USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1216 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 56 LYS NZ :NH3+ 162:sc= 1.14 (180deg=0.173) USER MOD Set 1.2: A 117 ASN : amide:sc= -0.0266 K(o=1.8,f=0.94) USER MOD Set 1.3: A 121 ASN : amide:sc= 0.0205 K(o=1.8,f=0.91) USER MOD Set 1.4: A 126 ASN : amide:sc= 0.67 K(o=1.8,f=-3.5) USER MOD Set 2.1: A 109 THR OG1 : rot -79:sc= 0.552 USER MOD Set 2.2: A 110 GLN :FLIP amide:sc= -1.16 F(o=-2.4!,f=-0.6) USER MOD Set 3.1: A 78 ASN : amide:sc= -0.0662 K(o=-0.089,f=-1.3!) USER MOD Set 3.2: A 104 ASN : amide:sc= -0.0225 K(o=-0.089,f=-1.4) USER MOD Set 4.1: A 68 TYR OH : rot -130:sc= -1.05 USER MOD Set 4.2: A 88 HIS : no HD1:sc= -1.72 X(o=-2.8,f=-2.3) USER MOD Single : A 1 MET CE :methyl 170:sc= 0 (180deg=-0.0954) USER MOD Single : A 1 MET N :NH3+ 159:sc= 1.26 (180deg=0.875) USER MOD Single : A 2 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 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ -138:sc= 0.179 (180deg=-0.31) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot -42:sc= 1.02 USER MOD Single : A 26 GLN :FLIP amide:sc= -0.0256 F(o=-0.58,f=-0.026) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN :FLIP amide:sc=-0.00499 F(o=-0.86,f=-0.005) USER MOD Single : A 39 ASN :FLIP amide:sc= -0.468 F(o=-2.3!,f=-0.47) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -159:sc= 1.18 (180deg=0.758) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.214 USER MOD Single : A 64 TYR OH : rot 86:sc= 0.445 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.0536 X(o=-0.054,f=-0.12) USER MOD Single : A 70 LYS NZ :NH3+ 154:sc= 0.887 (180deg=0.477) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 170:sc= -1.45 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 178:sc= 0.609 (180deg=0.608) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.091 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -0.171 K(o=-0.17,f=-1.2) USER MOD Single : A 102 LYS NZ :NH3+ -169:sc= -0.488 (180deg=-0.607) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc=-0.00285 K(o=-0.0029,f=-0.71) USER MOD Single : A 125 TYR OH : rot 30:sc= 1.25 USER MOD Single : A 133 THR OG1 : rot -150:sc= -0.122 USER MOD Single : A 136 TYR OH : rot 68:sc= 0.227 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS : no HD1:sc= -0.0774 X(o=-0.077,f=-0.48) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 149 HIS : no HD1:sc= -0.0146 K(o=-0.015,f=-0.54) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.088 8.271 -5.740 1.00 44.01 N ATOM 2 CA MET A 1 18.682 8.359 -6.225 1.00 31.31 C ATOM 3 C MET A 1 18.438 7.368 -7.393 1.00 13.11 C ATOM 4 O MET A 1 19.087 7.457 -8.438 1.00 63.34 O ATOM 5 CB MET A 1 18.338 9.817 -6.656 1.00 14.44 C ATOM 6 CG MET A 1 18.311 10.845 -5.504 1.00 53.33 C ATOM 7 SD MET A 1 19.917 11.090 -4.700 1.00 45.01 S ATOM 8 CE MET A 1 20.881 11.886 -5.990 1.00 1.11 C ATOM 0 H1 MET A 1 20.336 9.145 -5.233 1.00 44.01 H new ATOM 0 H2 MET A 1 20.183 7.459 -5.097 1.00 44.01 H new ATOM 0 H3 MET A 1 20.728 8.148 -6.551 1.00 44.01 H new ATOM 0 HA MET A 1 18.022 8.082 -5.403 1.00 31.31 H new ATOM 0 HB2 MET A 1 19.067 10.143 -7.398 1.00 14.44 H new ATOM 0 HB3 MET A 1 17.364 9.816 -7.146 1.00 14.44 H new ATOM 0 HG2 MET A 1 17.960 11.801 -5.892 1.00 53.33 H new ATOM 0 HG3 MET A 1 17.587 10.519 -4.757 1.00 53.33 H new ATOM 0 HE1 MET A 1 21.820 12.248 -5.572 1.00 1.11 H new ATOM 0 HE2 MET A 1 21.090 11.168 -6.784 1.00 1.11 H new ATOM 0 HE3 MET A 1 20.319 12.726 -6.399 1.00 1.11 H new ATOM 20 N LYS A 2 17.506 6.415 -7.185 1.00 30.52 N ATOM 21 CA LYS A 2 17.091 5.429 -8.209 1.00 65.34 C ATOM 22 C LYS A 2 15.555 5.248 -8.172 1.00 2.40 C ATOM 23 O LYS A 2 14.974 5.043 -7.102 1.00 74.23 O ATOM 24 CB LYS A 2 17.816 4.072 -7.968 1.00 1.32 C ATOM 25 CG LYS A 2 17.453 2.950 -8.976 1.00 75.45 C ATOM 26 CD LYS A 2 18.207 1.625 -8.705 1.00 33.13 C ATOM 27 CE LYS A 2 19.734 1.766 -8.843 1.00 73.03 C ATOM 28 NZ LYS A 2 20.437 0.494 -8.559 1.00 14.31 N ATOM 0 H LYS A 2 17.016 6.306 -6.297 1.00 30.52 H new ATOM 0 HA LYS A 2 17.371 5.795 -9.197 1.00 65.34 H new ATOM 0 HB2 LYS A 2 18.892 4.240 -8.006 1.00 1.32 H new ATOM 0 HB3 LYS A 2 17.582 3.726 -6.961 1.00 1.32 H new ATOM 0 HG2 LYS A 2 16.380 2.766 -8.935 1.00 75.45 H new ATOM 0 HG3 LYS A 2 17.679 3.290 -9.987 1.00 75.45 H new ATOM 0 HD2 LYS A 2 17.969 1.276 -7.700 1.00 33.13 H new ATOM 0 HD3 LYS A 2 17.853 0.863 -9.399 1.00 33.13 H new ATOM 0 HE2 LYS A 2 19.978 2.097 -9.852 1.00 73.03 H new ATOM 0 HE3 LYS A 2 20.090 2.537 -8.160 1.00 73.03 H new ATOM 0 HZ1 LYS A 2 21.462 0.633 -8.663 1.00 14.31 H new ATOM 0 HZ2 LYS A 2 20.226 0.190 -7.587 1.00 14.31 H new ATOM 0 HZ3 LYS A 2 20.117 -0.236 -9.227 1.00 14.31 H new ATOM 42 N VAL A 3 14.907 5.333 -9.347 1.00 31.24 N ATOM 43 CA VAL A 3 13.442 5.166 -9.491 1.00 42.43 C ATOM 44 C VAL A 3 13.111 3.830 -10.201 1.00 54.20 C ATOM 45 O VAL A 3 13.619 3.546 -11.292 1.00 13.43 O ATOM 46 CB VAL A 3 12.788 6.390 -10.256 1.00 43.31 C ATOM 47 CG1 VAL A 3 13.567 6.754 -11.542 1.00 1.21 C ATOM 48 CG2 VAL A 3 11.286 6.141 -10.581 1.00 44.32 C ATOM 0 H VAL A 3 15.383 5.520 -10.230 1.00 31.24 H new ATOM 0 HA VAL A 3 13.012 5.139 -8.490 1.00 42.43 H new ATOM 0 HB VAL A 3 12.847 7.240 -9.576 1.00 43.31 H new ATOM 0 HG11 VAL A 3 13.083 7.598 -12.034 1.00 1.21 H new ATOM 0 HG12 VAL A 3 14.591 7.023 -11.283 1.00 1.21 H new ATOM 0 HG13 VAL A 3 13.576 5.898 -12.216 1.00 1.21 H new ATOM 0 HG21 VAL A 3 10.879 7.006 -11.105 1.00 44.32 H new ATOM 0 HG22 VAL A 3 11.192 5.257 -11.212 1.00 44.32 H new ATOM 0 HG23 VAL A 3 10.734 5.986 -9.654 1.00 44.32 H new ATOM 58 N PHE A 4 12.270 3.004 -9.552 1.00 25.21 N ATOM 59 CA PHE A 4 11.754 1.751 -10.137 1.00 45.32 C ATOM 60 C PHE A 4 10.409 2.021 -10.845 1.00 54.31 C ATOM 61 O PHE A 4 9.332 1.935 -10.245 1.00 52.43 O ATOM 62 CB PHE A 4 11.626 0.654 -9.045 1.00 3.31 C ATOM 63 CG PHE A 4 12.974 0.184 -8.492 1.00 71.13 C ATOM 64 CD1 PHE A 4 13.637 0.912 -7.502 1.00 71.31 C ATOM 65 CD2 PHE A 4 13.587 -0.975 -8.973 1.00 3.55 C ATOM 66 CE1 PHE A 4 14.859 0.495 -7.014 1.00 54.42 C ATOM 67 CE2 PHE A 4 14.810 -1.389 -8.481 1.00 21.21 C ATOM 68 CZ PHE A 4 15.445 -0.656 -7.502 1.00 32.12 C ATOM 0 H PHE A 4 11.929 3.185 -8.608 1.00 25.21 H new ATOM 0 HA PHE A 4 12.457 1.381 -10.883 1.00 45.32 H new ATOM 0 HB2 PHE A 4 11.019 1.038 -8.225 1.00 3.31 H new ATOM 0 HB3 PHE A 4 11.094 -0.202 -9.461 1.00 3.31 H new ATOM 0 HD1 PHE A 4 13.188 1.814 -7.113 1.00 71.31 H new ATOM 0 HD2 PHE A 4 13.098 -1.556 -9.741 1.00 3.55 H new ATOM 0 HE1 PHE A 4 15.358 1.071 -6.248 1.00 54.42 H new ATOM 0 HE2 PHE A 4 15.269 -2.288 -8.864 1.00 21.21 H new ATOM 0 HZ PHE A 4 16.400 -0.982 -7.117 1.00 32.12 H new ATOM 78 N LYS A 5 10.496 2.416 -12.122 1.00 73.13 N ATOM 79 CA LYS A 5 9.322 2.698 -12.970 1.00 55.13 C ATOM 80 C LYS A 5 9.007 1.499 -13.890 1.00 3.52 C ATOM 81 O LYS A 5 9.889 0.698 -14.219 1.00 24.30 O ATOM 82 CB LYS A 5 9.570 3.987 -13.805 1.00 3.03 C ATOM 83 CG LYS A 5 10.825 3.943 -14.709 1.00 44.53 C ATOM 84 CD LYS A 5 11.027 5.243 -15.523 1.00 63.14 C ATOM 85 CE LYS A 5 9.875 5.516 -16.511 1.00 52.23 C ATOM 86 NZ LYS A 5 10.076 6.776 -17.265 1.00 42.35 N ATOM 0 H LYS A 5 11.386 2.551 -12.602 1.00 73.13 H new ATOM 0 HA LYS A 5 8.457 2.858 -12.327 1.00 55.13 H new ATOM 0 HB2 LYS A 5 8.696 4.172 -14.429 1.00 3.03 H new ATOM 0 HB3 LYS A 5 9.660 4.833 -13.123 1.00 3.03 H new ATOM 0 HG2 LYS A 5 11.706 3.767 -14.091 1.00 44.53 H new ATOM 0 HG3 LYS A 5 10.743 3.100 -15.395 1.00 44.53 H new ATOM 0 HD2 LYS A 5 11.118 6.085 -14.837 1.00 63.14 H new ATOM 0 HD3 LYS A 5 11.965 5.178 -16.075 1.00 63.14 H new ATOM 0 HE2 LYS A 5 9.793 4.684 -17.211 1.00 52.23 H new ATOM 0 HE3 LYS A 5 8.933 5.567 -15.964 1.00 52.23 H new ATOM 0 HZ1 LYS A 5 9.279 6.921 -17.917 1.00 42.35 H new ATOM 0 HZ2 LYS A 5 10.129 7.574 -16.600 1.00 42.35 H new ATOM 0 HZ3 LYS A 5 10.961 6.718 -17.807 1.00 42.35 H new ATOM 100 N ARG A 6 7.738 1.400 -14.313 1.00 42.45 N ATOM 101 CA ARG A 6 7.257 0.331 -15.204 1.00 42.30 C ATOM 102 C ARG A 6 7.358 0.832 -16.654 1.00 70.21 C ATOM 103 O ARG A 6 6.647 1.772 -17.041 1.00 0.11 O ATOM 104 CB ARG A 6 5.787 -0.027 -14.852 1.00 23.22 C ATOM 105 CG ARG A 6 5.157 -1.155 -15.708 1.00 45.23 C ATOM 106 CD ARG A 6 3.645 -1.332 -15.446 1.00 62.04 C ATOM 107 NE ARG A 6 2.873 -0.119 -15.790 1.00 33.12 N ATOM 108 CZ ARG A 6 1.590 -0.082 -16.083 1.00 32.31 C ATOM 109 NH1 ARG A 6 0.856 -1.157 -16.089 1.00 70.53 N ATOM 110 NH2 ARG A 6 1.046 1.043 -16.381 1.00 22.55 N ATOM 0 H ARG A 6 7.011 2.063 -14.045 1.00 42.45 H new ATOM 0 HA ARG A 6 7.863 -0.567 -15.082 1.00 42.30 H new ATOM 0 HB2 ARG A 6 5.743 -0.322 -13.803 1.00 23.22 H new ATOM 0 HB3 ARG A 6 5.177 0.870 -14.957 1.00 23.22 H new ATOM 0 HG2 ARG A 6 5.315 -0.935 -16.764 1.00 45.23 H new ATOM 0 HG3 ARG A 6 5.670 -2.094 -15.498 1.00 45.23 H new ATOM 0 HD2 ARG A 6 3.273 -2.175 -16.029 1.00 62.04 H new ATOM 0 HD3 ARG A 6 3.486 -1.576 -14.396 1.00 62.04 H new ATOM 0 HE ARG A 6 3.379 0.767 -15.801 1.00 33.12 H new ATOM 0 HH11 ARG A 6 1.272 -2.060 -15.862 1.00 70.53 H new ATOM 0 HH12 ARG A 6 -0.136 -1.096 -16.320 1.00 70.53 H new ATOM 0 HH21 ARG A 6 1.607 1.895 -16.389 1.00 22.55 H new ATOM 0 HH22 ARG A 6 0.053 1.085 -16.610 1.00 22.55 H new ATOM 124 N VAL A 7 8.235 0.212 -17.454 1.00 74.20 N ATOM 125 CA VAL A 7 8.505 0.649 -18.839 1.00 43.51 C ATOM 126 C VAL A 7 7.876 -0.366 -19.815 1.00 14.20 C ATOM 127 O VAL A 7 8.142 -1.570 -19.710 1.00 4.42 O ATOM 128 CB VAL A 7 10.054 0.786 -19.114 1.00 23.12 C ATOM 129 CG1 VAL A 7 10.347 1.231 -20.574 1.00 5.35 C ATOM 130 CG2 VAL A 7 10.721 1.748 -18.092 1.00 43.31 C ATOM 0 H VAL A 7 8.777 -0.603 -17.166 1.00 74.20 H new ATOM 0 HA VAL A 7 8.062 1.634 -18.987 1.00 43.51 H new ATOM 0 HB VAL A 7 10.493 -0.203 -18.984 1.00 23.12 H new ATOM 0 HG11 VAL A 7 11.424 1.313 -20.720 1.00 5.35 H new ATOM 0 HG12 VAL A 7 9.942 0.494 -21.267 1.00 5.35 H new ATOM 0 HG13 VAL A 7 9.881 2.199 -20.760 1.00 5.35 H new ATOM 0 HG21 VAL A 7 11.787 1.823 -18.305 1.00 43.31 H new ATOM 0 HG22 VAL A 7 10.265 2.735 -18.170 1.00 43.31 H new ATOM 0 HG23 VAL A 7 10.579 1.362 -17.083 1.00 43.31 H new ATOM 140 N ALA A 8 7.012 0.132 -20.723 1.00 2.02 N ATOM 141 CA ALA A 8 6.358 -0.686 -21.770 1.00 1.31 C ATOM 142 C ALA A 8 7.394 -1.461 -22.634 1.00 54.45 C ATOM 143 O ALA A 8 8.024 -0.893 -23.530 1.00 34.25 O ATOM 144 CB ALA A 8 5.457 0.206 -22.643 1.00 44.13 C ATOM 0 H ALA A 8 6.746 1.116 -20.752 1.00 2.02 H new ATOM 0 HA ALA A 8 5.739 -1.437 -21.278 1.00 1.31 H new ATOM 0 HB1 ALA A 8 4.979 -0.401 -23.411 1.00 44.13 H new ATOM 0 HB2 ALA A 8 4.693 0.671 -22.020 1.00 44.13 H new ATOM 0 HB3 ALA A 8 6.061 0.980 -23.116 1.00 44.13 H new ATOM 150 N GLY A 9 7.576 -2.761 -22.318 1.00 5.31 N ATOM 151 CA GLY A 9 8.590 -3.602 -22.978 1.00 44.14 C ATOM 152 C GLY A 9 9.333 -4.542 -22.025 1.00 51.54 C ATOM 153 O GLY A 9 9.758 -5.630 -22.440 1.00 73.31 O ATOM 0 H GLY A 9 7.031 -3.249 -21.608 1.00 5.31 H new ATOM 0 HA2 GLY A 9 8.106 -4.195 -23.754 1.00 44.14 H new ATOM 0 HA3 GLY A 9 9.315 -2.957 -23.475 1.00 44.14 H new ATOM 157 N ILE A 10 9.520 -4.123 -20.748 1.00 44.40 N ATOM 158 CA ILE A 10 10.226 -4.948 -19.737 1.00 40.12 C ATOM 159 C ILE A 10 9.401 -6.212 -19.381 1.00 62.35 C ATOM 160 O ILE A 10 8.407 -6.154 -18.649 1.00 11.24 O ATOM 161 CB ILE A 10 10.584 -4.135 -18.430 1.00 15.24 C ATOM 162 CG1 ILE A 10 11.506 -2.917 -18.778 1.00 60.12 C ATOM 163 CG2 ILE A 10 11.250 -5.050 -17.358 1.00 70.14 C ATOM 164 CD1 ILE A 10 11.959 -2.082 -17.583 1.00 43.55 C ATOM 0 H ILE A 10 9.193 -3.223 -20.396 1.00 44.40 H new ATOM 0 HA ILE A 10 11.168 -5.256 -20.190 1.00 40.12 H new ATOM 0 HB ILE A 10 9.656 -3.754 -18.005 1.00 15.24 H new ATOM 0 HG12 ILE A 10 12.390 -3.288 -19.298 1.00 60.12 H new ATOM 0 HG13 ILE A 10 10.976 -2.268 -19.474 1.00 60.12 H new ATOM 0 HG21 ILE A 10 11.484 -4.461 -16.471 1.00 70.14 H new ATOM 0 HG22 ILE A 10 10.565 -5.854 -17.089 1.00 70.14 H new ATOM 0 HG23 ILE A 10 12.168 -5.476 -17.763 1.00 70.14 H new ATOM 0 HD11 ILE A 10 12.592 -1.265 -17.929 1.00 43.55 H new ATOM 0 HD12 ILE A 10 11.087 -1.674 -17.072 1.00 43.55 H new ATOM 0 HD13 ILE A 10 12.523 -2.710 -16.893 1.00 43.55 H new ATOM 176 N LYS A 11 9.830 -7.341 -19.958 1.00 70.14 N ATOM 177 CA LYS A 11 9.239 -8.675 -19.719 1.00 62.33 C ATOM 178 C LYS A 11 10.254 -9.585 -18.993 1.00 42.13 C ATOM 179 O LYS A 11 10.180 -10.813 -19.059 1.00 33.42 O ATOM 180 CB LYS A 11 8.775 -9.299 -21.063 1.00 71.25 C ATOM 181 CG LYS A 11 7.702 -8.470 -21.810 1.00 22.31 C ATOM 182 CD LYS A 11 7.165 -9.182 -23.073 1.00 23.40 C ATOM 183 CE LYS A 11 6.429 -10.497 -22.748 1.00 73.34 C ATOM 184 NZ LYS A 11 5.913 -11.167 -23.968 1.00 44.23 N ATOM 0 H LYS A 11 10.610 -7.360 -20.615 1.00 70.14 H new ATOM 0 HA LYS A 11 8.365 -8.573 -19.076 1.00 62.33 H new ATOM 0 HB2 LYS A 11 9.642 -9.420 -21.713 1.00 71.25 H new ATOM 0 HB3 LYS A 11 8.379 -10.296 -20.870 1.00 71.25 H new ATOM 0 HG2 LYS A 11 6.872 -8.265 -21.134 1.00 22.31 H new ATOM 0 HG3 LYS A 11 8.127 -7.507 -22.094 1.00 22.31 H new ATOM 0 HD2 LYS A 11 6.487 -8.512 -23.602 1.00 23.40 H new ATOM 0 HD3 LYS A 11 7.995 -9.392 -23.747 1.00 23.40 H new ATOM 0 HE2 LYS A 11 7.107 -11.171 -22.225 1.00 73.34 H new ATOM 0 HE3 LYS A 11 5.600 -10.290 -22.071 1.00 73.34 H new ATOM 0 HZ1 LYS A 11 5.426 -12.046 -23.701 1.00 44.23 H new ATOM 0 HZ2 LYS A 11 5.246 -10.535 -24.455 1.00 44.23 H new ATOM 0 HZ3 LYS A 11 6.706 -11.389 -24.604 1.00 44.23 H new ATOM 198 N ASP A 12 11.187 -8.949 -18.271 1.00 33.33 N ATOM 199 CA ASP A 12 12.200 -9.638 -17.460 1.00 44.34 C ATOM 200 C ASP A 12 11.692 -9.751 -16.018 1.00 23.10 C ATOM 201 O ASP A 12 11.611 -8.745 -15.310 1.00 14.32 O ATOM 202 CB ASP A 12 13.534 -8.861 -17.509 1.00 35.04 C ATOM 203 CG ASP A 12 14.001 -8.630 -18.950 1.00 22.44 C ATOM 204 OD1 ASP A 12 14.694 -9.506 -19.514 1.00 43.31 O ATOM 205 OD2 ASP A 12 13.636 -7.585 -19.538 1.00 71.20 O ATOM 0 H ASP A 12 11.260 -7.932 -18.233 1.00 33.33 H new ATOM 0 HA ASP A 12 12.375 -10.638 -17.857 1.00 44.34 H new ATOM 0 HB2 ASP A 12 13.415 -7.901 -17.006 1.00 35.04 H new ATOM 0 HB3 ASP A 12 14.298 -9.414 -16.963 1.00 35.04 H new ATOM 210 N LYS A 13 11.348 -10.978 -15.597 1.00 22.34 N ATOM 211 CA LYS A 13 10.770 -11.241 -14.265 1.00 2.32 C ATOM 212 C LYS A 13 11.725 -10.845 -13.112 1.00 51.44 C ATOM 213 O LYS A 13 11.270 -10.572 -12.009 1.00 61.41 O ATOM 214 CB LYS A 13 10.362 -12.735 -14.138 1.00 61.23 C ATOM 215 CG LYS A 13 9.306 -13.222 -15.163 1.00 0.13 C ATOM 216 CD LYS A 13 8.010 -12.364 -15.187 1.00 35.45 C ATOM 217 CE LYS A 13 7.330 -12.233 -13.809 1.00 22.12 C ATOM 218 NZ LYS A 13 7.002 -13.552 -13.201 1.00 4.02 N ATOM 0 H LYS A 13 11.461 -11.816 -16.167 1.00 22.34 H new ATOM 0 HA LYS A 13 9.883 -10.614 -14.174 1.00 2.32 H new ATOM 0 HB2 LYS A 13 11.256 -13.349 -14.243 1.00 61.23 H new ATOM 0 HB3 LYS A 13 9.975 -12.905 -13.133 1.00 61.23 H new ATOM 0 HG2 LYS A 13 9.751 -13.218 -16.158 1.00 0.13 H new ATOM 0 HG3 LYS A 13 9.042 -14.255 -14.935 1.00 0.13 H new ATOM 0 HD2 LYS A 13 8.250 -11.368 -15.560 1.00 35.45 H new ATOM 0 HD3 LYS A 13 7.304 -12.806 -15.890 1.00 35.45 H new ATOM 0 HE2 LYS A 13 7.986 -11.681 -13.136 1.00 22.12 H new ATOM 0 HE3 LYS A 13 6.416 -11.649 -13.914 1.00 22.12 H new ATOM 0 HZ1 LYS A 13 6.057 -13.510 -12.769 1.00 4.02 H new ATOM 0 HZ2 LYS A 13 7.014 -14.286 -13.937 1.00 4.02 H new ATOM 0 HZ3 LYS A 13 7.706 -13.782 -12.471 1.00 4.02 H new ATOM 232 N ALA A 14 13.040 -10.796 -13.400 1.00 13.42 N ATOM 233 CA ALA A 14 14.068 -10.333 -12.435 1.00 64.44 C ATOM 234 C ALA A 14 13.991 -8.795 -12.232 1.00 23.22 C ATOM 235 O ALA A 14 14.131 -8.288 -11.113 1.00 42.32 O ATOM 236 CB ALA A 14 15.465 -10.748 -12.930 1.00 74.14 C ATOM 0 H ALA A 14 13.423 -11.074 -14.303 1.00 13.42 H new ATOM 0 HA ALA A 14 13.878 -10.802 -11.470 1.00 64.44 H new ATOM 0 HB1 ALA A 14 16.219 -10.407 -12.220 1.00 74.14 H new ATOM 0 HB2 ALA A 14 15.513 -11.834 -13.017 1.00 74.14 H new ATOM 0 HB3 ALA A 14 15.654 -10.298 -13.904 1.00 74.14 H new ATOM 242 N ALA A 15 13.734 -8.069 -13.339 1.00 11.43 N ATOM 243 CA ALA A 15 13.619 -6.590 -13.336 1.00 1.11 C ATOM 244 C ALA A 15 12.243 -6.132 -12.776 1.00 74.53 C ATOM 245 O ALA A 15 12.122 -5.037 -12.217 1.00 64.00 O ATOM 246 CB ALA A 15 13.865 -6.032 -14.744 1.00 74.23 C ATOM 0 H ALA A 15 13.600 -8.487 -14.260 1.00 11.43 H new ATOM 0 HA ALA A 15 14.386 -6.189 -12.673 1.00 1.11 H new ATOM 0 HB1 ALA A 15 13.777 -4.946 -14.725 1.00 74.23 H new ATOM 0 HB2 ALA A 15 14.866 -6.309 -15.076 1.00 74.23 H new ATOM 0 HB3 ALA A 15 13.127 -6.444 -15.433 1.00 74.23 H new ATOM 252 N ILE A 16 11.206 -6.978 -12.952 1.00 74.14 N ATOM 253 CA ILE A 16 9.868 -6.754 -12.353 1.00 43.45 C ATOM 254 C ILE A 16 9.919 -7.013 -10.824 1.00 35.11 C ATOM 255 O ILE A 16 9.378 -6.238 -10.034 1.00 12.52 O ATOM 256 CB ILE A 16 8.771 -7.688 -13.011 1.00 71.23 C ATOM 257 CG1 ILE A 16 8.689 -7.473 -14.560 1.00 40.43 C ATOM 258 CG2 ILE A 16 7.375 -7.484 -12.359 1.00 53.53 C ATOM 259 CD1 ILE A 16 8.267 -6.076 -14.999 1.00 32.41 C ATOM 0 H ILE A 16 11.269 -7.830 -13.509 1.00 74.14 H new ATOM 0 HA ILE A 16 9.591 -5.717 -12.543 1.00 43.45 H new ATOM 0 HB ILE A 16 9.080 -8.717 -12.826 1.00 71.23 H new ATOM 0 HG12 ILE A 16 9.664 -7.694 -14.994 1.00 40.43 H new ATOM 0 HG13 ILE A 16 7.985 -8.195 -14.974 1.00 40.43 H new ATOM 0 HG21 ILE A 16 6.650 -8.142 -12.838 1.00 53.53 H new ATOM 0 HG22 ILE A 16 7.432 -7.719 -11.296 1.00 53.53 H new ATOM 0 HG23 ILE A 16 7.062 -6.447 -12.485 1.00 53.53 H new ATOM 0 HD11 ILE A 16 8.241 -6.029 -16.088 1.00 32.41 H new ATOM 0 HD12 