USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=44 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 116 ASN :FLIP amide:sc= -5.97! C(o=-6.7!,f=-6!) USER MOD Set 1.2: A 144 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 101 LYS NZ :NH3+ 167:sc= -1.37 (180deg=-2.02!) USER MOD Set 2.2: A 111 MET CE :methyl -153:sc= -4.57! (180deg=-6.95!) USER MOD Set 3.1: A 94 HIS : no HE2:sc= 0.462 K(o=-0.78,f=-5.6!) USER MOD Set 3.2: A 137 TYR OH : rot -7:sc= -1.24 USER MOD Set 4.1: A 87 THR OG1 : rot -28:sc= 0.0543 USER MOD Set 4.2: A 124 THR OG1 : rot -48:sc= 1.03 USER MOD Set 5.1: A 72 MET CE :methyl 166:sc= -1.79 (180deg=-0.269) USER MOD Set 5.2: A 99 GLN : amide:sc= -1.61 K(o=-3.4,f=-15!) USER MOD Set 6.1: A 61 GLN : amide:sc= -0.243 X(o=-0.17,f=0.086) USER MOD Set 6.2: A 96 TYR OH : rot 130:sc= 0.0773 USER MOD Set 7.1: A 1 MET CE :methyl -143:sc= -2 (180deg=-1.9!) USER MOD Set 7.2: A 43 GLN : amide:sc= -1.46 K(o=-3.5,f=-7.4!) USER MOD Single : A 1 MET N :NH3+ -125:sc= 1.36 (180deg=-0.2) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= -0.858 USER MOD Single : A 5 LYS NZ :NH3+ -148:sc= -0.1 (180deg=-0.728) USER MOD Single : A 16 LYS NZ :NH3+ 146:sc= 0.891 (180deg=-0.26) USER MOD Single : A 20 THR OG1 : rot 104:sc= 1.15 USER MOD Single : A 22 GLN : amide:sc= -1.14 K(o=-1.1,f=-5.7!) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 ASN : amide:sc= -1.35 K(o=-1.4,f=-1.9) USER MOD Single : A 27 HIS : no HD1:sc= -4.08! C(o=-4.1!,f=-5.4!) USER MOD Single : A 32 TYR OH : rot 180:sc= -0.209! USER MOD Single : A 35 SER OG : rot 170:sc= 0.501 USER MOD Single : A 39 SER OG : rot 115:sc= 0.00286 USER MOD Single : A 40 TYR OH : rot 160:sc= -3.47! USER MOD Single : A 42 LYS NZ :NH3+ -155:sc= 0.982 (180deg=0.334) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 15:sc= -2.11! USER MOD Single : A 58 THR OG1 : rot -103:sc= 0.045 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0.0566 USER MOD Single : A 67 MET CE :methyl 177:sc= -6.01! (180deg=-6.43!) USER MOD Single : A 70 GLN :FLIP amide:sc= -0.169 F(o=-0.83,f=-0.17) USER MOD Single : A 71 TYR OH : rot 4:sc= 0.744 USER MOD Single : A 74 THR OG1 : rot 140:sc= -1.78! USER MOD Single : A 80 CYS SG : rot 180:sc= -0.332 USER MOD Single : A 85 ASN : amide:sc= -1.21! X(o=-1.2!,f=-1.3) USER MOD Single : A 86 ASN : amide:sc= -0.212 K(o=-0.21,f=-1.4!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -80:sc= -0.637 USER MOD Single : A 95 GLN : amide:sc= -1.45 X(o=-1.4,f=-1) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot -48:sc= -0.461 USER MOD Single : A 127 SER OG : rot 180:sc= 0.0948 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) 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 15:sc= 0.0414 USER MOD Single : A 145 SER OG : rot 70:sc= -1.07 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 176:sc= 0 USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 76:sc= 0.687 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= 0.993 K(o=0.99,f=-3!) USER MOD Single : A 201 GNP O2' : rot 172:sc= -0.144 USER MOD Single : A 201 GNP O3' : rot 133:sc= 0.0935 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.926 -2.195 22.764 1.00 64.23 N ATOM 2 CA MET A 1 -4.307 -1.701 21.415 1.00 32.24 C ATOM 3 C MET A 1 -4.468 -2.854 20.429 1.00 64.45 C ATOM 4 O MET A 1 -4.093 -3.990 20.721 1.00 22.22 O ATOM 5 CB MET A 1 -3.225 -0.736 20.927 1.00 31.40 C ATOM 6 CG MET A 1 -1.850 -1.372 20.808 1.00 54.03 C ATOM 7 SD MET A 1 -0.931 -1.334 22.359 1.00 42.44 S ATOM 8 CE MET A 1 -0.936 0.422 22.711 1.00 71.12 C ATOM 0 H1 MET A 1 -4.606 -1.842 23.468 1.00 64.23 H new ATOM 0 H2 MET A 1 -3.933 -3.235 22.768 1.00 64.23 H new ATOM 0 H3 MET A 1 -2.973 -1.854 23.002 1.00 64.23 H new ATOM 0 HA MET A 1 -5.267 -1.189 21.480 1.00 32.24 H new ATOM 0 HB2 MET A 1 -3.517 -0.338 19.955 1.00 31.40 H new ATOM 0 HB3 MET A 1 -3.167 0.109 21.613 1.00 31.40 H new ATOM 0 HG2 MET A 1 -1.959 -2.406 20.480 1.00 54.03 H new ATOM 0 HG3 MET A 1 -1.279 -0.852 20.039 1.00 54.03 H new ATOM 0 HE1 MET A 1 0.018 0.707 23.156 1.00 71.12 H new ATOM 0 HE2 MET A 1 -1.085 0.978 21.786 1.00 71.12 H new ATOM 0 HE3 MET A 1 -1.743 0.651 23.407 1.00 71.12 H new ATOM 18 N THR A 2 -5.027 -2.553 19.261 1.00 53.32 N ATOM 19 CA THR A 2 -5.237 -3.565 18.232 1.00 5.15 C ATOM 20 C THR A 2 -4.049 -3.619 17.273 1.00 54.53 C ATOM 21 O THR A 2 -3.382 -2.611 17.039 1.00 60.12 O ATOM 22 CB THR A 2 -6.545 -3.285 17.474 1.00 3.13 C ATOM 23 OG1 THR A 2 -7.308 -4.471 17.342 1.00 32.30 O ATOM 24 CG2 THR A 2 -6.349 -2.714 16.082 1.00 31.14 C ATOM 0 H THR A 2 -5.342 -1.618 19.004 1.00 53.32 H new ATOM 0 HA THR A 2 -5.319 -4.540 18.713 1.00 5.15 H new ATOM 0 HB THR A 2 -7.059 -2.536 18.077 1.00 3.13 H new ATOM 0 HG1 THR A 2 -8.138 -4.274 16.859 1.00 32.30 H new ATOM 0 HG21 THR A 2 -7.321 -2.546 15.617 1.00 31.14 H new ATOM 0 HG22 THR A 2 -5.811 -1.769 16.149 1.00 31.14 H new ATOM 0 HG23 THR A 2 -5.775 -3.417 15.478 1.00 31.14 H new ATOM 32 N GLU A 3 -3.791 -4.800 16.722 1.00 25.24 N ATOM 33 CA GLU A 3 -2.685 -4.984 15.790 1.00 20.40 C ATOM 34 C GLU A 3 -3.186 -5.003 14.348 1.00 74.21 C ATOM 35 O GLU A 3 -3.931 -5.899 13.951 1.00 12.12 O ATOM 36 CB GLU A 3 -1.937 -6.282 16.106 1.00 4.22 C ATOM 37 CG GLU A 3 -0.543 -6.059 16.668 1.00 75.23 C ATOM 38 CD GLU A 3 0.180 -7.358 16.967 1.00 64.42 C ATOM 39 OE1 GLU A 3 -0.256 -8.082 17.887 1.00 41.25 O ATOM 40 OE2 GLU A 3 1.181 -7.653 16.280 1.00 53.53 O ATOM 0 H GLU A 3 -4.333 -5.644 16.905 1.00 25.24 H new ATOM 0 HA GLU A 3 -2.000 -4.144 15.903 1.00 20.40 H new ATOM 0 HB2 GLU A 3 -2.520 -6.862 16.821 1.00 4.22 H new ATOM 0 HB3 GLU A 3 -1.862 -6.879 15.197 1.00 4.22 H new ATOM 0 HG2 GLU A 3 0.043 -5.477 15.956 1.00 75.23 H new ATOM 0 HG3 GLU A 3 -0.614 -5.468 17.581 1.00 75.23 H new ATOM 47 N TYR A 4 -2.773 -4.008 13.568 1.00 74.15 N ATOM 48 CA TYR A 4 -3.181 -3.910 12.171 1.00 61.31 C ATOM 49 C TYR A 4 -2.034 -4.284 11.237 1.00 22.12 C ATOM 50 O TYR A 4 -0.975 -3.656 11.256 1.00 52.24 O ATOM 51 CB TYR A 4 -3.665 -2.493 11.857 1.00 1.42 C ATOM 52 CG TYR A 4 -5.094 -2.233 12.278 1.00 1.13 C ATOM 53 CD1 TYR A 4 -6.122 -3.074 11.871 1.00 53.01 C ATOM 54 CD2 TYR A 4 -5.415 -1.146 13.081 1.00 12.14 C ATOM 55 CE1 TYR A 4 -7.430 -2.840 12.253 1.00 41.01 C ATOM 56 CE2 TYR A 4 -6.720 -0.904 13.467 1.00 62.40 C ATOM 57 CZ TYR A 4 -7.723 -1.754 13.050 1.00 31.32 C ATOM 58 OH TYR A 4 -9.023 -1.517 13.432 1.00 12.13 O ATOM 0 H TYR A 4 -2.156 -3.258 13.880 1.00 74.15 H new ATOM 0 HA TYR A 4 -3.999 -4.612 12.010 1.00 61.31 H new ATOM 0 HB2 TYR A 4 -3.012 -1.776 12.356 1.00 1.42 H new ATOM 0 HB3 TYR A 4 -3.573 -2.316 10.785 1.00 1.42 H new ATOM 0 HD1 TYR A 4 -5.896 -3.925 11.246 1.00 53.01 H new ATOM 0 HD2 TYR A 4 -4.632 -0.479 13.409 1.00 12.14 H new ATOM 0 HE1 TYR A 4 -8.218 -3.504 11.929 1.00 41.01 H new ATOM 0 HE2 TYR A 4 -6.953 -0.054 14.092 1.00 62.40 H new ATOM 0 HH TYR A 4 -9.058 -0.714 13.992 1.00 12.13 H new ATOM 68 N LYS A 5 -2.254 -5.308 10.419 1.00 51.34 N ATOM 69 CA LYS A 5 -1.241 -5.765 9.474 1.00 11.34 C ATOM 70 C LYS A 5 -1.549 -5.266 8.065 1.00 41.34 C ATOM 71 O LYS A 5 -2.338 -5.872 7.341 1.00 65.34 O ATOM 72 CB LYS A 5 -1.160 -7.292 9.480 1.00 52.42 C ATOM 73 CG LYS A 5 -0.464 -7.862 10.705 1.00 24.14 C ATOM 74 CD LYS A 5 0.975 -8.250 10.399 1.00 3.41 C ATOM 75 CE LYS A 5 1.245 -9.704 10.747 1.00 31.14 C ATOM 76 NZ LYS A 5 0.858 -10.021 12.150 1.00 31.11 N ATOM 0 H LYS A 5 -3.125 -5.838 10.391 1.00 51.34 H new ATOM 0 HA LYS A 5 -0.279 -5.356 9.784 1.00 11.34 H new ATOM 0 HB2 LYS A 5 -2.169 -7.701 9.423 1.00 52.42 H new ATOM 0 HB3 LYS A 5 -0.631 -7.623 8.586 1.00 52.42 H new ATOM 0 HG2 LYS A 5 -0.480 -7.126 11.509 1.00 24.14 H new ATOM 0 HG3 LYS A 5 -1.010 -8.736 11.061 1.00 24.14 H new ATOM 0 HD2 LYS A 5 1.181 -8.083 9.342 1.00 3.41 H new ATOM 0 HD3 LYS A 5 1.653 -7.608 10.961 1.00 3.41 H new ATOM 0 HE2 LYS A 5 0.693 -10.349 10.064 1.00 31.14 H new ATOM 0 HE3 LYS A 5 2.304 -9.921 10.605 1.00 31.14 H new ATOM 0 HZ1 LYS A 5 1.492 -10.754 12.528 1.00 31.11 H new ATOM 0 HZ2 LYS A 5 0.934 -9.163 12.733 1.00 31.11 H new ATOM 0 HZ3 LYS A 5 -0.123 -10.367 12.170 1.00 31.11 H new ATOM 90 N LEU A 6 -0.923 -4.157 7.684 1.00 41.24 N ATOM 91 CA LEU A 6 -1.134 -3.574 6.362 1.00 70.20 C ATOM 92 C LEU A 6 -0.177 -4.176 5.336 1.00 45.24 C ATOM 93 O LEU A 6 1.039 -4.019 5.440 1.00 24.42 O ATOM 94 CB LEU A 6 -0.949 -2.057 6.418 1.00 34.21 C ATOM 95 CG LEU A 6 -1.541 -1.380 7.656 1.00 43.33 C ATOM 96 CD1 LEU A 6 -1.398 0.132 7.557 1.00 41.20 C ATOM 97 CD2 LEU A 6 -3.003 -1.772 7.832 1.00 2.14 C ATOM 0 H LEU A 6 -0.266 -3.644 8.271 1.00 41.24 H new ATOM 0 HA LEU A 6 -2.154 -3.801 6.053 1.00 70.20 H new ATOM 0 HB2 LEU A 6 0.117 -1.834 6.375 1.00 34.21 H new ATOM 0 HB3 LEU A 6 -1.403 -1.617 5.530 1.00 34.21 H new ATOM 0 HG LEU A 6 -0.988 -1.719 8.532 1.00 43.33 H new ATOM 0 HD11 LEU A 6 -1.824 0.597 8.446 1.00 41.20 H new ATOM 0 HD12 LEU A 6 -0.343 0.393 7.482 1.00 41.20 H new ATOM 0 HD13 LEU A 6 -1.925 0.490 6.672 1.00 41.20 H new ATOM 0 HD21 LEU A 6 -3.407 -1.281 8.717 1.00 2.14 H new ATOM 0 HD22 LEU A 6 -3.571 -1.463 6.954 1.00 2.14 H new ATOM 0 HD23 LEU A 6 -3.078 -2.853 7.950 1.00 2.14 H new ATOM 109 N VAL A 7 -0.736 -4.866 4.345 1.00 24.35 N ATOM 110 CA VAL A 7 0.061 -5.490 3.301 1.00 4.23 C ATOM 111 C VAL A 7 0.172 -4.581 2.079 1.00 60.14 C ATOM 112 O VAL A 7 -0.788 -4.419 1.326 1.00 45.24 O ATOM 113 CB VAL A 7 -0.548 -6.837 2.874 1.00 71.03 C ATOM 114 CG1 VAL A 7 0.342 -7.527 1.856 1.00 35.43 C ATOM 115 CG2 VAL A 7 -0.775 -7.729 4.086 1.00 65.22 C ATOM 0 H VAL A 7 -1.742 -5.005 4.246 1.00 24.35 H new ATOM 0 HA VAL A 7 1.056 -5.660 3.712 1.00 4.23 H new ATOM 0 HB VAL A 7 -1.514 -6.645 2.406 1.00 71.03 H new ATOM 0 HG11 VAL A 7 -0.106 -8.478 1.566 1.00 35.43 H new ATOM 0 HG12 VAL A 7 0.448 -6.893 0.976 1.00 35.43 H new ATOM 0 HG13 VAL A 7 1.324 -7.707 2.294 1.00 35.43 H new ATOM 0 HG21 VAL A 7 -1.206 -8.677 3.764 1.00 65.22 H new ATOM 0 HG22 VAL A 7 0.176 -7.914 4.585 1.00 65.22 H new ATOM 0 HG23 VAL A 7 -1.458 -7.236 4.778 1.00 65.22 H new ATOM 125 N VAL A 8 1.347 -3.989 1.890 1.00 1.44 N ATOM 126 CA VAL A 8 1.580 -3.096 0.763 1.00 72.34 C ATOM 127 C VAL A 8 1.844 -3.880 -0.521 1.00 70.31 C ATOM 128 O VAL A 8 2.416 -4.970 -0.487 1.00 22.45 O ATOM 129 CB VAL A 8 2.767 -2.151 1.036 1.00 35.21 C ATOM 130 CG1 VAL A 8 4.081 -2.918 1.055 1.00 25.44 C ATOM 131 CG2 VAL A 8 2.806 -1.036 0.005 1.00 51.11 C ATOM 0 H VAL A 8 2.152 -4.112 2.504 1.00 1.44 H new ATOM 0 HA VAL A 8 0.675 -2.502 0.636 1.00 72.34 H new ATOM 0 HB VAL A 8 2.628 -1.704 2.020 1.00 35.21 H new ATOM 0 HG11 VAL A 8 4.902 -2.228 1.249 1.00 25.44 H new ATOM 0 HG12 VAL A 8 4.049 -3.675 1.839 1.00 25.44 H new ATOM 0 HG13 VAL A 8 4.234 -3.401 0.090 1.00 25.44 H new ATOM 0 HG21 VAL A 8 3.650 -0.378 0.212 1.00 51.11 H new ATOM 0 HG22 VAL A 8 2.917 -1.465 -0.991 1.00 51.11 H new ATOM 0 HG23 VAL A 8 1.880 -0.464 0.053 1.00 51.11 H new ATOM 141 N VAL A 9 1.426 -3.316 -1.650 1.00 3.33 N ATOM 142 CA VAL A 9 1.620 -3.960 -2.944 1.00 44.35 C ATOM 143 C VAL A 9 1.644 -2.931 -4.071 1.00 33.40 C ATOM 144 O VAL A 9 0.978 -1.898 -3.994 1.00 0.42 O ATOM 145 CB VAL A 9 0.516 -5.000 -3.228 1.00 62.31 C ATOM 146 CG1 VAL A 9 0.454 -6.033 -2.114 1.00 4.15 C ATOM 147 CG2 VAL A 9 -0.835 -4.320 -3.406 1.00 23.30 C ATOM 0 H VAL A 9 0.951 -2.415 -1.695 1.00 3.33 H new ATOM 0 HA VAL A 9 2.582 -4.470 -2.903 1.00 44.35 H new ATOM 0 HB VAL A 9 0.763 -5.513 -4.158 1.00 62.31 H new ATOM 0 HG11 VAL A 9 -0.331 -6.757 -2.333 1.00 4.15 H new ATOM 0 HG12 VAL A 9 1.412 -6.547 -2.041 1.00 4.15 H new ATOM 0 HG13 VAL A 9 0.236 -5.536 -1.169 1.00 4.15 H new ATOM 0 HG21 VAL A 9 -1.598 -5.073 -3.605 1.00 23.30 H new ATOM 0 HG22 VAL A 9 -1.091 -3.776 -2.497 1.00 23.30 H new ATOM 0 HG23 VAL A 9 -0.785 -3.624 -4.243 1.00 23.30 H new ATOM 157 N GLY A 10 2.411 -3.219 -5.118 1.00 72.14 N ATOM 158 CA GLY A 10 2.501 -2.306 -6.243 1.00 2.21 C ATOM 159 C GLY A 10 3.908 -2.189 -6.793 1.00 54.15 C ATOM 160 O GLY A 10 4.583 -1.184 -6.577 1.00 70.25 O ATOM 0 H GLY A 10 2.971 -4.067 -5.207 1.00 72.14 H new ATOM 0 HA2 GLY A 10 1.833 -2.645 -7.035 1.00 2.21 H new ATOM 0 HA3 GLY A 10 2.153 -1.320 -5.934 1.00 2.21 H new ATOM 164 N ALA A 11 4.353 -3.216 -7.510 1.00 74.22 N ATOM 165 CA ALA A 11 5.688 -3.216 -8.095 1.00 5.24 C ATOM 166 C ALA A 11 6.758 -2.990 -7.029 1.00 53.12 C ATOM 167 O ALA A 11 6.498 -3.143 -5.835 1.00 51.43 O ATOM 168 CB ALA A 11 5.783 -2.155 -9.182 1.00 30.12 C ATOM 0 H ALA A 11 3.809 -4.058 -7.699 1.00 74.22 H new ATOM 0 HA ALA A 11 5.865 -4.195 -8.541 1.00 5.24 H new ATOM 0 HB1 ALA A 11 6.784 -2.164 -9.612 1.00 30.12 H new ATOM 0 HB2 ALA A 11 5.051 -2.366 -9.962 1.00 30.12 H new ATOM 0 HB3 ALA A 11 5.582 -1.174 -8.752 1.00 30.12 H new ATOM 174 N GLY A 12 7.961 -2.630 -7.466 1.00 74.35 N ATOM 175 CA GLY A 12 9.050 -2.394 -6.534 1.00 44.31 C ATOM 176 C GLY A 12 9.727 -1.048 -6.735 1.00 13.13 C ATOM 177 O GLY A 12 10.667 -0.710 -6.016 1.00 4.32 O ATOM 0 H GLY A 12 8.202 -2.497 -8.448 1.00 74.35 H new ATOM 0 HA2 GLY A 12 8.667 -2.453 -5.515 1.00 44.31 H new ATOM 0 HA3 GLY A 12 9.791 -3.186 -6.642 1.00 44.31 H new ATOM 181 N GLY A 13 9.252 -0.276 -7.710 1.00 70.20 N ATOM 182 CA GLY A 13 9.835 1.027 -7.974 1.00 20.22 C ATOM 183 C GLY A 13 8.858 2.165 -7.738 1.00 41.44 C ATOM 184 O GLY A 13 9.248 3.332 -7.726 1.00 51.11 O ATOM 0 H GLY A 13 8.475 -0.530 -8.320 1.00 70.20 H new ATOM 0 HA2 GLY A 13 10.708 1.165 -7.337 1.00 20.22 H new ATOM 0 HA3 GLY A 13 10.184 1.062 -9.006 1.00 20.22 H new ATOM 188 N VAL A 14 7.586 1.825 -7.550 1.00 12.11 N ATOM 189 CA VAL A 14 6.551 2.825 -7.314 1.00 12.44 C ATOM 190 C VAL A 14 6.889 3.696 -6.108 1.00 64.41 C ATOM 191 O VAL A 14 6.528 4.872 -6.058 1.00 63.31 O ATOM 192 CB VAL A 14 5.179 2.161 -7.087 1.00 73.41 C ATOM 193 CG1 VAL A 14 4.796 1.303 -8.285 1.00 73.51 C ATOM 194 CG2 VAL A 14 5.189 1.329 -5.812 1.00 21.22 C ATOM 0 H VAL A 14 7.248 0.863 -7.557 1.00 12.11 H new ATOM 0 HA VAL A 14 6.504 3.451 -8.205 1.00 12.44 H new ATOM 0 HB VAL A 14 4.432 2.947 -6.975 1.00 73.41 H new ATOM 0 HG11 VAL A 14 3.824 0.842 -8.107 1.00 73.51 H new ATOM 0 HG12 VAL A 14 4.743 1.927 -9.177 1.00 73.51 H new ATOM 0 HG13 VAL A 14 5.546 0.525 -8.430 1.00 73.51 H new ATOM 0 HG21 VAL A 14 4.211 0.869 -5.670 1.00 21.22 H new ATOM 0 HG22 VAL A 14 5.948 0.551 -5.891 1.00 21.22 H new ATOM 0 HG23 VAL A 14 5.415 1.971 -4.960 1.00 21.22 H new ATOM 204 N GLY A 15 7.578 3.108 -5.137 1.00 40.12 N ATOM 205 CA GLY A 15 7.949 3.839 -3.940 1.00 43.12 C ATOM 206 C GLY A 15 7.134 3.420 -2.732 1.00 62.33 C ATOM 207 O GLY A 15 6.983 4.186 -1.780 1.00 40.14 O ATOM 0 H GLY A 15 7.887 2.136 -5.158 1.00 40.12 H new ATOM 0 HA2 GLY A 15 9.007 3.680 -3.734 1.00 43.12 H new ATOM 0 HA3 GLY A 15 7.815 4.907 -4.113 1.00 43.12 H new ATOM 211 N LYS A 16 6.606 2.200 -2.771 1.00 22.52 N ATOM 212 CA LYS A 16 5.801 1.679 -1.672 1.00 2.22 C ATOM 213 C LYS A 16 6.601 1.661 -0.374 1.00 12.21 C ATOM 214 O LYS A 16 6.048 1.845 0.711 1.00 61.12 O ATOM 215 CB LYS A 16 5.305 0.269 -1.999 1.00 60.24 C ATOM 216 CG LYS A 16 6.405 -0.672 -2.465 1.00 44.32 C ATOM 217 CD LYS A 16 5.901 -2.101 -2.588 1.00 50.22 C ATOM 218 CE LYS A 16 6.955 -3.106 -2.150 1.00 21.34 C ATOM 219 NZ LYS A 16 7.363 -4.005 -3.266 1.00 43.14 N ATOM 0 H LYS A 16 6.721 1.554 -3.552 1.00 22.52 H new ATOM 0 HA LYS A 16 4.942 2.337 -1.540 1.00 2.22 H new ATOM 0 HB2 LYS A 16 4.828 -0.153 -1.115 1.00 60.24 H new ATOM 0 HB3 LYS A 16 4.541 0.333 -2.774 1.00 60.24 H new ATOM 0 HG2 LYS A 16 6.788 -0.336 -3.428 1.00 44.32 H new ATOM 0 HG3 LYS A 16 7.237 -0.638 -1.761 1.00 44.32 H new ATOM 0 HD2 LYS A 16 5.005 -2.225 -1.980 1.00 50.22 H new ATOM 0 HD3 LYS A 16 5.616 -2.299 -3.621 1.00 50.22 H new ATOM 0 HE2 LYS A 16 7.829 -2.575 -1.774 1.00 21.34 H new ATOM 0 HE3 LYS A 16 6.566 -3.704 -1.326 1.00 21.34 H new ATOM 0 HZ1 LYS A 16 8.371 -4.243 -3.169 1.00 43.14 H new ATOM 0 HZ2 LYS A 16 6.797 -4.877 -3.234 1.00 43.14 H new ATOM 0 HZ3 LYS A 16 7.207 -3.524 -4.174 1.00 43.14 H new ATOM 233 N SER A 17 7.905 1.439 -0.493 1.00 4.23 N ATOM 234 CA SER A 17 8.783 1.399 0.670 1.00 51.45 C ATOM 235 C SER A 17 9.057 2.806 1.192 1.00 62.30 C ATOM 236 O SER A 17 9.194 3.016 2.397 1.00 2.13 O ATOM 237 CB SER A 17 10.101 0.705 0.317 1.00 71.51 C ATOM 238 OG SER A 17 10.335 0.735 -1.081 1.00 72.45 O ATOM 0 H SER A 17 8.378 1.284 -1.384 1.00 4.23 H new ATOM 0 HA SER A 17 8.282 0.832 1.454 1.00 51.45 H new ATOM 0 HB2 SER A 17 10.924 1.195 0.837 1.00 71.51 H new ATOM 0 HB3 SER A 17 10.075 -0.328 0.663 1.00 71.51 H new ATOM 244 N ALA A 18 9.134 3.767 0.277 1.00 24.21 N ATOM 245 CA ALA A 18 9.391 5.154 0.645 1.00 1.55 C ATOM 246 C ALA A 18 8.266 5.709 1.512 1.00 4.35 C ATOM 247 O ALA A 18 8.497 6.154 2.636 1.00 72.21 O ATOM 248 CB ALA A 18 9.568 6.006 -0.603 1.00 12.43 C ATOM 0 H ALA A 18 9.022 3.610 -0.725 1.00 24.21 H new ATOM 0 HA ALA A 18 10.312 5.186 1.227 1.00 1.55 H new ATOM 0 HB1 ALA A 18 9.759 7.039 -0.314 1.00 12.43 H new ATOM 0 HB2 ALA A 18 10.410 5.630 -1.184 1.00 12.43 H new ATOM 0 HB3 ALA A 18 8.662 5.960 -1.207 1.00 12.43 H new ATOM 254 N LEU A 19 7.047 5.680 0.982 1.00 24.13 N ATOM 255 CA LEU A 19 5.885 6.181 1.709 1.00 43.51 C ATOM 256 C LEU A 19 5.734 5.475 3.054 1.00 75.30 C ATOM 257 O LEU A 19 5.171 6.030 3.998 1.00 32.01 O ATOM 258 CB LEU A 19 4.615 5.995 0.876 1.00 31.53 C ATOM 259 CG LEU A 19 4.392 4.581 0.337 1.00 50.52 C ATOM 260 CD1 LEU A 19 3.576 3.757 1.321 1.00 44.40 C ATOM 261 CD2 LEU A 19 3.704 4.631 -1.020 1.00 65.15 C ATOM 0 H LEU A 19 6.838 5.315 0.053 1.00 24.13 H new ATOM 0 HA LEU A 19 6.037 7.244 1.894 1.00 43.51 H new ATOM 0 HB2 LEU A 19 3.756 6.274 1.486 1.00 31.53 H new ATOM 0 HB3 LEU A 19 4.647 6.687 0.034 1.00 31.53 H new ATOM 0 HG LEU A 19 5.363 4.102 0.213 1.00 50.52 H new ATOM 0 HD11 LEU A 19 3.427 2.754 0.920 1.00 44.40 H new ATOM 0 HD12 LEU A 19 4.107 3.693 2.271 1.00 44.40 H new ATOM 0 HD13 LEU A 19 2.608 4.232 1.478 1.00 44.40 H new ATOM 0 HD21 LEU A 19 3.553 3.617 -1.389 1.00 65.15 H new ATOM 0 HD22 LEU A 19 2.739 5.128 -0.921 1.00 65.15 H new ATOM 0 HD23 LEU A 19 4.327 5.184 -1.723 1.00 65.15 H new ATOM 273 N THR A 20 6.244 4.249 3.137 1.00 51.12 N ATOM 274 CA THR A 20 6.167 3.471 4.368 1.00 61.33 C ATOM 275 C THR A 20 7.069 4.069 5.444 1.00 14.40 C ATOM 276 O THR A 20 6.605 4.435 6.523 1.00 72.13 O ATOM 277 CB THR A 20 6.561 2.017 4.100 1.00 44.10 C ATOM 278 OG1 THR A 20 5.697 1.431 3.142 1.00 32.13 O ATOM 279 CG2 THR A 20 6.528 1.147 5.339 1.00 20.32 C ATOM 0 H THR A 20 6.714 3.774 2.367 1.00 51.12 H new ATOM 0 HA THR A 20 5.138 3.499 4.727 1.00 61.33 H new ATOM 0 HB THR A 20 7.587 2.061 3.734 1.00 44.10 H new ATOM 0 HG1 THR A 20 6.155 1.378 2.277 1.00 32.13 H new ATOM 0 HG21 THR A 20 6.818 0.129 5.077 1.00 20.32 H new ATOM 0 HG22 THR A 20 7.222 1.543 6.080 1.00 20.32 H new ATOM 0 HG23 THR A 20 5.520 1.142 5.753 1.00 20.32 H new ATOM 287 N ILE A 21 8.360 4.167 5.140 1.00 12.33 N ATOM 288 CA ILE A 21 9.327 4.723 6.080 1.00 22.24 C ATOM 289 C ILE A 21 8.940 6.141 6.488 1.00 2.14 C ATOM 290 O ILE A 21 9.178 6.557 7.622 1.00 1.31 O ATOM 291 CB ILE A 21 10.748 4.736 5.478 1.00 14.14 C ATOM 292 CG1 ILE A 21 11.162 3.329 5.054 1.00 75.24 C ATOM 293 CG2 ILE A 21 11.749 5.298 6.473 1.00 21.11 C ATOM 294 CD1 ILE A 21 11.199 2.338 6.197 1.00 22.50 C ATOM 0 H ILE A 21 8.760 3.869 4.250 1.00 12.33 H new ATOM 0 HA ILE A 21 9.322 4.083 6.962 1.00 22.24 H new ATOM 0 HB ILE A 21 10.737 5.379 4.598 1.00 14.14 H new ATOM 0 HG12 ILE A 21 10.468 2.969 4.294 1.00 75.24 H new ATOM 0 HG13 ILE A 21 12.148 3.373 4.591 1.00 75.24 H new ATOM 