USER MOD reduce.3.24.130724 H: found=0, std=0, add=1153, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1154 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: B 105 GLN :FLIP amide:sc= -0.193 F(o=-1.4,f=0.25) USER MOD Set 1.2: B 166 HIS : no HD1:sc= 0.439 K(o=0.25,f=-1.4) USER MOD Set 2.1: B 138 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: B 142 HIS : no HE2:sc= -0.215 K(o=-0.21,f=-3.1!) USER MOD Set 3.1: A 5 GLN : amide:sc= -5.04! C(o=-4!,f=-8!) USER MOD Set 3.2: B 116 LYS NZ :NH3+ 143:sc= 1.05 (180deg=-0.111) USER MOD Set 4.1: A 64 HIS : no HD1:sc= -0.542 X(o=-0.8,f=-0.62) USER MOD Set 4.2: B 164 HIS : no HE2:sc= -0.259 X(o=-0.8,f=-0.88) USER MOD Set 5.1: A 38 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 42 HIS : no HE2:sc= -1.76! C(o=-1.8!,f=-3.9!) USER MOD Single : A 1 MET CE :methyl -147:sc= -0.152 (180deg=-0.573) USER MOD Single : A 1 MET N :NH3+ -130:sc= 0.0433 (180deg=-0.00698) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.492 K(o=-0.49,f=-1.8) USER MOD Single : A 16 LYS NZ :NH3+ 157:sc= 0.552 (180deg=-0.162) USER MOD Single : A 27 SER OG : rot 86:sc= 0.0558 USER MOD Single : A 28 LYS NZ :NH3+ 155:sc= 0.214 (180deg=0.00401) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 137:sc= 0.328 (180deg=0.00397) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -120:sc= 1.26 (180deg=-0.272) USER MOD Single : A 50 GLN :FLIP amide:sc= -0.377 F(o=-1.1,f=-0.38) USER MOD Single : A 52 THR OG1 : rot -73:sc= 0.833 USER MOD Single : A 55 ASN :FLIP amide:sc=-0.00758 F(o=-1.6,f=-0.0076) USER MOD Single : A 57 HIS : no HD1:sc= -0.134 X(o=-0.13,f=-0.11) USER MOD Single : A 60 TYR OH : rot 142:sc= 0.0277 USER MOD Single : A 66 HIS : no HD1:sc= -0.277 K(o=-0.28,f=-1.1) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : B 101 MET CE :methyl -173:sc= -0.551 (180deg=-0.763) USER MOD Single : B 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 108 HIS : no HE2:sc= -0.503 X(o=-0.5,f=-0.91) USER MOD Single : B 127 SER OG : rot 180:sc= 0 USER MOD Single : B 128 LYS NZ :NH3+ 174:sc=-0.00173 (180deg=-0.0649) USER MOD Single : B 135 TYR OH : rot 180:sc= 0 USER MOD Single : B 137 SER OG : rot 180:sc= 0 USER MOD Single : B 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 148 LYS NZ :NH3+ 166:sc= 1.15 (180deg=0.975) USER MOD Single : B 150 GLN :FLIP amide:sc= -0.0103 F(o=-0.84,f=-0.01) USER MOD Single : B 152 THR OG1 : rot -77:sc= 0.659 USER MOD Single : B 155 ASN : amide:sc= -1.75! C(o=-1.7!,f=-2!) USER MOD Single : B 157 HIS : no HE2:sc= -0.0598 K(o=-0.06,f=-0.82) USER MOD Single : B 160 TYR OH : rot 136:sc= 0.413 USER MOD Single : B 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 172 SER OG : rot -35:sc= 0.115 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.326 -15.784 -7.215 1.00 44.00 N ATOM 2 CA MET A 1 17.363 -16.473 -8.111 1.00 41.03 C ATOM 3 C MET A 1 16.355 -15.452 -8.696 1.00 12.41 C ATOM 4 O MET A 1 16.175 -14.365 -8.130 1.00 12.11 O ATOM 5 CB MET A 1 16.596 -17.594 -7.337 1.00 40.54 C ATOM 6 CG MET A 1 17.478 -18.653 -6.663 1.00 61.11 C ATOM 7 SD MET A 1 16.512 -20.027 -5.985 1.00 51.32 S ATOM 8 CE MET A 1 15.339 -19.182 -4.910 1.00 73.15 C ATOM 0 H1 MET A 1 19.296 -16.054 -7.475 1.00 44.00 H new ATOM 0 H2 MET A 1 18.215 -14.755 -7.312 1.00 44.00 H new ATOM 0 H3 MET A 1 18.142 -16.060 -6.229 1.00 44.00 H new ATOM 0 HA MET A 1 17.921 -16.932 -8.927 1.00 41.03 H new ATOM 0 HB2 MET A 1 15.975 -17.125 -6.574 1.00 40.54 H new ATOM 0 HB3 MET A 1 15.923 -18.096 -8.032 1.00 40.54 H new ATOM 0 HG2 MET A 1 18.195 -19.039 -7.387 1.00 61.11 H new ATOM 0 HG3 MET A 1 18.053 -18.187 -5.863 1.00 61.11 H new ATOM 0 HE1 MET A 1 15.115 -19.812 -4.049 1.00 73.15 H new ATOM 0 HE2 MET A 1 15.771 -18.241 -4.568 1.00 73.15 H new ATOM 0 HE3 MET A 1 14.420 -18.980 -5.461 1.00 73.15 H new ATOM 20 N PRO A 2 15.676 -15.779 -9.849 1.00 0.43 N ATOM 21 CA PRO A 2 14.549 -14.968 -10.400 1.00 73.32 C ATOM 22 C PRO A 2 13.199 -15.243 -9.687 1.00 73.51 C ATOM 23 O PRO A 2 12.134 -15.160 -10.319 1.00 4.52 O ATOM 24 CB PRO A 2 14.501 -15.404 -11.905 1.00 1.11 C ATOM 25 CG PRO A 2 15.660 -16.347 -12.109 1.00 12.13 C ATOM 26 CD PRO A 2 15.982 -16.915 -10.752 1.00 33.42 C ATOM 0 HA PRO A 2 14.706 -13.899 -10.259 1.00 73.32 H new ATOM 0 HB2 PRO A 2 13.556 -15.894 -12.138 1.00 1.11 H new ATOM 0 HB3 PRO A 2 14.583 -14.539 -12.563 1.00 1.11 H new ATOM 0 HG2 PRO A 2 15.399 -17.139 -12.811 1.00 12.13 H new ATOM 0 HG3 PRO A 2 16.520 -15.823 -12.526 1.00 12.13 H new ATOM 0 HD2 PRO A 2 15.374 -17.790 -10.524 1.00 33.42 H new ATOM 0 HD3 PRO A 2 17.025 -17.223 -10.678 1.00 33.42 H new ATOM 34 N ASP A 3 13.252 -15.533 -8.368 1.00 52.03 N ATOM 35 CA ASP A 3 12.067 -15.896 -7.565 1.00 71.35 C ATOM 36 C ASP A 3 11.173 -14.659 -7.338 1.00 10.21 C ATOM 37 O ASP A 3 11.419 -13.824 -6.452 1.00 44.13 O ATOM 38 CB ASP A 3 12.489 -16.583 -6.223 1.00 13.12 C ATOM 39 CG ASP A 3 13.365 -15.714 -5.295 1.00 4.03 C ATOM 40 OD1 ASP A 3 14.515 -15.396 -5.666 1.00 70.15 O ATOM 41 OD2 ASP A 3 12.914 -15.345 -4.184 1.00 32.22 O ATOM 0 H ASP A 3 14.119 -15.521 -7.831 1.00 52.03 H new ATOM 0 HA ASP A 3 11.476 -16.626 -8.118 1.00 71.35 H new ATOM 0 HB2 ASP A 3 11.589 -16.873 -5.682 1.00 13.12 H new ATOM 0 HB3 ASP A 3 13.030 -17.500 -6.456 1.00 13.12 H new ATOM 46 N LYS A 4 10.141 -14.529 -8.193 1.00 23.44 N ATOM 47 CA LYS A 4 9.250 -13.369 -8.203 1.00 12.12 C ATOM 48 C LYS A 4 8.149 -13.518 -7.141 1.00 40.45 C ATOM 49 O LYS A 4 7.013 -13.899 -7.427 1.00 55.15 O ATOM 50 CB LYS A 4 8.675 -13.121 -9.620 1.00 22.04 C ATOM 51 CG LYS A 4 7.945 -11.760 -9.782 1.00 5.54 C ATOM 52 CD LYS A 4 7.534 -11.469 -11.244 1.00 4.41 C ATOM 53 CE LYS A 4 8.748 -11.356 -12.184 1.00 64.22 C ATOM 54 NZ LYS A 4 8.348 -11.079 -13.588 1.00 53.24 N ATOM 0 H LYS A 4 9.907 -15.231 -8.895 1.00 23.44 H new ATOM 0 HA LYS A 4 9.830 -12.484 -7.940 1.00 12.12 H new ATOM 0 HB2 LYS A 4 9.488 -13.173 -10.344 1.00 22.04 H new ATOM 0 HB3 LYS A 4 7.980 -13.925 -9.864 1.00 22.04 H new ATOM 0 HG2 LYS A 4 7.056 -11.753 -9.151 1.00 5.54 H new ATOM 0 HG3 LYS A 4 8.595 -10.960 -9.426 1.00 5.54 H new ATOM 0 HD2 LYS A 4 6.876 -12.263 -11.598 1.00 4.41 H new ATOM 0 HD3 LYS A 4 6.963 -10.542 -11.280 1.00 4.41 H new ATOM 0 HE2 LYS A 4 9.405 -10.561 -11.832 1.00 64.22 H new ATOM 0 HE3 LYS A 4 9.321 -12.283 -12.147 1.00 64.22 H new ATOM 0 HZ1 LYS A 4 9.198 -11.011 -14.184 1.00 53.24 H new ATOM 0 HZ2 LYS A 4 7.742 -11.850 -13.935 1.00 53.24 H new ATOM 0 HZ3 LYS A 4 7.824 -10.182 -13.629 1.00 53.24 H new ATOM 68 N GLN A 5 8.560 -13.287 -5.889 1.00 13.01 N ATOM 69 CA GLN A 5 7.642 -13.046 -4.757 1.00 11.32 C ATOM 70 C GLN A 5 7.031 -11.640 -4.879 1.00 73.52 C ATOM 71 O GLN A 5 6.023 -11.338 -4.242 1.00 23.23 O ATOM 72 CB GLN A 5 8.395 -13.222 -3.390 1.00 65.25 C ATOM 73 CG GLN A 5 9.832 -12.633 -3.340 1.00 74.52 C ATOM 74 CD GLN A 5 9.917 -11.109 -3.527 1.00 41.13 C ATOM 75 OE1 GLN A 5 10.838 -10.606 -4.160 1.00 41.52 O ATOM 76 NE2 GLN A 5 9.018 -10.356 -2.907 1.00 33.22 N ATOM 0 H GLN A 5 9.545 -13.261 -5.625 1.00 13.01 H new ATOM 0 HA GLN A 5 6.835 -13.779 -4.785 1.00 11.32 H new ATOM 0 HB2 GLN A 5 7.801 -12.754 -2.605 1.00 65.25 H new ATOM 0 HB3 GLN A 5 8.448 -14.286 -3.158 1.00 65.25 H new ATOM 0 HG2 GLN A 5 10.281 -12.892 -2.381 1.00 74.52 H new ATOM 0 HG3 GLN A 5 10.432 -13.113 -4.113 1.00 74.52 H new ATOM 0 HE21 GLN A 5 8.259 -10.794 -2.385 1.00 33.22 H new ATOM 0 HE22 GLN A 5 9.086 -9.339 -2.952 1.00 33.22 H new ATOM 85 N LEU A 6 7.736 -10.784 -5.663 1.00 41.22 N ATOM 86 CA LEU A 6 7.363 -9.399 -5.946 1.00 61.31 C ATOM 87 C LEU A 6 6.029 -9.392 -6.709 1.00 61.15 C ATOM 88 O LEU A 6 5.852 -10.135 -7.682 1.00 62.34 O ATOM 89 CB LEU A 6 8.529 -8.716 -6.743 1.00 44.05 C ATOM 90 CG LEU A 6 8.581 -7.145 -6.772 1.00 51.34 C ATOM 91 CD1 LEU A 6 9.901 -6.645 -7.397 1.00 61.23 C ATOM 92 CD2 LEU A 6 7.388 -6.524 -7.512 1.00 71.22 C ATOM 0 H LEU A 6 8.604 -11.060 -6.123 1.00 41.22 H new ATOM 0 HA LEU A 6 7.216 -8.826 -5.030 1.00 61.31 H new ATOM 0 HB2 LEU A 6 9.471 -9.074 -6.328 1.00 44.05 H new ATOM 0 HB3 LEU A 6 8.480 -9.068 -7.774 1.00 44.05 H new ATOM 0 HG LEU A 6 8.527 -6.821 -5.733 1.00 51.34 H new ATOM 0 HD11 LEU A 6 9.910 -5.555 -7.404 1.00 61.23 H new ATOM 0 HD12 LEU A 6 10.743 -7.011 -6.810 1.00 61.23 H new ATOM 0 HD13 LEU A 6 9.983 -7.015 -8.419 1.00 61.23 H new ATOM 0 HD21 LEU A 6 7.478 -5.438 -7.500 1.00 71.22 H new ATOM 0 HD22 LEU A 6 7.377 -6.876 -8.544 1.00 71.22 H new ATOM 0 HD23 LEU A 6 6.461 -6.817 -7.019 1.00 71.22 H new ATOM 104 N LEU A 7 5.114 -8.530 -6.265 1.00 63.10 N ATOM 105 CA LEU A 7 3.700 -8.643 -6.616 1.00 70.53 C ATOM 106 C LEU A 7 2.925 -7.356 -6.320 1.00 62.22 C ATOM 107 O LEU A 7 3.494 -6.347 -5.899 1.00 1.33 O ATOM 108 CB LEU A 7 3.084 -9.884 -5.877 1.00 54.42 C ATOM 109 CG LEU A 7 2.890 -9.860 -4.295 1.00 50.45 C ATOM 110 CD1 LEU A 7 3.899 -8.982 -3.527 1.00 2.21 C ATOM 111 CD2 LEU A 7 1.455 -9.519 -3.885 1.00 25.43 C ATOM 0 H LEU A 7 5.330 -7.740 -5.657 1.00 63.10 H new ATOM 0 HA LEU A 7 3.618 -8.795 -7.692 1.00 70.53 H new ATOM 0 HB2 LEU A 7 2.106 -10.071 -6.320 1.00 54.42 H new ATOM 0 HB3 LEU A 7 3.710 -10.744 -6.113 1.00 54.42 H new ATOM 0 HG LEU A 7 3.103 -10.886 -3.996 1.00 50.45 H new ATOM 0 HD11 LEU A 7 3.685 -9.031 -2.459 1.00 2.21 H new ATOM 0 HD12 LEU A 7 4.910 -9.344 -3.711 1.00 2.21 H new ATOM 0 HD13 LEU A 7 3.816 -7.950 -3.867 1.00 2.21 H new ATOM 0 HD21 LEU A 7 1.378 -9.516 -2.798 1.00 25.43 H new ATOM 0 HD22 LEU A 7 1.191 -8.534 -4.270 1.00 25.43 H new ATOM 0 HD23 LEU A 7 0.773 -10.264 -4.295 1.00 25.43 H new ATOM 123 N HIS A 8 1.609 -7.427 -6.549 1.00 33.44 N ATOM 124 CA HIS A 8 0.680 -6.317 -6.330 1.00 15.14 C ATOM 125 C HIS A 8 0.103 -6.395 -4.912 1.00 1.21 C ATOM 126 O HIS A 8 -0.770 -7.230 -4.652 1.00 51.33 O ATOM 127 CB HIS A 8 -0.460 -6.386 -7.373 1.00 72.31 C ATOM 128 CG HIS A 8 -0.020 -6.237 -8.807 1.00 71.13 C ATOM 129 ND1 HIS A 8 -0.909 -6.099 -9.844 1.00 12.23 N ATOM 130 CD2 HIS A 8 1.210 -6.225 -9.376 1.00 13.54 C ATOM 131 CE1 HIS A 8 -0.251 -6.015 -10.974 1.00 53.02 C ATOM 132 NE2 HIS A 8 1.033 -6.090 -10.718 1.00 11.21 N ATOM 0 H HIS A 8 1.154 -8.271 -6.897 1.00 33.44 H new ATOM 0 HA HIS A 8 1.210 -5.371 -6.442 1.00 15.14 H new ATOM 0 HB2 HIS A 8 -0.975 -7.340 -7.264 1.00 72.31 H new ATOM 0 HB3 HIS A 8 -1.186 -5.605 -7.148 1.00 72.31 H new ATOM 0 HD2 HIS A 8 2.155 -6.307 -8.860 1.00 13.54 H new ATOM 0 HE1 HIS A 8 -0.693 -5.903 -11.953 1.00 53.02 H new ATOM 0 HE2 HIS A 8 1.779 -6.053 -11.413 1.00 11.21 H new ATOM 141 N ILE A 9 0.612 -5.548 -3.992 1.00 1.21 N ATOM 142 CA ILE A 9 0.147 -5.527 -2.587 1.00 64.31 C ATOM 143 C ILE A 9 -1.308 -5.022 -2.511 1.00 42.32 C ATOM 144 O ILE A 9 -1.786 -4.332 -3.411 1.00 3.21 O ATOM 145 CB ILE A 9 1.068 -4.644 -1.660 1.00 24.11 C ATOM 146 CG1 ILE A 9 0.938 -3.128 -2.026 1.00 72.21 C ATOM 147 CG2 ILE A 9 2.541 -5.122 -1.729 1.00 2.35 C ATOM 148 CD1 ILE A 9 1.814 -2.172 -1.225 1.00 54.23 C ATOM 0 H ILE A 9 1.345 -4.869 -4.196 1.00 1.21 H new ATOM 0 HA ILE A 9 0.200 -6.552 -2.220 1.00 64.31 H new ATOM 0 HB ILE A 9 0.731 -4.763 -0.630 1.00 24.11 H new ATOM 0 HG12 ILE A 9 1.175 -3.008 -3.083 1.00 72.21 H new ATOM 0 HG13 ILE A 9 -0.103 -2.831 -1.897 1.00 72.21 H new ATOM 0 HG21 ILE A 9 3.157 -4.498 -1.081 1.00 2.35 H new ATOM 0 HG22 ILE A 9 2.603 -6.159 -1.399 1.00 2.35 H new ATOM 0 HG23 ILE A 9 2.901 -5.046 -2.755 1.00 2.35 H new ATOM 0 HD11 ILE A 9 1.641 -1.150 -1.563 1.00 54.23 H new ATOM 0 HD12 ILE A 9 1.565 -2.251 -0.167 1.00 54.23 H new ATOM 0 HD13 ILE A 9 2.863 -2.430 -1.371 1.00 54.23 H new ATOM 160 N VAL A 10 -1.985 -5.338 -1.413 1.00 15.40 N ATOM 161 CA VAL A 10 -3.441 -5.131 -1.267 1.00 71.45 C ATOM 162 C VAL A 10 -3.752 -4.117 -0.150 1.00 43.42 C ATOM 163 O VAL A 10 -3.163 -4.167 0.935 1.00 21.31 O ATOM 164 CB VAL A 10 -4.170 -6.511 -1.023 1.00 33.22 C ATOM 165 CG1 VAL A 10 -4.411 -7.238 -2.351 1.00 14.40 C ATOM 166 CG2 VAL A 10 -3.353 -7.422 -0.068 1.00 1.12 C ATOM 0 H VAL A 10 -1.547 -5.748 -0.588 1.00 15.40 H new ATOM 0 HA VAL A 10 -3.824 -4.708 -2.196 1.00 71.45 H new ATOM 0 HB VAL A 10 -5.130 -6.294 -0.554 1.00 33.22 H new ATOM 0 HG11 VAL A 10 -4.914 -8.186 -2.161 1.00 14.40 H new ATOM 0 HG12 VAL A 10 -5.035 -6.619 -2.996 1.00 14.40 H new ATOM 0 HG13 VAL A 10 -3.456 -7.426 -2.841 1.00 14.40 H new ATOM 0 HG21 VAL A 10 -3.883 -8.363 0.079 1.00 1.12 H new ATOM 0 HG22 VAL A 10 -2.374 -7.621 -0.504 1.00 1.12 H new ATOM 0 HG23 VAL A 10 -3.228 -6.923 0.893 1.00 1.12 H new ATOM 176 N VAL A 11 -4.703 -3.206 -0.443 1.00 62.42 N ATOM 177 CA VAL A 11 -5.079 -2.084 0.440 1.00 75.22 C ATOM 178 C VAL A 11 -6.572 -1.724 0.241 1.00 64.40 C ATOM 179 O VAL A 11 -7.141 -1.952 -0.834 1.00 74.11 O ATOM 180 CB VAL A 11 -4.165 -0.826 0.162 1.00 72.45 C ATOM 181 CG1 VAL A 11 -4.315 -0.319 -1.293 1.00 64.21 C ATOM 182 CG2 VAL A 11 -4.411 0.310 1.187 1.00 25.22 C ATOM 0 H VAL A 11 -5.238 -3.230 -1.311 1.00 62.42 H new ATOM 0 HA VAL A 11 -4.929 -2.392 1.475 1.00 75.22 H new ATOM 0 HB VAL A 11 -3.133 -1.153 0.289 1.00 72.45 H new ATOM 0 HG11 VAL A 11 -3.671 0.547 -1.445 1.00 64.21 H new ATOM 0 HG12 VAL A 11 -4.028 -1.110 -1.985 1.00 64.21 H new ATOM 0 HG13 VAL A 11 -5.352 -0.036 -1.475 1.00 64.21 H new ATOM 0 HG21 VAL A 11 -3.761 1.154 0.957 1.00 25.22 H new ATOM 0 HG22 VAL A 11 -5.452 0.628 1.134 1.00 25.22 H new ATOM 0 HG23 VAL A 11 -4.193 -0.053 2.191 1.00 25.22 H new ATOM 192 N GLY A 12 -7.193 -1.159 1.285 1.00 22.31 N ATOM 193 CA GLY A 12 -8.583 -0.729 1.235 1.00 62.50 C ATOM 194 C GLY A 12 -8.897 0.280 2.322 1.00 25.51 C ATOM 195 O GLY A 12 -8.051 1.115 2.652 1.00 65.42 O ATOM 0 H GLY A 12 -6.740 -0.991 2.183 1.00 22.31 H new ATOM 0 HA2 GLY A 12 -8.793 -0.290 0.260 1.00 62.50 H new ATOM 0 HA3 GLY A 12 -9.236 -1.595 1.343 1.00 62.50 H new ATOM 199 N GLY A 13 -10.107 0.193 2.890 1.00 55.00 N ATOM 200 CA GLY A 13 -10.590 1.152 3.895 1.00 2.21 C ATOM 201 C GLY A 13 -11.857 1.823 3.404 1.00 30.12 C ATOM 202 O GLY A 13 -12.389 1.419 2.357 1.00 42.00 O ATOM 0 H GLY A 13 -10.778 -0.542 2.667 1.00 55.00 H new ATOM 0 HA2 GLY A 13 -10.782 0.638 4.837 1.00 2.21 H new ATOM 0 HA3 GLY A 13 -9.824 1.902 4.092 1.00 2.21 H new ATOM 206 N GLU A 14 -12.354 2.845 4.124 1.00 41.13 N ATOM 207 CA GLU A 14 -13.595 3.543 3.737 1.00 74.14 C ATOM 208 C GLU A 14 -13.316 4.679 2.750 1.00 31.33 C ATOM 209 O GLU A 14 -12.330 5.426 2.868 1.00 22.04 O ATOM 210 CB GLU A 14 -14.405 4.064 4.958 1.00 50.40 C ATOM 211 CG GLU A 14 -15.245 2.971 5.661 1.00 12.24 C ATOM 212 CD GLU A 14 -16.398 3.535 6.514 1.00 53.02 C ATOM 213 OE1 GLU A 14 -16.125 4.170 7.544 1.00 23.41 O ATOM 214 OE2 GLU A 14 -17.588 3.335 6.149 1.00 32.12 O ATOM 0 H GLU A 14 -11.918 3.205 4.973 1.00 41.13 H new ATOM 0 HA GLU A 14 -14.215 2.797 3.240 1.00 74.14 H new ATOM 0 HB2 GLU A 14 -13.715 4.500 5.681 1.00 50.40 H new ATOM 0 HB3 GLU A 14 -15.069 4.863 4.628 1.00 50.40 H new ATOM 0 HG2 GLU A 14 -15.656 2.299 4.907 1.00 12.24 H new ATOM 0 HG3 GLU A 14 -14.591 2.375 6.297 1.00 12.24 H new ATOM 221 N LEU A 15 -14.208 4.757 1.767 1.00 44.30 N ATOM 222 CA LEU A 15 -14.228 5.774 0.717 1.00 5.32 C ATOM 223 C LEU A 15 -15.287 6.842 1.078 1.00 44.32 C ATOM 224 O LEU A 15 -16.156 6.602 1.925 1.00 23.32 O ATOM 225 CB LEU A 15 -14.566 5.090 -0.649 1.00 40.10 C ATOM 226 CG LEU A 15 -13.460 4.176 -1.302 1.00 32.21 C ATOM 227 CD1 LEU A 15 -12.166 4.947 -1.563 1.00 71.51 C ATOM 228 CD2 LEU A 15 -13.176 2.907 -0.483 1.00 72.53 C ATOM 0 H LEU A 15 -14.970 4.085 1.675 1.00 44.30 H new ATOM 0 HA LEU A 15 -13.256 6.259 0.631 1.00 5.32 H new ATOM 0 HB2 LEU A 15 -15.462 4.485 -0.509 1.00 40.10 H new ATOM 0 HB3 LEU A 15 -14.819 5.873 -1.363 1.00 40.10 H new ATOM 0 HG LEU A 15 -13.867 3.857 -2.261 1.00 32.21 H new ATOM 0 HD11 LEU A 15 -11.430 4.281 -2.013 1.00 71.51 H new ATOM 0 HD12 LEU A 15 -12.367 5.777 -2.241 1.00 71.51 H new ATOM 0 HD13 LEU A 15 -11.777 5.334 -0.621 1.00 71.51 H new ATOM 0 HD21 LEU A 15 -12.407 2.317 -0.981 1.00 72.53 H new ATOM 0 HD22 LEU A 15 -12.831 3.186 0.513 1.00 72.53 H new ATOM 0 HD23 LEU A 15 -14.088 2.316 -0.399 1.00 72.53 H new ATOM 240 N LYS A 16 -15.199 8.028 0.462 1.00 25.33 N ATOM 241 CA LYS A 16 -16.199 9.099 0.662 1.00 4.04 C ATOM 242 C LYS A 16 -17.545 8.709 0.025 1.00 74.24 C ATOM 243 O LYS A 16 -18.609 8.969 0.596 1.00 14.24 O ATOM 244 CB LYS A 16 -15.693 10.443 0.086 1.00 61.13 C ATOM 245 CG LYS A 16 -14.362 10.917 0.701 1.00 52.34 C ATOM 246 CD LYS A 16 -13.930 12.316 0.217 1.00 53.21 C ATOM 247 CE LYS A 16 -12.551 12.715 0.748 1.00 60.53 C ATOM 248 NZ LYS A 16 -12.189 14.116 0.405 1.00 11.42 N ATOM 0 H LYS A 16 -14.447 8.276 -0.181 1.00 25.33 H new ATOM 0 HA LYS A 16 -16.349 9.226 1.734 1.00 4.04 H new ATOM 0 HB2 LYS A 16 -15.570 10.343 -0.992 1.00 61.13 H new ATOM 0 HB3 LYS A 16 -16.452 11.208 0.250 