117 -10.679 6.430 1.00 22.02 H new ATOM 0 HB3 ARG A 69 -4.526 -11.024 7.078 1.00 22.02 H new ATOM 0 HG2 ARG A 69 -5.912 -12.802 7.813 1.00 73.23 H new ATOM 0 HG3 ARG A 69 -5.671 -11.789 9.223 1.00 73.23 H new ATOM 0 HD2 ARG A 69 -7.868 -10.696 8.826 1.00 54.33 H new ATOM 0 HD3 ARG A 69 -8.109 -11.680 7.397 1.00 54.33 H new ATOM 0 HE ARG A 69 -7.819 -12.896 10.124 1.00 75.13 H new ATOM 0 HH11 ARG A 69 -9.431 -12.632 7.032 1.00 72.04 H new ATOM 0 HH12 ARG A 69 -10.597 -13.899 7.427 1.00 72.04 H new ATOM 0 HH21 ARG A 69 -9.301 -14.470 10.584 1.00 2.41 H new ATOM 0 HH22 ARG A 69 -10.525 -14.913 9.389 1.00 2.41 H new ATOM 1171 N PHE A 70 -3.196 -8.936 8.694 1.00 20.31 N ATOM 1172 CA PHE A 70 -2.098 -8.730 9.647 1.00 25.41 C ATOM 1173 C PHE A 70 -2.117 -7.291 10.199 1.00 55.11 C ATOM 1174 O PHE A 70 -2.033 -7.075 11.411 1.00 12.23 O ATOM 1175 CB PHE A 70 -0.751 -9.029 8.974 1.00 42.41 C ATOM 1176 CG PHE A 70 0.436 -8.947 9.907 1.00 1.43 C ATOM 1177 CD1 PHE A 70 0.774 -10.021 10.720 1.00 14.22 C ATOM 1178 CD2 PHE A 70 1.216 -7.798 9.967 1.00 61.41 C ATOM 1179 CE1 PHE A 70 1.859 -9.951 11.573 1.00 64.41 C ATOM 1180 CE2 PHE A 70 2.301 -7.725 10.821 1.00 54.31 C ATOM 1181 CZ PHE A 70 2.623 -8.802 11.623 1.00 73.12 C ATOM 0 H PHE A 70 -2.938 -8.781 7.719 1.00 20.31 H new ATOM 0 HA PHE A 70 -2.233 -9.416 10.483 1.00 25.41 H new ATOM 0 HB2 PHE A 70 -0.788 -10.027 8.538 1.00 42.41 H new ATOM 0 HB3 PHE A 70 -0.603 -8.328 8.153 1.00 42.41 H new ATOM 0 HD1 PHE A 70 0.181 -10.923 10.685 1.00 14.22 H new ATOM 0 HD2 PHE A 70 0.972 -6.953 9.340 1.00 61.41 H new ATOM 0 HE1 PHE A 70 2.109 -10.794 12.200 1.00 64.41 H new ATOM 0 HE2 PHE A 70 2.897 -6.825 10.861 1.00 54.31 H new ATOM 0 HZ PHE A 70 3.472 -8.746 12.289 1.00 73.12 H new ATOM 1191 N VAL A 71 -2.243 -6.312 9.297 1.00 62.23 N ATOM 1192 CA VAL A 71 -2.259 -4.884 9.668 1.00 24.13 C ATOM 1193 C VAL A 71 -3.320 -4.569 10.743 1.00 42.11 C ATOM 1194 O VAL A 71 -3.124 -3.690 11.586 1.00 13.42 O ATOM 1195 CB VAL A 71 -2.512 -3.989 8.424 1.00 64.33 C ATOM 1196 CG1 VAL A 71 -2.559 -2.508 8.808 1.00 52.14 C ATOM 1197 CG2 VAL A 71 -1.446 -4.238 7.355 1.00 41.51 C ATOM 0 H VAL A 71 -2.336 -6.480 8.295 1.00 62.23 H new ATOM 0 HA VAL A 71 -1.276 -4.665 10.084 1.00 24.13 H new ATOM 0 HB VAL A 71 -3.484 -4.257 8.010 1.00 64.33 H new ATOM 0 HG11 VAL A 71 -2.737 -1.907 7.917 1.00 52.14 H new ATOM 0 HG12 VAL A 71 -3.364 -2.343 9.524 1.00 52.14 H new ATOM 0 HG13 VAL A 71 -1.609 -2.218 9.257 1.00 52.14 H new ATOM 0 HG21 VAL A 71 -1.641 -3.602 6.492 1.00 41.51 H new ATOM 0 HG22 VAL A 71 -0.462 -4.006 7.762 1.00 41.51 H new ATOM 0 HG23 VAL A 71 -1.475 -5.284 7.049 1.00 41.51 H new ATOM 1207 N LYS A 72 -4.430 -5.304 10.720 1.00 13.45 N ATOM 1208 CA LYS A 72 -5.519 -5.115 11.695 1.00 23.22 C ATOM 1209 C LYS A 72 -5.018 -5.232 13.154 1.00 4.12 C ATOM 1210 O LYS A 72 -5.643 -4.718 14.081 1.00 31.13 O ATOM 1211 CB LYS A 72 -6.638 -6.143 11.421 1.00 14.04 C ATOM 1212 CG LYS A 72 -6.235 -7.601 11.663 1.00 12.44 C ATOM 1213 CD LYS A 72 -6.524 -8.064 13.091 1.00 40.02 C ATOM 1214 CE LYS A 72 -5.820 -9.379 13.419 1.00 44.13 C ATOM 1215 NZ LYS A 72 -6.161 -10.464 12.462 1.00 45.43 N ATOM 0 H LYS A 72 -4.606 -6.041 10.037 1.00 13.45 H new ATOM 0 HA LYS A 72 -5.911 -4.105 11.574 1.00 23.22 H new ATOM 0 HB2 LYS A 72 -7.494 -5.906 12.053 1.00 14.04 H new ATOM 0 HB3 LYS A 72 -6.966 -6.037 10.387 1.00 14.04 H new ATOM 0 HG2 LYS A 72 -6.770 -8.242 10.962 1.00 12.44 H new ATOM 0 HG3 LYS A 72 -5.171 -7.719 11.455 1.00 12.44 H new ATOM 0 HD2 LYS A 72 -6.202 -7.295 13.794 1.00 40.02 H new ATOM 0 HD3 LYS A 72 -7.599 -8.186 13.222 1.00 40.02 H new ATOM 0 HE2 LYS A 72 -4.742 -9.221 13.414 1.00 44.13 H new ATOM 0 HE3 LYS A 72 -6.092 -9.691 14.428 1.00 44.13 H new ATOM 0 HZ1 LYS A 72 -5.858 -11.379 12.852 1.00 45.43 H new ATOM 0 HZ2 LYS A 72 -7.189 -10.478 12.305 1.00 45.43 H new ATOM 0 HZ3 LYS A 72 -5.675 -10.295 11.558 1.00 45.43 H new ATOM 1229 N SER A 73 -3.884 -5.912 13.344 1.00 5.01 N ATOM 1230 CA SER A 73 -3.329 -6.152 14.688 1.00 4.31 C ATOM 1231 C SER A 73 -2.488 -4.970 15.198 1.00 21.32 C ATOM 1232 O SER A 73 -2.135 -4.919 16.376 1.00 52.30 O ATOM 1233 CB SER A 73 -2.473 -7.427 14.690 1.00 23.45 C ATOM 1234 OG SER A 73 -1.941 -7.695 15.982 1.00 64.22 O ATOM 0 H SER A 73 -3.328 -6.308 12.586 1.00 5.01 H new ATOM 0 HA SER A 73 -4.177 -6.270 15.363 1.00 4.31 H new ATOM 0 HB2 SER A 73 -3.077 -8.273 14.361 1.00 23.45 H new ATOM 0 HB3 SER A 73 -1.658 -7.320 13.974 1.00 23.45 H new ATOM 0 HG SER A 73 -1.867 -6.857 16.485 1.00 64.22 H new ATOM 1240 N LEU A 74 -2.153 -4.031 14.315 1.00 23.44 N ATOM 1241 CA LEU A 74 -1.303 -2.886 14.685 1.00 0.41 C ATOM 1242 C LEU A 74 -2.027 -1.910 15.630 1.00 4.32 C ATOM 1243 O LEU A 74 -1.425 -1.374 16.562 1.00 60.55 O ATOM 1244 CB LEU A 74 -0.831 -2.145 13.424 1.00 73.00 C ATOM 1245 CG LEU A 74 0.008 -2.984 12.443 1.00 14.12 C ATOM 1246 CD1 LEU A 74 0.432 -2.145 11.239 1.00 25.12 C ATOM 1247 CD2 LEU A 74 1.230 -3.579 13.145 1.00 65.20 C ATOM 0 H LEU A 74 -2.453 -4.034 13.340 1.00 23.44 H new ATOM 0 HA LEU A 74 -0.439 -3.282 15.219 1.00 0.41 H new ATOM 0 HB2 LEU A 74 -1.706 -1.766 12.896 1.00 73.00 H new ATOM 0 HB3 LEU A 74 -0.244 -1.279 13.730 1.00 73.00 H new ATOM 0 HG LEU A 74 -0.611 -3.806 12.084 1.00 14.12 H new ATOM 0 HD11 LEU A 74 1.024 -2.758 10.559 1.00 25.12 H new ATOM 0 HD12 LEU A 74 -0.454 -1.779 10.720 1.00 25.12 H new ATOM 0 HD13 LEU A 74 1.029 -1.298 11.578 1.00 25.12 H new ATOM 0 HD21 LEU A 74 1.808 -4.168 12.433 1.00 65.20 H new ATOM 0 HD22 LEU A 74 1.851 -2.774 13.539 1.00 65.20 H new ATOM 0 HD23 LEU A 74 0.903 -4.219 13.964 1.00 65.20 H new ATOM 1259 N GLY A 75 -3.318 -1.686 15.384 1.00 20.52 N ATOM 1260 CA GLY A 75 -4.102 -0.785 16.227 1.00 14.44 C ATOM 1261 C GLY A 75 -3.723 0.689 16.071 1.00 52.31 C ATOM 1262 O GLY A 75 -3.600 1.418 17.060 1.00 21.11 O ATOM 0 H GLY A 75 -3.838 -2.111 14.616 1.00 20.52 H new ATOM 0 HA2 GLY A 75 -5.159 -0.906 15.989 1.00 14.44 H new ATOM 0 HA3 GLY A 75 -3.975 -1.075 17.270 1.00 14.44 H new ATOM 1266 N ALA A 76 -3.550 1.132 14.825 1.00 54.05 N ATOM 1267 CA ALA A 76 -3.213 2.532 14.536 1.00 43.34 C ATOM 1268 C ALA A 76 -3.869 3.015 13.234 1.00 52.44 C ATOM 1269 O ALA A 76 -4.220 2.215 12.365 1.00 10.15 O ATOM 1270 CB ALA A 76 -1.700 2.712 14.458 1.00 41.14 C ATOM 0 H ALA A 76 -3.637 0.543 13.997 1.00 54.05 H new ATOM 0 HA ALA A 76 -3.603 3.138 15.353 1.00 43.34 H new ATOM 0 HB1 ALA A 76 -1.468 3.755 14.243 1.00 41.14 H new ATOM 0 HB2 ALA A 76 -1.250 2.429 15.410 1.00 41.14 H new ATOM 0 HB3 ALA A 76 -1.299 2.081 13.665 1.00 41.14 H new ATOM 1276 N GLN A 77 -4.029 4.329 13.109 1.00 42.32 N ATOM 1277 CA GLN A 77 -4.634 4.932 11.918 1.00 3.10 C ATOM 1278 C GLN A 77 -3.604 5.069 10.781 1.00 62.22 C ATOM 1279 O GLN A 77 -2.684 5.885 10.862 1.00 42.42 O ATOM 1280 CB GLN A 77 -5.223 6.307 12.270 1.00 11.35 C ATOM 1281 CG GLN A 77 -6.246 6.267 13.402 1.00 31.52 C ATOM 1282 CD GLN A 77 -6.785 7.645 13.756 1.00 34.43 C ATOM 1283 OE1 GLN A 77 -6.099 8.652 13.614 1.00 43.52 O ATOM 1284 NE2 GLN A 77 -8.016 7.704 14.221 1.00 65.51 N ATOM 0 H GLN A 77 -3.747 5.003 13.821 1.00 42.32 H new ATOM 0 HA GLN A 77 -5.433 4.277 11.571 1.00 3.10 H new ATOM 0 HB2 GLN A 77 -4.411 6.979 12.550 1.00 11.35 H new ATOM 0 HB3 GLN A 77 -5.694 6.728 11.382 1.00 11.35 H new ATOM 0 HG2 GLN A 77 -7.075 5.620 13.114 1.00 31.52 H new ATOM 0 HG3 GLN A 77 -5.787 5.823 14.285 1.00 31.52 H new ATOM 0 HE21 GLN A 77 -8.562 6.849 14.328 1.00 65.51 H new ATOM 0 HE22 GLN A 77 -8.423 8.604 14.474 1.00 65.51 H new ATOM 1293 N VAL A 78 -3.755 4.259 9.732 1.00 43.44 N ATOM 1294 CA VAL A 78 -2.829 4.284 8.588 1.00 34.23 C ATOM 1295 C VAL A 78 -3.545 4.651 7.274 1.00 23.22 C ATOM 1296 O VAL A 78 -4.726 4.350 7.089 1.00 52.41 O ATOM 1297 CB VAL A 78 -2.107 2.919 8.412 1.00 53.33 C ATOM 1298 CG1 VAL A 78 -1.321 2.548 9.669 1.00 71.54 C ATOM 1299 CG2 