ILE A 16 7.277 -5.854 -14.602 1.00 32.41 H new ATOM 0 HD13 ILE A 16 8.982 -5.345 -14.622 1.00 32.41 H new ATOM 271 N LYS A 17 10.617 -8.098 -10.432 1.00 33.01 N ATOM 272 CA LYS A 17 10.701 -8.564 -9.024 1.00 33.44 C ATOM 273 C LYS A 17 11.439 -7.553 -8.106 1.00 25.23 C ATOM 274 O LYS A 17 11.122 -7.453 -6.913 1.00 1.34 O ATOM 275 CB LYS A 17 11.400 -9.950 -8.977 1.00 64.12 C ATOM 276 CG LYS A 17 11.397 -10.668 -7.602 1.00 62.23 C ATOM 277 CD LYS A 17 12.076 -12.059 -7.674 1.00 54.32 C ATOM 278 CE LYS A 17 12.032 -12.842 -6.349 1.00 72.04 C ATOM 279 NZ LYS A 17 12.666 -14.181 -6.490 1.00 62.10 N ATOM 0 H LYS A 17 11.142 -8.682 -11.083 1.00 33.01 H new ATOM 0 HA LYS A 17 9.684 -8.649 -8.642 1.00 33.44 H new ATOM 0 HB2 LYS A 17 10.919 -10.602 -9.706 1.00 64.12 H new ATOM 0 HB3 LYS A 17 12.435 -9.824 -9.296 1.00 64.12 H new ATOM 0 HG2 LYS A 17 11.914 -10.049 -6.868 1.00 62.23 H new ATOM 0 HG3 LYS A 17 10.370 -10.783 -7.255 1.00 62.23 H new ATOM 0 HD2 LYS A 17 11.591 -12.650 -8.451 1.00 54.32 H new ATOM 0 HD3 LYS A 17 13.116 -11.930 -7.975 1.00 54.32 H new ATOM 0 HE2 LYS A 17 12.544 -12.275 -5.572 1.00 72.04 H new ATOM 0 HE3 LYS A 17 10.997 -12.959 -6.028 1.00 72.04 H new ATOM 0 HZ1 LYS A 17 12.621 -14.684 -5.581 1.00 62.10 H new ATOM 0 HZ2 LYS A 17 12.161 -14.730 -7.215 1.00 62.10 H new ATOM 0 HZ3 LYS A 17 13.660 -14.066 -6.773 1.00 62.10 H new ATOM 293 N THR A 18 12.426 -6.805 -8.655 1.00 72.23 N ATOM 294 CA THR A 18 13.170 -5.766 -7.885 1.00 44.34 C ATOM 295 C THR A 18 12.328 -4.470 -7.719 1.00 14.14 C ATOM 296 O THR A 18 12.456 -3.754 -6.721 1.00 71.14 O ATOM 297 CB THR A 18 14.560 -5.439 -8.540 1.00 51.34 C ATOM 298 OG1 THR A 18 15.306 -4.524 -7.714 1.00 42.35 O ATOM 299 CG2 THR A 18 14.418 -4.848 -9.950 1.00 0.23 C ATOM 0 H THR A 18 12.728 -6.898 -9.625 1.00 72.23 H new ATOM 0 HA THR A 18 13.357 -6.180 -6.894 1.00 44.34 H new ATOM 0 HB THR A 18 15.095 -6.385 -8.624 1.00 51.34 H new ATOM 0 HG1 THR A 18 16.169 -4.332 -8.136 1.00 42.35 H new ATOM 0 HG21 THR A 18 15.407 -4.640 -10.358 1.00 0.23 H new ATOM 0 HG22 THR A 18 13.903 -5.561 -10.593 1.00 0.23 H new ATOM 0 HG23 THR A 18 13.844 -3.923 -9.901 1.00 0.23 H new ATOM 307 N LEU A 19 11.464 -4.186 -8.722 1.00 15.41 N ATOM 308 CA LEU A 19 10.443 -3.107 -8.652 1.00 62.31 C ATOM 309 C LEU A 19 9.433 -3.418 -7.519 1.00 54.12 C ATOM 310 O LEU A 19 9.065 -2.543 -6.736 1.00 54.14 O ATOM 311 CB LEU A 19 9.751 -2.972 -10.053 1.00 54.33 C ATOM 312 CG LEU A 19 8.719 -1.796 -10.285 1.00 74.44 C ATOM 313 CD1 LEU A 19 8.589 -1.475 -11.794 1.00 23.24 C ATOM 314 CD2 LEU A 19 7.309 -2.100 -9.700 1.00 72.31 C ATOM 0 H LEU A 19 11.453 -4.697 -9.604 1.00 15.41 H new ATOM 0 HA LEU A 19 10.906 -2.150 -8.414 1.00 62.31 H new ATOM 0 HB2 LEU A 19 10.538 -2.873 -10.801 1.00 54.33 H new ATOM 0 HB3 LEU A 19 9.234 -3.910 -10.257 1.00 54.33 H new ATOM 0 HG LEU A 19 9.117 -0.933 -9.751 1.00 74.44 H new ATOM 0 HD11 LEU A 19 7.875 -0.664 -11.933 1.00 23.24 H new ATOM 0 HD12 LEU A 19 9.560 -1.175 -12.187 1.00 23.24 H new ATOM 0 HD13 LEU A 19 8.240 -2.360 -12.326 1.00 23.24 H new ATOM 0 HD21 LEU A 19 6.646 -1.256 -9.891 1.00 72.31 H new ATOM 0 HD22 LEU A 19 6.904 -2.994 -10.174 1.00 72.31 H new ATOM 0 HD23 LEU A 19 7.388 -2.263 -8.625 1.00 72.31 H new ATOM 326 N ILE A 20 9.019 -4.693 -7.460 1.00 15.14 N ATOM 327 CA ILE A 20 8.145 -5.243 -6.397 1.00 14.34 C ATOM 328 C ILE A 20 8.842 -5.200 -5.008 1.00 54.32 C ATOM 329 O ILE A 20 8.201 -4.913 -3.994 1.00 44.05 O ATOM 330 CB ILE A 20 7.738 -6.720 -6.776 1.00 71.12 C ATOM 331 CG1 ILE A 20 6.888 -6.732 -8.086 1.00 12.54 C ATOM 332 CG2 ILE A 20 7.001 -7.451 -5.634 1.00 32.14 C ATOM 333 CD1 ILE A 20 6.551 -8.113 -8.622 1.00 12.54 C ATOM 0 H ILE A 20 9.283 -5.387 -8.159 1.00 15.14 H new ATOM 0 HA ILE A 20 7.249 -4.626 -6.324 1.00 14.34 H new ATOM 0 HB ILE A 20 8.663 -7.270 -6.947 1.00 71.12 H new ATOM 0 HG12 ILE A 20 5.958 -6.193 -7.903 1.00 12.54 H new ATOM 0 HG13 ILE A 20 7.428 -6.182 -8.856 1.00 12.54 H new ATOM 0 HG21 ILE A 20 6.747 -8.462 -5.953 1.00 32.14 H new ATOM 0 HG22 ILE A 20 7.646 -7.499 -4.757 1.00 32.14 H new ATOM 0 HG23 ILE A 20 6.089 -6.909 -5.384 1.00 32.14 H new ATOM 0 HD11 ILE A 20 5.959 -8.016 -9.532 1.00 12.54 H new ATOM 0 HD12 ILE A 20 7.472 -8.652 -8.844 1.00 12.54 H new ATOM 0 HD13 ILE A 20 5.979 -8.664 -7.875 1.00 12.54 H new ATOM 345 N SER A 21 10.162 -5.472 -4.989 1.00 60.34 N ATOM 346 CA SER A 21 10.988 -5.450 -3.751 1.00 33.11 C ATOM 347 C SER A 21 11.094 -4.025 -3.157 1.00 20.40 C ATOM 348 O SER A 21 11.067 -3.846 -1.932 1.00 31.32 O ATOM 349 CB SER A 21 12.396 -6.010 -4.046 1.00 1.12 C ATOM 350 OG SER A 21 13.212 -6.053 -2.880 1.00 43.41 O ATOM 0 H SER A 21 10.691 -5.714 -5.827 1.00 60.34 H new ATOM 0 HA SER A 21 10.495 -6.080 -3.010 1.00 33.11 H new ATOM 0 HB2 SER A 21 12.306 -7.013 -4.462 1.00 1.12 H new ATOM 0 HB3 SER A 21 12.879 -5.393 -4.803 1.00 1.12 H new ATOM 0 HG SER A 21 14.093 -6.415 -3.111 1.00 43.41 H new ATOM 356 N ALA A 22 11.209 -3.012 -4.038 1.00 51.04 N ATOM 357 CA ALA A 22 11.237 -1.585 -3.634 1.00 54.45 C ATOM 358 C ALA A 22 9.829 -1.101 -3.225 1.00 60.53 C ATOM 359 O ALA A 22 9.674 -0.301 -2.291 1.00 3.52 O ATOM 360 CB ALA A 22 11.786 -0.730 -4.783 1.00 41.21 C ATOM 0 H ALA A 22 11.285 -3.154 -5.045 1.00 51.04 H new ATOM 0 HA ALA A 22 11.892 -1.481 -2.769 1.00 54.45 H new ATOM 0 HB1 ALA A 22 11.804 0.317 -4.481 1.00 41.21 H new ATOM 0 HB2 ALA A 22 12.797 -1.055 -5.027 1.00 41.21 H new ATOM 0 HB3 ALA A 22 11.147 -0.844 -5.659 1.00 41.21 H new ATOM 366 N ALA A 23 8.814 -1.595 -3.956 1.00 63.30 N ATOM 367 CA ALA A 23 7.389 -1.370 -3.640 1.00 74.23 C ATOM 368 C ALA A 23 7.029 -1.892 -2.227 1.00 52.44 C ATOM 369 O ALA A 23 6.239 -1.269 -1.513 1.00 4.34 O ATOM 370 CB ALA A 23 6.504 -2.035 -4.704 1.00 42.53 C ATOM 0 H ALA A 23 8.959 -2.166 -4.789 1.00 63.30 H new ATOM 0 HA ALA A 23 7.207 -0.295 -3.646 1.00 74.23 H new ATOM 0 HB1 ALA A 23 5.455 -1.864 -4.463 1.00 42.53 H new ATOM 0 HB2 ALA A 23 6.726 -1.607 -5.681 1.00 42.53 H new ATOM 0 HB3 ALA A 23 6.702 -3.107 -4.724 1.00 42.53 H new ATOM 376 N TYR A 24 7.625 -3.046 -1.840 1.00 33.33 N ATOM 377 CA TYR A 24 7.493 -3.602 -0.477 1.00 2.12 C ATOM 378 C TYR A 24 8.010 -2.606 0.575 1.00 45.42 C ATOM 379 O TYR A 24 7.304 -2.286 1.508 1.00 54.13 O ATOM 380 CB TYR A 24 8.264 -4.947 -0.322 1.00 50.15 C ATOM 381 CG TYR A 24 7.654 -6.159 -1.041 1.00 71.00 C ATOM 382 CD1 TYR A 24 6.269 -6.329 -1.139 1.00 44.00 C ATOM 383 CD2 TYR A 24 8.470 -7.160 -1.580 1.00 24.24 C ATOM 384 CE1 TYR A 24 5.731 -7.440 -1.757 1.00 53.33 C ATOM 385 CE2 TYR A 24 7.932 -8.267 -2.198 1.00 73.04 C ATOM 386 CZ TYR A 24 6.563 -8.407 -2.281 1.00 32.02 C ATOM 387 OH TYR A 24 6.030 -9.514 -2.903 1.00 13.43 O ATOM 0 H TYR A 24 8.205 -3.611 -2.460 1.00 33.33 H new ATOM 0 HA TYR A 24 6.431 -3.787 -0.317 1.00 2.12 H new ATOM 0 HB2 TYR A 24 9.280 -4.805 -0.690 1.00 50.15 H new ATOM 0 HB3 TYR A 24 8.339 -5.180 0.740 1.00 50.15 H new ATOM 0 HD1 TYR A 24 5.611 -5.580 -0.725 1.00 44.00 H new ATOM 0 HD2 TYR A 24 9.543 -7.062 -1.510 1.00 24.24 H new ATOM 0 HE1 TYR A 24 4.659 -7.552 -1.830 1.00 53.33 H new ATOM 0 HE2 TYR A 24 8.580 -9.023 -2.616 1.00 73.04 H new ATOM 0 HH TYR A 24 5.258 -9.836 -2.392 1.00 13.43 H new ATOM 397 N ARG A 25 9.226 -2.070 0.370 1.00 73.42 N ATOM 398 CA ARG A 25 9.893 -1.156 1.337 1.00 63.25 C ATOM 399 C ARG A 25 9.125 0.175 1.536 1.00 63.23 C ATOM 400 O ARG A 25 9.249 0.819 2.593 1.00 11.35 O ATOM 401 CB ARG A 25 11.336 -0.885 0.846 1.00 63.42 C ATOM 402 CG ARG A 25 12.229 -2.149 0.809 1.00 44.52 C ATOM 403 CD ARG A 25 12.712 -2.588 2.203 1.00 70.30 C ATOM 404 NE ARG A 25 13.588 -1.578 2.825 1.00 74.00 N ATOM 405 CZ ARG A 25 14.468 -1.803 3.778 1.00 42.25 C ATOM 406 NH1 ARG A 25 14.624 -2.987 4.290 1.00 20.31 N ATOM 407 NH2 ARG A 25 15.199 -0.830 4.205 1.00 0.51 N ATOM 0 H ARG A 25 9.780 -2.253 -0.467 1.00 73.42 H new ATOM 0 HA ARG A 25 9.907 -1.644 2.312 1.00 63.25 H new ATOM 0 HB2 ARG A 25 11.295 -0.451 -0.153 1.00 63.42 H new ATOM 0 HB3 ARG A 25 11.799 -0.143 1.497 1.00 63.42 H new ATOM 0 HG2 ARG A 25 11.673 -2.966 0.350 1.00 44.52 H new ATOM 0 HG3 ARG A 25 13.095 -1.957 0.175 1.00 44.52 H new ATOM 0 HD2 ARG A 25 11.850 -2.767 2.846 1.00 70.30 H new ATOM 0 HD3 ARG A 25 13.249 -3.533 2.120 1.00 70.30 H new ATOM 0 HE ARG A 25 13.505 -0.619 2.487 1.00 74.00 H new ATOM 0 HH11 ARG A 25 14.058 -3.766 3.954 1.00 20.31 H new ATOM 0 HH12 ARG A 25 15.312 -3.137 5.028 1.00 20.31 H new ATOM 0 HH21 ARG A 25 15.092 0.102 3.805 1.00 0.51 H new ATOM 0 HH22 ARG A 25 15.884 -0.993 4.943 1.00 0.51 H new ATOM 421 N GLN A 26 8.355 0.589 0.511 1.00 74.52 N ATOM 422 CA GLN A 26 7.458 1.760 0.604 1.00 70.41 C ATOM 423 C GLN A 26 6.291 1.500 1.588 1.00 30.51 C ATOM 424 O GLN A 26 6.014 2.331 2.444 1.00 1.34 O ATOM 425 CB GLN A 26 6.925 2.160 -0.800 1.00 2.22 C ATOM 426 CG GLN A 26 7.986 2.795 -1.731 1.00 51.11 C ATOM 427 CD GLN A 26 8.503 4.173 -1.264 1.00 53.03 C ATOM 428 OE1 GLN A 26 7.647 4.980 -0.653 1.00 33.25 O flip ATOM 429 NE2 GLN A 26 9.659 4.530 -1.491 1.00 21.31 N flip ATOM 0 H GLN A 26 8.336 0.126 -0.398 1.00 74.52 H new ATOM 0 HA GLN A 26 8.039 2.594 0.997 1.00 70.41 H new ATOM 0 HB2 GLN A 26 6.517 1.274 -1.286 1.00 2.22 H new ATOM 0 HB3 GLN A 26 6.101 2.863 -0.676 1.00 2.22 H new ATOM 0 HG2 GLN A 26 8.832 2.113 -1.816 1.00 51.11 H new ATOM 0 HG3 GLN A 26 7.560 2.900 -2.729 1.00 51.11 H new ATOM 0 HE21 GLN A 26 10.305 3.897 -1.962 1.00 21.31 H new ATOM 0 HE22 GLN A 26 9.971 5.459 -1.208 1.00 21.31 H new ATOM 438 N ILE A 27 5.634 0.331 1.475 1.00 65.10 N ATOM 439 CA ILE A 27 4.480 -0.038 2.337 1.00 21.00 C ATOM 440 C ILE A 27 4.985 -0.758 3.621 1.00 34.53 C ATOM 441 O ILE A 27 4.896 -0.221 4.728 1.00 32.05 O ATOM 442 CB ILE A 27 3.428 -0.940 1.555 1.00 40.23 C ATOM 443 CG1 ILE A 27 2.706 -0.143 0.413 1.00 31.15 C ATOM 444 CG2 ILE A 27 2.371 -1.558 2.508 1.00 1.34 C ATOM 445 CD1 ILE A 27 3.550 0.252 -0.781 1.00 32.12 C ATOM 0 H ILE A 27 5.880 -0.384 0.791 1.00 65.10 H new ATOM 0 HA ILE A 27 3.965 0.878 2.626 1.00 21.00 H new ATOM 0 HB ILE A 27 4.002 -1.749 1.103 1.00 40.23 H new ATOM 0 HG12 ILE A 27 1.870 -0.744 0.055 1.00 31.15 H new ATOM 0 HG13 ILE A 27 2.284 0.764 0.846 1.00 31.15 H new ATOM 0 HG21 ILE A 27 1.673 -2.166 1.932 1.00 1.34 H new ATOM 0 HG22 ILE A 27 2.870 -2.182 3.249 1.00 1.34 H new ATOM 0 HG23 ILE A 27 1.826 -0.761 3.013 1.00 1.34 H new ATOM 0 HD11 ILE A 27 2.935 0.796 -1.497 1.00 32.12 H new ATOM 0 HD12 ILE A 27 4.372 0.888 -0.451 1.00 32.12 H new ATOM 0 HD13 ILE A 27 3.952 -0.644 -1.255 1.00 32.12 H new ATOM 457 N PHE A 28 5.528 -1.971 3.444 1.00 3.24 N ATOM 458 CA PHE A 28 6.157 -2.761 4.529 1.00 31.40 C ATOM 459 C PHE A 28 7.638 -2.293 4.711 1.00 72.12 C ATOM 460 O PHE A 28 8.526 -2.816 4.033 1.00 2.34 O ATOM 461 CB PHE A 28 6.133 -4.295 4.189 1.00 13.43 C ATOM 462 CG PHE A 28 4.849 -4.814 3.538 1.00 23.51 C ATOM 463 CD1 PHE A 28 3.737 -5.168 4.300 1.00 53.01 C ATOM 464 CD2 PHE A 28 4.767 -4.963 2.150 1.00 50.54 C ATOM 465 CE1 PHE A 28 2.592 -5.651 3.694 1.00 42.11 C ATOM 466 CE2 PHE A 28 3.623 -5.448 1.550 1.00 60.15 C ATOM 467 CZ PHE A 28 2.536 -5.793 2.323 1.00 70.02 C ATOM 0 H PHE A 28 5.547 -2.441 2.539 1.00 3.24 H new ATOM 0 HA PHE A 28 5.596 -2.602 5.450 1.00 31.40 H new ATOM 0 HB2 PHE A 28 6.969 -4.513 3.524 1.00 13.43 H new ATOM 0 HB3 PHE A 28 6.303 -4.854 5.109 1.00 13.43 H new ATOM 0 HD1 PHE A 28 3.770 -5.064 5.374 1.00 53.01 H new ATOM 0 HD2 PHE A 28 5.614 -4.694 1.537 1.00 50.54 H new ATOM 0 HE1 PHE A 28 1.737 -5.919 4.297 1.00 42.11 H new ATOM 0 HE2 PHE A 28 3.580 -5.557 0.476 1.00 60.15 H new ATOM 0 HZ PHE A 28 1.640 -6.175 1.856 1.00 70.02 H new ATOM 477 N GLU A 29 7.842 -1.186 5.465 1.00 11.14 N ATOM 478 CA GLU A 29 9.198 -0.745 5.963 1.00 32.23 C ATOM 479 C GLU A 29 10.063 -1.907 6.595 1.00 2.34 C ATOM 480 O GLU A 29 10.376 -1.930 7.792 1.00 61.41 O ATOM 481 CB GLU A 29 9.056 0.456 6.952 1.00 21.24 C ATOM 482 CG GLU A 29 8.176 0.173 8.186 1.00 54.42 C ATOM 483 CD GLU A 29 8.116 1.339 9.191 1.00 10.33 C ATOM 484 OE1 GLU A 29 9.107 1.558 9.922 1.00 52.21 O ATOM 485 OE2 GLU A 29 7.073 2.023 9.274 1.00 24.32 O ATOM 0 H GLU A 29 7.085 -0.566 5.752 1.00 11.14 H new ATOM 0 HA GLU A 29 9.751 -0.421 5.082 1.00 32.23 H new ATOM 0 HB2 GLU A 29 10.050 0.750 7.291 1.00 21.24 H new ATOM 0 HB3 GLU A 29 8.639 1.306 6.412 1.00 21.24 H new ATOM 0 HG2 GLU A 29 7.164 -0.059 7.853 1.00 54.42 H new ATOM 0 HG3 GLU A 29 8.555 -0.713 8.695 1.00 54.42 H new ATOM 492 N ARG A 30 10.499 -2.824 5.720 1.00 30.23 N ATOM 493 CA ARG A 30 11.198 -4.081 6.049 1.00 51.54 C ATOM 494 C ARG A 30 11.432 -4.878 4.749 1.00 42.31 C ATOM 495 O ARG A 30 10.617 -4.826 3.814 1.00 23.41 O ATOM 496 CB ARG A 30 10.407 -4.991 7.055 1.00 1.52 C ATOM 497 CG ARG A 30 8.971 -5.394 6.602 1.00 51.00 C ATOM 498 CD ARG A 30 8.518 -6.759 7.161 1.00 61.21 C ATOM 499 NE ARG A 30 9.316 -7.869 6.587 1.00 25.42 N ATOM 500 CZ ARG A 30 9.075 -9.149 6.750 1.00 32.11 C ATOM 501 NH1 ARG A 30 8.107 -9.572 7.504 1.00 53.21 N ATOM 502 NH2 ARG A 30 9.840 -10.013 6.163 1.00 35.25 N ATOM 0 H ARG A 30 10.369 -2.707 4.715 1.00 30.23 H new ATOM 0 HA ARG A 30 12.135 -3.804 6.531 1.00 51.54 H new ATOM 0 HB2 ARG A 30 10.984 -5.900 7.228 1.00 1.52 H new ATOM 0 HB3 ARG A 30 10.336 -4.472 8.011 1.00 1.52 H new ATOM 0 HG2 ARG A 30 8.267 -4.626 6.922 1.00 51.00 H new ATOM 0 HG3 ARG A 30 8.936 -5.425 5.513 1.00 51.00 H new ATOM 0 HD2 ARG A 30 8.617 -6.761 8.246 1.00 61.21 H new ATOM 0 HD3 ARG A 30 7.463 -6.914 6.937 1.00 61.21 H new ATOM 0 HE ARG A 30 10.122 -7.616 6.016 1.00 25.42 H new ATOM 0 HH11 ARG A 30 7.509 -8.903 7.989 1.00 53.21 H new ATOM 0 HH12 ARG A 30 7.944 -10.573 7.611 1.00 53.21 H new ATOM 0 HH21 ARG A 30 10.617 -9.696 5.584 1.00 35.25 H new ATOM 0 HH22 ARG A 30 9.666 -11.011 6.280 1.00 35.25 H new ATOM 516 N ASP A 31 12.557 -5.594 4.678 1.00 75.44 N ATOM 517 CA ASP A 31 12.828 -6.527 3.572 1.00 12.51 C ATOM 518 C ASP A 31 11.909 -7.781 3.675 1.00 64.11 C ATOM 519 O ASP A 31 11.898 -8.481 4.695 1.00 64.01 O ATOM 520 CB ASP A 31 14.332 -6.906 3.542 1.00 54.41 C ATOM 521 CG ASP A 31 14.821 -7.617 4.822 1.00 53.24 C ATOM 522 OD1 ASP A 31 14.752 -7.011 5.915 1.00 54.43 O ATOM 523 OD2 ASP A 31 15.256 -8.787 4.741 1.00 2.54 O ATOM 0 H ASP A 31 13.300 -5.548 5.375 1.00 75.44 H new ATOM 0 HA ASP A 31 12.596 -6.035 2.627 1.00 12.51 H new ATOM 0 HB2 ASP A 31 14.517 -7.553 2.685 1.00 54.41 H new ATOM 0 HB3 ASP A 31 14.922 -6.002 3.392 1.00 54.41 H new ATOM 528 N ILE A 32 11.081 -8.006 2.639 1.00 52.32 N ATOM 529 CA ILE A 32 10.271 -9.235 2.512 1.00 5.51 C ATOM 530 C ILE A 32 11.148 -10.336 1.869 1.00 63.14 C ATOM 531 O ILE A 32 11.732 -10.108 0.801 1.00 10.15 O ATOM 532 CB ILE A 32 8.976 -8.988 1.637 1.00 20.54 C ATOM 533 CG1 ILE A 32 8.081 -7.848 2.241 1.00 73.13 C ATOM 534 CG2 ILE A 32 8.151 -10.293 1.449 1.00 43.41 C ATOM 535 CD1 ILE A 32 7.303 -8.223 3.490 1.00 32.51 C ATOM 0 H ILE A 32 10.954 -7.347 1.871 1.00 52.32 H new ATOM 0 HA ILE A 32 9.938 -9.545 3.502 1.00 5.51 H new ATOM 0 HB ILE A 32 9.316 -8.664 0.653 1.00 20.54 H new ATOM 0 HG12 ILE A 32 8.717 -6.994 2.473 1.00 73.13 H new ATOM 0 HG13 ILE A 32 7.375 -7.521 1.478 1.00 73.13 H new ATOM 0 HG21 ILE A 32 7.270 -10.082 0.843 1.00 43.41 H new ATOM 0 HG22 ILE A 32 8.765 -11.042 0.949 1.00 43.41 H new ATOM 0 HG23 ILE A 32 7.840 -10.670 2.423 1.00 43.41 H new ATOM 0 HD11 ILE A 32 6.718 -7.366 3.825 1.00 32.51 H new ATOM 0 HD12 ILE A 32 6.634 -9.054 3.266 1.00 32.51 H new ATOM 0 HD13 ILE A 32 7.998 -8.518 4.276 1.00 32.51 H new ATOM 547 N ALA A 33 11.255 -11.501 2.543 1.00 22.12 N ATOM 548 CA ALA A 33 12.042 -12.651 2.059 1.00 11.02 C ATOM 549 C ALA A 33 11.529 -13.140 0.676 1.00 52.41 C ATOM 550 O ALA A 33 10.355 -13.458 0.567 1.00 2.44 O ATOM 551 CB ALA A 33 11.966 -13.776 3.099 1.00 14.03 C ATOM 0 H ALA A 33 10.797 -11.669 3.439 1.00 22.12 H new ATOM 0 HA ALA A 33 13.080 -12.346 1.927 1.00 11.02 H new ATOM 0 HB1 ALA A 33 12.544 -14.632 2.752 1.00 14.03 H new ATOM 0 HB2 ALA A 33 12.373 -13.423 4.047 1.00 14.03 H new ATOM 0 HB3 ALA A 33 10.927 -14.073 3.238 1.00 14.03 H new ATOM 557 N PRO A 34 12.396 -13.182 -0.399 1.00 61.13 N ATOM 558 CA PRO A 34 11.976 -13.554 -1.791 1.00 1.42 C ATOM 559 C PRO A 34 11.241 -14.918 -1.893 1.00 21.32 C ATOM 560 O PRO A 34 10.274 -15.054 -2.652 1.00 10.53 O ATOM 561 CB PRO A 34 13.317 -13.579 -2.576 1.00 52.43 C ATOM 562 CG PRO A 34 14.207 -12.647 -1.814 1.00 71.51 C ATOM 563 CD PRO A 34 13.845 -12.846 -0.357 1.00 44.13 C ATOM 0 HA PRO A 34 11.244 -12.847 -2.181 1.00 1.42 H new ATOM 0 HB2 PRO A 34 13.736 -14.585 -2.617 1.00 52.43 H new ATOM 0 HB3 PRO A 34 13.182 -13.248 -3.606 1.00 52.43 H new ATOM 0 HG2 PRO A 34 15.258 -12.874 -1.992 1.00 71.51 H new ATOM 0 HG3 PRO A 34 14.048 -11.613 -2.121 1.00 71.51 H new ATOM 0 HD2 PRO A 34 14.429 -13.647 0.095 1.00 44.13 H new ATOM 0 HD3 PRO A 34 14.031 -11.946 0.229 1.00 44.13 H new ATOM 571 N TYR A 35 11.704 -15.909 -1.104 1.00 4.20 N ATOM 572 CA TYR A 35 11.089 -17.266 -1.052 1.00 33.21 C ATOM 573 C TYR A 35 9.678 -17.247 -0.398 1.00 4.43 C ATOM 574 O TYR A 35 8.861 -18.128 -0.664 1.00 64.22 O ATOM 575 CB TYR A 35 12.035 -18.279 -0.338 1.00 13.42 C ATOM 576 CG TYR A 35 12.448 -17.910 1.101 1.00 72.52 C ATOM 577 CD1 TYR A 35 13.530 -17.059 1.345 1.00 2.14 C ATOM 578 CD2 TYR A 35 11.760 -18.415 2.212 1.00 54.44 C ATOM 579 CE1 TYR A 35 13.906 -16.729 2.634 1.00 54.13 C ATOM 580 CE2 TYR A 35 12.136 -18.081 3.502 1.00 12.32 C ATOM 581 CZ TYR A 35 13.207 -17.238 3.708 1.00 72.34 C ATOM 582 OH TYR A 35 13.580 -16.890 4.994 1.00 62.23 