0 HG21 ILE A 21 12.744 5.298 6.028 1.00 21.11 H new ATOM 0 HG22 ILE A 21 11.469 6.318 6.734 1.00 21.11 H new ATOM 0 HG23 ILE A 21 11.754 4.682 7.372 1.00 21.11 H new ATOM 0 HD11 ILE A 21 11.501 1.360 5.821 1.00 22.50 H new ATOM 0 HD12 ILE A 21 11.914 2.675 6.948 1.00 22.50 H new ATOM 0 HD13 ILE A 21 10.209 2.264 6.647 1.00 22.50 H new ATOM 306 N GLN A 22 8.341 6.878 5.558 1.00 22.34 N ATOM 307 CA GLN A 22 7.919 8.248 5.825 1.00 42.04 C ATOM 308 C GLN A 22 6.933 8.293 6.988 1.00 40.42 C ATOM 309 O GLN A 22 7.045 9.135 7.879 1.00 71.01 O ATOM 310 CB GLN A 22 7.282 8.861 4.577 1.00 13.22 C ATOM 311 CG GLN A 22 8.289 9.244 3.505 1.00 10.11 C ATOM 312 CD GLN A 22 9.181 10.395 3.926 1.00 40.14 C ATOM 313 OE1 GLN A 22 9.141 10.840 5.073 1.00 42.34 O ATOM 314 NE2 GLN A 22 9.993 10.885 2.996 1.00 50.55 N ATOM 0 H GLN A 22 8.137 6.550 4.614 1.00 22.34 H new ATOM 0 HA GLN A 22 8.801 8.829 6.095 1.00 42.04 H new ATOM 0 HB2 GLN A 22 6.569 8.151 4.157 1.00 13.22 H new ATOM 0 HB3 GLN A 22 6.717 9.747 4.866 1.00 13.22 H new ATOM 0 HG2 GLN A 22 8.907 8.378 3.267 1.00 10.11 H new ATOM 0 HG3 GLN A 22 7.757 9.516 2.593 1.00 10.11 H new ATOM 0 HE21 GLN A 22 9.993 10.486 2.057 1.00 50.55 H new ATOM 0 HE22 GLN A 22 10.616 11.661 3.220 1.00 50.55 H new ATOM 323 N LEU A 23 5.969 7.379 6.971 1.00 35.31 N ATOM 324 CA LEU A 23 4.961 7.307 8.023 1.00 73.44 C ATOM 325 C LEU A 23 5.525 6.670 9.294 1.00 71.05 C ATOM 326 O LEU A 23 4.850 6.622 10.322 1.00 74.50 O ATOM 327 CB LEU A 23 3.746 6.519 7.537 1.00 20.51 C ATOM 328 CG LEU A 23 2.492 6.679 8.400 1.00 33.23 C ATOM 329 CD1 LEU A 23 1.368 7.325 7.604 1.00 13.32 C ATOM 330 CD2 LEU A 23 2.052 5.334 8.951 1.00 73.31 C ATOM 0 H LEU A 23 5.864 6.676 6.239 1.00 35.31 H new ATOM 0 HA LEU A 23 4.656 8.326 8.263 1.00 73.44 H new ATOM 0 HB2 LEU A 23 3.512 6.830 6.519 1.00 20.51 H new ATOM 0 HB3 LEU A 23 4.009 5.462 7.495 1.00 20.51 H new ATOM 0 HG LEU A 23 2.734 7.333 9.238 1.00 33.23 H new ATOM 0 HD11 LEU A 23 0.487 7.429 8.237 1.00 13.32 H new ATOM 0 HD12 LEU A 23 1.685 8.309 7.259 1.00 13.32 H new ATOM 0 HD13 LEU A 23 1.125 6.700 6.744 1.00 13.32 H new ATOM 0 HD21 LEU A 23 1.159 5.466 9.562 1.00 73.31 H new ATOM 0 HD22 LEU A 23 1.830 4.658 8.126 1.00 73.31 H new ATOM 0 HD23 LEU A 23 2.851 4.912 9.561 1.00 73.31 H new ATOM 342 N ILE A 24 6.762 6.183 9.221 1.00 72.52 N ATOM 343 CA ILE A 24 7.402 5.554 10.371 1.00 51.34 C ATOM 344 C ILE A 24 8.477 6.462 10.965 1.00 71.04 C ATOM 345 O ILE A 24 8.309 7.005 12.057 1.00 20.42 O ATOM 346 CB ILE A 24 8.032 4.197 9.993 1.00 54.30 C ATOM 347 CG1 ILE A 24 6.964 3.251 9.437 1.00 11.21 C ATOM 348 CG2 ILE A 24 8.726 3.572 11.197 1.00 52.13 C ATOM 349 CD1 ILE A 24 5.997 2.744 10.486 1.00 61.00 C ATOM 0 H ILE A 24 7.338 6.212 8.380 1.00 72.52 H new ATOM 0 HA ILE A 24 6.624 5.385 11.116 1.00 51.34 H new ATOM 0 HB ILE A 24 8.781 4.368 9.219 1.00 54.30 H new ATOM 0 HG12 ILE A 24 6.404 3.767 8.658 1.00 11.21 H new ATOM 0 HG13 ILE A 24 7.455 2.400 8.966 1.00 11.21 H new ATOM 0 HG21 ILE A 24 9.163 2.616 10.909 1.00 52.13 H new ATOM 0 HG22 ILE A 24 9.512 4.239 11.551 1.00 52.13 H new ATOM 0 HG23 ILE A 24 7.999 3.413 11.994 1.00 52.13 H new ATOM 0 HD11 ILE A 24 5.269 2.080 10.019 1.00 61.00 H new ATOM 0 HD12 ILE A 24 6.546 2.199 11.254 1.00 61.00 H new ATOM 0 HD13 ILE A 24 5.478 3.588 10.941 1.00 61.00 H new ATOM 361 N GLN A 25 9.581 6.619 10.242 1.00 34.03 N ATOM 362 CA GLN A 25 10.682 7.457 10.703 1.00 44.22 C ATOM 363 C GLN A 25 10.615 8.853 10.087 1.00 74.42 C ATOM 364 O GLN A 25 11.183 9.804 10.624 1.00 43.53 O ATOM 365 CB GLN A 25 12.020 6.802 10.369 1.00 41.11 C ATOM 366 CG GLN A 25 12.345 5.616 11.259 1.00 33.13 C ATOM 367 CD GLN A 25 13.769 5.132 11.086 1.00 25.34 C ATOM 368 OE1 GLN A 25 14.722 5.821 11.449 1.00 33.13 O ATOM 369 NE2 GLN A 25 13.918 3.939 10.528 1.00 32.40 N ATOM 0 H GLN A 25 9.737 6.178 9.336 1.00 34.03 H new ATOM 0 HA GLN A 25 10.593 7.560 11.784 1.00 44.22 H new ATOM 0 HB2 GLN A 25 12.007 6.475 9.329 1.00 41.11 H new ATOM 0 HB3 GLN A 25 12.813 7.544 10.460 1.00 41.11 H new ATOM 0 HG2 GLN A 25 12.183 5.893 12.301 1.00 33.13 H new ATOM 0 HG3 GLN A 25 11.658 4.800 11.036 1.00 33.13 H new ATOM 0 HE21 GLN A 25 13.098 3.403 10.243 1.00 32.40 H new ATOM 0 HE22 GLN A 25 14.853 3.557 10.384 1.00 32.40 H new ATOM 378 N ASN A 26 9.917 8.971 8.960 1.00 33.23 N ATOM 379 CA ASN A 26 9.775 10.253 8.273 1.00 44.22 C ATOM 380 C ASN A 26 11.080 10.660 7.592 1.00 74.21 C ATOM 381 O ASN A 26 11.788 11.548 8.067 1.00 51.24 O ATOM 382 CB ASN A 26 9.336 11.346 9.254 1.00 34.24 C ATOM 383 CG ASN A 26 8.239 10.878 10.191 1.00 44.33 C ATOM 384 OD1 ASN A 26 7.065 10.844 9.823 1.00 33.44 O ATOM 385 ND2 ASN A 26 8.619 10.514 11.410 1.00 33.13 N ATOM 0 H ASN A 26 9.440 8.194 8.503 1.00 33.23 H new ATOM 0 HA ASN A 26 9.008 10.135 7.507 1.00 44.22 H new ATOM 0 HB2 ASN A 26 10.196 11.671 9.840 1.00 34.24 H new ATOM 0 HB3 ASN A 26 8.986 12.213 8.694 1.00 34.24 H new ATOM 0 HD21 ASN A 26 7.926 10.190 12.085 1.00 33.13 H new ATOM 0 HD22 ASN A 26 9.604 10.559 11.672 1.00 33.13 H new ATOM 392 N HIS A 27 11.388 10.007 6.475 1.00 4.21 N ATOM 393 CA HIS A 27 12.605 10.305 5.726 1.00 53.54 C ATOM 394 C HIS A 27 12.673 9.478 4.445 1.00 52.30 C ATOM 395 O HIS A 27 12.033 8.432 4.335 1.00 62.20 O ATOM 396 CB HIS A 27 13.843 10.042 6.590 1.00 33.01 C ATOM 397 CG HIS A 27 14.134 8.587 6.805 1.00 72.44 C ATOM 398 ND1 HIS A 27 14.546 7.745 5.794 1.00 71.20 N ATOM 399 CD2 HIS A 27 14.069 7.826 7.923 1.00 41.14 C ATOM 400 CE1 HIS A 27 14.722 6.529 6.280 1.00 21.31 C ATOM 401 NE2 HIS A 27 14.440 6.552 7.569 1.00 0.40 N ATOM 0 H HIS A 27 10.813 9.269 6.069 1.00 4.21 H new ATOM 0 HA HIS A 27 12.583 11.360 5.453 1.00 53.54 H new ATOM 0 HB2 HIS A 27 14.708 10.510 6.121 1.00 33.01 H new ATOM 0 HB3 HIS A 27 13.707 10.523 7.559 1.00 33.01 H new ATOM 0 HD2 HIS A 27 13.780 8.159 8.909 1.00 41.14 H new ATOM 0 HE1 HIS A 27 15.042 5.664 5.718 1.00 21.31 H new ATOM 0 HE2 HIS A 27 14.490 5.753 8.200 1.00 0.40 H new ATOM 410 N PHE A 28 13.455 9.952 3.481 1.00 62.21 N ATOM 411 CA PHE A 28 13.610 9.253 2.211 1.00 23.04 C ATOM 412 C PHE A 28 14.507 8.031 2.375 1.00 52.35 C ATOM 413 O PHE A 28 15.717 8.159 2.563 1.00 3.31 O ATOM 414 CB PHE A 28 14.195 10.193 1.155 1.00 51.23 C ATOM 415 CG PHE A 28 13.696 9.920 -0.236 1.00 45.53 C ATOM 416 CD1 PHE A 28 13.778 8.647 -0.777 1.00 24.32 C ATOM 417 CD2 PHE A 28 13.147 10.936 -1.001 1.00 34.14 C ATOM 418 CE1 PHE A 28 13.321 8.393 -2.056 1.00 2.13 C ATOM 419 CE2 PHE A 28 12.688 10.687 -2.280 1.00 51.14 C ATOM 420 CZ PHE A 28 12.775 9.414 -2.809 1.00 75.32 C ATOM 0 H PHE A 28 13.991 10.817 3.555 1.00 62.21 H new ATOM 0 HA PHE A 28 12.626 8.920 1.882 1.00 23.04 H new ATOM 0 HB2 PHE A 28 13.954 11.222 1.423 1.00 51.23 H new ATOM 0 HB3 PHE A 28 15.282 10.107 1.166 1.00 51.23 H new ATOM 0 HD1 PHE A 28 14.204 7.845 -0.193 1.00 24.32 H new ATOM 0 HD2 PHE A 28 13.077 11.934 -0.593 1.00 34.14 H new ATOM 0 HE1 PHE A 28 13.391 7.397 -2.467 1.00 2.13 H new ATOM 0 HE2 PHE A 28 12.261 11.487 -2.866 1.00 51.14 H new ATOM 0 HZ PHE A 28 12.417 9.218 -3.809 1.00 75.32 H new ATOM 430 N VAL A 29 13.907 6.847 2.309 1.00 51.42 N ATOM 431 CA VAL A 29 14.654 5.604 2.457 1.00 3.03 C ATOM 432 C VAL A 29 15.791 5.516 1.440 1.00 2.12 C ATOM 433 O VAL A 29 15.701 6.068 0.343 1.00 54.14 O ATOM 434 CB VAL A 29 13.733 4.371 2.313 1.00 11.33 C ATOM 435 CG1 VAL A 29 13.457 4.058 0.849 1.00 2.32 C ATOM 436 CG2 VAL A 29 14.338 3.167 3.017 1.00 52.24 C ATOM 0 H VAL A 29 12.907 6.722 2.154 1.00 51.42 H new ATOM 0 HA VAL A 29 15.079 5.607 3.461 1.00 3.03 H new ATOM 0 HB VAL A 29 12.781 4.605 2.788 1.00 11.33 H new ATOM 0 HG11 VAL A 29 12.807 3.186 0.780 1.00 2.32 H new ATOM 0 HG12 VAL A 29 12.969 4.913 0.380 1.00 2.32 H new ATOM 0 HG13 VAL A 29 14.397 3.851 0.338 1.00 2.32 H new ATOM 0 HG21 VAL A 29 13.675 2.309 2.905 1.00 52.24 H new ATOM 0 HG22 VAL A 29 15.308 2.937 2.576 1.00 52.24 H new ATOM 0 HG23 VAL A 29 14.465 3.391 4.076 1.00 52.24 H new ATOM 446 N ASP A 30 16.858 4.820 1.814 1.00 22.23 N ATOM 447 CA ASP A 30 18.012 4.657 0.939 1.00 21.04 C ATOM 448 C ASP A 30 18.867 3.473 1.381 1.00 52.21 C ATOM 449 O ASP A 30 19.300 2.666 0.559 1.00 54.41 O ATOM 450 CB ASP A 30 18.854 5.935 0.928 1.00 50.12 C ATOM 451 CG ASP A 30 20.043 5.838 -0.008 1.00 60.31 C ATOM 452 OD1 ASP A 30 19.828 5.627 -1.220 1.00 11.14 O ATOM 453 OD2 ASP A 30 21.188 5.974 0.471 1.00 72.40 O ATOM 0 H ASP A 30 16.948 4.359 2.719 1.00 22.23 H new ATOM 0 HA ASP A 30 17.648 4.462 -0.070 1.00 21.04 H new ATOM 0 HB2 ASP A 30 18.228 6.776 0.630 1.00 50.12 H new ATOM 0 HB3 ASP A 30 19.207 6.143 1.938 1.00 50.12 H new ATOM 458 N GLU A 31 19.103 3.375 2.685 1.00 43.21 N ATOM 459 CA GLU A 31 19.903 2.289 3.239 1.00 54.25 C ATOM 460 C GLU A 31 19.015 1.125 3.666 1.00 24.30 C ATOM 461 O GLU A 31 18.536 1.080 4.799 1.00 50.34 O ATOM 462 CB GLU A 31 20.722 2.786 4.431 1.00 35.41 C ATOM 463 CG GLU A 31 21.590 1.710 5.065 1.00 53.24 C ATOM 464 CD GLU A 31 23.015 2.172 5.300 1.00 32.14 C ATOM 465 OE1 GLU A 31 23.279 2.766 6.367 1.00 23.34 O ATOM 466 OE2 GLU A 31 23.867 1.939 4.417 1.00 61.32 O ATOM 0 H GLU A 31 18.751 4.035 3.378 1.00 43.21 H new ATOM 0 HA GLU A 31 20.583 1.939 2.463 1.00 54.25 H new ATOM 0 HB2 GLU A 31 21.358 3.609 4.106 1.00 35.41 H new ATOM 0 HB3 GLU A 31 20.044 3.185 5.185 1.00 35.41 H new ATOM 0 HG2 GLU A 31 21.149 1.406 6.015 1.00 53.24 H new ATOM 0 HG3 GLU A 31 21.599 0.830 4.422 1.00 53.24 H new ATOM 473 N TYR A 32 18.798 0.187 2.751 1.00 41.40 N ATOM 474 CA TYR A 32 17.966 -0.977 3.031 1.00 25.35 C ATOM 475 C TYR A 32 18.484 -2.206 2.292 1.00 41.14 C ATOM 476 O TYR A 32 19.399 -2.110 1.473 1.00 12.03 O ATOM 477 CB TYR A 32 16.516 -0.700 2.630 1.00 73.14 C ATOM 478 CG TYR A 32 16.366 -0.223 1.204 1.00 21.15 C ATOM 479 CD1 TYR A 32 16.250 -1.128 0.157 1.00 35.22 C ATOM 480 CD2 TYR A 32 16.341 1.134 0.904 1.00 33.53 C ATOM 481 CE1 TYR A 32 16.114 -0.696 -1.149 1.00 55.51 C ATOM 482 CE2 TYR A 32 16.204 1.574 -0.399 1.00 13.12 C ATOM 483 CZ TYR A 32 16.092 0.656 -1.421 1.00 33.41 C ATOM 484 OH TYR A 32 15.957 1.090 -2.719 1.00 62.24 O ATOM 0 H TYR A 32 19.187 0.210 1.808 1.00 41.40 H new ATOM 0 HA TYR A 32 18.009 -1.175 4.102 1.00 25.35 H new ATOM 0 HB2 TYR A 32 15.930 -1.609 2.764 1.00 73.14 H new ATOM 0 HB3 TYR A 32 16.099 0.050 3.302 1.00 73.14 H new ATOM 0 HD1 TYR A 32 16.266 -2.187 0.367 1.00 35.22 H new ATOM 0 HD2 TYR A 32 16.430 1.856 1.702 1.00 33.53 H new ATOM 0 HE1 TYR A 32 16.025 -1.413 -1.952 1.00 55.51 H new ATOM 0 HE2 TYR A 32 16.185 2.632 -0.615 1.00 13.12 H new ATOM 0 HH TYR A 32 15.959 2.070 -2.738 1.00 62.24 H new ATOM 494 N ASP A 33 17.894 -3.360 2.585 1.00 44.42 N ATOM 495 CA ASP A 33 18.296 -4.608 1.947 1.00 24.01 C ATOM 496 C ASP A 33 17.358 -4.955 0.792 1.00 32.22 C ATOM 497 O ASP A 33 16.171 -4.632 0.827 1.00 3.35 O ATOM 498 CB ASP A 33 18.312 -5.747 2.969 1.00 43.40 C ATOM 499 CG ASP A 33 19.374 -5.556 4.035 1.00 42.21 C ATOM 500 OD1 ASP A 33 20.102 -4.542 3.976 1.00 11.24 O ATOM 501 OD2 ASP A 33 19.478 -6.421 4.930 1.00 61.23 O ATOM 0 H ASP A 33 17.136 -3.457 3.260 1.00 44.42 H new ATOM 0 HA ASP A 33 19.301 -4.476 1.547 1.00 24.01 H new ATOM 0 HB2 ASP A 33 17.334 -5.818 3.444 1.00 43.40 H new ATOM 0 HB3 ASP A 33 18.485 -6.691 2.453 1.00 43.40 H new ATOM 506 N PRO A 34 17.883 -5.622 -0.251 1.00 24.31 N ATOM 507 CA PRO A 34 17.087 -6.012 -1.420 1.00 71.35 C ATOM 508 C PRO A 34 16.090 -7.121 -1.101 1.00 4.42 C ATOM 509 O PRO A 34 16.479 -8.237 -0.756 1.00 15.24 O ATOM 510 CB PRO A 34 18.138 -6.508 -2.415 1.00 61.13 C ATOM 511 CG PRO A 34 19.277 -6.957 -1.569 1.00 21.45 C ATOM 512 CD PRO A 34 19.290 -6.045 -0.374 1.00 15.52 C ATOM 0 HA PRO A 34 16.482 -5.186 -1.794 1.00 71.35 H new ATOM 0 HB2 PRO A 34 17.752 -7.325 -3.025 1.00 61.13 H new ATOM 0 HB3 PRO A 34 18.441 -5.715 -3.099 1.00 61.13 H new ATOM 0 HG2 PRO A 34 19.152 -7.996 -1.265 1.00 21.45 H new ATOM 0 HG3 PRO A 34 20.218 -6.896 -2.117 1.00 21.45 H new ATOM 0 HD2 PRO A 34 19.634 -6.562 0.522 1.00 15.52 H new ATOM 0 HD3 PRO A 34 19.954 -5.194 -0.526 1.00 15.52 H new ATOM 520 N SER A 35 14.804 -6.806 -1.218 1.00 51.21 N ATOM 521 CA SER A 35 13.749 -7.777 -0.943 1.00 72.21 C ATOM 522 C SER A 35 13.895 -8.360 0.460 1.00 43.13 C ATOM 523 O SER A 35 14.547 -9.386 0.651 1.00 23.42 O ATOM 524 CB SER A 35 13.778 -8.901 -1.980 1.00 71.01 C ATOM 525 OG SER A 35 14.204 -8.419 -3.243 1.00 41.43 O ATOM 0 H SER A 35 14.467 -5.886 -1.501 1.00 51.21 H new ATOM 0 HA SER A 35 12.791 -7.260 -1.003 1.00 72.21 H new ATOM 0 HB2 SER A 35 14.448 -9.692 -1.644 1.00 71.01 H new ATOM 0 HB3 SER A 35 12.785 -9.341 -2.071 1.00 71.01 H new ATOM 0 HG SER A 35 14.369 -9.176 -3.843 1.00 41.43 H new ATOM 531 N ILE A 36 13.285 -7.697 1.437 1.00 31.21 N ATOM 532 CA ILE A 36 13.349 -8.149 2.822 1.00 45.20 C ATOM 533 C ILE A 36 12.069 -7.801 3.575 1.00 4.22 C ATOM 534 O ILE A 36 11.137 -7.231 3.006 1.00 63.15 O ATOM 535 CB ILE A 36 14.549 -7.525 3.560 1.00 52.15 C ATOM 536 CG1 ILE A 36 14.416 -6.001 3.600 1.00 3.32 C ATOM 537 CG2 ILE A 36 15.853 -7.930 2.888 1.00 54.21 C ATOM 538 CD1 ILE A 36 13.662 -5.493 4.810 1.00 61.21 C ATOM 0 H ILE A 36 12.741 -6.846 1.295 1.00 31.21 H new ATOM 0 HA ILE A 36 13.469 -9.232 2.796 1.00 45.20 H new ATOM 0 HB ILE A 36 14.559 -7.897 4.585 1.00 52.15 H new ATOM 0 HG12 ILE A 36 15.411 -5.557 3.589 1.00 3.32 H new ATOM 0 HG13 ILE A 36 13.907 -5.665 2.697 1.00 3.32 H new ATOM 0 HG21 ILE A 36 16.691 -7.481 3.421 1.00 54.21 H new ATOM 0 HG22 ILE A 36 15.950 -9.016 2.907 1.00 54.21 H new ATOM 0 HG23 ILE A 36 15.853 -7.584 1.855 1.00 54.21 H new ATOM 0 HD11 ILE A 36 13.606 -4.405 4.773 1.00 61.21 H new ATOM 0 HD12 ILE A 36 12.654 -5.909 4.812 1.00 61.21 H new ATOM 0 HD13 ILE A 36 14.182 -5.799 5.718 1.00 61.21 H new ATOM 550 N GLU A 37 12.033 -8.144 4.858 1.00 50.51 N ATOM 551 CA GLU A 37 10.871 -7.863 5.692 1.00 40.42 C ATOM 552 C GLU A 37 11.119 -6.637 6.565 1.00 15.45 C ATOM 553 O GLU A 37 10.819 -5.511 6.168 1.00 14.02 O ATOM 554 CB GLU A 37 10.527 -9.081 6.555 1.00 65.24 C ATOM 555 CG GLU A 37 9.897 -10.222 5.774 1.00 71.21 C ATOM 556 CD GLU A 37 9.115 -11.172 6.659 1.00 43.32 C ATOM 557 OE1 GLU A 37 9.695 -11.684 7.639 1.00 54.31 O ATOM 558 OE2 GLU A 37 7.922 -11.405 6.371 1.00 11.33 O ATOM 0 H GLU A 37 12.796 -8.617 5.343 1.00 50.51 H new ATOM 0 HA GLU A 37 10.023 -7.650 5.042 1.00 40.42 H new ATOM 0 HB2 GLU A 37 11.435 -9.441 7.039 1.00 65.24 H new ATOM 0 HB3 GLU A 37 9.844 -8.773 7.347 1.00 65.24 H new ATOM 0 HG2 GLU A 37 9.234 -9.813 5.011 1.00 71.21 H new ATOM 0 HG3 GLU A 37 10.678 -10.776 5.254 1.00 71.21 H new ATOM 565 N ASP A 38 11.675 -6.861 7.749 1.00 21.54 N ATOM 566 CA ASP A 38 11.975 -5.775 8.680 1.00 52.24 C ATOM 567 C ASP A 38 10.795 -4.820 8.817 1.00 61.31 C ATOM 568 O ASP A 38 10.966 -3.601 8.863 1.00 23.33 O ATOM 569 CB ASP A 38 13.201 -5.006 8.209 1.00 54.33 C ATOM 570 CG ASP A 38 14.493 -5.757 8.466 1.00 51.24 C ATOM 571 OD1 ASP A 38 14.922 -5.816 9.637 1.00 13.41 O ATOM 572 OD2 ASP A 38 15.075 -6.286 7.496 1.00 20.55 O ATOM 0 H ASP A 38 11.929 -7.788 8.090 1.00 21.54 H new ATOM 0 HA ASP A 38 12.173 -6.218 9.656 1.00 52.24 H new ATOM 0 HB2 ASP A 38 13.110 -4.802 7.142 1.00 54.33 H new ATOM 0 HB3 ASP A 38 13.238 -4.042 8.716 1.00 54.33 H new ATOM 577 N SER A 39 9.601 -5.385 8.877 1.00 12.23 N ATOM 578 CA SER A 39 8.380 -4.596 9.004 1.00 41.31 C ATOM 579 C SER A 39 8.462 -3.648 10.197 1.00 4.13 C ATOM 580 O SER A 39 9.294 -3.825 11.087 1.00 30.22 O ATOM 581 CB SER A 39 7.167 -5.517 9.151 1.00 11.13 C ATOM 582 OG SER A 39 7.009 -5.944 10.494 1.00 65.21 O ATOM 0 H SER A 39 9.447 -6.393 8.840 1.00 12.23 H new ATOM 0 HA SER A 39 8.268 -3.999 8.099 1.00 41.31 H new ATOM 0 HB2 SER A 39 6.268 -4.994 8.824 1.00 11.13 H new ATOM 0 HB3 SER A 39 7.285 -6.385 8.502 1.00 11.13 H new ATOM 0 HG SER A 39 6.176 -5.577 10.858 1.00 65.21 H new ATOM 588 N TYR A 40 7.599 -2.637 10.204 1.00 0.10 N ATOM 589 CA TYR A 40 7.580 -1.656 11.284 1.00 24.14 C ATOM 590 C TYR A 40 6.240 -1.668 12.012 1.00 35.05 C ATOM 591 O TYR A 40 5.253 -2.205 11.509 1.00 11.13 O ATOM 592 CB TYR A 40 7.864 -0.258 10.730 1.00 31.13 C ATOM 593 CG TYR A 40 8.951 -0.239 9.681 1.00 53.22 C ATOM 594 CD1 TYR A 40 10.289 -0.147 10.042 1.00 51.11 C ATOM 595 CD2 TYR A 40 8.640 -0.321 8.330 1.00 14.25 C ATOM 596 CE1 TYR A 40 11.287 -0.137 9.086 1.00 64.23 C ATOM 597 CE2 TYR A 40 9.632 -0.311 7.368 1.00 53.31 C ATOM 598 CZ TYR A 40 10.953 -0.220 7.751 1.00 52.02 C ATOM 599 OH TYR A 40 11.944 -0.213 6.797 1.00 72.34 O ATOM 0 H TYR A 40 6.904 -2.475 9.475 1.00 0.10 H new ATOM 0 HA TYR A 40 8.358 -1.923 11.999 1.00 24.14 H new ATOM 0 HB2 TYR A 40 6.948 0.148 10.301 1.00 31.13 H new ATOM 0 HB3 TYR A 40 8.150 0.399 11.551 1.00 31.13 H new ATOM 0 HD1 TYR A 40 10.554 -0.082 11.087 1.00 51.11 H new ATOM 0 HD2 TYR A 40 7.606 -0.394 8.026 1.00 14.25 H new ATOM 0 HE1 TYR A 40 12.323 -0.065 9.383 1.00 64.23 H new ATOM 0 HE2 TYR A 40 9.374 -0.374 6.321 1.00 53.31 H new ATOM 0 HH TYR A 40 11.597 -0.590 5.962 1.00 72.34 H new ATOM 609 N ARG A 41 6.214 -1.072 13.199 1.00 42.34 N ATOM 610 CA ARG A 41 4.996 -1.013 13.999 1.00 72.31 C ATOM 611 C ARG A 41 4.922 0.293 14.783 1.00 55.14 C ATOM 612 O ARG A 41 5.666 0.495 15.743 1.00 31.10 O ATOM 613 CB ARG A 41 4.936 -2.200 14.963 1.00 21.32 C ATOM 614 CG ARG A 41 4.509 -3.501 14.302 1.00 30.14 C ATOM 615 CD ARG A 41 4.926 -4.707 15.128 1.00 34.15 C ATOM 616 NE ARG A 41 4.180 -5.908 14.759 1.00 10.54 N ATOM 617 CZ ARG A 41 4.401 -7.109 15.288 1.00 75.34 C ATOM 618 NH1 ARG A 41 5.342 -7.273 16.210 1.00 52.45 N ATOM 619 NH2 ARG A 41 3.679 -8.149 14.895 1.00 4.11 N ATOM 0 H ARG A 41 7.023 -0.623 13.629 1.00 42.34 H new ATOM 0 HA ARG A 41 4.144 -1.059 13.320 1.00 72.31 H new ATOM 0 HB2 ARG A 41 5.917 -2.338 15.417 1.00 21.32 H new ATOM 0 HB3 ARG A 41 4.241 -1.967 15.770 1.00 21.32 H new ATOM 0 HG2 ARG A 41 3.427 -3.505 14.170 1.00 30.14 H new ATOM 0 HG3 ARG A 41 4.952 -3.568 13.308 1.00 30.14 H new ATOM 0 HD2 ARG A 41 5.993 -4.887 14.994 1.00 34.15 H new ATOM 0 HD3 ARG A 41 4.770 -4.494 16.185 1.00 34.15 H new ATOM 0 HE ARG A 41 3.447 -5.821 14.055 1.00 10.54 H new ATOM 0 HH11 ARG A 41 5.900 -6.476 16.517 1.00 52.45 H new ATOM 0 HH12 ARG A 41 5.507 -8.196 16.612 1.00 52.45 H new ATOM 0 HH21 ARG A 41 2.954 -8.029 14.187 1.00 4.11 H new ATOM 0 HH22 ARG A 41 3.848 -9.070 15.300 1.00 4.11 H new ATOM 633 N LYS A 42 4.019 1.175 14.369 1.00 75.22 N ATOM 634 CA LYS A 42 3.847 2.461 15.035 1.00 42.53 C ATOM 635 C LYS A 42 2.450 2.580 15.631 1.00 0.24 C ATOM 636 O LYS A 42 1.481 2.067 15.074 1.00 50.31 O ATOM 637 CB LYS A 42 4.090 3.607 14.054 1.00 51.22 C ATOM 638 CG LYS A 42 4.451 4.921 14.728 1.00 40.01 C ATOM 639 CD LYS A 42 4.665 6.029 13.709 1.00 5.20 C ATOM 640 CE LYS A 42 3.413 6.277 12.881 1.00 3.51 C ATOM 641 NZ LYS A 42 3.366 7.666 12.347 1.00 2.11 N ATOM 0 H LYS A 42 3.395 1.023 13.576 1.00 75.22 H new ATOM 0 HA LYS A 42 4.577 2.522 15.842 1.00 42.53 H new ATOM 0 HB2 LYS A 42 4.893 3.326 13.372 1.00 51.22 H new ATOM 0 HB3 LYS A 42 3.195 3.753 13.450 1.00 51.22 H new ATOM 0 HG2 LYS A 42 3.657 5.208 15.418 1.00 40.01 H new ATOM 0 HG3 LYS A 42 5.356 4.790 15.321 1.00 40.01 H new ATOM 0 HD2 LYS A 42 4.950 6.947 14.223 1.00 5.20 H new ATOM 0 HD3 LYS A 42 5.491 5.763 13.050 1.00 5.20 H new ATOM 0 HE2 LYS A 42 3.379 5.569 12.053 1.00 3.51 H new ATOM 0 HE3 LYS A 42 2.530 6.094 13.494 1.00 3.51 H new ATOM 0 HZ1 LYS A 42 2.378 7.937 12.170 1.00 2.11 H new ATOM 0 HZ2 LYS A 42 3.785 8.319 13.040 1.00 2.11 H new ATOM 0 HZ3 LYS A 42 3.903 7.714 11.457 1.00 2.11 H new