1.00 61.13 H new ATOM 0 HG2 LYS A 16 -14.455 10.929 1.787 1.00 52.34 H new ATOM 0 HG3 LYS A 16 -13.580 10.198 0.456 1.00 52.34 H new ATOM 0 HD2 LYS A 16 -13.916 12.332 -0.873 1.00 53.21 H new ATOM 0 HD3 LYS A 16 -14.667 13.052 0.537 1.00 53.21 H new ATOM 0 HE2 LYS A 16 -12.534 12.594 1.831 1.00 60.53 H new ATOM 0 HE3 LYS A 16 -11.799 12.039 0.340 1.00 60.53 H new ATOM 0 HZ1 LYS A 16 -11.476 14.465 1.077 1.00 11.42 H new ATOM 0 HZ2 LYS A 16 -11.801 14.148 -0.559 1.00 11.42 H new ATOM 0 HZ3 LYS A 16 -13.037 14.716 0.457 1.00 11.42 H new ATOM 262 N ASP A 17 -17.488 8.079 -1.156 1.00 40.01 N ATOM 263 CA ASP A 17 -18.680 7.560 -1.857 1.00 62.13 C ATOM 264 C ASP A 17 -18.699 6.020 -1.772 1.00 31.00 C ATOM 265 O ASP A 17 -17.652 5.398 -1.591 1.00 71.55 O ATOM 266 CB ASP A 17 -18.669 8.050 -3.327 1.00 61.32 C ATOM 267 CG ASP A 17 -19.968 7.744 -4.098 1.00 43.42 C ATOM 268 OD1 ASP A 17 -20.916 8.557 -4.028 1.00 32.41 O ATOM 269 OD2 ASP A 17 -20.057 6.687 -4.758 1.00 54.44 O ATOM 0 H ASP A 17 -16.615 7.912 -1.657 1.00 40.01 H new ATOM 0 HA ASP A 17 -19.587 7.934 -1.383 1.00 62.13 H new ATOM 0 HB2 ASP A 17 -18.496 9.126 -3.340 1.00 61.32 H new ATOM 0 HB3 ASP A 17 -17.831 7.586 -3.848 1.00 61.32 H new ATOM 274 N VAL A 18 -19.898 5.419 -1.887 1.00 55.32 N ATOM 275 CA VAL A 18 -20.091 3.951 -1.789 1.00 45.12 C ATOM 276 C VAL A 18 -19.426 3.206 -2.966 1.00 1.35 C ATOM 277 O VAL A 18 -18.888 2.106 -2.794 1.00 44.43 O ATOM 278 CB VAL A 18 -21.619 3.572 -1.718 1.00 2.02 C ATOM 279 CG1 VAL A 18 -22.241 4.029 -0.379 1.00 42.12 C ATOM 280 CG2 VAL A 18 -22.418 4.142 -2.922 1.00 51.23 C ATOM 0 H VAL A 18 -20.764 5.933 -2.051 1.00 55.32 H new ATOM 0 HA VAL A 18 -19.608 3.637 -0.864 1.00 45.12 H new ATOM 0 HB VAL A 18 -21.683 2.485 -1.774 1.00 2.02 H new ATOM 0 HG11 VAL A 18 -23.296 3.755 -0.356 1.00 42.12 H new ATOM 0 HG12 VAL A 18 -21.722 3.544 0.448 1.00 42.12 H new ATOM 0 HG13 VAL A 18 -22.145 5.110 -0.283 1.00 42.12 H new ATOM 0 HG21 VAL A 18 -23.466 3.856 -2.831 1.00 51.23 H new ATOM 0 HG22 VAL A 18 -22.338 5.229 -2.930 1.00 51.23 H new ATOM 0 HG23 VAL A 18 -22.012 3.741 -3.851 1.00 51.23 H new ATOM 290 N ALA A 19 -19.509 3.813 -4.155 1.00 54.04 N ATOM 291 CA ALA A 19 -18.917 3.285 -5.403 1.00 23.12 C ATOM 292 C ALA A 19 -17.625 4.032 -5.772 1.00 62.40 C ATOM 293 O ALA A 19 -16.900 3.610 -6.688 1.00 63.25 O ATOM 294 CB ALA A 19 -19.942 3.410 -6.538 1.00 65.12 C ATOM 0 H ALA A 19 -19.996 4.700 -4.286 1.00 54.04 H new ATOM 0 HA ALA A 19 -18.659 2.237 -5.249 1.00 23.12 H new ATOM 0 HB1 ALA A 19 -19.512 3.022 -7.461 1.00 65.12 H new ATOM 0 HB2 ALA A 19 -20.835 2.838 -6.286 1.00 65.12 H new ATOM 0 HB3 ALA A 19 -20.208 4.458 -6.674 1.00 65.12 H new ATOM 300 N GLY A 20 -17.358 5.136 -5.052 1.00 40.55 N ATOM 301 CA GLY A 20 -16.221 6.017 -5.333 1.00 43.42 C ATOM 302 C GLY A 20 -14.859 5.420 -4.985 1.00 73.52 C ATOM 303 O GLY A 20 -14.779 4.333 -4.405 1.00 73.14 O ATOM 0 H GLY A 20 -17.926 5.438 -4.261 1.00 40.55 H new ATOM 0 HA2 GLY A 20 -16.231 6.276 -6.392 1.00 43.42 H new ATOM 0 HA3 GLY A 20 -16.350 6.945 -4.777 1.00 43.42 H new ATOM 307 N VAL A 21 -13.778 6.158 -5.321 1.00 3.24 N ATOM 308 CA VAL A 21 -12.393 5.683 -5.149 1.00 73.21 C ATOM 309 C VAL A 21 -11.506 6.794 -4.529 1.00 14.42 C ATOM 310 O VAL A 21 -10.266 6.763 -4.603 1.00 54.31 O ATOM 311 CB VAL A 21 -11.824 5.155 -6.519 1.00 54.25 C ATOM 312 CG1 VAL A 21 -11.510 6.302 -7.515 1.00 51.52 C ATOM 313 CG2 VAL A 21 -10.612 4.219 -6.294 1.00 62.01 C ATOM 0 H VAL A 21 -13.844 7.096 -5.717 1.00 3.24 H new ATOM 0 HA VAL A 21 -12.386 4.846 -4.451 1.00 73.21 H new ATOM 0 HB VAL A 21 -12.610 4.563 -6.989 1.00 54.25 H new ATOM 0 HG11 VAL A 21 -11.121 5.882 -8.442 1.00 51.52 H new ATOM 0 HG12 VAL A 21 -12.422 6.862 -7.725 1.00 51.52 H new ATOM 0 HG13 VAL A 21 -10.767 6.969 -7.079 1.00 51.52 H new ATOM 0 HG21 VAL A 21 -10.239 3.869 -7.257 1.00 62.01 H new ATOM 0 HG22 VAL A 21 -9.823 4.764 -5.775 1.00 62.01 H new ATOM 0 HG23 VAL A 21 -10.919 3.364 -5.691 1.00 62.01 H new ATOM 323 N GLU A 22 -12.160 7.748 -3.855 1.00 23.33 N ATOM 324 CA GLU A 22 -11.486 8.815 -3.097 1.00 42.34 C ATOM 325 C GLU A 22 -11.613 8.484 -1.597 1.00 3.21 C ATOM 326 O GLU A 22 -12.722 8.440 -1.061 1.00 1.44 O ATOM 327 CB GLU A 22 -12.047 10.238 -3.463 1.00 4.43 C ATOM 328 CG GLU A 22 -13.550 10.504 -3.200 1.00 45.33 C ATOM 329 CD GLU A 22 -14.489 9.724 -4.131 1.00 21.22 C ATOM 330 OE1 GLU A 22 -14.532 10.041 -5.336 1.00 34.22 O ATOM 331 OE2 GLU A 22 -15.176 8.785 -3.671 1.00 64.23 O ATOM 0 H GLU A 22 -13.178 7.804 -3.819 1.00 23.33 H new ATOM 0 HA GLU A 22 -10.430 8.856 -3.363 1.00 42.34 H new ATOM 0 HB2 GLU A 22 -11.472 10.979 -2.908 1.00 4.43 H new ATOM 0 HB3 GLU A 22 -11.855 10.413 -4.521 1.00 4.43 H new ATOM 0 HG2 GLU A 22 -13.780 10.244 -2.167 1.00 45.33 H new ATOM 0 HG3 GLU A 22 -13.746 11.570 -3.312 1.00 45.33 H new ATOM 338 N PHE A 23 -10.471 8.158 -0.940 1.00 2.23 N ATOM 339 CA PHE A 23 -10.460 7.711 0.469 1.00 73.43 C ATOM 340 C PHE A 23 -11.044 8.790 1.400 1.00 52.53 C ATOM 341 O PHE A 23 -10.693 9.967 1.287 1.00 51.31 O ATOM 342 CB PHE A 23 -9.026 7.339 0.944 1.00 61.23 C ATOM 343 CG PHE A 23 -8.382 6.163 0.204 1.00 22.45 C ATOM 344 CD1 PHE A 23 -9.014 4.917 0.163 1.00 64.43 C ATOM 345 CD2 PHE A 23 -7.135 6.286 -0.421 1.00 32.41 C ATOM 346 CE1 PHE A 23 -8.429 3.843 -0.484 1.00 54.42 C ATOM 347 CE2 PHE A 23 -6.552 5.209 -1.070 1.00 74.00 C ATOM 348 CZ PHE A 23 -7.199 3.989 -1.100 1.00 23.44 C ATOM 0 H PHE A 23 -9.546 8.198 -1.368 1.00 2.23 H new ATOM 0 HA PHE A 23 -11.085 6.819 0.520 1.00 73.43 H new ATOM 0 HB2 PHE A 23 -8.385 8.213 0.833 1.00 61.23 H new ATOM 0 HB3 PHE A 23 -9.062 7.103 2.008 1.00 61.23 H new ATOM 0 HD1 PHE A 23 -9.973 4.791 0.643 1.00 64.43 H new ATOM 0 HD2 PHE A 23 -6.620 7.235 -0.397 1.00 32.41 H new ATOM 0 HE1 PHE A 23 -8.934 2.889 -0.508 1.00 54.42 H new ATOM 0 HE2 PHE A 23 -5.592 5.324 -1.552 1.00 74.00 H new ATOM 0 HZ PHE A 23 -6.745 3.149 -1.604 1.00 23.44 H new ATOM 358 N ARG A 24 -11.937 8.355 2.303 1.00 70.54 N ATOM 359 CA ARG A 24 -12.565 9.213 3.325 1.00 52.05 C ATOM 360 C ARG A 24 -11.509 9.844 4.247 1.00 15.55 C ATOM 361 O ARG A 24 -11.448 11.071 4.400 1.00 63.43 O ATOM 362 CB ARG A 24 -13.577 8.371 4.153 1.00 12.41 C ATOM 363 CG ARG A 24 -14.168 9.093 5.386 1.00 63.25 C ATOM 364 CD ARG A 24 -15.173 8.229 6.148 1.00 12.45 C ATOM 365 NE ARG A 24 -15.673 8.904 7.356 1.00 33.32 N ATOM 366 CZ ARG A 24 -16.693 8.479 8.114 1.00 74.20 C ATOM 367 NH1 ARG A 24 -17.349 7.363 7.806 1.00 32.01 N ATOM 368 NH2 ARG A 24 -17.028 9.160 9.203 1.00 32.44 N ATOM 0 H ARG A 24 -12.249 7.385 2.346 1.00 70.54 H new ATOM 0 HA ARG A 24 -13.092 10.025 2.824 1.00 52.05 H new ATOM 0 HB2 ARG A 24 -14.396 8.068 3.500 1.00 12.41 H new ATOM 0 HB3 ARG A 24 -13.082 7.459 4.487 1.00 12.41 H new ATOM 0 HG2 ARG A 24 -13.358 9.379 6.057 1.00 63.25 H new ATOM 0 HG3 ARG A 24 -14.656 10.013 5.064 1.00 63.25 H new ATOM 0 HD2 ARG A 24 -16.011 7.986 5.495 1.00 12.45 H new ATOM 0 HD3 ARG A 24 -14.703 7.286 6.427 1.00 12.45 H new ATOM 0 HE ARG A 24 -15.205 9.765 7.639 1.00 33.32 H new ATOM 0 HH11 ARG A 24 -17.077 6.821 6.986 1.00 32.01 H new ATOM 0 HH12 ARG A 24 -18.124 7.049 8.390 1.00 32.01 H new ATOM 0 HH21 ARG A 24 -16.510 10.001 9.458 1.00 32.44 H new ATOM 0 HH22 ARG A 24 -17.803 8.842 9.785 1.00 32.44 H new ATOM 382 N ASP A 25 -10.673 8.973 4.820 1.00 12.35 N ATOM 383 CA ASP A 25 -9.672 9.339 5.823 1.00 64.43 C ATOM 384 C ASP A 25 -8.530 8.320 5.757 1.00 11.45 C ATOM 385 O ASP A 25 -8.765 7.105 5.791 1.00 12.14 O ATOM 386 CB ASP A 25 -10.328 9.391 7.236 1.00 22.24 C ATOM 387 CG ASP A 25 -9.380 9.723 8.410 1.00 42.31 C ATOM 388 OD1 ASP A 25 -8.291 10.299 8.193 1.00 40.32 O ATOM 389 OD2 ASP A 25 -9.736 9.403 9.570 1.00 51.42 O ATOM 0 H ASP A 25 -10.674 7.978 4.595 1.00 12.35 H new ATOM 0 HA ASP A 25 -9.268 10.331 5.623 1.00 64.43 H new ATOM 0 HB2 ASP A 25 -11.126 10.134 7.218 1.00 22.24 H new ATOM 0 HB3 ASP A 25 -10.795 8.426 7.434 1.00 22.24 H new ATOM 394 N LEU A 26 -7.302 8.838 5.654 1.00 74.40 N ATOM 395 CA LEU A 26 -6.082 8.041 5.511 1.00 43.11 C ATOM 396 C LEU A 26 -5.611 7.445 6.854 1.00 51.33 C ATOM 397 O LEU A 26 -4.572 6.782 6.914 1.00 22.54 O ATOM 398 CB LEU A 26 -4.985 8.920 4.854 1.00 20.54 C ATOM 399 CG LEU A 26 -5.283 9.419 3.397 1.00 40.10 C ATOM 400 CD1 LEU A 26 -5.690 8.256 2.486 1.00 32.31 C ATOM 401 CD2 LEU A 26 -6.310 10.573 3.342 1.00 73.52 C ATOM 0 H LEU A 26 -7.126 9.843 5.668 1.00 74.40 H new ATOM 0 HA LEU A 26 -6.293 7.186 4.868 1.00 43.11 H new ATOM 0 HB2 LEU A 26 -4.818 9.791 5.488 1.00 20.54 H new ATOM 0 HB3 LEU A 26 -4.054 8.353 4.839 1.00 20.54 H new ATOM 0 HG LEU A 26 -4.349 9.836 3.020 1.00 40.10 H new ATOM 0 HD11 LEU A 26 -5.890 8.632 1.483 1.00 32.31 H new ATOM 0 HD12 LEU A 26 -4.882 7.526 2.445 1.00 32.31 H new ATOM 0 HD13 LEU A 26 -6.588 7.781 2.881 1.00 32.31 H new ATOM 0 HD21 LEU A 26 -6.469 10.869 2.305 1.00 73.52 H new ATOM 0 HD22 LEU A 26 -7.254 10.241 3.774 1.00 73.52 H new ATOM 0 HD23 LEU A 26 -5.932 11.424 3.908 1.00 73.52 H new ATOM 413 N SER A 27 -6.382 7.696 7.921 1.00 22.04 N ATOM 414 CA SER A 27 -6.226 7.003 9.205 1.00 73.22 C ATOM 415 C SER A 27 -7.057 5.700 9.199 1.00 43.23 C ATOM 416 O SER A 27 -6.693 4.710 9.834 1.00 73.41 O ATOM 417 CB SER A 27 -6.695 7.931 10.351 1.00 34.13 C ATOM 418 OG SER A 27 -6.101 9.220 10.255 1.00 53.30 O ATOM 0 H SER A 27 -7.132 8.387 7.917 1.00 22.04 H new ATOM 0 HA SER A 27 -5.177 6.750 9.358 1.00 73.22 H new ATOM 0 HB2 SER A 27 -7.780 8.026 10.322 1.00 34.13 H new ATOM 0 HB3 SER A 27 -6.440 7.482 11.311 1.00 34.13 H new ATOM 0 HG SER A 27 -6.640 9.785 9.663 1.00 53.30 H new ATOM 424 N LYS A 28 -8.182 5.720 8.445 1.00 2.14 N ATOM 425 CA LYS A 28 -9.178 4.623 8.433 1.00 31.44 C ATOM 426 C LYS A 28 -8.955 3.670 7.249 1.00 43.10 C ATOM 427 O LYS A 28 -9.747 2.741 7.040 1.00 35.24 O ATOM 428 CB LYS A 28 -10.613 5.223 8.390 1.00 2.21 C ATOM 429 CG LYS A 28 -10.865 6.309 9.454 1.00 51.41 C ATOM 430 CD LYS A 28 -10.764 5.801 10.916 1.00 52.23 C ATOM 431 CE LYS A 28 -10.519 6.949 11.926 1.00 43.22 C ATOM 432 NZ LYS A 28 -11.484 8.080 11.776 1.00 61.13 N ATOM 0 H LYS A 28 -8.424 6.496 7.829 1.00 2.14 H new ATOM 0 HA LYS A 28 -9.057 4.039 9.345 1.00 31.44 H new ATOM 0 HB2 LYS A 28 -10.790 5.648 7.402 1.00 2.21 H new ATOM 0 HB3 LYS A 28 -11.337 4.420 8.526 1.00 2.21 H new ATOM 0 HG2 LYS A 28 -10.146 7.116 9.311 1.00 51.41 H new ATOM 0 HG3 LYS A 28 -11.856 6.734 9.296 1.00 51.41 H new ATOM 0 HD2 LYS A 28 -11.683 5.279 11.180 1.00 52.23 H new ATOM 0 HD3 LYS A 28 -9.953 5.076 10.990 1.00 52.23 H new ATOM 0 HE2 LYS A 28 -10.587 6.554 12.939 1.00 43.22 H new ATOM 0 HE3 LYS A 28 -9.504 7.326 11.799 1.00 43.22 H new ATOM 0 HZ1 LYS A 28 -11.566 8.589 12.679 1.00 61.13 H new ATOM 0 HZ2 LYS A 28 -11.143 8.732 11.041 1.00 61.13 H new ATOM 0 HZ3 LYS A 28 -12.416 7.707 11.503 1.00 61.13 H new ATOM 446 N VAL A 29 -7.881 3.907 6.470 1.00 24.11 N ATOM 447 CA VAL A 29 -7.499 3.020 5.363 1.00 33.51 C ATOM 448 C VAL A 29 -6.842 1.745 5.932 1.00 5.22 C ATOM 449 O VAL A 29 -5.882 1.811 6.708 1.00 63.32 O ATOM 450 CB VAL A 29 -6.574 3.727 4.294 1.00 71.34 C ATOM 451 CG1 VAL A 29 -7.335 4.876 3.601 1.00 32.25 C ATOM 452 CG2 VAL A 29 -5.250 4.231 4.905 1.00 73.23 C ATOM 0 H VAL A 29 -7.263 4.710 6.591 1.00 24.11 H new ATOM 0 HA VAL A 29 -8.407 2.748 4.824 1.00 33.51 H new ATOM 0 HB VAL A 29 -6.310 2.979 3.547 1.00 71.34 H new ATOM 0 HG11 VAL A 29 -6.685 5.353 2.868 1.00 32.25 H new ATOM 0 HG12 VAL A 29 -8.217 4.478 3.099 1.00 32.25 H new ATOM 0 HG13 VAL A 29 -7.642 5.610 4.346 1.00 32.25 H new ATOM 0 HG21 VAL A 29 -4.650 4.709 4.130 1.00 73.23 H new ATOM 0 HG22 VAL A 29 -5.465 4.952 5.694 1.00 73.23 H new ATOM 0 HG23 VAL A 29 -4.698 3.389 5.323 1.00 73.23 H new ATOM 462 N GLU A 30 -7.415 0.589 5.585 1.00 74.14 N ATOM 463 CA GLU A 30 -6.973 -0.708 6.089 1.00 75.20 C ATOM 464 C GLU A 30 -6.116 -1.404 5.029 1.00 32.54 C ATOM 465 O GLU A 30 -6.631 -1.863 3.999 1.00 32.10 O ATOM 466 CB GLU A 30 -8.190 -1.585 6.468 1.00 12.33 C ATOM 467 CG GLU A 30 -7.811 -2.958 7.069 1.00 54.13 C ATOM 468 CD GLU A 30 -9.021 -3.846 7.403 1.00 54.42 C ATOM 469 OE1 GLU A 30 -9.953 -3.369 8.070 1.00 33.10 O ATOM 470 OE2 GLU A 30 -9.041 -5.024 7.000 1.00 73.44 O ATOM 0 H GLU A 30 -8.204 0.530 4.942 1.00 74.14 H new ATOM 0 HA GLU A 30 -6.374 -0.557 6.987 1.00 75.20 H new ATOM 0 HB2 GLU A 30 -8.806 -1.043 7.185 1.00 12.33 H new ATOM 0 HB3 GLU A 30 -8.801 -1.745 5.580 1.00 12.33 H new ATOM 0 HG2 GLU A 30 -7.168 -3.487 6.366 1.00 54.13 H new ATOM 0 HG3 GLU A 30 -7.228 -2.798 7.976 1.00 54.13 H new ATOM 477 N PHE A 31 -4.804 -1.443 5.278 1.00 62.32 N ATOM 478 CA PHE A 31 -3.850 -2.187 4.456 1.00 62.44 C ATOM 479 C PHE A 31 -4.088 -3.683 4.675 1.00 1.23 C ATOM 480 O PHE A 31 -3.732 -4.223 5.731 1.00 15.14 O ATOM 481 CB PHE A 31 -2.392 -1.784 4.813 1.00 33.01 C ATOM 482 CG PHE A 31 -2.106 -0.303 4.567 1.00 25.10 C ATOM 483 CD1 PHE A 31 -2.474 0.668 5.503 1.00 42.35 C ATOM 484 CD2 PHE A 31 -1.500 0.119 3.386 1.00 4.23 C ATOM 485 CE1 PHE A 31 -2.246 2.005 5.259 1.00 50.32 C ATOM 486 CE2 PHE A 31 -1.275 1.458 3.146 1.00 74.23 C ATOM 487 CZ PHE A 31 -1.648 2.398 4.080 1.00 33.11 C ATOM 0 H PHE A 31 -4.372 -0.955 6.063 1.00 62.32 H new ATOM 0 HA PHE A 31 -3.997 -1.951 3.402 1.00 62.44 H new ATOM 0 HB2 PHE A 31 -2.203 -2.016 5.861 1.00 33.01 H new ATOM 0 HB3 PHE A 31 -1.700 -2.385 4.223 1.00 33.01 H new ATOM 0 HD1 PHE A 31 -2.943 0.367 6.428 1.00 42.35 H new ATOM 0 HD2 PHE A 31 -1.203 -0.612 2.649 1.00 4.23 H new ATOM 0 HE1 PHE A 31 -2.535 2.745 5.991 1.00 50.32 H new ATOM 0 HE2 PHE A 31 -0.806 1.770 2.225 1.00 74.23 H new ATOM 0 HZ PHE A 31 -1.472 3.446 3.889 1.00 33.11 H new ATOM 497 N VAL A 32 -4.761 -4.312 3.692 1.00 51.13 N ATOM 498 CA VAL A 32 -5.121 -5.744 3.715 1.00 63.00 C ATOM 499 C VAL A 32 -3.873 -6.608 3.974 1.00 65.14 C ATOM 500 O VAL A 32 -3.919 -7.588 4.728 1.00 21.13 O ATOM 501 CB VAL A 32 -5.799 -6.173 2.361 1.00 44.13 C ATOM 502 CG1 VAL A 32 -6.215 -7.665 2.359 1.00 30.24 C ATOM 503 CG2 VAL A 32 -6.998 -5.266 2.024 1.00 23.14 C ATOM 0 H VAL A 32 -5.074 -3.833 2.848 1.00 51.13 H new ATOM 0 HA VAL A 32 -5.834 -5.900 4.524 1.00 63.00 H new ATOM 0 HB VAL A 32 -5.048 -6.049 1.581 1.00 44.13 H new ATOM 0 HG11 VAL A 32 -6.678 -7.912 1.404 1.00 30.24 H new ATOM 0 HG12 VAL A 32 -5.333 -8.289 2.507 1.00 30.24 H new ATOM 0 HG13 VAL A 32 -6.927 -7.845 3.165 1.00 30.24 H new ATOM 0 HG21 VAL A 32 -7.445 -5.588 1.083 1.00 23.14 H new ATOM 0 HG22 VAL A 32 -7.740 -5.333 2.820 1.00 23.14 H new ATOM 0 HG23 VAL A 32 -6.659 -4.234 1.930 1.00 23.14 H new ATOM 513 N GLY A 33 -2.760 -6.198 3.346 1.00 40.11 N ATOM 514 CA GLY A 33 -1.454 -6.800 3.551 1.00 4.41 C ATOM 515 C GLY A 33 -0.721 -6.970 2.238 1.00 31.44 C ATOM 516 O GLY A 33 -0.761 -6.073 1.380 1.00 0.00 O ATOM 0 H GLY A 33 -2.753 -5.429 2.676 1.00 40.11 H new ATOM 0 HA2 GLY A 33 -0.864 -6.176 4.223 1.00 4.41 H new ATOM 0 HA3 GLY A 33 -1.569 -7.770 4.035 1.00 4.41 H new ATOM 520 N ALA A 34 -0.053 -8.111 2.089 1.00 31.42 N ATOM 521 CA ALA A 34 0.712 -8.470 0.890 1.00 24.12 C ATOM 522 C ALA A 34 1.001 -9.973 0.937 1.00 51.31 C ATOM 523 O ALA A 34 1.282 -10.521 2.008 1.00 70.32 O ATOM 524 CB ALA A 34 2.021 -7.668 0.808 1.00 44.01 C ATOM 0 H ALA A 34 -0.026 -8.830 2.812 1.00 31.42 H new ATOM 0 HA ALA A 34 0.131 -8.229 -0.000 1.00 24.12 H new ATOM 0 HB1 ALA A 34 2.568 -7.955 -0.090 1.00 44.01 H new ATOM 0 HB2 ALA A 34 1.793 -6.603 0.770 1.00 44.01 H new ATOM 0 HB3 ALA A 34 2.632 -7.877 1.686 1.00 44.01 H new ATOM 530 N TYR A 35 0.917 -10.635 -0.217 1.00 43.33 N ATOM 531 CA TYR A 35 1.123 -12.092 -0.338 1.00 41.22 C ATOM 532 C TYR A 35 2.441 -12.386 -1.085 1.00 44.41 C ATOM 533 O TYR A 35 2.985 -11.492 -1.708 1.00 60.24 O ATOM 534 CB TYR A 35 -0.093 -12.704 -1.073 1.00 14.12 C ATOM 535 CG TYR A 35 -1.382 -12.778 -0.232 1.00 24.54 C ATOM 536 CD1 TYR A 35 -2.122 -11.631 0.065 1.00 41.10 C ATOM 537 CD2 TYR A 35 -1.865 -14.001 0.248 1.00 24.13 C ATOM 538 CE1 TYR A 35 -3.280 -11.700 0.812 1.00 40.31 C ATOM 539 CE2 TYR A 35 -3.025 -14.073 0.989 1.00 1.13 C ATOM 540 CZ TYR A 35 -3.733 -12.921 1.267 1.00 62.15 C ATOM 541 OH TYR A 35 -4.903 -12.994 1.998 1.00 32.21 O ATOM 0 H TYR A 35 0.703 -10.179 -1.104 1.00 43.33 H new ATOM 0 HA TYR A 35 1.204 -12.544 0.651 1.00 41.22 H new ATOM 0 HB2 TYR A 35 -0.293 -12.116 -1.969 1.00 14.12 H new ATOM 0 HB3 TYR A 35 0.168 -13.710 -1.403 1.00 14.12 H new ATOM 0 HD1 TYR A 35 -1.781 -10.672 -0.297 1.00 41.10 H new ATOM 0 HD2 TYR A 35 -1.317 -14.907 0.033 1.00 24.13 H new ATOM 0 HE1 TYR A 35 -3.831 -10.800 1.040 1.00 40.31 H new ATOM 0 HE2 TYR A 35 -3.379 -15.027 1.351 1.00 1.13 H new ATOM 0 HH TYR A 35 -5.080 -13.927 2.240 1.00 32.21 H new ATOM 551 N PRO A 36 2.999 -13.640 -1.024 