USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 957 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 84 SER OG : rot -82:sc= 1.23 USER MOD Set 1.2: A 123 TYR OH : rot 30:sc= 1.13 USER MOD Set 2.1: A 71 ASN : amide:sc= 0.724 K(o=2.5,f=1.3) USER MOD Set 2.2: A 101 GLN : amide:sc= 1.81 K(o=2.5,f=1.3) USER MOD Set 3.1: A 37 LYS NZ :NH3+ 167:sc= 0.431 (180deg=0) USER MOD Set 3.2: A 68 GLN : amide:sc= -0.241 K(o=0.19,f=-6.4!) USER MOD Set 4.1: A 25 ASN : amide:sc= -0.087 X(o=0.28,f=0.44) USER MOD Set 4.2: A 31 SER OG : rot 86:sc= 0.368 USER MOD Set 5.1: A 17 THR OG1 : rot 180:sc= 0.75 USER MOD Set 5.2: A 114 THR OG1 : rot -116:sc= 0.852 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= -0.356 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot -95:sc= 1.19 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 165:sc=-0.00837 (180deg=-0.186) USER MOD Single : A 20 MET CE :methyl 165:sc= 0 (180deg=-0.0828) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 76:sc= 1.2 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 86:sc= 0.886 USER MOD Single : A 47 MET CE :methyl -166:sc= -0.345 (180deg=-0.595) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -65:sc= 0.075 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.0824 K(o=-0.082,f=-2.4!) USER MOD Single : A 59 GLN :FLIP amide:sc= -0.17 F(o=-2,f=-0.17) USER MOD Single : A 61 ASN :FLIP amide:sc= -0.248 F(o=-1.5,f=-0.25) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.618 K(o=0.62,f=-1.1) USER MOD Single : A 76 ASN : amide:sc= 1.07 K(o=1.1,f=-0.0074) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.0601 USER MOD Single : A 96 LYS NZ :NH3+ -167:sc= 0.882 (180deg=0.743) USER MOD Single : A 97 THR OG1 : rot -66:sc= 0.706 USER MOD Single : A 102 MET CE :methyl 168:sc= -0.0181 (180deg=-0.169) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN :FLIP amide:sc= 0 F(o=-0.61,f=0) USER MOD Single : A 105 TYR OH : rot 156:sc= 1.2 USER MOD Single : A 111 SER OG : rot -178:sc= 1.81 USER MOD Single : A 115 SER OG : rot 180:sc= -0.617 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN :FLIP amide:sc= -0.807 F(o=-1.6!,f=-0.81) USER MOD Single : A 120 HIS : no HD1:sc= -0.261 K(o=-0.26,f=-1.1) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= -0.36 K(o=-0.36,f=-3.5!) USER MOD Single : A 128 ASN : amide:sc= 0.48 K(o=0.48,f=-0.039) USER MOD Single : A 135 ASN : amide:sc= -0.011 X(o=-0.011,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 173:sc= 0.77 (180deg=0.666) USER MOD Single : A 150 SER OG : rot -25:sc= 0.556 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 33 N LYS A 4 -5.718 -17.527 -2.973 1.00 13.43 N ATOM 34 CA LYS A 4 -4.899 -16.665 -2.111 1.00 31.34 C ATOM 35 C LYS A 4 -3.825 -15.986 -2.955 1.00 65.42 C ATOM 36 O LYS A 4 -3.208 -16.655 -3.791 1.00 10.31 O ATOM 37 CB LYS A 4 -4.324 -17.421 -0.895 1.00 12.03 C ATOM 38 CG LYS A 4 -3.286 -18.535 -1.140 1.00 24.23 C ATOM 39 CD LYS A 4 -3.851 -19.782 -1.837 1.00 71.22 C ATOM 40 CE LYS A 4 -3.595 -19.791 -3.349 1.00 25.45 C ATOM 41 NZ LYS A 4 -2.367 -20.522 -3.711 1.00 34.24 N ATOM 0 HA LYS A 4 -5.535 -15.891 -1.680 1.00 31.34 H new ATOM 0 HB2 LYS A 4 -3.869 -16.685 -0.233 1.00 12.03 H new ATOM 0 HB3 LYS A 4 -5.161 -17.862 -0.354 1.00 12.03 H new ATOM 0 HG2 LYS A 4 -2.473 -18.132 -1.744 1.00 24.23 H new ATOM 0 HG3 LYS A 4 -2.855 -18.831 -0.184 1.00 24.23 H new ATOM 0 HD2 LYS A 4 -3.406 -20.673 -1.393 1.00 71.22 H new ATOM 0 HD3 LYS A 4 -4.924 -19.838 -1.655 1.00 71.22 H new ATOM 0 HE2 LYS A 4 -4.447 -20.245 -3.855 1.00 25.45 H new ATOM 0 HE3 LYS A 4 -3.521 -18.764 -3.708 1.00 25.45 H new ATOM 0 HZ1 LYS A 4 -2.240 -20.498 -4.743 1.00 34.24 H new ATOM 0 HZ2 LYS A 4 -1.548 -20.075 -3.251 1.00 34.24 H new ATOM 0 HZ3 LYS A 4 -2.445 -21.510 -3.395 1.00 34.24 H new ATOM 51 N LYS A 5 -3.595 -14.682 -2.783 1.00 74.43 N ATOM 52 CA LYS A 5 -2.599 -13.930 -3.548 1.00 1.12 C ATOM 53 C LYS A 5 -2.086 -12.754 -2.746 1.00 65.52 C ATOM 54 O LYS A 5 -2.706 -12.349 -1.765 1.00 25.45 O ATOM 55 CB LYS A 5 -3.173 -13.316 -4.834 1.00 13.03 C ATOM 56 CG LYS A 5 -4.021 -14.209 -5.718 1.00 11.21 C ATOM 57 CD LYS A 5 -4.323 -13.449 -7.015 1.00 21.23 C ATOM 58 CE LYS A 5 -5.343 -14.201 -7.854 1.00 52.13 C ATOM 59 NZ LYS A 5 -5.545 -13.549 -9.160 1.00 41.32 N ATOM 0 H LYS A 5 -4.100 -14.114 -2.103 1.00 74.43 H new ATOM 0 HA LYS A 5 -1.819 -14.654 -3.783 1.00 1.12 H new ATOM 0 HB2 LYS A 5 -3.774 -12.451 -4.554 1.00 13.03 H new ATOM 0 HB3 LYS A 5 -2.340 -12.946 -5.431 1.00 13.03 H new ATOM 0 HG2 LYS A 5 -3.495 -15.139 -5.936 1.00 11.21 H new ATOM 0 HG3 LYS A 5 -4.947 -14.478 -5.210 1.00 11.21 H new ATOM 0 HD2 LYS A 5 -4.701 -12.454 -6.780 1.00 21.23 H new ATOM 0 HD3 LYS A 5 -3.404 -13.314 -7.586 1.00 21.23 H new ATOM 0 HE2 LYS A 5 -5.008 -15.227 -8.005 1.00 52.13 H new ATOM 0 HE3 LYS A 5 -6.291 -14.251 -7.319 1.00 52.13 H new ATOM 0 HZ1 LYS A 5 -6.246 -14.084 -9.711 1.00 41.32 H new ATOM 0 HZ2 LYS A 5 -5.888 -12.578 -9.014 1.00 41.32 H new ATOM 0 HZ3 LYS A 5 -4.644 -13.524 -9.679 1.00 41.32 H new ATOM 69 N THR A 6 -1.068 -12.113 -3.308 1.00 33.51 N ATOM 70 CA THR A 6 -0.467 -10.890 -2.812 1.00 70.52 C ATOM 71 C THR A 6 -0.242 -9.933 -3.982 1.00 63.30 C ATOM 72 O THR A 6 0.606 -10.166 -4.845 1.00 41.11 O ATOM 73 CB THR A 6 0.811 -11.244 -2.043 1.00 10.03 C ATOM 74 OG1 THR A 6 0.509 -12.235 -1.079 1.00 34.11 O ATOM 75 CG2 THR A 6 1.435 -10.031 -1.355 1.00 21.43 C ATOM 0 H THR A 6 -0.622 -12.451 -4.161 1.00 33.51 H new ATOM 0 HA THR A 6 -1.122 -10.372 -2.111 1.00 70.52 H new ATOM 0 HB THR A 6 1.541 -11.615 -2.763 1.00 10.03 H new ATOM 0 HG1 THR A 6 1.322 -12.468 -0.584 1.00 34.11 H new ATOM 0 HG21 THR A 6 2.337 -10.337 -0.825 1.00 21.43 H new ATOM 0 HG22 THR A 6 1.691 -9.280 -2.103 1.00 21.43 H new ATOM 0 HG23 THR A 6 0.723 -9.609 -0.646 1.00 21.43 H new ATOM 83 N LEU A 7 -1.038 -8.867 -4.053 1.00 4.42 N ATOM 84 CA LEU A 7 -0.683 -7.683 -4.846 1.00 70.11 C ATOM 85 C LEU A 7 0.181 -6.742 -4.002 1.00 62.43 C ATOM 86 O LEU A 7 0.008 -6.680 -2.783 1.00 52.34 O ATOM 87 CB LEU A 7 -1.969 -7.026 -5.342 1.00 44.31 C ATOM 88 CG LEU A 7 -1.772 -5.859 -6.328 1.00 53.14 C ATOM 89 CD1 LEU A 7 -0.835 -6.157 -7.508 1.00 14.21 C ATOM 90 CD2 LEU A 7 -3.149 -5.506 -6.905 1.00 50.02 C ATOM 0 H LEU A 7 -1.935 -8.796 -3.572 1.00 4.42 H new ATOM 0 HA LEU A 7 -0.091 -7.955 -5.720 1.00 70.11 H new ATOM 0 HB2 LEU A 7 -2.584 -7.786 -5.823 1.00 44.31 H new ATOM 0 HB3 LEU A 7 -2.528 -6.662 -4.480 1.00 44.31 H new ATOM 0 HG LEU A 7 -1.307 -5.051 -5.763 1.00 53.14 H new ATOM 0 HD11 LEU A 7 -0.760 -5.276 -8.145 1.00 14.21 H new ATOM 0 HD12 LEU A 7 0.154 -6.417 -7.131 1.00 14.21 H new ATOM 0 HD13 LEU A 7 -1.233 -6.990 -8.087 1.00 14.21 H new ATOM 0 HD21 LEU A 7 -3.048 -4.681 -7.610 1.00 50.02 H new ATOM 0 HD22 LEU A 7 -3.561 -6.374 -7.420 1.00 50.02 H new ATOM 0 HD23 LEU A 7 -3.818 -5.212 -6.096 1.00 50.02 H new ATOM 101 N ILE A 8 1.118 -6.037 -4.638 1.00 34.13 N ATOM 102 CA ILE A 8 2.004 -5.073 -4.014 1.00 44.40 C ATOM 103 C ILE A 8 1.906 -3.797 -4.847 1.00 43.30 C ATOM 104 O ILE A 8 2.122 -3.859 -6.057 1.00 45.00 O ATOM 105 CB ILE A 8 3.447 -5.628 -3.958 1.00 73.30 C ATOM 106 CG1 ILE A 8 3.506 -7.095 -3.459 1.00 5.21 C ATOM 107 CG2 ILE A 8 4.237 -4.690 -3.044 1.00 34.22 C ATOM 108 CD1 ILE A 8 4.922 -7.676 -3.344 1.00 1.41 C ATOM 0 H ILE A 8 1.281 -6.131 -5.641 1.00 34.13 H new ATOM 0 HA ILE A 8 1.721 -4.867 -2.982 1.00 44.40 H new ATOM 0 HB ILE A 8 3.876 -5.657 -4.960 1.00 73.30 H new ATOM 0 HG12 ILE A 8 3.024 -7.152 -2.483 1.00 5.21 H new ATOM 0 HG13 ILE A 8 2.926 -7.719 -4.138 1.00 5.21 H new ATOM 0 HG21 ILE A 8 5.267 -5.037 -2.969 1.00 34.22 H new ATOM 0 HG22 ILE A 8 4.223 -3.682 -3.458 1.00 34.22 H new ATOM 0 HG23 ILE A 8 3.784 -4.681 -2.053 1.00 34.22 H new ATOM 0 HD11 ILE A 8 4.865 -8.705 -2.988 1.00 1.41 H new ATOM 0 HD12 ILE A 8 5.404 -7.656 -4.321 1.00 1.41 H new ATOM 0 HD13 ILE A 8 5.504 -7.080 -2.640 1.00 1.41 H new ATOM 119 N LEU A 9 1.568 -2.660 -4.227 1.00 14.31 N ATOM 120 CA LEU A 9 1.315 -1.383 -4.893 1.00 63.11 C ATOM 121 C LEU A 9 1.921 -0.274 -4.049 1.00 61.40 C ATOM 122 O LEU A 9 1.368 0.107 -3.025 1.00 50.33 O ATOM 123 CB LEU A 9 -0.196 -1.155 -5.029 1.00 51.02 C ATOM 124 CG LEU A 9 -0.823 -1.942 -6.190 1.00 21.34 C ATOM 125 CD1 LEU A 9 -2.262 -2.321 -5.850 1.00 71.30 C ATOM 126 CD2 LEU A 9 -0.783 -1.117 -7.479 1.00 23.41 C ATOM 0 H LEU A 9 1.460 -2.605 -3.214 1.00 14.31 H new ATOM 0 HA LEU A 9 1.761 -1.388 -5.888 1.00 63.11 H new ATOM 0 HB2 LEU A 9 -0.686 -1.441 -4.098 1.00 51.02 H new ATOM 0 HB3 LEU A 9 -0.385 -0.092 -5.175 1.00 51.02 H new ATOM 0 HG LEU A 9 -0.246 -2.853 -6.345 1.00 21.34 H new ATOM 0 HD11 LEU A 9 -2.697 -2.878 -6.679 1.00 71.30 H new ATOM 0 HD12 LEU A 9 -2.273 -2.939 -4.952 1.00 71.30 H new ATOM 0 HD13 LEU A 9 -2.845 -1.417 -5.675 1.00 71.30 H new ATOM 0 HD21 LEU A 9 -1.231 -1.689 -8.291 1.00 23.41 H new ATOM 0 HD22 LEU A 9 -1.341 -0.192 -7.336 1.00 23.41 H new ATOM 0 HD23 LEU A 9 0.252 -0.882 -7.729 1.00 23.41 H new ATOM 137 N TYR A 10 3.103 0.213 -4.399 1.00 41.15 N ATOM 138 CA TYR A 10 3.766 1.326 -3.705 1.00 3.02 C ATOM 139 C TYR A 10 4.044 2.477 -4.652 1.00 3.34 C ATOM 140 O TYR A 10 4.062 2.278 -5.861 1.00 63.33 O ATOM 141 CB TYR A 10 5.039 0.900 -2.939 1.00 62.53 C ATOM 142 CG TYR A 10 5.780 -0.341 -3.382 1.00 65.22 C ATOM 143 CD1 TYR A 10 5.922 -0.679 -4.739 1.00 52.33 C ATOM 144 CD2 TYR A 10 6.263 -1.214 -2.392 1.00 25.32 C ATOM 145 CE1 TYR A 10 6.428 -1.937 -5.094 1.00 42.35 C ATOM 146 CE2 TYR A 10 6.756 -2.476 -2.734 1.00 51.13 C ATOM 147 CZ TYR A 10 6.816 -2.852 -4.090 1.00 31.13 C ATOM 148 OH TYR A 10 7.300 -4.066 -4.438 1.00 53.14 O ATOM 0 H TYR A 10 3.642 -0.154 -5.183 1.00 41.15 H new ATOM 0 HA TYR A 10 3.064 1.672 -2.946 1.00 3.02 H new ATOM 0 HB2 TYR A 10 5.740 1.733 -2.977 1.00 62.53 H new ATOM 0 HB3 TYR A 10 4.764 0.763 -1.893 1.00 62.53 H new ATOM 0 HD1 TYR A 10 5.642 0.028 -5.506 1.00 52.33 H new ATOM 0 HD2 TYR A 10 6.253 -0.906 -1.357 1.00 25.32 H new ATOM 0 HE1 TYR A 10 6.521 -2.207 -6.136 1.00 42.35 H new ATOM 0 HE2 TYR A 10 7.088 -3.157 -1.965 1.00 51.13 H new ATOM 0 HH TYR A 10 7.521 -4.574 -3.630 1.00 53.14 H new ATOM 157 N TYR A 11 4.273 3.667 -4.101 1.00 30.24 N ATOM 158 CA TYR A 11 4.873 4.792 -4.806 1.00 41.41 C ATOM 159 C TYR A 11 6.319 4.924 -4.310 1.00 43.34 C ATOM 160 O TYR A 11 6.595 4.559 -3.160 1.00 5.44 O ATOM 161 CB TYR A 11 4.039 6.054 -4.512 1.00 1.41 C ATOM 162 CG TYR A 11 4.542 7.341 -5.158 1.00 10.11 C ATOM 163 CD1 TYR A 11 5.030 7.347 -6.479 1.00 21.30 C ATOM 164 CD2 TYR A 11 4.534 8.545 -4.430 1.00 25.51 C ATOM 165 CE1 TYR A 11 5.516 8.529 -7.062 1.00 4.02 C ATOM 166 CE2 TYR A 11 5.054 9.723 -4.992 1.00 31.24 C ATOM 167 CZ TYR A 11 5.541 9.725 -6.317 1.00 3.44 C ATOM 168 OH TYR A 11 6.004 10.869 -6.886 1.00 23.41 O ATOM 0 H TYR A 11 4.041 3.878 -3.131 1.00 30.24 H new ATOM 0 HA TYR A 11 4.885 4.648 -5.886 1.00 41.41 H new ATOM 0 HB2 TYR A 11 3.016 5.877 -4.844 1.00 1.41 H new ATOM 0 HB3 TYR A 11 4.003 6.200 -3.432 1.00 1.41 H new ATOM 0 HD1 TYR A 11 5.031 6.431 -7.051 1.00 21.30 H new ATOM 0 HD2 TYR A 11 4.125 8.564 -3.431 1.00 25.51 H new ATOM 0 HE1 TYR A 11 5.871 8.521 -8.082 1.00 4.02 H new ATOM 0 HE2 TYR A 11 5.081 10.631 -4.408 1.00 31.24 H new ATOM 0 HH TYR A 11 5.952 11.601 -6.237 1.00 23.41 H new ATOM 177 N SER A 12 7.217 5.486 -5.123 1.00 55.25 N ATOM 178 CA SER A 12 8.517 5.959 -4.675 1.00 15.41 C ATOM 179 C SER A 12 8.643 7.439 -5.036 1.00 61.15 C ATOM 180 O SER A 12 8.394 7.839 -6.170 1.00 60.15 O ATOM 181 CB SER A 12 9.638 5.086 -5.244 1.00 34.50 C ATOM 182 OG SER A 12 9.813 5.197 -6.638 1.00 74.23 O ATOM 0 H SER A 12 7.054 5.624 -6.120 1.00 55.25 H new ATOM 0 HA SER A 12 8.611 5.873 -3.592 1.00 15.41 H new ATOM 0 HB2 SER A 12 10.573 5.350 -4.751 1.00 34.50 H new ATOM 0 HB3 SER A 12 9.431 4.044 -4.998 1.00 34.50 H new ATOM 0 HG SER A 12 9.312 4.485 -7.088 1.00 74.23 H new ATOM 187 N TRP A 13 9.062 8.261 -4.081 1.00 10.32 N ATOM 188 CA TRP A 13 9.130 9.710 -4.214 1.00 54.43 C ATOM 189 C TRP A 13 10.189 10.133 -5.223 1.00 23.52 C ATOM 190 O TRP A 13 9.955 10.954 -6.106 1.00 44.01 O ATOM 191 CB TRP A 13 9.465 10.292 -2.835 1.00 53.43 C ATOM 192 CG TRP A 13 8.982 11.673 -2.574 1.00 3.01 C ATOM 193 CD1 TRP A 13 7.774 12.164 -2.929 1.00 45.14 C ATOM 194 CD2 TRP A 13 9.686 12.765 -1.912 1.00 54.15 C ATOM 195 NE1 TRP A 13 7.702 13.491 -2.581 1.00 61.33 N ATOM 196 CE2 TRP A 13 8.868 13.927 -1.996 1.00 4.31 C ATOM 197 CE3 TRP A 13 10.938 12.896 -1.273 1.00 23.50 C ATOM 198 CZ2 TRP A 13 9.302 15.180 -1.549 1.00 52.25 C ATOM 199 CZ3 TRP A 13 11.367 14.142 -0.782 1.00 11.23 C ATOM 200 CH2 TRP A 13 10.569 15.284 -0.960 1.00 34.12 C ATOM 0 H TRP A 13 9.372 7.928 -3.168 1.00 10.32 H new ATOM 0 HA TRP A 13 8.172 10.083 -4.576 1.00 54.43 H new ATOM 0 HB2 TRP A 13 9.048 9.633 -2.074 1.00 53.43 H new ATOM 0 HB3 TRP A 13 10.548 10.278 -2.710 1.00 53.43 H new ATOM 0 HD1 TRP A 13 6.988 11.601 -3.411 1.00 45.14 H new ATOM 0 HE1 TRP A 13 6.884 14.080 -2.737 1.00 61.33 H new ATOM 0 HE3 TRP A 13 11.573 12.030 -1.160 1.00 23.50 H new ATOM 0 HZ2 TRP A 13 8.672 16.051 -1.656 1.00 52.25 H new ATOM 0 HZ3 TRP A 13 12.313 14.221 -0.267 1.00 11.23 H new ATOM 0 HH2 TRP A 13 10.934 16.249 -0.641 1.00 34.12 H new ATOM 210 N SER A 14 11.385 9.580 -5.040 1.00 53.21 N ATOM 211 CA SER A 14 12.533 9.749 -5.898 1.00 62.23 C ATOM 212 C SER A 14 13.444 8.560 -5.594 1.00 12.21 C ATOM 213 O SER A 14 14.506 8.694 -4.984 1.00 12.01 O ATOM 214 CB SER A 14 13.166 11.124 -5.631 1.00 62.11 C ATOM 215 OG SER A 14 14.031 11.502 -6.685 1.00 54.45 O ATOM 0 H SER A 14 11.580 8.972 -4.245 1.00 53.21 H new ATOM 0 HA SER A 14 12.299 9.750 -6.963 1.00 62.23 H new ATOM 0 HB2 SER A 14 12.382 11.872 -5.515 1.00 62.11 H new ATOM 0 HB3 SER A 14 13.721 11.096 -4.694 1.00 62.11 H new ATOM 0 HG SER A 14 14.419 12.381 -6.491 1.00 54.45 H new ATOM 220 N GLY A 15 12.964 7.353 -5.899 1.00 61.11 N ATOM 221 CA GLY A 15 13.766 6.138 -5.841 1.00 71.22 C ATOM 222 C GLY A 15 13.869 5.527 -4.441 1.00 55.02 C ATOM 223 O GLY A 15 14.231 4.357 -4.322 1.00 20.34 O ATOM 0 H GLY A 15 12.001 7.194 -6.195 1.00 61.11 H new ATOM 0 HA2 GLY A 15 13.337 5.399 -6.518 1.00 71.22 H new ATOM 0 HA3 GLY A 15 14.769 6.359 -6.205 1.00 71.22 H new ATOM 227 N GLU A 16 13.520 6.273 -3.390 1.00 72.21 N ATOM 228 CA GLU A 16 13.789 5.897 -2.003 1.00 52.44 C ATOM 229 C GLU A 16 13.020 4.624 -1.637 1.00 51.45 C ATOM 230 O GLU A 16 13.622 3.616 -1.264 1.00 42.42 O ATOM 231 CB GLU A 16 13.489 7.074 -1.048 1.00 2.24 C ATOM 232 CG GLU A 16 14.189 8.375 -1.501 1.00 71.15 C ATOM 233 CD GLU A 16 14.272 9.478 -0.436 1.00 62.12 C ATOM 234 OE1 GLU A 16 14.532 9.186 0.752 1.00 11.13 O ATOM 235 OE2 GLU A 16 14.159 10.670 -0.803 1.00 70.52 O ATOM 0 H GLU A 16 13.036 7.166 -3.481 1.00 72.21 H new ATOM 0 HA GLU A 16 14.850 5.671 -1.893 1.00 52.44 H new ATOM 0 HB2 GLU A 16 12.412 7.238 -1.001 1.00 2.24 H new ATOM 0 HB3 GLU A 16 13.817 6.817 -0.041 1.00 2.24 H new ATOM 0 HG2 GLU A 16 15.200 8.130 -1.827 1.00 71.15 H new ATOM 0 HG3 GLU A 16 13.661 8.769 -2.369 1.00 71.15 H new ATOM 240 N THR A 17 11.697 4.628 -1.814 1.00 41.42 N ATOM 241 CA THR A 17 10.874 3.438 -1.573 1.00 53.02 C ATOM 242 C THR A 17 11.022 2.426 -2.724 1.00 42.25 C ATOM 243 O THR A 17 10.620 1.275 -2.599 1.00 22.42 O ATOM 244 CB THR A 17 9.409 3.853 -1.354 1.00 74.41 C ATOM 245 OG1 THR A 17 9.357 5.068 -0.640 1.00 74.31 O ATOM 246 CG2 THR A 17 8.543 2.852 -0.585 1.00 71.35 C ATOM 0 H THR A 17 11.170 5.444 -2.124 1.00 41.42 H new ATOM 0 HA THR A 17 11.221 2.940 -0.668 1.00 53.02 H new ATOM 0 HB THR A 17 9.002 3.925 -2.363 1.00 74.41 H new ATOM 0 HG1 THR A 17 8.422 5.328 -0.505 1.00 74.31 H new ATOM 0 HG21 THR A 17 7.531 3.245 -0.488 1.00 71.35 H new ATOM 0 HG22 THR A 17 8.514 1.906 -1.125 1.00 71.35 H new ATOM 0 HG23 THR A 17 8.966 2.691 0.407 1.00 71.35 H new ATOM 254 N LYS A 18 11.637 2.823 -3.844 1.00 44.14 N ATOM 255 CA LYS A 18 11.777 1.984 -5.029 1.00 75.23 C ATOM 256 C LYS A 18 12.796 0.874 -4.800 1.00 55.15 C ATOM 257 O LYS A 18 12.712 -0.187 -5.424 1.00 60.25 O ATOM 258 CB LYS A 18 12.237 2.849 -6.206 1.00 54.22 C ATOM 259 CG LYS A 18 11.636 2.404 -7.540 1.00 41.15 C ATOM 260 CD LYS A 18 12.406 3.038 -8.707 1.00 75.23 C ATOM 261 CE LYS A 18 13.795 2.382 -8.828 1.00 15.00 C ATOM 262 NZ LYS A 18 14.003 1.727 -10.132 1.00 12.23 N ATOM 0 H LYS A 18 12.055 3.748 -3.949 1.00 44.14 H new ATOM 0 HA LYS A 18 10.810 1.528 -5.244 1.00 75.23 H new ATOM 0 HB2 LYS A 18 11.962 3.887 -6.017 1.00 54.22 H new ATOM 0 HB3 LYS A 18 13.324 2.814 -6.273 1.00 54.22 H new ATOM 0 HG2 LYS A 18 11.672 1.317 -7.619 1.00 41.15 H new ATOM 0 HG3 LYS A 18 10.586 2.693 -7.588 1.00 41.15 H new ATOM 0 HD2 LYS A 18 11.850 2.909 -9.635 1.00 75.23 H new ATOM 0 HD3 LYS A 18 12.512 4.111 -8.546 