ATOM 655 N GLN A 43 2.356 3.261 16.765 1.00 22.54 N ATOM 656 CA GLN A 43 1.076 3.448 17.438 1.00 50.31 C ATOM 657 C GLN A 43 0.456 4.790 17.064 1.00 23.21 C ATOM 658 O GLN A 43 1.154 5.796 16.944 1.00 53.24 O ATOM 659 CB GLN A 43 1.253 3.361 18.954 1.00 15.21 C ATOM 660 CG GLN A 43 -0.045 3.128 19.706 1.00 14.35 C ATOM 661 CD GLN A 43 0.079 3.450 21.175 1.00 62.14 C ATOM 662 OE1 GLN A 43 0.583 2.650 21.963 1.00 34.50 O ATOM 663 NE2 GLN A 43 -0.384 4.630 21.549 1.00 41.33 N ATOM 0 H GLN A 43 3.149 3.693 17.239 1.00 22.54 H new ATOM 0 HA GLN A 43 0.405 2.653 17.112 1.00 50.31 H new ATOM 0 HB2 GLN A 43 1.947 2.552 19.184 1.00 15.21 H new ATOM 0 HB3 GLN A 43 1.709 4.284 19.312 1.00 15.21 H new ATOM 0 HG2 GLN A 43 -0.832 3.741 19.267 1.00 14.35 H new ATOM 0 HG3 GLN A 43 -0.349 2.088 19.589 1.00 14.35 H new ATOM 0 HE21 GLN A 43 -0.793 5.259 20.859 1.00 41.33 H new ATOM 0 HE22 GLN A 43 -0.332 4.911 22.528 1.00 41.33 H new ATOM 672 N VAL A 44 -0.860 4.796 16.882 1.00 75.45 N ATOM 673 CA VAL A 44 -1.575 6.014 16.522 1.00 42.13 C ATOM 674 C VAL A 44 -3.006 5.984 17.045 1.00 44.52 C ATOM 675 O VAL A 44 -3.554 4.918 17.325 1.00 35.31 O ATOM 676 CB VAL A 44 -1.600 6.221 14.996 1.00 2.20 C ATOM 677 CG1 VAL A 44 -0.190 6.404 14.457 1.00 54.14 C ATOM 678 CG2 VAL A 44 -2.293 5.053 14.308 1.00 52.13 C ATOM 0 H VAL A 44 -1.453 3.971 16.978 1.00 75.45 H new ATOM 0 HA VAL A 44 -1.040 6.844 16.983 1.00 42.13 H new ATOM 0 HB VAL A 44 -2.167 7.127 14.782 1.00 2.20 H new ATOM 0 HG11 VAL A 44 -0.229 6.549 13.377 1.00 54.14 H new ATOM 0 HG12 VAL A 44 0.268 7.276 14.924 1.00 54.14 H new ATOM 0 HG13 VAL A 44 0.404 5.518 14.683 1.00 54.14 H new ATOM 0 HG21 VAL A 44 -2.301 5.218 13.231 1.00 52.13 H new ATOM 0 HG22 VAL A 44 -1.757 4.130 14.530 1.00 52.13 H new ATOM 0 HG23 VAL A 44 -3.318 4.974 14.670 1.00 52.13 H new ATOM 688 N VAL A 45 -3.608 7.161 17.173 1.00 53.44 N ATOM 689 CA VAL A 45 -4.977 7.269 17.661 1.00 31.22 C ATOM 690 C VAL A 45 -5.940 7.593 16.524 1.00 33.52 C ATOM 691 O VAL A 45 -6.046 8.742 16.095 1.00 34.51 O ATOM 692 CB VAL A 45 -5.102 8.350 18.751 1.00 61.55 C ATOM 693 CG1 VAL A 45 -6.484 8.311 19.384 1.00 72.24 C ATOM 694 CG2 VAL A 45 -4.020 8.173 19.805 1.00 51.52 C ATOM 0 H VAL A 45 -3.169 8.053 16.946 1.00 53.44 H new ATOM 0 HA VAL A 45 -5.238 6.302 18.090 1.00 31.22 H new ATOM 0 HB VAL A 45 -4.967 9.327 18.286 1.00 61.55 H new ATOM 0 HG11 VAL A 45 -6.554 9.081 20.152 1.00 72.24 H new ATOM 0 HG12 VAL A 45 -7.240 8.491 18.619 1.00 72.24 H new ATOM 0 HG13 VAL A 45 -6.650 7.333 19.835 1.00 72.24 H new ATOM 0 HG21 VAL A 45 -4.124 8.946 20.567 1.00 51.52 H new ATOM 0 HG22 VAL A 45 -4.120 7.191 20.268 1.00 51.52 H new ATOM 0 HG23 VAL A 45 -3.039 8.255 19.337 1.00 51.52 H new ATOM 704 N ILE A 46 -6.640 6.572 16.041 1.00 72.41 N ATOM 705 CA ILE A 46 -7.596 6.745 14.954 1.00 73.41 C ATOM 706 C ILE A 46 -8.983 6.265 15.365 1.00 54.43 C ATOM 707 O ILE A 46 -9.132 5.191 15.949 1.00 32.40 O ATOM 708 CB ILE A 46 -7.152 5.986 13.688 1.00 32.32 C ATOM 709 CG1 ILE A 46 -5.700 6.329 13.347 1.00 11.13 C ATOM 710 CG2 ILE A 46 -8.069 6.318 12.521 1.00 13.24 C ATOM 711 CD1 ILE A 46 -5.178 5.599 12.129 1.00 62.55 C ATOM 0 H ILE A 46 -6.563 5.615 16.386 1.00 72.41 H new ATOM 0 HA ILE A 46 -7.635 7.811 14.731 1.00 73.41 H new ATOM 0 HB ILE A 46 -7.218 4.915 13.881 1.00 32.32 H new ATOM 0 HG12 ILE A 46 -5.618 7.403 13.180 1.00 11.13 H new ATOM 0 HG13 ILE A 46 -5.068 6.090 14.202 1.00 11.13 H new ATOM 0 HG21 ILE A 46 -7.742 5.774 11.635 1.00 13.24 H new ATOM 0 HG22 ILE A 46 -9.091 6.029 12.767 1.00 13.24 H new ATOM 0 HG23 ILE A 46 -8.033 7.389 12.323 1.00 13.24 H new ATOM 0 HD11 ILE A 46 -4.144 5.890 11.946 1.00 62.55 H new ATOM 0 HD12 ILE A 46 -5.228 4.524 12.300 1.00 62.55 H new ATOM 0 HD13 ILE A 46 -5.786 5.857 11.262 1.00 62.55 H new ATOM 723 N ASP A 47 -9.997 7.067 15.057 1.00 2.24 N ATOM 724 CA ASP A 47 -11.374 6.724 15.396 1.00 62.13 C ATOM 725 C ASP A 47 -11.564 6.671 16.909 1.00 32.43 C ATOM 726 O ASP A 47 -12.358 5.881 17.418 1.00 15.32 O ATOM 727 CB ASP A 47 -11.757 5.380 14.774 1.00 10.24 C ATOM 728 CG ASP A 47 -13.201 5.346 14.313 1.00 0.34 C ATOM 729 OD1 ASP A 47 -14.101 5.347 15.179 1.00 63.44 O ATOM 730 OD2 ASP A 47 -13.432 5.318 13.085 1.00 63.41 O ATOM 0 H ASP A 47 -9.891 7.959 14.573 1.00 2.24 H new ATOM 0 HA ASP A 47 -12.025 7.500 14.993 1.00 62.13 H new ATOM 0 HB2 ASP A 47 -11.103 5.176 13.926 1.00 10.24 H new ATOM 0 HB3 ASP A 47 -11.592 4.586 15.502 1.00 10.24 H new ATOM 735 N GLY A 48 -10.828 7.518 17.622 1.00 34.35 N ATOM 736 CA GLY A 48 -10.929 7.551 19.070 1.00 74.13 C ATOM 737 C GLY A 48 -10.583 6.220 19.708 1.00 12.33 C ATOM 738 O GLY A 48 -11.059 5.905 20.799 1.00 53.25 O ATOM 0 H GLY A 48 -10.164 8.182 17.223 1.00 34.35 H new ATOM 0 HA2 GLY A 48 -10.263 8.321 19.460 1.00 74.13 H new ATOM 0 HA3 GLY A 48 -11.943 7.833 19.354 1.00 74.13 H new ATOM 742 N GLU A 49 -9.753 5.437 19.028 1.00 22.11 N ATOM 743 CA GLU A 49 -9.344 4.132 19.536 1.00 21.12 C ATOM 744 C GLU A 49 -7.886 3.847 19.190 1.00 31.34 C ATOM 745 O GLU A 49 -7.543 3.636 18.027 1.00 24.34 O ATOM 746 CB GLU A 49 -10.242 3.034 18.961 1.00 2.13 C ATOM 747 CG GLU A 49 -9.870 1.636 19.430 1.00 5.44 C ATOM 748 CD GLU A 49 -11.084 0.791 19.765 1.00 72.23 C ATOM 749 OE1 GLU A 49 -11.747 1.083 20.782 1.00 42.41 O ATOM 750 OE2 GLU A 49 -11.370 -0.163 19.011 1.00 60.14 O ATOM 0 H GLU A 49 -9.350 5.683 18.124 1.00 22.11 H new ATOM 0 HA GLU A 49 -9.445 4.143 20.621 1.00 21.12 H new ATOM 0 HB2 GLU A 49 -11.276 3.239 19.240 1.00 2.13 H new ATOM 0 HB3 GLU A 49 -10.192 3.068 17.873 1.00 2.13 H new ATOM 0 HG2 GLU A 49 -9.289 1.139 18.653 1.00 5.44 H new ATOM 0 HG3 GLU A 49 -9.230 1.710 20.309 1.00 5.44 H new ATOM 757 N THR A 50 -7.032 3.840 20.209 1.00 51.44 N ATOM 758 CA THR A 50 -5.610 3.578 20.014 1.00 1.12 C ATOM 759 C THR A 50 -5.393 2.218 19.359 1.00 12.45 C ATOM 760 O THR A 50 -5.908 1.203 19.828 1.00 3.11 O ATOM 761 CB THR A 50 -4.870 3.637 21.351 1.00 72.30 C ATOM 762 OG1 THR A 50 -5.067 4.891 21.979 1.00 61.33 O ATOM 763 CG2 THR A 50 -3.378 3.418 21.221 1.00 11.33 C ATOM 0 H THR A 50 -7.300 4.013 21.178 1.00 51.44 H new ATOM 0 HA THR A 50 -5.212 4.348 19.353 1.00 1.12 H new ATOM 0 HB THR A 50 -5.289 2.826 21.947 1.00 72.30 H new ATOM 0 HG1 THR A 50 -4.587 4.908 22.833 1.00 61.33 H new ATOM 0 HG21 THR A 50 -2.915 3.473 22.206 1.00 11.33 H new ATOM 0 HG22 THR A 50 -3.191 2.436 20.786 1.00 11.33 H new ATOM 0 HG23 THR A 50 -2.952 4.187 20.577 1.00 11.33 H new ATOM 771 N CYS A 51 -4.631 2.205 18.271 1.00 13.15 N ATOM 772 CA CYS A 51 -4.350 0.968 17.552 1.00 33.41 C ATOM 773 C CYS A 51 -2.962 1.005 16.921 1.00 31.31 C ATOM 774 O CYS A 51 -2.514 2.046 16.441 1.00 11.42 O ATOM 775 CB CYS A 51 -5.408 0.731 16.474 1.00 63.42 C ATOM 776 SG CYS A 51 -7.016 0.215 17.119 1.00 11.34 S ATOM 0 H CYS A 51 -4.197 3.036 17.868 1.00 13.15 H new ATOM 0 HA CYS A 51 -4.379 0.147 18.268 1.00 33.41 H new ATOM 0 HB2 CYS A 51 -5.537 1.648 15.898 1.00 63.42 H new ATOM 0 HB3 CYS A 51 -5.044 -0.030 15.784 1.00 63.42 H new ATOM 0 HG CYS A 51 -7.066 0.449 18.397 1.00 11.34 H new ATOM 782 N LEU A 52 -2.289 -0.141 16.921 1.00 74.30 N ATOM 783 CA LEU A 52 -0.954 -0.245 16.345 1.00 54.14 C ATOM 784 C LEU A 52 -1.031 -0.335 14.824 1.00 34.33 C ATOM 785 O LEU A 52 -1.979 -0.897 14.274 1.00 43.44 O ATOM 786 CB LEU A 52 -0.229 -1.471 16.910 1.00 2.52 C ATOM 787 CG LEU A 52 1.060 -1.169 17.679 1.00 14.25 C ATOM 788 CD1 LEU A 52 2.149 -0.696 16.729 1.00 25.35 C ATOM 789 CD2 LEU A 52 0.806 -0.133 18.766 1.00 24.44 C ATOM 0 H LEU A 52 -2.647 -1.011 17.314 1.00 74.30 H new ATOM 0 HA LEU A 52 -0.393 0.651 16.610 1.00 54.14 H new ATOM 0 HB2 LEU A 52 -0.912 -2.004 17.572 1.00 2.52 H new ATOM 0 HB3 LEU A 52 0.007 -2.145 16.087 1.00 2.52 H new ATOM 0 HG LEU A 52 1.399 -2.088 18.157 1.00 14.25 H new ATOM 0 HD11 LEU A 52 3.058 -0.486 17.293 1.00 25.35 H new ATOM 0 HD12 LEU A 52 2.351 -1.473 15.991 1.00 25.35 H new ATOM 0 HD13 LEU A 52 1.820 0.210 16.221 1.00 25.35 H new ATOM 0 HD21 LEU A 52 1.734 0.068 19.301 1.00 24.44 H new ATOM 0 HD22 LEU A 52 0.442 0.789 18.312 1.00 24.44 H new ATOM 0 HD23 LEU A 52 0.060 -0.513 19.464 1.00 24.44 H new ATOM 801 N LEU A 53 -0.032 0.222 14.149 1.00 12.43 N ATOM 802 CA LEU A 53 0.009 0.204 12.691 1.00 20.24 C ATOM 803 C LEU A 53 1.220 -0.573 12.188 1.00 72.24 C ATOM 804 O LEU A 53 2.345 -0.073 12.210 1.00 3.41 O ATOM 805 CB LEU A 53 0.041 1.633 12.144 1.00 71.02 C ATOM 806 CG LEU A 53 -1.276 2.403 12.261 1.00 4.15 C ATOM 807 CD1 LEU A 53 -1.157 3.766 11.595 1.00 22.31 C ATOM 808 CD2 LEU A 53 -2.416 1.606 11.645 1.00 60.51 C ATOM 0 H LEU A 53 0.760 0.692 14.588 1.00 12.43 H new ATOM 0 HA LEU A 53 -0.892 -0.295 12.334 1.00 20.24 H new ATOM 0 HB2 LEU A 53 0.817 2.189 12.670 1.00 71.02 H new ATOM 0 HB3 LEU A 53 0.331 1.597 11.094 1.00 71.02 H new ATOM 0 HG LEU A 53 -1.494 2.554 13.318 1.00 4.15 H new ATOM 0 HD11 LEU A 53 -2.103 4.300 11.688 1.00 22.31 H new ATOM 0 HD12 LEU A 53 -0.367 4.340 12.080 1.00 22.31 H new ATOM 0 HD13 LEU A 53 -0.916 3.636 10.540 1.00 22.31 H new ATOM 0 HD21 LEU A 53 -3.345 2.169 11.737 1.00 60.51 H new ATOM 0 HD22 LEU A 53 -2.205 1.424 10.591 1.00 60.51 H new ATOM 0 HD23 LEU A 53 -2.516 0.653 12.165 1.00 60.51 H new ATOM 820 N ASP A 54 0.982 -1.800 11.735 1.00 40.11 N ATOM 821 CA ASP A 54 2.053 -2.649 11.226 1.00 54.14 C ATOM 822 C ASP A 54 2.144 -2.554 9.707 1.00 21.21 C ATOM 823 O ASP A 54 1.373 -3.190 8.988 1.00 13.31 O ATOM 824 CB ASP A 54 1.821 -4.102 11.643 1.00 64.12 C ATOM 825 CG ASP A 54 3.115 -4.882 11.769 1.00 32.44 C ATOM 826 OD1 ASP A 54 4.144 -4.418 11.235 1.00 63.20 O ATOM 827 OD2 ASP A 54 3.099 -5.958 12.403 1.00 32.21 O ATOM 0 H ASP A 54 0.057 -2.228 11.710 1.00 40.11 H new ATOM 0 HA ASP A 54 2.994 -2.301 11.652 1.00 54.14 H new ATOM 0 HB2 ASP A 54 1.293 -4.123 12.596 1.00 64.12 H new ATOM 0 HB3 ASP A 54 1.177 -4.589 10.911 1.00 64.12 H new ATOM 832 N ILE A 55 3.091 -1.756 9.222 1.00 34.13 N ATOM 833 CA ILE A 55 3.278 -1.582 7.787 1.00 70.43 C ATOM 834 C ILE A 55 4.185 -2.667 7.218 1.00 51.04 C ATOM 835 O ILE A 55 5.391 -2.675 7.463 1.00 22.15 O ATOM 836 CB ILE A 55 3.879 -0.203 7.454 1.00 72.24 C ATOM 837 CG1 ILE A 55 3.240 0.886 8.319 1.00 63.35 C ATOM 838 CG2 ILE A 55 3.692 0.110 5.977 1.00 45.51 C ATOM 839 CD1 ILE A 55 1.732 0.946 8.201 1.00 44.22 C ATOM 0 H ILE A 55 3.739 -1.221 9.801 1.00 34.13 H new ATOM 0 HA ILE A 55 2.290 -1.656 7.332 1.00 70.43 H new ATOM 0 HB ILE A 55 4.947 -0.228 7.672 1.00 72.24 H new ATOM 0 HG12 ILE A 55 3.508 0.714 9.361 1.00 63.35 H new ATOM 0 HG13 ILE A 55 3.657 1.853 8.038 1.00 63.35 H new ATOM 0 HG21 ILE A 55 4.121 1.087 5.755 1.00 45.51 H new ATOM 0 HG22 ILE A 55 4.192 -0.651 5.378 1.00 45.51 H new ATOM 0 HG23 ILE A 55 2.628 0.118 5.739 1.00 45.51 H new ATOM 0 HD11 ILE A 55 1.348 1.740 8.841 1.00 44.22 H new ATOM 0 HD12 ILE A 55 1.456 1.149 7.166 1.00 44.22 H new ATOM 0 HD13 ILE A 55 1.305 -0.008 8.510 1.00 44.22 H new ATOM 851 N LEU A 56 3.595 -3.582 6.458 1.00 33.14 N ATOM 852 CA LEU A 56 4.347 -4.675 5.855 1.00 42.24 C ATOM 853 C LEU A 56 4.968 -4.245 4.531 1.00 43.34 C ATOM 854 O LEU A 56 4.279 -3.738 3.646 1.00 1.32 O ATOM 855 CB LEU A 56 3.438 -5.884 5.636 1.00 1.25 C ATOM 856 CG LEU A 56 4.132 -7.241 5.733 1.00 12.50 C ATOM 857 CD1 LEU A 56 3.104 -8.360 5.764 1.00 22.31 C ATOM 858 CD2 LEU A 56 5.096 -7.430 4.571 1.00 33.41 C ATOM 0 H LEU A 56 2.598 -3.588 6.245 1.00 33.14 H new ATOM 0 HA LEU A 56 5.150 -4.950 6.538 1.00 42.24 H new ATOM 0 HB2 LEU A 56 2.633 -5.852 6.370 1.00 1.25 H new ATOM 0 HB3 LEU A 56 2.976 -5.799 4.652 1.00 1.25 H new ATOM 0 HG LEU A 56 4.704 -7.273 6.661 1.00 12.50 H new ATOM 0 HD11 LEU A 56 3.614 -9.321 5.833 1.00 22.31 H new ATOM 0 HD12 LEU A 56 2.453 -8.232 6.629 1.00 22.31 H new ATOM 0 HD13 LEU A 56 2.507 -8.331 4.852 1.00 22.31 H new ATOM 0 HD21 LEU A 56 5.582 -8.402 4.656 1.00 33.41 H new ATOM 0 HD22 LEU A 56 4.547 -7.380 3.631 1.00 33.41 H new ATOM 0 HD23 LEU A 56 5.851 -6.644 4.593 1.00 33.41 H new ATOM 870 N ASP A 57 6.274 -4.454 4.401 1.00 52.02 N ATOM 871 CA ASP A 57 6.991 -4.091 3.185 1.00 45.13 C ATOM 872 C ASP A 57 7.418 -5.339 2.417 1.00 53.45 C ATOM 873 O ASP A 57 8.519 -5.853 2.613 1.00 21.21 O ATOM 874 CB ASP A 57 8.215 -3.239 3.525 1.00 22.54 C ATOM 875 CG ASP A 57 8.996 -2.825 2.293 1.00 24.40 C ATOM 876 OD1 ASP A 57 8.383 -2.722 1.209 1.00 22.32 O ATOM 877 OD2 ASP A 57 10.219 -2.604 2.411 1.00 44.53 O ATOM 0 H ASP A 57 6.858 -4.874 5.124 1.00 52.02 H new ATOM 0 HA ASP A 57 6.320 -3.509 2.553 1.00 45.13 H new ATOM 0 HB2 ASP A 57 7.894 -2.348 4.064 1.00 22.54 H new ATOM 0 HB3 ASP A 57 8.868 -3.799 4.194 1.00 22.54 H new ATOM 882 N THR A 58 6.538 -5.823 1.546 1.00 14.33 N ATOM 883 CA THR A 58 6.823 -7.013 0.752 1.00 61.02 C ATOM 884 C THR A 58 7.695 -6.671 -0.453 1.00 70.21 C ATOM 885 O THR A 58 8.122 -5.528 -0.619 1.00 23.30 O ATOM 886 CB THR A 58 5.521 -7.665 0.284 1.00 14.54 C ATOM 887 OG1 THR A 58 4.954 -6.937 -0.791 1.00 74.32 O ATOM 888 CG2 THR A 58 4.476 -7.764 1.374 1.00 61.04 C ATOM 0 H THR A 58 5.622 -5.410 1.372 1.00 14.33 H new ATOM 0 HA THR A 58 7.367 -7.716 1.383 1.00 61.02 H new ATOM 0 HB THR A 58 5.797 -8.673 -0.024 1.00 14.54 H new ATOM 0 HG1 THR A 58 4.205 -6.398 -0.462 1.00 74.32 H new ATOM 0 HG21 THR A 58 3.578 -8.236 0.975 1.00 61.04 H new ATOM 0 HG22 THR A 58 4.865 -8.363 2.198 1.00 61.04 H new ATOM 0 HG23 THR A 58 4.231 -6.765 1.735 1.00 61.04 H new ATOM 896 N ALA A 59 7.954 -7.670 -1.290 1.00 60.41 N ATOM 897 CA ALA A 59 8.775 -7.480 -2.480 1.00 41.21 C ATOM 898 C ALA A 59 7.914 -7.172 -3.700 1.00 34.01 C ATOM 899 O ALA A 59 6.707 -7.418 -3.698 1.00 23.45 O ATOM 900 CB ALA A 59 9.628 -8.714 -2.732 1.00 23.31 C ATOM 0 H ALA A 59 7.607 -8.621 -1.166 1.00 60.41 H new ATOM 0 HA ALA A 59 9.430 -6.626 -2.307 1.00 41.21 H new ATOM 0 HB1 ALA A 59 10.236 -8.560 -3.623 1.00 23.31 H new ATOM 0 HB2 ALA A 59 10.278 -8.888 -1.875 1.00 23.31 H new ATOM 0 HB3 ALA A 59 8.982 -9.579 -2.879 1.00 23.31 H new ATOM 906 N GLY A 60 8.541 -6.633 -4.740 1.00 12.14 N ATOM 907 CA GLY A 60 7.817 -6.301 -5.953 1.00 72.35 C ATOM 908 C GLY A 60 7.656 -7.491 -6.880 1.00 73.35 C ATOM 909 O GLY A 60 8.063 -7.439 -8.041 1.00 52.14 O ATOM 0 H GLY A 60 9.538 -6.420 -4.765 1.00 12.14 H new ATOM 0 HA2 GLY A 60 6.832 -5.914 -5.690 1.00 72.35 H new ATOM 0 HA3 GLY A 60 8.343 -5.504 -6.479 1.00 72.35 H new ATOM 913 N GLN A 61 7.060 -8.564 -6.364 1.00 2.45 N ATOM 914 CA GLN A 61 6.837 -9.783 -7.144 1.00 51.43 C ATOM 915 C GLN A 61 8.063 -10.149 -7.978 1.00 71.41 C ATOM 916 O GLN A 61 8.127 -9.851 -9.171 1.00 71.33 O ATOM 917 CB GLN A 61 5.615 -9.622 -8.053 1.00 41.31 C ATOM 918 CG GLN A 61 5.628 -8.349 -8.884 1.00 1.24 C ATOM 919 CD GLN A 61 4.477 -8.286 -9.870 1.00 73.00 C ATOM 920 OE1 GLN A 61 4.677 -8.047 -11.061 1.00 42.00 O ATOM 921 NE2 GLN A 61 3.263 -8.501 -9.376 1.00 44.42 N ATOM 0 H GLN A 61 6.721 -8.615 -5.404 1.00 2.45 H new ATOM 0 HA GLN A 61 6.654 -10.594 -6.439 1.00 51.43 H new ATOM 0 HB2 GLN A 61 5.557 -10.480 -8.722 1.00 41.31 H new ATOM 0 HB3 GLN A 61 4.714 -9.634 -7.440 1.00 41.31 H new ATOM 0 HG2 GLN A 61 5.581 -7.486 -8.220 1.00 1.24 H new ATOM 0 HG3 GLN A 61 6.571 -8.283 -9.427 1.00 1.24 H new ATOM 0 HE21 GLN A 61 3.144 -8.696 -8.382 1.00 44.42 H new ATOM 0 HE22 GLN A 61 2.450 -8.472 -9.991 1.00 44.42 H new ATOM 930 N GLU A 62 9.033 -10.800 -7.343 1.00 51.41 N ATOM 931 CA GLU A 62 10.254 -11.211 -8.027 1.00 31.33 C ATOM 932 C GLU A 62 10.402 -12.728 -8.006 1.00 13.05 C ATOM 933 O GLU A 62 10.683 -13.349 -9.031 1.00 74.44 O ATOM 934 CB GLU A 62 11.474 -10.557 -7.376 1.00 42.14 C ATOM 935 CG GLU A 62 11.486 -10.671 -5.863 1.00 51.10 C ATOM 936 CD GLU A 62 12.614 -9.881 -5.228 1.00 72.34 C ATOM 937 OE1 GLU A 62 12.766 -8.688 -5.565 1.00 33.52 O ATOM 938 OE2 GLU A 62 13.346 -10.456 -4.395 1.00 3.12 O ATOM 0 H GLU A 62 8.997 -11.054 -6.356 1.00 51.41 H new ATOM 0 HA GLU A 62 10.188 -10.884 -9.065 1.00 31.33 H new ATOM 0 HB2 GLU A 62 12.379 -11.016 -7.774 1.00 42.14 H new ATOM 0 HB3 GLU A 62 11.503 -9.503 -7.653 1.00 42.14 H new ATOM 0 HG2 GLU A 62 10.533 -10.318 -5.468 1.00 51.10 H new ATOM 0 HG3 GLU A 62 11.579 -11.720 -5.582 1.00 51.10 H new ATOM 945 N GLU A 63 10.209 -13.319 -6.831 1.00 31.53 N ATOM 946 CA GLU A 63 10.317 -14.766 -6.670 1.00 40.25 C ATOM 947 C GLU A 63 10.075 -15.166 -5.220 1.00 24.31 C ATOM 948 O GLU A 63 11.016 -15.320 -4.442 1.00 32.55 O ATOM 949 CB GLU A 63 11.693 -15.254 -7.115 1.00 50.02 C ATOM 950 CG GLU A 63 11.713 -15.827 -8.522 1.00 34.11 C ATOM 951 CD GLU A 63 12.570 -17.074 -8.631 1.00 63.50 C ATOM 952 OE1 GLU A 63 12.437 -17.964 -7.765 1.00 64.23 O ATOM 953 OE2 GLU A 63 13.375 -17.159 -9.582 1.00 31.32 O ATOM 0 H GLU A 63 9.976 -12.817 -5.974 1.00 31.53 H new ATOM 0 HA GLU A 63 9.556 -15.231 -7.296 1.00 40.25 H new ATOM 0 HB2 GLU A 63 12.398 -14.424 -7.060 1.00 50.02 H new ATOM 0 HB3 GLU A 63 12.042 -16.015 -6.417 1.00 50.02 H new ATOM 0 HG2 GLU A 63 10.694 -16.063 -8.829 1.00 34.11 H new ATOM 0 HG3 GLU A 63 12.087 -15.072 -9.213 1.00 34.11 H new ATOM 960 N TYR A 64 8.808 -15.332 -4.868 1.00 75.43 N ATOM 961 CA TYR A 64 8.428 -15.714 -3.512 1.00 52.41 C ATOM 962 C TYR A 64 6.908 -15.792 -3.379 1.00 2.32 C ATOM 963 O TYR A 64 6.330 -15.297 -2.411 1.00 33.11 O ATOM 964 CB TYR A 64 8.996 -14.715 -2.499 1.00 42.42 C ATOM 965 CG TYR A 64 10.280 -15.177 -1.843 1.00 54.31 C ATOM 966 CD1 TYR A 64 10.432 -16.492 -1.420 1.00 41.21 C ATOM 967 CD2 TYR A 64 11.336 -14.297 -1.643 1.00 51.00 C ATOM 968 CE1 TYR A 64 11.601 -16.917 -0.818 1.00 5.04 C ATOM 969 CE2 TYR A 64 12.509 -14.716 -1.042 1.00 20.31 C ATOM 970 CZ TYR A 64 12.636 -16.026 -0.631 1.00 42.13 C ATOM 971 OH TYR A 64 13.801 -16.445 -0.031 1.00 64.44 O ATOM 0 H TYR A 64 8.021 -15.208 -5.505 1.00 75.43 H new ATOM 0 HA TYR A 64 8.844 -16.700 -3.305 1.00 52.41 H new ATOM 0 HB2 TYR A 64 9.177 -13.765 -3.001 1.00 42.42 H new ATOM 0 HB3 TYR A 64 8.250 -14.530 -1.726 1.00 42.42 H new ATOM 0 HD1 TYR A 64 9.623 -17.193 -1.564 1.00 41.21 H new ATOM 0 HD2 TYR A 64 11.240 -13.270 -1.962 1.00 51.00 H new ATOM 0 HE1 TYR A 64 11.703 -17.943 -0.495 1.00 5.04 H new ATOM 0 HE2 TYR A 64 13.322 -14.020 -0.895 1.00 20.31 H new ATOM 0 HH TYR A 64 14.429 -15.695 0.024 1.00 64.44 H new ATOM 981 N SER A 65 6.266 -16.420 -4.361 1.00 14.03 N ATOM 982 CA SER A 65 4.814 -16.565 -4.358 1.00 44.22 C ATOM 983 C SER A 65 4.331 -17.212 -3.062 1.00 52.03 C ATOM 984 O SER A 65 3.212 -16.963 -2.612 1.00 42.23 O ATOM 985 CB SER A 65 4.362 -17.399 -5.559 1.00 23.53 C ATOM 986 OG SER A 65 5.398 -18.258 -6.003 1.00 12.02 O ATOM 0 H SER A 65 6.729 -16.836 -5.169 1.00 14.03 H new ATOM 0 HA SER A 65 4.375 -15.570 -4.429 1.00 44.22 H new ATOM 0 HB2 SER A 65 3.487 -17.990 -5.287 1.00 23.53 H new ATOM 0 HB3 SER A 65 4.060 -16.738 -6.372 1.00 23.53 H new ATOM 0 HG SER A 65 5.083 -18.781 -6.770 1.00 12.02 H new ATOM 992 N ALA A 66 5.182 -18.040 -2.465 1.00 13.32 N ATOM 993 CA ALA A 66 4.842 -18.718 -1.220 1.00 70.54 C ATOM 994 C ALA A 66 4.772 -17.730 -0.062 1.00 11.23 C ATOM 995 O ALA A 66 3.998 -17.912 0.877 1.00 61.21 O ATOM 996 CB ALA A 66 5.856 -19.811 -0.920 1.00 40.51 C ATOM 0 H ALA A 66 6.112 -18.257 -2.823 1.00 13.32 H new ATOM 0 HA ALA A 66 3.858 -19.173 -1.339 1.00 70.54 H new ATOM 0 HB1 ALA A 66 5.589 -20.309 0.012 1.00 40.51 H new ATOM 0 HB2 ALA A 66 5.858 -20.538 -1.732 1.00 40.51 H new ATOM 0 HB3 ALA A 66 6.849 -19.370 -0.825 1.00 40.51 H new ATOM 1002 N MET A 67 5.587 -16.682 -0.136 1.00 75.45 N ATOM 1003 CA MET A 67 5.616 -15.664 0.907 1.00 54.32 C ATOM 1004 C MET A 67 4.508 -14.638 0.687 1.00 12.21 