VAL A 78 -3.100 1.814 8.055 1.00 24.40 C ATOM 0 H VAL A 78 -4.508 3.576 9.647 1.00 43.44 H new ATOM 0 HA VAL A 78 -2.091 5.055 8.810 1.00 34.23 H new ATOM 0 HB VAL A 78 -1.402 3.022 7.587 1.00 53.33 H new ATOM 0 HG11 VAL A 78 -0.826 1.589 9.519 1.00 71.54 H new ATOM 0 HG12 VAL A 78 -0.573 3.315 9.870 1.00 71.54 H new ATOM 0 HG13 VAL A 78 -2.003 2.475 10.516 1.00 71.54 H new ATOM 0 HG21 VAL A 78 -2.567 0.870 7.938 1.00 24.40 H new ATOM 0 HG22 VAL A 78 -3.839 1.718 8.851 1.00 24.40 H new ATOM 0 HG23 VAL A 78 -3.603 2.065 7.121 1.00 24.40 H new ATOM 1309 N LEU A 79 -2.816 5.308 6.370 1.00 22.13 N ATOM 1310 CA LEU A 79 -3.338 5.643 5.039 1.00 42.10 C ATOM 1311 C LEU A 79 -3.022 4.521 4.044 1.00 60.03 C ATOM 1312 O LEU A 79 -1.861 4.213 3.794 1.00 42.22 O ATOM 1313 CB LEU A 79 -2.739 6.967 4.527 1.00 30.42 C ATOM 1314 CG LEU A 79 -3.160 8.241 5.287 1.00 24.13 C ATOM 1315 CD1 LEU A 79 -4.680 8.382 5.321 1.00 23.02 C ATOM 1316 CD2 LEU A 79 -2.581 8.264 6.701 1.00 15.10 C ATOM 0 H LEU A 79 -1.859 5.621 6.534 1.00 22.13 H new ATOM 0 HA LEU A 79 -4.419 5.758 5.124 1.00 42.10 H new ATOM 0 HB2 LEU A 79 -1.652 6.889 4.564 1.00 30.42 H new ATOM 0 HB3 LEU A 79 -3.015 7.086 3.479 1.00 30.42 H new ATOM 0 HG LEU A 79 -2.752 9.095 4.747 1.00 24.13 H new ATOM 0 HD11 LEU A 79 -4.949 9.289 5.863 1.00 23.02 H new ATOM 0 HD12 LEU A 79 -5.063 8.441 4.302 1.00 23.02 H new ATOM 0 HD13 LEU A 79 -5.115 7.517 5.822 1.00 23.02 H new ATOM 0 HD21 LEU A 79 -2.897 9.175 7.209 1.00 15.10 H new ATOM 0 HD22 LEU A 79 -2.940 7.397 7.255 1.00 15.10 H new ATOM 0 HD23 LEU A 79 -1.493 8.237 6.649 1.00 15.10 H new ATOM 1328 N ILE A 80 -4.055 3.910 3.484 1.00 75.13 N ATOM 1329 CA ILE A 80 -3.876 2.790 2.554 1.00 50.04 C ATOM 1330 C ILE A 80 -4.092 3.220 1.094 1.00 32.03 C ATOM 1331 O ILE A 80 -5.194 3.590 0.699 1.00 23.53 O ATOM 1332 CB ILE A 80 -4.834 1.623 2.907 1.00 0.11 C ATOM 1333 CG1 ILE A 80 -4.579 1.159 4.354 1.00 42.13 C ATOM 1334 CG2 ILE A 80 -4.667 0.460 1.923 1.00 72.31 C ATOM 1335 CD1 ILE A 80 -5.490 0.042 4.815 1.00 32.42 C ATOM 0 H ILE A 80 -5.028 4.166 3.653 1.00 75.13 H new ATOM 0 HA ILE A 80 -2.846 2.450 2.657 1.00 50.04 H new ATOM 0 HB ILE A 80 -5.862 1.977 2.827 1.00 0.11 H new ATOM 0 HG12 ILE A 80 -3.544 0.828 4.441 1.00 42.13 H new ATOM 0 HG13 ILE A 80 -4.699 2.011 5.024 1.00 42.13 H new ATOM 0 HG21 ILE A 80 -5.350 -0.346 2.193 1.00 72.31 H new ATOM 0 HG22 ILE A 80 -4.891 0.803 0.913 1.00 72.31 H new ATOM 0 HG23 ILE A 80 -3.641 0.094 1.963 1.00 72.31 H new ATOM 0 HD11 ILE A 80 -5.246 -0.226 5.843 1.00 32.42 H new ATOM 0 HD12 ILE A 80 -6.527 0.373 4.763 1.00 32.42 H new ATOM 0 HD13 ILE A 80 -5.354 -0.827 4.171 1.00 32.42 H new ATOM 1347 N ILE A 81 -3.027 3.174 0.299 1.00 74.23 N ATOM 1348 CA ILE A 81 -3.101 3.528 -1.123 1.00 3.11 C ATOM 1349 C ILE A 81 -3.135 2.268 -2.001 1.00 20.21 C ATOM 1350 O ILE A 81 -2.174 1.502 -2.036 1.00 15.42 O ATOM 1351 CB ILE A 81 -1.898 4.406 -1.552 1.00 72.23 C ATOM 1352 CG1 ILE A 81 -1.806 5.669 -0.680 1.00 71.03 C ATOM 1353 CG2 ILE A 81 -2.004 4.780 -3.031 1.00 72.20 C ATOM 1354 CD1 ILE A 81 -0.658 6.589 -1.056 1.00 73.31 C ATOM 0 H ILE A 81 -2.098 2.895 0.613 1.00 74.23 H new ATOM 0 HA ILE A 81 -4.022 4.095 -1.261 1.00 3.11 H new ATOM 0 HB ILE A 81 -0.986 3.826 -1.409 1.00 72.23 H new ATOM 0 HG12 ILE A 81 -2.743 6.221 -0.757 1.00 71.03 H new ATOM 0 HG13 ILE A 81 -1.695 5.372 0.363 1.00 71.03 H new ATOM 0 HG21 ILE A 81 -1.150 5.396 -3.313 1.00 72.20 H new ATOM 0 HG22 ILE A 81 -2.012 3.873 -3.636 1.00 72.20 H new ATOM 0 HG23 ILE A 81 -2.925 5.337 -3.200 1.00 72.20 H new ATOM 0 HD11 ILE A 81 -0.657 7.458 -0.398 1.00 73.31 H new ATOM 0 HD12 ILE A 81 0.286 6.054 -0.952 1.00 73.31 H new ATOM 0 HD13 ILE A 81 -0.777 6.917 -2.089 1.00 73.31 H new ATOM 1366 N ILE A 82 -4.240 2.057 -2.711 1.00 31.43 N ATOM 1367 CA ILE A 82 -4.403 0.864 -3.550 1.00 55.04 C ATOM 1368 C ILE A 82 -4.275 1.206 -5.047 1.00 13.13 C ATOM 1369 O ILE A 82 -4.884 2.163 -5.529 1.00 21.12 O ATOM 1370 CB ILE A 82 -5.769 0.183 -3.287 1.00 2.20 C ATOM 1371 CG1 ILE A 82 -5.919 -0.155 -1.792 1.00 60.42 C ATOM 1372 CG2 ILE A 82 -5.917 -1.080 -4.136 1.00 62.13 C ATOM 1373 CD1 ILE A 82 -7.242 -0.802 -1.437 1.00 13.40 C ATOM 0 H ILE A 82 -5.037 2.693 -2.725 1.00 31.43 H new ATOM 0 HA ILE A 82 -3.604 0.173 -3.283 1.00 55.04 H new ATOM 0 HB ILE A 82 -6.559 0.879 -3.569 1.00 2.20 H new ATOM 0 HG12 ILE A 82 -5.109 -0.823 -1.498 1.00 60.42 H new ATOM 0 HG13 ILE A 82 -5.806 0.760 -1.210 1.00 60.42 H new ATOM 0 HG21 ILE A 82 -6.884 -1.542 -3.935 1.00 62.13 H new ATOM 0 HG22 ILE A 82 -5.852 -0.818 -5.192 1.00 62.13 H new ATOM 0 HG23 ILE A 82 -5.121 -1.781 -3.887 1.00 62.13 H new ATOM 0 HD11 ILE A 82 -7.270 -1.009 -0.367 1.00 13.40 H new ATOM 0 HD12 ILE A 82 -8.058 -0.128 -1.698 1.00 13.40 H new ATOM 0 HD13 ILE A 82 -7.351 -1.735 -1.990 1.00 13.40 H new ATOM 1385 N TYR A 83 -3.484 0.414 -5.773 1.00 62.23 N ATOM 1386 CA TYR A 83 -3.226 0.658 -7.201 1.00 72.11 C ATOM 1387 C TYR A 83 -3.725 -0.493 -8.088 1.00 0.22 C ATOM 1388 O TYR A 83 -3.278 -1.637 -7.956 1.00 21.41 O ATOM 1389 CB TYR A 83 -1.723 0.867 -7.433 1.00 4.54 C ATOM 1390 CG TYR A 83 -1.341 1.045 -8.897 1.00 22.13 C ATOM 1391 CD1 TYR A 83 -1.611 2.235 -9.567 1.00 11.52 C ATOM 1392 CD2 TYR A 83 -0.712 0.024 -9.606 1.00 41.41 C ATOM 1393 CE1 TYR A 83 -1.265 2.404 -10.893 1.00 41.40 C ATOM 1394 CE2 TYR A 83 -0.361 0.189 -10.934 1.00 22.11 C ATOM 1395 CZ TYR A 83 -0.638 1.380 -11.572 1.00 74.15 C ATOM 1396 OH TYR A 83 -0.284 1.555 -12.891 1.00 51.21 O ATOM 0 H TYR A 83 -3.007 -0.406 -5.398 1.00 62.23 H new ATOM 0 HA TYR A 83 -3.778 1.556 -7.480 1.00 72.11 H new ATOM 0 HB2 TYR A 83 -1.398 1.745 -6.874 1.00 4.54 H new ATOM 0 HB3 TYR A 83 -1.181 0.012 -7.028 1.00 4.54 H new ATOM 0 HD1 TYR A 83 -2.100 3.041 -9.040 1.00 11.52 H new ATOM 0 HD2 TYR A 83 -0.495 -0.911 -9.111 1.00 41.41 H new ATOM 0 HE1 TYR A 83 -1.484 3.334 -11.396 1.00 41.40 H new ATOM 0 HE2 TYR A 83 0.128 -0.612 -11.469 1.00 22.11 H new ATOM 0 HH TYR A 83 0.149 0.742 -13.224 1.00 51.21 H new ATOM 1406 N ASP A 84 -4.635 -0.171 -9.003 1.00 2.13 N ATOM 1407 CA ASP A 84 -5.106 -1.125 -10.011 1.00 53.25 C ATOM 1408 C ASP A 84 -5.738 -0.367 -11.193 1.00 20.35 C ATOM 1409 O ASP A 84 -6.520 0.564 -10.995 1.00 12.14 O ATOM 1410 CB ASP A 84 -6.125 -2.104 -9.396 1.00 22.22 C ATOM 1411 CG ASP A 84 -6.396 -3.322 -10.275 1.00 62.23 C ATOM 1412 OD1 ASP A 84 -6.209 -3.240 -11.507 1.00 43.11 O ATOM 1413 OD2 ASP A 84 -6.799 -4.372 -9.737 1.00 50.51 O ATOM 0 H ASP A 84 -5.066 0.751 -9.070 1.00 2.13 H new ATOM 0 HA ASP A 84 -4.255 -1.701 -10.373 1.00 53.25 H new ATOM 0 HB2 ASP A 84 -5.757 -2.439 -8.426 1.00 22.22 H new ATOM 0 HB3 ASP A 84 -7.062 -1.577 -9.217 1.00 22.22 H new ATOM 1418 N GLN A 85 -5.386 -0.761 -12.418 1.00 60.01 N ATOM 1419 CA GLN A 85 -5.937 -0.126 -13.625 1.00 13.41 C ATOM 1420 C GLN A 85 -7.413 -0.497 -13.833 1.00 3.12 C ATOM 1421 O GLN A 85 -8.175 0.269 -14.430 1.00 31.34 O ATOM 1422 CB GLN A 85 -5.118 -0.509 -14.868 1.00 61.32 C ATOM 1423 CG GLN A 85 -3.695 0.043 -14.862 1.00 2.44 C ATOM 1424 CD GLN A 85 -2.955 -0.229 -16.162 1.00 15.21 C ATOM 1425 OE1 GLN A 85 -2.994 0.565 -17.094 1.00 2.43 O ATOM 1426 NE2 GLN A 85 -2.273 -1.350 -16.235 1.00 51.41 N ATOM 0 H GLN A 85 -4.724 -1.514 -12.604 1.00 60.01 H new ATOM 0 HA GLN A 85 -5.874 0.953 -13.481 1.00 13.41 H new ATOM 0 HB2 GLN A 85 -5.076 -1.596 -14.943 1.00 61.32 H new ATOM 0 HB3 GLN A 85 -5.634 -0.148 -15.757 1.00 61.32 H new ATOM 0 HG2 GLN A 85 -3.727 1.118 -14.685 1.00 2.44 H new ATOM 0 HG3 GLN A 85 -3.141 -0.400 -14.034 1.00 2.44 H new ATOM 0 HE21 GLN A 85 -2.260 -1.991 -15.442 1.00 51.41 H new ATOM 0 HE22 GLN A 85 -1.757 -1.579 -17.085 1.00 51.41 H new ATOM 1435 N ASP A 86 -7.813 -1.674 -13.355 1.00 54.03 N ATOM 1436 CA ASP A 86 -9.213 -2.097 -13.421 1.00 53.31 C ATOM 1437 C ASP A 86 -10.019 -1.446 -12.283 1.00 53.04 C ATOM 1438 O ASP A 86 -10.159 -2.008 -11.193 1.00 41.13 O ATOM 1439 CB ASP A 86 -9.322 -3.627 -13.366 1.00 53.42 C ATOM 1440 CG ASP A 86 -8.630 -4.296 -14.542 1.00 72.11 C ATOM 1441 OD1 ASP A 86 -9.077 -4.090 -15.692 1.00 3.02 O ATOM 1442 OD2 ASP A 86 -7.642 -5.035 -14.331 1.00 43.11 O ATOM 0 H ASP A 86 -7.189 -2.352 -12.918 1.00 54.03 H new ATOM 0 HA ASP A 86 -9.632 -1.767 -14.372 1.00 53.31 H new ATOM 0 HB2 ASP A 86 -8.883 -3.987 -12.436 1.00 53.42 H new ATOM 0 HB3 ASP A 86 -10.373 -3.914 -13.354 1.00 53.42 H new ATOM 1447 N GLN A 87 -10.537 -0.249 -12.556 1.00 42.23 N ATOM 1448 CA GLN A 87 -11.194 0.589 -11.541 1.00 43.43 C ATOM 1449 C GLN A 87 -12.405 -0.103 -10.882 1.00 51.30 C ATOM 1450 O GLN A 87 -12.761 0.215 -9.749 1.00 43.20 O ATOM 1451 CB GLN A 87 -11.615 1.923 -12.177 1.00 55.32 C ATOM 1452 CG GLN A 87 -10.448 2.691 -12.793 1.00 53.35 C ATOM 1453 CD GLN A 87 -10.863 3.988 -13.473 1.00 72.40 C ATOM 1454 OE1 GLN A 87 -11.827 4.638 -13.082 1.00 41.10 O ATOM 1455 NE2 GLN A 87 -10.136 4.375 -14.503 1.00 11.23 N ATOM 0 H GLN A 87 -10.515 0.171 -13.485 1.00 42.23 H new ATOM 0 HA GLN A 87 -10.472 0.766 -10.744 1.00 43.43 H new ATOM 0 HB2 GLN A 87 -12.362 1.731 -12.947 1.00 55.32 H new ATOM 0 HB3 GLN A 87 -12.091 2.545 -11.419 1.00 55.32 H new ATOM 0 HG2 GLN A 87 -9.720 2.916 -12.013 1.00 53.35 H new ATOM 0 HG3 GLN A 87 -9.948 2.053 -13.521 1.00 53.35 H new ATOM 0 HE21 GLN A 87 -9.340 3.813 -14.805 1.00 11.23 H new ATOM 0 HE22 GLN A 87 -10.370 5.236 -14.998 1.00 11.23 H new ATOM 1464 N ASN A 88 -13.026 -1.045 -11.591 1.00 5.03 N ATOM 1465 CA ASN A 88 -14.163 -1.807 -11.051 1.00 42.52 C ATOM 1466 C ASN A 88 -13.758 -2.606 -9.793 1.00 35.12 C ATOM 1467 O ASN A 88 -14.293 -2.386 -8.703 1.00 72.50 O ATOM 1468 CB ASN A 88 -14.718 -2.756 -12.127 1.00 55.33 C ATOM 1469 CG ASN A 88 -15.934 -3.540 -11.655 1.00 60.54 C ATOM 1470 OD1 ASN A 88 -16.707 -3.070 -10.829 1.00 3.53 O ATOM 1471 ND2 ASN A 88 -16.108 -4.741 -12.172 1.00 11.32 N ATOM 0 H ASN A 88 -12.764 -1.303 -12.543 1.00 5.03 H new ATOM 0 HA ASN A 88 -14.939 -1.098 -10.761 1.00 42.52 H new ATOM 0 HB2 ASN A 88 -14.986 -2.178 -13.011 1.00 55.33 H new ATOM 0 HB3 ASN A 88 -13.936 -3.454 -12.427 1.00 55.33 H new ATOM 0 HD21 ASN A 88 -16.906 -5.309 -11.886 1.00 11.32 H new ATOM 0 HD22 ASN A 88 -15.445 -5.102 -12.858 1.00 11.32 H new ATOM 1478 N ARG A 89 -12.797 -3.518 -9.948 1.00 53.44 N ATOM 1479 CA ARG A 89 -12.316 -4.337 -8.825 1.00 31.20 C ATOM 1480 C ARG A 89 -11.559 -3.473 -7.798 1.00 41.24 C ATOM 1481 O ARG A 89 -11.650 -3.697 -6.589 1.00 43.32 O ATOM 1482 CB ARG A 89 -11.419 -5.476 -9.343 1.00 50.03 C ATOM 1483 CG ARG A 89 -10.079 -5.007 -9.905 1.00 14.04 C ATOM 1484 CD ARG A 89 -9.388 -6.086 -10.735 1.00 21.00 C ATOM 1485 NE ARG A 89 -9.270 -7.366 -10.032 1.00 51.21 N ATOM 1486 CZ ARG A 89 -8.156 -7.833 -9.529 1.00 3.12 C ATOM 1487 NH1 ARG A 89 -7.089 -7.103 -9.490 1.00 4.32 N ATOM 1488 NH2 ARG A 89 -8.120 -9.032 -9.040 1.00 32.34 N ATOM 0 H ARG A 89 -12.335 -3.711 -10.837 1.00 53.44 H new ATOM 0 HA ARG A 89 -13.180 -4.774 -8.324 1.00 31.20 H new ATOM 0 HB2 ARG A 89 -11.234 -6.177 -8.529 1.00 50.03 H new ATOM 0 HB3 ARG A 89 -11.955 -6.022 -10.119 1.00 50.03 H new ATOM 0 HG2 ARG A 89 -10.236 -4.122 -10.522 1.00 14.04 H new ATOM 0 HG3 ARG A 89 -9.427 -4.711 -9.083 1.00 14.04 H new ATOM 0 HD2 ARG A 89 -9.945 -6.236 -11.660 1.00 21.00 H new ATOM 0 HD3 ARG A 89 -8.393 -5.739 -11.015 1.00 21.00 H new ATOM 0 HE ARG A 89 -10.113 -7.931 -9.928 1.00 51.21 H new ATOM 0 HH11 ARG A 89 -7.109 -6.150 -9.854 1.00 4.32 H new ATOM 0 HH12 ARG A 89 -6.227 -7.480 -9.095 1.00 4.32 H new ATOM 0 HH21 ARG A 89 -8.960 -9.611 -9.047 1.00 32.34 H new ATOM 0 HH22 ARG A 89 -7.252 -9.397 -8.648 1.00 32.34 H new ATOM 1502 N LEU A 90 -10.827 -2.475 -8.299 1.00 13.41 N ATOM 1503 CA LEU A 90 -10.118 -1.506 -7.451 1.00 63.31 C ATOM 1504 C LEU A 90 -11.071 -0.834 -6.452 1.00 11.21 C ATOM 1505 O LEU A 90 -10.851 -0.858 -5.238 1.00 3.31 O ATOM 1506 CB LEU A 90 -9.472 -0.431 -8.336 1.00 43.13 C ATOM 1507 CG LEU A 90 -8.812 0.740 -7.586 1.00 64.13 C ATOM 1508 CD1 LEU A 90 -7.534 0.290 -6.885 1.00 44.12 C ATOM 1509 CD2 LEU A 90 -8.537 1.903 -8.537 1.00 1.52 C ATOM 0 H LEU A 90 -10.708 -2.314 -9.299 1.00 13.41 H new ATOM 0 HA LEU A 90 -9.354 -2.042 -6.888 1.00 63.31 H new ATOM 0 HB2 LEU A 90 -8.719 -0.907 -8.964 1.00 43.13 H new ATOM 0 HB3 LEU A 90 -10.235 -0.028 -9.003 1.00 43.13 H new ATOM 0 HG LEU A 90 -9.506 1.087 -6.820 1.00 64.13 H new ATOM 0 HD11 LEU A 90 -7.088 1.137 -6.363 1.00 44.12 H new ATOM 0 HD12 LEU A 90 -7.770 -0.496 -6.167 1.00 44.12 H new ATOM 0 HD13 LEU A 90 -6.830 -0.093 -7.623 1.00 44.12 H new ATOM 0 HD21 LEU A 90 -8.070 2.720 -7.987 1.00 1.52 H new ATOM 0 HD22 LEU A 90 -7.869 1.573 -9.332 1.00 1.52 H new ATOM 0 HD23 LEU A 90 -9.475 2.247 -8.972 1.00 1.52 H new ATOM 1521 N GLU A 91 -12.133 -0.236 -6.984 1.00 61.41 N ATOM 1522 CA GLU A 91 -13.106 0.504 -6.180 1.00 73.14 C ATOM 1523 C GLU A 91 -13.789 -0.416 -5.150 1.00 33.42 C ATOM 1524 O GLU A 91 -13.911 -0.065 -3.974 1.00 53.02 O ATOM 1525 CB GLU A 91 -14.141 1.162 -7.118 1.00 72.01 C ATOM 1526 CG GLU A 91 -14.912 2.338 -6.517 1.00 35.13 C ATOM 1527 CD GLU A 91 -16.152 1.928 -5.730 1.00 21.14 C ATOM 1528 OE1 GLU A 91 -17.198 1.663 -6.359 1.00 11.43 O ATOM 1529 OE2 GLU A 91 -16.095 1.894 -4.485 1.00 21.34 O ATOM 0 H GLU A 91 -12.345 -0.249 -7.982 1.00 61.41 H new ATOM 0 HA GLU A 91 -12.590 1.282 -5.618 1.00 73.14 H new ATOM 0 HB2 GLU A 91 -13.627 1.506 -8.015 1.00 72.01 H new ATOM 0 HB3 GLU A 91 -14.857 0.402 -7.433 1.00 72.01 H new ATOM 0 HG2 GLU A 91 -14.246 2.898 -5.861 1.00 35.13 H new ATOM 0 HG3 GLU A 91 -15.210 3.012 -7.320 1.00 35.13 H new ATOM 1536 N GLU A 92 -14.195 -1.611 -5.589 1.00 52.31 N ATOM 1537 CA GLU A 92 -14.874 -2.563 -4.700 1.00 61.43 C ATOM 1538 C GLU A 92 -13.964 -3.029 -3.549 1.00 20.44 C ATOM 1539 O GLU A 92 -14.397 -3.095 -2.398 1.00 41.42 O ATOM 1540 CB GLU A 92 -15.384 -3.780 -5.482 1.00 24.31 C ATOM 1541 CG GLU A 92 -16.195 -4.748 -4.621 1.00 41.45 C ATOM 1542 CD GLU A 92 -16.763 -5.916 -5.406 1.00 50.44 C ATOM 1543 OE1 GLU A 92 -17.716 -5.705 -6.185 1.00 60.14 O ATOM 1544 OE2 GLU A 92 -16.280 -7.054 -5.228 1.00 55.15 O ATOM 0 H GLU A 92 -14.068 -1.942 -6.545 1.00 52.31 H new ATOM 0 HA GLU A 92 -15.724 -2.035 -4.267 1.00 61.43 H new ATOM 0 HB2 GLU A 92 -16.001 -3.438 -6.313 1.00 24.31 H new ATOM 0 HB3 GLU A 92 -14.534 -4.310 -5.912 1.00 24.31 H new ATOM 0 HG2 GLU A 92 -15.561 -5.131 -3.821 1.00 41.45 H new ATOM 0 HG3 GLU A 92 -17.013 -4.205 -4.148 1.00 41.45 H new ATOM 1551 N PHE A 93 -12.705 -3.356 -3.849 1.00 65.20 N ATOM 1552 CA PHE A 93 -11.764 -3.768 -2.798 1.00 0.15 C ATOM 1553 C PHE A 93 -11.485 -2.611 -1.823 1.00 1.42 C ATOM 1554 O PHE A 93 -11.351 -2.818 -0.614 1.00 53.15 O ATOM 1555 CB PHE A 93 -10.447 -4.289 -3.390 1.00 43.13 C ATOM 1556 CG PHE A 93 -9.475 -4.747 -2.329 1.00 72.15 C ATOM 1557 CD1 PHE A 93 -9.764 -5.851 -1.536 1.00 61.33 C ATOM 1558 CD2 PHE A 93 -8.287 -4.067 -2.111 1.00 34.32 C ATOM 1559 CE1 PHE A 93 -8.887 -6.263 -0.550 1.00 71.44 C ATOM 1560 CE2 PHE A 93 -7.405 -4.477 -1.128 1.00 52.20 C ATOM 1561 CZ PHE A 93 -7.706 -5.576 -0.346 1.00 0.12 C ATOM 0 H PHE A 93 -12.316 -3.345 -4.792 1.00 65.20 H new ATOM 0 HA PHE A 93 -12.234 -4.584 -2.248 1.00 0.15 H new ATOM 0 HB2 PHE A 93 -10.659 -5.118 -4.065 1.00 43.13 H new ATOM 0 HB3 PHE A 93 -9.984 -3.502 -3.986 1.00 43.13 H new ATOM 0 HD1 PHE A 93 -10.685 -6.394 -1.692 1.00 61.33 H new ATOM 0 HD2 PHE A 93 -8.047 -3.206 -2.717 1.00 34.32 H new ATOM 0 HE1 PHE A 93 -9.125 -7.122 0.060 1.00 71.44 H new ATOM 0 HE2 PHE A 93 -6.482 -3.939 -0.972 1.00 52.20 H new ATOM 0 HZ PHE A 93 -7.019 -5.897 0.423 1.00 0.12 H new ATOM 1571 N SER A 94 -11.406 -1.394 -2.353 1.00 63.52 N ATOM 1572 CA SER A 94 -11.244 -0.195 -1.518 1.00 12.51 C ATOM 1573 C SER A 94 -12.456 -0.004 -0.594 1.00 53.44 C ATOM 1574 O SER A 94 -12.327 0.483 