1.00 75.23 H new ATOM 0 HE2 LYS A 18 14.564 3.140 -8.680 1.00 15.00 H new ATOM 0 HE3 LYS A 18 13.915 1.646 -8.033 1.00 15.00 H new ATOM 0 HZ1 LYS A 18 14.952 1.303 -10.160 1.00 12.23 H new ATOM 0 HZ2 LYS A 18 13.287 0.984 -10.265 1.00 12.23 H new ATOM 0 HZ3 LYS A 18 13.916 2.432 -10.892 1.00 12.23 H new ATOM 272 N LYS A 19 13.787 1.121 -3.941 1.00 34.30 N ATOM 273 CA LYS A 19 14.715 0.078 -3.524 1.00 64.51 C ATOM 274 C LYS A 19 13.955 -0.914 -2.652 1.00 53.04 C ATOM 275 O LYS A 19 14.084 -2.131 -2.818 1.00 11.24 O ATOM 276 CB LYS A 19 15.877 0.725 -2.756 1.00 44.23 C ATOM 277 CG LYS A 19 17.183 -0.039 -2.965 1.00 55.15 C ATOM 278 CD LYS A 19 18.363 0.728 -2.356 1.00 71.41 C ATOM 279 CE LYS A 19 19.680 0.061 -2.754 1.00 73.44 C ATOM 280 NZ LYS A 19 19.990 0.246 -4.188 1.00 64.23 N ATOM 0 H LYS A 19 13.964 2.034 -3.523 1.00 34.30 H new ATOM 0 HA LYS A 19 15.129 -0.452 -4.382 1.00 64.51 H new ATOM 0 HB2 LYS A 19 16.002 1.757 -3.085 1.00 44.23 H new ATOM 0 HB3 LYS A 19 15.639 0.756 -1.693 1.00 44.23 H new ATOM 0 HG2 LYS A 19 17.110 -1.026 -2.508 1.00 55.15 H new ATOM 0 HG3 LYS A 19 17.354 -0.193 -4.031 1.00 55.15 H new ATOM 0 HD2 LYS A 19 18.351 1.762 -2.699 1.00 71.41 H new ATOM 0 HD3 LYS A 19 18.271 0.751 -1.270 1.00 71.41 H new ATOM 0 HE2 LYS A 19 20.490 0.474 -2.153 1.00 73.44 H new ATOM 0 HE3 LYS A 19 19.628 -1.004 -2.530 1.00 73.44 H new ATOM 0 HZ1 LYS A 19 20.988 0.009 -4.361 1.00 64.23 H new ATOM 0 HZ2 LYS A 19 19.382 -0.377 -4.758 1.00 64.23 H new ATOM 0 HZ3 LYS A 19 19.818 1.236 -4.455 1.00 64.23 H new ATOM 290 N MET A 20 13.124 -0.366 -1.766 1.00 5.34 N ATOM 291 CA MET A 20 12.237 -1.014 -0.815 1.00 1.24 C ATOM 292 C MET A 20 10.982 -1.575 -1.509 1.00 44.25 C ATOM 293 O MET A 20 9.872 -1.480 -0.986 1.00 32.43 O ATOM 294 CB MET A 20 11.921 0.042 0.267 1.00 3.24 C ATOM 295 CG MET A 20 11.424 -0.545 1.585 1.00 52.12 C ATOM 296 SD MET A 20 12.463 -1.850 2.273 1.00 50.05 S ATOM 297 CE MET A 20 13.990 -0.967 2.647 1.00 34.40 C ATOM 0 H MET A 20 13.052 0.649 -1.694 1.00 5.34 H new ATOM 0 HA MET A 20 12.703 -1.885 -0.354 1.00 1.24 H new ATOM 0 HB2 MET A 20 12.819 0.629 0.459 1.00 3.24 H new ATOM 0 HB3 MET A 20 11.168 0.728 -0.120 1.00 3.24 H new ATOM 0 HG2 MET A 20 11.343 0.259 2.317 1.00 52.12 H new ATOM 0 HG3 MET A 20 10.420 -0.941 1.434 1.00 52.12 H new ATOM 0 HE1 MET A 20 14.609 -1.574 3.308 1.00 34.40 H new ATOM 0 HE2 MET A 20 14.532 -0.770 1.722 1.00 34.40 H new ATOM 0 HE3 MET A 20 13.753 -0.022 3.137 1.00 34.40 H new ATOM 305 N ALA A 21 11.156 -2.145 -2.705 1.00 10.22 N ATOM 306 CA ALA A 21 10.130 -2.756 -3.520 1.00 70.31 C ATOM 307 C ALA A 21 10.680 -4.104 -3.984 1.00 73.32 C ATOM 308 O ALA A 21 10.227 -5.151 -3.524 1.00 64.13 O ATOM 309 CB ALA A 21 9.754 -1.812 -4.674 1.00 71.15 C ATOM 0 H ALA A 21 12.075 -2.189 -3.146 1.00 10.22 H new ATOM 0 HA ALA A 21 9.205 -2.929 -2.970 1.00 70.31 H new ATOM 0 HB1 ALA A 21 8.981 -2.276 -5.286 1.00 71.15 H new ATOM 0 HB2 ALA A 21 9.380 -0.872 -4.268 1.00 71.15 H new ATOM 0 HB3 ALA A 21 10.634 -1.618 -5.287 1.00 71.15 H new ATOM 315 N GLU A 22 11.738 -4.076 -4.803 1.00 21.11 N ATOM 316 CA GLU A 22 12.394 -5.262 -5.370 1.00 14.24 C ATOM 317 C GLU A 22 12.764 -6.275 -4.279 1.00 73.52 C ATOM 318 O GLU A 22 12.529 -7.479 -4.415 1.00 3.22 O ATOM 319 CB GLU A 22 13.683 -4.858 -6.120 1.00 61.22 C ATOM 320 CG GLU A 22 13.562 -3.651 -7.067 1.00 74.31 C ATOM 321 CD GLU A 22 14.890 -3.332 -7.773 1.00 72.41 C ATOM 322 OE1 GLU A 22 15.584 -4.243 -8.279 1.00 40.34 O ATOM 323 OE2 GLU A 22 15.284 -2.138 -7.796 1.00 31.22 O ATOM 0 H GLU A 22 12.175 -3.203 -5.099 1.00 21.11 H new ATOM 0 HA GLU A 22 11.686 -5.722 -6.059 1.00 14.24 H new ATOM 0 HB2 GLU A 22 14.456 -4.640 -5.383 1.00 61.22 H new ATOM 0 HB3 GLU A 22 14.027 -5.715 -6.698 1.00 61.22 H new ATOM 0 HG2 GLU A 22 12.795 -3.853 -7.814 1.00 74.31 H new ATOM 0 HG3 GLU A 22 13.234 -2.779 -6.501 1.00 74.31 H new ATOM 328 N LYS A 23 13.327 -5.778 -3.167 1.00 74.54 N ATOM 329 CA LYS A 23 13.740 -6.576 -2.025 1.00 52.22 C ATOM 330 C LYS A 23 12.548 -7.365 -1.496 1.00 1.13 C ATOM 331 O LYS A 23 12.541 -8.591 -1.532 1.00 13.24 O ATOM 332 CB LYS A 23 14.327 -5.640 -0.947 1.00 70.35 C ATOM 333 CG LYS A 23 15.826 -5.868 -0.727 1.00 45.15 C ATOM 334 CD LYS A 23 16.699 -5.008 -1.647 1.00 74.22 C ATOM 335 CE LYS A 23 18.144 -5.517 -1.631 1.00 71.15 C ATOM 336 NZ LYS A 23 18.345 -6.605 -2.610 1.00 74.35 N ATOM 0 H LYS A 23 13.508 -4.782 -3.044 1.00 74.54 H new ATOM 0 HA LYS A 23 14.509 -7.291 -2.316 1.00 52.22 H new ATOM 0 HB2 LYS A 23 14.159 -4.604 -1.240 1.00 70.35 H new ATOM 0 HB3 LYS A 23 13.797 -5.796 -0.007 1.00 70.35 H new ATOM 0 HG2 LYS A 23 16.074 -5.648 0.311 1.00 45.15 H new ATOM 0 HG3 LYS A 23 16.057 -6.920 -0.894 1.00 45.15 H new ATOM 0 HD2 LYS A 23 16.307 -5.036 -2.664 1.00 74.22 H new ATOM 0 HD3 LYS A 23 16.668 -3.968 -1.322 1.00 74.22 H new ATOM 0 HE2 LYS A 23 18.823 -4.694 -1.855 1.00 71.15 H new ATOM 0 HE3 LYS A 23 18.394 -5.874 -0.632 1.00 71.15 H new ATOM 0 HZ1 LYS A 23 19.333 -6.927 -2.573 1.00 74.35 H new ATOM 0 HZ2 LYS A 23 17.714 -7.399 -2.381 1.00 74.35 H new ATOM 0 HZ3 LYS A 23 18.130 -6.256 -3.566 1.00 74.35 H new ATOM 346 N ILE A 24 11.508 -6.646 -1.079 1.00 43.33 N ATOM 347 CA ILE A 24 10.306 -7.208 -0.491 1.00 21.35 C ATOM 348 C ILE A 24 9.649 -8.178 -1.488 1.00 12.34 C ATOM 349 O ILE A 24 9.195 -9.239 -1.081 1.00 51.30 O ATOM 350 CB ILE A 24 9.383 -6.053 -0.028 1.00 64.21 C ATOM 351 CG1 ILE A 24 10.087 -5.114 0.977 1.00 63.15 C ATOM 352 CG2 ILE A 24 8.067 -6.582 0.577 1.00 43.21 C ATOM 353 CD1 ILE A 24 9.240 -3.895 1.357 1.00 5.23 C ATOM 0 H ILE A 24 11.483 -5.628 -1.145 1.00 43.33 H new ATOM 0 HA ILE A 24 10.535 -7.799 0.396 1.00 21.35 H new ATOM 0 HB ILE A 24 9.145 -5.476 -0.921 1.00 64.21 H new ATOM 0 HG12 ILE A 24 10.331 -5.675 1.879 1.00 63.15 H new ATOM 0 HG13 ILE A 24 11.030 -4.774 0.548 1.00 63.15 H new ATOM 0 HG21 ILE A 24 7.447 -5.742 0.890 1.00 43.21 H new ATOM 0 HG22 ILE A 24 7.533 -7.169 -0.170 1.00 43.21 H new ATOM 0 HG23 ILE A 24 8.290 -7.210 1.440 1.00 43.21 H new ATOM 0 HD11 ILE A 24 9.791 -3.276 2.065 1.00 5.23 H new ATOM 0 HD12 ILE A 24 9.018 -3.313 0.462 1.00 5.23 H new ATOM 0 HD13 ILE A 24 8.308 -4.228 1.814 1.00 5.23 H new ATOM 364 N ASN A 25 9.579 -7.849 -2.785 1.00 63.20 N ATOM 365 CA ASN A 25 8.984 -8.742 -3.781 1.00 41.01 C ATOM 366 C ASN A 25 9.764 -10.055 -3.875 1.00 41.02 C ATOM 367 O ASN A 25 9.139 -11.106 -3.967 1.00 30.32 O ATOM 368 CB ASN A 25 8.899 -8.059 -5.158 1.00 13.04 C ATOM 369 CG ASN A 25 8.363 -8.981 -6.257 1.00 15.13 C ATOM 370 OD1 ASN A 25 8.888 -9.018 -7.363 1.00 60.24 O ATOM 371 ND2 ASN A 25 7.313 -9.743 -6.020 1.00 64.21 N ATOM 0 H ASN A 25 9.928 -6.970 -3.166 1.00 63.20 H new ATOM 0 HA ASN A 25 7.969 -8.972 -3.456 1.00 41.01 H new ATOM 0 HB2 ASN A 25 8.256 -7.182 -5.082 1.00 13.04 H new ATOM 0 HB3 ASN A 25 9.890 -7.704 -5.442 1.00 13.04 H new ATOM 0 HD21 ASN A 25 6.949 -10.352 -6.753 1.00 64.21 H new ATOM 0 HD22 ASN A 25 6.865 -9.723 -5.104 1.00 64.21 H new ATOM 377 N SER A 26 11.097 -10.002 -3.821 1.00 34.24 N ATOM 378 CA SER A 26 11.950 -11.183 -3.861 1.00 63.10 C ATOM 379 C SER A 26 11.838 -12.022 -2.581 1.00 64.51 C ATOM 380 O SER A 26 11.856 -13.248 -2.656 1.00 4.04 O ATOM 381 CB SER A 26 13.398 -10.735 -4.066 1.00 54.04 C ATOM 382 OG SER A 26 13.539 -9.920 -5.227 1.00 51.32 O ATOM 0 H SER A 26 11.616 -9.127 -3.748 1.00 34.24 H new ATOM 0 HA SER A 26 11.623 -11.815 -4.687 1.00 63.10 H new ATOM 0 HB2 SER A 26 13.735 -10.181 -3.190 1.00 54.04 H new ATOM 0 HB3 SER A 26 14.041 -11.611 -4.156 1.00 54.04 H new ATOM 0 HG SER A 26 13.201 -9.020 -5.038 1.00 51.32 H new ATOM 387 N GLU A 27 11.720 -11.377 -1.416 1.00 62.20 N ATOM 388 CA GLU A 27 11.468 -12.040 -0.140 1.00 52.31 C ATOM 389 C GLU A 27 10.148 -12.816 -0.189 1.00 22.22 C ATOM 390 O GLU A 27 10.044 -13.915 0.361 1.00 1.15 O ATOM 391 CB GLU A 27 11.429 -10.980 0.978 1.00 22.51 C ATOM 392 CG GLU A 27 12.810 -10.738 1.601 1.00 54.34 C ATOM 393 CD GLU A 27 13.160 -11.821 2.622 1.00 34.54 C ATOM 394 OE1 GLU A 27 12.454 -11.946 3.653 1.00 44.31 O ATOM 395 OE2 GLU A 27 14.170 -12.535 2.429 1.00 4.11 O ATOM 0 H GLU A 27 11.799 -10.363 -1.336 1.00 62.20 H new ATOM 0 HA GLU A 27 12.268 -12.752 0.062 1.00 52.31 H new ATOM 0 HB2 GLU A 27 11.046 -10.043 0.574 1.00 22.51 H new ATOM 0 HB3 GLU A 27 10.734 -11.300 1.754 1.00 22.51 H new ATOM 0 HG2 GLU A 27 13.566 -10.718 0.816 1.00 54.34 H new ATOM 0 HG3 GLU A 27 12.826 -9.761 2.085 1.00 54.34 H new ATOM 400 N ILE A 28 9.133 -12.244 -0.837 1.00 24.53 N ATOM 401 CA ILE A 28 7.820 -12.840 -1.011 1.00 30.43 C ATOM 402 C ILE A 28 7.899 -13.943 -2.083 1.00 52.14 C ATOM 403 O ILE A 28 8.885 -14.124 -2.802 1.00 42.30 O ATOM 404 CB ILE A 28 6.790 -11.701 -1.265 1.00 65.51 C ATOM 405 CG1 ILE A 28 6.680 -10.865 0.038 1.00 43.11 C ATOM 406 CG2 ILE A 28 5.383 -12.183 -1.665 1.00 52.03 C ATOM 407 CD1 ILE A 28 5.818 -9.603 -0.057 1.00 51.03 C ATOM 0 H ILE A 28 9.211 -11.322 -1.267 1.00 24.53 H new ATOM 0 HA ILE A 28 7.465 -13.354 -0.118 1.00 30.43 H new ATOM 0 HB ILE A 28 7.158 -11.123 -2.113 1.00 65.51 H new ATOM 0 HG12 ILE A 28 6.275 -11.502 0.824 1.00 43.11 H new ATOM 0 HG13 ILE A 28 7.684 -10.575 0.348 1.00 43.11 H new ATOM 0 HG21 ILE A 28 4.734 -11.321 -1.821 1.00 52.03 H new ATOM 0 HG22 ILE A 28 5.445 -12.762 -2.586 1.00 52.03 H new ATOM 0 HG23 ILE A 28 4.973 -12.807 -0.871 1.00 52.03 H new ATOM 0 HD11 ILE A 28 5.809 -9.095 0.907 1.00 51.03 H new ATOM 0 HD12 ILE A 28 6.231 -8.937 -0.815 1.00 51.03 H new ATOM 0 HD13 ILE A 28 4.800 -9.878 -0.331 1.00 51.03 H new ATOM 418 N LYS A 29 6.854 -14.767 -2.122 1.00 34.23 N ATOM 419 CA LYS A 29 6.551 -15.755 -3.151 1.00 21.14 C ATOM 420 C LYS A 29 6.316 -15.102 -4.523 1.00 1.01 C ATOM 421 O LYS A 29 6.608 -13.933 -4.744 1.00 71.31 O ATOM 422 CB LYS A 29 5.352 -16.593 -2.673 1.00 1.21 C ATOM 423 CG LYS A 29 4.037 -15.793 -2.690 1.00 3.11 C ATOM 424 CD LYS A 29 2.844 -16.704 -2.429 1.00 5.23 C ATOM 425 CE LYS A 29 1.575 -15.960 -2.836 1.00 64.12 C ATOM 426 NZ LYS A 29 0.380 -16.750 -2.514 1.00 52.22 N ATOM 0 H LYS A 29 6.150 -14.760 -1.384 1.00 34.23 H new ATOM 0 HA LYS A 29 7.407 -16.414 -3.297 1.00 21.14 H new ATOM 0 HB2 LYS A 29 5.249 -17.472 -3.310 1.00 1.21 H new ATOM 0 HB3 LYS A 29 5.543 -16.953 -1.662 1.00 1.21 H new ATOM 0 HG2 LYS A 29 4.074 -15.009 -1.934 1.00 3.11 H new ATOM 0 HG3 LYS A 29 3.919 -15.300 -3.655 1.00 3.11 H new ATOM 0 HD2 LYS A 29 2.941 -17.629 -2.998 1.00 5.23 H new ATOM 0 HD3 LYS A 29 2.801 -16.981 -1.376 1.00 5.23 H new ATOM 0 HE2 LYS A 29 1.531 -15.000 -2.322 1.00 64.12 H new ATOM 0 HE3 LYS A 29 1.599 -15.749 -3.905 1.00 64.12 H new ATOM 0 HZ1 LYS A 29 -0.471 -16.225 -2.799 1.00 52.22 H new ATOM 0 HZ2 LYS A 29 0.415 -17.656 -3.024 1.00 52.22 H new ATOM 0 HZ3 LYS A 29 0.348 -16.930 -1.490 1.00 52.22 H new ATOM 436 N ASP A 30 5.717 -15.880 -5.427 1.00 22.43 N ATOM 437 CA ASP A 30 5.259 -15.604 -6.785 1.00 61.24 C ATOM 438 C ASP A 30 4.125 -14.555 -6.816 1.00 71.54 C ATOM 439 O ASP A 30 3.088 -14.766 -7.456 1.00 53.22 O ATOM 440 CB ASP A 30 4.746 -16.921 -7.414 1.00 71.33 C ATOM 441 CG ASP A 30 5.752 -18.065 -7.477 1.00 73.43 C ATOM 442 OD1 ASP A 30 6.767 -17.946 -8.195 1.00 60.11 O ATOM 443 OD2 ASP A 30 5.455 -19.129 -6.881 1.00 40.02 O ATOM 0 H ASP A 30 5.516 -16.851 -5.186 1.00 22.43 H new ATOM 0 HA ASP A 30 6.100 -15.200 -7.349 1.00 61.24 H new ATOM 0 HB2 ASP A 30 3.878 -17.257 -6.848 1.00 71.33 H new ATOM 0 HB3 ASP A 30 4.403 -16.708 -8.427 1.00 71.33 H new ATOM 447 N SER A 31 4.257 -13.456 -6.076 1.00 12.12 N ATOM 448 CA SER A 31 3.293 -12.358 -6.005 1.00 50.21 C ATOM 449 C SER A 31 3.176 -11.602 -7.342 1.00 31.23 C ATOM 450 O SER A 31 3.674 -12.042 -8.382 1.00 52.04 O ATOM 451 CB SER A 31 3.658 -11.447 -4.820 1.00 45.33 C ATOM 452 OG SER A 31 4.833 -10.693 -5.030 1.00 53.34 O ATOM 0 H SER A 31 5.073 -13.299 -5.484 1.00 12.12 H new ATOM 0 HA SER A 31 2.296 -12.762 -5.827 1.00 50.21 H new ATOM 0 HB2 SER A 31 2.829 -10.766 -4.626 1.00 45.33 H new ATOM 0 HB3 SER A 31 3.783 -12.059 -3.927 1.00 45.33 H new ATOM 0 HG SER A 31 4.611 -9.868 -5.510 1.00 53.34 H new ATOM 457 N GLU A 32 2.509 -10.451 -7.332 1.00 13.34 N ATOM 458 CA GLU A 32 2.715 -9.417 -8.343 1.00 33.44 C ATOM 459 C GLU A 32 3.582 -8.316 -7.714 1.00 55.02 C ATOM 460 O GLU A 32 3.767 -8.295 -6.492 1.00 70.43 O ATOM 461 CB GLU A 32 1.342 -8.924 -8.836 1.00 74.50 C ATOM 462 CG GLU A 32 1.430 -8.034 -10.088 1.00 72.33 C ATOM 463 CD GLU A 32 0.084 -7.663 -10.708 1.00 72.30 C ATOM 464 OE1 GLU A 32 -0.925 -8.363 -10.488 1.00 13.31 O ATOM 465 OE2 GLU A 32 0.022 -6.697 -11.504 1.00 60.42 O ATOM 0 H GLU A 32 1.813 -10.209 -6.626 1.00 13.34 H new ATOM 0 HA GLU A 32 3.242 -9.787 -9.222 1.00 33.44 H new ATOM 0 HB2 GLU A 32 0.711 -9.786 -9.055 1.00 74.50 H new ATOM 0 HB3 GLU A 32 0.855 -8.367 -8.036 1.00 74.50 H new ATOM 0 HG2 GLU A 32 1.959 -7.117 -9.828 1.00 72.33 H new ATOM 0 HG3 GLU A 32 2.031 -8.547 -10.839 1.00 72.33 H new ATOM 470 N LEU A 33 4.068 -7.401 -8.550 1.00 53.13 N ATOM 471 CA LEU A 33 4.848 -6.210 -8.266 1.00 24.23 C ATOM 472 C LEU A 33 4.261 -5.098 -9.143 1.00 11.45 C ATOM 473 O LEU A 33 4.338 -5.188 -10.368 1.00 14.11 O ATOM 474 CB LEU A 33 6.325 -6.497 -8.624 1.00 60.20 C ATOM 475 CG LEU A 33 7.261 -5.271 -8.680 1.00 75.23 C ATOM 476 CD1 LEU A 33 7.464 -4.666 -7.293 1.00 51.13 C ATOM 477 CD2 LEU A 33 8.637 -5.658 -9.239 1.00 24.25 C ATOM 0 H LEU A 33 3.903 -7.492 -9.553 1.00 53.13 H new ATOM 0 HA LEU A 33 4.811 -5.915 -7.217 1.00 24.23 H new ATOM 0 HB2 LEU A 33 6.725 -7.200 -7.894 1.00 60.20 H new ATOM 0 HB3 LEU A 33 6.353 -6.994 -9.594 1.00 60.20 H new ATOM 0 HG LEU A 33 6.785 -4.540 -9.333 1.00 75.23 H new ATOM 0 HD11 LEU A 33 8.128 -3.804 -7.365 1.00 51.13 H new ATOM 0 HD12 LEU A 33 6.502 -4.350 -6.890 1.00 51.13 H new ATOM 0 HD13 LEU A 33 7.907 -5.411 -6.632 1.00 51.13 H new ATOM 0 HD21 LEU A 33 9.279 -4.777 -9.269 1.00 24.25 H new ATOM 0 HD22 LEU A 33 9.090 -6.415 -8.599 1.00 24.25 H new ATOM 0 HD23 LEU A 33 8.521 -6.057 -10.247 1.00 24.25 H new ATOM 488 N LYS A 34 3.653 -4.062 -8.556 1.00 32.55 N ATOM 489 CA LYS A 34 3.315 -2.837 -9.273 1.00 33.34 C ATOM 490 C LYS A 34 3.981 -1.670 -8.557 1.00 61.23 C ATOM 491 O LYS A 34 4.207 -1.722 -7.348 1.00 24.32 O ATOM 492 CB LYS A 34 1.797 -2.612 -9.297 1.00 20.22 C ATOM 493 CG LYS A 34 0.938 -3.634 -10.059 1.00 53.43 C ATOM 494 CD LYS A 34 1.212 -3.634 -11.571 1.00 34.34 C ATOM 495 CE LYS A 34 -0.069 -3.727 -12.410 1.00 23.31 C ATOM 496 NZ LYS A 34 0.248 -3.798 -13.849 1.00 35.22 N ATOM 0 H LYS A 34 3.384 -4.053 -7.572 1.00 32.55 H new ATOM 0 HA LYS A 34 3.663 -2.917 -10.303 1.00 33.34 H new ATOM 0 HB2 LYS A 34 1.446 -2.580 -8.266 1.00 20.22 H new ATOM 0 HB3 LYS A 34 1.610 -1.628 -9.728 1.00 20.22 H new ATOM 0 HG2 LYS A 34 1.128 -4.630 -9.660 1.00 53.43 H new ATOM 0 HG3 LYS A 34 -0.116 -3.417 -9.886 1.00 53.43 H new ATOM 0 HD2 LYS A 34 1.750 -2.724 -11.838 1.00 34.34 H new ATOM 0 HD3 LYS A 34 1.863 -4.473 -11.817 1.00 34.34 H new ATOM 0 HE2 LYS A 34 -0.638 -4.608 -12.115 1.00 23.31 H new ATOM 0 HE3 LYS A 34 -0.700 -2.860 -12.215 1.00 23.31 H new ATOM 0 HZ1 LYS A 34 -0.634 -3.860 -14.396 1.00 35.22 H new ATOM 0 HZ2 LYS A 34 0.771 -2.945 -14.132 1.00 35.22 H new ATOM 0 HZ3 LYS A 34 0.831 -4.639 -14.035 1.00 35.22 H new ATOM 506 N GLU A 35 4.182 -0.567 -9.269 1.00 23.34 N ATOM 507 CA GLU A 35 4.506 0.727 -8.672 1.00 74.31 C ATOM 508 C GLU A 35 3.548 1.766 -9.243 1.00 55.12 C ATOM 509 O GLU A 35 3.138 1.673 -10.400 1.00 71.22 O ATOM 510 CB GLU A 35 5.971 1.134 -8.913 1.00 23.12 C ATOM 511 CG GLU A 35 6.442 2.175 -7.881 1.00 0.12 C ATOM 512 CD GLU A 35 7.738 2.893 -8.251 1.00 54.02 C ATOM 513 OE1 GLU A 35 8.591 2.309 -8.953 1.00 20.12 O ATOM 514 OE2 GLU A 35 7.880 4.069 -7.830 1.00 22.12 O ATOM 0 H GLU A 35 4.124 -0.544 -10.287 1.00 23.34 H new ATOM 0 HA GLU A 35 4.389 0.657 -7.591 1.00 74.31 H new ATOM 0 HB2 GLU A 35 6.609 0.252 -8.859 1.00 23.12 H new ATOM 0 HB3 GLU A 35 6.076 1.542 -9.918 1.00 23.12 H new ATOM 0 HG2 GLU A 35 5.655 2.918 -7.748 1.00 0.12 H new ATOM 0 HG3 GLU A 35 6.578 1.679 -6.920 1.00 0.12 H new ATOM 519 N VAL A 36 3.211 2.759 -8.437 1.00 73.52 N ATOM 520 CA VAL A 36 2.235 3.798 -8.701 1.00 74.12 C ATOM 521 C VAL A 36 2.975 5.090 -9.059 1.00 2.23 C ATOM 522 O VAL A 36 4.185 5.219 -8.843 1.00 13.40 O ATOM 523 CB VAL A 36 1.274 3.905 -7.482 1.00 75.25 C ATOM 524 CG1 VAL A 36 0.059 4.806 -7.754 1.00 61.41 C ATOM 525 CG2 VAL A 36 0.723 2.533 -7.029 1.00 20.23 C ATOM 0 H VAL A 36 3.643 2.866 -7.519 1.00 73.52 H new ATOM 0 HA VAL A 36 1.603 3.568 -9.559 1.00 74.12 H new ATOM 0 HB VAL A 36 1.895 4.339 -6.699 1.00 75.25 H new ATOM 0 HG11 VAL A 36 -0.574 4.841 -6.867 1.00 61.41 H new ATOM 0 HG12 VAL A 36 0.400 5.813 -7.997 1.00 61.41 H new ATOM 0 HG13 VAL A 36 -0.512 4.404 -8.591 1.00 61.41 H new ATOM 0 HG21 VAL A 36 0.059 2.671 -6.176 1.00 20.23 H new ATOM 0 HG22 VAL A 36 0.170 2.074 -7.849 1.00 20.23 H new ATOM 0 HG23 VAL A 36 1.551 1.885 -6.743 1.00 20.23 H new ATOM 535 N LYS A 37 2.251 6.057 -9.622 1.00 41.13 N ATOM 536 CA LYS A 37 2.719 7.408 -9.914 1.00 40.13 C ATOM 537 C LYS A 37 1.580 8.386 -9.651 1.00 61.31 C ATOM 538 O LYS A 37 0.418 7.970 -9.662 1.00 34.52 O ATOM 539 CB LYS A 37 3.155 7.505 -11.389 1.00 3.33 C ATOM 540 CG LYS A 37 4.493 6.809 -11.681 1.00 43.14 C ATOM 541 CD LYS A 37 4.339 5.418 -12.318 1.00 52.41 C ATOM 542 CE LYS A 37 4.572 5.492 -13.835 1.00 24.52 C ATOM 543 NZ LYS A 37 3.518 6.237 -14.561 1.00 75.41 N ATOM 0 H LYS A 37 1.280 5.912 -9.898 1.00 41.13 H new ATOM 0 HA LYS A 37 3.572 7.648 -9.279 1.00 40.13 H new ATOM 0 HB2 LYS A 37 2.381 7.065 -12.018 1.00 3.33 H new ATOM 0 HB3 LYS A 37 3.233 8.556 -11.668 1.00 3.33 H new ATOM 0 HG2 LYS A 37 5.083 7.440 -12.345 1.00 43.14 H new ATOM 0 HG3 LYS A 37 5.053 6.713 -10.751 1.00 43.14 H new ATOM 0 HD2 LYS A 37 5.050 4.725 -11.868 1.00 52.41 H new ATOM 0 HD3 LYS A 37 3.342 5.027 -12.116 1.00 52.41 H new ATOM 0 HE2 LYS A 37 5.535 5.966 -14.023 1.00 24.52 H new ATOM 0 HE3 LYS A 37 4.631 4.480 -14.235 1.00 24.52 H new ATOM 0 HZ1 LYS A 37 3.840 6.439 -15.529 1.00 75.41 H new ATOM 0 HZ2 LYS A 37 2.650 5.665 -14.597 1.00 75.41 H new ATOM 0 HZ3 LYS A 37 3.323 7.131 -14.068 1.00 75.41 H new ATOM 553 N VAL A 38 1.916 9.664 -9.484 1.00 72.43 N ATOM 554 CA VAL A 38 1.027 10.800 -9.723 1.00 60.13 C ATOM 555 C VAL A 38 1.514 11.502 -11.002 1.00 71.22 C ATOM 556 O VAL A 38 2.563 11.130 -11.541 1.00 52.03 O ATOM 557 CB VAL A 38 0.985 11.754 -8.503 1.00 4.02 C ATOM 558 CG1 VAL A 38 0.413 11.082 -7.244 1.00 74.33 C ATOM 559 CG2 VAL A 38 2.355 12.356 -8.148 1.00 21.30 C ATOM 0 H VAL A 38 2.844 9.946 -9.169 1.00 72.43 H new ATOM 0 HA VAL A 38 -0.000 10.462 -9.860 1.00 60.13 H new ATOM 0 HB VAL A 38 0.322 12.558 -8.822 1.00 4.02 H new ATOM 0 HG11 VAL A 38 0.407 11.797 -6.421 1.00 74.33 H new ATOM 0 HG12 VAL A 38 -0.605 10.747 -7.441 1.00 74.33 H new ATOM 0 HG13 VAL A 38 1.031 10.225 -6.976 1.00 74.33 H new ATOM 0 HG21 VAL A 38 2.251 13.013 -7.285 1.00 21.30 H new ATOM 0 HG22 VAL A 38 3.054 11.554 -7.911 1.00 21.30 H new ATOM 0 HG23 VAL A 38 2.732 12.928 -8.996 1.00 21.30 H new ATOM 569 N SER A 39 0.782 12.516 -11.465 1.00 2.04 N ATOM 570 CA SER A 39 1.155 13.346 -12.603 1.00 23.13 C ATOM 571 C SER A 39 2.450 14.118 -12.350 1.00 51.03 C ATOM 572 O SER A 39 2.996 14.147 -11.238 1.00 0.22 O ATOM 573 CB SER A 39 0.018 14.297 -12.931 1.00 12.02 C ATOM 574 OG SER A 39 -0.056 14.648 -14.296 1.00 53.02 O ATOM 0 H SER A 39 -0.108 12.787 -11.046 1.00 2.04 H new ATOM 0 HA SER A 39 1.339 12.691 -13.455 1.00 23.13 H new ATOM 0 HB2 SER A 39 -0.924 13.838 -12.632 1.00 12.02 H new ATOM 0 HB3 SER A 39 0.133 15.204 -12.338 1.00 12.02 H new ATOM 0 HG SER A 39 -0.809 15.259 -14.436 1.00 53.02 H new ATOM 579 N GLU A 40 2.943 14.759 -13.400 1.00 42.03 N ATOM 580 CA GLU A 40 4.112 15.591 -13.383 1.00 1.10 C ATOM 581 C GLU A 40 3.759 16.895 -12.671 1.00 22.51 C ATOM 582 O GLU A 40 2.769 17.549 -13.008 1.00 62.13 O ATOM 583 CB GLU A 40 4.553 15.778 -14.836 1.00 64.55 C ATOM 584 CG GLU A 40 5.627 16.846 -14.916 1.00 61.35 C ATOM 585 CD GLU A 40 6.485 16.728 -16.171 1.00 53.03 C ATOM 586 OE1 GLU A 40 7.442 15.910 -16.175 1.00 24.14 O ATOM 587 OE2 GLU A 40 6.232 17.467 -17.149 1.00 22.42 O ATOM 0 H GLU A 40 2.511 14.703 -14.322 1.00 42.03 H new ATOM 0 HA GLU A 40 4.948 15.154 -12.837 1.00 1.10 H new ATOM 0 HB2 GLU A 40 4.933 14.837 -15.234 1.00 64.55 H new ATOM 0 HB3 GLU A 40 3.699 16.062 -15.451 1.00 64.55 H new ATOM 0 HG2 GLU A 40 5.157 17.829 -14.894 1.00 61.35 H new ATOM 0 HG3 GLU A 40 6.267 16.778 -14.036 1.00 61.35 H new ATOM 592 N GLY A 41 4.566 17.265 -11.678 1.00 61.13 N ATOM 593 CA GLY A 41 4.432 18.535 -10.986 1.00 13.24 C ATOM 594 C GLY A 41 3.202 18.614 -10.086 1.00 52.03 C ATOM 595 O GLY A 41 2.853 19.720 -9.665 1.00 52.42 O ATOM 0 H GLY A 41 5.332 16.687 -11.333 1.00 61.13 H new ATOM 0 HA2 GLY A 41 5.324 18.707 -10.384 1.00 13.24 H new ATOM 0 HA3 GLY A 41 4.385 19.337 -11.722 1.00 13.24 H new ATOM 599 N THR A 42 2.567 17.483 -9.757 1.00 23.23 N ATOM 600 CA THR A 42 1.494 17.435 -8.764 1.00 54.11 C ATOM 601 C THR A 42 1.973 18.094 -7.463 1.00 15.31 C ATOM 602 O THR A 42 1.213 18.833 -6.833 1.00 53.01 O ATOM 603 CB THR A 42 1.042 15.977 -8.530 1.00 13.42 C ATOM 604 OG1 THR A 42 0.928 15.252 -9.743 1.00 32.42 O ATOM 605 CG2 THR A 42 -0.327 15.903 -7.847 1.00 42.01 C ATOM 0 H THR A 42 2.784 16.577 -10.173 1.00 23.23 H new ATOM 0 HA THR A 42 0.630 17.988 -9.132 1.00 54.11 H new ATOM 0 HB THR A 42 1.813 15.542 -7.895 1.00 13.42 H new ATOM 0 HG1 THR A 42 1.800 14.875 -9.982 1.00 32.42 H new ATOM 0 HG21 THR A 42 -0.605 14.859 -7.702 1.00 42.01 H new ATOM 0 HG22 THR A 42 -0.279 16.403 -6.880 1.00 42.01 H new ATOM 0 HG23 THR A 42 -1.073 16.394 -8.472 1.00 42.01 H new ATOM 613 N PHE A 43 3.243 17.876 -7.102 1.00 44.23 N ATOM 614 CA PHE A 43 3.854 18.325 -5.867 1.00 3.01 C ATOM 615 C PHE A 43 5.256 18.894 -6.097 1.00 40.12 C ATOM 616 O PHE A 43 5.750 18.945 -7.225 1.00 3.10 O ATOM 617 CB PHE A 43 3.866 17.149 -4.885 1.00 22.33 C ATOM 618 CG PHE A 43 2.504 16.535 -4.636 1.00 13.04 C ATOM 619 CD1 PHE A 43 1.493 17.333 -4.079 1.00 2.02 C ATOM 620 CD2 PHE A 43 2.231 15.200 -4.987 1.00 44.12 C ATOM 621 CE1 PHE A 43 0.216 16.799 -3.848 1.00 22.51 C ATOM 622 CE2 PHE A 43 0.952 14.662 -4.759 1.00 12.30 C ATOM 623 CZ PHE A 43 -0.053 15.464 -4.189 1.00 53.12 C ATOM 0 H PHE A 43 3.892 17.359 -7.695 1.00 44.23 H new ATOM 0 HA PHE A 43 3.271 19.144 -5.447 1.00 3.01 H new ATOM 0 HB2 PHE A 43 4.535 16.378 -5.267 1.00 22.33 H new ATOM 0 HB3 PHE A 43 4.279 17.488 -3.935 1.00 22.33 H new ATOM 0 HD1 PHE A 43 1.699 18.363 -3.827 1.00 2.02 H new ATOM 0 HD2 PHE A 43 3.003 14.589 -5.431 1.00 44.12 H new ATOM 0 HE1 PHE A 43 -0.557 17.413 -3.410 1.00 22.51 H new ATOM 0 HE2 PHE A 43 0.742 13.636 -5.021 1.00 12.30 H new ATOM 0 HZ PHE A 43 -1.035 15.051 -4.013 1.00 53.12 H new ATOM 632 N ASP A 44 5.886 19.345 -5.012 1.00 42.42 N ATOM 633 CA ASP A 44 7.221 19.938 -4.938 1.00 71.31 C ATOM 634 C ASP A 44 7.868 19.427 -3.636 1.00 43.45 C ATOM 635 O ASP A 44 7.440 18.393 -3.114 1.00 13.13 O ATOM 636 CB ASP A 44 7.099 21.470 -4.994 1.00 43.04 C ATOM 637 CG ASP A 44 8.426 22.121 -5.381 1.00 32.21 C ATOM 638 OD1 ASP A 44 9.222 22.426 -4.469 1.00 60.15 O ATOM 639 OD2 ASP A 44 8.691 22.278 -6.594 1.00 54.42 O ATOM 0 H ASP A 44 5.443 19.302 -4.094 1.00 42.42 H new ATOM 0 HA ASP A 44 7.855 19.651 -5.777 1.00 71.31 H new ATOM 0 HB2 ASP A 44 6.331 21.749 -5.715 1.00 43.04 H new ATOM 0 HB3 ASP A 44 6.777 21.847 -4.023 1.00 43.04 H new ATOM 643 N ALA A 45 8.856 20.112 -3.063 1.00 71.35 N ATOM 644 CA ALA A 45 9.321 19.878 -1.698 1.00 64.24 C ATOM 645 C ALA A 45 9.731 21.165 -0.964 1.00 22.21 C ATOM 646 O ALA A 45 10.283 21.060 0.133 1.00 4.00 O ATOM 647 CB ALA A 45 10.418 18.823 -1.710 1.00 54.23 C ATOM 0 H ALA A 45 9.363 20.856 -3.542 1.00 71.35 H new ATOM 0 HA ALA A 45 8.482 19.497 -1.115 1.00 64.24 H new ATOM 0 HB1 ALA A 45 10.766 18.648 -0.692 1.00 54.23 H new ATOM 0 HB2 ALA A 45 10.025 17.894 -2.124 1.00 54.23 H new ATOM 0 HB3 ALA A 45 11.250 19.170 -2.323 1.00 54.23 H new ATOM 653 N ASP A 46 9.470 22.348 -1.538 1.00 43.25 N ATOM 654 CA ASP A 46 9.763 23.635 -0.890 1.00 25.14 C ATOM 655 C ASP A 46 8.838 23.852 0.304 1.00 53.43 C ATOM 656 O ASP A 46 7.647 23.536 0.223 1.00 51.45 O ATOM 657 CB ASP A 46 9.584 24.833 -1.836 1.00 43.34 C ATOM 658 CG ASP A 46 10.435 26.040 -1.411 1.00 44.42 C ATOM 659 OD1 ASP A 46 10.259 26.557 -0.285 1.00 10.31 O ATOM 660 OD2 ASP A 46 11.261 26.468 -2.258 1.00 12.12 O ATOM 0 H ASP A 46 9.050 22.440 -2.463 1.00 43.25 H new ATOM 0 HA ASP A 46 10.807 23.582 -0.580 1.00 25.14 H new ATOM 0 HB2 ASP A 46 9.856 24.538 -2.849 1.00 43.34 H new ATOM 0 HB3 ASP A 46 8.533 25.122 -1.859 1.00 43.34 H new ATOM 664 N MET A 47 9.367 24.422 1.385 1.00 42.21 N ATOM 665 CA MET A 47 8.659 24.617 2.640 1.00 70.22 C ATOM 666 C MET A 47 7.420 25.497 2.520 1.00 50.35 C ATOM 667 O MET A 47 6.474 25.257 3.270 1.00 1.34 O ATOM 668 CB MET A 47 9.611 25.146 3.719 1.00 30.22 C ATOM 669 CG MET A 47 10.215 26.529 3.447 1.00 63.41 C ATOM 670 SD MET A 47 9.653 27.765 4.647 1.00 73.15 S ATOM 671 CE MET A 47 8.763 28.911 3.578 1.00 31.21 C ATOM 0 H MET A 47 10.326 24.769 1.408 1.00 42.21 H new ATOM 0 HA MET A 47 8.291 23.635 2.937 1.00 70.22 H new ATOM 0 HB2 MET A 47 9.073 25.184 4.666 1.00 30.22 H new ATOM 0 HB3 MET A 47 10.425 24.431 3.843 1.00 30.22 H new ATOM 0 HG2 MET A 47 11.302 26.462 3.478 1.00 63.41 H new ATOM 0 HG3 MET A 47 9.944 26.851 2.441 1.00 63.41 H new ATOM 0 HE1 MET A 47 8.575 29.840 4.117 1.00 31.21 H new ATOM 0 HE2 MET A 47 9.361 29.121 2.691 1.00 31.21 H new ATOM 0 HE3 MET A 47 7.814 28.467 3.278 1.00 31.21 H new ATOM 679 N TYR A 48 7.379 26.475 1.599 1.00 10.13 N ATOM 680 CA TYR A 48 6.122 27.160 1.331 1.00 5.30 C ATOM 681 C TYR A 48 5.215 26.233 0.535 1.00 10.11 C ATOM 682 O TYR A 48 4.097 25.928 0.959 1.00 45.24 O ATOM 683 CB TYR A 48 6.304 28.528 0.648 1.00 12.44 C ATOM 684 CG TYR A 48 7.284 28.677 -0.504 1.00 73.15 C ATOM 685 CD1 TYR A 48 6.908 28.442 -1.844 1.00 21.42 C ATOM 686 CD2 TYR A 48 8.566 29.171 -0.229 1.00 41.42 C ATOM 687 CE1 TYR A 48 7.827 28.676 -2.886 1.00 54.02 C ATOM 688 CE2 TYR A 48 9.475 29.439 -1.260 1.00 24.43 C ATOM 689 CZ TYR A 48 9.117 29.178 -2.596 1.00 31.53 C ATOM 690 OH TYR A 48 10.016 29.414 -3.589 1.00 53.15 O ATOM 0 H TYR A 48 8.177 26.794 1.049 1.00 10.13 H new ATOM 0 HA TYR A 48 5.652 27.393 2.286 1.00 5.30 H new ATOM 0 HB2 TYR A 48 5.326 28.841 0.284 1.00 12.44 H new ATOM 0 HB3 TYR A 48 6.600 29.239 1.419 1.00 12.44 H new ATOM 0 HD1 TYR A 48 5.915 28.083 -2.071 1.00 21.42 H new ATOM 0 HD2 TYR A 48 8.858 29.348 0.796 1.00 41.42 H new ATOM 0 HE1 TYR A 48 7.546 28.472 -3.908 1.00 54.02 H new ATOM 0 HE2 TYR A 48 10.449 29.845 -1.030 1.00 24.43 H new ATOM 0 HH TYR A 48 10.848 29.758 -3.202 1.00 53.15 H new ATOM 699 N LYS A 49 5.702 25.780 -0.622 1.00 21.51 N ATOM 700 CA LYS A 49 4.856 25.159 -1.620 1.00 45.14 C ATOM 701 C LYS A 49 4.140 23.944 -1.048 1.00 41.32 C ATOM 702 O LYS A 49 2.925 23.834 -1.193 1.00 43.15 O ATOM 703 CB LYS A 49 5.680 24.836 -2.879 1.00 12.30 C ATOM 704 CG LYS A 49 4.834 24.877 -4.160 1.00 71.35 C ATOM 705 CD LYS A 49 4.596 26.316 -4.638 1.00 21.51 C ATOM 706 CE LYS A 49 3.728 26.340 -5.895 1.00 42.41 C ATOM 707 NZ LYS A 49 3.591 27.698 -6.456 1.00 0.44 N ATOM 0 H LYS A 49 6.686 25.836 -0.884 1.00 21.51 H new ATOM 0 HA LYS A 49 4.074 25.857 -1.918 1.00 45.14 H new ATOM 0 HB2 LYS A 49 6.500 25.549 -2.966 1.00 12.30 H new ATOM 0 HB3 LYS A 49 6.127 23.847 -2.774 1.00 12.30 H new ATOM 0 HG2 LYS A 49 5.335 24.311 -4.945 1.00 71.35 H new ATOM 0 HG3 LYS A 49 3.876 24.391 -3.979 1.00 71.35 H new ATOM 0 HD2 LYS A 49 4.113 26.890 -3.847 1.00 21.51 H new ATOM 0 HD3 LYS A 49 5.552 26.798 -4.843 1.00 21.51 H new ATOM 0 HE2 LYS A 49 4.163 25.681 -6.647 1.00 42.41 H new ATOM 0 HE3 LYS A 49 2.740 25.946 -5.659 1.00 42.41 H new ATOM 0 HZ1 LYS A 49 2.994 27.664 -7.307 1.00 0.44 H new ATOM 0 HZ2 LYS A 49 3.152 28.323 -5.750 1.00 0.44 H new ATOM 0 HZ3 LYS A 49 4.531 28.066 -6.707 1.00 0.44 H new ATOM 717 N THR A 50 4.849 23.022 -0.404 1.00 50.42 N ATOM 718 CA THR A 50 4.242 21.783 0.030 1.00 52.45 C ATOM 719 C THR A 50 3.545 21.861 1.374 1.00 62.25 C ATOM 720 O THR A 50 2.839 20.909 1.714 1.00 13.14 O ATOM 721 CB THR A 50 5.282 20.680 0.009 1.00 44.24 C ATOM 722 OG1 THR A 50 6.249 20.762 1.032 1.00 73.24 O ATOM 723 CG2 THR A 50 5.992 20.699 -1.341 1.00 63.51 C ATOM 0 H THR A 50 5.839 23.115 -0.175 1.00 50.42 H new ATOM 0 HA THR A 50 3.444 21.560 -0.678 1.00 52.45 H new ATOM 0 HB THR A 50 4.740 19.750 0.179 1.00 44.24 H new ATOM 0 HG1 THR A 50 6.786 21.573 0.910 1.00 73.24 H new ATOM 0 HG21 THR A 50 6.743 19.910 -1.368 1.00 63.51 H new ATOM 0 HG22 THR A 50 5.265 20.536 -2.137 1.00 63.51 H new ATOM 0 HG23 THR A 50 6.476 21.665 -1.484 1.00 63.51 H new ATOM 731 N SER A 51 3.723 22.945 2.133 1.00 64.13 N ATOM 732 CA SER A 51 2.785 23.241 3.195 1.00 31.14 C ATOM 733 C SER A 51 1.424 23.410 2.520 1.00 14.00 C ATOM 734 O SER A 51 0.481 22.654 2.776 1.00 21.30 O ATOM 735 CB SER A 51 3.248 24.479 3.986 1.00 63.14 C ATOM 736 OG SER A 51 2.441 24.689 5.131 1.00 13.04 O ATOM 0 H SER A 51 4.489 23.610 2.030 1.00 64.13 H new ATOM 0 HA SER A 51 2.720 22.445 3.937 1.00 31.14 H new ATOM 0 HB2 SER A 51 4.287 24.352 4.289 1.00 63.14 H new ATOM 0 HB3 SER A 51 3.209 25.359 3.344 1.00 63.14 H new ATOM 0 HG SER A 51 2.759 25.480 5.615 1.00 13.04 H new ATOM 741 N ASP A 52 1.360 24.377 1.613 1.00 41.15 N ATOM 742 CA ASP A 52 0.112 24.965 1.166 1.00 71.33 C ATOM 743 C ASP A 52 -0.638 24.091 0.165 1.00 52.12 C ATOM 744 O ASP A 52 -1.868 24.151 0.128 1.00 50.22 O ATOM 745 CB ASP A 52 0.397 26.357 0.577 1.00 3.41 C ATOM 746 CG ASP A 52 -0.561 27.408 1.139 1.00 61.13 C ATOM 747 OD1 ASP A 52 -0.795 27.409 2.370 1.00 24.14 O ATOM 748 OD2 ASP A 52 -1.005 28.288 0.366 1.00 11.24 O ATOM 0 H ASP A 52 2.185 24.777 1.165 1.00 41.15 H new ATOM 0 HA ASP A 52 -0.545 25.052 2.032 1.00 71.33 H new ATOM 0 HB2 ASP A 52 1.425 26.644 0.799 1.00 3.41 H new ATOM 0 HB3 ASP A 52 0.303 26.321 -0.508 1.00 3.41 H new ATOM 752 N ILE A 53 0.060 23.282 -0.648 1.00 61.35 N ATOM 753 CA ILE A 53 -0.606 22.350 -1.562 1.00 34.33 C ATOM 754 C ILE A 53 -1.380 21.321 -0.743 1.00 62.11 C ATOM 755 O ILE A 53 -2.585 21.189 -0.955 1.00 12.43 O ATOM 756 CB ILE A 53 0.364 21.668 -2.569 1.00 4.34 C ATOM 757 CG1 ILE A 53 0.996 22.670 -3.560 1.00 65.52 C ATOM 758 CG2 ILE A 53 -0.375 20.584 -3.390 1.00 25.23 C ATOM 759 CD1 ILE A 53 2.271 22.113 -4.217 1.00 43.12 C ATOM 0 H ILE A 53 1.079 23.257 -0.689 1.00 61.35 H new ATOM 0 HA ILE A 53 -1.295 22.925 -2.181 1.00 34.33 H new ATOM 0 HB ILE A 53 1.157 21.225 -1.967 1.00 4.34 H new ATOM 0 HG12 ILE A 53 0.270 22.920 -4.334 1.00 65.52 H new ATOM 0 HG13 ILE A 53 1.234 23.595 -3.036 1.00 65.52 H new ATOM 0 HG21 ILE A 53 0.321 20.119 -4.088 1.00 25.23 H new ATOM 0 HG22 ILE A 53 -0.774 19.826 -2.716 1.00 25.23 H new ATOM 0 HG23 ILE A 53 -1.194 21.043 -3.945 1.00 25.23 H new ATOM 0 HD11 ILE A 53 2.679 22.853 -4.905 1.00 43.12 H new ATOM 0 HD12 ILE A 53 3.009 21.888 -3.447 1.00 43.12 H new ATOM 0 HD13 ILE A 53 2.030 21.202 -4.765 1.00 43.12 H new ATOM 770 N ALA A 54 -0.703 20.587 0.152 1.00 31.12 N ATOM 771 CA ALA A 54 -1.352 19.501 0.873 1.00 73.52 C ATOM 772 C ALA A 54 -2.480 20.059 1.727 1.00 70.42 C ATOM 773 O ALA A 54 -3.570 19.502 1.733 1.00 5.03 O ATOM 774 CB ALA A 54 -0.363 18.699 1.730 1.00 23.30 C ATOM 0 H ALA A 54 0.280 20.728 0.386 1.00 31.12 H new ATOM 0 HA ALA A 54 -1.761 18.807 0.139 1.00 73.52 H new ATOM 0 HB1 ALA A 54 -0.895 17.901 2.248 1.00 23.30 H new ATOM 0 HB2 ALA A 54 0.406 18.267 1.090 1.00 23.30 H new ATOM 0 HB3 ALA A 54 0.103 19.359 2.462 1.00 23.30 H new ATOM 780 N LEU A 55 -2.225 21.158 2.440 1.00 53.01 N ATOM 781 CA LEU A 55 -3.161 21.742 3.395 1.00 34.41 C ATOM 782 C LEU A 55 -4.503 22.069 2.730 1.00 52.33 C ATOM 783 O LEU A 55 -5.564 21.849 3.323 1.00 34.52 O ATOM 784 CB LEU A 55 -2.477 22.968 4.018 1.00 23.20 C ATOM 785 CG LEU A 55 -3.155 23.623 5.229 1.00 31.51 C ATOM 786 CD1 LEU A 55 -4.208 24.635 4.785 1.00 22.24 C ATOM 787 CD2 LEU A 55 -3.632 22.618 6.278 1.00 61.43 C ATOM 0 H LEU A 55 -1.348 21.673 2.367 1.00 53.01 H new ATOM 0 HA LEU A 55 -3.406 21.033 4.186 1.00 34.41 H new ATOM 0 HB2 LEU A 55 -1.470 22.676 4.315 1.00 23.20 H new ATOM 0 HB3 LEU A 55 -2.373 23.725 3.241 1.00 23.20 H new ATOM 0 HG LEU A 55 -2.396 24.194 5.763 1.00 31.51 H new ATOM 0 HD11 LEU A 55 -4.673 25.085 5.662 1.00 22.24 H new ATOM 0 HD12 LEU A 55 -3.735 25.413 4.186 1.00 22.24 H new ATOM 0 HD13 LEU A 55 -4.969 24.131 4.189 1.00 22.24 H new ATOM 0 HD21 LEU A 55 -4.101 23.151 7.105 1.00 61.43 H new ATOM 0 HD22 LEU A 55 -4.355 21.938 5.828 1.00 61.43 H new ATOM 0 HD23 LEU A 55 -2.780 22.048 6.650 1.00 61.43 H new ATOM 798 N ASP A 56 -4.450 22.542 1.481 1.00 65.14 N ATOM 799 CA ASP A 56 -5.607 22.802 0.626 1.00 25.11 C ATOM 800 C ASP A 56 -6.451 21.534 0.459 1.00 2.24 C ATOM 801 O ASP A 56 -7.652 21.546 0.748 1.00 45.02 O ATOM 802 CB ASP A 56 -5.155 23.331 -0.756 1.00 1.02 C ATOM 803 CG ASP A 56 -5.462 24.800 -1.043 1.00 21.20 C ATOM 804 OD1 ASP A 56 -6.039 25.511 -0.191 1.00 53.12 O ATOM 805 OD2 ASP A 56 -5.070 25.267 -2.135 1.00 33.40 O ATOM 0 H ASP A 56 -3.566 22.762 1.023 1.00 65.14 H new ATOM 0 HA ASP A 56 -6.220 23.565 1.106 1.00 25.11 H new ATOM 0 HB2 ASP A 56 -4.079 23.181 -0.847 1.00 1.02 H new ATOM 0 HB3 ASP A 56 -5.628 22.724 -1.528 1.00 1.02 H new ATOM 809 N GLN A 57 -5.818 20.446 0.013 1.00 53.44 N ATOM 810 CA