C ATOM 1005 O MET A 67 3.996 -14.050 1.639 1.00 53.41 O ATOM 1006 CB MET A 67 6.979 -14.964 0.947 1.00 32.44 C ATOM 1007 CG MET A 67 8.162 -15.895 0.729 1.00 13.04 C ATOM 1008 SD MET A 67 8.931 -16.427 2.271 1.00 50.23 S ATOM 1009 CE MET A 67 8.196 -18.048 2.471 1.00 74.45 C ATOM 0 H MET A 67 6.235 -16.516 -0.906 1.00 75.45 H new ATOM 0 HA MET A 67 5.451 -16.159 1.864 1.00 54.32 H new ATOM 0 HB2 MET A 67 6.998 -14.185 0.185 1.00 32.44 H new ATOM 0 HB3 MET A 67 7.093 -14.469 1.911 1.00 32.44 H new ATOM 0 HG2 MET A 67 7.830 -16.772 0.173 1.00 13.04 H new ATOM 0 HG3 MET A 67 8.906 -15.390 0.113 1.00 13.04 H new ATOM 0 HE1 MET A 67 8.613 -18.530 3.355 1.00 74.45 H new ATOM 0 HE2 MET A 67 7.117 -17.946 2.588 1.00 74.45 H new ATOM 0 HE3 MET A 67 8.410 -18.656 1.592 1.00 74.45 H new ATOM 1019 N ARG A 68 4.137 -14.431 -0.574 1.00 20.14 N ATOM 1020 CA ARG A 68 3.083 -13.481 -0.910 1.00 32.02 C ATOM 1021 C ARG A 68 1.750 -13.939 -0.329 1.00 33.11 C ATOM 1022 O ARG A 68 1.099 -13.205 0.415 1.00 33.32 O ATOM 1023 CB ARG A 68 2.963 -13.328 -2.427 1.00 51.33 C ATOM 1024 CG ARG A 68 2.145 -12.117 -2.854 1.00 45.15 C ATOM 1025 CD ARG A 68 2.923 -11.228 -3.810 1.00 21.54 C ATOM 1026 NE ARG A 68 2.536 -9.824 -3.696 1.00 43.15 N ATOM 1027 CZ ARG A 68 3.202 -8.823 -4.267 1.00 0.11 C ATOM 1028 NH1 ARG A 68 4.281 -9.069 -5.001 1.00 74.14 N ATOM 1029 NH2 ARG A 68 2.788 -7.574 -4.107 1.00 12.44 N ATOM 0 H ARG A 68 4.549 -14.907 -1.376 1.00 20.14 H new ATOM 0 HA ARG A 68 3.344 -12.515 -0.479 1.00 32.02 H new ATOM 0 HB2 ARG A 68 3.962 -13.251 -2.856 1.00 51.33 H new ATOM 0 HB3 ARG A 68 2.507 -14.228 -2.840 1.00 51.33 H new ATOM 0 HG2 ARG A 68 1.224 -12.449 -3.333 1.00 45.15 H new ATOM 0 HG3 ARG A 68 1.857 -11.542 -1.974 1.00 45.15 H new ATOM 0 HD2 ARG A 68 3.990 -11.327 -3.609 1.00 21.54 H new ATOM 0 HD3 ARG A 68 2.759 -11.566 -4.833 1.00 21.54 H new ATOM 0 HE ARG A 68 1.707 -9.598 -3.147 1.00 43.15 H new ATOM 0 HH11 ARG A 68 4.603 -10.028 -5.129 1.00 74.14 H new ATOM 0 HH12 ARG A 68 4.788 -8.299 -5.437 1.00 74.14 H new ATOM 0 HH21 ARG A 68 1.959 -7.380 -3.546 1.00 12.44 H new ATOM 0 HH22 ARG A 68 3.299 -6.807 -4.545 1.00 12.44 H new ATOM 1043 N ASP A 69 1.355 -15.167 -0.665 1.00 73.02 N ATOM 1044 CA ASP A 69 0.106 -15.736 -0.168 1.00 43.52 C ATOM 1045 C ASP A 69 0.005 -15.552 1.344 1.00 41.11 C ATOM 1046 O ASP A 69 -1.077 -15.335 1.889 1.00 11.03 O ATOM 1047 CB ASP A 69 0.030 -17.224 -0.524 1.00 10.54 C ATOM 1048 CG ASP A 69 -0.294 -17.454 -1.989 1.00 63.14 C ATOM 1049 OD1 ASP A 69 0.024 -16.571 -2.813 1.00 10.13 O ATOM 1050 OD2 ASP A 69 -0.866 -18.517 -2.311 1.00 43.31 O ATOM 0 H ASP A 69 1.884 -15.786 -1.280 1.00 73.02 H new ATOM 0 HA ASP A 69 -0.728 -15.216 -0.639 1.00 43.52 H new ATOM 0 HB2 ASP A 69 0.981 -17.700 -0.286 1.00 10.54 H new ATOM 0 HB3 ASP A 69 -0.730 -17.704 0.093 1.00 10.54 H new ATOM 1055 N GLN A 70 1.152 -15.635 2.006 1.00 11.11 N ATOM 1056 CA GLN A 70 1.238 -15.476 3.448 1.00 63.33 C ATOM 1057 C GLN A 70 0.757 -14.105 3.889 1.00 2.32 C ATOM 1058 O GLN A 70 -0.205 -13.978 4.644 1.00 14.23 O ATOM 1059 CB GLN A 70 2.685 -15.646 3.875 1.00 23.23 C ATOM 1060 CG GLN A 70 2.915 -16.852 4.738 1.00 70.32 C ATOM 1061 CD GLN A 70 2.426 -18.137 4.100 1.00 73.32 C ATOM 1062 OE1 GLN A 70 1.899 -19.040 4.917 1.00 33.20 O flip ATOM 1063 NE2 GLN A 70 2.521 -18.315 2.885 1.00 41.51 N flip ATOM 0 H GLN A 70 2.049 -15.815 1.555 1.00 11.11 H new ATOM 0 HA GLN A 70 0.601 -16.229 3.912 1.00 63.33 H new ATOM 0 HB2 GLN A 70 3.312 -15.720 2.986 1.00 23.23 H new ATOM 0 HB3 GLN A 70 3.003 -14.755 4.417 1.00 23.23 H new ATOM 0 HG2 GLN A 70 3.980 -16.941 4.952 1.00 70.32 H new ATOM 0 HG3 GLN A 70 2.409 -16.711 5.693 1.00 70.32 H new ATOM 0 HE21 GLN A 70 2.933 -17.593 2.294 1.00 41.51 H new ATOM 0 HE22 GLN A 70 2.187 -19.185 2.469 1.00 41.51 H new ATOM 1072 N TYR A 71 1.462 -13.085 3.423 1.00 10.03 N ATOM 1073 CA TYR A 71 1.153 -11.703 3.770 1.00 61.03 C ATOM 1074 C TYR A 71 -0.330 -11.408 3.579 1.00 41.04 C ATOM 1075 O TYR A 71 -0.897 -10.558 4.267 1.00 0.41 O ATOM 1076 CB TYR A 71 1.993 -10.756 2.916 1.00 74.44 C ATOM 1077 CG TYR A 71 3.481 -10.975 3.069 1.00 42.43 C ATOM 1078 CD1 TYR A 71 4.085 -10.908 4.317 1.00 54.43 C ATOM 1079 CD2 TYR A 71 4.283 -11.246 1.967 1.00 31.13 C ATOM 1080 CE1 TYR A 71 5.444 -11.103 4.464 1.00 60.21 C ATOM 1081 CE2 TYR A 71 5.643 -11.445 2.106 1.00 23.21 C ATOM 1082 CZ TYR A 71 6.219 -11.371 3.357 1.00 44.11 C ATOM 1083 OH TYR A 71 7.573 -11.566 3.501 1.00 32.05 O ATOM 0 H TYR A 71 2.260 -13.189 2.797 1.00 10.03 H new ATOM 0 HA TYR A 71 1.394 -11.550 4.822 1.00 61.03 H new ATOM 0 HB2 TYR A 71 1.720 -10.883 1.869 1.00 74.44 H new ATOM 0 HB3 TYR A 71 1.755 -9.727 3.185 1.00 74.44 H new ATOM 0 HD1 TYR A 71 3.482 -10.700 5.188 1.00 54.43 H new ATOM 0 HD2 TYR A 71 3.836 -11.302 0.986 1.00 31.13 H new ATOM 0 HE1 TYR A 71 5.897 -11.046 5.443 1.00 60.21 H new ATOM 0 HE2 TYR A 71 6.252 -11.657 1.240 1.00 23.21 H new ATOM 0 HH TYR A 71 7.807 -11.546 4.452 1.00 32.05 H new ATOM 1093 N MET A 72 -0.962 -12.131 2.664 1.00 72.21 N ATOM 1094 CA MET A 72 -2.384 -11.960 2.417 1.00 41.54 C ATOM 1095 C MET A 72 -3.183 -12.578 3.561 1.00 63.25 C ATOM 1096 O MET A 72 -4.158 -12.000 4.041 1.00 71.51 O ATOM 1097 CB MET A 72 -2.773 -12.601 1.083 1.00 31.42 C ATOM 1098 CG MET A 72 -1.914 -12.139 -0.085 1.00 21.04 C ATOM 1099 SD MET A 72 -2.886 -11.449 -1.438 1.00 55.02 S ATOM 1100 CE MET A 72 -1.645 -10.469 -2.280 1.00 33.23 C ATOM 0 H MET A 72 -0.513 -12.839 2.083 1.00 72.21 H new ATOM 0 HA MET A 72 -2.611 -10.895 2.363 1.00 41.54 H new ATOM 0 HB2 MET A 72 -2.697 -13.685 1.174 1.00 31.42 H new ATOM 0 HB3 MET A 72 -3.817 -12.372 0.869 1.00 31.42 H new ATOM 0 HG2 MET A 72 -1.205 -11.389 0.266 1.00 21.04 H new ATOM 0 HG3 MET A 72 -1.330 -12.981 -0.456 1.00 21.04 H new ATOM 0 HE1 MET A 72 -2.014 -10.182 -3.264 1.00 33.23 H new ATOM 0 HE2 MET A 72 -1.432 -9.573 -1.697 1.00 33.23 H new ATOM 0 HE3 MET A 72 -0.733 -11.055 -2.392 1.00 33.23 H new ATOM 1110 N ARG A 73 -2.748 -13.759 3.995 1.00 5.42 N ATOM 1111 CA ARG A 73 -3.402 -14.471 5.088 1.00 13.44 C ATOM 1112 C ARG A 73 -2.953 -13.944 6.451 1.00 35.42 C ATOM 1113 O ARG A 73 -3.623 -14.169 7.459 1.00 15.23 O ATOM 1114 CB ARG A 73 -3.110 -15.965 4.992 1.00 61.00 C ATOM 1115 CG ARG A 73 -3.761 -16.626 3.791 1.00 10.55 C ATOM 1116 CD ARG A 73 -3.202 -18.014 3.551 1.00 31.41 C ATOM 1117 NE ARG A 73 -3.998 -19.048 4.208 1.00 55.03 N ATOM 1118 CZ ARG A 73 -3.830 -19.427 5.473 1.00 43.52 C ATOM 1119 NH1 ARG A 73 -2.893 -18.862 6.227 1.00 62.05 N ATOM 1120 NH2 ARG A 73 -4.601 -20.374 5.988 1.00 64.34 N ATOM 0 H ARG A 73 -1.941 -14.244 3.603 1.00 5.42 H new ATOM 0 HA ARG A 73 -4.475 -14.302 4.996 1.00 13.44 H new ATOM 0 HB2 ARG A 73 -2.032 -16.115 4.941 1.00 61.00 H new ATOM 0 HB3 ARG A 73 -3.457 -16.456 5.901 1.00 61.00 H new ATOM 0 HG2 ARG A 73 -4.838 -16.688 3.948 1.00 10.55 H new ATOM 0 HG3 ARG A 73 -3.603 -16.011 2.905 1.00 10.55 H new ATOM 0 HD2 ARG A 73 -3.167 -18.210 2.479 1.00 31.41 H new ATOM 0 HD3 ARG A 73 -2.176 -18.060 3.917 1.00 31.41 H new ATOM 0 HE ARG A 73 -4.728 -19.508 3.664 1.00 55.03 H new ATOM 0 HH11 ARG A 73 -2.296 -18.132 5.837 1.00 62.05 H new ATOM 0 HH12 ARG A 73 -2.771 -19.158 7.195 1.00 62.05 H new ATOM 0 HH21 ARG A 73 -5.322 -20.812 5.415 1.00 64.34 H new ATOM 0 HH22 ARG A 73 -4.473 -20.665 6.957 1.00 64.34 H new ATOM 1134 N THR A 74 -1.818 -13.246 6.481 1.00 75.11 N ATOM 1135 CA THR A 74 -1.294 -12.699 7.728 1.00 72.14 C ATOM 1136 C THR A 74 -1.675 -11.231 7.885 1.00 13.11 C ATOM 1137 O THR A 74 -1.578 -10.669 8.976 1.00 42.14 O ATOM 1138 CB THR A 74 0.229 -12.837 7.783 1.00 15.51 C ATOM 1139 OG1 THR A 74 0.843 -12.014 6.809 1.00 43.11 O ATOM 1140 CG2 THR A 74 0.714 -14.252 7.563 1.00 44.20 C ATOM 0 H THR A 74 -1.247 -13.048 5.659 1.00 75.11 H new ATOM 0 HA THR A 74 -1.736 -13.268 8.546 1.00 72.14 H new ATOM 0 HB THR A 74 0.508 -12.531 8.791 1.00 15.51 H new ATOM 0 HG1 THR A 74 1.647 -11.602 7.189 1.00 43.11 H new ATOM 0 HG21 THR A 74 1.802 -14.276 7.615 1.00 44.20 H new ATOM 0 HG22 THR A 74 0.299 -14.903 8.333 1.00 44.20 H new ATOM 0 HG23 THR A 74 0.390 -14.599 6.582 1.00 44.20 H new ATOM 1148 N GLY A 75 -2.095 -10.610 6.787 1.00 42.31 N ATOM 1149 CA GLY A 75 -2.466 -9.212 6.827 1.00 22.53 C ATOM 1150 C GLY A 75 -3.957 -8.995 7.005 1.00 5.51 C ATOM 1151 O GLY A 75 -4.759 -9.903 6.777 1.00 31.31 O ATOM 0 H GLY A 75 -2.184 -11.052 5.872 1.00 42.31 H new ATOM 0 HA2 GLY A 75 -1.934 -8.725 7.644 1.00 22.53 H new ATOM 0 HA3 GLY A 75 -2.143 -8.730 5.904 1.00 22.53 H new ATOM 1155 N GLU A 76 -4.326 -7.783 7.411 1.00 62.04 N ATOM 1156 CA GLU A 76 -5.727 -7.430 7.619 1.00 10.30 C ATOM 1157 C GLU A 76 -6.246 -6.550 6.482 1.00 22.13 C ATOM 1158 O GLU A 76 -7.454 -6.377 6.321 1.00 11.11 O ATOM 1159 CB GLU A 76 -5.896 -6.708 8.956 1.00 54.51 C ATOM 1160 CG GLU A 76 -5.389 -7.506 10.146 1.00 75.45 C ATOM 1161 CD GLU A 76 -6.513 -8.043 11.012 1.00 4.40 C ATOM 1162 OE1 GLU A 76 -7.167 -9.022 10.597 1.00 23.44 O ATOM 1163 OE2 GLU A 76 -6.737 -7.483 12.106 1.00 23.22 O ATOM 0 H GLU A 76 -3.670 -7.026 7.603 1.00 62.04 H new ATOM 0 HA GLU A 76 -6.309 -8.351 7.633 1.00 10.30 H new ATOM 0 HB2 GLU A 76 -5.366 -5.756 8.915 1.00 54.51 H new ATOM 0 HB3 GLU A 76 -6.951 -6.479 9.105 1.00 54.51 H new ATOM 0 HG2 GLU A 76 -4.782 -8.338 9.789 1.00 75.45 H new ATOM 0 HG3 GLU A 76 -4.739 -6.874 10.752 1.00 75.45 H new ATOM 1170 N GLY A 77 -5.327 -5.997 5.694 1.00 40.13 N ATOM 1171 CA GLY A 77 -5.713 -5.144 4.584 1.00 22.45 C ATOM 1172 C GLY A 77 -4.700 -5.175 3.456 1.00 35.25 C ATOM 1173 O GLY A 77 -3.754 -5.961 3.486 1.00 61.31 O ATOM 0 H GLY A 77 -4.321 -6.125 5.805 1.00 40.13 H new ATOM 0 HA2 GLY A 77 -6.685 -5.461 4.206 1.00 22.45 H new ATOM 0 HA3 GLY A 77 -5.828 -4.120 4.938 1.00 22.45 H new ATOM 1177 N PHE A 78 -4.898 -4.321 2.457 1.00 34.13 N ATOM 1178 CA PHE A 78 -3.992 -4.261 1.315 1.00 22.22 C ATOM 1179 C PHE A 78 -3.975 -2.864 0.702 1.00 62.42 C ATOM 1180 O PHE A 78 -5.024 -2.291 0.408 1.00 62.40 O ATOM 1181 CB PHE A 78 -4.403 -5.288 0.260 1.00 33.13 C ATOM 1182 CG PHE A 78 -4.422 -6.699 0.772 1.00 71.14 C ATOM 1183 CD1 PHE A 78 -5.566 -7.223 1.352 1.00 74.24 C ATOM 1184 CD2 PHE A 78 -3.298 -7.502 0.672 1.00 41.13 C ATOM 1185 CE1 PHE A 78 -5.588 -8.521 1.824 1.00 61.12 C ATOM 1186 CE2 PHE A 78 -3.313 -8.801 1.141 1.00 75.21 C ATOM 1187 CZ PHE A 78 -4.460 -9.312 1.718 1.00 40.42 C ATOM 0 H PHE A 78 -5.676 -3.662 2.415 1.00 34.13 H new ATOM 0 HA PHE A 78 -2.987 -4.493 1.669 1.00 22.22 H new ATOM 0 HB2 PHE A 78 -5.394 -5.033 -0.117 1.00 33.13 H new ATOM 0 HB3 PHE A 78 -3.716 -5.225 -0.584 1.00 33.13 H new ATOM 0 HD1 PHE A 78 -6.451 -6.609 1.436 1.00 74.24 H new ATOM 0 HD2 PHE A 78 -2.399 -7.108 0.222 1.00 41.13 H new ATOM 0 HE1 PHE A 78 -6.486 -8.917 2.275 1.00 61.12 H new ATOM 0 HE2 PHE A 78 -2.430 -9.417 1.057 1.00 75.21 H new ATOM 0 HZ PHE A 78 -4.475 -10.328 2.085 1.00 40.42 H new ATOM 1197 N LEU A 79 -2.776 -2.324 0.511 1.00 35.31 N ATOM 1198 CA LEU A 79 -2.618 -0.995 -0.069 1.00 33.13 C ATOM 1199 C LEU A 79 -1.917 -1.073 -1.422 1.00 54.32 C ATOM 1200 O LEU A 79 -0.788 -1.553 -1.521 1.00 12.44 O ATOM 1201 CB LEU A 79 -1.826 -0.095 0.882 1.00 62.31 C ATOM 1202 CG LEU A 79 -2.470 1.266 1.164 1.00 51.22 C ATOM 1203 CD1 LEU A 79 -2.777 1.416 2.646 1.00 53.30 C ATOM 1204 CD2 LEU A 79 -1.566 2.393 0.688 1.00 33.04 C ATOM 0 H LEU A 79 -1.899 -2.787 0.750 1.00 35.31 H new ATOM 0 HA LEU A 79 -3.609 -0.568 -0.220 1.00 33.13 H new ATOM 0 HB2 LEU A 79 -1.690 -0.620 1.828 1.00 62.31 H new ATOM 0 HB3 LEU A 79 -0.833 0.068 0.463 1.00 62.31 H new ATOM 0 HG LEU A 79 -3.409 1.323 0.613 1.00 51.22 H new ATOM 0 HD11 LEU A 79 -3.234 2.389 2.826 1.00 53.30 H new ATOM 0 HD12 LEU A 79 -3.464 0.629 2.957 1.00 53.30 H new ATOM 0 HD13 LEU A 79 -1.853 1.337 3.219 1.00 53.30 H new ATOM 0 HD21 LEU A 79 -2.040 3.352 0.897 1.00 33.04 H new ATOM 0 HD22 LEU A 79 -0.611 2.339 1.211 1.00 33.04 H new ATOM 0 HD23 LEU A 79 -1.399 2.297 -0.385 1.00 33.04 H new ATOM 1216 N CYS A 80 -2.593 -0.596 -2.462 1.00 75.42 N ATOM 1217 CA CYS A 80 -2.033 -0.611 -3.808 1.00 54.23 C ATOM 1218 C CYS A 80 -1.355 0.716 -4.129 1.00 4.41 C ATOM 1219 O CYS A 80 -2.018 1.739 -4.298 1.00 32.14 O ATOM 1220 CB CYS A 80 -3.126 -0.900 -4.839 1.00 3.50 C ATOM 1221 SG CYS A 80 -3.564 -2.649 -4.981 1.00 70.14 S ATOM 0 H CYS A 80 -3.529 -0.195 -2.398 1.00 75.42 H new ATOM 0 HA CYS A 80 -1.285 -1.403 -3.852 1.00 54.23 H new ATOM 0 HB2 CYS A 80 -4.019 -0.333 -4.575 1.00 3.50 H new ATOM 0 HB3 CYS A 80 -2.796 -0.539 -5.813 1.00 3.50 H new ATOM 0 HG CYS A 80 -4.497 -2.792 -5.875 1.00 70.14 H new ATOM 1227 N VAL A 81 -0.029 0.691 -4.210 1.00 42.53 N ATOM 1228 CA VAL A 81 0.739 1.892 -4.510 1.00 55.03 C ATOM 1229 C VAL A 81 1.254 1.872 -5.945 1.00 62.04 C ATOM 1230 O VAL A 81 2.099 1.050 -6.300 1.00 3.24 O ATOM 1231 CB VAL A 81 1.934 2.049 -3.550 1.00 61.21 C ATOM 1232 CG1 VAL A 81 2.650 3.369 -3.795 1.00 62.14 C ATOM 1233 CG2 VAL A 81 1.475 1.945 -2.103 1.00 61.44 C ATOM 0 H VAL A 81 0.535 -0.148 -4.072 1.00 42.53 H new ATOM 0 HA VAL A 81 0.065 2.739 -4.381 1.00 55.03 H new ATOM 0 HB VAL A 81 2.638 1.240 -3.744 1.00 61.21 H new ATOM 0 HG11 VAL A 81 3.490 3.460 -3.107 1.00 62.14 H new ATOM 0 HG12 VAL A 81 3.016 3.399 -4.821 1.00 62.14 H new ATOM 0 HG13 VAL A 81 1.957 4.194 -3.633 1.00 62.14 H new ATOM 0 HG21 VAL A 81 2.333 2.058 -1.440 1.00 61.44 H new ATOM 0 HG22 VAL A 81 0.749 2.731 -1.894 1.00 61.44 H new ATOM 0 HG23 VAL A 81 1.014 0.971 -1.937 1.00 61.44 H new ATOM 1243 N PHE A 82 0.741 2.782 -6.766 1.00 10.14 N ATOM 1244 CA PHE A 82 1.153 2.871 -8.162 1.00 13.10 C ATOM 1245 C PHE A 82 1.631 4.280 -8.496 1.00 4.03 C ATOM 1246 O PHE A 82 1.048 5.267 -8.046 1.00 60.21 O ATOM 1247 CB PHE A 82 -0.002 2.471 -9.086 1.00 32.32 C ATOM 1248 CG PHE A 82 -1.097 3.498 -9.170 1.00 54.32 C ATOM 1249 CD1 PHE A 82 -1.968 3.690 -8.110 1.00 23.52 C ATOM 1250 CD2 PHE A 82 -1.251 4.271 -10.310 1.00 11.33 C ATOM 1251 CE1 PHE A 82 -2.974 4.634 -8.186 1.00 54.24 C ATOM 1252 CE2 PHE A 82 -2.256 5.216 -10.391 1.00 34.22 C ATOM 1253 CZ PHE A 82 -3.118 5.398 -9.328 1.00 64.42 C ATOM 0 H PHE A 82 0.039 3.468 -6.489 1.00 10.14 H new ATOM 0 HA PHE A 82 1.982 2.181 -8.317 1.00 13.10 H new ATOM 0 HB2 PHE A 82 0.391 2.291 -10.086 1.00 32.32 H new ATOM 0 HB3 PHE A 82 -0.426 1.530 -8.736 1.00 32.32 H new ATOM 0 HD1 PHE A 82 -1.860 3.096 -7.215 1.00 23.52 H new ATOM 0 HD2 PHE A 82 -0.579 4.133 -11.144 1.00 11.33 H new ATOM 0 HE1 PHE A 82 -3.647 4.775 -7.353 1.00 54.24 H new ATOM 0 HE2 PHE A 82 -2.367 5.812 -11.285 1.00 34.22 H new ATOM 0 HZ PHE A 82 -3.904 6.136 -9.389 1.00 64.42 H new ATOM 1263 N ALA A 83 2.696 4.368 -9.285 1.00 45.01 N ATOM 1264 CA ALA A 83 3.249 5.658 -9.676 1.00 51.31 C ATOM 1265 C ALA A 83 2.544 6.205 -10.912 1.00 3.32 C ATOM 1266 O ALA A 83 2.495 5.549 -11.952 1.00 62.23 O ATOM 1267 CB ALA A 83 4.744 5.536 -9.929 1.00 64.20 C ATOM 0 H ALA A 83 3.193 3.562 -9.666 1.00 45.01 H new ATOM 0 HA ALA A 83 3.086 6.359 -8.857 1.00 51.31 H new ATOM 0 HB1 ALA A 83 5.144 6.507 -10.220 1.00 64.20 H new ATOM 0 HB2 ALA A 83 5.240 5.197 -9.020 1.00 64.20 H new ATOM 0 HB3 ALA A 83 4.920 4.816 -10.728 1.00 64.20 H new ATOM 1273 N ILE A 84 2.000 7.411 -10.790 1.00 34.23 N ATOM 1274 CA ILE A 84 1.297 8.048 -11.897 1.00 34.03 C ATOM 1275 C ILE A 84 2.210 8.207 -13.109 1.00 51.24 C ATOM 1276 O ILE A 84 1.743 8.254 -14.247 1.00 72.43 O ATOM 1277 CB ILE A 84 0.749 9.430 -11.494 1.00 72.04 C ATOM 1278 CG1 ILE A 84 1.831 10.250 -10.792 1.00 50.21 C ATOM 1279 CG2 ILE A 84 -0.468 9.275 -10.596 1.00 40.31 C ATOM 1280 CD1 ILE A 84 1.661 11.744 -10.959 1.00 61.03 C ATOM 0 H ILE A 84 2.033 7.967 -9.935 1.00 34.23 H new ATOM 0 HA ILE A 84 0.462 7.398 -12.158 1.00 34.03 H new ATOM 0 HB ILE A 84 0.447 9.960 -12.397 1.00 72.04 H new ATOM 0 HG12 ILE A 84 1.826 10.009 -9.729 1.00 50.21 H new ATOM 0 HG13 ILE A 84 2.806 9.958 -11.181 1.00 50.21 H new ATOM 0 HG21 ILE A 84 -0.844 10.260 -10.320 1.00 40.31 H new ATOM 0 HG22 ILE A 84 -1.245 8.726 -11.128 1.00 40.31 H new ATOM 0 HG23 ILE A 84 -0.189 8.728 -9.696 1.00 40.31 H new ATOM 0 HD11 ILE A 84 2.464 12.262 -10.435 1.00 61.03 H new ATOM 0 HD12 ILE A 84 1.696 11.998 -12.018 1.00 61.03 H new ATOM 0 HD13 ILE A 84 0.700 12.050 -10.544 1.00 61.03 H new ATOM 1292 N ASN A 85 3.513 8.289 -12.857 1.00 14.22 N ATOM 1293 CA ASN A 85 4.490 8.440 -13.928 1.00 23.03 C ATOM 1294 C ASN A 85 4.722 7.113 -14.644 1.00 41.22 C ATOM 1295 O ASN A 85 5.027 7.084 -15.837 1.00 74.13 O ATOM 1296 CB ASN A 85 5.811 8.972 -13.368 1.00 3.32 C ATOM 1297 CG ASN A 85 6.860 9.172 -14.445 1.00 2.42 C ATOM 1298 OD1 ASN A 85 7.919 8.544 -14.422 1.00 75.14 O ATOM 1299 ND2 ASN A 85 6.570 10.051 -15.397 1.00 33.33 N ATOM 0 H ASN A 85 3.916 8.253 -11.921 1.00 14.22 H new ATOM 0 HA ASN A 85 4.096 9.155 -14.650 1.00 23.03 H new ATOM 0 HB2 ASN A 85 5.631 9.920 -12.860 1.00 3.32 H new ATOM 0 HB3 ASN A 85 6.191 8.276 -12.620 1.00 3.32 H new ATOM 0 HD21 ASN A 85 7.237 10.228 -16.148 1.00 33.33 H new ATOM 0 HD22 ASN A 85 5.680 10.549 -15.377 1.00 33.33 H new ATOM 1306 N ASN A 86 4.575 6.015 -13.909 1.00 63.42 N ATOM 1307 CA ASN A 86 4.769 4.685 -14.475 1.00 25.12 C ATOM 1308 C ASN A 86 3.429 4.006 -14.743 1.00 44.14 C ATOM 1309 O ASN A 86 2.717 3.628 -13.813 1.00 44.32 O ATOM 1310 CB ASN A 86 5.613 3.825 -13.532 1.00 22.14 C ATOM 1311 CG ASN A 86 6.677 3.033 -14.268 1.00 62.52 C ATOM 1312 OD1 ASN A 86 7.181 3.464 -15.305 1.00 64.44 O ATOM 1313 ND2 ASN A 86 7.024 1.869 -13.733 1.00 40.01 N ATOM 0 H ASN A 86 4.322 6.020 -12.921 1.00 63.42 H new ATOM 0 HA ASN A 86 5.295 4.794 -15.423 1.00 25.12 H new ATOM 0 HB2 ASN A 86 6.089 4.465 -12.789 1.00 22.14 H new ATOM 0 HB3 ASN A 86 4.962 3.138 -12.991 1.00 22.14 H new ATOM 0 HD21 ASN A 86 7.735 1.293 -14.183 1.00 40.01 H new ATOM 0 HD22 ASN A 86 6.580 1.551 -12.872 1.00 40.01 H new ATOM 1320 N THR A 87 3.093 3.855 -16.020 1.00 64.23 N ATOM 1321 CA THR A 87 1.839 3.221 -16.411 1.00 33.31 C ATOM 1322 C THR A 87 1.863 1.723 -16.119 1.00 22.34 C ATOM 1323 O THR A 87 0.815 1.086 -16.015 1.00 12.14 O ATOM 1324 CB THR A 87 1.566 3.457 -17.897 1.00 42.22 C ATOM 1325 OG1 THR A 87 1.923 4.776 -18.270 1.00 50.43 O ATOM 1326 CG2 THR A 87 0.117 3.247 -18.281 1.00 22.14 C ATOM 0 H THR A 87 3.671 4.163 -16.802 1.00 64.23 H new ATOM 0 HA THR A 87 1.039 3.671 -15.823 1.00 33.31 H new ATOM 0 HB THR A 87 2.174 2.720 -18.422 1.00 42.22 H new ATOM 0 HG1 THR A 87 1.842 5.369 -17.494 1.00 50.43 H new ATOM 0 HG21 THR A 87 -0.007 3.431 -19.348 1.00 22.14 H new ATOM 0 HG22 THR A 87 -0.175 2.222 -18.053 1.00 22.14 H new ATOM 0 HG23 THR A 87 -0.512 3.937 -17.719 1.00 22.14 H new ATOM 1334 N LYS A 88 3.063 1.163 -15.986 1.00 65.40 N ATOM 1335 CA LYS A 88 3.218 -0.254 -15.707 1.00 42.32 C ATOM 1336 C LYS A 88 2.652 -0.597 -14.331 1.00 1.12 C ATOM 1337 O LYS A 88 1.915 -1.571 -14.177 1.00 12.40 O ATOM 1338 CB LYS A 88 4.697 -0.637 -15.792 1.00 41.14 C ATOM 1339 CG LYS A 88 5.008 -2.010 -15.223 1.00 21.35 C ATOM 1340 CD LYS A 88 5.832 -2.846 -16.191 1.00 13.30 C ATOM 1341 CE LYS A 88 7.275 -2.372 -16.247 1.00 4.23 C ATOM 1342 NZ LYS A 88 8.194 -3.446 -16.717 1.00 44.52 N ATOM 0 H LYS A 88 3.942 1.674 -16.068 1.00 65.40 H new ATOM 0 HA LYS A 88 2.661 -0.824 -16.451 1.00 42.32 H new ATOM 0 HB2 LYS A 88 5.011 -0.607 -16.835 1.00 41.14 H new ATOM 0 HB3 LYS A 88 5.287 0.109 -15.260 1.00 41.14 H new ATOM 0 HG2 LYS A 88 5.550 -1.901 -14.284 1.00 21.35 H new ATOM 0 HG3 LYS A 88 4.077 -2.529 -14.995 1.00 21.35 H new ATOM 0 HD2 LYS A 88 5.803 -3.892 -15.886 1.00 13.30 H new ATOM 0 HD3 