0.532 1.00 14.41 O ATOM 1575 CB SER A 94 -11.052 1.044 -2.397 1.00 51.34 C ATOM 1576 OG SER A 94 -9.884 0.926 -3.195 1.00 21.54 O ATOM 0 H SER A 94 -11.451 -1.206 -3.355 1.00 63.52 H new ATOM 0 HA SER A 94 -10.357 -0.330 -0.899 1.00 12.51 H new ATOM 0 HB2 SER A 94 -11.923 1.178 -3.039 1.00 51.34 H new ATOM 0 HB3 SER A 94 -10.979 1.932 -1.769 1.00 51.34 H new ATOM 0 HG SER A 94 -10.059 0.317 -3.943 1.00 21.54 H new ATOM 1582 N ARG A 95 -13.633 -0.384 -1.086 1.00 32.13 N ATOM 1583 CA ARG A 95 -14.850 -0.411 -0.268 1.00 21.12 C ATOM 1584 C ARG A 95 -14.714 -1.415 0.887 1.00 24.21 C ATOM 1585 O ARG A 95 -15.084 -1.128 2.024 1.00 61.53 O ATOM 1586 CB ARG A 95 -16.052 -0.759 -1.143 1.00 33.40 C ATOM 1587 CG ARG A 95 -17.361 -0.890 -0.378 1.00 3.51 C ATOM 1588 CD ARG A 95 -18.537 -0.907 -1.329 1.00 2.25 C ATOM 1589 NE ARG A 95 -19.784 -1.304 -0.680 1.00 4.21 N ATOM 1590 CZ ARG A 95 -20.951 -1.275 -1.260 1.00 71.13 C ATOM 1591 NH1 ARG A 95 -21.077 -0.800 -2.462 1.00 11.32 N ATOM 1592 NH2 ARG A 95 -21.993 -1.711 -0.630 1.00 24.23 N ATOM 0 H ARG A 95 -13.773 -0.680 -2.052 1.00 32.13 H new ATOM 0 HA ARG A 95 -15.000 0.577 0.166 1.00 21.12 H new ATOM 0 HB2 ARG A 95 -16.166 0.010 -1.907 1.00 33.40 H new ATOM 0 HB3 ARG A 95 -15.851 -1.697 -1.661 1.00 33.40 H new ATOM 0 HG2 ARG A 95 -17.352 -1.805 0.214 1.00 3.51 H new ATOM 0 HG3 ARG A 95 -17.464 -0.060 0.321 1.00 3.51 H new ATOM 0 HD2 ARG A 95 -18.660 0.084 -1.766 1.00 2.25 H new ATOM 0 HD3 ARG A 95 -18.325 -1.593 -2.149 1.00 2.25 H new ATOM 0 HE ARG A 95 -19.739 -1.624 0.287 1.00 4.21 H new ATOM 0 HH11 ARG A 95 -20.259 -0.446 -2.959 1.00 11.32 H new ATOM 0 HH12 ARG A 95 -21.994 -0.781 -2.909 1.00 11.32 H new ATOM 0 HH21 ARG A 95 -21.900 -2.076 0.318 1.00 24.23 H new ATOM 0 HH22 ARG A 95 -22.908 -1.690 -1.081 1.00 24.23 H new ATOM 1606 N GLU A 96 -14.164 -2.593 0.584 1.00 44.32 N ATOM 1607 CA GLU A 96 -13.891 -3.620 1.604 1.00 11.13 C ATOM 1608 C GLU A 96 -12.970 -3.071 2.709 1.00 4.33 C ATOM 1609 O GLU A 96 -13.251 -3.208 3.900 1.00 31.53 O ATOM 1610 CB GLU A 96 -13.238 -4.847 0.950 1.00 71.20 C ATOM 1611 CG GLU A 96 -14.088 -5.504 -0.135 1.00 53.42 C ATOM 1612 CD GLU A 96 -15.219 -6.356 0.424 1.00 3.13 C ATOM 1613 OE1 GLU A 96 -16.195 -5.795 0.968 1.00 70.21 O ATOM 1614 OE2 GLU A 96 -15.143 -7.598 0.306 1.00 63.15 O ATOM 0 H GLU A 96 -13.896 -2.864 -0.362 1.00 44.32 H new ATOM 0 HA GLU A 96 -14.839 -3.909 2.057 1.00 11.13 H new ATOM 0 HB2 GLU A 96 -12.283 -4.549 0.517 1.00 71.20 H new ATOM 0 HB3 GLU A 96 -13.021 -5.585 1.723 1.00 71.20 H new ATOM 0 HG2 GLU A 96 -14.508 -4.730 -0.777 1.00 53.42 H new ATOM 0 HG3 GLU A 96 -13.449 -6.126 -0.762 1.00 53.42 H new ATOM 1621 N VAL A 97 -11.870 -2.440 2.296 1.00 24.53 N ATOM 1622 CA VAL A 97 -10.913 -1.837 3.233 1.00 73.21 C ATOM 1623 C VAL A 97 -11.589 -0.782 4.129 1.00 12.24 C ATOM 1624 O VAL A 97 -11.428 -0.791 5.355 1.00 73.55 O ATOM 1625 CB VAL A 97 -9.728 -1.188 2.473 1.00 65.15 C ATOM 1626 CG1 VAL A 97 -8.751 -0.525 3.441 1.00 34.42 C ATOM 1627 CG2 VAL A 97 -9.011 -2.224 1.610 1.00 62.22 C ATOM 0 H VAL A 97 -11.616 -2.331 1.314 1.00 24.53 H new ATOM 0 HA VAL A 97 -10.535 -2.640 3.866 1.00 73.21 H new ATOM 0 HB VAL A 97 -10.131 -0.414 1.820 1.00 65.15 H new ATOM 0 HG11 VAL A 97 -7.930 -0.078 2.880 1.00 34.42 H new ATOM 0 HG12 VAL A 97 -9.268 0.250 4.006 1.00 34.42 H new ATOM 0 HG13 VAL A 97 -8.356 -1.273 4.128 1.00 34.42 H new ATOM 0 HG21 VAL A 97 -8.182 -1.749 1.085 1.00 62.22 H new ATOM 0 HG22 VAL A 97 -8.628 -3.024 2.244 1.00 62.22 H new ATOM 0 HG23 VAL A 97 -9.710 -2.640 0.884 1.00 62.22 H new ATOM 1637 N ARG A 98 -12.355 0.115 3.510 1.00 15.13 N ATOM 1638 CA ARG A 98 -13.111 1.138 4.246 1.00 51.15 C ATOM 1639 C ARG A 98 -14.192 0.499 5.133 1.00 62.24 C ATOM 1640 O ARG A 98 -14.513 1.010 6.209 1.00 72.24 O ATOM 1641 CB ARG A 98 -13.747 2.141 3.262 1.00 14.04 C ATOM 1642 CG ARG A 98 -13.190 3.559 3.360 1.00 25.24 C ATOM 1643 CD ARG A 98 -13.580 4.237 4.670 1.00 62.23 C ATOM 1644 NE ARG A 98 -12.991 5.569 4.788 1.00 4.14 N ATOM 1645 CZ ARG A 98 -13.545 6.571 5.412 1.00 25.24 C ATOM 1646 NH1 ARG A 98 -14.707 6.446 5.972 1.00 30.23 N ATOM 1647 NH2 ARG A 98 -12.932 7.707 5.477 1.00 61.12 N ATOM 0 H ARG A 98 -12.471 0.157 2.498 1.00 15.13 H new ATOM 0 HA ARG A 98 -12.416 1.671 4.895 1.00 51.15 H new ATOM 0 HB2 ARG A 98 -13.602 1.776 2.245 1.00 14.04 H new ATOM 0 HB3 ARG A 98 -14.822 2.173 3.439 1.00 14.04 H new ATOM 0 HG2 ARG A 98 -12.104 3.528 3.277 1.00 25.24 H new ATOM 0 HG3 ARG A 98 -13.557 4.151 2.522 1.00 25.24 H new ATOM 0 HD2 ARG A 98 -14.666 4.313 4.731 1.00 62.23 H new ATOM 0 HD3 ARG A 98 -13.256 3.621 5.509 1.00 62.23 H new ATOM 0 HE ARG A 98 -12.083 5.726 4.352 1.00 4.14 H new ATOM 0 HH11 ARG A 98 -15.201 5.555 5.928 1.00 30.23 H new ATOM 0 HH12 ARG A 98 -15.128 7.239 6.457 1.00 30.23 H new ATOM 0 HH21 ARG A 98 -12.017 7.818 5.041 1.00 61.12 H new ATOM 0 HH22 ARG A 98 -13.363 8.492 5.965 1.00 61.12 H new ATOM 1661 N ARG A 99 -14.745 -0.624 4.681 1.00 61.35 N ATOM 1662 CA ARG A 99 -15.751 -1.360 5.452 1.00 13.21 C ATOM 1663 C ARG A 99 -15.135 -1.940 6.734 1.00 11.42 C ATOM 1664 O ARG A 99 -15.825 -2.144 7.735 1.00 41.13 O ATOM 1665 CB ARG A 99 -16.362 -2.481 4.596 1.00 41.20 C ATOM 1666 CG ARG A 99 -17.595 -3.132 5.215 1.00 44.52 C ATOM 1667 CD ARG A 99 -18.673 -2.098 5.522 1.00 22.00 C ATOM 1668 NE ARG A 99 -19.907 -2.708 6.005 1.00 1.11 N ATOM 1669 CZ ARG A 99 -20.738 -2.130 6.829 1.00 14.24 C ATOM 1670 NH1 ARG A 99 -20.472 -0.967 7.330 1.00 13.35 N ATOM 1671 NH2 ARG A 99 -21.837 -2.727 7.156 1.00 13.23 N ATOM 0 H ARG A 99 -14.514 -1.047 3.782 1.00 61.35 H new ATOM 0 HA ARG A 99 -16.542 -0.666 5.737 1.00 13.21 H new ATOM 0 HB2 ARG A 99 -16.629 -2.075 3.621 1.00 41.20 H new ATOM 0 HB3 ARG A 99 -15.606 -3.247 4.426 1.00 41.20 H new ATOM 0 HG2 ARG A 99 -17.993 -3.884 4.533 1.00 44.52 H new ATOM 0 HG3 ARG A 99 -17.314 -3.650 6.132 1.00 44.52 H new ATOM 0 HD2 ARG A 99 -18.299 -1.399 6.270 1.00 22.00 H new ATOM 0 HD3 ARG A 99 -18.885 -1.520 4.623 1.00 22.00 H new ATOM 0 HE ARG A 99 -20.135 -3.647 5.678 1.00 1.11 H new ATOM 0 HH11 ARG A 99 -19.605 -0.491 7.082 1.00 13.35 H new ATOM 0 HH12 ARG A 99 -21.130 -0.526 7.973 1.00 13.35 H new ATOM 0 HH21 ARG A 99 -22.052 -3.646 6.770 1.00 13.23 H new ATOM 0 HH22 ARG A 99 -22.489 -2.279 7.800 1.00 13.23 H new ATOM 1685 N ARG A 100 -13.829 -2.194 6.692 1.00 41.54 N ATOM 1686 CA ARG A 100 -13.083 -2.643 7.874 1.00 32.33 C ATOM 1687 C ARG A 100 -12.709 -1.463 8.793 1.00 55.34 C ATOM 1688 O ARG A 100 -12.048 -1.647 9.815 1.00 54.42 O ATOM 1689 CB ARG A 100 -11.818 -3.400 7.448 1.00 0.12 C ATOM 1690 CG ARG A 100 -12.101 -4.718 6.734 1.00 54.45 C ATOM 1691 CD ARG A 100 -10.816 -5.484 6.425 1.00 54.44 C ATOM 1692 NE ARG A 100 -11.073 -6.883 6.088 1.00 44.31 N ATOM 1693 CZ ARG A 100 -10.838 -7.882 6.900 1.00 45.15 C ATOM 1694 NH1 ARG A 100 -10.330 -7.676 8.072 1.00 13.30 N ATOM 1695 NH2 ARG A 100 -11.105 -9.094 6.542 1.00 11.15 N ATOM 0 H ARG A 100 -13.260 -2.097 5.851 1.00 41.54 H new ATOM 0 HA ARG A 100 -13.731 -3.313 8.438 1.00 32.33 H new ATOM 0 HB2 ARG A 100 -11.227 -2.761 6.791 1.00 0.12 H new ATOM 0 HB3 ARG A 100 -11.210 -3.599 8.331 1.00 0.12 H new ATOM 0 HG2 ARG A 100 -12.751 -5.335 7.354 1.00 54.45 H new ATOM 0 HG3 ARG A 100 -12.638 -4.521 5.806 1.00 54.45 H new ATOM 0 HD2 ARG A 100 -10.298 -5.002 5.596 1.00 54.44 H new ATOM 0 HD3 ARG A 100 -10.151 -5.436 7.287 1.00 54.44 H new ATOM 0 HE ARG A 100 -11.458 -7.093 5.167 1.00 44.31 H new ATOM 0 HH11 ARG A 100 -10.108 -6.727 8.372 1.00 13.30 H new ATOM 0 HH12 ARG A 100 -10.151 -8.463 8.696 1.00 13.30 H new ATOM 0 HH21 ARG A 100 -11.502 -9.278 5.621 1.00 11.15 H new ATOM 0 HH22 ARG A 100 -10.919 -9.867 7.181 1.00 11.15 H new ATOM 1709 N GLY A 101 -13.135 -0.255 8.420 1.00 0.12 N ATOM 1710 CA GLY A 101 -12.886 0.923 9.246 1.00 10.44 C ATOM 1711 C GLY A 101 -11.614 1.685 8.877 1.00 22.45 C