GLN A 57 -6.436 19.153 -0.293 1.00 1.24 C ATOM 811 C GLN A 57 -6.994 18.510 0.986 1.00 32.30 C ATOM 812 O GLN A 57 -8.125 18.020 1.018 1.00 1.11 O ATOM 813 CB GLN A 57 -5.387 18.217 -0.934 1.00 10.23 C ATOM 814 CG GLN A 57 -4.724 18.773 -2.209 1.00 54.21 C ATOM 815 CD GLN A 57 -3.514 17.945 -2.650 1.00 54.21 C ATOM 816 OE1 GLN A 57 -2.622 17.639 -1.865 1.00 62.45 O ATOM 817 NE2 GLN A 57 -3.420 17.592 -3.921 1.00 14.11 N ATOM 0 H GLN A 57 -4.812 20.443 -0.153 1.00 53.44 H new ATOM 0 HA GLN A 57 -7.258 19.311 -0.991 1.00 1.24 H new ATOM 0 HB2 GLN A 57 -4.610 18.006 -0.199 1.00 10.23 H new ATOM 0 HB3 GLN A 57 -5.865 17.267 -1.174 1.00 10.23 H new ATOM 0 HG2 GLN A 57 -5.457 18.797 -3.015 1.00 54.21 H new ATOM 0 HG3 GLN A 57 -4.411 19.802 -2.033 1.00 54.21 H new ATOM 0 HE21 GLN A 57 -4.160 17.845 -4.576 1.00 14.11 H new ATOM 0 HE22 GLN A 57 -2.608 17.067 -4.246 1.00 14.11 H new ATOM 824 N ILE A 58 -6.187 18.509 2.051 1.00 31.24 N ATOM 825 CA ILE A 58 -6.467 17.884 3.339 1.00 11.00 C ATOM 826 C ILE A 58 -7.779 18.438 3.876 1.00 42.03 C ATOM 827 O ILE A 58 -8.705 17.677 4.150 1.00 42.35 O ATOM 828 CB ILE A 58 -5.287 18.129 4.314 1.00 32.20 C ATOM 829 CG1 ILE A 58 -4.051 17.313 3.878 1.00 42.32 C ATOM 830 CG2 ILE A 58 -5.647 17.773 5.772 1.00 44.11 C ATOM 831 CD1 ILE A 58 -2.746 17.842 4.493 1.00 50.12 C ATOM 0 H ILE A 58 -5.276 18.968 2.033 1.00 31.24 H new ATOM 0 HA ILE A 58 -6.571 16.805 3.227 1.00 11.00 H new ATOM 0 HB ILE A 58 -5.062 19.195 4.275 1.00 32.20 H new ATOM 0 HG12 ILE A 58 -4.188 16.271 4.167 1.00 42.32 H new ATOM 0 HG13 ILE A 58 -3.971 17.335 2.791 1.00 42.32 H new ATOM 0 HG21 ILE A 58 -4.788 17.962 6.415 1.00 44.11 H new ATOM 0 HG22 ILE A 58 -6.487 18.385 6.099 1.00 44.11 H new ATOM 0 HG23 ILE A 58 -5.921 16.720 5.832 1.00 44.11 H new ATOM 0 HD11 ILE A 58 -1.910 17.231 4.153 1.00 50.12 H new ATOM 0 HD12 ILE A 58 -2.590 18.875 4.183 1.00 50.12 H new ATOM 0 HD13 ILE A 58 -2.811 17.795 5.580 1.00 50.12 H new ATOM 842 N GLN A 59 -7.851 19.755 4.070 1.00 2.02 N ATOM 843 CA GLN A 59 -8.918 20.328 4.876 1.00 25.11 C ATOM 844 C GLN A 59 -10.260 20.426 4.139 1.00 73.11 C ATOM 845 O GLN A 59 -11.245 20.826 4.762 1.00 30.32 O ATOM 846 CB GLN A 59 -8.484 21.691 5.422 1.00 70.35 C ATOM 847 CG GLN A 59 -7.361 21.588 6.458 1.00 70.53 C ATOM 848 CD GLN A 59 -7.228 22.918 7.174 1.00 22.22 C ATOM 849 OE1 GLN A 59 -6.611 23.885 6.526 1.00 53.33 O flip ATOM 850 NE2 GLN A 59 -7.728 23.095 8.287 1.00 53.15 N flip ATOM 0 H GLN A 59 -7.192 20.432 3.685 1.00 2.02 H new ATOM 0 HA GLN A 59 -9.092 19.642 5.705 1.00 25.11 H new ATOM 0 HB2 GLN A 59 -8.152 22.319 4.595 1.00 70.35 H new ATOM 0 HB3 GLN A 59 -9.344 22.186 5.873 1.00 70.35 H new ATOM 0 HG2 GLN A 59 -7.580 20.795 7.173 1.00 70.53 H new ATOM 0 HG3 GLN A 59 -6.422 21.327 5.971 1.00 70.53 H new ATOM 0 HE21 GLN A 59 -8.199 22.325 8.763 1.00 53.15 H new ATOM 0 HE22 GLN A 59 -7.671 24.011 8.732 1.00 53.15 H new ATOM 857 N GLY A 60 -10.318 20.072 2.850 1.00 31.44 N ATOM 858 CA GLY A 60 -11.545 20.119 2.062 1.00 2.14 C ATOM 859 C GLY A 60 -11.682 21.400 1.242 1.00 2.24 C ATOM 860 O GLY A 60 -12.692 21.576 0.554 1.00 62.21 O ATOM 0 H GLY A 60 -9.507 19.743 2.325 1.00 31.44 H new ATOM 0 HA2 GLY A 60 -11.572 19.261 1.391 1.00 2.14 H new ATOM 0 HA3 GLY A 60 -12.402 20.029 2.729 1.00 2.14 H new ATOM 864 N ASN A 61 -10.684 22.294 1.278 1.00 45.13 N ATOM 865 CA ASN A 61 -10.682 23.473 0.414 1.00 61.32 C ATOM 866 C ASN A 61 -10.638 23.009 -1.038 1.00 5.10 C ATOM 867 O ASN A 61 -11.357 23.563 -1.872 1.00 72.43 O ATOM 868 CB ASN A 61 -9.497 24.430 0.647 1.00 32.22 C ATOM 869 CG ASN A 61 -9.087 24.593 2.096 1.00 32.30 C ATOM 870 OD1 ASN A 61 -8.239 23.707 2.580 1.00 44.42 O flip ATOM 871 ND2 ASN A 61 -9.491 25.509 2.801 1.00 71.34 N flip ATOM 0 H ASN A 61 -9.874 22.220 1.894 1.00 45.13 H new ATOM 0 HA ASN A 61 -11.588 24.030 0.653 1.00 61.32 H new ATOM 0 HB2 ASN A 61 -8.639 24.068 0.080 1.00 32.22 H new ATOM 0 HB3 ASN A 61 -9.755 25.410 0.245 1.00 32.22 H new ATOM 0 HD21 ASN A 61 -10.147 26.192 2.423 1.00 71.34 H new ATOM 0 HD22 ASN A 61 -9.172 25.589 3.766 1.00 71.34 H new ATOM 877 N LYS A 62 -9.810 22.002 -1.340 1.00 62.15 N ATOM 878 CA LYS A 62 -9.538 21.544 -2.695 1.00 53.32 C ATOM 879 C LYS A 62 -9.645 20.034 -2.791 1.00 43.02 C ATOM 880 O LYS A 62 -9.669 19.337 -1.776 1.00 72.53 O ATOM 881 CB LYS A 62 -8.155 22.055 -3.125 1.00 34.33 C ATOM 882 CG LYS A 62 -8.184 23.580 -3.326 1.00 42.32 C ATOM 883 CD LYS A 62 -7.474 23.979 -4.615 1.00 62.13 C ATOM 884 CE LYS A 62 -7.698 25.472 -4.840 1.00 45.33 C ATOM 885 NZ LYS A 62 -7.196 25.921 -6.149 1.00 10.30 N ATOM 0 H LYS A 62 -9.302 21.476 -0.629 1.00 62.15 H new ATOM 0 HA LYS A 62 -10.285 21.949 -3.378 1.00 53.32 H new ATOM 0 HB2 LYS A 62 -7.414 21.796 -2.369 1.00 34.33 H new ATOM 0 HB3 LYS A 62 -7.851 21.566 -4.050 1.00 34.33 H new ATOM 0 HG2 LYS A 62 -9.217 23.926 -3.354 1.00 42.32 H new ATOM 0 HG3 LYS A 62 -7.707 24.071 -2.478 1.00 42.32 H new ATOM 0 HD2 LYS A 62 -6.408 23.761 -4.545 1.00 62.13 H new ATOM 0 HD3 LYS A 62 -7.863 23.405 -5.456 1.00 62.13 H new ATOM 0 HE2 LYS A 62 -8.763 25.692 -4.767 1.00 45.33 H new ATOM 0 HE3 LYS A 62 -7.201 26.035 -4.050 1.00 45.33 H new ATOM 0 HZ1 LYS A 62 -7.370 26.941 -6.256 1.00 10.30 H new ATOM 0 HZ2 LYS A 62 -6.175 25.736 -6.211 1.00 10.30 H new ATOM 0 HZ3 LYS A 62 -7.688 25.404 -6.905 1.00 10.30 H new ATOM 895 N ASP A 63 -9.729 19.533 -4.018 1.00 70.52 N ATOM 896 CA ASP A 63 -9.947 18.124 -4.304 1.00 21.53 C ATOM 897 C ASP A 63 -8.651 17.350 -4.101 1.00 3.01 C ATOM 898 O ASP A 63 -7.558 17.920 -4.089 1.00 72.13 O ATOM 899 CB ASP A 63 -10.445 17.941 -5.742 1.00 25.14 C ATOM 900 CG ASP A 63 -11.713 18.744 -5.985 1.00 32.42 C ATOM 901 OD1 ASP A 63 -12.790 18.358 -5.479 1.00 74.35 O ATOM 902 OD2 ASP A 63 -11.596 19.861 -6.532 1.00 43.21 O ATOM 0 H ASP A 63 -9.646 20.108 -4.857 1.00 70.52 H new ATOM 0 HA ASP A 63 -10.706 17.741 -3.621 1.00 21.53 H new ATOM 0 HB2 ASP A 63 -9.671 18.256 -6.442 1.00 25.14 H new ATOM 0 HB3 ASP A 63 -10.637 16.885 -5.933 1.00 25.14 H new ATOM 906 N PHE A 64 -8.777 16.032 -3.963 1.00 41.14 N ATOM 907 CA PHE A 64 -7.667 15.087 -3.913 1.00 43.15 C ATOM 908 C PHE A 64 -6.823 15.103 -5.202 1.00 1.22 C ATOM 909 O PHE A 64 -7.309 15.559 -6.243 1.00 62.24 O ATOM 910 CB PHE A 64 -8.204 13.673 -3.599 1.00 24.30 C ATOM 911 CG PHE A 64 -9.085 12.933 -4.604 1.00 52.33 C ATOM 912 CD1 PHE A 64 -9.950 13.580 -5.515 1.00 65.12 C ATOM 913 CD2 PHE A 64 -9.103 11.526 -4.541 1.00 34.52 C ATOM 914 CE1 PHE A 64 -10.877 12.834 -6.264 1.00 25.24 C ATOM 915 CE2 PHE A 64 -9.992 10.779 -5.330 1.00 51.14 C ATOM 916 CZ PHE A 64 -10.903 11.434 -6.173 1.00 4.32 C ATOM 0 H PHE A 64 -9.687 15.578 -3.880 1.00 41.14 H new ATOM 0 HA PHE A 64 -6.994 15.395 -3.112 1.00 43.15 H new ATOM 0 HB2 PHE A 64 -7.340 13.038 -3.401 1.00 24.30 H new ATOM 0 HB3 PHE A 64 -8.768 13.743 -2.669 1.00 24.30 H new ATOM 0 HD1 PHE A 64 -9.899 14.652 -5.636 1.00 65.12 H new ATOM 0 HD2 PHE A 64 -8.423 11.014 -3.876 1.00 34.52 H new ATOM 0 HE1 PHE A 64 -11.574 13.342 -6.914 1.00 25.24 H new ATOM 0 HE2 PHE A 64 -9.975 9.700 -5.288 1.00 51.14 H new ATOM 0 HZ PHE A 64 -11.619 10.865 -6.747 1.00 4.32 H new ATOM 925 N PRO A 65 -5.575 14.596 -5.152 1.00 11.01 N ATOM 926 CA PRO A 65 -4.772 14.320 -6.336 1.00 31.23 C ATOM 927 C PRO A 65 -5.350 13.145 -7.139 1.00 24.13 C ATOM 928 O PRO A 65 -6.482 12.706 -6.947 1.00 30.22 O ATOM 929 CB PRO A 65 -3.348 14.083 -5.808 1.00 2.21 C ATOM 930 CG PRO A 65 -3.610 13.449 -4.450 1.00 5.04 C ATOM 931 CD PRO A 65 -4.819 14.237 -3.954 1.00 43.21 C ATOM 0 HA PRO A 65 -4.771 15.143 -7.050 1.00 31.23 H new ATOM 0 HB2 PRO A 65 -2.776 13.424 -6.461 1.00 2.21 H new ATOM 0 HB3 PRO A 65 -2.786 15.013 -5.722 1.00 2.21 H new ATOM 0 HG2 PRO A 65 -3.825 12.384 -4.533 1.00 5.04 H new ATOM 0 HG3 PRO A 65 -2.755 13.551 -3.781 1.00 5.04 H new ATOM 0 HD2 PRO A 65 -5.424 13.638 -3.274 1.00 43.21 H new ATOM 0 HD3 PRO A 65 -4.509 15.126 -3.406 1.00 43.21 H new ATOM 936 N GLU A 66 -4.562 12.655 -8.084 1.00 14.40 N ATOM 937 CA GLU A 66 -4.851 11.538 -8.967 1.00 0.20 C ATOM 938 C GLU A 66 -3.711 10.532 -8.853 1.00 51.14 C ATOM 939 O GLU A 66 -2.663 10.839 -8.282 1.00 61.41 O ATOM 940 CB GLU A 66 -5.036 12.059 -10.396 1.00 31.10 C ATOM 941 CG GLU A 66 -3.735 12.668 -10.929 1.00 75.12 C ATOM 942 CD GLU A 66 -3.978 13.588 -12.118 1.00 31.23 C ATOM 943 OE1 GLU A 66 -4.572 14.674 -11.924 1.00 44.44 O ATOM 944 OE2 GLU A 66 -3.496 13.273 -13.220 1.00 51.25 O ATOM 0 H GLU A 66 -3.642 13.055 -8.265 1.00 14.40 H new ATOM 0 HA GLU A 66 -5.776 11.035 -8.687 1.00 0.20 H new ATOM 0 HB2 GLU A 66 -5.354 11.244 -11.046 1.00 31.10 H new ATOM 0 HB3 GLU A 66 -5.827 12.808 -10.414 1.00 31.10 H new ATOM 0 HG2 GLU A 66 -3.244 13.228 -10.133 1.00 75.12 H new ATOM 0 HG3 GLU A 66 -3.055 11.869 -11.223 1.00 75.12 H new ATOM 949 N ILE A 67 -3.875 9.340 -9.428 1.00 43.31 N ATOM 950 CA ILE A 67 -2.794 8.382 -9.641 1.00 14.40 C ATOM 951 C ILE A 67 -2.829 7.925 -11.100 1.00 11.44 C ATOM 952 O ILE A 67 -3.780 8.245 -11.818 1.00 0.12 O ATOM 953 CB ILE A 67 -2.882 7.208 -8.636 1.00 20.21 C ATOM 954 CG1 ILE A 67 -4.228 6.450 -8.741 1.00 63.23 C ATOM 955 CG2 ILE A 67 -2.605 7.718 -7.209 1.00 64.21 C ATOM 956 CD1 ILE A 67 -4.269 5.173 -7.898 1.00 2.04 C ATOM 0 H ILE A 67 -4.779 9.009 -9.764 1.00 43.31 H new ATOM 0 HA ILE A 67 -1.829 8.854 -9.454 1.00 14.40 H new ATOM 0 HB ILE A 67 -2.113 6.479 -8.890 1.00 20.21 H new ATOM 0 HG12 ILE A 67 -5.035 7.111 -8.426 1.00 63.23 H new ATOM 0 HG13 ILE A 67 -4.413 6.195 -9.784 1.00 63.23 H new ATOM 0 HG21 ILE A 67 -2.669 6.887 -6.507 1.00 64.21 H new ATOM 0 HG22 ILE A 67 -1.607 8.154 -7.166 1.00 64.21 H new ATOM 0 HG23 ILE A 67 -3.343 8.475 -6.943 1.00 64.21 H new ATOM 0 HD11 ILE A 67 -5.239 4.690 -8.016 1.00 2.04 H new ATOM 0 HD12 ILE A 67 -3.483 4.494 -8.228 1.00 2.04 H new ATOM 0 HD13 ILE A 67 -4.115 5.425 -6.849 1.00 2.04 H new ATOM 967 N GLN A 68 -1.820 7.168 -11.541 1.00 44.12 N ATOM 968 CA GLN A 68 -1.675 6.751 -12.940 1.00 64.33 C ATOM 969 C GLN A 68 -1.822 5.254 -13.154 1.00 33.13 C ATOM 970 O GLN A 68 -1.498 4.711 -14.214 1.00 24.11 O ATOM 971 CB GLN A 68 -0.323 7.233 -13.481 1.00 21.52 C ATOM 972 CG GLN A 68 -0.082 8.723 -13.240 1.00 20.50 C ATOM 973 CD GLN A 68 1.026 9.283 -14.122 1.00 3.21 C ATOM 974 OE1 GLN A 68 1.983 8.594 -14.479 1.00 64.11 O ATOM 975 NE2 GLN A 68 0.872 10.527 -14.527 1.00 13.03 N ATOM 0 H GLN A 68 -1.076 6.825 -10.934 1.00 44.12 H new ATOM 0 HA GLN A 68 -2.495 7.213 -13.490 1.00 64.33 H new ATOM 0 HB2 GLN A 68 0.476 6.660 -13.010 1.00 21.52 H new ATOM 0 HB3 GLN A 68 -0.273 7.030 -14.551 1.00 21.52 H new ATOM 0 HG2 GLN A 68 -1.005 9.272 -13.428 1.00 20.50 H new ATOM 0 HG3 GLN A 68 0.176 8.882 -12.193 1.00 20.50 H new ATOM 0 HE21 GLN A 68 0.068 11.070 -14.212 1.00 13.03 H new ATOM 0 HE22 GLN A 68 1.557 10.947 -15.155 1.00 13.03 H new ATOM 982 N LEU A 69 -2.336 4.580 -12.133 1.00 51.34 N ATOM 983 CA LEU A 69 -2.499 3.157 -12.141 1.00 14.11 C ATOM 984 C LEU A 69 -3.776 2.828 -12.896 1.00 4.04 C ATOM 985 O LEU A 69 -4.736 3.605 -12.929 1.00 12.41 O ATOM 986 CB LEU A 69 -2.563 2.624 -10.704 1.00 53.00 C ATOM 987 CG LEU A 69 -1.685 1.392 -10.431 1.00 3.22 C ATOM 988 CD1 LEU A 69 -2.080 0.207 -11.293 1.00 11.04 C ATOM 989 CD2 LEU A 69 -0.214 1.709 -10.674 1.00 52.03 C ATOM 0 H LEU A 69 -2.651 5.025 -11.271 1.00 51.34 H new ATOM 0 HA LEU A 69 -1.650 2.682 -12.633 1.00 14.11 H new ATOM 0 HB2 LEU A 69 -2.267 3.421 -10.023 1.00 53.00 H new ATOM 0 HB3 LEU A 69 -3.598 2.374 -10.471 1.00 53.00 H new ATOM 0 HG LEU A 69 -1.839 1.128 -9.385 1.00 3.22 H new ATOM 0 HD11 LEU A 69 -1.433 -0.640 -11.066 1.00 11.04 H new ATOM 0 HD12 LEU A 69 -3.116 -0.063 -11.088 1.00 11.04 H new ATOM 0 HD13 LEU A 69 -1.975 0.472 -12.345 1.00 11.04 H new ATOM 0 HD21 LEU A 69 0.387 0.822 -10.474 1.00 52.03 H new ATOM 0 HD22 LEU A 69 -0.074 2.016 -11.710 1.00 52.03 H new ATOM 0 HD23 LEU A 69 0.099 2.516 -10.011 1.00 52.03 H new ATOM 1000 N ASP A 70 -3.782 1.633 -13.442 1.00 41.01 N ATOM 1001 CA ASP A 70 -4.879 1.011 -14.159 1.00 22.22 C ATOM 1002 C ASP A 70 -5.961 0.620 -13.143 1.00 74.43 C ATOM 1003 O ASP A 70 -5.653 0.397 -11.968 1.00 32.51 O ATOM 1004 CB ASP A 70 -4.357 -0.221 -14.917 1.00 51.14 C ATOM 1005 CG ASP A 70 -3.400 0.115 -16.067 1.00 34.51 C ATOM 1006 OD1 ASP A 70 -2.457 0.919 -15.874 1.00 41.22 O ATOM 1007 OD2 ASP A 70 -3.522 -0.499 -17.146 1.00 34.11 O ATOM 0 H ASP A 70 -2.964 1.025 -13.395 1.00 41.01 H new ATOM 0 HA ASP A 70 -5.308 1.699 -14.887 1.00 22.22 H new ATOM 0 HB2 ASP A 70 -3.847 -0.879 -14.213 1.00 51.14 H new ATOM 0 HB3 ASP A 70 -5.206 -0.777 -15.315 1.00 51.14 H new ATOM 1011 N ASN A 71 -7.229 0.558 -13.553 1.00 53.04 N ATOM 1012 CA ASN A 71 -8.304 0.078 -12.687 1.00 60.12 C ATOM 1013 C ASN A 71 -8.338 -1.433 -12.843 1.00 14.34 C ATOM 1014 O ASN A 71 -8.429 -1.944 -13.958 1.00 13.33 O ATOM 1015 CB ASN A 71 -9.666 0.690 -13.028 1.00 62.53 C ATOM 1016 CG ASN A 71 -10.714 0.279 -11.995 1.00 63.13 C ATOM 1017 OD1 ASN A 71 -11.403 -0.721 -12.154 1.00 1.14 O ATOM 1018 ND2 ASN A 71 -10.851 0.996 -10.897 1.00 24.23 N ATOM 0 H ASN A 71 -7.536 0.836 -14.485 1.00 53.04 H new ATOM 0 HA ASN A 71 -8.107 0.377 -11.658 1.00 60.12 H new ATOM 0 HB2 ASN A 71 -9.585 1.777 -13.059 1.00 62.53 H new ATOM 0 HB3 ASN A 71 -9.979 0.365 -14.020 1.00 62.53 H new ATOM 0 HD21 ASN A 71 -11.528 0.717 -10.187 1.00 24.23 H new ATOM 0 HD22 ASN A 71 -10.280 1.830 -10.758 1.00 24.23 H new ATOM 1024 N ILE A 72 -8.197 -2.137 -11.731 1.00 3.32 N ATOM 1025 CA ILE A 72 -7.950 -3.564 -11.617 1.00 35.12 C ATOM 1026 C ILE A 72 -8.834 -4.065 -10.474 1.00 55.42 C ATOM 1027 O ILE A 72 -8.964 -3.404 -9.440 1.00 10.14 O ATOM 1028 CB ILE A 72 -6.432 -3.798 -11.383 1.00 62.23 C ATOM 1029 CG1 ILE A 72 -5.646 -3.492 -12.688 1.00 43.00 C ATOM 1030 CG2 ILE A 72 -6.168 -5.231 -10.882 1.00 41.34 C ATOM 1031 CD1 ILE A 72 -4.116 -3.590 -12.610 1.00 55.13 C ATOM 0 H ILE A 72 -8.257 -1.691 -10.816 1.00 3.32 H new ATOM 0 HA ILE A 72 -8.202 -4.120 -12.520 1.00 35.12 H new ATOM 0 HB ILE A 72 -6.082 -3.118 -10.606 1.00 62.23 H new ATOM 0 HG12 ILE A 72 -5.992 -4.177 -13.462 1.00 43.00 H new ATOM 0 HG13 ILE A 72 -5.906 -2.485 -13.014 1.00 43.00 H new ATOM 0 HG21 ILE A 72 -5.098 -5.370 -10.726 1.00 41.34 H new ATOM 0 HG22 ILE A 72 -6.696 -5.391 -9.942 1.00 41.34 H new ATOM 0 HG23 ILE A 72 -6.523 -5.947 -11.624 1.00 41.34 H new ATOM 0 HD11 ILE A 72 -3.686 -3.354 -13.583 1.00 55.13 H new ATOM 0 HD12 ILE A 72 -3.744 -2.884 -11.868 1.00 55.13 H new ATOM 0 HD13 ILE A 72 -3.830 -4.602 -12.323 1.00 55.13 H new ATOM 1042 N ASP A 73 -9.429 -5.242 -10.668 1.00 15.33 N ATOM 1043 CA ASP A 73 -10.318 -5.878 -9.709 1.00 34.22 C ATOM 1044 C ASP A 73 -9.525 -6.357 -8.502 1.00 65.30 C ATOM 1045 O ASP A 73 -8.854 -7.389 -8.583 1.00 1.45 O ATOM 1046 CB ASP A 73 -11.048 -7.070 -10.343 1.00 5.22 C ATOM 1047 CG ASP A 73 -12.338 -6.667 -11.038 1.00 4.03 C ATOM 1048 OD1 ASP A 73 -13.366 -6.505 -10.339 1.00 41.03 O ATOM 1049 OD2 ASP A 73 -12.299 -6.486 -12.273 1.00 22.45 O ATOM 0 H ASP A 73 -9.300 -5.789 -11.519 1.00 15.33 H new ATOM 0 HA ASP A 73 -11.058 -5.142 -9.395 1.00 34.22 H new ATOM 0 HB2 ASP A 73 -10.388 -7.553 -11.063 1.00 5.22 H new ATOM 0 HB3 ASP A 73 -11.271 -7.806 -9.571 1.00 5.22 H new ATOM 1053 N TYR A 74 -9.594 -5.655 -7.371 1.00 64.44 N ATOM 1054 CA TYR A 74 -8.874 -6.062 -6.165 1.00 22.24 C ATOM 1055 C TYR A 74 -9.556 -7.190 -5.396 1.00 44.10 C ATOM 1056 O TYR A 74 -8.951 -7.755 -4.489 1.00 3.22 O ATOM 1057 CB TYR A 74 -8.591 -4.850 -5.271 1.00 50.23 C ATOM 1058 CG TYR A 74 -7.716 -3.814 -5.948 1.00 62.12 C ATOM 1059 CD1 TYR A 74 -6.577 -4.210 -6.679 1.00 52.01 C ATOM 1060 CD2 TYR A 74 -8.064 -2.453 -5.889 1.00 70.42 C ATOM 1061 CE1 TYR A 74 -5.838 -3.268 -7.403 1.00 3.43 C ATOM 1062 CE2 TYR A 74 -7.292 -1.495 -6.567 1.00 12.43 C ATOM 1063 CZ TYR A 74 -6.192 -1.906 -7.353 1.00 4.12 C ATOM 1064 OH TYR A 74 -5.488 -0.996 -8.075 1.00 22.34 O ATOM 0 H TYR A 74 -10.142 -4.801 -7.265 1.00 64.44 H new ATOM 0 HA TYR A 74 -7.923 -6.478 -6.496 1.00 22.24 H new ATOM 0 HB2 TYR A 74 -9.535 -4.389 -4.982 1.00 50.23 H new ATOM 0 HB3 TYR A 74 -8.106 -5.186 -4.354 1.00 50.23 H new ATOM 0 HD1 TYR A 74 -6.273 -5.246 -6.680 1.00 52.01 H new ATOM 0 HD2 TYR A 74 -8.928 -2.143 -5.320 1.00 70.42 H new ATOM 0 HE1 TYR A 74 -4.996 -3.586 -8.000 1.00 3.43 H new ATOM 0 HE2 TYR A 74 -7.539 -0.447 -6.488 1.00 12.43 H new ATOM 0 HH TYR A 74 -5.863 -0.102 -7.929 1.00 22.34 H new ATOM 1073 N ASN A 75 -10.759 -7.610 -5.791 1.00 32.34 N ATOM 1074 CA ASN A 75 -11.509 -8.667 -5.137 1.00 13.31 C ATOM 1075 C ASN A 75 -10.909 -10.066 -5.389 1.00 24.52 C ATOM 1076 O ASN A 75 -11.542 -11.078 -5.098 1.00 13.42 O ATOM 1077 CB ASN A 75 -12.967 -8.550 -5.635 1.00 51.11 C ATOM 1078 CG ASN A 75 -13.851 -7.715 -4.715 1.00 24.24 C ATOM 1079 OD1 ASN A 75 -14.587 -6.846 -5.176 1.00 42.03 O ATOM 1080 ND2 ASN A 75 -13.754 -7.882 -3.409 1.00 14.13 N ATOM 0 H ASN A 75 -11.245 -7.211 -6.594 1.00 32.34 H new ATOM 0 HA ASN A 75 -11.465 -8.548 -4.054 1.00 13.31 H new ATOM 0 HB2 ASN A 75 -12.969 -8.107 -6.631 1.00 51.11 H new ATOM 0 HB3 ASN A 75 -13.393 -9.549 -5.729 1.00 51.11 H new ATOM 0 HD21 ASN A 75 -14.292 -7.288 -2.778 1.00 14.13 H new ATOM 0 HD22 ASN A 75 -13.142 -8.605 -3.031 1.00 14.13 H new ATOM 1086 N ASN A 76 -9.702 -10.144 -5.965 1.00 5.41 N ATOM 1087 CA ASN A 76 -9.001 -11.366 -6.331 1.00 14.34 C ATOM 1088 C ASN A 76 -7.848 -11.697 -5.384 1.00 72.23 C ATOM 1089 O ASN A 76 -7.293 -12.796 -5.501 1.00 41.44 O ATOM 1090 CB ASN A 76 -8.385 -11.214 -7.727 1.00 34.35 C ATOM 1091 CG ASN A 76 -9.397 -11.123 -8.851 1.00 42.04 C ATOM 1092 OD1 ASN A 76 -9.827 -12.132 -9.398 1.00 24.52 O ATOM 1093 ND2 ASN A 76 -9.770 -9.921 -9.235 1.00 54.10 N ATOM 0 H ASN A 76 -9.166 -9.308 -6.197 1.00 5.41 H new ATOM 0 HA ASN A 76 -9.744 -12.162 -6.288 1.00 14.34 H new ATOM 0 HB2 ASN A 76 -7.763 -10.319 -7.741 1.00 34.35 H new ATOM 0 HB3 ASN A 76 -7.727 -12.062 -7.915 1.00 34.35 H new ATOM 0 HD21 ASN A 76 -10.431 -9.814 -10.004 1.00 54.10 H new ATOM 0 HD22 ASN A 76 -9.398 -9.097 -8.764 1.00 54.10 H new ATOM 1099 N TYR A 77 -7.437 -10.782 -4.503 1.00 62.14 N ATOM 1100 CA TYR A 77 -6.214 -10.900 -3.711 1.00 22.23 C ATOM 1101 C TYR A 77 -6.602 -11.090 -2.250 1.00 63.31 C ATOM 1102 O TYR A 77 -7.645 -10.600 -1.823 1.00 50.14 O ATOM 1103 CB TYR A 77 -5.301 -9.685 -3.938 1.00 13.15 C ATOM 1104 CG TYR A 77 -5.037 -9.401 -5.410 1.00 5.35 C ATOM 1105 CD1 TYR A 77 -5.960 -8.623 -6.130 1.00 63.12 C ATOM 1106 CD2 TYR A 77 -3.928 -9.953 -6.081 1.00 31.23 C ATOM 1107 CE1 TYR A 77 -5.818 -8.436 -7.514 1.00 43.14 C ATOM 1108 CE2 TYR A 77 -3.758 -9.743 -7.463 1.00 61.51 C ATOM 1109 CZ TYR A 77 -4.705 -8.986 -8.186 1.00 50.31 C ATOM 1110 OH TYR A 77 -4.549 -8.796 -9.523 1.00 23.33 O ATOM 0 H TYR A 77 -7.955 -9.923 -4.318 1.00 62.14 H new ATOM 0 HA TYR A 77 -5.635 -11.769 -4.025 1.00 22.23 H new ATOM 0 HB2 TYR A 77 -5.756 -8.806 -3.481 1.00 13.15 H new ATOM 0 HB3 TYR A 77 -4.351 -9.853 -3.431 1.00 13.15 H new ATOM 0 HD1 TYR A 77 -6.789 -8.163 -5.612 1.00 63.12 H new ATOM 0 HD2 TYR A 77 -3.205 -10.540 -5.533 1.00 31.23 H new ATOM 0 HE1 TYR A 77 -6.558 -7.873 -8.063 1.00 43.14 H new ATOM 0 HE2 TYR A 77 -2.902 -10.162 -7.971 1.00 61.51 H new ATOM 0 HH TYR A 77 -3.729 -9.242 -9.823 1.00 23.33 H new ATOM 1119 N ASP A 78 -5.777 -11.819 -1.497 1.00 41.11 N ATOM 1120 CA ASP A 78 -6.066 -12.130 -0.087 1.00 5.05 C ATOM 1121 C ASP A 78 -5.198 -11.313 0.874 1.00 65.53 C ATOM 1122 O ASP A 78 -5.486 -11.194 2.065 1.00 50.24 O ATOM 1123 CB ASP A 78 -5.876 -13.629 0.146 1.00 64.50 C ATOM 1124 CG ASP A 78 -6.744 -14.130 1.295 1.00 23.44 C ATOM 1125 OD1 ASP A 78 -7.908 -14.508 1.021 1.00 30.42 O ATOM 1126 OD2 ASP A 78 -6.255 -14.192 2.443 1.00 10.41 O ATOM 0 H ASP A 78 -4.898 -12.209 -1.838 1.00 41.11 H new ATOM 0 HA ASP A 78 -7.100 -11.855 0.120 1.00 5.05 H new ATOM 0 HB2 ASP A 78 -6.125 -14.174 -0.764 1.00 64.50 H new ATOM 0 HB3 ASP A 78 -4.828 -13.835 0.364 1.00 64.50 H new ATOM 1130 N LEU A 79 -4.131 -10.720 0.341 1.00 1.11 N ATOM 1131 CA LEU A 79 -3.246 -9.765 0.982 1.00 50.22 C ATOM 1132 C LEU A 79 -2.937 -8.688 -0.059 1.00 73.52 C ATOM 1133 O LEU A 79 -2.743 -9.017 -1.235 1.00 1.01 O ATOM 1134 CB LEU A 79 -1.986 -10.514 1.439 1.00 33.24 C ATOM 1135 CG LEU A 79 -0.832 -9.618 1.921 1.00 51.21 C ATOM 1136 CD1 LEU A 79 -1.149 -8.861 3.217 1.00 31.31 C ATOM 1137 CD2 LEU A 79 0.401 -10.496 2.126 1.00 13.35 C ATOM 0 H LEU A 79 -3.847 -10.912 -0.620 1.00 1.11 H new ATOM 0 HA LEU A 79 -3.686 -9.294 1.861 1.00 50.22 H new ATOM 0 HB2 LEU A 79 -2.259 -11.194 2.246 1.00 33.24 H new ATOM 0 HB3 LEU A 79 -1.628 -11.128 0.613 1.00 33.24 H new ATOM 0 HG LEU A 79 -0.661 -8.858 1.159 1.00 51.21 H new ATOM 0 HD11 LEU A 79 -0.293 -8.249 3.500 1.00 31.31 H new ATOM 0 HD12 LEU A 79 -2.017 -8.221 3.061 1.00 31.31 H new ATOM 0 HD13 LEU A 79 -1.363 -9.575 4.012 1.00 31.31 H new ATOM 0 HD21 LEU A 79 1.233 -9.881 2.468 1.00 13.35 H new ATOM 0 HD22 LEU A 79 0.184 -11.260 2.872 1.00 13.35 H new ATOM 0 HD23 LEU A 79 0.667 -10.975 1.184 1.00 13.35 H new ATOM 1148 N ILE A 80 -2.862 -7.420 0.352 1.00 42.23 N ATOM 1149 CA ILE A 80 -2.415 -6.325 -0.504 1.00 11.22 C ATOM 1150 C ILE A 80 -1.462 -5.456 0.316 1.00 33.32 C ATOM 1151 O ILE A 80 -1.842 -4.892 1.340 1.00 50.30 O ATOM 1152 CB ILE A 80 -3.597 -5.537 -1.122 1.00 45.34 C ATOM 1153 CG1 ILE A 80 -4.504 -6.482 -1.948 1.00 52.41 C ATOM 1154 CG2 ILE A 80 -3.045 -4.401 -2.010 1.00 50.40 C ATOM 1155 CD1 ILE A 80 -5.670 -5.806 -2.675 1.00 44.44 C ATOM 0 H ILE A 80 -3.112 -7.125 1.296 1.00 42.23 H new ATOM 0 HA ILE A 80 -1.882 -6.717 -1.370 1.00 11.22 H new ATOM 0 HB ILE A 80 -4.199 -5.105 -0.323 1.00 45.34 H new ATOM 0 HG12 ILE A 80 -3.888 -6.996 -2.685 1.00 52.41 H new ATOM 0 HG13 ILE A 80 -4.907 -7.245 -1.282 1.00 52.41 H new ATOM 0 HG21 ILE A 80 -3.874 -3.845 -2.446 1.00 50.40 H new ATOM 0 HG22 ILE A 80 -2.436 -3.729 -1.405 1.00 50.40 H new ATOM 0 HG23 ILE A 80 -2.434 -4.826 -2.807 1.00 50.40 H new ATOM 0 HD11 ILE A 80 -6.241 -6.556 -3.223 1.00 44.44 H new ATOM 0 HD12 ILE A 80 -6.318 -5.316 -1.948 1.00 44.44 H new ATOM 0 HD13 ILE A 80 -5.282 -5.064 -3.373 1.00 44.44 H new ATOM 1166 N LEU A 81 -0.205 -5.377 -0.111 1.00 53.12 N ATOM 1167 CA LEU A 81 0.807 -4.504 0.458 1.00 41.20 C ATOM 1168 C LEU A 81 0.733 -3.126 -0.204 1.00 53.02 C ATOM 1169 O LEU A 81 0.531 -3.039 -1.423 1.00 14.05 O ATOM 1170 CB LEU A 81 2.185 -5.120 0.176 1.00 21.44 C ATOM 1171 CG LEU A 81 2.710 -6.038 1.285 1.00 12.02 C ATOM 1172 CD1 LEU A 81 1.839 -7.265 1.531 1.00 73.23 C ATOM 1173 CD2 LEU A 81 4.133 -6.502 0.949 1.00 21.45 C ATOM 0 H LEU A 81 0.145 -5.938 -0.888 1.00 53.12 H new ATOM 0 HA LEU A 81 0.645 -4.396 1.530 1.00 41.20 H new ATOM 0 HB2 LEU A 81 2.132 -5.687 -0.753 1.00 21.44 H new ATOM 0 HB3 LEU A 81 2.903 -4.315 0.018 1.00 21.44 H new ATOM 0 HG LEU A 81 2.694 -5.444 2.199 1.00 12.02 H new ATOM 0 HD11 LEU A 81 2.274 -7.866 2.329 1.00 73.23 H new ATOM 0 HD12 LEU A 81 0.837 -6.948 1.821 1.00 73.23 H new ATOM 0 HD13 LEU A 81 1.782 -7.859 0.619 1.00 73.23 H new ATOM 0 HD21 LEU A 81 4.500 -7.154 1.742 1.00 21.45 H new ATOM 0 HD22 LEU A 81 4.125 -7.047 0.005 1.00 21.45 H new ATOM 0 HD23 LEU A 81 4.787 -5.635 0.861 1.00 21.45 H new ATOM 1184 N ILE A 82 0.962 -2.067 0.578 1.00 43.21 N ATOM 1185 CA ILE A 82 1.057 -0.683 0.126 1.00 22.24 C ATOM 1186 C ILE A 82 2.356 -0.057 0.669 1.00 44.24 C ATOM 1187 O ILE A 82 2.884 -0.476 1.696 1.00 21.41 O ATOM 1188 CB ILE A 82 -0.247 0.085 0.477 1.00 24.10 C ATOM 1189 CG1 ILE A 82 -1.455 -0.455 -0.338 1.00 23.34 C ATOM 1190 CG2 ILE A 82 -0.145 1.598 0.209 1.00 71.24 C ATOM 1191 CD1 ILE A 82 -2.364 -1.366 0.490 1.00 10.41 C ATOM 0 H ILE A 82 1.091 -2.159 1.586 1.00 43.21 H new ATOM 0 HA ILE A 82 1.132 -0.624 -0.960 1.00 22.24 H new ATOM 0 HB ILE A 82 -0.395 -0.077 1.545 1.00 24.10 H new ATOM 0 HG12 ILE A 82 -2.037 0.385 -0.717 1.00 23.34 H new ATOM 0 HG13 ILE A 82 -1.087 -1.005 -1.204 1.00 23.34 H new ATOM 0 HG21 ILE A 82 -1.087 2.079 0.474 1.00 71.24 H new ATOM 0 HG22 ILE A 82 0.660 2.021 0.810 1.00 71.24 H new ATOM 0 HG23 ILE A 82 0.064 1.767 -0.847 1.00 71.24 H new ATOM 0 HD11 ILE A 82 -3.191 -1.714 -0.129 1.00 10.41 H new ATOM 0 HD12 ILE A 82 -1.792 -2.222 0.848 1.00 10.41 H new ATOM 0 HD13 ILE A 82 -2.757 -0.811 1.342 1.00 10.41 H new ATOM 1202 N GLY A 83 2.875 0.984 0.009 1.00 24.12 N ATOM 1203 CA GLY A 83 3.994 1.798 0.491 1.00 32.41 C ATOM 1204 C GLY A 83 3.882 3.223 -0.078 1.00 61.34 C ATOM 1205 O GLY A 83 3.447 3.358 -1.225 1.00 45.14 O ATOM 0 H GLY A 83 2.519 1.290 -0.897 1.00 24.12 H new ATOM 0 HA2 GLY A 83 3.990 1.830 1.581 1.00 32.41 H new ATOM 0 HA3 GLY A 83 4.940 1.349 0.189 1.00 32.41 H new ATOM 1209 N SER A 84 4.261 4.291 0.642 1.00 62.21 N ATOM 1210 CA SER A 84 4.250 5.657 0.100 1.00 30.51 C ATOM 1211 C SER A 84 5.286 6.553 0.823 1.00 25.22 C ATOM 1212 O SER A 84 5.796 6.164 1.873 1.00 14.33 O ATOM 1213 CB SER A 84 2.802 6.189 0.121 1.00 50.35 C ATOM 1214 OG SER A 84 2.549 7.245 1.025 1.00 50.32 O ATOM 0 H SER A 84 4.581 4.232 1.609 1.00 62.21 H new ATOM 0 HA SER A 84 4.572 5.665 -0.941 1.00 30.51 H new ATOM 0 HB2 SER A 84 2.544 6.525 -0.883 1.00 50.35 H new ATOM 0 HB3 SER A 84 2.134 5.362 0.362 1.00 50.35 H new ATOM 0 HG SER A 84 2.402 6.879 1.922 1.00 50.32 H new ATOM 1219 N PRO A 85 5.641 7.736 0.280 1.00 51.12 N ATOM 1220 CA PRO A 85 6.607 8.650 0.884 1.00 65.11 C ATOM 1221 C PRO A 85 6.096 9.403 2.110 1.00 11.22 C ATOM 1222 O PRO A 85 4.927 9.793 2.161 1.00 74.12 O ATOM 1223 CB PRO A 85 6.905 9.716 -0.170 1.00 5.03 C ATOM 1224 CG PRO A 85 6.073 9.380 -1.402 1.00 64.22 C ATOM 1225 CD PRO A 85 5.116 8.277 -0.958 1.00 61.24 C ATOM 0 HA PRO A 85 7.459 8.049 1.203 1.00 65.11 H new ATOM 0 HB2 PRO A 85 6.653 10.708 0.205 1.00 5.03 H new ATOM 0 HB3 PRO A 85 7.967 9.728 -0.415 1.00 5.03 H new ATOM 0 HG2 PRO A 85 5.527 10.254 -1.757 1.00 64.22 H new ATOM 0 HG3 PRO A 85 6.706 9.044 -2.223 1.00 64.22 H new ATOM 0 HD2 PRO A 85 4.112 8.674 -0.811 1.00 61.24 H new ATOM 0 HD3 PRO A 85 5.043 7.500 -1.719 1.00 61.24 H new ATOM 1230 N VAL A 86 7.021 9.796 2.986 1.00 62.24 N ATOM 1231 CA VAL A 86 6.824 10.907 3.913 1.00 22.32 C ATOM 1232 C VAL A 86 6.913 12.241 3.138 1.00 10.04 C ATOM 1233 O VAL A 86 7.471 12.309 2.041 1.00 54.25 O ATOM 1234 CB VAL A 86 7.864 10.765 5.046 1.00 11.12 C ATOM 1235 CG1 VAL A 86 8.073 11.968 5.957 1.00 23.12 C ATOM 1236 CG2 VAL A 86 7.379 9.645 5.961 1.00 74.22 C ATOM 0 H VAL A 86 7.934 9.348 3.072 1.00 62.24 H new ATOM 0 HA VAL A 86 5.836 10.895 4.373 1.00 22.32 H new ATOM 0 HB VAL A 86 8.811 10.602 4.531 1.00 11.12 H new ATOM 0 HG11 VAL A 86 8.829 11.730 6.706 1.00 23.12 H new ATOM 0 HG12 VAL A 86 8.405 12.820 5.364 1.00 23.12 H new ATOM 0 HG13 VAL A 86 7.135 12.215 6.454 1.00 23.12 H new ATOM 0 HG21 VAL A 86 8.087 9.511 6.778 1.00 74.22 H new ATOM 0 HG22 VAL A 86 6.401 9.905 6.367 1.00 74.22 H new ATOM 0 HG23 VAL A 86 7.301 8.718 5.392 1.00 74.22 H new ATOM 1246 N TRP A 87 6.379 13.317 3.722 1.00 11.00 N ATOM 1247 CA TRP A 87 6.543 14.726 3.339 1.00 11.32 C ATOM 1248 C TRP A 87 6.792 15.511 4.646 1.00 2.44 C ATOM 1249 O TRP A 87 7.179 14.885 5.634 1.00 41.24 O ATOM 1250 CB TRP A 87 5.338 15.224 2.521 1.00 65.55 C ATOM 1251 CG TRP A 87 5.559 16.039 1.275 1.00 73.21 C ATOM 1252 CD1 TRP A 87 6.720 16.404 0.665 1.00 34.52 C ATOM 1253 CD2 TRP A 87 4.494 16.637 0.480 1.00 25.40 C ATOM 1254 NE1 TRP A 87 6.429 17.161 -0.461 1.00 65.12 N ATOM 1255 CE2 TRP A 87 5.080 17.331 -0.608 1.00 4.13 C ATOM 1256 CE3 TRP A 87 3.089 16.688 0.580 1.00 53.44 C ATOM 1257 CZ2 TRP A 87 4.332 18.067 -1.523 1.00 34.14 C ATOM 1258 CZ3 TRP A 87 2.318 17.436 -0.329 1.00 12.13 C ATOM 1259 CH2 TRP A 87 2.947 18.162 -1.347 1.00 52.22 C ATOM 0 H TRP A 87 5.774 13.221 4.538 1.00 11.00 H new ATOM 0 HA TRP A 87 7.393 14.873 2.672 1.00 11.32 H new ATOM 0 HB2 TRP A 87 4.755 14.348 2.236 1.00 65.55 H new ATOM 0 HB3 TRP A 87 4.715 15.817 3.190 1.00 65.55 H new ATOM 0 HD1 TRP A 87 7.712 16.145 1.004 1.00 34.52 H new ATOM 0 HE1 TRP A 87 7.130 17.541 -1.097 1.00 65.12 H new ATOM 0 HE3 TRP A 87 2.594 16.142 1.370 1.00 53.44 H new ATOM 0 HZ2 TRP A 87 4.813 18.557 -2.356 1.00 34.14 H new ATOM 0 HZ3 TRP A 87 1.242 17.450 -0.241 1.00 12.13 H new ATOM 0 HH2 TRP A 87 2.363 18.796 -1.997 1.00 52.22 H new ATOM 1269 N SER A 88 6.659 16.842 4.699 1.00 73.35 N ATOM 1270 CA SER A 88 6.937 17.699 5.872 1.00 32.43 C ATOM 1271 C SER A 88 6.111 17.414 7.160 1.00 45.42 C ATOM 1272 O SER A 88 6.001 18.269 8.040 1.00 51.13 O ATOM 1273 CB SER A 88 6.810 19.166 5.428 1.00 65.53 C ATOM 1274 OG SER A 88 7.712 19.993 6.141 1.00 3.24 O ATOM 0 H SER A 88 6.341 17.381 3.893 1.00 73.35 H new ATOM 0 HA SER A 88 7.950 17.457 6.193 1.00 32.43 H new ATOM 0 HB2 SER A 88 7.007 19.244 4.359 1.00 65.53 H new ATOM 0 HB3 SER A 88 5.789 19.511 5.590 1.00 65.53 H new ATOM 0 HG SER A 88 7.613 20.920 5.840 1.00 3.24 H new ATOM 1279 N GLY A 89 5.524 16.228 7.317 1.00 24.31 N ATOM 1280 CA GLY A 89 4.823 15.756 8.505 1.00 42.25 C ATOM 1281 C GLY A 89 3.698 14.806 8.141 1.00 5.11 C ATOM 1282 O GLY A 89 3.329 13.951 8.945 1.00 3.13 O ATOM 0 H GLY A 89 5.527 15.531 6.572 1.00 24.31 H new ATOM 0 HA2 GLY A 89 5.526 15.253 9.169 1.00 42.25 H new ATOM 0 HA3 GLY A 89 4.420 16.607 9.054 1.00 42.25 H new ATOM 1286 N TYR A 90 3.207 14.893 6.910 1.00 65.51 N ATOM 1287 CA TYR A 90 1.992 14.250 6.440 1.00 25.32 C ATOM 1288 C TYR A 90 2.294 13.863 4.992 1.00 34.10 C ATOM 1289 O TYR A 90 2.958 14.648 4.315 1.00 21.23 O ATOM 1290 CB TYR A 90 0.823 15.266 6.454 1.00 43.43 C ATOM 1291 CG TYR A 90 0.956 16.441 7.420 1.00 73.34 C ATOM 1292 CD1 TYR A 90 1.800 17.524 7.097 1.00 63.23 C ATOM 1293 CD2 TYR A 90 0.307 16.428 8.664 1.00 13.14 C ATOM 1294 CE1 TYR A 90 2.081 18.524 8.041 1.00 32.40 C ATOM 1295 CE2 TYR A 90 0.589 17.420 9.623 1.00 41.24 C ATOM 1296 CZ TYR A 90 1.504 18.458 9.323 1.00 74.52 C ATOM 1297 OH TYR A 90 1.866 19.367 10.266 1.00 51.44 O ATOM 0 H TYR A 90 3.668 15.439 6.182 1.00 65.51 H new ATOM 0 HA TYR A 90 1.711 13.398 7.059 1.00 25.32 H new ATOM 0 HB2 TYR A 90 0.704 15.664 5.446 1.00 43.43 H new ATOM 0 HB3 TYR A 90 -0.094 14.728 6.694 1.00 43.43 H new ATOM 0 HD1 TYR A 90 2.236 17.585 6.111 1.00 63.23 H new ATOM 0 HD2 TYR A 90 -0.412 15.654 8.887 1.00 13.14 H new ATOM 0 HE1 TYR A 90 2.738 19.342 7.784 1.00 32.40 H new ATOM 0 HE2 TYR A 90 0.107 17.389 10.589 1.00 41.24 H new ATOM 0 HH TYR A 90 1.379 19.188 11.097 1.00 51.44 H new ATOM 1306 N PRO A 91 1.809 12.728 4.473 1.00 4.00 N ATOM 1307 CA PRO A 91 2.043 12.376 3.081 1.00 64.23 C ATOM 1308 C PRO A 91 1.294 13.311 2.134 1.00 71.22 C ATOM 1309 O PRO A 91 0.323 13.964 2.518 1.00 21.21 O ATOM 1310 CB PRO A 91 1.595 10.926 2.937 1.00 62.43 C ATOM 1311 CG PRO A 91 0.714 10.646 4.150 1.00 23.23 C ATOM 1312 CD PRO A 91 1.121 11.678 5.197 1.00 34.34 C ATOM 0 HA PRO A 91 3.094 12.484 2.812 1.00 64.23 H new ATOM 0 HB2 PRO A 91 1.043 10.777 2.009 1.00 62.43 H new ATOM 0 HB3 PRO A 91 2.451 10.252 2.911 1.00 62.43 H new ATOM 0 HG2 PRO A 91 -0.342 10.739 3.898 1.00 23.23 H new ATOM 0 HG3 PRO A 91 0.866 9.632 4.519 1.00 23.23 H new ATOM 0 HD2 PRO A 91 0.248 12.071 5.719 1.00 34.34 H new ATOM 0 HD3 PRO A 91 1.770 11.234 5.952 1.00 34.34 H new ATOM 1317 N ALA A 92 1.698 13.308 0.864 1.00 70.45 N ATOM 1318 CA ALA A 92 1.111 14.096 -0.219 1.00 51.22 C ATOM 1319 C ALA A 92 -0.223 13.503 -0.715 1.00 1.33 C ATOM 1320 O ALA A 92 -0.516 13.484 -1.906 1.00 2.10 O ATOM 1321 CB ALA A 92 2.131 14.204 -1.359 1.00 22.53 C ATOM 0 H ALA A 92 2.478 12.731 0.548 1.00 70.45 H new ATOM 0 HA ALA A 92 0.876 15.091 0.159 1.00 51.22 H new ATOM 0 HB1 ALA A 92 1.705 14.790 -2.174 1.00 22.53 H new ATOM 0 HB2 ALA A 92 3.034 14.693 -0.994 1.00 22.53 H new ATOM 0 HB3 ALA A 92 2.379 13.206 -1.721 1.00 22.53 H new ATOM 1327 N THR A 93 -0.978 12.866 0.175 1.00 33.42 N ATOM 1328 CA THR A 93 -2.192 12.099 -0.110 1.00 3.33 C ATOM 1329 C THR A 93 -2.065 11.156 -1.338 1.00 23.30 C ATOM 1330 O THR A 93 -2.959 11.119 -2.183 1.00 31.54 O ATOM 1331 CB THR A 93 -3.377 13.104 -0.239 1.00 73.52 C ATOM 1332 OG1 THR A 93 -3.145 14.112 -1.201 1.00 2.44 O ATOM 1333 CG2 THR A 93 -3.671 13.857 1.067 1.00 53.05 C ATOM 0 H THR A 93 -0.749 12.870 1.169 1.00 33.42 H new ATOM 0 HA THR A 93 -2.376 11.414 0.718 1.00 3.33 H new ATOM 0 HB THR A 93 -4.213 12.466 -0.526 1.00 73.52 H new ATOM 0 HG1 THR A 93 -3.919 14.711 -1.240 1.00 2.44 H new ATOM 0 HG21 THR A 93 -4.506 14.541 0.913 1.00 53.05 H new ATOM 0 HG22 THR A 93 -3.927 13.142 1.849 1.00 53.05 H new ATOM 0 HG23 THR A 93 -2.789 14.423 1.367 1.00 53.05 H new ATOM 1341 N PRO A 94 -1.052 10.273 -1.443 1.00 64.33 N ATOM 1342 CA PRO A 94 -0.878 9.414 -2.620 1.00 52.35 C ATOM 1343 C PRO A 94 -1.807 8.210 -2.616 1.00 21.23 C ATOM 1344 O PRO A 94 -2.253 7.782 -3.682 1.00 25.34 O ATOM 1345 CB PRO A 94 0.584 8.938 -2.592 1.00 2.01 C ATOM 1346 CG PRO A 94 0.925 8.990 -1.105 1.00 51.04 C ATOM 1347 CD PRO A 94 0.112 10.167 -0.586 1.00 52.34 C ATOM 0 HA PRO A 94 -1.120 9.979 -3.520 1.00 52.35 H new ATOM 0 HB2 PRO A 94 0.690 7.932 -2.997 1.00 2.01 H new ATOM 0 HB3 PRO A 94 1.233 9.588 -3.179 1.00 2.01 H new ATOM 0 HG2 PRO A 94 0.654 8.063 -0.600 1.00 51.04 H new ATOM 0 HG3 PRO A 94 1.993 9.140 -0.945 1.00 51.04 H new ATOM 0 HD2 PRO A 94 -0.183 10.007 0.451 1.00 52.34 H new ATOM 0 HD3 PRO A 94 0.698 11.085 -0.613 1.00 52.34 H new ATOM 1352 N ILE A 95 -2.121 7.665 -1.441 1.00 3.40 N ATOM 1353 CA ILE A 95 -2.836 6.402 -1.355 1.00 3.01 C ATOM 1354 C ILE A 95 -4.353 6.633 -1.431 1.00 11.13 C ATOM 1355 O ILE A 95 -5.066 5.702 -1.792 1.00 24.31 