LYS A 88 5.391 -2.792 -17.186 1.00 13.30 H new ATOM 0 HE2 LYS A 88 7.349 -1.513 -16.914 1.00 4.23 H new ATOM 0 HE3 LYS A 88 7.585 -2.036 -15.258 1.00 4.23 H new ATOM 0 HZ1 LYS A 88 9.168 -3.083 -16.741 1.00 44.52 H new ATOM 0 HZ2 LYS A 88 8.142 -4.256 -16.067 1.00 44.52 H new ATOM 0 HZ3 LYS A 88 7.914 -3.750 -17.671 1.00 44.52 H new ATOM 1356 N SER A 89 2.999 0.211 -13.334 1.00 33.11 N ATOM 1357 CA SER A 89 2.522 -0.006 -11.973 1.00 71.44 C ATOM 1358 C SER A 89 0.998 0.047 -11.920 1.00 21.05 C ATOM 1359 O SER A 89 0.371 -0.624 -11.100 1.00 35.31 O ATOM 1360 CB SER A 89 3.112 1.043 -11.030 1.00 64.50 C ATOM 1361 OG SER A 89 4.436 1.381 -11.406 1.00 74.35 O ATOM 0 H SER A 89 3.608 1.022 -13.443 1.00 33.11 H new ATOM 0 HA SER A 89 2.847 -0.996 -11.652 1.00 71.44 H new ATOM 0 HB2 SER A 89 2.489 1.937 -11.040 1.00 64.50 H new ATOM 0 HB3 SER A 89 3.107 0.662 -10.009 1.00 64.50 H new ATOM 0 HG SER A 89 5.054 0.695 -11.078 1.00 74.35 H new ATOM 1367 N PHE A 90 0.410 0.849 -12.802 1.00 24.12 N ATOM 1368 CA PHE A 90 -1.040 0.993 -12.862 1.00 23.34 C ATOM 1369 C PHE A 90 -1.706 -0.341 -13.192 1.00 60.31 C ATOM 1370 O PHE A 90 -2.605 -0.790 -12.482 1.00 2.31 O ATOM 1371 CB PHE A 90 -1.422 2.046 -13.907 1.00 15.14 C ATOM 1372 CG PHE A 90 -2.903 2.176 -14.127 1.00 31.13 C ATOM 1373 CD1 PHE A 90 -3.757 2.418 -13.063 1.00 33.33 C ATOM 1374 CD2 PHE A 90 -3.440 2.053 -15.399 1.00 64.11 C ATOM 1375 CE1 PHE A 90 -5.119 2.536 -13.263 1.00 51.00 C ATOM 1376 CE2 PHE A 90 -4.801 2.170 -15.605 1.00 24.54 C ATOM 1377 CZ PHE A 90 -5.642 2.412 -14.536 1.00 13.54 C ATOM 0 H PHE A 90 0.917 1.410 -13.486 1.00 24.12 H new ATOM 0 HA PHE A 90 -1.393 1.318 -11.883 1.00 23.34 H new ATOM 0 HB2 PHE A 90 -1.024 3.012 -13.597 1.00 15.14 H new ATOM 0 HB3 PHE A 90 -0.945 1.794 -14.854 1.00 15.14 H new ATOM 0 HD1 PHE A 90 -3.353 2.515 -12.066 1.00 33.33 H new ATOM 0 HD2 PHE A 90 -2.787 1.864 -16.238 1.00 64.11 H new ATOM 0 HE1 PHE A 90 -5.774 2.725 -12.425 1.00 51.00 H new ATOM 0 HE2 PHE A 90 -5.207 2.072 -16.601 1.00 24.54 H new ATOM 0 HZ PHE A 90 -6.706 2.504 -14.695 1.00 13.54 H new ATOM 1387 N GLU A 91 -1.258 -0.966 -14.276 1.00 65.22 N ATOM 1388 CA GLU A 91 -1.811 -2.247 -14.703 1.00 1.21 C ATOM 1389 C GLU A 91 -1.643 -3.307 -13.618 1.00 51.14 C ATOM 1390 O GLU A 91 -2.441 -4.239 -13.521 1.00 4.50 O ATOM 1391 CB GLU A 91 -1.135 -2.710 -15.995 1.00 64.11 C ATOM 1392 CG GLU A 91 -1.063 -1.632 -17.065 1.00 21.44 C ATOM 1393 CD GLU A 91 -1.376 -2.164 -18.450 1.00 44.55 C ATOM 1394 OE1 GLU A 91 -2.154 -3.135 -18.552 1.00 1.23 O ATOM 1395 OE2 GLU A 91 -0.841 -1.609 -19.433 1.00 35.44 O ATOM 0 H GLU A 91 -0.514 -0.607 -14.875 1.00 65.22 H new ATOM 0 HA GLU A 91 -2.877 -2.110 -14.885 1.00 1.21 H new ATOM 0 HB2 GLU A 91 -0.125 -3.050 -15.765 1.00 64.11 H new ATOM 0 HB3 GLU A 91 -1.678 -3.568 -16.392 1.00 64.11 H new ATOM 0 HG2 GLU A 91 -1.764 -0.834 -16.819 1.00 21.44 H new ATOM 0 HG3 GLU A 91 -0.066 -1.192 -17.066 1.00 21.44 H new ATOM 1402 N ASP A 92 -0.601 -3.160 -12.807 1.00 44.20 N ATOM 1403 CA ASP A 92 -0.330 -4.107 -11.731 1.00 34.54 C ATOM 1404 C ASP A 92 -1.404 -4.027 -10.650 1.00 44.11 C ATOM 1405 O ASP A 92 -1.721 -5.024 -10.002 1.00 71.41 O ATOM 1406 CB ASP A 92 1.049 -3.838 -11.123 1.00 34.13 C ATOM 1407 CG ASP A 92 2.020 -4.978 -11.365 1.00 44.00 C ATOM 1408 OD1 ASP A 92 1.573 -6.143 -11.392 1.00 43.20 O ATOM 1409 OD2 ASP A 92 3.228 -4.704 -11.527 1.00 70.42 O ATOM 0 H ASP A 92 0.070 -2.394 -12.874 1.00 44.20 H new ATOM 0 HA ASP A 92 -0.343 -5.112 -12.153 1.00 34.54 H new ATOM 0 HB2 ASP A 92 1.457 -2.920 -11.547 1.00 34.13 H new ATOM 0 HB3 ASP A 92 0.945 -3.675 -10.050 1.00 34.13 H new ATOM 1414 N ILE A 93 -1.963 -2.836 -10.460 1.00 11.41 N ATOM 1415 CA ILE A 93 -3.002 -2.635 -9.457 1.00 10.43 C ATOM 1416 C ILE A 93 -4.227 -3.493 -9.762 1.00 71.10 C ATOM 1417 O ILE A 93 -4.963 -3.886 -8.857 1.00 45.03 O ATOM 1418 CB ILE A 93 -3.426 -1.152 -9.375 1.00 70.34 C ATOM 1419 CG1 ILE A 93 -2.223 -0.260 -9.085 1.00 74.41 C ATOM 1420 CG2 ILE A 93 -4.483 -0.953 -8.305 1.00 62.13 C ATOM 1421 CD1 ILE A 93 -1.383 -0.728 -7.915 1.00 53.15 C ATOM 0 H ILE A 93 -1.715 -1.998 -10.986 1.00 11.41 H new ATOM 0 HA ILE A 93 -2.583 -2.934 -8.497 1.00 10.43 H new ATOM 0 HB ILE A 93 -3.846 -0.872 -10.341 1.00 70.34 H new ATOM 0 HG12 ILE A 93 -1.595 -0.212 -9.975 1.00 74.41 H new ATOM 0 HG13 ILE A 93 -2.573 0.753 -8.887 1.00 74.41 H new ATOM 0 HG21 ILE A 93 -4.767 0.099 -8.265 1.00 62.13 H new ATOM 0 HG22 ILE A 93 -5.359 -1.556 -8.542 1.00 62.13 H new ATOM 0 HG23 ILE A 93 -4.084 -1.258 -7.338 1.00 62.13 H new ATOM 0 HD11 ILE A 93 -0.547 -0.044 -7.771 1.00 53.15 H new ATOM 0 HD12 ILE A 93 -1.995 -0.749 -7.013 1.00 53.15 H new ATOM 0 HD13 ILE A 93 -1.002 -1.729 -8.118 1.00 53.15 H new ATOM 1433 N HIS A 94 -4.437 -3.782 -11.043 1.00 71.43 N ATOM 1434 CA HIS A 94 -5.570 -4.596 -11.466 1.00 33.11 C ATOM 1435 C HIS A 94 -5.341 -6.065 -11.122 1.00 24.21 C ATOM 1436 O HIS A 94 -6.157 -6.688 -10.444 1.00 4.23 O ATOM 1437 CB HIS A 94 -5.801 -4.437 -12.972 1.00 21.34 C ATOM 1438 CG HIS A 94 -6.871 -5.332 -13.517 1.00 25.45 C ATOM 1439 ND1 HIS A 94 -8.218 -5.094 -13.337 1.00 24.31 N ATOM 1440 CD2 HIS A 94 -6.787 -6.473 -14.242 1.00 50.45 C ATOM 1441 CE1 HIS A 94 -8.915 -6.049 -13.926 1.00 43.54 C ATOM 1442 NE2 HIS A 94 -8.070 -6.897 -14.483 1.00 34.24 N ATOM 0 H HIS A 94 -3.838 -3.465 -11.805 1.00 71.43 H new ATOM 0 HA HIS A 94 -6.456 -4.253 -10.932 1.00 33.11 H new ATOM 0 HB2 HIS A 94 -6.065 -3.401 -13.182 1.00 21.34 H new ATOM 0 HB3 HIS A 94 -4.868 -4.641 -13.497 1.00 21.34 H new ATOM 0 HD1 HIS A 94 -8.614 -4.304 -12.828 1.00 24.31 H new ATOM 0 HD2 HIS A 94 -5.880 -6.959 -14.569 1.00 50.45 H new ATOM 0 HE1 HIS A 94 -9.992 -6.123 -13.948 1.00 43.54 H new ATOM 1451 N GLN A 95 -4.225 -6.612 -11.594 1.00 44.01 N ATOM 1452 CA GLN A 95 -3.891 -8.008 -11.335 1.00 1.03 C ATOM 1453 C GLN A 95 -3.607 -8.236 -9.853 1.00 13.40 C ATOM 1454 O GLN A 95 -3.820 -9.331 -9.332 1.00 31.15 O ATOM 1455 CB GLN A 95 -2.683 -8.433 -12.174 1.00 13.21 C ATOM 1456 CG GLN A 95 -1.478 -7.520 -12.019 1.00 4.21 C ATOM 1457 CD GLN A 95 -0.367 -8.151 -11.203 1.00 34.23 C ATOM 1458 OE1 GLN A 95 0.352 -9.026 -11.685 1.00 12.55 O ATOM 1459 NE2 GLN A 95 -0.223 -7.710 -9.960 1.00 33.54 N ATOM 0 H GLN A 95 -3.538 -6.111 -12.157 1.00 44.01 H new ATOM 0 HA GLN A 95 -4.749 -8.618 -11.617 1.00 1.03 H new ATOM 0 HB2 GLN A 95 -2.397 -9.447 -11.895 1.00 13.21 H new ATOM 0 HB3 GLN A 95 -2.973 -8.461 -13.224 1.00 13.21 H new ATOM 0 HG2 GLN A 95 -1.095 -7.259 -13.006 1.00 4.21 H new ATOM 0 HG3 GLN A 95 -1.790 -6.591 -11.543 1.00 4.21 H new ATOM 0 HE21 GLN A 95 -0.842 -6.983 -9.602 1.00 33.54 H new ATOM 0 HE22 GLN A 95 0.507 -8.098 -9.362 1.00 33.54 H new ATOM 1468 N TYR A 96 -3.127 -7.196 -9.177 1.00 30.44 N ATOM 1469 CA TYR A 96 -2.820 -7.286 -7.754 1.00 44.21 C ATOM 1470 C TYR A 96 -4.087 -7.524 -6.940 1.00 3.54 C ATOM 1471 O TYR A 96 -4.125 -8.390 -6.067 1.00 43.05 O ATOM 1472 CB TYR A 96 -2.130 -6.007 -7.277 1.00 53.42 C ATOM 1473 CG TYR A 96 -0.621 -6.067 -7.351 1.00 32.32 C ATOM 1474 CD1 TYR A 96 0.077 -7.145 -6.821 1.00 64.30 C ATOM 1475 CD2 TYR A 96 0.104 -5.046 -7.950 1.00 21.25 C ATOM 1476 CE1 TYR A 96 1.456 -7.204 -6.887 1.00 24.32 C ATOM 1477 CE2 TYR A 96 1.483 -5.097 -8.020 1.00 51.42 C ATOM 1478 CZ TYR A 96 2.154 -6.177 -7.488 1.00 65.32 C ATOM 1479 OH TYR A 96 3.527 -6.232 -7.556 1.00 61.52 O ATOM 0 H TYR A 96 -2.943 -6.282 -9.592 1.00 30.44 H new ATOM 0 HA TYR A 96 -2.148 -8.131 -7.606 1.00 44.21 H new ATOM 0 HB2 TYR A 96 -2.481 -5.169 -7.879 1.00 53.42 H new ATOM 0 HB3 TYR A 96 -2.427 -5.807 -6.247 1.00 53.42 H new ATOM 0 HD1 TYR A 96 -0.467 -7.950 -6.350 1.00 64.30 H new ATOM 0 HD2 TYR A 96 -0.418 -4.198 -8.368 1.00 21.25 H new ATOM 0 HE1 TYR A 96 1.984 -8.049 -6.471 1.00 24.32 H new ATOM 0 HE2 TYR A 96 2.032 -4.294 -8.489 1.00 51.42 H new ATOM 0 HH TYR A 96 3.816 -6.057 -8.476 1.00 61.52 H new ATOM 1489 N ARG A 97 -5.123 -6.746 -7.236 1.00 60.32 N ATOM 1490 CA ARG A 97 -6.398 -6.864 -6.537 1.00 52.45 C ATOM 1491 C ARG A 97 -6.944 -8.288 -6.633 1.00 55.44 C ATOM 1492 O ARG A 97 -7.535 -8.801 -5.683 1.00 72.23 O ATOM 1493 CB ARG A 97 -7.406 -5.866 -7.117 1.00 53.34 C ATOM 1494 CG ARG A 97 -8.844 -6.113 -6.684 1.00 35.34 C ATOM 1495 CD ARG A 97 -9.620 -6.871 -7.749 1.00 50.34 C ATOM 1496 NE ARG A 97 -11.004 -6.414 -7.848 1.00 33.35 N ATOM 1497 CZ ARG A 97 -11.893 -6.922 -8.698 1.00 52.23 C ATOM 1498 NH1 ARG A 97 -11.548 -7.905 -9.522 1.00 74.45 N ATOM 1499 NH2 ARG A 97 -13.131 -6.449 -8.725 1.00 31.45 N ATOM 0 H ARG A 97 -5.104 -6.025 -7.957 1.00 60.32 H new ATOM 0 HA ARG A 97 -6.237 -6.635 -5.484 1.00 52.45 H new ATOM 0 HB2 ARG A 97 -7.116 -4.858 -6.819 1.00 53.34 H new ATOM 0 HB3 ARG A 97 -7.354 -5.904 -8.205 1.00 53.34 H new ATOM 0 HG2 ARG A 97 -8.853 -6.679 -5.753 1.00 35.34 H new ATOM 0 HG3 ARG A 97 -9.334 -5.160 -6.483 1.00 35.34 H new ATOM 0 HD2 ARG A 97 -9.128 -6.747 -8.713 1.00 50.34 H new ATOM 0 HD3 ARG A 97 -9.606 -7.936 -7.519 1.00 50.34 H new ATOM 0 HE ARG A 97 -11.307 -5.662 -7.229 1.00 33.35 H new ATOM 0 HH11 ARG A 97 -10.597 -8.274 -9.505 1.00 74.45 H new ATOM 0 HH12 ARG A 97 -12.234 -8.290 -10.171 1.00 74.45 H new ATOM 0 HH21 ARG A 97 -13.403 -5.695 -8.094 1.00 31.45 H new ATOM 0 HH22 ARG A 97 -13.812 -6.839 -9.377 1.00 31.45 H new ATOM 1513 N GLU A 98 -6.743 -8.918 -7.785 1.00 64.41 N ATOM 1514 CA GLU A 98 -7.217 -10.280 -8.003 1.00 54.31 C ATOM 1515 C GLU A 98 -6.519 -11.258 -7.064 1.00 71.03 C ATOM 1516 O GLU A 98 -7.125 -12.219 -6.590 1.00 2.43 O ATOM 1517 CB GLU A 98 -6.984 -10.697 -9.457 1.00 34.32 C ATOM 1518 CG GLU A 98 -7.867 -9.959 -10.450 1.00 34.42 C ATOM 1519 CD GLU A 98 -8.931 -10.850 -11.060 1.00 25.11 C ATOM 1520 OE1 GLU A 98 -9.395 -11.780 -10.367 1.00 52.12 O ATOM 1521 OE2 GLU A 98 -9.301 -10.618 -12.230 1.00 21.40 O ATOM 0 H GLU A 98 -6.256 -8.508 -8.582 1.00 64.41 H new ATOM 0 HA GLU A 98 -8.286 -10.303 -7.792 1.00 54.31 H new ATOM 0 HB2 GLU A 98 -5.939 -10.523 -9.713 1.00 34.32 H new ATOM 0 HB3 GLU A 98 -7.161 -11.768 -9.552 1.00 34.32 H new ATOM 0 HG2 GLU A 98 -8.346 -9.118 -9.949 1.00 34.42 H new ATOM 0 HG3 GLU A 98 -7.246 -9.545 -11.244 1.00 34.42 H new ATOM 1528 N GLN A 99 -5.240 -11.009 -6.799 1.00 72.34 N ATOM 1529 CA GLN A 99 -4.460 -11.869 -5.917 1.00 24.31 C ATOM 1530 C GLN A 99 -5.044 -11.880 -4.507 1.00 42.10 C ATOM 1531 O GLN A 99 -4.979 -12.890 -3.806 1.00 10.53 O ATOM 1532 CB GLN A 99 -3.001 -11.405 -5.878 1.00 34.53 C ATOM 1533 CG GLN A 99 -2.015 -12.460 -6.349 1.00 63.31 C ATOM 1534 CD GLN A 99 -0.768 -12.520 -5.489 1.00 61.42 C ATOM 1535 OE1 GLN A 99 -0.535 -11.647 -4.652 1.00 34.04 O ATOM 1536 NE2 GLN A 99 0.041 -13.553 -5.691 1.00 3.23 N ATOM 0 H GLN A 99 -4.722 -10.218 -7.183 1.00 72.34 H new ATOM 0 HA GLN A 99 -4.500 -12.884 -6.312 1.00 24.31 H new ATOM 0 HB2 GLN A 99 -2.894 -10.516 -6.500 1.00 34.53 H new ATOM 0 HB3 GLN A 99 -2.748 -11.113 -4.859 1.00 34.53 H new ATOM 0 HG2 GLN A 99 -2.502 -13.435 -6.344 1.00 63.31 H new ATOM 0 HG3 GLN A 99 -1.731 -12.251 -7.380 1.00 63.31 H new ATOM 0 HE21 GLN A 99 -0.192 -14.253 -6.395 1.00 3.23 H new ATOM 0 HE22 GLN A 99 0.895 -13.647 -5.142 1.00 3.23 H new ATOM 1545 N ILE A 100 -5.613 -10.751 -4.098 1.00 43.10 N ATOM 1546 CA ILE A 100 -6.207 -10.632 -2.771 1.00 3.32 C ATOM 1547 C ILE A 100 -7.534 -11.383 -2.693 1.00 63.10 C ATOM 1548 O ILE A 100 -7.797 -12.094 -1.724 1.00 1.44 O ATOM 1549 CB ILE A 100 -6.428 -9.154 -2.387 1.00 11.40 C ATOM 1550 CG1 ILE A 100 -5.099 -8.397 -2.417 1.00 52.14 C ATOM 1551 CG2 ILE A 100 -7.072 -9.047 -1.010 1.00 21.23 C ATOM 1552 CD1 ILE A 100 -5.254 -6.906 -2.621 1.00 52.24 C ATOM 0 H ILE A 100 -5.675 -9.906 -4.666 1.00 43.10 H new ATOM 0 HA ILE A 100 -5.506 -11.077 -2.065 1.00 3.32 H new ATOM 0 HB ILE A 100 -7.103 -8.704 -3.115 1.00 11.40 H new ATOM 0 HG12 ILE A 100 -4.569 -8.574 -1.481 1.00 52.14 H new ATOM 0 HG13 ILE A 100 -4.478 -8.802 -3.216 1.00 52.14 H new ATOM 0 HG21 ILE A 100 -7.219 -7.997 -0.758 1.00 21.23 H new ATOM 0 HG22 ILE A 100 -8.035 -9.557 -1.018 1.00 21.23 H new ATOM 0 HG23 ILE A 100 -6.422 -9.511 -0.268 1.00 21.23 H new ATOM 0 HD11 ILE A 100 -4.271 -6.436 -2.631 1.00 52.24 H new ATOM 0 HD12 ILE A 100 -5.756 -6.719 -3.570 1.00 52.24 H new ATOM 0 HD13 ILE A 100 -5.848 -6.487 -1.808 1.00 52.24 H new ATOM 1564 N LYS A 101 -8.367 -11.222 -3.718 1.00 64.23 N ATOM 1565 CA LYS A 101 -9.666 -11.888 -3.759 1.00 63.33 C ATOM 1566 C LYS A 101 -9.516 -13.392 -3.546 1.00 75.44 C ATOM 1567 O LYS A 101 -10.304 -14.009 -2.831 1.00 43.42 O ATOM 1568 CB LYS A 101 -10.360 -11.613 -5.095 1.00 11.44 C ATOM 1569 CG LYS A 101 -11.457 -10.563 -5.004 1.00 32.13 C ATOM 1570 CD LYS A 101 -10.956 -9.286 -4.346 1.00 23.53 C ATOM 1571 CE LYS A 101 -11.408 -8.052 -5.108 1.00 45.31 C ATOM 1572 NZ LYS A 101 -10.922 -6.797 -4.472 1.00 34.12 N ATOM 0 H LYS A 101 -8.166 -10.638 -4.530 1.00 64.23 H new ATOM 0 HA LYS A 101 -10.278 -11.487 -2.951 1.00 63.33 H new ATOM 0 HB2 LYS A 101 -9.616 -11.287 -5.822 1.00 11.44 H new ATOM 0 HB3 LYS A 101 -10.788 -12.542 -5.471 1.00 11.44 H new ATOM 0 HG2 LYS A 101 -11.829 -10.337 -6.003 1.00 32.13 H new ATOM 0 HG3 LYS A 101 -12.297 -10.961 -4.434 1.00 32.13 H new ATOM 0 HD2 LYS A 101 -11.322 -9.236 -3.321 1.00 23.53 H new ATOM 0 HD3 LYS A 101 -9.867 -9.305 -4.295 1.00 23.53 H new ATOM 0 HE2 LYS A 101 -11.042 -8.104 -6.133 1.00 45.31 H new ATOM 0 HE3 LYS A 101 -12.497 -8.035 -5.159 1.00 45.31 H new ATOM 0 HZ1 LYS A 101 -11.058 -6.001 -5.127 1.00 34.12 H new ATOM 0 HZ2 LYS A 101 -11.457 -6.621 -3.598 1.00 34.12 H new ATOM 0 HZ3 LYS A 101 -9.911 -6.891 -4.246 1.00 34.12 H new ATOM 1586 N ARG A 102 -8.497 -13.975 -4.170 1.00 60.14 N ATOM 1587 CA ARG A 102 -8.243 -15.403 -4.046 1.00 44.40 C ATOM 1588 C ARG A 102 -7.947 -15.777 -2.597 1.00 61.25 C ATOM 1589 O ARG A 102 -8.644 -16.599 -2.002 1.00 1.04 O ATOM 1590 CB ARG A 102 -7.072 -15.807 -4.943 1.00 33.10 C ATOM 1591 CG ARG A 102 -7.366 -17.019 -5.808 1.00 65.54 C ATOM 1592 CD ARG A 102 -6.510 -17.029 -7.064 1.00 63.52 C ATOM 1593 NE ARG A 102 -6.096 -18.380 -7.434 1.00 51.43 N ATOM 1594 CZ ARG A 102 -6.927 -19.307 -7.907 1.00 22.02 C ATOM 1595 NH1 ARG A 102 -8.216 -19.032 -8.069 1.00 22.34 N ATOM 1596 NH2 ARG A 102 -6.469 -20.511 -8.219 1.00 31.22 N ATOM 0 H ARG A 102 -7.835 -13.479 -4.766 1.00 60.14 H new ATOM 0 HA ARG A 102 -9.137 -15.940 -4.363 1.00 44.40 H new ATOM 0 HB2 ARG A 102 -6.809 -14.967 -5.585 1.00 33.10 H new ATOM 0 HB3 ARG A 102 -6.202 -16.017 -4.320 1.00 33.10 H new ATOM 0 HG2 ARG A 102 -7.184 -17.928 -5.235 1.00 65.54 H new ATOM 0 HG3 ARG A 102 -8.420 -17.022 -6.085 1.00 65.54 H new ATOM 0 HD2 ARG A 102 -7.069 -16.583 -7.887 1.00 63.52 H new ATOM 0 HD3 ARG A 102 -5.627 -16.410 -6.906 1.00 63.52 H new ATOM 0 HE ARG A 102 -5.113 -18.628 -7.324 1.00 51.43 H new ATOM 0 HH11 ARG A 102 -8.574 -18.107 -7.831 1.00 22.34 H new ATOM 0 HH12 ARG A 102 -8.848 -19.746 -8.432 1.00 22.34 H new ATOM 0 HH21 ARG A 102 -5.480 -20.728 -8.097 1.00 31.22 H new ATOM 0 HH22 ARG A 102 -7.106 -21.221 -8.581 1.00 31.22 H new ATOM 1610 N VAL A 103 -6.908 -15.167 -2.036 1.00 70.50 N ATOM 1611 CA VAL A 103 -6.516 -15.429 -0.658 1.00 14.14 C ATOM 1612 C VAL A 103 -7.670 -15.162 0.300 1.00 52.54 C ATOM 1613 O VAL A 103 -8.178 -16.073 0.954 1.00 64.42 O ATOM 1614 CB VAL A 103 -5.322 -14.547 -0.251 1.00 72.44 C ATOM 1615 CG1 VAL A 103 -4.893 -14.837 1.179 1.00 5.14 C ATOM 1616 CG2 VAL A 103 -4.165 -14.742 -1.217 1.00 31.11 C ATOM 0 H VAL A 103 -6.321 -14.486 -2.517 1.00 70.50 H new ATOM 0 HA VAL A 103 -6.232 -16.480 -0.598 1.00 14.14 H new ATOM 0 HB VAL A 103 -5.635 -13.504 -0.298 1.00 72.44 H new ATOM 0 HG11 VAL A 103 -4.048 -14.201 1.441 1.00 5.14 H new ATOM 0 HG12 VAL A 103 -5.723 -14.635 1.856 1.00 5.14 H new ATOM 0 HG13 VAL A 103 -4.600 -15.883 1.266 1.00 5.14 H new ATOM 0 HG21 VAL A 103 -3.329 -14.111 -0.915 1.00 31.11 H new ATOM 0 HG22 VAL A 103 -3.854 -15.787 -1.206 1.00 31.11 H new ATOM 0 HG23 VAL A 103 -4.481 -14.468 -2.224 1.00 31.11 H new ATOM 1626 N LYS A 104 -8.074 -13.901 0.373 1.00 54.34 N ATOM 1627 CA LYS A 104 -9.168 -13.493 1.248 1.00 33.13 C ATOM 1628 C LYS A 104 -10.454 -14.236 0.896 1.00 3.24 C ATOM 1629 O LYS A 104 -11.333 -14.407 1.741 1.00 2.32 O ATOM 1630 CB LYS A 104 -9.396 -11.983 1.145 1.00 53.22 C ATOM 1631 CG LYS A 104 -8.152 -11.156 1.427 1.00 5.22 C ATOM 1632 CD LYS A 104 -7.738 -11.252 2.887 1.00 35.21 C ATOM 1633 CE LYS A 104 -8.271 -10.080 3.697 1.00 34.54 C ATOM 1634 NZ LYS A 104 -8.948 -10.529 4.944 1.00 71.24 N ATOM 0 H LYS A 104 -7.660 -13.140 -0.165 1.00 54.34 H new ATOM 0 HA LYS A 104 -8.892 -13.744 2.272 1.00 33.13 H new ATOM 0 HB2 LYS A 104 -9.759 -11.747 0.145 1.00 53.22 H new ATOM 0 HB3 LYS A 104 -10.180 -11.694 1.845 1.00 53.22 H new ATOM 0 HG2 LYS A 104 -7.335 -11.499 0.793 1.00 5.22 H new ATOM 0 HG3 LYS A 104 -8.340 -10.114 1.169 1.00 5.22 H new ATOM 0 HD2 LYS A 104 -8.108 -12.186 3.310 1.00 35.21 H new ATOM 0 HD3 LYS A 104 -6.651 -11.279 2.957 1.00 35.21 H new ATOM 0 HE2 LYS A 104 -7.449 -9.411 3.951 1.00 34.54 H new ATOM 0 HE3 LYS A 104 -8.972 -9.508 3.089 1.00 34.54 H new ATOM 0 HZ1 LYS A 104 -9.297 -9.701 5.467 1.00 71.24 H new ATOM 0 HZ2 LYS A 104 -9.748 -11.147 4.701 1.00 71.24 H new ATOM 0 HZ3 LYS A 104 -8.273 -11.053 5.536 1.00 71.24 H new ATOM 1648 N ASP A 105 -10.558 -14.676 -0.354 1.00 5.21 N ATOM 1649 CA ASP A 105 -11.737 -15.400 -0.813 1.00 3.44 C ATOM 1650 C ASP A 105 -12.986 -14.531 -0.704 1.00 62.34 C ATOM 1651 O ASP A 105 -14.029 -14.978 -0.225 1.00 21.14 O ATOM 1652 CB ASP A 105 -11.918 -16.684 -0.001 1.00 33.00 C ATOM 1653 CG ASP A 105 -12.917 -17.633 -0.633 1.00 61.43 C ATOM 1654 OD1 ASP A 105 -13.109 -17.559 -1.865 1.00 4.35 O ATOM 1655 OD2 ASP A 105 -13.507 -18.451 0.104 1.00 42.25 O ATOM 0 H ASP A 105 -9.840 -14.544 -1.066 1.00 5.21 H new ATOM 0 HA ASP A 105 -11.590 -15.660 -1.861 1.00 3.44 H new ATOM 0 HB2 ASP A 105 -10.956 -17.187 0.097 1.00 33.00 H new ATOM 0 HB3 ASP A 105 -12.249 -16.430 1.006 1.00 33.00 H new ATOM 1660 N SER A 106 -12.873 -13.285 -1.153 1.00 52.41 N ATOM 1661 CA SER A 106 -13.992 -12.351 -1.108 1.00 54.04 C ATOM 1662 C SER A 106 -13.704 -11.118 -1.958 1.00 70.12 C ATOM 1663 O SER A 106 -12.561 -10.672 -2.056 1.00 22.31 O ATOM 1664 CB SER A 106 -14.277 -11.934 0.336 1.00 71.11 C ATOM 1665 OG SER A 106 -15.195 -10.855 0.384 1.00 55.11 O ATOM 0 H SER A 106 -12.017 -12.899 -1.552 1.00 52.41 H new ATOM 0 HA SER A 106 -14.870 -12.854 -1.514 1.00 54.04 H new ATOM 0 HB2 SER A 106 -14.679 -12.782 0.890 1.00 71.11 H new ATOM 0 HB3 SER A 106 -13.346 -11.646 0.825 1.00 71.11 H new ATOM 0 HG SER A 106 -15.362 -10.609 1.318 1.00 55.11 H new ATOM 1671 N ASP A 107 -14.748 -10.571 -2.571 1.00 75.25 N ATOM 1672 CA ASP A 107 -14.607 -9.389 -3.414 1.00 74.52 C ATOM 1673 C ASP A 107 -14.572 -8.119 -2.571 1.00 31.34 C ATOM 1674 O ASP A 107 -13.895 -7.150 -2.917 1.00 25.13 O ATOM 1675 CB ASP A 107 -15.756 -9.314 -4.421 1.00 12.41 C ATOM 1676 CG ASP A 107 -17.109 -9.196 -3.747 1.00 21.24 C ATOM 1677 OD1 ASP A 107 -17.483 -10.125 -3.001 1.00 24.23 O ATOM 1678 OD2 ASP A 107 -17.793 -8.174 -3.964 1.00 21.02 O ATOM 0 H ASP A 107 -15.701 -10.927 -2.500 1.00 75.25 H new ATOM 0 HA ASP A 107 -13.664 -9.471 -3.954 1.00 74.52 H new ATOM 0 HB2 ASP A 107 -15.604 -8.457 -5.078 1.00 12.41 H new ATOM 0 HB3 ASP A 107 -15.743 -10.204 -5.050 1.00 12.41 H new ATOM 1683 N ASP A 108 -15.307 -8.129 -1.464 1.00 31.41 N ATOM 1684 CA ASP A 108 -15.360 -6.976 -0.572 1.00 42.32 C ATOM 1685 C ASP A 108 -14.345 -7.112 0.558 1.00 64.50 C ATOM 1686 O ASP A 108 -14.673 -7.582 1.648 