USER MOD reduce.3.24.130724 H: found=0, std=0, add=1696, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1692 hydrogens (26 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 72 LYS NZ :NH3+ -165:sc= -0.0193 (180deg=-0.202) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 162:sc= 0.177 (180deg=0.0266) USER MOD Single : A 7 THR OG1 : rot 89:sc= 0.972 USER MOD Single : A 12 SER OG : rot 59:sc= 0.351 USER MOD Single : A 15 THR OG1 : rot 62:sc= 0.72 USER MOD Single : A 18 THR OG1 : rot 5:sc= 0.255 USER MOD Single : A 19 THR OG1 : rot 76:sc= 1.03 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 140:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 75:sc= 0.215 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= -0.0907 K(o=-0.091,f=-2.3!) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 51 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00359) USER MOD Single : A 55 SER OG : rot 6:sc= 0.617 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0348) USER MOD Single : A 62 SER OG : rot 79:sc= 0.122 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 67 GLN : amide:sc= -0.0503 K(o=-0.05,f=-0.81) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0.41) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 154:sc= -0.0495 (180deg=-1.02) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0819) USER MOD Single : A 98 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0629) USER MOD Single : A 99 ANW OAV : rot 179:sc= 0.471! USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 161:sc= 0.0279 (180deg=-0.086) USER MOD Single : B 7 THR OG1 : rot 113:sc= 0.628 USER MOD Single : B 12 SER OG : rot 56:sc= 0.779 USER MOD Single : B 15 THR OG1 : rot 64:sc= 1.04 USER MOD Single : B 18 THR OG1 : rot -4:sc= 0.147 USER MOD Single : B 19 THR OG1 : rot 78:sc= 0.898 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 38:sc= 0.0947 USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 75:sc= 0.918 USER MOD Single : B 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 45 GLN : amide:sc=-0.00235 X(o=-0.0023,f=-0.47) USER MOD Single : B 48 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD Single : B 51 LYS NZ :NH3+ 162:sc= 0.75 (180deg=0.551) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00568) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -0.126 X(o=-0.13,f=0) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 69 SER OG : rot -51:sc= 0.275 USER MOD Single : B 74 ASN : amide:sc= 0 X(o=0,f=0.0022) USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 85 LYS NZ :NH3+ 151:sc= 0.0102 (180deg=-0.502) USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ 169:sc= 0.331 (180deg=0.261) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 LYS NZ :NH3+ 165:sc= -0.177 (180deg=-0.499) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 99 ANW OAV : rot 166:sc= 0.627 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.359 17.405 7.746 1.00 1.04 N ATOM 2 CA MET A 1 7.438 16.458 7.316 1.00 0.91 C ATOM 3 C MET A 1 7.619 15.257 8.286 1.00 0.73 C ATOM 4 O MET A 1 8.487 14.408 8.048 1.00 0.96 O ATOM 5 CB MET A 1 8.776 17.222 7.139 1.00 1.31 C ATOM 6 CG MET A 1 9.437 17.697 8.444 1.00 1.57 C ATOM 7 SD MET A 1 10.917 18.696 8.167 1.00 2.18 S ATOM 8 CE MET A 1 11.601 18.757 9.822 1.00 2.71 C ATOM 0 H1 MET A 1 6.481 18.315 7.258 1.00 1.04 H new ATOM 0 H2 MET A 1 5.430 17.005 7.506 1.00 1.04 H new ATOM 0 H3 MET A 1 6.417 17.553 8.774 1.00 1.04 H new ATOM 0 HA MET A 1 7.127 16.036 6.360 1.00 0.91 H new ATOM 0 HB2 MET A 1 9.477 16.577 6.610 1.00 1.31 H new ATOM 0 HB3 MET A 1 8.599 18.090 6.503 1.00 1.31 H new ATOM 0 HG2 MET A 1 8.716 18.278 9.019 1.00 1.57 H new ATOM 0 HG3 MET A 1 9.700 16.829 9.048 1.00 1.57 H new ATOM 0 HE1 MET A 1 12.521 19.341 9.814 1.00 2.71 H new ATOM 0 HE2 MET A 1 10.882 19.222 10.496 1.00 2.71 H new ATOM 0 HE3 MET A 1 11.817 17.745 10.164 1.00 2.71 H new ATOM 20 N ALA A 2 6.803 15.188 9.369 1.00 0.77 N ATOM 21 CA ALA A 2 6.890 14.107 10.369 1.00 0.71 C ATOM 22 C ALA A 2 5.591 13.285 10.421 1.00 0.59 C ATOM 23 O ALA A 2 4.513 13.793 10.091 1.00 0.68 O ATOM 24 CB ALA A 2 7.211 14.694 11.744 1.00 1.02 C ATOM 0 H ALA A 2 6.076 15.875 9.567 1.00 0.77 H new ATOM 0 HA ALA A 2 7.694 13.432 10.073 1.00 0.71 H new ATOM 0 HB1 ALA A 2 7.274 13.890 12.477 1.00 1.02 H new ATOM 0 HB2 ALA A 2 8.164 15.221 11.701 1.00 1.02 H new ATOM 0 HB3 ALA A 2 6.424 15.390 12.035 1.00 1.02 H new ATOM 30 N ALA A 3 5.706 12.013 10.849 1.00 0.56 N ATOM 31 CA ALA A 3 4.555 11.101 10.941 1.00 0.54 C ATOM 32 C ALA A 3 3.916 11.149 12.343 1.00 0.55 C ATOM 33 O ALA A 3 4.552 10.768 13.332 1.00 0.70 O ATOM 34 CB ALA A 3 4.991 9.680 10.579 1.00 0.66 C ATOM 0 H ALA A 3 6.590 11.594 11.137 1.00 0.56 H new ATOM 0 HA ALA A 3 3.795 11.425 10.230 1.00 0.54 H new ATOM 0 HB1 ALA A 3 4.136 9.008 10.649 1.00 0.66 H new ATOM 0 HB2 ALA A 3 5.381 9.667 9.561 1.00 0.66 H new ATOM 0 HB3 ALA A 3 5.768 9.351 11.269 1.00 0.66 H new ATOM 40 N GLU A 4 2.652 11.623 12.410 1.00 0.52 N ATOM 41 CA GLU A 4 1.904 11.747 13.680 1.00 0.55 C ATOM 42 C GLU A 4 0.791 10.673 13.765 1.00 0.52 C ATOM 43 O GLU A 4 0.167 10.366 12.744 1.00 0.50 O ATOM 44 CB GLU A 4 1.296 13.164 13.787 1.00 0.61 C ATOM 45 CG GLU A 4 0.868 13.577 15.198 1.00 0.74 C ATOM 46 CD GLU A 4 0.468 15.042 15.288 1.00 0.86 C ATOM 47 OE1 GLU A 4 1.364 15.892 15.480 1.00 1.02 O ATOM 48 OE2 GLU A 4 -0.740 15.339 15.166 1.00 0.94 O ATOM 0 H GLU A 4 2.125 11.928 11.592 1.00 0.52 H new ATOM 0 HA GLU A 4 2.590 11.589 14.512 1.00 0.55 H new ATOM 0 HB2 GLU A 4 2.025 13.885 13.419 1.00 0.61 H new ATOM 0 HB3 GLU A 4 0.429 13.222 13.128 1.00 0.61 H new ATOM 0 HG2 GLU A 4 0.030 12.956 15.515 1.00 0.74 H new ATOM 0 HG3 GLU A 4 1.687 13.385 15.892 1.00 0.74 H new ATOM 55 N PRO A 5 0.520 10.079 14.980 1.00 0.57 N ATOM 56 CA PRO A 5 -0.532 9.043 15.153 1.00 0.59 C ATOM 57 C PRO A 5 -1.953 9.539 14.811 1.00 0.53 C ATOM 58 O PRO A 5 -2.369 10.608 15.270 1.00 0.59 O ATOM 59 CB PRO A 5 -0.444 8.668 16.647 1.00 0.74 C ATOM 60 CG PRO A 5 0.910 9.114 17.079 1.00 0.73 C ATOM 61 CD PRO A 5 1.224 10.333 16.262 1.00 0.67 C ATOM 0 HA PRO A 5 -0.364 8.207 14.474 1.00 0.59 H new ATOM 0 HB2 PRO A 5 -1.225 9.163 17.224 1.00 0.74 H new ATOM 0 HB3 PRO A 5 -0.571 7.595 16.793 1.00 0.74 H new ATOM 0 HG2 PRO A 5 0.924 9.344 18.144 1.00 0.73 H new ATOM 0 HG3 PRO A 5 1.650 8.331 16.913 1.00 0.73 H new ATOM 0 HD2 PRO A 5 0.866 11.243 16.744 1.00 0.67 H new ATOM 0 HD3 PRO A 5 2.297 10.452 16.114 1.00 0.67 H new ATOM 69 N LEU A 6 -2.683 8.751 13.996 1.00 0.58 N ATOM 70 CA LEU A 6 -4.061 9.079 13.575 1.00 0.67 C ATOM 71 C LEU A 6 -5.012 7.889 13.899 1.00 0.71 C ATOM 72 O LEU A 6 -4.705 7.092 14.791 1.00 1.19 O ATOM 73 CB LEU A 6 -4.059 9.419 12.062 1.00 0.84 C ATOM 74 CG LEU A 6 -3.110 10.558 11.617 1.00 0.91 C ATOM 75 CD1 LEU A 6 -2.987 10.599 10.092 1.00 1.14 C ATOM 76 CD2 LEU A 6 -3.586 11.911 12.156 1.00 1.03 C ATOM 0 H LEU A 6 -2.336 7.872 13.612 1.00 0.58 H new ATOM 0 HA LEU A 6 -4.427 9.948 14.122 1.00 0.67 H new ATOM 0 HB2 LEU A 6 -3.795 8.518 11.509 1.00 0.84 H new ATOM 0 HB3 LEU A 6 -5.075 9.686 11.770 1.00 0.84 H new ATOM 0 HG LEU A 6 -2.124 10.355 12.035 1.00 0.91 H new ATOM 0 HD11 LEU A 6 -2.315 11.407 9.803 1.00 1.14 H new ATOM 0 HD12 LEU A 6 -2.588 9.650 9.733 1.00 1.14 H new ATOM 0 HD13 LEU A 6 -3.970 10.769 9.652 1.00 1.14 H new ATOM 0 HD21 LEU A 6 -2.902 12.694 11.829 1.00 1.03 H new ATOM 0 HD22 LEU A 6 -4.586 12.122 11.778 1.00 1.03 H new ATOM 0 HD23 LEU A 6 -3.609 11.881 13.245 1.00 1.03 H new ATOM 88 N THR A 7 -6.180 7.789 13.203 1.00 0.52 N ATOM 89 CA THR A 7 -7.155 6.681 13.407 1.00 0.52 C ATOM 90 C THR A 7 -6.491 5.291 13.199 1.00 0.49 C ATOM 91 O THR A 7 -5.429 5.213 12.590 1.00 0.56 O ATOM 92 CB THR A 7 -8.379 6.839 12.440 1.00 0.58 C ATOM 93 OG1 THR A 7 -8.735 8.225 12.324 1.00 0.98 O ATOM 94 CG2 THR A 7 -9.601 6.059 12.923 1.00 0.94 C ATOM 0 H THR A 7 -6.468 8.464 12.495 1.00 0.52 H new ATOM 0 HA THR A 7 -7.504 6.739 14.438 1.00 0.52 H new ATOM 0 HB THR A 7 -8.076 6.437 11.473 1.00 0.58 H new ATOM 0 HG1 THR A 7 -8.224 8.634 11.595 1.00 0.98 H new ATOM 0 HG21 THR A 7 -10.423 6.199 12.221 1.00 0.94 H new ATOM 0 HG22 THR A 7 -9.355 4.999 12.986 1.00 0.94 H new ATOM 0 HG23 THR A 7 -9.898 6.422 13.907 1.00 0.94 H new ATOM 102 N GLU A 8 -7.124 4.203 13.705 1.00 0.51 N ATOM 103 CA GLU A 8 -6.576 2.820 13.592 1.00 0.50 C ATOM 104 C GLU A 8 -6.109 2.456 12.155 1.00 0.46 C ATOM 105 O GLU A 8 -5.030 1.879 11.989 1.00 0.48 O ATOM 106 CB GLU A 8 -7.599 1.781 14.107 1.00 0.55 C ATOM 107 CG GLU A 8 -6.979 0.434 14.480 1.00 0.91 C ATOM 108 CD GLU A 8 -7.960 -0.518 15.143 1.00 0.95 C ATOM 109 OE1 GLU A 8 -8.102 -0.459 16.383 1.00 1.42 O ATOM 110 OE2 GLU A 8 -8.581 -1.326 14.423 1.00 1.14 O ATOM 0 H GLU A 8 -8.016 4.253 14.197 1.00 0.51 H new ATOM 0 HA GLU A 8 -5.687 2.794 14.222 1.00 0.50 H new ATOM 0 HB2 GLU A 8 -8.109 2.189 14.980 1.00 0.55 H new ATOM 0 HB3 GLU A 8 -8.357 1.621 13.340 1.00 0.55 H new ATOM 0 HG2 GLU A 8 -6.580 -0.035 13.581 1.00 0.91 H new ATOM 0 HG3 GLU A 8 -6.138 0.603 15.152 1.00 0.91 H new ATOM 117 N LEU A 9 -6.926 2.787 11.130 1.00 0.45 N ATOM 118 CA LEU A 9 -6.568 2.514 9.717 1.00 0.44 C ATOM 119 C LEU A 9 -5.534 3.531 9.188 1.00 0.42 C ATOM 120 O LEU A 9 -4.645 3.161 8.412 1.00 0.43 O ATOM 121 CB LEU A 9 -7.826 2.510 8.821 1.00 0.48 C ATOM 122 CG LEU A 9 -8.666 1.209 8.847 1.00 0.56 C ATOM 123 CD1 LEU A 9 -9.981 1.398 8.090 1.00 0.65 C ATOM 124 CD2 LEU A 9 -7.877 0.030 8.257 1.00 0.65 C ATOM 0 H LEU A 9 -7.832 3.240 11.252 1.00 0.45 H new ATOM 0 HA LEU A 9 -6.113 1.524 9.682 1.00 0.44 H new ATOM 0 HB2 LEU A 9 -8.466 3.340 9.121 1.00 0.48 H new ATOM 0 HB3 LEU A 9 -7.518 2.701 7.793 1.00 0.48 H new ATOM 0 HG LEU A 9 -8.894 0.981 9.888 1.00 0.56 H new ATOM 0 HD11 LEU A 9 -10.555 0.472 8.121 1.00 0.65 H new ATOM 0 HD12 LEU A 9 -10.557 2.198 8.555 1.00 0.65 H new ATOM 0 HD13 LEU A 9 -9.770 1.659 7.053 1.00 0.65 H new ATOM 0 HD21 LEU A 9 -8.491 -0.870 8.288 1.00 0.65 H new ATOM 0 HD22 LEU A 9 -7.610 0.252 7.224 1.00 0.65 H new ATOM 0 HD23 LEU A 9 -6.970 -0.129 8.840 1.00 0.65 H new ATOM 136 N GLU A 10 -5.655 4.810 9.608 1.00 0.42 N ATOM 137 CA GLU A 10 -4.704 5.869 9.199 1.00 0.44 C ATOM 138 C GLU A 10 -3.332 5.666 9.882 1.00 0.44 C ATOM 139 O GLU A 10 -2.307 6.111 9.358 1.00 0.48 O ATOM 140 CB GLU A 10 -5.258 7.275 9.534 1.00 0.49 C ATOM 141 CG GLU A 10 -6.515 7.657 8.753 1.00 0.54 C ATOM 142 CD GLU A 10 -7.043 9.047 9.092 1.00 0.63 C ATOM 143 OE1 GLU A 10 -7.130 9.382 10.294 1.00 0.96 O ATOM 144 OE2 GLU A 10 -7.380 9.797 8.151 1.00 1.03 O ATOM 0 H GLU A 10 -6.398 5.134 10.227 1.00 0.42 H new ATOM 0 HA GLU A 10 -4.574 5.797 8.119 1.00 0.44 H new ATOM 0 HB2 GLU A 10 -5.479 7.321 10.600 1.00 0.49 H new ATOM 0 HB3 GLU A 10 -4.482 8.015 9.336 1.00 0.49 H new ATOM 0 HG2 GLU A 10 -6.298 7.610 7.686 1.00 0.54 H new ATOM 0 HG3 GLU A 10 -7.295 6.922 8.953 1.00 0.54 H new ATOM 151 N GLU A 11 -3.326 4.991 11.058 1.00 0.44 N ATOM 152 CA GLU A 11 -2.097 4.705 11.811 1.00 0.46 C ATOM 153 C GLU A 11 -1.394 3.431 11.287 1.00 0.45 C ATOM 154 O GLU A 11 -0.193 3.263 11.511 1.00 0.47 O ATOM 155 CB GLU A 11 -2.400 4.562 13.317 1.00 0.52 C ATOM 156 CG GLU A 11 -1.176 4.730 14.225 1.00 0.61 C ATOM 157 CD GLU A 11 -1.496 4.518 15.694 1.00 0.69 C ATOM 158 OE1 GLU A 11 -2.124 5.412 16.299 1.00 0.79 O ATOM 159 OE2 GLU A 11 -1.118 3.461 16.240 1.00 0.81 O ATOM 0 H GLU A 11 -4.172 4.635 11.502 1.00 0.44 H new ATOM 0 HA GLU A 11 -1.422 5.548 11.665 1.00 0.46 H new ATOM 0 HB2 GLU A 11 -3.150 5.302 13.597 1.00 0.52 H new ATOM 0 HB3 GLU A 11 -2.839 3.580 13.496 1.00 0.52 H new ATOM 0 HG2 GLU A 11 -0.405 4.023 13.921 1.00 0.61 H new ATOM 0 HG3 GLU A 11 -0.763 5.730 14.089 1.00 0.61 H new ATOM 166 N SER A 12 -2.146 2.529 10.600 1.00 0.45 N ATOM 167 CA SER A 12 -1.566 1.291 10.027 1.00 0.47 C ATOM 168 C SER A 12 -0.408 1.623 9.067 1.00 0.44 C ATOM 169 O SER A 12 0.660 1.016 9.151 1.00 0.49 O ATOM 170 CB SER A 12 -2.636 0.456 9.304 1.00 0.52 C ATOM 171 OG SER A 12 -3.551 -0.115 10.226 1.00 0.63 O ATOM 0 H SER A 12 -3.146 2.638 10.432 1.00 0.45 H new ATOM 0 HA SER A 12 -1.174 0.698 10.853 1.00 0.47 H new ATOM 0 HB2 SER A 12 -3.175 1.085 8.595 1.00 0.52 H new ATOM 0 HB3 SER A 12 -2.156 -0.335 8.727 1.00 0.52 H new ATOM 0 HG SER A 12 -3.988 0.598 10.737 1.00 0.63 H new ATOM 177 N ILE A 13 -0.629 2.599 8.162 1.00 0.42 N ATOM 178 CA ILE A 13 0.413 3.045 7.213 1.00 0.43 C ATOM 179 C ILE A 13 1.459 3.946 7.918 1.00 0.41 C ATOM 180 O ILE A 13 2.607 4.027 7.479 1.00 0.46 O ATOM 181 CB ILE A 13 -0.182 3.778 5.954 1.00 0.47 C ATOM 182 CG1 ILE A 13 -1.036 5.029 6.325 1.00 0.46 C ATOM 183 CG2 ILE A 13 -1.004 2.802 5.106 1.00 0.56 C ATOM 184 CD1 ILE A 13 -0.232 6.295 6.582 1.00 0.44 C ATOM 0 H ILE A 13 -1.517 3.092 8.068 1.00 0.42 H new ATOM 0 HA ILE A 13 0.907 2.142 6.854 1.00 0.43 H new ATOM 0 HB ILE A 13 0.666 4.139 5.372 1.00 0.47 H new ATOM 0 HG12 ILE A 13 -1.743 5.222 5.518 1.00 0.46 H new ATOM 0 HG13 ILE A 13 -1.623 4.801 7.215 1.00 0.46 H new ATOM 0 HG21 ILE A 13 -1.409 3.325 4.239 1.00 0.56 H new ATOM 0 HG22 ILE A 13 -0.366 1.984 4.771 1.00 0.56 H new ATOM 0 HG23 ILE A 13 -1.823 2.402 5.703 1.00 0.56 H new ATOM 0 HD11 ILE A 13 -0.909 7.111 6.833 1.00 0.44 H new ATOM 0 HD12 ILE A 13 0.456 6.127 7.410 1.00 0.44 H new ATOM 0 HD13 ILE A 13 0.334 6.555 5.687 1.00 0.44 H new ATOM 196 N GLU A 14 1.041 4.625 9.013 1.00 0.39 N ATOM 197 CA GLU A 14 1.921 5.512 9.807 1.00 0.40 C ATOM 198 C GLU A 14 2.988 4.718 10.598 1.00 0.41 C ATOM 199 O GLU A 14 4.116 5.194 10.748 1.00 0.44 O ATOM 200 CB GLU A 14 1.065 6.361 10.778 1.00 0.43 C ATOM 201 CG GLU A 14 1.830 7.432 11.572 1.00 0.52 C ATOM 202 CD GLU A 14 2.157 7.027 13.008 1.00 0.61 C ATOM 203 OE1 GLU A 14 2.426 5.833 13.256 1.00 1.00 O ATOM 204 OE2 GLU A 14 2.153 7.913 13.885 1.00 0.93 O ATOM 0 H GLU A 14 0.087 4.573 9.369 1.00 0.39 H new ATOM 0 HA GLU A 14 2.450 6.163 9.111 1.00 0.40 H new ATOM 0 HB2 GLU A 14 0.277 6.851 10.206 1.00 0.43 H new ATOM 0 HB3 GLU A 14 0.576 5.690 11.484 1.00 0.43 H new ATOM 0 HG2 GLU A 14 2.759 7.662 11.050 1.00 0.52 H new ATOM 0 HG3 GLU A 14 1.239 8.348 11.589 1.00 0.52 H new ATOM 211 N THR A 15 2.621 3.516 11.103 1.00 0.42 N ATOM 212 CA THR A 15 3.542 2.659 11.891 1.00 0.45 C ATOM 213 C THR A 15 4.848 2.342 11.122 1.00 0.43 C ATOM 214 O THR A 15 5.927 2.330 11.721 1.00 0.45 O ATOM 215 CB THR A 15 2.849 1.328 12.318 1.00 0.50 C ATOM 216 OG1 THR A 15 1.580 1.608 12.931 1.00 0.65 O ATOM 217 CG2 THR A 15 3.698 0.523 13.301 1.00 0.77 C ATOM 0 H THR A 15 1.691 3.116 10.979 1.00 0.42 H new ATOM 0 HA THR A 15 3.804 3.228 12.783 1.00 0.45 H new ATOM 0 HB THR A 15 2.716 0.735 11.413 1.00 0.50 H new ATOM 0 HG1 THR A 15 0.996 2.055 12.284 1.00 0.65 H new ATOM 0 HG21 THR A 15 3.173 -0.394 13.568 1.00 0.77 H new ATOM 0 HG22 THR A 15 4.653 0.273 12.838 1.00 0.77 H new ATOM 0 HG23 THR A 15 3.874 1.115 14.199 1.00 0.77 H new ATOM 225 N VAL A 16 4.743 2.087 9.799 1.00 0.41 N ATOM 226 CA VAL A 16 5.928 1.785 8.960 1.00 0.42 C ATOM 227 C VAL A 16 6.769 3.067 8.719 1.00 0.42 C ATOM 228 O VAL A 16 7.992 2.987 8.580 1.00 0.46 O ATOM 229 CB VAL A 16 5.536 1.123 7.588 1.00 0.44 C ATOM 230 CG1 VAL A 16 6.777 0.680 6.796 1.00 0.50 C ATOM 231 CG2 VAL A 16 4.599 -0.074 7.801 1.00 0.49 C ATOM 0 H VAL A 16 3.859 2.084 9.291 1.00 0.41 H new ATOM 0 HA VAL A 16 6.530 1.061 9.509 1.00 0.42 H new ATOM 0 HB VAL A 16 5.013 1.882 7.006 1.00 0.44 H new ATOM 0 HG11 VAL A 16 6.465 0.227 5.855 1.00 0.50 H new ATOM 0 HG12 VAL A 16 7.406 1.546 6.592 1.00 0.50 H new ATOM 0 HG13 VAL A 16 7.340 -0.048 7.380 1.00 0.50 H new ATOM 0 HG21 VAL A 16 4.344 -0.513 6.836 1.00 0.49 H new ATOM 0 HG22 VAL A 16 5.098 -0.821 8.419 1.00 0.49 H new ATOM 0 HG23 VAL A 16 3.689 0.260 8.299 1.00 0.49 H new ATOM 241 N VAL A 17 6.102 4.245 8.687 1.00 0.42 N ATOM 242 CA VAL A 17 6.777 5.550 8.486 1.00 0.47 C ATOM 243 C VAL A 17 7.392 6.091 9.818 1.00 0.55 C ATOM 244 O VAL A 17 8.094 7.107 9.806 1.00 0.95 O ATOM 245 CB VAL A 17 5.789 6.614 7.864 1.00 0.51 C ATOM 246 CG1 VAL A 17 6.485 7.946 7.538 1.00 0.60 C ATOM 247 CG2 VAL A 17 5.104 6.065 6.603 1.00 0.52 C ATOM 0 H VAL A 17 5.091 4.318 8.799 1.00 0.42 H new ATOM 0 HA VAL A 17 7.592 5.384 7.782 1.00 0.47 H new ATOM 0 HB VAL A 17 5.035 6.811 8.626 1.00 0.51 H new ATOM 0 HG11 VAL A 17 5.760 8.641 7.113 1.00 0.60 H new ATOM 0 HG12 VAL A 17 6.903 8.371 8.451 1.00 0.60 H new ATOM 0 HG13 VAL A 17 7.285 7.772 6.819 1.00 0.60 H new ATOM 0 HG21 VAL A 17 4.430 6.820 6.197 1.00 0.52 H new ATOM 0 HG22 VAL A 17 5.859 5.815 5.858 1.00 0.52 H new ATOM 0 HG23 VAL A 17 4.536 5.170 6.858 1.00 0.52 H new ATOM 257 N THR A 18 7.132 5.410 10.963 1.00 0.47 N ATOM 258 CA THR A 18 7.666 5.824 12.280 1.00 0.51 C ATOM 259 C THR A 18 8.718 4.840 12.847 1.00 0.51 C ATOM 260 O THR A 18 9.527 5.241 13.693 1.00 0.60 O ATOM 261 CB THR A 18 6.529 5.988 13.332 1.00 0.56 C ATOM 262 OG1 THR A 18 5.744 4.791 13.407 1.00 0.57 O ATOM 263 CG2 THR A 18 5.617 7.165 13.003 1.00 0.62 C ATOM 0 H THR A 18 6.554 4.570 10.997 1.00 0.47 H new ATOM 0 HA THR A 18 8.153 6.783 12.100 1.00 0.51 H new ATOM 0 HB THR A 18 7.005 6.181 14.293 1.00 0.56 H new ATOM 0 HG1 THR A 18 6.140 4.104 12.831 1.00 0.57 H new ATOM 0 HG21 THR A 18 4.838 7.244 13.761 1.00 0.62 H new ATOM 0 HG22 THR A 18 6.202 8.085 12.986 1.00 0.62 H new ATOM 0 HG23 THR A 18 5.159 7.008 12.027 1.00 0.62 H new ATOM 271 N THR A 19 8.719 3.565 12.392 1.00 0.49 N ATOM 272 CA THR A 19 9.669 2.552 12.904 1.00 0.53 C ATOM 273 C THR A 19 10.977 2.483 12.079 1.00 0.53 C ATOM 274 O THR A 19 12.064 2.665 12.639 1.00 0.62 O ATOM 275 CB THR A 19 9.015 1.137 12.967 1.00 0.55 C ATOM 276 OG1 THR A 19 7.722 1.223 13.586 1.00 0.56 O ATOM 277 CG2 THR A 19 9.876 0.141 13.751 1.00 0.66 C ATOM 0 H THR A 19 8.079 3.217 11.678 1.00 0.49 H new ATOM 0 HA THR A 19 9.929 2.873 13.913 1.00 0.53 H new ATOM 0 HB THR A 19 8.923 0.777 11.942 1.00 0.55 H new ATOM 0 HG1 THR A 19 7.081 1.608 12.953 1.00 0.56 H new ATOM 0 HG21 THR A 19 9.383 -0.831 13.770 1.00 0.66 H new ATOM 0 HG22 THR A 19 10.850 0.045 13.270 1.00 0.66 H new ATOM 0 HG23 THR A 19 10.009 0.500 14.772 1.00 0.66 H new ATOM 285 N PHE A 20 10.875 2.220 10.758 1.00 0.53 N ATOM 286 CA PHE A 20 12.068 2.094 9.887 1.00 0.57 C ATOM 287 C PHE A 20 12.609 3.451 9.381 1.00 0.57 C ATOM 288 O PHE A 20 13.723 3.498 8.853 1.00 0.89 O ATOM 289 CB PHE A 20 11.776 1.153 8.695 1.00 0.64 C ATOM 290 CG PHE A 20 13.022 0.680 7.956 1.00 0.71 C ATOM 291 CD1 PHE A 20 13.926 -0.183 8.570 1.00 0.83 C ATOM 292 CD2 PHE A 20 13.289 1.099 6.656 1.00 0.76 C ATOM 293 CE1 PHE A 20 15.060 -0.612 7.905 1.00 0.95 C ATOM 294 CE2 PHE A 20 14.424 0.668 5.992 1.00 0.86 C ATOM 295 CZ PHE A 20 15.307 -0.187 6.617 1.00 0.93 C ATOM 0 H PHE A 20 9.987 2.091 10.273 1.00 0.53 H new ATOM 0 HA PHE A 20 12.852 1.662 10.509 1.00 0.57 H new ATOM 0 HB2 PHE A 20 11.230 0.283 9.058 1.00 0.64 H new ATOM 0 HB3 PHE A 20 11.123 1.668 7.991 1.00 0.64 H new ATOM 0 HD1 PHE A 20 13.739 -0.522 9.578 1.00 0.83 H new ATOM 0 HD2 PHE A 20 12.602 1.768 6.159 1.00 0.76 H new ATOM 0 HE1 PHE A 20 15.753 -1.280 8.395 1.00 0.95 H new ATOM 0 HE2 PHE A 20 14.618 1.002 4.983 1.00 0.86 H new ATOM 0 HZ PHE A 20 16.192 -0.524 6.098 1.00 0.93 H new ATOM 305 N PHE A 21 11.844 4.555 9.549 1.00 0.71 N ATOM 306 CA PHE A 21 12.291 5.894 9.092 1.00 0.73 C ATOM 307 C PHE A 21 13.483 6.435 9.916 1.00 0.66 C ATOM 308 O PHE A 21 14.172 7.354 9.461 1.00 0.67 O ATOM 309 CB PHE A 21 11.112 6.895 9.087 1.00 1.04 C ATOM 310 CG PHE A 21 10.544 7.170 7.699 1.00 1.67 C ATOM 311 CD1 PHE A 21 10.176 6.123 6.851 1.00 1.97 C ATOM 312 CD2 PHE A 21 10.393 8.475 7.233 1.00 2.34 C ATOM 313 CE1 PHE A 21 9.676 6.373 5.588 1.00 2.74 C ATOM 314 CE2 PHE A 21 9.893 8.721 5.968 1.00 3.02 C ATOM 315 CZ PHE A 21 9.535 7.671 5.146 1.00 3.17 C ATOM 0 H PHE A 21 10.925 4.547 9.992 1.00 0.71 H new ATOM 0 HA PHE A 21 12.649 5.779 8.069 1.00 0.73 H new ATOM 0 HB2 PHE A 21 10.317 6.509 9.725 1.00 1.04 H new ATOM 0 HB3 PHE A 21 11.444 7.836 9.526 1.00 1.04 H new ATOM 0 HD1 PHE A 21 10.284 5.103 7.188 1.00 1.97 H new ATOM 0 HD2 PHE A 21 10.670 9.304 7.868 1.00 2.34 H new ATOM 0 HE1 PHE A 21 9.395 5.551 4.946 1.00 2.74 H new ATOM 0 HE2 PHE A 21 9.782 9.738 5.621 1.00 3.02 H new ATOM 0 HZ PHE A 21 9.145 7.866 4.158 1.00 3.17 H new ATOM 325 N THR A 22 13.713 5.875 11.129 1.00 0.75 N ATOM 326 CA THR A 22 14.855 6.264 11.984 1.00 0.89 C ATOM 327 C THR A 22 16.192 5.824 11.338 1.00 0.82 C ATOM 328 O THR A 22 17.213 6.497 11.508 1.00 0.97 O ATOM 329 CB THR A 22 14.743 5.630 13.410 1.00 1.11 C ATOM 330 OG1 THR A 22 13.387 5.703 13.889 1.00 1.25 O ATOM 331 CG2 THR A 22 15.670 6.319 14.417 1.00 1.37 C ATOM 0 H THR A 22 13.120 5.151 11.535 1.00 0.75 H new ATOM 0 HA THR A 22 14.833 7.350 12.080 1.00 0.89 H new ATOM 0 HB THR A 22 15.048 4.588 13.320 1.00 1.11 H new ATOM 0 HG1 THR A 22 13.333 5.301 14.781 1.00 1.25 H new ATOM 0 HG21 THR A 22 15.561 5.848 15.394 1.00 1.37 H new ATOM 0 HG22 THR A 22 16.703 6.226 14.083 1.00 1.37 H new ATOM 0 HG23 THR A 22 15.406 7.374 14.492 1.00 1.37 H new ATOM 339 N PHE A 23 16.164 4.688 10.603 1.00 0.69 N ATOM 340 CA PHE A 23 17.352 4.141 9.914 1.00 0.76 C ATOM 341 C PHE A 23 17.362 4.518 8.418 1.00 0.69 C ATOM 342 O PHE A 23 18.435 4.719 7.844 1.00 0.82 O ATOM 343 CB PHE A 23 17.406 2.606 10.060 1.00 0.87 C ATOM 344 CG PHE A 23 17.432 2.123 11.500 1.00 1.04 C ATOM 345 CD1 PHE A 23 16.252 1.995 12.228 1.00 1.01 C ATOM 346 CD2 PHE A 23 18.633 1.811 12.126 1.00 1.34 C ATOM 347 CE1 PHE A 23 16.274 1.566 13.540 1.00 1.24 C ATOM 348 CE2 PHE A 23 18.656 1.382 13.438 1.00 1.55 C ATOM 349 CZ PHE A 23 17.476 1.259 14.145 1.00 1.49 C ATOM 0 H PHE A 23 15.321 4.129 10.472 1.00 0.69 H new ATOM 0 HA PHE A 23 18.231 4.580 10.386 1.00 0.76 H new ATOM 0 HB2 PHE A 23 16.541 2.173 9.558 1.00 0.87 H new ATOM 0 HB3 PHE A 23 18.292 2.233 9.546 1.00 0.87 H new ATOM 0 HD1 PHE A 23 15.308 2.234 11.761 1.00 1.01 H new ATOM 0 HD2 PHE A 23 19.560 1.905 11.579 1.00 1.34 H new ATOM 0 HE1 PHE A 23 15.351 1.471 14.093 1.00 1.24 H new ATOM 0 HE2 PHE A 23 19.597 1.143 13.911 1.00 1.55 H new ATOM 0 HZ PHE A 23 17.494 0.923 15.171 1.00 1.49 H new ATOM 359 N ALA A 24 16.161 4.618 7.795 1.00 0.59 N ATOM 360 CA ALA A 24 16.025 4.965 6.362 1.00 0.67 C ATOM 361 C ALA A 24 16.640 6.334 6.012 1.00 0.62 C ATOM 362 O ALA A 24 17.200 6.491 4.924 1.00 0.83 O ATOM 363 CB ALA A 24 14.553 4.927 5.939 1.00 0.82 C ATOM 0 H ALA A 24 15.270 4.462 8.267 1.00 0.59 H new ATOM 0 HA ALA A 24 16.586 4.213 5.807 1.00 0.67 H new ATOM 0 HB1 ALA A 24 14.471 5.185 4.883 1.00 0.82 H new ATOM 0 HB2 ALA A 24 14.154 3.926 6.100 1.00 0.82 H new ATOM 0 HB3 ALA A 24 13.985 5.644 6.532 1.00 0.82 H new ATOM 369 N ARG A 25 16.550 7.318 6.939 1.00 0.61 N ATOM 370 CA ARG A 25 17.104 8.674 6.699 1.00 0.65 C ATOM 371 C ARG A 25 18.651 8.714 6.758 1.00 0.69 C ATOM 372 O ARG A 25 19.260 9.666 6.258 1.00 0.88 O ATOM 373 CB ARG A 25 16.491 9.713 7.672 1.00 0.75 C ATOM 374 CG ARG A 25 16.799 9.504 9.161 1.00 0.78 C ATOM 375 CD ARG A 25 16.327 10.691 10.010 1.00 0.97 C ATOM 376 NE ARG A 25 16.405 10.429 11.457 1.00 1.09 N ATOM 377 CZ ARG A 25 15.948 11.260 12.424 1.00 1.32 C ATOM 378 NH1 ARG A 25 15.327 12.409 12.125 1.00 1.55 N ATOM 379 NH2 ARG A 25 16.108 10.925 13.702 1.00 1.47 N ATOM 0 H ARG A 25 16.105 7.202 7.849 1.00 0.61 H new ATOM 0 HA ARG A 25 16.821 8.941 5.681 1.00 