O ATOM 1356 CB ILE A 95 -2.336 5.601 -0.122 1.00 51.33 C ATOM 1357 CG1 ILE A 95 -0.803 5.348 -0.148 1.00 44.33 C ATOM 1358 CG2 ILE A 95 -3.040 4.244 0.024 1.00 74.25 C ATOM 1359 CD1 ILE A 95 -0.210 4.844 -1.481 1.00 23.44 C ATOM 0 H ILE A 95 -1.890 8.082 -0.539 1.00 3.40 H new ATOM 0 HA ILE A 95 -2.618 5.770 -2.216 1.00 3.01 H new ATOM 0 HB ILE A 95 -2.582 6.234 0.731 1.00 51.33 H new ATOM 0 HG12 ILE A 95 -0.299 6.277 0.120 1.00 44.33 H new ATOM 0 HG13 ILE A 95 -0.564 4.621 0.628 1.00 44.33 H new ATOM 0 HG21 ILE A 95 -2.653 3.726 0.901 1.00 74.25 H new ATOM 0 HG22 ILE A 95 -4.112 4.401 0.139 1.00 74.25 H new ATOM 0 HG23 ILE A 95 -2.855 3.641 -0.865 1.00 74.25 H new ATOM 0 HD11 ILE A 95 0.866 4.706 -1.372 1.00 23.44 H new ATOM 0 HD12 ILE A 95 -0.673 3.894 -1.749 1.00 23.44 H new ATOM 0 HD13 ILE A 95 -0.404 5.576 -2.265 1.00 23.44 H new ATOM 1370 N LYS A 96 -4.869 7.856 -1.210 1.00 22.34 N ATOM 1371 CA LYS A 96 -6.302 8.155 -1.230 1.00 31.22 C ATOM 1372 C LYS A 96 -6.941 7.627 -2.518 1.00 34.42 C ATOM 1373 O LYS A 96 -7.886 6.846 -2.449 1.00 54.02 O ATOM 1374 CB LYS A 96 -6.534 9.659 -0.975 1.00 64.21 C ATOM 1375 CG LYS A 96 -8.011 10.079 -1.091 1.00 54.02 C ATOM 1376 CD LYS A 96 -8.854 9.739 0.150 1.00 64.54 C ATOM 1377 CE LYS A 96 -8.583 10.791 1.232 1.00 72.21 C ATOM 1378 NZ LYS A 96 -9.170 10.452 2.542 1.00 61.32 N ATOM 0 H LYS A 96 -4.290 8.671 -1.010 1.00 22.34 H new ATOM 0 HA LYS A 96 -6.807 7.632 -0.417 1.00 31.22 H new ATOM 0 HB2 LYS A 96 -6.169 9.911 0.021 1.00 64.21 H new ATOM 0 HB3 LYS A 96 -5.943 10.236 -1.686 1.00 64.21 H new ATOM 0 HG2 LYS A 96 -8.060 11.153 -1.269 1.00 54.02 H new ATOM 0 HG3 LYS A 96 -8.450 9.591 -1.961 1.00 54.02 H new ATOM 0 HD2 LYS A 96 -9.914 9.724 -0.106 1.00 64.54 H new ATOM 0 HD3 LYS A 96 -8.601 8.745 0.518 1.00 64.54 H new ATOM 0 HE2 LYS A 96 -7.506 10.914 1.346 1.00 72.21 H new ATOM 0 HE3 LYS A 96 -8.980 11.751 0.902 1.00 72.21 H new ATOM 0 HZ1 LYS A 96 -9.144 11.288 3.161 1.00 61.32 H new ATOM 0 HZ2 LYS A 96 -10.156 10.147 2.412 1.00 61.32 H new ATOM 0 HZ3 LYS A 96 -8.624 9.682 2.978 1.00 61.32 H new ATOM 1388 N THR A 97 -6.397 7.982 -3.676 1.00 41.13 N ATOM 1389 CA THR A 97 -7.036 7.647 -4.947 1.00 5.40 C ATOM 1390 C THR A 97 -6.821 6.173 -5.349 1.00 34.51 C ATOM 1391 O THR A 97 -7.339 5.720 -6.365 1.00 63.11 O ATOM 1392 CB THR A 97 -6.523 8.614 -6.023 1.00 22.11 C ATOM 1393 OG1 THR A 97 -6.420 9.920 -5.495 1.00 62.31 O ATOM 1394 CG2 THR A 97 -7.415 8.706 -7.267 1.00 45.43 C ATOM 0 H THR A 97 -5.521 8.498 -3.764 1.00 41.13 H new ATOM 0 HA THR A 97 -8.115 7.761 -4.838 1.00 5.40 H new ATOM 0 HB THR A 97 -5.558 8.208 -6.325 1.00 22.11 H new ATOM 0 HG1 THR A 97 -7.314 10.257 -5.278 1.00 62.31 H new ATOM 0 HG21 THR A 97 -6.979 9.410 -7.976 1.00 45.43 H new ATOM 0 HG22 THR A 97 -7.492 7.724 -7.733 1.00 45.43 H new ATOM 0 HG23 THR A 97 -8.408 9.050 -6.978 1.00 45.43 H new ATOM 1402 N LEU A 98 -6.027 5.399 -4.601 1.00 14.42 N ATOM 1403 CA LEU A 98 -6.042 3.934 -4.691 1.00 42.23 C ATOM 1404 C LEU A 98 -7.100 3.393 -3.736 1.00 52.22 C ATOM 1405 O LEU A 98 -7.973 2.640 -4.139 1.00 1.41 O ATOM 1406 CB LEU A 98 -4.644 3.358 -4.394 1.00 11.43 C ATOM 1407 CG LEU A 98 -4.581 1.840 -4.103 1.00 32.24 C ATOM 1408 CD1 LEU A 98 -5.359 0.986 -5.113 1.00 4.33 C ATOM 1409 CD2 LEU A 98 -3.112 1.397 -4.088 1.00 31.12 C ATOM 0 H LEU A 98 -5.361 5.766 -3.921 1.00 14.42 H new ATOM 0 HA LEU A 98 -6.299 3.624 -5.704 1.00 42.23 H new ATOM 0 HB2 LEU A 98 -3.997 3.571 -5.245 1.00 11.43 H new ATOM 0 HB3 LEU A 98 -4.229 3.889 -3.537 1.00 11.43 H new ATOM 0 HG LEU A 98 -5.055 1.682 -3.134 1.00 32.24 H new ATOM 0 HD11 LEU A 98 -5.269 -0.067 -4.845 1.00 4.33 H new ATOM 0 HD12 LEU A 98 -6.410 1.275 -5.101 1.00 4.33 H new ATOM 0 HD13 LEU A 98 -4.951 1.142 -6.112 1.00 4.33 H new ATOM 0 HD21 LEU A 98 -3.056 0.328 -3.884 1.00 31.12 H new ATOM 0 HD22 LEU A 98 -2.659 1.605 -5.057 1.00 31.12 H new ATOM 0 HD23 LEU A 98 -2.575 1.943 -3.312 1.00 31.12 H new ATOM 1420 N LEU A 99 -7.025 3.762 -2.464 1.00 64.44 N ATOM 1421 CA LEU A 99 -7.839 3.239 -1.374 1.00 43.21 C ATOM 1422 C LEU A 99 -9.332 3.406 -1.611 1.00 51.44 C ATOM 1423 O LEU A 99 -10.096 2.510 -1.245 1.00 64.42 O ATOM 1424 CB LEU A 99 -7.266 3.760 -0.062 1.00 61.41 C ATOM 1425 CG LEU A 99 -7.825 5.068 0.492 1.00 30.42 C ATOM 1426 CD1 LEU A 99 -9.061 4.744 1.313 1.00 70.13 C ATOM 1427 CD2 LEU A 99 -6.749 5.731 1.350 1.00 71.34 C ATOM 0 H LEU A 99 -6.362 4.470 -2.149 1.00 64.44 H new ATOM 0 HA LEU A 99 -7.776 2.152 -1.317 1.00 43.21 H new ATOM 0 HB2 LEU A 99 -7.408 2.988 0.695 1.00 61.41 H new ATOM 0 HB3 LEU A 99 -6.191 3.884 -0.193 1.00 61.41 H new ATOM 0 HG LEU A 99 -8.102 5.756 -0.307 1.00 30.42 H new ATOM 0 HD11 LEU A 99 -9.479 5.665 1.720 1.00 70.13 H new ATOM 0 HD12 LEU A 99 -9.802 4.258 0.678 1.00 70.13 H new ATOM 0 HD13 LEU A 99 -8.790 4.076 2.131 1.00 70.13 H new ATOM 0 HD21 LEU A 99 -7.132 6.668 1.754 1.00 71.34 H new ATOM 0 HD22 LEU A 99 -6.477 5.066 2.170 1.00 71.34 H new ATOM 0 HD23 LEU A 99 -5.869 5.932 0.739 1.00 71.34 H new ATOM 1438 N ASP A 100 -9.762 4.490 -2.258 1.00 14.04 N ATOM 1439 CA ASP A 100 -11.178 4.632 -2.630 1.00 13.23 C ATOM 1440 C ASP A 100 -11.580 3.651 -3.744 1.00 41.14 C ATOM 1441 O ASP A 100 -12.722 3.203 -3.789 1.00 14.03 O ATOM 1442 CB ASP A 100 -11.559 6.074 -2.994 1.00 70.10 C ATOM 1443 CG ASP A 100 -12.932 6.436 -2.416 1.00 51.30 C ATOM 1444 OD1 ASP A 100 -12.995 6.731 -1.200 1.00 53.10 O ATOM 1445 OD2 ASP A 100 -13.951 6.365 -3.139 1.00 32.52 O ATOM 0 H ASP A 100 -9.166 5.271 -2.533 1.00 14.04 H new ATOM 0 HA ASP A 100 -11.749 4.374 -1.738 1.00 13.23 H new ATOM 0 HB2 ASP A 100 -10.805 6.762 -2.611 1.00 70.10 H new ATOM 0 HB3 ASP A 100 -11.574 6.189 -4.078 1.00 70.10 H new ATOM 1449 N GLN A 101 -10.646 3.222 -4.602 1.00 63.21 N ATOM 1450 CA GLN A 101 -10.816 2.121 -5.560 1.00 23.15 C ATOM 1451 C GLN A 101 -10.667 0.735 -4.893 1.00 52.02 C ATOM 1452 O GLN A 101 -10.610 -0.265 -5.615 1.00 2.41 O ATOM 1453 CB GLN A 101 -9.822 2.223 -6.747 1.00 53.12 C ATOM 1454 CG GLN A 101 -9.840 3.527 -7.553 1.00 21.15 C ATOM 1455 CD GLN A 101 -8.840 3.486 -8.714 1.00 30.21 C ATOM 1456 OE1 GLN A 101 -8.961 2.727 -9.675 1.00 31.22 O ATOM 1457 NE2 GLN A 101 -7.794 4.284 -8.679 1.00 11.02 N ATOM 0 H GLN A 101 -9.720 3.646 -4.650 1.00 63.21 H new ATOM 0 HA GLN A 101 -11.833 2.219 -5.940 1.00 23.15 H new ATOM 0 HB2 GLN A 101 -8.814 2.077 -6.359 1.00 53.12 H new ATOM 0 HB3 GLN A 101 -10.023 1.398 -7.431 1.00 53.12 H new ATOM 0 HG2 GLN A 101 -10.843 3.701 -7.942 1.00 21.15 H new ATOM 0 HG3 GLN A 101 -9.603 4.364 -6.897 1.00 21.15 H new ATOM 0 HE21 GLN A 101 -7.667 4.924 -7.895 1.00 11.02 H new ATOM 0 HE22 GLN A 101 -7.110 4.262 -9.436 1.00 11.02 H new ATOM 1464 N MET A 102 -10.555 0.631 -3.558 1.00 14.34 N ATOM 1465 CA MET A 102 -10.433 -0.643 -2.830 1.00 52.40 C ATOM 1466 C MET A 102 -11.652 -0.950 -1.953 1.00 34.33 C ATOM 1467 O MET A 102 -11.637 -1.953 -1.244 1.00 24.24 O ATOM 1468 CB MET A 102 -9.182 -0.673 -1.932 1.00 2.01 C ATOM 1469 CG MET A 102 -7.854 -0.485 -2.660 1.00 63.52 C ATOM 1470 SD MET A 102 -6.400 -0.725 -1.600 1.00 44.23 S ATOM 1471 CE MET A 102 -6.423 -2.533 -1.463 1.00 51.13 C ATOM 0 H MET A 102 -10.547 1.445 -2.944 1.00 14.34 H new ATOM 0 HA MET A 102 -10.355 -1.403 -3.608 1.00 52.40 H new ATOM 0 HB2 MET A 102 -9.278 0.107 -1.177 1.00 2.01 H new ATOM 0 HB3 MET A 102 -9.157 -1.626 -1.404 1.00 2.01 H new ATOM 0 HG2 MET A 102 -7.804 -1.186 -3.494 1.00 63.52 H new ATOM 0 HG3 MET A 102 -7.821 0.518 -3.085 1.00 63.52 H new ATOM 0 HE1 MET A 102 -5.485 -2.877 -1.027 1.00 51.13 H new ATOM 0 HE2 MET A 102 -7.253 -2.839 -0.827 1.00 51.13 H new ATOM 0 HE3 MET A 102 -6.544 -2.971 -2.454 1.00 51.13 H new ATOM 1479 N LYS A 103 -12.698 -0.127 -1.954 1.00 10.25 N ATOM 1480 CA LYS A 103 -13.769 -0.150 -0.949 1.00 70.34 C ATOM 1481 C LYS A 103 -14.735 -1.339 -1.084 1.00 34.33 C ATOM 1482 O LYS A 103 -15.824 -1.314 -0.506 1.00 50.30 O ATOM 1483 CB LYS A 103 -14.547 1.173 -1.066 1.00 13.44 C ATOM 1484 CG LYS A 103 -13.750 2.431 -0.712 1.00 61.11 C ATOM 1485 CD LYS A 103 -14.125 3.004 0.656 1.00 45.13 C ATOM 1486 CE LYS A 103 -13.230 4.223 0.870 1.00 70.20 C ATOM 1487 NZ LYS A 103 -13.787 5.195 1.821 1.00 31.45 N ATOM 0 H LYS A 103 -12.832 0.591 -2.666 1.00 10.25 H new ATOM 0 HA LYS A 103 -13.303 -0.268 0.029 1.00 70.34 H new ATOM 0 HB2 LYS A 103 -14.915 1.271 -2.087 1.00 13.44 H new ATOM 0 HB3 LYS A 103 -15.421 1.121 -0.416 1.00 13.44 H new ATOM 0 HG2 LYS A 103 -12.686 2.197 -0.723 1.00 61.11 H new ATOM 0 HG3 LYS A 103 -13.918 3.189 -1.477 1.00 61.11 H new ATOM 0 HD2 LYS A 103 -15.178 3.285 0.685 1.00 45.13 H new ATOM 0 HD3 LYS A 103 -13.971 2.265 1.443 1.00 45.13 H new ATOM 0 HE2 LYS A 103 -12.256 3.891 1.229 1.00 70.20 H new ATOM 0 HE3 LYS A 103 -13.065 4.716 -0.088 1.00 70.20 H new ATOM 0 HZ1 LYS A 103 -13.132 5.997 1.921 1.00 31.45 H new ATOM 0 HZ2 LYS A 103 -14.704 5.538 1.470 1.00 31.45 H new ATOM 0 HZ3 LYS A 103 -13.920 4.739 2.746 1.00 31.45 H new ATOM 1497 N ASN A 104 -14.415 -2.362 -1.881 1.00 25.25 N ATOM 1498 CA ASN A 104 -15.117 -3.650 -1.913 1.00 33.22 C ATOM 1499 C ASN A 104 -14.198 -4.820 -1.534 1.00 34.44 C ATOM 1500 O ASN A 104 -14.642 -5.969 -1.534 1.00 52.40 O ATOM 1501 CB ASN A 104 -15.775 -3.855 -3.292 1.00 1.25 C ATOM 1502 CG ASN A 104 -17.203 -3.343 -3.355 1.00 2.22 C ATOM 1503 OD1 ASN A 104 -17.480 -2.204 -2.751 1.00 53.30 O flip ATOM 1504 ND2 ASN A 104 -18.081 -3.951 -3.955 1.00 51.11 N flip ATOM 0 H ASN A 104 -13.639 -2.317 -2.541 1.00 25.25 H new ATOM 0 HA ASN A 104 -15.902 -3.629 -1.157 1.00 33.22 H new ATOM 0 HB2 ASN A 104 -15.180 -3.347 -4.051 1.00 1.25 H new ATOM 0 HB3 ASN A 104 -15.765 -4.917 -3.538 1.00 1.25 H new ATOM 0 HD21 ASN A 104 -17.864 -4.832 -4.421 1.00 51.11 H new ATOM 0 HD22 ASN A 104 -19.029 -3.576 -3.988 1.00 51.11 H new ATOM 1510 N TYR A 105 -12.928 -4.558 -1.215 1.00 65.34 N ATOM 1511 CA TYR A 105 -11.937 -5.550 -0.817 1.00 41.01 C ATOM 1512 C TYR A 105 -12.311 -6.213 0.513 1.00 41.00 C ATOM 1513 O TYR A 105 -12.982 -5.626 1.364 1.00 10.41 O ATOM 1514 CB TYR A 105 -10.575 -4.847 -0.696 1.00 22.13 C ATOM 1515 CG TYR A 105 -9.425 -5.730 -0.251 1.00 44.30 C ATOM 1516 CD1 TYR A 105 -8.854 -6.642 -1.154 1.00 73.10 C ATOM 1517 CD2 TYR A 105 -8.941 -5.656 1.070 1.00 23.52 C ATOM 1518 CE1 TYR A 105 -7.776 -7.448 -0.752 1.00 5.04 C ATOM 1519 CE2 TYR A 105 -7.858 -6.457 1.474 1.00 44.44 C ATOM 1520 CZ TYR A 105 -7.254 -7.342 0.554 1.00 63.44 C ATOM 1521 OH TYR A 105 -6.171 -8.088 0.903 1.00 1.21 O ATOM 0 H TYR A 105 -12.551 -3.610 -1.229 1.00 65.34 H new ATOM 0 HA TYR A 105 -11.894 -6.338 -1.569 1.00 41.01 H new ATOM 0 HB2 TYR A 105 -10.323 -4.411 -1.663 1.00 22.13 H new ATOM 0 HB3 TYR A 105 -10.672 -4.022 0.010 1.00 22.13 H new ATOM 0 HD1 TYR A 105 -9.244 -6.724 -2.158 1.00 73.10 H new ATOM 0 HD2 TYR A 105 -9.404 -4.981 1.775 1.00 23.52 H new ATOM 0 HE1 TYR A 105 -7.344 -8.153 -1.447 1.00 5.04 H new ATOM 0 HE2 TYR A 105 -7.489 -6.395 2.487 1.00 44.44 H new ATOM 0 HH TYR A 105 -5.700 -7.654 1.645 1.00 1.21 H new ATOM 1530 N ARG A 106 -11.802 -7.425 0.724 1.00 12.03 N ATOM 1531 CA ARG A 106 -11.597 -8.089 1.995 1.00 24.35 C ATOM 1532 C ARG A 106 -10.336 -8.938 1.868 1.00 12.02 C ATOM 1533 O ARG A 106 -10.047 -9.376 0.750 1.00 64.41 O ATOM 1534 CB ARG A 106 -12.813 -8.857 2.426 1.00 32.45 C ATOM 1535 CG ARG A 106 -13.163 -10.052 1.574 1.00 62.11 C ATOM 1536 CD ARG A 106 -12.654 -11.386 2.119 1.00 33.15 C ATOM 1537 NE ARG A 106 -13.228 -12.525 1.385 1.00 63.51 N ATOM 1538 CZ ARG A 106 -14.325 -13.215 1.710 1.00 73.41 C ATOM 1539 NH1 ARG A 106 -15.081 -12.891 2.755 1.00 61.52 N ATOM 1540 NH2 ARG A 106 -14.654 -14.271 0.988 1.00 12.45 N ATOM 0 H ARG A 106 -11.501 -8.009 -0.056 1.00 12.03 H new ATOM 0 HA ARG A 106 -11.449 -7.364 2.796 1.00 24.35 H new ATOM 0 HB2 ARG A 106 -12.663 -9.195 3.451 1.00 32.45 H new ATOM 0 HB3 ARG A 106 -13.665 -8.178 2.436 1.00 32.45 H new ATOM 0 HG2 ARG A 106 -14.247 -10.105 1.471 1.00 62.11 H new ATOM 0 HG3 ARG A 106 -12.755 -9.902 0.574 1.00 62.11 H new ATOM 0 HD2 ARG A 106 -11.567 -11.418 2.048 1.00 33.15 H new ATOM 0 HD3 ARG A 106 -12.907 -11.468 3.176 1.00 33.15 H new ATOM 0 HE ARG A 106 -12.737 -12.818 0.540 1.00 63.51 H new ATOM 0 HH11 ARG A 106 -14.830 -12.093 3.338 1.00 61.52 H new ATOM 0 HH12 ARG A 106 -15.912 -13.441 2.973 1.00 61.52 H new ATOM 0 HH21 ARG A 106 -14.074 -14.548 0.196 1.00 12.45 H new ATOM 0 HH22 ARG A 106 -15.488 -14.809 1.222 1.00 12.45 H new ATOM 1551 N GLY A 107 -9.639 -9.187 2.970 1.00 21.21 N ATOM 1552 CA GLY A 107 -8.291 -9.744 3.011 1.00 64.52 C ATOM 1553 C GLY A 107 -7.434 -8.886 3.943 1.00 33.31 C ATOM 1554 O GLY A 107 -7.946 -7.966 4.586 1.00 30.35 O ATOM 0 H GLY A 107 -10.013 -8.998 3.900 1.00 21.21 H new ATOM 0 HA2 GLY A 107 -8.319 -10.775 3.365 1.00 64.52 H new ATOM 0 HA3 GLY A 107 -7.859 -9.762 2.010 1.00 64.52 H new ATOM 1558 N GLU A 108 -6.138 -9.158 4.038 1.00 1.34 N ATOM 1559 CA GLU A 108 -5.237 -8.429 4.931 1.00 11.13 C ATOM 1560 C GLU A 108 -4.568 -7.298 4.146 1.00 54.23 C ATOM 1561 O GLU A 108 -4.507 -7.347 2.912 1.00 33.35 O ATOM 1562 CB GLU A 108 -4.244 -9.405 5.589 1.00 23.21 C ATOM 1563 CG GLU A 108 -5.014 -10.354 6.530 1.00 53.01 C ATOM 1564 CD GLU A 108 -4.190 -11.091 7.594 1.00 22.35 C ATOM 1565 OE1 GLU A 108 -2.969 -10.859 7.756 1.00 22.32 O ATOM 1566 OE2 GLU A 108 -4.823 -11.855 8.361 1.00 52.33 O ATOM 0 H GLU A 108 -5.678 -9.891 3.498 1.00 1.34 H new ATOM 0 HA GLU A 108 -5.786 -7.966 5.751 1.00 11.13 H new ATOM 0 HB2 GLU A 108 -3.719 -9.978 4.825 1.00 23.21 H new ATOM 0 HB3 GLU A 108 -3.489 -8.852 6.148 1.00 23.21 H new ATOM 0 HG2 GLU A 108 -5.786 -9.776 7.038 1.00 53.01 H new ATOM 0 HG3 GLU A 108 -5.524 -11.099 5.919 1.00 53.01 H new ATOM 1571 N VAL A 109 -4.086 -6.263 4.833 1.00 42.20 N ATOM 1572 CA VAL A 109 -3.476 -5.096 4.208 1.00 12.22 C ATOM 1573 C VAL A 109 -2.332 -4.651 5.111 1.00 50.11 C ATOM 1574 O VAL A 109 -2.482 -4.656 6.332 1.00 63.24 O ATOM 1575 CB VAL A 109 -4.512 -3.959 4.020 1.00 3.03 C ATOM 1576 CG1 VAL A 109 -3.975 -2.885 3.063 1.00 63.54 C ATOM 1577 CG2 VAL A 109 -5.857 -4.427 3.443 1.00 63.13 C ATOM 0 H VAL A 109 -4.110 -6.213 5.852 1.00 42.20 H new ATOM 0 HA VAL A 109 -3.105 -5.345 3.214 1.00 12.22 H new ATOM 0 HB VAL A 109 -4.676 -3.571 5.025 1.00 3.03 H new ATOM 0 HG11 VAL A 109 -4.719 -2.097 2.946 1.00 63.54 H new ATOM 0 HG12 VAL A 109 -3.058 -2.460 3.471 1.00 63.54 H new ATOM 0 HG13 VAL A 109 -3.767 -3.334 2.092 1.00 63.54 H new ATOM 0 HG21 VAL A 109 -6.527 -3.573 3.342 1.00 63.13 H new ATOM 0 HG22 VAL A 109 -5.696 -4.879 2.464 1.00 63.13 H new ATOM 0 HG23 VAL A 109 -6.304 -5.161 4.113 1.00 63.13 H new ATOM 1587 N ALA A 110 -1.205 -4.233 4.539 1.00 51.04 N ATOM 1588 CA ALA A 110 -0.097 -3.637 5.281 1.00 51.31 C ATOM 1589 C ALA A 110 0.409 -2.419 4.506 1.00 72.33 C ATOM 1590 O ALA A 110 0.179 -2.328 3.296 1.00 71.40 O ATOM 1591 CB ALA A 110 0.989 -4.691 5.487 1.00 74.53 C ATOM 0 H ALA A 110 -1.034 -4.300 3.536 1.00 51.04 H new ATOM 0 HA ALA A 110 -0.415 -3.299 6.267 1.00 51.31 H new ATOM 0 HB1 ALA A 110 1.820 -4.254 6.040 1.00 74.53 H new ATOM 0 HB2 ALA A 110 0.580 -5.530 6.050 1.00 74.53 H new ATOM 0 HB3 ALA A 110 1.343 -5.043 4.518 1.00 74.53 H new ATOM 1597 N SER A 111 1.059 -1.472 5.186 1.00 72.25 N ATOM 1598 CA SER A 111 1.369 -0.163 4.624 1.00 51.23 C ATOM 1599 C SER A 111 2.714 0.312 5.166 1.00 44.35 C ATOM 1600 O SER A 111 2.942 0.272 6.372 1.00 53.25 O ATOM 1601 CB SER A 111 0.224 0.794 4.976 1.00 61.14 C ATOM 1602 OG SER A 111 0.399 2.073 4.400 1.00 34.23 O ATOM 0 H SER A 111 1.385 -1.595 6.145 1.00 72.25 H new ATOM 0 HA SER A 111 1.456 -0.205 3.538 1.00 51.23 H new ATOM 0 HB2 SER A 111 -0.720 0.370 4.634 1.00 61.14 H new ATOM 0 HB3 SER A 111 0.155 0.892 6.059 1.00 61.14 H new ATOM 0 HG SER A 111 -0.333 2.661 4.680 1.00 34.23 H new ATOM 1607 N PHE A 112 3.618 0.762 4.294 1.00 71.22 N ATOM 1608 CA PHE A 112 4.996 1.103 4.665 1.00 3.00 C ATOM 1609 C PHE A 112 5.393 2.445 4.085 1.00 73.54 C ATOM 1610 O PHE A 112 4.605 3.087 3.386 1.00 4.31 O ATOM 1611 CB PHE A 112 5.960 0.019 4.194 1.00 13.44 C ATOM 1612 CG PHE A 112 5.381 -1.373 4.239 1.00 42.21 C ATOM 1613 CD1 PHE A 112 4.936 -1.916 5.453 1.00 23.31 C ATOM 1614 CD2 PHE A 112 5.172 -2.060 3.038 1.00 52.15 C ATOM 1615 CE1 PHE A 112 4.257 -3.141 5.457 1.00 61.15 C ATOM 1616 CE2 PHE A 112 4.575 -3.331 3.060 1.00 51.11 C ATOM 1617 CZ PHE A 112 4.117 -3.872 4.268 1.00 10.34 C ATOM 0 H PHE A 112 3.415 0.902 3.304 1.00 71.22 H new ATOM 0 HA PHE A 112 5.048 1.169 5.752 1.00 3.00 H new ATOM 0 HB2 PHE A 112 6.270 0.240 3.173 1.00 13.44 H new ATOM 0 HB3 PHE A 112 6.857 0.050 4.813 1.00 13.44 H new ATOM 0 HD1 PHE A 112 5.116 -1.392 6.380 1.00 23.31 H new ATOM 0 HD2 PHE A 112 5.468 -1.615 2.099 1.00 52.15 H new ATOM 0 