USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1324 hydrogens (29 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 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 201 GNP O2' : rot 160:sc= 0.0821 USER MOD Set 2.1: A 145 SER OG : rot 177:sc= 0.842 USER MOD Set 2.2: A 148 THR OG1 : rot 20:sc= 0.935 USER MOD Set 3.1: A 94 HIS : no HE2:sc= 0.52 K(o=0.76,f=-6!) USER MOD Set 3.2: A 137 TYR OH : rot 30:sc= 0.241 USER MOD Set 4.1: A 101 LYS NZ :NH3+ -152:sc=-0.00595 (180deg=0.407) USER MOD Set 4.2: A 111 MET CE :methyl -141:sc= -4.17! (180deg=-9.72!) USER MOD Set 5.1: A 87 THR OG1 : rot -30:sc= 0.478 USER MOD Set 5.2: A 124 THR OG1 : rot -67:sc= 0.925 USER MOD Set 6.1: A 85 ASN : amide:sc= -2.32! C(o=-2.1!,f=-6.6!) USER MOD Set 6.2: A 117 LYS NZ :NH3+ -151:sc= 0.175 (180deg=0) USER MOD Set 7.1: A 25 GLN : amide:sc= -0.0129 X(o=-5.1,f=-5.1) USER MOD Set 7.2: A 27 HIS : no HD1:sc= -5.08! C(o=-5.1!,f=-6.3!) USER MOD Single : A 1 MET CE :methyl 157:sc= -0.226 (180deg=-0.697) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= -0.0937 (180deg=-0.0937) USER MOD Single : A 16 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0474) USER MOD Single : A 20 THR OG1 : rot 99:sc= 1.16 USER MOD Single : A 22 GLN : amide:sc= -0.531 K(o=-0.53,f=-4.3!) USER MOD Single : A 26 ASN : amide:sc= -1.52 K(o=-1.5,f=-9.2!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0.225 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 62:sc= 1.14 USER MOD Single : A 40 TYR OH : rot 180:sc= -2.48! USER MOD Single : A 42 LYS NZ :NH3+ -159:sc= 0.102 (180deg=0.00823) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 50 THR OG1 : rot 180:sc=-0.00366 USER MOD Single : A 51 CYS SG : rot 15:sc= -0.785 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.088 X(o=-0.088,f=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 176:sc= -7.35! (180deg=-7.44!) USER MOD Single : A 70 GLN : amide:sc= -0.134 K(o=-0.13,f=-0.85) USER MOD Single : A 71 TYR OH : rot -9:sc= 0.0794 USER MOD Single : A 72 MET CE :methyl -158:sc= -0.587 (180deg=-1.12) USER MOD Single : A 74 THR OG1 : rot 81:sc= -2.27! USER MOD Single : A 80 CYS SG : rot 100:sc= -0.725 USER MOD Single : A 86 ASN : amide:sc= -0.234 K(o=-0.23,f=-1.4!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -76:sc= -0.917 USER MOD Single : A 95 GLN : amide:sc= -1.49 K(o=-1.5,f=-3.2!) USER MOD Single : A 96 TYR OH : rot 130:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -0.245 X(o=-0.24,f=-0.48) USER MOD Single : A 104 LYS NZ :NH3+ -175:sc= -0.666 (180deg=-0.7) USER MOD Single : A 106 SER OG : rot 54:sc= 0.716 USER MOD Single : A 116 ASN : amide:sc=-0.00173 K(o=-0.0017,f=-13!) USER MOD Single : A 118 CYS SG : rot -43:sc= -0.192 USER MOD Single : A 127 SER OG : rot 180:sc= -0.0529 USER MOD Single : A 129 GLN : amide:sc=-0.00229 X(o=-0.0023,f=-0.13) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 115:sc= 1.21 USER MOD Single : A 158 THR OG1 : rot 81:sc= 0.099 USER MOD Single : A 165 GLN : amide:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.14) USER MOD Single : A 201 GNP O3' : rot 141:sc= 0.0869 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.920 -4.120 22.244 1.00 33.45 N ATOM 2 CA MET A 1 -3.998 -3.956 21.089 1.00 50.23 C ATOM 3 C MET A 1 -4.044 -5.171 20.167 1.00 21.11 C ATOM 4 O MET A 1 -4.034 -6.313 20.624 1.00 2.12 O ATOM 5 CB MET A 1 -2.580 -3.753 21.624 1.00 14.45 C ATOM 6 CG MET A 1 -1.650 -3.066 20.637 1.00 2.52 C ATOM 7 SD MET A 1 -1.462 -1.304 20.971 1.00 14.23 S ATOM 8 CE MET A 1 -0.620 -1.346 22.551 1.00 70.12 C ATOM 0 H1 MET A 1 -4.867 -3.279 22.853 1.00 33.45 H new ATOM 0 H2 MET A 1 -5.894 -4.236 21.897 1.00 33.45 H new ATOM 0 H3 MET A 1 -4.645 -4.961 22.791 1.00 33.45 H new ATOM 0 HA MET A 1 -4.308 -3.090 20.504 1.00 50.23 H new ATOM 0 HB2 MET A 1 -2.627 -3.162 22.538 1.00 14.45 H new ATOM 0 HB3 MET A 1 -2.160 -4.722 21.892 1.00 14.45 H new ATOM 0 HG2 MET A 1 -0.671 -3.545 20.672 1.00 2.52 H new ATOM 0 HG3 MET A 1 -2.035 -3.201 19.626 1.00 2.52 H new ATOM 0 HE1 MET A 1 -0.080 -0.411 22.701 1.00 70.12 H new ATOM 0 HE2 MET A 1 -1.351 -1.475 23.349 1.00 70.12 H new ATOM 0 HE3 MET A 1 0.084 -2.178 22.566 1.00 70.12 H new ATOM 18 N THR A 2 -4.095 -4.912 18.864 1.00 31.02 N ATOM 19 CA THR A 2 -4.144 -5.975 17.870 1.00 23.12 C ATOM 20 C THR A 2 -3.142 -5.704 16.748 1.00 4.24 C ATOM 21 O THR A 2 -2.845 -4.552 16.433 1.00 44.44 O ATOM 22 CB THR A 2 -5.568 -6.100 17.311 1.00 42.42 C ATOM 23 OG1 THR A 2 -6.272 -7.138 17.970 1.00 63.30 O ATOM 24 CG2 THR A 2 -5.625 -6.387 15.825 1.00 72.11 C ATOM 0 H THR A 2 -4.103 -3.970 18.472 1.00 31.02 H new ATOM 0 HA THR A 2 -3.872 -6.918 18.344 1.00 23.12 H new ATOM 0 HB THR A 2 -6.024 -5.126 17.487 1.00 42.42 H new ATOM 0 HG1 THR A 2 -7.178 -7.203 17.603 1.00 63.30 H new ATOM 0 HG21 THR A 2 -6.665 -6.461 15.508 1.00 72.11 H new ATOM 0 HG22 THR A 2 -5.136 -5.580 15.280 1.00 72.11 H new ATOM 0 HG23 THR A 2 -5.115 -7.327 15.616 1.00 72.11 H new ATOM 32 N GLU A 3 -2.628 -6.773 16.149 1.00 24.32 N ATOM 33 CA GLU A 3 -1.662 -6.649 15.064 1.00 62.15 C ATOM 34 C GLU A 3 -2.362 -6.666 13.708 1.00 23.54 C ATOM 35 O GLU A 3 -3.043 -7.631 13.362 1.00 34.14 O ATOM 36 CB GLU A 3 -0.634 -7.780 15.136 1.00 64.24 C ATOM 37 CG GLU A 3 0.562 -7.459 16.017 1.00 71.24 C ATOM 38 CD GLU A 3 1.106 -8.681 16.731 1.00 62.04 C ATOM 39 OE1 GLU A 3 0.382 -9.244 17.579 1.00 55.31 O ATOM 40 OE2 GLU A 3 2.256 -9.075 16.444 1.00 4.42 O ATOM 0 H GLU A 3 -2.864 -7.734 16.396 1.00 24.32 H new ATOM 0 HA GLU A 3 -1.148 -5.694 15.175 1.00 62.15 H new ATOM 0 HB2 GLU A 3 -1.121 -8.679 15.513 1.00 64.24 H new ATOM 0 HB3 GLU A 3 -0.283 -8.006 14.129 1.00 64.24 H new ATOM 0 HG2 GLU A 3 1.350 -7.019 15.406 1.00 71.24 H new ATOM 0 HG3 GLU A 3 0.274 -6.710 16.755 1.00 71.24 H new ATOM 47 N TYR A 4 -2.190 -5.590 12.946 1.00 13.35 N ATOM 48 CA TYR A 4 -2.805 -5.480 11.628 1.00 61.30 C ATOM 49 C TYR A 4 -1.760 -5.604 10.527 1.00 23.11 C ATOM 50 O TYR A 4 -0.882 -4.751 10.392 1.00 0.03 O ATOM 51 CB TYR A 4 -3.544 -4.147 11.494 1.00 71.14 C ATOM 52 CG TYR A 4 -4.832 -4.087 12.282 1.00 62.41 C ATOM 53 CD1 TYR A 4 -5.864 -4.983 12.032 1.00 43.52 C ATOM 54 CD2 TYR A 4 -5.015 -3.135 13.276 1.00 54.54 C ATOM 55 CE1 TYR A 4 -7.043 -4.931 12.751 1.00 12.12 C ATOM 56 CE2 TYR A 4 -6.191 -3.077 14.000 1.00 10.14 C ATOM 57 CZ TYR A 4 -7.201 -3.976 13.734 1.00 0.31 C ATOM 58 OH TYR A 4 -8.373 -3.922 14.452 1.00 22.11 O ATOM 0 H TYR A 4 -1.630 -4.782 13.219 1.00 13.35 H new ATOM 0 HA TYR A 4 -3.519 -6.297 11.522 1.00 61.30 H new ATOM 0 HB2 TYR A 4 -2.887 -3.342 11.825 1.00 71.14 H new ATOM 0 HB3 TYR A 4 -3.763 -3.967 10.442 1.00 71.14 H new ATOM 0 HD1 TYR A 4 -5.743 -5.732 11.263 1.00 43.52 H new ATOM 0 HD2 TYR A 4 -4.226 -2.428 13.487 1.00 54.54 H new ATOM 0 HE1 TYR A 4 -7.836 -5.634 12.545 1.00 12.12 H new ATOM 0 HE2 TYR A 4 -6.318 -2.331 14.770 1.00 10.14 H new ATOM 0 HH TYR A 4 -8.323 -3.194 15.106 1.00 22.11 H new ATOM 68 N LYS A 5 -1.861 -6.669 9.740 1.00 43.52 N ATOM 69 CA LYS A 5 -0.925 -6.902 8.650 1.00 31.44 C ATOM 70 C LYS A 5 -1.397 -6.219 7.371 1.00 63.12 C ATOM 71 O LYS A 5 -2.259 -6.736 6.661 1.00 60.52 O ATOM 72 CB LYS A 5 -0.757 -8.401 8.404 1.00 64.43 C ATOM 73 CG LYS A 5 0.416 -9.012 9.151 1.00 61.23 C ATOM 74 CD LYS A 5 1.521 -9.428 8.195 1.00 63.21 C ATOM 75 CE LYS A 5 2.216 -10.695 8.659 1.00 14.51 C ATOM 76 NZ LYS A 5 3.699 -10.574 8.584 1.00 15.13 N ATOM 0 H LYS A 5 -2.582 -7.384 9.837 1.00 43.52 H new ATOM 0 HA LYS A 5 0.037 -6.476 8.936 1.00 31.44 H new ATOM 0 HB2 LYS A 5 -1.672 -8.914 8.700 1.00 64.43 H new ATOM 0 HB3 LYS A 5 -0.626 -8.573 7.336 1.00 64.43 H new ATOM 0 HG2 LYS A 5 0.806 -8.293 9.871 1.00 61.23 H new ATOM 0 HG3 LYS A 5 0.077 -9.879 9.718 1.00 61.23 H new ATOM 0 HD2 LYS A 5 1.102 -9.586 7.201 1.00 63.21 H new ATOM 0 HD3 LYS A 5 2.251 -8.623 8.110 1.00 63.21 H new ATOM 0 HE2 LYS A 5 1.921 -10.916 9.685 1.00 14.51 H new ATOM 0 HE3 LYS A 5 1.889 -11.534 8.045 1.00 14.51 H new ATOM 0 HZ1 LYS A 5 4.136 -11.460 8.909 1.00 15.13 H new ATOM 0 HZ2 LYS A 5 3.983 -10.388 7.601 1.00 15.13 H new ATOM 0 HZ3 LYS A 5 4.014 -9.789 9.189 1.00 15.13 H new ATOM 90 N LEU A 6 -0.826 -5.055 7.082 1.00 62.25 N ATOM 91 CA LEU A 6 -1.188 -4.306 5.887 1.00 42.24 C ATOM 92 C LEU A 6 -0.343 -4.744 4.697 1.00 21.43 C ATOM 93 O LEU A 6 0.865 -4.511 4.662 1.00 1.43 O ATOM 94 CB LEU A 6 -1.014 -2.805 6.125 1.00 43.15 C ATOM 95 CG LEU A 6 -1.461 -2.311 7.502 1.00 72.41 C ATOM 96 CD1 LEU A 6 -1.375 -0.795 7.576 1.00 41.42 C ATOM 97 CD2 LEU A 6 -2.876 -2.784 7.803 1.00 25.01 C ATOM 0 H LEU A 6 -0.112 -4.611 7.659 1.00 62.25 H new ATOM 0 HA LEU A 6 -2.235 -4.511 5.664 1.00 42.24 H new ATOM 0 HB2 LEU A 6 0.037 -2.551 5.988 1.00 43.15 H new ATOM 0 HB3 LEU A 6 -1.575 -2.264 5.362 1.00 43.15 H new ATOM 0 HG LEU A 6 -0.792 -2.729 8.254 1.00 72.41 H new ATOM 0 HD11 LEU A 6 -1.697 -0.460 8.562 1.00 41.42 H new ATOM 0 HD12 LEU A 6 -0.346 -0.480 7.404 1.00 41.42 H new ATOM 0 HD13 LEU A 6 -2.021 -0.356 6.815 1.00 41.42 H new ATOM 0 HD21 LEU A 6 -3.179 -2.424 8.786 1.00 25.01 H new ATOM 0 HD22 LEU A 6 -3.558 -2.394 7.048 1.00 25.01 H new ATOM 0 HD23 LEU A 6 -2.906 -3.874 7.791 1.00 25.01 H new ATOM 109 N VAL A 7 -0.985 -5.381 3.725 1.00 44.54 N ATOM 110 CA VAL A 7 -0.291 -5.851 2.536 1.00 44.45 C ATOM 111 C VAL A 7 -0.079 -4.713 1.544 1.00 14.21 C ATOM 112 O VAL A 7 -1.000 -4.320 0.828 1.00 71.22 O ATOM 113 CB VAL A 7 -1.077 -6.982 1.846 1.00 33.43 C ATOM 114 CG1 VAL A 7 -0.285 -7.551 0.681 1.00 24.23 C ATOM 115 CG2 VAL A 7 -1.428 -8.074 2.846 1.00 0.54 C ATOM 0 H VAL A 7 -1.985 -5.583 3.738 1.00 44.54 H new ATOM 0 HA VAL A 7 0.678 -6.234 2.857 1.00 44.45 H new ATOM 0 HB VAL A 7 -2.005 -6.567 1.454 1.00 33.43 H new ATOM 0 HG11 VAL A 7 -0.857 -8.348 0.207 1.00 24.23 H new ATOM 0 HG12 VAL A 7 -0.090 -6.763 -0.046 1.00 24.23 H new ATOM 0 HG13 VAL A 7 0.661 -7.951 1.045 1.00 24.23 H new ATOM 0 HG21 VAL A 7 -1.983 -8.865 2.341 1.00 0.54 H new ATOM 0 HG22 VAL A 7 -0.513 -8.487 3.270 1.00 0.54 H new ATOM 0 HG23 VAL A 7 -2.040 -7.654 3.644 1.00 0.54 H new ATOM 125 N VAL A 8 1.141 -4.187 1.508 1.00 53.52 N ATOM 126 CA VAL A 8 1.475 -3.094 0.607 1.00 61.02 C ATOM 127 C VAL A 8 1.838 -3.620 -0.779 1.00 30.23 C ATOM 128 O VAL A 8 2.555 -4.612 -0.910 1.00 73.03 O ATOM 129 CB VAL A 8 2.644 -2.255 1.158 1.00 14.20 C ATOM 130 CG1 VAL A 8 2.996 -1.126 0.202 1.00 54.45 C ATOM 131 CG2 VAL A 8 2.302 -1.706 2.535 1.00 31.02 C ATOM 0 H VAL A 8 1.914 -4.502 2.094 1.00 53.52 H new ATOM 0 HA VAL A 8 0.592 -2.460 0.528 1.00 61.02 H new ATOM 0 HB VAL A 8 3.516 -2.903 1.252 1.00 14.20 H new ATOM 0 HG11 VAL A 8 3.824 -0.547 0.612 1.00 54.45 H new ATOM 0 HG12 VAL A 8 3.287 -1.543 -0.762 1.00 54.45 H new ATOM 0 HG13 VAL A 8 2.130 -0.477 0.070 1.00 54.45 H new ATOM 0 HG21 VAL A 8 3.138 -1.116 2.909 1.00 31.02 H new ATOM 0 HG22 VAL A 8 1.416 -1.076 2.465 1.00 31.02 H new ATOM 0 HG23 VAL A 8 2.107 -2.533 3.218 1.00 31.02 H new ATOM 141 N VAL A 9 1.338 -2.946 -1.809 1.00 11.15 N ATOM 142 CA VAL A 9 1.609 -3.341 -3.186 1.00 70.10 C ATOM 143 C VAL A 9 1.641 -2.125 -4.107 1.00 31.54 C ATOM 144 O VAL A 9 0.997 -1.113 -3.836 1.00 31.13 O ATOM 145 CB VAL A 9 0.553 -4.337 -3.706 1.00 1.25 C ATOM 146 CG1 VAL A 9 0.569 -5.615 -2.883 1.00 32.23 C ATOM 147 CG2 VAL A 9 -0.832 -3.706 -3.695 1.00 1.05 C ATOM 0 H VAL A 9 0.743 -2.123 -1.716 1.00 11.15 H new ATOM 0 HA VAL A 9 2.585 -3.826 -3.190 1.00 70.10 H new ATOM 0 HB VAL A 9 0.802 -4.593 -4.736 1.00 1.25 H new ATOM 0 HG11 VAL A 9 -0.183 -6.304 -3.266 1.00 32.23 H new ATOM 0 HG12 VAL A 9 1.553 -6.079 -2.950 1.00 32.23 H new ATOM 0 HG13 VAL A 9 0.349 -5.380 -1.842 1.00 32.23 H new ATOM 0 HG21 VAL A 9 -1.562 -4.425 -4.066 1.00 1.05 H new ATOM 0 HG22 VAL A 9 -1.092 -3.417 -2.677 1.00 1.05 H new ATOM 0 HG23 VAL A 9 -0.835 -2.824 -4.335 1.00 1.05 H new ATOM 157 N GLY A 10 2.394 -2.233 -5.196 1.00 20.03 N ATOM 158 CA GLY A 10 2.493 -1.133 -6.137 1.00 45.53 C ATOM 159 C GLY A 10 2.977 -1.577 -7.503 1.00 4.42 C ATOM 160 O GLY A 10 2.211 -1.584 -8.467 1.00 30.42 O ATOM 0 H GLY A 10 2.936 -3.061 -5.444 1.00 20.03 H new ATOM 0 HA2 GLY A 10 1.518 -0.657 -6.238 1.00 45.53 H new ATOM 0 HA3 GLY A 10 3.175 -0.381 -5.741 1.00 45.53 H new ATOM 164 N ALA A 11 4.252 -1.947 -7.588 1.00 52.41 N ATOM 165 CA ALA A 11 4.837 -2.394 -8.849 1.00 62.11 C ATOM 166 C ALA A 11 6.326 -2.685 -8.698 1.00 4.54 C ATOM 167 O ALA A 11 6.851 -3.612 -9.316 1.00 30.34 O ATOM 168 CB ALA A 11 4.612 -1.352 -9.937 1.00 74.14 C ATOM 0 H ALA A 11 4.899 -1.946 -6.800 1.00 52.41 H new ATOM 0 HA ALA A 11 4.341 -3.321 -9.137 1.00 62.11 H new ATOM 0 HB1 ALA A 11 5.054 -1.700 -10.871 1.00 74.14 H new ATOM 0 HB2 ALA A 11 3.542 -1.197 -10.077 1.00 74.14 H new ATOM 0 HB3 ALA A 11 5.079 -0.412 -9.643 1.00 74.14 H new ATOM 174 N GLY A 12 7.004 -1.889 -7.879 1.00 62.42 N ATOM 175 CA GLY A 12 8.426 -2.078 -7.669 1.00 42.21 C ATOM 176 C GLY A 12 9.228 -0.846 -8.038 1.00 43.53 C ATOM 177 O GLY A 12 10.163 -0.920 -8.835 1.00 32.40 O ATOM 0 H GLY A 12 6.593 -1.115 -7.356 1.00 62.42 H new ATOM 0 HA2 GLY A 12 8.607 -2.328 -6.624 1.00 42.21 H new ATOM 0 HA3 GLY A 12 8.770 -2.925 -8.263 1.00 42.21 H new ATOM 181 N GLY A 13 8.859 0.291 -7.457 1.00 21.01 N ATOM 182 CA GLY A 13 9.556 1.532 -7.741 1.00 32.31 C ATOM 183 C GLY A 13 8.677 2.753 -7.544 1.00 21.04 C ATOM 184 O GLY A 13 9.178 3.856 -7.328 1.00 34.20 O ATOM 0 H GLY A 13 8.089 0.375 -6.794 1.00 21.01 H new ATOM 0 HA2 GLY A 13 10.430 1.610 -7.094 1.00 32.31 H new ATOM 0 HA3 GLY A 13 9.920 1.513 -8.768 1.00 32.31 H new ATOM 188 N VAL A 14 7.361 2.557 -7.616 1.00 51.34 N ATOM 189 CA VAL A 14 6.410 3.651 -7.443 1.00 72.12 C ATOM 190 C VAL A 14 6.705 4.452 -6.177 1.00 31.03 C ATOM 191 O VAL A 14 6.372 5.634 -6.088 1.00 54.44 O ATOM 192 CB VAL A 14 4.960 3.131 -7.380 1.00 24.53 C ATOM 193 CG1 VAL A 14 4.579 2.446 -8.683 1.00 12.32 C ATOM 194 CG2 VAL A 14 4.780 2.185 -6.201 1.00 65.35 C ATOM 0 H VAL A 14 6.930 1.650 -7.793 1.00 51.34 H new ATOM 0 HA VAL A 14 6.521 4.300 -8.311 1.00 72.12 H new ATOM 0 HB VAL A 14 4.296 3.984 -7.237 1.00 24.53 H new ATOM 0 HG11 VAL A 14 3.552 2.086 -8.618 1.00 12.32 H new ATOM 0 HG12 VAL A 14 4.663 3.156 -9.506 1.00 12.32 H new ATOM 0 HG13 VAL A 14 5.248 1.604 -8.861 1.00 12.32 H new ATOM 0 HG21 VAL A 14 3.750 1.829 -6.174 1.00 65.35 H new ATOM 0 HG22 VAL A 14 5.455 1.336 -6.310 1.00 65.35 H new ATOM 0 HG23 VAL A 14 5.006 2.712 -5.274 1.00 65.35 H new ATOM 204 N GLY A 15 7.334 3.802 -5.203 1.00 60.33 N ATOM 205 CA GLY A 15 7.664 4.471 -3.958 1.00 62.22 C ATOM 206 C GLY A 15 6.923 3.891 -2.767 1.00 22.14 C ATOM 207 O GLY A 15 6.766 4.558 -1.744 1.00 3.43 O ATOM 0 H GLY A 15 7.621 2.824 -5.254 1.00 60.33 H new ATOM 0 HA2 GLY A 15 8.737 4.397 -3.784 1.00 62.22 H new ATOM 0 HA3 GLY A 15 7.428 5.531 -4.046 1.00 62.22 H new ATOM 211 N LYS A 16 6.469 2.648 -2.896 1.00 51.01 N ATOM 212 CA LYS A 16 5.746 1.983 -1.819 1.00 43.21 C ATOM 213 C LYS A 16 6.617 1.873 -0.573 1.00 31.23 C ATOM 214 O LYS A 16 6.140 2.044 0.549 1.00 15.23 O ATOM 215 CB LYS A 16 5.293 0.591 -2.263 1.00 51.51 C ATOM 216 CG LYS A 16 6.436 -0.308 -2.706 1.00 75.40 C ATOM 217 CD LYS A 16 5.999 -1.271 -3.799 1.00 52.35 C ATOM 218 CE LYS A 16 6.496 -2.683 -3.532 1.00 62.15 C ATOM 219 NZ LYS A 16 5.437 -3.542 -2.935 1.00 31.13 N ATOM 0 H LYS A 16 6.589 2.082 -3.736 1.00 51.01 H new ATOM 0 HA LYS A 16 4.868 2.582 -1.578 1.00 43.21 H new ATOM 0 HB2 LYS A 16 4.762 0.111 -1.441 1.00 51.51 H new ATOM 0 HB3 LYS A 16 4.583 0.694 -3.084 1.00 51.51 H new ATOM 0 HG2 LYS A 16 7.262 0.304 -3.068 1.00 75.40 H new ATOM 0 HG3 LYS A 16 6.809 -0.872 -1.851 1.00 75.40 H new ATOM 0 HD2 LYS A 16 4.911 -1.274 -3.868 1.00 52.35 H new ATOM 0 HD3 LYS A 16 6.378 -0.927 -4.761 1.00 52.35 H new ATOM 0 HE2 LYS A 16 6.841 -3.129 -4.465 1.00 62.15 H new ATOM 0 HE3 LYS A 16 7.354 -2.645 -2.860 1.00 62.15 H new ATOM 0 HZ1 LYS A 16 5.857 -4.437 -2.613 1.00 31.13 H new ATOM 0 HZ2 LYS A 16 5.007 -3.051 -2.126 1.00 31.13 H new ATOM 0 HZ3 LYS A 16 4.707 -3.739 -3.649 1.00 31.13 H new ATOM 233 N SER A 17 7.897 1.586 -0.781 1.00 55.25 N ATOM 234 CA SER A 17 8.841 1.453 0.322 1.00 40.04 C ATOM 235 C SER A 17 9.016 2.783 1.049 1.00 75.51 C ATOM 236 O SER A 17 9.140 2.822 2.273 1.00 32.24 O ATOM 237 CB SER A 17 10.195 0.960 -0.197 1.00 62.12 C ATOM 238 OG SER A 17 10.088 0.464 -1.522 1.00 34.35 O ATOM 0 H SER A 17 8.305 1.441 -1.704 1.00 55.25 H new ATOM 0 HA SER A 17 8.441 0.724 1.026 1.00 40.04 H new ATOM 0 HB2 SER A 17 10.917 1.776 -0.169 1.00 62.12 H new ATOM 0 HB3 SER A 17 10.575 0.176 0.458 1.00 62.12 H new ATOM 244 N ALA A 18 9.029 3.869 0.283 1.00 14.23 N ATOM 245 CA ALA A 18 9.192 5.203 0.847 1.00 31.50 C ATOM 246 C ALA A 18 8.085 5.523 1.846 1.00 2.33 C ATOM 247 O ALA A 18 8.350 5.787 3.018 1.00 31.23 O ATOM 248 CB ALA A 18 9.219 6.242 -0.264 1.00 21.31 C ATOM 0 H ALA A 18 8.928 3.851 -0.732 1.00 14.23 H new ATOM 0 HA ALA A 18 10.141 5.229 1.382 1.00 31.50 H new ATOM 0 HB1 ALA A 18 9.341 7.235 0.169 1.00 21.31 H new ATOM 0 HB2 ALA A 18 10.052 6.034 -0.936 1.00 21.31 H new ATOM 0 HB3 ALA A 18 8.284 6.202 -0.822 1.00 21.31 H new ATOM 254 N LEU A 19 6.843 5.500 1.373 1.00 21.02 N ATOM 255 CA LEU A 19 5.694 5.791 2.224 1.00 72.40 C ATOM 256 C LEU A 19 5.646 4.847 3.422 1.00 40.20 C ATOM 257 O LEU A 19 5.145 5.206 4.488 1.00 62.41 O ATOM 258 CB LEU A 19 4.398 5.681 1.419 1.00 4.00 C ATOM 259 CG LEU A 19 4.253 6.698 0.286 1.00 13.54 C ATOM 260 CD1 LEU A 19 3.137 6.286 -0.661 1.00 32.14 C ATOM 261 CD2 LEU A 19 3.991 8.088 0.848 1.00 10.02 C ATOM 0 H LEU A 19 6.606 5.283 0.405 1.00 21.02 H new ATOM 0 HA LEU A 19 5.799 6.810 2.596 1.00 72.40 H new ATOM 0 HB2 LEU A 19 4.334 4.678 0.997 1.00 4.00 H new ATOM 0 HB3 LEU A 19 3.554 5.795 2.100 1.00 4.00 H new ATOM 0 HG LEU A 19 5.187 6.724 -0.275 1.00 13.54 H new ATOM 0 HD11 LEU A 19 3.048 7.021 -1.461 1.00 32.14 H new ATOM 0 HD12 LEU A 19 3.365 5.310 -1.089 1.00 32.14 H new ATOM 0 HD13 LEU A 19 2.196 6.231 -0.113 1.00 32.14 H new ATOM 0 HD21 LEU A 19 3.890 8.799 0.028 1.00 10.02 H new ATOM 0 HD22 LEU A 19 3.071 8.077 1.433 1.00 10.02 H new ATOM 0 HD23 LEU A 19 4.823 8.385 1.486 1.00 10.02 H new ATOM 273 N THR A 20 6.169 3.639 3.240 1.00 43.23 N ATOM 274 CA THR A 20 6.185 2.645 4.306 1.00 21.11 C ATOM 275 C THR A 20 7.031 3.123 5.483 1.00 34.44 C ATOM 276 O THR A 20 6.620 3.018 6.638 1.00 24.01 O ATOM 277 CB THR A 20 6.723 1.313 3.780 1.00 14.02 C ATOM 278 OG1 THR A 20 5.927 0.839 2.709 1.00 1.13 O ATOM 279 CG2 THR A 20 6.769 0.225 4.832 1.00 43.12 C ATOM 0 H THR A 20 6.587 3.325 2.364 1.00 43.23 H new ATOM 0 HA THR A 20 5.162 2.503 4.654 1.00 21.11 H new ATOM 0 HB THR A 20 7.742 1.524 3.454 1.00 14.02 H new ATOM 0 HG1 THR A 20 6.361 1.056 1.858 1.00 1.13 H new ATOM 0 HG21 THR A 20 7.160 -0.692 4.391 1.00 43.12 H new ATOM 0 HG22 THR A 20 7.416 0.538 5.651 1.00 43.12 H new ATOM 0 HG23 THR A 20 5.764 0.044 5.212 1.00 43.12 H new ATOM 287 N ILE A 21 8.214 3.648 5.181 1.00 62.33 N ATOM 288 CA ILE A 21 9.117 4.142 6.214 1.00 71.22 C ATOM 289 C ILE A 21 8.592 5.433 6.833 1.00 51.42 C ATOM 290 O ILE A 21 8.792 5.690 8.020 1.00 32.02 O ATOM 291 CB ILE A 21 10.532 4.389 5.650 1.00 32.43 C ATOM 292 CG1 ILE A 21 11.074 3.121 4.992 1.00 4.43 C ATOM 293 CG2 ILE A 21 11.472 4.857 6.749 1.00 11.54 C ATOM 294 CD1 ILE A 21 11.058 1.911 5.901 1.00 23.23 C ATOM 0 H ILE A 21 8.570 3.742 4.230 1.00 62.33 H new ATOM 0 HA ILE A 21 9.171 3.372 6.984 1.00 71.22 H new ATOM 0 HB ILE A 21 10.467 5.172 4.895 1.00 32.43 H new ATOM 0 HG12 ILE A 21 10.484 2.904 4.101 1.00 4.43 H new ATOM 0 HG13 ILE A 21 12.096 3.302 