1.00 33.12 N ATOM 552 CA PRO A 36 4.241 -14.005 -1.774 1.00 23.03 C ATOM 553 C PRO A 36 4.044 -14.196 -3.299 1.00 51.33 C ATOM 554 O PRO A 36 4.964 -14.671 -3.974 1.00 54.24 O ATOM 555 CB PRO A 36 4.673 -15.332 -1.099 1.00 4.33 C ATOM 556 CG PRO A 36 3.389 -15.937 -0.612 1.00 2.41 C ATOM 557 CD PRO A 36 2.532 -14.771 -0.164 1.00 54.23 C ATOM 0 HA PRO A 36 4.979 -13.205 -1.722 1.00 23.03 H new ATOM 0 HB2 PRO A 36 5.180 -15.990 -1.804 1.00 4.33 H new ATOM 0 HB3 PRO A 36 5.365 -15.153 -0.276 1.00 4.33 H new ATOM 0 HG2 PRO A 36 2.898 -16.503 -1.403 1.00 2.41 H new ATOM 0 HG3 PRO A 36 3.569 -16.629 0.210 1.00 2.41 H new ATOM 0 HD2 PRO A 36 1.471 -14.974 -0.310 1.00 54.23 H new ATOM 0 HD3 PRO A 36 2.672 -14.554 0.895 1.00 54.23 H new ATOM 565 N SER A 37 2.865 -13.832 -3.840 1.00 62.10 N ATOM 566 CA SER A 37 2.574 -13.946 -5.281 1.00 62.43 C ATOM 567 C SER A 37 1.350 -13.086 -5.634 1.00 51.50 C ATOM 568 O SER A 37 0.516 -12.792 -4.762 1.00 24.25 O ATOM 569 CB SER A 37 2.345 -15.427 -5.682 1.00 41.41 C ATOM 570 OG SER A 37 2.378 -15.601 -7.088 1.00 4.32 O ATOM 0 H SER A 37 2.092 -13.453 -3.293 1.00 62.10 H new ATOM 0 HA SER A 37 3.433 -13.580 -5.844 1.00 62.43 H new ATOM 0 HB2 SER A 37 3.110 -16.051 -5.220 1.00 41.41 H new ATOM 0 HB3 SER A 37 1.383 -15.764 -5.296 1.00 41.41 H new ATOM 0 HG SER A 37 2.232 -16.546 -7.304 1.00 4.32 H new ATOM 576 N TYR A 38 1.258 -12.688 -6.926 1.00 52.40 N ATOM 577 CA TYR A 38 0.223 -11.770 -7.427 1.00 43.24 C ATOM 578 C TYR A 38 -1.187 -12.330 -7.204 1.00 24.04 C ATOM 579 O TYR A 38 -1.973 -11.687 -6.526 1.00 42.10 O ATOM 580 CB TYR A 38 0.463 -11.424 -8.931 1.00 63.21 C ATOM 581 CG TYR A 38 -0.641 -10.570 -9.618 1.00 62.21 C ATOM 582 CD1 TYR A 38 -1.379 -9.607 -8.913 1.00 30.15 C ATOM 583 CD2 TYR A 38 -0.952 -10.742 -10.971 1.00 64.02 C ATOM 584 CE1 TYR A 38 -2.370 -8.866 -9.523 1.00 71.44 C ATOM 585 CE2 TYR A 38 -1.948 -9.996 -11.583 1.00 44.55 C ATOM 586 CZ TYR A 38 -2.651 -9.059 -10.855 1.00 13.25 C ATOM 587 OH TYR A 38 -3.640 -8.308 -11.458 1.00 53.42 O ATOM 0 H TYR A 38 1.907 -13.000 -7.649 1.00 52.40 H new ATOM 0 HA TYR A 38 0.298 -10.846 -6.853 1.00 43.24 H new ATOM 0 HB2 TYR A 38 1.411 -10.892 -9.014 1.00 63.21 H new ATOM 0 HB3 TYR A 38 0.571 -12.356 -9.485 1.00 63.21 H new ATOM 0 HD1 TYR A 38 -1.166 -9.442 -7.867 1.00 30.15 H new ATOM 0 HD2 TYR A 38 -0.405 -11.471 -11.551 1.00 64.02 H new ATOM 0 HE1 TYR A 38 -2.925 -8.134 -8.954 1.00 71.44 H new ATOM 0 HE2 TYR A 38 -2.173 -10.149 -12.628 1.00 44.55 H new ATOM 0 HH TYR A 38 -3.715 -8.563 -12.401 1.00 53.42 H new ATOM 597 N ASP A 39 -1.484 -13.518 -7.769 1.00 55.24 N ATOM 598 CA ASP A 39 -2.851 -14.093 -7.761 1.00 2.24 C ATOM 599 C ASP A 39 -3.356 -14.389 -6.333 1.00 5.42 C ATOM 600 O ASP A 39 -4.569 -14.414 -6.091 1.00 34.54 O ATOM 601 CB ASP A 39 -2.914 -15.356 -8.658 1.00 12.03 C ATOM 602 CG ASP A 39 -4.340 -15.896 -8.880 1.00 3.23 C ATOM 603 OD1 ASP A 39 -5.186 -15.153 -9.427 1.00 41.20 O ATOM 604 OD2 ASP A 39 -4.621 -17.055 -8.517 1.00 23.23 O ATOM 0 H ASP A 39 -0.794 -14.103 -8.240 1.00 55.24 H new ATOM 0 HA ASP A 39 -3.523 -13.342 -8.175 1.00 2.24 H new ATOM 0 HB2 ASP A 39 -2.469 -15.124 -9.626 1.00 12.03 H new ATOM 0 HB3 ASP A 39 -2.306 -16.140 -8.207 1.00 12.03 H new ATOM 609 N GLU A 40 -2.413 -14.566 -5.394 1.00 4.54 N ATOM 610 CA GLU A 40 -2.717 -14.756 -3.970 1.00 71.23 C ATOM 611 C GLU A 40 -3.306 -13.452 -3.365 1.00 44.15 C ATOM 612 O GLU A 40 -4.271 -13.492 -2.589 1.00 43.21 O ATOM 613 CB GLU A 40 -1.431 -15.166 -3.216 1.00 51.03 C ATOM 614 CG GLU A 40 -0.699 -16.407 -3.767 1.00 2.02 C ATOM 615 CD GLU A 40 -1.487 -17.720 -3.623 1.00 33.52 C ATOM 616 OE1 GLU A 40 -1.454 -18.330 -2.533 1.00 51.11 O ATOM 617 OE2 GLU A 40 -2.141 -18.152 -4.593 1.00 73.34 O ATOM 0 H GLU A 40 -1.415 -14.581 -5.604 1.00 4.54 H new ATOM 0 HA GLU A 40 -3.459 -15.548 -3.866 1.00 71.23 H new ATOM 0 HB2 GLU A 40 -0.740 -14.323 -3.230 1.00 51.03 H new ATOM 0 HB3 GLU A 40 -1.687 -15.351 -2.173 1.00 51.03 H new ATOM 0 HG2 GLU A 40 -0.475 -16.245 -4.821 1.00 2.02 H new ATOM 0 HG3 GLU A 40 0.255 -16.511 -3.251 1.00 2.02 H new ATOM 624 N ALA A 41 -2.706 -12.296 -3.734 1.00 42.32 N ATOM 625 CA ALA A 41 -3.170 -10.967 -3.296 1.00 4.02 C ATOM 626 C ALA A 41 -4.390 -10.526 -4.115 1.00 14.13 C ATOM 627 O ALA A 41 -5.309 -9.895 -3.592 1.00 1.30 O ATOM 628 CB ALA A 41 -2.030 -9.957 -3.431 1.00 55.35 C ATOM 0 H ALA A 41 -1.888 -12.263 -4.343 1.00 42.32 H new ATOM 0 HA ALA A 41 -3.472 -11.020 -2.250 1.00 4.02 H new ATOM 0 HB1 ALA A 41 -2.374 -8.975 -3.107 1.00 55.35 H new ATOM 0 HB2 ALA A 41 -1.191 -10.271 -2.810 1.00 55.35 H new ATOM 0 HB3 ALA A 41 -1.712 -9.905 -4.472 1.00 55.35 H new ATOM 634 N HIS A 42 -4.398 -10.926 -5.392 1.00 13.32 N ATOM 635 CA HIS A 42 -5.471 -10.622 -6.346 1.00 1.52 C ATOM 636 C HIS A 42 -6.783 -11.267 -5.874 1.00 70.15 C ATOM 637 O HIS A 42 -7.866 -10.803 -6.203 1.00 5.24 O ATOM 638 CB HIS A 42 -5.070 -11.133 -7.763 1.00 75.14 C ATOM 639 CG HIS A 42 -5.909 -10.630 -8.913 1.00 64.03 C ATOM 640 ND1 HIS A 42 -5.782 -11.116 -10.191 1.00 12.11 N ATOM 641 CD2 HIS A 42 -6.812 -9.625 -8.994 1.00 64.32 C ATOM 642 CE1 HIS A 42 -6.550 -10.429 -11.001 1.00 2.31 C ATOM 643 NE2 HIS A 42 -7.183 -9.513 -10.301 1.00 21.33 N ATOM 0 H HIS A 42 -3.645 -11.480 -5.799 1.00 13.32 H new ATOM 0 HA HIS A 42 -5.623 -9.544 -6.400 1.00 1.52 H new ATOM 0 HB2 HIS A 42 -4.033 -10.854 -7.947 1.00 75.14 H new ATOM 0 HB3 HIS A 42 -5.111 -12.222 -7.759 1.00 75.14 H new ATOM 0 HD1 HIS A 42 -5.182 -11.893 -10.468 1.00 12.11 H new ATOM 0 HD2 HIS A 42 -7.173 -9.022 -8.174 1.00 64.32 H new ATOM 0 HE1 HIS A 42 -6.647 -10.588 -12.065 1.00 2.31 H new ATOM 652 N LYS A 43 -6.642 -12.342 -5.090 1.00 72.04 N ATOM 653 CA LYS A 43 -7.753 -13.080 -4.506 1.00 24.01 C ATOM 654 C LYS A 43 -8.283 -12.353 -3.258 1.00 34.11 C ATOM 655 O LYS A 43 -9.497 -12.336 -3.012 1.00 3.30 O ATOM 656 CB LYS A 43 -7.278 -14.516 -4.143 1.00 74.04 C ATOM 657 CG LYS A 43 -8.354 -15.599 -4.323 1.00 52.10 C ATOM 658 CD LYS A 43 -8.724 -15.805 -5.820 1.00 3.20 C ATOM 659 CE LYS A 43 -7.506 -16.253 -6.666 1.00 55.13 C ATOM 660 NZ LYS A 43 -7.786 -16.278 -8.121 1.00 11.52 N ATOM 0 H LYS A 43 -5.730 -12.726 -4.842 1.00 72.04 H new ATOM 0 HA LYS A 43 -8.566 -13.143 -5.229 1.00 24.01 H new ATOM 0 HB2 LYS A 43 -6.417 -14.769 -4.761 1.00 74.04 H new ATOM 0 HB3 LYS A 43 -6.940 -14.524 -3.107 1.00 74.04 H new ATOM 0 HG2 LYS A 43 -7.996 -16.540 -3.905 1.00 52.10 H new ATOM 0 HG3 LYS A 43 -9.247 -15.320 -3.763 1.00 52.10 H new ATOM 0 HD2 LYS A 43 -9.513 -16.552 -5.898 1.00 3.20 H new ATOM 0 HD3 LYS A 43 -9.124 -14.875 -6.225 1.00 3.20 H new ATOM 0 HE2 LYS A 43 -6.671 -15.579 -6.474 1.00 55.13 H new ATOM 0 HE3 LYS A 43 -7.194 -17.247 -6.345 1.00 55.13 H new ATOM 0 HZ1 LYS A 43 -6.981 -15.868 -8.636 1.00 11.52 H new ATOM 0 HZ2 LYS A 43 -7.931 -17.260 -8.430 1.00 11.52 H new ATOM 0 HZ3 LYS A 43 -8.643 -15.723 -8.319 1.00 11.52 H new ATOM 674 N ALA A 44 -7.342 -11.756 -2.486 1.00 24.12 N ATOM 675 CA ALA A 44 -7.638 -11.069 -1.219 1.00 11.31 C ATOM 676 C ALA A 44 -8.555 -9.853 -1.415 1.00 52.22 C ATOM 677 O ALA A 44 -9.254 -9.463 -0.484 1.00 71.42 O ATOM 678 CB ALA A 44 -6.338 -10.642 -0.536 1.00 42.33 C ATOM 0 H ALA A 44 -6.352 -11.741 -2.733 1.00 24.12 H new ATOM 0 HA ALA A 44 -8.170 -11.777 -0.584 1.00 11.31 H new ATOM 0 HB1 ALA A 44 -6.569 -10.135 0.401 1.00 42.33 H new ATOM 0 HB2 ALA A 44 -5.728 -11.522 -0.331 1.00 42.33 H new ATOM 0 HB3 ALA A 44 -5.789 -9.965 -1.190 1.00 42.33 H new ATOM 684 N TRP A 45 -8.515 -9.261 -2.633 1.00 2.31 N ATOM 685 CA TRP A 45 -9.427 -8.181 -3.062 1.00 13.21 C ATOM 686 C TRP A 45 -10.906 -8.590 -2.785 1.00 65.13 C ATOM 687 O TRP A 45 -11.641 -7.882 -2.091 1.00 2.31 O ATOM 688 CB TRP A 45 -9.153 -7.837 -4.595 1.00 63.52 C ATOM 689 CG TRP A 45 -10.402 -7.611 -5.445 1.00 50.15 C ATOM 690 CD1 TRP A 45 -11.144 -6.462 -5.568 1.00 44.43 C ATOM 691 CD2 TRP A 45 -11.052 -8.593 -6.284 1.00 21.33 C ATOM 692 NE1 TRP A 45 -12.232 -6.693 -6.379 1.00 34.43 N ATOM 693 CE2 TRP A 45 -12.197 -7.987 -6.831 1.00 11.31 C ATOM 694 CE3 TRP A 45 -10.776 -9.928 -6.613 1.00 62.11 C ATOM 695 CZ2 TRP A 45 -13.081 -8.676 -7.662 1.00 23.45 C ATOM 696 CZ3 TRP A 45 -11.647 -10.612 -7.437 1.00 11.31 C ATOM 697 CH2 TRP A 45 -12.785 -9.984 -7.956 1.00 35.53 C ATOM 0 H TRP A 45 -7.840 -9.525 -3.351 1.00 2.31 H new ATOM 0 HA TRP A 45 -9.241 -7.274 -2.487 1.00 13.21 H new ATOM 0 HB2 TRP A 45 -8.533 -6.942 -4.645 1.00 63.52 H new ATOM 0 HB3 TRP A 45 -8.576 -8.650 -5.035 1.00 63.52 H new ATOM 0 HD1 TRP A 45 -10.909 -5.518 -5.099 1.00 44.43 H new ATOM 0 HE1 TRP A 45 -12.952 -6.008 -6.608 1.00 34.43 H new ATOM 0 HE3 TRP A 45 -9.893 -10.415 -6.226 1.00 62.11 H new ATOM 0 HZ2 TRP A 45 -13.965 -8.198 -8.059 1.00 23.45 H new ATOM 0 HZ3 TRP A 45 -11.448 -11.644 -7.684 1.00 11.31 H new ATOM 0 HH2 TRP A 45 -13.446 -10.542 -8.603 1.00 35.53 H new ATOM 708 N LYS A 46 -11.297 -9.766 -3.313 1.00 71.24 N ATOM 709 CA LYS A 46 -12.675 -10.292 -3.204 1.00 44.40 C ATOM 710 C LYS A 46 -12.919 -10.935 -1.837 1.00 30.12 C ATOM 711 O LYS A 46 -14.033 -10.860 -1.317 1.00 2.44 O ATOM 712 CB LYS A 46 -12.941 -11.307 -4.334 1.00 3.34 C ATOM 713 CG LYS A 46 -14.339 -11.960 -4.352 1.00 35.33 C ATOM 714 CD LYS A 46 -14.438 -13.120 -5.371 1.00 42.14 C ATOM 715 CE LYS A 46 -13.498 -14.294 -5.024 1.00 3.34 C ATOM 716 NZ LYS A 46 -13.640 -15.423 -5.982 1.00 34.34 N ATOM 0 H LYS A 46 -10.666 -10.380 -3.828 1.00 71.24 H new ATOM 0 HA LYS A 46 -13.368 -9.457 -3.304 1.00 44.40 H new ATOM 0 HB2 LYS A 46 -12.786 -10.804 -5.289 1.00 3.34 H new ATOM 0 HB3 LYS A 46 -12.195 -12.098 -4.266 1.00 3.34 H new ATOM 0 HG2 LYS A 46 -14.574 -12.335 -3.356 1.00 35.33 H new ATOM 0 HG3 LYS A 46 -15.086 -11.204 -4.593 1.00 35.33 H new ATOM 0 HD2 LYS A 46 -15.466 -13.481 -5.407 1.00 42.14 H new ATOM 0 HD3 LYS A 46 -14.196 -12.747 -6.366 1.00 42.14 H new ATOM 0 HE2 LYS A 46 -12.466 -13.945 -5.026 1.00 3.34 H new ATOM 0 HE3 LYS A 46 -13.714 -14.645 -4.015 1.00 3.34 H new ATOM 0 HZ1 LYS A 46 -12.991 -16.190 -5.713 1.00 34.34 H new ATOM 0 HZ2 LYS A 46 -14.619 -15.774 -5.962 1.00 34.34 H new ATOM 0 HZ3 LYS A 46 -13.409 -15.095 -6.942 1.00 34.34 H new ATOM 730 N ALA A 47 -11.872 -11.554 -1.255 1.00 44.12 N ATOM 731 CA ALA A 47 -11.957 -12.165 0.083 1.00 41.02 C ATOM 732 C ALA A 47 -12.345 -11.108 1.139 1.00 35.22 C ATOM 733 O ALA A 47 -13.040 -11.406 2.107 1.00 65.04 O ATOM 734 CB ALA A 47 -10.627 -12.853 0.444 1.00 41.02 C ATOM 0 H ALA A 47 -10.956 -11.643 -1.694 1.00 44.12 H new ATOM 0 HA ALA A 47 -12.738 -12.926 0.071 1.00 41.02 H new ATOM 0 HB1 ALA A 47 -10.706 -13.300 1.435 1.00 41.02 H new ATOM 0 HB2 ALA A 47 -10.409 -13.631 -0.288 1.00 41.02 H new ATOM 0 HB3 ALA A 47 -9.824 -12.116 0.441 1.00 41.02 H new ATOM 740 N LYS A 48 -11.902 -9.862 0.909 1.00 23.15 N ATOM 741 CA LYS A 48 -12.236 -8.714 1.748 1.00 51.33 C ATOM 742 C LYS A 48 -13.597 -8.125 1.372 1.00 50.30 C ATOM 743 O LYS A 48 -14.428 -7.907 2.247 1.00 51.24 O ATOM 744 CB LYS A 48 -11.128 -7.647 1.620 1.00 45.03 C ATOM 745 CG LYS A 48 -9.809 -8.010 2.325 1.00 34.34 C ATOM 746 CD LYS A 48 -9.977 -8.226 3.846 1.00 14.32 C ATOM 747 CE LYS A 48 -10.524 -6.983 4.558 1.00 21.14 C ATOM 748 NZ LYS A 48 -10.553 -7.154 6.029 1.00 42.43 N ATOM 0 H LYS A 48 -11.295 -9.627 0.124 1.00 23.15 H new ATOM 0 HA LYS A 48 -12.301 -9.047 2.784 1.00 51.33 H new ATOM 0 HB2 LYS A 48 -10.925 -7.477 0.563 1.00 45.03 H new ATOM 0 HB3 LYS A 48 -11.497 -6.707 2.029 1.00 45.03 H new ATOM 0 HG2 LYS A 48 -9.402 -8.917 1.878 1.00 34.34 H new ATOM 0 HG3 LYS A 48 -9.082 -7.216 2.154 1.00 34.34 H new ATOM 0 HD2 LYS A 48 -10.650 -9.066 4.018 1.00 14.32 H new ATOM 0 HD3 LYS A 48 -9.014 -8.495 4.280 1.00 14.32 H new ATOM 0 HE2 LYS A 48 -9.908 -6.120 4.305 1.00 21.14 H new ATOM 0 HE3 LYS A 48 -11.531 -6.772 4.198 1.00 21.14 H new ATOM 0 HZ1 LYS A 48 -11.531 -7.059 6.370 1.00 42.43 H new ATOM 0 HZ2 LYS A 48 -10.190 -8.097 6.276 1.00 42.43 H new ATOM 0 HZ3 LYS A 48 -9.958 -6.427 6.475 1.00 42.43 H new ATOM 762 N ALA A 49 -13.809 -7.892 0.064 1.00 44.33 N ATOM 763 CA ALA A 49 -15.034 -7.247 -0.467 1.00 62.21 C ATOM 764 C ALA A 49 -16.315 -8.013 -0.062 1.00 20.13 C ATOM 765 O ALA A 49 -17.344 -7.398 0.250 1.00 55.13 O ATOM 766 CB ALA A 49 -14.931 -7.127 -1.991 1.00 52.11 C ATOM 0 H ALA A 49 -13.137 -8.145 -0.660 1.00 44.33 H new ATOM 0 HA ALA A 49 -15.110 -6.252 -0.029 1.00 62.21 H new ATOM 0 HB1 ALA A 49 -15.832 -6.653 -2.380 1.00 52.11 H new ATOM 0 HB2 ALA A 49 -14.062 -6.523 -2.250 1.00 52.11 H new ATOM 0 HB3 ALA A 49 -14.826 -8.120 -2.428 1.00 52.11 H new ATOM 772 N GLN A 50 -16.219 -9.351 -0.057 1.00 23.30 N ATOM 773 CA GLN A 50 -17.295 -10.242 0.398 1.00 45.20 C ATOM 774 C GLN A 50 -17.454 -10.157 1.929 1.00 54.31 C ATOM 775 O GLN A 50 -18.577 -10.076 2.444 1.00 71.41 O ATOM 776 CB GLN A 50 -17.004 -11.711 -0.022 1.00 31.12 C ATOM 777 CG GLN A 50 -16.999 -11.970 -1.546 1.00 24.24 C ATOM 778 CD GLN A 50 -16.580 -13.399 -1.938 1.00 0.33 C ATOM 779 OE1 GLN A 50 -15.658 -13.995 -1.193 1.00 33.11 O flip ATOM 780 NE2 GLN A 50 -17.049 -13.950 -2.938 1.00 75.31 N flip ATOM 0 H GLN A 50 -15.386 -9.848 -0.371 1.00 23.30 H new ATOM 0 HA GLN A 50 -18.224 -9.920 -0.072 1.00 45.20 H new ATOM 0 HB2 GLN A 50 -16.035 -12.003 0.383 1.00 31.12 H new ATOM 0 HB3 GLN A 50 -17.750 -12.358 0.438 1.00 31.12 H new ATOM 0 HG2 GLN A 50 -17.996 -11.774 -1.941 1.00 24.24 H new ATOM 0 HG3 GLN A 50 -16.322 -11.261 -2.022 1.00 24.24 H new ATOM 0 HE21 GLN A 50 -17.757 -13.475 -3.497 1.00 75.31 H new ATOM 0 HE22 GLN A 50 -16.728 -14.881 -3.205 1.00 75.31 H new ATOM 789 N ALA A 51 -16.310 -10.149 2.639 1.00 25.43 N ATOM 790 CA ALA A 51 -16.270 -10.231 4.116 1.00 25.04 C ATOM 791 C ALA A 51 -16.814 -8.954 4.776 1.00 21.31 C ATOM 792 O ALA A 51 -17.494 -9.017 5.814 1.00 11.44 O ATOM 793 CB ALA A 51 -14.835 -10.515 4.577 1.00 74.54 C ATOM 0 H ALA A 51 -15.388 -10.086 2.208 1.00 25.43 H new ATOM 0 HA ALA A 51 -16.918 -11.050 4.429 1.00 25.04 H new ATOM 0 HB1 ALA A 51 -14.808 -10.575 5.665 1.00 74.54 H new ATOM 0 HB2 ALA A 51 -14.497 -11.460 4.153 1.00 74.54 H new ATOM 0 HB3 ALA A 51 -14.179 -9.712 4.241 1.00 74.54 H new ATOM 799 N THR A 52 -16.541 -7.804 4.145 1.00 75.02 N ATOM 800 CA THR A 52 -16.858 -6.492 4.701 1.00 4.33 C ATOM 801 C THR A 52 -18.245 -6.032 4.242 1.00 12.13 C ATOM 802 O THR A 52 -18.398 -5.321 3.247 1.00 32.23 O ATOM 803 CB THR A 52 -15.741 -5.458 4.356 1.00 63.04 C ATOM 804 OG1 THR A 52 -15.565 -5.366 2.930 1.00 23.23 O ATOM 805 CG2 THR A 52 -14.410 -5.864 5.015 1.00 14.53 C ATOM 0 H THR A 52 -16.092 -7.763 3.230 1.00 75.02 H new ATOM 0 HA THR A 52 -16.891 -6.569 5.788 1.00 4.33 H new ATOM 0 HB THR A 52 -16.047 -4.485 4.741 1.00 63.04 H new ATOM 0 HG1 THR A 52 -15.116 -6.173 2.603 1.00 23.23 H new ATOM 0 HG21 THR A 52 -13.642 -5.132 4.764 1.00 14.53 H new ATOM 0 HG22 THR A 52 -14.536 -5.901 6.097 1.00 14.53 H new ATOM 0 HG23 THR A 52 -14.108 -6.846 4.651 1.00 14.53 H new ATOM 813 N VAL A 53 -19.259 -6.555 4.940 1.00 60.02 N ATOM 814 CA VAL A 53 -20.661 -6.123 4.812 1.00 33.32 C ATOM 815 C VAL A 53 -20.966 -5.095 5.918 1.00 25.14 C ATOM 816 O VAL A 53 -21.695 -4.114 5.705 1.00 45.53 O ATOM 817 CB VAL A 53 -21.636 -7.355 4.936 1.00 45.32 C ATOM 818 CG1 VAL A 53 -23.115 -6.942 4.748 1.00 42.15 C ATOM 819 CG2 VAL A 53 -21.243 -8.473 3.944 1.00 5.34 C ATOM 0 H VAL A 53 -19.130 -7.303 5.622 1.00 60.02 H new ATOM 0 HA VAL A 53 -20.811 -5.671 3.832 1.00 33.32 H new ATOM 0 HB VAL A 53 -21.536 -7.746 5.949 1.00 45.32 H new ATOM 0 HG11 VAL A 53 -23.753 -7.821 4.841 1.00 42.15 H new ATOM 0 HG12 VAL A 53 -23.389 -6.213 5.510 1.00 42.15 H new ATOM 0 HG13 VAL A 53 -23.247 -6.501 3.760 1.00 42.15 H new ATOM 0 HG21 VAL A 53 -21.931 -9.312 4.050 1.00 5.34 H new ATOM 0 HG22 VAL A 53 -21.292 -8.089 2.925 1.00 5.34 H new ATOM 0 HG23 VAL A 53 -20.228 -8.808 4.157 1.00 5.34 H new ATOM 829 N ASP A 54 -20.361 -5.354 7.091 1.00 4.13 N ATOM 830 CA ASP A 54 -20.533 -4.565 8.327 1.00 63.04 C ATOM 831 C ASP A 54 -20.110 -3.098 8.129 1.00 1.42 C ATOM 832 O ASP A 54 -20.855 -2.175 8.478 1.00 34.41 O ATOM 833 CB ASP A 54 -19.693 -5.208 9.464 1.00 52.25 C ATOM 834 CG ASP A 54 -20.104 -6.656 9.790 1.00 45.01 C ATOM 835 OD1 ASP A 54 -19.782 -7.569 8.994 1.00 70.45 O ATOM 836 OD2 ASP A 54 -20.746 -6.896 10.832 1.00 72.50 O ATOM 0 H ASP A 54 -19.721 -6.139 7.210 1.00 4.13 H new ATOM 0 HA ASP A 54 -21.590 -4.570 8.592 1.00 63.04 H new ATOM 0 HB2 ASP A 54 -18.641 -5.193 9.180 1.00 52.25 H new ATOM 0 HB3 ASP A 54 -19.789 -4.600 10.364 1.00 52.25 H new ATOM 841 N ASN A 55 -18.911 -2.902 7.565 1.00 61.24 N ATOM 842 CA ASN A 55 -18.345 -1.568 7.339 1.00 1.00 C ATOM 843 C ASN A 55 -18.900 -0.998 6.011 1.00 43.13 C ATOM 844 O ASN A 55 -18.801 -1.654 4.975 1.00 32.13 O