HE1 PHE A 112 3.840 -3.523 6.377 1.00 61.15 H new ATOM 0 HE2 PHE A 112 4.469 -3.892 2.144 1.00 51.11 H new ATOM 0 HZ PHE A 112 3.657 -4.849 4.284 1.00 10.34 H new ATOM 1626 N PHE A 113 6.613 2.883 4.386 1.00 53.11 N ATOM 1627 CA PHE A 113 7.086 4.210 4.066 1.00 65.41 C ATOM 1628 C PHE A 113 8.583 4.334 4.339 1.00 43.32 C ATOM 1629 O PHE A 113 9.180 3.502 5.026 1.00 14.43 O ATOM 1630 CB PHE A 113 6.277 5.260 4.855 1.00 70.33 C ATOM 1631 CG PHE A 113 6.397 5.298 6.374 1.00 42.11 C ATOM 1632 CD1 PHE A 113 6.441 4.148 7.197 1.00 13.20 C ATOM 1633 CD2 PHE A 113 6.386 6.561 6.981 1.00 70.31 C ATOM 1634 CE1 PHE A 113 6.503 4.272 8.595 1.00 50.21 C ATOM 1635 CE2 PHE A 113 6.518 6.686 8.369 1.00 2.20 C ATOM 1636 CZ PHE A 113 6.540 5.545 9.184 1.00 10.03 C ATOM 0 H PHE A 113 7.306 2.309 4.867 1.00 53.11 H new ATOM 0 HA PHE A 113 6.936 4.393 3.002 1.00 65.41 H new ATOM 0 HB2 PHE A 113 6.559 6.243 4.478 1.00 70.33 H new ATOM 0 HB3 PHE A 113 5.224 5.115 4.612 1.00 70.33 H new ATOM 0 HD1 PHE A 113 6.427 3.166 6.747 1.00 13.20 H new ATOM 0 HD2 PHE A 113 6.275 7.446 6.372 1.00 70.31 H new ATOM 0 HE1 PHE A 113 6.522 3.388 9.216 1.00 50.21 H new ATOM 0 HE2 PHE A 113 6.603 7.666 8.814 1.00 2.20 H new ATOM 0 HZ PHE A 113 6.585 5.645 10.258 1.00 10.03 H new ATOM 1645 N THR A 114 9.166 5.424 3.851 1.00 4.33 N ATOM 1646 CA THR A 114 10.561 5.809 4.022 1.00 30.50 C ATOM 1647 C THR A 114 10.605 7.201 4.656 1.00 33.54 C ATOM 1648 O THR A 114 9.594 7.908 4.659 1.00 70.11 O ATOM 1649 CB THR A 114 11.250 5.768 2.642 1.00 34.23 C ATOM 1650 OG1 THR A 114 10.432 6.269 1.595 1.00 70.24 O ATOM 1651 CG2 THR A 114 11.573 4.321 2.271 1.00 72.11 C ATOM 0 H THR A 114 8.646 6.101 3.293 1.00 4.33 H new ATOM 0 HA THR A 114 11.094 5.125 4.682 1.00 30.50 H new ATOM 0 HB THR A 114 12.140 6.390 2.736 1.00 34.23 H new ATOM 0 HG1 THR A 114 10.239 5.550 0.958 1.00 70.24 H new ATOM 0 HG21 THR A 114 12.059 4.295 1.296 1.00 72.11 H new ATOM 0 HG22 THR A 114 12.239 3.893 3.020 1.00 72.11 H new ATOM 0 HG23 THR A 114 10.651 3.741 2.232 1.00 72.11 H new ATOM 1659 N SER A 115 11.733 7.625 5.228 1.00 14.14 N ATOM 1660 CA SER A 115 11.933 9.016 5.630 1.00 22.34 C ATOM 1661 C SER A 115 13.424 9.320 5.733 1.00 62.42 C ATOM 1662 O SER A 115 14.273 8.425 5.648 1.00 23.13 O ATOM 1663 CB SER A 115 11.266 9.334 6.983 1.00 22.30 C ATOM 1664 OG SER A 115 10.170 8.490 7.259 1.00 42.41 O ATOM 0 H SER A 115 12.528 7.017 5.424 1.00 14.14 H new ATOM 0 HA SER A 115 11.468 9.639 4.866 1.00 22.34 H new ATOM 0 HB2 SER A 115 12.004 9.237 7.779 1.00 22.30 H new ATOM 0 HB3 SER A 115 10.930 10.371 6.984 1.00 22.30 H new ATOM 0 HG SER A 115 9.783 8.730 8.127 1.00 42.41 H new ATOM 1669 N ALA A 116 13.725 10.587 6.016 1.00 33.11 N ATOM 1670 CA ALA A 116 15.035 11.104 6.352 1.00 24.14 C ATOM 1671 C ALA A 116 15.285 11.044 7.858 1.00 70.53 C ATOM 1672 O ALA A 116 16.003 11.887 8.417 1.00 50.45 O ATOM 1673 CB ALA A 116 15.118 12.534 5.816 1.00 61.52 C ATOM 0 H ALA A 116 13.013 11.317 6.014 1.00 33.11 H new ATOM 0 HA ALA A 116 15.814 10.493 5.895 1.00 24.14 H new ATOM 0 HB1 ALA A 116 16.095 12.955 6.053 1.00 61.52 H new ATOM 0 HB2 ALA A 116 14.978 12.526 4.735 1.00 61.52 H new ATOM 0 HB3 ALA A 116 14.340 13.141 6.278 1.00 61.52 H new ATOM 1679 N GLY A 117 14.644 10.089 8.533 1.00 33.30 N ATOM 1680 CA GLY A 117 14.843 9.860 9.943 1.00 31.51 C ATOM 1681 C GLY A 117 14.038 10.800 10.840 1.00 14.23 C ATOM 1682 O GLY A 117 14.388 10.987 12.010 1.00 54.44 O ATOM 0 H GLY A 117 13.970 9.455 8.103 1.00 33.30 H new ATOM 0 HA2 GLY A 117 14.572 8.830 10.176 1.00 31.51 H new ATOM 0 HA3 GLY A 117 15.902 9.971 10.174 1.00 31.51 H new ATOM 1686 N THR A 118 12.985 11.417 10.314 1.00 5.11 N ATOM 1687 CA THR A 118 12.071 12.318 11.007 1.00 45.43 C ATOM 1688 C THR A 118 10.664 12.076 10.449 1.00 62.14 C ATOM 1689 O THR A 118 10.516 11.412 9.423 1.00 63.23 O ATOM 1690 CB THR A 118 12.544 13.786 10.864 1.00 65.51 C ATOM 1691 OG1 THR A 118 13.415 13.978 9.759 1.00 21.50 O ATOM 1692 CG2 THR A 118 13.309 14.223 12.117 1.00 42.05 C ATOM 0 H THR A 118 12.732 11.294 9.334 1.00 5.11 H new ATOM 0 HA THR A 118 12.055 12.120 12.079 1.00 45.43 H new ATOM 0 HB THR A 118 11.640 14.376 10.716 1.00 65.51 H new ATOM 0 HG1 THR A 118 13.682 14.920 9.713 1.00 21.50 H new ATOM 0 HG21 THR A 118 13.635 15.257 12.002 1.00 42.05 H new ATOM 0 HG22 THR A 118 12.658 14.143 12.987 1.00 42.05 H new ATOM 0 HG23 THR A 118 14.179 13.581 12.254 1.00 42.05 H new ATOM 1700 N ASN A 119 9.631 12.597 11.124 1.00 31.20 N ATOM 1701 CA ASN A 119 8.220 12.553 10.715 1.00 11.42 C ATOM 1702 C ASN A 119 7.657 11.127 10.618 1.00 1.34 C ATOM 1703 O ASN A 119 6.557 10.942 10.088 1.00 73.54 O ATOM 1704 CB ASN A 119 7.964 13.360 9.428 1.00 11.14 C ATOM 1705 CG ASN A 119 8.646 14.713 9.367 1.00 65.33 C ATOM 1706 OD1 ASN A 119 7.964 15.792 9.677 1.00 30.52 O flip ATOM 1707 ND2 ASN A 119 9.827 14.802 9.055 1.00 2.00 N flip ATOM 0 H ASN A 119 9.762 13.083 12.011 1.00 31.20 H new ATOM 0 HA ASN A 119 7.666 13.038 11.519 1.00 11.42 H new ATOM 0 HB2 ASN A 119 8.293 12.767 8.575 1.00 11.14 H new ATOM 0 HB3 ASN A 119 6.890 13.507 9.319 1.00 11.14 H new ATOM 0 HD21 ASN A 119 10.356 13.963 8.815 1.00 2.00 H new ATOM 0 HD22 ASN A 119 10.282 15.715 9.036 1.00 2.00 H new ATOM 1713 N HIS A 120 8.395 10.136 11.137 1.00 30.10 N ATOM 1714 CA HIS A 120 8.074 8.714 11.123 1.00 51.05 C ATOM 1715 C HIS A 120 6.722 8.501 11.804 1.00 72.32 C ATOM 1716 O HIS A 120 5.725 8.188 11.161 1.00 65.53 O ATOM 1717 CB HIS A 120 9.216 7.937 11.810 1.00 24.44 C ATOM 1718 CG HIS A 120 8.991 6.456 11.996 1.00 64.42 C ATOM 1719 ND1 HIS A 120 9.099 5.486 11.025 1.00 3.41 N ATOM 1720 CD2 HIS A 120 8.696 5.827 13.176 1.00 22.11 C ATOM 1721 CE1 HIS A 120 8.833 4.302 11.602 1.00 11.12 C ATOM 1722 NE2 HIS A 120 8.601 4.462 12.912 1.00 12.01 N ATOM 0 H HIS A 120 9.282 10.323 11.604 1.00 30.10 H new ATOM 0 HA HIS A 120 7.988 8.338 10.104 1.00 51.05 H new ATOM 0 HB2 HIS A 120 10.126 8.075 11.226 1.00 24.44 H new ATOM 0 HB3 HIS A 120 9.395 8.383 12.788 1.00 24.44 H new ATOM 0 HD2 HIS A 120 8.561 6.302 14.136 1.00 22.11 H new ATOM 0 HE1 HIS A 120 8.810 3.355 11.083 1.00 11.12 H new ATOM 0 HE2 HIS A 120 8.394 3.726 13.587 1.00 12.01 H new ATOM 1729 N LYS A 121 6.672 8.699 13.122 1.00 54.33 N ATOM 1730 CA LYS A 121 5.517 8.397 13.949 1.00 42.13 C ATOM 1731 C LYS A 121 4.262 9.157 13.487 1.00 4.03 C ATOM 1732 O LYS A 121 3.187 8.568 13.425 1.00 44.35 O ATOM 1733 CB LYS A 121 5.938 8.688 15.397 1.00 33.11 C ATOM 1734 CG LYS A 121 5.213 7.791 16.393 1.00 62.51 C ATOM 1735 CD LYS A 121 5.826 7.859 17.802 1.00 31.12 C ATOM 1736 CE LYS A 121 7.131 7.052 17.919 1.00 14.21 C ATOM 1737 NZ LYS A 121 7.654 7.024 19.303 1.00 5.02 N ATOM 0 H LYS A 121 7.455 9.083 13.651 1.00 54.33 H new ATOM 0 HA LYS A 121 5.220 7.352 13.863 1.00 42.13 H new ATOM 0 HB2 LYS A 121 7.014 8.546 15.497 1.00 33.11 H new ATOM 0 HB3 LYS A 121 5.731 9.732 15.632 1.00 33.11 H new ATOM 0 HG2 LYS A 121 4.164 8.082 16.442 1.00 62.51 H new ATOM 0 HG3 LYS A 121 5.242 6.761 16.037 1.00 62.51 H new ATOM 0 HD2 LYS A 121 6.023 8.900 18.059 1.00 31.12 H new ATOM 0 HD3 LYS A 121 5.104 7.483 18.527 1.00 31.12 H new ATOM 0 HE2 LYS A 121 6.956 6.031 17.579 1.00 14.21 H new ATOM 0 HE3 LYS A 121 7.883 7.484 17.258 1.00 14.21 H new ATOM 0 HZ1 LYS A 121 8.533 6.469 19.331 1.00 5.02 H new ATOM 0 HZ2 LYS A 121 7.847 7.995 19.621 1.00 5.02 H new ATOM 0 HZ3 LYS A 121 6.949 6.588 19.932 1.00 5.02 H new ATOM 1747 N ALA A 122 4.424 10.417 13.071 1.00 3.24 N ATOM 1748 CA ALA A 122 3.367 11.283 12.570 1.00 12.42 C ATOM 1749 C ALA A 122 2.667 10.657 11.368 1.00 72.15 C ATOM 1750 O ALA A 122 1.443 10.648 11.331 1.00 44.02 O ATOM 1751 CB ALA A 122 3.927 12.666 12.209 1.00 72.44 C ATOM 0 H ALA A 122 5.336 10.875 13.077 1.00 3.24 H new ATOM 0 HA ALA A 122 2.629 11.405 13.363 1.00 12.42 H new ATOM 0 HB1 ALA A 122 3.121 13.299 11.836 1.00 72.44 H new ATOM 0 HB2 ALA A 122 4.367 13.123 13.095 1.00 72.44 H new ATOM 0 HB3 ALA A 122 4.691 12.560 11.439 1.00 72.44 H new ATOM 1757 N TYR A 123 3.419 10.120 10.396 1.00 24.44 N ATOM 1758 CA TYR A 123 2.842 9.444 9.233 1.00 25.22 C ATOM 1759 C TYR A 123 1.915 8.315 9.680 1.00 65.14 C ATOM 1760 O TYR A 123 0.840 8.177 9.115 1.00 4.12 O ATOM 1761 CB TYR A 123 3.956 8.871 8.360 1.00 11.03 C ATOM 1762 CG TYR A 123 3.508 8.166 7.090 1.00 22.12 C ATOM 1763 CD1 TYR A 123 3.027 6.838 7.124 1.00 14.24 C ATOM 1764 CD2 TYR A 123 3.648 8.821 5.854 1.00 70.23 C ATOM 1765 CE1 TYR A 123 2.645 6.180 5.938 1.00 24.40 C ATOM 1766 CE2 TYR A 123 3.313 8.154 4.666 1.00 62.22 C ATOM 1767 CZ TYR A 123 2.791 6.847 4.701 1.00 2.11 C ATOM 1768 OH TYR A 123 2.407 6.286 3.525 1.00 11.00 O ATOM 0 H TYR A 123 4.439 10.144 10.397 1.00 24.44 H new ATOM 0 HA TYR A 123 2.266 10.170 8.659 1.00 25.22 H new ATOM 0 HB2 TYR A 123 4.629 9.683 8.084 1.00 11.03 H new ATOM 0 HB3 TYR A 123 4.535 8.167 8.958 1.00 11.03 H new ATOM 0 HD1 TYR A 123 2.951 6.321 8.069 1.00 14.24 H new ATOM 0 HD2 TYR A 123 4.013 9.837 5.819 1.00 70.23 H new ATOM 0 HE1 TYR A 123 2.245 5.177 5.974 1.00 24.40 H new ATOM 0 HE2 TYR A 123 3.457 8.648 3.716 1.00 62.22 H new ATOM 0 HH TYR A 123 1.654 5.679 3.683 1.00 11.00 H new ATOM 1777 N VAL A 124 2.293 7.525 10.690 1.00 21.11 N ATOM 1778 CA VAL A 124 1.500 6.381 11.142 1.00 53.14 C ATOM 1779 C VAL A 124 0.099 6.851 11.569 1.00 32.12 C ATOM 1780 O VAL A 124 -0.905 6.220 11.217 1.00 71.12 O ATOM 1781 CB VAL A 124 2.238 5.624 12.268 1.00 62.42 C ATOM 1782 CG1 VAL A 124 1.624 4.242 12.484 1.00 30.13 C ATOM 1783 CG2 VAL A 124 3.732 5.409 11.970 1.00 4.12 C ATOM 0 H VAL A 124 3.156 7.662 11.216 1.00 21.11 H new ATOM 0 HA VAL A 124 1.372 5.677 10.320 1.00 53.14 H new ATOM 0 HB VAL A 124 2.135 6.252 13.153 1.00 62.42 H new ATOM 0 HG11 VAL A 124 2.159 3.727 13.281 1.00 30.13 H new ATOM 0 HG12 VAL A 124 0.575 4.349 12.761 1.00 30.13 H new ATOM 0 HG13 VAL A 124 1.699 3.663 11.564 1.00 30.13 H new ATOM 0 HG21 VAL A 124 4.195 4.872 12.798 1.00 4.12 H new ATOM 0 HG22 VAL A 124 3.840 4.827 11.055 1.00 4.12 H new ATOM 0 HG23 VAL A 124 4.221 6.375 11.846 1.00 4.12 H new ATOM 1793 N SER A 125 0.017 7.985 12.269 1.00 32.40 N ATOM 1794 CA SER A 125 -1.271 8.587 12.586 1.00 43.44 C ATOM 1795 C SER A 125 -1.923 9.196 11.340 1.00 54.03 C ATOM 1796 O SER A 125 -3.072 8.889 11.028 1.00 74.24 O ATOM 1797 CB SER A 125 -1.067 9.620 13.696 1.00 74.45 C ATOM 1798 OG SER A 125 -1.097 8.967 14.948 1.00 21.51 O ATOM 0 H SER A 125 0.824 8.499 12.623 1.00 32.40 H new ATOM 0 HA SER A 125 -1.960 7.820 12.941 1.00 43.44 H new ATOM 0 HB2 SER A 125 -0.114 10.132 13.562 1.00 74.45 H new ATOM 0 HB3 SER A 125 -1.847 10.380 13.650 1.00 74.45 H new ATOM 0 HG SER A 125 -0.965 9.624 15.663 1.00 21.51 H new ATOM 1803 N HIS A 126 -1.218 10.066 10.619 1.00 62.41 N ATOM 1804 CA HIS A 126 -1.796 10.850 9.535 1.00 51.25 C ATOM 1805 C HIS A 126 -2.305 9.980 8.390 1.00 70.55 C ATOM 1806 O HIS A 126 -3.310 10.322 7.767 1.00 50.44 O ATOM 1807 CB HIS A 126 -0.759 11.859 9.024 1.00 65.15 C ATOM 1808 CG HIS A 126 -0.371 12.896 10.048 1.00 53.14 C ATOM 1809 ND1 HIS A 126 0.829 13.568 10.121 1.00 2.33 N ATOM 1810 CD2 HIS A 126 -1.173 13.379 11.044 1.00 23.12 C ATOM 1811 CE1 HIS A 126 0.739 14.461 11.118 1.00 31.24 C ATOM 1812 NE2 HIS A 126 -0.474 14.399 11.691 1.00 70.42 N ATOM 0 H HIS A 126 -0.226 10.246 10.773 1.00 62.41 H new ATOM 0 HA HIS A 126 -2.662 11.378 9.933 1.00 51.25 H new ATOM 0 HB2 HIS A 126 0.134 11.321 8.708 1.00 65.15 H new ATOM 0 HB3 HIS A 126 -1.157 12.362 8.143 1.00 65.15 H new ATOM 0 HD1 HIS A 126 1.641 13.414 9.524 1.00 2.33 H new ATOM 0 HD2 HIS A 126 -2.167 13.034 11.286 1.00 23.12 H new ATOM 0 HE1 HIS A 126 1.529 15.134 11.417 1.00 31.24 H new ATOM 1819 N PHE A 127 -1.622 8.869 8.099 1.00 45.14 N ATOM 1820 CA PHE A 127 -2.025 7.880 7.112 1.00 63.44 C ATOM 1821 C PHE A 127 -3.431 7.402 7.450 1.00 51.21 C ATOM 1822 O PHE A 127 -4.323 7.532 6.616 1.00 30.22 O ATOM 1823 CB PHE A 127 -0.997 6.739 7.049 1.00 1.03 C ATOM 1824 CG PHE A 127 -1.379 5.626 6.095 1.00 41.23 C ATOM 1825 CD1 PHE A 127 -1.366 5.841 4.702 1.00 74.52 C ATOM 1826 CD2 PHE A 127 -1.784 4.379 6.605 1.00 74.21 C ATOM 1827 CE1 PHE A 127 -1.777 4.819 3.829 1.00 11.34 C ATOM 1828 CE2 PHE A 127 -2.193 3.361 5.731 1.00 11.32 C ATOM 1829 CZ PHE A 127 -2.209 3.585 4.343 1.00 33.30 C ATOM 0 H PHE A 127 -0.745 8.631 8.563 1.00 45.14 H new ATOM 0 HA PHE A 127 -2.051 8.317 6.114 1.00 63.44 H new ATOM 0 HB2 PHE A 127 -0.032 7.148 6.749 1.00 1.03 H new ATOM 0 HB3 PHE A 127 -0.869 6.321 8.048 1.00 1.03 H new ATOM 0 HD1 PHE A 127 -1.040 6.791 4.305 1.00 74.52 H new ATOM 0 HD2 PHE A 127 -1.780 4.205 7.671 1.00 74.21 H new ATOM 0 HE1 PHE A 127 -1.761 4.983 2.762 1.00 11.34 H new ATOM 0 HE2 PHE A 127 -2.496 2.402 6.125 1.00 11.32 H new ATOM 0 HZ PHE A 127 -2.553 2.810 3.674 1.00 33.30 H new ATOM 1838 N ASN A 128 -3.629 6.924 8.685 1.00 52.25 N ATOM 1839 CA ASN A 128 -4.886 6.353 9.154 1.00 44.23 C ATOM 1840 C ASN A 128 -6.048 7.293 8.880 1.00 24.21 C ATOM 1841 O ASN A 128 -7.023 6.865 8.273 1.00 33.34 O ATOM 1842 CB ASN A 128 -4.822 6.001 10.648 1.00 71.31 C ATOM 1843 CG ASN A 128 -4.365 4.573 10.837 1.00 14.01 C ATOM 1844 OD1 ASN A 128 -5.087 3.640 10.496 1.00 62.14 O ATOM 1845 ND2 ASN A 128 -3.164 4.381 11.352 1.00 1.01 N ATOM 0 H ASN A 128 -2.899 6.926 9.398 1.00 52.25 H new ATOM 0 HA ASN A 128 -5.050 5.430 8.598 1.00 44.23 H new ATOM 0 HB2 ASN A 128 -4.137 6.679 11.158 1.00 71.31 H new ATOM 0 HB3 ASN A 128 -5.803 6.138 11.102 1.00 71.31 H new ATOM 0 HD21 ASN A 128 -2.809 3.433 11.478 1.00 1.01 H new ATOM 0 HD22 ASN A 128 -2.592 5.180 11.624 1.00 1.01 H new ATOM 1851 N GLU A 129 -5.954 8.558 9.296 1.00 21.13 N ATOM 1852 CA GLU A 129 -7.068 9.515 9.239 1.00 74.23 C ATOM 1853 C GLU A 129 -7.617 9.714 7.816 1.00 22.41 C ATOM 1854 O GLU A 129 -8.785 10.082 7.637 1.00 24.50 O ATOM 1855 CB GLU A 129 -6.596 10.867 9.783 1.00 45.23 C ATOM 1856 CG GLU A 129 -6.218 10.808 11.267 1.00 54.14 C ATOM 1857 CD GLU A 129 -5.939 12.183 11.877 1.00 70.45 C ATOM 1858 OE1 GLU A 129 -5.248 13.013 11.249 1.00 22.22 O ATOM 1859 OE2 GLU A 129 -6.394 12.408 13.023 1.00 53.35 O ATOM 0 H GLU A 129 -5.098 8.953 9.685 1.00 21.13 H new ATOM 0 HA GLU A 129 -7.876 9.104 9.844 1.00 74.23 H new ATOM 0 HB2 GLU A 129 -5.735 11.206 9.206 1.00 45.23 H new ATOM 0 HB3 GLU A 129 -7.385 11.606 9.642 1.00 45.23 H new ATOM 0 HG2 GLU A 129 -7.025 10.330 11.821 1.00 54.14 H new ATOM 0 HG3 GLU A 129 -5.335 10.180 11.385 1.00 54.14 H new ATOM 1864 N TRP A 130 -6.775 9.489 6.804 1.00 14.40 N ATOM 1865 CA TRP A 130 -7.092 9.665 5.390 1.00 12.32 C ATOM 1866 C TRP A 130 -7.183 8.324 4.658 1.00 65.25 C ATOM 1867 O TRP A 130 -7.370 8.356 3.438 1.00 50.22 O ATOM 1868 CB TRP A 130 -6.059 10.601 4.747 1.00 21.23 C ATOM 1869 CG TRP A 130 -5.857 11.946 5.408 1.00 53.14 C ATOM 1870 CD1 TRP A 130 -6.688 12.548 6.295 1.00 70.41 C ATOM 1871 CD2 TRP A 130 -4.725 12.858 5.281 1.00 30.43 C ATOM 1872 NE1 TRP A 130 -6.134 13.724 6.753 1.00 73.15 N ATOM 1873 CE2 TRP A 130 -4.875 13.909 6.231 1.00 4.04 C ATOM 1874 CE3 TRP A 130 -3.562 12.890 4.486 1.00 65.23 C ATOM 1875 CZ2 TRP A 130 -3.871 14.857 6.466 1.00 45.34 C ATOM 1876 CZ3 TRP A 130 -2.543 13.835 4.705 1.00 44.03 C ATOM 1877 CH2 TRP A 130 -2.686 14.798 5.718 1.00 45.33 C ATOM 0 H TRP A 130 -5.819 9.167 6.956 1.00 14.40 H new ATOM 0 HA TRP A 130 -8.077 10.124 5.305 1.00 12.32 H new ATOM 0 HB2 TRP A 130 -5.099 10.085 4.725 1.00 21.23 H new ATOM 0 HB3 TRP A 130 -6.353 10.772 3.711 1.00 21.23 H new ATOM 0 HD1 TRP A 130 -7.649 12.160 6.600 1.00 70.41 H new ATOM 0 HE1 TRP A 130 -6.596 14.370 7.393 1.00 73.15 H new ATOM 0 HE3 TRP A 130 -3.450 12.171 3.688 1.00 65.23 H new ATOM 0 HZ2 TRP A 130 -4.008 15.624 7.214 1.00 45.34 H new ATOM 0 HZ3 TRP A 130 -1.652 13.820 4.095 1.00 44.03 H new ATOM 0 HH2 TRP A 130 -1.884 15.492 5.921 1.00 45.33 H new ATOM 1887 N ALA A 131 -7.058 7.185 5.354 1.00 10.14 N ATOM 1888 CA ALA A 131 -6.958 5.849 4.782 1.00 10.13 C ATOM 1889 C ALA A 131 -7.667 4.785 5.624 1.00 22.20 C ATOM 1890 O ALA A 131 -7.261 3.620 5.607 1.00 41.14 O ATOM 1891 CB ALA A 131 -5.475 5.485 4.577 1.00 2.44 C ATOM 0 H ALA A 131 -7.023 7.177 6.373 1.00 10.14 H new ATOM 0 HA ALA A 131 -7.470 5.866 3.820 1.00 10.13 H new ATOM 0 HB1 ALA A 131 -5.402 4.485 4.149 1.00 2.44 H new ATOM 0 HB2 ALA A 131 -5.014 6.204 3.900 1.00 2.44 H new ATOM 0 HB3 ALA A 131 -4.959 5.508 5.537 1.00 2.44 H new ATOM 1897 N ASP A 132 -8.688 5.145 6.395 1.00 70.33 N ATOM 1898 CA ASP A 132 -9.201 4.345 7.515 1.00 24.12 C ATOM 1899 C ASP A 132 -10.132 3.191 7.116 1.00 30.21 C ATOM 1900 O ASP A 132 -11.069 2.843 7.830 1.00 5.34 O ATOM 1901 CB ASP A 132 -9.890 5.289 8.509 1.00 22.14 C ATOM 1902 CG ASP A 132 -9.933 4.779 9.950 1.00 13.04 C ATOM 1903 OD1 ASP A 132 -9.150 3.877 10.352 