ATOM 1712 O GLY A 101 -11.290 2.697 9.505 1.00 24.25 O ATOM 0 H GLY A 101 -13.649 -0.069 7.559 1.00 0.12 H new ATOM 0 HA2 GLY A 101 -13.738 1.598 9.164 1.00 10.44 H new ATOM 0 HA3 GLY A 101 -12.823 0.615 10.290 1.00 10.44 H new ATOM 1716 N PHE A 102 -10.901 1.219 7.851 1.00 2.44 N ATOM 1717 CA PHE A 102 -9.639 1.851 7.434 1.00 42.55 C ATOM 1718 C PHE A 102 -9.840 2.979 6.412 1.00 11.45 C ATOM 1719 O PHE A 102 -10.889 3.098 5.779 1.00 54.54 O ATOM 1720 CB PHE A 102 -8.674 0.803 6.863 1.00 5.22 C ATOM 1721 CG PHE A 102 -7.868 0.097 7.920 1.00 64.45 C ATOM 1722 CD1 PHE A 102 -6.784 0.734 8.512 1.00 72.11 C ATOM 1723 CD2 PHE A 102 -8.182 -1.194 8.318 1.00 3.42 C ATOM 1724 CE1 PHE A 102 -6.033 0.094 9.480 1.00 62.01 C ATOM 1725 CE2 PHE A 102 -7.434 -1.837 9.287 1.00 12.22 C ATOM 1726 CZ PHE A 102 -6.357 -1.193 9.867 1.00 22.41 C ATOM 0 H PHE A 102 -11.171 0.409 7.292 1.00 2.44 H new ATOM 0 HA PHE A 102 -9.211 2.300 8.331 1.00 42.55 H new ATOM 0 HB2 PHE A 102 -9.243 0.066 6.297 1.00 5.22 H new ATOM 0 HB3 PHE A 102 -7.995 1.288 6.162 1.00 5.22 H new ATOM 0 HD1 PHE A 102 -6.526 1.739 8.213 1.00 72.11 H new ATOM 0 HD2 PHE A 102 -9.020 -1.703 7.866 1.00 3.42 H new ATOM 0 HE1 PHE A 102 -5.193 0.599 9.934 1.00 62.01 H new ATOM 0 HE2 PHE A 102 -7.691 -2.841 9.590 1.00 12.22 H new ATOM 0 HZ PHE A 102 -5.769 -1.695 10.622 1.00 22.41 H new ATOM 1736 N GLU A 103 -8.800 3.798 6.260 1.00 62.23 N ATOM 1737 CA GLU A 103 -8.802 4.923 5.322 1.00 34.20 C ATOM 1738 C GLU A 103 -8.018 4.564 4.046 1.00 35.21 C ATOM 1739 O GLU A 103 -6.833 4.234 4.109 1.00 21.12 O ATOM 1740 CB GLU A 103 -8.180 6.150 6.006 1.00 12.12 C ATOM 1741 CG GLU A 103 -8.076 7.387 5.123 1.00 73.24 C ATOM 1742 CD GLU A 103 -9.429 7.921 4.662 1.00 35.41 C ATOM 1743 OE1 GLU A 103 -10.262 8.275 5.524 1.00 73.45 O ATOM 1744 OE2 GLU A 103 -9.659 8.008 3.435 1.00 75.21 O ATOM 0 H GLU A 103 -7.930 3.701 6.784 1.00 62.23 H new ATOM 0 HA GLU A 103 -9.828 5.150 5.034 1.00 34.20 H new ATOM 0 HB2 GLU A 103 -8.773 6.398 6.886 1.00 12.12 H new ATOM 0 HB3 GLU A 103 -7.182 5.886 6.357 1.00 12.12 H new ATOM 0 HG2 GLU A 103 -7.552 8.171 5.670 1.00 73.24 H new ATOM 0 HG3 GLU A 103 -7.471 7.149 4.248 1.00 73.24 H new ATOM 1751 N VAL A 104 -8.679 4.638 2.891 1.00 31.10 N ATOM 1752 CA VAL A 104 -8.080 4.190 1.624 1.00 70.34 C ATOM 1753 C VAL A 104 -8.192 5.238 0.496 1.00 44.23 C ATOM 1754 O VAL A 104 -9.169 5.984 0.406 1.00 44.50 O ATOM 1755 CB VAL A 104 -8.732 2.861 1.157 1.00 22.00 C ATOM 1756 CG1 VAL A 104 -10.243 3.018 0.991 1.00 3.43 C ATOM 1757 CG2 VAL A 104 -8.094 2.354 -0.136 1.00 71.35 C ATOM 0 H VAL A 104 -9.628 5.002 2.802 1.00 31.10 H new ATOM 0 HA VAL A 104 -7.019 4.040 1.825 1.00 70.34 H new ATOM 0 HB VAL A 104 -8.552 2.117 1.933 1.00 22.00 H new ATOM 0 HG11 VAL A 104 -10.673 2.072 0.663 1.00 3.43 H new ATOM 0 HG12 VAL A 104 -10.686 3.307 1.944 1.00 3.43 H new ATOM 0 HG13 VAL A 104 -10.449 3.787 0.247 1.00 3.43 H new ATOM 0 HG21 VAL A 104 -8.573 1.422 -0.437 1.00 71.35 H new ATOM 0 HG22 VAL A 104 -8.223 3.098 -0.922 1.00 71.35 H new ATOM 0 HG23 VAL A 104 -7.030 2.180 0.027 1.00 71.35 H new ATOM 1767 N ARG A 105 -7.171 5.279 -0.366 1.00 41.44 N ATOM 1768 CA ARG A 105 -7.173 6.131 -1.562 1.00 73.33 C ATOM 1769 C ARG A 105 -6.896 5.278 -2.814 1.00 12.20 C ATOM 1770 O ARG A 105 -5.988 4.443 -2.820 1.00 62.35 O ATOM 1771 CB ARG A 105 -6.119 7.256 -1.432 1.00 60.13 C ATOM 1772 CG ARG A 105 -6.674 8.666 -1.648 1.00 63.43 C ATOM 1773 CD ARG A 105 -7.153 8.900 -3.082 1.00 3.23 C ATOM 1774 NE ARG A 105 -6.047 8.967 -4.043 1.00 12.41 N ATOM 1775 CZ ARG A 105 -6.200 9.201 -5.324 1.00 22.34 C ATOM 1776 NH1 ARG A 105 -7.385 9.374 -5.825 1.00 44.21 N ATOM 1777 NH2 ARG A 105 -5.167 9.259 -6.106 1.00 71.23 N ATOM 0 H ARG A 105 -6.322 4.725 -0.256 1.00 41.44 H new ATOM 0 HA ARG A 105 -8.155 6.594 -1.659 1.00 73.33 H new ATOM 0 HB2 ARG A 105 -5.669 7.203 -0.441 1.00 60.13 H new ATOM 0 HB3 ARG A 105 -5.322 7.077 -2.154 1.00 60.13 H new ATOM 0 HG2 ARG A 105 -7.503 8.835 -0.961 1.00 63.43 H new ATOM 0 HG3 ARG A 105 -5.903 9.397 -1.403 1.00 63.43 H new ATOM 0 HD2 ARG A 105 -7.831 8.097 -3.370 1.00 3.23 H new ATOM 0 HD3 ARG A 105 -7.722 9.829 -3.124 1.00 3.23 H new ATOM 0 HE ARG A 105 -5.100 8.823 -3.693 1.00 12.41 H new ATOM 0 HH11 ARG A 105 -8.206 9.328 -5.221 1.00 44.21 H new ATOM 0 HH12 ARG A 105 -7.495 9.556 -6.823 1.00 44.21 H new ATOM 0 HH21 ARG A 105 -4.231 9.122 -5.725 1.00 71.23 H new ATOM 0 HH22 ARG A 105 -5.291 9.441 -7.102 1.00 71.23 H new ATOM 1791 N THR A 106 -7.677 5.496 -3.868 1.00 0.15 N ATOM 1792 CA THR A 106 -7.566 4.703 -5.105 1.00 52.40 C ATOM 1793 C THR A 106 -6.709 5.411 -6.159 1.00 32.21 C ATOM 1794 O THR A 106 -7.030 6.519 -6.588 1.00 2.04 O ATOM 1795 CB THR A 106 -8.961 4.413 -5.722 1.00 11.11 C ATOM 1796 OG1 THR A 106 -9.662 5.644 -5.998 1.00 42.30 O ATOM 1797 CG2 THR A 106 -9.802 3.550 -4.788 1.00 62.23 C ATOM 0 H THR A 106 -8.399 6.216 -3.898 1.00 0.15 H new ATOM 0 HA THR A 106 -7.088 3.765 -4.821 1.00 52.40 H new ATOM 0 HB THR A 106 -8.803 3.873 -6.655 1.00 11.11 H new ATOM 0 HG1 THR A 106 -9.013 6.362 -6.155 1.00 42.30 H new ATOM 0 HG21 THR A 106 -10.774 3.361 -5.244 1.00 62.23 H new ATOM 0 HG22 THR A 106 -9.294 2.602 -4.612 1.00 62.23 H new ATOM 0 HG23 THR A 106 -9.940 4.069 -3.839 1.00 62.23 H new ATOM 1805 N VAL A 107 -5.620 4.766 -6.581 1.00 41.13 N ATOM 1806 CA VAL A 107 -4.726 5.330 -7.603 1.00 61.43 C ATOM 1807 C VAL A 107 -4.664 4.437 -8.860 1.00 61.23 C ATOM 1808 O VAL A 107 -4.730 3.210 -8.773 1.00 1.12 O ATOM 1809 CB VAL A 107 -3.297 5.559 -7.050 1.00 34.45 C ATOM 1810 CG1 VAL A 107 -3.323 6.575 -5.911 1.00 24.45 C ATOM 1811 CG2 VAL A 107 -2.662 4.251 -6.586 1.00 74.32 C ATOM 0 H VAL A 107 -5.333 3.851 -6.233 1.00 41.13 H new ATOM 0 HA VAL A 107 -5.146 6.296 -7.885 1.00 61.43 H new ATOM 0 HB VAL A 107 -2.685 5.956 -7.860 1.00 34.45 H new ATOM 0 HG11 VAL A 107 -2.311 6.725 -5.534 1.00 24.45 H new ATOM 0 HG12 VAL A 107 -3.717 7.523 -6.278 1.00 24.45 H new ATOM 0 HG13 VAL A 107 -3.959 6.204 -5.107 1.00 24.45 H new ATOM 0 HG21 VAL A 107 -1.660 4.448 -6.204 1.00 74.32 H new ATOM 0 HG22 VAL A 107 -3.271 3.811 -5.797 1.00 74.32 H new ATOM 0 HG23 VAL A 107 -2.600 3.559 -7.426 1.00 74.32 H new ATOM 1821 N THR A 108 -4.537 5.069 -10.031 1.00 33.31 N ATOM 1822 CA THR A 108 -4.579 4.349 -11.321 1.00 32.30 C ATOM 1823 C THR A 108 -3.401 4.707 -12.243 1.00 43.03 C ATOM 1824 O THR A 108 -3.161 4.030 -13.243 1.00 60.12 O ATOM 1825 CB THR A 108 -5.896 4.644 -12.077 1.00 5.31 C ATOM 1826 OG1 THR A 108 -6.091 6.067 -12.200 1.00 73.12 O ATOM 1827 CG2 THR A 108 -7.089 4.024 -11.358 1.00 14.35 C ATOM 0 H THR A 108 -4.404 6.076 -10.119 1.00 33.31 H new ATOM 0 HA THR A 108 -4.513 3.290 -11.071 1.00 32.30 H new ATOM 0 HB THR A 108 -5.821 4.202 -13.070 1.00 5.31 H new ATOM 0 HG1 THR A 108 -6.926 6.242 -12.681 1.00 73.12 H new ATOM 0 HG21 THR A 108 -8.002 4.246 -11.910 1.00 14.35 H new ATOM 0 HG22 THR A 108 -6.956 2.944 -11.297 1.00 14.35 H new ATOM 0 HG23 THR A 108 -7.163 4.438 -10.352 1.00 14.35 H new ATOM 1835 N SER A 109 -2.673 5.768 -11.908 1.00 53.14 N ATOM 1836 CA SER A 109 -1.522 6.215 -12.716 1.00 33.21 C ATOM 1837 C SER A 109 -0.385 6.711 -11.810 1.00 63.31 C ATOM 1838 O SER A 109 -0.637 7.130 -10.680 1.00 42.41 O ATOM 1839 CB SER A 109 -1.943 7.334 -13.688 1.00 54.43 C ATOM 1840 OG SER A 109 -2.968 6.899 -14.570 1.00 32.22 O ATOM 0 H SER A 109 -2.853 6.341 -11.083 1.00 53.14 H new ATOM 0 HA SER A 109 -1.165 5.363 -13.294 1.00 33.21 H new ATOM 0 HB2 SER A 109 -2.291 8.198 -13.121 1.00 54.43 H new ATOM 0 HB3 SER A 109 -1.078 7.660 -14.266 1.00 54.43 H new ATOM 0 HG SER A 109 -3.214 7.632 -15.172 1.00 32.22 H new ATOM 1846 N PRO A 110 0.885 6.672 -12.282 1.00 64.10 N ATOM 1847 CA PRO A 110 2.047 7.121 -11.486 1.00 32.11 C ATOM 1848 C PRO A 110 1.883 8.542 -10.912 1.00 3.50 C ATOM 1849 O PRO A 110 2.194 8.786 -9.747 1.00 4.13 O ATOM 