O ATOM 0 H TYR A 35 12.508 -15.800 -0.486 1.00 4.20 H new ATOM 0 HA TYR A 35 10.952 -17.599 -2.081 1.00 33.21 H new ATOM 0 HB2 TYR A 35 11.545 -19.252 -0.317 1.00 13.42 H new ATOM 0 HB3 TYR A 35 12.938 -18.389 -0.938 1.00 13.42 H new ATOM 0 HD1 TYR A 35 14.082 -16.652 0.511 1.00 2.14 H new ATOM 0 HD2 TYR A 35 10.921 -19.077 2.059 1.00 54.44 H new ATOM 0 HE1 TYR A 35 14.747 -16.072 2.800 1.00 54.13 H new ATOM 0 HE2 TYR A 35 11.591 -18.480 4.345 1.00 12.32 H new ATOM 0 HH TYR A 35 12.987 -17.331 5.637 1.00 62.23 H new ATOM 592 N ILE A 36 9.417 -16.246 0.467 1.00 10.22 N ATOM 593 CA ILE A 36 8.069 -15.987 1.037 1.00 61.40 C ATOM 594 C ILE A 36 7.203 -15.144 0.059 1.00 33.12 C ATOM 595 O ILE A 36 6.042 -15.466 -0.186 1.00 3.21 O ATOM 596 CB ILE A 36 8.176 -15.283 2.450 1.00 65.13 C ATOM 597 CG1 ILE A 36 8.869 -16.244 3.473 1.00 55.52 C ATOM 598 CG2 ILE A 36 6.794 -14.815 2.977 1.00 41.41 C ATOM 599 CD1 ILE A 36 9.028 -15.694 4.884 1.00 64.35 C ATOM 0 H ILE A 36 10.130 -15.593 0.793 1.00 10.22 H new ATOM 0 HA ILE A 36 7.575 -16.948 1.178 1.00 61.40 H new ATOM 0 HB ILE A 36 8.786 -14.387 2.331 1.00 65.13 H new ATOM 0 HG12 ILE A 36 8.293 -17.168 3.525 1.00 55.52 H new ATOM 0 HG13 ILE A 36 9.856 -16.504 3.090 1.00 55.52 H new ATOM 0 HG21 ILE A 36 6.918 -14.338 3.949 1.00 41.41 H new ATOM 0 HG22 ILE A 36 6.359 -14.102 2.276 1.00 41.41 H new ATOM 0 HG23 ILE A 36 6.132 -15.675 3.077 1.00 41.41 H new ATOM 0 HD11 ILE A 36 9.519 -16.438 5.511 1.00 64.35 H new ATOM 0 HD12 ILE A 36 9.633 -14.788 4.855 1.00 64.35 H new ATOM 0 HD13 ILE A 36 8.046 -15.462 5.297 1.00 64.35 H new ATOM 611 N ALA A 37 7.808 -14.092 -0.521 1.00 25.30 N ATOM 612 CA ALA A 37 7.128 -13.118 -1.417 1.00 2.33 C ATOM 613 C ALA A 37 6.531 -13.796 -2.671 1.00 3.14 C ATOM 614 O ALA A 37 5.475 -13.394 -3.169 1.00 0.53 O ATOM 615 CB ALA A 37 8.126 -12.024 -1.839 1.00 34.44 C ATOM 0 H ALA A 37 8.797 -13.885 -0.383 1.00 25.30 H new ATOM 0 HA ALA A 37 6.301 -12.677 -0.861 1.00 2.33 H new ATOM 0 HB1 ALA A 37 7.628 -11.311 -2.495 1.00 34.44 H new ATOM 0 HB2 ALA A 37 8.494 -11.506 -0.953 1.00 34.44 H new ATOM 0 HB3 ALA A 37 8.963 -12.480 -2.367 1.00 34.44 H new ATOM 621 N GLN A 38 7.226 -14.842 -3.150 1.00 5.44 N ATOM 622 CA GLN A 38 6.842 -15.569 -4.374 1.00 5.14 C ATOM 623 C GLN A 38 5.558 -16.417 -4.177 1.00 62.33 C ATOM 624 O GLN A 38 4.792 -16.576 -5.119 1.00 72.42 O ATOM 625 CB GLN A 38 8.031 -16.443 -4.884 1.00 4.51 C ATOM 626 CG GLN A 38 8.443 -17.640 -3.965 1.00 31.40 C ATOM 627 CD GLN A 38 8.020 -19.042 -4.461 1.00 54.43 C ATOM 628 OE1 GLN A 38 6.947 -19.147 -5.227 1.00 45.14 O flip ATOM 629 NE2 GLN A 38 8.669 -20.036 -4.157 1.00 74.10 N flip ATOM 0 H GLN A 38 8.067 -15.207 -2.702 1.00 5.44 H new ATOM 0 HA GLN A 38 6.607 -14.827 -5.137 1.00 5.14 H new ATOM 0 HB2 GLN A 38 7.771 -16.837 -5.867 1.00 4.51 H new ATOM 0 HB3 GLN A 38 8.899 -15.798 -5.018 1.00 4.51 H new ATOM 0 HG2 GLN A 38 9.527 -17.628 -3.848 1.00 31.40 H new ATOM 0 HG3 GLN A 38 8.013 -17.480 -2.976 1.00 31.40 H new ATOM 0 HE21 GLN A 38 9.495 -19.945 -3.566 1.00 74.10 H new ATOM 0 HE22 GLN A 38 8.383 -20.955 -4.495 1.00 74.10 H new ATOM 638 N ASN A 39 5.370 -17.024 -2.979 1.00 13.42 N ATOM 639 CA ASN A 39 4.137 -17.804 -2.665 1.00 70.44 C ATOM 640 C ASN A 39 2.967 -16.895 -2.190 1.00 60.33 C ATOM 641 O ASN A 39 1.813 -17.094 -2.590 1.00 14.23 O ATOM 642 CB ASN A 39 4.427 -18.947 -1.651 1.00 63.41 C ATOM 643 CG ASN A 39 4.872 -18.487 -0.263 1.00 63.45 C ATOM 644 OD1 ASN A 39 6.162 -18.437 -0.031 1.00 30.25 O flip ATOM 645 ND2 ASN A 39 4.057 -18.216 0.608 1.00 0.15 N flip ATOM 0 H ASN A 39 6.048 -16.992 -2.217 1.00 13.42 H new ATOM 0 HA ASN A 39 3.812 -18.268 -3.596 1.00 70.44 H new ATOM 0 HB2 ASN A 39 3.528 -19.554 -1.544 1.00 63.41 H new ATOM 0 HB3 ASN A 39 5.200 -19.593 -2.067 1.00 63.41 H new ATOM 0 HD21 ASN A 39 3.059 -18.262 0.404 1.00 0.15 H new ATOM 0 HD22 ASN A 39 4.376 -17.944 1.538 1.00 0.15 H new ATOM 652 N GLU A 40 3.286 -15.900 -1.342 1.00 24.03 N ATOM 653 CA GLU A 40 2.286 -14.970 -0.756 1.00 60.44 C ATOM 654 C GLU A 40 1.637 -14.063 -1.821 1.00 21.22 C ATOM 655 O GLU A 40 0.409 -13.986 -1.939 1.00 32.10 O ATOM 656 CB GLU A 40 2.967 -14.097 0.335 1.00 70.45 C ATOM 657 CG GLU A 40 3.351 -14.856 1.618 1.00 51.31 C ATOM 658 CD GLU A 40 2.133 -15.309 2.440 1.00 34.32 C ATOM 659 OE1 GLU A 40 1.585 -14.483 3.199 1.00 4.11 O ATOM 660 OE2 GLU A 40 1.707 -16.477 2.327 1.00 23.43 O ATOM 0 H GLU A 40 4.242 -15.713 -1.040 1.00 24.03 H new ATOM 0 HA GLU A 40 1.492 -15.573 -0.315 1.00 60.44 H new ATOM 0 HB2 GLU A 40 3.865 -13.647 -0.087 1.00 70.45 H new ATOM 0 HB3 GLU A 40 2.295 -13.280 0.599 1.00 70.45 H new ATOM 0 HG2 GLU A 40 3.947 -15.729 1.352 1.00 51.31 H new ATOM 0 HG3 GLU A 40 3.981 -14.217 2.236 1.00 51.31 H new ATOM 667 N PHE A 41 2.487 -13.368 -2.579 1.00 13.31 N ATOM 668 CA PHE A 41 2.069 -12.461 -3.666 1.00 43.04 C ATOM 669 C PHE A 41 2.172 -13.165 -5.051 1.00 41.10 C ATOM 670 O PHE A 41 2.392 -12.511 -6.064 1.00 63.24 O ATOM 671 CB PHE A 41 2.939 -11.168 -3.586 1.00 24.32 C ATOM 672 CG PHE A 41 2.756 -10.383 -2.269 1.00 54.11 C ATOM 673 CD1 PHE A 41 1.715 -9.462 -2.131 1.00 14.13 C ATOM 674 CD2 PHE A 41 3.603 -10.579 -1.163 1.00 72.34 C ATOM 675 CE1 PHE A 41 1.527 -8.766 -0.948 1.00 22.21 C ATOM 676 CE2 PHE A 41 3.409 -9.881 0.019 1.00 64.23 C ATOM 677 CZ PHE A 41 2.372 -8.976 0.125 1.00 25.11 C ATOM 0 H PHE A 41 3.499 -13.415 -2.459 1.00 13.31 H new ATOM 0 HA PHE A 41 1.021 -12.186 -3.548 1.00 43.04 H new ATOM 0 HB2 PHE A 41 3.989 -11.439 -3.695 1.00 24.32 H new ATOM 0 HB3 PHE A 41 2.688 -10.518 -4.425 1.00 24.32 H new ATOM 0 HD1 PHE A 41 1.045 -9.290 -2.961 1.00 14.13 H new ATOM 0 HD2 PHE A 41 4.417 -11.285 -1.236 1.00 72.34 H new ATOM 0 HE1 PHE A 41 0.717 -8.057 -0.864 1.00 22.21 H new ATOM 0 HE2 PHE A 41 4.070 -10.045 0.857 1.00 64.23 H new ATOM 0 HZ PHE A 41 2.221 -8.432 1.046 1.00 25.11 H new ATOM 687 N SER A 42 1.924 -14.499 -5.074 1.00 33.23 N ATOM 688 CA SER A 42 2.041 -15.356 -6.297 1.00 75.31 C ATOM 689 C SER A 42 1.063 -14.947 -7.418 1.00 31.51 C ATOM 690 O SER A 42 1.457 -14.770 -8.578 1.00 4.44 O ATOM 691 CB SER A 42 1.785 -16.837 -5.928 1.00 42.51 C ATOM 692 OG SER A 42 1.882 -17.692 -7.061 1.00 63.21 O ATOM 0 H SER A 42 1.636 -15.019 -4.245 1.00 33.23 H new ATOM 0 HA SER A 42 3.054 -15.218 -6.676 1.00 75.31 H new ATOM 0 HB2 SER A 42 2.505 -17.152 -5.173 1.00 42.51 H new ATOM 0 HB3 SER A 42 0.794 -16.934 -5.484 1.00 42.51 H new ATOM 0 HG SER A 42 1.716 -18.618 -6.787 1.00 63.21 H new ATOM 698 N GLY A 43 -0.221 -14.808 -7.051 1.00 13.05 N ATOM 699 CA GLY A 43 -1.266 -14.410 -7.999 1.00 34.54 C ATOM 700 C GLY A 43 -1.212 -12.921 -8.320 1.00 31.24 C ATOM 701 O GLY A 43 -1.401 -12.511 -9.470 1.00 72.44 O ATOM 0 H GLY A 43 -0.558 -14.967 -6.101 1.00 13.05 H new ATOM 0 HA2 GLY A 43 -1.157 -14.983 -8.920 1.00 34.54 H new ATOM 0 HA3 GLY A 43 -2.244 -14.656 -7.584 1.00 34.54 H new ATOM 705 N TRP A 44 -0.909 -12.115 -7.288 1.00 63.43 N ATOM 706 CA TRP A 44 -0.919 -10.640 -7.375 1.00 32.50 C ATOM 707 C TRP A 44 0.250 -10.102 -8.242 1.00 65.51 C ATOM 708 O TRP A 44 0.119 -9.062 -8.901 1.00 74.43 O ATOM 709 CB TRP A 44 -0.900 -10.039 -5.941 1.00 61.31 C ATOM 710 CG TRP A 44 -1.203 -8.553 -5.852 1.00 61.24 C ATOM 711 CD1 TRP A 44 -0.550 -7.624 -5.085 1.00 2.54 C ATOM 712 CD2 TRP A 44 -2.249 -7.832 -6.544 1.00 43.22 C ATOM 713 NE1 TRP A 44 -1.101 -6.383 -5.273 1.00 42.41 N ATOM 714 CE2 TRP A 44 -2.147 -6.488 -6.157 1.00 32.32 C ATOM 715 CE3 TRP A 44 -3.255 -8.191 -7.460 1.00 33.43 C ATOM 716 CZ2 TRP A 44 -3.002 -5.510 -6.649 1.00 3.42 C ATOM 717 CZ3 TRP A 44 -4.106 -7.220 -7.941 1.00 20.41 C ATOM 718 CH2 TRP A 44 -3.973 -5.889 -7.536 1.00 61.34 C ATOM 0 H TRP A 44 -0.649 -12.467 -6.366 1.00 63.43 H new ATOM 0 HA TRP A 44 -1.835 -10.326 -7.876 1.00 32.50 H new ATOM 0 HB2 TRP A 44 -1.625 -10.577 -5.330 1.00 61.31 H new ATOM 0 HB3 TRP A 44 0.082 -10.219 -5.503 1.00 61.31 H new ATOM 0 HD1 TRP A 44 0.279 -7.839 -4.427 1.00 2.54 H new ATOM 0 HE1 TRP A 44 -0.785 -5.521 -4.828 1.00 42.41 H new ATOM 0 HE3 TRP A 44 -3.359 -9.216 -7.783 1.00 33.43 H new ATOM 0 HZ2 TRP A 44 -2.903 -4.480 -6.340 1.00 3.42 H new ATOM 0 HZ3 TRP A 44 -4.885 -7.490 -8.639 1.00 20.41 H new ATOM 0 HH2 TRP A 44 -4.649 -5.145 -7.931 1.00 61.34 H new ATOM 729 N GLU A 45 1.375 -10.842 -8.256 1.00 64.13 N ATOM 730 CA GLU A 45 2.545 -10.543 -9.115 1.00 33.34 C ATOM 731 C GLU A 45 2.222 -10.819 -10.597 1.00 53.54 C ATOM 732 O GLU A 45 2.629 -10.053 -11.473 1.00 33.25 O ATOM 733 CB GLU A 45 3.775 -11.394 -8.646 1.00 12.12 C ATOM 734 CG GLU A 45 5.091 -11.251 -9.479 1.00 25.05 C ATOM 735 CD GLU A 45 5.279 -12.302 -10.602 1.00 70.14 C ATOM 736 OE1 GLU A 45 4.832 -12.077 -11.750 1.00 50.13 O ATOM 737 OE2 GLU A 45 5.879 -13.367 -10.342 1.00 54.52 O ATOM 0 H GLU A 45 1.502 -11.668 -7.671 1.00 64.13 H new ATOM 0 HA GLU A 45 2.790 -9.485 -9.021 1.00 33.34 H new ATOM 0 HB2 GLU A 45 3.997 -11.129 -7.612 1.00 12.12 H new ATOM 0 HB3 GLU A 45 3.483 -12.444 -8.650 1.00 12.12 H new ATOM 0 HG2 GLU A 45 5.113 -10.257 -9.926 1.00 25.05 H new ATOM 0 HG3 GLU A 45 5.941 -11.313 -8.799 1.00 25.05 H new ATOM 744 N SER A 46 1.460 -11.910 -10.844 1.00 24.00 N ATOM 745 CA SER A 46 1.192 -12.453 -12.207 1.00 14.43 C ATOM 746 C SER A 46 0.655 -11.391 -13.196 1.00 34.41 C ATOM 747 O SER A 46 1.028 -11.382 -14.378 1.00 73.43 O ATOM 748 CB SER A 46 0.195 -13.632 -12.114 1.00 73.31 C ATOM 749 OG SER A 46 -0.154 -14.136 -13.395 1.00 13.32 O ATOM 0 H SER A 46 1.009 -12.445 -10.102 1.00 24.00 H new ATOM 0 HA SER A 46 2.149 -12.793 -12.602 1.00 14.43 H new ATOM 0 HB2 SER A 46 0.634 -14.432 -11.517 1.00 73.31 H new ATOM 0 HB3 SER A 46 -0.706 -13.305 -11.595 1.00 73.31 H new ATOM 0 HG SER A 46 -0.784 -14.880 -13.293 1.00 13.32 H new ATOM 755 N LYS A 47 -0.206 -10.488 -12.696 1.00 20.24 N ATOM 756 CA LYS A 47 -0.741 -9.369 -13.499 1.00 24.41 C ATOM 757 C LYS A 47 0.321 -8.254 -13.724 1.00 24.40 C ATOM 758 O LYS A 47 0.406 -7.705 -14.819 1.00 42.01 O ATOM 759 CB LYS A 47 -2.032 -8.780 -12.856 1.00 22.32 C ATOM 760 CG LYS A 47 -3.330 -9.608 -13.087 1.00 15.40 C ATOM 761 CD LYS A 47 -3.468 -10.867 -12.199 1.00 63.24 C ATOM 762 CE LYS A 47 -3.694 -10.529 -10.711 1.00 1.31 C ATOM 763 NZ LYS A 47 -4.022 -11.740 -9.919 1.00 13.51 N ATOM 0 H LYS A 47 -0.549 -10.510 -11.736 1.00 20.24 H new ATOM 0 HA LYS A 47 -1.001 -9.775 -14.477 1.00 24.41 H new ATOM 0 HB2 LYS A 47 -1.870 -8.681 -11.783 1.00 22.32 H new ATOM 0 HB3 LYS A 47 -2.187 -7.775 -13.249 1.00 22.32 H new ATOM 0 HG2 LYS A 47 -4.191 -8.962 -12.913 1.00 15.40 H new ATOM 0 HG3 LYS A 47 -3.367 -9.913 -14.133 1.00 15.40 H new ATOM 0 HD2 LYS A 47 -4.301 -11.471 -12.560 1.00 63.24 H new ATOM 0 HD3 LYS A 47 -2.568 -11.474 -12.296 1.00 63.24 H new ATOM 0 HE2 LYS A 47 -2.799 -10.059 -10.304 1.00 1.31 H new ATOM 0 HE3 LYS A 47 -4.503 -9.804 -10.621 1.00 1.31 H new ATOM 0 HZ1 LYS A 47 -4.505 -11.461 -9.041 1.00 13.51 H new ATOM 0 HZ2 LYS A 47 -4.645 -12.360 -10.475 1.00 13.51 H new ATOM 0 HZ3 LYS A 47 -3.146 -12.250 -9.685 1.00 13.51 H new ATOM 777 N LEU A 48 1.133 -7.927 -12.693 1.00 32.15 N ATOM 778 CA LEU A 48 2.165 -6.847 -12.796 1.00 73.42 C ATOM 779 C LEU A 48 3.345 -7.250 -13.722 1.00 15.31 C ATOM 780 O LEU A 48 3.935 -6.390 -14.391 1.00 42.01 O ATOM 781 CB LEU A 48 2.710 -6.438 -11.392 1.00 0.42 C ATOM 782 CG LEU A 48 3.617 -5.153 -11.370 1.00 51.43 C ATOM 783 CD1 LEU A 48 2.820 -3.890 -11.779 1.00 64.23 C ATOM 784 CD2 LEU A 48 4.300 -4.960 -9.998 1.00 32.13 C ATOM 0 H LEU A 48 1.101 -8.386 -11.783 1.00 32.15 H new ATOM 0 HA LEU A 48 1.663 -5.988 -13.241 1.00 73.42 H new ATOM 0 HB2 LEU A 48 1.863 -6.276 -10.725 1.00 0.42 H new ATOM 0 HB3 LEU A 48 3.281 -7.273 -10.985 1.00 0.42 H new ATOM 0 HG LEU A 48 4.404 -5.303 -12.109 1.00 51.43 H new ATOM 0 HD11 LEU A 48 3.477 -3.021 -11.753 1.00 64.23 H new ATOM 0 HD12 LEU A 48 2.428 -4.018 -12.788 1.00 64.23 H new ATOM 0 HD13 LEU A 48 1.993 -3.741 -11.084 1.00 64.23 H new ATOM 0 HD21 LEU A 48 4.918 -4.062 -10.022 1.00 32.13 H new ATOM 0 HD22 LEU A 48 3.539 -4.856 -9.224 1.00 32.13 H new ATOM 0 HD23 LEU A 48 4.926 -5.825 -9.778 1.00 32.13 H new ATOM 796 N GLY A 49 3.658 -8.563 -13.780 1.00 44.34 N ATOM 797 CA GLY A 49 4.744 -9.083 -14.630 1.00 52.34 C ATOM 798 C GLY A 49 4.411 -9.012 -16.126 1.00 30.43 C ATOM 799 O GLY A 49 5.304 -8.869 -16.969 1.00 71.31 O ATOM 0 H GLY A 49 3.170 -9.282 -13.245 1.00 44.34 H new ATOM 0 HA2 GLY A 49 5.654 -8.515 -14.437 1.00 52.34 H new ATOM 0 HA3 GLY A 49 4.950 -10.118 -14.357 1.00 52.34 H new ATOM 803 N ASN A 50 3.110 -9.153 -16.445 1.00 41.31 N ATOM 804 CA ASN A 50 2.577 -8.963 -17.817 1.00 33.14 C ATOM 805 C ASN A 50 2.193 -7.479 -18.082 1.00 41.01 C ATOM 806 O ASN A 50 2.066 -7.061 -19.237 1.00 60.13 O ATOM 807 CB ASN A 50 1.340 -9.876 -18.026 1.00 31.55 C ATOM 808 CG ASN A 50 1.608 -11.356 -17.740 1.00 11.45 C ATOM 809 OD1 ASN A 50 2.717 -11.850 -17.909 1.00 64.23 O ATOM 810 ND2 ASN A 50 0.594 -12.077 -17.305 1.00 2.44 N ATOM 0 H ASN A 50 2.395 -9.402 -15.762 1.00 41.31 H new ATOM 0 HA ASN A 50 3.360 -9.234 -18.525 1.00 33.14 H new ATOM 0 HB2 ASN A 50 0.533 -9.531 -17.380 1.00 31.55 H new ATOM 0 HB3 ASN A 50 0.993 -9.771 -19.054 1.00 31.55 H new ATOM 0 HD21 ASN A 50 0.723 -13.068 -17.101 1.00 2.44 H new ATOM 0 HD22 ASN A 50 -0.320 -11.644 -17.172 1.00 2.44 H new ATOM 817 N GLY A 51 2.020 -6.693 -17.001 1.00 33.41 N ATOM 818 CA GLY A 51 1.580 -5.288 -17.095 1.00 25.40 C ATOM 819 C GLY A 51 0.053 -5.110 -17.166 1.00 11.45 C ATOM 820 O GLY A 51 -0.429 -4.015 -17.478 1.00 72.12 O ATOM 0 H GLY A 51 2.180 -7.012 -16.045 1.00 33.41 H new ATOM 0 HA2 GLY A 51 1.959 -4.742 -16.231 1.00 25.40 H new ATOM 0 HA3 GLY A 51 2.029 -4.837 -17.980 1.00 25.40 H new ATOM 824 N GLU A 52 -0.702 -6.190 -16.862 1.00 41.32 N ATOM 825 CA GLU A 52 -2.194 -6.175 -16.818 1.00 0.31 C ATOM 826 C GLU A 52 -2.727 -5.176 -15.753 1.00 45.12 C ATOM 827 O GLU A 52 -3.799 -4.582 -15.918 1.00 14.14 O ATOM 828 CB GLU A 52 -2.739 -7.601 -16.518 1.00 42.33 C ATOM 829 CG GLU A 52 -2.145 -8.734 -17.383 1.00 21.32 C ATOM 830 CD GLU A 52 -2.341 -8.536 -18.898 1.00 71.22 C ATOM 831 OE1 GLU A 52 -3.435 -8.863 -19.413 1.00 70.32 O ATOM 832 OE2 GLU A 52 -1.408 -8.046 -19.580 1.00 11.31 O ATOM 0 H GLU A 52 -0.300 -7.100 -16.639 1.00 41.32 H new ATOM 0 HA GLU A 52 -2.547 -5.848 -17.796 1.00 0.31 H new ATOM 0 HB2 GLU A 52 -2.550 -7.830 -15.469 1.00 42.33 H new ATOM 0 HB3 GLU A 52 -3.821 -7.594 -16.652 1.00 42.33 H new ATOM 0 HG2 GLU A 52 -1.079 -8.816 -17.173 1.00 21.32 H new ATOM 0 HG3 GLU A 52 -2.602 -9.679 -17.089 1.00 21.32 H new ATOM 839 N ILE A 53 -1.958 -5.026 -14.658 1.00 30.02 N ATOM 840 CA ILE A 53 -2.195 -3.988 -13.625 1.00 1.13 C ATOM 841 C ILE A 53 -1.037 -2.964 -13.627 1.00 61.45 C ATOM 842 O ILE A 53 0.067 -3.245 -14.120 1.00 60.05 O ATOM 843 CB ILE A 53 -2.370 -4.583 -12.172 1.00 1.42 C ATOM 844 CG1 ILE A 53 -1.069 -5.304 -11.675 1.00 62.30 C ATOM 845 CG2 ILE A 53 -3.606 -5.518 -12.100 1.00 22.42 C ATOM 846 CD1 ILE A 53 -1.119 -5.807 -10.236 1.00 1.41 C ATOM 0 H ILE A 53 -1.153 -5.620 -14.460 1.00 30.02 H new ATOM 0 HA ILE A 53 -3.134 -3.501 -13.886 1.00 1.13 H new ATOM 0 HB ILE A 53 -2.545 -3.748 -11.494 1.00 1.42 H new ATOM 0 HG12 ILE A 53 -0.867 -6.150 -12.332 1.00 62.30 H new ATOM 0 HG13 ILE A 53 -0.230 -4.615 -11.774 1.00 62.30 H new ATOM 0 HG21 ILE A 53 -3.704 -5.914 -11.089 1.00 22.42 H new ATOM 0 HG22 ILE A 53 -4.503 -4.955 -12.358 1.00 22.42 H new ATOM 0 HG23 ILE A 53 -3.480 -6.342 -12.802 1.00 22.42 H new ATOM 0 HD11 ILE A 53 -0.174 -6.290 -9.986 1.00 1.41 H new ATOM 0 HD12 ILE A 53 -1.286 -4.966 -9.562 1.00 1.41 H new ATOM 0 HD13 ILE A 53 -1.933 -6.524 -10.129 1.00 1.41 H new ATOM 858 N THR A 54 -1.315 -1.769 -13.097 1.00 34.14 N ATOM 859 CA THR A 54 -0.305 -0.706 -12.922 1.00 52.42 C ATOM 860 C THR A 54 0.471 -0.894 -11.606 1.00 63.13 C ATOM 861 O THR A 54 0.087 -1.722 -10.764 1.00 62.21 O ATOM 862 CB THR A 54 -0.972 0.711 -12.938 1.00 22.14 C ATOM 863 OG1 THR A 54 -1.901 0.847 -11.844 1.00 22.14 O ATOM 864 CG2 THR A 54 -1.704 0.972 -14.268 1.00 15.32 C ATOM 0 H THR A 54 -2.246 -1.505 -12.775 1.00 34.14 H new ATOM 0 HA THR A 54 0.392 -0.778 -13.757 1.00 52.42 H new ATOM 0 HB THR A 54 -0.175 1.447 -12.830 1.00 22.14 H new ATOM 0 HG1 THR A 54 -2.307 1.739 -11.868 1.00 22.14 H new ATOM 0 HG21 THR A 54 -2.156 1.964 -14.246 1.00 15.32 H new ATOM 0 HG22 THR A 54 -0.993 0.915 -15.092 1.00 15.32 H new ATOM 0 HG23 THR A 54 -2.482 0.222 -14.408 1.00 15.32 H new ATOM 872 N VAL A 55 1.570 -0.127 -11.431 1.00 14.43 N ATOM 873 CA VAL A 55 2.352 -0.153 -10.170 1.00 75.40 C ATOM 874 C VAL A 55 1.475 0.358 -9.011 1.00 31.33 C ATOM 875 O VAL A 55 1.424 -0.263 -7.963 1.00 21.21 O ATOM 876 CB VAL A 55 3.672 0.700 -10.242 1.00 34.24 C ATOM 877 CG1 VAL A 55 4.488 0.596 -8.921 1.00 30.33 C ATOM 878 CG2 VAL A 55 4.533 0.289 -11.454 1.00 75.31 C ATOM 0 H VAL A 55 1.935 0.512 -12.138 1.00 14.43 H new ATOM 0 HA VAL A 55 2.651 -1.188 -10.004 1.00 75.40 H new ATOM 0 HB VAL A 55 3.382 1.743 -10.372 1.00 34.24 H new ATOM 0 HG11 VAL A 55 5.394 1.197 -9.004 1.00 30.33 H new ATOM 0 HG12 VAL A 55 3.884 0.963 -8.091 1.00 30.33 H new ATOM 0 HG13 VAL A 55 4.758 -0.445 -8.741 1.00 30.33 H new ATOM 0 HG21 VAL A 55 5.439 0.895 -11.479 1.00 75.31 H new ATOM 0 HG22 VAL A 55 4.803 -0.764 -11.369 1.00 75.31 H new ATOM 0 HG23 VAL A 55 3.967 0.445 -12.372 1.00 75.31 H new ATOM 888 N LYS A 56 0.798 1.502 -9.240 1.00 25.14 N ATOM 889 CA LYS A 56 -0.268 2.048 -8.359 1.00 11.00 C ATOM 890 C LYS A 56 -1.284 0.995 -7.846 1.00 50.24 C