1.00 11.55 O ATOM 1687 CB ASP A 108 -16.767 -6.818 0.008 1.00 44.23 C ATOM 1688 CG ASP A 108 -17.293 -8.108 0.607 1.00 12.41 C ATOM 1689 OD1 ASP A 108 -17.662 -9.015 -0.168 1.00 72.32 O ATOM 1690 OD2 ASP A 108 -17.337 -8.210 1.851 1.00 31.13 O ATOM 0 H ASP A 108 -15.874 -8.922 -1.163 1.00 31.41 H new ATOM 0 HA ASP A 108 -15.111 -6.088 -1.154 1.00 42.32 H new ATOM 0 HB2 ASP A 108 -16.756 -6.043 0.774 1.00 44.23 H new ATOM 0 HB3 ASP A 108 -17.445 -6.482 -0.777 1.00 44.23 H new ATOM 1695 N VAL A 109 -13.110 -6.696 0.293 1.00 52.11 N ATOM 1696 CA VAL A 109 -12.049 -6.770 1.290 1.00 32.32 C ATOM 1697 C VAL A 109 -11.502 -5.380 1.612 1.00 5.24 C ATOM 1698 O VAL A 109 -11.569 -4.471 0.786 1.00 14.01 O ATOM 1699 CB VAL A 109 -10.892 -7.673 0.817 1.00 11.33 C ATOM 1700 CG1 VAL A 109 -11.392 -9.082 0.544 1.00 24.22 C ATOM 1701 CG2 VAL A 109 -10.223 -7.089 -0.418 1.00 1.40 C ATOM 0 H VAL A 109 -12.820 -6.305 -0.603 1.00 52.11 H new ATOM 0 HA VAL A 109 -12.488 -7.202 2.189 1.00 32.32 H new ATOM 0 HB VAL A 109 -10.149 -7.722 1.613 1.00 11.33 H new ATOM 0 HG11 VAL A 109 -10.562 -9.705 0.211 1.00 24.22 H new ATOM 0 HG12 VAL A 109 -11.817 -9.501 1.456 1.00 24.22 H new ATOM 0 HG13 VAL A 109 -12.157 -9.053 -0.232 1.00 24.22 H new ATOM 0 HG21 VAL A 109 -9.410 -7.742 -0.734 1.00 1.40 H new ATOM 0 HG22 VAL A 109 -10.954 -7.004 -1.222 1.00 1.40 H new ATOM 0 HG23 VAL A 109 -9.825 -6.102 -0.184 1.00 1.40 H new ATOM 1711 N PRO A 110 -10.954 -5.199 2.825 1.00 65.11 N ATOM 1712 CA PRO A 110 -10.396 -3.913 3.255 1.00 74.32 C ATOM 1713 C PRO A 110 -9.080 -3.586 2.558 1.00 23.11 C ATOM 1714 O PRO A 110 -8.053 -4.209 2.825 1.00 14.23 O ATOM 1715 CB PRO A 110 -10.172 -4.111 4.755 1.00 30.43 C ATOM 1716 CG PRO A 110 -9.968 -5.577 4.913 1.00 54.12 C ATOM 1717 CD PRO A 110 -10.836 -6.231 3.872 1.00 51.24 C ATOM 0 HA PRO A 110 -11.057 -3.081 3.013 1.00 74.32 H new ATOM 0 HB2 PRO A 110 -9.305 -3.550 5.104 1.00 30.43 H new ATOM 0 HB3 PRO A 110 -11.029 -3.765 5.333 1.00 30.43 H new ATOM 0 HG2 PRO A 110 -8.921 -5.843 4.771 1.00 54.12 H new ATOM 0 HG3 PRO A 110 -10.247 -5.904 5.915 1.00 54.12 H new ATOM 0 HD2 PRO A 110 -10.382 -7.144 3.487 1.00 51.24 H new ATOM 0 HD3 PRO A 110 -11.810 -6.506 4.276 1.00 51.24 H new ATOM 1725 N MET A 111 -9.119 -2.604 1.663 1.00 2.14 N ATOM 1726 CA MET A 111 -7.929 -2.191 0.927 1.00 14.34 C ATOM 1727 C MET A 111 -8.065 -0.753 0.436 1.00 13.23 C ATOM 1728 O MET A 111 -9.146 -0.168 0.492 1.00 54.32 O ATOM 1729 CB MET A 111 -7.686 -3.127 -0.259 1.00 31.24 C ATOM 1730 CG MET A 111 -8.874 -3.241 -1.198 1.00 71.20 C ATOM 1731 SD MET A 111 -8.418 -3.881 -2.819 1.00 62.34 S ATOM 1732 CE MET A 111 -8.215 -5.618 -2.440 1.00 14.31 C ATOM 0 H MET A 111 -9.962 -2.079 1.430 1.00 2.14 H new ATOM 0 HA MET A 111 -7.076 -2.246 1.604 1.00 14.34 H new ATOM 0 HB2 MET A 111 -6.823 -2.771 -0.821 1.00 31.24 H new ATOM 0 HB3 MET A 111 -7.435 -4.119 0.117 1.00 31.24 H new ATOM 0 HG2 MET A 111 -9.624 -3.894 -0.752 1.00 71.20 H new ATOM 0 HG3 MET A 111 -9.335 -2.260 -1.315 1.00 71.20 H new ATOM 0 HE1 MET A 111 -7.507 -6.063 -3.139 1.00 14.31 H new ATOM 0 HE2 MET A 111 -7.838 -5.727 -1.423 1.00 14.31 H new ATOM 0 HE3 MET A 111 -9.177 -6.124 -2.526 1.00 14.31 H new ATOM 1742 N VAL A 112 -6.960 -0.187 -0.039 1.00 74.21 N ATOM 1743 CA VAL A 112 -6.956 1.184 -0.534 1.00 14.52 C ATOM 1744 C VAL A 112 -5.993 1.348 -1.706 1.00 73.21 C ATOM 1745 O VAL A 112 -5.021 0.603 -1.833 1.00 11.10 O ATOM 1746 CB VAL A 112 -6.565 2.174 0.578 1.00 2.35 C ATOM 1747 CG1 VAL A 112 -6.741 3.608 0.105 1.00 31.31 C ATOM 1748 CG2 VAL A 112 -7.383 1.913 1.834 1.00 62.25 C ATOM 0 H VAL A 112 -6.056 -0.657 -0.091 1.00 74.21 H new ATOM 0 HA VAL A 112 -7.969 1.402 -0.871 1.00 14.52 H new ATOM 0 HB VAL A 112 -5.513 2.025 0.819 1.00 2.35 H new ATOM 0 HG11 VAL A 112 -6.459 4.292 0.905 1.00 31.31 H new ATOM 0 HG12 VAL A 112 -6.107 3.785 -0.764 1.00 31.31 H new ATOM 0 HG13 VAL A 112 -7.783 3.776 -0.166 1.00 31.31 H new ATOM 0 HG21 VAL A 112 -7.094 2.622 2.610 1.00 62.25 H new ATOM 0 HG22 VAL A 112 -8.443 2.033 1.609 1.00 62.25 H new ATOM 0 HG23 VAL A 112 -7.199 0.897 2.183 1.00 62.25 H new ATOM 1758 N LEU A 113 -6.271 2.328 -2.562 1.00 42.40 N ATOM 1759 CA LEU A 113 -5.432 2.593 -3.723 1.00 44.43 C ATOM 1760 C LEU A 113 -4.782 3.969 -3.622 1.00 50.23 C ATOM 1761 O LEU A 113 -5.468 4.991 -3.612 1.00 42.20 O ATOM 1762 CB LEU A 113 -6.259 2.501 -5.007 1.00 34.20 C ATOM 1763 CG LEU A 113 -5.495 2.810 -6.297 1.00 12.02 C ATOM 1764 CD1 LEU A 113 -4.125 2.150 -6.278 1.00 33.42 C ATOM 1765 CD2 LEU A 113 -6.291 2.352 -7.510 1.00 52.41 C ATOM 0 H LEU A 113 -7.073 2.952 -2.471 1.00 42.40 H new ATOM 0 HA LEU A 113 -4.645 1.840 -3.750 1.00 44.43 H new ATOM 0 HB2 LEU A 113 -6.675 1.496 -5.081 1.00 34.20 H new ATOM 0 HB3 LEU A 113 -7.101 3.189 -4.928 1.00 34.20 H new ATOM 0 HG LEU A 113 -5.355 3.889 -6.364 1.00 12.02 H new ATOM 0 HD11 LEU A 113 -3.597 2.381 -7.203 1.00 33.42 H new ATOM 0 HD12 LEU A 113 -3.552 2.525 -5.430 1.00 33.42 H new ATOM 0 HD13 LEU A 113 -4.243 1.070 -6.187 1.00 33.42 H new ATOM 0 HD21 LEU A 113 -5.733 2.579 -8.418 1.00 52.41 H new ATOM 0 HD22 LEU A 113 -6.462 1.277 -7.449 1.00 52.41 H new ATOM 0 HD23 LEU A 113 -7.249 2.871 -7.533 1.00 52.41 H new ATOM 1777 N VAL A 114 -3.455 3.988 -3.547 1.00 11.10 N ATOM 1778 CA VAL A 114 -2.713 5.235 -3.444 1.00 25.00 C ATOM 1779 C VAL A 114 -1.877 5.486 -4.696 1.00 2.34 C ATOM 1780 O VAL A 114 -1.374 4.549 -5.316 1.00 65.44 O ATOM 1781 CB VAL A 114 -1.788 5.229 -2.215 1.00 53.04 C ATOM 1782 CG1 VAL A 114 -1.139 6.590 -2.029 1.00 60.41 C ATOM 1783 CG2 VAL A 114 -2.559 4.822 -0.969 1.00 23.12 C ATOM 0 H VAL A 114 -2.872 3.151 -3.556 1.00 11.10 H new ATOM 0 HA VAL A 114 -3.446 6.034 -3.338 1.00 25.00 H new ATOM 0 HB VAL A 114 -0.998 4.496 -2.381 1.00 53.04 H new ATOM 0 HG11 VAL A 114 -0.488 6.566 -1.155 1.00 60.41 H new ATOM 0 HG12 VAL A 114 -0.551 6.836 -2.913 1.00 60.41 H new ATOM 0 HG13 VAL A 114 -1.912 7.345 -1.886 1.00 60.41 H new ATOM 0 HG21 VAL A 114 -1.889 4.823 -0.110 1.00 23.12 H new ATOM 0 HG22 VAL A 114 -3.371 5.528 -0.797 1.00 23.12 H new ATOM 0 HG23 VAL A 114 -2.971 3.822 -1.106 1.00 23.12 H new ATOM 1793 N GLY A 115 -1.732 6.756 -5.059 1.00 75.55 N ATOM 1794 CA GLY A 115 -0.954 7.111 -6.232 1.00 21.22 C ATOM 1795 C GLY A 115 0.255 7.958 -5.888 1.00 55.20 C ATOM 1796 O GLY A 115 0.196 9.186 -5.938 1.00 50.13 O ATOM 0 H GLY A 115 -2.140 7.547 -4.561 1.00 75.55 H new ATOM 0 HA2 GLY A 115 -0.626 6.202 -6.736 1.00 21.22 H new ATOM 0 HA3 GLY A 115 -1.587 7.654 -6.934 1.00 21.22 H new ATOM 1800 N ASN A 116 1.354 7.300 -5.533 1.00 23.25 N ATOM 1801 CA ASN A 116 2.582 7.999 -5.175 1.00 32.33 C ATOM 1802 C ASN A 116 3.114 8.810 -6.353 1.00 1.32 C ATOM 1803 O ASN A 116 2.570 8.752 -7.456 1.00 60.51 O ATOM 1804 CB ASN A 116 3.642 7.001 -4.704 1.00 53.04 C ATOM 1805 CG ASN A 116 4.324 7.442 -3.424 1.00 5.34 C ATOM 1806 OD1 ASN A 116 5.255 6.628 -2.939 1.00 21.13 O flip ATOM 1807 ND2 ASN A 116 4.019 8.501 -2.877 1.00 53.24 N flip ATOM 0 H ASN A 116 1.419 6.283 -5.486 1.00 23.25 H new ATOM 0 HA ASN A 116 2.354 8.687 -4.361 1.00 32.33 H new ATOM 0 HB2 ASN A 116 3.177 6.028 -4.548 1.00 53.04 H new ATOM 0 HB3 ASN A 116 4.391 6.874 -5.486 1.00 53.04 H new ATOM 0 HD21 ASN A 116 3.298 9.096 -3.284 1.00 53.24 H new ATOM 0 HD22 ASN A 116 4.487 8.784 -2.016 1.00 53.24 H new ATOM 1814 N LYS A 117 4.182 9.564 -6.110 1.00 51.41 N ATOM 1815 CA LYS A 117 4.791 10.386 -7.149 1.00 14.10 C ATOM 1816 C LYS A 117 3.800 11.416 -7.684 1.00 4.01 C ATOM 1817 O LYS A 117 3.646 11.575 -8.895 1.00 71.03 O ATOM 1818 CB LYS A 117 5.300 9.505 -8.292 1.00 42.44 C ATOM 1819 CG LYS A 117 6.521 10.072 -8.999 1.00 62.41 C ATOM 1820 CD LYS A 117 7.665 9.070 -9.033 1.00 14.13 C ATOM 1821 CE LYS A 117 8.727 9.471 -10.045 1.00 24.54 C ATOM 1822 NZ LYS A 117 9.686 8.364 -10.313 1.00 20.12 N ATOM 0 H LYS A 117 4.643 9.622 -5.202 1.00 51.41 H new ATOM 0 HA LYS A 117 5.633 10.919 -6.708 1.00 14.10 H new ATOM 0 HB2 LYS A 117 5.544 8.518 -7.898 1.00 42.44 H new ATOM 0 HB3 LYS A 117 4.500 9.369 -9.019 1.00 42.44 H new ATOM 0 HG2 LYS A 117 6.254 10.354 -10.017 1.00 62.41 H new ATOM 0 HG3 LYS A 117 6.847 10.980 -8.491 1.00 62.41 H new ATOM 0 HD2 LYS A 117 8.114 8.995 -8.043 1.00 14.13 H new ATOM 0 HD3 LYS A 117 7.278 8.082 -9.283 1.00 14.13 H new ATOM 0 HE2 LYS A 117 8.246 9.768 -10.977 1.00 24.54 H new ATOM 0 HE3 LYS A 117 9.271 10.340 -9.675 1.00 24.54 H new ATOM 0 HZ1 LYS A 117 10.393 8.678 -11.008 1.00 20.12 H new ATOM 0 HZ2 LYS A 117 10.164 8.097 -9.429 1.00 20.12 H new ATOM 0 HZ3 LYS A 117 9.171 7.543 -10.690 1.00 20.12 H new ATOM 1836 N CYS A 118 3.130 12.115 -6.773 1.00 53.04 N ATOM 1837 CA CYS A 118 2.154 13.131 -7.155 1.00 11.01 C ATOM 1838 C CYS A 118 2.700 14.538 -6.924 1.00 35.40 C ATOM 1839 O CYS A 118 1.938 15.500 -6.831 1.00 14.03 O ATOM 1840 CB CYS A 118 0.857 12.944 -6.364 1.00 35.03 C ATOM 1841 SG CYS A 118 -0.548 13.874 -7.019 1.00 15.01 S ATOM 0 H CYS A 118 3.244 11.997 -5.766 1.00 53.04 H new ATOM 0 HA CYS A 118 1.949 13.013 -8.219 1.00 11.01 H new ATOM 0 HB2 CYS A 118 0.602 11.884 -6.350 1.00 35.03 H new ATOM 0 HB3 CYS A 118 1.028 13.245 -5.330 1.00 35.03 H new ATOM 0 HG CYS A 118 -0.189 15.104 -7.239 1.00 15.01 H new ATOM 1847 N ASP A 119 4.022 14.654 -6.826 1.00 11.53 N ATOM 1848 CA ASP A 119 4.660 15.949 -6.601 1.00 1.24 C ATOM 1849 C ASP A 119 5.543 16.358 -7.780 1.00 43.14 C ATOM 1850 O ASP A 119 5.938 17.518 -7.891 1.00 3.35 O ATOM 1851 CB ASP A 119 5.492 15.909 -5.319 1.00 14.21 C ATOM 1852 CG ASP A 119 5.811 17.294 -4.792 1.00 32.24 C ATOM 1853 OD1 ASP A 119 4.894 17.950 -4.253 1.00 40.15 O ATOM 1854 OD2 ASP A 119 6.977 17.724 -4.918 1.00 63.43 O ATOM 0 H ASP A 119 4.671 13.870 -6.899 1.00 11.53 H new ATOM 0 HA ASP A 119 3.870 16.693 -6.501 1.00 1.24 H new ATOM 0 HB2 ASP A 119 4.952 15.349 -4.556 1.00 14.21 H new ATOM 0 HB3 ASP A 119 6.422 15.373 -5.509 1.00 14.21 H new ATOM 1859 N LEU A 120 5.857 15.405 -8.655 1.00 3.13 N ATOM 1860 CA LEU A 120 6.699 15.686 -9.814 1.00 11.22 C ATOM 1861 C LEU A 120 5.859 16.135 -11.008 1.00 2.44 C ATOM 1862 O LEU A 120 4.630 16.061 -10.979 1.00 70.42 O ATOM 1863 CB LEU A 120 7.535 14.450 -10.176 1.00 55.54 C ATOM 1864 CG LEU A 120 6.841 13.414 -11.068 1.00 3.42 C ATOM 1865 CD1 LEU A 120 7.715 12.180 -11.227 1.00 52.13 C ATOM 1866 CD2 LEU A 120 5.483 13.036 -10.496 1.00 54.43 C ATOM 0 H LEU A 120 5.543 14.437 -8.584 1.00 3.13 H new ATOM 0 HA LEU A 120 7.374 16.502 -9.555 1.00 11.22 H new ATOM 0 HB2 LEU A 120 8.444 14.783 -10.678 1.00 55.54 H new ATOM 0 HB3 LEU A 120 7.842 13.959 -9.253 1.00 55.54 H new ATOM 0 HG LEU A 120 6.686 13.857 -12.052 1.00 3.42 H new ATOM 0 HD11 LEU A 120 7.208 11.454 -11.863 1.00 52.13 H new ATOM 0 HD12 LEU A 120 8.664 12.462 -11.684 1.00 52.13 H new ATOM 0 HD13 LEU A 120 7.901 11.737 -10.248 1.00 52.13 H new ATOM 0 HD21 LEU A 120 5.007 12.300 -11.144 1.00 54.43 H new ATOM 0 HD22 LEU A 120 5.613 12.613 -9.500 1.00 54.43 H new ATOM 0 HD23 LEU A 120 4.854 13.924 -10.434 1.00 54.43 H new ATOM 1878 N ALA A 121 6.531 16.603 -12.056 1.00 34.32 N ATOM 1879 CA ALA A 121 5.849 17.067 -13.258 1.00 32.55 C ATOM 1880 C ALA A 121 5.933 16.030 -14.374 1.00 55.51 C ATOM 1881 O ALA A 121 6.315 16.344 -15.502 1.00 15.11 O ATOM 1882 CB ALA A 121 6.438 18.393 -13.719 1.00 52.33 C ATOM 0 H ALA A 121 7.548 16.671 -12.096 1.00 34.32 H new ATOM 0 HA ALA A 121 4.797 17.214 -13.015 1.00 32.55 H new ATOM 0 HB1 ALA A 121 5.920 18.729 -14.617 1.00 52.33 H new ATOM 0 HB2 ALA A 121 6.319 19.137 -12.932 1.00 52.33 H new ATOM 0 HB3 ALA A 121 7.498 18.264 -13.938 1.00 52.33 H new ATOM 1888 N ALA A 122 5.576 14.792 -14.051 1.00 20.23 N ATOM 1889 CA ALA A 122 5.612 13.706 -15.019 1.00 63.32 C ATOM 1890 C ALA A 122 4.516 12.685 -14.736 1.00 42.12 C ATOM 1891 O ALA A 122 4.788 11.583 -14.260 1.00 74.22 O ATOM 1892 CB ALA A 122 6.976 13.039 -15.001 1.00 71.01 C ATOM 0 H ALA A 122 5.257 14.516 -13.122 1.00 20.23 H new ATOM 0 HA ALA A 122 5.434 14.123 -16.010 1.00 63.32 H new ATOM 0 HB1 ALA A 122 6.994 12.227 -15.728 1.00 71.01 H new ATOM 0 HB2 ALA A 122 7.742 13.771 -15.255 1.00 71.01 H new ATOM 0 HB3 ALA A 122 7.172 12.639 -14.006 1.00 71.01 H new ATOM 1898 N ARG A 123 3.275 13.060 -15.027 1.00 73.22 N ATOM 1899 CA ARG A 123 2.138 12.178 -14.799 1.00 12.32 C ATOM 1900 C ARG A 123 1.675 11.541 -16.108 1.00 24.33 C ATOM 1901 O ARG A 123 1.069 12.202 -16.952 1.00 53.33 O ATOM 1902 CB ARG A 123 0.993 12.963 -14.148 1.00 3.13 C ATOM 1903 CG ARG A 123 -0.371 12.301 -14.279 1.00 13.55 C ATOM 1904 CD ARG A 123 -1.195 12.947 -15.381 1.00 21.10 C ATOM 1905 NE ARG A 123 -2.184 13.880 -14.847 1.00 35.22 N ATOM 1906 CZ ARG A 123 -3.091 14.506 -15.593 1.00 25.13 C ATOM 1907 NH1 ARG A 123 -3.139 14.301 -16.904 1.00 11.43 N ATOM 1908 NH2 ARG A 123 -3.953 15.339 -15.027 1.00 41.40 N ATOM 0 H ARG A 123 3.032 13.969 -15.421 1.00 73.22 H new ATOM 0 HA ARG A 123 2.446 11.378 -14.126 1.00 12.32 H new ATOM 0 HB2 ARG A 123 1.217 13.101 -13.090 1.00 3.13 H new ATOM 0 HB3 ARG A 123 0.947 13.956 -14.596 1.00 3.13 H new ATOM 0 HG2 ARG A 123 -0.244 11.240 -14.492 1.00 13.55 H new ATOM 0 HG3 ARG A 123 -0.906 12.374 -13.332 1.00 13.55 H new ATOM 0 HD2 ARG A 123 -0.533 13.474 -16.068 1.00 21.10 H new ATOM 0 HD3 ARG A 123 -1.701 12.172 -15.957 1.00 21.10 H new ATOM 0 HE ARG A 123 -2.179 14.062 -13.843 1.00 35.22 H new ATOM 0 HH11 ARG A 123 -2.478 13.661 -17.345 1.00 11.43 H new ATOM 0 HH12 ARG A 123 -3.836 14.784 -17.470 1.00 11.43 H new ATOM 0 HH21 ARG A 123 -3.921 15.500 -14.020 1.00 41.40 H new ATOM 0 HH22 ARG A 123 -4.648 15.819 -15.598 1.00 41.40 H new ATOM 1922 N THR A 124 1.961 10.253 -16.266 1.00 53.24 N ATOM 1923 CA THR A 124 1.571 9.525 -17.467 1.00 62.42 C ATOM 1924 C THR A 124 0.129 9.041 -17.357 1.00 52.44 C ATOM 1925 O THR A 124 -0.672 9.230 -18.272 1.00 4.04 O ATOM 1926 CB THR A 124 2.505 8.336 -17.696 1.00 21.24 C ATOM 1927 OG1 THR A 124 2.363 7.379 -16.661 1.00 20.34 O ATOM 1928 CG2 THR A 124 3.966 8.728 -17.761 1.00 0.12 C ATOM 0 H THR A 124 2.462 9.692 -15.577 1.00 53.24 H new ATOM 0 HA THR A 124 1.648 10.203 -18.317 1.00 62.42 H new ATOM 0 HB THR A 124 2.213 7.920 -18.660 1.00 21.24 H new ATOM 0 HG1 THR A 124 2.390 7.831 -15.792 1.00 20.34 H new ATOM 0 HG21 THR A 124 4.574 7.839 -17.925 1.00 0.12 H new ATOM 0 HG22 THR A 124 4.119 9.429 -18.582 1.00 0.12 H new ATOM 0 HG23 THR A 124 4.258 9.199 -16.823 1.00 0.12 H new ATOM 1936 N VAL A 125 -0.194 8.419 -16.227 1.00 44.21 N ATOM 1937 CA VAL A 125 -1.536 7.911 -15.990 1.00 12.04 C ATOM 1938 C VAL A 125 -2.375 8.933 -15.229 1.00 22.23 C ATOM 1939 O VAL A 125 -2.317 9.006 -14.002 1.00 72.20 O ATOM 1940 CB VAL A 125 -1.497 6.591 -15.196 1.00 65.24 C ATOM 1941 CG1 VAL A 125 -2.902 6.067 -14.957 1.00 23.22 C ATOM 1942 CG2 VAL A 125 -0.653 5.554 -15.922 1.00 52.50 C ATOM 0 H VAL A 125 0.459 8.256 -15.461 1.00 44.21 H new ATOM 0 HA VAL A 125 -1.991 7.725 -16.963 1.00 12.04 H new ATOM 0 HB VAL A 125 -1.038 6.788 -14.227 1.00 65.24 H new ATOM 0 HG11 VAL A 125 -2.852 5.134 -14.395 1.00 23.22 H new ATOM 0 HG12 VAL A 125 -3.473 6.802 -14.390 1.00 23.22 H new ATOM 0 HG13 VAL A 125 -3.391 5.888 -15.914 1.00 23.22 H new ATOM 0 HG21 VAL A 125 -0.638 4.629 -15.346 1.00 52.50 H new ATOM 0 HG22 VAL A 125 -1.080 5.361 -16.906 1.00 52.50 H new ATOM 0 HG23 VAL A 125 0.365 5.928 -16.035 1.00 52.50 H new ATOM 1952 N GLU A 126 -3.151 9.722 -15.966 1.00 50.20 N ATOM 1953 CA GLU A 126 -4.001 10.743 -15.361 1.00 3.23 C ATOM 1954 C GLU A 126 -4.870 10.152 -14.254 1.00 63.34 C ATOM 1955 O GLU A 126 -5.122 8.947 -14.225 1.00 31.33 O ATOM 1956 CB GLU A 126 -4.884 11.398 -16.425 1.00 34.02 C ATOM 1957 CG GLU A 126 -5.560 10.402 -17.351 1.00 41.35 C ATOM 1958 CD GLU A 126 -6.622 11.043 -18.223 1.00 2.42 C ATOM 1959 OE1 GLU A 126 -7.147 12.108 -17.834 1.00 55.11 O ATOM 1960 OE2 GLU A 126 -6.928 10.481 -19.296 1.00 73.05 O ATOM 0 H GLU A 126 -3.209 9.674 -16.983 1.00 50.20 H new ATOM 0 HA GLU A 126 -3.353 11.500 -14.919 1.00 3.23 H new ATOM 0 HB2 GLU A 126 -5.648 11.999 -15.932 1.00 34.02 H new ATOM 0 HB3 GLU A 126 -4.277 12.080 -17.020 1.00 34.02 H new ATOM 0 HG2 GLU A 126 -4.808 9.934 -17.986 1.00 41.35 H new ATOM 0 HG3 GLU A 126 -6.014 9.609 -16.756 1.00 41.35 H new ATOM 1967 N SER A 127 -5.321 11.009 -13.345 1.00 40.00 N ATOM 1968 CA SER A 127 -6.160 10.577 -12.232 1.00 0.31 C ATOM 1969 C SER A 127 -7.452 9.942 -12.735 1.00 21.31 C ATOM 1970 O SER A 127 -7.924 8.949 -12.181 1.00 31.40 O ATOM 1971 CB SER A 127 -6.480 11.761 -11.318 1.00 51.44 C ATOM 1972 OG SER A 127 -5.557 12.819 -11.510 1.00 21.03 O ATOM 0 H SER A 127 -5.120 12.009 -13.357 1.00 40.00 H new ATOM 0 HA SER A 127 -5.608 9.828 -11.665 1.00 0.31 H new ATOM 0 HB2 SER A 127 -7.491 12.116 -11.518 1.00 51.44 H new ATOM 0 HB3 SER A 127 -6.456 11.438 -10.277 1.00 51.44 H new ATOM 0 HG SER A 127 -5.785 13.564 -10.915 1.00 21.03 H new ATOM 1978 N ARG A 128 -8.019 10.522 -13.788 1.00 52.24 N ATOM 1979 CA ARG A 128 -9.259 10.016 -14.371 1.00 73.41 C ATOM 1980 C ARG A 128 -9.164 8.516 -14.643 1.00 31.13 C ATOM 1981 O ARG A 128 -10.018 7.741 -14.212 1.00 40.54 O ATOM 1982 CB ARG A 128 -9.571 10.769 -15.670 1.00 33.24 C ATOM 1983 CG ARG A 128 -10.599 10.080 -16.556 1.00 51.10 C ATOM 1984 CD ARG A 128 -9.932 9.232 -17.628 1.00 72.33 C ATOM 1985 NE ARG A 128 -10.425 9.554 -18.966 1.00 31.41 N ATOM 1986 CZ ARG A 128 -10.232 10.727 -19.564 1.00 31.25 C ATOM 1987 NH1 ARG A 128 -9.562 11.693 -18.947 1.00 63.23 N ATOM 1988 NH2 ARG A 128 -10.711 10.936 -20.783 1.00 42.34 N ATOM 0 H ARG A 128 -7.639 11.345 -14.257 1.00 52.24 H new ATOM 0 HA ARG A 128 -10.066 10.181 -13.657 1.00 73.41 H new ATOM 0 HB2 ARG A 128 -9.932 11.767 -15.421 1.00 33.24 H new ATOM 0 HB3 ARG A 128 -8.647 10.896 -16.235 1.00 33.24 H new ATOM 0 HG2 ARG A 128 -11.246 9.452 -15.944 1.00 51.10 H new ATOM 0 HG3 ARG A 128 -11.235 10.829 -17.027 1.00 51.10 H new ATOM 0 HD2 ARG A 128 -8.853 9.385 -17.592 1.00 72.33 H new ATOM 0 HD3 ARG A 128 -10.111 8.177 -17.420 1.00 72.33 H new ATOM 0 HE ARG A 128 -10.947 8.838 -19.471 1.00 31.41 H new ATOM 0 HH11 ARG A 128 -9.192 11.538 -18.009 1.00 63.23 H new ATOM 0 HH12 ARG A 128 -9.417 12.590 -19.411 1.00 63.23 H new ATOM 0 HH21 ARG A 128 -11.227 10.198 -21.262 1.00 42.34 H new ATOM 0 HH22 ARG A 128 -10.563 11.835 -21.242 1.00 42.34 H new ATOM 2002 N GLN A 129 -8.121 8.118 -15.362 1.00 63.24 N ATOM 2003 CA GLN A 129 -7.910 6.715 -15.697 1.00 63.14 C ATOM 2004 C GLN A 129 -7.913 5.845 -14.444 1.00 71.20 C ATOM 2005 O GLN A 129 -8.538 4.784 -14.413 1.00 34.33 O ATOM 2006 CB GLN A 129 -6.587 6.546 -16.445 1.00 10.22 C ATOM 2007 CG GLN A 129 -6.666 5.561 -17.596 1.00 42.43 C ATOM 2008 CD GLN A 129 -5.611 5.815 -18.655 1.00 22.34 C ATOM 2009 OE1 GLN A 129 -5.716 6.759 -19.438 1.00 3.31 O ATOM 2010 NE2 GLN A 129 -4.587 4.971 -18.685 1.00 24.34 N ATOM 0 H GLN A 129 -7.407 8.749 -15.725 1.00 63.24 H new ATOM 0 HA GLN A 129 -8.730 6.394 -16.339 1.00 63.14 H new ATOM 0 HB2 GLN A 129 -6.268 7.516 -16.828 1.00 10.22 H new ATOM 0 HB3 GLN A 129 -5.822 6.213 -15.744 1.00 10.22 H new ATOM 0 HG2 GLN A 129 -6.552 4.548 -17.211 1.00 42.43 H new ATOM 0 HG3 GLN A 129 -7.654 5.619 -18.052 1.00 42.43 H new ATOM 0 HE21 GLN A 129 -4.540 4.202 -18.017 1.00 24.34 H new ATOM 0 HE22 GLN A 129 -3.847 5.092 -19.376 1.00 24.34 H new ATOM 2019 N ALA A 130 -7.211 6.302 -13.414 1.00 12.22 N ATOM 2020 CA ALA A 130 -7.130 5.568 -12.157 1.00 12.41 C ATOM 2021 C ALA A 130 -8.450 5.631 -11.397 1.00 61.04 C ATOM 2022 O ALA A 130 -8.825 4.684 -10.705 1.00 0.35 O ATOM 2023 CB ALA A 130 -5.999 6.114 -11.299 