ATOM 845 CB ASN A 55 -16.792 -1.659 7.329 1.00 34.15 C ATOM 846 CG ASN A 55 -16.083 -0.418 7.882 1.00 23.02 C ATOM 847 OD1 ASN A 55 -16.698 0.751 7.782 1.00 42.13 O flip ATOM 848 ND2 ASN A 55 -14.979 -0.515 8.411 1.00 4.21 N flip ATOM 0 H ASN A 55 -18.308 -3.663 7.253 1.00 61.24 H new ATOM 0 HA ASN A 55 -18.632 -0.889 8.142 1.00 1.00 H new ATOM 0 HB2 ASN A 55 -16.487 -2.527 7.913 1.00 34.15 H new ATOM 0 HB3 ASN A 55 -16.456 -1.829 6.306 1.00 34.15 H new ATOM 0 HD21 ASN A 55 -14.523 -1.425 8.477 1.00 4.21 H new ATOM 0 HD22 ASN A 55 -14.518 0.315 8.784 1.00 4.21 H new ATOM 855 N ALA A 56 -19.450 0.231 6.071 1.00 72.21 N ATOM 856 CA ALA A 56 -20.320 0.808 5.021 1.00 73.21 C ATOM 857 C ALA A 56 -19.610 1.047 3.669 1.00 54.54 C ATOM 858 O ALA A 56 -19.825 0.288 2.724 1.00 12.23 O ATOM 859 CB ALA A 56 -20.957 2.101 5.557 1.00 2.32 C ATOM 0 H ALA A 56 -19.302 0.861 6.860 1.00 72.21 H new ATOM 0 HA ALA A 56 -21.091 0.070 4.798 1.00 73.21 H new ATOM 0 HB1 ALA A 56 -21.600 2.534 4.791 1.00 2.32 H new ATOM 0 HB2 ALA A 56 -21.550 1.874 6.443 1.00 2.32 H new ATOM 0 HB3 ALA A 56 -20.173 2.812 5.817 1.00 2.32 H new ATOM 865 N HIS A 57 -18.755 2.088 3.584 1.00 45.50 N ATOM 866 CA HIS A 57 -18.098 2.509 2.311 1.00 14.22 C ATOM 867 C HIS A 57 -16.732 1.818 2.127 1.00 63.33 C ATOM 868 O HIS A 57 -15.913 2.247 1.305 1.00 52.02 O ATOM 869 CB HIS A 57 -17.898 4.046 2.294 1.00 22.44 C ATOM 870 CG HIS A 57 -19.154 4.886 2.283 1.00 51.02 C ATOM 871 ND1 HIS A 57 -19.268 6.059 1.561 1.00 3.31 N ATOM 872 CD2 HIS A 57 -20.338 4.747 2.932 1.00 33.34 C ATOM 873 CE1 HIS A 57 -20.459 6.592 1.767 1.00 54.12 C ATOM 874 NE2 HIS A 57 -21.123 5.814 2.592 1.00 55.45 N ATOM 0 H HIS A 57 -18.496 2.663 4.386 1.00 45.50 H new ATOM 0 HA HIS A 57 -18.751 2.212 1.490 1.00 14.22 H new ATOM 0 HB2 HIS A 57 -17.309 4.324 3.168 1.00 22.44 H new ATOM 0 HB3 HIS A 57 -17.306 4.304 1.416 1.00 22.44 H new ATOM 0 HD2 HIS A 57 -20.611 3.940 3.596 1.00 33.34 H new ATOM 0 HE1 HIS A 57 -20.825 7.510 1.332 1.00 54.12 H new ATOM 0 HE2 HIS A 57 -22.073 5.980 2.926 1.00 55.45 H new ATOM 883 N ALA A 58 -16.517 0.738 2.876 1.00 64.23 N ATOM 884 CA ALA A 58 -15.234 0.042 2.944 1.00 24.11 C ATOM 885 C ALA A 58 -15.057 -0.862 1.720 1.00 2.23 C ATOM 886 O ALA A 58 -15.652 -1.944 1.638 1.00 52.03 O ATOM 887 CB ALA A 58 -15.115 -0.747 4.254 1.00 10.45 C ATOM 0 H ALA A 58 -17.239 0.316 3.460 1.00 64.23 H new ATOM 0 HA ALA A 58 -14.431 0.779 2.934 1.00 24.11 H new ATOM 0 HB1 ALA A 58 -14.153 -1.258 4.285 1.00 10.45 H new ATOM 0 HB2 ALA A 58 -15.190 -0.063 5.099 1.00 10.45 H new ATOM 0 HB3 ALA A 58 -15.918 -1.482 4.310 1.00 10.45 H new ATOM 893 N ARG A 59 -14.273 -0.374 0.755 1.00 64.51 N ATOM 894 CA ARG A 59 -14.013 -1.056 -0.515 1.00 23.43 C ATOM 895 C ARG A 59 -12.522 -1.379 -0.580 1.00 72.24 C ATOM 896 O ARG A 59 -11.676 -0.486 -0.438 1.00 42.11 O ATOM 897 CB ARG A 59 -14.445 -0.168 -1.711 1.00 45.50 C ATOM 898 CG ARG A 59 -15.921 0.287 -1.689 1.00 24.33 C ATOM 899 CD ARG A 59 -16.904 -0.893 -1.661 1.00 21.41 C ATOM 900 NE ARG A 59 -18.290 -0.452 -1.430 1.00 34.52 N ATOM 901 CZ ARG A 59 -18.941 -0.545 -0.264 1.00 32.32 C ATOM 902 NH1 ARG A 59 -18.349 -1.083 0.807 1.00 53.54 N ATOM 903 NH2 ARG A 59 -20.188 -0.116 -0.172 1.00 45.10 N ATOM 0 H ARG A 59 -13.793 0.522 0.836 1.00 64.51 H new ATOM 0 HA ARG A 59 -14.593 -1.977 -0.574 1.00 23.43 H new ATOM 0 HB2 ARG A 59 -13.809 0.717 -1.735 1.00 45.50 H new ATOM 0 HB3 ARG A 59 -14.264 -0.717 -2.635 1.00 45.50 H new ATOM 0 HG2 ARG A 59 -16.090 0.916 -0.815 1.00 24.33 H new ATOM 0 HG3 ARG A 59 -16.121 0.901 -2.567 1.00 24.33 H new ATOM 0 HD2 ARG A 59 -16.848 -1.433 -2.606 1.00 21.41 H new ATOM 0 HD3 ARG A 59 -16.610 -1.591 -0.877 1.00 21.41 H new ATOM 0 HE ARG A 59 -18.792 -0.045 -2.219 1.00 34.52 H new ATOM 0 HH11 ARG A 59 -17.391 -1.428 0.741 1.00 53.54 H new ATOM 0 HH12 ARG A 59 -18.855 -1.149 1.690 1.00 53.54 H new ATOM 0 HH21 ARG A 59 -20.651 0.284 -0.988 1.00 45.10 H new ATOM 0 HH22 ARG A 59 -20.687 -0.185 0.715 1.00 45.10 H new ATOM 917 N TYR A 60 -12.210 -2.665 -0.753 1.00 33.24 N ATOM 918 CA TYR A 60 -10.844 -3.184 -0.697 1.00 13.24 C ATOM 919 C TYR A 60 -10.402 -3.625 -2.085 1.00 44.44 C ATOM 920 O TYR A 60 -10.992 -4.534 -2.686 1.00 11.31 O ATOM 921 CB TYR A 60 -10.760 -4.348 0.305 1.00 11.32 C ATOM 922 CG TYR A 60 -11.084 -3.928 1.743 1.00 62.11 C ATOM 923 CD1 TYR A 60 -12.399 -3.743 2.158 1.00 73.21 C ATOM 924 CD2 TYR A 60 -10.078 -3.710 2.682 1.00 42.35 C ATOM 925 CE1 TYR A 60 -12.688 -3.359 3.443 1.00 73.01 C ATOM 926 CE2 TYR A 60 -10.365 -3.328 3.966 1.00 50.10 C ATOM 927 CZ TYR A 60 -11.672 -3.154 4.347 1.00 1.34 C ATOM 928 OH TYR A 60 -11.966 -2.791 5.640 1.00 11.53 O ATOM 0 H TYR A 60 -12.909 -3.384 -0.938 1.00 33.24 H new ATOM 0 HA TYR A 60 -10.173 -2.396 -0.356 1.00 13.24 H new ATOM 0 HB2 TYR A 60 -11.450 -5.134 -0.002 1.00 11.32 H new ATOM 0 HB3 TYR A 60 -9.757 -4.774 0.274 1.00 11.32 H new ATOM 0 HD1 TYR A 60 -13.205 -3.904 1.457 1.00 73.21 H new ATOM 0 HD2 TYR A 60 -9.047 -3.845 2.391 1.00 42.35 H new ATOM 0 HE1 TYR A 60 -13.715 -3.217 3.745 1.00 73.01 H new ATOM 0 HE2 TYR A 60 -9.567 -3.165 4.675 1.00 50.10 H new ATOM 0 HH TYR A 60 -11.348 -3.240 6.254 1.00 11.53 H new ATOM 938 N PHE A 61 -9.372 -2.953 -2.581 1.00 21.43 N ATOM 939 CA PHE A 61 -8.811 -3.174 -3.913 1.00 3.25 C ATOM 940 C PHE A 61 -7.306 -3.475 -3.782 1.00 2.54 C ATOM 941 O PHE A 61 -6.849 -3.951 -2.734 1.00 34.11 O ATOM 942 CB PHE A 61 -9.084 -1.930 -4.798 1.00 73.42 C ATOM 943 CG PHE A 61 -10.565 -1.636 -5.068 1.00 73.22 C ATOM 944 CD1 PHE A 61 -11.308 -2.447 -5.926 1.00 10.15 C ATOM 945 CD2 PHE A 61 -11.210 -0.553 -4.469 1.00 31.24 C ATOM 946 CE1 PHE A 61 -12.639 -2.175 -6.185 1.00 10.20 C ATOM 947 CE2 PHE A 61 -12.541 -0.283 -4.730 1.00 25.04 C ATOM 948 CZ PHE A 61 -13.257 -1.098 -5.580 1.00 1.22 C ATOM 0 H PHE A 61 -8.890 -2.221 -2.059 1.00 21.43 H new ATOM 0 HA PHE A 61 -9.283 -4.031 -4.394 1.00 3.25 H new ATOM 0 HB2 PHE A 61 -8.638 -1.058 -4.320 1.00 73.42 H new ATOM 0 HB3 PHE A 61 -8.576 -2.064 -5.753 1.00 73.42 H new ATOM 0 HD1 PHE A 61 -10.837 -3.299 -6.394 1.00 10.15 H new ATOM 0 HD2 PHE A 61 -10.661 0.084 -3.791 1.00 31.24 H new ATOM 0 HE1 PHE A 61 -13.196 -2.806 -6.862 1.00 10.20 H new ATOM 0 HE2 PHE A 61 -13.020 0.567 -4.267 1.00 25.04 H new ATOM 0 HZ PHE A 61 -14.300 -0.895 -5.773 1.00 1.22 H new ATOM 958 N ILE A 62 -6.539 -3.226 -4.862 1.00 3.21 N ATOM 959 CA ILE A 62 -5.126 -3.625 -4.966 1.00 34.31 C ATOM 960 C ILE A 62 -4.312 -2.425 -5.495 1.00 42.52 C ATOM 961 O ILE A 62 -4.885 -1.461 -6.001 1.00 62.41 O ATOM 962 CB ILE A 62 -4.960 -4.858 -5.954 1.00 64.45 C ATOM 963 CG1 ILE A 62 -6.130 -5.884 -5.806 1.00 32.24 C ATOM 964 CG2 ILE A 62 -3.611 -5.567 -5.742 1.00 24.02 C ATOM 965 CD1 ILE A 62 -6.158 -6.963 -6.865 1.00 73.12 C ATOM 0 H ILE A 62 -6.886 -2.740 -5.689 1.00 3.21 H new ATOM 0 HA ILE A 62 -4.765 -3.925 -3.982 1.00 34.31 H new ATOM 0 HB ILE A 62 -4.988 -4.454 -6.966 1.00 64.45 H new ATOM 0 HG12 ILE A 62 -6.060 -6.356 -4.826 1.00 32.24 H new ATOM 0 HG13 ILE A 62 -7.076 -5.343 -5.832 1.00 32.24 H new ATOM 0 HG21 ILE A 62 -3.528 -6.406 -6.433 1.00 24.02 H new ATOM 0 HG22 ILE A 62 -2.798 -4.864 -5.925 1.00 24.02 H new ATOM 0 HG23 ILE A 62 -3.550 -5.934 -4.717 1.00 24.02 H new ATOM 0 HD11 ILE A 62 -7.002 -7.629 -6.684 1.00 73.12 H new ATOM 0 HD12 ILE A 62 -6.262 -6.505 -7.849 1.00 73.12 H new ATOM 0 HD13 ILE A 62 -5.230 -7.534 -6.827 1.00 73.12 H new ATOM 977 N ILE A 63 -2.981 -2.483 -5.352 1.00 40.04 N ATOM 978 CA ILE A 63 -2.038 -1.558 -6.010 1.00 14.44 C ATOM 979 C ILE A 63 -0.831 -2.366 -6.520 1.00 14.42 C ATOM 980 O ILE A 63 -0.371 -3.293 -5.855 1.00 73.44 O ATOM 981 CB ILE A 63 -1.531 -0.398 -5.063 1.00 22.44 C ATOM 982 CG1 ILE A 63 -2.703 0.528 -4.612 1.00 74.10 C ATOM 983 CG2 ILE A 63 -0.423 0.433 -5.747 1.00 3.13 C ATOM 984 CD1 ILE A 63 -2.292 1.725 -3.767 1.00 14.15 C ATOM 0 H ILE A 63 -2.519 -3.181 -4.769 1.00 40.04 H new ATOM 0 HA ILE A 63 -2.573 -1.078 -6.830 1.00 14.44 H new ATOM 0 HB ILE A 63 -1.112 -0.868 -4.173 1.00 22.44 H new ATOM 0 HG12 ILE A 63 -3.221 0.891 -5.500 1.00 74.10 H new ATOM 0 HG13 ILE A 63 -3.419 -0.068 -4.046 1.00 74.10 H new ATOM 0 HG21 ILE A 63 -0.093 1.224 -5.073 1.00 3.13 H new ATOM 0 HG22 ILE A 63 0.420 -0.214 -5.988 1.00 3.13 H new ATOM 0 HG23 ILE A 63 -0.814 0.876 -6.663 1.00 3.13 H new ATOM 0 HD11 ILE A 63 -3.176 2.306 -3.504 1.00 14.15 H new ATOM 0 HD12 ILE A 63 -1.803 1.377 -2.857 1.00 14.15 H new ATOM 0 HD13 ILE A 63 -1.602 2.351 -4.333 1.00 14.15 H new ATOM 996 N HIS A 64 -0.339 -2.002 -7.710 1.00 41.31 N ATOM 997 CA HIS A 64 0.876 -2.580 -8.296 1.00 52.45 C ATOM 998 C HIS A 64 2.126 -2.031 -7.575 1.00 54.31 C ATOM 999 O HIS A 64 2.477 -0.854 -7.719 1.00 75.22 O ATOM 1000 CB HIS A 64 0.939 -2.317 -9.829 1.00 62.52 C ATOM 1001 CG HIS A 64 0.644 -0.894 -10.259 1.00 74.24 C ATOM 1002 ND1 HIS A 64 1.612 0.077 -10.394 1.00 70.22 N ATOM 1003 CD2 HIS A 64 -0.525 -0.298 -10.608 1.00 23.31 C ATOM 1004 CE1 HIS A 64 1.053 1.197 -10.804 1.00 63.23 C ATOM 1005 NE2 HIS A 64 -0.244 0.999 -10.944 1.00 42.14 N ATOM 0 H HIS A 64 -0.776 -1.292 -8.298 1.00 41.31 H new ATOM 0 HA HIS A 64 0.850 -3.661 -8.157 1.00 52.45 H new ATOM 0 HB2 HIS A 64 1.933 -2.587 -10.186 1.00 62.52 H new ATOM 0 HB3 HIS A 64 0.231 -2.982 -10.324 1.00 62.52 H new ATOM 0 HD2 HIS A 64 -1.500 -0.763 -10.619 1.00 23.31 H new ATOM 0 HE1 HIS A 64 1.571 2.125 -10.994 1.00 63.23 H new ATOM 0 HE2 HIS A 64 -0.923 1.695 -11.251 1.00 42.14 H new ATOM 1014 N ALA A 65 2.736 -2.884 -6.747 1.00 60.02 N ATOM 1015 CA ALA A 65 3.989 -2.579 -6.045 1.00 42.41 C ATOM 1016 C ALA A 65 5.164 -3.161 -6.842 1.00 62.10 C ATOM 1017 O ALA A 65 5.202 -4.370 -7.081 1.00 12.12 O ATOM 1018 CB ALA A 65 3.944 -3.150 -4.618 1.00 11.43 C ATOM 0 H ALA A 65 2.372 -3.814 -6.542 1.00 60.02 H new ATOM 0 HA ALA A 65 4.121 -1.500 -5.967 1.00 42.41 H new ATOM 0 HB1 ALA A 65 4.877 -2.919 -4.104 1.00 11.43 H new ATOM 0 HB2 ALA A 65 3.111 -2.705 -4.074 1.00 11.43 H new ATOM 0 HB3 ALA A 65 3.812 -4.231 -4.663 1.00 11.43 H new ATOM 1024 N HIS A 66 6.073 -2.280 -7.288 1.00 24.43 N ATOM 1025 CA HIS A 66 7.300 -2.640 -8.030 1.00 34.22 C ATOM 1026 C HIS A 66 8.079 -1.354 -8.266 1.00 11.41 C ATOM 1027 O HIS A 66 9.271 -1.263 -7.961 1.00 51.51 O ATOM 1028 CB HIS A 66 6.987 -3.325 -9.398 1.00 22.13 C ATOM 1029 CG HIS A 66 8.181 -3.923 -10.118 1.00 41.31 C ATOM 1030 ND1 HIS A 66 9.363 -3.247 -10.342 1.00 30.44 N ATOM 1031 CD2 HIS A 66 8.365 -5.158 -10.653 1.00 55.55 C ATOM 1032 CE1 HIS A 66 10.207 -4.032 -10.970 1.00 42.43 C ATOM 1033 NE2 HIS A 66 9.627 -5.194 -11.172 1.00 22.54 N ATOM 0 H HIS A 66 5.977 -1.275 -7.142 1.00 24.43 H new ATOM 0 HA HIS A 66 7.874 -3.359 -7.445 1.00 34.22 H new ATOM 0 HB2 HIS A 66 6.254 -4.114 -9.230 1.00 22.13 H new ATOM 0 HB3 HIS A 66 6.520 -2.590 -10.054 1.00 22.13 H new ATOM 0 HD2 HIS A 66 7.645 -5.963 -10.665 1.00 55.55 H new ATOM 0 HE1 HIS A 66 11.210 -3.767 -11.270 1.00 42.43 H new ATOM 0 HE2 HIS A 66 10.052 -5.994 -11.641 1.00 22.54 H new ATOM 1042 N LYS A 67 7.381 -0.373 -8.855 1.00 42.02 N ATOM 1043 CA LYS A 67 7.910 0.970 -9.062 1.00 44.14 C ATOM 1044 C LYS A 67 7.648 1.803 -7.802 1.00 50.34 C ATOM 1045 O LYS A 67 6.542 2.323 -7.598 1.00 63.10 O ATOM 1046 CB LYS A 67 7.276 1.629 -10.314 1.00 12.10 C ATOM 1047 CG LYS A 67 7.781 3.059 -10.596 1.00 35.44 C ATOM 1048 CD LYS A 67 7.122 3.692 -11.844 1.00 52.51 C ATOM 1049 CE LYS A 67 7.546 5.151 -12.043 1.00 65.33 C ATOM 1050 NZ LYS A 67 6.964 5.747 -13.276 1.00 51.31 N ATOM 0 H LYS A 67 6.429 -0.496 -9.201 1.00 42.02 H new ATOM 0 HA LYS A 67 8.984 0.916 -9.240 1.00 44.14 H new ATOM 0 HB2 LYS A 67 7.481 1.005 -11.183 1.00 12.10 H new ATOM 0 HB3 LYS A 67 6.194 1.655 -10.189 1.00 12.10 H new ATOM 0 HG2 LYS A 67 7.582 3.687 -9.728 1.00 35.44 H new ATOM 0 HG3 LYS A 67 8.862 3.037 -10.733 1.00 35.44 H new ATOM 0 HD2 LYS A 67 7.390 3.113 -12.728 1.00 52.51 H new ATOM 0 HD3 LYS A 67 6.038 3.640 -11.746 1.00 52.51 H new ATOM 0 HE2 LYS A 67 7.237 5.738 -11.178 1.00 65.33 H new ATOM 0 HE3 LYS A 67 8.633 5.207 -12.094 1.00 65.33 H new ATOM 0 HZ1 LYS A 67 7.279 6.734 -13.367 1.00 51.31 H new ATOM 0 HZ2 LYS A 67 7.279 5.205 -14.106 1.00 51.31 H new ATOM 0 HZ3 LYS A 67 5.926 5.719 -13.218 1.00 51.31 H new ATOM 1064 N LEU A 68 8.655 1.854 -6.930 1.00 5.31 N ATOM 1065 CA LEU A 68 8.614 2.645 -5.704 1.00 40.43 C ATOM 1066 C LEU A 68 9.072 4.077 -6.017 1.00 31.32 C ATOM 1067 O LEU A 68 10.151 4.285 -6.584 1.00 13.02 O ATOM 1068 CB LEU A 68 9.476 1.986 -4.587 1.00 31.50 C ATOM 1069 CG LEU A 68 8.825 0.765 -3.852 1.00 13.10 C ATOM 1070 CD1 LEU A 68 9.784 0.115 -2.831 1.00 14.33 C ATOM 1071 CD2 LEU A 68 7.509 1.173 -3.168 1.00 74.10 C ATOM 0 H LEU A 68 9.528 1.343 -7.057 1.00 5.31 H new ATOM 0 HA LEU A 68 7.593 2.683 -5.325 1.00 40.43 H new ATOM 0 HB2 LEU A 68 10.419 1.660 -5.027 1.00 31.50 H new ATOM 0 HB3 LEU A 68 9.717 2.747 -3.844 1.00 31.50 H new ATOM 0 HG LEU A 68 8.608 0.018 -4.615 1.00 13.10 H new ATOM 0 HD11 LEU A 68 9.286 -0.726 -2.349 1.00 14.33 H new ATOM 0 HD12 LEU A 68 10.678 -0.239 -3.345 1.00 14.33 H new ATOM 0 HD13 LEU A 68 10.066 0.850 -2.078 1.00 14.33 H new ATOM 0 HD21 LEU A 68 7.077 0.308 -2.665 1.00 74.10 H new ATOM 0 HD22 LEU A 68 7.707 1.957 -2.437 1.00 74.10 H new ATOM 0 HD23 LEU A 68 6.809 1.544 -3.917 1.00 74.10 H new ATOM 1083 N LEU A 69 8.215 5.044 -5.664 1.00 22.24 N ATOM 1084 CA LEU A 69 8.412 6.467 -5.947 1.00 71.02 C ATOM 1085 C LEU A 69 9.511 7.028 -5.040 1.00 70.12 C ATOM 1086 O LEU A 69 9.245 7.495 -3.927 1.00 41.44 O ATOM 1087 CB LEU A 69 7.079 7.243 -5.749 1.00 31.41 C ATOM 1088 CG LEU A 69 5.880 6.793 -6.644 1.00 73.04 C ATOM 1089 CD1 LEU A 69 4.595 7.555 -6.271 1.00 2.41 C ATOM 1090 CD2 LEU A 69 6.208 6.944 -8.148 1.00 13.54 C ATOM 0 H LEU A 69 7.347 4.852 -5.163 1.00 22.24 H new ATOM 0 HA LEU A 69 8.724 6.588 -6.984 1.00 71.02 H new ATOM 0 HB2 LEU A 69 6.781 7.151 -4.705 1.00 31.41 H new ATOM 0 HB3 LEU A 69 7.267 8.300 -5.935 1.00 31.41 H new ATOM 0 HG LEU A 69 5.706 5.734 -6.455 1.00 73.04 H new ATOM 0 HD11 LEU A 69 3.776 7.222 -6.909 1.00 2.41 H new ATOM 0 HD12 LEU A 69 4.345 7.358 -5.228 1.00 2.41 H new ATOM 0 HD13 LEU A 69 4.753 8.624 -6.411 1.00 2.41 H new ATOM 0 HD21 LEU A 69 5.352 6.622 -8.741 1.00 13.54 H new ATOM 0 HD22 LEU A 69 6.430 7.988 -8.369 1.00 13.54 H new ATOM 0 HD23 LEU A 69 7.073 6.329 -8.395 1.00 13.54 H new ATOM 1102 N ASP A 70 10.754 6.874 -5.497 1.00 45.14 N ATOM 1103 CA ASP A 70 11.926 7.476 -4.860 1.00 34.04 C ATOM 1104 C ASP A 70 12.165 8.861 -5.474 1.00 15.31 C ATOM 1105 O ASP A 70 12.450 8.949 -6.669 1.00 15.10 O ATOM 1106 CB ASP A 70 13.180 6.579 -5.024 1.00 5.21 C ATOM 1107 CG ASP A 70 14.480 7.229 -4.495 1.00 32.14 C ATOM 1108 OD1 ASP A 70 14.488 7.759 -3.351 1.00 4.31 O ATOM 1109 OD2 ASP A 70 15.489 7.237 -5.227 1.00 23.21 O ATOM 0 H ASP A 70 10.978 6.324 -6.326 1.00 45.14 H new ATOM 0 HA ASP A 70 11.740 7.575 -3.791 1.00 34.04 H new ATOM 0 HB2 ASP A 70 13.015 5.638 -4.499 1.00 5.21 H new ATOM 0 HB3 ASP A 70 13.308 6.337 -6.079 1.00 5.21 H new ATOM 1114 N PRO A 71 12.021 9.966 -4.676 1.00 35.52 N ATOM 1115 CA PRO A 71 12.295 11.346 -5.152 1.00 1.14 C ATOM 1116 C PRO A 71 13.751 11.564 -5.600 1.00 4.14 C ATOM 1117 O PRO A 71 14.009 12.419 -6.461 1.00 60.15 O ATOM 1118 CB PRO A 71 11.958 12.225 -3.921 1.00 23.33 C ATOM 1119 CG PRO A 71 11.997 11.295 -2.757 1.00 22.43 C ATOM 1120 CD PRO A 71 11.534 9.960 -3.270 1.00 11.11 C ATOM 0 HA PRO A 71 11.709 11.583 -6.040 1.00 1.14 H new ATOM 0 HB2 PRO A 71 12.680 13.033 -3.804 1.00 23.33 H new ATOM 0 HB3 PRO A 71 10.976 12.687 -4.024 1.00 23.33 H new ATOM 0 HG2 PRO A 71 13.005 11.226 -2.347 1.00 22.43 H new ATOM 0 HG3 PRO A 71 11.350 11.649 -1.954 1.00 22.43 H new ATOM 0 HD2 PRO A 71 11.959 9.136 -2.697 1.00 11.11 H new ATOM 0 HD3 PRO A 71 10.450 9.859 -3.217 1.00 11.11 H new ATOM 1128 N SER A 72 14.690 10.793 -5.012 1.00 51.45 N ATOM 1129 CA SER A 72 16.131 10.963 -5.251 1.00 1.31 C ATOM 1130 C SER A 72 16.491 10.631 -6.723 1.00 73.12 C ATOM 1131 O SER A 72 17.211 11.397 -7.378 1.00 5.42 O ATOM 1132 CB SER A 72 16.931 10.091 -4.254 1.00 63.42 C ATOM 1133 OG SER A 72 18.333 10.203 -4.444 1.00 21.41 O ATOM 0 H SER A 72 14.468 10.039 -4.362 1.00 51.45 H new ATOM 0 HA SER A 72 16.401 12.006 -5.085 1.00 1.31 H new ATOM 0 HB2 SER A 72 16.680 10.385 -3.235 1.00 63.42 H new ATOM 0 HB3 SER A 72 16.634 9.048 -4.367 1.00 63.42 H new ATOM 0 HG SER A 72 18.798 9.637 -3.793 1.00 21.41 H new ATOM 1139 N GLU A 73 15.962 9.504 -7.232 1.00 64.03 N ATOM 1140 CA GLU A 73 16.142 9.090 -8.638 1.00 31.12 C ATOM 1141 C GLU A 73 14.999 9.641 -9.510 1.00 23.01 C ATOM 1142 O GLU A 73 15.242 10.302 -10.529 1.00 31.40 O ATOM 1143 CB GLU A 73 16.236 7.543 -8.728 1.00 14.34 C ATOM 1144 CG