4.661 1.00 4.43 H new ATOM 0 HG21 ILE A 21 12.465 5.026 6.331 1.00 11.54 H new ATOM 0 HG22 ILE A 21 11.096 5.786 7.178 1.00 11.54 H new ATOM 0 HG23 ILE A 21 11.530 4.095 7.527 1.00 11.54 H new ATOM 0 HD11 ILE A 21 11.457 1.049 5.366 1.00 23.23 H new ATOM 0 HD12 ILE A 21 11.671 2.108 6.780 1.00 23.23 H new ATOM 0 HD13 ILE A 21 10.034 1.703 6.212 1.00 23.23 H new ATOM 306 N GLN A 22 7.921 6.245 6.022 1.00 51.02 N ATOM 307 CA GLN A 22 7.369 7.510 6.494 1.00 54.11 C ATOM 308 C GLN A 22 6.396 7.285 7.647 1.00 64.43 C ATOM 309 O GLN A 22 6.399 8.027 8.629 1.00 62.54 O ATOM 310 CB GLN A 22 6.662 8.240 5.350 1.00 71.13 C ATOM 311 CG GLN A 22 7.591 8.637 4.214 1.00 64.11 C ATOM 312 CD GLN A 22 8.207 10.007 4.417 1.00 11.23 C ATOM 313 OE1 GLN A 22 7.752 10.789 5.252 1.00 42.43 O ATOM 314 NE2 GLN A 22 9.250 10.305 3.651 1.00 2.43 N ATOM 0 H GLN A 22 7.747 6.050 5.036 1.00 51.02 H new ATOM 0 HA GLN A 22 8.194 8.125 6.854 1.00 54.11 H new ATOM 0 HB2 GLN A 22 5.872 7.601 4.956 1.00 71.13 H new ATOM 0 HB3 GLN A 22 6.181 9.135 5.744 1.00 71.13 H new ATOM 0 HG2 GLN A 22 8.385 7.896 4.123 1.00 64.11 H new ATOM 0 HG3 GLN A 22 7.036 8.627 3.276 1.00 64.11 H new ATOM 0 HE21 GLN A 22 9.594 9.627 2.972 1.00 2.43 H new ATOM 0 HE22 GLN A 22 9.707 11.212 3.742 1.00 2.43 H new ATOM 323 N LEU A 23 5.564 6.256 7.520 1.00 52.53 N ATOM 324 CA LEU A 23 4.585 5.933 8.550 1.00 13.23 C ATOM 325 C LEU A 23 5.267 5.410 9.810 1.00 62.35 C ATOM 326 O LEU A 23 4.784 5.621 10.922 1.00 70.12 O ATOM 327 CB LEU A 23 3.590 4.895 8.028 1.00 61.40 C ATOM 328 CG LEU A 23 2.167 5.033 8.569 1.00 25.51 C ATOM 329 CD1 LEU A 23 2.126 4.710 10.054 1.00 21.44 C ATOM 330 CD2 LEU A 23 1.635 6.435 8.310 1.00 13.00 C ATOM 0 H LEU A 23 5.549 5.632 6.713 1.00 52.53 H new ATOM 0 HA LEU A 23 4.049 6.848 8.804 1.00 13.23 H new ATOM 0 HB2 LEU A 23 3.557 4.961 6.940 1.00 61.40 H new ATOM 0 HB3 LEU A 23 3.962 3.901 8.276 1.00 61.40 H new ATOM 0 HG LEU A 23 1.528 4.320 8.047 1.00 25.51 H new ATOM 0 HD11 LEU A 23 1.105 4.814 10.421 1.00 21.44 H new ATOM 0 HD12 LEU A 23 2.467 3.687 10.213 1.00 21.44 H new ATOM 0 HD13 LEU A 23 2.777 5.397 10.594 1.00 21.44 H new ATOM 0 HD21 LEU A 23 0.621 6.517 8.701 1.00 13.00 H new ATOM 0 HD22 LEU A 23 2.275 7.165 8.806 1.00 13.00 H new ATOM 0 HD23 LEU A 23 1.627 6.629 7.237 1.00 13.00 H new ATOM 342 N ILE A 24 6.389 4.721 9.628 1.00 25.43 N ATOM 343 CA ILE A 24 7.132 4.164 10.752 1.00 20.31 C ATOM 344 C ILE A 24 8.033 5.212 11.399 1.00 44.43 C ATOM 345 O ILE A 24 7.785 5.644 12.524 1.00 43.03 O ATOM 346 CB ILE A 24 7.986 2.956 10.318 1.00 22.02 C ATOM 347 CG1 ILE A 24 7.119 1.931 9.587 1.00 35.44 C ATOM 348 CG2 ILE A 24 8.658 2.319 11.525 1.00 61.14 C ATOM 349 CD1 ILE A 24 6.105 1.255 10.484 1.00 34.12 C ATOM 0 H ILE A 24 6.803 4.535 8.714 1.00 25.43 H new ATOM 0 HA ILE A 24 6.394 3.832 11.483 1.00 20.31 H new ATOM 0 HB ILE A 24 8.762 3.305 9.637 1.00 22.02 H new ATOM 0 HG12 ILE A 24 6.597 2.426 8.768 1.00 35.44 H new ATOM 0 HG13 ILE A 24 7.763 1.172 9.142 1.00 35.44 H new ATOM 0 HG21 ILE A 24 9.257 1.468 11.201 1.00 61.14 H new ATOM 0 HG22 ILE A 24 9.302 3.052 12.012 1.00 61.14 H new ATOM 0 HG23 ILE A 24 7.897 1.981 12.228 1.00 61.14 H new ATOM 0 HD11 ILE A 24 5.524 0.540 9.902 1.00 34.12 H new ATOM 0 HD12 ILE A 24 6.622 0.732 11.289 1.00 34.12 H new ATOM 0 HD13 ILE A 24 5.438 2.005 10.909 1.00 34.12 H new ATOM 361 N GLN A 25 9.081 5.615 10.686 1.00 44.13 N ATOM 362 CA GLN A 25 10.012 6.609 11.205 1.00 11.24 C ATOM 363 C GLN A 25 9.632 8.016 10.730 1.00 42.34 C ATOM 364 O GLN A 25 8.760 8.652 11.321 1.00 62.15 O ATOM 365 CB GLN A 25 11.447 6.255 10.798 1.00 23.54 C ATOM 366 CG GLN A 25 11.962 4.978 11.442 1.00 14.01 C ATOM 367 CD GLN A 25 13.265 4.501 10.830 1.00 12.43 C ATOM 368 OE1 GLN A 25 14.349 4.849 11.298 1.00 22.13 O ATOM 369 NE2 GLN A 25 13.164 3.700 9.775 1.00 33.43 N ATOM 0 H GLN A 25 9.305 5.270 9.753 1.00 44.13 H new ATOM 0 HA GLN A 25 9.954 6.603 12.293 1.00 11.24 H new ATOM 0 HB2 GLN A 25 11.494 6.150 9.714 1.00 23.54 H new ATOM 0 HB3 GLN A 25 12.107 7.080 11.067 1.00 23.54 H new ATOM 0 HG2 GLN A 25 12.106 5.146 12.509 1.00 14.01 H new ATOM 0 HG3 GLN A 25 11.210 4.196 11.341 1.00 14.01 H new ATOM 0 HE21 GLN A 25 12.244 3.437 9.420 1.00 33.43 H new ATOM 0 HE22 GLN A 25 14.006 3.348 9.320 1.00 33.43 H new ATOM 378 N ASN A 26 10.281 8.498 9.664 1.00 2.43 N ATOM 379 CA ASN A 26 10.002 9.828 9.120 1.00 42.24 C ATOM 380 C ASN A 26 11.134 10.282 8.203 1.00 65.42 C ATOM 381 O ASN A 26 11.892 11.192 8.540 1.00 33.32 O ATOM 382 CB ASN A 26 9.806 10.851 10.247 1.00 12.13 C ATOM 383 CG ASN A 26 8.348 11.209 10.456 1.00 41.04 C ATOM 384 OD1 ASN A 26 7.609 11.438 9.498 1.00 22.33 O ATOM 385 ND2 ASN A 26 7.926 11.259 11.714 1.00 13.52 N ATOM 0 H ASN A 26 11.004 7.984 9.161 1.00 2.43 H new ATOM 0 HA ASN A 26 9.080 9.764 8.542 1.00 42.24 H new ATOM 0 HB2 ASN A 26 10.215 10.449 11.174 1.00 12.13 H new ATOM 0 HB3 ASN A 26 10.370 11.755 10.016 1.00 12.13 H new ATOM 0 HD21 ASN A 26 6.955 11.495 11.917 1.00 13.52 H new ATOM 0 HD22 ASN A 26 8.573 11.062 12.477 1.00 13.52 H new ATOM 392 N HIS A 27 11.249 9.645 7.043 1.00 24.14 N ATOM 393 CA HIS A 27 12.295 9.993 6.089 1.00 54.43 C ATOM 394 C HIS A 27 12.142 9.208 4.790 1.00 22.41 C ATOM 395 O HIS A 27 11.275 8.343 4.671 1.00 52.32 O ATOM 396 CB HIS A 27 13.674 9.729 6.697 1.00 35.05 C ATOM 397 CG HIS A 27 13.933 8.283 6.991 1.00 11.14 C ATOM 398 ND1 HIS A 27 14.050 7.324 6.006 1.00 5.22 N ATOM 399 CD2 HIS A 27 14.098 7.633 8.167 1.00 32.44 C ATOM 400 CE1 HIS A 27 14.276 6.148 6.564 1.00 71.53 C ATOM 401 NE2 HIS A 27 14.310 6.309 7.874 1.00 25.33 N ATOM 0 H HIS A 27 10.634 8.889 6.742 1.00 24.14 H new ATOM 0 HA HIS A 27 12.199 11.054 5.859 1.00 54.43 H new ATOM 0 HB2 HIS A 27 14.440 10.095 6.013 1.00 35.05 H new ATOM 0 HB3 HIS A 27 13.771 10.302 7.619 1.00 35.05 H new ATOM 0 HD2 HIS A 27 14.068 8.074 9.152 1.00 32.44 H new ATOM 0 HE1 HIS A 27 14.410 5.214 6.038 1.00 71.53 H new ATOM 0 HE2 HIS A 27 14.468 5.569 8.558 1.00 25.33 H new ATOM 410 N PHE A 28 12.997 9.519 3.822 1.00 11.30 N ATOM 411 CA PHE A 28 12.970 8.847 2.529 1.00 41.21 C ATOM 412 C PHE A 28 13.852 7.602 2.552 1.00 11.04 C ATOM 413 O PHE A 28 14.949 7.619 3.109 1.00 73.12 O ATOM 414 CB PHE A 28 13.442 9.801 1.430 1.00 2.45 C ATOM 415 CG PHE A 28 12.879 9.487 0.073 1.00 14.44 C ATOM 416 CD1 PHE A 28 11.558 9.778 -0.228 1.00 13.24 C ATOM 417 CD2 PHE A 28 13.673 8.906 -0.903 1.00 21.21 C ATOM 418 CE1 PHE A 28 11.039 9.493 -1.478 1.00 45.10 C ATOM 419 CE2 PHE A 28 13.160 8.620 -2.154 1.00 4.24 C ATOM 420 CZ PHE A 28 11.842 8.914 -2.441 1.00 45.21 C ATOM 0 H PHE A 28 13.719 10.234 3.909 1.00 11.30 H new ATOM 0 HA PHE A 28 11.944 8.542 2.321 1.00 41.21 H new ATOM 0 HB2 PHE A 28 13.164 10.819 1.702 1.00 2.45 H new ATOM 0 HB3 PHE A 28 14.530 9.770 1.378 1.00 2.45 H new ATOM 0 HD1 PHE A 28 10.927 10.232 0.522 1.00 13.24 H new ATOM 0 HD2 PHE A 28 14.705 8.674 -0.683 1.00 21.21 H new ATOM 0 HE1 PHE A 28 10.007 9.723 -1.701 1.00 45.10 H new ATOM 0 HE2 PHE A 28 13.789 8.167 -2.906 1.00 4.24 H new ATOM 0 HZ PHE A 28 11.439 8.691 -3.418 1.00 45.21 H new ATOM 430 N VAL A 29 13.366 6.523 1.948 1.00 73.44 N ATOM 431 CA VAL A 29 14.114 5.273 1.905 1.00 5.33 C ATOM 432 C VAL A 29 15.479 5.473 1.253 1.00 45.55 C ATOM 433 O VAL A 29 15.645 6.326 0.381 1.00 20.00 O ATOM 434 CB VAL A 29 13.333 4.175 1.150 1.00 63.45 C ATOM 435 CG1 VAL A 29 14.231 2.992 0.811 1.00 30.45 C ATOM 436 CG2 VAL A 29 12.142 3.719 1.976 1.00 1.31 C ATOM 0 H VAL A 29 12.459 6.489 1.482 1.00 73.44 H new ATOM 0 HA VAL A 29 14.259 4.950 2.936 1.00 5.33 H new ATOM 0 HB VAL A 29 12.973 4.598 0.212 1.00 63.45 H new ATOM 0 HG11 VAL A 29 13.652 2.236 0.280 1.00 30.45 H new ATOM 0 HG12 VAL A 29 15.054 3.329 0.180 1.00 30.45 H new ATOM 0 HG13 VAL A 29 14.631 2.563 1.730 1.00 30.45 H new ATOM 0 HG21 VAL A 29 11.599 2.945 1.434 1.00 1.31 H new ATOM 0 HG22 VAL A 29 12.491 3.319 2.928 1.00 1.31 H new ATOM 0 HG23 VAL A 29 11.481 4.566 2.159 1.00 1.31 H new ATOM 446 N ASP A 30 16.449 4.677 1.688 1.00 41.20 N ATOM 447 CA ASP A 30 17.807 4.753 1.161 1.00 62.32 C ATOM 448 C ASP A 30 18.720 3.767 1.885 1.00 4.41 C ATOM 449 O ASP A 30 19.598 3.156 1.276 1.00 63.00 O ATOM 450 CB ASP A 30 18.359 6.175 1.304 1.00 11.42 C ATOM 451 CG ASP A 30 19.775 6.305 0.776 1.00 65.11 C ATOM 452 OD1 ASP A 30 19.959 6.222 -0.457 1.00 53.10 O ATOM 453 OD2 ASP A 30 20.700 6.489 1.595 1.00 31.23 O ATOM 0 H ASP A 30 16.319 3.967 2.409 1.00 41.20 H new ATOM 0 HA ASP A 30 17.776 4.491 0.103 1.00 62.32 H new ATOM 0 HB2 ASP A 30 17.710 6.868 0.769 1.00 11.42 H new ATOM 0 HB3 ASP A 30 18.338 6.465 2.354 1.00 11.42 H new ATOM 458 N GLU A 31 18.505 3.619 3.189 1.00 4.20 N ATOM 459 CA GLU A 31 19.307 2.708 3.998 1.00 73.12 C ATOM 460 C GLU A 31 18.430 1.649 4.657 1.00 14.15 C ATOM 461 O GLU A 31 17.952 1.833 5.776 1.00 21.53 O ATOM 462 CB GLU A 31 20.075 3.487 5.067 1.00 74.05 C ATOM 463 CG GLU A 31 19.227 4.516 5.796 1.00 62.54 C ATOM 464 CD GLU A 31 19.604 4.652 7.259 1.00 5.21 C ATOM 465 OE1 GLU A 31 20.637 5.291 7.549 1.00 33.30 O ATOM 466 OE2 GLU A 31 18.865 4.119 8.114 1.00 2.42 O ATOM 0 H GLU A 31 17.782 4.118 3.707 1.00 4.20 H new ATOM 0 HA GLU A 31 20.017 2.207 3.340 1.00 73.12 H new ATOM 0 HB2 GLU A 31 20.484 2.785 5.793 1.00 74.05 H new ATOM 0 HB3 GLU A 31 20.921 3.991 4.600 1.00 74.05 H new ATOM 0 HG2 GLU A 31 19.335 5.483 5.305 1.00 62.54 H new ATOM 0 HG3 GLU A 31 18.177 4.235 5.720 1.00 62.54 H new ATOM 473 N TYR A 32 18.223 0.539 3.956 1.00 63.41 N ATOM 474 CA TYR A 32 17.403 -0.550 4.474 1.00 74.22 C ATOM 475 C TYR A 32 18.012 -1.903 4.124 1.00 43.14 C ATOM 476 O TYR A 32 18.967 -1.984 3.351 1.00 70.34 O ATOM 477 CB TYR A 32 15.981 -0.457 3.916 1.00 3.30 C ATOM 478 CG TYR A 32 15.918 -0.486 2.406 1.00 65.42 C ATOM 479 CD1 TYR A 32 16.287 0.623 1.655 1.00 44.33 C ATOM 480 CD2 TYR A 32 15.487 -1.621 1.732 1.00 74.31 C ATOM 481 CE1 TYR A 32 16.230 0.600 0.274 1.00 64.41 C ATOM 482 CE2 TYR A 32 15.427 -1.652 0.351 1.00 3.41 C ATOM 483 CZ TYR A 32 15.799 -0.539 -0.373 1.00 14.32 C ATOM 484 OH TYR A 32 15.740 -0.565 -1.747 1.00 41.23 O ATOM 0 H TYR A 32 18.612 0.370 3.028 1.00 63.41 H new ATOM 0 HA TYR A 32 17.366 -0.459 5.560 1.00 74.22 H new ATOM 0 HB2 TYR A 32 15.390 -1.283 4.311 1.00 3.30 H new ATOM 0 HB3 TYR A 32 15.520 0.464 4.273 1.00 3.30 H new ATOM 0 HD1 TYR A 32 16.624 1.517 2.158 1.00 44.33 H new ATOM 0 HD2 TYR A 32 15.194 -2.494 2.296 1.00 74.31 H new ATOM 0 HE1 TYR A 32 16.522 1.470 -0.296 1.00 64.41 H new ATOM 0 HE2 TYR A 32 15.091 -2.543 -0.158 1.00 3.41 H new ATOM 0 HH TYR A 32 15.417 -1.441 -2.044 1.00 41.23 H new ATOM 494 N ASP A 33 17.455 -2.964 4.700 1.00 41.55 N ATOM 495 CA ASP A 33 17.945 -4.315 4.450 1.00 64.31 C ATOM 496 C ASP A 33 16.979 -5.089 3.556 1.00 63.14 C ATOM 497 O ASP A 33 16.056 -5.741 4.045 1.00 44.51 O ATOM 498 CB ASP A 33 18.145 -5.061 5.771 1.00 61.13 C ATOM 499 CG ASP A 33 16.970 -4.896 6.714 1.00 3.41 C ATOM 500 OD1 ASP A 33 15.863 -4.574 6.233 1.00 71.25 O ATOM 501 OD2 ASP A 33 17.156 -5.090 7.934 1.00 2.22 O ATOM 0 H ASP A 33 16.664 -2.914 5.343 1.00 41.55 H new ATOM 0 HA ASP A 33 18.903 -4.237 3.936 1.00 64.31 H new ATOM 0 HB2 ASP A 33 18.297 -6.121 5.567 1.00 61.13 H new ATOM 0 HB3 ASP A 33 19.050 -4.697 6.257 1.00 61.13 H new ATOM 506 N PRO A 34 17.178 -5.030 2.227 1.00 15.14 N ATOM 507 CA PRO A 34 16.318 -5.731 1.268 1.00 42.10 C ATOM 508 C PRO A 34 16.484 -7.246 1.338 1.00 51.44 C ATOM 509 O PRO A 34 15.599 -7.997 0.927 1.00 11.13 O ATOM 510 CB PRO A 34 16.791 -5.204 -0.089 1.00 34.45 C ATOM 511 CG PRO A 34 18.199 -4.775 0.139 1.00 24.51 C ATOM 512 CD PRO A 34 18.256 -4.277 1.557 1.00 63.13 C ATOM 0 HA PRO A 34 15.261 -5.551 1.465 1.00 42.10 H new ATOM 0 HB2 PRO A 34 16.732 -5.977 -0.856 1.00 34.45 H new ATOM 0 HB3 PRO A 34 16.174 -4.372 -0.427 1.00 34.45 H new ATOM 0 HG2 PRO A 34 18.889 -5.605 -0.011 1.00 24.51 H new ATOM 0 HG3 PRO A 34 18.486 -3.991 -0.562 1.00 24.51 H new ATOM 0 HD2 PRO A 34 19.226 -4.473 2.013 1.00 63.13 H new ATOM 0 HD3 PRO A 34 18.089 -3.201 1.612 1.00 63.13 H new ATOM 520 N SER A 35 17.623 -7.690 1.862 1.00 13.51 N ATOM 521 CA SER A 35 17.905 -9.116 1.985 1.00 41.43 C ATOM 522 C SER A 35 16.893 -9.804 2.901 1.00 44.44 C ATOM 523 O SER A 35 16.751 -11.027 2.872 1.00 10.51 O ATOM 524 CB SER A 35 19.323 -9.329 2.521 1.00 3.31 C ATOM 525 OG SER A 35 20.195 -9.768 1.495 1.00 44.14 O ATOM 0 H SER A 35 18.365 -7.082 2.208 1.00 13.51 H new ATOM 0 HA SER A 35 17.824 -9.561 0.993 1.00 41.43 H new ATOM 0 HB2 SER A 35 19.698 -8.398 2.947 1.00 3.31 H new ATOM 0 HB3 SER A 35 19.304 -10.064 3.326 1.00 3.31 H new ATOM 0 HG SER A 35 21.095 -9.895 1.862 1.00 44.14 H new ATOM 531 N ILE A 36 16.192 -9.016 3.712 1.00 32.51 N ATOM 532 CA ILE A 36 15.198 -9.558 4.631 1.00 35.22 C ATOM 533 C ILE A 36 13.844 -8.882 4.442 1.00 34.14 C ATOM 534 O ILE A 36 13.721 -7.916 3.689 1.00 30.03 O ATOM 535 CB ILE A 36 15.641 -9.404 6.100 1.00 30.13 C ATOM 536 CG1 ILE A 36 15.904 -7.934 6.432 1.00 1.14 C ATOM 537 CG2 ILE A 36 16.882 -10.241 6.368 1.00 74.05 C ATOM 538 CD1 ILE A 36 14.654 -7.161 6.791 1.00 72.42 C ATOM 0 H ILE A 36 16.294 -8.002 3.751 1.00 32.51 H new ATOM 0 HA ILE A 36 15.104 -10.619 4.401 1.00 35.22 H new ATOM 0 HB ILE A 36 14.836 -9.761 6.743 1.00 30.13 H new ATOM 0 HG12 ILE A 36 16.607 -7.878 7.263 1.00 1.14 H new ATOM 0 HG13 ILE A 36 16.383 -7.457 5.577 1.00 1.14 H new ATOM 0 HG21 ILE A 36 17.183 -10.122 7.409 1.00 74.05 H new ATOM 0 HG22 ILE A 36 16.663 -11.290 6.171 1.00 74.05 H new ATOM 0 HG23 ILE A 36 17.691 -9.911 5.716 1.00 74.05 H new ATOM 0 HD11 ILE A 36 14.917 -6.127 7.014 1.00 72.42 H new ATOM 0 HD12 ILE A 36 13.958 -7.185 5.953 1.00 72.42 H new ATOM 0 HD13 ILE A 36 14.185 -7.613 7.665 1.00 72.42 H new ATOM 550 N GLU A 37 12.828 -9.400 5.128 1.00 41.13 N ATOM 551 CA GLU A 37 11.479 -8.849 5.034 1.00 52.21 C ATOM 552 C GLU A 37 11.469 -7.362 5.379 1.00 3.43 C ATOM 553 O GLU A 37 11.957 -6.956 6.433 1.00 24.21 O ATOM 554 CB GLU A 37 10.530 -9.608 5.965 1.00 5.14 C ATOM 555 CG GLU A 37 9.635 -10.603 5.243 1.00 60.34 C ATOM 556 CD GLU A 37 8.460 -11.050 6.090 1.00 12.23 C ATOM 557 OE1 GLU A 37 8.693 -11.667 7.151 1.00 24.51 O ATOM 558 OE2 GLU A 37 7.306 -10.784 5.692 1.00 35.41 O ATOM 0 H GLU A 37 12.913 -10.200 5.755 1.00 41.13 H new ATOM 0 HA GLU A 37 11.138 -8.965 4.005 1.00 52.21 H new ATOM 0 HB2 GLU A 37 11.117 -10.138 6.715 1.00 5.14 H new ATOM 0 HB3 GLU A 37 9.906 -8.890 6.497 1.00 5.14 H new ATOM 0 HG2 GLU A 37 9.264 -10.152 4.323 1.00 60.34 H new ATOM 0 HG3 GLU A 37 10.224 -11.474 4.956 1.00 60.34 H new ATOM 565 N ASP A 38 10.908 -6.556 4.483 1.00 15.33 N ATOM 566 CA ASP A 38 10.833 -5.116 4.694 1.00 71.34 C ATOM 567 C ASP A 38 9.545 -4.738 5.422 1.00 62.42 C ATOM 568 O ASP A 38 8.802 -3.862 4.979 1.00 43.11 O ATOM 569 CB ASP A 38 10.913 -4.379 3.355 1.00 43.54 C ATOM 570 CG ASP A 38 12.327 -4.326 2.809 1.00 51.13 C ATOM 571 OD1 ASP A 38 12.763 -5.321 2.192 1.00 32.32 O ATOM 572 OD2 ASP A 38 12.998 -3.290 2.998 1.00 53.33 O ATOM 0 H ASP A 38 10.499 -6.876 3.605 1.00 15.33 H new ATOM 0 HA ASP A 38 11.679 -4.820 5.315 1.00 71.34 H new ATOM 0 HB2 ASP A 38 10.265 -4.874 2.631 1.00 43.54 H new ATOM 0 HB3 ASP A 38 10.536 -3.364 3.479 1.00 43.54 H new ATOM 577 N SER A 39 9.288 -5.405 6.543 1.00 54.01 N ATOM 578 CA SER A 39 8.092 -5.139 7.334 1.00 62.11 C ATOM 579 C SER A 39 8.432 -4.318 8.573 1.00 11.31 C ATOM 580 O SER A 39 9.578 -4.301 9.024 1.00 14.04 O ATOM 581 CB SER A 39 7.423 -6.452 7.743 1.00 61.35 C ATOM 582 OG SER A 39 6.501 -6.248 8.800 1.00 52.11 O ATOM 0 H SER A 39 9.892 -6.133 6.924 1.00 54.01 H new ATOM 0 HA SER A 39 7.399 -4.564 6.719 1.00 62.11 H new ATOM 0 HB2 SER A 39 6.908 -6.884 6.885 1.00 61.35 H new ATOM 0 HB3 SER A 39 8.183 -7.170 8.053 1.00 61.35 H new ATOM 0 HG SER A 39 5.793 -5.639 8.503 1.00 52.11 H new ATOM 588 N TYR A 40 7.430 -3.637 9.120 1.00 61.32 N ATOM 589 CA TYR A 40 7.624 -2.812 10.307 1.00 53.44 C ATOM 590 C TYR A 40 6.395 -2.858 11.209 1.00 21.44 C ATOM 591 O TYR A 40 5.307 -3.236 10.774 1.00 73.52 O ATOM 592 CB TYR A 40 7.923 -1.367 9.905 1.00 0.32 C ATOM 593 CG TYR A 40 8.903 -1.245 8.761 1.00 51.23 C ATOM 594 CD1 TYR A 40 8.476 -1.341 7.442 1.00 10.11 C ATOM 595 CD2 TYR A 40 10.256 -1.035 8.998 1.00 22.43 C ATOM 596 CE1 TYR A 40 9.369 -1.232 6.393 1.00 63.33 C ATOM 597 CE2 TYR A 40 11.155 -0.924 7.954 1.00 34.31 C ATOM 598 CZ TYR A 40 10.706 -1.023 6.654 1.00 51.13 C ATOM 599 OH TYR A 40 11.598 -0.915 5.612 1.00 13.11 O ATOM 0 H TYR A 40 6.476 -3.640 8.760 1.00 61.32 H new ATOM 0 HA TYR A 40 8.473 -3.211 10.862 1.00 53.44 H new ATOM 0 HB2 TYR A 40 6.990 -0.876 9.627 1.00 0.32 H new ATOM 0 HB3 TYR A 40 8.319 -0.833 10.769 1.00 0.32 H new ATOM 0 HD1 TYR A 40 7.429 -1.503 7.233 1.00 10.11 H new ATOM 0 HD2 TYR A 40 10.611 -0.957 10.015 1.00 22.43 H new ATOM 0 HE1 TYR A 40 9.021 -1.310 5.374 1.00 63.33 H new ATOM 0 HE2 TYR A 40 12.203 -0.761 8.155 1.00 34.31 H new ATOM 0 HH TYR A 40 12.500 -0.768 5.967 1.00 13.11 H new ATOM 609 N ARG A 41 6.576 -2.473 12.469 1.00 72.51 N ATOM 610 CA ARG A 41 5.481 -2.471 13.432 1.00 5.04 C ATOM 611 C ARG A 41 5.480 -1.189 14.258 1.00 4.54 C ATOM 612 O ARG A 41 6.512 -0.782 14.791 1.00 73.30 O ATOM 613 CB ARG A 41 5.585 -3.685 14.356 1.00 23.02 C ATOM 614 CG ARG A 41 5.193 -4.993 13.689 1.00 51.43 C ATOM 615 CD ARG A 41 5.770 -6.190 14.426 1.00 61.32 C ATOM 616 NE ARG A 41 5.260 -7.454 13.901 1.00 62.01 N ATOM 617 CZ ARG A 41 5.611 -7.963 12.722 1.00 33.11 C ATOM 618 NH1 ARG A 41 6.473 -7.320 11.945 1.00 34.22 N ATOM 619 NH2 ARG A 41 5.099 -9.118 12.320 1.00 51.04 N ATOM 0 H ARG A 41 7.470 -2.159 12.846 1.00 72.51 H new ATOM 0 HA ARG A 41 4.545 -2.523 12.876 1.00 5.04 H new ATOM 0 HB2 ARG A 41 6.609 -3.766 14.722 1.00 23.02 H new ATOM 0 HB3 ARG A 41 4.947 -3.525 15.225 1.00 23.02 H new ATOM 0 HG2 ARG A 41 4.107 -5.074 13.656 1.00 51.43 H new ATOM 0 HG3 ARG A 41 5.544 -4.996 12.657 1.00 51.43 H new ATOM 0 HD2 ARG A 41 6.857 -6.176 14.345 1.00 61.32 H new ATOM 0 HD3 ARG A 41 5.528 -6.114 15.486 1.00 61.32 H new ATOM 0 HE ARG A 41 4.596 -7.978 14.471 1.00 62.01 H new ATOM 0 HH11 ARG A 41 6.870 -6.431 12.250 1.00 34.22 H new ATOM 0 HH12 ARG A 41 6.739 -7.714 11.043 1.00 34.22 H new ATOM 0 HH21 ARG A 41 4.436 -9.616 12.914 1.00 51.04 H new ATOM 0 HH22 ARG A 41 5.368 -9.508 11.417 1.00 51.04 H new ATOM 633 N LYS A 42 4.315 -0.560 14.362 1.00 70.33 N ATOM 634 CA LYS A 42 4.177 0.675 15.126 1.00 43.13 C ATOM 635 C LYS A 42 2.812 0.748 15.798 1.00 61.21 C ATOM 636 O LYS A 42 1.816 0.263 15.261 1.00 11.24 O ATOM 637 CB LYS A 42 4.374 1.889 14.219 1.00 63.31 C ATOM 638 CG LYS A 42 4.614 3.184 14.977 1.00 35.13 C ATOM 639 CD LYS A 42 4.723 4.369 14.031 1.00 33.24 C ATOM 640 CE LYS A 42 3.414 4.622 13.299 1.00 1.22 C ATOM 641 NZ LYS A 42 3.052 6.066 13.291 1.00 24.25 N ATOM 0 H LYS A 42 3.452 -0.885 13.927 1.00 70.33 H new ATOM 0 HA LYS A 42 4.946 0.680 15.899 1.00 43.13 H new ATOM 0 HB2 LYS A 42 5.220 1.704 13.557 1.00 63.31 H new ATOM 0 HB3 LYS A 42 3.494 2.006 13.587 1.00 63.31 H new ATOM 0 HG2 LYS A 42 3.798 3.352 15.680 1.00 35.13 H new ATOM 0 HG3 LYS A 42 5.529 3.100 15.564 1.00 35.13 H new ATOM 0 HD2 LYS A 42 5.004 5.260 14.593 1.00 33.24 H new ATOM 0 HD3 LYS A 42 5.516 4.185 13.306 1.00 33.24 H new ATOM 0 HE2 LYS A 42 3.497 4.263 12.273 1.00 1.22 H new ATOM 0 HE3 LYS A 42 2.616 4.050 13.774 1.00 1.22 H new ATOM 0 HZ1 LYS A 42 2.032 6.167 13.117 1.00 24.25 H new ATOM 0 HZ2 LYS A 42 3.290 6.489 14.211 1.00 24.25 H new ATOM 0 HZ3 LYS A 42 3.581 6.552 12.539 1.00 24.25 H new ATOM 