0.65 H new ATOM 0 HB2 ARG A 25 16.844 10.703 7.384 1.00 0.75 H new ATOM 0 HB3 ARG A 25 15.409 9.710 7.541 1.00 0.75 H new ATOM 0 HG2 ARG A 25 16.313 8.592 9.509 1.00 0.78 H new ATOM 0 HG3 ARG A 25 17.872 9.365 9.295 1.00 0.78 H new ATOM 0 HD2 ARG A 25 16.933 11.565 9.771 1.00 0.97 H new ATOM 0 HD3 ARG A 25 15.298 10.934 9.745 1.00 0.97 H new ATOM 0 HE ARG A 25 16.837 9.554 11.754 1.00 1.09 H new ATOM 0 HH11 ARG A 25 15.189 12.675 11.150 1.00 1.55 H new ATOM 0 HH12 ARG A 25 14.992 13.017 12.872 1.00 1.55 H new ATOM 0 HH21 ARG A 25 16.571 10.049 13.946 1.00 1.47 H new ATOM 0 HH22 ARG A 25 15.767 11.544 14.438 1.00 1.47 H new ATOM 393 N GLN A 26 19.277 7.674 7.356 1.00 0.73 N ATOM 394 CA GLN A 26 20.752 7.576 7.483 1.00 0.84 C ATOM 395 C GLN A 26 21.463 7.663 6.108 1.00 0.78 C ATOM 396 O GLN A 26 22.533 8.270 6.006 1.00 0.89 O ATOM 397 CB GLN A 26 21.130 6.255 8.197 1.00 1.01 C ATOM 398 CG GLN A 26 22.604 6.128 8.588 1.00 1.22 C ATOM 399 CD GLN A 26 22.906 4.864 9.391 1.00 1.49 C ATOM 400 OE1 GLN A 26 23.184 3.811 8.815 1.00 1.63 O ATOM 401 NE2 GLN A 26 22.859 4.953 10.722 1.00 1.80 N ATOM 0 H GLN A 26 18.778 6.883 7.762 1.00 0.73 H new ATOM 0 HA GLN A 26 21.090 8.425 8.077 1.00 0.84 H new ATOM 0 HB2 GLN A 26 20.522 6.159 9.097 1.00 1.01 H new ATOM 0 HB3 GLN A 26 20.870 5.421 7.546 1.00 1.01 H new ATOM 0 HG2 GLN A 26 23.215 6.132 7.685 1.00 1.22 H new ATOM 0 HG3 GLN A 26 22.895 7.001 9.173 1.00 1.22 H new ATOM 0 HE21 GLN A 26 22.625 5.841 11.166 1.00 1.80 H new ATOM 0 HE22 GLN A 26 23.057 4.133 11.295 1.00 1.80 H new ATOM 410 N GLU A 27 20.860 7.053 5.062 1.00 0.70 N ATOM 411 CA GLU A 27 21.430 7.053 3.700 1.00 0.76 C ATOM 412 C GLU A 27 20.375 7.445 2.648 1.00 0.93 C ATOM 413 O GLU A 27 19.270 6.893 2.636 1.00 1.59 O ATOM 414 CB GLU A 27 22.005 5.655 3.370 1.00 0.92 C ATOM 415 CG GLU A 27 23.239 5.258 4.187 1.00 1.09 C ATOM 416 CD GLU A 27 24.466 6.104 3.874 1.00 1.27 C ATOM 417 OE1 GLU A 27 25.080 5.893 2.806 1.00 1.52 O ATOM 418 OE2 GLU A 27 24.807 6.980 4.696 1.00 1.46 O ATOM 0 H GLU A 27 19.974 6.553 5.139 1.00 0.70 H new ATOM 0 HA GLU A 27 22.229 7.794 3.670 1.00 0.76 H new ATOM 0 HB2 GLU A 27 21.226 4.910 3.530 1.00 0.92 H new ATOM 0 HB3 GLU A 27 22.262 5.624 2.311 1.00 0.92 H new ATOM 0 HG2 GLU A 27 23.007 5.345 5.248 1.00 1.09 H new ATOM 0 HG3 GLU A 27 23.471 4.210 3.997 1.00 1.09 H new ATOM 425 N GLY A 28 20.728 8.420 1.775 1.00 0.79 N ATOM 426 CA GLY A 28 19.832 8.873 0.704 1.00 0.92 C ATOM 427 C GLY A 28 18.594 9.611 1.197 1.00 0.73 C ATOM 428 O GLY A 28 17.595 8.971 1.539 1.00 0.72 O ATOM 0 H GLY A 28 21.627 8.902 1.799 1.00 0.79 H new ATOM 0 HA2 GLY A 28 20.388 9.527 0.033 1.00 0.92 H new ATOM 0 HA3 GLY A 28 19.517 8.009 0.119 1.00 0.92 H new ATOM 432 N ARG A 29 18.655 10.966 1.231 1.00 0.72 N ATOM 433 CA ARG A 29 17.526 11.827 1.670 1.00 0.71 C ATOM 434 C ARG A 29 17.045 11.486 3.106 1.00 0.68 C ATOM 435 O ARG A 29 17.621 10.619 3.777 1.00 0.76 O ATOM 436 CB ARG A 29 16.346 11.741 0.648 1.00 0.73 C ATOM 437 CG ARG A 29 16.109 13.017 -0.171 1.00 0.92 C ATOM 438 CD ARG A 29 16.878 13.025 -1.491 1.00 1.31 C ATOM 439 NE ARG A 29 16.707 14.297 -2.216 1.00 1.46 N ATOM 440 CZ ARG A 29 17.521 15.376 -2.112 1.00 1.91 C ATOM 441 NH1 ARG A 29 18.549 15.398 -1.251 1.00 2.60 N ATOM 442 NH2 ARG A 29 17.275 16.457 -2.858 1.00 2.05 N ATOM 0 H ARG A 29 19.485 11.492 0.956 1.00 0.72 H new ATOM 0 HA ARG A 29 17.892 12.853 1.699 1.00 0.71 H new ATOM 0 HB2 ARG A 29 16.538 10.916 -0.038 1.00 0.73 H new ATOM 0 HB3 ARG A 29 15.432 11.499 1.190 1.00 0.73 H new ATOM 0 HG2 ARG A 29 15.043 13.119 -0.376 1.00 0.92 H new ATOM 0 HG3 ARG A 29 16.404 13.883 0.421 1.00 0.92 H new ATOM 0 HD2 ARG A 29 17.937 12.857 -1.296 1.00 1.31 H new ATOM 0 HD3 ARG A 29 16.535 12.201 -2.117 1.00 1.31 H new ATOM 0 HE ARG A 29 15.910 14.371 -2.848 1.00 1.46 H new ATOM 0 HH11 ARG A 29 18.733 14.591 -0.655 1.00 2.60 H new ATOM 0 HH12 ARG A 29 19.147 16.222 -1.192 1.00 2.60 H new ATOM 0 HH21 ARG A 29 16.481 16.465 -3.498 1.00 2.05 H new ATOM 0 HH22 ARG A 29 17.881 17.274 -2.787 1.00 2.05 H new ATOM 456 N LYS A 30 15.994 12.194 3.573 1.00 0.67 N ATOM 457 CA LYS A 30 15.409 11.975 4.911 1.00 0.67 C ATOM 458 C LYS A 30 14.144 11.098 4.839 1.00 0.66 C ATOM 459 O LYS A 30 13.876 10.326 5.764 1.00 0.72 O ATOM 460 CB LYS A 30 15.073 13.324 5.589 1.00 0.76 C ATOM 461 CG LYS A 30 16.290 14.147 6.038 1.00 0.82 C ATOM 462 CD LYS A 30 17.020 13.532 7.240 1.00 0.89 C ATOM 463 CE LYS A 30 18.063 14.483 7.830 1.00 1.00 C ATOM 464 NZ LYS A 30 19.327 14.505 7.033 1.00 1.22 N ATOM 0 H LYS A 30 15.531 12.928 3.037 1.00 0.67 H new ATOM 0 HA LYS A 30 16.155 11.451 5.509 1.00 0.67 H new ATOM 0 HB2 LYS A 30 14.483 13.924 4.896 1.00 0.76 H new ATOM 0 HB3 LYS A 30 14.444 13.130 6.458 1.00 0.76 H new ATOM 0 HG2 LYS A 30 16.987 14.239 5.205 1.00 0.82 H new ATOM 0 HG3 LYS A 30 15.965 15.155 6.294 1.00 0.82 H new ATOM 0 HD2 LYS A 30 16.293 13.270 8.009 1.00 0.89 H new ATOM 0 HD3 LYS A 30 17.507 12.607 6.933 1.00 0.89 H new ATOM 0 HE2 LYS A 30 17.648 15.490 7.876 1.00 1.00 H new ATOM 0 HE3 LYS A 30 18.287 14.183 8.854 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 20.002 15.163 7.471 1.00 1.22 H new ATOM 0 HZ2 LYS A 30 19.739 13.550 7.009 1.00 1.22 H new ATOM 0 HZ3 LYS A 30 19.120 14.817 6.063 1.00 1.22 H new ATOM 478 N ASP A 31 13.370 11.219 3.735 1.00 0.66 N ATOM 479 CA ASP A 31 12.131 10.435 3.542 1.00 0.71 C ATOM 480 C ASP A 31 12.311 9.382 2.430 1.00 0.64 C ATOM 481 O ASP A 31 11.423 9.199 1.587 1.00 0.89 O ATOM 482 CB ASP A 31 10.952 11.378 3.206 1.00 0.87 C ATOM 483 CG ASP A 31 10.662 12.392 4.303 1.00 1.03 C ATOM 484 OD1 ASP A 31 11.388 13.407 4.380 1.00 1.43 O ATOM 485 OD2 ASP A 31 9.709 12.175 5.081 1.00 1.38 O ATOM 0 H ASP A 31 13.583 11.853 2.965 1.00 0.66 H new ATOM 0 HA ASP A 31 11.910 9.910 4.471 1.00 0.71 H new ATOM 0 HB2 ASP A 31 11.172 11.908 2.279 1.00 0.87 H new ATOM 0 HB3 ASP A 31 10.058 10.781 3.027 1.00 0.87 H new ATOM 490 N SER A 32 13.457 8.670 2.441 1.00 0.65 N ATOM 491 CA SER A 32 13.752 7.646 1.427 1.00 0.58 C ATOM 492 C SER A 32 14.590 6.492 2.006 1.00 0.56 C ATOM 493 O SER A 32 15.512 6.727 2.792 1.00 0.63 O ATOM 494 CB SER A 32 14.484 8.294 0.237 1.00 0.58 C ATOM 495 OG SER A 32 14.832 7.333 -0.748 1.00 1.09 O ATOM 0 H SER A 32 14.190 8.788 3.141 1.00 0.65 H new ATOM 0 HA SER A 32 12.806 7.222 1.089 1.00 0.58 H new ATOM 0 HB2 SER A 32 13.849 9.059 -0.209 1.00 0.58 H new ATOM 0 HB3 SER A 32 15.385 8.795 0.592 1.00 0.58 H new ATOM 0 HG SER A 32 14.683 7.710 -1.640 1.00 1.09 H new ATOM 501 N LEU A 33 14.261 5.244 1.603 1.00 0.54 N ATOM 502 CA LEU A 33 14.983 4.034 2.055 1.00 0.54 C ATOM 503 C LEU A 33 16.215 3.783 1.167 1.00 0.52 C ATOM 504 O LEU A 33 16.251 4.228 0.016 1.00 0.66 O ATOM 505 CB LEU A 33 14.052 2.795 2.023 1.00 0.55 C ATOM 506 CG LEU A 33 13.016 2.679 3.171 1.00 0.67 C ATOM 507 CD1 LEU A 33 11.910 3.732 3.045 1.00 0.76 C ATOM 508 CD2 LEU A 33 12.414 1.270 3.214 1.00 0.75 C ATOM 0 H LEU A 33 13.494 5.048 0.960 1.00 0.54 H new ATOM 0 HA LEU A 33 15.311 4.198 3.082 1.00 0.54 H new ATOM 0 HB2 LEU A 33 13.513 2.798 1.076 1.00 0.55 H new ATOM 0 HB3 LEU A 33 14.674 1.900 2.033 1.00 0.55 H new ATOM 0 HG LEU A 33 13.542 2.864 4.107 1.00 0.67 H new ATOM 0 HD11 LEU A 33 11.204 3.618 3.867 1.00 0.76 H new ATOM 0 HD12 LEU A 33 12.351 4.728 3.080 1.00 0.76 H new ATOM 0 HD13 LEU A 33 11.388 3.600 2.097 1.00 0.76 H new ATOM 0 HD21 LEU A 33 11.689 1.209 4.026 1.00 0.75 H new ATOM 0 HD22 LEU A 33 11.917 1.058 2.267 1.00 0.75 H new ATOM 0 HD23 LEU A 33 13.207 0.540 3.379 1.00 0.75 H new ATOM 520 N SER A 34 17.217 3.061 1.706 1.00 0.50 N ATOM 521 CA SER A 34 18.451 2.745 0.962 1.00 0.52 C ATOM 522 C SER A 34 18.330 1.373 0.278 1.00 0.47 C ATOM 523 O SER A 34 17.545 0.526 0.718 1.00 0.47 O ATOM 524 CB SER A 34 19.665 2.781 1.908 1.00 0.62 C ATOM 525 OG SER A 34 20.887 2.671 1.193 1.00 0.68 O ATOM 0 H SER A 34 17.195 2.686 2.654 1.00 0.50 H new ATOM 0 HA SER A 34 18.597 3.498 0.187 1.00 0.52 H new ATOM 0 HB2 SER A 34 19.657 3.711 2.476 1.00 0.62 H new ATOM 0 HB3 SER A 34 19.590 1.967 2.629 1.00 0.62 H new ATOM 0 HG SER A 34 21.638 2.699 1.822 1.00 0.68 H new ATOM 531 N VAL A 35 19.111 1.161 -0.800 1.00 0.50 N ATOM 532 CA VAL A 35 19.087 -0.111 -1.556 1.00 0.49 C ATOM 533 C VAL A 35 19.659 -1.303 -0.732 1.00 0.45 C ATOM 534 O VAL A 35 19.322 -2.457 -1.007 1.00 0.46 O ATOM 535 CB VAL A 35 19.830 0.031 -2.934 1.00 0.59 C ATOM 536 CG1 VAL A 35 21.344 0.205 -2.763 1.00 0.63 C ATOM 537 CG2 VAL A 35 19.511 -1.144 -3.870 1.00 0.64 C ATOM 0 H VAL A 35 19.766 1.852 -1.168 1.00 0.50 H new ATOM 0 HA VAL A 35 18.040 -0.337 -1.756 1.00 0.49 H new ATOM 0 HB VAL A 35 19.453 0.942 -3.399 1.00 0.59 H new ATOM 0 HG11 VAL A 35 21.812 0.299 -3.743 1.00 0.63 H new ATOM 0 HG12 VAL A 35 21.543 1.103 -2.178 1.00 0.63 H new ATOM 0 HG13 VAL A 35 21.754 -0.663 -2.246 1.00 0.63 H new ATOM 0 HG21 VAL A 35 20.042 -1.012 -4.813 1.00 0.64 H new ATOM 0 HG22 VAL A 35 19.826 -2.077 -3.403 1.00 0.64 H new ATOM 0 HG23 VAL A 35 18.438 -1.178 -4.059 1.00 0.64 H new ATOM 547 N ASN A 36 20.523 -1.013 0.268 1.00 0.45 N ATOM 548 CA ASN A 36 21.125 -2.058 1.123 1.00 0.46 C ATOM 549 C ASN A 36 20.383 -2.200 2.471 1.00 0.44 C ATOM 550 O ASN A 36 20.402 -3.280 3.066 1.00 0.55 O ATOM 551 CB ASN A 36 22.619 -1.753 1.362 1.00 0.55 C ATOM 552 CG ASN A 36 23.432 -2.991 1.740 1.00 0.64 C ATOM 553 OD1 ASN A 36 23.859 -3.746 0.867 1.00 0.82 O ATOM 554 ND2 ASN A 36 23.655 -3.204 3.037 1.00 0.77 N ATOM 0 H ASN A 36 20.818 -0.065 0.501 1.00 0.45 H new ATOM 0 HA ASN A 36 21.031 -3.009 0.598 1.00 0.46 H new ATOM 0 HB2 ASN A 36 23.042 -1.310 0.460 1.00 0.55 H new ATOM 0 HB3 ASN A 36 22.710 -1.010 2.155 1.00 0.55 H new ATOM 0 HD21 ASN A 36 24.196 -4.016 3.335 1.00 0.77 H new ATOM 0 HD22 ASN A 36 23.284 -2.555 3.731 1.00 0.77 H new ATOM 561 N GLU A 37 19.734 -1.113 2.951 1.00 0.44 N ATOM 562 CA GLU A 37 18.996 -1.137 4.232 1.00 0.46 C ATOM 563 C GLU A 37 17.629 -1.831 4.098 1.00 0.41 C ATOM 564 O GLU A 37 17.235 -2.577 5.000 1.00 0.43 O ATOM 565 CB GLU A 37 18.813 0.287 4.795 1.00 0.55 C ATOM 566 CG GLU A 37 20.116 0.949 5.236 1.00 0.70 C ATOM 567 CD GLU A 37 19.892 2.290 5.917 1.00 0.83 C ATOM 568 OE1 GLU A 37 19.638 2.297 7.140 1.00 1.54 O ATOM 569 OE2 GLU A 37 19.961 3.328 5.225 1.00 1.25 O ATOM 0 H GLU A 37 19.708 -0.213 2.471 1.00 0.44 H new ATOM 0 HA GLU A 37 19.599 -1.717 4.931 1.00 0.46 H new ATOM 0 HB2 GLU A 37 18.339 0.909 4.036 1.00 0.55 H new ATOM 0 HB3 GLU A 37 18.131 0.247 5.645 1.00 0.55 H new ATOM 0 HG2 GLU A 37 20.644 0.283 5.919 1.00 0.70 H new ATOM 0 HG3 GLU A 37 20.759 1.090 4.367 1.00 0.70 H new ATOM 576 N PHE A 38 16.901 -1.588 2.979 1.00 0.40 N ATOM 577 CA PHE A 38 15.579 -2.221 2.747 1.00 0.39 C ATOM 578 C PHE A 38 15.705 -3.762 2.665 1.00 0.37 C ATOM 579 O PHE A 38 14.805 -4.483 3.102 1.00 0.40 O ATOM 580 CB PHE A 38 14.879 -1.642 1.477 1.00 0.43 C ATOM 581 CG PHE A 38 15.035 -2.461 0.197 1.00 0.41 C ATOM 582 CD1 PHE A 38 16.186 -2.369 -0.575 1.00 0.49 C ATOM 583 CD2 PHE A 38 14.028 -3.329 -0.217 1.00 0.50 C ATOM 584 CE1 PHE A 38 16.330 -3.121 -1.725 1.00 0.61 C ATOM 585 CE2 PHE A 38 14.172 -4.080 -1.368 1.00 0.61 C ATOM 586 CZ PHE A 38 15.323 -3.975 -2.122 1.00 0.65 C ATOM 0 H PHE A 38 17.204 -0.965 2.230 1.00 0.40 H new ATOM 0 HA PHE A 38 14.947 -1.982 3.603 1.00 0.39 H new ATOM 0 HB2 PHE A 38 13.815 -1.535 1.689 1.00 0.43 H new ATOM 0 HB3 PHE A 38 15.270 -0.641 1.295 1.00 0.43 H new ATOM 0 HD1 PHE A 38 16.979 -1.701 -0.272 1.00 0.49 H new ATOM 0 HD2 PHE A 38 13.124 -3.416 0.368 1.00 0.50 H new ATOM 0 HE1 PHE A 38 17.232 -3.040 -2.313 1.00 0.61 H new ATOM 0 HE2 PHE A 38 13.383 -4.750 -1.678 1.00 0.61 H new ATOM 0 HZ PHE A 38 15.435 -4.561 -3.022 1.00 0.65 H new ATOM 596 N LYS A 39 16.835 -4.249 2.099 1.00 0.37 N ATOM 597 CA LYS A 39 17.101 -5.694 1.956 1.00 0.40 C ATOM 598 C LYS A 39 17.287 -6.377 3.328 1.00 0.38 C ATOM 599 O LYS A 39 16.835 -7.510 3.523 1.00 0.42 O ATOM 600 CB LYS A 39 18.345 -5.925 1.075 1.00 0.46 C ATOM 601 CG LYS A 39 18.458 -7.342 0.515 1.00 0.55 C ATOM 602 CD LYS A 39 19.655 -7.496 -0.423 1.00 0.64 C ATOM 603 CE LYS A 39 19.678 -8.864 -1.104 1.00 0.76 C ATOM 604 NZ LYS A 39 18.696 -8.959 -2.229 1.00 0.87 N ATOM 0 H LYS A 39 17.579 -3.655 1.733 1.00 0.37 H new ATOM 0 HA LYS A 39 16.232 -6.143 1.475 1.00 0.40 H new ATOM 0 HB2 LYS A 39 18.326 -5.218 0.245 1.00 0.46 H new ATOM 0 HB3 LYS A 39 19.238 -5.705 1.660 1.00 0.46 H new ATOM 0 HG2 LYS A 39 18.550 -8.050 1.338 1.00 0.55 H new ATOM 0 HG3 LYS A 39 17.543 -7.593 -0.021 1.00 0.55 H new ATOM 0 HD2 LYS A 39 19.624 -6.714 -1.182 1.00 0.64 H new ATOM 0 HD3 LYS A 39 20.577 -7.356 0.141 1.00 0.64 H new ATOM 0 HE2 LYS A 39 20.681 -9.061 -1.483 1.00 0.76 H new ATOM 0 HE3 LYS A 39 19.458 -9.637 -0.368 1.00 0.76 H new ATOM 0 HZ1 LYS A 39 18.750 -9.905 -2.658 1.00 0.87 H new ATOM 0 HZ2 LYS A 39 17.735 -8.798 -1.865 1.00 0.87 H new ATOM 0 HZ3 LYS A 39 18.920 -8.240 -2.947 1.00 0.87 H new ATOM 618 N GLU A 40 17.953 -5.672 4.269 1.00 0.38 N ATOM 619 CA GLU A 40 18.197 -6.193 5.632 1.00 0.40 C ATOM 620 C GLU A 40 16.886 -6.321 6.432 1.00 0.40 C ATOM 621 O GLU A 40 16.771 -7.202 7.289 1.00 0.44 O ATOM 622 CB GLU A 40 19.194 -5.295 6.397 1.00 0.45 C ATOM 623 CG GLU A 40 20.628 -5.376 5.878 1.00 0.49 C ATOM 624 CD GLU A 40 21.602 -4.554 6.706 1.00 0.59 C ATOM 625 OE1 GLU A 40 21.648 -3.318 6.523 1.00 0.64 O ATOM 626 OE2 GLU A 40 22.318 -5.147 7.540 1.00 0.73 O ATOM 0 H GLU A 40 18.332 -4.739 4.109 1.00 0.38 H new ATOM 0 HA GLU A 40 18.630 -7.187 5.523 1.00 0.40 H new ATOM 0 HB2 GLU A 40 18.855 -4.261 6.338 1.00 0.45 H new ATOM 0 HB3 GLU A 40 19.184 -5.574 7.451 1.00 0.45 H new ATOM 0 HG2 GLU A 40 20.950 -6.417 5.875 1.00 0.49 H new ATOM 0 HG3 GLU A 40 20.655 -5.031 4.845 1.00 0.49 H new ATOM 633 N LEU A 41 15.903 -5.436 6.152 1.00 0.39 N ATOM 634 CA LEU A 41 14.594 -5.459 6.837 1.00 0.41 C ATOM 635 C LEU A 41 13.758 -6.684 6.412 1.00 0.40 C ATOM 636 O LEU A 41 13.010 -7.232 7.225 1.00 0.44 O ATOM 637 CB LEU A 41 13.816 -4.151 6.563 1.00 0.44 C ATOM 638 CG LEU A 41 12.640 -3.842 7.523 1.00 0.55 C ATOM 639 CD1 LEU A 41 13.137 -3.624 8.957 1.00 0.65 C ATOM 640 CD2 LEU A 41 11.839 -2.629 7.036 1.00 0.58 C ATOM 0 H LEU A 41 15.993 -4.697 5.455 1.00 0.39 H new ATOM 0 HA LEU A 41 14.780 -5.538 7.908 1.00 0.41 H new ATOM 0 HB2 LEU A 41 14.519 -3.319 6.603 1.00 0.44 H new ATOM 0 HB3 LEU A 41 13.427 -4.190 5.546 1.00 0.44 H new ATOM 0 HG LEU A 41 11.978 -4.708 7.525 1.00 0.55 H new ATOM 0 HD11 LEU A 41 12.289 -3.409 9.607 1.00 0.65 H new ATOM 0 HD12 LEU A 41 13.644 -4.523 9.307 1.00 0.65 H new ATOM 0 HD13 LEU A 41 13.832 -2.784 8.978 1.00 0.65 H new ATOM 0 HD21 LEU A 41 11.019 -2.433 7.727 1.00 0.58 H new ATOM 0 HD22 LEU A 41 12.491 -1.757 6.990 1.00 0.58 H new ATOM 0 HD23 LEU A 41 11.436 -2.833 6.044 1.00 0.58 H new ATOM 652 N VAL A 42 13.895 -7.103 5.137 1.00 0.36 N ATOM 653 CA VAL A 42 13.173 -8.272 4.597 1.00 0.37 C ATOM 654 C VAL A 42 13.776 -9.591 5.136 1.00 0.38 C ATOM 655 O VAL A 42 13.063 -10.591 5.250 1.00 0.41 O ATOM 656 CB VAL A 42 13.174 -8.270 3.026 1.00 0.40 C ATOM 657 CG1 VAL A 42 12.475 -9.503 2.437 1.00 0.45 C ATOM 658 CG2 VAL A 42 12.518 -6.993 2.489 1.00 0.41 C ATOM 0 H VAL A 42 14.504 -6.645 4.459 1.00 0.36 H new ATOM 0 HA VAL A 42 12.139 -8.202 4.933 1.00 0.37 H new ATOM 0 HB VAL A 42 14.217 -8.304 2.712 1.00 0.40 H new ATOM 0 HG11 VAL A 42 12.504 -9.452 1.349 1.00 0.45 H new ATOM 0 HG12 VAL A 42 12.986 -10.406 2.772 1.00 0.45 H new ATOM 0 HG13 VAL A 42 11.438 -9.528 2.772 1.00 0.45 H new ATOM 0 HG21 VAL A 42 12.528 -7.009 1.399 1.00 0.41 H new ATOM 0 HG22 VAL A 42 11.488 -6.937 2.842 1.00 0.41 H new ATOM 0 HG23 VAL A 42 13.071 -6.123 2.844 1.00 0.41 H new ATOM 668 N THR A 43 15.088 -9.579 5.472 1.00 0.39 N ATOM 669 CA THR A 43 15.784 -10.770 5.996 1.00 0.42 C ATOM 670 C THR A 43 16.023 -10.673 7.530 1.00 0.49 C ATOM 671 O THR A 43 17.029 -11.186 8.038 1.00 0.80 O ATOM 672 CB THR A 43 17.141 -10.980 5.244 1.00 0.45 C ATOM 673 OG1 THR A 43 17.008 -10.616 3.856 1.00 0.46 O ATOM 674 CG2 THR A 43 17.629 -12.430 5.340 1.00 0.50 C ATOM 0 H THR A 43 15.683 -8.755 5.388 1.00 0.39 H new ATOM 0 HA THR A 43 15.141 -11.632 5.819 1.00 0.42 H new ATOM 0 HB THR A 43 17.877 -10.337 5.727 1.00 0.45 H new ATOM 0 HG1 THR A 43 16.986 -9.640 3.774 1.00 0.46 H new ATOM 0 HG21 THR A 43 18.573 -12.532 4.805 1.00 0.50 H new ATOM 0 HG22 THR A 43 17.774 -12.696 6.387 1.00 0.50 H new ATOM 0 HG23 THR A 43 16.887 -13.094 4.896 1.00 0.50 H new ATOM 682 N GLN A 44 15.092 -10.026 8.275 1.00 0.41 N ATOM 683 CA GLN A 44 15.225 -9.899 9.746 1.00 0.44 C ATOM 684 C GLN A 44 13.872 -9.602 10.435 1.00 0.44 C ATOM 685 O GLN A 44 13.414 -10.402 11.257 1.00 0.50 O ATOM 686 CB GLN A 44 16.259 -8.806 10.120 1.00 0.48 C ATOM 687 CG GLN A 44 16.806 -8.925 11.545 1.00 0.65 C ATOM 688 CD GLN A 44 17.830 -7.847 11.881 1.00 0.77 C ATOM 689 OE1 GLN A 44 19.027 -8.030 11.654 1.00 1.02 O ATOM 690 NE2 GLN A 44 17.367 -6.715 12.420 1.00 1.10 N ATOM 0 H GLN A 44 14.254 -9.591 7.888 1.00 0.41 H new ATOM 0 HA GLN A 44 15.579 -10.864 10.110 1.00 0.44 H new ATOM 0 HB2 GLN A 44 17.091 -8.853 9.418 1.00 0.48 H new ATOM 0 HB3 GLN A 44 15.796 -7.827 10.001 1.00 0.48 H new ATOM 0 HG2 GLN A 44 15.979 -8.866 12.252 1.00 0.65 H new ATOM 0 HG3 GLN A 44 17.264 -9.906 11.672 1.00 0.65 H new ATOM 0 HE21 GLN A 44 16.368 -6.603 12.592 1.00 1.10 H new ATOM 0 HE22 GLN A 44 18.013 -5.963 12.659 1.00 1.10 H new ATOM 699 N GLN A 45 13.249 -8.450 10.099 1.00 0.41 N ATOM 700 CA GLN A 45 11.967 -8.026 10.707 1.00 0.43 C ATOM 701 C GLN A 45 10.741 -8.273 9.787 1.00 0.41 C ATOM 702 O GLN A 45 9.599 -8.074 10.218 1.00 0.45 O ATOM 703 CB GLN A 45 12.064 -6.537 11.108 1.00 0.47 C ATOM 704 CG GLN A 45 11.030 -6.095 12.149 1.00 0.59 C ATOM 705 CD GLN A 45 11.345 -4.741 12.794 1.00 0.64 C ATOM 706 OE1 GLN A 45 11.964 -3.872 12.175 1.00 0.65 O ATOM 707 NE2 GLN A 45 10.914 -4.547 14.045 1.00 0.84 N ATOM 0 H GLN A 45 13.615 -7.795 9.408 1.00 0.41 H new ATOM 0 HA GLN A 45 11.802 -8.642 11.591 1.00 0.43 H new ATOM 0 HB2 GLN A 45 13.062 -6.343 11.500 1.00 0.47 H new ATOM 0 HB3 GLN A 45 11.947 -5.924 10.214 1.00 0.47 H new ATOM 0 HG2 GLN A 45 10.050 -6.042 11.675 1.00 0.59 H new ATOM 0 HG3 GLN A 45 10.966 -6.853 12.929 1.00 0.59 H new ATOM 0 HE21 GLN A 45 10.405 -5.286 14.529 1.00 0.84 H new ATOM 0 HE22 GLN A 45 11.095 -3.660 14.515 1.00 0.84 H new ATOM 716 N LEU A 46 10.972 -8.721 8.532 1.00 0.40 N ATOM 717 CA LEU A 46 9.885 -8.995 7.573 1.00 0.40 C ATOM 718 C LEU A 46 10.190 -10.259 6.713 1.00 0.40 C ATOM 719 O LEU A 46 10.114 -10.204 5.481 1.00 0.42 O ATOM 720 CB LEU A 46 9.682 -7.740 6.684 1.00 0.41 C ATOM 721 CG LEU A 46 8.365 -7.665 5.861 1.00 0.40 C ATOM 722 CD1 LEU A 46 7.511 -6.467 6.296 1.00 0.59 C ATOM 723 CD2 LEU A 46 8.657 -7.586 4.356 1.00 0.67 C ATOM 0 H LEU A 46 11.905 -8.900 8.162 1.00 0.40 H new ATOM 0 HA LEU A 46 8.965 -9.206 8.118 1.00 0.40 H new ATOM 0 HB2 LEU A 46 9.732 -6.859 7.324 1.00 0.41 H new ATOM 0 HB3 LEU A 46 10.520 -7.677 5.990 1.00 0.41 H new ATOM 0 HG LEU A 46 7.805 -8.579 6.056 1.00 0.40 H new ATOM 0 HD11 LEU A 46 6.596 -6.438 5.704 1.00 0.59 H new ATOM 0 HD12 LEU A 46 7.258 -6.565 7.352 1.00 0.59 H new ATOM 0 HD13 LEU A 46 8.072 -5.545 6.142 1.00 0.59 H new ATOM 0 HD21 LEU A 46 7.718 -7.535 3.805 1.00 0.67 H new ATOM 0 HD22 LEU A 46 9.250 -6.695 4.147 1.00 0.67 H new ATOM 0 HD23 LEU A 46 9.211 -8.472 4.046 1.00 0.67 H new ATOM 735 N PRO A 47 10.535 -11.434 7.343 1.00 0.42 N ATOM 736 CA PRO A 47 10.845 -12.665 6.592 1.00 0.45 C ATOM 737 C PRO A 47 9.620 -13.550 6.245 1.00 0.47 C ATOM 738 O PRO A 47 9.545 -14.076 5.130 1.00 0.52 O ATOM 739 CB PRO A 47 11.809 -13.384 7.543 1.00 0.49 C ATOM 740 CG PRO A 47 11.350 -13.014 8.917 1.00 0.49 C ATOM 741 CD PRO A 47 10.688 -11.658 8.810 1.00 0.46 C ATOM 0 HA PRO A 47 11.250 -12.441 5.605 1.00 0.45 H new ATOM 0 HB2 PRO A 47 11.777 -14.463 7.394 1.00 0.49 H new ATOM 0 HB3 PRO A 47 12.839 -13.069 7.373 1.00 0.49 H new ATOM 0 HG2 PRO A 47 10.651 -13.756 9.303 1.00 0.49 H new ATOM 0 HG3 PRO A 47 12.192 -12.979 9.609 1.00 0.49 H new ATOM 0 HD2 PRO A 47 9.723 -11.646 9.316 1.00 0.46 H new ATOM 0 HD3 PRO A 47 11.299 -10.880 9.269 1.00 0.46 H new ATOM 749 N HIS A 48 8.665 -13.708 7.190 1.00 0.47 N ATOM 750 CA HIS A 48 7.465 -14.554 6.979 1.00 0.52 C ATOM 751 C HIS A 48 6.501 -13.966 5.931 1.00 0.50 C ATOM 752 O HIS A 48 5.814 -14.722 5.236 1.00 0.57 O ATOM 753 CB HIS A 48 6.726 -14.787 8.310 1.00 0.57 C ATOM 754 CG HIS A 48 7.549 -15.534 9.322 1.00 0.65 C ATOM 755 ND1 HIS A 48 8.303 -14.901 10.291 1.00 0.69 N ATOM 756 CD2 HIS A 48 7.743 -16.861 9.503 1.00 0.79 C ATOM 757 CE1 HIS A 48 8.924 -15.807 11.021 1.00 0.80 C ATOM 758 NE2 HIS A 48 8.599 -17.005 10.568 1.00 0.85 N ATOM 0 H HIS A 48 8.701 -13.261 8.106 1.00 0.47 H new ATOM 0 HA HIS A 48 7.819 -15.509 6.590 1.00 0.52 H new ATOM 0 HB2 HIS A 48 6.433 -13.824 8.729 1.00 0.57 H new ATOM 0 HB3 HIS A 48 5.808 -15.343 8.116 1.00 0.57 H new ATOM 0 HD2 HIS A 48 7.306 -17.658 8.919 1.00 0.79 H new ATOM 0 HE1 HIS A 48 9.587 -15.604 11.849 1.00 0.80 H new ATOM 0 HE2 HIS A 48 8.930 -17.892 10.947 1.00 0.85 H new ATOM 767 N LEU A 49 6.443 -12.617 5.823 1.00 0.46 N ATOM 768 CA LEU A 49 5.568 -11.942 4.844 1.00 0.46 C ATOM 769 C LEU A 49 6.021 -12.251 3.403 1.00 0.45 C ATOM 770 O LEU A 49 5.268 -12.869 2.646 1.00 0.53 O ATOM 771 CB LEU A 49 5.533 -10.419 5.109 1.00 0.47 C ATOM 772 CG LEU A 49 4.527 -9.589 4.277 1.00 0.50 C ATOM 773 CD1 LEU A 49 3.092 -10.041 4.542 1.00 0.87 C ATOM 774 CD2 LEU A 49 4.686 -8.100 4.580 1.00 0.53 C ATOM 0 H LEU A 49 6.991 -11.980 6.401 1.00 0.46 H new ATOM 0 HA LEU A 49 4.555 -12.326 4.961 1.00 0.46 H new ATOM 0 HB2 LEU A 49 5.311 -10.263 6.165 1.00 0.47 H new ATOM 0 HB3 LEU A 49 6.532 -10.020 4.931 1.00 0.47 H new ATOM 0 HG LEU A 49 4.742 -9.754 3.221 1.00 0.50 H new ATOM 0 HD11 LEU A 49 2.405 -9.441 3.945 1.00 0.87 H new ATOM 0 HD12 LEU A 49 2.986 -11.092 4.272 1.00 0.87 H new ATOM 0 HD13 LEU A 49 2.860 -9.913 5.599 1.00 0.87 H new ATOM 0 HD21 LEU A 49 3.971 -7.530 3.987 1.00 0.53 H new ATOM 0 HD22 LEU A 49 4.502 -7.923 5.640 1.00 0.53 H new ATOM 0 HD23 LEU A 49 5.699 -7.784 4.330 1.00 0.53 H new ATOM 786 N LEU A 50 7.250 -11.826 3.035 1.00 0.43 N ATOM 787 CA LEU A 50 7.793 -12.097 1.693 1.00 0.45 C ATOM 788 C LEU A 50 8.575 -13.424 1.726 1.00 0.48 C ATOM 789 O LEU A 50 9.741 -13.451 2.133 1.00 0.54 O ATOM 790 CB LEU A 50 8.691 -10.932 1.189 1.00 0.48 C ATOM 791 CG LEU A 50 8.056 -9.513 1.172 1.00 0.57 C ATOM 792 CD1 LEU A 50 9.058 -8.470 0.664 1.00 0.66 C ATOM 793 CD2 LEU A 50 6.773 -9.471 0.332 1.00 0.73 C ATOM 0 H LEU A 50 7.876 -11.300 3.644 1.00 0.43 H new ATOM 0 HA LEU A 50 6.965 -12.180 0.989 1.00 0.45 H new ATOM 0 HB2 LEU A 50 9.584 -10.897 1.813 1.00 0.48 H new ATOM 0 HB3 LEU A 50 9.019 -11.169 0.177 1.00 0.48 H new ATOM 0 HG LEU A 50 7.789 -9.270 2.200 1.00 0.57 H new ATOM 0 HD11 LEU A 50 8.589 -7.486 0.662 1.00 0.66 H new ATOM 0 HD12 LEU A 50 9.930 -8.455 1.317 1.00 0.66 H new ATOM 0 HD13 LEU A 50 9.368 -8.726 -0.349 1.00 0.66 H new ATOM 0 HD21 LEU A 50 6.361 -8.462 0.347 1.00 0.73 H new ATOM 0 HD22 LEU A 50 7.001 -9.755 -0.695 1.00 0.73 H new ATOM 0 HD23 LEU A 50 6.043 -10.166 0.747 1.00 0.73 H new ATOM 805 N LYS A 51 7.909 -14.530 1.308 1.00 0.55 N ATOM 806 CA LYS A 51 8.509 -15.894 1.298 1.00 0.66 C ATOM 807 C LYS A 51 