GLU A 73 17.505 6.950 -8.079 1.00 22.32 C ATOM 1145 CD GLU A 73 17.601 5.420 -8.200 1.00 4.54 C ATOM 1146 OE1 GLU A 73 17.619 4.905 -9.342 1.00 73.44 O ATOM 1147 OE2 GLU A 73 17.666 4.725 -7.166 1.00 11.43 O ATOM 0 H GLU A 73 15.399 8.855 -6.683 1.00 64.03 H new ATOM 0 HA GLU A 73 17.075 9.506 -9.018 1.00 31.12 H new ATOM 0 HB2 GLU A 73 15.359 7.108 -8.249 1.00 14.34 H new ATOM 0 HB3 GLU A 73 16.206 7.248 -9.777 1.00 14.34 H new ATOM 0 HG2 GLU A 73 18.384 7.399 -8.543 1.00 22.32 H new ATOM 0 HG3 GLU A 73 17.526 7.225 -7.024 1.00 22.32 H new ATOM 1154 N GLY A 74 13.753 9.361 -9.097 1.00 72.04 N ATOM 1155 CA GLY A 74 12.549 9.823 -9.809 1.00 33.45 C ATOM 1156 C GLY A 74 11.969 11.096 -9.206 1.00 64.23 C ATOM 1157 O GLY A 74 10.963 11.062 -8.482 1.00 20.42 O ATOM 0 H GLY A 74 13.551 8.810 -8.263 1.00 72.04 H new ATOM 0 HA2 GLY A 74 12.795 10.000 -10.856 1.00 33.45 H new ATOM 0 HA3 GLY A 74 11.794 9.037 -9.787 1.00 33.45 H new TER 1161 GLY A 74 ATOM 1162 N MET B 101 -17.366 14.344 0.605 1.00 44.24 N ATOM 1163 CA MET B 101 -16.777 15.460 1.335 1.00 33.22 C ATOM 1164 C MET B 101 -15.705 16.160 0.456 1.00 2.13 C ATOM 1165 O MET B 101 -14.630 15.585 0.248 1.00 34.20 O ATOM 1166 CB MET B 101 -16.157 14.955 2.666 1.00 32.53 C ATOM 1167 CG MET B 101 -17.152 14.250 3.607 1.00 52.13 C ATOM 1168 SD MET B 101 -16.406 13.756 5.179 1.00 75.14 S ATOM 1169 CE MET B 101 -15.094 12.657 4.639 1.00 3.14 C ATOM 0 HA MET B 101 -17.555 16.186 1.573 1.00 33.22 H new ATOM 0 HB2 MET B 101 -15.344 14.266 2.435 1.00 32.53 H new ATOM 0 HB3 MET B 101 -15.717 15.802 3.192 1.00 32.53 H new ATOM 0 HG2 MET B 101 -17.993 14.916 3.803 1.00 52.13 H new ATOM 0 HG3 MET B 101 -17.553 13.368 3.108 1.00 52.13 H new ATOM 0 HE1 MET B 101 -14.635 12.185 5.507 1.00 3.14 H new ATOM 0 HE2 MET B 101 -15.508 11.890 3.985 1.00 3.14 H new ATOM 0 HE3 MET B 101 -14.341 13.228 4.096 1.00 3.14 H new ATOM 1179 N PRO B 102 -15.990 17.393 -0.100 1.00 54.05 N ATOM 1180 CA PRO B 102 -15.045 18.127 -0.989 1.00 3.01 C ATOM 1181 C PRO B 102 -13.753 18.551 -0.250 1.00 51.33 C ATOM 1182 O PRO B 102 -13.658 19.646 0.320 1.00 54.52 O ATOM 1183 CB PRO B 102 -15.875 19.352 -1.482 1.00 10.43 C ATOM 1184 CG PRO B 102 -17.307 19.005 -1.175 1.00 22.42 C ATOM 1185 CD PRO B 102 -17.252 18.163 0.078 1.00 62.12 C ATOM 0 HA PRO B 102 -14.685 17.511 -1.813 1.00 3.01 H new ATOM 0 HB2 PRO B 102 -15.572 20.265 -0.970 1.00 10.43 H new ATOM 0 HB3 PRO B 102 -15.731 19.522 -2.549 1.00 10.43 H new ATOM 0 HG2 PRO B 102 -17.905 19.903 -1.020 1.00 22.42 H new ATOM 0 HG3 PRO B 102 -17.764 18.456 -1.998 1.00 22.42 H new ATOM 0 HD2 PRO B 102 -17.228 18.777 0.978 1.00 62.12 H new ATOM 0 HD3 PRO B 102 -18.118 17.507 0.163 1.00 62.12 H new ATOM 1193 N ASP B 103 -12.773 17.646 -0.257 1.00 42.44 N ATOM 1194 CA ASP B 103 -11.500 17.802 0.465 1.00 20.03 C ATOM 1195 C ASP B 103 -10.395 17.073 -0.301 1.00 54.34 C ATOM 1196 O ASP B 103 -10.641 16.015 -0.897 1.00 11.42 O ATOM 1197 CB ASP B 103 -11.634 17.251 1.915 1.00 64.13 C ATOM 1198 CG ASP B 103 -10.310 17.283 2.708 1.00 52.34 C ATOM 1199 OD1 ASP B 103 -9.920 18.365 3.190 1.00 10.24 O ATOM 1200 OD2 ASP B 103 -9.655 16.221 2.835 1.00 31.40 O ATOM 0 H ASP B 103 -12.838 16.768 -0.772 1.00 42.44 H new ATOM 0 HA ASP B 103 -11.242 18.859 0.533 1.00 20.03 H new ATOM 0 HB2 ASP B 103 -12.383 17.835 2.450 1.00 64.13 H new ATOM 0 HB3 ASP B 103 -11.999 16.225 1.873 1.00 64.13 H new ATOM 1205 N LYS B 104 -9.174 17.643 -0.285 1.00 13.24 N ATOM 1206 CA LYS B 104 -8.030 17.074 -0.998 1.00 41.40 C ATOM 1207 C LYS B 104 -7.467 15.876 -0.209 1.00 65.34 C ATOM 1208 O LYS B 104 -6.595 16.033 0.648 1.00 22.11 O ATOM 1209 CB LYS B 104 -6.938 18.149 -1.253 1.00 32.13 C ATOM 1210 CG LYS B 104 -5.843 17.713 -2.259 1.00 4.41 C ATOM 1211 CD LYS B 104 -6.431 17.439 -3.664 1.00 65.34 C ATOM 1212 CE LYS B 104 -5.376 17.032 -4.691 1.00 33.52 C ATOM 1213 NZ LYS B 104 -5.976 16.833 -6.036 1.00 62.22 N ATOM 0 H LYS B 104 -8.961 18.503 0.220 1.00 13.24 H new ATOM 0 HA LYS B 104 -8.364 16.720 -1.973 1.00 41.40 H new ATOM 0 HB2 LYS B 104 -7.416 19.056 -1.623 1.00 32.13 H new ATOM 0 HB3 LYS B 104 -6.465 18.403 -0.304 1.00 32.13 H new ATOM 0 HG2 LYS B 104 -5.082 18.491 -2.328 1.00 4.41 H new ATOM 0 HG3 LYS B 104 -5.348 16.815 -1.891 1.00 4.41 H new ATOM 0 HD2 LYS B 104 -7.179 16.650 -3.590 1.00 65.34 H new ATOM 0 HD3 LYS B 104 -6.945 18.333 -4.016 1.00 65.34 H new ATOM 0 HE2 LYS B 104 -4.604 17.800 -4.745 1.00 33.52 H new ATOM 0 HE3 LYS B 104 -4.888 16.112 -4.369 1.00 33.52 H new ATOM 0 HZ1 LYS B 104 -5.233 16.557 -6.710 1.00 62.22 H new ATOM 0 HZ2 LYS B 104 -6.695 16.083 -5.988 1.00 62.22 H new ATOM 0 HZ3 LYS B 104 -6.420 17.719 -6.353 1.00 62.22 H new ATOM 1227 N GLN B 105 -8.024 14.691 -0.483 1.00 32.52 N ATOM 1228 CA GLN B 105 -7.609 13.434 0.156 1.00 64.23 C ATOM 1229 C GLN B 105 -6.451 12.793 -0.614 1.00 71.32 C ATOM 1230 O GLN B 105 -5.711 11.988 -0.045 1.00 52.32 O ATOM 1231 CB GLN B 105 -8.828 12.457 0.247 1.00 70.20 C ATOM 1232 CG GLN B 105 -9.535 12.107 -1.100 1.00 3.34 C ATOM 1233 CD GLN B 105 -8.785 11.131 -2.024 1.00 10.54 C ATOM 1234 OE1 GLN B 105 -8.046 10.184 -1.464 1.00 65.34 O flip ATOM 1235 NE2 GLN B 105 -8.895 11.212 -3.249 1.00 11.31 N flip ATOM 0 H GLN B 105 -8.780 14.575 -1.158 1.00 32.52 H new ATOM 0 HA GLN B 105 -7.259 13.650 1.165 1.00 64.23 H new ATOM 0 HB2 GLN B 105 -8.489 11.529 0.707 1.00 70.20 H new ATOM 0 HB3 GLN B 105 -9.567 12.894 0.918 1.00 70.20 H new ATOM 0 HG2 GLN B 105 -10.513 11.683 -0.874 1.00 3.34 H new ATOM 0 HG3 GLN B 105 -9.708 13.033 -1.648 1.00 3.34 H new ATOM 0 HE21 GLN B 105 -9.468 11.948 -3.662 1.00 11.31 H new ATOM 0 HE22 GLN B 105 -8.413 10.543 -3.850 1.00 11.31 H new ATOM 1244 N LEU B 106 -6.341 13.136 -1.928 1.00 53.51 N ATOM 1245 CA LEU B 106 -5.474 12.421 -2.877 1.00 11.24 C ATOM 1246 C LEU B 106 -4.006 12.618 -2.493 1.00 24.44 C ATOM 1247 O LEU B 106 -3.530 13.742 -2.280 1.00 22.21 O ATOM 1248 CB LEU B 106 -5.776 12.838 -4.357 1.00 15.14 C ATOM 1249 CG LEU B 106 -5.426 11.782 -5.479 1.00 13.45 C ATOM 1250 CD1 LEU B 106 -6.049 12.164 -6.831 1.00 22.42 C ATOM 1251 CD2 LEU B 106 -3.908 11.540 -5.649 1.00 72.34 C ATOM 0 H LEU B 106 -6.852 13.913 -2.346 1.00 53.51 H new ATOM 0 HA LEU B 106 -5.689 11.354 -2.818 1.00 11.24 H new ATOM 0 HB2 LEU B 106 -6.837 13.076 -4.433 1.00 15.14 H new ATOM 0 HB3 LEU B 106 -5.227 13.755 -4.570 1.00 15.14 H new ATOM 0 HG LEU B 106 -5.863 10.845 -5.134 1.00 13.45 H new ATOM 0 HD11 LEU B 106 -5.786 11.414 -7.577 1.00 22.42 H new ATOM 0 HD12 LEU B 106 -7.133 12.212 -6.731 1.00 22.42 H new ATOM 0 HD13 LEU B 106 -5.670 13.137 -7.145 1.00 22.42 H new ATOM 0 HD21 LEU B 106 -3.743 10.804 -6.436 1.00 72.34 H new ATOM 0 HD22 LEU B 106 -3.418 12.476 -5.919 1.00 72.34 H new ATOM 0 HD23 LEU B 106 -3.491 11.170 -4.712 1.00 72.34 H new ATOM 1263 N LEU B 107 -3.319 11.489 -2.424 1.00 2.15 N ATOM 1264 CA LEU B 107 -2.012 11.372 -1.816 1.00 53.12 C ATOM 1265 C LEU B 107 -1.290 10.151 -2.377 1.00 53.21 C ATOM 1266 O LEU B 107 -1.839 9.392 -3.190 1.00 22.21 O ATOM 1267 CB LEU B 107 -2.162 11.305 -0.251 1.00 32.32 C ATOM 1268 CG LEU B 107 -2.807 10.012 0.433 1.00 12.23 C ATOM 1269 CD1 LEU B 107 -3.880 9.290 -0.411 1.00 64.04 C ATOM 1270 CD2 LEU B 107 -1.740 9.030 0.938 1.00 1.53 C ATOM 0 H LEU B 107 -3.668 10.608 -2.801 1.00 2.15 H new ATOM 0 HA LEU B 107 -1.408 12.248 -2.053 1.00 53.12 H new ATOM 0 HB2 LEU B 107 -1.168 11.437 0.176 1.00 32.32 H new ATOM 0 HB3 LEU B 107 -2.757 12.165 0.055 1.00 32.32 H new ATOM 0 HG LEU B 107 -3.345 10.410 1.294 1.00 12.23 H new ATOM 0 HD11 LEU B 107 -4.256 8.427 0.139 1.00 64.04 H new ATOM 0 HD12 LEU B 107 -4.702 9.975 -0.617 1.00 64.04 H new ATOM 0 HD13 LEU B 107 -3.440 8.957 -1.351 1.00 64.04 H new ATOM 0 HD21 LEU B 107 -2.226 8.168 1.395 1.00 1.53 H new ATOM 0 HD22 LEU B 107 -1.125 8.699 0.101 1.00 1.53 H new ATOM 0 HD23 LEU B 107 -1.110 9.525 1.677 1.00 1.53 H new ATOM 1282 N HIS B 108 -0.048 9.981 -1.944 1.00 12.32 N ATOM 1283 CA HIS B 108 0.766 8.816 -2.266 1.00 54.20 C ATOM 1284 C HIS B 108 1.099 8.118 -0.945 1.00 24.53 C ATOM 1285 O HIS B 108 1.832 8.686 -0.135 1.00 73.34 O ATOM 1286 CB HIS B 108 2.055 9.257 -3.010 1.00 13.12 C ATOM 1287 CG HIS B 108 1.858 9.931 -4.352 1.00 54.43 C ATOM 1288 ND1 HIS B 108 2.909 10.403 -5.109 1.00 24.03 N ATOM 1289 CD2 HIS B 108 0.741 10.247 -5.056 1.00 14.24 C ATOM 1290 CE1 HIS B 108 2.445 10.980 -6.194 1.00 23.44 C ATOM 1291 NE2 HIS B 108 1.136 10.896 -6.186 1.00 60.21 N ATOM 0 H HIS B 108 0.430 10.659 -1.350 1.00 12.32 H new ATOM 0 HA HIS B 108 0.232 8.132 -2.925 1.00 54.20 H new ATOM 0 HB2 HIS B 108 2.607 9.938 -2.363 1.00 13.12 H new ATOM 0 HB3 HIS B 108 2.683 8.378 -3.157 1.00 13.12 H new ATOM 0 HD1 HIS B 108 3.895 10.317 -4.864 1.00 24.03 H new ATOM 0 HD2 HIS B 108 -0.277 10.024 -4.771 1.00 14.24 H new ATOM 0 HE1 HIS B 108 3.042 11.446 -6.964 1.00 23.44 H new ATOM 1300 N ILE B 109 0.507 6.921 -0.695 1.00 13.21 N ATOM 1301 CA ILE B 109 0.716 6.179 0.572 1.00 44.42 C ATOM 1302 C ILE B 109 2.176 5.735 0.712 1.00 42.13 C ATOM 1303 O ILE B 109 2.893 5.580 -0.273 1.00 62.11 O ATOM 1304 CB ILE B 109 -0.213 4.908 0.727 1.00 30.12 C ATOM 1305 CG1 ILE B 109 0.076 3.867 -0.403 1.00 31.41 C ATOM 1306 CG2 ILE B 109 -1.705 5.301 0.782 1.00 2.54 C ATOM 1307 CD1 ILE B 109 -0.775 2.603 -0.369 1.00 4.31 C ATOM 0 H ILE B 109 -0.116 6.452 -1.353 1.00 13.21 H new ATOM 0 HA ILE B 109 0.450 6.882 1.361 1.00 44.42 H new ATOM 0 HB ILE B 109 0.023 4.432 1.679 1.00 30.12 H new ATOM 0 HG12 ILE B 109 -0.069 4.355 -1.367 1.00 31.41 H new ATOM 0 HG13 ILE B 109 1.126 3.578 -0.346 1.00 31.41 H new ATOM 0 HG21 ILE B 109 -2.314 4.403 0.889 1.00 2.54 H new ATOM 0 HG22 ILE B 109 -1.877 5.959 1.634 1.00 2.54 H new ATOM 0 HG23 ILE B 109 -1.979 5.818 -0.137 1.00 2.54 H new ATOM 0 HD11 ILE B 109 -0.492 1.951 -1.196 1.00 4.31 H new ATOM 0 HD12 ILE B 109 -0.615 2.082 0.575 1.00 4.31 H new ATOM 0 HD13 ILE B 109 -1.828 2.870 -0.462 1.00 4.31 H new ATOM 1319 N VAL B 110 2.580 5.488 1.945 1.00 12.03 N ATOM 1320 CA VAL B 110 3.965 5.155 2.291 1.00 22.42 C ATOM 1321 C VAL B 110 4.067 3.676 2.680 1.00 31.11 C ATOM 1322 O VAL B 110 3.325 3.188 3.539 1.00 51.02 O ATOM 1323 CB VAL B 110 4.507 6.108 3.424 1.00 25.41 C ATOM 1324 CG1 VAL B 110 5.051 7.405 2.813 1.00 70.42 C ATOM 1325 CG2 VAL B 110 3.404 6.436 4.467 1.00 42.54 C ATOM 0 H VAL B 110 1.954 5.511 2.750 1.00 12.03 H new ATOM 0 HA VAL B 110 4.599 5.313 1.418 1.00 22.42 H new ATOM 0 HB VAL B 110 5.314 5.586 3.938 1.00 25.41 H new ATOM 0 HG11 VAL B 110 5.422 8.054 3.607 1.00 70.42 H new ATOM 0 HG12 VAL B 110 5.864 7.171 2.126 1.00 70.42 H new ATOM 0 HG13 VAL B 110 4.254 7.914 2.271 1.00 70.42 H new ATOM 0 HG21 VAL B 110 3.812 7.095 5.233 1.00 42.54 H new ATOM 0 HG22 VAL B 110 2.569 6.931 3.970 1.00 42.54 H new ATOM 0 HG23 VAL B 110 3.055 5.513 4.930 1.00 42.54 H new ATOM 1335 N VAL B 111 4.995 2.980 2.015 1.00 0.14 N ATOM 1336 CA VAL B 111 5.219 1.539 2.182 1.00 53.12 C ATOM 1337 C VAL B 111 6.725 1.236 2.119 1.00 4.32 C ATOM 1338 O VAL B 111 7.489 1.931 1.437 1.00 43.52 O ATOM 1339 CB VAL B 111 4.446 0.716 1.079 1.00 74.33 C ATOM 1340 CG1 VAL B 111 4.908 1.097 -0.348 1.00 21.13 C ATOM 1341 CG2 VAL B 111 4.548 -0.816 1.322 1.00 72.10 C ATOM 0 H VAL B 111 5.622 3.409 1.334 1.00 0.14 H new ATOM 0 HA VAL B 111 4.834 1.238 3.156 1.00 53.12 H new ATOM 0 HB VAL B 111 3.393 0.985 1.162 1.00 74.33 H new ATOM 0 HG11 VAL B 111 4.353 0.509 -1.079 1.00 21.13 H new ATOM 0 HG12 VAL B 111 4.723 2.157 -0.519 1.00 21.13 H new ATOM 0 HG13 VAL B 111 5.974 0.893 -0.452 1.00 21.13 H new ATOM 0 HG21 VAL B 111 4.003 -1.345 0.541 1.00 72.10 H new ATOM 0 HG22 VAL B 111 5.595 -1.119 1.302 1.00 72.10 H new ATOM 0 HG23 VAL B 111 4.118 -1.060 2.294 1.00 72.10 H new ATOM 1351 N GLY B 112 7.139 0.205 2.850 1.00 3.15 N ATOM 1352 CA GLY B 112 8.506 -0.266 2.805 1.00 74.13 C ATOM 1353 C GLY B 112 8.661 -1.617 3.458 1.00 60.02 C ATOM 1354 O GLY B 112 7.721 -2.417 3.477 1.00 4.11 O ATOM 0 H GLY B 112 6.536 -0.319 3.484 1.00 3.15 H new ATOM 0 HA2 GLY B 112 8.835 -0.325 1.767 1.00 74.13 H new ATOM 0 HA3 GLY B 112 9.154 0.454 3.304 1.00 74.13 H new ATOM 1358 N GLY B 113 9.851 -1.857 4.009 1.00 35.21 N ATOM 1359 CA GLY B 113 10.218 -3.148 4.590 1.00 4.45 C ATOM 1360 C GLY B 113 11.522 -3.633 3.994 1.00 5.24 C ATOM 1361 O GLY B 113 12.058 -2.981 3.083 1.00 4.01 O ATOM 0 H GLY B 113 10.591 -1.157 4.065 1.00 35.21 H new ATOM 0 HA2 GLY B 113 10.316 -3.055 5.672 1.00 4.45 H new ATOM 0 HA3 GLY B 113 9.430 -3.877 4.403 1.00 4.45 H new ATOM 1365 N GLU B 114 12.047 -4.764 4.484 1.00 13.34 N ATOM 1366 CA GLU B 114 13.351 -5.276 4.041 1.00 73.04 C ATOM 1367 C GLU B 114 13.215 -6.085 2.753 1.00 72.05 C ATOM 1368 O GLU B 114 12.340 -6.952 2.616 1.00 51.24 O ATOM 1369 CB GLU B 114 14.085 -6.079 5.157 1.00 20.41 C ATOM 1370 CG GLU B 114 14.687 -5.165 6.247 1.00 74.44 C ATOM 1371 CD GLU B 114 15.593 -5.879 7.252 1.00 70.41 C ATOM 1372 OE1 GLU B 114 15.078 -6.430 8.237 1.00 73.10 O ATOM 1373 OE2 GLU B 114 16.836 -5.894 7.046 1.00 3.35 O ATOM 0 H GLU B 114 11.588 -5.342 5.188 1.00 13.34 H new ATOM 0 HA GLU B 114 13.979 -4.411 3.825 1.00 73.04 H new ATOM 0 HB2 GLU B 114 13.385 -6.776 5.618 1.00 20.41 H new ATOM 0 HB3 GLU B 114 14.880 -6.675 4.708 1.00 20.41 H new ATOM 0 HG2 GLU B 114 15.258 -4.373 5.763 1.00 74.44 H new ATOM 0 HG3 GLU B 114 13.873 -4.685 6.790 1.00 74.44 H new ATOM 1380 N LEU B 115 14.083 -5.732 1.806 1.00 61.33 N ATOM 1381 CA LEU B 115 14.242 -6.396 0.521 1.00 63.50 C ATOM 1382 C LEU B 115 15.195 -7.608 0.693 1.00 45.20 C ATOM 1383 O LEU B 115 15.845 -7.759 1.739 1.00 62.25 O ATOM 1384 CB LEU B 115 14.815 -5.374 -0.520 1.00 71.21 C ATOM 1385 CG LEU B 115 13.910 -4.151 -0.949 1.00 33.33 C ATOM 1386 CD1 LEU B 115 12.551 -4.587 -1.473 1.00 43.22 C ATOM 1387 CD2 LEU B 115 13.731 -3.111 0.161 1.00 75.53 C ATOM 0 H LEU B 115 14.719 -4.943 1.922 1.00 61.33 H new ATOM 0 HA LEU B 115 13.280 -6.757 0.157 1.00 63.50 H new ATOM 0 HB2 LEU B 115 15.744 -4.973 -0.115 1.00 71.21 H new ATOM 0 HB3 LEU B 115 15.073 -5.929 -1.422 1.00 71.21 H new ATOM 0 HG LEU B 115 14.457 -3.675 -1.763 1.00 33.33 H new ATOM 0 HD11 LEU B 115 11.970 -3.708 -1.753 1.00 43.22 H new ATOM 0 HD12 LEU B 115 12.685 -5.227 -2.345 1.00 43.22 H new ATOM 0 HD13 LEU B 115 12.022 -5.139 -0.696 1.00 43.22 H new ATOM 0 HD21 LEU B 115 13.100 -2.299 -0.200 1.00 75.53 H new ATOM 0 HD22 LEU B 115 13.261 -3.579 1.026 1.00 75.53 H new ATOM 0 HD23 LEU B 115 14.705 -2.714 0.448 1.00 75.53 H new ATOM 1399 N LYS B 116 15.236 -8.497 -0.305 1.00 51.54 N ATOM 1400 CA LYS B 116 16.280 -9.550 -0.397 1.00 21.13 C ATOM 1401 C LYS B 116 17.664 -8.912 -0.641 1.00 54.31 C ATOM 1402 O LYS B 116 18.679 -9.384 -0.118 1.00 5.15 O ATOM 1403 CB LYS B 116 15.921 -10.575 -1.515 1.00 51.34 C ATOM 1404 CG LYS B 116 14.786 -11.555 -1.129 1.00 25.00 C ATOM 1405 CD LYS B 116 14.325 -12.474 -2.285 1.00 32.33 C ATOM 1406 CE LYS B 116 13.675 -11.687 -3.426 1.00 21.51 C ATOM 1407 NZ LYS B 116 13.183 -12.567 -4.517 1.00 15.32 N ATOM 0 H LYS B 116 14.560 -8.517 -1.068 1.00 51.54 H new ATOM 0 HA LYS B 116 16.322 -10.090 0.549 1.00 21.13 H new ATOM 0 HB2 LYS B 116 15.628 -10.030 -2.412 1.00 51.34 H new ATOM 0 HB3 LYS B 116 16.813 -11.149 -1.768 1.00 51.34 H new ATOM 0 HG2 LYS B 116 15.123 -12.175 -0.298 1.00 25.00 H new ATOM 0 HG3 LYS B 116 13.931 -10.981 -0.772 1.00 25.00 H new ATOM 0 HD2 LYS B 116 15.181 -13.028 -2.670 1.00 32.33 H new ATOM 0 HD3 LYS B 116 13.616 -13.208 -1.902 1.00 32.33 H new ATOM 0 HE2 LYS B 116 12.843 -11.103 -3.032 1.00 21.51 H new ATOM 0 HE3 LYS B 116 14.398 -10.979 -3.832 1.00 21.51 H new ATOM 0 HZ1 LYS B 116 12.293 -12.186 -4.896 1.00 15.32 H new ATOM 0 HZ2 LYS B 116 13.892 -12.608 -5.276 1.00 15.32 H new ATOM 0 HZ3 LYS B 116 13.019 -13.524 -4.144 1.00 15.32 H new ATOM 1421 N ASP B 117 17.673 -7.817 -1.415 1.00 41.13 N ATOM 1422 CA ASP B 117 18.890 -7.037 -1.733 1.00 11.21 C ATOM 1423 C ASP B 117 18.884 -5.722 -0.899 1.00 21.34 C ATOM 1424 O ASP B 117 17.924 -5.458 -0.180 1.00 71.34 O ATOM 1425 CB ASP B 117 18.897 -6.761 -3.265 1.00 4.05 C ATOM 1426 CG ASP B 117 20.251 -6.258 -3.794 1.00 24.11 C ATOM 1427 OD1 ASP B 117 20.483 -5.037 -3.816 1.00 50.11 O ATOM 1428 OD2 ASP B 117 21.102 -7.089 -4.169 1.00 64.32 O ATOM 0 H ASP B 117 16.829 -7.439 -1.845 1.00 41.13 H new ATOM 0 HA ASP B 117 19.797 -7.583 -1.475 1.00 11.21 H new ATOM 0 HB2 ASP B 117 18.628 -7.677 -3.792 1.00 4.05 H new ATOM 0 HB3 ASP B 117 18.129 -6.023 -3.496 1.00 4.05 H new ATOM 1433 N VAL B 118 19.959 -4.916 -0.965 1.00 31.30 N ATOM 1434 CA VAL B 118 20.023 -3.609 -0.261 1.00 22.34 C ATOM 1435 C VAL B 118 19.562 -2.459 -1.182 1.00 11.01 C ATOM 1436 O VAL B 118 18.842 -1.564 -0.747 1.00 44.04 O ATOM 1437 CB VAL B 118 21.458 -3.311 0.314 1.00 