655 N GLN A 43 2.774 1.359 16.975 1.00 43.25 N ATOM 656 CA GLN A 43 1.530 1.499 17.724 1.00 14.41 C ATOM 657 C GLN A 43 0.879 2.850 17.447 1.00 75.32 C ATOM 658 O GLN A 43 1.555 3.878 17.403 1.00 4.32 O ATOM 659 CB GLN A 43 1.794 1.347 19.223 1.00 24.55 C ATOM 660 CG GLN A 43 0.530 1.345 20.065 1.00 43.14 C ATOM 661 CD GLN A 43 0.414 2.576 20.930 1.00 15.24 C ATOM 662 OE1 GLN A 43 -0.039 3.630 20.482 1.00 74.24 O ATOM 663 NE2 GLN A 43 0.826 2.444 22.178 1.00 52.15 N ATOM 0 H GLN A 43 3.590 1.766 17.432 1.00 43.25 H new ATOM 0 HA GLN A 43 0.848 0.713 17.400 1.00 14.41 H new ATOM 0 HB2 GLN A 43 2.337 0.418 19.396 1.00 24.55 H new ATOM 0 HB3 GLN A 43 2.440 2.160 19.554 1.00 24.55 H new ATOM 0 HG2 GLN A 43 -0.339 1.281 19.411 1.00 43.14 H new ATOM 0 HG3 GLN A 43 0.519 0.457 20.697 1.00 43.14 H new ATOM 0 HE21 GLN A 43 1.194 1.549 22.502 1.00 52.15 H new ATOM 0 HE22 GLN A 43 0.776 3.237 22.818 1.00 52.15 H new ATOM 672 N VAL A 44 -0.437 2.842 17.263 1.00 12.05 N ATOM 673 CA VAL A 44 -1.177 4.069 16.993 1.00 63.32 C ATOM 674 C VAL A 44 -2.565 4.023 17.622 1.00 31.21 C ATOM 675 O VAL A 44 -2.962 3.011 18.200 1.00 73.51 O ATOM 676 CB VAL A 44 -1.317 4.319 15.480 1.00 32.40 C ATOM 677 CG1 VAL A 44 0.048 4.543 14.847 1.00 24.43 C ATOM 678 CG2 VAL A 44 -2.039 3.160 14.811 1.00 70.45 C ATOM 0 H VAL A 44 -1.012 2.000 17.296 1.00 12.05 H new ATOM 0 HA VAL A 44 -0.608 4.886 17.436 1.00 63.32 H new ATOM 0 HB VAL A 44 -1.912 5.220 15.333 1.00 32.40 H new ATOM 0 HG11 VAL A 44 -0.071 4.718 13.778 1.00 24.43 H new ATOM 0 HG12 VAL A 44 0.524 5.410 15.306 1.00 24.43 H new ATOM 0 HG13 VAL A 44 0.671 3.662 15.003 1.00 24.43 H new ATOM 0 HG21 VAL A 44 -2.128 3.355 13.742 1.00 70.45 H new ATOM 0 HG22 VAL A 44 -1.474 2.241 14.966 1.00 70.45 H new ATOM 0 HG23 VAL A 44 -3.033 3.052 15.244 1.00 70.45 H new ATOM 688 N VAL A 45 -3.299 5.124 17.506 1.00 52.51 N ATOM 689 CA VAL A 45 -4.643 5.209 18.065 1.00 2.32 C ATOM 690 C VAL A 45 -5.651 5.652 17.010 1.00 71.12 C ATOM 691 O VAL A 45 -5.745 6.836 16.685 1.00 2.05 O ATOM 692 CB VAL A 45 -4.699 6.187 19.253 1.00 51.53 C ATOM 693 CG1 VAL A 45 -6.051 6.111 19.945 1.00 24.32 C ATOM 694 CG2 VAL A 45 -3.572 5.901 20.234 1.00 21.41 C ATOM 0 H VAL A 45 -2.986 5.970 17.030 1.00 52.51 H new ATOM 0 HA VAL A 45 -4.902 4.210 18.415 1.00 2.32 H new ATOM 0 HB VAL A 45 -4.569 7.200 18.872 1.00 51.53 H new ATOM 0 HG11 VAL A 45 -6.071 6.809 20.782 1.00 24.32 H new ATOM 0 HG12 VAL A 45 -6.837 6.371 19.236 1.00 24.32 H new ATOM 0 HG13 VAL A 45 -6.215 5.098 20.313 1.00 24.32 H new ATOM 0 HG21 VAL A 45 -3.628 6.602 21.067 1.00 21.41 H new ATOM 0 HG22 VAL A 45 -3.667 4.882 20.610 1.00 21.41 H new ATOM 0 HG23 VAL A 45 -2.613 6.013 19.729 1.00 21.41 H new ATOM 704 N ILE A 46 -6.403 4.694 16.479 1.00 64.33 N ATOM 705 CA ILE A 46 -7.405 4.983 15.462 1.00 75.44 C ATOM 706 C ILE A 46 -8.764 4.411 15.853 1.00 74.41 C ATOM 707 O ILE A 46 -8.856 3.291 16.355 1.00 43.42 O ATOM 708 CB ILE A 46 -6.991 4.411 14.092 1.00 31.33 C ATOM 709 CG1 ILE A 46 -5.577 4.871 13.732 1.00 42.54 C ATOM 710 CG2 ILE A 46 -7.981 4.834 13.017 1.00 71.24 C ATOM 711 CD1 ILE A 46 -4.900 3.994 12.701 1.00 22.44 C ATOM 0 H ILE A 46 -6.337 3.709 16.737 1.00 64.33 H new ATOM 0 HA ILE A 46 -7.480 6.068 15.387 1.00 75.44 H new ATOM 0 HB ILE A 46 -6.997 3.323 14.153 1.00 31.33 H new ATOM 0 HG12 ILE A 46 -5.621 5.893 13.355 1.00 42.54 H new ATOM 0 HG13 ILE A 46 -4.969 4.891 14.636 1.00 42.54 H new ATOM 0 HG21 ILE A 46 -7.673 4.421 12.056 1.00 71.24 H new ATOM 0 HG22 ILE A 46 -8.974 4.462 13.270 1.00 71.24 H new ATOM 0 HG23 ILE A 46 -8.006 5.922 12.953 1.00 71.24 H new ATOM 0 HD11 ILE A 46 -3.902 4.380 12.494 1.00 22.44 H new ATOM 0 HD12 ILE A 46 -4.824 2.976 13.083 1.00 22.44 H new ATOM 0 HD13 ILE A 46 -5.486 3.994 11.782 1.00 22.44 H new ATOM 723 N ASP A 47 -9.817 5.189 15.621 1.00 52.40 N ATOM 724 CA ASP A 47 -11.172 4.760 15.950 1.00 11.33 C ATOM 725 C ASP A 47 -11.316 4.512 17.449 1.00 43.42 C ATOM 726 O ASP A 47 -12.107 3.669 17.875 1.00 44.11 O ATOM 727 CB ASP A 47 -11.532 3.493 15.170 1.00 53.44 C ATOM 728 CG ASP A 47 -12.763 3.678 14.303 1.00 62.04 C ATOM 729 OD1 ASP A 47 -13.809 4.098 14.840 1.00 23.32 O ATOM 730 OD2 ASP A 47 -12.680 3.402 13.088 1.00 11.24 O ATOM 0 H ASP A 47 -9.758 6.119 15.207 1.00 52.40 H new ATOM 0 HA ASP A 47 -11.859 5.558 15.667 1.00 11.33 H new ATOM 0 HB2 ASP A 47 -10.689 3.204 14.542 1.00 53.44 H new ATOM 0 HB3 ASP A 47 -11.703 2.675 15.870 1.00 53.44 H new ATOM 735 N GLY A 48 -10.548 5.250 18.244 1.00 44.43 N ATOM 736 CA GLY A 48 -10.607 5.094 19.686 1.00 13.43 C ATOM 737 C GLY A 48 -10.224 3.697 20.135 1.00 12.41 C ATOM 738 O GLY A 48 -10.717 3.208 21.151 1.00 11.54 O ATOM 0 H GLY A 48 -9.886 5.953 17.916 1.00 44.43 H new ATOM 0 HA2 GLY A 48 -9.940 5.818 20.154 1.00 13.43 H new ATOM 0 HA3 GLY A 48 -11.616 5.319 20.032 1.00 13.43 H new ATOM 742 N GLU A 49 -9.344 3.053 19.375 1.00 43.34 N ATOM 743 CA GLU A 49 -8.896 1.704 19.700 1.00 42.33 C ATOM 744 C GLU A 49 -7.410 1.535 19.399 1.00 71.15 C ATOM 745 O GLU A 49 -7.022 1.295 18.256 1.00 13.32 O ATOM 746 CB GLU A 49 -9.708 0.672 18.913 1.00 44.52 C ATOM 747 CG GLU A 49 -9.302 -0.765 19.194 1.00 54.03 C ATOM 748 CD GLU A 49 -10.484 -1.715 19.202 1.00 23.32 C ATOM 749 OE1 GLU A 49 -11.210 -1.767 18.187 1.00 22.11 O ATOM 750 OE2 GLU A 49 -10.684 -2.405 20.223 1.00 32.55 O ATOM 0 H GLU A 49 -8.927 3.444 18.530 1.00 43.34 H new ATOM 0 HA GLU A 49 -9.052 1.544 20.767 1.00 42.33 H new ATOM 0 HB2 GLU A 49 -10.765 0.795 19.151 1.00 44.52 H new ATOM 0 HB3 GLU A 49 -9.596 0.870 17.847 1.00 44.52 H new ATOM 0 HG2 GLU A 49 -8.585 -1.090 18.440 1.00 54.03 H new ATOM 0 HG3 GLU A 49 -8.795 -0.813 20.158 1.00 54.03 H new ATOM 757 N THR A 50 -6.584 1.661 20.432 1.00 4.54 N ATOM 758 CA THR A 50 -5.140 1.519 20.278 1.00 14.13 C ATOM 759 C THR A 50 -4.784 0.127 19.768 1.00 33.22 C ATOM 760 O THR A 50 -5.090 -0.877 20.411 1.00 54.34 O ATOM 761 CB THR A 50 -4.435 1.785 21.610 1.00 11.34 C ATOM 762 OG1 THR A 50 -4.729 3.088 22.081 1.00 20.51 O ATOM 763 CG2 THR A 50 -2.929 1.655 21.529 1.00 14.34 C ATOM 0 H THR A 50 -6.889 1.861 21.385 1.00 4.54 H new ATOM 0 HA THR A 50 -4.803 2.252 19.545 1.00 14.13 H new ATOM 0 HB THR A 50 -4.812 1.023 22.292 1.00 11.34 H new ATOM 0 HG1 THR A 50 -4.271 3.239 22.934 1.00 20.51 H new ATOM 0 HG21 THR A 50 -2.493 1.856 22.508 1.00 14.34 H new ATOM 0 HG22 THR A 50 -2.667 0.644 21.216 1.00 14.34 H new ATOM 0 HG23 THR A 50 -2.540 2.371 20.805 1.00 14.34 H new ATOM 771 N CYS A 51 -4.138 0.073 18.609 1.00 33.04 N ATOM 772 CA CYS A 51 -3.742 -1.197 18.014 1.00 75.11 C ATOM 773 C CYS A 51 -2.415 -1.065 17.275 1.00 4.54 C ATOM 774 O CYS A 51 -2.040 0.024 16.840 1.00 52.12 O ATOM 775 CB CYS A 51 -4.825 -1.694 17.055 1.00 44.23 C ATOM 776 SG CYS A 51 -6.288 -2.366 17.878 1.00 24.35 S ATOM 0 H CYS A 51 -3.877 0.894 18.063 1.00 33.04 H new ATOM 0 HA CYS A 51 -3.617 -1.921 18.819 1.00 75.11 H new ATOM 0 HB2 CYS A 51 -5.130 -0.870 16.410 1.00 44.23 H new ATOM 0 HB3 CYS A 51 -4.399 -2.462 16.410 1.00 44.23 H new ATOM 0 HG CYS A 51 -6.278 -2.021 19.131 1.00 24.35 H new ATOM 782 N LEU A 52 -1.708 -2.182 17.136 1.00 24.13 N ATOM 783 CA LEU A 52 -0.423 -2.193 16.449 1.00 43.25 C ATOM 784 C LEU A 52 -0.618 -2.176 14.936 1.00 25.44 C ATOM 785 O LEU A 52 -1.602 -2.707 14.422 1.00 64.12 O ATOM 786 CB LEU A 52 0.387 -3.425 16.864 1.00 25.22 C ATOM 787 CG LEU A 52 1.758 -3.130 17.479 1.00 1.32 C ATOM 788 CD1 LEU A 52 2.740 -2.685 16.407 1.00 51.12 C ATOM 789 CD2 LEU A 52 1.640 -2.075 18.570 1.00 13.53 C ATOM 0 H LEU A 52 -2.004 -3.091 17.491 1.00 24.13 H new ATOM 0 HA LEU A 52 0.126 -1.296 16.734 1.00 43.25 H new ATOM 0 HB2 LEU A 52 -0.199 -4.000 17.582 1.00 25.22 H new ATOM 0 HB3 LEU A 52 0.529 -4.058 15.988 1.00 25.22 H new ATOM 0 HG LEU A 52 2.136 -4.047 17.930 1.00 1.32 H new ATOM 0 HD11 LEU A 52 3.708 -2.480 16.863 1.00 51.12 H new ATOM 0 HD12 LEU A 52 2.849 -3.474 15.663 1.00 51.12 H new ATOM 0 HD13 LEU A 52 2.367 -1.781 15.925 1.00 51.12 H new ATOM 0 HD21 LEU A 52 2.625 -1.879 18.995 1.00 13.53 H new ATOM 0 HD22 LEU A 52 1.239 -1.155 18.145 1.00 13.53 H new ATOM 0 HD23 LEU A 52 0.972 -2.434 19.353 1.00 13.53 H new ATOM 801 N LEU A 53 0.324 -1.562 14.229 1.00 73.14 N ATOM 802 CA LEU A 53 0.255 -1.474 12.774 1.00 2.53 C ATOM 803 C LEU A 53 1.388 -2.261 12.125 1.00 24.54 C ATOM 804 O LEU A 53 2.463 -1.721 11.866 1.00 31.34 O ATOM 805 CB LEU A 53 0.314 -0.012 12.328 1.00 42.42 C ATOM 806 CG LEU A 53 -0.998 0.760 12.465 1.00 22.24 C ATOM 807 CD1 LEU A 53 -0.827 2.192 11.982 1.00 3.22 C ATOM 808 CD2 LEU A 53 -2.109 0.064 11.693 1.00 13.13 C ATOM 0 H LEU A 53 1.145 -1.117 14.639 1.00 73.14 H new ATOM 0 HA LEU A 53 -0.693 -1.907 12.454 1.00 2.53 H new ATOM 0 HB2 LEU A 53 1.081 0.499 12.910 1.00 42.42 H new ATOM 0 HB3 LEU A 53 0.630 0.021 11.285 1.00 42.42 H new ATOM 0 HG LEU A 53 -1.275 0.784 13.519 1.00 22.24 H new ATOM 0 HD11 LEU A 53 -1.771 2.727 12.087 1.00 3.22 H new ATOM 0 HD12 LEU A 53 -0.061 2.688 12.578 1.00 3.22 H new ATOM 0 HD13 LEU A 53 -0.526 2.189 10.934 1.00 3.22 H new ATOM 0 HD21 LEU A 53 -3.036 0.627 11.802 1.00 13.13 H new ATOM 0 HD22 LEU A 53 -1.840 0.009 10.638 1.00 13.13 H new ATOM 0 HD23 LEU A 53 -2.249 -0.943 12.085 1.00 13.13 H new ATOM 820 N ASP A 54 1.139 -3.540 11.863 1.00 35.34 N ATOM 821 CA ASP A 54 2.139 -4.400 11.242 1.00 63.41 C ATOM 822 C ASP A 54 2.188 -4.172 9.735 1.00 2.34 C ATOM 823 O ASP A 54 1.400 -4.746 8.985 1.00 1.33 O ATOM 824 CB ASP A 54 1.833 -5.870 11.537 1.00 5.24 C ATOM 825 CG ASP A 54 2.011 -6.215 13.002 1.00 41.42 C ATOM 826 OD1 ASP A 54 1.590 -5.409 13.858 1.00 22.21 O ATOM 827 OD2 ASP A 54 2.574 -7.292 13.294 1.00 51.31 O ATOM 0 H ASP A 54 0.254 -4.003 12.071 1.00 35.34 H new ATOM 0 HA ASP A 54 3.112 -4.148 11.663 1.00 63.41 H new ATOM 0 HB2 ASP A 54 0.809 -6.093 11.236 1.00 5.24 H new ATOM 0 HB3 ASP A 54 2.487 -6.502 10.936 1.00 5.24 H new ATOM 832 N ILE A 55 3.119 -3.331 9.298 1.00 54.20 N ATOM 833 CA ILE A 55 3.266 -3.031 7.879 1.00 60.22 C ATOM 834 C ILE A 55 4.044 -4.128 7.165 1.00 1.42 C ATOM 835 O ILE A 55 5.226 -4.341 7.432 1.00 53.51 O ATOM 836 CB ILE A 55 3.981 -1.685 7.655 1.00 21.05 C ATOM 837 CG1 ILE A 55 3.373 -0.601 8.547 1.00 21.12 C ATOM 838 CG2 ILE A 55 3.900 -1.283 6.190 1.00 13.43 C ATOM 839 CD1 ILE A 55 1.876 -0.447 8.382 1.00 2.23 C ATOM 0 H ILE A 55 3.781 -2.846 9.904 1.00 54.20 H new ATOM 0 HA ILE A 55 2.259 -2.971 7.466 1.00 60.22 H new ATOM 0 HB ILE A 55 5.031 -1.799 7.924 1.00 21.05 H new ATOM 0 HG12 ILE A 55 3.593 -0.834 9.589 1.00 21.12 H new ATOM 0 HG13 ILE A 55 3.854 0.352 8.325 1.00 21.12 H new ATOM 0 HG21 ILE A 55 4.409 -0.330 6.045 1.00 13.43 H new ATOM 0 HG22 ILE A 55 4.378 -2.047 5.576 1.00 13.43 H new ATOM 0 HG23 ILE A 55 2.855 -1.184 5.897 1.00 13.43 H new ATOM 0 HD11 ILE A 55 1.516 0.339 9.046 1.00 2.23 H new ATOM 0 HD12 ILE A 55 1.649 -0.182 7.349 1.00 2.23 H new ATOM 0 HD13 ILE A 55 1.384 -1.387 8.632 1.00 2.23 H new ATOM 851 N LEU A 56 3.372 -4.822 6.254 1.00 45.15 N ATOM 852 CA LEU A 56 3.999 -5.897 5.497 1.00 11.01 C ATOM 853 C LEU A 56 4.319 -5.441 4.078 1.00 41.41 C ATOM 854 O LEU A 56 3.425 -5.294 3.245 1.00 72.24 O ATOM 855 CB LEU A 56 3.086 -7.127 5.470 1.00 24.12 C ATOM 856 CG LEU A 56 3.630 -8.337 4.704 1.00 41.34 C ATOM 857 CD1 LEU A 56 3.423 -8.161 3.209 1.00 63.24 C ATOM 858 CD2 LEU A 56 5.103 -8.559 5.015 1.00 63.24 C ATOM 0 H LEU A 56 2.392 -4.659 6.022 1.00 45.15 H new ATOM 0 HA LEU A 56 4.934 -6.165 5.988 1.00 11.01 H new ATOM 0 HB2 LEU A 56 2.884 -7.430 6.497 1.00 24.12 H new ATOM 0 HB3 LEU A 56 2.131 -6.839 5.029 1.00 24.12 H new ATOM 0 HG LEU A 56 3.077 -9.219 5.028 1.00 41.34 H new ATOM 0 HD11 LEU A 56 3.816 -9.031 2.682 1.00 63.24 H new ATOM 0 HD12 LEU A 56 2.358 -8.060 2.999 1.00 63.24 H new ATOM 0 HD13 LEU A 56 3.946 -7.266 2.872 1.00 63.24 H new ATOM 0 HD21 LEU A 56 5.466 -9.424 4.459 1.00 63.24 H new ATOM 0 HD22 LEU A 56 5.673 -7.676 4.726 1.00 63.24 H new ATOM 0 HD23 LEU A 56 5.227 -8.736 6.083 1.00 63.24 H new ATOM 870 N ASP A 57 5.601 -5.211 3.812 1.00 73.30 N ATOM 871 CA ASP A 57 6.041 -4.765 2.496 1.00 23.10 C ATOM 872 C ASP A 57 6.851 -5.850 1.797 1.00 10.20 C ATOM 873 O ASP A 57 7.944 -6.205 2.238 1.00 70.23 O ATOM 874 CB ASP A 57 6.877 -3.490 2.619 1.00 61.45 C ATOM 875 CG ASP A 57 6.834 -2.647 1.360 1.00 3.33 C ATOM 876 OD1 ASP A 57 6.566 -3.210 0.277 1.00 75.43 O ATOM 877 OD2 ASP A 57 7.069 -1.424 1.456 1.00 51.05 O ATOM 0 H ASP A 57 6.353 -5.326 4.491 1.00 73.30 H new ATOM 0 HA ASP A 57 5.155 -4.554 1.897 1.00 23.10 H new ATOM 0 HB2 ASP A 57 6.513 -2.900 3.460 1.00 61.45 H new ATOM 0 HB3 ASP A 57 7.911 -3.756 2.839 1.00 61.45 H new ATOM 882 N THR A 58 6.307 -6.373 0.704 1.00 21.24 N ATOM 883 CA THR A 58 6.980 -7.417 -0.056 1.00 25.14 C ATOM 884 C THR A 58 8.073 -6.825 -0.939 1.00 13.44 C ATOM 885 O THR A 58 8.369 -5.632 -0.863 1.00 21.42 O ATOM 886 CB THR A 58 5.973 -8.185 -0.913 1.00 53.34 C ATOM 887 OG1 THR A 58 5.626 -7.442 -2.068 1.00 34.44 O ATOM 888 CG2 THR A 58 4.692 -8.520 -0.180 1.00 13.12 C ATOM 0 H THR A 58 5.403 -6.091 0.326 1.00 21.24 H new ATOM 0 HA THR A 58 7.442 -8.107 0.650 1.00 25.14 H new ATOM 0 HB THR A 58 6.473 -9.116 -1.178 1.00 53.34 H new ATOM 0 HG1 THR A 58 4.982 -7.951 -2.603 1.00 34.44 H new ATOM 0 HG21 THR A 58 4.023 -9.064 -0.847 1.00 13.12 H new ATOM 0 HG22 THR A 58 4.921 -9.138 0.688 1.00 13.12 H new ATOM 0 HG23 THR A 58 4.208 -7.599 0.147 1.00 13.12 H new ATOM 896 N ALA A 59 8.671 -7.666 -1.776 1.00 62.50 N ATOM 897 CA ALA A 59 9.732 -7.225 -2.672 1.00 51.21 C ATOM 898 C ALA A 59 9.160 -6.587 -3.932 1.00 24.53 C ATOM 899 O ALA A 59 8.077 -6.952 -4.389 1.00 0.20 O ATOM 900 CB ALA A 59 10.634 -8.394 -3.036 1.00 14.40 C ATOM 0 H ALA A 59 8.439 -8.656 -1.852 1.00 62.50 H new ATOM 0 HA ALA A 59 10.322 -6.471 -2.151 1.00 51.21 H new ATOM 0 HB1 ALA A 59 11.422 -8.050 -3.706 1.00 14.40 H new ATOM 0 HB2 ALA A 59 11.081 -8.805 -2.130 1.00 14.40 H new ATOM 0 HB3 ALA A 59 10.046 -9.166 -3.533 1.00 14.40 H new ATOM 906 N GLY A 60 9.896 -5.632 -4.490 1.00 41.35 N ATOM 907 CA GLY A 60 9.451 -4.958 -5.695 1.00 71.14 C ATOM 908 C GLY A 60 10.342 -5.246 -6.890 1.00 52.20 C ATOM 909 O GLY A 60 10.056 -4.806 -8.004 1.00 34.03 O ATOM 0 H GLY A 60 10.795 -5.312 -4.128 1.00 41.35 H new ATOM 0 HA2 GLY A 60 8.431 -5.268 -5.924 1.00 71.14 H new ATOM 0 HA3 GLY A 60 9.425 -3.883 -5.517 1.00 71.14 H new ATOM 913 N GLN A 61 11.424 -5.987 -6.662 1.00 50.31 N ATOM 914 CA GLN A 61 12.355 -6.330 -7.731 1.00 21.42 C ATOM 915 C GLN A 61 12.608 -7.834 -7.768 1.00 42.55 C ATOM 916 O GLN A 61 13.734 -8.279 -7.993 1.00 62.42 O ATOM 917 CB GLN A 61 13.676 -5.581 -7.543 1.00 10.02 C ATOM 918 CG GLN A 61 13.543 -4.073 -7.680 1.00 3.32 C ATOM 919 CD GLN A 61 14.648 -3.462 -8.519 1.00 32.13 C ATOM 920 OE1 GLN A 61 14.393 -2.636 -9.395 1.00 53.35 O ATOM 921 NE2 GLN A 61 15.884 -3.868 -8.255 1.00 61.25 N ATOM 0 H GLN A 61 11.676 -6.360 -5.747 1.00 50.31 H new ATOM 0 HA GLN A 61 11.909 -6.032 -8.680 1.00 21.42 H new ATOM 0 HB2 GLN A 61 14.080 -5.814 -6.558 1.00 10.02 H new ATOM 0 HB3 GLN A 61 14.397 -5.942 -8.276 1.00 10.02 H new ATOM 0 HG2 GLN A 61 12.578 -3.837 -8.129 1.00 3.32 H new ATOM 0 HG3 GLN A 61 13.552 -3.620 -6.689 1.00 3.32 H new ATOM 0 HE21 GLN A 61 16.049 -4.555 -7.519 1.00 61.25 H new ATOM 0 HE22 GLN A 61 16.669 -3.493 -8.788 1.00 61.25 H new ATOM 930 N GLU A 62 11.553 -8.613 -7.546 1.00 54.23 N ATOM 931 CA GLU A 62 11.661 -10.068 -7.555 1.00 33.32 C ATOM 932 C GLU A 62 10.282 -10.715 -7.628 1.00 61.23 C ATOM 933 O GLU A 62 9.301 -10.169 -7.123 1.00 22.53 O ATOM 934 CB GLU A 62 12.404 -10.553 -6.308 1.00 43.15 C ATOM 935 CG GLU A 62 13.721 -11.246 -6.617 1.00 70.01 C ATOM 936 CD GLU A 62 14.813 -10.892 -5.627 1.00 53.43 C ATOM 937 OE1 GLU A 62 15.329 -9.757 -5.695 1.00 5.12 O ATOM 938 OE2 GLU A 62 15.150 -11.749 -4.784 1.00 52.04 O ATOM 0 H GLU A 62 10.614 -8.261 -7.358 1.00 54.23 H new ATOM 0 HA GLU A 62 12.225 -10.361 -8.440 1.00 33.32 H new ATOM 0 HB2 GLU A 62 12.595 -9.702 -5.655 1.00 43.15 H new ATOM 0 HB3 GLU A 62 11.762 -11.240 -5.757 1.00 43.15 H new ATOM 0 HG2 GLU A 62 13.569 -12.325 -6.614 1.00 70.01 H new ATOM 0 HG3 GLU A 62 14.044 -10.973 -7.622 1.00 70.01 H new ATOM 945 N GLU A 63 10.215 -11.884 -8.259 1.00 71.41 N ATOM 946 CA GLU A 63 8.956 -12.606 -8.396 1.00 4.34 C ATOM 947 C GLU A 63 8.412 -13.011 -7.028 1.00 35.20 C ATOM 948 O GLU A 63 7.513 -12.363 -6.492 1.00 71.13 O ATOM 949 CB GLU A 63 9.145 -13.843 -9.279 1.00 24.12 C ATOM 950 CG GLU A 63 7.890 -14.690 -9.423 1.00 71.32 C ATOM 951 CD GLU A 63 8.122 -16.145 -9.063 1.00 11.51 C ATOM 952 OE1 GLU A 63 8.459 -16.420 -7.892 1.00 11.42 O ATOM 953 OE2 GLU A 63 7.967 -17.008 -9.952 1.00 30.31 O ATOM 0 H GLU A 63 11.017 -12.350 -8.683 1.00 71.41 H new ATOM 0 HA GLU A 63 8.232 -11.943 -8.870 1.00 4.34 H new ATOM 0 HB2 GLU A 63 9.473 -13.525 -10.269 1.00 24.12 H new ATOM 0 HB3 GLU A 63 9.942 -14.458 -8.861 1.00 24.12 H new ATOM 0 HG2 GLU A 63 7.106 -14.282 -8.785 1.00 71.32 H new ATOM 0 HG3 GLU A 63 7.530 -14.627 -10.450 1.00 71.32 H new ATOM 960 N TYR A 64 8.962 -14.085 -6.468 1.00 5.54 N ATOM 961 CA TYR A 64 8.532 -14.575 -5.162 1.00 75.52 C ATOM 962 C TYR A 64 7.012 -14.712 -5.102 1.00 60.10 C ATOM 963 O TYR A 64 6.397 -14.479 -4.062 1.00 22.24 O ATOM 964 CB TYR A 64 9.021 -13.635 -4.058 1.00 21.30 C ATOM 965 CG TYR A 64 10.203 -14.176 -3.285 1.00 23.00 C ATOM 966 CD1 TYR A 64 10.211 -15.484 -2.819 1.00 42.33 C ATOM 967 CD2 TYR A 64 11.309 -13.378 -3.021 1.00 50.10 C ATOM 968 CE1 TYR A 64 11.288 -15.983 -2.111 1.00 74.11 C ATOM 969 CE2 TYR A 64 12.390 -13.869 -2.314 1.00 54.54 C ATOM 970 CZ TYR A 64 12.374 -15.172 -1.861 1.00 24.54 C ATOM 971 OH TYR A 64 13.448 -15.665 -1.157 1.00 42.10 O ATOM 0 H TYR A 64 9.707 -14.633 -6.899 1.00 5.54 H new ATOM 0 HA TYR A 64 8.969 -15.562 -5.008 1.00 75.52 H new ATOM 0 HB2 TYR A 64 9.294 -12.678 -4.502 1.00 21.30 H new ATOM 0 HB3 TYR A 64 8.201 -13.443 -3.366 1.00 21.30 H new ATOM 0 HD1 TYR A 64 9.361 -16.122 -3.013 1.00 42.33 H new ATOM 0 HD2 TYR A 64 11.324 -12.357 -3.374 1.00 50.10 H new ATOM 0 HE1 TYR A 64 11.279 -17.003 -1.756 1.00 74.11 H new ATOM 0 HE2 TYR A 64 13.243 -13.236 -2.117 1.00 54.54 H new ATOM 0 HH TYR A 64 14.130 -14.966 -1.068 1.00 42.10 H new ATOM 981 N SER A 65 6.414 -15.091 -6.227 1.00 32.00 N ATOM 982 CA SER A 65 4.967 -15.258 -6.304 1.00 73.32 C ATOM 983 C SER A 65 4.479 -16.264 -5.269 1.00 73.12 C ATOM 984 O SER A 65 3.387 -16.123 -4.719 1.00 71.01 O ATOM 985 CB SER A 65 4.561 -15.713 -7.705 1.00 31.11 C ATOM 986 OG SER A 65 5.065 -17.007 -7.989 1.00 73.53 O ATOM 0 H SER A 65 6.908 -15.288 -7.097 1.00 32.00 H new ATOM 0 HA SER A 65 4.503 -14.294 -6.093 1.00 73.32 H new ATOM 0 HB2 SER A 65 3.474 -15.717 -7.789 1.00 31.11 H new ATOM 0 HB3 SER A 65 4.935 -15.004 -8.443 1.00 31.11 H new ATOM 0 HG SER A 65 4.789 -17.275 -8.891 1.00 73.53 H new ATOM 992 N ALA A 66 5.298 -17.279 -5.004 1.00 72.12 N ATOM 993 CA ALA A 66 4.951 -18.307 -4.031 1.00 61.41 C ATOM 994 C ALA A 66 4.604 -17.688 -2.681 1.00 43.03 C ATOM 995 O ALA A 66 3.596 -18.036 -2.067 1.00 1.13 O ATOM 996 CB ALA A 66 6.096 -19.298 -3.881 1.00 4.34 C ATOM 0 H ALA A 66 6.206 -17.410 -5.450 1.00 72.12 H new ATOM 0 HA ALA A 66 4.071 -18.837 -4.395 1.00 61.41 H new ATOM 0 HB1 ALA A 66 5.824 -20.061 -3.151 1.00 4.34 H new ATOM 0 HB2 ALA A 66 6.296 -19.771 -4.842 1.00 4.34 H new ATOM 0 HB3 ALA A 66 6.989 -18.773 -3.542 1.00 4.34 H new ATOM 1002 N MET A 67 5.445 -16.763 -2.229 1.00 61.04 N ATOM 1003 CA MET A 67 5.226 -16.090 -0.954 1.00 23.05 C ATOM 1004 C MET A 67 