9.895 -15.948 0.613 1.00 0.63 C ATOM 808 O LYS A 51 10.757 -16.729 1.034 1.00 0.76 O ATOM 809 CB LYS A 51 7.551 -16.931 0.653 1.00 0.78 C ATOM 810 CG LYS A 51 7.040 -16.570 -0.755 1.00 0.78 C ATOM 811 CD LYS A 51 7.210 -17.718 -1.756 1.00 1.18 C ATOM 812 CE LYS A 51 6.778 -17.324 -3.172 1.00 1.16 C ATOM 813 NZ LYS A 51 7.724 -16.364 -3.817 1.00 1.32 N ATOM 0 H LYS A 51 6.947 -14.505 0.970 1.00 0.55 H new ATOM 0 HA LYS A 51 8.661 -16.155 2.345 1.00 0.66 H new ATOM 0 HB2 LYS A 51 8.064 -17.891 0.600 1.00 0.78 H new ATOM 0 HB3 LYS A 51 6.692 -17.065 1.310 1.00 0.78 H new ATOM 0 HG2 LYS A 51 5.986 -16.297 -0.696 1.00 0.78 H new ATOM 0 HG3 LYS A 51 7.576 -15.693 -1.118 1.00 0.78 H new ATOM 0 HD2 LYS A 51 8.254 -18.032 -1.771 1.00 1.18 H new ATOM 0 HD3 LYS A 51 6.624 -18.575 -1.425 1.00 1.18 H new ATOM 0 HE2 LYS A 51 6.701 -18.221 -3.787 1.00 1.16 H new ATOM 0 HE3 LYS A 51 5.784 -16.878 -3.133 1.00 1.16 H new ATOM 0 HZ1 LYS A 51 7.403 -16.157 -4.784 1.00 1.32 H new ATOM 0 HZ2 LYS A 51 7.753 -15.482 -3.266 1.00 1.32 H new ATOM 0 HZ3 LYS A 51 8.675 -16.783 -3.850 1.00 1.32 H new ATOM 827 N ASP A 52 10.104 -15.118 -0.428 1.00 0.64 N ATOM 828 CA ASP A 52 11.381 -15.069 -1.150 1.00 0.71 C ATOM 829 C ASP A 52 12.279 -13.964 -0.554 1.00 0.59 C ATOM 830 O ASP A 52 12.242 -12.811 -1.000 1.00 0.73 O ATOM 831 CB ASP A 52 11.123 -14.842 -2.656 1.00 0.99 C ATOM 832 CG ASP A 52 12.300 -15.236 -3.533 1.00 1.46 C ATOM 833 OD1 ASP A 52 12.382 -16.417 -3.926 1.00 2.02 O ATOM 834 OD2 ASP A 52 13.133 -14.359 -3.829 1.00 2.08 O ATOM 0 H ASP A 52 9.400 -14.472 -0.785 1.00 0.64 H new ATOM 0 HA ASP A 52 11.903 -16.020 -1.039 1.00 0.71 H new ATOM 0 HB2 ASP A 52 10.246 -15.415 -2.958 1.00 0.99 H new ATOM 0 HB3 ASP A 52 10.890 -13.790 -2.823 1.00 0.99 H new ATOM 839 N VAL A 53 13.070 -14.325 0.478 1.00 0.51 N ATOM 840 CA VAL A 53 13.979 -13.372 1.157 1.00 0.52 C ATOM 841 C VAL A 53 15.408 -13.405 0.569 1.00 0.56 C ATOM 842 O VAL A 53 16.120 -12.397 0.627 1.00 0.71 O ATOM 843 CB VAL A 53 14.030 -13.599 2.711 1.00 0.59 C ATOM 844 CG1 VAL A 53 12.646 -13.413 3.334 1.00 0.65 C ATOM 845 CG2 VAL A 53 14.606 -14.974 3.095 1.00 0.64 C ATOM 0 H VAL A 53 13.099 -15.270 0.861 1.00 0.51 H new ATOM 0 HA VAL A 53 13.559 -12.383 0.973 1.00 0.52 H new ATOM 0 HB VAL A 53 14.708 -12.845 3.111 1.00 0.59 H new ATOM 0 HG11 VAL A 53 12.707 -13.575 4.410 1.00 0.65 H new ATOM 0 HG12 VAL A 53 12.292 -12.401 3.139 1.00 0.65 H new ATOM 0 HG13 VAL A 53 11.951 -14.130 2.898 1.00 0.65 H new ATOM 0 HG21 VAL A 53 14.617 -15.074 4.180 1.00 0.64 H new ATOM 0 HG22 VAL A 53 13.987 -15.761 2.664 1.00 0.64 H new ATOM 0 HG23 VAL A 53 15.623 -15.062 2.713 1.00 0.64 H new ATOM 855 N GLY A 54 15.816 -14.560 0.002 1.00 0.53 N ATOM 856 CA GLY A 54 17.149 -14.708 -0.579 1.00 0.64 C ATOM 857 C GLY A 54 17.313 -14.058 -1.954 1.00 0.61 C ATOM 858 O GLY A 54 18.271 -13.312 -2.166 1.00 0.83 O ATOM 0 H GLY A 54 15.236 -15.397 -0.061 1.00 0.53 H new ATOM 0 HA2 GLY A 54 17.880 -14.275 0.104 1.00 0.64 H new ATOM 0 HA3 GLY A 54 17.380 -15.770 -0.662 1.00 0.64 H new ATOM 862 N SER A 55 16.375 -14.339 -2.885 1.00 0.57 N ATOM 863 CA SER A 55 16.437 -13.802 -4.260 1.00 0.58 C ATOM 864 C SER A 55 15.520 -12.572 -4.454 1.00 0.51 C ATOM 865 O SER A 55 14.635 -12.576 -5.322 1.00 0.62 O ATOM 866 CB SER A 55 16.077 -14.920 -5.260 1.00 0.74 C ATOM 867 OG SER A 55 16.270 -14.504 -6.601 1.00 0.85 O ATOM 0 H SER A 55 15.566 -14.935 -2.708 1.00 0.57 H new ATOM 0 HA SER A 55 17.455 -13.459 -4.444 1.00 0.58 H new ATOM 0 HB2 SER A 55 16.690 -15.799 -5.060 1.00 0.74 H new ATOM 0 HB3 SER A 55 15.038 -15.216 -5.117 1.00 0.74 H new ATOM 0 HG SER A 55 16.679 -13.614 -6.612 1.00 0.85 H new ATOM 873 N LEU A 56 15.743 -11.503 -3.657 1.00 0.49 N ATOM 874 CA LEU A 56 14.944 -10.262 -3.763 1.00 0.53 C ATOM 875 C LEU A 56 15.637 -9.275 -4.737 1.00 0.58 C ATOM 876 O LEU A 56 16.064 -8.185 -4.345 1.00 1.03 O ATOM 877 CB LEU A 56 14.725 -9.638 -2.345 1.00 0.67 C ATOM 878 CG LEU A 56 13.447 -8.774 -2.117 1.00 0.83 C ATOM 879 CD1 LEU A 56 13.511 -7.447 -2.876 1.00 1.22 C ATOM 880 CD2 LEU A 56 12.166 -9.545 -2.469 1.00 1.21 C ATOM 0 H LEU A 56 16.465 -11.475 -2.937 1.00 0.49 H new ATOM 0 HA LEU A 56 13.959 -10.491 -4.170 1.00 0.53 H new ATOM 0 HB2 LEU A 56 14.712 -10.452 -1.620 1.00 0.67 H new ATOM 0 HB3 LEU A 56 15.592 -9.019 -2.114 1.00 0.67 H new ATOM 0 HG LEU A 56 13.414 -8.543 -1.052 1.00 0.83 H new ATOM 0 HD11 LEU A 56 12.601 -6.877 -2.689 1.00 1.22 H new ATOM 0 HD12 LEU A 56 14.374 -6.875 -2.536 1.00 1.22 H new ATOM 0 HD13 LEU A 56 13.603 -7.643 -3.944 1.00 1.22 H new ATOM 0 HD21 LEU A 56 11.299 -8.908 -2.296 1.00 1.21 H new ATOM 0 HD22 LEU A 56 12.196 -9.841 -3.518 1.00 1.21 H new ATOM 0 HD23 LEU A 56 12.093 -10.434 -1.843 1.00 1.21 H new ATOM 892 N ASP A 57 15.743 -9.690 -6.022 1.00 0.49 N ATOM 893 CA ASP A 57 16.381 -8.877 -7.084 1.00 0.53 C ATOM 894 C ASP A 57 15.355 -8.414 -8.133 1.00 0.47 C ATOM 895 O ASP A 57 15.446 -7.282 -8.623 1.00 0.50 O ATOM 896 CB ASP A 57 17.550 -9.641 -7.757 1.00 0.67 C ATOM 897 CG ASP A 57 17.167 -11.007 -8.323 1.00 0.70 C ATOM 898 OD1 ASP A 57 17.254 -12.003 -7.577 1.00 0.77 O ATOM 899 OD2 ASP A 57 16.788 -11.075 -9.511 1.00 0.77 O ATOM 0 H ASP A 57 15.392 -10.590 -6.349 1.00 0.49 H new ATOM 0 HA ASP A 57 16.793 -7.989 -6.605 1.00 0.53 H new ATOM 0 HB2 ASP A 57 17.953 -9.027 -8.563 1.00 0.67 H new ATOM 0 HB3 ASP A 57 18.349 -9.774 -7.027 1.00 0.67 H new ATOM 904 N GLU A 58 14.385 -9.291 -8.487 1.00 0.46 N ATOM 905 CA GLU A 58 13.324 -8.947 -9.460 1.00 0.51 C ATOM 906 C GLU A 58 12.447 -7.804 -8.910 1.00 0.47 C ATOM 907 O GLU A 58 12.088 -6.882 -9.650 1.00 0.56 O ATOM 908 CB GLU A 58 12.463 -10.183 -9.790 1.00 0.60 C ATOM 909 CG GLU A 58 11.530 -9.998 -10.986 1.00 0.79 C ATOM 910 CD GLU A 58 10.705 -11.236 -11.287 1.00 0.92 C ATOM 911 OE1 GLU A 58 11.278 -12.219 -11.803 1.00 1.09 O ATOM 912 OE2 GLU A 58 9.485 -11.221 -11.010 1.00 1.02 O ATOM 0 H GLU A 58 14.317 -10.238 -8.114 1.00 0.46 H new ATOM 0 HA GLU A 58 13.797 -8.610 -10.382 1.00 0.51 H new ATOM 0 HB2 GLU A 58 13.122 -11.029 -9.986 1.00 0.60 H new ATOM 0 HB3 GLU A 58 11.866 -10.440 -8.915 1.00 0.60 H new ATOM 0 HG2 GLU A 58 10.861 -9.160 -10.792 1.00 0.79 H new ATOM 0 HG3 GLU A 58 12.121 -9.738 -11.865 1.00 0.79 H new ATOM 919 N LYS A 59 12.105 -7.883 -7.606 1.00 0.42 N ATOM 920 CA LYS A 59 11.316 -6.840 -6.931 1.00 0.47 C ATOM 921 C LYS A 59 12.155 -5.555 -6.792 1.00 0.53 C ATOM 922 O LYS A 59 11.643 -4.464 -7.042 1.00 0.91 O ATOM 923 CB LYS A 59 10.836 -7.319 -5.536 1.00 0.52 C ATOM 924 CG LYS A 59 9.550 -8.155 -5.549 1.00 0.60 C ATOM 925 CD LYS A 59 9.763 -9.573 -6.083 1.00 0.81 C ATOM 926 CE LYS A 59 8.461 -10.371 -6.108 1.00 1.17 C ATOM 927 NZ LYS A 59 8.673 -11.798 -6.495 1.00 1.55 N ATOM 0 H LYS A 59 12.366 -8.662 -7.002 1.00 0.42 H new ATOM 0 HA LYS A 59 10.435 -6.630 -7.538 1.00 0.47 H new ATOM 0 HB2 LYS A 59 11.630 -7.907 -5.077 1.00 0.52 H new ATOM 0 HB3 LYS A 59 10.679 -6.446 -4.902 1.00 0.52 H new ATOM 0 HG2 LYS A 59 9.149 -8.210 -4.537 1.00 0.60 H new ATOM 0 HG3 LYS A 59 8.802 -7.651 -6.161 1.00 0.60 H new ATOM 0 HD2 LYS A 59 10.179 -9.524 -7.089 1.00 0.81 H new ATOM 0 HD3 LYS A 59 10.494 -10.090 -5.461 1.00 0.81 H new ATOM 0 HE2 LYS A 59 7.994 -10.330 -5.124 1.00 1.17 H new ATOM 0 HE3 LYS A 59 7.767 -9.907 -6.809 1.00 1.17 H new ATOM 0 HZ1 LYS A 59 7.760 -12.296 -6.497 1.00 1.55 H new ATOM 0 HZ2 LYS A 59 9.093 -11.841 -7.445 1.00 1.55 H new ATOM 0 HZ3 LYS A 59 9.313 -12.251 -5.812 1.00 1.55 H new ATOM 941 N MET A 60 13.458 -5.708 -6.424 1.00 0.39 N ATOM 942 CA MET A 60 14.399 -4.569 -6.261 1.00 0.41 C ATOM 943 C MET A 60 14.489 -3.717 -7.549 1.00 0.42 C ATOM 944 O MET A 60 14.472 -2.485 -7.476 1.00 0.46 O ATOM 945 CB MET A 60 15.800 -5.086 -5.857 1.00 0.45 C ATOM 946 CG MET A 60 16.790 -3.993 -5.445 1.00 0.53 C ATOM 947 SD MET A 60 18.343 -4.652 -4.793 1.00 0.66 S ATOM 948 CE MET A 60 19.276 -4.926 -6.299 1.00 0.84 C ATOM 0 H MET A 60 13.880 -6.617 -6.234 1.00 0.39 H new ATOM 0 HA MET A 60 14.014 -3.929 -5.468 1.00 0.41 H new ATOM 0 HB2 MET A 60 15.689 -5.787 -5.030 1.00 0.45 H new ATOM 0 HB3 MET A 60 16.222 -5.643 -6.693 1.00 0.45 H new ATOM 0 HG2 MET A 60 17.004 -3.361 -6.307 1.00 0.53 H new ATOM 0 HG3 MET A 60 16.327 -3.357 -4.691 1.00 0.53 H new ATOM 0 HE1 MET A 60 20.257 -5.332 -6.051 1.00 0.84 H new ATOM 0 HE2 MET A 60 18.742 -5.632 -6.935 1.00 0.84 H new ATOM 0 HE3 MET A 60 19.398 -3.981 -6.829 1.00 0.84 H new ATOM 958 N LYS A 61 14.585 -4.389 -8.718 1.00 0.44 N ATOM 959 CA LYS A 61 14.639 -3.707 -10.032 1.00 0.49 C ATOM 960 C LYS A 61 13.360 -2.874 -10.282 1.00 0.46 C ATOM 961 O LYS A 61 13.426 -1.793 -10.875 1.00 0.49 O ATOM 962 CB LYS A 61 14.820 -4.740 -11.167 1.00 0.59 C ATOM 963 CG LYS A 61 16.239 -5.329 -11.285 1.00 0.70 C ATOM 964 CD LYS A 61 16.936 -4.933 -12.596 1.00 1.11 C ATOM 965 CE LYS A 61 16.328 -5.628 -13.821 1.00 1.90 C ATOM 966 NZ LYS A 61 16.605 -7.097 -13.846 1.00 2.56 N ATOM 0 H LYS A 61 14.627 -5.406 -8.779 1.00 0.44 H new ATOM 0 HA LYS A 61 15.494 -3.031 -10.022 1.00 0.49 H new ATOM 0 HB2 LYS A 61 14.115 -5.556 -11.012 1.00 0.59 H new ATOM 0 HB3 LYS A 61 14.558 -4.268 -12.114 1.00 0.59 H new ATOM 0 HG2 LYS A 61 16.840 -4.990 -10.441 1.00 0.70 H new ATOM 0 HG3 LYS A 61 16.184 -6.416 -11.221 1.00 0.70 H new ATOM 0 HD2 LYS A 61 16.870 -3.853 -12.726 1.00 1.11 H new ATOM 0 HD3 LYS A 61 17.995 -5.182 -12.530 1.00 1.11 H new ATOM 0 HE2 LYS A 61 15.250 -5.465 -13.829 1.00 1.90 H new ATOM 0 HE3 LYS A 61 16.726 -5.172 -14.727 1.00 1.90 H new ATOM 0 HZ1 LYS A 61 16.277 -7.497 -14.748 1.00 2.56 H new ATOM 0 HZ2 LYS A 61 17.627 -7.259 -13.747 1.00 2.56 H new ATOM 0 HZ3 LYS A 61 16.104 -7.558 -13.060 1.00 2.56 H new ATOM 980 N SER A 62 12.202 -3.394 -9.814 1.00 0.44 N ATOM 981 CA SER A 62 10.898 -2.722 -9.959 1.00 0.46 C ATOM 982 C SER A 62 10.785 -1.483 -9.044 1.00 0.43 C ATOM 983 O SER A 62 10.164 -0.492 -9.435 1.00 0.47 O ATOM 984 CB SER A 62 9.757 -3.707 -9.647 1.00 0.53 C ATOM 985 OG SER A 62 9.806 -4.828 -10.513 1.00 0.61 O ATOM 0 H SER A 62 12.149 -4.289 -9.327 1.00 0.44 H new ATOM 0 HA SER A 62 10.817 -2.383 -10.992 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.831 -4.039 -8.611 1.00 0.53 H new ATOM 0 HB3 SER A 62 8.797 -3.203 -9.753 1.00 0.53 H new ATOM 0 HG SER A 62 10.495 -5.451 -10.202 1.00 0.61 H new ATOM 991 N LEU A 63 11.401 -1.537 -7.834 1.00 0.40 N ATOM 992 CA LEU A 63 11.356 -0.408 -6.872 1.00 0.43 C ATOM 993 C LEU A 63 12.160 0.794 -7.393 1.00 0.45 C ATOM 994 O LEU A 63 11.583 1.844 -7.678 1.00 0.53 O ATOM 995 CB LEU A 63 11.875 -0.792 -5.450 1.00 0.45 C ATOM 996 CG LEU A 63 11.610 -2.226 -4.948 1.00 0.42 C ATOM 997 CD1 LEU A 63 12.121 -2.398 -3.517 1.00 0.48 C ATOM 998 CD2 LEU A 63 10.130 -2.603 -5.049 1.00 0.68 C ATOM 0 H LEU A 63 11.930 -2.344 -7.505 1.00 0.40 H new ATOM 0 HA LEU A 63 10.303 -0.141 -6.781 1.00 0.43 H new ATOM 0 HB2 LEU A 63 12.952 -0.625 -5.431 1.00 0.45 H new ATOM 0 HB3 LEU A 63 11.432 -0.100 -4.734 1.00 0.45 H new ATOM 0 HG LEU A 63 12.160 -2.907 -5.597 1.00 0.42 H new ATOM 0 HD11 LEU A 63 11.925 -3.416 -3.181 1.00 0.48 H new ATOM 0 HD12 LEU A 63 13.194 -2.207 -3.488 1.00 0.48 H new ATOM 0 HD13 LEU A 63 11.609 -1.694 -2.861 1.00 0.48 H new ATOM 0 HD21 LEU A 63 9.988 -3.621 -4.685 1.00 0.68 H new ATOM 0 HD22 LEU A 63 9.537 -1.916 -4.445 1.00 0.68 H new ATOM 0 HD23 LEU A 63 9.809 -2.541 -6.089 1.00 0.68 H new ATOM 1010 N ASP A 64 13.493 0.617 -7.539 1.00 0.45 N ATOM 1011 CA ASP A 64 14.389 1.684 -8.010 1.00 0.51 C ATOM 1012 C ASP A 64 14.327 1.789 -9.549 1.00 0.50 C ATOM 1013 O ASP A 64 15.233 1.335 -10.259 1.00 0.54 O ATOM 1014 CB ASP A 64 15.831 1.431 -7.503 1.00 0.60 C ATOM 1015 CG ASP A 64 16.752 2.633 -7.665 1.00 0.83 C ATOM 1016 OD1 ASP A 64 16.394 3.730 -7.183 1.00 1.28 O ATOM 1017 OD2 ASP A 64 17.835 2.474 -8.266 1.00 1.39 O ATOM 0 H ASP A 64 13.969 -0.262 -7.335 1.00 0.45 H new ATOM 0 HA ASP A 64 14.061 2.640 -7.603 1.00 0.51 H new ATOM 0 HB2 ASP A 64 15.794 1.151 -6.450 1.00 0.60 H new ATOM 0 HB3 ASP A 64 16.254 0.584 -8.043 1.00 0.60 H new ATOM 1022 N VAL A 65 13.225 2.387 -10.048 1.00 0.51 N ATOM 1023 CA VAL A 65 12.988 2.568 -11.494 1.00 0.55 C ATOM 1024 C VAL A 65 13.670 3.851 -12.045 1.00 0.55 C ATOM 1025 O VAL A 65 13.900 3.957 -13.251 1.00 0.60 O ATOM 1026 CB VAL A 65 11.445 2.557 -11.804 1.00 0.64 C ATOM 1027 CG1 VAL A 65 10.727 3.810 -11.285 1.00 0.67 C ATOM 1028 CG2 VAL A 65 11.172 2.347 -13.295 1.00 0.73 C ATOM 0 H VAL A 65 12.477 2.757 -9.461 1.00 0.51 H new ATOM 0 HA VAL A 65 13.449 1.726 -12.011 1.00 0.55 H new ATOM 0 HB VAL A 65 11.031 1.708 -11.260 1.00 0.64 H new ATOM 0 HG11 VAL A 65 9.666 3.748 -11.527 1.00 0.67 H new ATOM 0 HG12 VAL A 65 10.849 3.878 -10.204 1.00 0.67 H new ATOM 0 HG13 VAL A 65 11.155 4.695 -11.755 1.00 0.67 H new ATOM 0 HG21 VAL A 65 10.096 2.345 -13.471 1.00 0.73 H new ATOM 0 HG22 VAL A 65 11.632 3.153 -13.866 1.00 0.73 H new ATOM 0 HG23 VAL A 65 11.593 1.393 -13.611 1.00 0.73 H new ATOM 1038 N ASN A 66 13.988 4.818 -11.152 1.00 0.56 N ATOM 1039 CA ASN A 66 14.651 6.081 -11.544 1.00 0.60 C ATOM 1040 C ASN A 66 16.189 5.914 -11.664 1.00 0.59 C ATOM 1041 O ASN A 66 16.832 6.669 -12.399 1.00 0.66 O ATOM 1042 CB ASN A 66 14.308 7.195 -10.525 1.00 0.67 C ATOM 1043 CG ASN A 66 14.680 8.606 -10.998 1.00 0.94 C ATOM 1044 OD1 ASN A 66 14.499 8.945 -12.169 1.00 1.29 O ATOM 1045 ND2 ASN A 66 15.207 9.438 -10.093 1.00 1.44 N ATOM 0 H ASN A 66 13.795 4.745 -10.153 1.00 0.56 H new ATOM 0 HA ASN A 66 14.277 6.362 -12.528 1.00 0.60 H new ATOM 0 HB2 ASN A 66 13.239 7.163 -10.313 1.00 0.67 H new ATOM 0 HB3 ASN A 66 14.825 6.988 -9.588 1.00 0.67 H new ATOM 0 HD21 ASN A 66 15.472 10.385 -10.364 1.00 1.44 H new ATOM 0 HD22 ASN A 66 15.344 9.126 -9.132 1.00 1.44 H new ATOM 1052 N GLN A 67 16.771 4.925 -10.929 1.00 0.55 N ATOM 1053 CA GLN A 67 18.227 4.642 -10.932 1.00 0.60 C ATOM 1054 C GLN A 67 19.039 5.836 -10.371 1.00 0.63 C ATOM 1055 O GLN A 67 19.861 6.439 -11.069 1.00 0.78 O ATOM 1056 CB GLN A 67 18.728 4.224 -12.340 1.00 0.70 C ATOM 1057 CG GLN A 67 18.253 2.834 -12.795 1.00 0.88 C ATOM 1058 CD GLN A 67 16.857 2.829 -13.425 1.00 1.20 C ATOM 1059 OE1 GLN A 67 16.483 3.761 -14.136 1.00 1.96 O ATOM 1060 NE2 GLN A 67 16.076 1.776 -13.165 1.00 1.86 N ATOM 0 H GLN A 67 16.239 4.304 -10.319 1.00 0.55 H new ATOM 0 HA GLN A 67 18.392 3.794 -10.267 1.00 0.60 H new ATOM 0 HB2 GLN A 67 18.394 4.965 -13.066 1.00 0.70 H new ATOM 0 HB3 GLN A 67 19.818 4.242 -12.345 1.00 0.70 H new ATOM 0 HG2 GLN A 67 18.967 2.435 -13.515 1.00 0.88 H new ATOM 0 HG3 GLN A 67 18.256 2.161 -11.937 1.00 0.88 H new ATOM 0 HE21 GLN A 67 16.419 1.021 -12.571 1.00 1.86 H new ATOM 0 HE22 GLN A 67 15.137 1.727 -13.561 1.00 1.86 H new ATOM 1069 N ASP A 68 18.784 6.161 -9.089 1.00 0.62 N ATOM 1070 CA ASP A 68 19.462 7.271 -8.384 1.00 0.71 C ATOM 1071 C ASP A 68 20.039 6.807 -7.018 1.00 0.77 C ATOM 1072 O ASP A 68 20.408 7.644 -6.188 1.00 1.32 O ATOM 1073 CB ASP A 68 18.450 8.424 -8.179 1.00 0.78 C ATOM 1074 CG ASP A 68 19.108 9.771 -7.900 1.00 1.08 C ATOM 1075 OD1 ASP A 68 19.497 10.454 -8.869 1.00 1.41 O ATOM 1076 OD2 ASP A 68 19.222 10.142 -6.712 1.00 1.37 O ATOM 0 H ASP A 68 18.105 5.664 -8.513 1.00 0.62 H new ATOM 0 HA ASP A 68 20.300 7.615 -8.990 1.00 0.71 H new ATOM 0 HB2 ASP A 68 17.826 8.511 -9.068 1.00 0.78 H new ATOM 0 HB3 ASP A 68 17.789 8.173 -7.349 1.00 0.78 H new ATOM 1081 N SER A 69 20.138 5.464 -6.804 1.00 0.62 N ATOM 1082 CA SER A 69 20.635 4.872 -5.538 1.00 0.67 C ATOM 1083 C SER A 69 19.771 5.305 -4.325 1.00 0.68 C ATOM 1084 O SER A 69 20.271 5.383 -3.197 1.00 1.24 O ATOM 1085 CB SER A 69 22.126 5.211 -5.304 1.00 0.82 C ATOM 1086 OG SER A 69 22.916 4.855 -6.429 1.00 1.31 O ATOM 0 H SER A 69 19.876 4.769 -7.503 1.00 0.62 H new ATOM 0 HA SER A 69 20.548 3.790 -5.634 1.00 0.67 H new ATOM 0 HB2 SER A 69 22.232 6.277 -5.104 1.00 0.82 H new ATOM 0 HB3 SER A 69 22.487 4.684 -4.421 1.00 0.82 H new ATOM 0 HG SER A 69 23.854 5.081 -6.255 1.00 1.31 H new ATOM 1092 N GLU A 70 18.463 5.565 -4.570 1.00 0.66 N ATOM 1093 CA GLU A 70 17.524 5.991 -3.518 1.00 0.77 C ATOM 1094 C GLU A 70 16.135 5.358 -3.728 1.00 0.64 C ATOM 1095 O GLU A 70 15.569 5.453 -4.822 1.00 0.75 O ATOM 1096 CB GLU A 70 17.390 7.527 -3.504 1.00 1.13 C ATOM 1097 CG GLU A 70 18.662 8.268 -3.086 1.00 1.41 C ATOM 1098 CD GLU A 70 18.503 9.784 -3.047 1.00 1.90 C ATOM 1099 OE1 GLU A 70 17.425 10.294 -3.432 1.00 2.41 O ATOM 1100 OE2 GLU A 70 19.465 10.466 -2.631 1.00 2.42 O ATOM 0 H GLU A 70 18.039 5.485 -5.494 1.00 0.66 H new ATOM 0 HA GLU A 70 17.923 5.654 -2.561 1.00 0.77 H new ATOM 0 HB2 GLU A 70 17.098 7.863 -4.499 1.00 1.13 H new ATOM 0 HB3 GLU A 70 16.583 7.803 -2.825 1.00 1.13 H new ATOM 0 HG2 GLU A 70 18.968 7.918 -2.100 1.00 1.41 H new ATOM 0 HG3 GLU A 70 19.464 8.013 -3.778 1.00 1.41 H new ATOM 1107 N LEU A 71 15.600 4.714 -2.674 1.00 0.57 N ATOM 1108 CA LEU A 71 14.272 4.077 -2.721 1.00 0.51 C ATOM 1109 C LEU A 71 13.249 4.914 -1.931 1.00 0.51 C ATOM 1110 O LEU A 71 12.864 4.554 -0.811 1.00 0.53 O ATOM 1111 CB LEU A 71 14.327 2.628 -2.169 1.00 0.53 C ATOM 1112 CG LEU A 71 14.903 1.548 -3.114 1.00 0.66 C ATOM 1113 CD1 LEU A 71 16.420 1.701 -3.296 1.00 0.95 C ATOM 1114 CD2 LEU A 71 14.551 0.155 -2.587 1.00 0.74 C ATOM 0 H LEU A 71 16.071 4.621 -1.774 1.00 0.57 H new ATOM 0 HA LEU A 71 13.957 4.028 -3.763 1.00 0.51 H new ATOM 0 HB2 LEU A 71 14.922 2.634 -1.256 1.00 0.53 H new ATOM 0 HB3 LEU A 71 13.316 2.332 -1.889 1.00 0.53 H new ATOM 0 HG LEU A 71 14.450 1.680 -4.097 1.00 0.66 H new ATOM 0 HD11 LEU A 71 16.786 0.924 -3.967 1.00 0.95 H new ATOM 0 HD12 LEU A 71 16.638 2.680 -3.722 1.00 0.95 H new ATOM 0 HD13 LEU A 71 16.914 1.608 -2.329 1.00 0.95 H new ATOM 0 HD21 LEU A 71 14.960 -0.601 -3.257 1.00 0.74 H new ATOM 0 HD22 LEU A 71 14.975 0.025 -1.591 1.00 0.74 H new ATOM 0 HD23 LEU A 71 13.467 0.048 -2.537 1.00 0.74 H new ATOM 1126 N LYS A 72 12.833 6.059 -2.512 1.00 0.53 N ATOM 1127 CA LYS A 72 11.827 6.946 -1.888 1.00 0.56 C ATOM 1128 C LYS A 72 10.462 6.224 -1.867 1.00 0.50 C ATOM 1129 O LYS A 72 10.293 5.245 -2.588 1.00 0.48 O ATOM 1130 CB LYS A 72 11.755 8.288 -2.663 1.00 0.63 C ATOM 1131 CG LYS A 72 11.039 9.430 -1.925 1.00 0.86 C ATOM 1132 CD LYS A 72 10.951 10.718 -2.755 1.00 1.00 C ATOM 1133 CE LYS A 72 12.252 11.525 -2.735 1.00 1.43 C ATOM 1134 NZ LYS A 72 12.071 12.907 -3.271 1.00 1.89 N ATOM 0 H LYS A 72 13.178 6.391 -3.412 1.00 0.53 H new ATOM 0 HA LYS A 72 12.110 7.175 -0.861 1.00 0.56 H new ATOM 0 HB2 LYS A 72 12.770 8.608 -2.898 1.00 0.63 H new ATOM 0 HB3 LYS A 72 11.247 8.115 -3.612 1.00 0.63 H new ATOM 0 HG2 LYS A 72 10.033 9.108 -1.657 1.00 0.86 H new ATOM 0 HG3 LYS A 72 11.565 9.640 -0.994 1.00 0.86 H new ATOM 0 HD2 LYS A 72 10.701 10.465 -3.785 1.00 1.00 H new ATOM 0 HD3 LYS A 72 10.139 11.337 -2.373 1.00 1.00 H new ATOM 0 HE2 LYS A 72 12.627 11.580 -1.713 1.00 1.43 H new ATOM 0 HE3 LYS A 72 13.008 11.006 -3.324 1.00 1.43 H new ATOM 0 HZ1 LYS A 72 12.978 13.414 -3.237 1.00 1.89 H new ATOM 0 HZ2 LYS A 72 11.739 12.857 -4.255 1.00 1.89 H new ATOM 0 HZ3 LYS A 72 11.369 13.414 -2.694 1.00 1.89 H new ATOM 1148 N PHE A 73 9.493 6.686 -1.048 1.00 0.53 N ATOM 1149 CA PHE A 73 8.165 6.020 -0.969 1.00 0.50 C ATOM 1150 C PHE A 73 7.458 5.892 -2.342 1.00 0.47 C ATOM 1151 O PHE A 73 6.623 5.002 -2.508 1.00 0.47 O ATOM 1152 CB PHE A 73 7.241 6.707 0.063 1.00 0.56 C ATOM 1153 CG PHE A 73 6.764 5.769 1.157 1.00 0.69 C ATOM 1154 CD1 PHE A 73 5.797 4.801 0.896 1.00 0.89 C ATOM 1155 CD2 PHE A 73 7.294 5.843 2.439 1.00 0.87 C ATOM 1156 CE1 PHE A 73 5.375 3.933 1.890 1.00 1.12 C ATOM 1157 CE2 PHE A 73 6.870 4.981 3.432 1.00 1.11 C ATOM 1158 CZ PHE A 73 5.912 4.025 3.158 1.00 1.20 C ATOM 0 H PHE A 73 9.596 7.500 -0.442 1.00 0.53 H new ATOM 0 HA PHE A 73 8.367 5.005 -0.628 1.00 0.50 H new ATOM 0 HB2 PHE A 73 7.773 7.543 0.517 1.00 0.56 H new ATOM 0 HB3 PHE A 73 6.376 7.122 -0.454 1.00 0.56 H new ATOM 0 HD1 PHE A 73 5.371 4.726 -0.094 1.00 0.89 H new ATOM 0 HD2 PHE A 73 8.047 6.584 2.662 1.00 0.87 H new ATOM 0 HE1 PHE A 73 4.627 3.185 1.673 1.00 1.12 H new ATOM 0 HE2 PHE A 73 7.289 5.055 4.425 1.00 1.11 H new ATOM 0 HZ PHE A 73 5.583 3.350 3.935 1.00 1.20 H new ATOM 1168 N ASN A 74 7.783 6.775 -3.316 1.00 0.49 N ATOM 1169 CA ASN A 74 7.199 6.695 -4.674 1.00 0.51 C ATOM 1170 C ASN A 74 7.788 5.486 -5.444 1.00 0.49 C ATOM 1171 O ASN A 74 7.097 4.871 -6.260 1.00 0.53 O ATOM 1172 CB ASN A 74 7.436 8.007 -5.454 1.00 0.57 C ATOM 1173 CG ASN A 74 6.647 8.085 -6.759 1.00 0.65 C ATOM 1174 OD1 ASN A 74 7.170 7.770 -7.829 1.00 0.98 O ATOM 1175 ND2 ASN A 74 5.377 8.490 -6.680 1.00 0.91 N ATOM 0 H ASN A 74 8.441 7.544 -3.188 1.00 0.49 H new ATOM 0 HA ASN A 74 6.123 6.552 -4.576 1.00 0.51 H new ATOM 0 HB2 ASN A 74 7.163 8.852 -4.822 1.00 0.57 H new ATOM 0 HB3 ASN A 74 8.499 8.104 -5.674 1.00 0.57 H new ATOM 0 HD21 ASN A 74 4.806 8.546 -7.524 1.00 0.91 H new ATOM 0 HD22 ASN A 74 4.978 8.743 -5.776 1.00 0.91 H new ATOM 1182 N GLU A 75 9.074 5.169 -5.179 1.00 0.46 N ATOM 1183 CA GLU A 75 9.769 4.025 -5.800 1.00 0.47 C ATOM 1184 C GLU A 75 9.548 2.747 -4.965 1.00 0.43 C ATOM 1185 O GLU A 75 9.278 1.679 -5.520 1.00 0.44 O ATOM 1186 CB GLU A 75 11.280 4.327 -5.941 1.00 0.53 C ATOM 1187 CG GLU A 75 11.646 5.147 -7.182 1.00 0.61 C ATOM 1188 CD GLU A 75 11.235 6.610 -7.081 1.00 0.78 C ATOM 1189 OE1 GLU A 75 10.083 6.931 -7.446 1.00 1.03 O ATOM 1190 OE2 GLU A 75 12.068 7.431 -6.645 1.00 0.98 O ATOM 0 H GLU A 75 9.656 5.698 -4.530 1.00 0.46 H new ATOM 0 HA GLU A 75 9.355 3.863 -6.795 1.00 0.47 H new ATOM 0 HB2 GLU A 75 11.616 4.863 -5.054 1.00 0.53 H new ATOM 0 HB3 GLU A 75 11.826 3.384 -5.969 1.00 0.53 H new ATOM 0 HG2 GLU A 75 12.723 5.090 -7.342 1.00 0.61 H new ATOM 0 HG3 GLU A 75 11.170 4.703 -8.056 1.00 0.61 H new ATOM 1197 N TYR A 76 9.659 2.877 -3.622 1.00 0.42 N ATOM 1198 CA TYR A 76 9.441 1.763 -2.669 1.00 0.41 C ATOM 1199 C TYR A 76 7.968 1.277 -2.693 1.00 0.39 C ATOM 1200 O TYR A 76 7.688 0.148 -2.275 1.00 0.52 O ATOM 1201 CB TYR A 76 9.860 2.209 -1.247 1.00 0.44 C ATOM 1202 CG TYR A 76 9.760 1.149 -0.146 1.00 0.45 C ATOM 1203 CD1 TYR A 76 10.587 0.024 -0.144 1.00 0.52 C ATOM 1204 CD2 TYR A 76 8.855 1.290 0.907 1.00 0.51 C ATOM 1205 CE1 TYR A 76 10.510 -0.923 0.863 1.00 0.59 C ATOM 1206 CE2 TYR A 76 8.777 0.350 1.919 1.00 0.57 C ATOM 1207 CZ TYR A 76 9.605 -0.756 1.895 1.00 0.59 C ATOM 1208 OH TYR A 76 9.540 -1.693 2.910 1.00 0.69 O ATOM 0 H TYR A 76 9.902 3.758 -3.169 1.00 0.42 H new ATOM 0 HA TYR A 76 10.060 0.918 -2.972 1.00 0.41 H new ATOM 0 HB2 TYR A 76 10.890 2.562 -1.289 1.00 0.44 H new ATOM 0 HB3 TYR A 76 9.243 3.060 -0.960 1.00 0.44 H new ATOM 0 HD1 TYR A 76 11.301 -0.110 -0.944 1.00 0.52 H new ATOM 0 HD2 TYR A 76 8.202 2.150 0.932 1.00 0.51 H new ATOM 0 HE1 TYR A 76 11.155 -1.789 0.843 1.00 0.59 H new ATOM 0 HE2 TYR A 76 8.071 0.480 2.726 1.00 0.57 H new ATOM 0 HH TYR A 76 8.854 -1.427 3.557 1.00 0.69 H new ATOM 1218 N TRP A 77 7.042 2.138 -3.195 1.00 0.40 N ATOM 1219 CA TRP A 77 5.603 1.812 -3.321 1.00 0.42 C ATOM 1220 C TRP A 77 5.378 0.521 -4.153 1.00 0.37 C ATOM 1221 O TRP A 77 4.350 -0.141 -3.988 1.00 0.39 O ATOM 1222 CB TRP A 77 4.844 3.040 -3.903 1.00 0.58 C ATOM 1223 CG TRP A 77 3.601 2.745 -4.707 1.00 0.49 C ATOM 1224 CD1 TRP A 77 2.375 2.388 -4.230 1.00 0.53 C ATOM 1225 CD2 TRP A 77 3.478 2.789 -6.133 1.00 0.78 C ATOM 1226 NE1 TRP A 77 1.496 