1850 CB PRO A 110 3.226 7.063 -12.482 1.00 13.50 C ATOM 1851 CG PRO A 110 2.604 6.891 -13.832 1.00 13.24 C ATOM 1852 CD PRO A 110 1.300 6.175 -13.605 1.00 4.32 C ATOM 0 HA PRO A 110 2.187 6.492 -10.607 1.00 32.11 H new ATOM 0 HB2 PRO A 110 3.821 7.975 -12.438 1.00 13.50 H new ATOM 0 HB3 PRO A 110 3.895 6.234 -12.250 1.00 13.50 H new ATOM 0 HG2 PRO A 110 2.440 7.856 -14.311 1.00 13.24 H new ATOM 0 HG3 PRO A 110 3.255 6.315 -14.490 1.00 13.24 H new ATOM 0 HD2 PRO A 110 0.567 6.414 -14.376 1.00 4.32 H new ATOM 0 HD3 PRO A 110 1.426 5.092 -13.610 1.00 4.32 H new ATOM 1860 N ASP A 111 1.393 9.472 -11.731 1.00 43.12 N ATOM 1861 CA ASP A 111 1.130 10.845 -11.278 1.00 61.41 C ATOM 1862 C ASP A 111 -0.051 10.891 -10.285 1.00 24.42 C ATOM 1863 O ASP A 111 0.043 11.506 -9.222 1.00 1.03 O ATOM 1864 CB ASP A 111 0.863 11.755 -12.483 1.00 43.04 C ATOM 1865 CG ASP A 111 -0.230 11.214 -13.384 1.00 3.31 C ATOM 1866 OD1 ASP A 111 0.067 10.333 -14.219 1.00 41.34 O ATOM 1867 OD2 ASP A 111 -1.389 11.655 -13.257 1.00 31.21 O ATOM 0 H ASP A 111 1.169 9.304 -12.712 1.00 43.12 H new ATOM 0 HA ASP A 111 2.014 11.207 -10.754 1.00 61.41 H new ATOM 0 HB2 ASP A 111 0.582 12.747 -12.130 1.00 43.04 H new ATOM 0 HB3 ASP A 111 1.781 11.870 -13.059 1.00 43.04 H new ATOM 1872 N ASP A 112 -1.153 10.229 -10.643 1.00 23.11 N ATOM 1873 CA ASP A 112 -2.320 10.087 -9.756 1.00 42.34 C ATOM 1874 C ASP A 112 -1.908 9.495 -8.390 1.00 61.45 C ATOM 1875 O ASP A 112 -2.507 9.794 -7.353 1.00 30.44 O ATOM 1876 CB ASP A 112 -3.369 9.206 -10.456 1.00 40.33 C ATOM 1877 CG ASP A 112 -4.606 8.921 -9.616 1.00 4.32 C ATOM 1878 OD1 ASP A 112 -5.043 9.805 -8.846 1.00 43.13 O ATOM 1879 OD2 ASP A 112 -5.155 7.805 -9.728 1.00 51.42 O ATOM 0 H ASP A 112 -1.266 9.777 -11.550 1.00 23.11 H new ATOM 0 HA ASP A 112 -2.751 11.069 -9.558 1.00 42.34 H new ATOM 0 HB2 ASP A 112 -3.676 9.693 -11.382 1.00 40.33 H new ATOM 0 HB3 ASP A 112 -2.905 8.259 -10.733 1.00 40.33 H new ATOM 1884 N PHE A 113 -0.876 8.657 -8.405 1.00 20.15 N ATOM 1885 CA PHE A 113 -0.296 8.112 -7.177 1.00 70.23 C ATOM 1886 C PHE A 113 0.563 9.159 -6.451 1.00 73.31 C ATOM 1887 O PHE A 113 0.358 9.431 -5.269 1.00 50.32 O ATOM 1888 CB PHE A 113 0.549 6.870 -7.504 1.00 42.14 C ATOM 1889 CG PHE A 113 1.368 6.362 -6.340 1.00 1.21 C ATOM 1890 CD1 PHE A 113 0.780 5.614 -5.330 1.00 33.32 C ATOM 1891 CD2 PHE A 113 2.729 6.632 -6.261 1.00 52.13 C ATOM 1892 CE1 PHE A 113 1.531 5.148 -4.267 1.00 62.45 C ATOM 1893 CE2 PHE A 113 3.482 6.169 -5.200 1.00 14.30 C ATOM 1894 CZ PHE A 113 2.883 5.427 -4.203 1.00 65.53 C ATOM 0 H PHE A 113 -0.420 8.337 -9.259 1.00 20.15 H new ATOM 0 HA PHE A 113 -1.113 7.830 -6.513 1.00 70.23 H new ATOM 0 HB2 PHE A 113 -0.112 6.073 -7.846 1.00 42.14 H new ATOM 0 HB3 PHE A 113 1.219 7.106 -8.331 1.00 42.14 H new ATOM 0 HD1 PHE A 113 -0.276 5.393 -5.375 1.00 33.32 H new ATOM 0 HD2 PHE A 113 3.204 7.211 -7.039 1.00 52.13 H new ATOM 0 HE1 PHE A 113 1.062 4.566 -3.487 1.00 62.45 H new ATOM 0 HE2 PHE A 113 4.539 6.387 -5.151 1.00 14.30 H new ATOM 0 HZ PHE A 113 3.471 5.064 -3.373 1.00 65.53 H new ATOM 1904 N LYS A 114 1.521 9.744 -7.173 1.00 11.35 N ATOM 1905 CA LYS A 114 2.475 10.696 -6.589 1.00 31.30 C ATOM 1906 C LYS A 114 1.764 11.896 -5.943 1.00 75.24 C ATOM 1907 O LYS A 114 2.039 12.243 -4.801 1.00 64.41 O ATOM 1908 CB LYS A 114 3.463 11.191 -7.656 1.00 33.20 C ATOM 1909 CG LYS A 114 4.622 12.009 -7.084 1.00 32.31 C ATOM 1910 CD LYS A 114 5.596 12.462 -8.172 1.00 64.53 C ATOM 1911 CE LYS A 114 4.998 13.546 -9.065 1.00 12.32 C ATOM 1912 NZ LYS A 114 4.784 14.821 -8.328 1.00 64.30 N ATOM 0 H LYS A 114 1.659 9.575 -8.169 1.00 11.35 H new ATOM 0 HA LYS A 114 3.020 10.167 -5.807 1.00 31.30 H new ATOM 0 HB2 LYS A 114 3.866 10.332 -8.193 1.00 33.20 H new ATOM 0 HB3 LYS A 114 2.925 11.798 -8.384 1.00 33.20 H new ATOM 0 HG2 LYS A 114 4.228 12.882 -6.564 1.00 32.31 H new ATOM 0 HG3 LYS A 114 5.156 11.412 -6.345 1.00 32.31 H new ATOM 0 HD2 LYS A 114 6.508 12.838 -7.708 1.00 64.53 H new ATOM 0 HD3 LYS A 114 5.880 11.605 -8.783 1.00 64.53 H new ATOM 0 HE2 LYS A 114 5.660 13.724 -9.912 1.00 12.32 H new ATOM 0 HE3 LYS A 114 4.048 13.198 -9.471 1.00 12.32 H new ATOM 0 HZ1 LYS A 114 4.506 15.567 -8.998 1.00 64.30 H new ATOM 0 HZ2 LYS A 114 4.032 14.692 -7.622 1.00 64.30 H new ATOM 0 HZ3 LYS A 114 5.665 15.097 -7.849 1.00 64.30 H new ATOM 1926 N LYS A 115 0.848 12.519 -6.681 1.00 30.14 N ATOM 1927 CA LYS A 115 0.096 13.676 -6.171 1.00 0.23 C ATOM 1928 C LYS A 115 -0.682 13.316 -4.898 1.00 20.34 C ATOM 1929 O LYS A 115 -0.668 14.059 -3.911 1.00 23.14 O ATOM 1930 CB LYS A 115 -0.867 14.198 -7.248 1.00 10.20 C ATOM 1931 CG LYS A 115 -0.164 14.697 -8.506 1.00 24.31 C ATOM 1932 CD LYS A 115 0.767 15.871 -8.210 1.00 21.50 C ATOM 1933 CE LYS A 115 0.004 17.092 -7.710 1.00 5.14 C ATOM 1934 NZ LYS A 115 0.921 18.195 -7.326 1.00 64.54 N ATOM 0 H LYS A 115 0.605 12.247 -7.633 1.00 30.14 H new ATOM 0 HA LYS A 115 0.812 14.459 -5.920 1.00 0.23 H new ATOM 0 HB2 LYS A 115 -1.560 13.402 -7.521 1.00 10.20 H new ATOM 0 HB3 LYS A 115 -1.462 15.009 -6.829 1.00 10.20 H new ATOM 0 HG2 LYS A 115 0.409 13.882 -8.949 1.00 24.31 H new ATOM 0 HG3 LYS A 115 -0.909 15.001 -9.242 1.00 24.31 H new ATOM 0 HD2 LYS A 115 1.502 15.572 -7.463 1.00 21.50 H new ATOM 0 HD3 LYS A 115 1.319 16.133 -9.113 1.00 21.50 H new ATOM 0 HE2 LYS A 115 -0.677 17.439 -8.487 1.00 5.14 H new ATOM 0 HE3 LYS A 115 -0.608 16.812 -6.852 1.00 5.14 H new ATOM 0 HZ1 LYS A 115 0.365 19.008 -6.991 1.00 64.54 H new ATOM 0 HZ2 LYS A 115 1.554 17.872 -6.567 1.00 64.54 H new ATOM 0 HZ3 LYS A 115 1.487 18.479 -8.151 1.00 64.54 H new ATOM 1948 N SER A 116 -1.353 12.168 -4.928 1.00 75.24 N ATOM 1949 CA SER A 116 -2.075 11.661 -3.757 1.00 44.32 C ATOM 1950 C SER A 116 -1.113 11.416 -2.585 1.00 71.14 C ATOM 1951 O SER A 116 -1.427 11.718 -1.428 1.00 1.23 O ATOM 1952 CB SER A 116 -2.815 10.359 -4.106 1.00 2.40 C ATOM 1953 OG SER A 116 -3.593 9.884 -3.014 1.00 1.11 O ATOM 0 H SER A 116 -1.414 11.568 -5.750 1.00 75.24 H new ATOM 0 HA SER A 116 -2.803 12.415 -3.457 1.00 44.32 H new ATOM 0 HB2 SER A 116 -3.462 10.528 -4.967 1.00 2.40 H new ATOM 0 HB3 SER A 116 -2.092 9.597 -4.396 1.00 2.40 H new ATOM 0 HG SER A 116 -3.286 8.989 -2.758 1.00 1.11 H new ATOM 1959 N LEU A 117 0.067 10.885 -2.901 1.00 33.32 N ATOM 1960 CA LEU A 117 1.097 10.601 -1.899 1.00 61.04 C ATOM 1961 C LEU A 117 1.631 11.898 -1.262 1.00 22.40 C ATOM 1962 O LEU A 117 1.641 12.035 -0.040 1.00 11.02 O ATOM 1963 CB LEU A 117 2.243 9.807 -2.547 1.00 41.03 C ATOM 1964 CG LEU A 117 3.362 9.348 -1.595 1.00 31.03 C ATOM 1965 CD1 LEU A 117 2.808 8.449 -0.493 1.00 61.14 C ATOM 1966 CD2 LEU A 117 4.466 8.634 -2.371 1.00 3.40 C ATOM 0 H LEU A 117 0.337 10.640 -3.854 1.00 33.32 H new ATOM 0 HA LEU A 117 0.650 10.004 -1.104 1.00 61.04 H new ATOM 0 HB2 LEU A 117 1.821 8.927 -3.032 1.00 41.03 H new ATOM 0 HB3 LEU A 117 2.687 10.421 -3.331 1.00 41.03 H new ATOM 0 HG LEU A 117 3.790 10.232 -1.123 1.00 31.03 H new ATOM 0 HD11 LEU A 117 3.619 8.139 0.166 1.00 61.14 H new ATOM 0 HD12 LEU A 117 2.062 8.997 0.083 1.00 61.14 H new ATOM 0 HD13 LEU A 117 2.346 7.568 -0.940 1.00 61.14 H new ATOM 0 HD21 LEU A 117 5.248 8.317 -1.682 1.00 3.40 H new ATOM 0 HD22 LEU A 117 4.051 7.761 -2.875 1.00 3.40 H new ATOM 0 HD23 LEU A 117 4.888 9.314 -3.111 1.00 3.40 H new ATOM 1978 N GLU A 118 2.048 12.851 -2.101 1.00 13.24 N ATOM 1979 CA GLU A 118 2.565 14.148 -1.634 1.00 15.35 C ATOM 1980 C GLU A 118 1.594 14.830 -0.652 1.00 54.05 C ATOM 1981 O GLU A 118 2.018 15.493 0.299 1.00 54.55 O ATOM 1982 CB GLU A 118 2.834 15.075 -2.833 1.00 0.23 C ATOM 1983 CG GLU A 118 3.931 14.576 -3.775 1.00 73.33 C ATOM 1984 CD GLU A 118 4.141 15.490 -4.980 1.00 54.12 C ATOM 1985 OE1 GLU A 118 3.476 15.284 -6.019 1.00 1.54 O ATOM 1986 OE2 GLU A 118 4.973 16.418 -4.898 1.00 30.32 O ATOM 0 H GLU A 118 2.039 12.750 -3.116 1.00 13.24 H new ATOM 0 