4.268 -14.917 -1.117 1.00 4.13 C ATOM 1005 O MET A 67 3.522 -14.581 -0.197 1.00 24.35 O ATOM 1006 CB MET A 67 6.552 -15.600 -0.373 1.00 75.23 C ATOM 1007 CG MET A 67 7.327 -14.684 -1.306 1.00 43.52 C ATOM 1008 SD MET A 67 8.734 -13.892 -0.498 1.00 62.22 S ATOM 1009 CE MET A 67 9.299 -15.205 0.582 1.00 31.05 C ATOM 0 H MET A 67 6.283 -16.463 -2.726 1.00 61.04 H new ATOM 0 HA MET A 67 4.781 -16.809 -0.266 1.00 23.05 H new ATOM 0 HB2 MET A 67 6.356 -15.072 0.560 1.00 75.23 H new ATOM 0 HB3 MET A 67 7.172 -16.462 -0.128 1.00 75.23 H new ATOM 0 HG2 MET A 67 7.681 -15.259 -2.161 1.00 43.52 H new ATOM 0 HG3 MET A 67 6.657 -13.917 -1.694 1.00 43.52 H new ATOM 0 HE1 MET A 67 10.207 -14.889 1.095 1.00 31.05 H new ATOM 0 HE2 MET A 67 8.526 -15.429 1.317 1.00 31.05 H new ATOM 0 HE3 MET A 67 9.508 -16.097 -0.008 1.00 31.05 H new ATOM 1019 N ARG A 68 4.291 -14.297 -2.294 1.00 61.32 N ATOM 1020 CA ARG A 68 3.421 -13.160 -2.575 1.00 74.53 C ATOM 1021 C ARG A 68 1.967 -13.503 -2.264 1.00 52.34 C ATOM 1022 O ARG A 68 1.240 -12.702 -1.676 1.00 14.21 O ATOM 1023 CB ARG A 68 3.560 -12.738 -4.039 1.00 3.40 C ATOM 1024 CG ARG A 68 2.746 -11.507 -4.402 1.00 24.12 C ATOM 1025 CD ARG A 68 3.415 -10.708 -5.508 1.00 72.42 C ATOM 1026 NE ARG A 68 3.437 -11.438 -6.773 1.00 14.54 N ATOM 1027 CZ ARG A 68 2.418 -11.472 -7.629 1.00 72.40 C ATOM 1028 NH1 ARG A 68 1.292 -10.823 -7.360 1.00 53.43 N ATOM 1029 NH2 ARG A 68 2.522 -12.162 -8.758 1.00 44.23 N ATOM 0 H ARG A 68 4.902 -14.563 -3.067 1.00 61.32 H new ATOM 0 HA ARG A 68 3.724 -12.330 -1.936 1.00 74.53 H new ATOM 0 HB2 ARG A 68 4.611 -12.543 -4.253 1.00 3.40 H new ATOM 0 HB3 ARG A 68 3.253 -13.567 -4.677 1.00 3.40 H new ATOM 0 HG2 ARG A 68 1.749 -11.809 -4.721 1.00 24.12 H new ATOM 0 HG3 ARG A 68 2.621 -10.878 -3.521 1.00 24.12 H new ATOM 0 HD2 ARG A 68 2.887 -9.764 -5.643 1.00 72.42 H new ATOM 0 HD3 ARG A 68 4.435 -10.464 -5.213 1.00 72.42 H new ATOM 0 HE ARG A 68 4.284 -11.953 -7.015 1.00 14.54 H new ATOM 0 HH11 ARG A 68 1.203 -10.294 -6.493 1.00 53.43 H new ATOM 0 HH12 ARG A 68 0.515 -10.854 -8.021 1.00 53.43 H new ATOM 0 HH21 ARG A 68 3.383 -12.666 -8.970 1.00 44.23 H new ATOM 0 HH22 ARG A 68 1.741 -12.188 -9.414 1.00 44.23 H new ATOM 1043 N ASP A 69 1.554 -14.705 -2.655 1.00 31.45 N ATOM 1044 CA ASP A 69 0.192 -15.165 -2.412 1.00 75.50 C ATOM 1045 C ASP A 69 -0.054 -15.330 -0.916 1.00 43.14 C ATOM 1046 O ASP A 69 -1.129 -15.005 -0.412 1.00 1.31 O ATOM 1047 CB ASP A 69 -0.056 -16.494 -3.132 1.00 30.30 C ATOM 1048 CG ASP A 69 -1.455 -17.037 -2.900 1.00 61.43 C ATOM 1049 OD1 ASP A 69 -2.222 -16.404 -2.145 1.00 5.51 O ATOM 1050 OD2 ASP A 69 -1.781 -18.099 -3.472 1.00 52.43 O ATOM 0 H ASP A 69 2.145 -15.379 -3.142 1.00 31.45 H new ATOM 0 HA ASP A 69 -0.499 -14.418 -2.802 1.00 75.50 H new ATOM 0 HB2 ASP A 69 0.103 -16.358 -4.202 1.00 30.30 H new ATOM 0 HB3 ASP A 69 0.675 -17.228 -2.792 1.00 30.30 H new ATOM 1055 N GLN A 70 0.953 -15.835 -0.213 1.00 24.30 N ATOM 1056 CA GLN A 70 0.851 -16.042 1.225 1.00 43.21 C ATOM 1057 C GLN A 70 0.611 -14.718 1.943 1.00 72.30 C ATOM 1058 O GLN A 70 -0.162 -14.651 2.897 1.00 74.31 O ATOM 1059 CB GLN A 70 2.124 -16.708 1.757 1.00 34.11 C ATOM 1060 CG GLN A 70 2.159 -16.839 3.272 1.00 34.03 C ATOM 1061 CD GLN A 70 2.837 -18.114 3.734 1.00 22.44 C ATOM 1062 OE1 GLN A 70 2.673 -19.173 3.127 1.00 41.45 O ATOM 1063 NE2 GLN A 70 3.604 -18.018 4.814 1.00 11.13 N ATOM 0 H GLN A 70 1.849 -16.108 -0.616 1.00 24.30 H new ATOM 0 HA GLN A 70 0.003 -16.699 1.418 1.00 43.21 H new ATOM 0 HB2 GLN A 70 2.217 -17.699 1.313 1.00 34.11 H new ATOM 0 HB3 GLN A 70 2.989 -16.130 1.431 1.00 34.11 H new ATOM 0 HG2 GLN A 70 2.682 -15.981 3.695 1.00 34.03 H new ATOM 0 HG3 GLN A 70 1.140 -16.814 3.658 1.00 34.03 H new ATOM 0 HE21 GLN A 70 3.711 -17.120 5.285 1.00 11.13 H new ATOM 0 HE22 GLN A 70 4.086 -18.843 5.172 1.00 11.13 H new ATOM 1072 N TYR A 71 1.280 -13.668 1.478 1.00 61.11 N ATOM 1073 CA TYR A 71 1.139 -12.348 2.081 1.00 15.42 C ATOM 1074 C TYR A 71 -0.312 -11.888 2.059 1.00 32.34 C ATOM 1075 O TYR A 71 -0.772 -11.211 2.978 1.00 35.34 O ATOM 1076 CB TYR A 71 2.034 -11.341 1.365 1.00 53.41 C ATOM 1077 CG TYR A 71 3.493 -11.514 1.711 1.00 21.24 C ATOM 1078 CD1 TYR A 71 3.938 -11.331 3.011 1.00 21.43 C ATOM 1079 CD2 TYR A 71 4.420 -11.873 0.746 1.00 43.51 C ATOM 1080 CE1 TYR A 71 5.269 -11.499 3.339 1.00 64.43 C ATOM 1081 CE2 TYR A 71 5.752 -12.043 1.063 1.00 63.12 C ATOM 1082 CZ TYR A 71 6.173 -11.855 2.362 1.00 41.30 C ATOM 1083 OH TYR A 71 7.499 -12.025 2.685 1.00 34.15 O ATOM 0 H TYR A 71 1.924 -13.705 0.688 1.00 61.11 H new ATOM 0 HA TYR A 71 1.452 -12.414 3.123 1.00 15.42 H new ATOM 0 HB2 TYR A 71 1.905 -11.447 0.288 1.00 53.41 H new ATOM 0 HB3 TYR A 71 1.720 -10.331 1.626 1.00 53.41 H new ATOM 0 HD1 TYR A 71 3.232 -11.053 3.780 1.00 21.43 H new ATOM 0 HD2 TYR A 71 4.094 -12.022 -0.273 1.00 43.51 H new ATOM 0 HE1 TYR A 71 5.600 -11.352 4.357 1.00 64.43 H new ATOM 0 HE2 TYR A 71 6.461 -12.322 0.297 1.00 63.12 H new ATOM 0 HH TYR A 71 7.655 -11.712 3.600 1.00 34.15 H new ATOM 1093 N MET A 72 -1.037 -12.275 1.016 1.00 61.13 N ATOM 1094 CA MET A 72 -2.442 -11.913 0.896 1.00 20.22 C ATOM 1095 C MET A 72 -3.261 -12.661 1.942 1.00 60.34 C ATOM 1096 O MET A 72 -4.175 -12.104 2.550 1.00 73.11 O ATOM 1097 CB MET A 72 -2.961 -12.231 -0.507 1.00 2.41 C ATOM 1098 CG MET A 72 -2.015 -11.804 -1.617 1.00 1.32 C ATOM 1099 SD MET A 72 -2.881 -11.259 -3.102 1.00 41.42 S ATOM 1100 CE MET A 72 -1.785 -9.964 -3.678 1.00 33.45 C ATOM 0 H MET A 72 -0.676 -12.837 0.245 1.00 61.13 H new ATOM 0 HA MET A 72 -2.542 -10.841 1.065 1.00 20.22 H new ATOM 0 HB2 MET A 72 -3.139 -13.304 -0.585 1.00 2.41 H new ATOM 0 HB3 MET A 72 -3.922 -11.737 -0.650 1.00 2.41 H new ATOM 0 HG2 MET A 72 -1.379 -10.996 -1.255 1.00 1.32 H new ATOM 0 HG3 MET A 72 -1.359 -12.637 -1.870 1.00 1.32 H new ATOM 0 HE1 MET A 72 -2.336 -9.283 -4.326 1.00 33.45 H new ATOM 0 HE2 MET A 72 -1.392 -9.413 -2.823 1.00 33.45 H new ATOM 0 HE3 MET A 72 -0.960 -10.407 -4.235 1.00 33.45 H new ATOM 1110 N ARG A 73 -2.917 -13.929 2.149 1.00 14.23 N ATOM 1111 CA ARG A 73 -3.608 -14.763 3.126 1.00 2.12 C ATOM 1112 C ARG A 73 -3.089 -14.505 4.542 1.00 21.51 C ATOM 1113 O ARG A 73 -3.706 -14.927 5.520 1.00 21.20 O ATOM 1114 CB ARG A 73 -3.443 -16.242 2.773 1.00 33.51 C ATOM 1115 CG ARG A 73 -3.843 -16.576 1.344 1.00 41.41 C ATOM 1116 CD ARG A 73 -4.003 -18.076 1.138 1.00 63.13 C ATOM 1117 NE ARG A 73 -3.005 -18.846 1.878 1.00 44.31 N ATOM 1118 CZ ARG A 73 -1.734 -18.966 1.501 1.00 72.54 C ATOM 1119 NH1 ARG A 73 -1.303 -18.371 0.396 1.00 41.21 N ATOM 1120 NH2 ARG A 73 -0.892 -19.684 2.231 1.00 54.04 N ATOM 0 H ARG A 73 -2.162 -14.402 1.652 1.00 14.23 H new ATOM 0 HA ARG A 73 -4.666 -14.503 3.097 1.00 2.12 H new ATOM 0 HB2 ARG A 73 -2.403 -16.530 2.927 1.00 33.51 H new ATOM 0 HB3 ARG A 73 -4.044 -16.840 3.459 1.00 33.51 H new ATOM 0 HG2 ARG A 73 -4.780 -16.074 1.102 1.00 41.41 H new ATOM 0 HG3 ARG A 73 -3.089 -16.193 0.656 1.00 41.41 H new ATOM 0 HD2 ARG A 73 -5.001 -18.380 1.454 1.00 63.13 H new ATOM 0 HD3 ARG A 73 -3.922 -18.306 0.076 1.00 63.13 H new ATOM 0 HE ARG A 73 -3.299 -19.319 2.733 1.00 44.31 H new ATOM 0 HH11 ARG A 73 -1.947 -17.818 -0.170 1.00 41.21 H new ATOM 0 HH12 ARG A 73 -0.328 -18.467 0.112 1.00 41.21 H new ATOM 0 HH21 ARG A 73 -1.218 -20.144 3.081 1.00 54.04 H new ATOM 0 HH22 ARG A 73 0.082 -19.776 1.943 1.00 54.04 H new ATOM 1134 N THR A 74 -1.958 -13.807 4.649 1.00 4.20 N ATOM 1135 CA THR A 74 -1.374 -13.495 5.949 1.00 31.31 C ATOM 1136 C THR A 74 -1.758 -12.085 6.389 1.00 53.41 C ATOM 1137 O THR A 74 -1.672 -11.747 7.569 1.00 45.11 O ATOM 1138 CB THR A 74 0.152 -13.612 5.902 1.00 65.15 C ATOM 1139 OG1 THR A 74 0.697 -12.652 5.019 1.00 33.45 O ATOM 1140 CG2 THR A 74 0.646 -14.974 5.463 1.00 74.34 C ATOM 0 H THR A 74 -1.431 -13.449 3.852 1.00 4.20 H new ATOM 0 HA THR A 74 -1.765 -14.214 6.668 1.00 31.31 H new ATOM 0 HB THR A 74 0.482 -13.445 6.927 1.00 65.15 H new ATOM 0 HG1 THR A 74 0.756 -11.786 5.473 1.00 33.45 H new ATOM 0 HG21 THR A 74 1.736 -14.980 5.454 1.00 74.34 H new ATOM 0 HG22 THR A 74 0.284 -15.733 6.157 1.00 74.34 H new ATOM 0 HG23 THR A 74 0.274 -15.191 4.462 1.00 74.34 H new ATOM 1148 N GLY A 75 -2.167 -11.260 5.427 1.00 25.50 N ATOM 1149 CA GLY A 75 -2.537 -9.893 5.733 1.00 32.25 C ATOM 1150 C GLY A 75 -4.027 -9.703 5.933 1.00 14.20 C ATOM 1151 O GLY A 75 -4.835 -10.501 5.458 1.00 34.13 O ATOM 0 H GLY A 75 -2.248 -11.516 4.443 1.00 25.50 H new ATOM 0 HA2 GLY A 75 -2.014 -9.576 6.635 1.00 32.25 H new ATOM 0 HA3 GLY A 75 -2.201 -9.244 4.925 1.00 32.25 H new ATOM 1155 N GLU A 76 -4.385 -8.630 6.632 1.00 45.22 N ATOM 1156 CA GLU A 76 -5.783 -8.310 6.895 1.00 4.24 C ATOM 1157 C GLU A 76 -6.271 -7.206 5.958 1.00 44.32 C ATOM 1158 O GLU A 76 -7.473 -6.986 5.816 1.00 41.11 O ATOM 1159 CB GLU A 76 -5.965 -7.875 8.351 1.00 34.30 C ATOM 1160 CG GLU A 76 -5.248 -8.769 9.351 1.00 41.21 C ATOM 1161 CD GLU A 76 -6.151 -9.218 10.485 1.00 23.55 C ATOM 1162 OE1 GLU A 76 -6.907 -8.374 11.011 1.00 3.44 O ATOM 1163 OE2 GLU A 76 -6.101 -10.412 10.847 1.00 23.13 O ATOM 0 H GLU A 76 -3.721 -7.964 7.028 1.00 45.22 H new ATOM 0 HA GLU A 76 -6.376 -9.207 6.715 1.00 4.24 H new ATOM 0 HB2 GLU A 76 -5.601 -6.854 8.464 1.00 34.30 H new ATOM 0 HB3 GLU A 76 -7.029 -7.862 8.587 1.00 34.30 H new ATOM 0 HG2 GLU A 76 -4.857 -9.645 8.834 1.00 41.21 H new ATOM 0 HG3 GLU A 76 -4.392 -8.234 9.763 1.00 41.21 H new ATOM 1170 N GLY A 77 -5.329 -6.515 5.319 1.00 64.44 N ATOM 1171 CA GLY A 77 -5.681 -5.445 4.403 1.00 24.22 C ATOM 1172 C GLY A 77 -4.667 -5.284 3.286 1.00 24.10 C ATOM 1173 O GLY A 77 -3.549 -5.792 3.379 1.00 45.13 O ATOM 0 H GLY A 77 -4.327 -6.678 5.420 1.00 64.44 H new ATOM 0 HA2 GLY A 77 -6.662 -5.646 3.973 1.00 24.22 H new ATOM 0 HA3 GLY A 77 -5.761 -4.509 4.955 1.00 24.22 H new ATOM 1177 N PHE A 78 -5.055 -4.582 2.226 1.00 52.24 N ATOM 1178 CA PHE A 78 -4.166 -4.367 1.089 1.00 41.51 C ATOM 1179 C PHE A 78 -4.125 -2.895 0.691 1.00 62.23 C ATOM 1180 O PHE A 78 -5.134 -2.195 0.753 1.00 35.44 O ATOM 1181 CB PHE A 78 -4.616 -5.222 -0.097 1.00 72.52 C ATOM 1182 CG PHE A 78 -4.664 -6.691 0.216 1.00 54.12 C ATOM 1183 CD1 PHE A 78 -5.566 -7.185 1.145 1.00 24.33 C ATOM 1184 CD2 PHE A 78 -3.800 -7.576 -0.410 1.00 52.23 C ATOM 1185 CE1 PHE A 78 -5.607 -8.533 1.442 1.00 10.23 C ATOM 1186 CE2 PHE A 78 -3.835 -8.925 -0.115 1.00 34.53 C ATOM 1187 CZ PHE A 78 -4.740 -9.405 0.812 1.00 42.44 C ATOM 0 H PHE A 78 -5.976 -4.154 2.130 1.00 52.24 H new ATOM 0 HA PHE A 78 -3.160 -4.664 1.384 1.00 41.51 H new ATOM 0 HB2 PHE A 78 -5.604 -4.893 -0.419 1.00 72.52 H new ATOM 0 HB3 PHE A 78 -3.937 -5.057 -0.934 1.00 72.52 H new ATOM 0 HD1 PHE A 78 -6.245 -6.508 1.642 1.00 24.33 H new ATOM 0 HD2 PHE A 78 -3.091 -7.207 -1.137 1.00 52.23 H new ATOM 0 HE1 PHE A 78 -6.316 -8.905 2.166 1.00 10.23 H new ATOM 0 HE2 PHE A 78 -3.155 -9.604 -0.609 1.00 34.53 H new ATOM 0 HZ PHE A 78 -4.770 -10.459 1.044 1.00 42.44 H new ATOM 1197 N LEU A 79 -2.947 -2.433 0.282 1.00 34.44 N ATOM 1198 CA LEU A 79 -2.771 -1.044 -0.127 1.00 15.24 C ATOM 1199 C LEU A 79 -2.141 -0.961 -1.515 1.00 54.41 C ATOM 1200 O LEU A 79 -1.015 -1.410 -1.724 1.00 11.21 O ATOM 1201 CB LEU A 79 -1.900 -0.300 0.889 1.00 62.52 C ATOM 1202 CG LEU A 79 -2.403 1.094 1.276 1.00 63.42 C ATOM 1203 CD1 LEU A 79 -2.571 1.203 2.784 1.00 34.15 C ATOM 1204 CD2 LEU A 79 -1.451 2.166 0.767 1.00 41.31 C ATOM 0 H LEU A 79 -2.101 -3.000 0.225 1.00 34.44 H new ATOM 0 HA LEU A 79 -3.754 -0.574 -0.167 1.00 15.24 H new ATOM 0 HB2 LEU A 79 -1.824 -0.906 1.792 1.00 62.52 H new ATOM 0 HB3 LEU A 79 -0.893 -0.206 0.482 1.00 62.52 H new ATOM 0 HG LEU A 79 -3.376 1.248 0.810 1.00 63.42 H new ATOM 0 HD11 LEU A 79 -2.929 2.200 3.039 1.00 34.15 H new ATOM 0 HD12 LEU A 79 -3.293 0.460 3.124 1.00 34.15 H new ATOM 0 HD13 LEU A 79 -1.612 1.026 3.271 1.00 34.15 H new ATOM 0 HD21 LEU A 79 -1.825 3.150 1.051 1.00 41.31 H new ATOM 0 HD22 LEU A 79 -0.464 2.013 1.203 1.00 41.31 H new ATOM 0 HD23 LEU A 79 -1.381 2.105 -0.319 1.00 41.31 H new ATOM 1216 N CYS A 80 -2.876 -0.382 -2.460 1.00 53.35 N ATOM 1217 CA CYS A 80 -2.388 -0.240 -3.827 1.00 40.12 C ATOM 1218 C CYS A 80 -1.793 1.146 -4.052 1.00 72.30 C ATOM 1219 O CYS A 80 -2.521 2.126 -4.216 1.00 2.44 O ATOM 1220 CB CYS A 80 -3.520 -0.490 -4.826 1.00 10.14 C ATOM 1221 SG CYS A 80 -3.699 -2.221 -5.318 1.00 43.43 S ATOM 0 H CYS A 80 -3.811 -0.004 -2.304 1.00 53.35 H new ATOM 0 HA CYS A 80 -1.605 -0.982 -3.984 1.00 40.12 H new ATOM 0 HB2 CYS A 80 -4.458 -0.148 -4.389 1.00 10.14 H new ATOM 0 HB3 CYS A 80 -3.345 0.114 -5.716 1.00 10.14 H new ATOM 0 HG CYS A 80 -4.670 -2.765 -4.647 1.00 43.43 H new ATOM 1227 N VAL A 81 -0.466 1.221 -4.058 1.00 72.41 N ATOM 1228 CA VAL A 81 0.227 2.487 -4.263 1.00 32.32 C ATOM 1229 C VAL A 81 0.959 2.504 -5.602 1.00 12.12 C ATOM 1230 O VAL A 81 1.709 1.583 -5.922 1.00 43.34 O ATOM 1231 CB VAL A 81 1.236 2.765 -3.130 1.00 65.21 C ATOM 1232 CG1 VAL A 81 2.285 1.666 -3.062 1.00 73.54 C ATOM 1233 CG2 VAL A 81 1.891 4.127 -3.315 1.00 41.43 C ATOM 0 H VAL A 81 0.151 0.420 -3.923 1.00 72.41 H new ATOM 0 HA VAL A 81 -0.533 3.268 -4.260 1.00 32.32 H new ATOM 0 HB VAL A 81 0.693 2.775 -2.185 1.00 65.21 H new ATOM 0 HG11 VAL A 81 2.987 1.882 -2.256 1.00 73.54 H new ATOM 0 HG12 VAL A 81 1.798 0.709 -2.873 1.00 73.54 H new ATOM 0 HG13 VAL A 81 2.823 1.618 -4.009 1.00 73.54 H new ATOM 0 HG21 VAL A 81 2.599 4.303 -2.505 1.00 41.43 H new ATOM 0 HG22 VAL A 81 2.418 4.151 -4.269 1.00 41.43 H new ATOM 0 HG23 VAL A 81 1.126 4.903 -3.303 1.00 41.43 H new ATOM 1243 N PHE A 82 0.735 3.558 -6.378 1.00 54.33 N ATOM 1244 CA PHE A 82 1.375 3.698 -7.681 1.00 21.22 C ATOM 1245 C PHE A 82 1.726 5.157 -7.959 1.00 13.15 C ATOM 1246 O PHE A 82 1.215 6.064 -7.304 1.00 24.21 O ATOM 1247 CB PHE A 82 0.462 3.155 -8.785 1.00 41.14 C ATOM 1248 CG PHE A 82 -0.729 4.027 -9.072 1.00 21.21 C ATOM 1249 CD1 PHE A 82 -1.861 3.961 -8.276 1.00 45.20 C ATOM 1250 CD2 PHE A 82 -0.714 4.912 -10.138 1.00 15.25 C ATOM 1251 CE1 PHE A 82 -2.956 4.762 -8.537 1.00 5.41 C ATOM 1252 CE2 PHE A 82 -1.806 5.715 -10.405 1.00 21.11 C ATOM 1253 CZ PHE A 82 -2.929 5.640 -9.604 1.00 42.10 C ATOM 0 H PHE A 82 0.115 4.328 -6.128 1.00 54.33 H new ATOM 0 HA PHE A 82 2.298 3.118 -7.670 1.00 21.22 H new ATOM 0 HB2 PHE A 82 1.044 3.038 -9.699 1.00 41.14 H new ATOM 0 HB3 PHE A 82 0.113 2.162 -8.500 1.00 41.14 H new ATOM 0 HD1 PHE A 82 -1.888 3.276 -7.442 1.00 45.20 H new ATOM 0 HD2 PHE A 82 0.161 4.975 -10.767 1.00 15.25 H new ATOM 0 HE1 PHE A 82 -3.832 4.702 -7.908 1.00 5.41 H new ATOM 0 HE2 PHE A 82 -1.782 6.401 -11.239 1.00 21.11 H new ATOM 0 HZ PHE A 82 -3.784 6.266 -9.811 1.00 42.10 H new ATOM 1263 N ALA A 83 2.600 5.374 -8.936 1.00 24.25 N ATOM 1264 CA ALA A 83 3.017 6.722 -9.301 1.00 51.03 C ATOM 1265 C ALA A 83 2.215 7.239 -10.491 1.00 24.32 C ATOM 1266 O ALA A 83 2.101 6.566 -11.515 1.00 50.41 O ATOM 1267 CB ALA A 83 4.506 6.748 -9.611 1.00 34.33 C ATOM 0 H ALA A 83 3.033 4.634 -9.489 1.00 24.25 H new ATOM 0 HA ALA A 83 2.824 7.379 -8.453 1.00 51.03 H new ATOM 0 HB1 ALA A 83 4.804 7.761 -9.882 1.00 34.33 H new ATOM 0 HB2 ALA A 83 5.066 6.428 -8.732 1.00 34.33 H new ATOM 0 HB3 ALA A 83 4.717 6.074 -10.441 1.00 34.33 H new ATOM 1273 N ILE A 84 1.659 8.438 -10.347 1.00 55.11 N ATOM 1274 CA ILE A 84 0.865 9.045 -11.408 1.00 72.21 C ATOM 1275 C ILE A 84 1.730 9.399 -12.612 1.00 61.05 C ATOM 1276 O ILE A 84 1.267 9.369 -13.753 1.00 11.03 O ATOM 1277 CB ILE A 84 0.146 10.316 -10.916 1.00 50.05 C ATOM 1278 CG1 ILE A 84 1.145 11.285 -10.284 1.00 43.54 C ATOM 1279 CG2 ILE A 84 -0.942 9.953 -9.920 1.00 4.41 C ATOM 1280 CD1 ILE A 84 0.711 12.733 -10.356 1.00 35.13 C ATOM 0 H ILE A 84 1.744 9.008 -9.505 1.00 55.11 H new ATOM 0 HA ILE A 84 0.120 8.306 -11.705 1.00 72.21 H new ATOM 0 HB ILE A 84 -0.315 10.807 -11.773 1.00 50.05 H new ATOM 0 HG12 ILE A 84 1.294 11.010 -9.240 1.00 43.54 H new ATOM 0 HG13 ILE A 84 2.108 11.178 -10.783 1.00 43.54 H new ATOM 0 HG21 ILE A 84 -1.442 10.860 -9.580 1.00 4.41 H new ATOM 0 HG22 ILE A 84 -1.668 9.296 -10.398 1.00 4.41 H new ATOM 0 HG23 ILE A 84 -0.498 9.442 -9.066 1.00 4.41 H new ATOM 0 HD11 ILE A 84 1.468 13.363 -9.889 1.00 35.13 H new ATOM 0 HD12 ILE A 84 0.589 13.025 -11.399 1.00 35.13 H new ATOM 0 HD13 ILE A 84 -0.237 12.855 -9.832 1.00 35.13 H new ATOM 1292 N ASN A 85 2.988 9.734 -12.352 1.00 0.51 N ATOM 1293 CA ASN A 85 3.919 10.095 -13.416 1.00 55.44 C ATOM 1294 C ASN A 85 4.199 8.901 -14.329 1.00 62.44 C ATOM 1295 O ASN A 85 4.653 9.067 -15.461 1.00 42.32 O ATOM 1296 CB ASN A 85 5.226 10.635 -12.819 1.00 13.13 C ATOM 1297 CG ASN A 85 6.160 9.535 -12.353 1.00 60.41 C ATOM 1298 OD1 ASN A 85 5.906 8.873 -11.347 1.00 15.10 O ATOM 1299 ND2 ASN A 85 7.247 9.335 -13.087 1.00 0.12 N ATOM 0 H ASN A 85 3.388 9.763 -11.414 1.00 0.51 H new ATOM 0 HA ASN A 85 3.460 10.878 -14.019 1.00 55.44 H new ATOM 0 HB2 ASN A 85 5.735 11.246 -13.565 1.00 13.13 H new ATOM 0 HB3 ASN A 85 4.993 11.288 -11.978 1.00 13.13 H new ATOM 0 HD21 ASN A 85 7.913 8.608 -12.825 1.00 0.12 H new ATOM 0 HD22 ASN A 85 7.417 9.908 -13.913 1.00 0.12 H new ATOM 1306 N ASN A 86 3.926 7.698 -13.830 1.00 71.31 N ATOM 1307 CA ASN A 86 4.148 6.481 -14.601 1.00 71.30 C ATOM 1308 C ASN A 86 2.849 5.699 -14.766 1.00 13.32 C ATOM 1309 O ASN A 86 2.376 5.058 -13.827 1.00 70.02 O ATOM 1310 CB ASN A 86 5.202 5.604 -13.920 1.00 32.31 C ATOM 1311 CG ASN A 86 6.077 4.872 -14.918 1.00 51.11 C ATOM 1312 OD1 ASN A 86 6.361 5.381 -16.003 1.00 51.00 O ATOM 1313 ND2 ASN A 86 6.511 3.670 -14.555 1.00 54.03 N ATOM 0 H ASN A 86 3.551 7.541 -12.895 1.00 71.31 H new ATOM 0 HA ASN A 86 4.508 6.767 -15.589 1.00 71.30 H new ATOM 0 HB2 ASN A 86 5.828 6.225 -13.279 1.00 32.31 H new ATOM 0 HB3 ASN A 86 4.706 4.879 -13.275 1.00 32.31 H new ATOM 0 HD21 ASN A 86 7.104 3.130 -15.185 1.00 54.03 H new ATOM 0 HD22 ASN A 86 6.251 3.287 -13.646 1.00 54.03 H new ATOM 1320 N THR A 87 2.275 5.758 -15.963 1.00 60.42 N ATOM 1321 CA THR A 87 1.029 5.058 -16.251 1.00 62.25 C ATOM 1322 C THR A 87 1.195 3.550 -16.083 1.00 52.24 C ATOM 1323 O THR A 87 0.234 2.839 -15.789 1.00 54.15 O ATOM 1324 CB THR A 87 0.557 5.374 -17.671 1.00 60.01 C ATOM 1325 OG1 THR A 87 0.856 6.716 -18.011 1.00 51.54 O ATOM 1326 CG2 THR A 87 -0.930 5.172 -17.866 1.00 24.12 C ATOM 0 H THR A 87 2.654 6.284 -16.750 1.00 60.42 H new ATOM 0 HA THR A 87 0.279 5.403 -15.540 1.00 62.25 H new ATOM 0 HB THR A 87 1.090 4.675 -18.315 1.00 60.01 H new ATOM 0 HG1 THR A 87 0.845 7.269 -17.202 1.00 51.54 H new ATOM 0 HG21 THR A 87 -1.198 5.414 -18.894 1.00 24.12 H new ATOM 0 HG22 THR A 87 -1.186 4.133 -17.659 1.00 24.12 H new ATOM 0 HG23 THR A 87 -1.478 5.824 -17.185 1.00 24.12 H new ATOM 1334 N LYS A 88 2.420 3.067 -16.273 1.00 13.10 N ATOM 1335 CA LYS A 88 2.712 1.643 -16.144 1.00 5.31 C ATOM 1336 C LYS A 88 2.280 1.116 -14.779 1.00 5.23 C ATOM 1337 O LYS A 88 1.640 0.069 -14.682 1.00 24.11 O ATOM 1338 CB LYS A 88 4.205 1.387 -16.351 1.00 1.23 C ATOM 1339 CG LYS A 88 4.614 1.323 -17.813 1.00 32.24 C ATOM 1340 CD LYS A 88 5.909 0.550 -17.996 1.00 61.52 C ATOM 1341 CE LYS A 88 5.644 -0.921 -18.275 1.00 34.23 C ATOM 1342 NZ LYS A 88 6.688 -1.515 -19.155 1.00 73.02 N ATOM 0 H LYS A 88 3.227 3.642 -16.517 1.00 13.10 H new ATOM 0 HA LYS A 88 2.148 1.113 -16.912 1.00 5.31 H new ATOM 0 HB2 LYS A 88 4.772 2.176 -15.858 1.00 1.23 H new ATOM 0 HB3 LYS A 88 4.475 0.449 -15.865 1.00 1.23 H new ATOM 0 HG2 LYS A 88 3.822 0.850 -18.393 1.00 32.24 H new ATOM 0 HG3 LYS A 88 4.734 2.334 -18.203 1.00 32.24 H new ATOM 0 HD2 LYS A 88 6.478 0.981 -18.820 