1.00 21.34 O ATOM 1904 OD2 ASP A 132 -10.667 5.434 10.730 1.00 50.15 O ATOM 0 H ASP A 132 -9.197 6.019 6.260 1.00 70.33 H new ATOM 0 HA ASP A 132 -8.343 3.849 7.970 1.00 24.12 H new ATOM 0 HB2 ASP A 132 -9.375 6.250 8.493 1.00 22.14 H new ATOM 0 HB3 ASP A 132 -10.911 5.469 8.171 1.00 22.14 H new ATOM 1908 N GLY A 133 -9.929 2.617 5.936 1.00 65.21 N ATOM 1909 CA GLY A 133 -10.969 1.914 5.192 1.00 3.05 C ATOM 1910 C GLY A 133 -10.968 0.392 5.276 1.00 32.41 C ATOM 1911 O GLY A 133 -12.043 -0.188 5.144 1.00 14.05 O ATOM 0 H GLY A 133 -9.026 2.627 5.462 1.00 65.21 H new ATOM 0 HA2 GLY A 133 -11.937 2.272 5.542 1.00 3.05 H new ATOM 0 HA3 GLY A 133 -10.885 2.196 4.142 1.00 3.05 H new ATOM 1915 N LEU A 134 -9.814 -0.265 5.425 1.00 13.01 N ATOM 1916 CA LEU A 134 -9.689 -1.729 5.372 1.00 14.44 C ATOM 1917 C LEU A 134 -8.838 -2.219 6.560 1.00 63.20 C ATOM 1918 O LEU A 134 -8.207 -1.407 7.250 1.00 11.05 O ATOM 1919 CB LEU A 134 -9.090 -2.177 4.013 1.00 30.24 C ATOM 1920 CG LEU A 134 -9.947 -2.052 2.725 1.00 72.50 C ATOM 1921 CD1 LEU A 134 -11.277 -2.788 2.826 1.00 12.14 C ATOM 1922 CD2 LEU A 134 -10.174 -0.629 2.201 1.00 5.25 C ATOM 0 H LEU A 134 -8.926 0.210 5.588 1.00 13.01 H new ATOM 0 HA LEU A 134 -10.678 -2.180 5.452 1.00 14.44 H new ATOM 0 HB2 LEU A 134 -8.175 -1.606 3.854 1.00 30.24 H new ATOM 0 HB3 LEU A 134 -8.799 -3.223 4.112 1.00 30.24 H new ATOM 0 HG LEU A 134 -9.318 -2.541 1.981 1.00 72.50 H new ATOM 0 HD11 LEU A 134 -11.832 -2.665 1.896 1.00 12.14 H new ATOM 0 HD12 LEU A 134 -11.094 -3.848 3.002 1.00 12.14 H new ATOM 0 HD13 LEU A 134 -11.858 -2.378 3.652 1.00 12.14 H new ATOM 0 HD21 LEU A 134 -10.785 -0.667 1.299 1.00 5.25 H new ATOM 0 HD22 LEU A 134 -10.685 -0.038 2.961 1.00 5.25 H new ATOM 0 HD23 LEU A 134 -9.213 -0.169 1.969 1.00 5.25 H new ATOM 1933 N ASN A 135 -8.806 -3.530 6.816 1.00 22.45 N ATOM 1934 CA ASN A 135 -8.099 -4.164 7.937 1.00 30.31 C ATOM 1935 C ASN A 135 -6.574 -4.135 7.748 1.00 54.00 C ATOM 1936 O ASN A 135 -6.031 -4.897 6.942 1.00 2.33 O ATOM 1937 CB ASN A 135 -8.590 -5.610 8.117 1.00 71.41 C ATOM 1938 CG ASN A 135 -7.771 -6.350 9.173 1.00 41.20 C ATOM 1939 OD1 ASN A 135 -7.997 -6.207 10.370 1.00 34.32 O ATOM 1940 ND2 ASN A 135 -6.806 -7.146 8.747 1.00 50.33 N ATOM 0 H ASN A 135 -9.290 -4.207 6.226 1.00 22.45 H new ATOM 0 HA ASN A 135 -8.323 -3.591 8.837 1.00 30.31 H new ATOM 0 HB2 ASN A 135 -9.641 -5.606 8.407 1.00 71.41 H new ATOM 0 HB3 ASN A 135 -8.524 -6.139 7.166 1.00 71.41 H new ATOM 0 HD21 ASN A 135 -6.232 -7.656 9.418 1.00 50.33 H new ATOM 0 HD22 ASN A 135 -6.635 -7.250 7.747 1.00 50.33 H new ATOM 1946 N VAL A 136 -5.891 -3.271 8.500 1.00 3.01 N ATOM 1947 CA VAL A 136 -4.434 -3.173 8.565 1.00 44.00 C ATOM 1948 C VAL A 136 -3.887 -4.298 9.458 1.00 32.13 C ATOM 1949 O VAL A 136 -4.531 -4.671 10.442 1.00 22.25 O ATOM 1950 CB VAL A 136 -4.058 -1.780 9.122 1.00 51.24 C ATOM 1951 CG1 VAL A 136 -2.547 -1.556 9.255 1.00 3.13 C ATOM 1952 CG2 VAL A 136 -4.640 -0.652 8.256 1.00 30.45 C ATOM 0 H VAL A 136 -6.357 -2.594 9.104 1.00 3.01 H new ATOM 0 HA VAL A 136 -3.994 -3.285 7.574 1.00 44.00 H new ATOM 0 HB VAL A 136 -4.492 -1.756 10.121 1.00 51.24 H new ATOM 0 HG11 VAL A 136 -2.361 -0.558 9.652 1.00 3.13 H new ATOM 0 HG12 VAL A 136 -2.127 -2.300 9.932 1.00 3.13 H new ATOM 0 HG13 VAL A 136 -2.078 -1.651 8.276 1.00 3.13 H new ATOM 0 HG21 VAL A 136 -4.356 0.313 8.676 1.00 30.45 H new ATOM 0 HG22 VAL A 136 -4.250 -0.734 7.241 1.00 30.45 H new ATOM 0 HG23 VAL A 136 -5.727 -0.733 8.235 1.00 30.45 H new ATOM 1962 N ILE A 137 -2.682 -4.802 9.151 1.00 54.31 N ATOM 1963 CA ILE A 137 -1.992 -5.873 9.875 1.00 22.41 C ATOM 1964 C ILE A 137 -0.528 -5.508 10.225 1.00 1.25 C ATOM 1965 O ILE A 137 0.205 -6.317 10.805 1.00 13.11 O ATOM 1966 CB ILE A 137 -2.106 -7.182 9.065 1.00 24.11 C ATOM 1967 CG1 ILE A 137 -1.311 -7.107 7.740 1.00 42.42 C ATOM 1968 CG2 ILE A 137 -3.584 -7.507 8.792 1.00 41.20 C ATOM 1969 CD1 ILE A 137 -0.114 -8.046 7.730 1.00 63.34 C ATOM 0 H ILE A 137 -2.142 -4.458 8.357 1.00 54.31 H new ATOM 0 HA ILE A 137 -2.479 -6.017 10.839 1.00 22.41 H new ATOM 0 HB ILE A 137 -1.669 -7.984 9.661 1.00 24.11 H new ATOM 0 HG12 ILE A 137 -1.971 -7.355 6.909 1.00 42.42 H new ATOM 0 HG13 ILE A 137 -0.969 -6.084 7.582 1.00 42.42 H new ATOM 0 HG21 ILE A 137 -3.653 -8.432 8.220 1.00 41.20 H new ATOM 0 HG22 ILE A 137 -4.111 -7.625 9.739 1.00 41.20 H new ATOM 0 HG23 ILE A 137 -4.036 -6.694 8.224 1.00 41.20 H new ATOM 0 HD11 ILE A 137 0.411 -7.956 6.779 1.00 63.34 H new ATOM 0 HD12 ILE A 137 0.562 -7.783 8.544 1.00 63.34 H new ATOM 0 HD13 ILE A 137 -0.456 -9.073 7.860 1.00 63.34 H new ATOM 1980 N GLY A 138 -0.096 -4.282 9.907 1.00 11.35 N ATOM 1981 CA GLY A 138 1.164 -3.713 10.362 1.00 2.35 C ATOM 1982 C GLY A 138 1.533 -2.484 9.541 1.00 65.53 C ATOM 1983 O GLY A 138 1.273 -2.447 8.335 1.00 50.21 O ATOM 0 H GLY A 138 -0.630 -3.649 9.312 1.00 11.35 H new ATOM 0 HA2 GLY A 138 1.086 -3.442 11.415 1.00 2.35 H new ATOM 0 HA3 GLY A 138 1.954 -4.459 10.282 1.00 2.35 H new ATOM 1987 N VAL A 139 2.162 -1.495 10.185 1.00 50.21 N ATOM 1988 CA VAL A 139 2.687 -0.292 9.552 1.00 73.55 C ATOM 1989 C VAL A 139 4.066 -0.025 10.149 1.00 14.32 C ATOM 1990 O VAL A 139 4.176 0.452 11.285 1.00 42.42 O ATOM 1991 CB VAL A 139 1.730 0.917 9.701 1.00 5.23 C ATOM 1992 CG1 VAL A 139 2.252 2.166 8.967 1.00 61.54 C ATOM 1993 CG2 VAL A 139 0.326 0.575 9.187 1.00 41.02 C ATOM 0 H VAL A 139 2.322 -1.515 11.192 1.00 50.21 H new ATOM 0 HA VAL A 139 2.774 -0.444 8.476 1.00 73.55 H new ATOM 0 HB VAL A 139 1.681 1.143 10.766 1.00 5.23 H new ATOM 0 HG11 VAL A 139 1.548 2.987 9.100 1.00 61.54 H new ATOM 0 HG12 VAL A 139 3.222 2.450 9.376 1.00 61.54 H new ATOM 0 HG13 VAL A 139 2.357 1.946 7.904 1.00 61.54 H new ATOM 0 HG21 VAL A 139 -0.325 1.441 9.304 1.00 41.02 H new ATOM 0 HG22 VAL A 139 0.381 0.301 8.133 1.00 41.02 H new ATOM 0 HG23 VAL A 139 -0.077 -0.261 9.758 1.00 41.02 H new ATOM 2003 N ALA A 140 5.130 -0.319 9.400 1.00 72.14 N ATOM 2004 CA ALA A 140 6.512 -0.021 9.768 1.00 22.11 C ATOM 2005 C ALA A 140 7.232 0.592 8.572 1.00 2.30 C ATOM 2006 O ALA A 140 6.753 0.485 7.442 1.00 70.53 O ATOM 2007 CB ALA A 140 7.219 -1.286 10.262 1.00 73.41 C ATOM 0 H ALA A 140 5.050 -0.784 8.496 1.00 72.14 H new ATOM 0 HA ALA A 140 6.526 0.699 10.586 1.00 22.11 H new ATOM 0 HB1 ALA A 140 8.247 -1.046 10.532 1.00 73.41 H new ATOM 0 HB2 ALA A 140 6.697 -1.677 11.135 1.00 73.41 H new ATOM 0 HB3 ALA A 140 7.217 -2.036 9.471 1.00 73.41 H new ATOM 2013 N ARG A 141 8.373 1.249 8.801 1.00 62.15 N ATOM 2014 CA ARG A 141 9.232 1.649 7.695 1.00 30.24 C ATOM 2015 C ARG A 141 10.052 0.443 7.247 1.00 62.21 C ATOM 2016 O ARG A 141 10.261 -0.475 8.051 1.00 3.03 O ATOM 2017 CB ARG A 141 10.115 2.823 8.139 1.00 1.00 C ATOM 2018 CG ARG A 141 11.327 2.385 8.973 1.00 25.13 C ATOM 2019 CD ARG A 141 11.888 3.526 9.820 1.00 3.41 C ATOM 2020 NE ARG A 141 13.342 3.702 9.640 1.00 53.05 N ATOM 2021 CZ ARG A 141 14.151 4.364 10.481 1.00 14.42 C ATOM 2022 NH1 ARG A 141 13.639 5.003 11.532 1.00 41.35 N ATOM 2023 NH2 ARG A 141 15.465 4.385 10.291 1.00 25.22 N ATOM 0 H ARG A 141 8.714 1.509 9.726 1.00 62.15 H new ATOM 0 HA ARG A 141 8.642 1.988 6.843 1.00 30.24 H new ATOM 0 HB2 ARG A 141 10.464 3.361 7.257 1.00 1.00 H new ATOM 0 HB3 ARG A 141 9.514 3.521 8.722 1.00 1.00 H new ATOM 0 HG2 ARG A 141 11.039 1.560 9.624 1.00 25.13 H new ATOM 0 HG3 ARG A 141 12.106 2.010 8.309 1.00 25.13 H new ATOM 0 HD2 ARG A 141 11.378 4.453 9.558 1.00 3.41 H new ATOM 0 HD3 ARG A 141 11.676 3.332 10.871 1.00 3.41 H new ATOM 0 HE ARG A 141 13.766 3.287 8.810 1.00 53.05 H new ATOM 0 HH11 ARG A 141 12.633 4.989 11.697 1.00 41.35 H new ATOM 0 HH12 ARG A 141 14.254 5.506 12.172 1.00 41.35 H new ATOM 0 HH21 ARG A 141 15.873 3.893 9.496 1.00 25.22 H new ATOM 0 HH22 ARG A 141 16.066 4.893 10.940 1.00 25.22 H new ATOM 2034 N ASP A 142 10.620 0.545 6.050 1.00 61.51 N ATOM 2035 CA ASP A 142 11.668 -0.344 5.532 1.00 71.25 C ATOM 2036 C ASP A 142 11.202 -1.820 5.546 1.00 4.24 C ATOM 2037 O ASP A 142 9.996 -2.070 5.434 1.00 12.34 O ATOM 2038 CB ASP A 142 13.031 -0.073 6.215 1.00 70.31 C ATOM 2039 CG ASP A 142 13.563 1.361 6.038 1.00 23.34 C ATOM 2040 OD1 ASP A 142 13.356 1.971 4.966 1.00 54.03 O ATOM 2041 OD2 ASP A 142 14.181 1.921 6.976 1.00 52.02 O ATOM 0 H ASP A 142 10.358 1.273 5.386 1.00 61.51 H new ATOM 0 HA ASP A 142 11.844 -0.117 4.481 1.00 71.25 H new ATOM 0 HB2 ASP A 142 12.937 -0.282 7.281 1.00 70.31 H new ATOM 0 HB3 ASP A 142 13.767 -0.771 5.817 1.00 70.31 H new ATOM 2045 N ASP A 143 12.099 -2.812 5.609 1.00 12.00 N ATOM 2046 CA ASP A 143 11.813 -4.249 5.411 1.00 50.31 C ATOM 2047 C ASP A 143 12.359 -5.131 6.545 1.00 65.23 C ATOM 2048 O ASP A 143 12.934 -6.199 6.311 1.00 73.25 O ATOM 2049 CB ASP A 143 12.247 -4.751 4.015 1.00 34.51 C ATOM 2050 CG ASP A 143 13.740 -4.646 3.680 1.00 64.31 C ATOM 2051 OD1 ASP A 143 14.540 -4.170 4.516 1.00 11.34 O ATOM 2052 OD2 ASP A 143 14.133 -5.008 2.544 1.00 33.52 O ATOM 0 H ASP A 143 13.084 -2.635 5.807 1.00 12.00 H new ATOM 0 HA ASP A 143 10.728 -4.345 5.452 1.00 50.31 H new ATOM 0 HB2 ASP A 143 11.950 -5.795 3.921 1.00 34.51 H new ATOM 0 HB3 ASP A 143 11.689 -4.192 3.264 1.00 34.51 H new ATOM 2056 N SER A 144 12.131 -4.715 7.792 1.00 3.30 N ATOM 2057 CA SER A 144 12.373 -5.421 9.021 1.00 1.41 C ATOM 2058 C SER A 144 11.249 -6.391 9.431 1.00 54.13 C ATOM 2059 O SER A 144 11.541 -7.290 10.217 1.00 73.52 O ATOM 2060 CB SER A 144 12.478 -4.307 10.058 1.00 31.32 C ATOM 2061 OG SER A 144 13.727 -3.643 9.983 1.00 23.53 O ATOM 0 H SER A 144 11.737 -3.791 7.967 1.00 3.30 H new ATOM 0 HA SER A 144 13.257 -6.051 8.924 1.00 1.41 H new ATOM 0 HB2 SER A 144 11.673 -3.588 9.904 1.00 31.32 H new ATOM 0 HB3 SER A 144 12.346 -4.724 11.056 1.00 31.32 H new ATOM 0 HG SER A 144 13.762 -2.934 10.659 1.00 23.53 H new ATOM 2066 N GLU A 145 10.002 -6.237 8.958 1.00 71.53 N ATOM 2067 CA GLU A 145 8.861 -7.036 9.443 1.00 45.05 C ATOM 2068 C GLU A 145 8.168 -7.846 8.332 1.00 14.33 C ATOM 2069 O GLU A 145 7.065 -8.347 8.554 1.00 23.31 O ATOM 2070 CB GLU A 145 7.840 -6.143 10.173 1.00 42.35 C ATOM 2071 CG GLU A 145 8.372 -5.375 11.388 1.00 70.41 C ATOM 2072 CD GLU A 145 7.276 -5.018 12.402 1.00 72.52 C ATOM 2073 OE1 GLU A 145 6.386 -4.191 12.097 1.00 1.32 O ATOM 2074 OE2 GLU A 145 7.373 -5.461 13.573 1.00 4.32 O ATOM 0 H GLU A 145 9.756 -5.561 8.235 1.00 71.53 H new ATOM 0 HA GLU A 145 9.274 -7.761 10.145 1.00 45.05 H new ATOM 0 HB2 GLU A 145 7.440 -5.423 9.459 1.00 42.35 H new ATOM 0 HB3 GLU A 145 7.007 -6.767 10.498 1.00 42.35 H new ATOM 0 HG2 GLU A 145 9.136 -5.975 11.883 1.00 70.41 H new ATOM 0 HG3 GLU A 145 8.856 -4.460 11.048 1.00 70.41 H new ATOM 2079 N VAL A 146 8.771 -8.017 7.149 1.00 4.24 N ATOM 2080 CA VAL A 146 8.123 -8.686 6.014 1.00 43.31 C ATOM 2081 C VAL A 146 7.682 -10.107 6.379 1.00 72.41 C ATOM 2082 O VAL A 146 6.627 -10.555 5.931 1.00 30.53 O ATOM 2083 CB VAL A 146 9.034 -8.652 4.765 1.00 5.35 C ATOM 2084 CG1 VAL A 146 8.324 -9.185 3.512 1.00 4.05 C ATOM 2085 CG2 VAL A 146 9.507 -7.222 4.445 1.00 12.25 C ATOM 0 H VAL A 146 9.719 -7.697 6.952 1.00 4.24 H new ATOM 0 HA VAL A 146 7.215 -8.136 5.765 1.00 43.31 H new ATOM 0 HB VAL A 146 9.883 -9.290 5.011 1.00 5.35 H new ATOM 0 HG11 VAL A 146 9.005 -9.141 2.662 1.00 4.05 H new ATOM 0 HG12 VAL A 146 8.018 -10.218 3.679 1.00 4.05 H new ATOM 0 HG13 VAL A 146 7.445 -8.575 3.305 1.00 4.05 H new ATOM 0 HG21 VAL A 146 10.145 -7.239 3.561 1.00 12.25 H new ATOM 0 HG22 VAL A 146 8.642 -6.586 4.256 1.00 12.25 H new ATOM 0 HG23 VAL A 146 10.070 -6.827 5.291 1.00 12.25 H new ATOM 2095 N ASP A 147 8.417 -10.761 7.283 1.00 53.23 N ATOM 2096 CA ASP A 147 8.092 -12.070 7.839 1.00 61.13 C ATOM 2097 C ASP A 147 6.648 -12.125 8.331 1.00 32.22 C ATOM 2098 O ASP A 147 5.949 -13.094 8.044 1.00 52.13 O ATOM 2099 CB ASP A 147 9.061 -12.416 8.973 1.00 30.13 C ATOM 2100 CG ASP A 147 8.586 -13.621 9.784 1.00 73.24 C ATOM 2101 OD1 ASP A 147 8.988 -14.763 9.461 1.00 72.13 O ATOM 2102 OD2 ASP A 147 7.894 -13.392 10.802 1.00 52.30 O ATOM 0 H ASP A 147 9.284 -10.377 7.658 1.00 53.23 H new ATOM 0 HA ASP A 147 8.197 -12.810 7.045 1.00 61.13 H new ATOM 0 HB2 ASP A 147 10.046 -12.625 8.557 1.00 30.13 H new ATOM 0 HB3 ASP A 147 9.169 -11.555 9.633 1.00 30.13 H new ATOM 2106 N LYS A 148 6.164 -11.079 9.006 1.00 63.21 N ATOM 2107 CA LYS A 148 4.815 -11.054 9.568 1.00 44.04 C ATOM 2108 C LYS A 148 3.787 -10.394 8.665 1.00 72.10 C ATOM 2109 O LYS A 148 2.675 -10.116 9.134 1.00 14.14 O ATOM 2110 CB LYS A 148 4.822 -10.406 10.947 1.00 51.21 C ATOM 2111 CG LYS A 148 5.246 -8.936 11.011 1.00 71.31 C ATOM 2112 CD LYS A 148 4.591 -8.214 12.198 1.00 31.13 C ATOM 2113 CE LYS A 148 3.227 -7.593 11.840 1.00 2.11 C ATOM 2114 NZ LYS A 148 2.115 -8.559 11.616 1.00 14.23 N ATOM 0 H LYS A 148 6.698 -10.227 9.177 1.00 63.21 H new ATOM 0 HA LYS A 148 4.505 -12.095 9.659 1.00 44.04 H new ATOM 0 HB2 LYS A 148 3.820 -10.490 11.368 1.00 51.21 H new ATOM 0 HB3 LYS A 148 5.488 -10.981 11.590 1.00 51.21 H new ATOM 0 HG2 LYS A 148 6.331 -8.872 11.098 1.00 71.31 H new ATOM 0 HG3 LYS A 148 4.971 -8.436 10.082 1.00 71.31 H new ATOM 0 HD2 LYS A 148 4.460 -8.919 13.019 1.00 31.13 H new ATOM 0 HD3 LYS A 148 5.260 -7.430 12.555 1.00 31.13 H new ATOM 0 HE2 LYS A 148 2.937 -6.913 12.641 1.00 2.11 H new ATOM 0 HE3 LYS A 148 3.348 -6.991 10.939 1.00 2.11 H new ATOM 0 HZ1 LYS A 148 1.222 -8.039 11.499 1.00 14.23 H new ATOM 0 HZ2 LYS A 148 2.306 -9.116 10.759 1.00 14.23 H new ATOM 0 HZ3 LYS A 148 2.040 -9.197 12.434 1.00 14.23 H new ATOM 2124 N TRP A 149 4.171 -10.075 7.437 1.00 30.55 N ATOM 2125 CA TRP A 149 3.280 -9.564 6.419 1.00 43.14 C ATOM 2126 C TRP A 149 3.068 -10.494 5.233 1.00 34.15 C ATOM 2127 O TRP A 149 2.208 -10.163 4.431 1.00 44.44 O ATOM 2128 CB TRP A 149 3.792 -8.229 5.900 1.00 5.45 C ATOM 2129 CG TRP A 149 4.043 -7.184 6.939 1.00 22.51 C ATOM 2130 CD1 TRP A 149 3.363 -7.061 8.097 1.00 73.42 C ATOM 2131 CD2 TRP A 149 5.044 -6.131 6.954 1.00 63.10 C ATOM 2132 NE1 TRP A 149 3.887 -6.030 8.832 1.00 24.24 N ATOM 2133 CE2 TRP A 149 4.875 -5.361 8.141 1.00 54.04 C ATOM 2134 CE3 TRP A 149 6.057 -5.740 6.060 1.00 12.35 C ATOM 2135 CZ2 TRP A 149 5.627 -4.205 8.390 1.00 25.43 C ATOM 2136 CZ3 TRP A 149 6.869 -4.625 6.326 1.00 11.21 C ATOM 2137 CH2 TRP A 149 6.634 -3.845 7.472 1.00 30.51 C ATOM 0 H TRP A 149 5.136 -10.169 7.119 1.00 30.55 H new ATOM 0 HA TRP A 149 2.314 -9.461 6.914 1.00 43.14 H new ATOM 0 HB2 TRP A 149 4.720 -8.403 5.355 1.00 5.45 H new ATOM 0 HB3 TRP A 149 3.070 -7.837 5.184 1.00 5.45 H new ATOM 0 HD1 TRP A 149 2.532 -7.681 8.399 1.00 73.42 H new ATOM 0 HE1 TRP A 149 3.583 -5.787 9.775 1.00 24.24 H new ATOM 0 HE3 TRP A 149 6.213 -6.306 5.154 1.00 12.35 H new ATOM 0 HZ2 TRP A 149 5.439 -3.603 9.267 1.00 25.43 H new ATOM 0 HZ3 TRP A 149 7.672 -4.367 5.652 1.00 11.21 H new ATOM 0 HH2 TRP A 149 7.230 -2.962 7.650 1.00 30.51 H new ATOM 2147 N SER A 150 3.815 -11.592 5.067 1.00 41.04 N ATOM 2148 CA SER A 150 3.616 -12.516 3.944 1.00 10.05 C ATOM 2149 C SER A 150 3.334 -13.958 4.389 1.00 74.23 C ATOM 2150 O SER A 150 3.131 -14.826 3.531 1.00 53.43 O ATOM 2151 CB SER A 150 4.789 -12.405 2.961 1.00 2.33 C ATOM 2152 OG SER A 150 4.503 -13.135 1.780 1.00 21.32 O ATOM 0 H SER A 150 4.567 -11.863 5.700 1.00 41.04 H new ATOM 0 HA SER A 150 2.709 -12.215 3.419 1.00 10.05 H new ATOM 0 HB2 SER A 150 4.971 -11.359 2.716 1.00 2.33 H new ATOM 0 HB3 SER A 150 5.699 -12.787 3.423 1.00 2.33 H new ATOM 0 HG SER A 150 3.859 -13.845 1.982 1.00 21.32 H new ATOM 2157 N LYS A 151 3.250 -14.224 5.690 1.00 5.25 N ATOM 2158 CA LYS A 151 2.701 -15.465 6.223 1.00 54.14 C ATOM 2159 C LYS A 151 1.241 -15.572 5.822 1.00 54.42 C ATOM 2160 O LYS A 151 0.767 -16.715 5.648 1.00 34.35 O ATOM 2161 CB LYS A 151 2.922 -15.506 7.738 1.00 41.44 C ATOM 2162 CG LYS A 151 4.356 -15.966 8.036 1.00 50.24 C ATOM 2163 CD LYS A 151 4.842 -15.561 9.427 1.00 73.51 C ATOM 2164 CE LYS A 151 4.136 -16.302 10.557 1.00 54.01 C ATOM 2165 NZ LYS A 151 4.910 -16.173 11.805 1.00 14.42 N ATOM 0 H LYS A 151 3.565 -13.575 6.411 1.00 5.25 H new ATOM 0 HA LYS A 151 3.210 -16.335 5.808 1.00 54.14 H new ATOM 0 HB2 LYS A 151 2.749 -14.519 8.168 1.00 41.44 H new ATOM 0 HB3 LYS A 151 2.207 -16.186 8.202 1.00 41.44 H new ATOM 0 HG2 LYS A 151 4.410 -17.051 7.941 1.00 50.24 H new ATOM 0 HG3 LYS A 151 5.028 -15.547 7.287 1.00 50.24 H new ATOM 0 HD2 LYS A 151 5.914 -15.745 9.497 1.00 73.51 H new ATOM 0 HD3 LYS A 151 4.693 -14.489 9.557 1.00 73.51 H new ATOM 0 HE2 LYS A 151 3.134 -15.898 10.698 1.00 54.01 H new ATOM 0 HE3 LYS A 151 4.022 -17.354 10.297 1.00 54.01 H new ATOM 0 HZ1 LYS A 151 4.422 -16.681 12.570 1.00 14.42 H new ATOM 0 HZ2 LYS A 151 5.858 -16.579 11.669 1.00 14.42 H new ATOM 0 HZ3 LYS A 151 4.997 -15.168 12.057 1.00 14.42 H new