HA GLU A 118 3.498 13.958 -1.104 1.00 15.35 H new ATOM 0 HB2 GLU A 118 1.911 15.195 -3.400 1.00 0.23 H new ATOM 0 HB3 GLU A 118 3.111 16.061 -2.461 1.00 0.23 H new ATOM 0 HG2 GLU A 118 4.867 14.491 -3.222 1.00 73.33 H new ATOM 0 HG3 GLU A 118 3.675 13.576 -4.124 1.00 73.33 H new ATOM 1993 N ARG A 119 0.293 14.669 -0.892 1.00 33.42 N ATOM 1994 CA ARG A 119 -0.737 15.212 0.005 1.00 34.14 C ATOM 1995 C ARG A 119 -0.792 14.453 1.342 1.00 25.11 C ATOM 1996 O ARG A 119 -0.696 15.060 2.413 1.00 21.31 O ATOM 1997 CB ARG A 119 -2.113 15.176 -0.677 1.00 42.30 C ATOM 1998 CG ARG A 119 -2.279 16.214 -1.784 1.00 61.44 C ATOM 1999 CD ARG A 119 -2.183 17.633 -1.231 1.00 43.24 C ATOM 2000 NE ARG A 119 -2.442 18.652 -2.246 1.00 33.24 N ATOM 2001 CZ ARG A 119 -2.773 19.887 -1.973 1.00 35.22 C ATOM 2002 NH1 ARG A 119 -2.912 20.274 -0.744 1.00 11.02 N ATOM 2003 NH2 ARG A 119 -2.973 20.732 -2.930 1.00 13.33 N ATOM 0 H ARG A 119 -0.077 14.167 -1.699 1.00 33.42 H new ATOM 0 HA ARG A 119 -0.468 16.246 0.221 1.00 34.14 H new ATOM 0 HB2 ARG A 119 -2.275 14.183 -1.096 1.00 42.30 H new ATOM 0 HB3 ARG A 119 -2.885 15.334 0.076 1.00 42.30 H new ATOM 0 HG2 ARG A 119 -1.512 16.065 -2.544 1.00 61.44 H new ATOM 0 HG3 ARG A 119 -3.243 16.076 -2.273 1.00 61.44 H new ATOM 0 HD2 ARG A 119 -2.896 17.750 -0.415 1.00 43.24 H new ATOM 0 HD3 ARG A 119 -1.189 17.789 -0.811 1.00 43.24 H new ATOM 0 HE ARG A 119 -2.360 18.384 -3.227 1.00 33.24 H new ATOM 0 HH11 ARG A 119 -2.763 19.613 0.019 1.00 11.02 H new ATOM 0 HH12 ARG A 119 -3.170 21.239 -0.539 1.00 11.02 H new ATOM 0 HH21 ARG A 119 -2.873 20.436 -3.901 1.00 13.33 H new ATOM 0 HH22 ARG A 119 -3.231 21.695 -2.714 1.00 13.33 H new ATOM 2017 N LEU A 120 -0.938 13.131 1.280 1.00 50.45 N ATOM 2018 CA LEU A 120 -1.013 12.302 2.492 1.00 35.43 C ATOM 2019 C LEU A 120 0.222 12.494 3.386 1.00 63.33 C ATOM 2020 O LEU A 120 0.102 12.628 4.603 1.00 4.40 O ATOM 2021 CB LEU A 120 -1.170 10.821 2.116 1.00 25.33 C ATOM 2022 CG LEU A 120 -2.489 10.459 1.410 1.00 4.13 C ATOM 2023 CD1 LEU A 120 -2.514 8.980 1.036 1.00 72.55 C ATOM 2024 CD2 LEU A 120 -3.687 10.814 2.290 1.00 30.24 C ATOM 0 H LEU A 120 -1.007 12.607 0.408 1.00 50.45 H new ATOM 0 HA LEU A 120 -1.888 12.622 3.058 1.00 35.43 H new ATOM 0 HB2 LEU A 120 -0.340 10.537 1.468 1.00 25.33 H new ATOM 0 HB3 LEU A 120 -1.086 10.222 3.023 1.00 25.33 H new ATOM 0 HG LEU A 120 -2.555 11.043 0.492 1.00 4.13 H new ATOM 0 HD11 LEU A 120 -3.455 8.746 0.538 1.00 72.55 H new ATOM 0 HD12 LEU A 120 -1.684 8.760 0.364 1.00 72.55 H new ATOM 0 HD13 LEU A 120 -2.421 8.375 1.938 1.00 72.55 H new ATOM 0 HD21 LEU A 120 -4.609 10.550 1.773 1.00 30.24 H new ATOM 0 HD22 LEU A 120 -3.626 10.261 3.228 1.00 30.24 H new ATOM 0 HD23 LEU A 120 -3.681 11.884 2.498 1.00 30.24 H new ATOM 2036 N ILE A 121 1.403 12.529 2.767 1.00 21.05 N ATOM 2037 CA ILE A 121 2.664 12.755 3.491 1.00 10.15 C ATOM 2038 C ILE A 121 2.616 14.046 4.333 1.00 63.31 C ATOM 2039 O ILE A 121 3.248 14.138 5.386 1.00 74.40 O ATOM 2040 CB ILE A 121 3.866 12.816 2.507 1.00 61.21 C ATOM 2041 CG1 ILE A 121 4.045 11.463 1.792 1.00 33.04 C ATOM 2042 CG2 ILE A 121 5.150 13.212 3.238 1.00 12.02 C ATOM 2043 CD1 ILE A 121 5.167 11.452 0.772 1.00 15.14 C ATOM 0 H ILE A 121 1.517 12.404 1.761 1.00 21.05 H new ATOM 0 HA ILE A 121 2.798 11.911 4.167 1.00 10.15 H new ATOM 0 HB ILE A 121 3.655 13.579 1.758 1.00 61.21 H new ATOM 0 HG12 ILE A 121 4.237 10.692 2.538 1.00 33.04 H new ATOM 0 HG13 ILE A 121 3.112 11.200 1.294 1.00 33.04 H new ATOM 0 HG21 ILE A 121 5.976 13.248 2.528 1.00 12.02 H new ATOM 0 HG22 ILE A 121 5.021 14.193 3.694 1.00 12.02 H new ATOM 0 HG23 ILE A 121 5.369 12.477 4.013 1.00 12.02 H new ATOM 0 HD11 ILE A 121 5.231 10.466 0.312 1.00 15.14 H new ATOM 0 HD12 ILE A 121 4.968 12.199 0.004 1.00 15.14 H new ATOM 0 HD13 ILE A 121 6.111 11.683 1.266 1.00 15.14 H new ATOM 2055 N ARG A 122 1.857 15.038 3.869 1.00 54.04 N ATOM 2056 CA ARG A 122 1.692 16.299 4.607 1.00 73.40 C ATOM 2057 C ARG A 122 0.616 16.184 5.700 1.00 63.33 C ATOM 2058 O ARG A 122 0.711 16.831 6.745 1.00 54.44 O ATOM 2059 CB ARG A 122 1.344 17.440 3.637 1.00 24.32 C ATOM 2060 CG ARG A 122 2.514 17.862 2.751 1.00 44.11 C ATOM 2061 CD ARG A 122 3.601 18.571 3.554 1.00 55.45 C ATOM 2062 NE ARG A 122 3.160 19.884 4.034 1.00 5.22 N ATOM 2063 CZ ARG A 122 3.467 20.392 5.201 1.00 5.32 C ATOM 2064 NH1 ARG A 122 4.141 19.709 6.068 1.00 2.31 N ATOM 2065 NH2 ARG A 122 3.079 21.584 5.503 1.00 32.42 N ATOM 0 H ARG A 122 1.346 14.997 2.987 1.00 54.04 H new ATOM 0 HA ARG A 122 2.639 16.521 5.099 1.00 73.40 H new ATOM 0 HB2 ARG A 122 0.513 17.128 3.004 1.00 24.32 H new ATOM 0 HB3 ARG A 122 1.002 18.302 4.210 1.00 24.32 H new ATOM 0 HG2 ARG A 122 2.936 16.984 2.263 1.00 44.11 H new ATOM 0 HG3 ARG A 122 2.154 18.523 1.963 1.00 44.11 H new ATOM 0 HD2 ARG A 122 3.886 17.951 4.404 1.00 55.45 H new ATOM 0 HD3 ARG A 122 4.490 18.691 2.934 1.00 55.45 H new ATOM 0 HE ARG A 122 2.572 20.442 3.415 1.00 5.22 H new ATOM 0 HH11 ARG A 122 4.442 18.760 5.847 1.00 2.31 H new ATOM 0 HH12 ARG A 122 4.372 20.120 6.973 1.00 2.31 H new ATOM 0 HH21 ARG A 122 2.535 22.128 4.834 1.00 32.42 H new ATOM 0 HH22 ARG A 122 3.316 21.983 6.411 1.00 32.42 H new ATOM 2079 N GLU A 123 -0.405 15.363 5.457 1.00 41.22 N ATOM 2080 CA GLU A 123 -1.489 15.180 6.430 1.00 33.14 C ATOM 2081 C GLU A 123 -1.058 14.287 7.604 1.00 42.14 C ATOM 2082 O GLU A 123 -1.141 14.696 8.764 1.00 52.41 O ATOM 2083 CB GLU A 123 -2.739 14.597 5.750 1.00 3.30 C ATOM 2084 CG GLU A 123 -3.343 15.515 4.690 1.00 31.24 C ATOM 2085 CD GLU A 123 -4.774 15.143 4.332 1.00 14.42 C ATOM 2086 OE1 GLU A 123 -5.701 15.577 5.052 1.00 51.51 O ATOM 2087 OE2 GLU A 123 -4.983 14.429 3.327 1.00 22.35 O ATOM 0 H GLU A 123 -0.507 14.816 4.602 1.00 41.22 H new ATOM 0 HA GLU A 123 -1.732 16.164 6.832 1.00 33.14 H new ATOM 0 HB2 GLU A 123 -2.480 13.644 5.288 1.00 3.30 H new ATOM 0 HB3 GLU A 123 -3.492 14.389 6.510 1.00 3.30 H new ATOM 0 HG2 GLU A 123 -3.319 16.543 5.051 1.00 31.24 H new ATOM 0 HG3 GLU A 123 -2.727 15.478 3.791 1.00 31.24 H new ATOM 2094 N VAL A 124 -0.605 13.069 7.312 1.00 41.00 N ATOM 2095 CA VAL A 124 -0.143 12.157 8.366 1.00 33.31 C ATOM 2096 C VAL A 124 1.240 12.578 8.895 1.00 32.33 C ATOM 2097 O VAL A 124 1.474 12.602 10.103 1.00 15.33 O ATOM 2098 CB VAL A 124 -0.106 10.680 7.881 1.00 63.10 C ATOM 2099 CG1 VAL A 124 0.848 10.498 6.700 1.00 42.21 C ATOM 2100 CG2 VAL A 124 0.262 9.740 9.030 1.00 0.51 C ATOM 0 H VAL A 124 -0.547 12.691 6.367 1.00 41.00 H new ATOM 0 HA VAL A 124 -0.864 12.223 9.181 1.00 33.31 H new ATOM 0 HB VAL A 124 -1.107 10.423 7.535 1.00 63.10 H new ATOM 0 HG11 VAL A 124 0.847 9.453 6.389 1.00 42.21 H new ATOM 0 HG12 VAL A 124 0.522 11.124 5.869 1.00 42.21 H new ATOM 0 HG13 VAL A 124 1.856 10.787 6.999 1.00 42.21 H new ATOM 0 HG21 VAL A 124 0.282 8.712 8.667 1.00 0.51 H new ATOM 0 HG22 VAL A 124 1.245 10.007 9.418 1.00 0.51 H new ATOM 0 HG23 VAL A 124 -0.478 9.830 9.825 1.00 0.51 H new ATOM 2110 N GLY A 125 2.136 12.965 7.986 1.00 73.24 N ATOM 2111 CA GLY A 125 3.484 13.370 8.378 1.00 73.20 C ATOM 2112 C GLY A 125 3.556 14.790 8.945 1.00 72.03 C ATOM 2113 O GLY A 125 4.596 15.446 8.870 1.00 24.13 O ATOM 0 H GLY A 125 1.954 13.006 6.983 1.00 73.24 H new ATOM 0 HA2 GLY A 125 3.862 12.670 9.123 1.00 73.20 H new ATOM 0 HA3 GLY A 125 4.142 13.300 7.512 1.00 73.20 H new ATOM 2117 N SER A 126 2.449 15.271 9.508 1.00 54.31 N ATOM 2118 CA SER A 126 2.416 16.593 10.149 1.00 62.20 C ATOM 2119 C SER A 126 2.850 16.507 11.618 1.00 3.01 C ATOM 2120 O SER A 126 3.509 17.408 12.141 1.00 31.45 O ATOM 2121 CB SER A 126 1.005 17.195 10.060 1.00 54.14 C ATOM 2122 OG SER A 126 0.940 18.461 10.701 1.00 52.42 O ATOM 0 H SER A 126 1.562 14.769 9.536 1.00 54.31 H new ATOM 0 HA SER A 126 3.117 17.238 9.619 1.00 62.20 H new ATOM 0 HB2 SER A 126 0.718 17.300 9.014 1.00 54.14 H new ATOM 0 HB3 SER A 126 0.288 16.515 