1.00 61.52 H new ATOM 0 HD3 LYS A 88 6.522 0.647 -17.100 1.00 61.52 H new ATOM 0 HE2 LYS A 88 5.608 -1.469 -17.333 1.00 34.23 H new ATOM 0 HE3 LYS A 88 4.667 -1.031 -18.745 1.00 34.23 H new ATOM 0 HZ1 LYS A 88 6.472 -2.519 -19.322 1.00 73.02 H new ATOM 0 HZ2 LYS A 88 6.705 -1.009 -20.063 1.00 73.02 H new ATOM 0 HZ3 LYS A 88 7.617 -1.433 -18.695 1.00 73.02 H new ATOM 1356 N SER A 89 2.630 1.850 -13.727 1.00 61.32 N ATOM 1357 CA SER A 89 2.273 1.454 -12.369 1.00 3.43 C ATOM 1358 C SER A 89 0.761 1.302 -12.233 1.00 74.10 C ATOM 1359 O SER A 89 0.275 0.366 -11.599 1.00 64.42 O ATOM 1360 CB SER A 89 2.790 2.481 -11.361 1.00 13.51 C ATOM 1361 OG SER A 89 4.122 2.863 -11.661 1.00 23.12 O ATOM 0 H SER A 89 3.159 2.720 -13.788 1.00 61.32 H new ATOM 0 HA SER A 89 2.739 0.491 -12.161 1.00 3.43 H new ATOM 0 HB2 SER A 89 2.145 3.360 -11.369 1.00 13.51 H new ATOM 0 HB3 SER A 89 2.746 2.063 -10.355 1.00 13.51 H new ATOM 0 HG SER A 89 4.736 2.151 -11.386 1.00 23.12 H new ATOM 1367 N PHE A 90 0.024 2.225 -12.843 1.00 53.02 N ATOM 1368 CA PHE A 90 -1.433 2.189 -12.801 1.00 2.00 C ATOM 1369 C PHE A 90 -1.956 0.907 -13.441 1.00 22.01 C ATOM 1370 O PHE A 90 -3.037 0.427 -13.102 1.00 1.51 O ATOM 1371 CB PHE A 90 -2.013 3.408 -13.522 1.00 52.22 C ATOM 1372 CG PHE A 90 -3.510 3.505 -13.435 1.00 55.22 C ATOM 1373 CD1 PHE A 90 -4.146 3.543 -12.204 1.00 31.21 C ATOM 1374 CD2 PHE A 90 -4.281 3.559 -14.585 1.00 73.10 C ATOM 1375 CE1 PHE A 90 -5.523 3.633 -12.123 1.00 22.51 C ATOM 1376 CE2 PHE A 90 -5.658 3.650 -14.510 1.00 44.42 C ATOM 1377 CZ PHE A 90 -6.279 3.688 -13.278 1.00 1.22 C ATOM 0 H PHE A 90 0.412 3.006 -13.372 1.00 53.02 H new ATOM 0 HA PHE A 90 -1.748 2.211 -11.758 1.00 2.00 H new ATOM 0 HB2 PHE A 90 -1.574 4.312 -13.100 1.00 52.22 H new ATOM 0 HB3 PHE A 90 -1.720 3.372 -14.571 1.00 52.22 H new ATOM 0 HD1 PHE A 90 -3.559 3.502 -11.298 1.00 31.21 H new ATOM 0 HD2 PHE A 90 -3.800 3.530 -15.552 1.00 73.10 H new ATOM 0 HE1 PHE A 90 -6.007 3.660 -11.158 1.00 22.51 H new ATOM 0 HE2 PHE A 90 -6.247 3.691 -15.414 1.00 44.42 H new ATOM 0 HZ PHE A 90 -7.355 3.761 -13.217 1.00 1.22 H new ATOM 1387 N GLU A 91 -1.176 0.358 -14.368 1.00 0.12 N ATOM 1388 CA GLU A 91 -1.553 -0.870 -15.059 1.00 52.12 C ATOM 1389 C GLU A 91 -1.379 -2.081 -14.148 1.00 13.42 C ATOM 1390 O GLU A 91 -2.128 -3.053 -14.241 1.00 60.51 O ATOM 1391 CB GLU A 91 -0.710 -1.042 -16.324 1.00 43.53 C ATOM 1392 CG GLU A 91 -0.757 0.159 -17.254 1.00 45.22 C ATOM 1393 CD GLU A 91 -0.653 -0.232 -18.715 1.00 4.01 C ATOM 1394 OE1 GLU A 91 0.032 -1.232 -19.015 1.00 60.21 O ATOM 1395 OE2 GLU A 91 -1.257 0.463 -19.560 1.00 24.13 O ATOM 0 H GLU A 91 -0.278 0.745 -14.658 1.00 0.12 H new ATOM 0 HA GLU A 91 -2.604 -0.797 -15.337 1.00 52.12 H new ATOM 0 HB2 GLU A 91 0.325 -1.229 -16.038 1.00 43.53 H new ATOM 0 HB3 GLU A 91 -1.056 -1.923 -16.864 1.00 43.53 H new ATOM 0 HG2 GLU A 91 -1.688 0.703 -17.092 1.00 45.22 H new ATOM 0 HG3 GLU A 91 0.057 0.839 -17.005 1.00 45.22 H new ATOM 1402 N ASP A 92 -0.385 -2.015 -13.267 1.00 73.24 N ATOM 1403 CA ASP A 92 -0.111 -3.105 -12.338 1.00 55.42 C ATOM 1404 C ASP A 92 -1.141 -3.131 -11.214 1.00 45.02 C ATOM 1405 O ASP A 92 -1.473 -4.193 -10.686 1.00 73.44 O ATOM 1406 CB ASP A 92 1.296 -2.965 -11.755 1.00 4.43 C ATOM 1407 CG ASP A 92 2.348 -2.765 -12.828 1.00 55.45 C ATOM 1408 OD1 ASP A 92 2.750 -3.765 -13.459 1.00 1.40 O ATOM 1409 OD2 ASP A 92 2.770 -1.608 -13.037 1.00 34.14 O ATOM 0 H ASP A 92 0.244 -1.217 -13.177 1.00 73.24 H new ATOM 0 HA ASP A 92 -0.176 -4.044 -12.888 1.00 55.42 H new ATOM 0 HB2 ASP A 92 1.319 -2.121 -11.066 1.00 4.43 H new ATOM 0 HB3 ASP A 92 1.537 -3.856 -11.175 1.00 4.43 H new ATOM 1414 N ILE A 93 -1.647 -1.957 -10.852 1.00 33.11 N ATOM 1415 CA ILE A 93 -2.642 -1.851 -9.794 1.00 75.53 C ATOM 1416 C ILE A 93 -3.898 -2.638 -10.156 1.00 15.11 C ATOM 1417 O ILE A 93 -4.531 -3.247 -9.294 1.00 54.04 O ATOM 1418 CB ILE A 93 -3.025 -0.379 -9.526 1.00 44.42 C ATOM 1419 CG1 ILE A 93 -1.815 0.415 -9.044 1.00 61.34 C ATOM 1420 CG2 ILE A 93 -4.141 -0.289 -8.502 1.00 22.32 C ATOM 1421 CD1 ILE A 93 -1.078 -0.233 -7.891 1.00 33.15 C ATOM 0 H ILE A 93 -1.384 -1.067 -11.276 1.00 33.11 H new ATOM 0 HA ILE A 93 -2.198 -2.268 -8.890 1.00 75.53 H new ATOM 0 HB ILE A 93 -3.376 0.050 -10.465 1.00 44.42 H new ATOM 0 HG12 ILE A 93 -1.124 0.547 -9.876 1.00 61.34 H new ATOM 0 HG13 ILE A 93 -2.142 1.410 -8.741 1.00 61.34 H new ATOM 0 HG21 ILE A 93 -4.393 0.757 -8.330 1.00 22.32 H new ATOM 0 HG22 ILE A 93 -5.019 -0.818 -8.873 1.00 22.32 H new ATOM 0 HG23 ILE A 93 -3.814 -0.742 -7.566 1.00 22.32 H new ATOM 0 HD11 ILE A 93 -0.231 0.390 -7.605 1.00 33.15 H new ATOM 0 HD12 ILE A 93 -1.753 -0.340 -7.042 1.00 33.15 H new ATOM 0 HD13 ILE A 93 -0.719 -1.216 -8.195 1.00 33.15 H new ATOM 1433 N HIS A 94 -4.250 -2.618 -11.436 1.00 33.20 N ATOM 1434 CA HIS A 94 -5.430 -3.326 -11.914 1.00 51.53 C ATOM 1435 C HIS A 94 -5.269 -4.833 -11.732 1.00 60.12 C ATOM 1436 O HIS A 94 -6.103 -5.483 -11.103 1.00 64.33 O ATOM 1437 CB HIS A 94 -5.682 -2.996 -13.389 1.00 32.24 C ATOM 1438 CG HIS A 94 -6.714 -3.868 -14.038 1.00 14.11 C ATOM 1439 ND1 HIS A 94 -8.070 -3.696 -13.855 1.00 3.52 N ATOM 1440 CD2 HIS A 94 -6.580 -4.927 -14.872 1.00 21.42 C ATOM 1441 CE1 HIS A 94 -8.725 -4.612 -14.547 1.00 25.51 C ATOM 1442 NE2 HIS A 94 -7.844 -5.370 -15.173 1.00 4.23 N ATOM 0 H HIS A 94 -3.735 -2.119 -12.161 1.00 33.20 H new ATOM 0 HA HIS A 94 -6.288 -3.000 -11.326 1.00 51.53 H new ATOM 0 HB2 HIS A 94 -5.997 -1.956 -13.470 1.00 32.24 H new ATOM 0 HB3 HIS A 94 -4.745 -3.089 -13.937 1.00 32.24 H new ATOM 0 HD1 HIS A 94 -8.500 -2.975 -13.276 1.00 3.52 H new ATOM 0 HD2 HIS A 94 -5.652 -5.345 -15.233 1.00 21.42 H new ATOM 0 HE1 HIS A 94 -9.798 -4.722 -14.593 1.00 25.51 H new ATOM 1451 N GLN A 95 -4.193 -5.382 -12.288 1.00 23.13 N ATOM 1452 CA GLN A 95 -3.927 -6.813 -12.189 1.00 34.41 C ATOM 1453 C GLN A 95 -3.616 -7.218 -10.751 1.00 25.30 C ATOM 1454 O GLN A 95 -3.893 -8.345 -10.341 1.00 22.45 O ATOM 1455 CB GLN A 95 -2.767 -7.205 -13.105 1.00 70.30 C ATOM 1456 CG GLN A 95 -1.476 -6.472 -12.796 1.00 41.23 C ATOM 1457 CD GLN A 95 -0.643 -7.176 -11.742 1.00 1.42 C ATOM 1458 OE1 GLN A 95 -0.832 -8.363 -11.477 1.00 61.31 O ATOM 1459 NE2 GLN A 95 0.284 -6.446 -11.135 1.00 53.21 N ATOM 0 H GLN A 95 -3.492 -4.858 -12.811 1.00 23.13 H new ATOM 0 HA GLN A 95 -4.826 -7.342 -12.506 1.00 34.41 H new ATOM 0 HB2 GLN A 95 -2.595 -8.278 -13.021 1.00 70.30 H new ATOM 0 HB3 GLN A 95 -3.049 -7.007 -14.139 1.00 70.30 H new ATOM 0 HG2 GLN A 95 -0.891 -6.374 -13.710 1.00 41.23 H new ATOM 0 HG3 GLN A 95 -1.708 -5.463 -12.456 1.00 41.23 H new ATOM 0 HE21 GLN A 95 0.406 -5.465 -11.386 1.00 53.21 H new ATOM 0 HE22 GLN A 95 0.874 -6.866 -10.417 1.00 53.21 H new ATOM 1468 N TYR A 96 -3.039 -6.293 -9.991 1.00 4.22 N ATOM 1469 CA TYR A 96 -2.691 -6.558 -8.599 1.00 24.52 C ATOM 1470 C TYR A 96 -3.935 -6.874 -7.774 1.00 15.44 C ATOM 1471 O TYR A 96 -4.009 -7.913 -7.118 1.00 60.15 O ATOM 1472 CB TYR A 96 -1.954 -5.359 -7.998 1.00 33.31 C ATOM 1473 CG TYR A 96 -0.448 -5.474 -8.070 1.00 11.12 C ATOM 1474 CD1 TYR A 96 0.205 -6.612 -7.611 1.00 14.13 C ATOM 1475 CD2 TYR A 96 0.322 -4.444 -8.597 1.00 44.44 C ATOM 1476 CE1 TYR A 96 1.581 -6.720 -7.675 1.00 70.12 C ATOM 1477 CE2 TYR A 96 1.699 -4.545 -8.665 1.00 50.24 C ATOM 1478 CZ TYR A 96 2.323 -5.684 -8.203 1.00 53.34 C ATOM 1479 OH TYR A 96 3.694 -5.788 -8.268 1.00 33.24 O ATOM 0 H TYR A 96 -2.803 -5.355 -10.314 1.00 4.22 H new ATOM 0 HA TYR A 96 -2.034 -7.428 -8.575 1.00 24.52 H new ATOM 0 HB2 TYR A 96 -2.266 -4.454 -8.519 1.00 33.31 H new ATOM 0 HB3 TYR A 96 -2.252 -5.246 -6.956 1.00 33.31 H new ATOM 0 HD1 TYR A 96 -0.373 -7.425 -7.197 1.00 14.13 H new ATOM 0 HD2 TYR A 96 -0.163 -3.550 -8.959 1.00 44.44 H new ATOM 0 HE1 TYR A 96 2.073 -7.611 -7.314 1.00 70.12 H new ATOM 0 HE2 TYR A 96 2.283 -3.736 -9.078 1.00 50.24 H new ATOM 0 HH TYR A 96 3.997 -5.564 -9.173 1.00 33.24 H new ATOM 1489 N ARG A 97 -4.910 -5.969 -7.807 1.00 54.41 N ATOM 1490 CA ARG A 97 -6.152 -6.148 -7.059 1.00 23.22 C ATOM 1491 C ARG A 97 -6.772 -7.518 -7.330 1.00 4.12 C ATOM 1492 O ARG A 97 -7.336 -8.142 -6.431 1.00 71.42 O ATOM 1493 CB ARG A 97 -7.149 -5.044 -7.416 1.00 52.54 C ATOM 1494 CG ARG A 97 -7.825 -4.422 -6.205 1.00 52.53 C ATOM 1495 CD ARG A 97 -8.667 -3.218 -6.592 1.00 43.23 C ATOM 1496 NE ARG A 97 -7.844 -2.068 -6.960 1.00 52.11 N ATOM 1497 CZ ARG A 97 -7.108 -1.376 -6.094 1.00 34.24 C ATOM 1498 NH1 ARG A 97 -7.086 -1.713 -4.811 1.00 13.14 N ATOM 1499 NH2 ARG A 97 -6.391 -0.342 -6.512 1.00 52.53 N ATOM 0 H ARG A 97 -4.864 -5.103 -8.344 1.00 54.41 H new ATOM 0 HA ARG A 97 -5.913 -6.088 -5.997 1.00 23.22 H new ATOM 0 HB2 ARG A 97 -6.631 -4.264 -7.973 1.00 52.54 H new ATOM 0 HB3 ARG A 97 -7.912 -5.455 -8.077 1.00 52.54 H new ATOM 0 HG2 ARG A 97 -8.455 -5.166 -5.717 1.00 52.53 H new ATOM 0 HG3 ARG A 97 -7.069 -4.120 -5.480 1.00 52.53 H new ATOM 0 HD2 ARG A 97 -9.314 -3.482 -7.428 1.00 43.23 H new ATOM 0 HD3 ARG A 97 -9.316 -2.947 -5.759 1.00 43.23 H new ATOM 0 HE ARG A 97 -7.833 -1.779 -7.938 1.00 52.11 H new ATOM 0 HH11 ARG A 97 -7.636 -2.507 -4.483 1.00 13.14 H new ATOM 0 HH12 ARG A 97 -6.519 -1.178 -4.153 1.00 13.14 H new ATOM 0 HH21 ARG A 97 -6.404 -0.077 -7.497 1.00 52.53 H new ATOM 0 HH22 ARG A 97 -5.827 0.189 -5.849 1.00 52.53 H new ATOM 1513 N GLU A 98 -6.665 -7.979 -8.572 1.00 31.20 N ATOM 1514 CA GLU A 98 -7.218 -9.275 -8.954 1.00 72.04 C ATOM 1515 C GLU A 98 -6.597 -10.397 -8.129 1.00 11.32 C ATOM 1516 O GLU A 98 -7.275 -11.351 -7.750 1.00 35.20 O ATOM 1517 CB GLU A 98 -6.988 -9.537 -10.444 1.00 1.23 C ATOM 1518 CG GLU A 98 -7.421 -8.388 -11.342 1.00 30.10 C ATOM 1519 CD GLU A 98 -8.819 -7.892 -11.027 1.00 72.25 C ATOM 1520 OE1 GLU A 98 -9.767 -8.701 -11.103 1.00 74.45 O ATOM 1521 OE2 GLU A 98 -8.965 -6.695 -10.705 1.00 42.14 O ATOM 0 H GLU A 98 -6.202 -7.477 -9.330 1.00 31.20 H new ATOM 0 HA GLU A 98 -8.290 -9.253 -8.758 1.00 72.04 H new ATOM 0 HB2 GLU A 98 -5.929 -9.736 -10.609 1.00 1.23 H new ATOM 0 HB3 GLU A 98 -7.531 -10.437 -10.733 1.00 1.23 H new ATOM 0 HG2 GLU A 98 -6.715 -7.564 -11.236 1.00 30.10 H new ATOM 0 HG3 GLU A 98 -7.380 -8.711 -12.382 1.00 30.10 H new ATOM 1528 N GLN A 99 -5.302 -10.276 -7.856 1.00 11.24 N ATOM 1529 CA GLN A 99 -4.590 -11.280 -7.076 1.00 50.24 C ATOM 1530 C GLN A 99 -5.193 -11.418 -5.681 1.00 52.24 C ATOM 1531 O GLN A 99 -5.140 -12.487 -5.075 1.00 42.10 O ATOM 1532 CB GLN A 99 -3.106 -10.920 -6.975 1.00 13.22 C ATOM 1533 CG GLN A 99 -2.194 -11.905 -7.688 1.00 24.15 C ATOM 1534 CD GLN A 99 -1.611 -12.942 -6.749 1.00 74.45 C ATOM 1535 OE1 GLN A 99 -2.271 -13.389 -5.811 1.00 34.12 O ATOM 1536 NE2 GLN A 99 -0.365 -13.330 -6.996 1.00 11.11 N ATOM 0 H GLN A 99 -4.725 -9.493 -8.163 1.00 11.24 H new ATOM 0 HA GLN A 99 -4.689 -12.238 -7.587 1.00 50.24 H new ATOM 0 HB2 GLN A 99 -2.952 -9.926 -7.394 1.00 13.22 H new ATOM 0 HB3 GLN A 99 -2.823 -10.870 -5.924 1.00 13.22 H new ATOM 0 HG2 GLN A 99 -2.754 -12.408 -8.477 1.00 24.15 H new ATOM 0 HG3 GLN A 99 -1.383 -11.360 -8.171 1.00 24.15 H new ATOM 0 HE21 GLN A 99 0.146 -12.933 -7.785 1.00 11.11 H new ATOM 0 HE22 GLN A 99 0.081 -14.025 -6.397 1.00 11.11 H new ATOM 1545 N ILE A 100 -5.768 -10.332 -5.178 1.00 24.32 N ATOM 1546 CA ILE A 100 -6.382 -10.338 -3.857 1.00 22.24 C ATOM 1547 C ILE A 100 -7.719 -11.072 -3.881 1.00 62.10 C ATOM 1548 O ILE A 100 -8.062 -11.791 -2.942 1.00 2.25 O ATOM 1549 CB ILE A 100 -6.596 -8.906 -3.330 1.00 11.14 C ATOM 1550 CG1 ILE A 100 -5.286 -8.118 -3.392 1.00 35.33 C ATOM 1551 CG2 ILE A 100 -7.137 -8.937 -1.908 1.00 4.23 C ATOM 1552 CD1 ILE A 100 -5.468 -6.624 -3.239 1.00 3.02 C ATOM 0 H ILE A 100 -5.822 -9.437 -5.665 1.00 24.32 H new ATOM 0 HA ILE A 100 -5.697 -10.859 -3.188 1.00 22.24 H new ATOM 0 HB ILE A 100 -7.330 -8.407 -3.963 1.00 11.14 H new ATOM 0 HG12 ILE A 100 -4.619 -8.476 -2.608 1.00 35.33 H new ATOM 0 HG13 ILE A 100 -4.795 -8.320 -4.344 1.00 35.33 H new ATOM 0 HG21 ILE A 100 -7.282 -7.917 -1.552 1.00 4.23 H new ATOM 0 HG22 ILE A 100 -8.090 -9.466 -1.893 1.00 4.23 H new ATOM 0 HG23 ILE A 100 -6.427 -9.450 -1.260 1.00 4.23 H new ATOM 0 HD11 ILE A 100 -4.497 -6.132 -3.293 1.00 3.02 H new ATOM 0 HD12 ILE A 100 -6.109 -6.252 -4.038 1.00 3.02 H new ATOM 0 HD13 ILE A 100 -5.930 -6.411 -2.275 1.00 3.02 H new ATOM 1564 N LYS A 101 -8.470 -10.885 -4.961 1.00 74.12 N ATOM 1565 CA LYS A 101 -9.769 -11.530 -5.110 1.00 33.11 C ATOM 1566 C LYS A 101 -9.627 -13.050 -5.125 1.00 1.41 C ATOM 1567 O LYS A 101 -10.274 -13.750 -4.348 1.00 5.03 O ATOM 1568 CB LYS A 101 -10.450 -11.055 -6.396 1.00 12.11 C ATOM 1569 CG LYS A 101 -11.488 -9.968 -6.169 1.00 72.44 C ATOM 1570 CD LYS A 101 -10.900 -8.780 -5.423 1.00 62.31 C ATOM 1571 CE LYS A 101 -11.358 -7.461 -6.026 1.00 11.22 C ATOM 1572 NZ LYS A 101 -11.630 -6.436 -4.980 1.00 71.31 N ATOM 0 H LYS A 101 -8.201 -10.292 -5.746 1.00 74.12 H new ATOM 0 HA LYS A 101 -10.385 -11.252 -4.255 1.00 33.11 H new ATOM 0 HB2 LYS A 101 -9.690 -10.683 -7.083 1.00 12.11 H new ATOM 0 HB3 LYS A 101 -10.928 -11.907 -6.880 1.00 12.11 H new ATOM 0 HG2 LYS A 101 -11.884 -9.636 -7.129 1.00 72.44 H new ATOM 0 HG3 LYS A 101 -12.325 -10.376 -5.603 1.00 72.44 H new ATOM 0 HD2 LYS A 101 -11.196 -8.824 -4.375 1.00 62.31 H new ATOM 0 HD3 LYS A 101 -9.812 -8.835 -5.449 1.00 62.31 H new ATOM 0 HE2 LYS A 101 -10.594 -7.089 -6.708 1.00 11.22 H new ATOM 0 HE3 LYS A 101 -12.260 -7.625 -6.616 1.00 11.22 H new ATOM 0 HZ1 LYS A 101 -12.348 -5.769 -5.327 1.00 71.31 H new ATOM 0 HZ2 LYS A 101 -11.978 -6.903 -4.119 1.00 71.31 H new ATOM 0 HZ3 LYS A 101 -10.754 -5.920 -4.764 1.00 71.31 H new ATOM 1586 N ARG A 102 -8.781 -13.554 -6.018 1.00 25.20 N ATOM 1587 CA ARG A 102 -8.561 -14.994 -6.135 1.00 61.54 C ATOM 1588 C ARG A 102 -8.099 -15.597 -4.810 1.00 71.41 C ATOM 1589 O ARG A 102 -8.638 -16.607 -4.357 1.00 54.13 O ATOM 1590 CB ARG A 102 -7.538 -15.304 -7.229 1.00 54.34 C ATOM 1591 CG ARG A 102 -6.404 -14.301 -7.302 1.00 51.43 C ATOM 1592 CD ARG A 102 -5.047 -14.987 -7.327 1.00 43.40 C ATOM 1593 NE ARG A 102 -4.532 -15.139 -8.685 1.00 20.20 N ATOM 1594 CZ ARG A 102 -3.509 -15.927 -9.006 1.00 4.02 C ATOM 1595 NH1 ARG A 102 -2.892 -16.639 -8.070 1.00 41.04 N ATOM 1596 NH2 ARG A 102 -3.102 -16.005 -10.265 1.00 31.23 N ATOM 0 H ARG A 102 -8.237 -12.989 -6.670 1.00 25.20 H new ATOM 0 HA ARG A 102 -9.516 -15.445 -6.405 1.00 61.54 H new ATOM 0 HB2 ARG A 102 -7.123 -16.297 -7.056 1.00 54.34 H new ATOM 0 HB3 ARG A 102 -8.047 -15.335 -8.192 1.00 54.34 H new ATOM 0 HG2 ARG A 102 -6.518 -13.687 -8.196 1.00 51.43 H new ATOM 0 HG3 ARG A 102 -6.457 -13.629 -6.445 1.00 51.43 H new ATOM 0 HD2 ARG A 102 -4.338 -14.409 -6.734 1.00 43.40 H new ATOM 0 HD3 ARG A 102 -5.129 -15.968 -6.859 1.00 43.40 H new ATOM 0 HE ARG A 102 -4.983 -14.610 -9.431 1.00 20.20 H new ATOM 0 HH11 ARG A 102 -3.202 -16.583 -7.100 1.00 41.04 H new ATOM 0 HH12 ARG A 102 -2.108 -17.242 -8.321 1.00 41.04 H new ATOM 0 HH21 ARG A 102 -3.573 -15.461 -10.988 1.00 31.23 H new ATOM 0 HH22 ARG A 102 -2.318 -16.609 -10.511 1.00 31.23 H new ATOM 1610 N VAL A 103 -7.096 -14.977 -4.196 1.00 44.41 N ATOM 1611 CA VAL A 103 -6.560 -15.458 -2.926 1.00 2.41 C ATOM 1612 C VAL A 103 -7.611 -15.388 -1.824 1.00 75.23 C ATOM 1613 O VAL A 103 -8.039 -16.412 -1.290 1.00 3.41 O ATOM 1614 CB VAL A 103 -5.330 -14.631 -2.498 1.00 20.34 C ATOM 1615 CG1 VAL A 103 -4.861 -15.029 -1.105 1.00 11.54 C ATOM 1616 CG2 VAL A 103 -4.209 -14.787 -3.512 1.00 14.31 C ATOM 0 H VAL A 103 -6.638 -14.140 -4.557 1.00 44.41 H new ATOM 0 HA VAL A 103 -6.265 -16.497 -3.075 1.00 2.41 H new ATOM 0 HB VAL A 103 -5.620 -13.581 -2.463 1.00 20.34 H new ATOM 0 HG11 VAL A 103 -3.993 -14.431 -0.829 1.00 11.54 H new ATOM 0 HG12 VAL A 103 -5.664 -14.857 -0.388 1.00 11.54 H new ATOM 0 HG13 VAL A 103 -4.590 -16.085 -1.100 1.00 11.54 H new ATOM 0 HG21 VAL A 103 -3.348 -14.198 -3.196 1.00 14.31 H new ATOM 0 HG22 VAL A 103 -3.924 -15.837 -3.581 1.00 14.31 H new ATOM 0 HG23 VAL A 103 -4.549 -14.438 -4.487 1.00 14.31 H new ATOM 1626 N LYS A 104 -8.016 -14.171 -1.489 1.00 20.05 N ATOM 1627 CA LYS A 104 -9.014 -13.954 -0.449 1.00 5.33 C ATOM 1628 C LYS A 104 -10.325 -14.654 -0.793 1.00 20.24 C ATOM 1629 O LYS A 104 -11.125 -14.961 0.091 1.00 73.33 O ATOM 1630 CB LYS A 104 -9.256 -12.457 -0.253 1.00 40.13 C ATOM 1631 CG LYS A 104 -7.997 -11.679 0.094 1.00 72.23 C ATOM 1632 CD LYS A 104 -8.327 -10.362 0.777 1.00 61.30 C ATOM 1633 CE LYS A 104 -8.279 -10.492 2.291 1.00 64.34 C ATOM 1634 NZ LYS A 104 -9.049 -11.672 2.772 1.00 33.52 N ATOM 0 H LYS A 104 -7.668 -13.316 -1.923 1.00 20.05 H new ATOM 0 HA LYS A 104 -8.633 -14.379 0.479 1.00 5.33 H new ATOM 0 HB2 LYS A 104 -9.689 -12.045 -1.165 1.00 40.13 H new ATOM 0 HB3 LYS A 104 -9.990 -12.317 0.540 1.00 40.13 H new ATOM 0 HG2 LYS A 104 -7.365 -12.280 0.747 1.00 72.23 H new ATOM 0 HG3 LYS A 104 -7.425 -11.486 -0.814 1.00 72.23 H new ATOM 0 HD2 LYS A 104 -7.621 -9.597 0.454 1.00 61.30 H new ATOM 0 HD3 LYS A 104 -9.319 -10.031 0.471 1.00 61.30 H new ATOM 0 HE2 LYS A 104 -7.242 -10.579 2.615 1.00 64.34 H new ATOM 0 HE3 LYS A 104 -8.681 -9.587 2.746 1.00 64.34 H new ATOM 0 HZ1 LYS A 104 -9.062 -11.677 3.812 1.00 33.52 H new ATOM 0 HZ2 LYS A 104 -10.024 -11.620 2.413 1.00 33.52 H new ATOM 0 HZ3 LYS A 104 -8.599 -12.544 2.427 1.00 33.52 H new ATOM 1648 N ASP A 105 -10.538 -14.906 -2.081 1.00 50.40 N ATOM 1649 CA ASP A 105 -11.751 -15.571 -2.539 1.00 4.40 C ATOM 1650 C ASP A 105 -12.984 -14.727 -2.233 1.00 12.31 C ATOM 1651 O ASP A 105 -13.947 -15.207 -1.635 1.00 4.44 O ATOM 1652 CB ASP A 105 -11.878 -16.947 -1.883 1.00 25.13 C ATOM 1653 CG ASP A 105 -13.023 -17.758 -2.457 1.00 11.30 C ATOM 1654 OD1 ASP A 105 -13.326 -17.591 -3.657 1.00 12.01 O ATOM 1655 OD2 ASP A 105 -13.616 -18.561 -1.706 1.00 22.40 O ATOM 0 H ASP A 105 -9.886 -14.659 -2.825 1.00 50.40 H new ATOM 0 HA ASP A 105 -11.683 -15.697 -3.620 1.00 4.40 H new ATOM 0 HB2 ASP A 105 -10.946 -17.496 -2.014 1.00 25.13 H new ATOM 0 HB3 ASP A 105 -12.026 -16.823 -0.810 1.00 25.13 H new ATOM 1660 N SER A 106 -12.946 -13.465 -2.650 1.00 24.22 N ATOM 1661 CA SER A 106 -14.059 -12.551 -2.424 1.00 12.22 C ATOM 1662 C SER A 106 -13.793 -11.200 -3.080 1.00 61.32 C ATOM 1663 O SER A 106 -12.644 -10.781 -3.217 1.00 5.01 O ATOM 1664 CB SER A 106 -14.300 -12.367 -0.924 1.00 41.21 C ATOM 1665 OG SER A 106 -15.393 -13.154 -0.483 1.00 11.41 O ATOM 0 H SER A 106 -12.156 -13.053 -3.146 1.00 24.22 H new ATOM 0 HA SER A 106 -14.951 -12.984 -2.876 1.00 12.22 H new ATOM 0 HB2 SER A 106 -13.402 -12.644 -0.372 1.00 41.21 H new ATOM 0 HB3 SER A 106 -14.495 -11.316 -0.710 1.00 41.21 H new ATOM 0 HG SER A 106 -15.253 -14.087 -0.750 1.00 11.41 H new ATOM 1671 N ASP A 107 -14.863 -10.524 -3.485 1.00 24.01 N ATOM 1672 CA ASP A 107 -14.745 -9.221 -4.129 1.00 24.20 C ATOM 1673 C ASP A 107 -14.737 -8.100 -3.094 1.00 61.41 C ATOM 1674 O ASP A 107 -14.121 -7.054 -3.303 1.00 61.20 O ATOM 1675 CB ASP A 107 -15.895 -9.012 -5.115 1.00 3.12 C ATOM 1676 CG ASP A 107 -17.250 -9.024 -4.434 1.00 61.44 C ATOM 1677 OD1 ASP A 107 -17.575 -10.035 -3.777 1.00 45.40 O ATOM 1678 OD2 ASP A 107 -17.986 -8.022 -4.558 1.00 1.14 O ATOM 0 H ASP A 107 -15.821 -10.857 -3.379 1.00 24.01 H new ATOM 0 HA ASP A 107 -13.800 -9.196 -4.672 1.00 24.20 H new ATOM 0 HB2 ASP A 107 -15.759 -8.062 -5.631 1.00 3.12 H new ATOM 0 HB3 ASP A 107 -15.866 -9.794 -5.874 1.00 3.12 H new ATOM 1683 N ASP A 108 -15.426 -8.324 -1.980 1.00 54.45 N ATOM 1684 CA ASP A 108 -15.499 -7.331 -0.914 1.00 5.24 C ATOM 1685 C ASP A 108 -14.422 -7.580 0.137 1.00 13.44 C ATOM 1686 O ASP A 108 -14.670 -8.233 1.151 1.00 15.21 O ATOM 1687 CB ASP A 108 -16.880 -7.356 -0.258 1.00 3.11 C ATOM 1688 CG ASP A 108 -18.004 -7.350 -1.276 1.00 40.31 C ATOM 1689 OD1 ASP A 108 -17.993 -6.475 -2.168 1.00 32.24 O ATOM 1690 OD2 ASP A 108 -18.896 -8.220 -1.181 1.00 11.13 O ATOM 0 H ASP A 108 -15.942 -9.184 -1.792 1.00 54.45 H new ATOM 0 HA ASP A 108 -15.331 -6.349 -1.356 1.00 5.24 H new ATOM 0 HB2 ASP A 108 -16.966 -8.244 0.368 1.00 3.11 H new ATOM 0 HB3 ASP A 108 -16.983 -6.492 0.398 1.00 3.11 H new ATOM 1695 N VAL A 109 -13.226 -7.055 -0.111 1.00 63.35 N ATOM 1696 CA VAL A 109 -12.114 -7.221 0.817 1.00 61.51 C ATOM 1697 C VAL A 109 -11.539 -5.868 1.234 1.00 43.13 C ATOM 1698 O VAL A 109 -11.624 -4.892 0.489 1.00 25.11 O ATOM 1699 CB VAL A 109 -10.994 -8.089 0.207 1.00 25.13 C ATOM 1700 CG1 VAL A 109 -11.562 -9.403 -0.307 1.00 4.20 C ATOM 1701 CG2 VAL A 109 -10.272 -7.344 -0.908 1.00 60.24 C ATOM 0 H VAL A 109 -13.003 -6.512 -0.945 1.00 63.35 H new ATOM 0 HA VAL A 109 -12.508 -7.728 1.698 1.00 61.51 H new ATOM 0 HB VAL A 109 -10.268 -8.307 0.990 1.00 25.13 H new ATOM 0 HG11 VAL A 109 -10.759 -10.004 -0.734 1.00 4.20 H new ATOM 0 HG12 VAL A 109 -12.023 -9.947 0.517 1.00 4.20 H new ATOM 0 HG13 VAL A 109 -12.311 -9.201 -1.073 1.00 4.20 H new ATOM 0 HG21 VAL A 109 -9.487 -7.978 -1.321 1.00 60.24 H new ATOM 0 HG22 VAL A 109 -10.983 -7.088 -1.694 1.00 60.24 H new ATOM 0 HG23 VAL A 109 -9.829 -6.432 -0.508 1.00 60.24 H new ATOM 1711 N PRO A 110 -10.945 -5.794 2.437 1.00 51.41 N ATOM 1712 CA PRO A 110 -10.356 -4.553 2.952 1.00 63.43 C ATOM 1713 C PRO A 110 -9.117 -4.129 2.171 1.00 31.04 C ATOM 1714 O PRO A 110 -8.054 -4.738 2.296 1.00 3.12 O ATOM 1715 CB PRO A 110 -9.983 -4.906 4.394 1.00 12.54 C ATOM 1716 CG PRO A 110 -9.809 -6.385 4.387 1.00 73.35 C ATOM 1717 CD PRO A 110 -10.801 -6.910 3.389 1.00 1.43 C ATOM 0 HA PRO A 110 -11.045 -3.713 2.869 1.00 63.43 H new ATOM 0 HB2 PRO A 110 -9.067 -4.401 4.701 1.00 12.54 H new ATOM 0 HB3 PRO A 110 -10.764 -4.602 5.091 1.00 12.54 H new ATOM 0 HG2 PRO A 110 -8.791 -6.657 4.107 1.00 73.35 H new ATOM 0 HG3 PRO A 110 -9.991 -6.805 5.376 1.00 73.35 H new ATOM 0 HD2 PRO A 110 -10.439 -7.813 2.898 1.00 1.43 H new ATOM 0 HD3 PRO A 110 -11.751 -7.162 3.860 1.00 1.43 H new ATOM 1725 N MET A 111 -9.259 -3.080 1.367 1.00 3.33 N ATOM 1726 CA MET A 111 -8.148 -2.573 0.569 1.00 62.22 C ATOM 1727 C MET A 111 -8.284 -1.072 0.339 1.00 53.12 C ATOM 1728 O MET A 111 -9.295 -0.467 0.695 1.00 43.23 O ATOM 1729 CB MET A 111 -8.073 -3.301 -0.775 1.00 3.05 C ATOM 1730 CG MET A 111 -9.431 -3.589 -1.392 1.00 61.22 C ATOM 1731 SD MET A 111 -9.322 -4.034 -3.135 1.00 14.11 S ATOM 1732 CE MET A 111 -8.677 -5.698 -3.011 1.00 12.20 C ATOM 0 H MET A 111 -10.132 -2.565 1.251 1.00 3.33 H new ATOM 0 HA MET A 111 -7.227 -2.758 1.123 1.00 62.22 H new ATOM 0 HB2 MET A 111 -7.488 -2.700 -1.471 1.00 3.05 H new ATOM 0 HB3 MET A 111 -7.539 -4.241 -0.639 1.00 3.05 H new ATOM 0 HG2 MET A 111 -9.910 -4.400 -0.843 1.00 61.22 H new ATOM 0 HG3 MET A 111 -10.068 -2.711 -1.284 1.00 61.22 H new ATOM 0 HE1 MET A 111 -7.948 -5.865 -3.803 1.00 12.20 H new ATOM 0 HE2 MET A 111 -8.197 -5.831 -2.042 1.00 12.20 H new ATOM 0 HE3 MET A 111 -9.493 -6.413 -3.112 1.00 12.20 H new ATOM 1742 N VAL A 112 -7.255 -0.477 -0.255 1.00 32.21 N ATOM 1743 CA VAL A 112 -7.252 0.954 -0.530 1.00 41.44 C ATOM 1744 C VAL A 112 -6.413 1.276 -1.763 1.00 73.40 C ATOM 1745 O VAL A 112 -5.579 0.475 -2.185 1.00 24.23 O ATOM 1746 CB VAL A 112 -6.705 1.751 0.669 1.00 3.04 C ATOM 1747 CG1 VAL A 112 -7.000 3.232 0.504 1.00 3.44 C ATOM 1748 CG2 VAL A 112 -7.286 1.224 1.972 1.00 41.03 C ATOM 0 H VAL A 112 -6.411 -0.965 -0.555 1.00 32.21 H new ATOM 0 HA VAL A 112 -8.287 1.244 -0.712 1.00 41.44 H new ATOM 0 HB VAL A 112 -5.623 1.622 0.704 1.00 3.04 H new ATOM 0 HG11 VAL A 112 -6.606 3.779 1.361 1.00 3.44 H new ATOM 0 HG12 VAL A 112 -6.528 3.598 -0.408 1.00 3.44 H new ATOM 0 HG13 VAL A 112 -8.078 3.384 0.441 1.00 3.44 H new ATOM 0 HG21 VAL A 112 -6.887 1.800 2.807 1.00 41.03 H new ATOM 0 HG22 VAL A 112 -8.372 1.319 1.951 1.00 41.03 H new ATOM 0 HG23 VAL A 112 -7.016 0.175 2.093 1.00 41.03 H new ATOM 1758 N LEU A 113 -6.638 2.455 -2.335 1.00 42.24 N ATOM 1759 CA LEU A 113 -5.903 2.885 -3.517 1.00 15.13 C ATOM 1760 C LEU A 113 -5.329 4.285 -3.320 1.00 15.03 C ATOM 1761 O LEU A 113 -6.069 5.267 -3.258 1.00 24.22 O ATOM 1762 CB LEU A 113 -6.815 2.865 -4.746 1.00 71.12 C ATOM 1763 CG LEU A 113 -6.144 3.263 -6.064 1.00 41.21 C ATOM 1764 CD1 LEU A 113 -4.721 2.725 -6.128 1.00 3.41 C ATOM 1765 CD2 LEU A 113 -6.960 2.762 -7.249 1.00 22.20 C ATOM 0 H LEU A 113 -7.325 3.130 -1.998 1.00 42.24 H new ATOM 0 HA LEU A 113 -5.078 2.191 -3.674 1.00 15.13 H new ATOM 0 HB2 LEU A 113 -7.228 1.862 -4.856 1.00 71.12 H new ATOM 0 HB3 LEU A 113 -7.654 3.537 -4.567 1.00 71.12 H new ATOM 0 HG LEU A 113 -6.099 4.351 -6.111 1.00 41.21 H new ATOM 0 HD11 LEU A 113 -4.263 3.019 -7.072 1.00 3.41 H new ATOM 0 HD12 LEU A 113 -4.140 3.133 -5.300 1.00 3.41 H new ATOM 0 HD13 LEU A 113 -4.740 1.637 -6.057 1.00 3.41 H new ATOM 0 HD21 LEU A 113 -6.469 3.053 -8.178 1.00 22.20 H new ATOM 0 HD22 LEU A 113 -7.037 1.676 -7.204 1.00 22.20 H new ATOM 0 HD23 LEU A 113 -7.958 3.198 -7.214 1.00 22.20 H new ATOM 1777 N VAL A 114 -4.006 4.369 -3.222 1.00 11.41 N ATOM 1778 CA VAL A 114 -3.335 5.647 -3.030 1.00 51.32 C ATOM 1779 C VAL A 114 -2.578 6.068 -4.285 1.00 51.33 C ATOM 1780 O VAL A 114 -2.200 5.232 -5.106 1.00 31.25 O ATOM 1781 CB VAL A 114 -2.352 5.586 -1.847 1.00 33.23 C ATOM 1782 CG1 VAL A 114 -1.789 6.965 -1.549 1.00 42.33 C ATOM 1783 CG2 VAL A 114 -3.031 5.002 -0.618 1.00 34.14 C ATOM 0 H VAL A 114 -3.379 3.566 -3.273 1.00 11.41 H new ATOM 0 HA VAL A 114 -4.109 6.384 -2.816 1.00 51.32 H new ATOM 0 HB VAL A 114 -1.523 4.933 -2.120 1.00 33.23 H new ATOM 0 HG11 VAL A 114 -1.096 6.902 -0.710 1.00 42.33 H new ATOM 0 HG12 VAL A 114 -1.263 7.341 -2.427 1.00 42.33 H new ATOM 0 HG13 VAL A 114 -2.604 7.644 -1.297 1.00 42.33 H new ATOM 0 HG21 VAL A 114 -2.321 4.967 0.208 1.00 34.14 H new ATOM 0 HG22 VAL A 114 -3.880 5.627 -0.340 1.00 34.14 H new ATOM 0 HG23 VAL A 114 -3.380 3.993 -0.840 1.00 34.14 H new ATOM 1793 N GLY A 115 -2.359 7.372 -4.427 1.00 3.32 N ATOM 1794 CA GLY A 115 -1.647 7.886 -5.583 1.00 53.14 C ATOM 1795 C GLY A 115 -0.383 8.630 -5.199 1.00 51.42 C ATOM 1796 O GLY A 115 -0.417 9.832 -4.934 1.00 2.24 O ATOM 0 H GLY A 115 -2.662 8.082 -3.761 1.00 3.32 H new ATOM 0 HA2 GLY A 115 -1.392 7.060 -6.246 1.00 53.14 H new ATOM 0 HA3 GLY A 115 -2.302 8.553 -6.143 1.00 53.14 H new ATOM 1800 N ASN A 116 0.736 7.913 -5.168 1.00 0.25 N ATOM 1801 CA ASN A 116 2.018 8.510 -4.812 1.00 13.41 C ATOM 1802 C ASN A 116 2.496 9.470 -5.897 1.00 32.10 C ATOM 1803 O ASN A 116 1.974 9.471 -7.013 1.00 45.00 O ATOM 1804 CB ASN A 116 3.065 7.417 -4.584 1.00 23.51 C ATOM 1805 CG ASN A 116 4.181 7.869 -3.663 1.00 51.41 C ATOM 1806 OD1 ASN A 116 4.283 9.048 -3.324 1.00 72.44 O ATOM 1807 ND2 ASN A 116 5.025 6.930 -3.252 1.00 52.33 N ATOM 0 H ASN A 116 0.781 6.917 -5.385 1.00 0.25 H new ATOM 0 HA ASN A 116 1.883 9.075 -3.890 1.00 13.41 H new ATOM 0 HB2 ASN A 116 2.581 6.537 -4.160 1.00 23.51 H new ATOM 0 HB3 ASN A 116 3.488 7.117 -5.543 1.00 23.51 H new ATOM 0 HD21 ASN A 116 5.796 7.174 -2.630 1.00 52.33 H new ATOM 0 HD22 ASN A 116 4.903 5.965 -3.558 1.00 52.33 H new ATOM 1814 N LYS A 117 3.491 10.285 -5.562 1.00 72.44 N ATOM 1815 CA LYS A 117 4.042 11.252 -6.505 1.00 61.51 C ATOM 1816 C LYS A 117 2.975 12.246 -6.953 1.00 24.01 C ATOM 1817 O LYS A 117 2.679 12.365 -8.142 1.00 61.51 O ATOM 1818 CB LYS A 117 4.632 10.533 -7.720 1.00 74.22 C ATOM 1819 CG LYS A 117 5.487 9.329 -7.357 1.00 42.43 C ATOM 1820 CD LYS A 117 6.739 9.254 -8.216 1.00 40.25 C ATOM 1821 CE LYS A 117 7.420 7.901 -8.093 1.00 24.11 C ATOM 1822 NZ LYS A 117 7.941 7.420 -9.402 1.00 34.50 N ATOM 0 H LYS A 117 3.933 10.295 -4.643 1.00 72.44 H new ATOM 0 HA LYS A 117 4.835 11.804 -5.999 1.00 61.51 H new ATOM 0 HB2 LYS A 117 3.819 10.209 -8.370 1.00 74.22 H new ATOM 0 HB3 LYS A 117 5.236 11.238 -8.292 1.00 74.22 H new ATOM 0 HG2 LYS A 117 5.769 9.386 -6.306 1.00 42.43 H new ATOM 0 HG3 LYS A 117 4.904 8.417 -7.482 1.00 42.43 H new ATOM 0 HD2 LYS A 117 6.478 9.437 -9.258 1.00 40.25 H new ATOM 0 HD3 LYS A 117 7.433 10.040 -7.918 1.00 40.25 H new ATOM 0 HE2 LYS A 117 8.241 7.971 -7.379 1.00 24.11 H new ATOM 0 HE3 LYS A 117 6.713 7.174 -7.694 1.00 24.11 H new ATOM 0 HZ1 LYS A 117 7.941 6.380 -9.415 1.00 34.50 H new ATOM 0 HZ2 LYS A 117 7.335 7.775 -10.169 1.00 34.50 H new ATOM 0 HZ3 LYS A 117 8.911 7.768 -9.539 1.00 34.50 H new ATOM 1836 N CYS A 118 2.400 12.961 -5.991 1.00 43.00 N ATOM 1837 CA CYS A 118 1.366 13.947 -6.283 1.00 51.34 C ATOM 1838 C CYS A 118 1.956 15.353 -6.401 1.00 14.54 C ATOM 1839 O CYS A 118 1.247 16.304 -6.729 1.00 14.02 O ATOM 1840 CB CYS A 118 0.292 13.924 -5.195 1.00 14.41 C ATOM 1841 SG CYS A 118 -1.318 14.547 -5.733 1.00 63.23 S ATOM 0 H CYS A 118 2.633 12.876 -5.002 1.00 43.00 H new ATOM 0 HA CYS A 118 0.916 13.685 -7.241 1.00 51.34 H new ATOM 0 HB2 CYS A 118 0.173 12.901 -4.839 1.00 14.41 H new ATOM 0 HB3 CYS A 118 0.635 14.519 -4.348 1.00 14.41 H new ATOM 0 HG CYS A 118 -1.152 15.623 -6.443 1.00 63.23 H new ATOM 1847 N ASP A 119 3.253 15.481 -6.131 1.00 11.41 N ATOM 1848 CA ASP A 119 3.926 16.773 -6.208 1.00 1.14 C ATOM 1849 C ASP A 119 4.805 16.869 -7.455 1.00 45.41 C ATOM 1850 O ASP A 119 5.231 17.958 -7.840 1.00 64.52 O ATOM 1851 CB ASP A 119 4.773 17.002 -4.955 1.00 2.24 C ATOM 1852 CG ASP A 119 5.894 15.989 -4.820 1.00 11.04 C ATOM 1853 OD1 ASP A 119 5.644 14.896 -4.270 1.00 32.12 O ATOM 1854 OD2 ASP A 119 7.021 16.289 -5.266 1.00 55.34 O ATOM 0 H ASP A 119 3.857 14.706 -5.857 1.00 11.41 H new ATOM 0 HA ASP A 119 3.160 17.546 -6.272 1.00 1.14 H new ATOM 0 HB2 ASP A 119 5.196 18.006 -4.985 1.00 2.24 H new ATOM 0 HB3 ASP A 119 4.134 16.952 -4.074 1.00 2.24 H new ATOM 1859 N LEU A 120 5.075 15.726 -8.084 1.00 22.23 N ATOM 1860 CA LEU A 120 5.904 15.686 -9.286 1.00 1.20 C ATOM 1861 C LEU A 120 5.434 16.713 -10.315 1.00 13.43 C ATOM 1862 O LEU A 120 4.254 17.057 -10.368 1.00 15.33 O ATOM 1863 CB LEU A 120 5.877 14.283 -9.899 1.00 10.11 C ATOM 1864 CG LEU A 120 7.091 13.412 -9.575 1.00 52.22 C ATOM 1865 CD1 LEU A 120 6.966 12.053 -10.245 1.00 72.41 C ATOM 1866 CD2 LEU A 120 8.373 14.106 -10.008 1.00 72.04 C ATOM 0 H LEU A 120 4.731 14.815 -7.780 1.00 22.23 H new ATOM 0 HA LEU A 120 6.926 15.934 -8.999 1.00 1.20 H new ATOM 0 HB2 LEU A 120 4.979 13.770 -9.555 1.00 10.11 H new ATOM 0 HB3 LEU A 120 5.795 14.378 -10.982 1.00 10.11 H new ATOM 0 HG LEU A 120 7.129 13.260 -8.496 1.00 52.22 H new ATOM 0 HD11 LEU A 120 7.839 11.447 -10.003 1.00 72.41 H new ATOM 0 HD12 LEU A 120 6.066 11.552 -9.887 1.00 72.41 H new ATOM 0 HD13 LEU A 120 6.903 12.184 -11.325 1.00 72.41 H new ATOM 0 HD21 LEU A 120 9.228 13.473 -9.770 1.00 72.04 H new ATOM 0 HD22 LEU A 120 8.344 14.287 -11.082 1.00 72.04 H new ATOM 0 HD23 LEU A 120 8.468 15.056 -9.482 1.00 72.04 H new ATOM 1878 N ALA A 121 6.367 17.197 -11.130 1.00 60.34 N ATOM 1879 CA ALA A 121 6.048 18.183 -12.156 1.00 63.51 C ATOM 1880 C ALA A 121 5.895 17.532 -13.529 1.00 63.10 C ATOM 1881 O ALA A 121 5.932 18.212 -14.555 1.00 32.14 O ATOM 1882 CB ALA A 121 7.119 19.262 -12.201 1.00 73.32 C ATOM 0 H ALA A 121 7.349 16.922 -11.099 1.00 60.34 H new ATOM 0 HA ALA A 121 5.093 18.639 -11.895 1.00 63.51 H new ATOM 0 HB1 ALA A 121 6.868 19.991 -12.971 1.00 73.32 H new ATOM 0 HB2 ALA A 121 7.174 19.760 -11.233 1.00 73.32 H new ATOM 0 HB3 ALA A 121 8.083 18.808 -12.431 1.00 73.32 H new ATOM 1888 N ALA A 122 5.724 16.212 -13.546 1.00 24.20 N ATOM 1889 CA ALA A 122 5.567 15.479 -14.795 1.00 31.32 C ATOM 1890 C ALA A 122 4.612 14.302 -14.623 1.00 5.20 C ATOM 1891 O ALA A 122 4.994 13.146 -14.812 1.00 41.02 O ATOM 1892 CB ALA A 122 6.921 14.998 -15.291 1.00 34.33 C ATOM 0 H ALA A 122 5.691 15.631 -12.709 1.00 24.20 H new ATOM 0 HA ALA A 122 5.138 16.153 -15.537 1.00 31.32 H new ATOM 0 HB1 ALA A 122 6.793 14.451 -16.225 1.00 34.33 H new ATOM 0 HB2 ALA A 122 7.573 15.856 -15.459 1.00 34.33 H new ATOM 0 HB3 ALA A 122 7.370 14.342 -14.545 1.00 34.33 H new ATOM 1898 N ARG A 123 3.369 14.602 -14.262 1.00 53.11 N ATOM 1899 CA ARG A 123 2.361 13.566 -14.064 1.00 52.05 C ATOM 1900 C ARG A 123 1.790 13.096 -15.398 1.00 24.44 C ATOM 1901 O ARG A 123 1.826 13.823 -16.391 1.00 31.14 O ATOM 1902 CB ARG A 123 1.237 14.083 -13.161 1.00 63.31 C ATOM 1903 CG ARG A 123 0.340 15.118 -13.825 1.00 20.15 C ATOM 1904 CD ARG A 123 -0.890 15.411 -12.982 1.00 44.41 C ATOM 1905 NE ARG A 123 -0.539 15.861 -11.637 1.00 74.22 N ATOM 1906 CZ ARG A 123 -0.014 17.054 -11.368 1.00 12.43 C ATOM 1907 NH1 ARG A 123 0.216 17.922 -12.346 1.00 54.44 N ATOM 1908 NH2 ARG A 123 0.280 17.382 -10.117 1.00 12.00 N ATOM 0 H ARG A 123 3.035 15.552 -14.101 1.00 53.11 H new ATOM 0 HA ARG A 123 2.841 12.715 -13.580 1.00 52.05 H new ATOM 0 HB2 ARG A 123 0.626 13.240 -12.839 1.00 63.31 H new ATOM 0 HB3 ARG A 123 1.676 14.519 -12.264 1.00 63.31 H new ATOM 0 HG2 ARG A 123 0.901 16.039 -13.984 1.00 20.15 H new ATOM 0 HG3 ARG A 123 0.032 14.758 -14.807 1.00 20.15 H new ATOM 0 HD2 ARG A 123 -1.493 16.175 -13.474 1.00 44.41 H new ATOM 0 HD3 ARG A 123 -1.505 14.514 -12.915 1.00 44.41 H new ATOM 0 HE ARG A 123 -0.706 15.223 -10.859 1.00 74.22 H new ATOM 0 HH11 ARG A 123 -0.010 17.676 -13.310 1.00 54.44 H new ATOM 0 HH12 ARG A 123 0.619 18.835 -12.134 1.00 54.44 H new ATOM 0 HH21 ARG A 123 0.104 16.720 -9.361 1.00 12.00 H new ATOM 0 HH22 ARG A 123 0.682 18.296 -9.911 1.00 12.00 H new ATOM 1922 N THR A 124 1.262 11.876 -15.412 1.00 52.50 N ATOM 1923 CA THR A 124 0.681 11.308 -16.623 1.00 12.34 C ATOM 1924 C THR A 124 -0.752 10.851 -16.373 1.00 4.12 C ATOM 1925 O THR A 124 -1.654 11.147 -17.157 1.00 3.24 O ATOM 1926 CB THR A 124 1.523 10.129 -17.115 1.00 12.03 C ATOM 1927 OG1 THR A 124 1.322 8.993 -16.294 1.00 12.41 O ATOM 1928 CG2 THR A 124 3.006 10.422 -17.138 1.00 34.05 C ATOM 0 H THR A 124 1.225 11.262 -14.598 1.00 52.50 H new ATOM 0 HA THR A 124 0.671 12.083 -17.389 1.00 12.34 H new ATOM 0 HB THR A 124 1.190 9.942 -18.136 1.00 12.03 H new ATOM 0 HG1 THR A 124 1.690 9.165 -15.402 1.00 12.41 H new ATOM 0 HG21 THR A 124 3.545 9.545 -17.496 1.00 34.05 H new ATOM 0 HG22 THR A 124 3.200 11.264 -17.803 1.00 34.05 H new ATOM 0 HG23 THR A 124 3.344 10.669 -16.131 1.00 34.05 H new ATOM 1936 N VAL A 125 -0.953 10.128 -15.277 1.00 40.30 N ATOM 1937 CA VAL A 125 -2.270 9.628 -14.920 1.00 75.03 C ATOM 1938 C VAL A 125 -2.956 10.556 -13.923 1.00 33.14 C ATOM 1939 O VAL A 125 -2.718 10.474 -12.718 1.00 42.12 O ATOM 1940 CB VAL A 125 -2.177 8.217 -14.314 1.00 21.23 C ATOM 1941 CG1 VAL A 125 -3.563 7.655 -14.056 1.00 23.21 C ATOM 1942 CG2 VAL A 125 -1.382 7.295 -15.226 1.00 63.40 C ATOM 0 H VAL A 125 -0.215 9.876 -14.619 1.00 40.30 H new ATOM 0 HA VAL A 125 -2.860 9.588 -15.836 1.00 75.03 H new ATOM 0 HB VAL A 125 -1.654 8.286 -13.360 1.00 21.23 H new ATOM 0 HG11 VAL A 125 -3.477 6.657 -13.627 1.00 23.21 H new ATOM 0 HG12 VAL A 125 -4.095 8.304 -13.360 1.00 23.21 H new ATOM 0 HG13 VAL A 125 -4.114 7.600 -14.995 1.00 23.21 H new ATOM 0 HG21 VAL A 125 -1.327 6.302 -14.781 1.00 63.40 H new ATOM 0 HG22 VAL A 125 -1.874 7.231 -16.197 1.00 63.40 H new ATOM 0 HG23 VAL A 125 -0.375 7.691 -15.355 1.00 63.40 H new ATOM 1952 N GLU A 126 -3.808 11.439 -14.433 1.00 22.15 N ATOM 1953 CA GLU A 126 -4.528 12.382 -13.586 1.00 41.14 C ATOM 1954 C GLU A 126 -5.362 11.650 -12.540 1.00 12.41 C ATOM 1955 O GLU A 126 -5.676 10.470 -12.698 1.00 30.14 O ATOM 1956 CB GLU A 126 -5.428 13.281 -14.435 1.00 10.33 C ATOM 1957 CG GLU A 126 -6.270 12.520 -15.446 1.00 34.25 C ATOM 1958 CD GLU A 126 -7.365 13.374 -16.055 1.00 1.32 C ATOM 1959 OE1 GLU A 126 -7.689 14.430 -15.470 1.00 15.32 O ATOM 1960 OE2 GLU A 126 -7.899 12.988 -17.116 1.00 44.11 O ATOM 0 H GLU A 126 -4.017 11.521 -15.428 1.00 22.15 H new ATOM 0 HA GLU A 126 -3.793 13.000 -13.070 1.00 41.14 H new ATOM 0 HB2 GLU A 126 -6.088 13.845 -13.777 1.00 10.33 H new ATOM 0 HB3 GLU A 126 -4.809 14.006 -14.963 1.00 10.33 H new ATOM 0 HG2 GLU A 126 -5.625 12.143 -16.240 1.00 34.25 H new ATOM 0 HG3 GLU A 126 -6.718 11.653 -14.961 1.00 34.25 H new ATOM 1967 N SER A 127 -5.718 12.358 -11.473 1.00 4.24 N ATOM 1968 CA SER A 127 -6.516 11.777 -10.399 1.00 62.12 C ATOM 1969 C SER A 127 -7.822 11.199 -10.937 1.00 31.24 C ATOM 1970 O SER A 127 -8.361 10.239 -10.387 1.00 52.33 O ATOM 1971 CB SER A 127 -6.813 12.831 -9.332 1.00 65.42 C ATOM 1972 OG SER A 127 -7.850 12.404 -8.466 1.00 54.13 O ATOM 0 H SER A 127 -5.466 13.336 -11.329 1.00 4.24 H new ATOM 0 HA SER A 127 -5.941 10.966 -9.952 1.00 62.12 H new ATOM 0 HB2 SER A 127 -5.911 13.031 -8.753 1.00 65.42 H new ATOM 0 HB3 SER A 127 -7.098 13.768 -9.811 1.00 65.42 H new ATOM 0 HG SER A 127 -8.019 13.095 -7.792 1.00 54.13 H new ATOM 1978 N ARG A 128 -8.325 11.791 -12.016 1.00 32.14 N ATOM 1979 CA ARG A 128 -9.567 11.335 -12.630 1.00 61.52 C ATOM 1980 C ARG A 128 -9.450 9.882 -13.081 1.00 13.15 C ATOM 1981 O ARG A 128 -10.343 9.072 -12.835 1.00 0.02 O ATOM 1982 CB ARG A 128 -9.926 12.227 -13.822 1.00 74.54 C ATOM 1983 CG ARG A 128 -11.167 11.772 -14.574 1.00 31.41 C ATOM 1984 CD ARG A 128 -12.392 11.763 -13.674 1.00 54.12 C ATOM 1985 NE ARG A 128 -13.606 12.129 -14.401 1.00 4.23 N ATOM 1986 CZ ARG A 128 -14.787 12.323 -13.820 1.00 44.02 C ATOM 1987 NH1 ARG A 128 -14.921 12.180 -12.507 1.00 41.13 N ATOM 1988 NH2 ARG A 128 -15.839 12.660 -14.554 1.00 11.24 N ATOM 0 H ARG A 128 -7.891 12.587 -12.483 1.00 32.14 H new ATOM 0 HA ARG A 128 -10.359 11.400 -11.884 1.00 61.52 H new ATOM 0 HB2 ARG A 128 -10.080 13.246 -13.468 1.00 74.54 H new ATOM 0 HB3 ARG A 128 -9.083 12.253 -14.512 1.00 74.54 H new ATOM 0 HG2 ARG A 128 -11.342 12.433 -15.422 1.00 31.41 H new ATOM 0 HG3 ARG A 128 -11.003 10.773 -14.977 1.00 31.41 H new ATOM 0 HD2 ARG A 128 -12.515 10.771 -13.238 1.00 54.12 H new ATOM 0 HD3 ARG A 128 -12.240 12.458 -12.848 1.00 54.12 H new ATOM 0 HE ARG A 128 -13.544 12.242 -15.413 1.00 4.23 H new ATOM 0 HH11 ARG A 128 -14.116 11.920 -11.937 1.00 41.13 H new ATOM 0 HH12 ARG A 128 -15.829 12.330 -12.068 1.00 41.13 H new ATOM 0 HH21 ARG A 128 -15.742 12.770 -15.563 1.00 11.24 H new ATOM 0 HH22 ARG A 128 -16.745 12.809 -14.109 1.00 11.24 H new ATOM 2002 N GLN A 129 -8.345 9.561 -13.745 1.00 35.33 N ATOM 2003 CA GLN A 129 -8.112 8.207 -14.232 1.00 43.11 C ATOM 2004 C GLN A 129 -7.988 7.223 -13.073 1.00 42.53 C ATOM 2005 O GLN A 129 -8.358 6.056 -13.195 1.00 51.44 O ATOM 2006 CB GLN A 129 -6.847 8.163 -15.092 1.00 10.43 C ATOM 2007 CG GLN A 129 -6.752 9.305 -16.092 1.00 43.12 C ATOM 2008 CD GLN A 129 -6.389 8.832 -17.486 1.00 44.41 C ATOM 2009 OE1 GLN A 129 -7.038 7.947 -18.043 1.00 2.55 O ATOM 2010 NE2 GLN A 129 -5.344 9.420 -18.057 1.00 21.53 N ATOM 0 H GLN A 129 -7.597 10.220 -13.958 1.00 35.33 H new ATOM 0 HA GLN A 129 -8.968 7.915 -14.841 1.00 43.11 H new ATOM 0 HB2 GLN A 129 -5.973 8.188 -14.440 1.00 10.43 H new ATOM 0 HB3 GLN A 129 -6.816 7.216 -15.630 1.00 10.43 H new ATOM 0 HG2 GLN A 129 -7.706 9.831 -16.128 1.00 43.12 H new ATOM 0 HG3 GLN A 129 -6.005 10.021 -15.750 1.00 43.12 H new ATOM 0 HE21 GLN A 129 -4.834 10.150 -17.559 1.00 21.53 H new ATOM 0 HE22 GLN A 129 -5.051 9.142 -18.994 1.00 21.53 H new ATOM 2019 N ALA A 130 -7.464 7.702 -11.950 1.00 32.52 N ATOM 2020 CA ALA A 130 -7.290 6.864 -10.770 1.00 54.33 C ATOM 2021 C ALA A 130 -8.602 6.708 -10.007 1.00 21.55 C ATOM 2022 O ALA A 130 -8.901 5.637 -9.479 1.00 24.44 O ATOM 2023 CB ALA A 130 -6.216 7.445 -9.863 1.00 13.31 C ATOM 0 H ALA A 130 -7.152 8.666 -11.832 1.00 32.52 H new ATOM 0 HA ALA A 130 -6.974 5.875 -11.102 1.00 54.33 H new ATOM 0 HB1 ALA A 130 -6.097 6.809 -8.986 1.00 13.31 H new ATOM 0 HB2 ALA A 130 -5.271 7.497 -10.404 1.00 13.31 H new ATOM 0 HB3 ALA A 130 -6.509 8.446 -9.548 1.00 13.31 H new ATOM 2029 N GLN A 131 -9.381 7.783 -9.953 1.00 23.44 N ATOM 2030 CA GLN A 131 -10.661 7.764 -9.253 1.00 14.33 C ATOM 2031 C GLN A 131 -11.664 6.869 -9.974 1.00 41.43 C ATOM 2032 O GLN A 131 -12.521 6.248 -9.346 1.00 75.01 O ATOM 2033 CB GLN A 131 -11.220 9.184 -9.131 1.00 53.12 C ATOM 2034 CG GLN A 131 -10.933 9.838 -7.789 1.00 22.51 C ATOM 2035 CD GLN A 131 -12.192 10.103 -6.986 1.00 2.33 C ATOM 2036 OE1 GLN A 131 -12.720 11.215 -6.986 1.00 51.42 O ATOM 2037 NE2 GLN A 131 -12.679 9.079 -6.295 1.00 12.24 N ATOM 0 H GLN A 131 -9.149 8.678 -10.385 1.00 23.44 H new ATOM 0 HA GLN A 131 -10.495 7.359 -8.255 1.00 14.33 H new ATOM 0 HB2 GLN A 131 -10.798 9.801 -9.924 1.00 53.12 H new ATOM 0 HB3 GLN A 131 -12.298 9.156 -9.289 1.00 53.12 H new ATOM 0 HG2 GLN A 131 -10.267 9.196 -7.212 1.00 22.51 H new ATOM 0 HG3 GLN A 131 -10.407 10.778 -7.953 1.00 22.51 H new ATOM 0 HE21 GLN A 131 -12.209 8.174 -6.324 1.00 12.24 H new ATOM 0 HE22 GLN A 131 -13.523 9.197 -5.735 1.00 12.24 H new ATOM 2046 N ASP A 132 -11.552 6.809 -11.297 1.00 22.41 N ATOM 2047 CA ASP A 132 -12.450 5.990 -12.104 1.00 40.12 C ATOM 2048 C ASP A 132 -12.218 4.506 -11.843 1.00 31.20 C ATOM 2049 O ASP A 132 -13.144 3.699 -11.924 1.00 15.42 O ATOM 2050 CB ASP A 132 -12.255 6.295 -13.590 1.00 63.34 C ATOM 2051 CG ASP A 132 -13.443 5.865 -14.429 1.00 3.32 C ATOM 2052 OD1 ASP A 132 -14.544 5.704 -13.861 1.00 70.55 O ATOM 2053 OD2 ASP A 132 -13.272 5.689 -15.653 1.00 21.14 O ATOM 0 H ASP A 132 -10.849 7.317 -11.833 1.00 22.41 H new ATOM 0 HA ASP A 132 -13.474 6.233 -11.821 1.00 40.12 H new ATOM 0 HB2 ASP A 132 -12.090 7.365 -13.720 1.00 63.34 H new ATOM 0 HB3 ASP A 132 -11.359 5.788 -13.948 1.00 63.34 H new ATOM 2058 N LEU A 133 -10.976 4.151 -11.531 1.00 12.20 N ATOM 2059 CA LEU A 133 -10.623 2.763 -11.259 1.00 65.23 C ATOM 2060 C LEU A 133 -11.035 2.362 -9.846 1.00 20.42 C ATOM 2061 O LEU A 133 -11.700 1.346 -9.647 1.00 44.42 O ATOM 2062 CB LEU A 133 -9.119 2.551 -11.446 1.00 25.31 C ATOM 2063 CG LEU A 133 -8.605 1.162 -11.066 1.00 44.12 C ATOM 2064 CD1 LEU A 133 -8.975 0.145 -12.134 1.00 53.21 C ATOM 2065 CD2 LEU A 133 -7.099 1.192 -10.855 1.00 3.34 C ATOM 0 H LEU A 133 -10.197 4.806 -11.460 1.00 12.20 H new ATOM 0 HA LEU A 133 -11.162 2.132 -11.966 1.00 65.23 H new ATOM 0 HB2 LEU A 133 -8.869 2.740 -12.490 1.00 25.31 H new ATOM 0 HB3 LEU A 133 -8.587 3.293 -10.851 1.00 25.31 H new ATOM 0 HG LEU A 133 -9.078 0.863 -10.130 1.00 44.12 H new ATOM 0 HD11 LEU A 133 -8.601 -0.837 -11.846 1.00 53.21 H new ATOM 0 HD12 LEU A 133 -10.059 0.104 -12.238 1.00 53.21 H new ATOM 0 HD13 LEU A 133 -8.530 0.438 -13.085 1.00 53.21 H new ATOM 0 HD21 LEU A 133 -6.749 0.195 -10.585 1.00 3.34 H new ATOM 0 HD22 LEU A 133 -6.609 1.512 -11.775 1.00 3.34 H new ATOM 0 HD23 LEU A 133 -6.858 1.890 -10.054 1.00 3.34 H new ATOM 2077 N ALA A 134 -10.634 3.167 -8.868 1.00 13.02 N ATOM 2078 CA ALA A 134 -10.959 2.896 -7.473 1.00 25.23 C ATOM 2079 C ALA A 134 -12.464 2.952 -7.237 1.00 34.13 C ATOM 2080 O ALA A 134 -13.020 2.121 -6.518 1.00 14.01 O ATOM 2081 CB ALA A 134 -10.245 3.884 -6.564 1.00 33.10 C ATOM 0 H ALA A 134 -10.083 4.013 -9.016 1.00 13.02 H new ATOM 0 HA ALA A 134 -10.618 1.888 -7.237 1.00 25.23 H new ATOM 0 HB1 ALA A 134 -10.497 3.670 -5.525 1.00 33.10 H new ATOM 0 HB2 ALA A 134 -9.168 3.793 -6.703 1.00 33.10 H new ATOM 0 HB3 ALA A 134 -10.558 4.898 -6.812 1.00 33.10 H new ATOM 2087 N ARG A 135 -13.120 3.935 -7.845 1.00 24.13 N ATOM 2088 CA ARG A 135 -14.560 4.097 -7.700 1.00 23.12 C ATOM 2089 C ARG A 135 -15.305 2.890 -8.265 1.00 52.24 C ATOM 2090 O ARG A 135 -16.413 2.576 -7.833 1.00 20.35 O ATOM 2091 CB ARG A 135 -15.021 5.378 -8.401 1.00 44.25 C ATOM 2092 CG ARG A 135 -16.532 5.522 -8.485 1.00 20.43 C ATOM 2093 CD ARG A 135 -17.053 5.085 -9.843 1.00 73.23 C ATOM 2094 NE ARG A 135 -18.302 5.758 -10.195 1.00 1.30 N ATOM 2095 CZ ARG A 135 -19.115 5.350 -11.167 1.00 53.32 C ATOM 2096 NH1 ARG A 135 -18.822 4.267 -11.876 1.00 53.53 N ATOM 2097 NH2 ARG A 135 -20.225 6.026 -11.430 1.00 63.13 N ATOM 0 H ARG A 135 -12.676 4.632 -8.443 1.00 24.13 H new ATOM 0 HA ARG A 135 -14.789 4.172 -6.637 1.00 23.12 H new ATOM 0 HB2 ARG A 135 -14.612 6.238 -7.871 1.00 44.25 H new ATOM 0 HB3 ARG A 135 -14.607 5.399 -9.409 1.00 44.25 H new ATOM 0 HG2 ARG A 135 -17.001 4.924 -7.704 1.00 20.43 H new ATOM 0 HG3 ARG A 135 -16.811 6.560 -8.303 1.00 20.43 H new ATOM 0 HD2 ARG A 135 -16.301 5.295 -10.604 1.00 73.23 H new ATOM 0 HD3 ARG A 135 -17.211 4.007 -9.840 1.00 73.23 H new ATOM 0 HE ARG A 135 -18.566 6.589 -9.665 1.00 1.30 H new ATOM 0 HH11 ARG A 135 -17.970 3.742 -11.677 1.00 53.53 H new ATOM 0 HH12 ARG A 135 -19.449 3.959 -12.620 1.00 53.53 H new ATOM 0 HH21 ARG A 135 -20.456 6.858 -10.888 1.00 63.13 H new ATOM 0 HH22 ARG A 135 -20.848 5.714 -12.175 1.00 63.13 H new ATOM 2111 N SER A 136 -14.690 2.219 -9.233 1.00 23.31 N ATOM 2112 CA SER A 136 -15.300 1.049 -9.853 1.00 70.15 C ATOM 2113 C SER A 136 -15.193 -0.168 -8.939 1.00 12.44 C ATOM 2114 O SER A 136 -16.081 -1.020 -8.917 1.00 14.51 O ATOM 2115 CB SER A 136 -14.637 0.752 -11.199 1.00 40.24 C ATOM 2116 OG SER A 136 -15.493 -0.011 -12.032 1.00 13.34 O ATOM 0 H SER A 136 -13.772 2.465 -9.604 1.00 23.31 H new ATOM 0 HA SER A 136 -16.355 1.266 -10.018 1.00 70.15 H new ATOM 0 HB2 SER A 136 -14.380 1.688 -11.696 1.00 40.24 H new ATOM 0 HB3 SER A 136 -13.705 0.211 -11.037 1.00 40.24 H new ATOM 0 HG SER A 136 -15.047 -0.186 -12.887 1.00 13.34 H new ATOM 2122 N TYR A 137 -14.100 -0.242 -8.186 1.00 40.24 N ATOM 2123 CA TYR A 137 -13.876 -1.355 -7.271 1.00 54.44 C ATOM 2124 C TYR A 137 -14.578 -1.127 -5.933 1.00 71.15 C ATOM 2125 O TYR A 137 -14.578 -2.001 -5.067 1.00 55.41 O ATOM 2126 CB TYR A 137 -12.378 -1.557 -7.045 1.00 5.25 C ATOM 2127 CG TYR A 137 -11.628 -1.976 -8.289 1.00 24.23 C ATOM 2128 CD1 TYR A 137 -12.167 -2.906 -9.168 1.00 5.11 C ATOM 2129 CD2 TYR A 137 -10.381 -1.440 -8.581 1.00 1.12 C ATOM 2130 CE1 TYR A 137 -11.483 -3.291 -10.306 1.00 2.12 C ATOM 2131 CE2 TYR A 137 -9.690 -1.820 -9.717 1.00 42.30 C ATOM 2132 CZ TYR A 137 -10.245 -2.745 -10.575 1.00 12.54 C ATOM 2133 OH TYR A 137 -9.560 -3.127 -11.706 1.00 22.52 O ATOM 0 H TYR A 137 -13.356 0.456 -8.192 1.00 40.24 H new ATOM 0 HA TYR A 137 -14.298 -2.251 -7.726 1.00 54.44 H new ATOM 0 HB2 TYR A 137 -11.948 -0.629 -6.667 1.00 5.25 H new ATOM 0 HB3 TYR A 137 -12.234 -2.313 -6.273 1.00 5.25 H new ATOM 0 HD1 TYR A 137 -13.136 -3.335 -8.959 1.00 5.11 H new ATOM 0 HD2 TYR A 137 -9.944 -0.715 -7.910 1.00 1.12 H new ATOM 0 HE1 TYR A 137 -11.915 -4.015 -10.981 1.00 2.12 H new ATOM 0 HE2 TYR A 137 -8.721 -1.394 -9.931 1.00 42.30 H new ATOM 0 HH TYR A 137 -10.198 -3.370 -12.409 1.00 22.52 H new ATOM 2143 N GLY A 138 -15.176 0.050 -5.769 1.00 52.33 N ATOM 2144 CA GLY A 138 -15.870 0.362 -4.533 1.00 62.22 C ATOM 2145 C GLY A 138 -14.918 0.689 -3.398 1.00 31.22 C ATOM 2146 O GLY A 138 -15.280 0.583 -2.226 1.00 14.33 O ATOM 0 H GLY A 138 -15.192 0.792 -6.469 1.00 52.33 H new ATOM 0 HA2 GLY A 138 -16.537 1.208 -4.698 1.00 62.22 H new ATOM 0 HA3 GLY A 138 -16.494 -0.485 -4.247 1.00 62.22 H new ATOM 2150 N ILE A 139 -13.698 1.087 -3.746 1.00 0.41 N ATOM 2151 CA ILE A 139 -12.693 1.430 -2.747 1.00 71.44 C ATOM 2152 C ILE A 139 -12.361 2.919 -2.783 1.00 2.23 C ATOM 2153 O ILE A 139 -12.505 3.571 -3.817 1.00 1.21 O ATOM 2154 CB ILE A 139 -11.403 0.630 -2.952 1.00 73.21 C ATOM 2155 CG1 ILE A 139 -10.950 0.729 -4.402 1.00 63.45 C ATOM 2156 CG2 ILE A 139 -11.611 -0.823 -2.551 1.00 24.44 C ATOM 2157 CD1 ILE A 139 -9.668 -0.008 -4.664 1.00 62.31 C ATOM 0 H ILE A 139 -13.382 1.180 -4.711 1.00 0.41 H new ATOM 0 HA ILE A 139 -13.120 1.179 -1.776 1.00 71.44 H new ATOM 0 HB ILE A 139 -10.623 1.051 -2.317 1.00 73.21 H new ATOM 0 HG12 ILE A 139 -11.731 0.331 -5.050 1.00 63.45 H new ATOM 0 HG13 ILE A 139 -10.821 1.779 -4.666 1.00 63.45 H new ATOM 0 HG21 ILE A 139 -10.685 -1.378 -2.702 1.00 24.44 H new ATOM 0 HG22 ILE A 139 -11.896 -0.873 -1.500 1.00 24.44 H new ATOM 0 HG23 ILE A 139 -12.400 -1.260 -3.163 1.00 24.44 H new ATOM 0 HD11 ILE A 139 -9.395 0.098 -5.714 1.00 62.31 H new ATOM 0 HD12 ILE A 139 -8.876 0.406 -4.040 1.00 62.31 H new ATOM 0 HD13 ILE A 139 -9.801 -1.064 -4.429 1.00 62.31 H new ATOM 2169 N PRO A 140 -11.905 3.479 -1.648 1.00 13.35 N ATOM 2170 CA PRO A 140 -11.549 4.898 -1.557 1.00 33.24 C ATOM 2171 C PRO A 140 -10.269 5.221 -2.321 1.00 53.41 C ATOM 2172 O PRO A 140 -9.500 4.325 -2.670 1.00 52.02 O ATOM 2173 CB PRO A 140 -11.347 5.118 -0.057 1.00 30.22 C ATOM 2174 CG PRO A 140 -10.966 3.780 0.473 1.00 34.22 C ATOM 2175 CD PRO A 140 -11.701 2.773 -0.369 1.00 65.32 C ATOM 0 HA PRO A 140 -12.313 5.540 -1.995 1.00 33.24 H new ATOM 0 HB2 PRO A 140 -10.568 5.856 0.134 1.00 30.22 H new ATOM 0 HB3 PRO A 140 -12.258 5.487 0.415 1.00 30.22 H new ATOM 0 HG2 PRO A 140 -9.888 3.628 0.410 1.00 34.22 H new ATOM 0 HG3 PRO A 140 -11.241 3.684 1.523 1.00 34.22 H new ATOM 0 HD2 PRO A 140 -11.120 1.860 -0.502 1.00 65.32 H new ATOM 0 HD3 PRO A 140 -12.648 2.484 0.086 1.00 65.32 H new ATOM 2183 N TYR A 141 -10.046 6.506 -2.578 1.00 65.21 N ATOM 2184 CA TYR A 141 -8.859 6.946 -3.302 1.00 22.11 C ATOM 2185 C TYR A 141 -8.183 8.111 -2.584 1.00 22.22 C ATOM 2186 O TYR A 141 -8.800 9.150 -2.347 1.00 33.43 O ATOM 2187 CB TYR A 141 -9.229 7.353 -4.732 1.00 43.51 C ATOM 2188 CG TYR A 141 -8.105 8.027 -5.489 1.00 51.24 C ATOM 2189 CD1 TYR A 141 -6.993 7.307 -5.908 1.00 35.03 C ATOM 2190 CD2 TYR A 141 -8.157 9.384 -5.782 1.00 22.44 C ATOM 2191 CE1 TYR A 141 -5.964 7.921 -6.598 1.00 45.11 C ATOM 2192 CE2 TYR A 141 -7.133 10.005 -6.472 1.00 64.55 C ATOM 2193 CZ TYR A 141 -6.039 9.270 -6.877 1.00 20.44 C ATOM 2194 OH TYR A 141 -5.018 9.885 -7.564 1.00 62.50 O ATOM 0 H TYR A 141 -10.672 7.261 -2.296 1.00 65.21 H new ATOM 0 HA TYR A 141 -8.157 6.113 -3.340 1.00 22.11 H new ATOM 0 HB2 TYR A 141 -9.543 6.466 -5.282 1.00 43.51 H new ATOM 0 HB3 TYR A 141 -10.085 8.026 -4.697 1.00 43.51 H new ATOM 0 HD1 TYR A 141 -6.931 6.251 -5.691 1.00 35.03 H new ATOM 0 HD2 TYR A 141 -9.012 9.963 -5.465 1.00 22.44 H new ATOM 0 HE1 TYR A 141 -5.106 7.348 -6.917 1.00 45.11 H new ATOM 0 HE2 TYR A 141 -7.189 11.061 -6.693 1.00 64.55 H new ATOM 0 HH TYR A 141 -5.227 10.835 -7.679 1.00 62.50 H new ATOM 2204 N ILE A 142 -6.912 7.929 -2.241 1.00 0.04 N ATOM 2205 CA ILE A 142 -6.150 8.959 -1.554 1.00 11.22 C ATOM 2206 C ILE A 142 -4.936 9.380 -2.377 1.00 53.34 C ATOM 2207 O ILE A 142 -4.450 8.623 -3.217 1.00 70.43 O ATOM 2208 CB ILE A 142 -5.678 8.470 -0.171 1.00 75.25 C ATOM 2209 CG1 ILE A 142 -6.868 7.975 0.655 1.00 73.03 C ATOM 2210 CG2 ILE A 142 -4.943 9.581 0.560 1.00 43.51 C ATOM 2211 CD1 ILE A 142 -6.862 6.479 0.886 1.00 13.35 C ATOM 0 H ILE A 142 -6.389 7.074 -2.429 1.00 0.04 H new ATOM 0 HA ILE A 142 -6.810 9.816 -1.423 1.00 11.22 H new ATOM 0 HB ILE A 142 -4.989 7.637 -0.312 1.00 75.25 H new ATOM 0 HG12 ILE A 142 -6.868 8.484 1.619 1.00 73.03 H new ATOM 0 HG13 ILE A 142 -7.792 8.253 0.149 1.00 73.03 H new ATOM 0 HG21 ILE A 142 -4.616 9.220 1.535 1.00 43.51 H new ATOM 0 HG22 ILE A 142 -4.075 9.888 -0.023 1.00 43.51 H new ATOM 0 HG23 ILE A 142 -5.610 10.432 0.693 1.00 43.51 H new ATOM 0 HD11 ILE A 142 -7.733 6.199 1.478 1.00 13.35 H new ATOM 0 HD12 ILE A 142 -6.894 5.963 -0.073 1.00 13.35 H new ATOM 0 HD13 ILE A 142 -5.955 6.197 1.420 1.00 13.35 H new ATOM 2223 N GLU A 143 -4.449 10.592 -2.129 1.00 30.24 N ATOM 2224 CA GLU A 143 -3.290 11.112 -2.847 1.00 50.51 C ATOM 2225 C GLU A 143 -2.195 11.534 -1.874 1.00 63.13 C ATOM 2226 O GLU A 143 -2.422 12.357 -0.988 1.00 22.10 O ATOM 2227 CB GLU A 143 -3.695 12.299 -3.724 1.00 44.45 C ATOM 2228 CG GLU A 143 -4.835 11.989 -4.679 1.00 11.52 C ATOM 2229 CD GLU A 143 -6.164 12.536 -4.197 1.00 2.42 C ATOM 2230 OE1 GLU A 143 -6.833 11.851 -3.396 1.00 74.32 O ATOM 2231 OE2 GLU A 143 -6.536 13.650 -4.622 1.00 31.00 O ATOM 0 H GLU A 143 -4.838 11.232 -1.437 1.00 30.24 H new ATOM 0 HA GLU A 143 -2.901 10.317 -3.483 1.00 50.51 H new ATOM 0 HB2 GLU A 143 -3.985 13.131 -3.083 1.00 44.45 H new ATOM 0 HB3 GLU A 143 -2.829 12.627 -4.299 1.00 44.45 H new ATOM 0 HG2 GLU A 143 -4.607 12.409 -5.659 1.00 11.52 H new ATOM 0 HG3 GLU A 143 -4.915 10.909 -4.805 1.00 11.52 H new ATOM 2238 N THR A 144 -1.007 10.964 -2.043 1.00 10.12 N ATOM 2239 CA THR A 144 0.121 11.281 -1.176 1.00 21.23 C ATOM 2240 C THR A 144 1.397 11.482 -1.987 1.00 31.33 C ATOM 2241 O THR A 144 1.401 11.327 -3.208 1.00 34.45 O ATOM 2242 CB THR A 144 0.328 10.169 -0.147 1.00 35.30 C ATOM 2243 OG1 THR A 144 0.738 8.970 -0.780 1.00 64.51 O ATOM 2244 CG2 THR A 144 -0.915 9.862 0.659 1.00 22.42 C ATOM 0 H THR A 144 -0.801 10.281 -2.772 1.00 10.12 H new ATOM 0 HA THR A 144 -0.106 12.212 -0.656 1.00 21.23 H new ATOM 0 HB THR A 144 1.098 10.540 0.530 1.00 35.30 H new ATOM 0 HG1 THR A 144 0.867 8.271 -0.105 1.00 64.51 H new ATOM 0 HG21 THR A 144 -0.700 9.064 1.370 1.00 22.42 H new ATOM 0 HG22 THR A 144 -1.228 10.755 1.199 1.00 22.42 H new ATOM 0 HG23 THR A 144 -1.714 9.545 -0.011 1.00 22.42 H new ATOM 2252 N SER A 145 2.479 11.829 -1.297 1.00 14.31 N ATOM 2253 CA SER A 145 3.764 12.052 -1.950 1.00 34.25 C ATOM 2254 C SER A 145 4.917 11.700 -1.015 1.00 31.42 C ATOM 2255 O SER A 145 5.113 12.344 0.015 1.00 40.44 O ATOM 2256 CB SER A 145 3.884 13.509 -2.400 1.00 20.32 C ATOM 2257 OG SER A 145 3.252 14.382 -1.480 1.00 24.22 O ATOM 0 H SER A 145 2.491 11.962 -0.286 1.00 14.31 H new ATOM 0 HA SER A 145 3.817 11.403 -2.824 1.00 34.25 H new ATOM 0 HB2 SER A 145 4.936 13.777 -2.496 1.00 20.32 H new ATOM 0 HB3 SER A 145 3.433 13.627 -3.386 1.00 20.32 H new ATOM 0 HG SER A 145 3.392 15.310 -1.761 1.00 24.22 H new ATOM 2263 N ALA A 146 5.675 10.672 -1.381 1.00 74.11 N ATOM 2264 CA ALA A 146 6.808 10.230 -0.576 1.00 13.35 C ATOM 2265 C ALA A 146 7.893 11.301 -0.506 1.00 42.34 C ATOM 2266 O ALA A 146 8.682 11.335 0.438 1.00 23.51 O ATOM 2267 CB ALA A 146 7.381 8.938 -1.139 1.00 21.11 C ATOM 0 H ALA A 146 5.525 10.129 -2.231 1.00 74.11 H new ATOM 0 HA ALA A 146 6.449 10.050 0.437 1.00 13.35 H new ATOM 0 HB1 ALA A 146 8.226 8.619 -0.529 1.00 21.11 H new ATOM 0 HB2 ALA A 146 6.613 8.164 -1.129 1.00 21.11 H new ATOM 0 HB3 ALA A 146 7.715 9.104 -2.163 1.00 21.11 H new ATOM 2273 N LYS A 147 7.932 12.170 -1.512 1.00 12.01 N ATOM 2274 CA LYS A 147 8.929 13.234 -1.561 1.00 12.25 C ATOM 2275 C LYS A 147 8.530 14.406 -0.668 1.00 71.11 C ATOM 2276 O LYS A 147 9.193 14.692 0.329 1.00 23.11 O ATOM 2277 CB LYS A 147 9.116 13.716 -3.001 1.00 24.13 C ATOM 2278 CG LYS A 147 10.559 14.035 -3.354 1.00 75.20 C ATOM 2279 CD LYS A 147 11.349 12.773 -3.662 1.00 53.50 C ATOM 2280 CE LYS A 147 12.821 12.941 -3.325 1.00 71.44 C ATOM 2281 NZ LYS A 147 13.685 12.047 -4.145 1.00 23.53 N ATOM 0 H LYS A 147 7.287 12.158 -2.302 1.00 12.01 H new ATOM 0 HA LYS A 147 9.871 12.829 -1.191 1.00 12.25 H new ATOM 0 HB2 LYS A 147 8.745 12.950 -3.682 1.00 24.13 H new ATOM 0 HB3 LYS A 147 8.507 14.606 -3.159 1.00 24.13 H new ATOM 0 HG2 LYS A 147 10.585 14.701 -4.216 1.00 75.20 H new ATOM 0 HG3 LYS A 147 11.028 14.566 -2.526 1.00 75.20 H new ATOM 0 HD2 LYS A 147 10.938 11.938 -3.095 1.00 53.50 H new ATOM 0 HD3 LYS A 147 11.243 12.525 -4.718 1.00 53.50 H new ATOM 0 HE2 LYS A 147 13.114 13.978 -3.488 1.00 71.44 H new ATOM 0 HE3 LYS A 147 12.978 12.727 -2.268 1.00 71.44 H new ATOM 0 HZ1 LYS A 147 14.681 12.192 -3.884 1.00 23.53 H new ATOM 0 HZ2 LYS A 147 13.423 11.056 -3.971 1.00 23.53 H new ATOM 0 HZ3 LYS A 147 13.555 12.268 -5.153 1.00 23.53 H new ATOM 2295 N THR A 148 7.447 15.083 -1.035 1.00 1.44 N ATOM 2296 CA THR A 148 6.965 16.227 -0.268 1.00 23.34 C ATOM 2297 C THR A 148 6.325 15.787 1.047 1.00 61.50 C ATOM 2298 O THR A 148 6.160 16.592 1.964 1.00 32.32 O ATOM 2299 CB THR A 148 5.958 17.033 -1.091 1.00 20.33 C ATOM 2300 OG1 THR A 148 4.959 16.188 -1.634 1.00 11.53 O ATOM 2301 CG2 THR A 148 6.594 17.793 -2.236 1.00 62.21 C ATOM 0 H THR A 148 6.887 14.860 -1.858 1.00 1.44 H new ATOM 0 HA THR A 148 7.825 16.855 -0.035 1.00 23.34 H new ATOM 0 HB THR A 148 5.526 17.752 -0.395 1.00 20.33 H new ATOM 0 HG1 THR A 148 4.930 15.349 -1.129 1.00 11.53 H new ATOM 0 HG21 THR A 148 5.825 18.343 -2.779 1.00 62.21 H new ATOM 0 HG22 THR A 148 7.332 18.493 -1.843 1.00 62.21 H new ATOM 0 HG23 THR A 148 7.083 17.091 -2.911 1.00 62.21 H new ATOM 2309 N ARG A 149 5.963 14.510 1.137 1.00 64.40 N ATOM 2310 CA ARG A 149 5.340 13.978 2.344 1.00 41.13 C ATOM 2311 C ARG A 149 4.001 14.661 2.605 1.00 33.11 C ATOM 2312 O ARG A 149 3.837 15.375 3.595 1.00 12.44 O ATOM 2313 CB ARG A 149 6.267 14.165 3.548 1.00 23.54 C ATOM 2314 CG ARG A 149 6.048 13.142 4.650 1.00 51.43 C ATOM 2315 CD ARG A 149 4.846 13.498 5.509 1.00 4.42 C ATOM 2316 NE ARG A 149 4.623 12.521 6.572 1.00 3.20 N ATOM 2317 CZ ARG A 149 5.320 12.486 7.705 1.00 2.31 C ATOM 2318 NH1 ARG A 149 6.284 13.371 7.927 1.00 34.51 N ATOM 2319 NH2 ARG A 149 5.052 11.564 8.620 1.00 34.12 N ATOM 0 H ARG A 149 6.090 13.827 0.390 1.00 64.40 H new ATOM 0 HA ARG A 149 5.163 12.913 2.196 1.00 41.13 H new ATOM 0 HB2 ARG A 149 7.302 14.108 3.211 1.00 23.54 H new ATOM 0 HB3 ARG A 149 6.120 15.164 3.957 1.00 23.54 H new ATOM 0 HG2 ARG A 149 5.902 12.156 4.209 1.00 51.43 H new ATOM 0 HG3 ARG A 149 6.939 13.083 5.275 1.00 51.43 H new ATOM 0 HD2 ARG A 149 4.994 14.484 5.949 1.00 4.42 H new ATOM 0 HD3 ARG A 149 3.957 13.559 4.881 1.00 4.42 H new ATOM 0 HE ARG A 149 3.890 11.825 6.438 1.00 3.20 H new ATOM 0 HH11 ARG A 149 6.494 14.083 7.227 1.00 34.51 H new ATOM 0 HH12 ARG A 149 6.815 13.339 8.797 1.00 34.51 H new ATOM 0 HH21 ARG A 149 4.312 10.882 8.455 1.00 34.12 H new ATOM 0 HH22 ARG A 149 5.586 11.537 9.489 1.00 34.12 H new ATOM 2333 N GLN A 150 3.047 14.441 1.706 1.00 3.13 N ATOM 2334 CA GLN A 150 1.723 15.038 1.833 1.00 31.22 C ATOM 2335 C GLN A 150 0.657 13.969 2.056 1.00 52.21 C ATOM 2336 O GLN A 150 0.545 13.019 1.282 1.00 4.24 O ATOM 2337 CB GLN A 150 1.391 15.853 0.581 1.00 0.31 C ATOM 2338 CG GLN A 150 0.011 16.491 0.615 1.00 45.12 C ATOM 2339 CD GLN A 150 0.055 17.988 0.387 1.00 41.12 C ATOM 2340 OE1 GLN A 150 -0.179 18.776 1.304 1.00 30.55 O ATOM 2341 NE2 GLN A 150 0.355 18.386 -0.842 1.00 14.12 N ATOM 0 H GLN A 150 3.167 13.853 0.881 1.00 3.13 H new ATOM 0 HA GLN A 150 1.731 15.698 2.701 1.00 31.22 H new ATOM 0 HB2 GLN A 150 2.140 16.635 0.458 1.00 0.31 H new ATOM 0 HB3 GLN A 150 1.461 15.205 -0.293 1.00 0.31 H new ATOM 0 HG2 GLN A 150 -0.617 16.030 -0.147 1.00 45.12 H new ATOM 0 HG3 GLN A 150 -0.455 16.288 1.579 1.00 45.12 H new ATOM 0 HE21 GLN A 150 0.541 17.696 -1.570 1.00 14.12 H new ATOM 0 HE22 GLN A 150 0.399 19.382 -1.059 1.00 14.12 H new ATOM 2350 N GLY A 151 -0.126 14.134 3.118 1.00 43.35 N ATOM 2351 CA GLY A 151 -1.179 13.181 3.426 1.00 75.33 C ATOM 2352 C GLY A 151 -0.695 11.743 3.416 1.00 21.31 C ATOM 2353 O GLY A 151 -1.474 10.821 3.173 1.00 55.23 O ATOM 0 H GLY A 151 -0.050 14.913 3.773 1.00 43.35 H new ATOM 0 HA2 GLY A 151 -1.596 13.412 4.406 1.00 75.33 H new ATOM 0 HA3 GLY A 151 -1.986 13.292 2.702 1.00 75.33 H new ATOM 2357 N VAL A 152 0.594 11.550 3.681 1.00 52.41 N ATOM 2358 CA VAL A 152 1.177 10.214 3.702 1.00 51.52 C ATOM 2359 C VAL A 152 0.448 9.312 4.692 1.00 51.30 C ATOM 2360 O VAL A 152 -0.035 8.239 4.332 1.00 23.42 O ATOM 2361 CB VAL A 152 2.672 10.261 4.071 1.00 