1.00 40.24 C ATOM 0 H ALA A 130 -6.689 7.178 -13.425 1.00 12.22 H new ATOM 0 HA ALA A 130 -6.924 4.523 -12.389 1.00 12.41 H new ATOM 0 HB1 ALA A 130 -5.950 5.557 -10.364 1.00 40.24 H new ATOM 0 HB2 ALA A 130 -5.054 6.010 -11.833 1.00 40.24 H new ATOM 0 HB3 ALA A 130 -6.181 7.167 -11.085 1.00 40.24 H new ATOM 2029 N GLN A 131 -9.151 6.752 -11.529 1.00 75.41 N ATOM 2030 CA GLN A 131 -10.430 6.939 -10.853 1.00 3.23 C ATOM 2031 C GLN A 131 -11.438 5.880 -11.291 1.00 11.21 C ATOM 2032 O GLN A 131 -12.170 5.327 -10.470 1.00 41.11 O ATOM 2033 CB GLN A 131 -10.981 8.338 -11.139 1.00 65.21 C ATOM 2034 CG GLN A 131 -10.889 9.282 -9.952 1.00 50.21 C ATOM 2035 CD GLN A 131 -12.222 9.475 -9.256 1.00 25.21 C ATOM 2036 OE1 GLN A 131 -12.906 10.477 -9.464 1.00 14.24 O ATOM 2037 NE2 GLN A 131 -12.597 8.512 -8.422 1.00 20.34 N ATOM 0 H GLN A 131 -8.855 7.545 -12.098 1.00 75.41 H new ATOM 0 HA GLN A 131 -10.266 6.834 -9.781 1.00 3.23 H new ATOM 0 HB2 GLN A 131 -10.436 8.769 -11.979 1.00 65.21 H new ATOM 0 HB3 GLN A 131 -12.024 8.253 -11.445 1.00 65.21 H new ATOM 0 HG2 GLN A 131 -10.164 8.892 -9.238 1.00 50.21 H new ATOM 0 HG3 GLN A 131 -10.516 10.249 -10.290 1.00 50.21 H new ATOM 0 HE21 GLN A 131 -11.998 7.699 -8.280 1.00 20.34 H new ATOM 0 HE22 GLN A 131 -13.484 8.586 -7.924 1.00 20.34 H new ATOM 2046 N ASP A 132 -11.472 5.604 -12.591 1.00 30.12 N ATOM 2047 CA ASP A 132 -12.391 4.613 -13.139 1.00 35.33 C ATOM 2048 C ASP A 132 -12.113 3.231 -12.557 1.00 34.11 C ATOM 2049 O ASP A 132 -13.034 2.447 -12.327 1.00 71.13 O ATOM 2050 CB ASP A 132 -12.276 4.569 -14.663 1.00 42.13 C ATOM 2051 CG ASP A 132 -13.447 3.856 -15.311 1.00 74.12 C ATOM 2052 OD1 ASP A 132 -13.435 2.608 -15.348 1.00 52.13 O ATOM 2053 OD2 ASP A 132 -14.376 4.546 -15.781 1.00 13.31 O ATOM 0 H ASP A 132 -10.874 6.053 -13.284 1.00 30.12 H new ATOM 0 HA ASP A 132 -13.405 4.905 -12.866 1.00 35.33 H new ATOM 0 HB2 ASP A 132 -12.215 5.586 -15.049 1.00 42.13 H new ATOM 0 HB3 ASP A 132 -11.349 4.066 -14.940 1.00 42.13 H new ATOM 2058 N LEU A 133 -10.839 2.939 -12.321 1.00 22.43 N ATOM 2059 CA LEU A 133 -10.440 1.651 -11.766 1.00 13.13 C ATOM 2060 C LEU A 133 -10.802 1.562 -10.287 1.00 24.31 C ATOM 2061 O LEU A 133 -11.437 0.601 -9.850 1.00 64.22 O ATOM 2062 CB LEU A 133 -8.936 1.438 -11.950 1.00 32.32 C ATOM 2063 CG LEU A 133 -8.374 0.172 -11.300 1.00 62.44 C ATOM 2064 CD1 LEU A 133 -8.772 -1.060 -12.099 1.00 43.14 C ATOM 2065 CD2 LEU A 133 -6.861 0.265 -11.177 1.00 30.10 C ATOM 0 H LEU A 133 -10.065 3.577 -12.505 1.00 22.43 H new ATOM 0 HA LEU A 133 -10.978 0.869 -12.301 1.00 13.13 H new ATOM 0 HB2 LEU A 133 -8.717 1.407 -13.017 1.00 32.32 H new ATOM 0 HB3 LEU A 133 -8.410 2.301 -11.542 1.00 32.32 H new ATOM 0 HG LEU A 133 -8.796 0.081 -10.299 1.00 62.44 H new ATOM 0 HD11 LEU A 133 -8.363 -1.951 -11.622 1.00 43.14 H new ATOM 0 HD12 LEU A 133 -9.859 -1.134 -12.136 1.00 43.14 H new ATOM 0 HD13 LEU A 133 -8.379 -0.979 -13.113 1.00 43.14 H new ATOM 0 HD21 LEU A 133 -6.477 -0.643 -10.713 1.00 30.10 H new ATOM 0 HD22 LEU A 133 -6.422 0.380 -12.168 1.00 30.10 H new ATOM 0 HD23 LEU A 133 -6.598 1.126 -10.562 1.00 30.10 H new ATOM 2077 N ALA A 134 -10.395 2.569 -9.522 1.00 52.14 N ATOM 2078 CA ALA A 134 -10.677 2.603 -8.092 1.00 55.01 C ATOM 2079 C ALA A 134 -12.179 2.615 -7.829 1.00 72.23 C ATOM 2080 O ALA A 134 -12.678 1.869 -6.987 1.00 34.40 O ATOM 2081 CB ALA A 134 -10.018 3.816 -7.453 1.00 51.21 C ATOM 0 H ALA A 134 -9.869 3.372 -9.868 1.00 52.14 H new ATOM 0 HA ALA A 134 -10.263 1.700 -7.644 1.00 55.01 H new ATOM 0 HB1 ALA A 134 -10.237 3.829 -6.385 1.00 51.21 H new ATOM 0 HB2 ALA A 134 -8.939 3.765 -7.602 1.00 51.21 H new ATOM 0 HB3 ALA A 134 -10.405 4.725 -7.914 1.00 51.21 H new ATOM 2087 N ARG A 135 -12.894 3.468 -8.556 1.00 22.54 N ATOM 2088 CA ARG A 135 -14.340 3.578 -8.403 1.00 64.14 C ATOM 2089 C ARG A 135 -15.028 2.257 -8.734 1.00 2.12 C ATOM 2090 O ARG A 135 -16.095 1.952 -8.203 1.00 31.13 O ATOM 2091 CB ARG A 135 -14.886 4.690 -9.301 1.00 14.13 C ATOM 2092 CG ARG A 135 -16.387 4.893 -9.174 1.00 13.55 C ATOM 2093 CD ARG A 135 -16.796 6.303 -9.572 1.00 10.11 C ATOM 2094 NE ARG A 135 -17.969 6.306 -10.443 1.00 72.34 N ATOM 2095 CZ ARG A 135 -17.973 5.823 -11.683 1.00 43.31 C ATOM 2096 NH1 ARG A 135 -16.869 5.300 -12.203 1.00 54.21 N ATOM 2097 NH2 ARG A 135 -19.083 5.864 -12.407 1.00 61.02 N ATOM 0 H ARG A 135 -12.495 4.093 -9.257 1.00 22.54 H new ATOM 0 HA ARG A 135 -14.551 3.824 -7.362 1.00 64.14 H new ATOM 0 HB2 ARG A 135 -14.380 5.624 -9.057 1.00 14.13 H new ATOM 0 HB3 ARG A 135 -14.646 4.459 -10.339 1.00 14.13 H new ATOM 0 HG2 ARG A 135 -16.907 4.171 -9.804 1.00 13.55 H new ATOM 0 HG3 ARG A 135 -16.695 4.700 -8.146 1.00 13.55 H new ATOM 0 HD2 ARG A 135 -17.008 6.886 -8.676 1.00 10.11 H new ATOM 0 HD3 ARG A 135 -15.965 6.792 -10.081 1.00 10.11 H new ATOM 0 HE ARG A 135 -18.836 6.702 -10.079 1.00 72.34 H new ATOM 0 HH11 ARG A 135 -16.012 5.267 -11.651 1.00 54.21 H new ATOM 0 HH12 ARG A 135 -16.878 4.931 -13.154 1.00 54.21 H new ATOM 0 HH21 ARG A 135 -19.934 6.266 -12.014 1.00 61.02 H new ATOM 0 HH22 ARG A 135 -19.086 5.494 -13.357 1.00 61.02 H new ATOM 2111 N SER A 136 -14.409 1.476 -9.614 1.00 25.03 N ATOM 2112 CA SER A 136 -14.962 0.187 -10.013 1.00 44.50 C ATOM 2113 C SER A 136 -14.806 -0.837 -8.895 1.00 23.32 C ATOM 2114 O SER A 136 -15.687 -1.666 -8.670 1.00 0.32 O ATOM 2115 CB SER A 136 -14.274 -0.317 -11.283 1.00 32.41 C ATOM 2116 OG SER A 136 -14.537 -1.693 -11.494 1.00 12.45 O ATOM 0 H SER A 136 -13.525 1.713 -10.064 1.00 25.03 H new ATOM 0 HA SER A 136 -16.025 0.321 -10.215 1.00 44.50 H new ATOM 0 HB2 SER A 136 -14.621 0.258 -12.141 1.00 32.41 H new ATOM 0 HB3 SER A 136 -13.199 -0.157 -11.206 1.00 32.41 H new ATOM 0 HG SER A 136 -14.087 -1.990 -12.313 1.00 12.45 H new ATOM 2122 N TYR A 137 -13.678 -0.769 -8.196 1.00 11.25 N ATOM 2123 CA TYR A 137 -13.401 -1.687 -7.098 1.00 75.10 C ATOM 2124 C TYR A 137 -14.196 -1.306 -5.852 1.00 4.34 C ATOM 2125 O TYR A 137 -14.426 -2.138 -4.974 1.00 72.30 O ATOM 2126 CB TYR A 137 -11.905 -1.694 -6.779 1.00 21.13 C ATOM 2127 CG TYR A 137 -11.055 -2.314 -7.865 1.00 70.24 C ATOM 2128 CD1 TYR A 137 -11.460 -3.474 -8.515 1.00 42.32 C ATOM 2129 CD2 TYR A 137 -9.847 -1.740 -8.240 1.00 13.31 C ATOM 2130 CE1 TYR A 137 -10.684 -4.043 -9.507 1.00 31.04 C ATOM 2131 CE2 TYR A 137 -9.066 -2.303 -9.231 1.00 5.52 C ATOM 2132 CZ TYR A 137 -9.489 -3.454 -9.862 1.00 20.42 C ATOM 2133 OH TYR A 137 -8.715 -4.018 -10.849 1.00 0.25 O ATOM 0 H TYR A 137 -12.940 -0.087 -8.371 1.00 11.25 H new ATOM 0 HA TYR A 137 -13.706 -2.686 -7.408 1.00 75.10 H new ATOM 0 HB2 TYR A 137 -11.574 -0.669 -6.611 1.00 21.13 H new ATOM 0 HB3 TYR A 137 -11.743 -2.238 -5.848 1.00 21.13 H new ATOM 0 HD1 TYR A 137 -12.396 -3.938 -8.240 1.00 42.32 H new ATOM 0 HD2 TYR A 137 -9.513 -0.838 -7.749 1.00 13.31 H new ATOM 0 HE1 TYR A 137 -11.012 -4.945 -10.002 1.00 31.04 H new ATOM 0 HE2 TYR A 137 -8.129 -1.844 -9.510 1.00 5.52 H new ATOM 0 HH TYR A 137 -9.097 -4.882 -11.111 1.00 0.25 H new ATOM 2143 N GLY A 138 -14.611 -0.045 -5.779 1.00 44.14 N ATOM 2144 CA GLY A 138 -15.372 0.419 -4.635 1.00 24.21 C ATOM 2145 C GLY A 138 -14.484 0.925 -3.513 1.00 32.33 C ATOM 2146 O GLY A 138 -14.942 1.103 -2.384 1.00 33.24 O ATOM 0 H GLY A 138 -14.434 0.663 -6.492 1.00 44.14 H new ATOM 0 HA2 GLY A 138 -16.045 1.217 -4.950 1.00 24.21 H new ATOM 0 HA3 GLY A 138 -15.995 -0.395 -4.263 1.00 24.21 H new ATOM 2150 N ILE A 139 -13.211 1.159 -3.822 1.00 65.22 N ATOM 2151 CA ILE A 139 -12.261 1.647 -2.830 1.00 34.03 C ATOM 2152 C ILE A 139 -11.840 3.084 -3.123 1.00 74.33 C ATOM 2153 O ILE A 139 -11.927 3.546 -4.260 1.00 62.11 O ATOM 2154 CB ILE A 139 -11.009 0.764 -2.760 1.00 14.30 C ATOM 2155 CG1 ILE A 139 -10.551 0.374 -4.159 1.00 41.14 C ATOM 2156 CG2 ILE A 139 -11.282 -0.475 -1.920 1.00 61.20 C ATOM 2157 CD1 ILE A 139 -9.285 -0.439 -4.151 1.00 4.02 C ATOM 0 H ILE A 139 -12.815 1.018 -4.751 1.00 65.22 H new ATOM 0 HA ILE A 139 -12.773 1.611 -1.869 1.00 34.03 H new ATOM 0 HB ILE A 139 -10.209 1.333 -2.286 1.00 14.30 H new ATOM 0 HG12 ILE A 139 -11.340 -0.196 -4.649 1.00 41.14 H new ATOM 0 HG13 ILE A 139 -10.395 1.276 -4.750 1.00 41.14 H new ATOM 0 HG21 ILE A 139 -10.384 -1.092 -1.879 1.00 61.20 H new ATOM 0 HG22 ILE A 139 -11.562 -0.175 -0.910 1.00 61.20 H new ATOM 0 HG23 ILE A 139 -12.095 -1.046 -2.368 1.00 61.20 H new ATOM 0 HD11 ILE A 139 -9.006 -0.688 -5.175 1.00 4.02 H new ATOM 0 HD12 ILE A 139 -8.485 0.138 -3.687 1.00 4.02 H new ATOM 0 HD13 ILE A 139 -9.445 -1.357 -3.585 1.00 4.02 H new ATOM 2169 N PRO A 140 -11.375 3.813 -2.093 1.00 74.23 N ATOM 2170 CA PRO A 140 -10.939 5.204 -2.245 1.00 72.11 C ATOM 2171 C PRO A 140 -9.625 5.321 -3.009 1.00 63.13 C ATOM 2172 O PRO A 140 -8.812 4.396 -3.013 1.00 24.01 O ATOM 2173 CB PRO A 140 -10.764 5.680 -0.802 1.00 25.20 C ATOM 2174 CG PRO A 140 -10.472 4.441 -0.028 1.00 24.55 C ATOM 2175 CD PRO A 140 -11.240 3.338 -0.703 1.00 20.34 C ATOM 0 HA PRO A 140 -11.653 5.794 -2.819 1.00 72.11 H new ATOM 0 HB2 PRO A 140 -9.950 6.400 -0.719 1.00 25.20 H new ATOM 0 HB3 PRO A 140 -11.665 6.173 -0.436 1.00 25.20 H new ATOM 0 HG2 PRO A 140 -9.403 4.226 -0.024 1.00 24.55 H new ATOM 0 HG3 PRO A 140 -10.779 4.550 1.012 1.00 24.55 H new ATOM 0 HD2 PRO A 140 -10.706 2.389 -0.653 1.00 20.34 H new ATOM 0 HD3 PRO A 140 -12.212 3.182 -0.236 1.00 20.34 H new ATOM 2183 N TYR A 141 -9.422 6.466 -3.652 1.00 74.21 N ATOM 2184 CA TYR A 141 -8.206 6.710 -4.420 1.00 72.12 C ATOM 2185 C TYR A 141 -7.501 7.971 -3.928 1.00 35.42 C ATOM 2186 O TYR A 141 -7.931 9.088 -4.216 1.00 40.44 O ATOM 2187 CB TYR A 141 -8.539 6.838 -5.911 1.00 50.35 C ATOM 2188 CG TYR A 141 -7.380 7.312 -6.761 1.00 72.22 C ATOM 2189 CD1 TYR A 141 -6.112 6.765 -6.611 1.00 31.51 C ATOM 2190 CD2 TYR A 141 -7.556 8.309 -7.713 1.00 42.33 C ATOM 2191 CE1 TYR A 141 -5.052 7.197 -7.385 1.00 32.33 C ATOM 2192 CE2 TYR A 141 -6.501 8.746 -8.491 1.00 72.10 C ATOM 2193 CZ TYR A 141 -5.252 8.188 -8.324 1.00 34.13 C ATOM 2194 OH TYR A 141 -4.199 8.621 -9.097 1.00 21.53 O ATOM 0 H TYR A 141 -10.085 7.241 -3.657 1.00 74.21 H new ATOM 0 HA TYR A 141 -7.534 5.863 -4.279 1.00 72.12 H new ATOM 0 HB2 TYR A 141 -8.877 5.870 -6.282 1.00 50.35 H new ATOM 0 HB3 TYR A 141 -9.371 7.532 -6.029 1.00 50.35 H new ATOM 0 HD1 TYR A 141 -5.952 5.989 -5.877 1.00 31.51 H new ATOM 0 HD2 TYR A 141 -8.533 8.749 -7.847 1.00 42.33 H new ATOM 0 HE1 TYR A 141 -4.072 6.761 -7.256 1.00 32.33 H new ATOM 0 HE2 TYR A 141 -6.655 9.522 -9.227 1.00 72.10 H new ATOM 0 HH TYR A 141 -3.460 7.981 -9.031 1.00 21.53 H new ATOM 2204 N ILE A 142 -6.415 7.784 -3.185 1.00 65.41 N ATOM 2205 CA ILE A 142 -5.651 8.906 -2.654 1.00 20.23 C ATOM 2206 C ILE A 142 -4.360 9.111 -3.439 1.00 23.12 C ATOM 2207 O ILE A 142 -3.797 8.163 -3.987 1.00 65.33 O ATOM 2208 CB ILE A 142 -5.306 8.697 -1.167 1.00 34.51 C ATOM 2209 CG1 ILE A 142 -6.561 8.325 -0.376 1.00 31.30 C ATOM 2210 CG2 ILE A 142 -4.664 9.950 -0.592 1.00 43.51 C ATOM 2211 CD1 ILE A 142 -6.767 6.832 -0.237 1.00 34.14 C ATOM 0 H ILE A 142 -6.045 6.866 -2.937 1.00 65.41 H new ATOM 0 HA ILE A 142 -6.279 9.792 -2.753 1.00 20.23 H new ATOM 0 HB ILE A 142 -4.593 7.876 -1.087 1.00 34.51 H new ATOM 0 HG12 ILE A 142 -6.500 8.769 0.617 1.00 31.30 H new ATOM 0 HG13 ILE A 142 -7.432 8.760 -0.866 1.00 31.30 H new ATOM 0 HG21 ILE A 142 -4.426 9.787 0.459 1.00 43.51 H new ATOM 0 HG22 ILE A 142 -3.749 10.175 -1.141 1.00 43.51 H new ATOM 0 HG23 ILE A 142 -5.356 10.787 -0.682 1.00 43.51 H new ATOM 0 HD11 ILE A 142 -7.675 6.642 0.335 1.00 34.14 H new ATOM 0 HD12 ILE A 142 -6.861 6.384 -1.226 1.00 34.14 H new ATOM 0 HD13 ILE A 142 -5.914 6.394 0.281 1.00 34.14 H new ATOM 2223 N GLU A 143 -3.895 10.355 -3.487 1.00 22.42 N ATOM 2224 CA GLU A 143 -2.668 10.687 -4.202 1.00 3.11 C ATOM 2225 C GLU A 143 -1.651 11.323 -3.262 1.00 43.22 C ATOM 2226 O GLU A 143 -1.969 12.261 -2.530 1.00 24.12 O ATOM 2227 CB GLU A 143 -2.970 11.636 -5.364 1.00 13.30 C ATOM 2228 CG GLU A 143 -4.111 11.168 -6.251 1.00 60.41 C ATOM 2229 CD GLU A 143 -5.441 11.783 -5.862 1.00 21.00 C ATOM 2230 OE1 GLU A 143 -5.688 12.949 -6.237 1.00 23.12 O ATOM 2231 OE2 GLU A 143 -6.236 11.100 -5.183 1.00 33.52 O ATOM 0 H GLU A 143 -4.350 11.150 -3.039 1.00 22.42 H new ATOM 0 HA GLU A 143 -2.245 9.764 -4.598 1.00 3.11 H new ATOM 0 HB2 GLU A 143 -3.212 12.621 -4.964 1.00 13.30 H new ATOM 0 HB3 GLU A 143 -2.072 11.750 -5.971 1.00 13.30 H new ATOM 0 HG2 GLU A 143 -3.888 11.420 -7.288 1.00 60.41 H new ATOM 0 HG3 GLU A 143 -4.187 10.082 -6.196 1.00 60.41 H new ATOM 2238 N THR A 144 -0.427 10.807 -3.284 1.00 24.23 N ATOM 2239 CA THR A 144 0.635 11.326 -2.431 1.00 75.25 C ATOM 2240 C THR A 144 1.980 11.288 -3.147 1.00 54.32 C ATOM 2241 O THR A 144 2.063 10.903 -4.314 1.00 33.14 O ATOM 2242 CB THR A 144 0.713 10.520 -1.133 1.00 30.25 C ATOM 2243 OG1 THR A 144 1.307 9.255 -1.364 1.00 24.40 O ATOM 2244 CG2 THR A 144 -0.638 10.283 -0.494 1.00 63.22 C ATOM 0 H THR A 144 -0.146 10.030 -3.883 1.00 24.23 H new ATOM 0 HA THR A 144 0.401 12.364 -2.195 1.00 75.25 H new ATOM 0 HB THR A 144 1.317 11.122 -0.454 1.00 30.25 H new ATOM 0 HG1 THR A 144 1.350 8.755 -0.522 1.00 24.40 H new ATOM 0 HG21 THR A 144 -0.511 9.706 0.422 1.00 63.22 H new ATOM 0 HG22 THR A 144 -1.102 11.241 -0.258 1.00 63.22 H new ATOM 0 HG23 THR A 144 -1.276 9.731 -1.185 1.00 63.22 H new ATOM 2252 N SER A 145 3.030 11.689 -2.440 1.00 12.42 N ATOM 2253 CA SER A 145 4.374 11.701 -3.005 1.00 40.25 C ATOM 2254 C SER A 145 5.410 11.342 -1.943 1.00 21.40 C ATOM 2255 O SER A 145 5.477 11.971 -0.888 1.00 31.22 O ATOM 2256 CB SER A 145 4.685 13.076 -3.604 1.00 62.02 C ATOM 2257 OG SER A 145 6.076 13.349 -3.575 1.00 52.41 O ATOM 0 H SER A 145 2.976 12.010 -1.473 1.00 12.42 H new ATOM 0 HA SER A 145 4.420 10.953 -3.796 1.00 40.25 H new ATOM 0 HB2 SER A 145 4.326 13.116 -4.632 1.00 62.02 H new ATOM 0 HB3 SER A 145 4.150 13.846 -3.049 1.00 62.02 H new ATOM 0 HG SER A 145 6.537 12.769 -4.216 1.00 52.41 H new ATOM 2263 N ALA A 146 6.213 10.324 -2.231 1.00 54.44 N ATOM 2264 CA ALA A 146 7.246 9.876 -1.304 1.00 53.51 C ATOM 2265 C ALA A 146 8.456 10.810 -1.319 1.00 2.34 C ATOM 2266 O ALA A 146 9.305 10.750 -0.431 1.00 31.45 O ATOM 2267 CB ALA A 146 7.669 8.453 -1.639 1.00 42.32 C ATOM 0 H ALA A 146 6.168 9.793 -3.100 1.00 54.44 H new ATOM 0 HA ALA A 146 6.826 9.896 -0.298 1.00 53.51 H new ATOM 0 HB1 ALA A 146 8.441 8.129 -0.941 1.00 42.32 H new ATOM 0 HB2 ALA A 146 6.808 7.790 -1.562 1.00 42.32 H new ATOM 0 HB3 ALA A 146 8.062 8.420 -2.655 1.00 42.32 H new ATOM 2273 N LYS A 147 8.532 11.668 -2.333 1.00 25.31 N ATOM 2274 CA LYS A 147 9.643 12.605 -2.458 1.00 61.11 C ATOM 2275 C LYS A 147 9.336 13.929 -1.760 1.00 64.31 C ATOM 2276 O LYS A 147 10.247 14.639 -1.335 1.00 42.33 O ATOM 2277 CB LYS A 147 9.971 12.839 -3.934 1.00 54.44 C ATOM 2278 CG LYS A 147 9.005 13.776 -4.636 1.00 63.04 C ATOM 2279 CD LYS A 147 9.678 15.079 -5.034 1.00 22.43 C ATOM 2280 CE LYS A 147 10.335 15.769 -3.848 1.00 42.20 C ATOM 2281 NZ LYS A 147 11.004 17.038 -4.246 1.00 52.30 N ATOM 0 H LYS A 147 7.839 11.733 -3.078 1.00 25.31 H new ATOM 0 HA LYS A 147 10.512 12.167 -1.968 1.00 61.11 H new ATOM 0 HB2 LYS A 147 10.979 13.246 -4.012 1.00 54.44 H new ATOM 0 HB3 LYS A 147 9.974 11.880 -4.452 1.00 54.44 H new ATOM 0 HG2 LYS A 147 8.604 13.287 -5.524 1.00 63.04 H new ATOM 0 HG3 LYS A 147 8.161 13.988 -3.980 1.00 63.04 H new ATOM 0 HD2 LYS A 147 10.429 14.880 -5.799 1.00 22.43 H new ATOM 0 HD3 LYS A 147 8.940 15.747 -5.478 1.00 22.43 H new ATOM 0 HE2 LYS A 147 9.583 15.978 -3.087 1.00 42.20 H new ATOM 0 HE3 LYS A 147 11.067 15.098 -3.397 1.00 42.20 H new ATOM 0 HZ1 LYS A 147 11.439 17.478 -3.410 1.00 52.30 H new ATOM 0 HZ2 LYS A 147 11.739 16.836 -4.953 1.00 52.30 H new ATOM 0 HZ3 LYS A 147 10.301 17.688 -4.653 1.00 52.30 H new ATOM 2295 N THR A 148 8.053 14.258 -1.646 1.00 53.34 N ATOM 2296 CA THR A 148 7.640 15.500 -1.000 1.00 15.11 C ATOM 2297 C THR A 148 6.918 15.226 0.319 1.00 33.34 C ATOM 2298 O THR A 148 6.885 16.078 1.207 1.00 60.44 O ATOM 2299 CB THR A 148 6.742 16.315 -1.939 1.00 73.32 C ATOM 2300 OG1 THR A 148 6.842 17.698 -1.652 1.00 73.42 O ATOM 2301 CG2 THR A 148 5.276 15.938 -1.866 1.00 31.11 C ATOM 0 H THR A 148 7.283 13.684 -1.991 1.00 53.34 H new ATOM 0 HA THR A 148 8.537 16.078 -0.778 1.00 15.11 H new ATOM 0 HB THR A 148 7.104 16.087 -2.942 1.00 73.32 H new ATOM 0 HG1 THR A 148 6.318 18.206 -2.306 1.00 73.42 H new ATOM 0 HG21 THR A 148 4.706 16.558 -2.558 1.00 31.11 H new ATOM 0 HG22 THR A 148 5.156 14.889 -2.135 1.00 31.11 H new ATOM 0 HG23 THR A 148 4.910 16.096 -0.852 1.00 31.11 H new ATOM 2309 N ARG A 149 6.334 14.035 0.437 1.00 43.52 N ATOM 2310 CA ARG A 149 5.607 13.653 1.643 1.00 30.25 C ATOM 2311 C ARG A 149 4.284 14.409 1.737 1.00 71.34 C ATOM 2312 O ARG A 149 3.929 14.934 2.793 1.00 62.35 O ATOM 2313 CB ARG A 149 6.455 13.918 2.890 1.00 70.04 C ATOM 2314 CG ARG A 149 6.353 12.822 3.937 1.00 43.22 C ATOM 2315 CD ARG A 149 5.083 12.959 4.761 1.00 12.03 C ATOM 2316 NE ARG A 149 5.119 14.133 5.629 1.00 54.40 N ATOM 2317 CZ ARG A 149 5.913 14.246 6.692 1.00 1.42 C ATOM 2318 NH1 ARG A 149 6.734 13.257 7.023 1.00 30.45 N ATOM 2319 NH2 ARG A 149 5.886 15.351 7.425 1.00 22.41 N ATOM 0 H ARG A 149 6.351 13.319 -0.289 1.00 43.52 H new ATOM 0 HA ARG A 149 5.394 12.586 1.586 1.00 30.25 H new ATOM 0 HB2 ARG A 149 7.498 14.030 2.593 1.00 70.04 H new ATOM 0 HB3 ARG A 149 6.147 14.864 3.335 1.00 70.04 H new ATOM 0 HG2 ARG A 149 6.368 11.848 3.449 1.00 43.22 H new ATOM 0 HG3 ARG A 149 7.221 12.863 4.595 1.00 43.22 H new ATOM 0 HD2 ARG A 149 4.224 13.027 4.094 1.00 12.03 H new ATOM 0 HD3 ARG A 149 4.946 12.064 5.367 1.00 12.03 H new ATOM 0 HE ARG A 149 4.499 14.912 5.408 1.00 54.40 H new ATOM 0 HH11 ARG A 149 6.759 12.405 6.462 1.00 30.45 H new ATOM 0 HH12 ARG A 149 7.340 13.349 7.838 1.00 30.45 H new ATOM 0 HH21 ARG A 149 5.257 16.114 7.174 1.00 22.41 H new ATOM 0 HH22 ARG A 149 6.494 15.438 8.239 1.00 22.41 H new ATOM 2333 N GLN A 150 3.561 14.463 0.623 1.00 71.05 N ATOM 2334 CA GLN A 150 2.279 15.159 0.575 1.00 53.04 C ATOM 2335 C GLN A 150 1.112 14.174 0.633 1.00 43.30 C ATOM 2336 O GLN A 150 0.938 13.347 -0.261 1.00 21.30 O ATOM 2337 CB GLN A 150 2.186 16.007 -0.697 1.00 60.43 C ATOM 2338 CG GLN A 150 0.822 16.644 -0.914 1.00 73.02 C ATOM 2339 CD GLN A 150 0.918 18.085 -1.376 1.00 15.04 C ATOM 2340 OE1 GLN A 150 0.942 19.010 -0.563 1.00 20.13 O ATOM 2341 NE2 GLN A 150 0.972 18.284 -2.688 1.00 32.42 N ATOM 0 H GLN A 150 3.841 14.033 -0.259 1.00 71.05 H new ATOM 0 HA GLN A 150 2.217 15.810 1.447 1.00 53.04 H new ATOM 0 HB2 GLN A 150 2.940 16.793 -0.654 1.00 60.43 H new ATOM 0 HB3 GLN A 150 2.425 15.382 -1.557 1.00 60.43 H new ATOM 0 HG2 GLN A 150 0.268 16.065 -1.654 1.00 73.02 H new ATOM 0 HG3 GLN A 150 0.253 16.601 0.015 1.00 73.02 H new ATOM 0 HE21 GLN A 150 0.949 17.488 -3.326 1.00 32.42 H new ATOM 0 HE22 GLN A 150 1.036 19.232 -3.058 1.00 32.42 H new ATOM 2350 N GLY A 151 0.310 14.280 1.688 1.00 2.20 N ATOM 2351 CA GLY A 151 -0.840 13.407 1.844 1.00 2.44 C ATOM 2352 C GLY A 151 -0.465 11.955 2.083 1.00 70.14 C ATOM 2353 O GLY A 151 -1.324 11.075 2.031 1.00 52.33 O ATOM 0 H GLY A 151 0.437 14.957 2.440 1.00 2.20 H new ATOM 0 HA2 GLY A 151 -1.445 13.761 2.679 1.00 2.44 H new ATOM 0 HA3 GLY A 151 -1.461 13.472 0.950 1.00 2.44 H new ATOM 2357 N VAL A 152 0.812 11.699 2.348 1.00 42.11 N ATOM 2358 CA VAL A 152 1.283 10.353 2.595 1.00 73.40 C ATOM 2359 C VAL A 152 0.556 9.722 3.780 1.00 34.33 C ATOM 2360 O VAL A 152 0.268 8.525 3.779 1.00 12.25 O ATOM 2361 CB VAL A 