ATOM 891 O LYS A 56 -1.535 0.908 -6.638 1.00 41.34 O ATOM 892 CB LYS A 56 -1.018 3.144 -9.150 1.00 53.33 C ATOM 893 CG LYS A 56 -2.208 3.786 -8.416 1.00 41.23 C ATOM 894 CD LYS A 56 -2.844 4.921 -9.221 1.00 30.33 C ATOM 895 CE LYS A 56 -4.112 5.488 -8.576 1.00 44.42 C ATOM 896 NZ LYS A 56 -4.755 6.487 -9.462 1.00 23.23 N ATOM 0 H LYS A 56 0.976 2.087 -10.056 1.00 25.14 H new ATOM 0 HA LYS A 56 0.221 2.437 -7.466 1.00 11.00 H new ATOM 0 HB2 LYS A 56 -0.309 3.929 -9.414 1.00 53.33 H new ATOM 0 HB3 LYS A 56 -1.378 2.713 -10.084 1.00 53.33 H new ATOM 0 HG2 LYS A 56 -2.960 3.024 -8.211 1.00 41.23 H new ATOM 0 HG3 LYS A 56 -1.873 4.170 -7.453 1.00 41.23 H new ATOM 0 HD2 LYS A 56 -2.116 5.724 -9.341 1.00 30.33 H new ATOM 0 HD3 LYS A 56 -3.085 4.557 -10.220 1.00 30.33 H new ATOM 0 HE2 LYS A 56 -4.811 4.679 -8.366 1.00 44.42 H new ATOM 0 HE3 LYS A 56 -3.863 5.950 -7.621 1.00 44.42 H new ATOM 0 HZ1 LYS A 56 -5.741 6.631 -9.165 1.00 23.23 H new ATOM 0 HZ2 LYS A 56 -4.240 7.388 -9.400 1.00 23.23 H new ATOM 0 HZ3 LYS A 56 -4.735 6.144 -10.444 1.00 23.23 H new ATOM 910 N GLU A 57 -1.857 0.215 -8.780 1.00 22.13 N ATOM 911 CA GLU A 57 -2.804 -0.879 -8.452 1.00 43.21 C ATOM 912 C GLU A 57 -2.156 -1.919 -7.492 1.00 72.04 C ATOM 913 O GLU A 57 -2.787 -2.366 -6.527 1.00 52.42 O ATOM 914 CB GLU A 57 -3.293 -1.560 -9.755 1.00 52.23 C ATOM 915 CG GLU A 57 -4.266 -2.746 -9.566 1.00 61.52 C ATOM 916 CD GLU A 57 -5.601 -2.378 -8.888 1.00 54.42 C ATOM 917 OE1 GLU A 57 -6.506 -1.858 -9.580 1.00 54.15 O ATOM 918 OE2 GLU A 57 -5.767 -2.633 -7.674 1.00 43.32 O ATOM 0 H GLU A 57 -1.682 0.320 -9.779 1.00 22.13 H new ATOM 0 HA GLU A 57 -3.662 -0.449 -7.935 1.00 43.21 H new ATOM 0 HB2 GLU A 57 -3.781 -0.808 -10.375 1.00 52.23 H new ATOM 0 HB3 GLU A 57 -2.422 -1.913 -10.308 1.00 52.23 H new ATOM 0 HG2 GLU A 57 -4.477 -3.185 -10.541 1.00 61.52 H new ATOM 0 HG3 GLU A 57 -3.771 -3.514 -8.972 1.00 61.52 H new ATOM 925 N PHE A 58 -0.863 -2.216 -7.735 1.00 72.24 N ATOM 926 CA PHE A 58 -0.084 -3.188 -6.935 1.00 22.03 C ATOM 927 C PHE A 58 0.237 -2.611 -5.522 1.00 52.45 C ATOM 928 O PHE A 58 0.166 -3.332 -4.523 1.00 14.31 O ATOM 929 CB PHE A 58 1.217 -3.566 -7.701 1.00 3.13 C ATOM 930 CG PHE A 58 1.981 -4.764 -7.121 1.00 75.54 C ATOM 931 CD1 PHE A 58 1.674 -6.067 -7.521 1.00 60.31 C ATOM 932 CD2 PHE A 58 3.011 -4.589 -6.191 1.00 42.34 C ATOM 933 CE1 PHE A 58 2.364 -7.150 -7.005 1.00 25.11 C ATOM 934 CE2 PHE A 58 3.697 -5.675 -5.678 1.00 0.51 C ATOM 935 CZ PHE A 58 3.373 -6.956 -6.087 1.00 10.32 C ATOM 0 H PHE A 58 -0.328 -1.789 -8.491 1.00 72.24 H new ATOM 0 HA PHE A 58 -0.678 -4.090 -6.789 1.00 22.03 H new ATOM 0 HB2 PHE A 58 0.961 -3.784 -8.738 1.00 3.13 H new ATOM 0 HB3 PHE A 58 1.880 -2.701 -7.711 1.00 3.13 H new ATOM 0 HD1 PHE A 58 0.888 -6.231 -8.243 1.00 60.31 H new ATOM 0 HD2 PHE A 58 3.274 -3.592 -5.869 1.00 42.34 H new ATOM 0 HE1 PHE A 58 2.111 -8.151 -7.323 1.00 25.11 H new ATOM 0 HE2 PHE A 58 4.487 -5.523 -4.957 1.00 0.51 H new ATOM 0 HZ PHE A 58 3.910 -7.803 -5.687 1.00 10.32 H new ATOM 945 N ILE A 59 0.547 -1.292 -5.471 1.00 12.22 N ATOM 946 CA ILE A 59 0.881 -0.540 -4.228 1.00 1.20 C ATOM 947 C ILE A 59 -0.323 -0.512 -3.259 1.00 64.50 C ATOM 948 O ILE A 59 -0.195 -0.808 -2.060 1.00 61.51 O ATOM 949 CB ILE A 59 1.315 0.946 -4.597 1.00 1.24 C ATOM 950 CG1 ILE A 59 2.679 0.964 -5.361 1.00 64.33 C ATOM 951 CG2 ILE A 59 1.354 1.897 -3.372 1.00 33.40 C ATOM 952 CD1 ILE A 59 3.864 0.443 -4.568 1.00 14.23 C ATOM 0 H ILE A 59 0.573 -0.707 -6.306 1.00 12.22 H new ATOM 0 HA ILE A 59 1.708 -1.047 -3.731 1.00 1.20 H new ATOM 0 HB ILE A 59 0.539 1.330 -5.259 1.00 1.24 H new ATOM 0 HG12 ILE A 59 2.578 0.369 -6.269 1.00 64.33 H new ATOM 0 HG13 ILE A 59 2.891 1.987 -5.673 1.00 64.33 H new ATOM 0 HG21 ILE A 59 1.657 2.893 -3.694 1.00 33.40 H new ATOM 0 HG22 ILE A 59 0.364 1.948 -2.919 1.00 33.40 H new ATOM 0 HG23 ILE A 59 2.068 1.519 -2.641 1.00 33.40 H new ATOM 0 HD11 ILE A 59 4.764 0.495 -5.181 1.00 14.23 H new ATOM 0 HD12 ILE A 59 3.999 1.051 -3.674 1.00 14.23 H new ATOM 0 HD13 ILE A 59 3.682 -0.592 -4.279 1.00 14.23 H new ATOM 964 N GLU A 60 -1.484 -0.124 -3.806 1.00 44.43 N ATOM 965 CA GLU A 60 -2.778 -0.184 -3.107 1.00 74.12 C ATOM 966 C GLU A 60 -3.099 -1.625 -2.632 1.00 44.10 C ATOM 967 O GLU A 60 -3.582 -1.826 -1.519 1.00 35.03 O ATOM 968 CB GLU A 60 -3.886 0.377 -4.043 1.00 65.20 C ATOM 969 CG GLU A 60 -5.203 0.745 -3.336 1.00 50.05 C ATOM 970 CD GLU A 60 -6.195 1.500 -4.239 1.00 15.03 C ATOM 971 OE1 GLU A 60 -5.922 2.675 -4.569 1.00 64.54 O ATOM 972 OE2 GLU A 60 -7.238 0.923 -4.622 1.00 0.23 O ATOM 0 H GLU A 60 -1.553 0.244 -4.755 1.00 44.43 H new ATOM 0 HA GLU A 60 -2.731 0.431 -2.209 1.00 74.12 H new ATOM 0 HB2 GLU A 60 -3.501 1.263 -4.548 1.00 65.20 H new ATOM 0 HB3 GLU A 60 -4.099 -0.363 -4.815 1.00 65.20 H new ATOM 0 HG2 GLU A 60 -5.677 -0.166 -2.971 1.00 50.05 H new ATOM 0 HG3 GLU A 60 -4.979 1.359 -2.464 1.00 50.05 H new ATOM 979 N GLY A 61 -2.755 -2.615 -3.483 1.00 63.42 N ATOM 980 CA GLY A 61 -2.873 -4.045 -3.143 1.00 15.55 C ATOM 981 C GLY A 61 -2.018 -4.473 -1.935 1.00 24.10 C ATOM 982 O GLY A 61 -2.413 -5.356 -1.165 1.00 42.33 O ATOM 0 H GLY A 61 -2.390 -2.445 -4.420 1.00 63.42 H new ATOM 0 HA2 GLY A 61 -3.918 -4.274 -2.935 1.00 15.55 H new ATOM 0 HA3 GLY A 61 -2.583 -4.639 -4.009 1.00 15.55 H new ATOM 986 N LEU A 62 -0.836 -3.842 -1.772 1.00 14.11 N ATOM 987 CA LEU A 62 0.065 -4.086 -0.616 1.00 25.54 C ATOM 988 C LEU A 62 -0.540 -3.525 0.700 1.00 21.41 C ATOM 989 O LEU A 62 -0.405 -4.136 1.764 1.00 12.52 O ATOM 990 CB LEU A 62 1.469 -3.472 -0.875 1.00 3.41 C ATOM 991 CG LEU A 62 2.225 -3.980 -2.146 1.00 22.33 C ATOM 992 CD1 LEU A 62 3.594 -3.287 -2.307 1.00 23.40 C ATOM 993 CD2 LEU A 62 2.376 -5.517 -2.137 1.00 44.14 C ATOM 0 H LEU A 62 -0.477 -3.152 -2.432 1.00 14.11 H new ATOM 0 HA LEU A 62 0.173 -5.165 -0.502 1.00 25.54 H new ATOM 0 HB2 LEU A 62 1.360 -2.390 -0.952 1.00 3.41 H new ATOM 0 HB3 LEU A 62 2.094 -3.669 -0.004 1.00 3.41 H new ATOM 0 HG LEU A 62 1.618 -3.712 -3.011 1.00 22.33 H new ATOM 0 HD11 LEU A 62 4.090 -3.665 -3.201 1.00 23.40 H new ATOM 0 HD12 LEU A 62 3.448 -2.211 -2.401 1.00 23.40 H new ATOM 0 HD13 LEU A 62 4.212 -3.495 -1.433 1.00 23.40 H new ATOM 0 HD21 LEU A 62 2.906 -5.836 -3.035 1.00 44.14 H new ATOM 0 HD22 LEU A 62 2.940 -5.822 -1.255 1.00 44.14 H new ATOM 0 HD23 LEU A 62 1.389 -5.979 -2.115 1.00 44.14 H new ATOM 1005 N GLY A 63 -1.169 -2.337 0.619 1.00 44.33 N ATOM 1006 CA GLY A 63 -1.962 -1.789 1.739 1.00 63.35 C ATOM 1007 C GLY A 63 -3.212 -2.611 2.099 1.00 72.11 C ATOM 1008 O GLY A 63 -3.629 -2.644 3.261 1.00 12.32 O ATOM 0 H GLY A 63 -1.144 -1.739 -0.207 1.00 44.33 H new ATOM 0 HA2 GLY A 63 -1.323 -1.719 2.619 1.00 63.35 H new ATOM 0 HA3 GLY A 63 -2.270 -0.774 1.487 1.00 63.35 H new ATOM 1012 N TYR A 64 -3.819 -3.259 1.083 1.00 54.14 N ATOM 1013 CA TYR A 64 -4.960 -4.197 1.271 1.00 22.43 C ATOM 1014 C TYR A 64 -4.502 -5.541 1.906 1.00 13.13 C ATOM 1015 O TYR A 64 -5.325 -6.270 2.479 1.00 71.43 O ATOM 1016 CB TYR A 64 -5.675 -4.473 -0.089 1.00 24.03 C ATOM 1017 CG TYR A 64 -6.512 -3.315 -0.680 1.00 50.51 C ATOM 1018 CD1 TYR A 64 -6.344 -1.982 -0.285 1.00 34.03 C ATOM 1019 CD2 TYR A 64 -7.482 -3.575 -1.654 1.00 54.33 C ATOM 1020 CE1 TYR A 64 -7.105 -0.969 -0.839 1.00 24.04 C ATOM 1021 CE2 TYR A 64 -8.244 -2.561 -2.203 1.00 54.41 C ATOM 1022 CZ TYR A 64 -8.054 -1.263 -1.796 1.00 4.40 C ATOM 1023 OH TYR A 64 -8.820 -0.253 -2.347 1.00 32.35 O ATOM 0 H TYR A 64 -3.537 -3.151 0.109 1.00 54.14 H new ATOM 0 HA TYR A 64 -5.661 -3.719 1.956 1.00 22.43 H new ATOM 0 HB2 TYR A 64 -4.918 -4.754 -0.821 1.00 24.03 H new ATOM 0 HB3 TYR A 64 -6.329 -5.335 0.039 1.00 24.03 H new ATOM 0 HD1 TYR A 64 -5.606 -1.741 0.466 1.00 34.03 H new ATOM 0 HD2 TYR A 64 -7.639 -4.591 -1.984 1.00 54.33 H new ATOM 0 HE1 TYR A 64 -6.956 0.053 -0.522 1.00 24.04 H new ATOM 0 HE2 TYR A 64 -8.988 -2.789 -2.952 1.00 54.41 H new ATOM 0 HH TYR A 64 -8.341 0.145 -3.104 1.00 32.35 H new ATOM 1033 N SER A 65 -3.194 -5.860 1.777 1.00 65.14 N ATOM 1034 CA SER A 65 -2.602 -7.098 2.343 1.00 63.14 C ATOM 1035 C SER A 65 -2.691 -7.127 3.889 1.00 45.43 C ATOM 1036 O SER A 65 -2.260 -6.182 4.562 1.00 14.51 O ATOM 1037 CB SER A 65 -1.123 -7.254 1.913 1.00 21.51 C ATOM 1038 OG SER A 65 -0.529 -8.419 2.480 1.00 10.14 O ATOM 0 H SER A 65 -2.522 -5.273 1.282 1.00 65.14 H new ATOM 0 HA SER A 65 -3.184 -7.931 1.948 1.00 63.14 H new ATOM 0 HB2 SER A 65 -1.064 -7.308 0.826 1.00 21.51 H new ATOM 0 HB3 SER A 65 -0.560 -6.372 2.220 1.00 21.51 H new ATOM 0 HG SER A 65 0.403 -8.487 2.186 1.00 10.14 H new ATOM 1044 N ASN A 66 -3.224 -8.242 4.433 1.00 50.04 N ATOM 1045 CA ASN A 66 -3.387 -8.466 5.898 1.00 61.43 C ATOM 1046 C ASN A 66 -2.040 -8.435 6.673 1.00 32.43 C ATOM 1047 O ASN A 66 -2.030 -8.266 7.898 1.00 61.25 O ATOM 1048 CB ASN A 66 -4.118 -9.809 6.145 1.00 13.32 C ATOM 1049 CG ASN A 66 -3.367 -11.010 5.565 1.00 31.22 C ATOM 1050 OD1 ASN A 66 -3.584 -11.407 4.424 1.00 23.40 O ATOM 1051 ND2 ASN A 66 -2.461 -11.582 6.336 1.00 71.24 N ATOM 0 H ASN A 66 -3.558 -9.023 3.868 1.00 50.04 H new ATOM 0 HA ASN A 66 -3.985 -7.640 6.283 1.00 61.43 H new ATOM 0 HB2 ASN A 66 -4.251 -9.953 7.217 1.00 13.32 H new ATOM 0 HB3 ASN A 66 -5.114 -9.762 5.704 1.00 13.32 H new ATOM 0 HD21 ASN A 66 -1.921 -12.374 5.987 1.00 71.24 H new ATOM 0 HD22 ASN A 66 -2.301 -11.232 7.281 1.00 71.24 H new ATOM 1058 N LEU A 67 -0.915 -8.618 5.946 1.00 32.44 N ATOM 1059 CA LEU A 67 0.448 -8.502 6.513 1.00 33.21 C ATOM 1060 C LEU A 67 0.700 -7.068 7.047 1.00 25.15 C ATOM 1061 O LEU A 67 1.208 -6.894 8.154 1.00 33.35 O ATOM 1062 CB LEU A 67 1.512 -8.887 5.451 1.00 52.43 C ATOM 1063 CG LEU A 67 3.007 -8.878 5.931 1.00 64.13 C ATOM 1064 CD1 LEU A 67 3.249 -9.883 7.084 1.00 11.22 C ATOM 1065 CD2 LEU A 67 3.974 -9.139 4.751 1.00 41.42 C ATOM 0 H LEU A 67 -0.926 -8.850 4.953 1.00 32.44 H new ATOM 0 HA LEU A 67 0.532 -9.195 7.350 1.00 33.21 H new ATOM 0 HB2 LEU A 67 1.278 -9.884 5.078 1.00 52.43 H new ATOM 0 HB3 LEU A 67 1.419 -8.202 4.609 1.00 52.43 H new ATOM 0 HG LEU A 67 3.214 -7.882 6.322 1.00 64.13 H new ATOM 0 HD11 LEU A 67 4.296 -9.845 7.386 1.00 11.22 H new ATOM 0 HD12 LEU A 67 2.617 -9.622 7.933 1.00 11.22 H new ATOM 0 HD13 LEU A 67 3.005 -10.890 6.746 1.00 11.22 H new ATOM 0 HD21 LEU A 67 5.002 -9.127 5.113 1.00 41.42 H new ATOM 0 HD22 LEU A 67 3.756 -10.112 4.310 1.00 41.42 H new ATOM 0 HD23 LEU A 67 3.846 -8.362 3.997 1.00 41.42 H new ATOM 1077 N TYR A 68 0.293 -6.048 6.266 1.00 60.55 N ATOM 1078 CA TYR A 68 0.384 -4.626 6.686 1.00 72.53 C ATOM 1079 C TYR A 68 -0.584 -4.317 7.863 1.00 63.44 C ATOM 1080 O TYR A 68 -0.304 -3.460 8.699 1.00 75.34 O ATOM 1081 CB TYR A 68 0.090 -3.688 5.482 1.00 40.32 C ATOM 1082 CG TYR A 68 0.273 -2.193 5.796 1.00 22.31 C ATOM 1083 CD1 TYR A 68 1.546 -1.660 6.031 1.00 3.13 C ATOM 1084 CD2 TYR A 68 -0.820 -1.321 5.878 1.00 23.24 C ATOM 1085 CE1 TYR A 68 1.719 -0.325 6.333 1.00 74.13 C ATOM 1086 CE2 TYR A 68 -0.648 0.019 6.177 1.00 75.34 C ATOM 1087 CZ TYR A 68 0.623 0.510 6.404 1.00 51.42 C ATOM 1088 OH TYR A 68 0.800 1.841 6.713 1.00 53.01 O ATOM 0 H TYR A 68 -0.104 -6.178 5.336 1.00 60.55 H new ATOM 0 HA TYR A 68 1.400 -4.445 7.036 1.00 72.53 H new ATOM 0 HB2 TYR A 68 0.746 -3.958 4.655 1.00 40.32 H new ATOM 0 HB3 TYR A 68 -0.933 -3.856 5.145 1.00 40.32 H new ATOM 0 HD1 TYR A 68 2.409 -2.306 5.975 1.00 3.13 H new ATOM 0 HD2 TYR A 68 -1.816 -1.702 5.705 1.00 23.24 H new ATOM 0 HE1 TYR A 68 2.710 0.065 6.513 1.00 74.13 H new ATOM 0 HE2 TYR A 68 -1.502 0.677 6.233 1.00 75.34 H new ATOM 0 HH TYR A 68 0.185 2.094 7.433 1.00 53.01 H new ATOM 1098 N LEU A 69 -1.722 -5.026 7.905 1.00 14.44 N ATOM 1099 CA LEU A 69 -2.744 -4.864 8.970 1.00 70.13 C ATOM 1100 C LEU A 69 -2.273 -5.445 10.334 1.00 60.52 C ATOM 1101 O LEU A 69 -2.612 -4.910 11.392 1.00 23.40 O ATOM 1102 CB LEU A 69 -4.104 -5.494 8.519 1.00 4.20 C ATOM 1103 CG LEU A 69 -5.014 -4.618 7.585 1.00 44.23 C ATOM 1104 CD1 LEU A 69 -5.532 -3.375 8.327 1.00 1.53 C ATOM 1105 CD2 LEU A 69 -4.298 -4.215 6.275 1.00 4.40 C ATOM 0 H LEU A 69 -1.967 -5.728 7.207 1.00 14.44 H new ATOM 0 HA LEU A 69 -2.891 -3.795 9.125 1.00 70.13 H new ATOM 0 HB2 LEU A 69 -3.891 -6.431 8.004 1.00 4.20 H new ATOM 0 HB3 LEU A 69 -4.676 -5.744 9.413 1.00 4.20 H new ATOM 0 HG LEU A 69 -5.867 -5.237 7.307 1.00 44.23 H new ATOM 0 HD11 LEU A 69 -6.159 -2.787 7.657 1.00 1.53 H new ATOM 0 HD12 LEU A 69 -6.117 -3.686 9.193 1.00 1.53 H new ATOM 0 HD13 LEU A 69 -4.687 -2.771 8.658 1.00 1.53 H new ATOM 0 HD21 LEU A 69 -4.969 -3.611 5.665 1.00 4.40 H new ATOM 0 HD22 LEU A 69 -3.404 -3.638 6.512 1.00 4.40 H new ATOM 0 HD23 LEU A 69 -4.015 -5.112 5.724 1.00 4.40 H new ATOM 1117 N LYS A 70 -1.496 -6.542 10.318 1.00 52.34 N ATOM 1118 CA LYS A 70 -0.945 -7.114 11.569 1.00 74.44 C ATOM 1119 C LYS A 70 0.322 -6.354 12.037 1.00 2.24 C ATOM 1120 O LYS A 70 0.597 -6.287 13.238 1.00 44.44 O ATOM 1121 CB LYS A 70 -0.733 -8.663 11.447 1.00 71.24 C ATOM 1122 CG LYS A 70 0.219 -9.169 10.323 1.00 31.43 C ATOM 1123 CD LYS A 70 1.727 -9.137 10.689 1.00 54.52 C ATOM 1124 CE LYS A 70 2.072 -9.992 11.928 1.00 73.24 C ATOM 1125 NZ LYS A 70 3.527 -9.983 12.223 1.00 54.01 N ATOM 0 H LYS A 70 -1.236 -7.047 9.471 1.00 52.34 H new ATOM 0 HA LYS A 70 -1.684 -6.972 12.358 1.00 74.44 H new ATOM 0 HB2 LYS A 70 -0.351 -9.027 12.401 1.00 71.24 H new ATOM 0 HB3 LYS A 70 -1.708 -9.126 11.296 1.00 71.24 H new ATOM 0 HG2 LYS A 70 -0.057 -10.191 10.065 1.00 31.43 H new ATOM 0 HG3 LYS A 70 0.062 -8.562 9.432 1.00 31.43 H new ATOM 0 HD2 LYS A 70 2.308 -9.492 9.838 1.00 54.52 H new ATOM 0 HD3 LYS A 70 2.028 -8.105 10.873 1.00 54.52 H new ATOM 0 HE2 LYS A 70 1.525 -9.615 12.792 1.00 73.24 H new ATOM 0 HE3 LYS A 70 1.742 -11.018 11.764 1.00 73.24 H new ATOM 0 HZ1 LYS A 70 3.677 -10.165 13.236 1.00 54.01 H new ATOM 0 HZ2 LYS A 70 3.999 -10.722 11.664 1.00 54.01 H new ATOM 0 HZ3 LYS A 70 3.926 -9.055 11.976 1.00 54.01 H new ATOM 1139 N GLU A 71 1.091 -5.783 11.085 1.00 72.34 N ATOM 1140 CA GLU A 71 2.279 -4.946 11.407 1.00 71.12 C ATOM 1141 C GLU A 71 1.892 -3.531 11.932 1.00 64.42 C ATOM 1142 O GLU A 71 2.293 -3.142 13.031 1.00 43.44 O ATOM 1143 CB GLU A 71 3.180 -4.802 10.144 1.00 51.01 C ATOM 1144 CG GLU A 71 3.872 -6.098 9.669 1.00 33.13 C ATOM 1145 CD GLU A 71 4.978 -6.588 10.623 1.00 1.11 C ATOM 1146 OE1 GLU A 71 6.140 -6.162 10.462 1.00 31.02 O ATOM 1147 OE2 GLU A 71 4.694 -7.397 11.537 1.00 3.10 O ATOM 0 H GLU A 71 0.915 -5.883 10.085 1.00 72.34 H new ATOM 0 HA GLU A 71 2.821 -5.453 12.205 1.00 71.12 H new ATOM 0 HB2 GLU A 71 2.571 -4.416 9.327 1.00 51.01 H new ATOM 0 HB3 GLU A 71 3.947 -4.056 10.350 1.00 51.01 H new ATOM 0 HG2 GLU A 71 3.123 -6.882 9.561 1.00 33.13 H new ATOM 0 HG3 GLU A 71 4.303 -5.930 8.682 1.00 33.13 H new ATOM 1154 N PHE A 72 1.104 -2.774 11.132 1.00 13.32 N ATOM 1155 CA PHE A 72 0.792 -1.336 11.401 1.00 52.14 C ATOM 1156 C PHE A 72 -0.729 -1.050 11.375 1.00 63.44 C ATOM 1157 O PHE A 72 -1.214 -0.242 10.572 1.00 52.54 O ATOM 1158 CB PHE A 72 1.555 -0.422 10.385 1.00 21.21 C ATOM 1159 CG PHE A 72 3.072 -0.635 10.390 1.00 34.14 C ATOM 1160 CD1 PHE A 72 3.844 -0.206 11.468 1.00 14.04 C ATOM 1161 CD2 PHE A 72 3.716 -1.303 9.345 1.00 61.11 C ATOM 1162 CE1 PHE A 72 5.204 -0.437 11.504 1.00 75.43 C ATOM 1163 CE2 PHE A 72 5.077 -1.526 9.379 1.00 71.24 C ATOM 1164 CZ PHE A 72 5.816 -1.099 10.462 1.00 21.33 C ATOM 0 H PHE A 72 0.665 -3.134 10.284 1.00 13.32 H new ATOM 0 HA PHE A 72 1.134 -1.106 12.410 1.00 52.14 H new ATOM 0 HB2 PHE A 72 1.173 -0.610 9.382 1.00 21.21 H new ATOM 0 HB3 PHE A 72 1.342 0.622 10.617 1.00 21.21 H new ATOM 0 HD1 PHE A 72 3.371 0.315 12.287 1.00 14.04 H new ATOM 0 HD2 PHE A 72 3.140 -1.649 8.499 1.00 61.11 H new ATOM 0 HE1 PHE A 72 5.788 -0.099 12.348 1.00 75.43 H new ATOM 0 HE2 PHE A 72 5.563 -2.034 8.559 1.00 71.24 H new ATOM 0 HZ PHE A 72 6.880 -1.284 10.494 1.00 21.33 H new ATOM 1174 N TYR A 73 -1.471 -1.729 12.271 1.00 33.54 N ATOM 1175 CA TYR A 73 -2.915 -1.460 12.498 1.00 53.02 C ATOM 1176 C TYR A 73 -3.378 -2.063 13.839 1.00 41.32 C ATOM 1177 O TYR A 73 -3.842 -1.345 14.728 1.00 24.31 O ATOM 1178 CB TYR A 73 -3.781 -1.996 11.321 1.00 15.42 C ATOM 1179 CG TYR A 73 -5.301 -1.759 11.450 1.00 63.23 C ATOM 1180 CD1 TYR A 73 -5.877 -0.564 11.029 1.00 60.45 C ATOM 1181 CD2 TYR A 73 -6.158 -2.735 11.984 1.00 51.20 C ATOM 1182 CE1 TYR A 73 -7.233 -0.341 11.134 1.00 12.44 C ATOM 1183 CE2 TYR A 73 -7.520 -2.514 12.090 1.00 65.45 C ATOM 1184 CZ TYR A 73 -8.050 -1.314 11.664 1.00 43.50 C ATOM 1185 OH TYR A 73 -9.404 -1.086 11.769 1.00 15.34 O ATOM 0 H TYR A 73 -1.095 -2.475 12.857 1.00 33.54 H new ATOM 0 HA TYR A 73 -3.050 -0.379 12.544 1.00 53.02 H new ATOM 0 HB2 TYR A 73 -3.436 -1.530 10.398 1.00 15.42 H new ATOM 0 HB3 TYR A 73 -3.605 -3.067 11.223 1.00 15.42 H new ATOM 0 HD1 TYR A 73 -5.247 0.207 10.610 1.00 60.45 H new ATOM 0 HD2 TYR A 73 -5.746 -3.676 12.318 1.00 51.20 H new ATOM 0 HE1 TYR A 73 -7.654 0.596 10.801 1.00 12.44 H new ATOM 0 HE2 TYR A 73 -8.164 -3.276 12.504 1.00 65.45 H new ATOM 0 HH TYR A 73 -9.838 -1.871 12.162 1.00 15.34 H new ATOM 1195 N THR A 74 -3.251 -3.400 13.957 1.00 64.32 N ATOM 1196 CA THR A 74 -3.696 -4.163 15.152 1.00 12.22 C ATOM 1197 C THR A 74 -2.917 -3.811 16.477 1.00 43.52 C ATOM 1198 O THR A 74 -3.564 -3.708 17.531 1.00 12.13 O ATOM 1199 CB THR A 74 -3.679 -5.721 14.900 1.00 72.41 C ATOM 1200 OG1 THR A 74 -2.370 -6.155 14.504 1.00 40.22 O ATOM 1201 CG2 THR A 74 -4.697 -6.143 13.820 1.00 22.30 C ATOM 0 H THR A 74 -2.838 -3.985 13.231 1.00 64.32 H new ATOM 