73.04 C ATOM 1438 CG1 VAL B 118 21.750 -4.202 1.543 1.00 55.34 C ATOM 1439 CG2 VAL B 118 22.553 -3.488 -0.769 1.00 4.45 C ATOM 0 H VAL B 118 20.799 -5.141 -1.498 1.00 31.30 H new ATOM 0 HA VAL B 118 19.339 -3.675 0.585 1.00 22.34 H new ATOM 0 HB VAL B 118 21.477 -2.269 0.632 1.00 73.04 H new ATOM 0 HG11 VAL B 118 22.747 -3.980 1.925 1.00 55.34 H new ATOM 0 HG12 VAL B 118 21.011 -4.004 2.320 1.00 55.34 H new ATOM 0 HG13 VAL B 118 21.698 -5.251 1.252 1.00 55.34 H new ATOM 0 HG21 VAL B 118 23.530 -3.274 -0.337 1.00 4.45 H new ATOM 0 HG22 VAL B 118 22.536 -4.513 -1.139 1.00 4.45 H new ATOM 0 HG23 VAL B 118 22.363 -2.801 -1.594 1.00 4.45 H new ATOM 1449 N ALA B 119 19.993 -2.496 -2.449 1.00 55.11 N ATOM 1450 CA ALA B 119 19.648 -1.466 -3.461 1.00 11.41 C ATOM 1451 C ALA B 119 18.575 -1.972 -4.447 1.00 34.25 C ATOM 1452 O ALA B 119 18.196 -1.243 -5.373 1.00 50.54 O ATOM 1453 CB ALA B 119 20.919 -1.026 -4.212 1.00 34.21 C ATOM 0 H ALA B 119 20.592 -3.238 -2.811 1.00 55.11 H new ATOM 0 HA ALA B 119 19.225 -0.606 -2.941 1.00 11.41 H new ATOM 0 HB1 ALA B 119 20.660 -0.270 -4.953 1.00 34.21 H new ATOM 0 HB2 ALA B 119 21.634 -0.609 -3.503 1.00 34.21 H new ATOM 0 HB3 ALA B 119 21.363 -1.887 -4.711 1.00 34.21 H new ATOM 1459 N GLY B 120 18.098 -3.215 -4.241 1.00 60.45 N ATOM 1460 CA GLY B 120 17.032 -3.799 -5.071 1.00 21.12 C ATOM 1461 C GLY B 120 15.626 -3.367 -4.647 1.00 1.22 C ATOM 1462 O GLY B 120 15.473 -2.508 -3.771 1.00 32.42 O ATOM 0 H GLY B 120 18.437 -3.834 -3.504 1.00 60.45 H new ATOM 0 HA2 GLY B 120 17.194 -3.514 -6.111 1.00 21.12 H new ATOM 0 HA3 GLY B 120 17.100 -4.886 -5.024 1.00 21.12 H new ATOM 1466 N VAL B 121 14.585 -3.976 -5.267 1.00 72.03 N ATOM 1467 CA VAL B 121 13.171 -3.651 -4.969 1.00 30.23 C ATOM 1468 C VAL B 121 12.310 -4.939 -4.881 1.00 12.13 C ATOM 1469 O VAL B 121 11.071 -4.899 -4.847 1.00 42.31 O ATOM 1470 CB VAL B 121 12.590 -2.621 -6.018 1.00 32.13 C ATOM 1471 CG1 VAL B 121 12.348 -3.261 -7.405 1.00 52.00 C ATOM 1472 CG2 VAL B 121 11.320 -1.927 -5.473 1.00 45.22 C ATOM 0 H VAL B 121 14.701 -4.697 -5.979 1.00 72.03 H new ATOM 0 HA VAL B 121 13.132 -3.170 -3.992 1.00 30.23 H new ATOM 0 HB VAL B 121 13.350 -1.853 -6.166 1.00 32.13 H new ATOM 0 HG11 VAL B 121 11.949 -2.511 -8.087 1.00 52.00 H new ATOM 0 HG12 VAL B 121 13.290 -3.645 -7.798 1.00 52.00 H new ATOM 0 HG13 VAL B 121 11.635 -4.080 -7.309 1.00 52.00 H new ATOM 0 HG21 VAL B 121 10.942 -1.224 -6.216 1.00 45.22 H new ATOM 0 HG22 VAL B 121 10.558 -2.677 -5.262 1.00 45.22 H new ATOM 0 HG23 VAL B 121 11.564 -1.390 -4.556 1.00 45.22 H new ATOM 1482 N GLU B 122 12.989 -6.086 -4.749 1.00 21.13 N ATOM 1483 CA GLU B 122 12.336 -7.393 -4.552 1.00 1.21 C ATOM 1484 C GLU B 122 12.372 -7.735 -3.055 1.00 63.32 C ATOM 1485 O GLU B 122 13.437 -7.963 -2.490 1.00 2.14 O ATOM 1486 CB GLU B 122 12.970 -8.516 -5.438 1.00 0.33 C ATOM 1487 CG GLU B 122 14.500 -8.741 -5.312 1.00 64.42 C ATOM 1488 CD GLU B 122 15.334 -7.623 -5.947 1.00 32.32 C ATOM 1489 OE1 GLU B 122 15.274 -7.459 -7.187 1.00 20.42 O ATOM 1490 OE2 GLU B 122 16.016 -6.888 -5.218 1.00 74.00 O ATOM 0 H GLU B 122 14.007 -6.137 -4.775 1.00 21.13 H new ATOM 0 HA GLU B 122 11.298 -7.329 -4.879 1.00 1.21 H new ATOM 0 HB2 GLU B 122 12.470 -9.455 -5.201 1.00 0.33 H new ATOM 0 HB3 GLU B 122 12.747 -8.290 -6.481 1.00 0.33 H new ATOM 0 HG2 GLU B 122 14.762 -8.825 -4.257 1.00 64.42 H new ATOM 0 HG3 GLU B 122 14.760 -9.690 -5.782 1.00 64.42 H new ATOM 1497 N PHE B 123 11.186 -7.698 -2.416 1.00 24.40 N ATOM 1498 CA PHE B 123 11.035 -7.847 -0.954 1.00 12.14 C ATOM 1499 C PHE B 123 11.513 -9.228 -0.466 1.00 53.41 C ATOM 1500 O PHE B 123 11.471 -10.205 -1.208 1.00 2.12 O ATOM 1501 CB PHE B 123 9.563 -7.591 -0.545 1.00 54.04 C ATOM 1502 CG PHE B 123 9.073 -6.179 -0.888 1.00 11.42 C ATOM 1503 CD1 PHE B 123 9.380 -5.101 -0.052 1.00 34.34 C ATOM 1504 CD2 PHE B 123 8.304 -5.927 -2.030 1.00 2.03 C ATOM 1505 CE1 PHE B 123 8.946 -3.821 -0.348 1.00 42.24 C ATOM 1506 CE2 PHE B 123 7.870 -4.644 -2.325 1.00 64.34 C ATOM 1507 CZ PHE B 123 8.188 -3.594 -1.481 1.00 35.14 C ATOM 0 H PHE B 123 10.300 -7.563 -2.903 1.00 24.40 H new ATOM 0 HA PHE B 123 11.669 -7.103 -0.472 1.00 12.14 H new ATOM 0 HB2 PHE B 123 8.923 -8.320 -1.042 1.00 54.04 H new ATOM 0 HB3 PHE B 123 9.458 -7.754 0.528 1.00 54.04 H new ATOM 0 HD1 PHE B 123 9.966 -5.270 0.840 1.00 34.34 H new ATOM 0 HD2 PHE B 123 8.046 -6.742 -2.690 1.00 2.03 H new ATOM 0 HE1 PHE B 123 9.199 -3.000 0.306 1.00 42.24 H new ATOM 0 HE2 PHE B 123 7.283 -4.464 -3.214 1.00 64.34 H new ATOM 0 HZ PHE B 123 7.843 -2.596 -1.708 1.00 35.14 H new ATOM 1517 N ARG B 124 11.997 -9.292 0.784 1.00 2.11 N ATOM 1518 CA ARG B 124 12.462 -10.558 1.384 1.00 25.04 C ATOM 1519 C ARG B 124 11.262 -11.447 1.749 1.00 11.12 C ATOM 1520 O ARG B 124 11.204 -12.619 1.361 1.00 3.21 O ATOM 1521 CB ARG B 124 13.380 -10.298 2.612 1.00 53.53 C ATOM 1522 CG ARG B 124 13.900 -11.588 3.290 1.00 12.01 C ATOM 1523 CD ARG B 124 14.977 -11.334 4.352 1.00 3.54 C ATOM 1524 NE ARG B 124 15.291 -12.568 5.095 1.00 2.12 N ATOM 1525 CZ ARG B 124 16.275 -12.708 5.997 1.00 21.12 C ATOM 1526 NH1 ARG B 124 17.073 -11.690 6.297 1.00 33.34 N ATOM 1527 NH2 ARG B 124 16.426 -13.863 6.624 1.00 12.34 N ATOM 0 H ARG B 124 12.078 -8.484 1.401 1.00 2.11 H new ATOM 0 HA ARG B 124 13.063 -11.089 0.646 1.00 25.04 H new ATOM 0 HB2 ARG B 124 14.232 -9.697 2.295 1.00 53.53 H new ATOM 0 HB3 ARG B 124 12.830 -9.710 3.346 1.00 53.53 H new ATOM 0 HG2 ARG B 124 13.061 -12.108 3.753 1.00 12.01 H new ATOM 0 HG3 ARG B 124 14.305 -12.252 2.526 1.00 12.01 H new ATOM 0 HD2 ARG B 124 15.880 -10.953 3.875 1.00 3.54 H new ATOM 0 HD3 ARG B 124 14.635 -10.566 5.045 1.00 3.54 H new ATOM 0 HE ARG B 124 14.711 -13.386 4.907 1.00 2.12 H new ATOM 0 HH11 ARG B 124 16.942 -10.788 5.840 1.00 33.34 H new ATOM 0 HH12 ARG B 124 17.817 -11.810 6.984 1.00 33.34 H new ATOM 0 HH21 ARG B 124 15.797 -14.640 6.421 1.00 12.34 H new ATOM 0 HH22 ARG B 124 17.172 -13.977 7.311 1.00 12.34 H new ATOM 1541 N ASP B 125 10.307 -10.851 2.461 1.00 43.15 N ATOM 1542 CA ASP B 125 9.077 -11.516 2.894 1.00 35.11 C ATOM 1543 C ASP B 125 7.984 -10.459 3.060 1.00 34.10 C ATOM 1544 O ASP B 125 8.195 -9.430 3.706 1.00 43.22 O ATOM 1545 CB ASP B 125 9.307 -12.314 4.211 1.00 15.33 C ATOM 1546 CG ASP B 125 8.035 -12.972 4.788 1.00 20.01 C ATOM 1547 OD1 ASP B 125 7.185 -13.455 4.012 1.00 21.12 O ATOM 1548 OD2 ASP B 125 7.874 -13.004 6.021 1.00 14.11 O ATOM 0 H ASP B 125 10.366 -9.877 2.758 1.00 43.15 H new ATOM 0 HA ASP B 125 8.764 -12.240 2.141 1.00 35.11 H new ATOM 0 HB2 ASP B 125 10.051 -13.089 4.027 1.00 15.33 H new ATOM 0 HB3 ASP B 125 9.726 -11.642 4.960 1.00 15.33 H new ATOM 1553 N LEU B 126 6.825 -10.726 2.451 1.00 20.02 N ATOM 1554 CA LEU B 126 5.685 -9.813 2.416 1.00 32.22 C ATOM 1555 C LEU B 126 4.889 -9.813 3.736 1.00 41.43 C ATOM 1556 O LEU B 126 3.926 -9.056 3.885 1.00 45.02 O ATOM 1557 CB LEU B 126 4.790 -10.174 1.207 1.00 15.15 C ATOM 1558 CG LEU B 126 5.416 -9.963 -0.213 1.00 41.41 C ATOM 1559 CD1 LEU B 126 5.918 -8.525 -0.399 1.00 53.40 C ATOM 1560 CD2 LEU B 126 6.495 -11.010 -0.563 1.00 42.10 C ATOM 0 H LEU B 126 6.652 -11.602 1.959 1.00 20.02 H new ATOM 0 HA LEU B 126 6.058 -8.796 2.299 1.00 32.22 H new ATOM 0 HB2 LEU B 126 4.498 -11.220 1.299 1.00 15.15 H new ATOM 0 HB3 LEU B 126 3.877 -9.581 1.269 1.00 15.15 H new ATOM 0 HG LEU B 126 4.611 -10.123 -0.931 1.00 41.41 H new ATOM 0 HD11 LEU B 126 6.346 -8.415 -1.395 1.00 53.40 H new ATOM 0 HD12 LEU B 126 5.085 -7.831 -0.283 1.00 53.40 H new ATOM 0 HD13 LEU B 126 6.680 -8.306 0.349 1.00 53.40 H new ATOM 0 HD21 LEU B 126 6.889 -10.808 -1.559 1.00 42.10 H new ATOM 0 HD22 LEU B 126 7.304 -10.956 0.165 1.00 42.10 H new ATOM 0 HD23 LEU B 126 6.055 -12.007 -0.542 1.00 42.10 H new ATOM 1572 N SER B 127 5.297 -10.668 4.684 1.00 42.21 N ATOM 1573 CA SER B 127 4.786 -10.634 6.064 1.00 13.21 C ATOM 1574 C SER B 127 5.665 -9.684 6.916 1.00 14.33 C ATOM 1575 O SER B 127 5.239 -9.188 7.962 1.00 53.12 O ATOM 1576 CB SER B 127 4.782 -12.064 6.652 1.00 3.51 C ATOM 1577 OG SER B 127 4.208 -12.992 5.741 1.00 33.14 O ATOM 0 H SER B 127 5.988 -11.400 4.518 1.00 42.21 H new ATOM 0 HA SER B 127 3.763 -10.258 6.072 1.00 13.21 H new ATOM 0 HB2 SER B 127 5.802 -12.366 6.888 1.00 3.51 H new ATOM 0 HB3 SER B 127 4.222 -12.074 7.587 1.00 3.51 H new ATOM 0 HG SER B 127 4.219 -13.889 6.137 1.00 33.14 H new ATOM 1583 N LYS B 128 6.905 -9.433 6.434 1.00 1.01 N ATOM 1584 CA LYS B 128 7.898 -8.568 7.112 1.00 13.53 C ATOM 1585 C LYS B 128 7.887 -7.137 6.558 1.00 33.12 C ATOM 1586 O LYS B 128 8.566 -6.261 7.111 1.00 5.24 O ATOM 1587 CB LYS B 128 9.318 -9.182 6.973 1.00 50.31 C ATOM 1588 CG LYS B 128 9.480 -10.553 7.650 1.00 34.43 C ATOM 1589 CD LYS B 128 9.267 -10.495 9.180 1.00 22.15 C ATOM 1590 CE LYS B 128 9.339 -11.881 9.835 1.00 51.04 C ATOM 1591 NZ LYS B 128 10.645 -12.549 9.593 1.00 12.02 N ATOM 0 H LYS B 128 7.246 -9.828 5.558 1.00 1.01 H new ATOM 0 HA LYS B 128 7.624 -8.514 8.165 1.00 13.53 H new ATOM 0 HB2 LYS B 128 9.557 -9.282 5.914 1.00 50.31 H new ATOM 0 HB3 LYS B 128 10.044 -8.490 7.400 1.00 50.31 H new ATOM 0 HG2 LYS B 128 8.768 -11.254 7.215 1.00 34.43 H new ATOM 0 HG3 LYS B 128 10.477 -10.941 7.441 1.00 34.43 H new ATOM 0 HD2 LYS B 128 10.022 -9.847 9.625 1.00 22.15 H new ATOM 0 HD3 LYS B 128 8.297 -10.046 9.392 1.00 22.15 H new ATOM 0 HE2 LYS B 128 9.176 -11.783 10.908 1.00 51.04 H new ATOM 0 HE3 LYS B 128 8.535 -12.507 9.447 1.00 51.04 H new ATOM 0 HZ1 LYS B 128 10.688 -13.435 10.136 1.00 12.02 H new ATOM 0 HZ2 LYS B 128 10.745 -12.759 8.579 1.00 12.02 H new ATOM 0 HZ3 LYS B 128 11.417 -11.921 9.894 1.00 12.02 H new ATOM 1605 N VAL B 129 7.131 -6.898 5.467 1.00 50.32 N ATOM 1606 CA VAL B 129 7.050 -5.562 4.853 1.00 22.52 C ATOM 1607 C VAL B 129 6.198 -4.636 5.737 1.00 1.43 C ATOM 1608 O VAL B 129 5.083 -4.988 6.153 1.00 71.43 O ATOM 1609 CB VAL B 129 6.519 -5.586 3.366 1.00 64.43 C ATOM 1610 CG1 VAL B 129 7.429 -6.460 2.491 1.00 3.42 C ATOM 1611 CG2 VAL B 129 5.047 -6.037 3.260 1.00 24.01 C ATOM 0 H VAL B 129 6.572 -7.610 4.997 1.00 50.32 H new ATOM 0 HA VAL B 129 8.066 -5.172 4.792 1.00 22.52 H new ATOM 0 HB VAL B 129 6.549 -4.560 2.999 1.00 64.43 H new ATOM 0 HG11 VAL B 129 7.052 -6.468 1.468 1.00 3.42 H new ATOM 0 HG12 VAL B 129 8.441 -6.056 2.501 1.00 3.42 H new ATOM 0 HG13 VAL B 129 7.441 -7.478 2.881 1.00 3.42 H new ATOM 0 HG21 VAL B 129 4.740 -6.033 2.214 1.00 24.01 H new ATOM 0 HG22 VAL B 129 4.945 -7.044 3.664 1.00 24.01 H new ATOM 0 HG23 VAL B 129 4.415 -5.353 3.826 1.00 24.01 H new ATOM 1621 N GLU B 130 6.752 -3.469 6.055 1.00 64.13 N ATOM 1622 CA GLU B 130 6.145 -2.519 6.977 1.00 52.54 C ATOM 1623 C GLU B 130 5.438 -1.417 6.176 1.00 42.01 C ATOM 1624 O GLU B 130 6.087 -0.540 5.585 1.00 33.43 O ATOM 1625 CB GLU B 130 7.225 -1.953 7.927 1.00 54.31 C ATOM 1626 CG GLU B 130 6.705 -0.904 8.939 1.00 72.14 C ATOM 1627 CD GLU B 130 7.740 -0.524 10.006 1.00 34.44 C ATOM 1628 OE1 GLU B 130 8.724 0.147 9.665 1.00 71.32 O ATOM 1629 OE2 GLU B 130 7.565 -0.877 11.191 1.00 52.32 O ATOM 0 H GLU B 130 7.645 -3.155 5.674 1.00 64.13 H new ATOM 0 HA GLU B 130 5.396 -3.013 7.595 1.00 52.54 H new ATOM 0 HB2 GLU B 130 7.675 -2.779 8.478 1.00 54.31 H new ATOM 0 HB3 GLU B 130 8.016 -1.501 7.329 1.00 54.31 H new ATOM 0 HG2 GLU B 130 6.404 -0.006 8.399 1.00 72.14 H new ATOM 0 HG3 GLU B 130 5.814 -1.294 9.430 1.00 72.14 H new ATOM 1636 N PHE B 131 4.101 -1.525 6.107 1.00 52.33 N ATOM 1637 CA PHE B 131 3.231 -0.491 5.536 1.00 52.41 C ATOM 1638 C PHE B 131 3.242 0.699 6.490 1.00 64.22 C ATOM 1639 O PHE B 131 2.552 0.683 7.516 1.00 2.33 O ATOM 1640 CB PHE B 131 1.782 -1.020 5.341 1.00 20.32 C ATOM 1641 CG PHE B 131 1.709 -2.285 4.500 1.00 21.02 C ATOM 1642 CD1 PHE B 131 1.630 -2.215 3.111 1.00 75.22 C ATOM 1643 CD2 PHE B 131 1.744 -3.548 5.099 1.00 61.22 C ATOM 1644 CE1 PHE B 131 1.588 -3.362 2.351 1.00 54.23 C ATOM 1645 CE2 PHE B 131 1.700 -4.690 4.334 1.00 34.31 C ATOM 1646 CZ PHE B 131 1.624 -4.595 2.962 1.00 72.44 C ATOM 0 H PHE B 131 3.592 -2.340 6.449 1.00 52.33 H new ATOM 0 HA PHE B 131 3.598 -0.198 4.552 1.00 52.41 H new ATOM 0 HB2 PHE B 131 1.340 -1.216 6.318 1.00 20.32 H new ATOM 0 HB3 PHE B 131 1.180 -0.243 4.869 1.00 20.32 H new ATOM 0 HD1 PHE B 131 1.601 -1.251 2.625 1.00 75.22 H new ATOM 0 HD2 PHE B 131 1.806 -3.628 6.174 1.00 61.22 H new ATOM 0 HE1 PHE B 131 1.527 -3.294 1.275 1.00 54.23 H new ATOM 0 HE2 PHE B 131 1.725 -5.660 4.808 1.00 34.31 H new ATOM 0 HZ PHE B 131 1.592 -5.493 2.362 1.00 72.44 H new ATOM 1656 N VAL B 132 4.085 1.687 6.164 1.00 34.52 N ATOM 1657 CA VAL B 132 4.329 2.880 6.996 1.00 11.34 C ATOM 1658 C VAL B 132 3.007 3.606 7.311 1.00 3.10 C ATOM 1659 O VAL B 132 2.841 4.192 8.383 1.00 64.33 O ATOM 1660 CB VAL B 132 5.323 3.850 6.271 1.00 1.13 C ATOM 1661 CG1 VAL B 132 5.610 5.122 7.099 1.00 15.52 C ATOM 1662 CG2 VAL B 132 6.627 3.116 5.898 1.00 53.12 C ATOM 0 H VAL B 132 4.628 1.683 5.300 1.00 34.52 H new ATOM 0 HA VAL B 132 4.774 2.558 7.937 1.00 11.34 H new ATOM 0 HB VAL B 132 4.841 4.180 5.351 1.00 1.13 H new ATOM 0 HG11 VAL B 132 6.304 5.762 6.554 1.00 15.52 H new ATOM 0 HG12 VAL B 132 4.679 5.661 7.272 1.00 15.52 H new ATOM 0 HG13 VAL B 132 6.050 4.842 8.056 1.00 15.52 H new ATOM 0 HG21 VAL B 132 7.303 3.808 5.396 1.00 53.12 H new ATOM 0 HG22 VAL B 132 7.102 2.737 6.802 1.00 53.12 H new ATOM 0 HG23 VAL B 132 6.398 2.284 5.232 1.00 53.12 H new ATOM 1672 N GLY B 133 2.075 3.534 6.356 1.00 2.50 N ATOM 1673 CA GLY B 133 0.720 4.025 6.527 1.00 3.43 C ATOM 1674 C GLY B 133 0.330 4.921 5.380 1.00 10.13 C ATOM 1675 O GLY B 133 0.635 4.619 4.214 1.00 50.12 O ATOM 0 H GLY B 133 2.250 3.128 5.437 1.00 2.50 H new ATOM 0 HA2 GLY B 133 0.029 3.185 6.590 1.00 3.43 H new ATOM 0 HA3 GLY B 133 0.642 4.573 7.466 1.00 3.43 H new ATOM 1679 N ALA B 134 -0.346 6.010 5.705 1.00 62.42 N ATOM 1680 CA ALA B 134 -0.795 7.010 4.738 1.00 22.12 C ATOM 1681 C ALA B 134 -0.961 8.347 5.456 1.00 61.14 C ATOM 1682 O ALA B 134 -0.965 8.396 6.692 1.00 31.10 O ATOM 1683 CB ALA B 134 -2.113 6.569 4.092 1.00 74.01 C ATOM 0 H ALA B 134 -0.606 6.232 6.666 1.00 62.42 H new ATOM 0 HA ALA B 134 -0.056 7.117 3.944 1.00 22.12 H new ATOM 0 HB1 ALA B 134 -2.436 7.323 3.374 1.00 74.01 H new ATOM 0 HB2 ALA B 134 -1.967 5.618 3.579 1.00 74.01 H new ATOM 0 HB3 ALA B 134 -2.875 6.452 4.863 1.00 74.01 H new ATOM 1689 N TYR B 135 -1.085 9.431 4.683 1.00 22.53 N ATOM 1690 CA TYR B 135 -1.181 10.802 5.212 1.00 54.14 C ATOM 1691 C TYR B 135 -2.161 11.611 4.357 1.00 3.32 C ATOM 1692 O TYR B 135 -2.277 11.339 3.169 1.00 3.23 O ATOM 1693 CB TYR B 135 0.224 11.467 5.225 1.00 43.21 C ATOM 1694 CG TYR B 135 1.163 10.915 6.314 1.00 72.24 C ATOM 1695 CD1 TYR B 135 1.076 11.374 7.629 1.00 51.22 C ATOM 1696 CD2 TYR B 135 2.107 9.918 6.035 1.00 55.41 C ATOM 1697 CE1 TYR B 135 1.889 10.866 8.618 1.00 53.44 C ATOM 1698 CE2 TYR B 135 2.925 9.411 7.024 1.00 24.21 C ATOM 1699 CZ TYR B 135 2.811 9.884 8.311 1.00 12.33 C ATOM 1700 OH TYR B 135 3.619 9.376 9.301 1.00 41.21 O ATOM 0 H TYR B 135 -1.122 9.385 3.665 1.00 22.53 H new ATOM 0 HA TYR B 135 -1.552 10.774 6.237 1.00 54.14 H new ATOM 0 HB2 TYR B 135 0.691 11.327 4.250 1.00 43.21 H new ATOM 0 HB3 TYR B 135 0.106 12.541 5.370 1.00 43.21 H new ATOM 0 HD1 TYR B 135 0.358 12.142 7.876 1.00 51.22 H new ATOM 0 HD2 TYR B 135 2.196 9.539 5.027 1.00 55.41 H new ATOM 0 HE1 TYR B 135 1.806 11.234 9.630 1.00 53.44 H new ATOM 0 HE2 TYR B 135 3.651 8.647 6.789 1.00 24.21 H new ATOM 0 HH TYR B 135 4.211 8.693 8.922 1.00 41.21 H new ATOM 1710 N PRO B 136 -2.868 12.642 4.929 1.00 2.01 N ATOM 1711 CA PRO B 136 -3.907 13.415 4.180 1.00 3.31 C ATOM 1712 C PRO B 136 -3.347 14.323 3.059 1.00 21.45 C ATOM 1713 O PRO B 136 -4.112 15.067 2.427 1.00 64.42 O ATOM 1714 CB PRO B 136 -4.600 14.236 5.293 1.00 11.44 C ATOM 1715 CG PRO B 136 -3.556 14.403 6.362 1.00 13.25 C ATOM 1716 CD PRO B 136 -2.732 13.129 6.339 1.00 54.22 C ATOM 0 HA PRO B 136 -4.578 12.752 3.633 1.00 3.31 H new ATOM 0 HB2 PRO B 136 -4.939 15.202 4.918 1.00 11.44 H new ATOM 0 HB3 PRO B 136 -5.478 13.717 5.677 1.00 11.44 H new ATOM 0 HG2 PRO B 136 -2.932 15.275 6.166 1.00 13.25 H new ATOM 0 HG3 PRO B 136 -4.017 14.553 7.338 1.00 13.25 H new ATOM 0 HD2 PRO B 136 -1.691 13.321 6.597 1.00 54.22 H new ATOM 0 HD3 PRO B 136 -3.108 12.396 7.053 1.00 54.22 H new ATOM 1724 N SER B 137 -2.024 14.245 2.818 1.00 61.14 N ATOM 1725 CA SER B 137 -1.343 14.943 1.720 1.00 73.43 C ATOM 1726 C SER B 137 -0.130 14.121 1.269 1.00 35.22 C ATOM 1727 O SER B 137 0.498 13.417 2.085 1.00 51.53 O ATOM 1728 CB SER B 137 -0.889 16.364 2.160 1.00 44.42 C ATOM 1729 OG SER B 137 -0.213 17.048 1.113 1.00 63.23 O ATOM 0 H SER B 137 -1.392 13.686 3.392 1.00 61.14 H new ATOM 0 HA SER B 137 -2.041 15.053 