2.212 -5.272 1.00 0.77 N ATOM 1227 CE2 TRP A 77 2.153 2.450 -6.450 1.00 0.97 C ATOM 1228 CE3 TRP A 77 4.363 3.085 -7.168 1.00 1.04 C ATOM 1229 CZ2 TRP A 77 1.692 2.400 -7.766 1.00 1.40 C ATOM 1230 CZ3 TRP A 77 3.911 3.033 -8.469 1.00 1.45 C ATOM 1231 CH2 TRP A 77 2.586 2.694 -8.761 1.00 1.62 C ATOM 0 H TRP A 77 7.276 3.075 -3.522 1.00 0.40 H new ATOM 0 HA TRP A 77 5.196 1.599 -2.332 1.00 0.42 H new ATOM 0 HB2 TRP A 77 4.568 3.694 -3.076 1.00 0.58 H new ATOM 0 HB3 TRP A 77 5.534 3.599 -4.535 1.00 0.58 H new ATOM 0 HD1 TRP A 77 2.130 2.262 -3.186 1.00 0.53 H new ATOM 0 HE1 TRP A 77 0.515 1.947 -5.183 1.00 0.77 H new ATOM 0 HE3 TRP A 77 5.388 3.351 -6.954 1.00 1.04 H new ATOM 0 HZ2 TRP A 77 0.669 2.139 -7.992 1.00 1.40 H new ATOM 0 HZ3 TRP A 77 4.592 3.258 -9.277 1.00 1.45 H new ATOM 0 HH2 TRP A 77 2.262 2.663 -9.791 1.00 1.62 H new ATOM 1242 N ARG A 78 6.333 0.176 -5.053 1.00 0.39 N ATOM 1243 CA ARG A 78 6.248 -1.057 -5.865 1.00 0.42 C ATOM 1244 C ARG A 78 6.318 -2.309 -4.958 1.00 0.40 C ATOM 1245 O ARG A 78 5.672 -3.321 -5.253 1.00 0.45 O ATOM 1246 CB ARG A 78 7.370 -1.090 -6.926 1.00 0.49 C ATOM 1247 CG ARG A 78 7.271 0.018 -7.989 1.00 0.64 C ATOM 1248 CD ARG A 78 6.302 -0.327 -9.126 1.00 0.82 C ATOM 1249 NE ARG A 78 6.897 -1.247 -10.116 1.00 1.11 N ATOM 1250 CZ ARG A 78 7.455 -0.891 -11.300 1.00 1.57 C ATOM 1251 NH1 ARG A 78 7.522 0.392 -11.696 1.00 1.96 N ATOM 1252 NH2 ARG A 78 7.944 -1.842 -12.104 1.00 1.93 N ATOM 0 H ARG A 78 7.167 0.735 -5.232 1.00 0.39 H new ATOM 0 HA ARG A 78 5.289 -1.061 -6.383 1.00 0.42 H new ATOM 0 HB2 ARG A 78 8.333 -1.008 -6.422 1.00 0.49 H new ATOM 0 HB3 ARG A 78 7.353 -2.059 -7.425 1.00 0.49 H new ATOM 0 HG2 ARG A 78 6.948 0.943 -7.512 1.00 0.64 H new ATOM 0 HG3 ARG A 78 8.261 0.203 -8.406 1.00 0.64 H new ATOM 0 HD2 ARG A 78 5.403 -0.780 -8.708 1.00 0.82 H new ATOM 0 HD3 ARG A 78 5.993 0.590 -9.627 1.00 0.82 H new ATOM 0 HE ARG A 78 6.888 -2.241 -9.889 1.00 1.11 H new ATOM 0 HH11 ARG A 78 7.147 1.130 -11.100 1.00 1.96 H new ATOM 0 HH12 ARG A 78 7.948 0.627 -12.592 1.00 1.96 H new ATOM 0 HH21 ARG A 78 7.895 -2.822 -11.824 1.00 1.93 H new ATOM 0 HH22 ARG A 78 8.366 -1.587 -12.997 1.00 1.93 H new ATOM 1266 N LEU A 79 7.101 -2.228 -3.847 1.00 0.37 N ATOM 1267 CA LEU A 79 7.212 -3.336 -2.874 1.00 0.37 C ATOM 1268 C LEU A 79 5.971 -3.356 -1.961 1.00 0.36 C ATOM 1269 O LEU A 79 5.546 -4.428 -1.537 1.00 0.39 O ATOM 1270 CB LEU A 79 8.494 -3.229 -2.003 1.00 0.40 C ATOM 1271 CG LEU A 79 8.945 -4.543 -1.305 1.00 0.44 C ATOM 1272 CD1 LEU A 79 9.663 -5.488 -2.279 1.00 0.49 C ATOM 1273 CD2 LEU A 79 9.836 -4.244 -0.094 1.00 0.53 C ATOM 0 H LEU A 79 7.660 -1.408 -3.609 1.00 0.37 H new ATOM 0 HA LEU A 79 7.276 -4.263 -3.444 1.00 0.37 H new ATOM 0 HB2 LEU A 79 9.310 -2.875 -2.632 1.00 0.40 H new ATOM 0 HB3 LEU A 79 8.329 -2.471 -1.238 1.00 0.40 H new ATOM 0 HG LEU A 79 8.044 -5.047 -0.957 1.00 0.44 H new ATOM 0 HD11 LEU A 79 9.962 -6.394 -1.753 1.00 0.49 H new ATOM 0 HD12 LEU A 79 8.990 -5.748 -3.096 1.00 0.49 H new ATOM 0 HD13 LEU A 79 10.547 -4.993 -2.681 1.00 0.49 H new ATOM 0 HD21 LEU A 79 10.137 -5.180 0.376 1.00 0.53 H new ATOM 0 HD22 LEU A 79 10.722 -3.700 -0.420 1.00 0.53 H new ATOM 0 HD23 LEU A 79 9.283 -3.639 0.624 1.00 0.53 H new ATOM 1285 N ILE A 80 5.396 -2.155 -1.669 1.00 0.38 N ATOM 1286 CA ILE A 80 4.184 -2.022 -0.817 1.00 0.41 C ATOM 1287 C ILE A 80 3.005 -2.844 -1.392 1.00 0.40 C ATOM 1288 O ILE A 80 2.171 -3.340 -0.626 1.00 0.43 O ATOM 1289 CB ILE A 80 3.769 -0.514 -0.629 1.00 0.49 C ATOM 1290 CG1 ILE A 80 4.894 0.300 0.080 1.00 0.53 C ATOM 1291 CG2 ILE A 80 2.433 -0.364 0.125 1.00 0.59 C ATOM 1292 CD1 ILE A 80 5.250 -0.147 1.496 1.00 0.61 C ATOM 0 H ILE A 80 5.756 -1.265 -2.013 1.00 0.38 H new ATOM 0 HA ILE A 80 4.434 -2.423 0.165 1.00 0.41 H new ATOM 0 HB ILE A 80 3.626 -0.104 -1.629 1.00 0.49 H new ATOM 0 HG12 ILE A 80 5.794 0.249 -0.533 1.00 0.53 H new ATOM 0 HG13 ILE A 80 4.591 1.346 0.116 1.00 0.53 H new ATOM 0 HG21 ILE A 80 2.191 0.694 0.229 1.00 0.59 H new ATOM 0 HG22 ILE A 80 1.642 -0.864 -0.434 1.00 0.59 H new ATOM 0 HG23 ILE A 80 2.520 -0.815 1.113 1.00 0.59 H new ATOM 0 HD11 ILE A 80 6.043 0.489 1.890 1.00 0.61 H new ATOM 0 HD12 ILE A 80 4.370 -0.068 2.135 1.00 0.61 H new ATOM 0 HD13 ILE A 80 5.592 -1.182 1.476 1.00 0.61 H new ATOM 1304 N GLY A 81 2.941 -2.971 -2.738 1.00 0.40 N ATOM 1305 CA GLY A 81 1.901 -3.770 -3.383 1.00 0.44 C ATOM 1306 C GLY A 81 2.056 -5.249 -3.054 1.00 0.41 C ATOM 1307 O GLY A 81 1.076 -5.913 -2.714 1.00 0.47 O ATOM 0 H GLY A 81 3.596 -2.530 -3.384 1.00 0.40 H new ATOM 0 HA2 GLY A 81 0.920 -3.424 -3.058 1.00 0.44 H new ATOM 0 HA3 GLY A 81 1.948 -3.629 -4.463 1.00 0.44 H new ATOM 1311 N GLU A 82 3.305 -5.760 -3.145 1.00 0.38 N ATOM 1312 CA GLU A 82 3.611 -7.164 -2.806 1.00 0.38 C ATOM 1313 C GLU A 82 3.583 -7.367 -1.271 1.00 0.36 C ATOM 1314 O GLU A 82 3.359 -8.482 -0.800 1.00 0.42 O ATOM 1315 CB GLU A 82 4.986 -7.591 -3.371 1.00 0.43 C ATOM 1316 CG GLU A 82 5.090 -7.567 -4.900 1.00 0.51 C ATOM 1317 CD GLU A 82 4.279 -8.660 -5.577 1.00 0.62 C ATOM 1318 OE1 GLU A 82 4.811 -9.779 -5.742 1.00 0.83 O ATOM 1319 OE2 GLU A 82 3.113 -8.398 -5.938 1.00 0.86 O ATOM 0 H GLU A 82 4.115 -5.220 -3.450 1.00 0.38 H new ATOM 0 HA GLU A 82 2.846 -7.791 -3.263 1.00 0.38 H new ATOM 0 HB2 GLU A 82 5.752 -6.934 -2.959 1.00 0.43 H new ATOM 0 HB3 GLU A 82 5.209 -8.599 -3.022 1.00 0.43 H new ATOM 0 HG2 GLU A 82 4.754 -6.596 -5.265 1.00 0.51 H new ATOM 0 HG3 GLU A 82 6.136 -7.670 -5.187 1.00 0.51 H new ATOM 1326 N LEU A 83 3.815 -6.271 -0.504 1.00 0.36 N ATOM 1327 CA LEU A 83 3.797 -6.299 0.975 1.00 0.39 C ATOM 1328 C LEU A 83 2.402 -6.701 1.500 1.00 0.40 C ATOM 1329 O LEU A 83 2.289 -7.606 2.329 1.00 0.49 O ATOM 1330 CB LEU A 83 4.212 -4.909 1.542 1.00 0.44 C ATOM 1331 CG LEU A 83 5.041 -4.912 2.846 1.00 0.49 C ATOM 1332 CD1 LEU A 83 6.464 -5.423 2.593 1.00 0.67 C ATOM 1333 CD2 LEU A 83 5.074 -3.512 3.467 1.00 0.61 C ATOM 0 H LEU A 83 4.018 -5.351 -0.894 1.00 0.36 H new ATOM 0 HA LEU A 83 4.514 -7.046 1.314 1.00 0.39 H new ATOM 0 HB2 LEU A 83 4.784 -4.386 0.776 1.00 0.44 H new ATOM 0 HB3 LEU A 83 3.306 -4.328 1.716 1.00 0.44 H new ATOM 0 HG LEU A 83 4.559 -5.591 3.550 1.00 0.49 H new ATOM 0 HD11 LEU A 83 7.025 -5.414 3.527 1.00 0.67 H new ATOM 0 HD12 LEU A 83 6.421 -6.441 2.204 1.00 0.67 H new ATOM 0 HD13 LEU A 83 6.959 -4.778 1.867 1.00 0.67 H new ATOM 0 HD21 LEU A 83 5.662 -3.535 4.384 1.00 0.61 H new ATOM 0 HD22 LEU A 83 5.525 -2.812 2.763 1.00 0.61 H new ATOM 0 HD23 LEU A 83 4.058 -3.191 3.696 1.00 0.61 H new ATOM 1345 N ALA A 84 1.343 -6.029 0.992 1.00 0.39 N ATOM 1346 CA ALA A 84 -0.051 -6.322 1.392 1.00 0.45 C ATOM 1347 C ALA A 84 -0.640 -7.533 0.626 1.00 0.45 C ATOM 1348 O ALA A 84 -1.601 -8.149 1.100 1.00 0.55 O ATOM 1349 CB ALA A 84 -0.937 -5.090 1.197 1.00 0.54 C ATOM 0 H ALA A 84 1.429 -5.280 0.304 1.00 0.39 H new ATOM 0 HA ALA A 84 -0.031 -6.585 2.450 1.00 0.45 H new ATOM 0 HB1 ALA A 84 -1.958 -5.325 1.497 1.00 0.54 H new ATOM 0 HB2 ALA A 84 -0.559 -4.270 1.808 1.00 0.54 H new ATOM 0 HB3 ALA A 84 -0.925 -4.796 0.147 1.00 0.54 H new ATOM 1355 N LYS A 85 -0.056 -7.869 -0.549 1.00 0.42 N ATOM 1356 CA LYS A 85 -0.520 -9.001 -1.383 1.00 0.46 C ATOM 1357 C LYS A 85 0.003 -10.355 -0.853 1.00 0.47 C ATOM 1358 O LYS A 85 -0.704 -11.362 -0.950 1.00 0.55 O ATOM 1359 CB LYS A 85 -0.074 -8.799 -2.852 1.00 0.49 C ATOM 1360 CG LYS A 85 -0.709 -9.773 -3.858 1.00 0.59 C ATOM 1361 CD LYS A 85 0.035 -9.827 -5.202 1.00 0.64 C ATOM 1362 CE LYS A 85 -0.399 -8.733 -6.186 1.00 0.69 C ATOM 1363 NZ LYS A 85 -0.016 -7.355 -5.751 1.00 0.96 N ATOM 0 H LYS A 85 0.741 -7.368 -0.941 1.00 0.42 H new ATOM 0 HA LYS A 85 -1.609 -9.023 -1.334 1.00 0.46 H new ATOM 0 HB2 LYS A 85 -0.315 -7.779 -3.153 1.00 0.49 H new ATOM 0 HB3 LYS A 85 1.010 -8.899 -2.905 1.00 0.49 H new ATOM 0 HG2 LYS A 85 -0.731 -10.772 -3.422 1.00 0.59 H new ATOM 0 HG3 LYS A 85 -1.744 -9.479 -4.035 1.00 0.59 H new ATOM 0 HD2 LYS A 85 1.106 -9.736 -5.019 1.00 0.64 H new ATOM 0 HD3 LYS A 85 -0.129 -10.802 -5.660 1.00 0.64 H new ATOM 0 HE2 LYS A 85 0.045 -8.935 -7.161 1.00 0.69 H new ATOM 0 HE3 LYS A 85 -1.481 -8.778 -6.313 1.00 0.69 H new ATOM 0 HZ1 LYS A 85 0.077 -6.741 -6.585 1.00 0.96 H new ATOM 0 HZ2 LYS A 85 -0.750 -6.973 -5.121 1.00 0.96 H new ATOM 0 HZ3 LYS A 85 0.891 -7.391 -5.244 1.00 0.96 H new ATOM 1377 N GLU A 86 1.236 -10.375 -0.297 1.00 0.42 N ATOM 1378 CA GLU A 86 1.850 -11.618 0.230 1.00 0.46 C ATOM 1379 C GLU A 86 1.498 -11.888 1.721 1.00 0.52 C ATOM 1380 O GLU A 86 2.131 -12.747 2.350 1.00 0.92 O ATOM 1381 CB GLU A 86 3.392 -11.580 0.043 1.00 0.49 C ATOM 1382 CG GLU A 86 3.869 -11.506 -1.413 1.00 0.55 C ATOM 1383 CD GLU A 86 3.751 -12.830 -2.159 1.00 1.03 C ATOM 1384 OE1 GLU A 86 4.674 -13.662 -2.039 1.00 1.52 O ATOM 1385 OE2 GLU A 86 2.736 -13.031 -2.861 1.00 1.65 O ATOM 0 H GLU A 86 1.825 -9.548 -0.201 1.00 0.42 H new ATOM 0 HA GLU A 86 1.429 -12.441 -0.347 1.00 0.46 H new ATOM 0 HB2 GLU A 86 3.787 -10.719 0.583 1.00 0.49 H new ATOM 0 HB3 GLU A 86 3.820 -12.470 0.505 1.00 0.49 H new ATOM 0 HG2 GLU A 86 3.288 -10.748 -1.939 1.00 0.55 H new ATOM 0 HG3 GLU A 86 4.909 -11.180 -1.430 1.00 0.55 H new ATOM 1392 N ILE A 87 0.489 -11.177 2.289 1.00 0.44 N ATOM 1393 CA ILE A 87 0.082 -11.388 3.696 1.00 0.47 C ATOM 1394 C ILE A 87 -0.942 -12.537 3.797 1.00 0.51 C ATOM 1395 O ILE A 87 -0.781 -13.430 4.636 1.00 0.61 O ATOM 1396 CB ILE A 87 -0.440 -10.054 4.372 1.00 0.51 C ATOM 1397 CG1 ILE A 87 -0.242 -10.068 5.917 1.00 0.59 C ATOM 1398 CG2 ILE A 87 -1.893 -9.696 4.008 1.00 0.55 C ATOM 1399 CD1 ILE A 87 -0.957 -11.176 6.682 1.00 0.66 C ATOM 0 H ILE A 87 -0.049 -10.463 1.799 1.00 0.44 H new ATOM 0 HA ILE A 87 0.966 -11.683 4.261 1.00 0.47 H new ATOM 0 HB ILE A 87 0.182 -9.264 3.952 1.00 0.51 H new ATOM 0 HG12 ILE A 87 0.825 -10.144 6.124 1.00 0.59 H new ATOM 0 HG13 ILE A 87 -0.576 -9.109 6.313 1.00 0.59 H new ATOM 0 HG21 ILE A 87 -2.176 -8.771 4.510 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -1.976 -9.564 2.929 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -2.557 -10.500 4.327 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -0.743 -11.080 7.746 1.00 0.66 H new ATOM 0 HD12 ILE A 87 -2.032 -11.095 6.520 1.00 0.66 H new ATOM 0 HD13 ILE A 87 -0.608 -12.146 6.328 1.00 0.66 H new ATOM 1411 N ARG A 88 -1.967 -12.530 2.920 1.00 0.54 N ATOM 1412 CA ARG A 88 -3.002 -13.570 2.927 1.00 0.68 C ATOM 1413 C ARG A 88 -2.768 -14.619 1.817 1.00 0.68 C ATOM 1414 O ARG A 88 -3.006 -15.810 2.051 1.00 0.87 O ATOM 1415 CB ARG A 88 -4.421 -12.936 2.870 1.00 0.83 C ATOM 1416 CG ARG A 88 -5.008 -12.647 1.478 1.00 0.91 C ATOM 1417 CD ARG A 88 -4.447 -11.370 0.853 1.00 1.05 C ATOM 1418 NE ARG A 88 -4.995 -11.109 -0.488 1.00 1.18 N ATOM 1419 CZ ARG A 88 -4.779 -9.982 -1.200 1.00 1.39 C ATOM 1420 NH1 ARG A 88 -4.031 -8.984 -0.711 1.00 1.74 N ATOM 1421 NH2 ARG A 88 -5.315 -9.860 -2.414 1.00 1.73 N ATOM 0 H ARG A 88 -2.095 -11.816 2.203 1.00 0.54 H new ATOM 0 HA ARG A 88 -2.933 -14.113 3.870 1.00 0.68 H new ATOM 0 HB2 ARG A 88 -5.108 -13.599 3.395 1.00 0.83 H new ATOM 0 HB3 ARG A 88 -4.395 -11.999 3.426 1.00 0.83 H new ATOM 0 HG2 ARG A 88 -4.801 -13.490 0.819 1.00 0.91 H new ATOM 0 HG3 ARG A 88 -6.092 -12.562 1.556 1.00 0.91 H new ATOM 0 HD2 ARG A 88 -4.669 -10.524 1.503 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -3.362 -11.447 0.789 1.00 1.05 H new ATOM 0 HE ARG A 88 -5.580 -11.831 -0.910 1.00 1.18 H new ATOM 0 HH11 ARG A 88 -3.612 -9.067 0.215 1.00 1.74 H new ATOM 0 HH12 ARG A 88 -3.880 -8.141 -1.265 1.00 1.74 H new ATOM 0 HH21 ARG A 88 -5.883 -10.615 -2.799 1.00 1.73 H new ATOM 0 HH22 ARG A 88 -5.157 -9.012 -2.958 1.00 1.73 H new ATOM 1435 N LYS A 89 -2.308 -14.184 0.618 1.00 0.58 N ATOM 1436 CA LYS A 89 -2.041 -15.112 -0.496 1.00 0.64 C ATOM 1437 C LYS A 89 -0.550 -15.124 -0.897 1.00 0.58 C ATOM 1438 O LYS A 89 -0.192 -14.789 -2.037 1.00 0.69 O ATOM 1439 CB LYS A 89 -2.965 -14.835 -1.714 1.00 0.76 C ATOM 1440 CG LYS A 89 -2.878 -13.433 -2.336 1.00 0.77 C ATOM 1441 CD LYS A 89 -3.570 -13.392 -3.702 1.00 1.00 C ATOM 1442 CE LYS A 89 -3.283 -12.104 -4.470 1.00 1.22 C ATOM 1443 NZ LYS A 89 -3.867 -12.120 -5.852 1.00 1.52 N ATOM 0 H LYS A 89 -2.117 -13.205 0.404 1.00 0.58 H new ATOM 0 HA LYS A 89 -2.279 -16.113 -0.136 1.00 0.64 H new ATOM 0 HB2 LYS A 89 -2.736 -15.567 -2.489 1.00 0.76 H new ATOM 0 HB3 LYS A 89 -3.996 -15.008 -1.406 1.00 0.76 H new ATOM 0 HG2 LYS A 89 -3.341 -12.706 -1.668 1.00 0.77 H new ATOM 0 HG3 LYS A 89 -1.833 -13.145 -2.446 1.00 0.77 H new ATOM 0 HD2 LYS A 89 -3.242 -14.245 -4.296 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -4.646 -13.495 -3.563 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -3.688 -11.257 -3.917 1.00 1.22 H new ATOM 0 HE3 LYS A 89 -2.205 -11.956 -4.536 1.00 1.22 H new ATOM 0 HZ1 LYS A 89 -3.645 -11.225 -6.333 1.00 1.52 H new ATOM 0 HZ2 LYS A 89 -3.462 -12.912 -6.391 1.00 1.52 H new ATOM 0 HZ3 LYS A 89 -4.899 -12.234 -5.792 1.00 1.52 H new ATOM 1457 N LYS A 90 0.328 -15.521 0.055 1.00 0.56 N ATOM 1458 CA LYS A 90 1.784 -15.636 -0.210 1.00 0.55 C ATOM 1459 C LYS A 90 2.032 -16.676 -1.331 1.00 0.55 C ATOM 1460 O LYS A 90 2.946 -16.521 -2.146 1.00 0.60 O ATOM 1461 CB LYS A 90 2.572 -15.997 1.084 1.00 0.61 C ATOM 1462 CG LYS A 90 2.170 -17.322 1.769 1.00 0.71 C ATOM 1463 CD LYS A 90 2.097 -17.216 3.301 1.00 0.97 C ATOM 1464 CE LYS A 90 3.473 -17.155 3.969 1.00 1.39 C ATOM 1465 NZ LYS A 90 3.381 -17.301 5.454 1.00 1.87 N ATOM 0 H LYS A 90 0.057 -15.766 1.007 1.00 0.56 H new ATOM 0 HA LYS A 90 2.154 -14.667 -0.545 1.00 0.55 H new ATOM 0 HB2 LYS A 90 3.633 -16.044 0.839 1.00 0.61 H new ATOM 0 HB3 LYS A 90 2.446 -15.186 1.802 1.00 0.61 H new ATOM 0 HG2 LYS A 90 1.200 -17.641 1.387 1.00 0.71 H new ATOM 0 HG3 LYS A 90 2.889 -18.095 1.499 1.00 0.71 H new ATOM 0 HD2 LYS A 90 1.530 -16.325 3.570 1.00 0.97 H new ATOM 0 HD3 LYS A 90 1.548 -18.073 3.692 1.00 0.97 H new ATOM 0 HE2 LYS A 90 4.107 -17.944 3.566 1.00 1.39 H new ATOM 0 HE3 LYS A 90 3.952 -16.206 3.727 1.00 1.39 H new ATOM 0 HZ1 LYS A 90 4.334 -17.254 5.867 1.00 1.87 H new ATOM 0 HZ2 LYS A 90 2.797 -16.533 5.843 1.00 1.87 H new ATOM 0 HZ3 LYS A 90 2.948 -18.217 5.687 1.00 1.87 H new ATOM 1479 N LYS A 91 1.188 -17.730 -1.342 1.00 0.57 N ATOM 1480 CA LYS A 91 1.214 -18.798 -2.349 1.00 0.64 C ATOM 1481 C LYS A 91 -0.157 -19.522 -2.321 1.00 0.69 C ATOM 1482 O LYS A 91 -0.262 -20.668 -1.872 1.00 0.71 O ATOM 1483 CB LYS A 91 2.394 -19.777 -2.086 1.00 0.72 C ATOM 1484 CG LYS A 91 2.937 -20.472 -3.343 1.00 0.85 C ATOM 1485 CD LYS A 91 4.150 -21.361 -3.028 1.00 0.97 C ATOM 1486 CE LYS A 91 4.898 -21.821 -4.287 1.00 1.29 C ATOM 1487 NZ LYS A 91 4.358 -23.098 -4.848 1.00 1.53 N ATOM 0 H LYS A 91 0.461 -17.859 -0.639 1.00 0.57 H new ATOM 0 HA LYS A 91 1.377 -18.379 -3.342 1.00 0.64 H new ATOM 0 HB2 LYS A 91 3.206 -19.227 -1.611 1.00 0.72 H new ATOM 0 HB3 LYS A 91 2.067 -20.538 -1.378 1.00 0.72 H new ATOM 0 HG2 LYS A 91 2.150 -21.078 -3.791 1.00 0.85 H new ATOM 0 HG3 LYS A 91 3.220 -19.720 -4.080 1.00 0.85 H new ATOM 0 HD2 LYS A 91 4.837 -20.813 -2.383 1.00 0.97 H new ATOM 0 HD3 LYS A 91 3.817 -22.236 -2.469 1.00 0.97 H new ATOM 0 HE2 LYS A 91 4.836 -21.041 -5.046 1.00 1.29 H new ATOM 0 HE3 LYS A 91 5.954 -21.952 -4.049 1.00 1.29 H new ATOM 0 HZ1 LYS A 91 4.900 -23.361 -5.696 1.00 1.53 H new ATOM 0 HZ2 LYS A 91 4.441 -23.852 -4.137 1.00 1.53 H new ATOM 0 HZ3 LYS A 91 3.358 -22.970 -5.102 1.00 1.53 H new ATOM 1501 N ASP A 92 -1.219 -18.808 -2.786 1.00 0.78 N ATOM 1502 CA ASP A 92 -2.616 -19.330 -2.794 1.00 0.87 C ATOM 1503 C ASP A 92 -2.769 -20.705 -3.486 1.00 1.03 C ATOM 1504 O ASP A 92 -3.642 -21.489 -3.104 1.00 1.81 O ATOM 1505 CB ASP A 92 -3.601 -18.312 -3.425 1.00 0.89 C ATOM 1506 CG ASP A 92 -3.291 -17.968 -4.874 1.00 0.98 C ATOM 1507 OD1 ASP A 92 -2.481 -17.047 -5.106 1.00 1.01 O ATOM 1508 OD2 ASP A 92 -3.859 -18.623 -5.774 1.00 1.18 O ATOM 0 H ASP A 92 -1.133 -17.864 -3.162 1.00 0.78 H new ATOM 0 HA ASP A 92 -2.867 -19.476 -1.743 1.00 0.87 H new ATOM 0 HB2 ASP A 92 -4.612 -18.716 -3.366 1.00 0.89 H new ATOM 0 HB3 ASP A 92 -3.589 -17.396 -2.834 1.00 0.89 H new ATOM 1513 N LEU A 93 -1.921 -20.990 -4.495 1.00 0.67 N ATOM 1514 CA LEU A 93 -1.976 -22.268 -5.240 1.00 0.70 C ATOM 1515 C LEU A 93 -1.606 -23.473 -4.344 1.00 0.70 C ATOM 1516 O LEU A 93 -2.218 -24.539 -4.460 1.00 0.79 O ATOM 1517 CB LEU A 93 -1.051 -22.217 -6.480 1.00 0.77 C ATOM 1518 CG LEU A 93 -1.260 -21.019 -7.444 1.00 0.97 C ATOM 1519 CD1 LEU A 93 -0.136 -20.953 -8.483 1.00 1.24 C ATOM 1520 CD2 LEU A 93 -2.629 -21.086 -8.128 1.00 1.15 C ATOM 0 H LEU A 93 -1.190 -20.354 -4.814 1.00 0.67 H new ATOM 0 HA LEU A 93 -3.005 -22.406 -5.572 1.00 0.70 H new ATOM 0 HB2 LEU A 93 -0.017 -22.203 -6.135 1.00 0.77 H new ATOM 0 HB3 LEU A 93 -1.186 -23.139 -7.046 1.00 0.77 H new ATOM 0 HG LEU A 93 -1.230 -20.106 -6.849 1.00 0.97 H new ATOM 0 HD11 LEU A 93 -0.304 -20.105 -9.147 1.00 1.24 H new ATOM 0 HD12 LEU A 93 0.821 -20.832 -7.976 1.00 1.24 H new ATOM 0 HD13 LEU A 93 -0.125 -21.874 -9.066 1.00 1.24 H new ATOM 0 HD21 LEU A 93 -2.744 -20.233 -8.796 1.00 1.15 H new ATOM 0 HD22 LEU A 93 -2.704 -22.009 -8.702 1.00 1.15 H new ATOM 0 HD23 LEU A 93 -3.415 -21.064 -7.373 1.00 1.15 H new ATOM 1532 N LYS A 94 -0.602 -23.292 -3.458 1.00 0.70 N ATOM 1533 CA LYS A 94 -0.154 -24.353 -2.533 1.00 0.77 C ATOM 1534 C LYS A 94 -0.947 -24.305 -1.205 1.00 0.71 C ATOM 1535 O LYS A 94 -1.461 -25.336 -0.761 1.00 0.77 O ATOM 1536 CB LYS A 94 1.367 -24.219 -2.267 1.00 0.92 C ATOM 1537 CG LYS A 94 2.016 -25.423 -1.567 1.00 1.09 C ATOM 1538 CD LYS A 94 2.139 -26.641 -2.489 1.00 1.23 C ATOM 1539 CE LYS A 94 2.884 -27.803 -1.827 1.00 1.57 C ATOM 1540 NZ LYS A 94 2.156 -28.364 -0.648 1.00 1.73 N ATOM 0 H LYS A 94 -0.086 -22.417 -3.365 1.00 0.70 H new ATOM 0 HA LYS A 94 -0.346 -25.319 -3.000 1.00 0.77 H new ATOM 0 HB2 LYS A 94 1.873 -24.056 -3.218 1.00 0.92 H new ATOM 0 HB3 LYS A 94 1.537 -23.330 -1.659 1.00 0.92 H new ATOM 0 HG2 LYS A 94 3.006 -25.141 -1.209 1.00 1.09 H new ATOM 0 HG3 LYS A 94 1.425 -25.692 -0.691 1.00 1.09 H new ATOM 0 HD2 LYS A 94 1.143 -26.972 -2.783 1.00 1.23 H new ATOM 0 HD3 LYS A 94 2.661 -26.351 -3.401 1.00 1.23 H new ATOM 0 HE2 LYS A 94 3.040 -28.593 -2.561 1.00 1.57 H new ATOM 0 HE3 LYS A 94 3.870 -27.463 -1.511 1.00 1.57 H new ATOM 0 HZ1 LYS A 94 2.706 -29.147 -0.240 1.00 1.73 H new ATOM 0 HZ2 LYS A 94 2.029 -27.620 0.068 1.00 1.73 H new ATOM 0 HZ3 LYS A 94 1.225 -28.716 -0.950 1.00 1.73 H new ATOM 1554 N ILE A 95 -1.041 -23.105 -0.581 1.00 0.68 N ATOM 1555 CA ILE A 95 -1.772 -22.911 0.696 1.00 0.67 C ATOM 1556 C ILE A 95 -2.838 -21.805 0.547 1.00 0.67 C ATOM 1557 O ILE A 95 -2.514 -20.686 0.142 1.00 0.77 O ATOM 1558 CB ILE A 95 -0.804 -22.578 1.893 1.00 0.75 C ATOM 1559 CG1 ILE A 95 0.122 -21.367 1.575 1.00 0.87 C ATOM 1560 CG2 ILE A 95 0.023 -23.819 2.259 1.00 0.85 C ATOM 1561 CD1 ILE A 95 0.945 -20.865 2.751 1.00 1.06 C ATOM 0 H ILE A 95 -0.617 -22.252 -0.945 1.00 0.68 H new ATOM 0 HA ILE A 95 -2.265 -23.855 0.929 1.00 0.67 H new ATOM 0 HB ILE A 95 -1.416 -22.293 2.749 1.00 0.75 H new ATOM 0 HG12 ILE A 95 0.800 -21.648 0.769 1.00 0.87 H new ATOM 0 HG13 ILE A 95 -0.492 -20.547 1.203 1.00 0.87 H new ATOM 0 HG21 ILE A 95 0.690 -23.580 3.088 1.00 0.85 H new ATOM 0 HG22 ILE A 95 -0.646 -24.628 2.553 1.00 0.85 H new ATOM 0 HG23 ILE A 95 0.613 -24.131 1.397 1.00 0.85 H new ATOM 0 HD11 ILE A 95 1.558 -20.021 2.433 1.00 1.06 H new ATOM 0 HD12 ILE A 95 0.278 -20.547 3.553 1.00 1.06 H new ATOM 0 HD13 ILE A 95 1.590 -21.666 3.112 1.00 1.06 H new ATOM 1573 N ARG A 96 -4.110 -22.125 0.879 1.00 0.71 N ATOM 1574 CA ARG A 96 -5.222 -21.152 0.751 1.00 0.77 C ATOM 1575 C ARG A 96 -6.053 -21.006 2.048 1.00 0.77 C ATOM 1576 O ARG A 96 -7.240 -20.661 1.987 1.00 0.93 O ATOM 1577 CB ARG A 96 -6.124 -21.534 -0.447 1.00 0.93 C ATOM 1578 CG ARG A 96 -6.845 -22.886 -0.323 1.00 1.05 C ATOM 1579 CD ARG A 96 -7.819 -23.135 -1.480 1.00 1.26 C ATOM 1580 NE ARG A 96 -8.958 -22.190 -1.470 1.00 1.40 N ATOM 1581 CZ ARG A 96 -9.752 -21.897 -2.527 1.00 1.83 C ATOM 1582 NH1 ARG A 96 -9.582 -22.483 -3.722 1.00 2.26 N ATOM 1583 NH2 ARG A 96 -10.736 -21.004 -2.375 1.00 2.18 N ATOM 0 H ARG A 96 -4.391 -23.039 1.234 1.00 0.71 H new ATOM 0 HA ARG A 96 -4.775 -20.175 0.569 1.00 0.77 H new ATOM 0 HB2 ARG A 96 -6.872 -20.753 -0.580 1.00 0.93 H new ATOM 0 HB3 ARG A 96 -5.514 -21.548 -1.350 1.00 0.93 H new ATOM 0 HG2 ARG A 96 -6.107 -23.687 -0.294 1.00 1.05 H new ATOM 0 HG3 ARG A 96 -7.389 -22.920 0.621 1.00 1.05 H new ATOM 0 HD2 ARG A 96 -7.285 -23.047 -2.426 1.00 1.26 H new ATOM 0 HD3 ARG A 96 -8.196 -24.156 -1.421 1.00 1.26 H new ATOM 0 HE ARG A 96 -9.163 -21.718 -0.589 1.00 1.40 H new ATOM 0 HH11 ARG A 96 -8.839 -23.169 -3.852 1.00 2.26 H new ATOM 0 HH12 ARG A 96 -10.196 -22.242 -4.500 1.00 2.26 H new ATOM 0 HH21 ARG A 96 -10.881 -20.553 -1.471 1.00 2.18 H new ATOM 0 HH22 ARG A 96 -11.342 -20.774 -3.163 1.00 2.18 H new ATOM 1597 N LYS A 97 -5.433 -21.256 3.221 1.00 0.72 N ATOM 1598 CA LYS A 97 -6.122 -21.118 4.517 1.00 0.75 C ATOM 1599 C LYS A 97 -5.115 -21.014 5.681 1.00 0.74 C ATOM 1600 O LYS A 97 -4.593 -22.027 6.160 1.00 0.95 O ATOM 1601 CB LYS A 97 -7.139 -22.265 4.760 1.00 0.87 C ATOM 1602 CG LYS A 97 -6.590 -23.684 4.570 1.00 0.94 C ATOM 1603 CD LYS A 97 -7.512 -24.734 5.194 1.00 1.10 C ATOM 1604 CE LYS A 97 -6.873 -26.121 5.229 1.00 1.36 C ATOM 1605 NZ LYS A 97 -5.725 -26.202 6.188 1.00 1.74 N ATOM 0 H LYS A 97 -4.460 -21.553 3.295 1.00 0.72 H new ATOM 0 HA LYS A 97 -6.688 -20.187 4.478 1.00 0.75 H new ATOM 0 HB2 LYS A 97 -7.525 -22.176 5.776 1.00 0.87 H new ATOM 0 HB3 LYS A 97 -7.984 -22.127 4.085 1.00 0.87 H new ATOM 0 HG2 LYS A 97 -6.472 -23.889 3.506 1.00 0.94 H new ATOM 0 HG3 LYS A 97 -5.600 -23.755 5.020 1.00 0.94 H new ATOM 0 HD2 LYS A 97 -7.771 -24.430 6.208 1.00 1.10 H new ATOM 0 HD3 LYS A 97 -8.442 -24.779 4.628 1.00 1.10 H new ATOM 0 HE2 LYS A 97 -7.627 -26.857 5.507 1.00 1.36 H new ATOM 0 HE3 LYS A 97 -6.526 -26.382 4.229 1.00 1.36 H new ATOM 0 HZ1 LYS A 97 -5.425 -27.193 6.288 1.00 1.74 H new ATOM 0 HZ2 LYS A 97 -4.931 -25.635 5.828 1.00 1.74 H new ATOM 0 HZ3 LYS A 97 -6.020 -25.834 7.115 1.00 1.74 H new ATOM 1619 N LYS A 98 -4.826 -19.769 6.110 1.00 0.69 N ATOM 1620 CA LYS A 98 -3.897 -19.513 7.225 1.00 0.72 C ATOM 1621 C LYS A 98 -4.359 -18.307 8.052 1.00 0.76 C ATOM 1622 O LYS A 98 -5.494 -18.263 8.527 1.00 0.98 O ATOM 1623 CB LYS A 98 -2.463 -19.291 6.696 1.00 0.88 C ATOM 1624 CG LYS A 98 -1.379 -19.421 7.769 1.00 1.04 C ATOM 1625 CD LYS A 98 0.033 -19.291 7.185 1.00 1.35 C ATOM 1626 CE LYS A 98 1.107 -19.880 8.107 1.00 1.61 C ATOM 1627 NZ LYS A 98 1.065 -21.375 8.156 1.00 1.71 N ATOM 0 H LYS A 98 -5.224 -18.925 5.699 1.00 0.69 H new ATOM 0 HA LYS A 98 -3.893 -20.389 7.873 1.00 0.72 H new ATOM 0 HB2 LYS A 98 -2.263 -20.011 5.903 1.00 0.88 H new ATOM 0 HB3 LYS A 98 -2.401 -18.299 6.249 1.00 0.88 H new ATOM 0 HG2 LYS A 98 -1.528 -18.654 8.529 1.00 1.04 H new ATOM 0 HG3 LYS A 98 -1.477 -20.386 8.267 1.00 1.04 H new ATOM 0 HD2 LYS A 98 0.071 -19.796 6.220 1.00 1.35 H new ATOM 0 HD3 LYS A 98 0.252 -18.239 7.003 1.00 1.35 H new ATOM 0 HE2 LYS A 98 2.091 -19.559 7.765 1.00 1.61 H new ATOM 0 HE3 LYS A 98 0.974 -19.483 9.113 1.00 1.61 H new ATOM 0 HZ1 LYS A 98 1.899 -21.729 8.667 1.00 1.71 H new ATOM 0 HZ2 LYS A 98 0.202 -21.682 8.648 1.00 1.71 H new ATOM 0 HZ3 LYS A 