0 HA THR A 74 -4.726 -3.842 15.310 1.00 12.22 H new ATOM 0 HB THR A 74 -3.958 -6.195 15.841 1.00 72.41 H new ATOM 0 HG1 THR A 74 -2.335 -7.134 14.508 1.00 40.22 H new ATOM 0 HG21 THR A 74 -4.651 -7.223 13.679 1.00 22.30 H new ATOM 0 HG22 THR A 74 -5.701 -5.861 14.136 1.00 22.30 H new ATOM 0 HG23 THR A 74 -4.459 -5.644 12.881 1.00 22.30 H new ATOM 1209 N PRO A 75 -1.542 -3.612 16.488 1.00 70.35 N ATOM 1210 CA PRO A 75 -0.825 -3.201 17.730 1.00 64.23 C ATOM 1211 C PRO A 75 -0.815 -1.660 17.978 1.00 20.12 C ATOM 1212 O PRO A 75 -0.391 -1.209 19.043 1.00 31.44 O ATOM 1213 CB PRO A 75 0.599 -3.757 17.481 1.00 53.31 C ATOM 1214 CG PRO A 75 0.791 -3.647 15.997 1.00 60.44 C ATOM 1215 CD PRO A 75 -0.579 -3.804 15.364 1.00 61.40 C ATOM 0 HA PRO A 75 -1.306 -3.582 18.631 1.00 64.23 H new ATOM 0 HB2 PRO A 75 1.350 -3.181 18.022 1.00 53.31 H new ATOM 0 HB3 PRO A 75 0.686 -4.790 17.817 1.00 53.31 H new ATOM 0 HG2 PRO A 75 1.230 -2.684 15.734 1.00 60.44 H new ATOM 0 HG3 PRO A 75 1.473 -4.417 15.637 1.00 60.44 H new ATOM 0 HD2 PRO A 75 -0.738 -3.067 14.577 1.00 61.40 H new ATOM 0 HD3 PRO A 75 -0.694 -4.787 14.908 1.00 61.40 H new ATOM 1223 N TYR A 76 -1.299 -0.870 16.994 1.00 54.13 N ATOM 1224 CA TYR A 76 -1.293 0.622 17.048 1.00 12.01 C ATOM 1225 C TYR A 76 -2.724 1.199 17.228 1.00 22.21 C ATOM 1226 O TYR A 76 -3.703 0.582 16.787 1.00 44.13 O ATOM 1227 CB TYR A 76 -0.650 1.193 15.751 1.00 24.25 C ATOM 1228 CG TYR A 76 0.853 0.905 15.630 1.00 5.45 C ATOM 1229 CD1 TYR A 76 1.793 1.730 16.251 1.00 43.24 C ATOM 1230 CD2 TYR A 76 1.331 -0.193 14.917 1.00 14.52 C ATOM 1231 CE1 TYR A 76 3.145 1.473 16.159 1.00 64.13 C ATOM 1232 CE2 TYR A 76 2.685 -0.455 14.828 1.00 72.55 C ATOM 1233 CZ TYR A 76 3.589 0.382 15.448 1.00 14.21 C ATOM 1234 OH TYR A 76 4.942 0.127 15.359 1.00 0.04 O ATOM 0 H TYR A 76 -1.707 -1.242 16.136 1.00 54.13 H new ATOM 0 HA TYR A 76 -0.704 0.922 17.915 1.00 12.01 H new ATOM 0 HB2 TYR A 76 -1.163 0.772 14.886 1.00 24.25 H new ATOM 0 HB3 TYR A 76 -0.808 2.271 15.722 1.00 24.25 H new ATOM 0 HD1 TYR A 76 1.455 2.587 16.815 1.00 43.24 H new ATOM 0 HD2 TYR A 76 0.630 -0.851 14.425 1.00 14.52 H new ATOM 0 HE1 TYR A 76 3.854 2.127 16.644 1.00 64.13 H new ATOM 0 HE2 TYR A 76 3.035 -1.314 14.274 1.00 72.55 H new ATOM 0 HH TYR A 76 5.088 -0.680 14.823 1.00 0.04 H new ATOM 1244 N PRO A 77 -2.876 2.398 17.900 1.00 62.22 N ATOM 1245 CA PRO A 77 -4.166 3.142 17.909 1.00 40.33 C ATOM 1246 C PRO A 77 -4.505 3.703 16.499 1.00 45.12 C ATOM 1247 O PRO A 77 -3.598 3.935 15.698 1.00 41.11 O ATOM 1248 CB PRO A 77 -3.927 4.277 18.946 1.00 15.14 C ATOM 1249 CG PRO A 77 -2.439 4.469 18.968 1.00 30.31 C ATOM 1250 CD PRO A 77 -1.836 3.096 18.717 1.00 43.44 C ATOM 0 HA PRO A 77 -5.018 2.514 18.171 1.00 40.33 H new ATOM 0 HB2 PRO A 77 -4.440 5.194 18.654 1.00 15.14 H new ATOM 0 HB3 PRO A 77 -4.305 4.000 19.930 1.00 15.14 H new ATOM 0 HG2 PRO A 77 -2.126 5.179 18.202 1.00 30.31 H new ATOM 0 HG3 PRO A 77 -2.111 4.870 19.927 1.00 30.31 H new ATOM 0 HD2 PRO A 77 -0.888 3.166 18.184 1.00 43.44 H new ATOM 0 HD3 PRO A 77 -1.639 2.568 19.650 1.00 43.44 H new ATOM 1258 N ASN A 78 -5.814 3.886 16.209 1.00 12.44 N ATOM 1259 CA ASN A 78 -6.313 4.362 14.884 1.00 14.33 C ATOM 1260 C ASN A 78 -5.586 5.651 14.395 1.00 31.53 C ATOM 1261 O ASN A 78 -5.133 5.705 13.252 1.00 61.34 O ATOM 1262 CB ASN A 78 -7.854 4.578 14.952 1.00 34.53 C ATOM 1263 CG ASN A 78 -8.557 4.702 13.585 1.00 60.44 C ATOM 1264 OD1 ASN A 78 -8.007 5.192 12.605 1.00 72.43 O ATOM 1265 ND2 ASN A 78 -9.797 4.255 13.514 1.00 61.42 N ATOM 0 H ASN A 78 -6.559 3.710 16.883 1.00 12.44 H new ATOM 0 HA ASN A 78 -6.088 3.590 14.148 1.00 14.33 H new ATOM 0 HB2 ASN A 78 -8.298 3.746 15.498 1.00 34.53 H new ATOM 0 HB3 ASN A 78 -8.054 5.481 15.529 1.00 34.53 H new ATOM 0 HD21 ASN A 78 -10.311 4.315 12.635 1.00 61.42 H new ATOM 0 HD22 ASN A 78 -10.241 3.850 14.338 1.00 61.42 H new ATOM 1272 N THR A 79 -5.460 6.663 15.284 1.00 13.11 N ATOM 1273 CA THR A 79 -4.731 7.933 14.994 1.00 14.32 C ATOM 1274 C THR A 79 -3.259 7.682 14.539 1.00 24.44 C ATOM 1275 O THR A 79 -2.720 8.412 13.695 1.00 25.32 O ATOM 1276 CB THR A 79 -4.739 8.889 16.243 1.00 63.23 C ATOM 1277 OG1 THR A 79 -6.076 9.006 16.761 1.00 32.52 O ATOM 1278 CG2 THR A 79 -4.215 10.302 15.913 1.00 41.25 C ATOM 0 H THR A 79 -5.858 6.629 16.223 1.00 13.11 H new ATOM 0 HA THR A 79 -5.262 8.410 14.170 1.00 14.32 H new ATOM 0 HB THR A 79 -4.072 8.445 16.982 1.00 63.23 H new ATOM 0 HG1 THR A 79 -6.074 9.601 17.540 1.00 32.52 H new ATOM 0 HG21 THR A 79 -4.243 10.919 16.811 1.00 41.25 H new ATOM 0 HG22 THR A 79 -3.189 10.234 15.551 1.00 41.25 H new ATOM 0 HG23 THR A 79 -4.842 10.752 15.144 1.00 41.25 H new ATOM 1286 N LYS A 80 -2.631 6.621 15.092 1.00 71.11 N ATOM 1287 CA LYS A 80 -1.251 6.218 14.726 1.00 3.32 C ATOM 1288 C LYS A 80 -1.211 5.497 13.355 1.00 15.44 C ATOM 1289 O LYS A 80 -0.262 5.662 12.595 1.00 12.33 O ATOM 1290 CB LYS A 80 -0.619 5.302 15.806 1.00 22.34 C ATOM 1291 CG LYS A 80 0.915 5.152 15.672 1.00 24.14 C ATOM 1292 CD LYS A 80 1.652 6.459 16.038 1.00 15.40 C ATOM 1293 CE LYS A 80 3.162 6.416 15.770 1.00 72.42 C ATOM 1294 NZ LYS A 80 3.803 7.711 16.122 1.00 71.53 N ATOM 0 H LYS A 80 -3.060 6.023 15.799 1.00 71.11 H new ATOM 0 HA LYS A 80 -0.669 7.137 14.658 1.00 3.32 H new ATOM 0 HB2 LYS A 80 -0.851 5.704 16.792 1.00 22.34 H new ATOM 0 HB3 LYS A 80 -1.078 4.315 15.747 1.00 22.34 H new ATOM 0 HG2 LYS A 80 1.260 4.346 16.320 1.00 24.14 H new ATOM 0 HG3 LYS A 80 1.165 4.868 14.650 1.00 24.14 H new ATOM 0 HD2 LYS A 80 1.216 7.282 15.472 1.00 15.40 H new ATOM 0 HD3 LYS A 80 1.486 6.675 17.093 1.00 15.40 H new ATOM 0 HE2 LYS A 80 3.615 5.612 16.350 1.00 72.42 H new ATOM 0 HE3 LYS A 80 3.342 6.191 14.719 1.00 72.42 H new ATOM 0 HZ1 LYS A 80 4.829 7.645 15.964 1.00 71.53 H new ATOM 0 HZ2 LYS A 80 3.409 8.467 15.526 1.00 71.53 H new ATOM 0 HZ3 LYS A 80 3.620 7.928 17.123 1.00 71.53 H new ATOM 1308 N VAL A 81 -2.253 4.699 13.058 1.00 74.24 N ATOM 1309 CA VAL A 81 -2.382 3.987 11.758 1.00 3.15 C ATOM 1310 C VAL A 81 -2.496 5.003 10.592 1.00 1.01 C ATOM 1311 O VAL A 81 -1.987 4.778 9.489 1.00 11.41 O ATOM 1312 CB VAL A 81 -3.634 3.035 11.742 1.00 53.14 C ATOM 1313 CG1 VAL A 81 -3.742 2.262 10.400 1.00 13.22 C ATOM 1314 CG2 VAL A 81 -3.616 2.066 12.949 1.00 13.33 C ATOM 0 H VAL A 81 -3.026 4.526 13.700 1.00 74.24 H new ATOM 0 HA VAL A 81 -1.485 3.381 11.630 1.00 3.15 H new ATOM 0 HB VAL A 81 -4.523 3.660 11.832 1.00 53.14 H new ATOM 0 HG11 VAL A 81 -4.618 1.614 10.423 1.00 13.22 H new ATOM 0 HG12 VAL A 81 -3.837 2.972 9.578 1.00 13.22 H new ATOM 0 HG13 VAL A 81 -2.847 1.657 10.255 1.00 13.22 H new ATOM 0 HG21 VAL A 81 -4.494 1.421 12.911 1.00 13.33 H new ATOM 0 HG22 VAL A 81 -2.714 1.455 12.911 1.00 13.33 H new ATOM 0 HG23 VAL A 81 -3.627 2.639 13.876 1.00 13.33 H new ATOM 1324 N ILE A 82 -3.162 6.125 10.888 1.00 63.12 N ATOM 1325 CA ILE A 82 -3.355 7.246 9.952 1.00 63.44 C ATOM 1326 C ILE A 82 -2.009 7.901 9.548 1.00 64.24 C ATOM 1327 O ILE A 82 -1.713 8.040 8.350 1.00 32.11 O ATOM 1328 CB ILE A 82 -4.322 8.302 10.601 1.00 14.01 C ATOM 1329 CG1 ILE A 82 -5.740 7.667 10.816 1.00 64.44 C ATOM 1330 CG2 ILE A 82 -4.406 9.602 9.765 1.00 21.30 C ATOM 1331 CD1 ILE A 82 -6.673 8.475 11.691 1.00 30.24 C ATOM 0 H ILE A 82 -3.591 6.285 11.800 1.00 63.12 H new ATOM 0 HA ILE A 82 -3.801 6.859 9.036 1.00 63.44 H new ATOM 0 HB ILE A 82 -3.914 8.584 11.572 1.00 14.01 H new ATOM 0 HG12 ILE A 82 -6.210 7.525 9.843 1.00 64.44 H new ATOM 0 HG13 ILE A 82 -5.616 6.678 11.258 1.00 64.44 H new ATOM 0 HG21 ILE A 82 -5.085 10.303 10.250 1.00 21.30 H new ATOM 0 HG22 ILE A 82 -3.415 10.050 9.688 1.00 21.30 H new ATOM 0 HG23 ILE A 82 -4.777 9.369 8.767 1.00 21.30 H new ATOM 0 HD11 ILE A 82 -7.628 7.956 11.781 1.00 30.24 H new ATOM 0 HD12 ILE A 82 -6.231 8.596 12.680 1.00 30.24 H new ATOM 0 HD13 ILE A 82 -6.834 9.456 11.243 1.00 30.24 H new ATOM 1343 N GLU A 83 -1.189 8.258 10.558 1.00 23.12 N ATOM 1344 CA GLU A 83 0.099 8.962 10.338 1.00 41.41 C ATOM 1345 C GLU A 83 1.188 7.997 9.797 1.00 72.40 C ATOM 1346 O GLU A 83 2.063 8.409 9.022 1.00 0.23 O ATOM 1347 CB GLU A 83 0.571 9.660 11.644 1.00 34.54 C ATOM 1348 CG GLU A 83 0.885 8.698 12.803 1.00 60.04 C ATOM 1349 CD GLU A 83 1.256 9.406 14.114 1.00 53.12 C ATOM 1350 OE1 GLU A 83 2.451 9.695 14.324 1.00 3.04 O ATOM 1351 OE2 GLU A 83 0.356 9.651 14.947 1.00 22.22 O ATOM 0 H GLU A 83 -1.394 8.071 11.539 1.00 23.12 H new ATOM 0 HA GLU A 83 -0.064 9.728 9.580 1.00 41.41 H new ATOM 0 HB2 GLU A 83 1.462 10.248 11.425 1.00 34.54 H new ATOM 0 HB3 GLU A 83 -0.201 10.359 11.967 1.00 34.54 H new ATOM 0 HG2 GLU A 83 0.019 8.060 12.978 1.00 60.04 H new ATOM 0 HG3 GLU A 83 1.707 8.045 12.508 1.00 60.04 H new ATOM 1358 N LEU A 84 1.106 6.707 10.193 1.00 72.22 N ATOM 1359 CA LEU A 84 2.005 5.645 9.697 1.00 51.05 C ATOM 1360 C LEU A 84 1.607 5.195 8.272 1.00 3.34 C ATOM 1361 O LEU A 84 2.463 4.769 7.500 1.00 52.34 O ATOM 1362 CB LEU A 84 2.036 4.430 10.683 1.00 65.01 C ATOM 1363 CG LEU A 84 2.811 4.648 12.025 1.00 54.03 C ATOM 1364 CD1 LEU A 84 2.789 3.374 12.897 1.00 61.01 C ATOM 1365 CD2 LEU A 84 4.259 5.127 11.779 1.00 72.25 C ATOM 0 H LEU A 84 0.414 6.375 10.865 1.00 72.22 H new ATOM 0 HA LEU A 84 3.012 6.060 9.644 1.00 51.05 H new ATOM 0 HB2 LEU A 84 1.008 4.156 10.922 1.00 65.01 H new ATOM 0 HB3 LEU A 84 2.480 3.580 10.165 1.00 65.01 H new ATOM 0 HG LEU A 84 2.295 5.438 12.571 1.00 54.03 H new ATOM 0 HD11 LEU A 84 3.335 3.557 13.822 1.00 61.01 H new ATOM 0 HD12 LEU A 84 1.757 3.111 13.131 1.00 61.01 H new ATOM 0 HD13 LEU A 84 3.259 2.554 12.354 1.00 61.01 H new ATOM 0 HD21 LEU A 84 4.763 5.267 12.735 1.00 72.25 H new ATOM 0 HD22 LEU A 84 4.794 4.381 11.192 1.00 72.25 H new ATOM 0 HD23 LEU A 84 4.242 6.072 11.236 1.00 72.25 H new ATOM 1377 N GLY A 85 0.313 5.310 7.926 1.00 11.40 N ATOM 1378 CA GLY A 85 -0.167 4.975 6.581 1.00 10.53 C ATOM 1379 C GLY A 85 0.275 5.985 5.522 1.00 35.04 C ATOM 1380 O GLY A 85 0.896 5.618 4.523 1.00 15.14 O ATOM 0 H GLY A 85 -0.416 5.633 8.562 1.00 11.40 H new ATOM 0 HA2 GLY A 85 0.198 3.985 6.307 1.00 10.53 H new ATOM 0 HA3 GLY A 85 -1.256 4.921 6.592 1.00 10.53 H new ATOM 1384 N THR A 86 -0.034 7.272 5.763 1.00 32.25 N ATOM 1385 CA THR A 86 0.297 8.372 4.818 1.00 63.54 C ATOM 1386 C THR A 86 1.815 8.522 4.556 1.00 62.05 C ATOM 1387 O THR A 86 2.200 8.874 3.453 1.00 72.20 O ATOM 1388 CB THR A 86 -0.295 9.750 5.263 1.00 42.40 C ATOM 1389 OG1 THR A 86 0.048 10.777 4.311 1.00 34.45 O ATOM 1390 CG2 THR A 86 0.181 10.177 6.659 1.00 43.41 C ATOM 0 H THR A 86 -0.515 7.584 6.607 1.00 32.25 H new ATOM 0 HA THR A 86 -0.177 8.075 3.882 1.00 63.54 H new ATOM 0 HB THR A 86 -1.377 9.622 5.305 1.00 42.40 H new ATOM 0 HG1 THR A 86 -0.331 11.633 4.602 1.00 34.45 H new ATOM 0 HG21 THR A 86 -0.261 11.140 6.915 1.00 43.41 H new ATOM 0 HG22 THR A 86 -0.125 9.430 7.392 1.00 43.41 H new ATOM 0 HG23 THR A 86 1.267 10.264 6.662 1.00 43.41 H new ATOM 1398 N LYS A 87 2.669 8.242 5.564 1.00 33.11 N ATOM 1399 CA LYS A 87 4.151 8.299 5.393 1.00 5.23 C ATOM 1400 C LYS A 87 4.696 7.135 4.511 1.00 52.31 C ATOM 1401 O LYS A 87 5.853 7.171 4.076 1.00 35.22 O ATOM 1402 CB LYS A 87 4.882 8.305 6.761 1.00 41.45 C ATOM 1403 CG LYS A 87 4.785 6.981 7.551 1.00 51.35 C ATOM 1404 CD LYS A 87 5.663 6.963 8.823 1.00 32.34 C ATOM 1405 CE LYS A 87 7.169 7.028 8.508 1.00 50.05 C ATOM 1406 NZ LYS A 87 7.996 7.003 9.740 1.00 24.54 N ATOM 0 H LYS A 87 2.368 7.975 6.501 1.00 33.11 H new ATOM 0 HA LYS A 87 4.357 9.236 4.876 1.00 5.23 H new ATOM 0 HB2 LYS A 87 5.934 8.536 6.594 1.00 41.45 H new ATOM 0 HB3 LYS A 87 4.472 9.108 7.373 1.00 41.45 H new ATOM 0 HG2 LYS A 87 3.746 6.809 7.832 1.00 51.35 H new ATOM 0 HG3 LYS A 87 5.080 6.156 6.902 1.00 51.35 H new ATOM 0 HD2 LYS A 87 5.392 7.807 9.458 1.00 32.34 H new ATOM 0 HD3 LYS A 87 5.454 6.056 9.391 1.00 32.34 H new ATOM 0 HE2 LYS A 87 7.443 6.187 7.870 1.00 50.05 H new ATOM 0 HE3 LYS A 87 7.383 7.937 7.946 1.00 50.05 H new ATOM 0 HZ1 LYS A 87 9.003 7.048 9.483 1.00 24.54 H new ATOM 0 HZ2 LYS A 87 7.754 7.819 10.337 1.00 24.54 H new ATOM 0 HZ3 LYS A 87 7.812 6.124 10.264 1.00 24.54 H new ATOM 1420 N HIS A 88 3.868 6.100 4.286 1.00 4.42 N ATOM 1421 CA HIS A 88 4.227 4.948 3.423 1.00 44.30 C ATOM 1422 C HIS A 88 3.844 5.168 1.941 1.00 15.01 C ATOM 1423 O HIS A 88 4.674 4.971 1.041 1.00 2.32 O ATOM 1424 CB HIS A 88 3.594 3.639 3.983 1.00 4.33 C ATOM 1425 CG HIS A 88 4.368 3.074 5.142 1.00 13.10 C ATOM 1426 ND1 HIS A 88 5.742 3.070 5.158 1.00 34.32 N ATOM 1427 CD2 HIS A 88 3.985 2.522 6.313 1.00 4.14 C ATOM 1428 CE1 HIS A 88 6.168 2.548 6.272 1.00 32.41 C ATOM 1429 NE2 HIS A 88 5.129 2.202 6.997 1.00 4.44 N ATOM 0 H HIS A 88 2.935 6.033 4.692 1.00 4.42 H new ATOM 0 HA HIS A 88 5.313 4.853 3.444 1.00 44.30 H new ATOM 0 HB2 HIS A 88 2.570 3.840 4.298 1.00 4.33 H new ATOM 0 HB3 HIS A 88 3.542 2.895 3.188 1.00 4.33 H new ATOM 0 HD2 HIS A 88 2.970 2.363 6.647 1.00 4.14 H new ATOM 0 HE1 HIS A 88 7.203 2.421 6.553 1.00 32.41 H new ATOM 0 HE2 HIS A 88 5.167 1.766 7.918 1.00 4.44 H new ATOM 1438 N PHE A 89 2.588 5.569 1.696 1.00 31.41 N ATOM 1439 CA PHE A 89 2.045 5.726 0.321 1.00 44.41 C ATOM 1440 C PHE A 89 2.368 7.115 -0.268 1.00 55.31 C ATOM 1441 O PHE A 89 2.678 7.237 -1.459 1.00 23.11 O ATOM 1442 CB PHE A 89 0.520 5.463 0.330 1.00 33.33 C ATOM 1443 CG PHE A 89 0.166 4.057 0.815 1.00 54.42 C ATOM 1444 CD1 PHE A 89 -0.017 3.792 2.169 1.00 2.23 C ATOM 1445 CD2 PHE A 89 0.052 2.999 -0.077 1.00 40.13 C ATOM 1446 CE1 PHE A 89 -0.305 2.524 2.614 1.00 50.43 C ATOM 1447 CE2 PHE A 89 -0.235 1.728 0.367 1.00 31.24 C ATOM 1448 CZ PHE A 89 -0.413 1.489 1.712 1.00 14.02 C ATOM 0 H PHE A 89 1.918 5.794 2.432 1.00 31.41 H new ATOM 0 HA PHE A 89 2.528 4.992 -0.324 1.00 44.41 H new ATOM 0 HB2 PHE A 89 0.033 6.197 0.971 1.00 33.33 H new ATOM 0 HB3 PHE A 89 0.125 5.606 -0.676 1.00 33.33 H new ATOM 0 HD1 PHE A 89 0.069 4.598 2.883 1.00 2.23 H new ATOM 0 HD2 PHE A 89 0.190 3.176 -1.133 1.00 40.13 H new ATOM 0 HE1 PHE A 89 -0.446 2.340 3.669 1.00 50.43 H new ATOM 0 HE2 PHE A 89 -0.321 0.917 -0.341 1.00 31.24 H new ATOM 0 HZ PHE A 89 -0.637 0.491 2.059 1.00 14.02 H new ATOM 1458 N LEU A 90 2.274 8.167 0.570 1.00 54.41 N ATOM 1459 CA LEU A 90 2.646 9.539 0.165 1.00 52.12 C ATOM 1460 C LEU A 90 4.101 9.870 0.593 1.00 51.13 C ATOM 1461 O LEU A 90 4.898 10.326 -0.216 1.00 63.41 O ATOM 1462 CB LEU A 90 1.633 10.556 0.762 1.00 25.31 C ATOM 1463 CG LEU A 90 0.134 10.329 0.367 1.00 0.14 C ATOM 1464 CD1 LEU A 90 -0.791 11.417 0.961 1.00 22.44 C ATOM 1465 CD2 LEU A 90 -0.026 10.225 -1.168 1.00 74.00 C ATOM 0 H LEU A 90 1.943 8.093 1.532 1.00 54.41 H new ATOM 0 HA LEU A 90 2.606 9.610 -0.922 1.00 52.12 H new ATOM 0 HB2 LEU A 90 1.712 10.525 1.849 1.00 25.31 H new ATOM 0 HB3 LEU A 90 1.925 11.559 0.449 1.00 25.31 H new ATOM 0 HG LEU A 90 -0.177 9.378 0.800 1.00 0.14 H new ATOM 0 HD11 LEU A 90 -1.821 11.221 0.663 1.00 22.44 H new ATOM 0 HD12 LEU A 90 -0.719 11.402 2.049 1.00 22.44 H new ATOM 0 HD13 LEU A 90 -0.486 12.396 0.591 1.00 22.44 H new ATOM 0 HD21 LEU A 90 -1.076 10.068 -1.415 1.00 74.00 H new ATOM 0 HD22 LEU A 90 0.322 11.147 -1.633 1.00 74.00 H new ATOM 0 HD23 LEU A 90 0.563 9.387 -1.539 1.00 74.00 H new ATOM 1477 N GLY A 91 4.445 9.602 1.863 1.00 23.54 N ATOM 1478 CA GLY A 91 5.761 9.962 2.426 1.00 50.14 C ATOM 1479 C GLY A 91 5.974 11.470 2.577 1.00 4.35 C ATOM 1480 O GLY A 91 7.075 11.975 2.329 1.00 71.12 O ATOM 0 H GLY A 91 3.826 9.134 2.525 1.00 23.54 H new ATOM 0 HA2 GLY A 91 5.870 9.489 3.402 1.00 50.14 H new ATOM 0 HA3 GLY A 91 6.544 9.556 1.785 1.00 50.14 H new ATOM 1484 N ARG A 92 4.922 12.189 3.014 1.00 40.12 N ATOM 1485 CA ARG A 92 4.920 13.678 3.046 1.00 11.12 C ATOM 1486 C ARG A 92 4.446 14.259 4.406 1.00 1.22 C ATOM 1487 O ARG A 92 4.300 15.487 4.515 1.00 44.43 O ATOM 1488 CB ARG A 92 3.987 14.213 1.909 1.00 74.24 C ATOM 1489 CG ARG A 92 2.473 13.979 2.173 1.00 44.15 C ATOM 1490 CD ARG A 92 1.553 14.573 1.092 1.00 31.14 C ATOM 1491 NE ARG A 92 1.801 16.011 0.847 1.00 43.04 N ATOM 1492 CZ ARG A 92 0.882 16.958 0.814 1.00 25.01 C ATOM 1493 NH1 ARG A 92 -0.356 16.711 1.106 1.00 31.14 N ATOM 1494 NH2 ARG A 92 1.217 18.162 0.498 1.00 62.14 N ATOM 0 H ARG A 92 4.057 11.768 3.352 1.00 40.12 H new ATOM 0 HA ARG A 92 5.950 14.003 2.900 1.00 11.12 H new ATOM 0 HB2 ARG A 92 4.162 15.281 1.781 1.00 74.24 H new ATOM 0 HB3 ARG A 92 4.261 13.730 0.971 1.00 74.24 H new ATOM 0 HG2 ARG A 92 2.288 12.907 2.245 1.00 44.15 H new ATOM 0 HG3 ARG A 92 2.211 14.413 3.138 1.00 44.15 H new ATOM 0 HD2 ARG A 92 1.692 14.022 0.162 1.00 31.14 H new ATOM 0 HD3 ARG A 92 0.514 14.435 1.391 1.00 31.14 H new ATOM 0 HE ARG A 92 2.768 16.296 0.690 1.00 43.04 H new ATOM 0 HH11 ARG A 92 -0.639 15.767 1.369 1.00 31.14 H new ATOM 0 HH12 ARG A 92 -1.047 17.460 1.073 1.00 31.14 H new ATOM 0 HH21 ARG A 92 2.188 18.379 0.275 1.00 62.14 H new ATOM 0 HH22 ARG A 92 0.511 18.897 0.471 1.00 62.14 H new ATOM 1508 N ALA A 93 4.252 13.399 5.445 1.00 40.53 N ATOM 1509 CA ALA A 93 3.466 13.748 6.679 1.00 33.44 C ATOM 1510 C ALA A 93 1.964 14.128 6.392 1.00 11.51 C ATOM 1511 O ALA A 93 1.610 14.467 5.258 1.00 50.01 O ATOM 1512 CB ALA A 93 4.187 14.852 7.492 1.00 52.02 C ATOM 0 H ALA A 93 4.629 12.451 5.458 1.00 40.53 H new ATOM 0 HA ALA A 93 3.422 12.840 7.280 1.00 33.44 H new ATOM 0 HB1 ALA A 93 3.602 15.090 8.381 1.00 52.02 H new ATOM 0 HB2 ALA A 93 5.174 14.498 7.791 1.00 52.02 H new ATOM 0 HB3 ALA A 93 4.293 15.746 6.877 1.00 52.02 H new ATOM 1518 N PRO A 94 1.035 14.033 7.414 1.00 0.55 N ATOM 1519 CA PRO A 94 -0.361 14.566 7.281 1.00 25.31 C ATOM 1520 C PRO A 94 -0.423 16.102 7.004 1.00 1.45 C ATOM 1521 O PRO A 94 0.497 16.849 7.377 1.00 61.03 O ATOM 1522 CB PRO A 94 -1.011 14.222 8.650 1.00 34.00 C ATOM 1523 CG PRO A 94 -0.199 13.075 9.175 1.00 24.41 C ATOM 1524 CD PRO A 94 1.222 13.357 8.732 1.00 44.33 C ATOM 0 HA PRO A 94 -0.872 14.126 6.424 1.00 25.31 H new ATOM 0 HB2 PRO A 94 -0.980 15.074 9.329 1.00 34.00 H new ATOM 0 HB3 PRO A 94 -2.059 13.946 8.533 1.00 34.00 H new ATOM 0 HG2 PRO A 94 -0.267 13.009 10.261 1.00 24.41 H new ATOM 0 HG3 PRO A 94 -0.555 12.125 8.775 1.00 24.41 H new ATOM 0 HD2 PRO A 94 1.747 13.996 9.442 1.00 44.33 H new ATOM 0 HD3 PRO A 94 1.804 12.441 8.637 1.00 44.33 H new ATOM 1532 N ILE A 95 -1.506 16.557 6.336 1.00 74.24 N ATOM 1533 CA ILE A 95 -1.754 17.997 6.075 1.00 40.54 C ATOM 1534 C ILE A 95 -2.221 18.730 7.371 1.00 24.40 C ATOM 1535 O ILE A 95 -1.466 19.510 7.964 1.00 1.21 O ATOM 1536 CB ILE A 95 -2.815 18.189 4.915 1.00 22.25 C ATOM 1537 CG1 ILE A 95 -2.380 17.421 3.622 1.00 34.54 C ATOM 1538 CG2 ILE A 95 -3.048 19.691 4.608 1.00 45.24 C ATOM 1539 CD1 ILE A 95 -3.402 17.438 2.488 1.00 42.02 C ATOM 0 H ILE A 95 -2.230 15.943 5.964 1.00 74.24 H new ATOM 0 HA ILE A 95 -0.812 18.442 5.753 1.00 40.54 H new ATOM 0 HB ILE A 95 -3.759 17.767 5.260 1.00 22.25 H new ATOM 0 HG12 ILE A 95 -1.448 17.852 3.257 1.00 34.54 H new ATOM 0 HG13 ILE A 95 -2.170 16.385 3.886 1.00 34.54 H new ATOM 0 HG21 ILE A 95 -3.781 19.789 3.808 1.00 45.24 H new ATOM 0 HG22 ILE A 95 -3.418 20.192 5.503 1.00 45.24 H new ATOM 0 HG23 ILE A 95 -2.109 20.149 4.298 1.00 45.24 H new ATOM 0 HD11 ILE A 95 -3.010 16.881 1.637 1.00 42.02 H new ATOM 0 HD12 ILE A 95 -4.330 16.978 2.827 1.00 42.02 H new ATOM 0 HD13 ILE A 95 -3.596 18.468 2.189 1.00 42.02 H new ATOM 1551 N ASP A 96 -3.476 18.471 7.795 1.00 41.23 N ATOM 1552 CA ASP A 96 -4.072 19.056 9.031 1.00 54.12 C ATOM 1553 C ASP A 96 -4.561 17.926 9.963 1.00 21.55 C ATOM 1554 O ASP A 96 -4.605 16.760 9.553 1.00 45.54 O ATOM 1555 CB ASP A 96 -5.272 19.974 8.665 1.00 53.42 C ATOM 1556 CG ASP A 96 -4.913 21.081 7.662 1.00 31.34 C ATOM 1557 OD1 ASP A 96 -4.073 21.947 7.987 1.00 11.34 O ATOM 1558 OD2 ASP A 96 -5.478 21.101 6.547 1.00 15.14 O ATOM 0 H ASP A 96 -4.112 17.850 7.294 1.00 41.23 H new ATOM 0 HA ASP A 96 -3.310 19.646 9.540 1.00 54.12 H new ATOM 0 HB2 ASP A 96 -6.073 19.363 8.248 1.00 53.42 H new ATOM 0 HB3 ASP A 96 -5.660 20.431 9.575 1.00 53.42 H new ATOM 1563 N GLN A 97 -4.970 18.260 11.214 1.00 40.00 N ATOM 1564 CA GLN A 97 -5.630 17.285 12.109 1.00 41.34 C ATOM 1565 C GLN A 97 -7.040 16.944 11.578 1.00 51.34 C ATOM 1566 O GLN A 97 -7.535 15.849 11.795 1.00 61.41 O ATOM 1567 CB GLN A 97 -5.722 17.842 13.560 1.00 21.42 C ATOM 1568 CG GLN A 97 -6.272 16.837 14.610 1.00 1.41 C ATOM 1569 CD GLN A 97 -5.337 15.655 14.887 1.00 52.52 C ATOM 1570 OE1 GLN A 97 -4.119 15.778 14.827 1.00 55.32 O ATOM 1571 NE2 GLN A 97 -5.899 14.501 15.191 1.00 41.53 N ATOM 0 H GLN A 97 -4.854 19.189 11.619 1.00 40.00 H new ATOM 0 HA GLN A 97 -5.030 16.375 12.128 1.00 41.34 H new ATOM 0 HB2 GLN A 97 -4.730 18.166 13.873 1.00 21.42 H new ATOM 0 HB3 GLN A 97 -6.360 18.726 13.555 1.00 21.42 H new ATOM 0 HG2 GLN A 97 -6.458 17.368 15.544 1.00 1.41 H new ATOM 0 HG3 GLN A 97 -7.232 16.455 14.264 1.00 1.41 H new ATOM 0 HE21 GLN A 97 -6.915 14.424 15.235 1.00 41.53 H new ATOM 0 HE22 GLN A 97 -5.317 13.685 15.383 1.00 41.53 H new ATOM 1580 N ALA A 98 -7.678 17.909 10.884 1.00 23.52 N ATOM 1581 CA ALA A 98 -8.969 17.687 10.188 1.00 41.43 C ATOM 1582 C ALA A 98 -8.865 16.570 9.113 1.00 35.34 C ATOM 1583 O ALA A 98 -9.843 15.869 8.854 1.00 11.21 O ATOM 1584 CB ALA A 98 -9.469 18.998 9.566 1.00 4.21 C ATOM 0 H ALA A 98 -7.319 18.859 10.789 1.00 23.52 H new ATOM 0 HA ALA A 98 -9.692 17.350 10.931 1.00 41.43 H new ATOM 0 HB1 ALA A 98 -10.417 18.821 9.058 1.00 4.21 H new ATOM 0 HB2 ALA A 98 -9.610 19.742 10.350 1.00 4.21 H new ATOM 0 HB3 ALA A 98 -8.735 19.363 8.847 1.00 4.21 H new ATOM 1590 N GLU A 99 -7.668 16.423 8.501 1.00 12.13 N ATOM 1591 CA GLU A 99 -7.366 15.314 7.561 1.00 33.22 C ATOM 1592 C GLU A 99 -7.225 13.961 8.314 1.00 15.15 C ATOM 1593 O GLU A 99 -7.658 12.915 7.823 1.00 12.22 O ATOM 1594 CB GLU A 99 -6.064 15.593 6.763 1.00 2.41 C ATOM 1595 CG GLU A 99 -5.758 14.512 5.695 1.00 62.33 C ATOM 1596 CD GLU A 99 -4.290 14.421 5.258 1.00 31.05 C ATOM 1597 OE1 GLU A 99 -3.429 14.235 6.135 1.00 13.04 O ATOM 1598 OE2 GLU A 99 -4.002 14.493 4.046 1.00 1.24 O ATOM 0 H GLU A 99 -6.887 17.064 8.642 1.00 12.13 H new ATOM 0 HA GLU A 99 -8.203 15.249 6.866 1.00 33.22 H new ATOM 0 HB2 GLU A 99 -6.146 16.564 6.274 1.00 2.41 H new ATOM 0 HB3 GLU A 99 -5.226 15.655 7.458 1.00 2.41 H new ATOM 0 HG2 GLU A 99 -6.065 13.542 6.085 1.00 62.33 H new ATOM 0 HG3 GLU A 99 -6.370 14.710 4.815 1.00 62.33 H new ATOM 1605 N ILE A 100 -6.590 14.003 9.494 1.00 52.51 N ATOM 1606 CA ILE A 100 -6.410 12.815 10.362 1.00 33.21 C ATOM 1607 C ILE A 100 -7.788 12.284 10.855 1.00 53.54 C ATOM 1608 O ILE A 100 -8.104 11.107 10.689 1.00 61.53 O ATOM 1609 CB ILE A 100 -5.457 13.164 11.570 1.00 25.50 C ATOM 1610 CG1 ILE A 100 -4.059 13.630 11.029 1.00 73.11 C ATOM 1611 CG2 ILE A 100 -5.304 11.977 12.555 1.00 64.23 C ATOM 1612 CD1 ILE A 100 -3.073 14.099 12.089 1.00 22.14 C ATOM 0 H ILE A 100 -6.185 14.856 9.879 1.00 52.51 H new ATOM 0 HA ILE A 100 -5.941 12.020 9.783 1.00 33.21 H new ATOM 0 HB ILE A 100 -5.912 13.980 12.131 1.00 25.50 H new ATOM 0 HG12 ILE A 100 -3.608 12.805 10.477 1.00 73.11 H new ATOM 0 HG13 ILE A 100 -4.215 14.441 10.318 1.00 73.11 H new ATOM 0 HG21 ILE A 100 -4.639 12.264 13.370 1.00 64.23 H new ATOM 0 HG22 ILE A 100 -6.281 11.712 12.960 1.00 64.23 H new ATOM 0 HG23 ILE A 100 -4.884 11.120 12.029 1.00 64.23 H new ATOM 0 HD11 ILE A 100 -2.140 14.399 11.611 1.00 22.14 H new ATOM 0 HD12 ILE A 100 -3.494 14.948 12.627 1.00 22.14 H new ATOM 0 HD13 ILE A 100 -2.878 13.287 12.789 1.00 22.14 H new ATOM 1624 N ARG A 101 -8.601 13.186 11.432 1.00 44.24 N ATOM 1625 CA ARG A 101 -10.014 12.916 11.805 1.00 62.24 C ATOM 1626 C ARG A 101 -10.844 12.398 10.597 1.00 2.21 C ATOM 1627 O ARG A 101 -11.666 11.491 10.746 1.00 5.50 O ATOM 1628 CB ARG A 101 -10.654 14.206 12.381 1.00 51.12 C ATOM 1629 CG ARG A 101 -9.993 14.729 13.681 1.00 65.43 C ATOM 1630 CD ARG A 101 -10.548 16.102 14.118 1.00 4.10 C ATOM 1631 NE ARG A 101 -12.010 16.070 14.347 1.00 23.04 N ATOM 1632 CZ ARG A 101 -12.910 16.843 13.762 1.00 2.12 C ATOM 1633 NH1 ARG A 101 -12.570 17.745 12.889 1.00 44.12 N ATOM 1634 NH2 ARG A 101 -14.156 16.706 14.071 1.00 73.13 N ATOM 0 H ARG A 101 -8.300 14.134 11.658 1.00 44.24 H new ATOM 0 HA ARG A 101 -10.019 12.132 12.562 1.00 62.24 H new ATOM 0 HB2 ARG A 101 -10.606 14.989 11.624 1.00 51.12 H new ATOM 0 HB3 ARG A 101 -11.709 14.016 12.577 1.00 51.12 H new ATOM 0 HG2 ARG A 101 -10.151 14.006 14.481 1.00 65.43 H new ATOM 0 HG3 ARG A 101 -8.916 14.808 13.531 1.00 65.43 H new ATOM 0 HD2 ARG A 101 -10.046 16.420 15.032 1.00 4.10 H new ATOM 0 HD3 ARG A 101 -10.318 16.844 13.353 1.00 4.10 H new ATOM 0 HE ARG A 101 -12.357 15.387 15.020 1.00 23.04 H new ATOM 0 HH11 ARG A 101 -11.589 17.870 12.640 1.00 44.12 H new ATOM 0 HH12 ARG A 101 -13.285 18.328 12.453 1.00 44.12 H new ATOM 0 HH21 ARG A 101 -14.437 16.008 14.759 1.00 73.13 H new ATOM 0 HH22 ARG A 101 -14.859 17.296 13.627 1.00 73.13 H new ATOM 1648 N LYS A 102 -10.601 12.986 9.404 1.00 64.03 N ATOM 1649 CA LYS A 102 -11.213 12.534 8.125 1.00 60.22 C ATOM 1650 C LYS A 102 -10.891 11.045 7.847 1.00 42.42 C ATOM 1651 O LYS A 102 -11.780 10.270 7.496 1.00 63.11 O ATOM 1652 CB LYS A 102 -10.704 13.411 6.952 1.00 1.11 C ATOM 1653 CG LYS A 102 -11.218 13.019 5.542 1.00 20.42 C ATOM 1654 CD LYS A 102 -10.452 13.746 4.408 1.00 45.51 C ATOM 1655 CE LYS A 102 -8.957 13.363 4.364 1.00 33.51 C ATOM 1656 NZ LYS A 102 -8.226 14.065 3.281 1.00 22.12 N ATOM 0 H LYS A 102 -9.977 13.786 9.296 1.00 64.03 H new ATOM 0 HA LYS A 102 -12.294 12.639 8.212 1.00 60.22 H new ATOM 0 HB2 LYS A 102 -10.988 14.445 7.147 1.00 1.11 H new ATOM 0 HB3 LYS A 102 -9.615 13.376 6.943 1.00 1.11 H new ATOM 0 HG2 LYS A 102 -11.120 11.942 5.410 1.00 20.42 H new ATOM 0 HG3 LYS A 102 -12.280 13.254 5.468 1.00 20.42 H new ATOM 0 HD2 LYS A 102 -10.914 13.506 3.450 1.00 45.51 H new ATOM 0 HD3 LYS A 102 -10.544 14.823 4.545 1.00 45.51 H new ATOM 0 HE2 LYS A 102 -8.496 13.599 5.323 1.00 33.51 H new ATOM 0 HE3 LYS A 102 -8.864 12.286 4.223 1.00 33.51 H new ATOM 0 HZ1 LYS A 102 -7.282 13.643 3.170 1.00 22.12 H new ATOM 0 HZ2 LYS A 102 -8.754 13.973 2.390 1.00 22.12 H new ATOM 0 HZ3 LYS A 102 -8.129 15.072 3.523 1.00 22.12 H new ATOM 1670 N TYR A 103 -9.613 10.655 8.034 1.00 31.45 N ATOM 1671 CA TYR A 103 -9.165 9.259 7.836 1.00 1.22 C ATOM 1672 C TYR A 103 -9.755 8.305 8.905 1.00 53.42 C ATOM 1673 O TYR A 103 -10.078 7.165 8.592 1.00 14.21 O ATOM 1674 CB TYR A 103 -7.617 9.159 7.811 1.00 20.12 C ATOM 1675 CG TYR A 103 -6.945 9.749 6.554 1.00 4.23 C ATOM 1676 CD1 TYR A 103 -7.451 9.492 5.276 1.00 22.12 C ATOM 1677 CD2 TYR A 103 -5.798 10.539 6.639 1.00 53.33 C ATOM 1678 CE1 TYR A 103 -6.846 10.008 4.146 1.00 75.10 C ATOM 1679 CE2 TYR A 103 -5.190 11.049 5.511 1.00 42.42 C ATOM 1680 CZ TYR A 103 -5.719 10.787 4.267 1.00 32.43 C ATOM 1681 OH TYR A 103 -5.119 11.306 3.134 1.00 71.41 O ATOM 0 H TYR A 103 -8.869 11.290 8.323 1.00 31.45 H new ATOM 0 HA TYR A 103 -9.543 8.942 6.864 1.00 1.22 H new ATOM 0 HB2 TYR A 103 -7.221 9.669 8.689 1.00 20.12 H new ATOM 0 HB3 TYR A 103 -7.334 8.110 7.897 1.00 20.12 H new ATOM 0 HD1 TYR A 103 -8.333 8.878 5.170 1.00 22.12 H new ATOM 0 HD2 TYR A 103 -5.377 10.756 7.610 1.00 53.33 H new ATOM 0 HE1 TYR A 103 -7.257 9.800 3.169 1.00 75.10 H new ATOM 0 HE2 TYR A 103 -4.300 11.653 5.603 1.00 42.42 H new ATOM 0 HH TYR A 103 -4.335 11.834 3.392 1.00 71.41 H new ATOM 1691 N ASN A 104 -9.917 8.778 10.157 1.00 32.31 N ATOM 1692 CA ASN A 104 -10.554 7.986 11.244 1.00 74.13 C ATOM 1693 C ASN A 104 -12.067 7.760 10.956 1.00 13.21 C ATOM 1694 O ASN A 104 -12.635 6.718 11.307 1.00 22.53 O ATOM 1695 CB ASN A 104 -10.325 8.714 12.600 1.00 32.44 C ATOM 1696 CG ASN A 104 -10.945 8.020 13.816 1.00 54.22 C ATOM 1697 OD1 ASN A 104 -11.128 6.809 13.855 1.00 1.23 O ATOM 1698 ND2 ASN A 104 -11.261 8.787 14.835 1.00 45.33 N ATOM 0 H ASN A 104 -9.616 9.708 10.447 1.00 32.31 H new ATOM 0 HA ASN A 104 -10.096 6.998 11.295 1.00 74.13 H new ATOM 0 HB2 ASN A 104 -9.252 8.815 12.765 1.00 32.44 H new ATOM 0 HB3 ASN A 104 -10.733 9.722 12.528 1.00 32.44 H new ATOM 0 HD21 ASN A 104 -11.666 8.376 15.676 1.00 45.33 H new ATOM 0 HD22 ASN A 104 -11.102 9.793 14.785 1.00 45.33 H new ATOM 1705 N GLN A 105 -12.697 8.754 10.295 1.00 0.44 N ATOM 1706 CA GLN A 105 -14.090 8.658 9.788 1.00 12.32 C ATOM 1707 C GLN A 105 -14.193 7.565 8.690 1.00 62.05 C ATOM 1708 O GLN A 105 -15.146 6.785 8.663 1.00 52.24 O ATOM 1709 CB GLN A 105 -14.533 10.043 9.224 1.00 13.04 C ATOM 1710 CG GLN A 105 -15.982 10.132 8.683 1.00 55.42 C ATOM 1711 CD GLN A 105 -17.071 9.969 9.753 1.00 54.30 C ATOM 1712 OE1 GLN A 105 -16.881 10.304 10.917 1.00 61.32 O ATOM 1713 NE2 GLN A 105 -18.228 9.476 9.364 1.00 15.45 N ATOM 0 H GLN A 105 -12.255 9.651 10.095 1.00 0.44 H new ATOM 0 HA GLN A 105 -14.752 8.378 10.608 1.00 12.32 H new ATOM 0 HB2 GLN A 105 -14.416 10.787 10.012 1.00 13.04 H new ATOM 0 HB3 GLN A 105 -13.850 10.320 8.421 1.00 13.04 H new ATOM 0 HG2 GLN A 105 -16.114 11.096 8.191 1.00 55.42 H new ATOM 0 HG3 GLN A 105 -16.120 9.364 7.922 1.00 55.42 H new ATOM 0 HE21 GLN A 105 -18.365 9.204 8.391 1.00 15.45 H new ATOM 0 HE22 GLN A 105 -18.988 9.367 10.036 1.00 15.45 H new ATOM 1722 N ILE A 106 -13.168 7.519 7.815 1.00 64.13 N ATOM 1723 CA ILE A 106 -13.042 6.518 6.729 1.00 44.25 C ATOM 1724 C ILE A 106 -12.928 5.073 7.295 1.00 64.02 C ATOM 1725 O ILE A 106 -13.608 4.152 6.819 1.00 32.40 O ATOM 1726 CB ILE A 106 -11.794 6.857 5.819 1.00 32.01 C ATOM 1727 CG1 ILE A 106 -12.010 8.219 5.076 1.00 4.24 C ATOM 1728 CG2 ILE A 106 -11.469 5.725 4.822 1.00 71.31 C ATOM 1729 CD1 ILE A 106 -10.832 8.693 4.235 1.00 54.51 C ATOM 0 H ILE A 106 -12.394 8.183 7.841 1.00 64.13 H new ATOM 0 HA ILE A 106 -13.947 6.563 6.123 1.00 44.25 H new ATOM 0 HB ILE A 106 -10.930 6.952 6.476 1.00 32.01 H new ATOM 0 HG12 ILE A 106 -12.883 8.128 4.430 1.00 4.24 H new ATOM 0 HG13 ILE A 106 -12.239 8.986 5.816 1.00 4.24 H new ATOM 0 HG21 ILE A 106 -10.605 6.007 4.221 1.00 71.31 H new ATOM 0 HG22 ILE A 106 -11.247 4.810 5.371 1.00 71.31 H new ATOM 0 HG23 ILE A 106 -12.326 5.558 4.169 1.00 71.31 H new ATOM 0 HD11 ILE A 106 -11.081 9.643 3.762 1.00 54.51 H new ATOM 0 HD12 ILE A 106 -9.958 8.823 4.873 1.00 54.51 H new ATOM 0 HD13 ILE A 106 -10.612 7.952 3.466 1.00 54.51 H new ATOM 1741 N LEU A 107 -12.067 4.903 8.320 1.00 53.31 N ATOM 1742 CA LEU A 107 -11.890 3.610 9.027 1.00 44.35 C ATOM 1743 C LEU A 107 -13.209 3.141 9.707 1.00 61.43 C ATOM 1744 O LEU A 107 -13.572 1.964 9.628 1.00 74.23 O ATOM 1745 CB LEU A 107 -10.731 3.710 10.084 1.00 25.41 C ATOM 1746 CG LEU A 107 -9.280 3.362 9.600 1.00 10.40 C ATOM 1747 CD1 LEU A 107 -9.194 1.934 9.038 1.00 4.23 C ATOM 1748 CD2 LEU A 107 -8.744 4.392 8.596 1.00 63.32 C ATOM 0 H LEU A 107 -11.476 5.652 8.682 1.00 53.31 H new ATOM 0 HA LEU A 107 -11.620 2.863 8.281 1.00 44.35 H new ATOM 0 HB2 LEU A 107 -10.720 4.727 10.477 1.00 25.41 H new ATOM 0 HB3 LEU A 107 -10.976 3.050 10.916 1.00 25.41 H new ATOM 0 HG LEU A 107 -8.637 3.407 10.479 1.00 10.40 H new ATOM 0 HD11 LEU A 107 -8.173 1.732 8.714 1.00 4.23 H new ATOM 0 HD12 LEU A 107 -9.477 1.221 9.812 1.00 4.23 H new ATOM 0 HD13 LEU A 107 -9.871 1.836 8.189 1.00 4.23 H new ATOM 0 HD21 LEU A 107 -7.737 4.110 8.289 1.00 63.32 H new ATOM 0 HD22 LEU A 107 -9.395 4.422 7.722 1.00 63.32 H new ATOM 0 HD23 LEU A 107 -8.719 5.376 9.063 1.00 63.32 H new ATOM 1760 N ALA A 108 -13.923 4.083 10.351 1.00 32.31 N ATOM 1761 CA ALA A 108 -15.169 3.788 11.100 1.00 74.30 C ATOM 1762 C ALA A 108 -16.340 3.368 10.174 1.00 14.40 C ATOM 1763 O ALA A 108 -17.062 2.412 10.472 1.00 12.21 O ATOM 1764 CB ALA A 108 -15.571 5.008 11.943 1.00 53.33 C ATOM 0 H ALA A 108 -13.658 5.068 10.370 1.00 32.31 H new ATOM 0 HA ALA A 108 -14.961 2.939 11.751 1.00 74.30 H new ATOM 0 HB1 ALA A 108 -16.487 4.786 12.491 1.00 53.33 H new ATOM 0 HB2 ALA A 108 -14.774 5.242 12.648 1.00 53.33 H new ATOM 0 HB3 ALA A 108 -15.738 5.863 11.288 1.00 53.33 H new ATOM 1770 N THR A 109 -16.518 4.102 9.061 1.00 73.40 N ATOM 1771 CA THR A 109 -17.635 3.877 8.104 1.00 21.33 C ATOM 1772 C THR A 109 -17.459 2.583 7.256 1.00 61.11 C ATOM 1773 O THR A 109 -18.367 1.744 7.205 1.00 61.20 O ATOM 1774 CB THR A 109 -17.824 5.108 7.149 1.00 71.23 C ATOM 1775 OG1 THR A 109 -16.584 5.406 6.491 1.00 23.21 O ATOM 1776 CG2 THR A 109 -18.316 6.364 7.898 1.00 11.23 C ATOM 0 H THR A 109 -15.898 4.867 8.793 1.00 73.40 H new ATOM 0 HA THR A 109 -18.528 3.751 8.717 1.00 21.33 H new ATOM 0 HB THR A 109 -18.587 4.836 6.420 1.00 71.23 H new ATOM 0 HG1 THR A 109 -16.003 5.907 7.100 1.00 23.21 H new ATOM 0 HG21 THR A 109 -18.431 7.187 7.192 1.00 11.23 H new ATOM 0 HG22 THR A 109 -19.276 6.154 8.369 1.00 11.23 H new ATOM 0 HG23 THR A 109 -17.589 6.640 8.662 1.00 11.23 H new ATOM 1784 N GLN A 110 -16.288 2.413 6.606 1.00 22.45 N ATOM 1785 CA GLN A 110 -16.033 1.238 5.716 1.00 74.22 C ATOM 1786 C GLN A 110 -14.771 0.438 6.121 1.00 63.34 C ATOM 1787 O GLN A 110 -14.825 -0.797 6.188 1.00 53.04 O ATOM 1788 CB GLN A 110 -15.990 1.638 4.210 1.00 2.53 C ATOM 1789 CG GLN A 110 -14.991 2.752 3.824 1.00 12.40 C ATOM 1790 CD GLN A 110 -15.575 4.171 3.841 1.00 74.11 C ATOM 1791 OE1 GLN A 110 -14.750 5.156 4.112 1.00 64.03 O flip ATOM 1792 NE2 GLN A 110 -16.756 4.384 3.602 1.00 34.31 N flip ATOM 0 H GLN A 110 -15.505 3.063 6.673 1.00 22.45 H new ATOM 0 HA GLN A 110 -16.885 0.572 5.855 1.00 74.22 H new ATOM 0 HB2 GLN A 110 -15.752 0.748 3.627 1.00 2.53 H new ATOM 0 HB3 GLN A 110 -16.989 1.957 3.912 1.00 2.53 H new ATOM 0 HG2 GLN A 110 -14.143 2.714 4.508 1.00 12.40 H new ATOM 0 HG3 GLN A 110 -14.604 2.545 2.826 1.00 12.40 H new ATOM 0 HE21 GLN A 110 -17.382 3.606 3.393 1.00 34.31 H new ATOM 0 HE22 GLN A 110 -17.114 5.339 3.611 1.00 34.31 H new ATOM 1801 N GLY A 111 -13.636 1.119 6.386 1.00 25.23 N ATOM 1802 CA GLY A 111 -12.415 0.426 6.849 1.00 52.51 C ATOM 1803 C GLY A 111 -11.120 0.826 6.133 1.00 14.12 C ATOM 1804 O GLY A 111 -10.993 1.946 5.616 1.00 70.44 O ATOM 0 H GLY A 111 -13.539 2.130 6.290 1.00 25.23 H new ATOM 0 HA2 GLY A 111 -12.293 0.614 7.916 1.00 52.51 H new ATOM 0 HA3 GLY A 111 -12.560 -0.648 6.729 1.00 52.51 H new ATOM 1808 N ILE A 112 -10.151 -0.125 6.116 1.00 23.22 N ATOM 1809 CA ILE A 112 -8.754 0.120 5.688 1.00 42.43 C ATOM 1810 C ILE A 112 -8.626 0.353 4.157 1.00 21.44 C ATOM 1811 O ILE A 112 -7.826 1.174 3.733 1.00 43.33 O ATOM 1812 CB ILE A 112 -7.800 -1.061 6.144 1.00 22.54 C ATOM 1813 CG1 ILE A 112 -6.287 -0.719 5.890 1.00 42.24 C ATOM 1814 CG2 ILE A 112 -8.187 -2.408 5.477 1.00 50.13 C ATOM 1815 CD1 ILE A 112 -5.730 0.393 6.767 1.00 51.42 C ATOM 0 H ILE A 112 -10.321 -1.089 6.401 1.00 23.22 H new ATOM 0 HA ILE A 112 -8.441 1.040 6.182 1.00 42.43 H new ATOM 0 HB ILE A 112 -7.936 -1.177 7.219 1.00 22.54 H new ATOM 0 HG12 ILE A 112 -5.694 -1.620 6.048 1.00 42.24 H new ATOM 0 HG13 ILE A 112 -6.163 -0.435 4.845 1.00 42.24 H new ATOM 0 HG21 ILE A 112 -7.508 -3.190 5.817 1.00 50.13 H new ATOM 0 HG22 ILE A 112 -9.209 -2.670 5.752 1.00 50.13 H new ATOM 0 HG23 ILE A 112 -8.116 -2.311 4.394 1.00 50.13 H new ATOM 0 HD11 ILE A 112 -4.681 0.559 