10.520 1.00 54.14 H new ATOM 0 HG SER A 126 0.031 18.819 10.626 1.00 52.42 H new ATOM 2128 N LEU A 127 2.486 15.408 12.281 1.00 24.24 N ATOM 2129 CA LEU A 127 2.812 15.214 13.702 1.00 50.03 C ATOM 2130 C LEU A 127 3.083 13.735 14.040 1.00 41.00 C ATOM 2131 O LEU A 127 3.323 13.393 15.199 1.00 63.43 O ATOM 2132 CB LEU A 127 1.680 15.754 14.600 1.00 54.43 C ATOM 2133 CG LEU A 127 0.344 14.979 14.560 1.00 63.23 C ATOM 2134 CD1 LEU A 127 -0.608 15.491 15.640 1.00 61.22 C ATOM 2135 CD2 LEU A 127 -0.316 15.080 13.184 1.00 12.42 C ATOM 0 H LEU A 127 1.966 14.638 11.861 1.00 24.24 H new ATOM 0 HA LEU A 127 3.727 15.774 13.895 1.00 50.03 H new ATOM 0 HB2 LEU A 127 2.037 15.767 15.630 1.00 54.43 H new ATOM 0 HB3 LEU A 127 1.484 16.788 14.318 1.00 54.43 H new ATOM 0 HG LEU A 127 0.565 13.929 14.754 1.00 63.23 H new ATOM 0 HD11 LEU A 127 -1.543 14.933 15.595 1.00 61.22 H new ATOM 0 HD12 LEU A 127 -0.152 15.357 16.621 1.00 61.22 H new ATOM 0 HD13 LEU A 127 -0.809 16.550 15.475 1.00 61.22 H new ATOM 0 HD21 LEU A 127 -1.254 14.524 13.189 1.00 12.42 H new ATOM 0 HD22 LEU A 127 -0.515 16.126 12.952 1.00 12.42 H new ATOM 0 HD23 LEU A 127 0.350 14.661 12.429 1.00 12.42 H new ATOM 2147 N GLU A 128 3.067 12.862 13.031 1.00 75.10 N ATOM 2148 CA GLU A 128 3.257 11.426 13.266 1.00 51.34 C ATOM 2149 C GLU A 128 4.733 11.108 13.562 1.00 0.43 C ATOM 2150 O GLU A 128 5.614 11.390 12.743 1.00 0.43 O ATOM 2151 CB GLU A 128 2.788 10.598 12.052 1.00 51.51 C ATOM 2152 CG GLU A 128 2.067 9.297 12.424 1.00 2.21 C ATOM 2153 CD GLU A 128 2.624 8.630 13.676 1.00 53.34 C ATOM 2154 OE1 GLU A 128 2.141 8.951 14.782 1.00 73.43 O ATOM 2155 OE2 GLU A 128 3.543 7.793 13.569 1.00 62.11 O ATOM 0 H GLU A 128 2.926 13.118 12.054 1.00 75.10 H new ATOM 0 HA GLU A 128 2.653 11.156 14.133 1.00 51.34 H new ATOM 0 HB2 GLU A 128 2.121 11.210 11.444 1.00 51.51 H new ATOM 0 HB3 GLU A 128 3.653 10.358 11.433 1.00 51.51 H new ATOM 0 HG2 GLU A 128 1.008 9.508 12.575 1.00 2.21 H new ATOM 0 HG3 GLU A 128 2.137 8.600 11.589 1.00 2.21 H new ATOM 2162 N HIS A 129 4.994 10.513 14.725 1.00 14.12 N ATOM 2163 CA HIS A 129 6.359 10.151 15.111 1.00 0.55 C ATOM 2164 C HIS A 129 6.367 9.129 16.265 1.00 44.41 C ATOM 2165 O HIS A 129 6.960 9.365 17.324 1.00 4.24 O ATOM 2166 CB HIS A 129 7.144 11.418 15.495 1.00 24.43 C ATOM 2167 CG HIS A 129 8.616 11.193 15.675 1.00 53.03 C ATOM 2168 ND1 HIS A 129 9.273 11.434 16.858 1.00 54.41 N ATOM 2169 CD2 HIS A 129 9.562 10.769 14.804 1.00 1.03 C ATOM 2170 CE1 HIS A 129 10.553 11.168 16.714 1.00 63.43 C ATOM 2171 NE2 HIS A 129 10.760 10.763 15.479 1.00 32.24 N ATOM 0 H HIS A 129 4.282 10.272 15.415 1.00 14.12 H new ATOM 0 HA HIS A 129 6.844 9.677 14.257 1.00 0.55 H new ATOM 0 HB2 HIS A 129 6.994 12.173 14.724 1.00 24.43 H new ATOM 0 HB3 HIS A 129 6.733 11.821 16.420 1.00 24.43 H new ATOM 0 HD2 HIS A 129 9.405 10.488 13.773 1.00 1.03 H new ATOM 0 HE1 HIS A 129 11.308 11.266 17.481 1.00 63.43 H new ATOM 0 HE2 HIS A 129 11.661 10.490 15.087 1.00 32.24 H new ATOM 2180 N HIS A 130 5.701 7.993 16.055 1.00 64.12 N ATOM 2181 CA HIS A 130 5.690 6.907 17.046 1.00 20.42 C ATOM 2182 C HIS A 130 7.071 6.247 17.195 1.00 64.15 C ATOM 2183 O HIS A 130 7.905 6.289 16.293 1.00 14.41 O ATOM 2184 CB HIS A 130 4.654 5.834 16.671 1.00 31.42 C ATOM 2185 CG HIS A 130 3.245 6.172 17.054 1.00 12.41 C ATOM 2186 ND1 HIS A 130 2.334 6.708 16.176 1.00 53.00 N ATOM 2187 CD2 HIS A 130 2.581 6.012 18.225 1.00 4.34 C ATOM 2188 CE1 HIS A 130 1.174 6.862 16.782 1.00 54.11 C ATOM 2189 NE2 HIS A 130 1.295 6.448 18.023 1.00 61.24 N ATOM 0 H HIS A 130 5.162 7.798 15.211 1.00 64.12 H new ATOM 0 HA HIS A 130 5.420 7.358 18.001 1.00 20.42 H new ATOM 0 HB2 HIS A 130 4.695 5.668 15.595 1.00 31.42 H new ATOM 0 HB3 HIS A 130 4.932 4.895 17.149 1.00 31.42 H new ATOM 0 HD2 HIS A 130 2.987 5.616 19.144 1.00 4.34 H new ATOM 0 HE1 HIS A 130 0.276 7.261 16.334 1.00 54.11 H new ATOM 0 HE2 HIS A 130 0.553 6.450 18.723 1.00 61.24 H new ATOM 2198 N HIS A 131 7.298 5.640 18.355 1.00 62.24 N ATOM 2199 CA HIS A 131 8.519 4.867 18.613 1.00 5.32 C ATOM 2200 C HIS A 131 8.194 3.368 18.755 1.00 3.32 C ATOM 2201 O HIS A 131 7.052 2.954 18.555 1.00 44.04 O ATOM 2202 CB HIS A 131 9.211 5.393 19.873 1.00 21.01 C ATOM 2203 CG HIS A 131 9.721 6.796 19.737 1.00 53.15 C ATOM 2204 ND1 HIS A 131 11.042 7.095 19.490 1.00 20.03 N ATOM 2205 CD2 HIS A 131 9.083 7.987 19.821 1.00 64.22 C ATOM 2206 CE1 HIS A 131 11.195 8.399 19.427 1.00 64.11 C ATOM 2207 NE2 HIS A 131 10.024 8.970 19.625 1.00 31.24 N ATOM 0 H HIS A 131 6.649 5.666 19.141 1.00 62.24 H new ATOM 0 HA HIS A 131 9.195 4.985 17.766 1.00 5.32 H new ATOM 0 HB2 HIS A 131 8.511 5.349 20.707 1.00 21.01 H new ATOM 0 HB3 HIS A 131 10.044 4.735 20.121 1.00 21.01 H new ATOM 0 HD2 HIS A 131 8.030 8.137 20.007 1.00 64.22 H new ATOM 0 HE1 HIS A 131 12.125 8.916 19.244 1.00 64.11 H new ATOM 0 HE2 HIS A 131 9.845 9.974 19.632 1.00 31.24 H new ATOM 2216 N HIS A 132 9.187 2.555 19.126 1.00 44.03 N ATOM 2217 CA HIS A 132 9.001 1.092 19.178 1.00 72.30 C ATOM 2218 C HIS A 132 8.224 0.630 20.429 1.00 35.53 C ATOM 2219 O HIS A 132 8.178 -0.564 20.730 1.00 32.23 O ATOM 2220 CB HIS A 132 10.358 0.364 19.084 1.00 64.31 C ATOM 2221 CG HIS A 132 11.329 0.655 20.199 1.00 13.22 C ATOM 2222 ND1 HIS A 132 12.650 0.985 19.976 1.00 1.22 N ATOM 2223 CD2 HIS A 132 11.183 0.628 21.548 1.00 53.44 C ATOM 2224 CE1 HIS A 132 13.268 1.145 21.128 1.00 15.22 C ATOM 2225 NE2 HIS A 132 12.403 0.937 22.098 1.00 10.30 N ATOM 0 H HIS A 132 10.118 2.874 19.393 1.00 44.03 H new ATOM 0 HA HIS A 132 8.393 0.825 18.313 1.00 72.30 H new ATOM 0 HB2 HIS A 132 10.173 -0.710 19.058 1.00 64.31 H new ATOM 0 HB3 HIS A 132 10.828 0.630 18.137 1.00 64.31 H new ATOM 0 HD2 HIS A 132 10.275 0.405 22.089 1.00 53.44 H new ATOM 0 HE1 HIS A 132 14.309 1.403 21.255 1.00 15.22 H new ATOM 0 HE2 HIS A 132 12.606 0.996 23.096 1.00 10.30 H new ATOM 2234 N HIS A 133 7.601 1.567 21.140 1.00 70.23 N ATOM 2235 CA HIS A 133 6.858 1.240 22.361 1.00 24.13 C ATOM 2236 C HIS A 133 5.412 0.817 22.050 1.00 74.01 C ATOM 2237 O HIS A 133 4.593 1.630 21.618 1.00 62.22 O ATOM 2238 CB HIS A 133 6.861 2.438 23.324 1.00 22.44 C ATOM 2239 CG HIS A 133 6.115 2.180 24.600 1.00 32.24 C ATOM 2240 ND1 HIS A 133 5.186 3.054 25.124 1.00 42.43 N ATOM 2241 CD2 HIS A 133 6.166 1.136 25.461 1.00 33.10 C ATOM 2242 CE1 HIS A 133 4.699 2.558 26.244 1.00 52.43 C ATOM 2243 NE2 HIS A 133 5.276 1.397 26.472 1.00 63.12 N ATOM 0 H HIS A 133 7.594 2.557 20.895 1.00 70.23 H new ATOM 0 HA HIS A 133 7.359 0.396 22.835 1.00 24.13 H new ATOM 0 HB2 HIS A 133 7.892 2.701 23.562 1.00 22.44 H new ATOM 0 HB3 HIS A 133 6.420 3.299 22.822 1.00 22.44 H new ATOM 0 HD2 HIS A 133 6.791 0.260 25.369 1.00 33.10 H new ATOM 0 HE1 HIS A 133 3.953 3.025 26.869 1.00 52.43 H new ATOM 0 HE2 HIS A 133 5.091 0.790 27.271 1.00 63.12 H new ATOM 2252 N HIS A 134 5.110 -0.461 22.282 1.00 1.23 N ATOM 2253 CA HIS A 134 3.757 -0.997 22.081 1.00 50.25 C ATOM 2254 C HIS A 134 3.503 -2.212 22.997 1.00 30.32 C ATOM 2255 O HIS A 134 2.847 -2.049 24.047 1.00 36.24 O ATOM 2256 CB HIS A 134 3.544 -1.383 20.607 1.00 41.23 C ATOM 2257 CG HIS A 134 2.145 -1.833 20.294 1.00 62.23 C ATOM 2258 ND1 HIS A 134 1.706 -3.122 20.497 1.00 73.44 N ATOM 2259 CD2 HIS A 134 1.082 -1.157 19.789 1.00 52.43 C ATOM 2260 CE1 HIS A 134 0.444 -3.222 20.134 1.00 44.44 C ATOM 2261 NE2 HIS A 134 0.042 -2.047 19.701 1.00 71.22 N ATOM 2262 OXT HIS A 134 3.982 -3.323 22.670 1.00 36.24 O ATOM 0 H HIS A 134 5.786 -1.150 22.611 1.00 1.23 H new ATOM 0 HA HIS A 134 3.042 -0.217 22.344 1.00 50.25 H new ATOM 0 HB2 HIS A 134 3.790 -0.527 19.978 1.00 41.23 H new ATOM 0 HB3 HIS A 134 4.239 -2.181 20.346 1.00 41.23 H new ATOM 0 HD2 HIS A 134 1.059 -0.114 19.509 1.00 52.43 H new ATOM 0 HE1 HIS A 134 -0.159 -4.117 20.183 1.00 44.44 H new ATOM 0 HE2 HIS A 134 -0.893 -1.832 19.355 1.00 71.22 H new TER 2271 HIS A 134