98 1.065 -21.754 7.188 1.00 1.71 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -5.678 -17.423 2.178 1.00 0.85 N ATOM 1643 CA MET B 1 -6.341 -16.183 1.763 1.00 0.86 C ATOM 1644 C MET B 1 -6.877 -15.384 2.979 1.00 0.76 C ATOM 1645 O MET B 1 -7.638 -14.424 2.802 1.00 0.93 O ATOM 1646 CB MET B 1 -7.478 -16.484 0.756 1.00 1.04 C ATOM 1647 CG MET B 1 -8.521 -17.486 1.257 1.00 1.09 C ATOM 1648 SD MET B 1 -9.873 -17.747 0.091 1.00 1.44 S ATOM 1649 CE MET B 1 -10.754 -19.092 0.884 1.00 1.75 C ATOM 0 H1 MET B 1 -5.621 -18.074 1.369 1.00 0.85 H new ATOM 0 H2 MET B 1 -4.719 -17.207 2.517 1.00 0.85 H new ATOM 0 H3 MET B 1 -6.223 -17.869 2.943 1.00 0.85 H new ATOM 0 HA MET B 1 -5.596 -15.560 1.268 1.00 0.86 H new ATOM 0 HB2 MET B 1 -7.981 -15.550 0.505 1.00 1.04 H new ATOM 0 HB3 MET B 1 -7.038 -16.866 -0.165 1.00 1.04 H new ATOM 0 HG2 MET B 1 -8.033 -18.440 1.457 1.00 1.09 H new ATOM 0 HG3 MET B 1 -8.929 -17.133 2.204 1.00 1.09 H new ATOM 0 HE1 MET B 1 -11.619 -19.366 0.280 1.00 1.75 H new ATOM 0 HE2 MET B 1 -10.092 -19.953 0.982 1.00 1.75 H new ATOM 0 HE3 MET B 1 -11.087 -18.776 1.872 1.00 1.75 H new ATOM 1659 N ALA B 2 -6.452 -15.763 4.209 1.00 0.73 N ATOM 1660 CA ALA B 2 -6.880 -15.091 5.446 1.00 0.67 C ATOM 1661 C ALA B 2 -5.688 -14.416 6.137 1.00 0.60 C ATOM 1662 O ALA B 2 -4.712 -15.086 6.493 1.00 0.68 O ATOM 1663 CB ALA B 2 -7.545 -16.094 6.381 1.00 0.78 C ATOM 0 H ALA B 2 -5.808 -16.538 4.364 1.00 0.73 H new ATOM 0 HA ALA B 2 -7.604 -14.317 5.190 1.00 0.67 H new ATOM 0 HB1 ALA B 2 -7.859 -15.588 7.294 1.00 0.78 H new ATOM 0 HB2 ALA B 2 -8.416 -16.528 5.889 1.00 0.78 H new ATOM 0 HB3 ALA B 2 -6.837 -16.885 6.629 1.00 0.78 H new ATOM 1669 N ALA B 3 -5.779 -13.088 6.339 1.00 0.57 N ATOM 1670 CA ALA B 3 -4.701 -12.311 6.977 1.00 0.57 C ATOM 1671 C ALA B 3 -4.571 -12.626 8.484 1.00 0.58 C ATOM 1672 O ALA B 3 -5.483 -12.338 9.265 1.00 0.69 O ATOM 1673 CB ALA B 3 -4.917 -10.814 6.745 1.00 0.64 C ATOM 0 H ALA B 3 -6.589 -12.531 6.069 1.00 0.57 H new ATOM 0 HA ALA B 3 -3.761 -12.606 6.511 1.00 0.57 H new ATOM 0 HB1 ALA B 3 -4.114 -10.252 7.222 1.00 0.64 H new ATOM 0 HB2 ALA B 3 -4.918 -10.608 5.675 1.00 0.64 H new ATOM 0 HB3 ALA B 3 -5.873 -10.514 7.173 1.00 0.64 H new ATOM 1679 N GLU B 4 -3.426 -13.225 8.878 1.00 0.56 N ATOM 1680 CA GLU B 4 -3.156 -13.593 10.281 1.00 0.59 C ATOM 1681 C GLU B 4 -2.115 -12.631 10.899 1.00 0.56 C ATOM 1682 O GLU B 4 -1.145 -12.284 10.222 1.00 0.54 O ATOM 1683 CB GLU B 4 -2.651 -15.051 10.336 1.00 0.66 C ATOM 1684 CG GLU B 4 -2.292 -15.569 11.734 1.00 0.79 C ATOM 1685 CD GLU B 4 -2.000 -17.062 11.749 1.00 0.91 C ATOM 1686 OE1 GLU B 4 -1.002 -17.479 11.123 1.00 1.10 O ATOM 1687 OE2 GLU B 4 -2.771 -17.811 12.385 1.00 1.00 O ATOM 0 H GLU B 4 -2.670 -13.465 8.237 1.00 0.56 H new ATOM 0 HA GLU B 4 -4.075 -13.511 10.861 1.00 0.59 H new ATOM 0 HB2 GLU B 4 -3.418 -15.700 9.912 1.00 0.66 H new ATOM 0 HB3 GLU B 4 -1.772 -15.138 9.698 1.00 0.66 H new ATOM 0 HG2 GLU B 4 -1.421 -15.029 12.105 1.00 0.79 H new ATOM 0 HG3 GLU B 4 -3.114 -15.357 12.418 1.00 0.79 H new ATOM 1694 N PRO B 5 -2.296 -12.179 12.189 1.00 0.62 N ATOM 1695 CA PRO B 5 -1.335 -11.268 12.870 1.00 0.65 C ATOM 1696 C PRO B 5 0.107 -11.825 12.913 1.00 0.59 C ATOM 1697 O PRO B 5 0.309 -12.999 13.237 1.00 0.68 O ATOM 1698 CB PRO B 5 -1.908 -11.146 14.295 1.00 0.83 C ATOM 1699 CG PRO B 5 -3.355 -11.447 14.154 1.00 0.80 C ATOM 1700 CD PRO B 5 -3.452 -12.486 13.074 1.00 0.73 C ATOM 0 HA PRO B 5 -1.245 -10.318 12.343 1.00 0.65 H new ATOM 0 HB2 PRO B 5 -1.424 -11.846 14.976 1.00 0.83 H new ATOM 0 HB3 PRO B 5 -1.750 -10.146 14.700 1.00 0.83 H new ATOM 0 HG2 PRO B 5 -3.771 -11.817 15.091 1.00 0.80 H new ATOM 0 HG3 PRO B 5 -3.917 -10.552 13.887 1.00 0.80 H new ATOM 0 HD2 PRO B 5 -3.388 -13.495 13.481 1.00 0.73 H new ATOM 0 HD3 PRO B 5 -4.398 -12.418 12.536 1.00 0.73 H new ATOM 1708 N LEU B 6 1.099 -10.968 12.573 1.00 0.61 N ATOM 1709 CA LEU B 6 2.533 -11.356 12.567 1.00 0.70 C ATOM 1710 C LEU B 6 3.387 -10.282 13.311 1.00 0.73 C ATOM 1711 O LEU B 6 2.898 -9.694 14.282 1.00 1.24 O ATOM 1712 CB LEU B 6 3.006 -11.572 11.104 1.00 0.87 C ATOM 1713 CG LEU B 6 2.191 -12.584 10.263 1.00 0.95 C ATOM 1714 CD1 LEU B 6 2.517 -12.456 8.774 1.00 1.18 C ATOM 1715 CD2 LEU B 6 2.429 -14.021 10.747 1.00 1.08 C ATOM 0 H LEU B 6 0.933 -10.000 12.298 1.00 0.61 H new ATOM 0 HA LEU B 6 2.665 -12.296 13.103 1.00 0.70 H new ATOM 0 HB2 LEU B 6 2.988 -10.609 10.593 1.00 0.87 H new ATOM 0 HB3 LEU B 6 4.044 -11.902 11.125 1.00 0.87 H new ATOM 0 HG LEU B 6 1.135 -12.350 10.398 1.00 0.95 H new ATOM 0 HD11 LEU B 6 1.929 -13.180 8.209 1.00 1.18 H new ATOM 0 HD12 LEU B 6 2.276 -11.449 8.434 1.00 1.18 H new ATOM 0 HD13 LEU B 6 3.578 -12.648 8.616 1.00 1.18 H new ATOM 0 HD21 LEU B 6 1.844 -14.711 10.139 1.00 1.08 H new ATOM 0 HD22 LEU B 6 3.488 -14.265 10.657 1.00 1.08 H new ATOM 0 HD23 LEU B 6 2.124 -14.109 11.790 1.00 1.08 H new ATOM 1727 N THR B 7 4.663 -10.038 12.884 1.00 0.52 N ATOM 1728 CA THR B 7 5.554 -9.026 13.519 1.00 0.50 C ATOM 1729 C THR B 7 4.944 -7.604 13.430 1.00 0.48 C ATOM 1730 O THR B 7 4.083 -7.367 12.590 1.00 0.53 O ATOM 1731 CB THR B 7 6.970 -9.033 12.850 1.00 0.53 C ATOM 1732 OG1 THR B 7 7.353 -10.382 12.538 1.00 0.92 O ATOM 1733 CG2 THR B 7 8.042 -8.422 13.750 1.00 1.06 C ATOM 0 H THR B 7 5.094 -10.531 12.102 1.00 0.52 H new ATOM 0 HA THR B 7 5.655 -9.296 14.570 1.00 0.50 H new ATOM 0 HB THR B 7 6.897 -8.428 11.946 1.00 0.53 H new ATOM 0 HG1 THR B 7 7.392 -10.494 11.565 1.00 0.92 H new ATOM 0 HG21 THR B 7 9.005 -8.451 13.240 1.00 1.06 H new ATOM 0 HG22 THR B 7 7.782 -7.388 13.975 1.00 1.06 H new ATOM 0 HG23 THR B 7 8.106 -8.991 14.678 1.00 1.06 H new ATOM 1741 N GLU B 8 5.409 -6.664 14.291 1.00 0.49 N ATOM 1742 CA GLU B 8 4.895 -5.263 14.323 1.00 0.49 C ATOM 1743 C GLU B 8 4.770 -4.608 12.919 1.00 0.44 C ATOM 1744 O GLU B 8 3.787 -3.907 12.664 1.00 0.47 O ATOM 1745 CB GLU B 8 5.771 -4.383 15.249 1.00 0.54 C ATOM 1746 CG GLU B 8 5.101 -3.079 15.687 1.00 0.95 C ATOM 1747 CD GLU B 8 5.981 -2.225 16.589 1.00 1.01 C ATOM 1748 OE1 GLU B 8 6.903 -1.564 16.066 1.00 1.29 O ATOM 1749 OE2 GLU B 8 5.743 -2.213 17.816 1.00 1.51 O ATOM 0 H GLU B 8 6.142 -6.848 14.976 1.00 0.49 H new ATOM 0 HA GLU B 8 3.883 -5.325 14.722 1.00 0.49 H new ATOM 0 HB2 GLU B 8 6.036 -4.959 16.136 1.00 0.54 H new ATOM 0 HB3 GLU B 8 6.702 -4.146 14.733 1.00 0.54 H new ATOM 0 HG2 GLU B 8 4.831 -2.502 14.802 1.00 0.95 H new ATOM 0 HG3 GLU B 8 4.174 -3.313 16.211 1.00 0.95 H new ATOM 1756 N LEU B 9 5.757 -4.835 12.022 1.00 0.42 N ATOM 1757 CA LEU B 9 5.737 -4.261 10.652 1.00 0.39 C ATOM 1758 C LEU B 9 4.772 -5.034 9.731 1.00 0.38 C ATOM 1759 O LEU B 9 3.993 -4.425 8.992 1.00 0.39 O ATOM 1760 CB LEU B 9 7.151 -4.254 10.028 1.00 0.41 C ATOM 1761 CG LEU B 9 8.221 -3.403 10.751 1.00 0.50 C ATOM 1762 CD1 LEU B 9 9.580 -3.553 10.061 1.00 0.63 C ATOM 1763 CD2 LEU B 9 7.812 -1.924 10.826 1.00 0.65 C ATOM 0 H LEU B 9 6.576 -5.410 12.219 1.00 0.42 H new ATOM 0 HA LEU B 9 5.385 -3.233 10.744 1.00 0.39 H new ATOM 0 HB2 LEU B 9 7.508 -5.283 9.981 1.00 0.41 H new ATOM 0 HB3 LEU B 9 7.069 -3.898 9.001 1.00 0.41 H new ATOM 0 HG LEU B 9 8.304 -3.773 11.773 1.00 0.50 H new ATOM 0 HD11 LEU B 9 10.322 -2.948 10.582 1.00 0.63 H new ATOM 0 HD12 LEU B 9 9.885 -4.599 10.082 1.00 0.63 H new ATOM 0 HD13 LEU B 9 9.502 -3.219 9.026 1.00 0.63 H new ATOM 0 HD21 LEU B 9 8.588 -1.358 11.341 1.00 0.65 H new ATOM 0 HD22 LEU B 9 7.684 -1.530 9.818 1.00 0.65 H new ATOM 0 HD23 LEU B 9 6.874 -1.833 11.373 1.00 0.65 H new ATOM 1775 N GLU B 10 4.843 -6.379 9.779 1.00 0.39 N ATOM 1776 CA GLU B 10 3.972 -7.257 8.965 1.00 0.41 C ATOM 1777 C GLU B 10 2.496 -7.141 9.408 1.00 0.42 C ATOM 1778 O GLU B 10 1.585 -7.282 8.590 1.00 0.47 O ATOM 1779 CB GLU B 10 4.444 -8.723 9.062 1.00 0.46 C ATOM 1780 CG GLU B 10 5.874 -8.959 8.570 1.00 0.50 C ATOM 1781 CD GLU B 10 6.374 -10.369 8.854 1.00 0.56 C ATOM 1782 OE1 GLU B 10 5.776 -11.330 8.330 1.00 0.95 O ATOM 1783 OE2 GLU B 10 7.365 -10.509 9.601 1.00 0.95 O ATOM 0 H GLU B 10 5.497 -6.885 10.376 1.00 0.39 H new ATOM 0 HA GLU B 10 4.042 -6.932 7.927 1.00 0.41 H new ATOM 0 HB2 GLU B 10 4.371 -9.048 10.100 1.00 0.46 H new ATOM 0 HB3 GLU B 10 3.765 -9.350 8.484 1.00 0.46 H new ATOM 0 HG2 GLU B 10 5.919 -8.772 7.497 1.00 0.50 H new ATOM 0 HG3 GLU B 10 6.540 -8.240 9.047 1.00 0.50 H new ATOM 1790 N GLU B 11 2.280 -6.882 10.721 1.00 0.42 N ATOM 1791 CA GLU B 11 0.935 -6.721 11.306 1.00 0.45 C ATOM 1792 C GLU B 11 0.303 -5.369 10.903 1.00 0.43 C ATOM 1793 O GLU B 11 -0.923 -5.243 10.896 1.00 0.45 O ATOM 1794 CB GLU B 11 1.006 -6.838 12.846 1.00 0.51 C ATOM 1795 CG GLU B 11 -0.342 -7.084 13.531 1.00 0.62 C ATOM 1796 CD GLU B 11 -0.239 -7.125 15.048 1.00 0.70 C ATOM 1797 OE1 GLU B 11 -0.003 -8.221 15.598 1.00 0.82 O ATOM 1798 OE2 GLU B 11 -0.397 -6.059 15.683 1.00 0.85 O ATOM 0 H GLU B 11 3.035 -6.780 11.399 1.00 0.42 H new ATOM 0 HA GLU B 11 0.302 -7.517 10.915 1.00 0.45 H new ATOM 0 HB2 GLU B 11 1.684 -7.652 13.104 1.00 0.51 H new ATOM 0 HB3 GLU B 11 1.440 -5.922 13.247 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -1.040 -6.298 13.241 1.00 0.62 H new ATOM 0 HG3 GLU B 11 -0.758 -8.027 13.175 1.00 0.62 H new ATOM 1805 N SER B 12 1.151 -4.358 10.580 1.00 0.43 N ATOM 1806 CA SER B 12 0.678 -3.019 10.162 1.00 0.44 C ATOM 1807 C SER B 12 -0.183 -3.110 8.888 1.00 0.42 C ATOM 1808 O SER B 12 -1.330 -2.651 8.882 1.00 0.47 O ATOM 1809 CB SER B 12 1.863 -2.067 9.927 1.00 0.48 C ATOM 1810 OG SER B 12 2.721 -2.015 11.057 1.00 0.56 O ATOM 0 H SER B 12 2.167 -4.449 10.602 1.00 0.43 H new ATOM 0 HA SER B 12 0.064 -2.620 10.969 1.00 0.44 H new ATOM 0 HB2 SER B 12 2.428 -2.396 9.055 1.00 0.48 H new ATOM 0 HB3 SER B 12 1.489 -1.067 9.706 1.00 0.48 H new ATOM 0 HG SER B 12 3.020 -2.921 11.283 1.00 0.56 H new ATOM 1816 N ILE B 13 0.380 -3.707 7.815 1.00 0.40 N ATOM 1817 CA ILE B 13 -0.355 -3.889 6.543 1.00 0.41 C ATOM 1818 C ILE B 13 -1.466 -4.964 6.683 1.00 0.41 C ATOM 1819 O ILE B 13 -2.457 -4.928 5.950 1.00 0.48 O ATOM 1820 CB ILE B 13 0.589 -4.216 5.325 1.00 0.46 C ATOM 1821 CG1 ILE B 13 1.482 -5.474 5.556 1.00 0.45 C ATOM 1822 CG2 ILE B 13 1.462 -3.001 4.992 1.00 0.53 C ATOM 1823 CD1 ILE B 13 0.792 -6.805 5.299 1.00 0.45 C ATOM 0 H ILE B 13 1.334 -4.069 7.803 1.00 0.40 H new ATOM 0 HA ILE B 13 -0.824 -2.930 6.325 1.00 0.41 H new ATOM 0 HB ILE B 13 -0.061 -4.448 4.482 1.00 0.46 H new ATOM 0 HG12 ILE B 13 2.357 -5.404 4.910 1.00 0.45 H new ATOM 0 HG13 ILE B 13 1.843 -5.461 6.584 1.00 0.45 H new ATOM 0 HG21 ILE B 13 2.110 -3.239 4.149 1.00 0.53 H new ATOM 0 HG22 ILE B 13 0.825 -2.155 4.733 1.00 0.53 H new ATOM 0 HG23 ILE B 13 2.072 -2.743 5.857 1.00 0.53 H new ATOM 0 HD11 ILE B 13 1.492 -7.620 5.486 1.00 0.45 H new ATOM 0 HD12 ILE B 13 -0.066 -6.904 5.964 1.00 0.45 H new ATOM 0 HD13 ILE B 13 0.455 -6.846 4.263 1.00 0.45 H new ATOM 1835 N GLU B 14 -1.289 -5.906 7.644 1.00 0.40 N ATOM 1836 CA GLU B 14 -2.270 -6.980 7.929 1.00 0.43 C ATOM 1837 C GLU B 14 -3.577 -6.407 8.521 1.00 0.45 C ATOM 1838 O GLU B 14 -4.661 -6.929 8.245 1.00 0.48 O ATOM 1839 CB GLU B 14 -1.639 -8.011 8.897 1.00 0.46 C ATOM 1840 CG GLU B 14 -2.555 -9.159 9.360 1.00 0.57 C ATOM 1841 CD GLU B 14 -3.243 -8.905 10.701 1.00 0.64 C ATOM 1842 OE1 GLU B 14 -2.629 -8.272 11.586 1.00 0.92 O ATOM 1843 OE2 GLU B 14 -4.395 -9.351 10.867 1.00 1.00 O ATOM 0 H GLU B 14 -0.463 -5.941 8.241 1.00 0.40 H new ATOM 0 HA GLU B 14 -2.527 -7.474 6.992 1.00 0.43 H new ATOM 0 HB2 GLU B 14 -0.764 -8.445 8.413 1.00 0.46 H new ATOM 0 HB3 GLU B 14 -1.284 -7.479 9.780 1.00 0.46 H new ATOM 0 HG2 GLU B 14 -3.317 -9.331 8.600 1.00 0.57 H new ATOM 0 HG3 GLU B 14 -1.966 -10.073 9.433 1.00 0.57 H new ATOM 1850 N THR B 15 -3.460 -5.336 9.337 1.00 0.45 N ATOM 1851 CA THR B 15 -4.625 -4.681 9.969 1.00 0.49 C ATOM 1852 C THR B 15 -5.592 -4.087 8.911 1.00 0.47 C ATOM 1853 O THR B 15 -6.808 -4.082 9.121 1.00 0.50 O ATOM 1854 CB THR B 15 -4.168 -3.571 10.964 1.00 0.54 C ATOM 1855 OG1 THR B 15 -3.279 -4.131 11.939 1.00 0.75 O ATOM 1856 CG2 THR B 15 -5.346 -2.924 11.691 1.00 0.88 C ATOM 0 H THR B 15 -2.566 -4.906 9.574 1.00 0.45 H new ATOM 0 HA THR B 15 -5.164 -5.449 10.524 1.00 0.49 H new ATOM 0 HB THR B 15 -3.665 -2.802 10.378 1.00 0.54 H new ATOM 0 HG1 THR B 15 -2.467 -4.453 11.495 1.00 0.75 H new ATOM 0 HG21 THR B 15 -4.977 -2.158 12.372 1.00 0.88 H new ATOM 0 HG22 THR B 15 -6.017 -2.469 10.963 1.00 0.88 H new ATOM 0 HG23 THR B 15 -5.886 -3.683 12.257 1.00 0.88 H new ATOM 1864 N VAL B 16 -5.040 -3.596 7.782 1.00 0.45 N ATOM 1865 CA VAL B 16 -5.849 -3.016 6.683 1.00 0.47 C ATOM 1866 C VAL B 16 -6.660 -4.110 5.935 1.00 0.47 C ATOM 1867 O VAL B 16 -7.720 -3.815 5.376 1.00 0.52 O ATOM 1868 CB VAL B 16 -4.951 -2.212 5.672 1.00 0.49 C ATOM 1869 CG1 VAL B 16 -5.782 -1.562 4.552 1.00 0.56 C ATOM 1870 CG2 VAL B 16 -4.098 -1.153 6.408 1.00 0.53 C ATOM 0 H VAL B 16 -4.036 -3.589 7.605 1.00 0.45 H new ATOM 0 HA VAL B 16 -6.555 -2.322 7.138 1.00 0.47 H new ATOM 0 HB VAL B 16 -4.278 -2.929 5.202 1.00 0.49 H new ATOM 0 HG11 VAL B 16 -5.121 -1.018 3.878 1.00 0.56 H new ATOM 0 HG12 VAL B 16 -6.311 -2.336 3.995 1.00 0.56 H new ATOM 0 HG13 VAL B 16 -6.504 -0.872 4.988 1.00 0.56 H new ATOM 0 HG21 VAL B 16 -3.487 -0.612 5.686 1.00 0.53 H new ATOM 0 HG22 VAL B 16 -4.754 -0.453 6.925 1.00 0.53 H new ATOM 0 HG23 VAL B 16 -3.451 -1.647 7.133 1.00 0.53 H new ATOM 1880 N VAL B 17 -6.164 -5.371 5.953 1.00 0.46 N ATOM 1881 CA VAL B 17 -6.842 -6.509 5.287 1.00 0.50 C ATOM 1882 C VAL B 17 -7.761 -7.288 6.274 1.00 0.57 C ATOM 1883 O VAL B 17 -8.229 -8.384 5.949 1.00 0.97 O ATOM 1884 CB VAL B 17 -5.809 -7.500 4.625 1.00 0.53 C ATOM 1885 CG1 VAL B 17 -6.445 -8.271 3.462 1.00 0.63 C ATOM 1886 CG2 VAL B 17 -4.536 -6.777 4.155 1.00 0.55 C ATOM 0 H VAL B 17 -5.295 -5.626 6.423 1.00 0.46 H new ATOM 0 HA VAL B 17 -7.462 -6.080 4.500 1.00 0.50 H new ATOM 0 HB VAL B 17 -5.519 -8.213 5.397 1.00 0.53 H new ATOM 0 HG11 VAL B 17 -5.708 -8.946 3.026 1.00 0.63 H new ATOM 0 HG12 VAL B 17 -7.293 -8.849 3.829 1.00 0.63 H new ATOM 0 HG13 VAL B 17 -6.786 -7.568 2.703 1.00 0.63 H new ATOM 0 HG21 VAL B 17 -3.853 -7.498 3.706 1.00 0.55 H new ATOM 0 HG22 VAL B 17 -4.799 -6.018 3.418 1.00 0.55 H new ATOM 0 HG23 VAL B 17 -4.052 -6.301 5.008 1.00 0.55 H new ATOM 1896 N THR B 18 -8.020 -6.715 7.475 1.00 0.50 N ATOM 1897 CA THR B 18 -8.882 -7.340 8.500 1.00 0.52 C ATOM 1898 C THR B 18 -10.009 -6.390 8.952 1.00 0.54 C ATOM 1899 O THR B 18 -11.164 -6.814 9.055 1.00 0.67 O ATOM 1900 CB THR B 18 -8.066 -7.779 9.750 1.00 0.56 C ATOM 1901 OG1 THR B 18 -7.237 -6.704 10.208 1.00 0.58 O ATOM 1902 CG2 THR B 18 -7.199 -8.996 9.455 1.00 0.62 C ATOM 0 H THR B 18 -7.638 -5.812 7.756 1.00 0.50 H new ATOM 0 HA THR B 18 -9.320 -8.221 8.031 1.00 0.52 H new ATOM 0 HB THR B 18 -8.782 -8.047 10.527 1.00 0.56 H new ATOM 0 HG1 THR B 18 -7.311 -5.948 9.589 1.00 0.58 H new ATOM 0 HG21 THR B 18 -6.644 -9.273 10.351 1.00 0.62 H new ATOM 0 HG22 THR B 18 -7.832 -9.828 9.148 1.00 0.62 H new ATOM 0 HG23 THR B 18 -6.499 -8.759 8.654 1.00 0.62 H new ATOM 1910 N THR B 19 -9.667 -5.106 9.219 1.00 0.53 N ATOM 1911 CA THR B 19 -10.651 -4.094 9.672 1.00 0.57 C ATOM 1912 C THR B 19 -11.703 -3.787 8.587 1.00 0.57 C ATOM 1913 O THR B 19 -12.893 -3.682 8.903 1.00 0.66 O ATOM 1914 CB THR B 19 -9.960 -2.764 10.104 1.00 0.60 C ATOM 1915 OG1 THR B 19 -8.789 -3.051 10.884 1.00 0.61 O ATOM 1916 CG2 THR B 19 -10.896 -1.870 10.926 1.00 0.69 C ATOM 0 H THR B 19 -8.717 -4.747 9.128 1.00 0.53 H new ATOM 0 HA THR B 19 -11.152 -4.530 10.536 1.00 0.57 H new ATOM 0 HB THR B 19 -9.690 -2.231 9.193 1.00 0.60 H new ATOM 0 HG1 THR B 19 -8.058 -3.319 10.289 1.00 0.61 H new ATOM 0 HG21 THR B 19 -10.373 -0.955 11.205 1.00 0.69 H new ATOM 0 HG22 THR B 19 -11.774 -1.619 10.331 1.00 0.69 H new ATOM 0 HG23 THR B 19 -11.207 -2.399 11.827 1.00 0.69 H new ATOM 1924 N PHE B 20 -11.257 -3.633 7.320 1.00 0.56 N ATOM 1925 CA PHE B 20 -12.163 -3.338 6.194 1.00 0.60 C ATOM 1926 C PHE B 20 -12.222 -4.522 5.199 1.00 0.60 C ATOM 1927 O PHE B 20 -12.236 -4.324 3.976 1.00 0.94 O ATOM 1928 CB PHE B 20 -11.727 -2.030 5.491 1.00 0.68 C ATOM 1929 CG PHE B 20 -12.842 -1.350 4.714 1.00 0.75 C ATOM 1930 CD1 PHE B 20 -13.836 -0.641 5.378 1.00 0.91 C ATOM 1931 CD2 PHE B 20 -12.894 -1.422 3.327 1.00 0.80 C ATOM 1932 CE1 PHE B 20 -14.854 -0.021 4.675 1.00 1.02 C ATOM 1933 CE2 PHE B 20 -13.910 -0.803 2.623 1.00 0.90 C ATOM 1934 CZ PHE B 20 -14.890 -0.102 3.297 1.00 0.97 C ATOM 0 H PHE B 20 -10.275 -3.709 7.055 1.00 0.56 H new ATOM 0 HA PHE B 20 -13.170 -3.197 6.586 1.00 0.60 H new ATOM 0 HB2 PHE B 20 -11.343 -1.337 6.240 1.00 0.68 H new ATOM 0 HB3 PHE B 20 -10.905 -2.251 4.810 1.00 0.68 H new ATOM 0 HD1 PHE B 20 -13.814 -0.573 6.456 1.00 0.91 H new ATOM 0 HD2 PHE B 20 -12.131 -1.968 2.792 1.00 0.80 H new ATOM 0 HE1 PHE B 20 -15.620 0.526 5.204 1.00 1.02 H new ATOM 0 HE2 PHE B 20 -13.937 -0.868 1.545 1.00 0.90 H new ATOM 0 HZ PHE B 20 -15.684 0.382 2.747 1.00 0.97 H new ATOM 1944 N PHE B 21 -12.270 -5.756 5.740 1.00 0.71 N ATOM 1945 CA PHE B 21 -12.352 -6.982 4.923 1.00 0.72 C ATOM 1946 C PHE B 21 -13.811 -7.471 4.801 1.00 0.68 C ATOM 1947 O PHE B 21 -14.183 -8.057 3.781 1.00 0.71 O ATOM 1948 CB PHE B 21 -11.467 -8.092 5.524 1.00 1.01 C ATOM 1949 CG PHE B 21 -11.269 -9.282 4.603 1.00 1.63 C ATOM 1950 CD1 PHE B 21 -10.389 -9.210 3.528 1.00 1.93 C ATOM 1951 CD2 PHE B 21 -11.977 -10.463 4.803 1.00 2.26 C ATOM 1952 CE1 PHE B 21 -10.220 -10.288 2.682 1.00 2.67 C ATOM 1953 CE2 PHE B 21 -11.809 -11.542 3.954 1.00 2.92 C ATOM 1954 CZ PHE B 21 -10.930 -11.455 2.894 1.00 3.08 C ATOM 0 H PHE B 21 -12.253 -5.929 6.745 1.00 0.71 H new ATOM 0 HA PHE B 21 -11.987 -6.744 3.924 1.00 0.72 H new ATOM 0 HB2 PHE B 21 -10.493 -7.672 5.774 1.00 1.01 H new ATOM 0 HB3 PHE B 21 -11.915 -8.436 6.456 1.00 1.01 H new ATOM 0 HD1 PHE B 21 -9.832 -8.301 3.353 1.00 1.93 H new ATOM 0 HD2 PHE B 21 -12.666 -10.538 5.631 1.00 2.26 H new ATOM 0 HE1 PHE B 21 -9.532 -10.219 1.853 1.00 2.67 H new ATOM 0 HE2 PHE B 21 -12.366 -12.452 4.121 1.00 2.92 H new ATOM 0 HZ PHE B 21 -10.797 -12.297 2.231 1.00 3.08 H new ATOM 1964 N THR B 22 -14.621 -7.241 5.860 1.00 0.76 N ATOM 1965 CA THR B 22 -16.044 -7.637 5.885 1.00 0.91 C ATOM 1966 C THR B 22 -16.882 -6.839 4.854 1.00 0.84 C ATOM 1967 O THR B 22 -17.794 -7.397 4.237 1.00 1.01 O ATOM 1968 CB THR B 22 -16.645 -7.449 7.316 1.00 1.10 C ATOM 1969 OG1 THR B 22 -15.817 -8.108 8.295 1.00 1.23 O ATOM 1970 CG2 THR B 22 -18.076 -7.983 7.423 1.00 1.37 C ATOM 0 H THR B 22 -14.308 -6.779 6.714 1.00 0.76 H new ATOM 0 HA THR B 22 -16.089 -8.692 5.613 1.00 0.91 H new ATOM 0 HB THR B 22 -16.673 -6.377 7.509 1.00 1.10 H new ATOM 0 HG1 THR B 22 -16.202 -7.982 9.187 1.00 1.23 H new ATOM 0 HG21 THR B 22 -18.447 -7.828 8.436 1.00 1.37 H new ATOM 0 HG22 THR B 22 -18.716 -7.453 6.717 1.00 1.37 H new ATOM 0 HG23 THR B 22 -18.085 -9.048 7.192 1.00 1.37 H new ATOM 1978 N PHE B 23 -16.564 -5.539 4.674 1.00 0.69 N ATOM 1979 CA PHE B 23 -17.284 -4.668 3.717 1.00 0.75 C ATOM 1980 C PHE B 23 -16.760 -4.837 2.280 1.00 0.70 C ATOM 1981 O PHE B 23 -17.517 -4.644 1.323 1.00 0.83 O ATOM 1982 CB PHE B 23 -17.187 -3.191 4.153 1.00 0.84 C ATOM 1983 CG PHE B 23 -18.046 -2.868 5.356 1.00 1.00 C ATOM 1984 CD1 PHE B 23 -19.405 -2.614 5.212 1.00 1.32 C ATOM 1985 CD2 PHE B 23 -17.498 -2.837 6.633 1.00 1.03 C ATOM 1986 CE1 PHE B 23 -20.193 -2.336 6.311 1.00 1.54 C ATOM 1987 CE2 PHE B 23 -18.284 -2.557 7.733 1.00 1.27 C ATOM 1988 CZ PHE B 23 -19.633 -2.307 7.573 1.00 1.48 C ATOM 0 H PHE B 23 -15.813 -5.068 5.179 1.00 0.69 H new ATOM 0 HA PHE B 23 -18.330 -4.973 3.723 1.00 0.75 H new ATOM 0 HB2 PHE B 23 -16.148 -2.954 4.382 1.00 0.84 H new ATOM 0 HB3 PHE B 23 -17.484 -2.553 3.321 1.00 0.84 H new ATOM 0 HD1 PHE B 23 -19.850 -2.634 4.228 1.00 1.32 H new ATOM 0 HD2 PHE B 23 -16.445 -3.034 6.766 1.00 1.03 H new ATOM 0 HE1 PHE B 23 -21.248 -2.141 6.184 1.00 1.54 H new ATOM 0 HE2 PHE B 23 -17.844 -2.533 8.719 1.00 1.27 H new ATOM 0 HZ PHE B 23 -20.249 -2.089 8.433 1.00 1.48 H new ATOM 1998 N ALA B 24 -15.467 -5.193 2.133 1.00 0.61 N ATOM 1999 CA ALA B 24 -14.851 -5.401 0.809 1.00 0.67 C ATOM 2000 C ALA B 24 -15.392 -6.660 0.102 1.00 0.65 C ATOM 2001 O ALA B 24 -15.590 -6.651 -1.115 1.00 0.85 O ATOM 2002 CB ALA B 24 -13.329 -5.490 0.939 1.00 0.77 C ATOM 0 H ALA B 24 -14.830 -5.342 2.916 1.00 0.61 H new ATOM 0 HA ALA B 24 -15.116 -4.541 0.194 1.00 0.67 H new ATOM 0 HB1 ALA B 24 -12.888 -5.644 -0.046 1.00 0.77 H new ATOM 0 HB2 ALA B 24 -12.946 -4.564 1.368 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -13.068 -6.326 1.588 1.00 0.77 H new ATOM 2008 N ARG B 25 -15.643 -7.736 0.879 1.00 0.62 N ATOM 2009 CA ARG B 25 -16.143 -9.020 0.335 1.00 0.68 C ATOM 2010 C ARG B 25 -17.636 -8.984 -0.082 1.00 0.70 C ATOM 2011 O ARG B 25 -18.061 -9.807 -0.898 1.00 0.87 O ATOM 2012 CB ARG B 25 -15.917 -10.166 1.351 1.00 0.77 C ATOM 2013 CG ARG B 25 -16.671 -10.007 2.679 1.00 0.80 C ATOM 2014 CD ARG B 25 -16.451 -11.189 3.618 1.00 1.01 C ATOM 2015 NE ARG B 25 -17.305 -11.120 4.818 1.00 1.10 N ATOM 2016 CZ ARG B 25 -17.195 -11.934 5.888 1.00 1.38 C ATOM 2017 NH1 ARG B 25 -16.298 -12.930 5.920 1.00 1.73 N ATOM 2018 NH2 ARG B 25 -18.002 -11.760 6.932 1.00 1.48 N ATOM 0 H ARG B 25 -15.507 -7.741 1.890 1.00 0.62 H new ATOM 0 HA ARG B 25 -15.567 -9.200 -0.572 1.00 0.68 H new ATOM 0 HB2 ARG B 25 -16.217 -11.107 0.889 1.00 0.77 H new ATOM 0 HB3 ARG B 25 -14.850 -10.241 1.562 1.00 0.77 H new ATOM 0 HG2 ARG B 25 -16.346 -9.090 3.171 1.00 0.80 H new ATOM 0 HG3 ARG B 25 -17.737 -9.900 2.478 1.00 0.80 H new ATOM 0 HD2 ARG B 25 -16.654 -12.117 3.083 1.00 1.01 H new ATOM 0 HD3 ARG B 25 -15.404 -11.219 3.921 1.00 1.01 H new ATOM 0 HE ARG B 25 -18.032 -10.405 4.841 1.00 1.10 H new ATOM 0 HH11 ARG B 25 -15.680 -13.085 5.124 1.00 1.73 H new ATOM 0 HH12 ARG B 25 -16.234 -13.532 6.741 1.00 1.73 H new ATOM 0 HH21 ARG B 25 -18.698 -11.015 6.920 1.00 1.48 H new ATOM 0 HH22 ARG B 25 -17.924 -12.372 7.744 1.00 1.48 H new ATOM 2032 N GLN B 26 -18.422 -8.038 0.477 1.00 0.71 N ATOM 2033 CA GLN B 26 -19.870 -7.927 0.181 1.00 0.79 C ATOM 2034 C GLN B 26 -20.170 -7.581 -1.298 1.00 0.73 C ATOM 2035 O GLN B 26 -21.238 -7.945 -1.798 1.00 0.84 O ATOM 2036 CB GLN B 26 -20.526 -6.888 1.121 1.00 0.90 C ATOM 2037 CG GLN B 26 -22.053 -6.970 1.200 1.00 1.09 C ATOM 2038 CD GLN B 26 -22.645 -6.033 2.251 1.00 1.31 C ATOM 2039 OE1 GLN B 26 -22.953 -4.878 1.956 1.00 1.46 O ATOM 2040 NE2 GLN B 26 -22.806 -6.519 3.486 1.00 1.68 N ATOM 0 H GLN B 26 -18.079 -7.339 1.136 1.00 0.71 H new ATOM 0 HA GLN B 26 -20.301 -8.912 0.359 1.00 0.79 H new ATOM 0 HB2 GLN B 26 -20.117 -7.016 2.123 1.00 0.90 H new ATOM 0 HB3 GLN B 26 -20.246 -5.889 0.787 1.00 0.90 H new ATOM 0 HG2 GLN B 26 -22.476 -6.728 0.225 1.00 1.09 H new ATOM 0 HG3 GLN B 26 -22.345 -7.995 1.428 1.00 1.09 H new ATOM 0 HE21 GLN B 26 -22.540 -7.481 3.694 1.00 1.68 H new ATOM 0 HE22 GLN B 26 -23.195 -5.927 4.220 1.00 1.68 H new ATOM 2049 N GLU B 27 -19.240 -6.886 -1.991 1.00 0.66 N ATOM 2050 CA GLU B 27 -19.439 -6.506 -3.402 1.00 0.71 C ATOM 2051 C GLU B 27 -18.210 -6.852 -4.266 1.00 0.88 C ATOM 2052 O GLU B 27 -17.212 -6.119 -4.262 1.00 1.45 O ATOM 2053 CB GLU B 27 -19.771 -4.998 -3.516 1.00 0.83 C ATOM 2054 CG GLU B 27 -21.161 -4.608 -3.004 1.00 0.93 C ATOM 2055 CD GLU B 27 -22.289 -5.093 -3.903 1.00 1.04 C ATOM 2056 OE1 GLU B 27 -22.551 -4.435 -4.934 1.00 1.23 O