6.521 1.00 51.42 H new ATOM 0 HD12 ILE A 112 -6.293 1.310 6.593 1.00 51.42 H new ATOM 0 HD13 ILE A 112 -5.816 0.107 7.815 1.00 51.42 H new ATOM 1827 N ARG A 113 -9.442 -0.346 3.344 1.00 50.45 N ATOM 1828 CA ARG A 113 -9.328 -0.305 1.862 1.00 42.22 C ATOM 1829 C ARG A 113 -9.548 1.117 1.292 1.00 70.45 C ATOM 1830 O ARG A 113 -8.803 1.562 0.421 1.00 73.52 O ATOM 1831 CB ARG A 113 -10.313 -1.300 1.200 1.00 3.41 C ATOM 1832 CG ARG A 113 -10.055 -2.790 1.522 1.00 71.53 C ATOM 1833 CD ARG A 113 -11.102 -3.716 0.864 1.00 70.41 C ATOM 1834 NE ARG A 113 -12.481 -3.376 1.272 1.00 34.21 N ATOM 1835 CZ ARG A 113 -13.583 -3.934 0.806 1.00 63.34 C ATOM 1836 NH1 ARG A 113 -13.552 -4.893 -0.071 1.00 64.12 N ATOM 1837 NH2 ARG A 113 -14.725 -3.516 1.235 1.00 32.31 N ATOM 0 H ARG A 113 -10.191 -0.949 3.684 1.00 50.45 H new ATOM 0 HA ARG A 113 -8.307 -0.602 1.622 1.00 42.22 H new ATOM 0 HB2 ARG A 113 -11.326 -1.047 1.513 1.00 3.41 H new ATOM 0 HB3 ARG A 113 -10.270 -1.165 0.119 1.00 3.41 H new ATOM 0 HG2 ARG A 113 -9.059 -3.068 1.178 1.00 71.53 H new ATOM 0 HG3 ARG A 113 -10.071 -2.935 2.602 1.00 71.53 H new ATOM 0 HD2 ARG A 113 -11.017 -3.645 -0.220 1.00 70.41 H new ATOM 0 HD3 ARG A 113 -10.890 -4.751 1.133 1.00 70.41 H new ATOM 0 HE ARG A 113 -12.591 -2.646 1.976 1.00 34.21 H new ATOM 0 HH11 ARG A 113 -12.657 -5.236 -0.420 1.00 64.12 H new ATOM 0 HH12 ARG A 113 -14.423 -5.302 -0.410 1.00 64.12 H new ATOM 0 HH21 ARG A 113 -14.767 -2.765 1.924 1.00 32.31 H new ATOM 0 HH22 ARG A 113 -15.586 -3.936 0.885 1.00 32.31 H new ATOM 1851 N ALA A 114 -10.575 1.809 1.802 1.00 52.33 N ATOM 1852 CA ALA A 114 -10.877 3.211 1.417 1.00 61.13 C ATOM 1853 C ALA A 114 -9.821 4.207 1.952 1.00 32.53 C ATOM 1854 O ALA A 114 -9.595 5.255 1.347 1.00 43.45 O ATOM 1855 CB ALA A 114 -12.273 3.598 1.896 1.00 43.23 C ATOM 0 H ALA A 114 -11.222 1.424 2.490 1.00 52.33 H new ATOM 0 HA ALA A 114 -10.843 3.266 0.329 1.00 61.13 H new ATOM 0 HB1 ALA A 114 -12.484 4.628 1.608 1.00 43.23 H new ATOM 0 HB2 ALA A 114 -13.010 2.936 1.441 1.00 43.23 H new ATOM 0 HB3 ALA A 114 -12.324 3.507 2.981 1.00 43.23 H new ATOM 1861 N PHE A 115 -9.197 3.871 3.104 1.00 55.42 N ATOM 1862 CA PHE A 115 -8.073 4.653 3.680 1.00 11.43 C ATOM 1863 C PHE A 115 -6.837 4.601 2.750 1.00 24.30 C ATOM 1864 O PHE A 115 -6.235 5.633 2.442 1.00 25.01 O ATOM 1865 CB PHE A 115 -7.735 4.113 5.099 1.00 74.22 C ATOM 1866 CG PHE A 115 -6.431 4.638 5.716 1.00 35.14 C ATOM 1867 CD1 PHE A 115 -6.343 5.931 6.226 1.00 31.23 C ATOM 1868 CD2 PHE A 115 -5.293 3.829 5.777 1.00 21.43 C ATOM 1869 CE1 PHE A 115 -5.159 6.395 6.774 1.00 30.34 C ATOM 1870 CE2 PHE A 115 -4.115 4.290 6.325 1.00 62.20 C ATOM 1871 CZ PHE A 115 -4.047 5.574 6.824 1.00 72.11 C ATOM 0 H PHE A 115 -9.455 3.055 3.660 1.00 55.42 H new ATOM 0 HA PHE A 115 -8.372 5.698 3.768 1.00 11.43 H new ATOM 0 HB2 PHE A 115 -8.558 4.362 5.768 1.00 74.22 H new ATOM 0 HB3 PHE A 115 -7.681 3.025 5.051 1.00 74.22 H new ATOM 0 HD1 PHE A 115 -7.207 6.578 6.194 1.00 31.23 H new ATOM 0 HD2 PHE A 115 -5.337 2.823 5.387 1.00 21.43 H new ATOM 0 HE1 PHE A 115 -5.104 7.401 7.163 1.00 30.34 H new ATOM 0 HE2 PHE A 115 -3.248 3.647 6.363 1.00 62.20 H new ATOM 0 HZ PHE A 115 -3.126 5.938 7.254 1.00 72.11 H new ATOM 1881 N ILE A 116 -6.488 3.381 2.309 1.00 32.53 N ATOM 1882 CA ILE A 116 -5.368 3.139 1.377 1.00 1.11 C ATOM 1883 C ILE A 116 -5.661 3.806 0.012 1.00 2.10 C ATOM 1884 O ILE A 116 -4.815 4.497 -0.536 1.00 63.24 O ATOM 1885 CB ILE A 116 -5.105 1.594 1.181 1.00 24.21 C ATOM 1886 CG1 ILE A 116 -4.876 0.873 2.554 1.00 53.11 C ATOM 1887 CG2 ILE A 116 -3.922 1.333 0.219 1.00 3.23 C ATOM 1888 CD1 ILE A 116 -3.716 1.399 3.384 1.00 0.22 C ATOM 0 H ILE A 116 -6.975 2.530 2.589 1.00 32.53 H new ATOM 0 HA ILE A 116 -4.469 3.580 1.809 1.00 1.11 H new ATOM 0 HB ILE A 116 -6.001 1.173 0.726 1.00 24.21 H new ATOM 0 HG12 ILE A 116 -5.789 0.955 3.144 1.00 53.11 H new ATOM 0 HG13 ILE A 116 -4.713 -0.188 2.365 1.00 53.11 H new ATOM 0 HG21 ILE A 116 -3.772 0.259 0.110 1.00 3.23 H new ATOM 0 HG22 ILE A 116 -4.142 1.770 -0.755 1.00 3.23 H new ATOM 0 HG23 ILE A 116 -3.017 1.786 0.624 1.00 3.23 H new ATOM 0 HD11 ILE A 116 -3.646 0.832 4.312 1.00 0.22 H new ATOM 0 HD12 ILE A 116 -2.788 1.291 2.822 1.00 0.22 H new ATOM 0 HD13 ILE A 116 -3.881 2.452 3.614 1.00 0.22 H new ATOM 1900 N ASN A 117 -6.896 3.617 -0.486 1.00 52.54 N ATOM 1901 CA ASN A 117 -7.388 4.229 -1.745 1.00 53.30 C ATOM 1902 C ASN A 117 -7.324 5.781 -1.692 1.00 33.33 C ATOM 1903 O ASN A 117 -7.024 6.429 -2.692 1.00 44.51 O ATOM 1904 CB ASN A 117 -8.841 3.752 -2.021 1.00 52.10 C ATOM 1905 CG ASN A 117 -9.369 4.152 -3.404 1.00 23.43 C ATOM 1906 OD1 ASN A 117 -9.258 3.406 -4.365 1.00 70.40 O ATOM 1907 ND2 ASN A 117 -9.934 5.339 -3.523 1.00 53.41 N ATOM 0 H ASN A 117 -7.592 3.030 -0.025 1.00 52.54 H new ATOM 0 HA ASN A 117 -6.739 3.907 -2.559 1.00 53.30 H new ATOM 0 HB2 ASN A 117 -8.882 2.667 -1.926 1.00 52.10 H new ATOM 0 HB3 ASN A 117 -9.500 4.164 -1.257 1.00 52.10 H new ATOM 0 HD21 ASN A 117 -10.287 5.647 -4.429 1.00 53.41 H new ATOM 0 HD22 ASN A 117 -10.018 5.948 -2.709 1.00 53.41 H new ATOM 1914 N ALA A 118 -7.599 6.357 -0.505 1.00 11.04 N ATOM 1915 CA ALA A 118 -7.528 7.823 -0.271 1.00 25.31 C ATOM 1916 C ALA A 118 -6.076 8.364 -0.382 1.00 33.25 C ATOM 1917 O ALA A 118 -5.869 9.531 -0.716 1.00 42.31 O ATOM 1918 CB ALA A 118 -8.125 8.167 1.104 1.00 50.40 C ATOM 0 H ALA A 118 -7.876 5.825 0.320 1.00 11.04 H new ATOM 0 HA ALA A 118 -8.113 8.309 -1.051 1.00 25.31 H new ATOM 0 HB1 ALA A 118 -8.068 9.243 1.266 1.00 50.40 H new ATOM 0 HB2 ALA A 118 -9.167 7.849 1.138 1.00 50.40 H new ATOM 0 HB3 ALA A 118 -7.563 7.653 1.884 1.00 50.40 H new ATOM 1924 N LEU A 119 -5.091 7.502 -0.069 1.00 11.03 N ATOM 1925 CA LEU A 119 -3.645 7.827 -0.168 1.00 33.44 C ATOM 1926 C LEU A 119 -3.079 7.573 -1.593 1.00 33.53 C ATOM 1927 O LEU A 119 -2.331 8.385 -2.131 1.00 42.23 O ATOM 1928 CB LEU A 119 -2.866 6.975 0.866 1.00 42.44 C ATOM 1929 CG LEU A 119 -3.323 7.127 2.352 1.00 3.52 C ATOM 1930 CD1 LEU A 119 -2.629 6.096 3.263 1.00 42.45 C ATOM 1931 CD2 LEU A 119 -3.097 8.569 2.860 1.00 1.35 C ATOM 0 H LEU A 119 -5.271 6.554 0.262 1.00 11.03 H new ATOM 0 HA LEU A 119 -3.523 8.890 0.041 1.00 33.44 H new ATOM 0 HB2 LEU A 119 -2.953 5.926 0.584 1.00 42.44 H new ATOM 0 HB3 LEU A 119 -1.810 7.236 0.802 1.00 42.44 H new ATOM 0 HG LEU A 119 -4.394 6.926 2.390 1.00 3.52 H new ATOM 0 HD11 LEU A 119 -2.970 6.230 4.290 1.00 42.45 H new ATOM 0 HD12 LEU A 119 -2.876 5.089 2.927 1.00 42.45 H new ATOM 0 HD13 LEU A 119 -1.549 6.239 3.218 1.00 42.45 H new ATOM 0 HD21 LEU A 119 -3.424 8.645 3.897 1.00 1.35 H new ATOM 0 HD22 LEU A 119 -2.037 8.816 2.795 1.00 1.35 H new ATOM 0 HD23 LEU A 119 -3.670 9.265 2.247 1.00 1.35 H new ATOM 1943 N VAL A 120 -3.452 6.440 -2.197 1.00 74.33 N ATOM 1944 CA VAL A 120 -2.895 5.984 -3.495 1.00 3.14 C ATOM 1945 C VAL A 120 -3.531 6.753 -4.691 1.00 2.44 C ATOM 1946 O VAL A 120 -2.850 7.089 -5.664 1.00 72.20 O ATOM 1947 CB VAL A 120 -3.071 4.426 -3.650 1.00 72.31 C ATOM 1948 CG1 VAL A 120 -2.473 3.908 -4.971 1.00 32.11 C ATOM 1949 CG2 VAL A 120 -2.441 3.680 -2.451 1.00 22.13 C ATOM 0 H VAL A 120 -4.149 5.806 -1.807 1.00 74.33 H new ATOM 0 HA VAL A 120 -1.828 6.208 -3.505 1.00 3.14 H new ATOM 0 HB VAL A 120 -4.142 4.225 -3.669 1.00 72.31 H new ATOM 0 HG11 VAL A 120 -2.616 2.829 -5.037 1.00 32.11 H new ATOM 0 HG12 VAL A 120 -2.972 4.392 -5.811 1.00 32.11 H new ATOM 0 HG13 VAL A 120 -1.407 4.135 -5.002 1.00 32.11 H new ATOM 0 HG21 VAL A 120 -2.575 2.606 -2.580 1.00 22.13 H new ATOM 0 HG22 VAL A 120 -1.377 3.909 -2.398 1.00 22.13 H new ATOM 0 HG23 VAL A 120 -2.927 3.998 -1.529 1.00 22.13 H new ATOM 1959 N ASN A 121 -4.842 7.045 -4.597 1.00 3.14 N ATOM 1960 CA ASN A 121 -5.554 7.907 -5.586 1.00 34.14 C ATOM 1961 C ASN A 121 -5.464 9.412 -5.218 1.00 73.24 C ATOM 1962 O ASN A 121 -6.089 10.246 -5.887 1.00 73.21 O ATOM 1963 CB ASN A 121 -7.037 7.469 -5.739 1.00 50.23 C ATOM 1964 CG ASN A 121 -7.180 6.082 -6.358 1.00 72.10 C ATOM 1965 OD1 ASN A 121 -7.298 5.938 -7.573 1.00 64.55 O ATOM 1966 ND2 ASN A 121 -7.138 5.059 -5.538 1.00 71.51 N ATOM 0 H ASN A 121 -5.440 6.700 -3.846 1.00 3.14 H new ATOM 0 HA ASN A 121 -5.052 7.775 -6.545 1.00 34.14 H new ATOM 0 HB2 ASN A 121 -7.517 7.477 -4.760 1.00 50.23 H new ATOM 0 HB3 ASN A 121 -7.564 8.195 -6.358 1.00 50.23 H new ATOM 0 HD21 ASN A 121 -7.204 4.109 -5.904 1.00 71.51 H new ATOM 0 HD22 ASN A 121 -7.039 5.213 -4.535 1.00 71.51 H new ATOM 1973 N SER A 122 -4.708 9.756 -4.149 1.00 4.25 N ATOM 1974 CA SER A 122 -4.399 11.161 -3.801 1.00 61.23 C ATOM 1975 C SER A 122 -3.481 11.791 -4.866 1.00 40.50 C ATOM 1976 O SER A 122 -2.516 11.155 -5.310 1.00 73.44 O ATOM 1977 CB SER A 122 -3.712 11.238 -2.424 1.00 74.42 C ATOM 1978 OG SER A 122 -3.416 12.568 -2.050 1.00 31.32 O ATOM 0 H SER A 122 -4.299 9.074 -3.510 1.00 4.25 H new ATOM 0 HA SER A 122 -5.338 11.714 -3.764 1.00 61.23 H new ATOM 0 HB2 SER A 122 -4.358 10.786 -1.672 1.00 74.42 H new ATOM 0 HB3 SER A 122 -2.791 10.655 -2.446 1.00 74.42 H new ATOM 0 HG SER A 122 -2.983 12.572 -1.171 1.00 31.32 H new ATOM 1984 N GLN A 123 -3.783 13.047 -5.238 1.00 72.11 N ATOM 1985 CA GLN A 123 -3.078 13.794 -6.311 1.00 34.31 C ATOM 1986 C GLN A 123 -1.538 13.875 -6.111 1.00 22.15 C ATOM 1987 O GLN A 123 -0.794 13.918 -7.092 1.00 64.44 O ATOM 1988 CB GLN A 123 -3.698 15.208 -6.438 1.00 50.42 C ATOM 1989 CG GLN A 123 -3.546 16.101 -5.181 1.00 63.30 C ATOM 1990 CD GLN A 123 -4.381 17.379 -5.239 1.00 21.23 C ATOM 1991 OE1 GLN A 123 -5.467 17.407 -5.810 1.00 2.25 O ATOM 1992 NE2 GLN A 123 -3.882 18.448 -4.661 1.00 75.10 N ATOM 0 H GLN A 123 -4.532 13.584 -4.801 1.00 72.11 H new ATOM 0 HA GLN A 123 -3.217 13.237 -7.238 1.00 34.31 H new ATOM 0 HB2 GLN A 123 -3.237 15.716 -7.285 1.00 50.42 H new ATOM 0 HB3 GLN A 123 -4.759 15.105 -6.667 1.00 50.42 H new ATOM 0 HG2 GLN A 123 -3.834 15.527 -4.300 1.00 63.30 H new ATOM 0 HG3 GLN A 123 -2.496 16.367 -5.059 1.00 63.30 H new ATOM 0 HE21 GLN A 123 -2.977 18.399 -4.193 1.00 75.10 H new ATOM 0 HE22 GLN A 123 -4.399 19.327 -4.681 1.00 75.10 H new ATOM 2001 N GLU A 124 -1.087 13.852 -4.843 1.00 64.33 N ATOM 2002 CA GLU A 124 0.356 13.873 -4.468 1.00 24.44 C ATOM 2003 C GLU A 124 1.177 12.793 -5.228 1.00 52.14 C ATOM 2004 O GLU A 124 2.277 13.051 -5.721 1.00 12.25 O ATOM 2005 CB GLU A 124 0.492 13.658 -2.936 1.00 24.24 C ATOM 2006 CG GLU A 124 1.936 13.725 -2.387 1.00 1.14 C ATOM 2007 CD GLU A 124 2.599 15.116 -2.488 1.00 62.04 C ATOM 2008 OE1 GLU A 124 1.905 16.142 -2.305 1.00 32.14 O ATOM 2009 OE2 GLU A 124 3.828 15.190 -2.687 1.00 12.54 O ATOM 0 H GLU A 124 -1.711 13.818 -4.037 1.00 64.33 H new ATOM 0 HA GLU A 124 0.760 14.845 -4.751 1.00 24.44 H new ATOM 0 HB2 GLU A 124 -0.109 14.410 -2.425 1.00 24.24 H new ATOM 0 HB3 GLU A 124 0.069 12.686 -2.683 1.00 24.24 H new ATOM 0 HG2 GLU A 124 1.928 13.416 -1.342 1.00 1.14 H new ATOM 0 HG3 GLU A 124 2.550 13.004 -2.927 1.00 1.14 H new ATOM 2016 N TYR A 125 0.647 11.567 -5.242 1.00 44.33 N ATOM 2017 CA TYR A 125 1.133 10.478 -6.107 1.00 54.35 C ATOM 2018 C TYR A 125 0.581 10.626 -7.561 1.00 14.43 C ATOM 2019 O TYR A 125 1.330 10.512 -8.533 1.00 73.52 O ATOM 2020 CB TYR A 125 0.732 9.115 -5.463 1.00 22.22 C ATOM 2021 CG TYR A 125 1.110 7.840 -6.249 1.00 42.23 C ATOM 2022 CD1 TYR A 125 2.281 7.753 -7.021 1.00 13.14 C ATOM 2023 CD2 TYR A 125 0.285 6.717 -6.207 1.00 3.43 C ATOM 2024 CE1 TYR A 125 2.594 6.601 -7.721 1.00 34.14 C ATOM 2025 CE2 TYR A 125 0.599 5.570 -6.898 1.00 50.34 C ATOM 2026 CZ TYR A 125 1.745 5.513 -7.654 1.00 41.53 C ATOM 2027 OH TYR A 125 2.039 4.360 -8.345 1.00 51.23 O ATOM 0 H TYR A 125 -0.138 11.296 -4.650 1.00 44.33 H new ATOM 0 HA TYR A 125 2.219 10.524 -6.187 1.00 54.35 H new ATOM 0 HB2 TYR A 125 1.192 9.056 -4.477 1.00 22.22 H new ATOM 0 HB3 TYR A 125 -0.347 9.114 -5.312 1.00 22.22 H new ATOM 0 HD1 TYR A 125 2.949 8.600 -7.069 1.00 13.14 H new ATOM 0 HD2 TYR A 125 -0.620 6.748 -5.619 1.00 3.43 H new ATOM 0 HE1 TYR A 125 3.495 6.553 -8.315 1.00 34.14 H new ATOM 0 HE2 TYR A 125 -0.056 4.713 -6.846 1.00 50.34 H new ATOM 0 HH TYR A 125 3.011 4.265 -8.424 1.00 51.23 H new ATOM 2037 N ASN A 126 -0.727 10.928 -7.675 1.00 52.43 N ATOM 2038 CA ASN A 126 -1.500 10.790 -8.938 1.00 44.11 C ATOM 2039 C ASN A 126 -1.147 11.871 -10.013 1.00 35.33 C ATOM 2040 O ASN A 126 -0.624 11.527 -11.071 1.00 23.54 O ATOM 2041 CB ASN A 126 -3.018 10.800 -8.605 1.00 1.51 C ATOM 2042 CG ASN A 126 -3.911 10.395 -9.781 1.00 53.31 C ATOM 2043 OD1 ASN A 126 -4.199 9.222 -9.972 1.00 72.10 O ATOM 2044 ND2 ASN A 126 -4.370 11.353 -10.565 1.00 3.03 N ATOM 0 H ASN A 126 -1.284 11.276 -6.895 1.00 52.43 H new ATOM 0 HA ASN A 126 -1.221 9.839 -9.391 1.00 44.11 H new ATOM 0 HB2 ASN A 126 -3.202 10.123 -7.771 1.00 1.51 H new ATOM 0 HB3 ASN A 126 -3.301 11.799 -8.273 1.00 1.51 H new ATOM 0 HD21 ASN A 126 -4.979 11.122 -11.350 1.00 3.03 H new ATOM 0 HD22 ASN A 126 -4.116 12.324 -10.386 1.00 3.03 H new ATOM 2051 N GLU A 127 -1.480 13.165 -9.774 1.00 52.03 N ATOM 2052 CA GLU A 127 -1.129 14.258 -10.741 1.00 75.23 C ATOM 2053 C GLU A 127 0.399 14.345 -11.046 1.00 0.13 C ATOM 2054 O GLU A 127 0.793 14.640 -12.179 1.00 54.43 O ATOM 2055 CB GLU A 127 -1.660 15.649 -10.281 1.00 24.14 C ATOM 2056 CG GLU A 127 -0.934 16.275 -9.070 1.00 30.14 C ATOM 2057 CD GLU A 127 -1.290 17.748 -8.836 1.00 73.50 C ATOM 2058 OE1 GLU A 127 -0.647 18.622 -9.465 1.00 54.35 O ATOM 2059 OE2 GLU A 127 -2.225 18.042 -8.057 1.00 64.14 O ATOM 0 H GLU A 127 -1.979 13.481 -8.943 1.00 52.03 H new ATOM 0 HA GLU A 127 -1.633 13.984 -11.668 1.00 75.23 H new ATOM 0 HB2 GLU A 127 -1.590 16.340 -11.121 1.00 24.14 H new ATOM 0 HB3 GLU A 127 -2.718 15.551 -10.037 1.00 24.14 H new ATOM 0 HG2 GLU A 127 -1.179 15.704 -8.175 1.00 30.14 H new ATOM 0 HG3 GLU A 127 0.142 16.189 -9.218 1.00 30.14 H new ATOM 2066 N VAL A 128 1.243 14.107 -10.024 1.00 54.32 N ATOM 2067 CA VAL A 128 2.715 14.163 -10.167 1.00 70.42 C ATOM 2068 C VAL A 128 3.272 13.008 -11.048 1.00 61.45 C ATOM 2069 O VAL A 128 3.880 13.254 -12.092 1.00 20.44 O ATOM 2070 CB VAL A 128 3.424 14.165 -8.762 1.00 61.53 C ATOM 2071 CG1 VAL A 128 4.964 14.267 -8.905 1.00 51.14 C ATOM 2072 CG2 VAL A 128 2.876 15.306 -7.868 1.00 54.04 C ATOM 0 H VAL A 128 0.930 13.872 -9.082 1.00 54.32 H new ATOM 0 HA VAL A 128 2.939 15.100 -10.676 1.00 70.42 H new ATOM 0 HB VAL A 128 3.199 13.215 -8.278 1.00 61.53 H new ATOM 0 HG11 VAL A 128 5.422 14.266 -7.916 1.00 51.14 H new ATOM 0 HG12 VAL A 128 5.333 13.416 -9.477 1.00 51.14 H new ATOM 0 HG13 VAL A 128 5.221 15.191 -9.423 1.00 51.14 H new ATOM 0 HG21 VAL A 128 3.382 15.286 -6.903 1.00 54.04 H new ATOM 0 HG22 VAL A 128 3.056 16.266 -8.352 1.00 54.04 H new ATOM 0 HG23 VAL A 128 1.805 15.169 -7.720 1.00 54.04 H new ATOM 2082 N PHE A 129 3.070 11.755 -10.613 1.00 20.33 N ATOM 2083 CA PHE A 129 3.609 10.556 -11.312 1.00 23.35 C ATOM 2084 C PHE A 129 2.503 9.802 -12.072 1.00 2.32 C ATOM 2085 O PHE A 129 2.625 9.534 -13.273 1.00 34.02 O ATOM 2086 CB PHE A 129 4.299 9.604 -10.301 1.00 55.43 C ATOM 2087 CG PHE A 129 5.486 10.219 -9.563 1.00 62.24 C ATOM 2088 CD1 PHE A 129 6.405 11.035 -10.230 1.00 33.20 C ATOM 2089 CD2 PHE A 129 5.684 9.979 -8.205 1.00 24.22 C ATOM 2090 CE1 PHE A 129 7.472 11.592 -9.560 1.00 5.21 C ATOM 2091 CE2 PHE A 129 6.755 10.534 -7.541 1.00 13.00 C ATOM 2092 CZ PHE A 129 7.645 11.344 -8.216 1.00 21.42 C ATOM 0 H PHE A 129 2.534 11.534 -9.774 1.00 20.33 H new ATOM 0 HA PHE A 129 4.345 10.901 -12.038 1.00 23.35 H new ATOM 0 HB2 PHE A 129 3.562 9.276 -9.568 1.00 55.43 H new ATOM 0 HB3 PHE A 129 4.638 8.714 -10.832 1.00 55.43 H new ATOM 0 HD1 PHE A 129 6.277 11.231 -11.284 1.00 33.20 H new ATOM 0 HD2 PHE A 129 4.990 9.351 -7.667 1.00 24.22 H new ATOM 0 HE1 PHE A 129 8.172 12.222 -10.088 1.00 5.21 H new ATOM 0 HE2 PHE A 129 6.899 10.335 -6.489 1.00 13.00 H new ATOM 0 HZ PHE A 129 8.479 11.784 -7.690 1.00 21.42 H new ATOM 2102 N GLY A 130 1.428 9.459 -11.351 1.00 51.32 N ATOM 2103 CA GLY A 130 0.296 8.725 -11.922 1.00 14.00 C ATOM 2104 C GLY A 130 0.253 7.268 -11.493 1.00 12.31 C ATOM 2105 O GLY A 130 0.296 6.960 -10.298 1.00 10.23 O ATOM 0 H GLY A 130 1.320 9.682 -10.361 1.00 51.32 H new ATOM 0 HA2 GLY A 130 -0.633 9.213 -11.625 1.00 14.00 H new ATOM 0 HA3 GLY A 130 0.349 8.776 -13.010 1.00 14.00 H new ATOM 2109 N GLU A 131 0.177 6.373 -12.483 1.00 23.04 N ATOM 2110 CA GLU A 131 -0.107 4.942 -12.274 1.00 30.51 C ATOM 2111 C GLU A 131 1.176 4.071 -12.475 1.00 44.15 C ATOM 2112 O GLU A 131 1.269 2.941 -11.980 1.00 65.01 O ATOM 2113 CB GLU A 131 -1.215 4.492 -13.294 1.00 24.23 C ATOM 2114 CG GLU A 131 -2.289 5.549 -13.684 1.00 23.21 C ATOM 2115 CD GLU A 131 -3.228 6.001 -12.541 1.00 74.25 C ATOM 2116 OE1 GLU A 131 -4.197 5.273 -12.225 1.00 14.11 O ATOM 2117 OE2 GLU A 131 -3.008 7.085 -11.949 1.00 4.22 O ATOM 0 H GLU A 131 0.312 6.620 -13.463 1.00 23.04 H new ATOM 0 HA GLU A 131 -0.451 4.800 -11.249 1.00 30.51 H new ATOM 0 HB2 GLU A 131 -0.720 4.160 -14.207 1.00 24.23 H new ATOM 0 HB3 GLU A 131 -1.728 3.626 -12.876 1.00 24.23 H new ATOM 0 HG2 GLU A 131 -1.781 6.428 -14.081 1.00 23.21 H new ATOM 0 HG3 GLU A 131 -2.898 5.141 -14.491 1.00 23.21 H new ATOM 2124 N ASP A 132 2.169 4.635 -13.192 1.00 71.43 N ATOM 2125 CA ASP A 132 3.210 3.856 -13.912 1.00 11.23 C ATOM 2126 C ASP A 132 4.582 3.748 -13.179 1.00 13.34 C ATOM 2127 O ASP A 132 5.552 3.291 -13.792 1.00 74.42 O ATOM 2128 CB ASP A 132 3.401 4.508 -15.312 1.00 12.35 C ATOM 2129 CG ASP A 132 2.077 4.655 -16.094 1.00 35.02 C ATOM 2130 OD1 ASP A 132 1.354 