152 2.796 10.362 2.863 1.00 23.43 C ATOM 2362 CG1 VAL A 152 3.293 8.964 3.151 1.00 3.34 C ATOM 2363 CG2 VAL A 152 3.539 10.968 1.683 1.00 65.13 C ATOM 0 H VAL A 152 1.538 12.414 2.396 1.00 42.11 H new ATOM 0 HA VAL A 152 1.074 9.757 1.706 1.00 73.40 H new ATOM 0 HB VAL A 152 2.989 10.977 3.742 1.00 23.43 H new ATOM 0 HG11 VAL A 152 4.366 8.991 3.338 1.00 3.34 H new ATOM 0 HG12 VAL A 152 2.781 8.570 4.029 1.00 3.34 H new ATOM 0 HG13 VAL A 152 3.090 8.322 2.294 1.00 3.34 H new ATOM 0 HG21 VAL A 152 4.610 10.967 1.888 1.00 65.13 H new ATOM 0 HG22 VAL A 152 3.341 10.380 0.787 1.00 65.13 H new ATOM 0 HG23 VAL A 152 3.200 11.992 1.527 1.00 65.13 H new ATOM 2373 N GLU A 153 0.261 10.536 4.788 1.00 24.22 N ATOM 2374 CA GLU A 153 -0.434 10.057 5.977 1.00 45.43 C ATOM 2375 C GLU A 153 -1.902 9.778 5.674 1.00 44.11 C ATOM 2376 O GLU A 153 -2.504 8.872 6.251 1.00 43.44 O ATOM 2377 CB GLU A 153 -0.319 11.082 7.107 1.00 54.03 C ATOM 2378 CG GLU A 153 1.085 11.639 7.282 1.00 51.41 C ATOM 2379 CD GLU A 153 1.563 11.577 8.720 1.00 15.01 C ATOM 2380 OE1 GLU A 153 1.018 12.323 9.560 1.00 24.44 O ATOM 2381 OE2 GLU A 153 2.484 10.782 9.006 1.00 41.53 O ATOM 0 H GLU A 153 0.492 11.529 4.805 1.00 24.22 H new ATOM 0 HA GLU A 153 0.036 9.125 6.292 1.00 45.43 H new ATOM 0 HB2 GLU A 153 -1.006 11.905 6.911 1.00 54.03 H new ATOM 0 HB3 GLU A 153 -0.636 10.618 8.041 1.00 54.03 H new ATOM 0 HG2 GLU A 153 1.775 11.080 6.650 1.00 51.41 H new ATOM 0 HG3 GLU A 153 1.106 12.674 6.940 1.00 51.41 H new ATOM 2388 N ASP A 154 -2.473 10.562 4.765 1.00 4.31 N ATOM 2389 CA ASP A 154 -3.872 10.400 4.385 1.00 74.32 C ATOM 2390 C ASP A 154 -4.126 9.003 3.827 1.00 62.23 C ATOM 2391 O ASP A 154 -5.028 8.298 4.279 1.00 33.20 O ATOM 2392 CB ASP A 154 -4.266 11.456 3.350 1.00 21.31 C ATOM 2393 CG ASP A 154 -5.564 12.157 3.703 1.00 52.14 C ATOM 2394 OD1 ASP A 154 -6.376 11.564 4.444 1.00 31.24 O ATOM 2395 OD2 ASP A 154 -5.768 13.298 3.239 1.00 11.32 O ATOM 0 H ASP A 154 -1.988 11.316 4.278 1.00 4.31 H new ATOM 0 HA ASP A 154 -4.483 10.531 5.278 1.00 74.32 H new ATOM 0 HB2 ASP A 154 -3.469 12.194 3.267 1.00 21.31 H new ATOM 0 HB3 ASP A 154 -4.366 10.983 2.373 1.00 21.31 H new ATOM 2400 N ALA A 155 -3.325 8.610 2.840 1.00 72.24 N ATOM 2401 CA ALA A 155 -3.461 7.298 2.216 1.00 2.33 C ATOM 2402 C ALA A 155 -3.493 6.185 3.260 1.00 72.10 C ATOM 2403 O ALA A 155 -4.398 5.351 3.265 1.00 33.32 O ATOM 2404 CB ALA A 155 -2.325 7.067 1.229 1.00 42.01 C ATOM 0 H ALA A 155 -2.574 9.183 2.455 1.00 72.24 H new ATOM 0 HA ALA A 155 -4.409 7.277 1.679 1.00 2.33 H new ATOM 0 HB1 ALA A 155 -2.436 6.085 0.769 1.00 42.01 H new ATOM 0 HB2 ALA A 155 -2.353 7.835 0.456 1.00 42.01 H new ATOM 0 HB3 ALA A 155 -1.371 7.116 1.754 1.00 42.01 H new ATOM 2410 N PHE A 156 -2.498 6.178 4.142 1.00 33.20 N ATOM 2411 CA PHE A 156 -2.412 5.166 5.189 1.00 20.14 C ATOM 2412 C PHE A 156 -3.649 5.196 6.081 1.00 42.55 C ATOM 2413 O PHE A 156 -4.283 4.167 6.314 1.00 11.04 O ATOM 2414 CB PHE A 156 -1.155 5.383 6.033 1.00 11.13 C ATOM 2415 CG PHE A 156 0.078 4.771 5.433 1.00 65.12 C ATOM 2416 CD1 PHE A 156 0.270 3.400 5.465 1.00 71.12 C ATOM 2417 CD2 PHE A 156 1.040 5.567 4.834 1.00 43.31 C ATOM 2418 CE1 PHE A 156 1.402 2.832 4.911 1.00 34.01 C ATOM 2419 CE2 PHE A 156 2.174 5.005 4.277 1.00 72.12 C ATOM 2420 CZ PHE A 156 2.355 3.636 4.316 1.00 34.32 C ATOM 0 H PHE A 156 -1.741 6.861 4.152 1.00 33.20 H new ATOM 0 HA PHE A 156 -2.357 4.188 4.710 1.00 20.14 H new ATOM 0 HB2 PHE A 156 -0.994 6.453 6.164 1.00 11.13 H new ATOM 0 HB3 PHE A 156 -1.315 4.961 7.025 1.00 11.13 H new ATOM 0 HD1 PHE A 156 -0.473 2.767 5.928 1.00 71.12 H new ATOM 0 HD2 PHE A 156 0.903 6.638 4.802 1.00 43.31 H new ATOM 0 HE1 PHE A 156 1.541 1.761 4.943 1.00 34.01 H new ATOM 0 HE2 PHE A 156 2.917 5.636 3.812 1.00 72.12 H new ATOM 0 HZ PHE A 156 3.240 3.195 3.882 1.00 34.32 H new ATOM 2430 N TYR A 157 -3.986 6.382 6.577 1.00 74.41 N ATOM 2431 CA TYR A 157 -5.148 6.548 7.444 1.00 53.31 C ATOM 2432 C TYR A 157 -6.411 6.017 6.772 1.00 1.34 C ATOM 2433 O TYR A 157 -7.318 5.519 7.440 1.00 72.32 O ATOM 2434 CB TYR A 157 -5.332 8.022 7.811 1.00 22.25 C ATOM 2435 CG TYR A 157 -4.250 8.563 8.718 1.00 15.43 C ATOM 2436 CD1 TYR A 157 -3.762 7.809 9.779 1.00 13.01 C ATOM 2437 CD2 TYR A 157 -3.715 9.829 8.514 1.00 23.11 C ATOM 2438 CE1 TYR A 157 -2.774 8.302 10.609 1.00 45.14 C ATOM 2439 CE2 TYR A 157 -2.726 10.329 9.340 1.00 54.45 C ATOM 2440 CZ TYR A 157 -2.259 9.561 10.386 1.00 33.43 C ATOM 2441 OH TYR A 157 -1.274 10.055 11.210 1.00 0.35 O ATOM 0 H TYR A 157 -3.471 7.243 6.394 1.00 74.41 H new ATOM 0 HA TYR A 157 -4.974 5.974 8.354 1.00 53.31 H new ATOM 0 HB2 TYR A 157 -5.357 8.614 6.896 1.00 22.25 H new ATOM 0 HB3 TYR A 157 -6.299 8.148 8.299 1.00 22.25 H new ATOM 0 HD1 TYR A 157 -4.162 6.822 9.957 1.00 13.01 H new ATOM 0 HD2 TYR A 157 -4.078 10.433 7.696 1.00 23.11 H new ATOM 0 HE1 TYR A 157 -2.407 7.703 11.429 1.00 45.14 H new ATOM 0 HE2 TYR A 157 -2.321 11.315 9.167 1.00 54.45 H new ATOM 0 HH TYR A 157 -1.021 10.955 10.915 1.00 0.35 H new ATOM 2451 N THR A 158 -6.463 6.124 5.448 1.00 43.13 N ATOM 2452 CA THR A 158 -7.611 5.654 4.686 1.00 64.25 C ATOM 2453 C THR A 158 -7.848 4.165 4.918 1.00 12.23 C ATOM 2454 O THR A 158 -8.982 3.730 5.114 1.00 13.30 O ATOM 2455 CB THR A 158 -7.398 5.922 3.197 1.00 12.42 C ATOM 2456 OG1 THR A 158 -6.846 7.211 2.993 1.00 45.13 O ATOM 2457 CG2 THR A 158 -8.670 5.835 2.387 1.00 42.31 C ATOM 0 H THR A 158 -5.721 6.533 4.881 1.00 43.13 H new ATOM 0 HA THR A 158 -8.492 6.199 5.027 1.00 64.25 H new ATOM 0 HB THR A 158 -6.716 5.142 2.858 1.00 12.42 H new ATOM 0 HG1 THR A 158 -5.894 7.200 3.226 1.00 45.13 H new ATOM 0 HG21 THR A 158 -8.448 6.036 1.339 1.00 42.31 H new ATOM 0 HG22 THR A 158 -9.095 4.836 2.483 1.00 42.31 H new ATOM 0 HG23 THR A 158 -9.386 6.571 2.754 1.00 42.31 H new ATOM 2465 N LEU A 159 -6.769 3.389 4.892 1.00 30.51 N ATOM 2466 CA LEU A 159 -6.859 1.949 5.097 1.00 53.31 C ATOM 2467 C LEU A 159 -7.436 1.626 6.472 1.00 33.22 C ATOM 2468 O LEU A 159 -8.256 0.718 6.613 1.00 12.22 O ATOM 2469 CB LEU A 159 -5.481 1.303 4.947 1.00 5.21 C ATOM 2470 CG LEU A 159 -5.464 -0.221 5.069 1.00 3.35 C ATOM 2471 CD1 LEU A 159 -6.446 -0.846 4.091 1.00 44.43 C ATOM 2472 CD2 LEU A 159 -4.061 -0.759 4.835 1.00 42.51 C ATOM 0 H LEU A 159 -5.823 3.734 4.731 1.00 30.51 H new ATOM 0 HA LEU A 159 -7.529 1.544 4.338 1.00 53.31 H new ATOM 0 HB2 LEU A 159 -5.071 1.579 3.976 1.00 5.21 H new ATOM 0 HB3 LEU A 159 -4.817 1.720 5.704 1.00 5.21 H new ATOM 0 HG LEU A 159 -5.770 -0.488 6.080 1.00 3.35 H new ATOM 0 HD11 LEU A 159 -6.420 -1.931 4.192 1.00 44.43 H new ATOM 0 HD12 LEU A 159 -7.452 -0.486 4.305 1.00 44.43 H new ATOM 0 HD13 LEU A 159 -6.171 -0.570 3.073 1.00 44.43 H new ATOM 0 HD21 LEU A 159 -4.068 -1.845 4.926 1.00 42.51 H new ATOM 0 HD22 LEU A 159 -3.727 -0.481 3.836 1.00 42.51 H new ATOM 0 HD23 LEU A 159 -3.381 -0.337 5.576 1.00 42.51 H new ATOM 2484 N VAL A 160 -7.005 2.373 7.483 1.00 45.02 N ATOM 2485 CA VAL A 160 -7.480 2.165 8.845 1.00 11.42 C ATOM 2486 C VAL A 160 -9.004 2.223 8.910 1.00 43.11 C ATOM 2487 O VAL A 160 -9.639 1.399 9.568 1.00 24.13 O ATOM 2488 CB VAL A 160 -6.891 3.216 9.808 1.00 71.21 C ATOM 2489 CG1 VAL A 160 -7.370 2.970 11.230 1.00 12.51 C ATOM 2490 CG2 VAL A 160 -5.371 3.209 9.743 1.00 41.11 C ATOM 0 H VAL A 160 -6.327 3.128 7.384 1.00 45.02 H new ATOM 0 HA VAL A 160 -7.146 1.174 9.153 1.00 11.42 H new ATOM 0 HB VAL A 160 -7.242 4.200 9.497 1.00 71.21 H new ATOM 0 HG11 VAL A 160 -6.943 3.722 11.893 1.00 12.51 H new ATOM 0 HG12 VAL A 160 -8.458 3.032 11.263 1.00 12.51 H new ATOM 0 HG13 VAL A 160 -7.053 1.979 11.554 1.00 12.51 H new ATOM 0 HG21 VAL A 160 -4.974 3.957 10.429 1.00 41.11 H new ATOM 0 HG22 VAL A 160 -4.999 2.224 10.025 1.00 41.11 H new ATOM 0 HG23 VAL A 160 -5.049 3.441 8.728 1.00 41.11 H new ATOM 2500 N ARG A 161 -9.583 3.201 8.222 1.00 61.42 N ATOM 2501 CA ARG A 161 -11.032 3.366 8.201 1.00 65.23 C ATOM 2502 C ARG A 161 -11.696 2.248 7.401 1.00 72.14 C ATOM 2503 O ARG A 161 -12.851 1.900 7.644 1.00 52.33 O ATOM 2504 CB ARG A 161 -11.404 4.725 7.605 1.00 24.33 C ATOM 2505 CG ARG A 161 -10.702 5.896 8.275 1.00 25.01 C ATOM 2506 CD ARG A 161 -10.477 7.042 7.300 1.00 74.50 C ATOM 2507 NE ARG A 161 -9.527 8.024 7.819 1.00 42.43 N ATOM 2508 CZ ARG A 161 -9.849 8.981 8.686 1.00 73.32 C ATOM 2509 NH1 ARG A 161 -11.093 9.087 9.139 1.00 62.42 N ATOM 2510 NH2 ARG A 161 -8.924 9.835 9.104 1.00 1.10 N ATOM 0 H ARG A 161 -9.072 3.891 7.672 1.00 61.42 H new ATOM 0 HA ARG A 161 -11.392 3.317 9.229 1.00 65.23 H new ATOM 0 HB2 ARG A 161 -11.160 4.726 6.543 1.00 24.33 H new ATOM 0 HB3 ARG A 161 -12.482 4.865 7.685 1.00 24.33 H new ATOM 0 HG2 ARG A 161 -11.298 6.245 9.118 1.00 25.01 H new ATOM 0 HG3 ARG A 161 -9.744 5.566 8.677 1.00 25.01 H new ATOM 0 HD2 ARG A 161 -10.108 6.646 6.354 1.00 74.50 H new ATOM 0 HD3 ARG A 161 -11.428 7.532 7.091 1.00 74.50 H new ATOM 0 HE ARG A 161 -8.560 7.973 7.498 1.00 42.43 H new ATOM 0 HH11 ARG A 161 -11.808 8.433 8.823 1.00 62.42 H new ATOM 0 HH12 ARG A 161 -11.333 9.823 9.803 1.00 62.42 H new ATOM 0 HH21 ARG A 161 -7.967 9.758 8.761 1.00 1.10 H new ATOM 0 HH22 ARG A 161 -9.170 10.569 9.768 1.00 1.10 H new ATOM 2524 N GLU A 162 -10.959 1.690 6.445 1.00 63.24 N ATOM 2525 CA GLU A 162 -11.478 0.614 5.609 1.00 64.11 C ATOM 2526 C GLU A 162 -11.510 -0.708 6.371 1.00 4.12 C ATOM 2527 O GLU A 162 -12.516 -1.417 6.360 1.00 50.43 O ATOM 2528 CB GLU A 162 -10.629 0.467 4.344 1.00 4.34 C ATOM 2529 CG GLU A 162 -11.448 0.222 3.088 1.00 60.33 C ATOM 2530 CD GLU A 162 -12.399 1.362 2.780 1.00 45.41 C ATOM 2531 OE1 GLU A 162 -12.169 2.480 3.286 1.00 51.55 O ATOM 2532 OE2 GLU A 162 -13.374 1.136 2.033 1.00 52.04 O ATOM 0 H GLU A 162 -10.001 1.966 6.231 1.00 63.24 H new ATOM 0 HA GLU A 162 -12.499 0.871 5.327 1.00 64.11 H new ATOM 0 HB2 GLU A 162 -10.033 1.370 4.209 1.00 4.34 H new ATOM 0 HB3 GLU A 162 -9.930 -0.359 4.479 1.00 4.34 H new ATOM 0 HG2 GLU A 162 -10.775 0.077 2.243 1.00 60.33 H new ATOM 0 HG3 GLU A 162 -12.018 -0.700 3.204 1.00 60.33 H new ATOM 2539 N ILE A 163 -10.403 -1.036 7.031 1.00 2.25 N ATOM 2540 CA ILE A 163 -10.305 -2.269 7.792 1.00 54.44 C ATOM 2541 C ILE A 163 -11.308 -2.289 8.942 1.00 22.24 C ATOM 2542 O ILE A 163 -11.902 -3.324 9.242 1.00 21.02 O ATOM 2543 CB ILE A 163 -8.888 -2.456 8.348 1.00 12.25 C ATOM 2544 CG1 ILE A 163 -7.879 -2.442 7.206 1.00 72.41 C ATOM 2545 CG2 ILE A 163 -8.791 -3.757 9.124 1.00 24.04 C ATOM 2546 CD1 ILE A 163 -6.461 -2.258 7.673 1.00 1.22 C ATOM 0 H ILE A 163 -9.561 -0.461 7.052 1.00 2.25 H new ATOM 0 HA ILE A 163 -10.534 -3.089 7.112 1.00 54.44 H new ATOM 0 HB ILE A 163 -8.664 -1.634 9.028 1.00 12.25 H new ATOM 0 HG12 ILE A 163 -7.954 -3.377 6.652 1.00 72.41 H new ATOM 0 HG13 ILE A 163 -8.134 -1.640 6.514 1.00 72.41 H new ATOM 0 HG21 ILE A 163 -7.779 -3.875 9.512 1.00 24.04 H new ATOM 0 HG22 ILE A 163 -9.498 -3.739 9.954 1.00 24.04 H new ATOM 0 HG23 ILE A 163 -9.026 -4.592 8.465 1.00 24.04 H new ATOM 0 HD11 ILE A 163 -5.792 -2.257 6.813 1.00 1.22 H new ATOM 0 HD12 ILE A 163 -6.373 -1.309 8.203 1.00 1.22 H new ATOM 0 HD13 ILE A 163 -6.190 -3.074 8.343 1.00 1.22 H new ATOM 2558 N ARG A 164 -11.488 -1.138 9.581 1.00 35.23 N ATOM 2559 CA ARG A 164 -12.417 -1.021 10.698 1.00 74.13 C ATOM 2560 C ARG A 164 -13.861 -1.082 10.213 1.00 60.12 C ATOM 2561 O ARG A 164 -14.677 -1.830 10.753 1.00 2.43 O ATOM 2562 CB ARG A 164 -12.176 0.288 11.453 1.00 70.21 C ATOM 2563 CG ARG A 164 -11.230 0.144 12.635 1.00 42.31 C ATOM 2564 CD ARG A 164 -11.588 1.105 13.758 1.00 53.14 C ATOM 2565 NE ARG A 164 -11.762 0.414 15.034 1.00 51.30 N ATOM 2566 CZ ARG A 164 -12.856 -0.269 15.364 1.00 50.22 C ATOM 2567 NH1 ARG A 164 -13.874 -0.355 14.516 1.00 41.23 N ATOM 2568 NH2 ARG A 164 -12.932 -0.868 16.544 1.00 20.31 N ATOM 0 H ARG A 164 -11.002 -0.273 9.344 1.00 35.23 H new ATOM 0 HA ARG A 164 -12.243 -1.860 11.372 1.00 74.13 H new ATOM 0 HB2 ARG A 164 -11.771 1.027 10.762 1.00 70.21 H new ATOM 0 HB3 ARG A 164 -13.131 0.674 11.808 1.00 70.21 H new ATOM 0 HG2 ARG A 164 -11.264 -0.880 13.007 1.00 42.31 H new ATOM 0 HG3 ARG A 164 -10.207 0.330 12.308 1.00 42.31 H new ATOM 0 HD2 ARG A 164 -10.804 1.856 13.856 1.00 53.14 H new ATOM 0 HD3 ARG A 164 -12.506 1.634 13.504 1.00 53.14 H new ATOM 0 HE ARG A 164 -11.001 0.458 15.711 1.00 51.30 H new ATOM 0 HH11 ARG A 164 -13.820 0.104 13.606 1.00 41.23 H new ATOM 0 HH12 ARG A 164 -14.710 -0.880 14.774 1.00 41.23 H new ATOM 0 HH21 ARG A 164 -12.152 -0.806 17.199 1.00 20.31 H new ATOM 0 HH22 ARG A 164 -13.770 -1.391 16.797 1.00 20.31 H new ATOM 2582 N GLN A 165 -14.170 -0.291 9.190 1.00 14.20 N ATOM 2583 CA GLN A 165 -15.516 -0.254 8.629 1.00 53.31 C ATOM 2584 C GLN A 165 -15.964 -1.645 8.189 1.00 11.02 C ATOM 2585 O GLN A 165 -17.154 -1.958 8.203 1.00 41.41 O ATOM 2586 CB GLN A 165 -15.569 0.711 7.444 1.00 14.13 C ATOM 2587 CG GLN A 165 -15.883 2.144 7.840 1.00 31.43 C ATOM 2588 CD GLN A 165 -16.814 2.829 6.858 1.00 0.13 C ATOM 2589 OE1 GLN A 165 -17.953 3.156 7.189 1.00 43.22 O ATOM 2590 NE2 GLN A 165 -16.330 3.050 5.641 1.00 12.12 N ATOM 0 H GLN A 165 -13.506 0.333 8.732 1.00 14.20 H new ATOM 0 HA GLN A 165 -16.196 0.096 9.406 1.00 53.31 H new ATOM 0 HB2 GLN A 165 -14.611 0.688 6.924 1.00 14.13 H new ATOM 0 HB3 GLN A 165 -16.323 0.365 6.737 1.00 14.13 H new ATOM 0 HG2 GLN A 165 -16.336 2.152 8.831 1.00 31.43 H new ATOM 0 HG3 GLN A 165 -14.954 2.710 7.910 1.00 31.43 H new ATOM 0 HE21 GLN A 165 -15.379 2.762 5.410 1.00 12.12 H new ATOM 0 HE22 GLN A 165 -16.909 3.508 4.937 1.00 12.12 H new ATOM 2599 N HIS A 166 -15.002 -2.475 7.799 1.00 61.33 N ATOM 2600 CA HIS A 166 -15.298 -3.833 7.355 1.00 55.32 C ATOM 2601 C HIS A 166 -14.793 -4.857 8.366 1.00 13.43 C ATOM 2602 O HIS A 166 -14.710 -4.514 9.564 1.00 54.22 O ATOM 2603 CB HIS A 166 -14.667 -4.094 5.986 1.00 12.13 C ATOM 2604 CG HIS A 166 -15.557 -4.854 5.053 1.00 75.02 C ATOM 2605 ND1 HIS A 166 -16.668 -4.300 4.453 1.00 42.32 N ATOM 2606 CD2 HIS A 166 -15.497 -6.135 4.618 1.00 11.03 C ATOM 2607 CE1 HIS A 166 -17.252 -5.206 3.690 1.00 4.15 C ATOM 2608 NE2 HIS A 166 -16.561 -6.328 3.773 1.00 1.11 N ATOM 2609 OXT HIS A 166 -14.486 -5.995 7.952 1.00 20.53 O ATOM 0 H HIS A 166 -14.012 -2.232 7.781 1.00 61.33 H new ATOM 0 HA HIS A 166 -16.380 -3.934 7.272 1.00 55.32 H new ATOM 0 HB2 HIS A 166 -14.404 -3.140 5.528 1.00 12.13 H new ATOM 0 HB3 HIS A 166 -13.739 -4.649 6.123 1.00 12.13 H new ATOM 0 HD2 HIS A 166 -14.751 -6.868 4.886 1.00 11.03 H new ATOM 0 HE1 HIS A 166 -18.143 -5.055 3.099 1.00 4.15 H new ATOM 0 HE2 HIS A 166 -16.782 -7.197 3.288 1.00 1.11 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 201 13.790 -1.441 -4.274 1.00 2.33 P HETATM 2620 O1G GNP A 201 15.133 -2.218 -3.844 1.00 60.11 O HETATM 2621 O2G GNP A 201 12.611 -2.063 -3.373 1.00 24.45 O HETATM 2622 O3G GNP A 201 13.514 -1.533 -5.725 1.00 24.20 O HETATM 2623 N3B GNP A 201 13.978 0.087 -3.765 1.00 54.23 N HETATM 2624 PB GNP A 201 12.864 1.027 -4.475 1.00 63.42 P HETATM 2625 O1B GNP A 201 12.918 0.759 -5.930 1.00 14.00 O HETATM 2626 O2B GNP A 201 11.575 0.841 -3.772 1.00 64.35 O HETATM 2627 O3A GNP A 201 13.412 2.513 -4.189 1.00 3.22 O HETATM 2628 PA GNP A 201 14.583 3.135 -5.103 1.00 4.01 P HETATM 2629 O1A GNP A 201 15.695 2.161 -5.171 1.00 1.15 O HETATM 2630 O2A GNP A 201 14.868 4.492 -4.585 1.00 3.21 O HETATM 2631 O5' GNP A 201 13.880 3.237 -6.548 1.00 62.54 O HETATM 2632 C5' GNP A 201 12.931 4.268 -6.834 1.00 62.55 C HETATM 2633 C4' GNP A 201 13.611 5.530 -7.372 1.00 51.22 C HETATM 2634 O4' GNP A 201 12.616 6.555 -7.543 1.00 30.54 O HETATM 2635 C3' GNP A 201 14.562 6.098 -6.319 1.00 11.23 C HETATM 2636 O3' GNP A 201 15.366 7.142 -6.876 1.00 43.30 O HETATM 2637 C2' GNP A 201 13.523 6.671 -5.360 1.00 23.21 C HETATM 2638 O2' GNP A 201 14.144 7.610 -4.478 1.00 20.04 O HETATM 2639 C1' GNP A 201 12.665 7.411 -6.386 1.00 0.41 C HETATM 2640 N9 GNP A 201 11.313 7.676 -5.845 1.00 55.51 N HETATM 2641 C8 GNP A 201 10.601 6.847 -5.085 1.00 23.40 C HETATM 2642 N7 GNP A 201 9.434 7.412 -4.787 1.00 3.01 N HETATM 2643 C5 GNP A 201 9.399 8.611 -5.359 1.00 22.14 C HETATM 2644 C6 GNP A 201 8.445 9.621 -5.387 1.00 34.15 C HETATM 2645 O6 GNP A 201 7.375 9.490 -4.794 1.00 74.33 O HETATM 2646 N1 GNP A 201 8.726 10.790 -6.102 1.00 34.22 N HETATM 2647 C2 GNP A 201 9.954 10.908 -6.766 1.00 44.21 C HETATM 2648 N2 GNP A 201 10.233 12.015 -7.449 1.00 5.51 N HETATM 2649 N3 GNP A 201 10.849 9.911 -6.716 1.00 71.31 N HETATM 2650 C4 GNP A 201 10.600 8.782 -6.036 1.00 74.35 C HETATM 0 HO3' GNP A 201 15.369 7.912 -6.269 1.00 43.30 H new HETATM 0 HO2' GNP A 201 13.457 8.065 -3.948 1.00 20.04 H new HETATM 0 HNB3 GNP A 201 14.685 0.406 -3.103 1.00 54.23 H new HETATM 0 HN22 GNP A 201 11.126 12.104 -7.933 1.00 5.51 H new HETATM 0 HN21 GNP A 201 9.554 12.775 -7.488 1.00 5.51 H new HETATM 0 H5'2 GNP A 201 12.375 4.512 -5.929 1.00 62.55 H new HETATM 0 H5'1 GNP A 201 12.208 3.905 -7.564 1.00 62.55 H new HETATM 0 HN1 GNP A 201 8.045 11.548 -6.140 1.00 34.22 H new HETATM 0 H8 GNP A 201 10.924 5.859 -4.758 1.00 23.40 H new HETATM 0 H4' GNP A 201 14.126 5.269 -8.297 1.00 51.22 H new HETATM 0 H3' GNP A 201 15.273 5.394 -5.887 1.00 11.23 H new HETATM 0 H2' GNP A 201 13.005 5.956 -4.721 1.00 23.21 H new HETATM 0 H1' GNP A 201 13.083 8.385 -6.639 1.00 0.41 H new HETATM 2664 MG MG A 202 11.346 -0.879 -2.248 1.00 54.43 MG HETATM 2665 C13 KOB A 203 6.145 -14.011 8.258 1.00 41.12 C HETATM 2666 C12 KOB A 203 5.502 -13.042 9.019 1.00 10.11 C HETATM 2667 C11 KOB A 203 4.588 -12.184 8.419 1.00 41.51 C HETATM 2668 F11 KOB A 203 3.965 -11.240 9.153 1.00 31.44 F HETATM 2669 C10 KOB A 203 4.318 -12.298 7.060 1.00 24.12 C HETATM 2670 C9 KOB A 203 4.961 -13.269 6.299 1.00 31.13 C HETATM 2671 C8 KOB A 203 5.877 -14.126 6.898 1.00 41.54 C HETATM 2672 N8 KOB A 203 6.499 -15.071 6.197 1.00 10.34 N HETATM 2673 C7 KOB A 203 6.294 -15.232 4.892 1.00 72.42 C HETATM 2674 S7 KOB A 203 5.220 -14.176 4.001 1.00 65.30 S HETATM 2675 N7 KOB A 203 6.939 -16.198 4.244 1.00 1.22 N HETATM 2676 N6 KOB A 203 7.717 -16.935 4.847 1.00 21.43 N HETATM 2677 C6 KOB A 203 7.270 -18.044 5.429 1.00 71.13 C HETATM 2678 C5 KOB A 203 5.920 -18.370 5.358 1.00 21.12 C HETATM 2679 C4 KOB A 203 5.461 -19.536 5.959 1.00 60.32 C HETATM 2680 C3 KOB A 203 6.347 -20.373 6.628 1.00 4.32 C HETATM 2681 N3 KOB A 203 5.904 -21.493 7.193 1.00 3.04 N HETATM 2682 O3B KOB A 203 6.808 -22.352 7.874 1.00 40.42 O HETATM 2683 O3A KOB A 203 4.526 -21.832 7.112 1.00 34.45 O HETATM 2684 C2 KOB A 203 7.696 -20.045 6.703 1.00 63.25 C HETATM 2685 C1 KOB A 203 8.155 -18.879 6.102 1.00 55.05 C HETATM 2686 N1 KOB A 203 9.446 -18.565 6.176 1.00 23.51 N HETATM 2687 O1B KOB A 203 9.929 -17.377 5.563 1.00 74.32 O HETATM 2688 O1A KOB A 203 10.344 -19.422 6.867 1.00 22.23 O HETATM 0 HE2 KOB A 203 5.714 -12.955 10.085 1.00 10.11 H new HETATM 0 HE1 KOB A 203 3.601 -11.625 6.590 1.00 24.12 H new HETATM 0 HD2 KOB A 203 6.862 -14.683 8.729 1.00 41.12 H new HETATM 0 HD1 KOB A 203 4.747 -13.358 5.234 1.00 31.13 H new HETATM 0 HAD KOB A 203 7.153 -15.691 6.675 1.00 10.34 H new HETATM 0 HAC KOB A 203 6.788 -16.328 3.244 1.00 1.22 H new HETATM 0 HAB KOB A 203 8.707 -16.695 4.901 1.00 21.43 H new HETATM 0 H5 KOB A 203 5.225 -17.714 4.833 1.00 21.12 H new HETATM 0 H4 KOB A 203 4.404 -19.795 5.906 1.00 60.32 H new HETATM 0 H2 KOB A 203 8.390 -20.699 7.231 1.00 63.25 H new HETATM 2699 O HOH A 301 13.095 -0.223 -0.916 1.00 34.42 O HETATM 2702 O HOH A 302 9.517 -1.176 -3.530 1.00 61.12 O HETATM 2705 O HOH A 303 10.901 -2.397 -0.669 1.00 45.50 O