ATOM 2057 OE2 GLU B 27 -22.907 -6.129 -3.578 1.00 1.16 O ATOM 0 H GLU B 27 -18.351 -6.580 -1.596 1.00 0.66 H new ATOM 0 HA GLU B 27 -20.282 -7.084 -3.781 1.00 0.71 H new ATOM 0 HB2 GLU B 27 -19.023 -4.432 -2.961 1.00 0.83 H new ATOM 0 HB3 GLU B 27 -19.687 -4.699 -4.561 1.00 0.83 H new ATOM 0 HG2 GLU B 27 -21.301 -5.018 -2.004 1.00 0.93 H new ATOM 0 HG3 GLU B 27 -21.217 -3.523 -2.915 1.00 0.93 H new ATOM 2064 N GLY B 28 -18.289 -7.987 -4.992 1.00 0.73 N ATOM 2065 CA GLY B 28 -17.210 -8.415 -5.883 1.00 0.86 C ATOM 2066 C GLY B 28 -16.029 -9.073 -5.172 1.00 0.69 C ATOM 2067 O GLY B 28 -15.287 -8.393 -4.463 1.00 0.66 O ATOM 0 H GLY B 28 -19.091 -8.617 -4.973 1.00 0.73 H new ATOM 0 HA2 GLY B 28 -17.615 -9.115 -6.614 1.00 0.86 H new ATOM 0 HA3 GLY B 28 -16.848 -7.549 -6.438 1.00 0.86 H new ATOM 2071 N ARG B 29 -15.865 -10.411 -5.364 1.00 0.68 N ATOM 2072 CA ARG B 29 -14.749 -11.204 -4.783 1.00 0.65 C ATOM 2073 C ARG B 29 -14.577 -11.011 -3.251 1.00 0.62 C ATOM 2074 O ARG B 29 -15.381 -10.330 -2.610 1.00 0.69 O ATOM 2075 CB ARG B 29 -13.428 -10.903 -5.557 1.00 0.66 C ATOM 2076 CG ARG B 29 -12.995 -12.012 -6.525 1.00 0.84 C ATOM 2077 CD ARG B 29 -13.887 -12.096 -7.769 1.00 1.28 C ATOM 2078 NE ARG B 29 -13.717 -13.365 -8.496 1.00 1.44 N ATOM 2079 CZ ARG B 29 -14.298 -14.545 -8.167 1.00 1.93 C ATOM 2080 NH1 ARG B 29 -15.092 -14.661 -7.093 1.00 2.62 N ATOM 2081 NH2 ARG B 29 -14.077 -15.617 -8.923 1.00 2.09 N ATOM 0 H ARG B 29 -16.506 -10.970 -5.928 1.00 0.68 H new ATOM 0 HA ARG B 29 -15.005 -12.256 -4.906 1.00 0.65 H new ATOM 0 HB2 ARG B 29 -13.552 -9.976 -6.117 1.00 0.66 H new ATOM 0 HB3 ARG B 29 -12.629 -10.734 -4.835 1.00 0.66 H new ATOM 0 HG2 ARG B 29 -11.964 -11.837 -6.834 1.00 0.84 H new ATOM 0 HG3 ARG B 29 -13.013 -12.970 -6.005 1.00 0.84 H new ATOM 0 HD2 ARG B 29 -14.930 -11.987 -7.473 1.00 1.28 H new ATOM 0 HD3 ARG B 29 -13.656 -11.265 -8.435 1.00 1.28 H new ATOM 0 HE ARG B 29 -13.111 -13.356 -9.316 1.00 1.44 H new ATOM 0 HH11 ARG B 29 -15.271 -13.850 -6.501 1.00 2.62 H new ATOM 0 HH12 ARG B 29 -15.517 -15.560 -6.868 1.00 2.62 H new ATOM 0 HH21 ARG B 29 -13.474 -15.547 -9.743 1.00 2.09 H new ATOM 0 HH22 ARG B 29 -14.510 -16.509 -8.683 1.00 2.09 H new ATOM 2095 N LYS B 30 -13.527 -11.644 -2.676 1.00 0.64 N ATOM 2096 CA LYS B 30 -13.233 -11.564 -1.231 1.00 0.65 C ATOM 2097 C LYS B 30 -12.155 -10.511 -0.925 1.00 0.63 C ATOM 2098 O LYS B 30 -12.374 -9.633 -0.086 1.00 0.67 O ATOM 2099 CB LYS B 30 -12.778 -12.943 -0.703 1.00 0.73 C ATOM 2100 CG LYS B 30 -13.878 -14.008 -0.656 1.00 0.79 C ATOM 2101 CD LYS B 30 -14.917 -13.725 0.436 1.00 0.87 C ATOM 2102 CE LYS B 30 -15.906 -14.876 0.623 1.00 1.01 C ATOM 2103 NZ LYS B 30 -16.750 -15.123 -0.587 1.00 1.11 N ATOM 0 H LYS B 30 -12.866 -12.219 -3.199 1.00 0.64 H new ATOM 0 HA LYS B 30 -14.151 -11.262 -0.726 1.00 0.65 H new ATOM 0 HB2 LYS B 30 -11.966 -13.307 -1.332 1.00 0.73 H new ATOM 0 HB3 LYS B 30 -12.372 -12.816 0.300 1.00 0.73 H new ATOM 0 HG2 LYS B 30 -14.376 -14.056 -1.624 1.00 0.79 H new ATOM 0 HG3 LYS B 30 -13.427 -14.985 -0.481 1.00 0.79 H new ATOM 0 HD2 LYS B 30 -14.404 -13.535 1.379 1.00 0.87 H new ATOM 0 HD3 LYS B 30 -15.466 -12.818 0.183 1.00 0.87 H new ATOM 0 HE2 LYS B 30 -15.356 -15.785 0.867 1.00 1.01 H new ATOM 0 HE3 LYS B 30 -16.553 -14.657 1.472 1.00 1.01 H new ATOM 0 HZ1 LYS B 30 -17.400 -15.913 -0.401 1.00 1.11 H new ATOM 0 HZ2 LYS B 30 -17.299 -14.268 -0.808 1.00 1.11 H new ATOM 0 HZ3 LYS B 30 -16.139 -15.360 -1.394 1.00 1.11 H new ATOM 2117 N ASP B 31 -10.992 -10.601 -1.612 1.00 0.65 N ATOM 2118 CA ASP B 31 -9.870 -9.660 -1.399 1.00 0.69 C ATOM 2119 C ASP B 31 -9.900 -8.489 -2.408 1.00 0.64 C ATOM 2120 O ASP B 31 -8.861 -8.115 -2.968 1.00 0.88 O ATOM 2121 CB ASP B 31 -8.517 -10.402 -1.490 1.00 0.83 C ATOM 2122 CG ASP B 31 -8.388 -11.542 -0.496 1.00 0.94 C ATOM 2123 OD1 ASP B 31 -8.869 -12.656 -0.799 1.00 1.24 O ATOM 2124 OD2 ASP B 31 -7.801 -11.321 0.581 1.00 1.36 O ATOM 0 H ASP B 31 -10.808 -11.315 -2.317 1.00 0.65 H new ATOM 0 HA ASP B 31 -9.984 -9.241 -0.399 1.00 0.69 H new ATOM 0 HB2 ASP B 31 -8.393 -10.794 -2.500 1.00 0.83 H new ATOM 0 HB3 ASP B 31 -7.709 -9.690 -1.323 1.00 0.83 H new ATOM 2129 N SER B 32 -11.094 -7.901 -2.631 1.00 0.65 N ATOM 2130 CA SER B 32 -11.255 -6.769 -3.558 1.00 0.59 C ATOM 2131 C SER B 32 -12.363 -5.818 -3.078 1.00 0.57 C ATOM 2132 O SER B 32 -13.487 -6.252 -2.812 1.00 0.64 O ATOM 2133 CB SER B 32 -11.560 -7.266 -4.979 1.00 0.59 C ATOM 2134 OG SER B 32 -12.785 -7.974 -5.026 1.00 1.13 O ATOM 0 H SER B 32 -11.960 -8.195 -2.179 1.00 0.65 H new ATOM 0 HA SER B 32 -10.314 -6.219 -3.578 1.00 0.59 H new ATOM 0 HB2 SER B 32 -11.602 -6.417 -5.662 1.00 0.59 H new ATOM 0 HB3 SER B 32 -10.751 -7.911 -5.322 1.00 0.59 H new ATOM 0 HG SER B 32 -13.433 -7.546 -4.428 1.00 1.13 H new ATOM 2140 N LEU B 33 -12.024 -4.519 -2.975 1.00 0.55 N ATOM 2141 CA LEU B 33 -12.972 -3.478 -2.528 1.00 0.56 C ATOM 2142 C LEU B 33 -13.876 -3.009 -3.688 1.00 0.55 C ATOM 2143 O LEU B 33 -13.606 -3.315 -4.854 1.00 0.72 O ATOM 2144 CB LEU B 33 -12.203 -2.264 -1.941 1.00 0.59 C ATOM 2145 CG LEU B 33 -11.632 -2.436 -0.512 1.00 0.69 C ATOM 2146 CD1 LEU B 33 -10.486 -3.451 -0.469 1.00 0.79 C ATOM 2147 CD2 LEU B 33 -11.173 -1.088 0.046 1.00 0.75 C ATOM 0 H LEU B 33 -11.094 -4.163 -3.197 1.00 0.55 H new ATOM 0 HA LEU B 33 -13.603 -3.914 -1.754 1.00 0.56 H new ATOM 0 HB2 LEU B 33 -11.378 -2.025 -2.612 1.00 0.59 H new ATOM 0 HB3 LEU B 33 -12.872 -1.404 -1.940 1.00 0.59 H new ATOM 0 HG LEU B 33 -12.435 -2.825 0.114 1.00 0.69 H new ATOM 0 HD11 LEU B 33 -10.116 -3.539 0.553 1.00 0.79 H new ATOM 0 HD12 LEU B 33 -10.847 -4.422 -0.810 1.00 0.79 H new ATOM 0 HD13 LEU B 33 -9.678 -3.115 -1.119 1.00 0.79 H new ATOM 0 HD21 LEU B 33 -10.774 -1.227 1.051 1.00 0.75 H new ATOM 0 HD22 LEU B 33 -10.398 -0.673 -0.598 1.00 0.75 H new ATOM 0 HD23 LEU B 33 -12.019 -0.402 0.083 1.00 0.75 H new ATOM 2159 N SER B 34 -14.957 -2.270 -3.352 1.00 0.52 N ATOM 2160 CA SER B 34 -15.895 -1.732 -4.360 1.00 0.53 C ATOM 2161 C SER B 34 -15.545 -0.267 -4.679 1.00 0.50 C ATOM 2162 O SER B 34 -14.835 0.385 -3.906 1.00 0.52 O ATOM 2163 CB SER B 34 -17.351 -1.835 -3.864 1.00 0.62 C ATOM 2164 OG SER B 34 -18.268 -1.550 -4.911 1.00 0.69 O ATOM 0 H SER B 34 -15.201 -2.033 -2.390 1.00 0.52 H new ATOM 0 HA SER B 34 -15.801 -2.326 -5.269 1.00 0.53 H new ATOM 0 HB2 SER B 34 -17.537 -2.837 -3.476 1.00 0.62 H new ATOM 0 HB3 SER B 34 -17.508 -1.140 -3.039 1.00 0.62 H new ATOM 0 HG SER B 34 -19.185 -1.624 -4.572 1.00 0.69 H new ATOM 2170 N VAL B 35 -16.051 0.250 -5.816 1.00 0.52 N ATOM 2171 CA VAL B 35 -15.781 1.643 -6.247 1.00 0.53 C ATOM 2172 C VAL B 35 -16.527 2.689 -5.376 1.00 0.48 C ATOM 2173 O VAL B 35 -16.078 3.834 -5.273 1.00 0.52 O ATOM 2174 CB VAL B 35 -16.120 1.838 -7.769 1.00 0.64 C ATOM 2175 CG1 VAL B 35 -17.629 1.796 -8.049 1.00 0.67 C ATOM 2176 CG2 VAL B 35 -15.494 3.122 -8.327 1.00 0.71 C ATOM 0 H VAL B 35 -16.649 -0.273 -6.455 1.00 0.52 H new ATOM 0 HA VAL B 35 -14.714 1.815 -6.105 1.00 0.53 H new ATOM 0 HB VAL B 35 -15.676 0.990 -8.291 1.00 0.64 H new ATOM 0 HG11 VAL B 35 -17.805 1.936 -9.116 1.00 0.67 H new ATOM 0 HG12 VAL B 35 -18.030 0.831 -7.739 1.00 0.67 H new ATOM 0 HG13 VAL B 35 -18.125 2.591 -7.492 1.00 0.67 H new ATOM 0 HG21 VAL B 35 -15.750 3.223 -9.382 1.00 0.71 H new ATOM 0 HG22 VAL B 35 -15.876 3.982 -7.777 1.00 0.71 H new ATOM 0 HG23 VAL B 35 -14.410 3.075 -8.220 1.00 0.71 H new ATOM 2186 N ASN B 36 -17.663 2.291 -4.764 1.00 0.47 N ATOM 2187 CA ASN B 36 -18.463 3.193 -3.909 1.00 0.48 C ATOM 2188 C ASN B 36 -18.172 2.992 -2.403 1.00 0.46 C ATOM 2189 O ASN B 36 -18.322 3.936 -1.623 1.00 0.66 O ATOM 2190 CB ASN B 36 -19.965 2.993 -4.202 1.00 0.55 C ATOM 2191 CG ASN B 36 -20.837 4.131 -3.677 1.00 0.64 C ATOM 2192 OD1 ASN B 36 -21.052 5.126 -4.368 1.00 0.83 O ATOM 2193 ND2 ASN B 36 -21.345 3.995 -2.449 1.00 0.79 N ATOM 0 H ASN B 36 -18.047 1.350 -4.847 1.00 0.47 H new ATOM 0 HA ASN B 36 -18.176 4.216 -4.150 1.00 0.48 H new ATOM 0 HB2 ASN B 36 -20.109 2.900 -5.278 1.00 0.55 H new ATOM 0 HB3 ASN B 36 -20.294 2.055 -3.754 1.00 0.55 H new ATOM 0 HD21 ASN B 36 -21.932 4.730 -2.056 1.00 0.79 H new ATOM 0 HD22 ASN B 36 -21.145 3.156 -1.905 1.00 0.79 H new ATOM 2200 N GLU B 37 -17.758 1.769 -1.997 1.00 0.46 N ATOM 2201 CA GLU B 37 -17.463 1.470 -0.576 1.00 0.50 C ATOM 2202 C GLU B 37 -16.097 2.026 -0.122 1.00 0.45 C ATOM 2203 O GLU B 37 -15.944 2.364 1.056 1.00 0.46 O ATOM 2204 CB GLU B 37 -17.547 -0.045 -0.302 1.00 0.62 C ATOM 2205 CG GLU B 37 -18.967 -0.610 -0.394 1.00 0.69 C ATOM 2206 CD GLU B 37 -19.072 -2.046 0.091 1.00 0.88 C ATOM 2207 OE1 GLU B 37 -18.960 -2.267 1.315 1.00 1.28 O ATOM 2208 OE2 GLU B 37 -19.272 -2.947 -0.752 1.00 1.61 O ATOM 0 H GLU B 37 -17.622 0.979 -2.628 1.00 0.46 H new ATOM 0 HA GLU B 37 -18.227 1.978 0.013 1.00 0.50 H new ATOM 0 HB2 GLU B 37 -16.910 -0.570 -1.014 1.00 0.62 H new ATOM 0 HB3 GLU B 37 -17.149 -0.248 0.692 1.00 0.62 H new ATOM 0 HG2 GLU B 37 -19.639 0.015 0.194 1.00 0.69 H new ATOM 0 HG3 GLU B 37 -19.306 -0.557 -1.429 1.00 0.69 H new ATOM 2215 N PHE B 38 -15.105 2.122 -1.041 1.00 0.43 N ATOM 2216 CA PHE B 38 -13.771 2.669 -0.690 1.00 0.43 C ATOM 2217 C PHE B 38 -13.861 4.192 -0.441 1.00 0.39 C ATOM 2218 O PHE B 38 -13.179 4.721 0.437 1.00 0.42 O ATOM 2219 CB PHE B 38 -12.707 2.320 -1.771 1.00 0.48 C ATOM 2220 CG PHE B 38 -12.460 3.382 -2.836 1.00 0.46 C ATOM 2221 CD1 PHE B 38 -13.292 3.493 -3.941 1.00 0.52 C ATOM 2222 CD2 PHE B 38 -11.396 4.272 -2.718 1.00 0.55 C ATOM 2223 CE1 PHE B 38 -13.070 4.462 -4.901 1.00 0.61 C ATOM 2224 CE2 PHE B 38 -11.172 5.240 -3.676 1.00 0.65 C ATOM 2225 CZ PHE B 38 -12.010 5.334 -4.769 1.00 0.66 C ATOM 0 H PHE B 38 -15.200 1.833 -2.015 1.00 0.43 H new ATOM 0 HA PHE B 38 -13.442 2.197 0.236 1.00 0.43 H new ATOM 0 HB2 PHE B 38 -11.762 2.112 -1.268 1.00 0.48 H new ATOM 0 HB3 PHE B 38 -13.013 1.400 -2.269 1.00 0.48 H new ATOM 0 HD1 PHE B 38 -14.124 2.813 -4.052 1.00 0.52 H new ATOM 0 HD2 PHE B 38 -10.737 4.204 -1.865 1.00 0.55 H new ATOM 0 HE1 PHE B 38 -13.727 4.536 -5.755 1.00 0.61 H new ATOM 0 HE2 PHE B 38 -10.342 5.923 -3.571 1.00 0.65 H new ATOM 0 HZ PHE B 38 -11.835 6.090 -5.520 1.00 0.66 H new ATOM 2235 N LYS B 39 -14.713 4.884 -1.232 1.00 0.37 N ATOM 2236 CA LYS B 39 -14.924 6.335 -1.095 1.00 0.38 C ATOM 2237 C LYS B 39 -15.604 6.669 0.250 1.00 0.36 C ATOM 2238 O LYS B 39 -15.310 7.705 0.852 1.00 0.39 O ATOM 2239 CB LYS B 39 -15.761 6.860 -2.278 1.00 0.43 C ATOM 2240 CG LYS B 39 -15.832 8.383 -2.377 1.00 0.50 C ATOM 2241 CD LYS B 39 -16.550 8.836 -3.648 1.00 0.60 C ATOM 2242 CE LYS B 39 -16.804 10.343 -3.654 1.00 0.70 C ATOM 2243 NZ LYS B 39 -15.550 11.136 -3.833 1.00 0.81 N ATOM 0 H LYS B 39 -15.266 4.454 -1.974 1.00 0.37 H new ATOM 0 HA LYS B 39 -13.953 6.830 -1.107 1.00 0.38 H new ATOM 0 HB2 LYS B 39 -15.343 6.467 -3.205 1.00 0.43 H new ATOM 0 HB3 LYS B 39 -16.774 6.466 -2.193 1.00 0.43 H new ATOM 0 HG2 LYS B 39 -16.351 8.780 -1.505 1.00 0.50 H new ATOM 0 HG3 LYS B 39 -14.823 8.796 -2.363 1.00 0.50 H new ATOM 0 HD2 LYS B 39 -15.952 8.565 -4.518 1.00 0.60 H new ATOM 0 HD3 LYS B 39 -17.499 8.308 -3.736 1.00 0.60 H new ATOM 0 HE2 LYS B 39 -17.501 10.587 -4.455 1.00 0.70 H new ATOM 0 HE3 LYS B 39 -17.281 10.631 -2.717 1.00 0.70 H new ATOM 0 HZ1 LYS B 39 -15.778 12.151 -3.830 1.00 0.81 H new ATOM 0 HZ2 LYS B 39 -14.893 10.926 -3.055 1.00 0.81 H new ATOM 0 HZ3 LYS B 39 -15.106 10.884 -4.739 1.00 0.81 H new ATOM 2257 N GLU B 40 -16.518 5.782 0.713 1.00 0.35 N ATOM 2258 CA GLU B 40 -17.207 5.962 2.009 1.00 0.38 C ATOM 2259 C GLU B 40 -16.198 5.845 3.171 1.00 0.38 C ATOM 2260 O GLU B 40 -16.340 6.530 4.185 1.00 0.41 O ATOM 2261 CB GLU B 40 -18.354 4.938 2.180 1.00 0.43 C ATOM 2262 CG GLU B 40 -19.571 5.228 1.301 1.00 0.47 C ATOM 2263 CD GLU B 40 -20.748 4.305 1.579 1.00 0.56 C ATOM 2264 OE1 GLU B 40 -20.810 3.216 0.974 1.00 0.63 O ATOM 2265 OE2 GLU B 40 -21.620 4.683 2.393 1.00 0.69 O ATOM 0 H GLU B 40 -16.793 4.939 0.209 1.00 0.35 H new ATOM 0 HA GLU B 40 -17.646 6.960 2.024 1.00 0.38 H new ATOM 0 HB2 GLU B 40 -17.978 3.942 1.948 1.00 0.43 H new ATOM 0 HB3 GLU B 40 -18.666 4.925 3.224 1.00 0.43 H new ATOM 0 HG2 GLU B 40 -19.884 6.261 1.455 1.00 0.47 H new ATOM 0 HG3 GLU B 40 -19.284 5.135 0.253 1.00 0.47 H new ATOM 2272 N LEU B 41 -15.171 4.977 3.000 1.00 0.37 N ATOM 2273 CA LEU B 41 -14.106 4.791 4.003 1.00 0.40 C ATOM 2274 C LEU B 41 -13.212 6.049 4.077 1.00 0.38 C ATOM 2275 O LEU B 41 -12.782 6.440 5.165 1.00 0.40 O ATOM 2276 CB LEU B 41 -13.257 3.538 3.663 1.00 0.44 C ATOM 2277 CG LEU B 41 -12.057 3.238 4.597 1.00 0.55 C ATOM 2278 CD1 LEU B 41 -12.528 2.872 6.006 1.00 0.68 C ATOM 2279 CD2 LEU B 41 -11.187 2.124 4.008 1.00 0.64 C ATOM 0 H LEU B 41 -15.062 4.394 2.170 1.00 0.37 H new ATOM 0 HA LEU B 41 -14.568 4.639 4.978 1.00 0.40 H new ATOM 0 HB2 LEU B 41 -13.916 2.670 3.665 1.00 0.44 H new ATOM 0 HB3 LEU B 41 -12.878 3.649 2.647 1.00 0.44 H new ATOM 0 HG LEU B 41 -11.455 4.143 4.675 1.00 0.55 H new ATOM 0 HD11 LEU B 41 -11.663 2.667 6.637 1.00 0.68 H new ATOM 0 HD12 LEU B 41 -13.096 3.702 6.427 1.00 0.68 H new ATOM 0 HD13 LEU B 41 -13.161 1.986 5.959 1.00 0.68 H new ATOM 0 HD21 LEU B 41 -10.349 1.925 4.676 1.00 0.64 H new ATOM 0 HD22 LEU B 41 -11.783 1.218 3.894 1.00 0.64 H new ATOM 0 HD23 LEU B 41 -10.809 2.434 3.034 1.00 0.64 H new ATOM 2291 N VAL B 42 -12.936 6.666 2.907 1.00 0.37 N ATOM 2292 CA VAL B 42 -12.116 7.893 2.826 1.00 0.38 C ATOM 2293 C VAL B 42 -12.875 9.120 3.388 1.00 0.39 C ATOM 2294 O VAL B 42 -12.243 10.040 3.909 1.00 0.43 O ATOM 2295 CB VAL B 42 -11.641 8.164 1.349 1.00 0.43 C ATOM 2296 CG1 VAL B 42 -10.924 9.516 1.200 1.00 0.48 C ATOM 2297 CG2 VAL B 42 -10.739 7.023 0.853 1.00 0.47 C ATOM 0 H VAL B 42 -13.271 6.332 2.003 1.00 0.37 H new ATOM 0 HA VAL B 42 -11.232 7.733 3.444 1.00 0.38 H new ATOM 0 HB VAL B 42 -12.538 8.206 0.731 1.00 0.43 H new ATOM 0 HG11 VAL B 42 -10.617 9.653 0.163 1.00 0.48 H new ATOM 0 HG12 VAL B 42 -11.601 10.320 1.488 1.00 0.48 H new ATOM 0 HG13 VAL B 42 -10.045 9.534 1.844 1.00 0.48 H new ATOM 0 HG21 VAL B 42 -10.421 7.229 -0.169 1.00 0.47 H new ATOM 0 HG22 VAL B 42 -9.863 6.946 1.497 1.00 0.47 H new ATOM 0 HG23 VAL B 42 -11.292 6.084 0.879 1.00 0.47 H new ATOM 2307 N THR B 43 -14.223 9.119 3.298 1.00 0.38 N ATOM 2308 CA THR B 43 -15.046 10.243 3.790 1.00 0.42 C ATOM 2309 C THR B 43 -15.715 9.929 5.157 1.00 0.48 C ATOM 2310 O THR B 43 -16.743 10.527 5.499 1.00 0.83 O ATOM 2311 CB THR B 43 -16.126 10.624 2.722 1.00 0.44 C ATOM 2312 OG1 THR B 43 -15.581 10.493 1.395 1.00 0.46 O ATOM 2313 CG2 THR B 43 -16.644 12.056 2.901 1.00 0.49 C ATOM 0 H THR B 43 -14.762 8.355 2.891 1.00 0.38 H new ATOM 0 HA THR B 43 -14.381 11.092 3.950 1.00 0.42 H new ATOM 0 HB THR B 43 -16.961 9.938 2.862 1.00 0.44 H new ATOM 0 HG1 THR B 43 -15.518 9.544 1.159 1.00 0.46 H new ATOM 0 HG21 THR B 43 -17.390 12.271 2.136 1.00 0.49 H new ATOM 0 HG22 THR B 43 -17.095 12.159 3.888 1.00 0.49 H new ATOM 0 HG23 THR B 43 -15.815 12.757 2.806 1.00 0.49 H new ATOM 2321 N GLN B 44 -15.116 9.013 5.963 1.00 0.42 N ATOM 2322 CA GLN B 44 -15.674 8.649 7.284 1.00 0.44 C ATOM 2323 C GLN B 44 -14.573 8.260 8.295 1.00 0.44 C ATOM 2324 O GLN B 44 -14.472 8.885 9.356 1.00 0.50 O ATOM 2325 CB GLN B 44 -16.717 7.514 7.150 1.00 0.47 C ATOM 2326 CG GLN B 44 -17.644 7.383 8.362 1.00 0.58 C ATOM 2327 CD GLN B 44 -18.733 6.330 8.177 1.00 0.67 C ATOM 2328 OE1 GLN B 44 -19.821 6.633 7.690 1.00 0.91 O ATOM 2329 NE2 GLN B 44 -18.448 5.085 8.570 1.00 0.98 N ATOM 0 H GLN B 44 -14.256 8.520 5.721 1.00 0.42 H new ATOM 0 HA GLN B 44 -16.173 9.536 7.674 1.00 0.44 H new ATOM 0 HB2 GLN B 44 -17.320 7.691 6.260 1.00 0.47 H new ATOM 0 HB3 GLN B 44 -16.195 6.569 6.999 1.00 0.47 H new ATOM 0 HG2 GLN B 44 -17.049 7.131 9.240 1.00 0.58 H new ATOM 0 HG3 GLN B 44 -18.111 8.348 8.560 1.00 0.58 H new ATOM 0 HE21 GLN B 44 -17.534 4.873 8.969 1.00 0.98 H new ATOM 0 HE22 GLN B 44 -19.145 4.347 8.470 1.00 0.98 H new ATOM 2338 N GLN B 45 -13.752 7.234 7.970 1.00 0.42 N ATOM 2339 CA GLN B 45 -12.676 6.765 8.874 1.00 0.43 C ATOM 2340 C GLN B 45 -11.261 7.180 8.407 1.00 0.41 C ATOM 2341 O GLN B 45 -10.318 7.120 9.205 1.00 0.46 O ATOM 2342 CB GLN B 45 -12.766 5.232 9.034 1.00 0.47 C ATOM 2343 CG GLN B 45 -11.925 4.665 10.185 1.00 0.57 C ATOM 2344 CD GLN B 45 -12.323 3.246 10.594 1.00 0.62 C ATOM 2345 OE1 GLN B 45 -12.791 2.453 9.771 1.00 0.70 O ATOM 2346 NE2 GLN B 45 -12.131 2.913 11.873 1.00 0.73 N ATOM 0 H GLN B 45 -13.814 6.717 7.093 1.00 0.42 H new ATOM 0 HA GLN B 45 -12.831 7.251 9.837 1.00 0.43 H new ATOM 0 HB2 GLN B 45 -13.809 4.956 9.192 1.00 0.47 H new ATOM 0 HB3 GLN B 45 -12.449 4.762 8.103 1.00 0.47 H new ATOM 0 HG2 GLN B 45 -10.875 4.669 9.893 1.00 0.57 H new ATOM 0 HG3 GLN B 45 -12.017 5.323 11.049 1.00 0.57 H new ATOM 0 HE21 GLN B 45 -11.742 3.595 12.525 1.00 0.73 H new ATOM 0 HE22 GLN B 45 -12.373 1.977 12.198 1.00 0.73 H new ATOM 2355 N LEU B 46 -11.110 7.610 7.135 1.00 0.39 N ATOM 2356 CA LEU B 46 -9.797 8.023 6.600 1.00 0.38 C ATOM 2357 C LEU B 46 -9.861 9.406 5.873 1.00 0.38 C ATOM 2358 O LEU B 46 -9.368 9.530 4.746 1.00 0.41 O ATOM 2359 CB LEU B 46 -9.283 6.907 5.656 1.00 0.40 C ATOM 2360 CG LEU B 46 -7.759 6.908 5.343 1.00 0.41 C ATOM 2361 CD1 LEU B 46 -7.077 5.661 5.921 1.00 0.58 C ATOM 2362 CD2 LEU B 46 -7.508 7.000 3.833 1.00 0.62 C ATOM 0 H LEU B 46 -11.876 7.679 6.465 1.00 0.39 H new ATOM 0 HA LEU B 46 -9.101 8.157 7.428 1.00 0.38 H new ATOM 0 HB2 LEU B 46 -9.540 5.943 6.096 1.00 0.40 H new ATOM 0 HB3 LEU B 46 -9.825 6.982 4.713 1.00 0.40 H new ATOM 0 HG LEU B 46 -7.325 7.788 5.818 1.00 0.41 H new ATOM 0 HD11 LEU B 46 -6.013 5.687 5.688 1.00 0.58 H new ATOM 0 HD12 LEU B 46 -7.211 5.641 7.003 1.00 0.58 H new ATOM 0 HD13 LEU B 46 -7.522 4.767 5.484 1.00 0.58 H new ATOM 0 HD21 LEU B 46 -6.435 6.999 3.642 1.00 0.62 H new ATOM 0 HD22 LEU B 46 -7.966 6.145 3.335 1.00 0.62 H new ATOM 0 HD23 LEU B 46 -7.944 7.921 3.447 1.00 0.62 H new ATOM 2374 N PRO B 47 -10.466 10.477 6.500 1.00 0.40 N ATOM 2375 CA PRO B 47 -10.551 11.819 5.881 1.00 0.42 C ATOM 2376 C PRO B 47 -9.314 12.726 6.115 1.00 0.42 C ATOM 2377 O PRO B 47 -8.958 13.510 5.231 1.00 0.46 O ATOM 2378 CB PRO B 47 -11.796 12.408 6.555 1.00 0.48 C ATOM 2379 CG PRO B 47 -11.783 11.835 7.932 1.00 0.48 C ATOM 2380 CD PRO B 47 -11.165 10.464 7.819 1.00 0.44 C ATOM 0 HA PRO B 47 -10.597 11.752 4.794 1.00 0.42 H new ATOM 0 HB2 PRO B 47 -11.757 13.497 6.578 1.00 0.48 H new ATOM 0 HB3 PRO B 47 -12.705 12.133 6.019 1.00 0.48 H new ATOM 0 HG2 PRO B 47 -11.207 12.466 8.609 1.00 0.48 H new ATOM 0 HG3 PRO B 47 -12.793 11.773 8.336 1.00 0.48 H new ATOM 0 HD2 PRO B 47 -10.468 10.274 8.636 1.00 0.44 H new ATOM 0 HD3 PRO B 47 -11.923 9.682 7.859 1.00 0.44 H new ATOM 2388 N HIS B 48 -8.664 12.617 7.295 1.00 0.42 N ATOM 2389 CA HIS B 48 -7.490 13.458 7.631 1.00 0.44 C ATOM 2390 C HIS B 48 -6.226 13.047 6.854 1.00 0.43 C ATOM 2391 O HIS B 48 -5.389 13.903 6.549 1.00 0.49 O ATOM 2392 CB HIS B 48 -7.210 13.423 9.146 1.00 0.49 C ATOM 2393 CG HIS B 48 -8.304 14.025 9.981 1.00 0.56 C ATOM 2394 ND1 HIS B 48 -9.367 13.294 10.469 1.00 0.67 N ATOM 2395 CD2 HIS B 48 -8.498 15.295 10.407 1.00 0.70 C ATOM 2396 CE1 HIS B 48 -10.166 14.088 11.159 1.00 0.79 C ATOM 2397 NE2 HIS B 48 -9.657 15.307 11.139 1.00 0.81 N ATOM 0 H HIS B 48 -8.929 11.959 8.028 1.00 0.42 H new ATOM 0 HA HIS B 48 -7.741 14.476 7.332 1.00 0.44 H new ATOM 0 HB2 HIS B 48 -7.059 12.388 9.454 1.00 0.49 H new ATOM 0 HB3 HIS B 48 -6.279 13.954 9.346 1.00 0.49 H new ATOM 0 HD2 HIS B 48 -7.858 16.142 10.207 1.00 0.70 H new ATOM 0 HE1 HIS B 48 -11.079 13.792 11.654 1.00 0.79 H new ATOM 0 HE2 HIS B 48 -10.061 16.125 11.595 1.00 0.81 H new ATOM 2406 N LEU B 49 -6.089 11.741 6.533 1.00 0.41 N ATOM 2407 CA LEU B 49 -4.920 11.237 5.786 1.00 0.42 C ATOM 2408 C LEU B 49 -4.941 11.742 4.331 1.00 0.40 C ATOM 2409 O LEU B 49 -3.978 12.373 3.885 1.00 0.48 O ATOM 2410 CB LEU B 49 -4.866 9.692 5.848 1.00 0.43 C ATOM 2411 CG LEU B 49 -3.596 9.024 5.273 1.00 0.52 C ATOM 2412 CD1 LEU B 49 -2.340 9.502 6.000 1.00 0.88 C ATOM 2413 CD2 LEU B 49 -3.712 7.500 5.352 1.00 0.62 C ATOM 0 H LEU B 49 -6.770 11.023 6.779 1.00 0.41 H new ATOM 0 HA LEU B 49 -4.015 11.624 6.254 1.00 0.42 H new ATOM 0 HB2 LEU B 49 -4.970 9.388 6.890 1.00 0.43 H new ATOM 0 HB3 LEU B 49 -5.731 9.298 5.314 1.00 0.43 H new ATOM 0 HG LEU B 49 -3.508 9.316 4.226 1.00 0.52 H new ATOM 0 HD11 LEU B 49 -1.464 9.014 5.572 1.00 0.88 H new ATOM 0 HD12 LEU B 49 -2.244 10.582 5.889 1.00 0.88 H new ATOM 0 HD13 LEU B 49 -2.415 9.251 7.058 1.00 0.88 H new ATOM 0 HD21 LEU B 49 -2.810 7.045 4.943 1.00 0.62 H new ATOM 0 HD22 LEU B 49 -3.832 7.198 6.392 1.00 0.62 H new ATOM 0 HD23 LEU B 49 -4.577 7.171 4.777 1.00 0.62 H new ATOM 2425 N LEU B 50 -6.041 11.463 3.599 1.00 0.38 N ATOM 2426 CA LEU B 50 -6.192 11.925 2.210 1.00 0.41 C ATOM 2427 C LEU B 50 -6.767 13.354 2.210 1.00 0.45 C ATOM 2428 O LEU B 50 -7.947 13.555 2.518 1.00 0.52 O ATOM 2429 CB LEU B 50 -7.089 10.955 1.404 1.00 0.44 C ATOM 2430 CG LEU B 50 -6.501 9.539 1.155 1.00 0.51 C ATOM 2431 CD1 LEU B 50 -7.573 8.590 0.627 1.00 0.57 C ATOM 2432 CD2 LEU B 50 -5.310 9.591 0.184 1.00 0.70 C ATOM 0 H LEU B 50 -6.832 10.922 3.949 1.00 0.38 H new ATOM 0 HA LEU B 50 -5.216 11.940 1.724 1.00 0.41 H new ATOM 0 HB2 LEU B 50 -8.038 10.846 1.929 1.00 0.44 H new ATOM 0 HB3 LEU B 50 -7.309 11.411 0.439 1.00 0.44 H new ATOM 0 HG LEU B 50 -6.142 9.160 2.112 1.00 0.51 H new ATOM 0 HD11 LEU B 50 -7.137 7.605 0.460 1.00 0.57 H new ATOM 0 HD12 LEU B 50 -8.380 8.511 1.356 1.00 0.57 H new ATOM 0 HD13 LEU B 50 -7.969 8.975 -0.313 1.00 0.57 H new ATOM 0 HD21 LEU B 50 -4.921 8.584 0.031 1.00 0.70 H new ATOM 0 HD22 LEU B 50 -5.637 10.003 -0.771 1.00 0.70 H new ATOM 0 HD23 LEU B 50 -4.526 10.223 0.603 1.00 0.70 H new ATOM 2444 N LYS B 51 -5.910 14.345 1.870 1.00 0.50 N ATOM 2445 CA LYS B 51 -6.289 15.781 1.863 1.00 0.58 C ATOM 2446 C LYS B 51 -7.574 16.089 1.058 1.00 0.53 C ATOM 2447 O LYS B 51 -8.339 16.976 1.450 1.00 0.61 O ATOM 2448 CB LYS B 51 -5.115 16.659 1.362 1.00 0.68 C ATOM 2449 CG LYS B 51 -4.674 16.406 -0.089 1.00 0.72 C ATOM 2450 CD LYS B 51 -3.495 17.299 -0.495 1.00 1.06 C ATOM 2451 CE LYS B 51 -3.124 17.142 -1.971 1.00 1.03 C ATOM 2452 NZ LYS B 51 -4.025 17.919 -2.875 1.00 1.23 N ATOM 0 H LYS B 51 -4.943 14.176 1.594 1.00 0.50 H new ATOM 0 HA LYS B 51 -6.515 16.030 2.900 1.00 0.58 H new ATOM 0 HB2 LYS B 51 -5.400 17.707 1.460 1.00 0.68 H new ATOM 0 HB3 LYS B 51 -4.259 16.499 2.017 1.00 0.68 H new ATOM 0 HG2 LYS B 51 -4.393 15.359 -0.205 1.00 0.72 H new ATOM 0 HG3 LYS B 51 -5.514 16.587 -0.760 1.00 0.72 H new ATOM 0 HD2 LYS B 51 -3.746 18.341 -0.295 1.00 1.06 H new ATOM 0 HD3 LYS B 51 -2.630 17.056 0.122 1.00 1.06 H new ATOM 0 HE2 LYS B 51 -2.095 17.470 -2.120 1.00 1.03 H new ATOM 0 HE3 LYS B 51 -3.165 16.087 -2.242 1.00 1.03 H new ATOM 0 HZ1 LYS B 51 -3.571 18.033 -3.803 1.00 1.23 H new ATOM 0 HZ2 LYS B 51 -4.924 17.410 -2.990 1.00 1.23 H new ATOM 0 HZ3 LYS B 51 -4.208 18.856 -2.462 1.00 1.23 H new ATOM 2466 N ASP B 52 -7.805 15.357 -0.055 1.00 0.48 N ATOM 2467 CA ASP B 52 -8.989 15.569 -0.905 1.00 0.54 C ATOM 2468 C ASP B 52 -10.055 14.484 -0.670 1.00 0.48 C ATOM 2469 O ASP B 52 -9.996 13.407 -1.277 1.00 0.60 O ATOM 2470 CB ASP B 52 -8.588 15.605 -2.398 1.00 0.69 C ATOM 2471 CG ASP B 52 -7.738 16.816 -2.765 1.00 1.20 C ATOM 2472 OD1 ASP B 52 -8.166 