5.654 -15.876 1.00 21.12 O ATOM 2131 OD2 ASP A 132 1.744 3.770 -16.912 1.00 62.32 O ATOM 0 H ASP A 132 2.276 5.644 -13.291 1.00 71.43 H new ATOM 0 HA ASP A 132 2.854 2.828 -13.977 1.00 11.23 H new ATOM 0 HB2 ASP A 132 3.856 5.491 -15.190 1.00 12.35 H new ATOM 0 HB3 ASP A 132 4.097 3.905 -15.896 1.00 12.35 H new ATOM 2136 N THR A 133 4.676 4.130 -11.886 1.00 73.34 N ATOM 2137 CA THR A 133 5.967 4.048 -11.123 1.00 4.53 C ATOM 2138 C THR A 133 5.741 3.904 -9.598 1.00 63.41 C ATOM 2139 O THR A 133 4.647 4.151 -9.108 1.00 4.22 O ATOM 2140 CB THR A 133 6.894 5.292 -11.395 1.00 11.33 C ATOM 2141 OG1 THR A 133 8.169 5.123 -10.739 1.00 61.01 O ATOM 2142 CG2 THR A 133 6.259 6.610 -10.929 1.00 3.21 C ATOM 0 H THR A 133 3.892 4.495 -11.345 1.00 73.34 H new ATOM 0 HA THR A 133 6.466 3.150 -11.487 1.00 4.53 H new ATOM 0 HB THR A 133 7.032 5.348 -12.475 1.00 11.33 H new ATOM 0 HG1 THR A 133 8.531 6.001 -10.497 1.00 61.01 H new ATOM 0 HG21 THR A 133 6.939 7.436 -11.140 1.00 3.21 H new ATOM 0 HG22 THR A 133 5.320 6.769 -11.459 1.00 3.21 H new ATOM 0 HG23 THR A 133 6.067 6.562 -9.857 1.00 3.21 H new ATOM 2150 N VAL A 134 6.800 3.497 -8.866 1.00 15.21 N ATOM 2151 CA VAL A 134 6.792 3.395 -7.382 1.00 53.43 C ATOM 2152 C VAL A 134 6.696 4.818 -6.735 1.00 62.32 C ATOM 2153 O VAL A 134 7.373 5.741 -7.206 1.00 55.01 O ATOM 2154 CB VAL A 134 8.093 2.620 -6.892 1.00 63.54 C ATOM 2155 CG1 VAL A 134 8.300 2.684 -5.358 1.00 4.11 C ATOM 2156 CG2 VAL A 134 8.060 1.141 -7.362 1.00 63.55 C ATOM 0 H VAL A 134 7.690 3.228 -9.285 1.00 15.21 H new ATOM 0 HA VAL A 134 5.916 2.831 -7.064 1.00 53.43 H new ATOM 0 HB VAL A 134 8.941 3.131 -7.348 1.00 63.54 H new ATOM 0 HG11 VAL A 134 9.204 2.137 -5.090 1.00 4.11 H new ATOM 0 HG12 VAL A 134 8.400 3.724 -5.047 1.00 4.11 H new ATOM 0 HG13 VAL A 134 7.442 2.237 -4.856 1.00 4.11 H new ATOM 0 HG21 VAL A 134 8.958 0.629 -7.017 1.00 63.55 H new ATOM 0 HG22 VAL A 134 7.180 0.648 -6.949 1.00 63.55 H new ATOM 0 HG23 VAL A 134 8.019 1.106 -8.451 1.00 63.55 H new ATOM 2166 N PRO A 135 5.822 5.028 -5.679 1.00 32.12 N ATOM 2167 CA PRO A 135 5.649 6.352 -5.012 1.00 74.30 C ATOM 2168 C PRO A 135 6.868 6.760 -4.133 1.00 51.42 C ATOM 2169 O PRO A 135 6.834 6.650 -2.903 1.00 21.45 O ATOM 2170 CB PRO A 135 4.349 6.174 -4.153 1.00 53.15 C ATOM 2171 CG PRO A 135 3.773 4.844 -4.557 1.00 3.12 C ATOM 2172 CD PRO A 135 4.929 4.018 -5.061 1.00 31.41 C ATOM 0 HA PRO A 135 5.573 7.160 -5.740 1.00 74.30 H new ATOM 0 HB2 PRO A 135 4.578 6.194 -3.088 1.00 53.15 H new ATOM 0 HB3 PRO A 135 3.641 6.981 -4.342 1.00 53.15 H new ATOM 0 HG2 PRO A 135 3.287 4.358 -3.711 1.00 3.12 H new ATOM 0 HG3 PRO A 135 3.016 4.967 -5.332 1.00 3.12 H new ATOM 0 HD2 PRO A 135 5.425 3.483 -4.251 1.00 31.41 H new ATOM 0 HD3 PRO A 135 4.605 3.270 -5.785 1.00 31.41 H new ATOM 2180 N TYR A 136 7.950 7.210 -4.793 1.00 34.41 N ATOM 2181 CA TYR A 136 9.175 7.702 -4.112 1.00 53.52 C ATOM 2182 C TYR A 136 9.039 9.207 -3.758 1.00 75.41 C ATOM 2183 O TYR A 136 8.088 9.872 -4.201 1.00 25.20 O ATOM 2184 CB TYR A 136 10.431 7.441 -5.000 1.00 0.21 C ATOM 2185 CG TYR A 136 10.503 8.263 -6.306 1.00 42.00 C ATOM 2186 CD1 TYR A 136 9.769 7.896 -7.436 1.00 45.05 C ATOM 2187 CD2 TYR A 136 11.310 9.406 -6.406 1.00 24.33 C ATOM 2188 CE1 TYR A 136 9.838 8.629 -8.605 1.00 3.31 C ATOM 2189 CE2 TYR A 136 11.373 10.138 -7.574 1.00 14.33 C ATOM 2190 CZ TYR A 136 10.641 9.746 -8.669 1.00 1.53 C ATOM 2191 OH TYR A 136 10.706 10.477 -9.836 1.00 30.31 O ATOM 0 H TYR A 136 8.006 7.245 -5.811 1.00 34.41 H new ATOM 0 HA TYR A 136 9.300 7.152 -3.179 1.00 53.52 H new ATOM 0 HB2 TYR A 136 11.322 7.651 -4.409 1.00 0.21 H new ATOM 0 HB3 TYR A 136 10.460 6.382 -5.256 1.00 0.21 H new ATOM 0 HD1 TYR A 136 9.135 7.022 -7.395 1.00 45.05 H new ATOM 0 HD2 TYR A 136 11.893 9.719 -5.553 1.00 24.33 H new ATOM 0 HE1 TYR A 136 9.263 8.326 -9.468 1.00 3.31 H new ATOM 0 HE2 TYR A 136 11.997 11.018 -7.628 1.00 14.33 H new ATOM 0 HH TYR A 136 9.846 10.921 -9.992 1.00 30.31 H new ATOM 2201 N ARG A 137 10.003 9.738 -2.975 1.00 50.30 N ATOM 2202 CA ARG A 137 9.985 11.152 -2.520 1.00 44.31 C ATOM 2203 C ARG A 137 10.072 12.145 -3.714 1.00 51.52 C ATOM 2204 O ARG A 137 10.887 11.974 -4.630 1.00 61.52 O ATOM 2205 CB ARG A 137 11.143 11.413 -1.504 1.00 40.12 C ATOM 2206 CG ARG A 137 12.572 11.410 -2.111 1.00 44.30 C ATOM 2207 CD ARG A 137 13.682 11.627 -1.058 1.00 14.15 C ATOM 2208 NE ARG A 137 13.569 12.944 -0.396 1.00 44.54 N ATOM 2209 CZ ARG A 137 14.545 13.591 0.213 1.00 45.30 C ATOM 2210 NH1 ARG A 137 15.745 13.102 0.282 1.00 13.51 N ATOM 2211 NH2 ARG A 137 14.299 14.743 0.745 1.00 4.33 N ATOM 0 H ARG A 137 10.809 9.208 -2.642 1.00 50.30 H new ATOM 0 HA ARG A 137 9.032 11.324 -2.021 1.00 44.31 H new ATOM 0 HB2 ARG A 137 10.972 12.376 -1.024 1.00 40.12 H new ATOM 0 HB3 ARG A 137 11.096 10.654 -0.723 1.00 40.12 H new ATOM 0 HG2 ARG A 137 12.742 10.460 -2.618 1.00 44.30 H new ATOM 0 HG3 ARG A 137 12.640 12.192 -2.867 1.00 44.30 H new ATOM 0 HD2 ARG A 137 13.629 10.838 -0.307 1.00 14.15 H new ATOM 0 HD3 ARG A 137 14.657 11.545 -1.538 1.00 14.15 H new ATOM 0 HE ARG A 137 12.654 13.394 -0.411 1.00 44.54 H new ATOM 0 HH11 ARG A 137 15.952 12.197 -0.140 1.00 13.51 H new ATOM 0 HH12 ARG A 137 16.481 13.623 0.759 1.00 13.51 H new ATOM 0 HH21 ARG A 137 13.361 15.140 0.691 1.00 4.33 H new ATOM 0 HH22 ARG A 137 15.043 15.255 1.219 1.00 4.33 H new ATOM 2225 N ARG A 138 9.202 13.167 -3.711 1.00 44.33 N ATOM 2226 CA ARG A 138 9.222 14.222 -4.745 1.00 55.24 C ATOM 2227 C ARG A 138 10.239 15.325 -4.375 1.00 1.44 C ATOM 2228 O ARG A 138 10.248 15.830 -3.250 1.00 1.41 O ATOM 2229 CB ARG A 138 7.815 14.841 -4.965 1.00 2.00 C ATOM 2230 CG ARG A 138 6.789 13.935 -5.701 1.00 33.42 C ATOM 2231 CD ARG A 138 6.327 12.718 -4.884 1.00 31.23 C ATOM 2232 NE ARG A 138 5.738 13.097 -3.597 1.00 60.43 N ATOM 2233 CZ ARG A 138 5.661 12.334 -2.540 1.00 31.55 C ATOM 2234 NH1 ARG A 138 6.132 11.121 -2.542 1.00 32.53 N ATOM 2235 NH2 ARG A 138 5.099 12.794 -1.475 1.00 70.24 N ATOM 0 H ARG A 138 8.475 13.288 -3.006 1.00 44.33 H new ATOM 0 HA ARG A 138 9.529 13.755 -5.681 1.00 55.24 H new ATOM 0 HB2 ARG A 138 7.402 15.112 -3.994 1.00 2.00 H new ATOM 0 HB3 ARG A 138 7.929 15.765 -5.532 1.00 2.00 H new ATOM 0 HG2 ARG A 138 5.917 14.533 -5.966 1.00 33.42 H new ATOM 0 HG3 ARG A 138 7.232 13.586 -6.634 1.00 33.42 H new ATOM 0 HD2 ARG A 138 5.596 12.153 -5.462 1.00 31.23 H new ATOM 0 HD3 ARG A 138 7.176 12.057 -4.711 1.00 31.23 H new ATOM 0 HE ARG A 138 5.355 14.039 -3.520 1.00 60.43 H new ATOM 0 HH11 ARG A 138 6.573 10.747 -3.382 1.00 32.53 H new ATOM 0 HH12 ARG A 138 6.060 10.545 -1.704 1.00 32.53 H new ATOM 0 HH21 ARG A 138 4.722 13.742 -1.466 1.00 70.24 H new ATOM 0 HH22 ARG A 138 5.031 12.210 -0.641 1.00 70.24 H new ATOM 2249 N PHE A 139 11.085 15.655 -5.349 1.00 53.01 N ATOM 2250 CA PHE A 139 12.113 16.721 -5.262 1.00 32.20 C ATOM 2251 C PHE A 139 11.465 18.143 -5.156 1.00 44.10 C ATOM 2252 O PHE A 139 10.291 18.302 -5.518 1.00 43.35 O ATOM 2253 CB PHE A 139 13.036 16.598 -6.512 1.00 11.15 C ATOM 2254 CG PHE A 139 13.805 15.267 -6.582 1.00 51.25 C ATOM 2255 CD1 PHE A 139 13.149 14.071 -6.899 1.00 4.51 C ATOM 2256 CD2 PHE A 139 15.175 15.211 -6.316 1.00 53.41 C ATOM 2257 CE1 PHE A 139 13.842 12.873 -6.958 1.00 35.03 C ATOM 2258 CE2 PHE A 139 15.863 14.013 -6.377 1.00 1.20 C ATOM 2259 CZ PHE A 139 15.197 12.845 -6.696 1.00 22.43 C ATOM 0 H PHE A 139 11.084 15.181 -6.252 1.00 53.01 H new ATOM 0 HA PHE A 139 12.702 16.595 -4.354 1.00 32.20 H new ATOM 0 HB2 PHE A 139 12.431 16.706 -7.412 1.00 11.15 H new ATOM 0 HB3 PHE A 139 13.751 17.421 -6.508 1.00 11.15 H new ATOM 0 HD1 PHE A 139 12.088 14.083 -7.100 1.00 4.51 H new ATOM 0 HD2 PHE A 139 15.705 16.116 -6.059 1.00 53.41 H new ATOM 0 HE1 PHE A 139 13.322 11.960 -7.209 1.00 35.03 H new ATOM 0 HE2 PHE A 139 16.924 13.990 -6.175 1.00 1.20 H new ATOM 0 HZ PHE A 139 15.737 11.910 -6.740 1.00 22.43 H new ATOM 2269 N PRO A 140 12.218 19.194 -4.633 1.00 22.22 N ATOM 2270 CA PRO A 140 11.685 20.591 -4.455 1.00 24.32 C ATOM 2271 C PRO A 140 11.043 21.176 -5.746 1.00 3.22 C ATOM 2272 O PRO A 140 10.018 21.864 -5.686 1.00 25.03 O ATOM 2273 CB PRO A 140 12.944 21.410 -4.016 1.00 60.23 C ATOM 2274 CG PRO A 140 14.115 20.535 -4.356 1.00 53.10 C ATOM 2275 CD PRO A 140 13.628 19.121 -4.158 1.00 4.42 C ATOM 0 HA PRO A 140 10.873 20.622 -3.729 1.00 24.32 H new ATOM 0 HB2 PRO A 140 12.998 22.363 -4.542 1.00 60.23 H new ATOM 0 HB3 PRO A 140 12.916 21.635 -2.950 1.00 60.23 H new ATOM 0 HG2 PRO A 140 14.442 20.698 -5.383 1.00 53.10 H new ATOM 0 HG3 PRO A 140 14.967 20.751 -3.712 1.00 53.10 H new ATOM 0 HD2 PRO A 140 14.214 18.406 -4.735 1.00 4.42 H new ATOM 0 HD3 PRO A 140 13.689 18.814 -3.114 1.00 4.42 H new ATOM 2283 N THR A 141 11.665 20.892 -6.903 1.00 32.40 N ATOM 2284 CA THR A 141 11.080 21.174 -8.238 1.00 52.20 C ATOM 2285 C THR A 141 10.634 19.859 -8.912 1.00 43.41 C ATOM 2286 O THR A 141 11.242 18.803 -8.690 1.00 44.22 O ATOM 2287 CB THR A 141 12.082 21.936 -9.176 1.00 32.12 C ATOM 2288 OG1 THR A 141 11.491 22.150 -10.471 1.00 23.43 O ATOM 2289 CG2 THR A 141 13.426 21.198 -9.342 1.00 44.43 C ATOM 0 H THR A 141 12.588 20.460 -6.946 1.00 32.40 H new ATOM 0 HA THR A 141 10.216 21.820 -8.081 1.00 52.20 H new ATOM 0 HB THR A 141 12.290 22.892 -8.695 1.00 32.12 H new ATOM 0 HG1 THR A 141 12.126 22.627 -11.045 1.00 23.43 H new ATOM 0 HG21 THR A 141 14.077 21.772 -10.001 1.00 44.43 H new ATOM 0 HG22 THR A 141 13.902 21.086 -8.368 1.00 44.43 H new ATOM 0 HG23 THR A 141 13.249 20.213 -9.775 1.00 44.43 H new ATOM 2297 N LEU A 142 9.571 19.932 -9.732 1.00 53.34 N ATOM 2298 CA LEU A 142 9.021 18.766 -10.463 1.00 14.44 C ATOM 2299 C LEU A 142 9.105 18.998 -11.984 1.00 34.43 C ATOM 2300 O LEU A 142 8.384 19.842 -12.530 1.00 42.14 O ATOM 2301 CB LEU A 142 7.548 18.509 -10.027 1.00 11.52 C ATOM 2302 CG LEU A 142 7.348 18.087 -8.534 1.00 34.14 C ATOM 2303 CD1 LEU A 142 5.853 17.915 -8.192 1.00 2.31 C ATOM 2304 CD2 LEU A 142 8.156 16.805 -8.209 1.00 22.20 C ATOM 0 H LEU A 142 9.065 20.800 -9.910 1.00 53.34 H new ATOM 0 HA LEU A 142 9.614 17.885 -10.219 1.00 14.44 H new ATOM 0 HB2 LEU A 142 6.971 19.415 -10.210 1.00 11.52 H new ATOM 0 HB3 LEU A 142 7.130 17.730 -10.665 1.00 11.52 H new ATOM 0 HG LEU A 142 7.732 18.891 -7.906 1.00 34.14 H new ATOM 0 HD11 LEU A 142 5.750 17.622 -7.147 1.00 2.31 H new ATOM 0 HD12 LEU A 142 5.331 18.858 -8.357 1.00 2.31 H new ATOM 0 HD13 LEU A 142 5.420 17.144 -8.830 1.00 2.31 H new ATOM 0 HD21 LEU A 142 8.001 16.532 -7.165 1.00 22.20 H new ATOM 0 HD22 LEU A 142 7.820 15.991 -8.851 1.00 22.20 H new ATOM 0 HD23 LEU A 142 9.216 16.990 -8.382 1.00 22.20 H new ATOM 2316 N GLU A 143 10.006 18.258 -12.661 1.00 31.35 N ATOM 2317 CA GLU A 143 10.143 18.310 -14.132 1.00 52.02 C ATOM 2318 C GLU A 143 9.123 17.336 -14.785 1.00 34.03 C ATOM 2319 O GLU A 143 9.482 16.279 -15.326 1.00 32.23 O ATOM 2320 CB GLU A 143 11.614 17.990 -14.551 1.00 73.23 C ATOM 2321 CG GLU A 143 11.975 18.360 -16.009 1.00 13.43 C ATOM 2322 CD GLU A 143 11.877 19.874 -16.291 1.00 20.43 C ATOM 2323 OE1 GLU A 143 12.812 20.620 -15.926 1.00 22.35 O ATOM 2324 OE2 GLU A 143 10.859 20.327 -16.867 1.00 22.32 O ATOM 0 H GLU A 143 10.654 17.613 -12.209 1.00 31.35 H new ATOM 0 HA GLU A 143 9.920 19.316 -14.488 1.00 52.02 H new ATOM 0 HB2 GLU A 143 12.290 18.520 -13.880 1.00 73.23 H new ATOM 0 HB3 GLU A 143 11.793 16.924 -14.408 1.00 73.23 H new ATOM 0 HG2 GLU A 143 12.989 18.021 -16.223 1.00 13.43 H new ATOM 0 HG3 GLU A 143 11.310 17.826 -16.688 1.00 13.43 H new ATOM 2331 N HIS A 144 7.835 17.704 -14.674 1.00 64.01 N ATOM 2332 CA HIS A 144 6.700 16.916 -15.187 1.00 33.52 C ATOM 2333 C HIS A 144 5.582 17.903 -15.593 1.00 64.44 C ATOM 2334 O HIS A 144 4.727 18.264 -14.773 1.00 25.54 O ATOM 2335 CB HIS A 144 6.227 15.891 -14.108 1.00 14.23 C ATOM 2336 CG HIS A 144 5.278 14.824 -14.603 1.00 72.42 C ATOM 2337 ND1 HIS A 144 5.691 13.550 -14.933 1.00 44.42 N ATOM 2338 CD2 HIS A 144 3.935 14.833 -14.796 1.00 42.34 C ATOM 2339 CE1 HIS A 144 4.655 12.827 -15.298 1.00 64.12 C ATOM 2340 NE2 HIS A 144 3.578 13.579 -15.227 1.00 22.45 N ATOM 0 H HIS A 144 7.548 18.570 -14.218 1.00 64.01 H new ATOM 0 HA HIS A 144 6.989 16.334 -16.062 1.00 33.52 H new ATOM 0 HB2 HIS A 144 7.105 15.404 -13.683 1.00 14.23 H new ATOM 0 HB3 HIS A 144 5.743 16.438 -13.299 1.00 14.23 H new ATOM 0 HD2 HIS A 144 3.271 15.670 -14.640 1.00 42.34 H new ATOM 0 HE1 HIS A 144 4.684 11.792 -15.604 1.00 64.12 H new ATOM 0 HE2 HIS A 144 2.630 13.279 -15.455 1.00 22.45 H new ATOM 2349 N HIS A 145 5.652 18.367 -16.856 1.00 31.22 N ATOM 2350 CA HIS A 145 4.829 19.486 -17.385 1.00 4.50 C ATOM 2351 C HIS A 145 3.296 19.288 -17.185 1.00 13.32 C ATOM 2352 O HIS A 145 2.665 18.457 -17.842 1.00 53.45 O ATOM 2353 CB HIS A 145 5.181 19.754 -18.877 1.00 15.24 C ATOM 2354 CG HIS A 145 5.036 18.566 -19.803 1.00 5.41 C ATOM 2355 ND1 HIS A 145 3.863 18.265 -20.472 1.00 43.13 N ATOM 2356 CD2 HIS A 145 5.917 17.605 -20.160 1.00 30.13 C ATOM 2357 CE1 HIS A 145 4.036 17.180 -21.195 1.00 20.54 C ATOM 2358 NE2 HIS A 145 5.271 16.763 -21.024 1.00 74.41 N ATOM 0 H HIS A 145 6.288 17.974 -17.550 1.00 31.22 H new ATOM 0 HA HIS A 145 5.082 20.366 -16.795 1.00 4.50 H new ATOM 0 HB2 HIS A 145 4.544 20.559 -19.244 1.00 15.24 H new ATOM 0 HB3 HIS A 145 6.209 20.112 -18.931 1.00 15.24 H new ATOM 0 HD2 HIS A 145 6.940 17.518 -19.826 1.00 30.13 H new ATOM 0 HE1 HIS A 145 3.291 16.712 -21.822 1.00 20.54 H new ATOM 0 HE2 HIS A 145 5.683 15.941 -21.466 1.00 74.41 H new ATOM 2367 N HIS A 146 2.725 20.064 -16.245 1.00 14.14 N ATOM 2368 CA HIS A 146 1.269 20.073 -15.955 1.00 63.22 C ATOM 2369 C HIS A 146 0.487 20.843 -17.061 1.00 72.55 C ATOM 2370 O HIS A 146 1.030 21.771 -17.678 1.00 52.32 O ATOM 2371 CB HIS A 146 1.012 20.707 -14.561 1.00 24.12 C ATOM 2372 CG HIS A 146 1.695 19.992 -13.415 1.00 15.04 C ATOM 2373 ND1 HIS A 146 1.286 18.768 -12.944 1.00 24.55 N ATOM 2374 CD2 HIS A 146 2.762 20.340 -12.648 1.00 10.33 C ATOM 2375 CE1 HIS A 146 2.064 18.391 -11.952 1.00 51.11 C ATOM 2376 NE2 HIS A 146 2.968 19.324 -11.747 1.00 3.50 N ATOM 0 H HIS A 146 3.258 20.707 -15.660 1.00 14.14 H new ATOM 0 HA HIS A 146 0.909 19.044 -15.946 1.00 63.22 H new ATOM 0 HB2 HIS A 146 1.348 21.744 -14.579 1.00 24.12 H new ATOM 0 HB3 HIS A 146 -0.062 20.724 -14.375 1.00 24.12 H new ATOM 0 HD2 HIS A 146 3.341 21.248 -12.732 1.00 10.33 H new ATOM 0 HE1 HIS A 146 1.975 17.468 -11.398 1.00 51.11 H new ATOM 0 HE2 HIS A 146 3.700 19.297 -11.037 1.00 3.50 H new ATOM 2385 N HIS A 147 -0.782 20.446 -17.304 1.00 51.05 N ATOM 2386 CA HIS A 147 -1.626 21.033 -18.383 1.00 64.44 C ATOM 2387 C HIS A 147 -1.962 22.528 -18.131 1.00 11.32 C ATOM 2388 O HIS A 147 -2.244 22.935 -17.000 1.00 4.11 O ATOM 2389 CB HIS A 147 -2.943 20.234 -18.556 1.00 64.31 C ATOM 2390 CG HIS A 147 -2.761 18.806 -18.997 1.00 54.34 C ATOM 2391 ND1 HIS A 147 -2.444 18.453 -20.287 1.00 4.55 N ATOM 2392 CD2 HIS A 147 -2.872 17.643 -18.317 1.00 23.22 C ATOM 2393 CE1 HIS A 147 -2.370 17.146 -20.383 1.00 15.23 C ATOM 2394 NE2 HIS A 147 -2.622 16.624 -19.200 1.00 12.20 N ATOM 0 H HIS A 147 -1.252 19.717 -16.767 1.00 51.05 H new ATOM 0 HA HIS A 147 -1.036 20.970 -19.297 1.00 64.44 H new ATOM 0 HB2 HIS A 147 -3.483 20.241 -17.609 1.00 64.31 H new ATOM 0 HB3 HIS A 147 -3.570 20.748 -19.285 1.00 64.31 H new ATOM 0 HD2 HIS A 147 -3.113 17.536 -17.270 1.00 23.22 H new ATOM 0 HE1 HIS A 147 -2.141 16.592 -21.281 1.00 15.23 H new ATOM 0 HE2 HIS A 147 -2.630 15.628 -18.978 1.00 12.20 H new ATOM 2403 N HIS A 148 -1.940 23.323 -19.216 1.00 60.12 N ATOM 2404 CA HIS A 148 -2.300 24.765 -19.197 1.00 50.54 C ATOM 2405 C HIS A 148 -3.792 24.988 -19.573 1.00 62.23 C ATOM 2406 O HIS A 148 -4.315 26.096 -19.420 1.00 32.14 O ATOM 2407 CB HIS A 148 -1.364 25.542 -20.163 1.00 3.11 C ATOM 2408 CG HIS A 148 0.105 25.376 -19.838 1.00 53.30 C ATOM 2409 ND1 HIS A 148 0.772 26.165 -18.920 1.00 64.21 N ATOM 2410 CD2 HIS A 148 1.030 24.499 -20.305 1.00 22.41 C ATOM 2411 CE1 HIS A 148 2.029 25.780 -18.838 1.00 23.45 C ATOM 2412 NE2 HIS A 148 2.211 24.776 -19.667 1.00 61.53 N ATOM 0 H HIS A 148 -1.671 22.987 -20.141 1.00 60.12 H new ATOM 0 HA HIS A 148 -2.167 25.143 -18.183 1.00 50.54 H new ATOM 0 HB2 HIS A 148 -1.544 25.202 -21.183 1.00 3.11 H new ATOM 0 HB3 HIS A 148 -1.619 26.601 -20.130 1.00 3.11 H new ATOM 0 HD2 HIS A 148 0.866 23.727 -21.042 1.00 22.41 H new ATOM 0 HE1 HIS A 148 2.782 26.215 -18.198 1.00 23.45 H new ATOM 0 HE2 HIS A 148 3.091 24.282 -19.812 1.00 61.53 H new ATOM 2421 N HIS A 149 -4.459 23.924 -20.075 1.00 23.53 N ATOM 2422 CA HIS A 149 -5.913 23.926 -20.377 1.00 31.12 C ATOM 2423 C HIS A 149 -6.494 22.502 -20.261 1.00 11.42 C ATOM 2424 O HIS A 149 -5.849 21.512 -20.632 1.00 63.04 O ATOM 2425 CB HIS A 149 -6.209 24.555 -21.779 1.00 30.11 C ATOM 2426 CG HIS A 149 -5.493 23.908 -22.949 1.00 11.44 C ATOM 2427 ND1 HIS A 149 -5.767 22.630 -23.391 1.00 73.15 N ATOM 2428 CD2 HIS A 149 -4.518 24.374 -23.771 1.00 54.12 C ATOM 2429 CE1 HIS A 149 -5.002 22.341 -24.421 1.00 11.10 C ATOM 2430 NE2 HIS A 149 -4.234 23.378 -24.673 1.00 4.11 N ATOM 0 H HIS A 149 -4.004 23.035 -20.284 1.00 23.53 H new ATOM 0 HA HIS A 149 -6.409 24.553 -19.636 1.00 31.12 H new ATOM 0 HB2 HIS A 149 -7.283 24.506 -21.960 1.00 30.11 H new ATOM 0 HB3 HIS A 149 -5.939 25.611 -21.749 1.00 30.11 H new ATOM 0 HD2 HIS A 149 -4.052 25.347 -23.724 1.00 54.12 H new ATOM 0 HE1 HIS A 149 -5.004 21.409 -24.967 1.00 11.10 H new ATOM 0 HE2 HIS A 149 -3.540 23.434 -25.418 1.00 4.11 H new TER 2439 HIS A 149