0.890 1.00 73.43 H new ATOM 0 HB2 SER B 137 -1.758 16.943 2.471 1.00 44.42 H new ATOM 0 HB3 SER B 137 -0.232 16.284 3.026 1.00 44.42 H new ATOM 0 HG SER B 137 0.056 17.938 1.424 1.00 63.23 H new ATOM 1735 N TYR B 138 0.177 14.205 -0.041 1.00 33.32 N ATOM 1736 CA TYR B 138 1.419 13.678 -0.616 1.00 2.44 C ATOM 1737 C TYR B 138 2.649 14.218 0.134 1.00 25.25 C ATOM 1738 O TYR B 138 3.541 13.450 0.449 1.00 51.35 O ATOM 1739 CB TYR B 138 1.522 14.022 -2.134 1.00 74.42 C ATOM 1740 CG TYR B 138 2.927 13.777 -2.742 1.00 14.21 C ATOM 1741 CD1 TYR B 138 3.511 12.509 -2.704 1.00 45.22 C ATOM 1742 CD2 TYR B 138 3.680 14.815 -3.307 1.00 51.24 C ATOM 1743 CE1 TYR B 138 4.777 12.278 -3.199 1.00 31.22 C ATOM 1744 CE2 TYR B 138 4.949 14.582 -3.812 1.00 73.53 C ATOM 1745 CZ TYR B 138 5.491 13.313 -3.750 1.00 74.12 C ATOM 1746 OH TYR B 138 6.760 13.083 -4.229 1.00 32.10 O ATOM 0 H TYR B 138 -0.436 14.643 -0.728 1.00 33.32 H new ATOM 0 HA TYR B 138 1.397 12.594 -0.507 1.00 2.44 H new ATOM 0 HB2 TYR B 138 0.792 13.426 -2.681 1.00 74.42 H new ATOM 0 HB3 TYR B 138 1.252 15.068 -2.278 1.00 74.42 H new ATOM 0 HD1 TYR B 138 2.956 11.687 -2.275 1.00 45.22 H new ATOM 0 HD2 TYR B 138 3.265 15.811 -3.349 1.00 51.24 H new ATOM 0 HE1 TYR B 138 5.205 11.287 -3.153 1.00 31.22 H new ATOM 0 HE2 TYR B 138 5.513 15.391 -4.253 1.00 73.53 H new ATOM 0 HH TYR B 138 7.130 13.916 -4.588 1.00 32.10 H new ATOM 1756 N ASP B 139 2.662 15.541 0.404 1.00 63.44 N ATOM 1757 CA ASP B 139 3.812 16.243 1.019 1.00 15.24 C ATOM 1758 C ASP B 139 4.188 15.642 2.391 1.00 63.23 C ATOM 1759 O ASP B 139 5.377 15.485 2.709 1.00 2.30 O ATOM 1760 CB ASP B 139 3.490 17.755 1.149 1.00 45.43 C ATOM 1761 CG ASP B 139 4.637 18.581 1.771 1.00 73.20 C ATOM 1762 OD1 ASP B 139 5.605 18.900 1.051 1.00 51.21 O ATOM 1763 OD2 ASP B 139 4.574 18.913 2.976 1.00 35.55 O ATOM 0 H ASP B 139 1.873 16.155 0.201 1.00 63.44 H new ATOM 0 HA ASP B 139 4.677 16.113 0.369 1.00 15.24 H new ATOM 0 HB2 ASP B 139 3.260 18.155 0.162 1.00 45.43 H new ATOM 0 HB3 ASP B 139 2.595 17.876 1.759 1.00 45.43 H new ATOM 1768 N GLU B 140 3.154 15.302 3.174 1.00 42.25 N ATOM 1769 CA GLU B 140 3.300 14.671 4.498 1.00 72.21 C ATOM 1770 C GLU B 140 3.928 13.266 4.377 1.00 1.10 C ATOM 1771 O GLU B 140 4.820 12.897 5.150 1.00 45.44 O ATOM 1772 CB GLU B 140 1.909 14.579 5.172 1.00 23.53 C ATOM 1773 CG GLU B 140 1.177 15.923 5.353 1.00 34.22 C ATOM 1774 CD GLU B 140 1.840 16.855 6.383 1.00 55.22 C ATOM 1775 OE1 GLU B 140 2.760 17.621 6.022 1.00 53.10 O ATOM 1776 OE2 GLU B 140 1.437 16.827 7.563 1.00 73.01 O ATOM 0 H GLU B 140 2.182 15.458 2.905 1.00 42.25 H new ATOM 0 HA GLU B 140 3.966 15.281 5.108 1.00 72.21 H new ATOM 0 HB2 GLU B 140 1.278 13.917 4.578 1.00 23.53 H new ATOM 0 HB3 GLU B 140 2.027 14.113 6.150 1.00 23.53 H new ATOM 0 HG2 GLU B 140 1.130 16.434 4.391 1.00 34.22 H new ATOM 0 HG3 GLU B 140 0.150 15.728 5.661 1.00 34.22 H new ATOM 1783 N ALA B 141 3.455 12.504 3.373 1.00 12.41 N ATOM 1784 CA ALA B 141 3.933 11.147 3.091 1.00 11.35 C ATOM 1785 C ALA B 141 5.320 11.181 2.419 1.00 54.25 C ATOM 1786 O ALA B 141 6.123 10.255 2.559 1.00 64.14 O ATOM 1787 CB ALA B 141 2.899 10.438 2.210 1.00 33.34 C ATOM 0 H ALA B 141 2.726 12.819 2.733 1.00 12.41 H new ATOM 0 HA ALA B 141 4.048 10.595 4.024 1.00 11.35 H new ATOM 0 HB1 ALA B 141 3.240 9.426 1.991 1.00 33.34 H new ATOM 0 HB2 ALA B 141 1.944 10.394 2.734 1.00 33.34 H new ATOM 0 HB3 ALA B 141 2.776 10.989 1.278 1.00 33.34 H new ATOM 1793 N HIS B 142 5.602 12.295 1.733 1.00 73.23 N ATOM 1794 CA HIS B 142 6.849 12.501 0.998 1.00 74.52 C ATOM 1795 C HIS B 142 8.003 12.710 1.981 1.00 5.22 C ATOM 1796 O HIS B 142 9.135 12.335 1.697 1.00 54.22 O ATOM 1797 CB HIS B 142 6.703 13.712 0.045 1.00 4.14 C ATOM 1798 CG HIS B 142 7.880 13.969 -0.853 1.00 43.05 C ATOM 1799 ND1 HIS B 142 8.201 15.221 -1.306 1.00 24.41 N ATOM 1800 CD2 HIS B 142 8.767 13.125 -1.433 1.00 41.02 C ATOM 1801 CE1 HIS B 142 9.219 15.141 -2.124 1.00 5.32 C ATOM 1802 NE2 HIS B 142 9.583 13.882 -2.226 1.00 64.12 N ATOM 0 H HIS B 142 4.961 13.086 1.674 1.00 73.23 H new ATOM 0 HA HIS B 142 7.068 11.618 0.397 1.00 74.52 H new ATOM 0 HB2 HIS B 142 5.820 13.560 -0.576 1.00 4.14 H new ATOM 0 HB3 HIS B 142 6.522 14.605 0.644 1.00 4.14 H new ATOM 0 HD1 HIS B 142 7.721 16.082 -1.046 1.00 24.41 H new ATOM 0 HD2 HIS B 142 8.819 12.055 -1.295 1.00 41.02 H new ATOM 0 HE1 HIS B 142 9.684 15.973 -2.632 1.00 5.32 H new ATOM 1811 N LYS B 143 7.685 13.306 3.136 1.00 74.54 N ATOM 1812 CA LYS B 143 8.647 13.482 4.221 1.00 11.02 C ATOM 1813 C LYS B 143 8.874 12.139 4.926 1.00 34.22 C ATOM 1814 O LYS B 143 10.012 11.804 5.271 1.00 74.10 O ATOM 1815 CB LYS B 143 8.146 14.535 5.239 1.00 42.22 C ATOM 1816 CG LYS B 143 9.250 15.035 6.199 1.00 72.24 C ATOM 1817 CD LYS B 143 10.340 15.838 5.448 1.00 1.44 C ATOM 1818 CE LYS B 143 9.789 17.156 4.858 1.00 1.34 C ATOM 1819 NZ LYS B 143 10.823 17.923 4.129 1.00 13.34 N ATOM 0 H LYS B 143 6.757 13.677 3.341 1.00 74.54 H new ATOM 0 HA LYS B 143 9.587 13.838 3.799 1.00 11.02 H new ATOM 0 HB2 LYS B 143 7.734 15.386 4.697 1.00 42.22 H new ATOM 0 HB3 LYS B 143 7.333 14.105 5.824 1.00 42.22 H new ATOM 0 HG2 LYS B 143 8.804 15.661 6.972 1.00 72.24 H new ATOM 0 HG3 LYS B 143 9.707 14.184 6.703 1.00 72.24 H new ATOM 0 HD2 LYS B 143 11.160 16.062 6.131 1.00 1.44 H new ATOM 0 HD3 LYS B 143 10.752 15.226 4.645 1.00 1.44 H new ATOM 0 HE2 LYS B 143 8.963 16.931 4.183 1.00 1.34 H new ATOM 0 HE3 LYS B 143 9.385 17.770 5.663 1.00 1.34 H new ATOM 0 HZ1 LYS B 143 10.405 18.798 3.752 1.00 13.34 H new ATOM 0 HZ2 LYS B 143 11.600 18.162 4.778 1.00 13.34 H new ATOM 0 HZ3 LYS B 143 11.192 17.349 3.344 1.00 13.34 H new ATOM 1833 N ALA B 144 7.763 11.384 5.108 1.00 53.33 N ATOM 1834 CA ALA B 144 7.750 10.086 5.804 1.00 14.13 C ATOM 1835 C ALA B 144 8.713 9.069 5.175 1.00 53.25 C ATOM 1836 O ALA B 144 9.259 8.239 5.886 1.00 4.21 O ATOM 1837 CB ALA B 144 6.332 9.521 5.837 1.00 12.31 C ATOM 0 H ALA B 144 6.844 11.668 4.770 1.00 53.33 H new ATOM 0 HA ALA B 144 8.096 10.265 6.822 1.00 14.13 H new ATOM 0 HB1 ALA B 144 6.335 8.561 6.354 1.00 12.31 H new ATOM 0 HB2 ALA B 144 5.676 10.215 6.363 1.00 12.31 H new ATOM 0 HB3 ALA B 144 5.971 9.383 4.818 1.00 12.31 H new ATOM 1843 N TRP B 145 8.904 9.162 3.843 1.00 30.40 N ATOM 1844 CA TRP B 145 9.877 8.352 3.081 1.00 33.42 C ATOM 1845 C TRP B 145 11.280 8.389 3.758 1.00 54.50 C ATOM 1846 O TRP B 145 11.823 7.350 4.160 1.00 13.44 O ATOM 1847 CB TRP B 145 9.907 8.870 1.582 1.00 51.10 C ATOM 1848 CG TRP B 145 11.277 8.874 0.920 1.00 44.11 C ATOM 1849 CD1 TRP B 145 11.955 7.806 0.408 1.00 51.33 C ATOM 1850 CD2 TRP B 145 12.125 10.023 0.708 1.00 72.54 C ATOM 1851 NE1 TRP B 145 13.178 8.204 -0.065 1.00 72.14 N ATOM 1852 CE2 TRP B 145 13.307 9.557 0.103 1.00 23.54 C ATOM 1853 CE3 TRP B 145 12.002 11.398 0.980 1.00 50.42 C ATOM 1854 CZ2 TRP B 145 14.363 10.404 -0.219 1.00 53.25 C ATOM 1855 CZ3 TRP B 145 13.047 12.235 0.658 1.00 54.43 C ATOM 1856 CH2 TRP B 145 14.212 11.739 0.060 1.00 1.33 C ATOM 0 H TRP B 145 8.379 9.812 3.258 1.00 30.40 H new ATOM 0 HA TRP B 145 9.573 7.305 3.075 1.00 33.42 H new ATOM 0 HB2 TRP B 145 9.237 8.249 0.987 1.00 51.10 H new ATOM 0 HB3 TRP B 145 9.508 9.884 1.558 1.00 51.10 H new ATOM 0 HD1 TRP B 145 11.581 6.793 0.380 1.00 51.33 H new ATOM 0 HE1 TRP B 145 13.881 7.590 -0.477 1.00 72.14 H new ATOM 0 HE3 TRP B 145 11.104 11.790 1.433 1.00 50.42 H new ATOM 0 HZ2 TRP B 145 15.267 10.025 -0.671 1.00 53.25 H new ATOM 0 HZ3 TRP B 145 12.967 13.291 0.870 1.00 54.43 H new ATOM 0 HH2 TRP B 145 15.010 12.423 -0.187 1.00 1.33 H new ATOM 1867 N LYS B 146 11.825 9.606 3.903 1.00 71.44 N ATOM 1868 CA LYS B 146 13.169 9.828 4.478 1.00 43.50 C ATOM 1869 C LYS B 146 13.127 9.793 6.009 1.00 61.20 C ATOM 1870 O LYS B 146 14.125 9.460 6.651 1.00 10.14 O ATOM 1871 CB LYS B 146 13.746 11.159 3.946 1.00 63.02 C ATOM 1872 CG LYS B 146 15.080 11.632 4.565 1.00 43.14 C ATOM 1873 CD LYS B 146 15.665 12.874 3.847 1.00 21.22 C ATOM 1874 CE LYS B 146 14.699 14.073 3.820 1.00 70.42 C ATOM 1875 NZ LYS B 146 15.311 15.260 3.163 1.00 14.23 N ATOM 0 H LYS B 146 11.351 10.466 3.627 1.00 71.44 H new ATOM 0 HA LYS B 146 13.830 9.020 4.165 1.00 43.50 H new ATOM 0 HB2 LYS B 146 13.885 11.064 2.869 1.00 63.02 H new ATOM 0 HB3 LYS B 146 13.002 11.940 4.103 1.00 63.02 H new ATOM 0 HG2 LYS B 146 14.924 11.866 5.618 1.00 43.14 H new ATOM 0 HG3 LYS B 146 15.804 10.818 4.523 1.00 43.14 H new ATOM 0 HD2 LYS B 146 16.588 13.171 4.344 1.00 21.22 H new ATOM 0 HD3 LYS B 146 15.927 12.604 2.824 1.00 21.22 H new ATOM 0 HE2 LYS B 146 13.788 13.794 3.291 1.00 70.42 H new ATOM 0 HE3 LYS B 146 14.410 14.330 4.839 1.00 70.42 H new ATOM 0 HZ1 LYS B 146 14.631 16.047 3.164 1.00 14.23 H new ATOM 0 HZ2 LYS B 146 16.167 15.542 3.683 1.00 14.23 H new ATOM 0 HZ3 LYS B 146 15.564 15.022 2.183 1.00 14.23 H new ATOM 1889 N ALA B 147 11.954 10.095 6.587 1.00 51.44 N ATOM 1890 CA ALA B 147 11.750 10.038 8.042 1.00 44.43 C ATOM 1891 C ALA B 147 11.841 8.583 8.543 1.00 75.44 C ATOM 1892 O ALA B 147 12.200 8.333 9.694 1.00 12.31 O ATOM 1893 CB ALA B 147 10.401 10.674 8.411 1.00 72.31 C ATOM 0 H ALA B 147 11.127 10.383 6.064 1.00 51.44 H new ATOM 0 HA ALA B 147 12.539 10.607 8.534 1.00 44.43 H new ATOM 0 HB1 ALA B 147 10.260 10.627 9.491 1.00 72.31 H new ATOM 0 HB2 ALA B 147 10.389 11.715 8.089 1.00 72.31 H new ATOM 0 HB3 ALA B 147 9.596 10.132 7.916 1.00 72.31 H new ATOM 1899 N LYS B 148 11.517 7.635 7.644 1.00 4.24 N ATOM 1900 CA LYS B 148 11.645 6.197 7.884 1.00 13.32 C ATOM 1901 C LYS B 148 13.069 5.717 7.593 1.00 42.21 C ATOM 1902 O LYS B 148 13.639 4.964 8.384 1.00 4.13 O ATOM 1903 CB LYS B 148 10.637 5.433 6.998 1.00 41.24 C ATOM 1904 CG LYS B 148 9.168 5.584 7.423 1.00 3.52 C ATOM 1905 CD LYS B 148 8.877 5.005 8.823 1.00 33.32 C ATOM 1906 CE LYS B 148 9.161 3.505 8.907 1.00 24.15 C ATOM 1907 NZ LYS B 148 8.667 2.936 10.174 1.00 34.13 N ATOM 0 H LYS B 148 11.154 7.857 6.717 1.00 4.24 H new ATOM 0 HA LYS B 148 11.430 6.000 8.934 1.00 13.32 H new ATOM 0 HB2 LYS B 148 10.741 5.780 5.970 1.00 41.24 H new ATOM 0 HB3 LYS B 148 10.897 4.374 7.005 1.00 41.24 H new ATOM 0 HG2 LYS B 148 8.900 6.640 7.411 1.00 3.52 H new ATOM 0 HG3 LYS B 148 8.532 5.086 6.692 1.00 3.52 H new ATOM 0 HD2 LYS B 148 9.483 5.528 9.562 1.00 33.32 H new ATOM 0 HD3 LYS B 148 7.834 5.189 9.079 1.00 33.32 H new ATOM 0 HE2 LYS B 148 8.687 2.996 8.068 1.00 24.15 H new ATOM 0 HE3 LYS B 148 10.234 3.330 8.821 1.00 24.15 H new ATOM 0 HZ1 LYS B 148 8.656 1.898 10.107 1.00 34.13 H new ATOM 0 HZ2 LYS B 148 9.293 3.226 10.952 1.00 34.13 H new ATOM 0 HZ3 LYS B 148 7.703 3.282 10.358 1.00 34.13 H new ATOM 1921 N ALA B 149 13.624 6.166 6.447 1.00 1.51 N ATOM 1922 CA ALA B 149 14.979 5.783 5.997 1.00 55.51 C ATOM 1923 C ALA B 149 16.050 6.134 7.056 1.00 32.34 C ATOM 1924 O ALA B 149 16.947 5.331 7.334 1.00 34.21 O ATOM 1925 CB ALA B 149 15.292 6.455 4.648 1.00 43.13 C ATOM 0 H ALA B 149 13.146 6.803 5.809 1.00 1.51 H new ATOM 0 HA ALA B 149 15.003 4.701 5.865 1.00 55.51 H new ATOM 0 HB1 ALA B 149 16.292 6.169 4.322 1.00 43.13 H new ATOM 0 HB2 ALA B 149 14.562 6.135 3.904 1.00 43.13 H new ATOM 0 HB3 ALA B 149 15.244 7.538 4.761 1.00 43.13 H new ATOM 1931 N GLN B 150 15.913 7.330 7.656 1.00 2.52 N ATOM 1932 CA GLN B 150 16.804 7.824 8.729 1.00 53.50 C ATOM 1933 C GLN B 150 16.536 7.099 10.069 1.00 13.55 C ATOM 1934 O GLN B 150 17.440 6.968 10.897 1.00 15.45 O ATOM 1935 CB GLN B 150 16.620 9.355 8.920 1.00 20.32 C ATOM 1936 CG GLN B 150 17.040 10.229 7.718 1.00 31.14 C ATOM 1937 CD GLN B 150 16.659 11.715 7.860 1.00 21.41 C ATOM 1938 OE1 GLN B 150 15.511 12.001 8.475 1.00 12.13 O flip ATOM 1939 NE2 GLN B 150 17.368 12.604 7.377 1.00 62.40 N flip ATOM 0 H GLN B 150 15.175 7.989 7.410 1.00 2.52 H new ATOM 0 HA GLN B 150 17.830 7.614 8.426 1.00 53.50 H new ATOM 0 HB2 GLN B 150 15.571 9.553 9.142 1.00 20.32 H new ATOM 0 HB3 GLN B 150 17.195 9.667 9.792 1.00 20.32 H new ATOM 0 HG2 GLN B 150 18.119 10.152 7.586 1.00 31.14 H new ATOM 0 HG3 GLN B 150 16.579 9.831 6.814 1.00 31.14 H new ATOM 0 HE21 GLN B 150 18.242 12.362 6.911 1.00 62.40 H new ATOM 0 HE22 GLN B 150 17.079 13.580 7.444 1.00 62.40 H new ATOM 1948 N ALA B 151 15.283 6.650 10.280 1.00 20.30 N ATOM 1949 CA ALA B 151 14.861 6.023 11.548 1.00 2.23 C ATOM 1950 C ALA B 151 15.360 4.570 11.663 1.00 42.44 C ATOM 1951 O ALA B 151 15.941 4.187 12.685 1.00 21.11 O ATOM 1952 CB ALA B 151 13.334 6.089 11.676 1.00 12.31 C ATOM 0 H ALA B 151 14.541 6.711 9.583 1.00 20.30 H new ATOM 0 HA ALA B 151 15.313 6.580 12.369 1.00 2.23 H new ATOM 0 HB1 ALA B 151 13.027 5.625 12.613 1.00 12.31 H new ATOM 0 HB2 ALA B 151 13.013 7.130 11.664 1.00 12.31 H new ATOM 0 HB3 ALA B 151 12.876 5.558 10.841 1.00 12.31 H new ATOM 1958 N THR B 152 15.167 3.794 10.585 1.00 42.33 N ATOM 1959 CA THR B 152 15.372 2.332 10.575 1.00 73.35 C ATOM 1960 C THR B 152 16.830 1.967 10.201 1.00 61.45 C ATOM 1961 O THR B 152 17.088 1.108 9.344 1.00 63.45 O ATOM 1962 CB THR B 152 14.352 1.677 9.588 1.00 34.25 C ATOM 1963 OG1 THR B 152 14.560 2.198 8.264 1.00 3.50 O ATOM 1964 CG2 THR B 152 12.895 1.945 10.020 1.00 1.30 C ATOM 0 H THR B 152 14.861 4.165 9.685 1.00 42.33 H new ATOM 0 HA THR B 152 15.198 1.943 11.578 1.00 73.35 H new ATOM 0 HB THR B 152 14.518 0.600 9.599 1.00 34.25 H new ATOM 0 HG1 THR B 152 14.167 3.094 8.199 1.00 3.50 H new ATOM 0 HG21 THR B 152 12.213 1.475 9.311 1.00 1.30 H new ATOM 0 HG22 THR B 152 12.728 1.530 11.014 1.00 1.30 H new ATOM 0 HG23 THR B 152 12.713 3.020 10.040 1.00 1.30 H new ATOM 1972 N VAL B 153 17.772 2.622 10.895 1.00 42.44 N ATOM 1973 CA VAL B 153 19.225 2.387 10.761 1.00 62.24 C ATOM 1974 C VAL B 153 19.638 0.994 11.291 1.00 54.11 C ATOM 1975 O VAL B 153 20.710 0.479 10.948 1.00 43.22 O ATOM 1976 CB VAL B 153 20.033 3.504 11.514 1.00 2.12 C ATOM 1977 CG1 VAL B 153 19.913 4.859 10.784 1.00 14.33 C ATOM 1978 CG2 VAL B 153 19.573 3.640 12.991 1.00 25.10 C ATOM 0 H VAL B 153 17.546 3.344 11.579 1.00 42.44 H new ATOM 0 HA VAL B 153 19.460 2.423 9.697 1.00 62.24 H new ATOM 0 HB VAL B 153 21.081 3.204 11.515 1.00 2.12 H new ATOM 0 HG11 VAL B 153 20.481 5.615 11.325 1.00 14.33 H new ATOM 0 HG12 VAL B 153 20.308 4.764 9.772 1.00 14.33 H new ATOM 0 HG13 VAL B 153 18.865 5.156 10.738 1.00 14.33 H new ATOM 0 HG21 VAL B 153 20.153 4.422 13.482 1.00 25.10 H new ATOM 0 HG22 VAL B 153 18.515 3.900 13.020 1.00 25.10 H new ATOM 0 HG23 VAL B 153 19.728 2.694 13.509 1.00 25.10 H new ATOM 1988 N ASP B 154 18.780 0.430 12.150 1.00 31.52 N ATOM 1989 CA ASP B 154 18.926 -0.929 12.708 1.00 61.55 C ATOM 1990 C ASP B 154 18.801 -1.988 11.605 1.00 1.23 C ATOM 1991 O ASP B 154 19.461 -3.036 11.651 1.00 63.43 O ATOM 1992 CB ASP B 154 17.832 -1.167 13.780 1.00 21.35 C ATOM 1993 CG ASP B 154 17.842 -0.096 14.881 1.00 13.14 C ATOM 1994 OD1 ASP B 154 17.244 0.982 14.672 1.00 50.30 O ATOM 1995 OD2 ASP B 154 18.449 -0.313 15.949 1.00 71.11 O ATOM 0 H ASP B 154 17.946 0.912 12.486 1.00 31.52 H new ATOM 0 HA ASP B 154 19.914 -1.015 13.160 1.00 61.55 H new ATOM 0 HB2 ASP B 154 16.854 -1.180 13.299 1.00 21.35 H new ATOM 0 HB3 ASP B 154 17.978 -2.148 14.231 1.00 21.35 H new ATOM 2000 N ASN B 155 17.937 -1.691 10.619 1.00 11.41 N ATOM 2001 CA ASN B 155 17.673 -2.578 9.475 1.00 44.31 C ATOM 2002 C ASN B 155 18.840 -2.547 8.473 1.00 32.53 C ATOM 2003 O ASN B 155 19.641 -1.603 8.453 1.00 15.42 O ATOM 2004 CB ASN B 155 16.362 -2.178 8.769 1.00 42.10 C ATOM 2005 CG ASN B 155 15.121 -2.351 9.648 1.00 55.34 C ATOM 2006 OD1 ASN B 155 15.135 -2.063 10.847 1.00 63.20 O ATOM 2007 ND2 ASN B 155 14.054 -2.867 9.073 1.00 30.54 N ATOM 0 H ASN B 155 17.400 -0.824 10.594 1.00 11.41 H new ATOM 0 HA ASN B 155 17.572 -3.594 9.857 1.00 44.31 H new ATOM 0 HB2 ASN B 155 16.432 -1.137 8.452 1.00 42.10 H new ATOM 0 HB3 ASN B 155 16.246 -2.779 7.867 1.00 42.10 H new ATOM 0 HD21 ASN B 155 13.211 -3.038 9.622 1.00 30.54 H new ATOM 0 HD22 ASN B 155 14.071 -3.096 8.079 1.00 30.54 H new ATOM 2014 N ALA B 156 18.909 -3.588 7.636 1.00 61.00 N ATOM 2015 CA ALA B 156 19.975 -3.757 6.640 1.00 64.10 C ATOM 2016 C ALA B 156 19.463 -3.452 5.225 1.00 45.44 C ATOM 2017 O ALA B 156 20.119 -2.750 4.452 1.00 41.25 O ATOM 2018 CB ALA B 156 20.517 -5.191 6.722 1.00 55.52 C ATOM 0 H ALA B 156 18.223 -4.342 7.630 1.00 61.00 H new ATOM 0 HA ALA B 156 20.778 -3.052 6.856 1.00 64.10 H new ATOM 0 HB1 ALA B 156 21.309 -5.323 5.985 1.00 55.52 H new ATOM 0 HB2 ALA B 156 20.916 -5.373 7.720 1.00 55.52 H new ATOM 0 HB3 ALA B 156 19.711 -5.897 6.519 1.00 55.52 H new ATOM 2024 N HIS B 157 18.269 -3.982 4.905 1.00 63.11 N ATOM 2025 CA HIS B 157 17.740 -3.998 3.518 1.00 31.11 C ATOM 2026 C HIS B 157 16.492 -3.124 3.358 1.00 3.02 C ATOM 2027 O HIS B 157 15.946 -3.028 2.264 1.00 60.51 O ATOM 