17.958 -2.476 1.00 1.78 O ATOM 2473 OD2 ASP B 52 -6.647 16.622 -3.340 1.00 1.94 O ATOM 0 H ASP B 52 -7.185 14.616 -0.382 1.00 0.48 H new ATOM 0 HA ASP B 52 -9.421 16.531 -0.630 1.00 0.54 H new ATOM 0 HB2 ASP B 52 -8.037 14.696 -2.641 1.00 0.69 H new ATOM 0 HB3 ASP B 52 -9.490 15.604 -3.010 1.00 0.69 H new ATOM 2478 N VAL B 53 -11.024 14.768 0.225 1.00 0.44 N ATOM 2479 CA VAL B 53 -12.127 13.823 0.519 1.00 0.45 C ATOM 2480 C VAL B 53 -13.205 13.880 -0.585 1.00 0.46 C ATOM 2481 O VAL B 53 -13.798 12.852 -0.927 1.00 0.57 O ATOM 2482 CB VAL B 53 -12.788 14.046 1.927 1.00 0.53 C ATOM 2483 CG1 VAL B 53 -11.841 13.610 3.048 1.00 0.60 C ATOM 2484 CG2 VAL B 53 -13.254 15.498 2.146 1.00 0.58 C ATOM 0 H VAL B 53 -11.067 15.638 0.755 1.00 0.44 H new ATOM 0 HA VAL B 53 -11.673 12.832 0.540 1.00 0.45 H new ATOM 0 HB VAL B 53 -13.681 13.421 1.953 1.00 0.53 H new ATOM 0 HG11 VAL B 53 -12.320 13.774 4.013 1.00 0.60 H new ATOM 0 HG12 VAL B 53 -11.606 12.552 2.935 1.00 0.60 H new ATOM 0 HG13 VAL B 53 -10.922 14.194 2.995 1.00 0.60 H new ATOM 0 HG21 VAL B 53 -13.702 15.591 3.135 1.00 0.58 H new ATOM 0 HG22 VAL B 53 -12.399 16.170 2.070 1.00 0.58 H new ATOM 0 HG23 VAL B 53 -13.991 15.762 1.388 1.00 0.58 H new ATOM 2494 N GLY B 54 -13.440 15.091 -1.134 1.00 0.44 N ATOM 2495 CA GLY B 54 -14.418 15.280 -2.203 1.00 0.51 C ATOM 2496 C GLY B 54 -13.825 15.036 -3.592 1.00 0.51 C ATOM 2497 O GLY B 54 -14.444 14.359 -4.419 1.00 0.67 O ATOM 0 H GLY B 54 -12.962 15.945 -0.848 1.00 0.44 H new ATOM 0 HA2 GLY B 54 -15.258 14.603 -2.046 1.00 0.51 H new ATOM 0 HA3 GLY B 54 -14.813 16.295 -2.154 1.00 0.51 H new ATOM 2501 N SER B 55 -12.614 15.589 -3.846 1.00 0.51 N ATOM 2502 CA SER B 55 -11.921 15.425 -5.138 1.00 0.57 C ATOM 2503 C SER B 55 -11.129 14.105 -5.164 1.00 0.52 C ATOM 2504 O SER B 55 -9.899 14.095 -5.024 1.00 0.63 O ATOM 2505 CB SER B 55 -10.999 16.627 -5.423 1.00 0.74 C ATOM 2506 OG SER B 55 -10.341 16.489 -6.676 1.00 0.92 O ATOM 0 H SER B 55 -12.100 16.153 -3.169 1.00 0.51 H new ATOM 0 HA SER B 55 -12.673 15.386 -5.926 1.00 0.57 H new ATOM 0 HB2 SER B 55 -11.584 17.546 -5.417 1.00 0.74 H new ATOM 0 HB3 SER B 55 -10.258 16.716 -4.629 1.00 0.74 H new ATOM 0 HG SER B 55 -9.765 17.266 -6.830 1.00 0.92 H new ATOM 2512 N LEU B 56 -11.863 12.989 -5.324 1.00 0.47 N ATOM 2513 CA LEU B 56 -11.271 11.639 -5.378 1.00 0.47 C ATOM 2514 C LEU B 56 -11.281 11.065 -6.814 1.00 0.48 C ATOM 2515 O LEU B 56 -10.721 9.996 -7.046 1.00 0.81 O ATOM 2516 CB LEU B 56 -12.025 10.688 -4.401 1.00 0.58 C ATOM 2517 CG LEU B 56 -11.156 9.748 -3.524 1.00 0.75 C ATOM 2518 CD1 LEU B 56 -10.263 8.831 -4.368 1.00 1.09 C ATOM 2519 CD2 LEU B 56 -10.322 10.546 -2.516 1.00 1.24 C ATOM 0 H LEU B 56 -12.879 12.997 -5.419 1.00 0.47 H new ATOM 0 HA LEU B 56 -10.229 11.717 -5.068 1.00 0.47 H new ATOM 0 HB2 LEU B 56 -12.638 11.299 -3.738 1.00 0.58 H new ATOM 0 HB3 LEU B 56 -12.706 10.071 -4.987 1.00 0.58 H new ATOM 0 HG LEU B 56 -11.842 9.108 -2.969 1.00 0.75 H new ATOM 0 HD11 LEU B 56 -9.674 8.192 -3.711 1.00 1.09 H new ATOM 0 HD12 LEU B 56 -10.885 8.212 -5.014 1.00 1.09 H new ATOM 0 HD13 LEU B 56 -9.595 9.437 -4.980 1.00 1.09 H new ATOM 0 HD21 LEU B 56 -9.723 9.861 -1.916 1.00 1.24 H new ATOM 0 HD22 LEU B 56 -9.663 11.231 -3.050 1.00 1.24 H new ATOM 0 HD23 LEU B 56 -10.985 11.115 -1.864 1.00 1.24 H new ATOM 2531 N ASP B 57 -11.901 11.781 -7.779 1.00 0.48 N ATOM 2532 CA ASP B 57 -11.976 11.321 -9.183 1.00 0.49 C ATOM 2533 C ASP B 57 -10.589 11.263 -9.874 1.00 0.44 C ATOM 2534 O ASP B 57 -10.374 10.405 -10.736 1.00 0.46 O ATOM 2535 CB ASP B 57 -12.955 12.199 -9.997 1.00 0.60 C ATOM 2536 CG ASP B 57 -12.556 13.668 -10.063 1.00 0.64 C ATOM 2537 OD1 ASP B 57 -11.748 14.022 -10.947 1.00 0.69 O ATOM 2538 OD2 ASP B 57 -13.050 14.459 -9.232 1.00 0.73 O ATOM 0 H ASP B 57 -12.356 12.678 -7.611 1.00 0.48 H new ATOM 0 HA ASP B 57 -12.355 10.299 -9.155 1.00 0.49 H new ATOM 0 HB2 ASP B 57 -13.024 11.805 -11.011 1.00 0.60 H new ATOM 0 HB3 ASP B 57 -13.949 12.122 -9.557 1.00 0.60 H new ATOM 2543 N GLU B 58 -9.654 12.165 -9.491 1.00 0.45 N ATOM 2544 CA GLU B 58 -8.292 12.198 -10.077 1.00 0.50 C ATOM 2545 C GLU B 58 -7.505 10.918 -9.711 1.00 0.47 C ATOM 2546 O GLU B 58 -6.742 10.401 -10.534 1.00 0.57 O ATOM 2547 CB GLU B 58 -7.531 13.462 -9.613 1.00 0.59 C ATOM 2548 CG GLU B 58 -6.307 13.817 -10.462 1.00 0.73 C ATOM 2549 CD GLU B 58 -5.694 15.150 -10.073 1.00 0.92 C ATOM 2550 OE1 GLU B 58 -4.815 15.167 -9.181 1.00 1.06 O ATOM 2551 OE2 GLU B 58 -6.099 16.181 -10.655 1.00 1.10 O ATOM 0 H GLU B 58 -9.817 12.878 -8.780 1.00 0.45 H new ATOM 0 HA GLU B 58 -8.388 12.236 -11.162 1.00 0.50 H new ATOM 0 HB2 GLU B 58 -8.219 14.307 -9.620 1.00 0.59 H new ATOM 0 HB3 GLU B 58 -7.212 13.319 -8.581 1.00 0.59 H new ATOM 0 HG2 GLU B 58 -5.557 13.032 -10.358 1.00 0.73 H new ATOM 0 HG3 GLU B 58 -6.594 13.846 -11.513 1.00 0.73 H new ATOM 2558 N LYS B 59 -7.700 10.420 -8.469 1.00 0.43 N ATOM 2559 CA LYS B 59 -7.039 9.188 -7.995 1.00 0.48 C ATOM 2560 C LYS B 59 -7.836 7.938 -8.414 1.00 0.54 C ATOM 2561 O LYS B 59 -7.252 6.987 -8.931 1.00 0.91 O ATOM 2562 CB LYS B 59 -6.868 9.206 -6.454 1.00 0.52 C ATOM 2563 CG LYS B 59 -5.562 9.836 -5.961 1.00 0.59 C ATOM 2564 CD LYS B 59 -5.554 11.358 -6.094 1.00 0.79 C ATOM 2565 CE LYS B 59 -4.244 11.965 -5.598 1.00 1.19 C ATOM 2566 NZ LYS B 59 -4.172 13.432 -5.853 1.00 1.47 N ATOM 0 H LYS B 59 -8.311 10.855 -7.778 1.00 0.43 H new ATOM 0 HA LYS B 59 -6.053 9.148 -8.457 1.00 0.48 H new ATOM 0 HB2 LYS B 59 -7.705 9.749 -6.016 1.00 0.52 H new ATOM 0 HB3 LYS B 59 -6.924 8.182 -6.084 1.00 0.52 H new ATOM 0 HG2 LYS B 59 -5.405 9.566 -4.917 1.00 0.59 H new ATOM 0 HG3 LYS B 59 -4.727 9.422 -6.527 1.00 0.59 H new ATOM 0 HD2 LYS B 59 -5.709 11.632 -7.137 1.00 0.79 H new ATOM 0 HD3 LYS B 59 -6.386 11.776 -5.527 1.00 0.79 H new ATOM 0 HE2 LYS B 59 -4.140 11.778 -4.529 1.00 1.19 H new ATOM 0 HE3 LYS B 59 -3.407 11.471 -6.091 1.00 1.19 H new ATOM 0 HZ1 LYS B 59 -3.266 13.802 -5.500 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -4.244 13.611 -6.875 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -4.955 13.909 -5.362 1.00 1.47 H new ATOM 2580 N MET B 60 -9.177 7.965 -8.194 1.00 0.40 N ATOM 2581 CA MET B 60 -10.091 6.834 -8.514 1.00 0.43 C ATOM 2582 C MET B 60 -9.859 6.236 -9.921 1.00 0.45 C ATOM 2583 O MET B 60 -9.787 5.011 -10.058 1.00 0.49 O ATOM 2584 CB MET B 60 -11.561 7.281 -8.359 1.00 0.47 C ATOM 2585 CG MET B 60 -12.589 6.147 -8.431 1.00 0.55 C ATOM 2586 SD MET B 60 -14.298 6.731 -8.339 1.00 0.67 S ATOM 2587 CE MET B 60 -14.575 7.249 -10.034 1.00 0.81 C ATOM 0 H MET B 60 -9.655 8.770 -7.790 1.00 0.40 H new ATOM 0 HA MET B 60 -9.866 6.040 -7.802 1.00 0.43 H new ATOM 0 HB2 MET B 60 -11.672 7.792 -7.403 1.00 0.47 H new ATOM 0 HB3 MET B 60 -11.789 8.009 -9.138 1.00 0.47 H new ATOM 0 HG2 MET B 60 -12.449 5.597 -9.361 1.00 0.55 H new ATOM 0 HG3 MET B 60 -12.406 5.447 -7.616 1.00 0.55 H new ATOM 0 HE1 MET B 60 -15.590 7.634 -10.136 1.00 0.81 H new ATOM 0 HE2 MET B 60 -13.862 8.030 -10.297 1.00 0.81 H new ATOM 0 HE3 MET B 60 -14.442 6.397 -10.701 1.00 0.81 H new ATOM 2597 N LYS B 61 -9.747 7.096 -10.960 1.00 0.47 N ATOM 2598 CA LYS B 61 -9.507 6.630 -12.347 1.00 0.53 C ATOM 2599 C LYS B 61 -8.164 5.881 -12.469 1.00 0.48 C ATOM 2600 O LYS B 61 -8.059 4.921 -13.238 1.00 0.52 O ATOM 2601 CB LYS B 61 -9.532 7.808 -13.346 1.00 0.63 C ATOM 2602 CG LYS B 61 -10.929 8.360 -13.679 1.00 0.78 C ATOM 2603 CD LYS B 61 -11.827 7.376 -14.464 1.00 1.13 C ATOM 2604 CE LYS B 61 -11.276 6.998 -15.851 1.00 1.87 C ATOM 2605 NZ LYS B 61 -11.089 8.174 -16.757 1.00 2.39 N ATOM 0 H LYS B 61 -9.818 8.109 -10.866 1.00 0.47 H new ATOM 0 HA LYS B 61 -10.315 5.940 -12.592 1.00 0.53 H new ATOM 0 HB2 LYS B 61 -8.926 8.619 -12.941 1.00 0.63 H new ATOM 0 HB3 LYS B 61 -9.056 7.487 -14.273 1.00 0.63 H new ATOM 0 HG2 LYS B 61 -11.431 8.631 -12.750 1.00 0.78 H new ATOM 0 HG3 LYS B 61 -10.817 9.275 -14.260 1.00 0.78 H new ATOM 0 HD2 LYS B 61 -11.955 6.468 -13.875 1.00 1.13 H new ATOM 0 HD3 LYS B 61 -12.815 7.819 -14.585 1.00 1.13 H new ATOM 0 HE2 LYS B 61 -10.320 6.488 -15.728 1.00 1.87 H new ATOM 0 HE3 LYS B 61 -11.956 6.289 -16.323 1.00 1.87 H new ATOM 0 HZ1 LYS B 61 -10.749 7.847 -17.684 1.00 2.39 H new ATOM 0 HZ2 LYS B 61 -11.996 8.668 -16.876 1.00 2.39 H new ATOM 0 HZ3 LYS B 61 -10.392 8.825 -16.342 1.00 2.39 H new ATOM 2619 N SER B 62 -7.140 6.333 -11.708 1.00 0.46 N ATOM 2620 CA SER B 62 -5.811 5.691 -11.717 1.00 0.47 C ATOM 2621 C SER B 62 -5.834 4.330 -10.989 1.00 0.44 C ATOM 2622 O SER B 62 -5.043 3.443 -11.326 1.00 0.50 O ATOM 2623 CB SER B 62 -4.750 6.604 -11.083 1.00 0.54 C ATOM 2624 OG SER B 62 -4.675 7.849 -11.758 1.00 0.63 O ATOM 0 H SER B 62 -7.211 7.136 -11.084 1.00 0.46 H new ATOM 0 HA SER B 62 -5.547 5.518 -12.760 1.00 0.47 H new ATOM 0 HB2 SER B 62 -4.990 6.771 -10.033 1.00 0.54 H new ATOM 0 HB3 SER B 62 -3.778 6.112 -11.113 1.00 0.54 H new ATOM 0 HG SER B 62 -3.994 8.411 -11.333 1.00 0.63 H new ATOM 2630 N LEU B 63 -6.752 4.164 -9.998 1.00 0.41 N ATOM 2631 CA LEU B 63 -6.868 2.901 -9.232 1.00 0.44 C ATOM 2632 C LEU B 63 -7.495 1.804 -10.110 1.00 0.47 C ATOM 2633 O LEU B 63 -6.882 0.756 -10.325 1.00 0.57 O ATOM 2634 CB LEU B 63 -7.704 3.059 -7.921 1.00 0.45 C ATOM 2635 CG LEU B 63 -7.559 4.375 -7.123 1.00 0.42 C ATOM 2636 CD1 LEU B 63 -8.401 4.323 -5.846 1.00 0.47 C ATOM 2637 CD2 LEU B 63 -6.098 4.685 -6.788 1.00 0.69 C ATOM 0 H LEU B 63 -7.416 4.885 -9.716 1.00 0.41 H new ATOM 0 HA LEU B 63 -5.856 2.619 -8.941 1.00 0.44 H new ATOM 0 HB2 LEU B 63 -8.756 2.939 -8.179 1.00 0.45 H new ATOM 0 HB3 LEU B 63 -7.443 2.235 -7.257 1.00 0.45 H new ATOM 0 HG LEU B 63 -7.926 5.182 -7.758 1.00 0.42 H new ATOM 0 HD11 LEU B 63 -8.287 5.258 -5.297 1.00 0.47 H new ATOM 0 HD12 LEU B 63 -9.450 4.181 -6.107 1.00 0.47 H new ATOM 0 HD13 LEU B 63 -8.067 3.493 -5.223 1.00 0.47 H new ATOM 0 HD21 LEU B 63 -6.043 5.618 -6.227 1.00 0.69 H new ATOM 0 HD22 LEU B 63 -5.683 3.876 -6.187 1.00 0.69 H new ATOM 0 HD23 LEU B 63 -5.526 4.782 -7.711 1.00 0.69 H new ATOM 2649 N ASP B 64 -8.718 2.071 -10.625 1.00 0.47 N ATOM 2650 CA ASP B 64 -9.442 1.126 -11.490 1.00 0.55 C ATOM 2651 C ASP B 64 -8.955 1.264 -12.947 1.00 0.53 C ATOM 2652 O ASP B 64 -9.552 1.991 -13.751 1.00 0.60 O ATOM 2653 CB ASP B 64 -10.967 1.361 -11.372 1.00 0.66 C ATOM 2654 CG ASP B 64 -11.805 0.306 -12.089 1.00 0.85 C ATOM 2655 OD1 ASP B 64 -11.478 -0.897 -11.978 1.00 1.27 O ATOM 2656 OD2 ASP B 64 -12.792 0.685 -12.757 1.00 1.32 O ATOM 0 H ASP B 64 -9.222 2.941 -10.451 1.00 0.47 H new ATOM 0 HA ASP B 64 -9.237 0.106 -11.166 1.00 0.55 H new ATOM 0 HB2 ASP B 64 -11.243 1.377 -10.318 1.00 0.66 H new ATOM 0 HB3 ASP B 64 -11.208 2.343 -11.780 1.00 0.66 H new ATOM 2661 N VAL B 65 -7.850 0.561 -13.260 1.00 0.53 N ATOM 2662 CA VAL B 65 -7.236 0.585 -14.605 1.00 0.56 C ATOM 2663 C VAL B 65 -7.781 -0.545 -15.515 1.00 0.56 C ATOM 2664 O VAL B 65 -7.803 -0.388 -16.740 1.00 0.61 O ATOM 2665 CB VAL B 65 -5.672 0.522 -14.504 1.00 0.64 C ATOM 2666 CG1 VAL B 65 -5.170 -0.833 -13.978 1.00 0.68 C ATOM 2667 CG2 VAL B 65 -5.005 0.875 -15.841 1.00 0.72 C ATOM 0 H VAL B 65 -7.359 -0.036 -12.594 1.00 0.53 H new ATOM 0 HA VAL B 65 -7.513 1.531 -15.071 1.00 0.56 H new ATOM 0 HB VAL B 65 -5.381 1.276 -13.772 1.00 0.64 H new ATOM 0 HG11 VAL B 65 -4.081 -0.823 -13.928 1.00 0.68 H new ATOM 0 HG12 VAL B 65 -5.578 -1.011 -12.983 1.00 0.68 H new ATOM 0 HG13 VAL B 65 -5.495 -1.627 -14.650 1.00 0.68 H new ATOM 0 HG21 VAL B 65 -3.922 0.821 -15.733 1.00 0.72 H new ATOM 0 HG22 VAL B 65 -5.329 0.170 -16.607 1.00 0.72 H new ATOM 0 HG23 VAL B 65 -5.290 1.885 -16.134 1.00 0.72 H new ATOM 2677 N ASN B 66 -8.209 -1.681 -14.911 1.00 0.56 N ATOM 2678 CA ASN B 66 -8.755 -2.830 -15.670 1.00 0.60 C ATOM 2679 C ASN B 66 -10.159 -2.511 -16.241 1.00 0.61 C ATOM 2680 O ASN B 66 -10.522 -3.032 -17.300 1.00 0.68 O ATOM 2681 CB ASN B 66 -8.798 -4.093 -14.778 1.00 0.65 C ATOM 2682 CG ASN B 66 -9.163 -5.369 -15.540 1.00 0.90 C ATOM 2683 OD1 ASN B 66 -8.297 -6.029 -16.114 1.00 1.38 O ATOM 2684 ND2 ASN B 66 -10.449 -5.725 -15.550 1.00 1.32 N ATOM 0 H ASN B 66 -8.186 -1.824 -13.901 1.00 0.56 H new ATOM 0 HA ASN B 66 -8.092 -3.023 -16.514 1.00 0.60 H new ATOM 0 HB2 ASN B 66 -7.825 -4.228 -14.306 1.00 0.65 H new ATOM 0 HB3 ASN B 66 -9.522 -3.938 -13.978 1.00 0.65 H new ATOM 0 HD21 ASN B 66 -10.741 -6.568 -16.044 1.00 1.32 H new ATOM 0 HD22 ASN B 66 -11.140 -5.154 -15.063 1.00 1.32 H new ATOM 2691 N GLN B 67 -10.938 -1.663 -15.520 1.00 0.59 N ATOM 2692 CA GLN B 67 -12.296 -1.237 -15.931 1.00 0.64 C ATOM 2693 C GLN B 67 -13.305 -2.405 -15.911 1.00 0.64 C ATOM 2694 O GLN B 67 -13.672 -2.946 -16.960 1.00 0.77 O ATOM 2695 CB GLN B 67 -12.282 -0.541 -17.318 1.00 0.75 C ATOM 2696 CG GLN B 67 -11.400 0.707 -17.381 1.00 0.96 C ATOM 2697 CD GLN B 67 -11.593 1.515 -18.663 1.00 1.28 C ATOM 2698 OE1 GLN B 67 -12.413 2.433 -18.706 1.00 2.02 O ATOM 2699 NE2 GLN B 67 -10.846 1.178 -19.719 1.00 1.87 N ATOM 0 H GLN B 67 -10.638 -1.256 -14.634 1.00 0.59 H new ATOM 0 HA GLN B 67 -12.629 -0.508 -15.192 1.00 0.64 H new ATOM 0 HB2 GLN B 67 -11.938 -1.254 -18.067 1.00 0.75 H new ATOM 0 HB3 GLN B 67 -13.302 -0.266 -17.585 1.00 0.75 H new ATOM 0 HG2 GLN B 67 -11.618 1.342 -16.522 1.00 0.96 H new ATOM 0 HG3 GLN B 67 -10.354 0.410 -17.300 1.00 0.96 H new ATOM 0 HE21 GLN B 67 -10.177 0.412 -19.647 1.00 1.87 H new ATOM 0 HE22 GLN B 67 -10.945 1.687 -20.597 1.00 1.87 H new ATOM 2708 N ASP B 68 -13.727 -2.801 -14.692 1.00 0.65 N ATOM 2709 CA ASP B 68 -14.714 -3.889 -14.501 1.00 0.72 C ATOM 2710 C ASP B 68 -15.483 -3.728 -13.160 1.00 0.79 C ATOM 2711 O ASP B 68 -16.006 -4.712 -12.622 1.00 1.30 O ATOM 2712 CB ASP B 68 -14.003 -5.266 -14.565 1.00 0.76 C ATOM 2713 CG ASP B 68 -14.927 -6.403 -14.985 1.00 0.97 C ATOM 2714 OD1 ASP B 68 -15.586 -6.995 -14.104 1.00 1.25 O ATOM 2715 OD2 ASP B 68 -14.986 -6.704 -16.198 1.00 1.16 O ATOM 0 H ASP B 68 -13.399 -2.383 -13.821 1.00 0.65 H new ATOM 0 HA ASP B 68 -15.446 -3.831 -15.306 1.00 0.72 H new ATOM 0 HB2 ASP B 68 -13.171 -5.205 -15.267 1.00 0.76 H new ATOM 0 HB3 ASP B 68 -13.579 -5.494 -13.587 1.00 0.76 H new ATOM 2720 N SER B 69 -15.570 -2.476 -12.633 1.00 0.66 N ATOM 2721 CA SER B 69 -16.261 -2.173 -11.358 1.00 0.71 C ATOM 2722 C SER B 69 -15.733 -3.034 -10.178 1.00 0.71 C ATOM 2723 O SER B 69 -16.507 -3.466 -9.315 1.00 1.26 O ATOM 2724 CB SER B 69 -17.786 -2.336 -11.529 1.00 0.86 C ATOM 2725 OG SER B 69 -18.488 -1.787 -10.425 1.00 1.35 O ATOM 0 H SER B 69 -15.164 -1.655 -13.081 1.00 0.66 H new ATOM 0 HA SER B 69 -16.043 -1.136 -11.104 1.00 0.71 H new ATOM 0 HB2 SER B 69 -18.106 -1.844 -12.448 1.00 0.86 H new ATOM 0 HB3 SER B 69 -18.032 -3.393 -11.631 1.00 0.86 H new ATOM 0 HG SER B 69 -18.117 -2.144 -9.591 1.00 1.35 H new ATOM 2731 N GLU B 70 -14.403 -3.259 -10.148 1.00 0.69 N ATOM 2732 CA GLU B 70 -13.757 -4.060 -9.092 1.00 0.75 C ATOM 2733 C GLU B 70 -12.405 -3.441 -8.700 1.00 0.62 C ATOM 2734 O GLU B 70 -11.508 -3.323 -9.546 1.00 0.78 O ATOM 2735 CB GLU B 70 -13.557 -5.521 -9.560 1.00 1.11 C ATOM 2736 CG GLU B 70 -14.845 -6.336 -9.675 1.00 1.39 C ATOM 2737 CD GLU B 70 -14.601 -7.765 -10.139 1.00 1.87 C ATOM 2738 OE1 GLU B 70 -14.218 -8.605 -9.299 1.00 2.40 O ATOM 2739 OE2 GLU B 70 -14.790 -8.040 -11.345 1.00 2.37 O ATOM 0 H GLU B 70 -13.755 -2.895 -10.847 1.00 0.69 H new ATOM 0 HA GLU B 70 -14.409 -4.062 -8.219 1.00 0.75 H new ATOM 0 HB2 GLU B 70 -13.060 -5.513 -10.530 1.00 1.11 H new ATOM 0 HB3 GLU B 70 -12.886 -6.023 -8.863 1.00 1.11 H new ATOM 0 HG2 GLU B 70 -15.346 -6.354 -8.707 1.00 1.39 H new ATOM 0 HG3 GLU B 70 -15.520 -5.842 -10.374 1.00 1.39 H new ATOM 2746 N LEU B 71 -12.269 -3.036 -7.421 1.00 0.54 N ATOM 2747 CA LEU B 71 -11.024 -2.436 -6.907 1.00 0.51 C ATOM 2748 C LEU B 71 -10.206 -3.484 -6.136 1.00 0.50 C ATOM 2749 O LEU B 71 -10.118 -3.446 -4.902 1.00 0.52 O ATOM 2750 CB LEU B 71 -11.323 -1.209 -6.011 1.00 0.58 C ATOM 2751 CG LEU B 71 -11.556 0.132 -6.742 1.00 0.78 C ATOM 2752 CD1 LEU B 71 -12.874 0.126 -7.526 1.00 1.13 C ATOM 2753 CD2 LEU B 71 -11.520 1.293 -5.749 1.00 0.92 C ATOM 0 H LEU B 71 -13.010 -3.115 -6.724 1.00 0.54 H new ATOM 0 HA LEU B 71 -10.437 -2.091 -7.758 1.00 0.51 H new ATOM 0 HB2 LEU B 71 -12.206 -1.430 -5.412 1.00 0.58 H new ATOM 0 HB3 LEU B 71 -10.492 -1.081 -5.318 1.00 0.58 H new ATOM 0 HG LEU B 71 -10.749 0.264 -7.463 1.00 0.78 H new ATOM 0 HD11 LEU B 71 -13.004 1.085 -8.027 1.00 1.13 H new ATOM 0 HD12 LEU B 71 -12.852 -0.671 -8.269 1.00 1.13 H new ATOM 0 HD13 LEU B 71 -13.705 -0.040 -6.840 1.00 1.13 H new ATOM 0 HD21 LEU B 71 -11.686 2.231 -6.279 1.00 0.92 H new ATOM 0 HD22 LEU B 71 -12.301 1.156 -5.001 1.00 0.92 H new ATOM 0 HD23 LEU B 71 -10.548 1.321 -5.257 1.00 0.92 H new ATOM 2765 N LYS B 72 -9.618 -4.435 -6.885 1.00 0.52 N ATOM 2766 CA LYS B 72 -8.777 -5.500 -6.305 1.00 0.54 C ATOM 2767 C LYS B 72 -7.496 -4.881 -5.710 1.00 0.48 C ATOM 2768 O LYS B 72 -7.125 -3.779 -6.100 1.00 0.46 O ATOM 2769 CB LYS B 72 -8.451 -6.547 -7.396 1.00 0.60 C ATOM 2770 CG LYS B 72 -7.719 -7.793 -6.900 1.00 0.78 C ATOM 2771 CD LYS B 72 -7.416 -8.769 -8.040 1.00 0.91 C ATOM 2772 CE LYS B 72 -6.295 -9.742 -7.687 1.00 1.29 C ATOM 2773 NZ LYS B 72 -4.967 -9.065 -7.576 1.00 1.81 N ATOM 0 H LYS B 72 -9.711 -4.488 -7.899 1.00 0.52 H new ATOM 0 HA LYS B 72 -9.310 -6.005 -5.499 1.00 0.54 H new ATOM 0 HB2 LYS B 72 -9.382 -6.856 -7.871 1.00 0.60 H new ATOM 0 HB3 LYS B 72 -7.844 -6.070 -8.166 1.00 0.60 H new ATOM 0 HG2 LYS B 72 -6.787 -7.498 -6.417 1.00 0.78 H new ATOM 0 HG3 LYS B 72 -8.325 -8.294 -6.145 1.00 0.78 H new ATOM 0 HD2 LYS B 72 -8.318 -9.330 -8.284 1.00 0.91 H new ATOM 0 HD3 LYS B 72 -7.139 -8.207 -8.932 1.00 0.91 H new ATOM 0 HE2 LYS B 72 -6.529 -10.234 -6.743 1.00 1.29 H new ATOM 0 HE3 LYS B 72 -6.240 -10.521 -8.448 1.00 1.29 H new ATOM 0 HZ1 LYS B 72 -4.211 -9.779 -7.589 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 -4.842 -8.413 -8.377 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 -4.923 -8.531 -6.685 1.00 1.81 H new ATOM 2787 N PHE B 73 -6.825 -5.584 -4.770 1.00 0.51 N ATOM 2788 CA PHE B 73 -5.582 -5.065 -4.129 1.00 0.49 C ATOM 2789 C PHE B 73 -4.516 -4.594 -5.152 1.00 0.46 C ATOM 2790 O PHE B 73 -3.690 -3.746 -4.815 1.00 0.46 O ATOM 2791 CB PHE B 73 -4.972 -6.099 -3.152 1.00 0.55 C ATOM 2792 CG PHE B 73 -5.200 -5.760 -1.688 1.00 0.69 C ATOM 2793 CD1 PHE B 73 -4.323 -4.920 -1.009 1.00 0.89 C ATOM 2794 CD2 PHE B 73 -6.291 -6.276 -0.999 1.00 0.90 C ATOM 2795 CE1 PHE B 73 -4.533 -4.605 0.322 1.00 1.14 C ATOM 2796 CE2 PHE B 73 -6.500 -5.962 0.330 1.00 1.15 C ATOM 2797 CZ PHE B 73 -5.622 -5.126 0.991 1.00 1.23 C ATOM 0 H PHE B 73 -7.115 -6.504 -4.437 1.00 0.51 H new ATOM 0 HA PHE B 73 -5.889 -4.185 -3.563 1.00 0.49 H new ATOM 0 HB2 PHE B 73 -5.400 -7.080 -3.360 1.00 0.55 H new ATOM 0 HB3 PHE B 73 -3.900 -6.173 -3.337 1.00 0.55 H new ATOM 0 HD1 PHE B 73 -3.469 -4.509 -1.527 1.00 0.89 H new ATOM 0 HD2 PHE B 73 -6.983 -6.930 -1.508 1.00 0.90 H new ATOM 0 HE1 PHE B 73 -3.845 -3.951 0.837 1.00 1.14 H new ATOM 0 HE2 PHE B 73 -7.352 -6.371 0.853 1.00 1.15 H new ATOM 0 HZ PHE B 73 -5.787 -4.880 2.030 1.00 1.23 H new ATOM 2807 N ASN B 74 -4.528 -5.159 -6.383 1.00 0.47 N ATOM 2808 CA ASN B 74 -3.592 -4.747 -7.454 1.00 0.50 C ATOM 2809 C ASN B 74 -4.031 -3.386 -8.061 1.00 0.48 C ATOM 2810 O ASN B 74 -3.185 -2.580 -8.448 1.00 0.54 O ATOM 2811 CB ASN B 74 -3.511 -5.833 -8.552 1.00 0.55 C ATOM 2812 CG ASN B 74 -2.331 -5.645 -9.507 1.00 0.63 C ATOM 2813 OD1 ASN B 74 -2.419 -4.879 -10.467 1.00 0.99 O ATOM 2814 ND2 ASN B 74 -1.221 -6.348 -9.261 1.00 0.93 N ATOM 0 H ASN B 74 -5.174 -5.899 -6.657 1.00 0.47 H new ATOM 0 HA ASN B 74 -2.600 -4.627 -7.020 1.00 0.50 H new ATOM 0 HB2 ASN B 74 -3.434 -6.812 -8.079 1.00 0.55 H new ATOM 0 HB3 ASN B 74 -4.438 -5.829 -9.126 1.00 0.55 H new ATOM 0 HD21 ASN B 74 -0.413 -6.259 -9.878 1.00 0.93 H new ATOM 0 HD22 ASN B 74 -1.182 -6.974 -8.457 1.00 0.93 H new ATOM 2821 N GLU B 75 -5.363 -3.157 -8.150 1.00 0.44 N ATOM 2822 CA GLU B 75 -5.935 -1.894 -8.671 1.00 0.47 C ATOM 2823 C GLU B 75 -5.997 -0.825 -7.550 1.00 0.41 C ATOM 2824 O GLU B 75 -5.738 0.354 -7.799 1.00 0.42 O ATOM 2825 CB GLU B 75 -7.346 -2.139 -9.271 1.00 0.54 C ATOM 2826 CG GLU B 75 -7.356 -2.715 -10.692 1.00 0.64 C ATOM 2827 CD GLU B 75 -6.835 -4.142 -10.784 1.00 0.76 C ATOM 2828 OE1 GLU B 75 -7.643 -5.081 -10.624 1.00 0.91 O ATOM 2829 OE2 GLU B 75 -5.622 -4.315 -11.026 1.00 0.93 O ATOM 0 H GLU B 75 -6.066 -3.838 -7.864 1.00 0.44 H new ATOM 0 HA GLU B 75 -5.286 -1.524 -9.465 1.00 0.47 H new ATOM 0 HB2 GLU B 75 -7.890 -2.820 -8.616 1.00 0.54 H new ATOM 0 HB3 GLU B 75 -7.892 -1.195 -9.274 1.00 0.54 H new ATOM 0 HG2 GLU B 75 -8.375 -2.685 -11.078 1.00 0.64 H new ATOM 0 HG3 GLU B 75 -6.752 -2.076 -11.336 1.00 0.64 H new ATOM 2836 N TYR B 76 -6.337 -1.259 -6.315 1.00 0.41 N ATOM 2837 CA TYR B 76 -6.402 -0.377 -5.128 1.00 0.39 C ATOM 2838 C TYR B 76 -4.976 -0.002 -4.636 1.00 0.36 C ATOM 2839 O TYR B 76 -4.821 0.930 -3.844 1.00 0.43 O ATOM 2840 CB TYR B 76 -7.201 -1.088 -4.003 1.00 0.43 C ATOM 2841 CG TYR B 76 -7.574 -0.234 -2.787 1.00 0.44 C ATOM 2842 CD1 TYR B 76 -8.382 0.895 -2.915 1.00 0.50 C ATOM 2843 CD2 TYR B 76 -7.137 -0.574 -1.502 1.00 0.52 C ATOM 2844 CE1 TYR B 76 -8.733 1.651 -1.813 1.00 0.58 C ATOM 2845 CE2 TYR B 76 -7.492 0.179 -0.399 1.00 0.59 C ATOM 2846 CZ TYR B 76 -8.288 1.290 -0.560 1.00 0.59 C ATOM 2847 OH TYR B 76 -8.645 2.040 0.539 1.00 0.71 O ATOM 0 H TYR B 76 -6.574 -2.230 -6.114 1.00 0.41 H new ATOM 0 HA TYR B 76 -6.910 0.548 -5.400 1.00 0.39 H new ATOM 0 HB2 TYR B 76 -8.119 -1.486 -4.435 1.00 0.43 H new ATOM 0 HB3 TYR B 76 -6.617 -1.940 -3.656 1.00 0.43 H new ATOM 0 HD1 TYR B 76 -8.740 1.184 -3.892 1.00 0.50 H new ATOM 0 HD2 TYR B 76 -6.509 -1.443 -1.369 1.00 0.52 H new ATOM 0 HE1 TYR B 76 -9.356 2.525 -1.934 1.00 0.58 H new ATOM 0 HE2 TYR B 76 -7.146 -0.103 0.585 1.00 0.59 H new ATOM 0 HH TYR B 76 -8.249 1.648 1.345 1.00 0.71 H new ATOM 2857 N TRP B 77 -3.945 -0.749 -5.117 1.00 0.39 N ATOM 2858 CA TRP B 77 -2.517 -0.525 -4.775 1.00 0.40 C ATOM 2859 C TRP B 77 -2.057 0.932 -5.036 1.00 0.35 C ATOM 2860 O TRP B 77 -1.191 1.435 -4.313 1.00 0.37 O ATOM 2861 CB TRP B 77 -1.659 -1.571 -5.549 1.00 0.58 C ATOM 2862 CG TRP B 77 -0.206 -1.246 -5.815 1.00 0.48 C ATOM 2863 CD1 TRP B 77 0.783 -1.026 -4.897 1.00 0.56 C ATOM 2864 CD2 TRP B 77 0.421 -1.146 -7.105 1.00 0.74 C ATOM 2865 NE1 TRP B 77 1.979 -0.800 -5.536 1.00 0.79 N ATOM 2866 CE2 TRP B 77 1.779 -0.865 -6.890 1.00 0.94 C ATOM 2867 CE3 TRP B 77 -0.039 -1.265 -8.421 1.00 0.98 C ATOM 2868 CZ2 TRP B 77 2.681 -0.706 -7.938 1.00 1.34 C ATOM 2869 CZ3 TRP B 77 0.856 -1.105 -9.460 1.00 1.37 C ATOM 2870 CH2 TRP B 77 2.204 -0.827 -9.213 1.00 1.54 C ATOM 0 H TRP B 77 -4.085 -1.530 -5.758 1.00 0.39 H new ATOM 0 HA TRP B 77 -2.380 -0.666 -3.703 1.00 0.40 H new ATOM 0 HB2 TRP B 77 -1.694 -2.508 -4.993 1.00 0.58 H new ATOM 0 HB3 TRP B 77 -2.141 -1.752 -6.510 1.00 0.58 H new ATOM 0 HD1 TRP B 77 0.645 -1.029 -3.826 1.00 0.56 H new ATOM 0 HE1 TRP B 77 2.871 -0.614 -5.077 1.00 0.79 H new ATOM 0 HE3 TRP B 77 -1.079 -1.479 -8.621 1.00 0.98 H new ATOM 0 HZ2 TRP B 77 3.723 -0.494 -7.750 1.00 1.34 H new ATOM 0 HZ3 TRP B 77 0.510 -1.196 -10.479 1.00 1.37 H new ATOM 0 HH2 TRP B 77 2.881 -0.706 -10.046 1.00 1.54 H new ATOM 2881 N ARG B 78 -2.643 1.611 -6.051 1.00 0.37 N ATOM 2882 CA ARG B 78 -2.284 3.012 -6.369 1.00 0.41 C