11.44 C ATOM 2362 CG1 VAL A 152 3.303 8.883 3.934 1.00 34.45 C ATOM 2363 CG2 VAL A 152 3.401 11.280 3.208 1.00 10.33 C ATOM 0 H VAL A 152 1.253 12.301 3.884 1.00 52.41 H new ATOM 0 HA VAL A 152 1.071 9.806 2.697 1.00 51.52 H new ATOM 0 HB VAL A 152 2.761 10.570 5.112 1.00 11.44 H new ATOM 0 HG11 VAL A 152 4.359 8.938 4.199 1.00 34.45 H new ATOM 0 HG12 VAL A 152 2.798 8.184 4.600 1.00 34.45 H new ATOM 0 HG13 VAL A 152 3.205 8.539 2.904 1.00 34.45 H new ATOM 0 HG21 VAL A 152 4.456 11.300 3.482 1.00 10.33 H new ATOM 0 HG22 VAL A 152 3.304 11.004 2.158 1.00 10.33 H new ATOM 0 HG23 VAL A 152 2.966 12.267 3.365 1.00 10.33 H new ATOM 2373 N GLU A 153 0.369 9.758 5.941 1.00 50.01 N ATOM 2374 CA GLU A 153 -0.305 8.994 6.985 1.00 41.03 C ATOM 2375 C GLU A 153 -1.800 8.885 6.699 1.00 1.42 C ATOM 2376 O GLU A 153 -2.454 7.931 7.121 1.00 54.01 O ATOM 2377 CB GLU A 153 -0.081 9.648 8.349 1.00 2.05 C ATOM 2378 CG GLU A 153 1.386 9.870 8.682 1.00 40.21 C ATOM 2379 CD GLU A 153 1.655 9.848 10.173 1.00 51.44 C ATOM 2380 OE1 GLU A 153 1.136 8.940 10.857 1.00 15.42 O ATOM 2381 OE2 GLU A 153 2.385 10.737 10.659 1.00 62.10 O ATOM 0 H GLU A 153 0.763 10.645 6.255 1.00 50.01 H new ATOM 0 HA GLU A 153 0.119 7.990 6.998 1.00 41.03 H new ATOM 0 HB2 GLU A 153 -0.600 10.606 8.373 1.00 2.05 H new ATOM 0 HB3 GLU A 153 -0.530 9.023 9.121 1.00 2.05 H new ATOM 0 HG2 GLU A 153 1.985 9.100 8.197 1.00 40.21 H new ATOM 0 HG3 GLU A 153 1.707 10.828 8.273 1.00 40.21 H new ATOM 2388 N ASP A 154 -2.335 9.868 5.980 1.00 23.14 N ATOM 2389 CA ASP A 154 -3.753 9.882 5.638 1.00 71.32 C ATOM 2390 C ASP A 154 -4.145 8.612 4.888 1.00 73.21 C ATOM 2391 O ASP A 154 -5.214 8.047 5.119 1.00 45.43 O ATOM 2392 CB ASP A 154 -4.083 11.114 4.791 1.00 33.31 C ATOM 2393 CG ASP A 154 -5.338 11.820 5.263 1.00 24.43 C ATOM 2394 OD1 ASP A 154 -6.373 11.142 5.434 1.00 21.22 O ATOM 2395 OD2 ASP A 154 -5.287 13.053 5.461 1.00 52.21 O ATOM 0 H ASP A 154 -1.808 10.665 5.623 1.00 23.14 H new ATOM 0 HA ASP A 154 -4.325 9.924 6.565 1.00 71.32 H new ATOM 0 HB2 ASP A 154 -3.244 11.809 4.824 1.00 33.31 H new ATOM 0 HB3 ASP A 154 -4.208 10.814 3.751 1.00 33.31 H new ATOM 2400 N ALA A 155 -3.272 8.168 3.989 1.00 64.05 N ATOM 2401 CA ALA A 155 -3.526 6.965 3.207 1.00 3.42 C ATOM 2402 C ALA A 155 -3.472 5.720 4.086 1.00 11.04 C ATOM 2403 O ALA A 155 -4.366 4.876 4.040 1.00 34.22 O ATOM 2404 CB ALA A 155 -2.523 6.855 2.068 1.00 14.53 C ATOM 0 H ALA A 155 -2.383 8.624 3.785 1.00 64.05 H new ATOM 0 HA ALA A 155 -4.529 7.038 2.786 1.00 3.42 H new ATOM 0 HB1 ALA A 155 -2.724 5.952 1.492 1.00 14.53 H new ATOM 0 HB2 ALA A 155 -2.612 7.726 1.419 1.00 14.53 H new ATOM 0 HB3 ALA A 155 -1.513 6.808 2.476 1.00 14.53 H new ATOM 2410 N PHE A 156 -2.417 5.615 4.888 1.00 31.34 N ATOM 2411 CA PHE A 156 -2.245 4.474 5.781 1.00 54.44 C ATOM 2412 C PHE A 156 -3.421 4.358 6.743 1.00 52.40 C ATOM 2413 O PHE A 156 -3.978 3.276 6.933 1.00 12.13 O ATOM 2414 CB PHE A 156 -0.941 4.608 6.567 1.00 23.21 C ATOM 2415 CG PHE A 156 0.279 4.254 5.767 1.00 52.35 C ATOM 2416 CD1 PHE A 156 0.694 2.937 5.661 1.00 51.23 C ATOM 2417 CD2 PHE A 156 1.009 5.238 5.121 1.00 31.43 C ATOM 2418 CE1 PHE A 156 1.816 2.607 4.925 1.00 20.21 C ATOM 2419 CE2 PHE A 156 2.132 4.915 4.384 1.00 45.13 C ATOM 2420 CZ PHE A 156 2.536 3.597 4.285 1.00 63.24 C ATOM 0 H PHE A 156 -1.668 6.306 4.938 1.00 31.34 H new ATOM 0 HA PHE A 156 -2.203 3.570 5.173 1.00 54.44 H new ATOM 0 HB2 PHE A 156 -0.846 5.633 6.926 1.00 23.21 H new ATOM 0 HB3 PHE A 156 -0.988 3.966 7.446 1.00 23.21 H new ATOM 0 HD1 PHE A 156 0.134 2.159 6.159 1.00 51.23 H new ATOM 0 HD2 PHE A 156 0.697 6.269 5.194 1.00 31.43 H new ATOM 0 HE1 PHE A 156 2.130 1.576 4.850 1.00 20.21 H new ATOM 0 HE2 PHE A 156 2.694 5.691 3.886 1.00 45.13 H new ATOM 0 HZ PHE A 156 3.413 3.342 3.708 1.00 63.24 H new ATOM 2430 N TYR A 157 -3.794 5.481 7.349 1.00 14.40 N ATOM 2431 CA TYR A 157 -4.906 5.510 8.294 1.00 3.45 C ATOM 2432 C TYR A 157 -6.165 4.910 7.674 1.00 32.11 C ATOM 2433 O TYR A 157 -6.961 4.269 8.359 1.00 32.52 O ATOM 2434 CB TYR A 157 -5.181 6.945 8.747 1.00 40.04 C ATOM 2435 CG TYR A 157 -4.127 7.499 9.680 1.00 20.42 C ATOM 2436 CD1 TYR A 157 -3.637 6.739 10.735 1.00 34.41 C ATOM 2437 CD2 TYR A 157 -3.623 8.781 9.506 1.00 24.41 C ATOM 2438 CE1 TYR A 157 -2.675 7.241 11.590 1.00 65.25 C ATOM 2439 CE2 TYR A 157 -2.660 9.291 10.356 1.00 25.31 C ATOM 2440 CZ TYR A 157 -2.189 8.517 11.396 1.00 4.24 C ATOM 2441 OH TYR A 157 -1.231 9.021 12.245 1.00 73.35 O ATOM 0 H TYR A 157 -3.342 6.384 7.203 1.00 14.40 H new ATOM 0 HA TYR A 157 -4.628 4.910 9.160 1.00 3.45 H new ATOM 0 HB2 TYR A 157 -5.250 7.587 7.869 1.00 40.04 H new ATOM 0 HB3 TYR A 157 -6.150 6.980 9.245 1.00 40.04 H new ATOM 0 HD1 TYR A 157 -4.015 5.739 10.889 1.00 34.41 H new ATOM 0 HD2 TYR A 157 -3.990 9.390 8.693 1.00 24.41 H new ATOM 0 HE1 TYR A 157 -2.306 6.638 12.406 1.00 65.25 H new ATOM 0 HE2 TYR A 157 -2.278 10.290 10.207 1.00 25.31 H new ATOM 0 HH TYR A 157 -0.397 9.163 11.750 1.00 73.35 H new ATOM 2451 N THR A 158 -6.337 5.122 6.373 1.00 12.01 N ATOM 2452 CA THR A 158 -7.494 4.602 5.659 1.00 25.24 C ATOM 2453 C THR A 158 -7.559 3.082 5.763 1.00 54.31 C ATOM 2454 O THR A 158 -8.641 2.500 5.837 1.00 44.24 O ATOM 2455 CB THR A 158 -7.437 5.023 4.191 1.00 42.14 C ATOM 2456 OG1 THR A 158 -6.983 6.359 4.070 1.00 3.11 O ATOM 2457 CG2 THR A 158 -8.771 4.926 3.489 1.00 22.51 C ATOM 0 H THR A 158 -5.687 5.652 5.792 1.00 12.01 H new ATOM 0 HA THR A 158 -8.392 5.016 6.116 1.00 25.24 H new ATOM 0 HB THR A 158 -6.745 4.327 3.718 1.00 42.14 H new ATOM 0 HG1 THR A 158 -6.005 6.379 4.132 1.00 3.11 H new ATOM 0 HG21 THR A 158 -8.660 5.239 2.451 1.00 22.51 H new ATOM 0 HG22 THR A 158 -9.125 3.896 3.521 1.00 22.51 H new ATOM 0 HG23 THR A 158 -9.493 5.573 3.988 1.00 22.51 H new ATOM 2465 N LEU A 159 -6.392 2.445 5.770 1.00 71.54 N ATOM 2466 CA LEU A 159 -6.314 0.992 5.866 1.00 51.04 C ATOM 2467 C LEU A 159 -6.976 0.496 7.147 1.00 31.33 C ATOM 2468 O LEU A 159 -7.769 -0.445 7.124 1.00 35.02 O ATOM 2469 CB LEU A 159 -4.855 0.534 5.821 1.00 25.30 C ATOM 2470 CG LEU A 159 -4.633 -0.858 5.228 1.00 1.55 C ATOM 2471 CD1 LEU A 159 -5.471 -1.891 5.965 1.00 33.23 C ATOM 2472 CD2 LEU A 159 -4.963 -0.862 3.743 1.00 34.42 C ATOM 0 H LEU A 159 -5.487 2.913 5.710 1.00 71.54 H new ATOM 0 HA LEU A 159 -6.846 0.567 5.015 1.00 51.04 H new ATOM 0 HB2 LEU A 159 -4.281 1.256 5.240 1.00 25.30 H new ATOM 0 HB3 LEU A 159 -4.454 0.549 6.834 1.00 25.30 H new ATOM 0 HG LEU A 159 -3.582 -1.121 5.347 1.00 1.55 H new ATOM 0 HD11 LEU A 159 -5.300 -2.876 5.530 1.00 33.23 H new ATOM 0 HD12 LEU A 159 -5.188 -1.906 7.017 1.00 33.23 H new ATOM 0 HD13 LEU A 159 -6.526 -1.633 5.877 1.00 33.23 H new ATOM 0 HD21 LEU A 159 -4.800 -1.860 3.337 1.00 34.42 H new ATOM 0 HD22 LEU A 159 -6.006 -0.579 3.601 1.00 34.42 H new ATOM 0 HD23 LEU A 159 -4.320 -0.150 3.226 1.00 34.42 H new ATOM 2484 N VAL A 160 -6.646 1.136 8.265 1.00 54.25 N ATOM 2485 CA VAL A 160 -7.210 0.760 9.556 1.00 42.51 C ATOM 2486 C VAL A 160 -8.732 0.845 9.533 1.00 23.14 C ATOM 2487 O VAL A 160 -9.419 0.024 10.140 1.00 21.34 O ATOM 2488 CB VAL A 160 -6.673 1.657 10.687 1.00 63.31 C ATOM 2489 CG1 VAL A 160 -7.125 1.135 12.043 1.00 42.22 C ATOM 2490 CG2 VAL A 160 -5.156 1.749 10.620 1.00 24.31 C ATOM 0 H VAL A 160 -5.991 1.917 8.302 1.00 54.25 H new ATOM 0 HA VAL A 160 -6.908 -0.270 9.747 1.00 42.51 H new ATOM 0 HB VAL A 160 -7.080 2.660 10.556 1.00 63.31 H new ATOM 0 HG11 VAL A 160 -6.736 1.781 12.830 1.00 42.22 H new ATOM 0 HG12 VAL A 160 -8.214 1.127 12.085 1.00 42.22 H new ATOM 0 HG13 VAL A 160 -6.749 0.122 12.187 1.00 42.22 H new ATOM 0 HG21 VAL A 160 -4.794 2.387 11.427 1.00 24.31 H new ATOM 0 HG22 VAL A 160 -4.726 0.753 10.724 1.00 24.31 H new ATOM 0 HG23 VAL A 160 -4.859 2.174 9.661 1.00 24.31 H new ATOM 2500 N ARG A 161 -9.252 1.844 8.827 1.00 3.13 N ATOM 2501 CA ARG A 161 -10.694 2.036 8.722 1.00 23.43 C ATOM 2502 C ARG A 161 -11.323 0.949 7.854 1.00 42.24 C ATOM 2503 O ARG A 161 -12.488 0.595 8.033 1.00 61.21 O ATOM 2504 CB ARG A 161 -11.004 3.418 8.140 1.00 53.02 C ATOM 2505 CG ARG A 161 -11.525 4.408 9.168 1.00 44.21 C ATOM 2506 CD ARG A 161 -11.524 5.828 8.625 1.00 71.13 C ATOM 2507 NE ARG A 161 -11.998 6.792 9.615 1.00 10.13 N ATOM 2508 CZ ARG A 161 -11.775 8.103 9.540 1.00 14.41 C ATOM 2509 NH1 ARG A 161 -11.089 8.609 8.523 1.00 23.42 N ATOM 2510 NH2 ARG A 161 -12.241 8.909 10.483 1.00 13.23 N ATOM 0 H ARG A 161 -8.697 2.533 8.319 1.00 3.13 H new ATOM 0 HA ARG A 161 -11.121 1.969 9.723 1.00 23.43 H new ATOM 0 HB2 ARG A 161 -10.100 3.822 7.684 1.00 53.02 H new ATOM 0 HB3 ARG A 161 -11.742 3.311 7.345 1.00 53.02 H new ATOM 0 HG2 ARG A 161 -12.537 4.130 9.461 1.00 44.21 H new ATOM 0 HG3 ARG A 161 -10.909 4.360 10.066 1.00 44.21 H new ATOM 0 HD2 ARG A 161 -10.515 6.096 8.312 1.00 71.13 H new ATOM 0 HD3 ARG A 161 -12.156 5.878 7.739 1.00 71.13 H new ATOM 0 HE ARG A 161 -12.531 6.440 10.410 1.00 10.13 H new ATOM 0 HH11 ARG A 161 -10.730 7.993 7.794 1.00 23.42 H new ATOM 0 HH12 ARG A 161 -10.921 9.614 8.471 1.00 23.42 H new ATOM 0 HH21 ARG A 161 -12.770 8.525 11.266 1.00 13.23 H new ATOM 0 HH22 ARG A 161 -12.070 9.913 10.426 1.00 13.23 H new ATOM 2524 N GLU A 162 -10.544 0.425 6.912 1.00 30.33 N ATOM 2525 CA GLU A 162 -11.024 -0.620 6.015 1.00 73.30 C ATOM 2526 C GLU A 162 -11.122 -1.958 6.740 1.00 73.03 C ATOM 2527 O GLU A 162 -12.152 -2.631 6.683 1.00 11.13 O ATOM 2528 CB GLU A 162 -10.095 -0.748 4.806 1.00 2.14 C ATOM 2529 CG GLU A 162 -10.505 0.121 3.629 1.00 34.32 C ATOM 2530 CD GLU A 162 -11.712 -0.426 2.892 1.00 34.25 C ATOM 2531 OE1 GLU A 162 -11.698 -1.624 2.540 1.00 74.31 O ATOM 2532 OE2 GLU A 162 -12.670 0.342 2.669 1.00 22.21 O ATOM 0 H GLU A 162 -9.577 0.707 6.750 1.00 30.33 H new ATOM 0 HA GLU A 162 -12.020 -0.341 5.672 1.00 73.30 H new ATOM 0 HB2 GLU A 162 -9.082 -0.482 5.107 1.00 2.14 H new ATOM 0 HB3 GLU A 162 -10.070 -1.790 4.486 1.00 2.14 H new ATOM 0 HG2 GLU A 162 -10.727 1.127 3.985 1.00 34.32 H new ATOM 0 HG3 GLU A 162 -9.668 0.205 2.936 1.00 34.32 H new ATOM 2539 N ILE A 163 -10.046 -2.339 7.422 1.00 55.45 N ATOM 2540 CA ILE A 163 -10.010 -3.592 8.156 1.00 61.15 C ATOM 2541 C ILE A 163 -11.100 -3.637 9.220 1.00 52.44 C ATOM 2542 O ILE A 163 -11.804 -4.637 9.362 1.00 60.34 O ATOM 2543 CB ILE A 163 -8.642 -3.798 8.825 1.00 24.15 C ATOM 2544 CG1 ILE A 163 -7.521 -3.659 7.793 1.00 1.34 C ATOM 2545 CG2 ILE A 163 -8.590 -5.160 9.495 1.00 50.02 C ATOM 2546 CD1 ILE A 163 -6.159 -4.046 8.323 1.00 53.31 C ATOM 0 H ILE A 163 -9.186 -1.793 7.479 1.00 55.45 H new ATOM 0 HA ILE A 163 -10.182 -4.393 7.436 1.00 61.15 H new ATOM 0 HB ILE A 163 -8.501 -3.032 9.587 1.00 24.15 H new ATOM 0 HG12 ILE A 163 -7.755 -4.280 6.929 1.00 1.34 H new ATOM 0 HG13 ILE A 163 -7.486 -2.627 7.444 1.00 1.34 H new ATOM 0 HG21 ILE A 163 -7.617 -5.297 9.966 1.00 50.02 H new ATOM 0 HG22 ILE A 163 -9.372 -5.223 10.252 1.00 50.02 H new ATOM 0 HG23 ILE A 163 -8.744 -5.939 8.748 1.00 50.02 H new ATOM 0 HD11 ILE A 163 -5.414 -3.922 7.537 1.00 53.31 H new ATOM 0 HD12 ILE A 163 -5.903 -3.408 9.169 1.00 53.31 H new ATOM 0 HD13 ILE A 163 -6.177 -5.087 8.646 1.00 53.31 H new ATOM 2558 N ARG A 164 -11.232 -2.546 9.968 1.00 5.21 N ATOM 2559 CA ARG A 164 -12.234 -2.457 11.023 1.00 63.13 C ATOM 2560 C ARG A 164 -13.637 -2.682 10.465 1.00 42.35 C ATOM 2561 O ARG A 164 -14.446 -3.394 11.060 1.00 21.31 O ATOM 2562 CB ARG A 164 -12.157 -1.092 11.712 1.00 61.12 C ATOM 2563 CG ARG A 164 -11.891 -1.177 13.206 1.00 54.05 C ATOM 2564 CD ARG A 164 -11.396 0.149 13.761 1.00 61.32 C ATOM 2565 NE ARG A 164 -12.010 0.467 15.048 1.00 4.34 N ATOM 2566 CZ ARG A 164 -13.300 0.752 15.204 1.00 64.24 C ATOM 2567 NH1 ARG A 164 -14.116 0.764 14.156 1.00 22.12 N ATOM 2568 NH2 ARG A 164 -13.777 1.027 16.410 1.00 43.55 N ATOM 0 H ARG A 164 -10.657 -1.711 9.862 1.00 5.21 H new ATOM 0 HA ARG A 164 -12.027 -3.238 11.754 1.00 63.13 H new ATOM 0 HB2 ARG A 164 -11.368 -0.503 11.244 1.00 61.12 H new ATOM 0 HB3 ARG A 164 -13.093 -0.559 11.548 1.00 61.12 H new ATOM 0 HG2 ARG A 164 -12.805 -1.470 13.723 1.00 54.05 H new ATOM 0 HG3 ARG A 164 -11.151 -1.953 13.401 1.00 54.05 H new ATOM 0 HD2 ARG A 164 -10.313 0.112 13.875 1.00 61.32 H new ATOM 0 HD3 ARG A 164 -11.615 0.944 13.049 1.00 61.32 H new ATOM 0 HE ARG A 164 -11.414 0.471 15.876 1.00 4.34 H new ATOM 0 HH11 ARG A 164 -13.754 0.554 13.226 1.00 22.12 H new ATOM 0 HH12 ARG A 164 -15.104 0.983 14.282 1.00 22.12 H new ATOM 0 HH21 ARG A 164 -13.155 1.020 17.218 1.00 43.55 H new ATOM 0 HH22 ARG A 164 -14.766 1.246 16.530 1.00 43.55 H new ATOM 2582 N GLN A 165 -13.918 -2.070 9.319 1.00 1.11 N ATOM 2583 CA GLN A 165 -15.223 -2.204 8.681 1.00 70.21 C ATOM 2584 C GLN A 165 -15.261 -3.398 7.725 1.00 45.22 C ATOM 2585 O GLN A 165 -16.240 -3.593 7.006 1.00 70.35 O ATOM 2586 CB GLN A 165 -15.580 -0.920 7.936 1.00 51.03 C ATOM 2587 CG GLN A 165 -14.826 -0.763 6.638 1.00 21.11 C ATOM 2588 CD GLN A 165 -15.126 0.546 5.934 1.00 61.31 C ATOM 2589 OE1 GLN A 165 -15.464 0.564 4.750 1.00 14.52 O ATOM 2590 NE2 GLN A 165 -15.004 1.650 6.661 1.00 20.34 N ATOM 0 H GLN A 165 -13.260 -1.477 8.813 1.00 1.11 H new ATOM 0 HA GLN A 165 -15.960 -2.381 9.464 1.00 70.21 H new ATOM 0 HB2 GLN A 165 -16.651 -0.911 7.731 1.00 51.03 H new ATOM 0 HB3 GLN A 165 -15.371 -0.064 8.577 1.00 51.03 H new ATOM 0 HG2 GLN A 165 -13.756 -0.826 6.836 1.00 21.11 H new ATOM 0 HG3 GLN A 165 -15.077 -1.591 5.976 1.00 21.11 H new ATOM 0 HE21 GLN A 165 -14.721 1.588 7.639 1.00 20.34 H new ATOM 0 HE22 GLN A 165 -15.193 2.560 6.242 1.00 20.34 H new ATOM 2599 N HIS A 166 -14.194 -4.194 7.721 1.00 62.14 N ATOM 2600 CA HIS A 166 -14.117 -5.362 6.852 1.00 13.52 C ATOM 2601 C HIS A 166 -13.034 -6.324 7.331 1.00 32.04 C ATOM 2602 O HIS A 166 -13.366 -7.254 8.096 1.00 32.14 O ATOM 2603 CB HIS A 166 -13.839 -4.933 5.409 1.00 51.11 C ATOM 2604 CG HIS A 166 -14.846 -5.448 4.427 1.00 44.43 C ATOM 2605 ND1 HIS A 166 -15.577 -4.624 3.596 1.00 34.43 N ATOM 2606 CD2 HIS A 166 -15.242 -6.712 4.143 1.00 51.40 C ATOM 2607 CE1 HIS A 166 -16.378 -5.359 2.845 1.00 45.40 C ATOM 2608 NE2 HIS A 166 -16.194 -6.628 3.157 1.00 2.03 N ATOM 2609 OXT HIS A 166 -11.864 -6.140 6.936 1.00 61.33 O ATOM 0 H HIS A 166 -13.373 -4.050 8.309 1.00 62.14 H new ATOM 0 HA HIS A 166 -15.076 -5.878 6.889 1.00 13.52 H new ATOM 0 HB2 HIS A 166 -13.819 -3.844 5.360 1.00 51.11 H new ATOM 0 HB3 HIS A 166 -12.848 -5.283 5.119 1.00 51.11 H new ATOM 0 HD2 HIS A 166 -14.877 -7.617 4.606 1.00 51.40 H new ATOM 0 HE1 HIS A 166 -17.067 -4.985 2.102 1.00 45.40 H new ATOM 0 HE2 HIS A 166 -16.680 -7.419 2.734 1.00 2.03 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 201 13.813 -1.031 -4.750 1.00 2.01 P HETATM 2620 O1G GNP A 201 15.151 -1.850 -4.387 1.00 45.41 O HETATM 2621 O2G GNP A 201 12.595 -1.865 -4.105 1.00 62.55 O HETATM 2622 O3G GNP A 201 13.652 -0.810 -6.204 1.00 22.31 O HETATM 2623 N3B GNP A 201 13.898 0.353 -3.909 1.00 72.21 N HETATM 2624 PB GNP A 201 12.846 1.420 -4.528 1.00 71.14 P HETATM 2625 O1B GNP A 201 13.321 1.779 -5.884 1.00 21.24 O HETATM 2626 O2B GNP A 201 11.480 0.870 -4.383 1.00 52.25 O HETATM 2627 O3A GNP A 201 13.010 2.691 -3.553 1.00 24.12 O HETATM 2628 PA GNP A 201 14.275 3.674 -3.709 1.00 52.35 P HETATM 2629 O1A GNP A 201 15.490 2.850 -3.901 1.00 51.40 O HETATM 2630 O2A GNP A 201 14.241 4.626 -2.576 1.00 32.03 O HETATM 2631 O5' GNP A 201 13.948 4.461 -5.075 1.00 54.21 O HETATM 2632 C5' GNP A 201 12.647 5.014 -5.288 1.00 63.22 C HETATM 2633 C4' GNP A 201 12.605 5.823 -6.586 1.00 74.03 C HETATM 2634 O4' GNP A 201 11.301 6.416 -6.729 1.00 4.11 O HETATM 2635 C3' GNP A 201 13.565 7.007 -6.455 1.00 14.51 C HETATM 2636 O3' GNP A 201 13.782 7.623 -7.727 1.00 50.33 O HETATM 2637 C2' GNP A 201 12.711 7.902 -5.561 1.00 13.13 C HETATM 2638 O2' GNP A 201 13.206 9.243 -5.600 1.00 12.23 O HETATM 2639 C1' GNP A 201 11.411 7.802 -6.358 1.00 12.32 C HETATM 2640 N9 GNP A 201 10.252 8.244 -5.550 1.00 61.12 N HETATM 2641 C8 GNP A 201 9.649 7.534 -4.599 1.00 1.13 C HETATM 2642 N7 GNP A 201 8.644 8.242 -4.089 1.00 64.42 N HETATM 2643 C5 GNP A 201 8.605 9.413 -4.718 1.00 74.54 C HETATM 2644 C6 GNP A 201 7.780 10.525 -4.601 1.00 71.51 C HETATM 2645 O6 GNP A 201 6.864 10.543 -3.781 1.00 20.42 O HETATM 2646 N1 GNP A 201 8.011 11.623 -5.437 1.00 4.15 N HETATM 2647 C2 GNP A 201 9.062 11.570 -6.361 1.00 2.35 C HETATM 2648 N2 GNP A 201 9.292 12.608 -7.161 1.00 4.41 N HETATM 2649 N3 GNP A 201 9.837 10.479 -6.444 1.00 63.31 N HETATM 2650 C4 GNP A 201 9.632 9.416 -5.652 1.00 1.40 C HETATM 0 HO3' GNP A 201 13.827 8.596 -7.616 1.00 50.33 H new HETATM 0 HO2' GNP A 201 12.504 9.860 -5.305 1.00 12.23 H new HETATM 0 HNB3 GNP A 201 14.516 0.525 -3.116 1.00 72.21 H new HETATM 0 HN22 GNP A 201 10.057 12.573 -7.835 1.00 4.41 H new HETATM 0 HN21 GNP A 201 8.704 13.439 -7.100 1.00 4.41 H new HETATM 0 H5'2 GNP A 201 12.377 5.653 -4.447 1.00 63.22 H new HETATM 0 H5'1 GNP A 201 11.909 4.213 -5.330 1.00 63.22 H new HETATM 0 HN1 GNP A 201 7.421 12.452 -5.374 1.00 4.15 H new HETATM 0 H8 GNP A 201 9.934 6.529 -4.287 1.00 1.13 H new HETATM 0 H4' GNP A 201 12.856 5.167 -7.420 1.00 74.03 H new HETATM 0 H3' GNP A 201 14.561 6.773 -6.080 1.00 14.51 H new HETATM 0 H2' GNP A 201 12.660 7.636 -4.505 1.00 13.13 H new HETATM 0 H1' GNP A 201 11.420 8.450 -7.234 1.00 12.32 H new HETATM 2664 MG MG A 202 11.408 -0.775 -2.781 1.00 12.33 MG HETATM 2665 C13 KOB A 203 5.187 -14.981 6.574 1.00 43.31 C HETATM 2666 C12 KOB A 203 4.267 -14.931 7.615 1.00 30.23 C HETATM 2667 C11 KOB A 203 3.291 -13.942 7.636 1.00 54.43 C HETATM 2668 F11 KOB A 203 2.396 -13.902 8.643 1.00 63.31 F HETATM 2669 C10 KOB A 203 3.236 -13.000 6.616 1.00 75.34 C HETATM 2670 C9 KOB A 203 4.156 -13.051 5.575 1.00 53.52 C HETATM 2671 C8 KOB A 203 5.132 -14.041 5.551 1.00 45.24 C HETATM 2672 N8 KOB A 203 5.982 -14.083 4.528 1.00 23.45 N HETATM 2673 C7 KOB A 203 6.919 -15.022 4.427 1.00 55.34 C HETATM 2674 S7 KOB A 203 7.090 -16.273 5.639 1.00 34.44 S HETATM 2675 N7 KOB A 203 7.741 -15.014 3.382 1.00 34.04 N HETATM 2676 N6 KOB A 203 8.608 -15.880 3.279 1.00 24.54 N HETATM 2677 C6 KOB A 203 8.266 -17.127 2.970 1.00 31.01 C HETATM 2678 C5 KOB A 203 6.927 -17.447 2.772 1.00 21.31 C HETATM 2679 C4 KOB A 203 6.567 -18.751 2.454 1.00 13.02 C HETATM 2680 C3 KOB A 203 7.543 -19.734 2.335 1.00 74.41 C HETATM 2681 N3 KOB A 203 7.195 -20.984 2.042 1.00 1.43 N HETATM 2682 O3B KOB A 203 8.191 -21.991 1.922 1.00 4.10 O HETATM 2683 O3A KOB A 203 5.827 -21.315 1.850 1.00 71.33 O HETATM 2684 C2 KOB A 203 8.881 -19.413 2.532 1.00 52.31 C HETATM 2685 C1 KOB A 203 9.243 -18.109 2.850 1.00 32.34 C HETATM 2686 N1 KOB A 203 10.524 -17.806 3.041 1.00 33.00 N HETATM 2687 O1B KOB A 203 10.901 -16.476 3.371 1.00 63.14 O HETATM 2688 O1A KOB A 203 11.516 -18.815 2.917 1.00 5.33 O HETATM 0 HE2 KOB A 203 4.311 -15.669 8.416 1.00 30.23 H new HETATM 0 HE1 KOB A 203 2.473 -12.222 6.632 1.00 75.34 H new HETATM 0 HD2 KOB A 203 5.952 -15.757 6.560 1.00 43.31 H new HETATM 0 HD1 KOB A 203 4.112 -12.312 4.775 1.00 53.52 H new HETATM 0 HAD KOB A 203 5.913 -13.373 3.799 1.00 23.45 H new HETATM 0 HAC KOB A 203 7.653 -14.291 2.668 1.00 34.04 H new HETATM 0 HAB KOB A 203 9.588 -15.642 3.430 1.00 24.54 H new HETATM 0 H5 KOB A 203 6.162 -16.677 2.866 1.00 21.31 H new HETATM 0 H4 KOB A 203 5.518 -19.003 2.298 1.00 13.02 H new HETATM 0 H2 KOB A 203 9.646 -20.183 2.437 1.00 52.31 H new HETATM 2699 O HOH A 301 9.516 -1.496 -3.866 1.00 73.31 O HETATM 2702 O HOH A 302 13.139 0.173 -1.712 1.00 40.03 O HETATM 2705 O HOH A 303 11.042 -2.492 -1.365 1.00 32.43 O