2028 CB HIS B 157 17.394 -5.452 3.114 1.00 31.14 C ATOM 2029 CG HIS B 157 18.461 -6.469 3.414 1.00 30.43 C ATOM 2030 ND1 HIS B 157 18.494 -7.185 4.594 1.00 63.43 N ATOM 2031 CD2 HIS B 157 19.523 -6.900 2.691 1.00 5.11 C ATOM 2032 CE1 HIS B 157 19.529 -7.997 4.584 1.00 74.15 C ATOM 2033 NE2 HIS B 157 20.164 -7.845 3.445 1.00 1.32 N ATOM 0 H HIS B 157 17.644 -4.409 5.589 1.00 63.11 H new ATOM 0 HA HIS B 157 18.516 -3.591 2.870 1.00 31.11 H new ATOM 0 HB2 HIS B 157 16.478 -5.747 3.627 1.00 31.14 H new ATOM 0 HB3 HIS B 157 17.182 -5.475 2.045 1.00 31.14 H new ATOM 0 HD1 HIS B 157 17.821 -7.098 5.355 1.00 63.43 H new ATOM 0 HD2 HIS B 157 19.809 -6.562 1.706 1.00 5.11 H new ATOM 0 HE1 HIS B 157 19.809 -8.674 5.378 1.00 74.15 H new ATOM 2042 N ALA B 158 16.056 -2.500 4.448 1.00 4.33 N ATOM 2043 CA ALA B 158 14.763 -1.800 4.520 1.00 32.05 C ATOM 2044 C ALA B 158 14.805 -0.464 3.782 1.00 0.21 C ATOM 2045 O ALA B 158 15.416 0.501 4.254 1.00 1.05 O ATOM 2046 CB ALA B 158 14.322 -1.609 5.970 1.00 50.40 C ATOM 0 H ALA B 158 16.589 -2.461 5.317 1.00 4.33 H new ATOM 0 HA ALA B 158 14.025 -2.428 4.021 1.00 32.05 H new ATOM 0 HB1 ALA B 158 13.364 -1.089 5.994 1.00 50.40 H new ATOM 0 HB2 ALA B 158 14.219 -2.582 6.450 1.00 50.40 H new ATOM 0 HB3 ALA B 158 15.068 -1.019 6.502 1.00 50.40 H new ATOM 2052 N ARG B 159 14.175 -0.438 2.609 1.00 34.51 N ATOM 2053 CA ARG B 159 14.132 0.730 1.734 1.00 54.11 C ATOM 2054 C ARG B 159 12.686 1.226 1.636 1.00 44.14 C ATOM 2055 O ARG B 159 11.898 0.749 0.809 1.00 3.40 O ATOM 2056 CB ARG B 159 14.718 0.357 0.353 1.00 62.52 C ATOM 2057 CG ARG B 159 16.186 -0.125 0.382 1.00 45.25 C ATOM 2058 CD ARG B 159 17.152 0.900 1.011 1.00 53.54 C ATOM 2059 NE ARG B 159 18.495 0.327 1.241 1.00 62.22 N ATOM 2060 CZ ARG B 159 18.949 -0.144 2.416 1.00 72.30 C ATOM 2061 NH1 ARG B 159 18.182 -0.119 3.510 1.00 45.42 N ATOM 2062 NH2 ARG B 159 20.177 -0.634 2.496 1.00 73.01 N ATOM 0 H ARG B 159 13.672 -1.242 2.234 1.00 34.51 H new ATOM 0 HA ARG B 159 14.737 1.541 2.139 1.00 54.11 H new ATOM 0 HB2 ARG B 159 14.102 -0.426 -0.088 1.00 62.52 H new ATOM 0 HB3 ARG B 159 14.648 1.225 -0.302 1.00 62.52 H new ATOM 0 HG2 ARG B 159 16.244 -1.059 0.941 1.00 45.25 H new ATOM 0 HG3 ARG B 159 16.510 -0.342 -0.636 1.00 45.25 H new ATOM 0 HD2 ARG B 159 17.235 1.768 0.357 1.00 53.54 H new ATOM 0 HD3 ARG B 159 16.741 1.252 1.957 1.00 53.54 H new ATOM 0 HE ARG B 159 19.129 0.285 0.443 1.00 62.22 H new ATOM 0 HH11 ARG B 159 17.237 0.261 3.462 1.00 45.42 H new ATOM 0 HH12 ARG B 159 18.542 -0.480 4.393 1.00 45.42 H new ATOM 0 HH21 ARG B 159 20.773 -0.653 1.669 1.00 73.01 H new ATOM 0 HH22 ARG B 159 20.526 -0.992 3.385 1.00 73.01 H new ATOM 2076 N TYR B 160 12.338 2.138 2.555 1.00 54.20 N ATOM 2077 CA TYR B 160 10.997 2.722 2.657 1.00 21.30 C ATOM 2078 C TYR B 160 10.826 3.832 1.622 1.00 74.20 C ATOM 2079 O TYR B 160 11.538 4.842 1.660 1.00 40.44 O ATOM 2080 CB TYR B 160 10.751 3.275 4.078 1.00 31.31 C ATOM 2081 CG TYR B 160 10.842 2.207 5.170 1.00 45.44 C ATOM 2082 CD1 TYR B 160 12.059 1.873 5.747 1.00 32.12 C ATOM 2083 CD2 TYR B 160 9.711 1.525 5.611 1.00 62.01 C ATOM 2084 CE1 TYR B 160 12.140 0.900 6.710 1.00 71.42 C ATOM 2085 CE2 TYR B 160 9.790 0.555 6.581 1.00 33.20 C ATOM 2086 CZ TYR B 160 11.012 0.241 7.127 1.00 10.54 C ATOM 2087 OH TYR B 160 11.110 -0.736 8.096 1.00 44.40 O ATOM 0 H TYR B 160 12.989 2.494 3.255 1.00 54.20 H new ATOM 0 HA TYR B 160 10.264 1.940 2.460 1.00 21.30 H new ATOM 0 HB2 TYR B 160 11.479 4.059 4.286 1.00 31.31 H new ATOM 0 HB3 TYR B 160 9.765 3.738 4.114 1.00 31.31 H new ATOM 0 HD1 TYR B 160 12.956 2.387 5.433 1.00 32.12 H new ATOM 0 HD2 TYR B 160 8.750 1.764 5.181 1.00 62.01 H new ATOM 0 HE1 TYR B 160 13.098 0.651 7.143 1.00 71.42 H new ATOM 0 HE2 TYR B 160 8.899 0.043 6.912 1.00 33.20 H new ATOM 0 HH TYR B 160 10.386 -0.625 8.747 1.00 44.40 H new ATOM 2097 N PHE B 161 9.901 3.613 0.690 1.00 74.33 N ATOM 2098 CA PHE B 161 9.558 4.574 -0.363 1.00 5.41 C ATOM 2099 C PHE B 161 8.039 4.808 -0.367 1.00 30.32 C ATOM 2100 O PHE B 161 7.371 4.612 0.657 1.00 10.15 O ATOM 2101 CB PHE B 161 10.081 4.071 -1.735 1.00 62.42 C ATOM 2102 CG PHE B 161 11.604 3.957 -1.827 1.00 12.32 C ATOM 2103 CD1 PHE B 161 12.403 5.076 -1.642 1.00 55.15 C ATOM 2104 CD2 PHE B 161 12.233 2.742 -2.087 1.00 10.42 C ATOM 2105 CE1 PHE B 161 13.776 4.986 -1.705 1.00 4.35 C ATOM 2106 CE2 PHE B 161 13.610 2.655 -2.157 1.00 70.24 C ATOM 2107 CZ PHE B 161 14.382 3.777 -1.960 1.00 40.11 C ATOM 0 H PHE B 161 9.359 2.750 0.642 1.00 74.33 H new ATOM 0 HA PHE B 161 10.041 5.531 -0.168 1.00 5.41 H new ATOM 0 HB2 PHE B 161 9.643 3.095 -1.942 1.00 62.42 H new ATOM 0 HB3 PHE B 161 9.732 4.749 -2.514 1.00 62.42 H new ATOM 0 HD1 PHE B 161 11.941 6.032 -1.446 1.00 55.15 H new ATOM 0 HD2 PHE B 161 11.636 1.855 -2.236 1.00 10.42 H new ATOM 0 HE1 PHE B 161 14.380 5.868 -1.554 1.00 4.35 H new ATOM 0 HE2 PHE B 161 14.081 1.706 -2.366 1.00 70.24 H new ATOM 0 HZ PHE B 161 15.459 3.709 -2.005 1.00 40.11 H new ATOM 2117 N ILE B 162 7.500 5.250 -1.517 1.00 73.23 N ATOM 2118 CA ILE B 162 6.130 5.765 -1.622 1.00 61.35 C ATOM 2119 C ILE B 162 5.454 5.109 -2.841 1.00 54.25 C ATOM 2120 O ILE B 162 6.144 4.659 -3.750 1.00 63.42 O ATOM 2121 CB ILE B 162 6.129 7.348 -1.797 1.00 14.44 C ATOM 2122 CG1 ILE B 162 7.294 8.042 -1.012 1.00 1.01 C ATOM 2123 CG2 ILE B 162 4.785 7.931 -1.347 1.00 52.54 C ATOM 2124 CD1 ILE B 162 7.461 9.530 -1.293 1.00 53.12 C ATOM 0 H ILE B 162 8.008 5.259 -2.402 1.00 73.23 H new ATOM 0 HA ILE B 162 5.586 5.526 -0.708 1.00 61.35 H new ATOM 0 HB ILE B 162 6.285 7.548 -2.857 1.00 14.44 H new ATOM 0 HG12 ILE B 162 7.124 7.906 0.056 1.00 1.01 H new ATOM 0 HG13 ILE B 162 8.228 7.535 -1.254 1.00 1.01 H new ATOM 0 HG21 ILE B 162 4.798 9.014 -1.472 1.00 52.54 H new ATOM 0 HG22 ILE B 162 3.983 7.506 -1.951 1.00 52.54 H new ATOM 0 HG23 ILE B 162 4.616 7.689 -0.298 1.00 52.54 H new ATOM 0 HD11 ILE B 162 8.291 9.921 -0.704 1.00 53.12 H new ATOM 0 HD12 ILE B 162 7.666 9.679 -2.353 1.00 53.12 H new ATOM 0 HD13 ILE B 162 6.545 10.056 -1.023 1.00 53.12 H new ATOM 2136 N ILE B 163 4.114 5.022 -2.850 1.00 73.11 N ATOM 2137 CA ILE B 163 3.329 4.626 -4.041 1.00 51.10 C ATOM 2138 C ILE B 163 2.068 5.502 -4.122 1.00 45.35 C ATOM 2139 O ILE B 163 1.442 5.786 -3.105 1.00 12.44 O ATOM 2140 CB ILE B 163 2.891 3.108 -4.047 1.00 60.11 C ATOM 2141 CG1 ILE B 163 4.111 2.146 -3.961 1.00 14.34 C ATOM 2142 CG2 ILE B 163 2.055 2.793 -5.311 1.00 14.45 C ATOM 2143 CD1 ILE B 163 3.755 0.667 -3.956 1.00 50.20 C ATOM 0 H ILE B 163 3.539 5.224 -2.032 1.00 73.11 H new ATOM 0 HA ILE B 163 3.982 4.768 -4.902 1.00 51.10 H new ATOM 0 HB ILE B 163 2.280 2.945 -3.159 1.00 60.11 H new ATOM 0 HG12 ILE B 163 4.772 2.344 -4.804 1.00 14.34 H new ATOM 0 HG13 ILE B 163 4.673 2.374 -3.055 1.00 14.34 H new ATOM 0 HG21 ILE B 163 1.761 1.743 -5.300 1.00 14.45 H new ATOM 0 HG22 ILE B 163 1.163 3.420 -5.323 1.00 14.45 H new ATOM 0 HG23 ILE B 163 2.651 2.994 -6.201 1.00 14.45 H new ATOM 0 HD11 ILE B 163 4.667 0.073 -3.894 1.00 50.20 H new ATOM 0 HD12 ILE B 163 3.121 0.448 -3.097 1.00 50.20 H new ATOM 0 HD13 ILE B 163 3.222 0.418 -4.874 1.00 50.20 H new ATOM 2155 N HIS B 164 1.713 5.907 -5.349 1.00 5.44 N ATOM 2156 CA HIS B 164 0.481 6.666 -5.644 1.00 14.10 C ATOM 2157 C HIS B 164 -0.771 5.830 -5.290 1.00 64.35 C ATOM 2158 O HIS B 164 -0.871 4.662 -5.683 1.00 30.15 O ATOM 2159 CB HIS B 164 0.466 7.099 -7.137 1.00 13.45 C ATOM 2160 CG HIS B 164 0.445 5.960 -8.140 1.00 21.25 C ATOM 2161 ND1 HIS B 164 -0.610 5.723 -8.991 1.00 43.21 N ATOM 2162 CD2 HIS B 164 1.368 5.009 -8.427 1.00 13.33 C ATOM 2163 CE1 HIS B 164 -0.336 4.678 -9.747 1.00 20.34 C ATOM 2164 NE2 HIS B 164 0.860 4.227 -9.427 1.00 11.25 N ATOM 0 H HIS B 164 2.277 5.717 -6.177 1.00 5.44 H new ATOM 0 HA HIS B 164 0.464 7.565 -5.028 1.00 14.10 H new ATOM 0 HB2 HIS B 164 -0.408 7.728 -7.307 1.00 13.45 H new ATOM 0 HB3 HIS B 164 1.345 7.715 -7.329 1.00 13.45 H new ATOM 0 HD1 HIS B 164 -1.470 6.270 -9.031 1.00 43.21 H new ATOM 0 HD2 HIS B 164 2.330 4.891 -7.952 1.00 13.33 H new ATOM 0 HE1 HIS B 164 -0.984 4.261 -10.503 1.00 20.34 H new ATOM 2173 N ALA B 165 -1.709 6.431 -4.539 1.00 13.24 N ATOM 2174 CA ALA B 165 -2.897 5.725 -4.036 1.00 11.51 C ATOM 2175 C ALA B 165 -4.179 6.507 -4.335 1.00 13.32 C ATOM 2176 O ALA B 165 -4.605 7.370 -3.552 1.00 72.42 O ATOM 2177 CB ALA B 165 -2.751 5.454 -2.542 1.00 41.12 C ATOM 0 H ALA B 165 -1.665 7.413 -4.266 1.00 13.24 H new ATOM 0 HA ALA B 165 -2.975 4.770 -4.555 1.00 11.51 H new ATOM 0 HB1 ALA B 165 -3.636 4.931 -2.179 1.00 41.12 H new ATOM 0 HB2 ALA B 165 -1.869 4.838 -2.368 1.00 41.12 H new ATOM 0 HB3 ALA B 165 -2.644 6.399 -2.010 1.00 41.12 H new ATOM 2183 N HIS B 166 -4.739 6.230 -5.513 1.00 51.11 N ATOM 2184 CA HIS B 166 -6.076 6.671 -5.913 1.00 10.04 C ATOM 2185 C HIS B 166 -6.555 5.773 -7.057 1.00 4.22 C ATOM 2186 O HIS B 166 -7.723 5.377 -7.100 1.00 25.43 O ATOM 2187 CB HIS B 166 -6.069 8.161 -6.333 1.00 13.24 C ATOM 2188 CG HIS B 166 -7.438 8.736 -6.595 1.00 30.13 C ATOM 2189 ND1 HIS B 166 -8.171 9.391 -5.626 1.00 21.55 N ATOM 2190 CD2 HIS B 166 -8.199 8.760 -7.710 1.00 64.51 C ATOM 2191 CE1 HIS B 166 -9.311 9.786 -6.138 1.00 50.13 C ATOM 2192 NE2 HIS B 166 -9.355 9.419 -7.398 1.00 23.14 N ATOM 0 H HIS B 166 -4.266 5.681 -6.231 1.00 51.11 H new ATOM 0 HA HIS B 166 -6.761 6.586 -5.069 1.00 10.04 H new ATOM 0 HB2 HIS B 166 -5.586 8.745 -5.550 1.00 13.24 H new ATOM 0 HB3 HIS B 166 -5.463 8.270 -7.232 1.00 13.24 H new ATOM 0 HD2 HIS B 166 -7.942 8.337 -8.670 1.00 64.51 H new ATOM 0 HE1 HIS B 166 -10.085 10.324 -5.611 1.00 50.13 H new ATOM 0 HE2 HIS B 166 -10.127 9.597 -8.040 1.00 23.14 H new ATOM 2201 N LYS B 167 -5.638 5.471 -7.994 1.00 1.44 N ATOM 2202 CA LYS B 167 -5.894 4.502 -9.065 1.00 24.34 C ATOM 2203 C LYS B 167 -5.656 3.082 -8.518 1.00 51.42 C ATOM 2204 O LYS B 167 -4.516 2.601 -8.465 1.00 1.45 O ATOM 2205 CB LYS B 167 -5.007 4.774 -10.310 1.00 12.24 C ATOM 2206 CG LYS B 167 -5.349 3.867 -11.518 1.00 10.24 C ATOM 2207 CD LYS B 167 -4.416 4.080 -12.732 1.00 45.02 C ATOM 2208 CE LYS B 167 -4.777 3.156 -13.904 1.00 24.20 C ATOM 2209 NZ LYS B 167 -3.820 3.282 -15.036 1.00 35.41 N ATOM 0 H LYS B 167 -4.708 5.890 -8.027 1.00 1.44 H new ATOM 0 HA LYS B 167 -6.929 4.601 -9.391 1.00 24.34 H new ATOM 0 HB2 LYS B 167 -5.118 5.817 -10.605 1.00 12.24 H new ATOM 0 HB3 LYS B 167 -3.961 4.629 -10.041 1.00 12.24 H new ATOM 0 HG2 LYS B 167 -5.294 2.824 -11.206 1.00 10.24 H new ATOM 0 HG3 LYS B 167 -6.378 4.055 -11.823 1.00 10.24 H new ATOM 0 HD2 LYS B 167 -4.476 5.119 -13.057 1.00 45.02 H new ATOM 0 HD3 LYS B 167 -3.384 3.899 -12.432 1.00 45.02 H new ATOM 0 HE2 LYS B 167 -4.793 2.123 -13.558 1.00 24.20 H new ATOM 0 HE3 LYS B 167 -5.783 3.391 -14.253 1.00 24.20 H new ATOM 0 HZ1 LYS B 167 -4.104 2.640 -15.803 1.00 35.41 H new ATOM 0 HZ2 LYS B 167 -3.822 4.262 -15.385 1.00 35.41 H new ATOM 0 HZ3 LYS B 167 -2.864 3.033 -14.712 1.00 35.41 H new ATOM 2223 N LEU B 168 -6.741 2.460 -8.053 1.00 23.03 N ATOM 2224 CA LEU B 168 -6.731 1.106 -7.487 1.00 62.32 C ATOM 2225 C LEU B 168 -7.024 0.065 -8.587 1.00 43.14 C ATOM 2226 O LEU B 168 -7.752 0.345 -9.549 1.00 55.52 O ATOM 2227 CB LEU B 168 -7.772 1.014 -6.336 1.00 12.00 C ATOM 2228 CG LEU B 168 -7.465 1.876 -5.063 1.00 1.10 C ATOM 2229 CD1 LEU B 168 -8.649 1.902 -4.080 1.00 2.14 C ATOM 2230 CD2 LEU B 168 -6.191 1.391 -4.354 1.00 34.34 C ATOM 0 H LEU B 168 -7.667 2.888 -8.058 1.00 23.03 H new ATOM 0 HA LEU B 168 -5.744 0.891 -7.079 1.00 62.32 H new ATOM 0 HB2 LEU B 168 -8.744 1.313 -6.727 1.00 12.00 H new ATOM 0 HB3 LEU B 168 -7.858 -0.029 -6.032 1.00 12.00 H new ATOM 0 HG LEU B 168 -7.301 2.896 -5.409 1.00 1.10 H new ATOM 0 HD11 LEU B 168 -8.390 2.511 -3.214 1.00 2.14 H new ATOM 0 HD12 LEU B 168 -9.523 2.327 -4.574 1.00 2.14 H new ATOM 0 HD13 LEU B 168 -8.874 0.886 -3.755 1.00 2.14 H new ATOM 0 HD21 LEU B 168 -6.006 2.009 -3.476 1.00 34.34 H new ATOM 0 HD22 LEU B 168 -6.318 0.353 -4.047 1.00 34.34 H new ATOM 0 HD23 LEU B 168 -5.344 1.466 -5.036 1.00 34.34 H new ATOM 2242 N LEU B 169 -6.430 -1.124 -8.435 1.00 14.53 N ATOM 2243 CA LEU B 169 -6.617 -2.255 -9.344 1.00 11.22 C ATOM 2244 C LEU B 169 -7.859 -3.052 -8.931 1.00 1.31 C ATOM 2245 O LEU B 169 -8.093 -3.272 -7.738 1.00 42.21 O ATOM 2246 CB LEU B 169 -5.369 -3.170 -9.312 1.00 74.00 C ATOM 2247 CG LEU B 169 -4.020 -2.515 -9.733 1.00 74.34 C ATOM 2248 CD1 LEU B 169 -2.844 -3.486 -9.518 1.00 50.44 C ATOM 2249 CD2 LEU B 169 -4.080 -2.025 -11.192 1.00 10.14 C ATOM 0 H LEU B 169 -5.795 -1.328 -7.663 1.00 14.53 H new ATOM 0 HA LEU B 169 -6.755 -1.879 -10.358 1.00 11.22 H new ATOM 0 HB2 LEU B 169 -5.258 -3.561 -8.301 1.00 74.00 H new ATOM 0 HB3 LEU B 169 -5.554 -4.023 -9.965 1.00 74.00 H new ATOM 0 HG LEU B 169 -3.852 -1.646 -9.096 1.00 74.34 H new ATOM 0 HD11 LEU B 169 -1.914 -3.004 -9.820 1.00 50.44 H new ATOM 0 HD12 LEU B 169 -2.786 -3.759 -8.464 1.00 50.44 H new ATOM 0 HD13 LEU B 169 -2.999 -4.383 -10.117 1.00 50.44 H new ATOM 0 HD21 LEU B 169 -3.127 -1.571 -11.463 1.00 10.14 H new ATOM 0 HD22 LEU B 169 -4.281 -2.869 -11.851 1.00 10.14 H new ATOM 0 HD23 LEU B 169 -4.875 -1.287 -11.296 1.00 10.14 H new ATOM 2261 N ASP B 170 -8.627 -3.477 -9.934 1.00 25.32 N ATOM 2262 CA ASP B 170 -9.842 -4.277 -9.761 1.00 13.12 C ATOM 2263 C ASP B 170 -10.062 -5.103 -11.036 1.00 63.25 C ATOM 2264 O ASP B 170 -10.249 -4.517 -12.090 1.00 52.33 O ATOM 2265 CB ASP B 170 -11.060 -3.360 -9.485 1.00 65.52 C ATOM 2266 CG ASP B 170 -12.402 -4.111 -9.479 1.00 44.04 C ATOM 2267 OD1 ASP B 170 -12.710 -4.797 -8.488 1.00 32.42 O ATOM 2268 OD2 ASP B 170 -13.132 -4.049 -10.486 1.00 62.04 O ATOM 0 H ASP B 170 -8.418 -3.271 -10.911 1.00 25.32 H new ATOM 0 HA ASP B 170 -9.731 -4.943 -8.905 1.00 13.12 H new ATOM 0 HB2 ASP B 170 -10.924 -2.867 -8.522 1.00 65.52 H new ATOM 0 HB3 ASP B 170 -11.094 -2.576 -10.242 1.00 65.52 H new ATOM 2273 N PRO B 171 -10.064 -6.468 -10.952 1.00 70.24 N ATOM 2274 CA PRO B 171 -10.156 -7.362 -12.145 1.00 72.43 C ATOM 2275 C PRO B 171 -11.463 -7.211 -12.953 1.00 34.55 C ATOM 2276 O PRO B 171 -11.504 -7.584 -14.131 1.00 32.03 O ATOM 2277 CB PRO B 171 -10.054 -8.776 -11.534 1.00 53.22 C ATOM 2278 CG PRO B 171 -10.483 -8.597 -10.120 1.00 2.24 C ATOM 2279 CD PRO B 171 -9.970 -7.250 -9.696 1.00 14.14 C ATOM 0 HA PRO B 171 -9.378 -7.124 -12.871 1.00 72.43 H new ATOM 0 HB2 PRO B 171 -10.697 -9.483 -12.058 1.00 53.22 H new ATOM 0 HB3 PRO B 171 -9.037 -9.163 -11.595 1.00 53.22 H new ATOM 0 HG2 PRO B 171 -11.568 -8.646 -10.033 1.00 2.24 H new ATOM 0 HG3 PRO B 171 -10.077 -9.386 -9.487 1.00 2.24 H new ATOM 0 HD2 PRO B 171 -10.575 -6.816 -8.900 1.00 14.14 H new ATOM 0 HD3 PRO B 171 -8.946 -7.303 -9.325 1.00 14.14 H new ATOM 2287 N SER B 172 -12.519 -6.679 -12.312 1.00 73.45 N ATOM 2288 CA SER B 172 -13.836 -6.500 -12.954 1.00 31.31 C ATOM 2289 C SER B 172 -13.834 -5.259 -13.885 1.00 43.12 C ATOM 2290 O SER B 172 -14.801 -5.024 -14.617 1.00 31.24 O ATOM 2291 CB SER B 172 -14.939 -6.407 -11.864 1.00 25.12 C ATOM 2292 OG SER B 172 -16.252 -6.425 -12.417 1.00 43.43 O ATOM 0 H SER B 172 -12.486 -6.363 -11.343 1.00 73.45 H new ATOM 0 HA SER B 172 -14.051 -7.365 -13.582 1.00 31.31 H new ATOM 0 HB2 SER B 172 -14.829 -7.239 -11.168 1.00 25.12 H new ATOM 0 HB3 SER B 172 -14.802 -5.491 -11.290 1.00 25.12 H new ATOM 0 HG SER B 172 -16.253 -5.948 -13.273 1.00 43.43 H new ATOM 2298 N GLU B 173 -12.736 -4.466 -13.839 1.00 34.15 N ATOM 2299 CA GLU B 173 -12.511 -3.334 -14.760 1.00 12.45 C ATOM 2300 C GLU B 173 -11.005 -3.034 -14.963 1.00 42.01 C ATOM 2301 O GLU B 173 -10.633 -1.919 -15.369 1.00 64.22 O ATOM 2302 CB GLU B 173 -13.259 -2.099 -14.223 1.00 1.40 C ATOM 2303 CG GLU B 173 -12.818 -1.625 -12.822 1.00 21.24 C ATOM 2304 CD GLU B 173 -13.640 -0.430 -12.319 1.00 64.31 C ATOM 2305 OE1 GLU B 173 -13.355 0.710 -12.737 1.00 15.44 O ATOM 2306 OE2 GLU B 173 -14.599 -0.626 -11.545 1.00 0.32 O ATOM 0 H GLU B 173 -11.984 -4.596 -13.162 1.00 34.15 H new ATOM 0 HA GLU B 173 -12.901 -3.601 -15.742 1.00 12.45 H new ATOM 0 HB2 GLU B 173 -13.124 -1.277 -14.927 1.00 1.40 H new ATOM 0 HB3 GLU B 173 -14.325 -2.323 -14.195 1.00 1.40 H new ATOM 0 HG2 GLU B 173 -12.914 -2.450 -12.116 1.00 21.24 H new ATOM 0 HG3 GLU B 173 -11.764 -1.350 -12.850 1.00 21.24 H new ATOM 2313 N GLY B 174 -10.148 -4.037 -14.714 1.00 51.20 N ATOM 2314 CA GLY B 174 -8.706 -3.884 -14.885 1.00 14.12 C ATOM 2315 C GLY B 174 -7.936 -5.103 -14.373 1.00 21.21 C ATOM 2316 O GLY B 174 -7.489 -5.105 -13.199 1.00 63.44 O ATOM 2317 OXT GLY B 174 -7.795 -6.079 -15.134 1.00 37.55 O ATOM 0 H GLY B 174 -10.436 -4.962 -14.393 1.00 51.20 H new ATOM 0 HA2 GLY B 174 -8.480 -3.730 -15.940 1.00 14.12 H new ATOM 0 HA3 GLY B 174 -8.370 -2.994 -14.354 1.00 14.12 H new TER 2321 GLY B 174