ATOM 2883 C ARG B 78 -2.680 3.969 -5.224 1.00 0.38 C ATOM 2884 O ARG B 78 -1.964 4.939 -4.961 1.00 0.45 O ATOM 2885 CB ARG B 78 -2.936 3.472 -7.696 1.00 0.49 C ATOM 2886 CG ARG B 78 -2.152 3.079 -8.956 1.00 0.68 C ATOM 2887 CD ARG B 78 -0.939 3.987 -9.207 1.00 0.88 C ATOM 2888 NE ARG B 78 -1.271 5.161 -10.038 1.00 1.17 N ATOM 2889 CZ ARG B 78 -1.025 5.291 -11.366 1.00 1.72 C ATOM 2890 NH1 ARG B 78 -0.508 4.288 -12.091 1.00 2.14 N ATOM 2891 NH2 ARG B 78 -1.326 6.437 -11.980 1.00 2.15 N ATOM 0 H ARG B 78 -3.360 1.215 -6.658 1.00 0.37 H new ATOM 0 HA ARG B 78 -1.201 3.046 -6.486 1.00 0.41 H new ATOM 0 HB2 ARG B 78 -3.939 3.049 -7.760 1.00 0.49 H new ATOM 0 HB3 ARG B 78 -3.048 4.556 -7.675 1.00 0.49 H new ATOM 0 HG2 ARG B 78 -1.815 2.047 -8.862 1.00 0.68 H new ATOM 0 HG3 ARG B 78 -2.816 3.120 -9.819 1.00 0.68 H new ATOM 0 HD2 ARG B 78 -0.539 4.325 -8.251 1.00 0.88 H new ATOM 0 HD3 ARG B 78 -0.153 3.411 -9.696 1.00 0.88 H new ATOM 0 HE ARG B 78 -1.727 5.945 -9.572 1.00 1.17 H new ATOM 0 HH11 ARG B 78 -0.289 3.397 -11.645 1.00 2.14 H new ATOM 0 HH12 ARG B 78 -0.334 4.416 -13.088 1.00 2.14 H new ATOM 0 HH21 ARG B 78 -1.737 7.206 -11.451 1.00 2.15 H new ATOM 0 HH22 ARG B 78 -1.145 6.544 -12.978 1.00 2.15 H new ATOM 2905 N LEU B 79 -3.818 3.691 -4.547 1.00 0.33 N ATOM 2906 CA LEU B 79 -4.283 4.526 -3.421 1.00 0.34 C ATOM 2907 C LEU B 79 -3.482 4.226 -2.141 1.00 0.32 C ATOM 2908 O LEU B 79 -3.244 5.140 -1.348 1.00 0.36 O ATOM 2909 CB LEU B 79 -5.793 4.333 -3.160 1.00 0.36 C ATOM 2910 CG LEU B 79 -6.493 5.466 -2.363 1.00 0.41 C ATOM 2911 CD1 LEU B 79 -6.518 6.775 -3.157 1.00 0.49 C ATOM 2912 CD2 LEU B 79 -7.908 5.052 -1.958 1.00 0.48 C ATOM 0 H LEU B 79 -4.426 2.900 -4.761 1.00 0.33 H new ATOM 0 HA LEU B 79 -4.116 5.566 -3.701 1.00 0.34 H new ATOM 0 HB2 LEU B 79 -6.297 4.226 -4.120 1.00 0.36 H new ATOM 0 HB3 LEU B 79 -5.932 3.396 -2.620 1.00 0.36 H new ATOM 0 HG LEU B 79 -5.913 5.638 -1.456 1.00 0.41 H new ATOM 0 HD11 LEU B 79 -7.015 7.547 -2.570 1.00 0.49 H new ATOM 0 HD12 LEU B 79 -5.497 7.087 -3.376 1.00 0.49 H new ATOM 0 HD13 LEU B 79 -7.060 6.624 -4.091 1.00 0.49 H new ATOM 0 HD21 LEU B 79 -8.379 5.862 -1.401 1.00 0.48 H new ATOM 0 HD22 LEU B 79 -8.494 4.838 -2.852 1.00 0.48 H new ATOM 0 HD23 LEU B 79 -7.861 4.161 -1.333 1.00 0.48 H new ATOM 2924 N ILE B 80 -3.053 2.952 -1.950 1.00 0.34 N ATOM 2925 CA ILE B 80 -2.252 2.552 -0.764 1.00 0.37 C ATOM 2926 C ILE B 80 -0.944 3.382 -0.695 1.00 0.36 C ATOM 2927 O ILE B 80 -0.490 3.730 0.401 1.00 0.39 O ATOM 2928 CB ILE B 80 -1.932 1.009 -0.755 1.00 0.44 C ATOM 2929 CG1 ILE B 80 -3.237 0.157 -0.752 1.00 0.47 C ATOM 2930 CG2 ILE B 80 -1.031 0.608 0.431 1.00 0.54 C ATOM 2931 CD1 ILE B 80 -4.172 0.387 0.433 1.00 0.56 C ATOM 0 H ILE B 80 -3.247 2.188 -2.598 1.00 0.34 H new ATOM 0 HA ILE B 80 -2.853 2.759 0.122 1.00 0.37 H new ATOM 0 HB ILE B 80 -1.384 0.802 -1.674 1.00 0.44 H new ATOM 0 HG12 ILE B 80 -3.786 0.363 -1.671 1.00 0.47 H new ATOM 0 HG13 ILE B 80 -2.961 -0.897 -0.775 1.00 0.47 H new ATOM 0 HG21 ILE B 80 -0.838 -0.464 0.395 1.00 0.54 H new ATOM 0 HG22 ILE B 80 -0.087 1.149 0.370 1.00 0.54 H new ATOM 0 HG23 ILE B 80 -1.531 0.855 1.368 1.00 0.54 H new ATOM 0 HD11 ILE B 80 -5.047 -0.255 0.336 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -3.650 0.150 1.360 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -4.487 1.430 0.450 1.00 0.56 H new ATOM 2943 N GLY B 81 -0.350 3.686 -1.875 1.00 0.36 N ATOM 2944 CA GLY B 81 0.859 4.507 -1.942 1.00 0.39 C ATOM 2945 C GLY B 81 0.580 5.965 -1.586 1.00 0.37 C ATOM 2946 O GLY B 81 1.407 6.613 -0.936 1.00 0.42 O ATOM 0 H GLY B 81 -0.695 3.372 -2.782 1.00 0.36 H new ATOM 0 HA2 GLY B 81 1.609 4.105 -1.261 1.00 0.39 H new ATOM 0 HA3 GLY B 81 1.279 4.453 -2.946 1.00 0.39 H new ATOM 2950 N GLU B 82 -0.595 6.483 -2.026 1.00 0.34 N ATOM 2951 CA GLU B 82 -1.021 7.866 -1.721 1.00 0.36 C ATOM 2952 C GLU B 82 -1.336 8.016 -0.218 1.00 0.33 C ATOM 2953 O GLU B 82 -1.162 9.102 0.343 1.00 0.40 O ATOM 2954 CB GLU B 82 -2.254 8.277 -2.561 1.00 0.41 C ATOM 2955 CG GLU B 82 -1.980 8.484 -4.057 1.00 0.49 C ATOM 2956 CD GLU B 82 -1.096 9.690 -4.358 1.00 0.61 C ATOM 2957 OE1 GLU B 82 -1.521 10.830 -4.065 1.00 0.91 O ATOM 2958 OE2 GLU B 82 0.018 9.492 -4.892 1.00 0.79 O ATOM 0 H GLU B 82 -1.262 5.960 -2.593 1.00 0.34 H new ATOM 0 HA GLU B 82 -0.196 8.529 -1.982 1.00 0.36 H new ATOM 0 HB2 GLU B 82 -3.022 7.511 -2.450 1.00 0.41 H new ATOM 0 HB3 GLU B 82 -2.663 9.200 -2.151 1.00 0.41 H new ATOM 0 HG2 GLU B 82 -1.506 7.588 -4.458 1.00 0.49 H new ATOM 0 HG3 GLU B 82 -2.930 8.602 -4.578 1.00 0.49 H new ATOM 2965 N LEU B 83 -1.812 6.917 0.422 1.00 0.33 N ATOM 2966 CA LEU B 83 -2.105 6.908 1.871 1.00 0.35 C ATOM 2967 C LEU B 83 -0.813 7.135 2.681 1.00 0.37 C ATOM 2968 O LEU B 83 -0.817 7.886 3.656 1.00 0.45 O ATOM 2969 CB LEU B 83 -2.768 5.569 2.310 1.00 0.42 C ATOM 2970 CG LEU B 83 -4.312 5.579 2.422 1.00 0.51 C ATOM 2971 CD1 LEU B 83 -4.979 5.392 1.060 1.00 0.69 C ATOM 2972 CD2 LEU B 83 -4.788 4.513 3.415 1.00 0.63 C ATOM 0 H LEU B 83 -1.999 6.030 -0.045 1.00 0.33 H new ATOM 0 HA LEU B 83 -2.806 7.719 2.069 1.00 0.35 H new ATOM 0 HB2 LEU B 83 -2.480 4.794 1.599 1.00 0.42 H new ATOM 0 HB3 LEU B 83 -2.356 5.283 3.277 1.00 0.42 H new ATOM 0 HG LEU B 83 -4.609 6.558 2.797 1.00 0.51 H new ATOM 0 HD11 LEU B 83 -6.062 5.405 1.181 1.00 0.69 H new ATOM 0 HD12 LEU B 83 -4.679 6.201 0.394 1.00 0.69 H new ATOM 0 HD13 LEU B 83 -4.673 4.437 0.633 1.00 0.69 H new ATOM 0 HD21 LEU B 83 -5.876 4.536 3.480 1.00 0.63 H new ATOM 0 HD22 LEU B 83 -4.465 3.529 3.075 1.00 0.63 H new ATOM 0 HD23 LEU B 83 -4.362 4.715 4.398 1.00 0.63 H new ATOM 2984 N ALA B 84 0.291 6.484 2.255 1.00 0.38 N ATOM 2985 CA ALA B 84 1.597 6.606 2.931 1.00 0.44 C ATOM 2986 C ALA B 84 2.332 7.921 2.595 1.00 0.45 C ATOM 2987 O ALA B 84 3.068 8.443 3.436 1.00 0.55 O ATOM 2988 CB ALA B 84 2.483 5.417 2.583 1.00 0.55 C ATOM 0 H ALA B 84 0.301 5.867 1.443 1.00 0.38 H new ATOM 0 HA ALA B 84 1.392 6.619 4.002 1.00 0.44 H new ATOM 0 HB1 ALA B 84 3.444 5.519 3.088 1.00 0.55 H new ATOM 0 HB2 ALA B 84 1.999 4.496 2.907 1.00 0.55 H new ATOM 0 HB3 ALA B 84 2.641 5.384 1.505 1.00 0.55 H new ATOM 2994 N LYS B 85 2.137 8.447 1.369 1.00 0.41 N ATOM 2995 CA LYS B 85 2.799 9.696 0.936 1.00 0.45 C ATOM 2996 C LYS B 85 2.120 10.957 1.519 1.00 0.47 C ATOM 2997 O LYS B 85 2.777 11.990 1.668 1.00 0.57 O ATOM 2998 CB LYS B 85 2.830 9.787 -0.609 1.00 0.49 C ATOM 2999 CG LYS B 85 3.952 10.675 -1.165 1.00 0.57 C ATOM 3000 CD LYS B 85 3.680 11.176 -2.590 1.00 0.66 C ATOM 3001 CE LYS B 85 3.929 10.114 -3.668 1.00 0.79 C ATOM 3002 NZ LYS B 85 2.814 9.122 -3.775 1.00 1.10 N ATOM 0 H LYS B 85 1.530 8.029 0.664 1.00 0.41 H new ATOM 0 HA LYS B 85 3.818 9.661 1.322 1.00 0.45 H new ATOM 0 HB2 LYS B 85 2.940 8.783 -1.019 1.00 0.49 H new ATOM 0 HB3 LYS B 85 1.871 10.171 -0.958 1.00 0.49 H new ATOM 0 HG2 LYS B 85 4.088 11.532 -0.506 1.00 0.57 H new ATOM 0 HG3 LYS B 85 4.887 10.115 -1.156 1.00 0.57 H new ATOM 0 HD2 LYS B 85 2.646 11.515 -2.657 1.00 0.66 H new ATOM 0 HD3 LYS B 85 4.313 12.041 -2.790 1.00 0.66 H new ATOM 0 HE2 LYS B 85 4.065 10.606 -4.631 1.00 0.79 H new ATOM 0 HE3 LYS B 85 4.857 9.588 -3.445 1.00 0.79 H new ATOM 0 HZ1 LYS B 85 2.761 8.763 -4.750 1.00 1.10 H new ATOM 0 HZ2 LYS B 85 2.990 8.330 -3.124 1.00 1.10 H new ATOM 0 HZ3 LYS B 85 1.915 9.582 -3.526 1.00 1.10 H new ATOM 3016 N GLU B 86 0.809 10.872 1.849 1.00 0.42 N ATOM 3017 CA GLU B 86 0.051 12.025 2.389 1.00 0.46 C ATOM 3018 C GLU B 86 -0.043 12.031 3.942 1.00 0.50 C ATOM 3019 O GLU B 86 -0.830 12.803 4.499 1.00 0.81 O ATOM 3020 CB GLU B 86 -1.368 12.063 1.765 1.00 0.52 C ATOM 3021 CG GLU B 86 -1.400 12.259 0.242 1.00 0.59 C ATOM 3022 CD GLU B 86 -0.944 13.642 -0.206 1.00 1.01 C ATOM 3023 OE1 GLU B 86 -1.769 14.579 -0.175 1.00 1.48 O ATOM 3024 OE2 GLU B 86 0.239 13.785 -0.579 1.00 1.68 O ATOM 0 H GLU B 86 0.257 10.020 1.751 1.00 0.42 H new ATOM 0 HA GLU B 86 0.606 12.922 2.112 1.00 0.46 H new ATOM 0 HB2 GLU B 86 -1.881 11.132 2.008 1.00 0.52 H new ATOM 0 HB3 GLU B 86 -1.933 12.869 2.232 1.00 0.52 H new ATOM 0 HG2 GLU B 86 -0.764 11.507 -0.226 1.00 0.59 H new ATOM 0 HG3 GLU B 86 -2.415 12.087 -0.117 1.00 0.59 H new ATOM 3031 N ILE B 87 0.764 11.200 4.649 1.00 0.48 N ATOM 3032 CA ILE B 87 0.737 11.159 6.129 1.00 0.51 C ATOM 3033 C ILE B 87 1.673 12.237 6.735 1.00 0.53 C ATOM 3034 O ILE B 87 1.257 12.971 7.637 1.00 0.58 O ATOM 3035 CB ILE B 87 1.070 9.711 6.679 1.00 0.56 C ATOM 3036 CG1 ILE B 87 0.521 9.486 8.123 1.00 0.61 C ATOM 3037 CG2 ILE B 87 2.565 9.359 6.589 1.00 0.62 C ATOM 3038 CD1 ILE B 87 1.138 10.345 9.220 1.00 0.63 C ATOM 0 H ILE B 87 1.432 10.558 4.223 1.00 0.48 H new ATOM 0 HA ILE B 87 -0.279 11.392 6.448 1.00 0.51 H new ATOM 0 HB ILE B 87 0.547 9.021 6.017 1.00 0.56 H new ATOM 0 HG12 ILE B 87 -0.554 9.665 8.112 1.00 0.61 H new ATOM 0 HG13 ILE B 87 0.667 8.438 8.386 1.00 0.61 H new ATOM 0 HG21 ILE B 87 2.727 8.355 6.981 1.00 0.62 H new ATOM 0 HG22 ILE B 87 2.886 9.398 5.548 1.00 0.62 H new ATOM 0 HG23 ILE B 87 3.143 10.074 7.174 1.00 0.62 H new ATOM 0 HD11 ILE B 87 0.677 10.099 10.177 1.00 0.63 H new ATOM 0 HD12 ILE B 87 2.210 10.153 9.273 1.00 0.63 H new ATOM 0 HD13 ILE B 87 0.969 11.398 8.996 1.00 0.63 H new ATOM 3050 N ARG B 88 2.917 12.346 6.213 1.00 0.57 N ATOM 3051 CA ARG B 88 3.905 13.319 6.721 1.00 0.67 C ATOM 3052 C ARG B 88 4.007 14.567 5.822 1.00 0.67 C ATOM 3053 O ARG B 88 4.284 15.660 6.325 1.00 0.84 O ATOM 3054 CB ARG B 88 5.295 12.643 6.926 1.00 0.75 C ATOM 3055 CG ARG B 88 6.208 12.515 5.686 1.00 0.82 C ATOM 3056 CD ARG B 88 5.963 11.239 4.881 1.00 1.05 C ATOM 3057 NE ARG B 88 6.854 11.136 3.711 1.00 1.17 N ATOM 3058 CZ ARG B 88 6.793 10.168 2.774 1.00 1.26 C ATOM 3059 NH1 ARG B 88 5.915 9.160 2.868 1.00 1.64 N ATOM 3060 NH2 ARG B 88 7.627 10.209 1.734 1.00 1.55 N ATOM 0 H ARG B 88 3.257 11.772 5.442 1.00 0.57 H new ATOM 0 HA ARG B 88 3.552 13.664 7.693 1.00 0.67 H new ATOM 0 HB2 ARG B 88 5.836 13.206 7.687 1.00 0.75 H new ATOM 0 HB3 ARG B 88 5.129 11.643 7.328 1.00 0.75 H new ATOM 0 HG2 ARG B 88 6.054 13.379 5.040 1.00 0.82 H new ATOM 0 HG3 ARG B 88 7.249 12.539 6.007 1.00 0.82 H new ATOM 0 HD2 ARG B 88 6.111 10.372 5.525 1.00 1.05 H new ATOM 0 HD3 ARG B 88 4.925 11.216 4.548 1.00 1.05 H new ATOM 0 HE ARG B 88 7.572 11.852 3.602 1.00 1.17 H new ATOM 0 HH11 ARG B 88 5.275 9.114 3.661 1.00 1.64 H new ATOM 0 HH12 ARG B 88 5.887 8.439 2.147 1.00 1.64 H new ATOM 0 HH21 ARG B 88 8.303 10.968 1.652 1.00 1.55 H new ATOM 0 HH22 ARG B 88 7.588 9.481 1.020 1.00 1.55 H new ATOM 3074 N LYS B 89 3.789 14.400 4.496 1.00 0.60 N ATOM 3075 CA LYS B 89 3.873 15.512 3.539 1.00 0.67 C ATOM 3076 C LYS B 89 2.606 15.635 2.660 1.00 0.63 C ATOM 3077 O LYS B 89 2.675 15.525 1.428 1.00 0.76 O ATOM 3078 CB LYS B 89 5.155 15.379 2.678 1.00 0.76 C ATOM 3079 CG LYS B 89 5.277 14.081 1.864 1.00 0.78 C ATOM 3080 CD LYS B 89 6.537 14.076 0.993 1.00 1.06 C ATOM 3081 CE LYS B 89 6.469 13.033 -0.122 1.00 1.32 C ATOM 3082 NZ LYS B 89 7.710 13.006 -0.960 1.00 1.65 N ATOM 0 H LYS B 89 3.554 13.503 4.072 1.00 0.60 H new ATOM 0 HA LYS B 89 3.933 16.437 4.112 1.00 0.67 H new ATOM 0 HB2 LYS B 89 5.198 16.223 1.990 1.00 0.76 H new ATOM 0 HB3 LYS B 89 6.022 15.458 3.334 1.00 0.76 H new ATOM 0 HG2 LYS B 89 5.299 13.227 2.541 1.00 0.78 H new ATOM 0 HG3 LYS B 89 4.397 13.964 1.232 1.00 0.78 H new ATOM 0 HD2 LYS B 89 6.677 15.064 0.555 1.00 1.06 H new ATOM 0 HD3 LYS B 89 7.407 13.879 1.619 1.00 1.06 H new ATOM 0 HE2 LYS B 89 6.309 12.048 0.316 1.00 1.32 H new ATOM 0 HE3 LYS B 89 5.609 13.242 -0.759 1.00 1.32 H new ATOM 0 HZ1 LYS B 89 7.613 12.283 -1.701 1.00 1.65 H new ATOM 0 HZ2 LYS B 89 7.851 13.937 -1.402 1.00 1.65 H new ATOM 0 HZ3 LYS B 89 8.529 12.780 -0.360 1.00 1.65 H new ATOM 3096 N LYS B 90 1.440 15.872 3.301 1.00 0.58 N ATOM 3097 CA LYS B 90 0.169 16.060 2.555 1.00 0.56 C ATOM 3098 C LYS B 90 0.202 17.390 1.772 1.00 0.54 C ATOM 3099 O LYS B 90 -0.250 17.447 0.625 1.00 0.58 O ATOM 3100 CB LYS B 90 -1.095 15.996 3.468 1.00 0.59 C ATOM 3101 CG LYS B 90 -0.999 16.722 4.828 1.00 0.66 C ATOM 3102 CD LYS B 90 -0.810 15.761 6.018 1.00 0.96 C ATOM 3103 CE LYS B 90 -2.089 14.999 6.394 1.00 1.48 C ATOM 3104 NZ LYS B 90 -3.127 15.872 7.026 1.00 2.03 N ATOM 0 H LYS B 90 1.349 15.937 4.315 1.00 0.58 H new ATOM 0 HA LYS B 90 0.089 15.226 1.858 1.00 0.56 H new ATOM 0 HB2 LYS B 90 -1.936 16.415 2.916 1.00 0.59 H new ATOM 0 HB3 LYS B 90 -1.327 14.948 3.656 1.00 0.59 H new ATOM 0 HG2 LYS B 90 -0.165 17.423 4.800 1.00 0.66 H new ATOM 0 HG3 LYS B 90 -1.904 17.309 4.984 1.00 0.66 H new ATOM 0 HD2 LYS B 90 -0.026 15.043 5.775 1.00 0.96 H new ATOM 0 HD3 LYS B 90 -0.466 16.328 6.883 1.00 0.96 H new ATOM 0 HE2 LYS B 90 -2.507 14.538 5.499 1.00 1.48 H new ATOM 0 HE3 LYS B 90 -1.835 14.191 7.080 1.00 1.48 H new ATOM 0 HZ1 LYS B 90 -4.026 15.353 7.087 1.00 2.03 H new ATOM 0 HZ2 LYS B 90 -2.818 16.143 7.981 1.00 2.03 H new ATOM 0 HZ3 LYS B 90 -3.259 16.727 6.449 1.00 2.03 H new ATOM 3118 N LYS B 91 0.754 18.445 2.407 1.00 0.55 N ATOM 3119 CA LYS B 91 0.890 19.777 1.791 1.00 0.59 C ATOM 3120 C LYS B 91 2.277 20.357 2.145 1.00 0.62 C ATOM 3121 O LYS B 91 2.384 21.349 2.871 1.00 0.69 O ATOM 3122 CB LYS B 91 -0.241 20.714 2.277 1.00 0.64 C ATOM 3123 CG LYS B 91 -1.648 20.290 1.851 1.00 0.74 C ATOM 3124 CD LYS B 91 -2.732 21.139 2.527 1.00 0.84 C ATOM 3125 CE LYS B 91 -4.142 20.655 2.189 1.00 1.14 C ATOM 3126 NZ LYS B 91 -4.538 20.969 0.787 1.00 1.36 N ATOM 0 H LYS B 91 1.117 18.395 3.359 1.00 0.55 H new ATOM 0 HA LYS B 91 0.806 19.690 0.708 1.00 0.59 H new ATOM 0 HB2 LYS B 91 -0.206 20.769 3.365 1.00 0.64 H new ATOM 0 HB3 LYS B 91 -0.049 21.719 1.901 1.00 0.64 H new ATOM 0 HG2 LYS B 91 -1.741 20.378 0.769 1.00 0.74 H new ATOM 0 HG3 LYS B 91 -1.802 19.240 2.100 1.00 0.74 H new ATOM 0 HD2 LYS B 91 -2.590 21.112 3.607 1.00 0.84 H new ATOM 0 HD3 LYS B 91 -2.623 22.178 2.217 1.00 0.84 H new ATOM 0 HE2 LYS B 91 -4.199 19.578 2.346 1.00 1.14 H new ATOM 0 HE3 LYS B 91 -4.854 21.115 2.875 1.00 1.14 H new ATOM 0 HZ1 LYS B 91 -5.502 20.619 0.612 1.00 1.36 H new ATOM 0 HZ2 LYS B 91 -4.512 21.998 0.641 1.00 1.36 H new ATOM 0 HZ3 LYS B 91 -3.878 20.509 0.128 1.00 1.36 H new ATOM 3140 N ASP B 92 3.339 19.714 1.611 1.00 0.66 N ATOM 3141 CA ASP B 92 4.754 20.106 1.872 1.00 0.74 C ATOM 3142 C ASP B 92 5.074 21.592 1.574 1.00 0.92 C ATOM 3143 O ASP B 92 5.942 22.171 2.235 1.00 1.72 O ATOM 3144 CB ASP B 92 5.727 19.193 1.086 1.00 0.75 C ATOM 3145 CG ASP B 92 5.502 19.201 -0.425 1.00 0.88 C ATOM 3146 OD1 ASP B 92 5.993 20.136 -1.092 1.00 1.15 O ATOM 3147 OD2 ASP B 92 4.834 18.275 -0.932 1.00 0.93 O ATOM 0 H ASP B 92 3.247 18.911 0.989 1.00 0.66 H new ATOM 0 HA ASP B 92 4.894 19.975 2.945 1.00 0.74 H new ATOM 0 HB2 ASP B 92 6.750 19.507 1.292 1.00 0.75 H new ATOM 0 HB3 ASP B 92 5.627 18.171 1.453 1.00 0.75 H new ATOM 3152 N LEU B 93 4.384 22.200 0.589 1.00 0.63 N ATOM 3153 CA LEU B 93 4.627 23.608 0.211 1.00 0.66 C ATOM 3154 C LEU B 93 3.980 24.609 1.194 1.00 0.69 C ATOM 3155 O LEU B 93 4.557 25.668 1.457 1.00 0.82 O ATOM 3156 CB LEU B 93 4.130 23.869 -1.233 1.00 0.71 C ATOM 3157 CG LEU B 93 4.898 24.952 -2.034 1.00 0.97 C ATOM 3158 CD1 LEU B 93 6.325 24.494 -2.372 1.00 1.27 C ATOM 3159 CD2 LEU B 93 4.135 25.326 -3.310 1.00 1.18 C ATOM 0 H LEU B 93 3.656 21.741 0.042 1.00 0.63 H new ATOM 0 HA LEU B 93 5.704 23.770 0.259 1.00 0.66 H new ATOM 0 HB2 LEU B 93 4.180 22.932 -1.788 1.00 0.71 H new ATOM 0 HB3 LEU B 93 3.080 24.156 -1.188 1.00 0.71 H new ATOM 0 HG LEU B 93 4.974 25.838 -1.403 1.00 0.97 H new ATOM 0 HD11 LEU B 93 6.835 25.277 -2.934 1.00 1.27 H new ATOM 0 HD12 LEU B 93 6.871 24.294 -1.450 1.00 1.27 H new ATOM 0 HD13 LEU B 93 6.283 23.585 -2.973 1.00 1.27 H new ATOM 0 HD21 LEU B 93 4.691 26.087 -3.857 1.00 1.18 H new ATOM 0 HD22 LEU B 93 4.018 24.442 -3.937 1.00 1.18 H new ATOM 0 HD23 LEU B 93 3.152 25.715 -3.045 1.00 1.18 H new ATOM 3171 N LYS B 94 2.786 24.274 1.729 1.00 0.66 N ATOM 3172 CA LYS B 94 2.067 25.148 2.679 1.00 0.74 C ATOM 3173 C LYS B 94 2.494 24.860 4.138 1.00 0.70 C ATOM 3174 O LYS B 94 2.959 25.764 4.835 1.00 0.79 O ATOM 3175 CB LYS B 94 0.535 24.965 2.508 1.00 0.84 C ATOM 3176 CG LYS B 94 -0.336 25.969 3.277 1.00 1.00 C ATOM 3177 CD LYS B 94 -0.386 27.343 2.600 1.00 1.15 C ATOM 3178 CE LYS B 94 -1.384 28.287 3.278 1.00 1.45 C ATOM 3179 NZ LYS B 94 -0.885 28.821 4.583 1.00 1.61 N ATOM 0 H LYS B 94 2.300 23.403 1.518 1.00 0.66 H new ATOM 0 HA LYS B 94 2.326 26.184 2.459 1.00 0.74 H new ATOM 0 HB2 LYS B 94 0.293 25.037 1.448 1.00 0.84 H new ATOM 0 HB3 LYS B 94 0.268 23.958 2.828 1.00 0.84 H new ATOM 0 HG2 LYS B 94 -1.348 25.574 3.365 1.00 1.00 H new ATOM 0 HG3 LYS B 94 0.052 26.081 4.290 1.00 1.00 H new ATOM 0 HD2 LYS B 94 0.607 27.792 2.620 1.00 1.15 H new ATOM 0 HD3 LYS B 94 -0.659 27.220 1.552 1.00 1.15 H new ATOM 0 HE2 LYS B 94 -1.601 29.120 2.609 1.00 1.45 H new ATOM 0 HE3 LYS B 94 -2.323 27.758 3.443 1.00 1.45 H new ATOM 0 HZ1 LYS B 94 -1.600 29.453 4.996 1.00 1.61 H new ATOM 0 HZ2 LYS B 94 -0.703 28.031 5.235 1.00 1.61 H new ATOM 0 HZ3 LYS B 94 -0.004 29.351 4.427 1.00 1.61 H new ATOM 3193 N ILE B 95 2.340 23.591 4.576 1.00 0.65 N ATOM 3194 CA ILE B 95 2.690 23.158 5.951 1.00 0.66 C ATOM 3195 C ILE B 95 3.804 22.089 5.922 1.00 0.68 C ATOM 3196 O ILE B 95 3.710 21.115 5.169 1.00 0.78 O ATOM 3197 CB ILE B 95 1.435 22.618 6.732 1.00 0.74 C ATOM 3198 CG1 ILE B 95 0.617 21.605 5.884 1.00 0.83 C ATOM 3199 CG2 ILE B 95 0.544 23.787 7.181 1.00 0.84 C ATOM 3200 CD1 ILE B 95 -0.481 20.884 6.649 1.00 1.04 C ATOM 0 H ILE B 95 1.972 22.840 3.992 1.00 0.65 H new ATOM 0 HA ILE B 95 3.058 24.036 6.482 1.00 0.66 H new ATOM 0 HB ILE B 95 1.797 22.087 7.612 1.00 0.74 H new ATOM 0 HG12 ILE B 95 0.169 22.133 5.042 1.00 0.83 H new ATOM 0 HG13 ILE B 95 1.300 20.864 5.468 1.00 0.83 H new ATOM 0 HG21 ILE B 95 -0.320 23.399 7.720 1.00 0.84 H new ATOM 0 HG22 ILE B 95 1.113 24.448 7.835 1.00 0.84 H new ATOM 0 HG23 ILE B 95 0.207 24.344 6.307 1.00 0.84 H new ATOM 0 HD11 ILE B 95 -1.000 20.197 5.980 1.00 1.04 H new ATOM 0 HD12 ILE B 95 -0.042 20.324 7.474 1.00 1.04 H new ATOM 0 HD13 ILE B 95 -1.190 21.613 7.042 1.00 1.04 H new ATOM 3212 N ARG B 96 4.861 22.274 6.747 1.00 0.70 N ATOM 3213 CA ARG B 96 6.000 21.330 6.786 1.00 0.79 C ATOM 3214 C ARG B 96 6.633 21.207 8.197 1.00 0.79 C ATOM 3215 O ARG B 96 7.855 21.331 8.351 1.00 1.02 O ATOM 3216 CB ARG B 96 7.067 21.742 5.732 1.00 0.99 C ATOM 3217 CG ARG B 96 7.491 23.221 5.780 1.00 1.12 C ATOM 3218 CD ARG B 96 8.813 23.468 5.052 1.00 1.41 C ATOM 3219 NE ARG B 96 9.974 22.935 5.792 1.00 1.59 N ATOM 3220 CZ ARG B 96 11.177 22.641 5.252 1.00 2.01 C ATOM 3221 NH1 ARG B 96 11.407 22.755 3.936 1.00 2.42 N ATOM 3222 NH2 ARG B 96 12.160 22.217 6.049 1.00 2.37 N ATOM 0 H ARG B 96 4.948 23.062 7.389 1.00 0.70 H new ATOM 0 HA ARG B 96 5.611 20.342 6.539 1.00 0.79 H new ATOM 0 HB2 ARG B 96 7.952 21.121 5.871 1.00 0.99 H new ATOM 0 HB3 ARG B 96 6.677 21.523 4.738 1.00 0.99 H new ATOM 0 HG2 ARG B 96 6.711 23.835 5.331 1.00 1.12 H new ATOM 0 HG3 ARG B 96 7.586 23.536 6.819 1.00 1.12 H new ATOM 0 HD2 ARG B 96 8.772 23.007 4.065 1.00 1.41 H new ATOM 0 HD3 ARG B 96 8.945 24.539 4.898 1.00 1.41 H new ATOM 0 HE ARG B 96 9.858 22.776 6.793 1.00 1.59 H new ATOM 0 HH11 ARG B 96 10.663 23.071 3.314 1.00 2.42 H new ATOM 0 HH12 ARG B 96 12.326 22.526 3.557 1.00 2.42 H new ATOM 0 HH21 ARG B 96 11.998 22.119 7.051 1.00 2.37 H new ATOM 0 HH22 ARG B 96 13.074 21.991 5.656 1.00 2.37 H new ATOM 3236 N LYS B 97 5.798 20.949 9.229 1.00 0.72 N ATOM 3237 CA LYS B 97 6.292 20.790 10.620 1.00 0.76 C ATOM 3238 C LYS B 97 5.312 19.974 11.501 1.00 0.76 C ATOM 3239 O LYS B 97 5.204 20.224 12.709 1.00 1.04 O ATOM 3240 CB LYS B 97 6.598 22.168 11.264 1.00 0.89 C ATOM 3241 CG LYS B 97 5.387 23.104 11.447 1.00 0.94 C ATOM 3242 CD LYS B 97 5.646 24.204 12.491 1.00 1.16 C ATOM 3243 CE LYS B 97 5.267 23.781 13.919 1.00 1.49 C ATOM 3244 NZ LYS B 97 6.122 22.681 14.465 1.00 1.86 N ATOM 0 H LYS B 97 4.788 20.847 9.129 1.00 0.72 H new ATOM 0 HA LYS B 97 7.221 20.223 10.564 1.00 0.76 H new ATOM 0 HB2 LYS B 97 7.054 21.999 12.239 1.00 0.89 H new ATOM 0 HB3 LYS B 97 7.339 22.679 10.650 1.00 0.89 H new ATOM 0 HG2 LYS B 97 5.141 23.566 10.491 1.00 0.94 H new ATOM 0 HG3 LYS B 97 4.520 22.517 11.750 1.00 0.94 H new ATOM 0 HD2 LYS B 97 6.701 24.478 12.467 1.00 1.16 H new ATOM 0 HD3 LYS B 97 5.079 25.095 12.220 1.00 1.16 H new ATOM 0 HE2 LYS B 97 5.340 24.647 14.577 1.00 1.49 H new ATOM 0 HE3 LYS B 97 4.226 23.460 13.929 1.00 1.49 H new ATOM 0 HZ1 LYS B 97 5.990 22.618 15.495 1.00 1.86 H new ATOM 0 HZ2 LYS B 97 5.850 21.779 14.025 1.00 1.86 H new ATOM 0 HZ3 LYS B 97 7.121 22.881 14.255 1.00 1.86 H new ATOM 3258 N LYS B 98 4.623 18.979 10.901 1.00 0.71 N ATOM 3259 CA LYS B 98 3.652 18.143 11.636 1.00 0.74 C ATOM 3260 C LYS B 98 3.648 16.700 11.109 1.00 0.90 C ATOM 3261 O LYS B 98 3.648 15.767 11.942 1.00 1.07 O ATOM 3262 CB LYS B 98 2.238 18.764 11.543 1.00 0.96 C ATOM 3263 CG LYS B 98 1.244 18.246 12.592 1.00 1.08 C ATOM 3264 CD LYS B 98 -0.123 18.935 12.484 1.00 1.52 C ATOM 3265 CE LYS B 98 -1.104 18.462 13.561 1.00 1.69 C ATOM 3266 NZ LYS B 98 -0.773 18.990 14.922 1.00 1.85 N ATOM 3267 OXT LYS B 98 3.649 16.517 9.872 1.00 1.15 O ATOM 0 H LYS B 98 4.721 18.737 9.915 1.00 0.71 H new ATOM 0 HA LYS B 98 3.953 18.110 12.683 1.00 0.74 H new ATOM 0 HB2 LYS B 98 2.323 19.846 11.645 1.00 0.96 H new ATOM 0 HB3 LYS B 98 1.834 18.568 10.550 1.00 0.96 H new ATOM 0 HG2 LYS B 98 1.118 17.170 12.470 1.00 1.08 H new ATOM 0 HG3 LYS B 98 1.653 18.408 13.589 1.00 1.08 H new ATOM 0 HD2 LYS B 98 0.010 20.014 12.566 1.00 1.52 H new ATOM 0 HD3 LYS B 98 -0.548 18.740 11.499 1.00 1.52 H new ATOM 0 HE2 LYS B 98 -2.112 18.776 13.290 1.00 1.69 H new ATOM 0 HE3 LYS B 98 -1.106 17.372 13.590 1.00 1.69 H new ATOM 0 HZ1 LYS B 98 -1.469 18.638 15.610 1.00 1.85 H new ATOM 0 HZ2 LYS B 98 0.178 18.670 15.197 1.00 1.85 H new ATOM 0 HZ3 LYS B 98 -0.797 20.030 14.906 1.00 1.85 H new TER 3281 LYS B 98 HETATM 3282 NAA ANW A 99 14.054 15.574 10.117 1.00 4.56 N HETATM 3283 NAB ANW A 99 14.643 17.534 9.018 1.00 6.22 N HETATM 3284 CAC ANW A 99 8.705 9.606 12.634 1.00 5.26 C HETATM 3285 CAD ANW A 99 9.953 9.356 11.782 1.00 4.51 C HETATM 3286 CAE ANW A 99 10.788 8.240 12.414 1.00 5.16 C HETATM 3287 CAF ANW A 99 10.709 10.520 11.699 1.00 3.64 C HETATM 3288 CAG ANW A 99 10.963 11.091 10.457 1.00 3.13 C HETATM 3289 CAH ANW A 99 11.670 12.284 10.365 1.00 2.76 C HETATM 3290 CAI ANW A 99 12.139 12.900 11.521 1.00 3.04 C HETATM 3291 CAJ ANW A 99 11.896 12.327 12.764 1.00 3.59 C HETATM 3292 CAK ANW A 99 11.180 11.138 12.853 1.00 3.84 C HETATM 3293 CAL ANW A 99 13.250 14.505 10.198 1.00 3.63 C HETATM 3294 CAM ANW A 99 14.123 16.310 8.997 1.00 5.17 C HETATM 3295 CAN ANW A 99 13.374 15.975 7.872 1.00 5.05 C HETATM 3296 CAO ANW A 99 12.527 14.874 7.936 1.00 4.25 C HETATM 3297 CAP ANW A 99 12.469 14.133 9.109 1.00 3.42 C HETATM 3298 CAQ ANW A 99 11.798 12.918 9.138 1.00 3.01 C HETATM 3299 CAR ANW A 99 13.573 16.634 6.664 1.00 6.05 C HETATM 3300 OAS ANW A 99 12.926 14.010 11.426 1.00 3.49 O HETATM 3301 OAT ANW A 99 11.369 12.403 8.108 1.00 3.52 O HETATM 3302 OAU ANW A 99 12.874 16.334 5.671 1.00 6.33 O HETATM 3303 OAV ANW A 99 14.457 17.510 6.562 1.00 6.88 O HETATM 0 HOAV ANW A 99 14.471 17.856 5.645 1.00 6.88 H new HETATM 0 HNAB ANW A 99 14.995 17.924 9.892 1.00 6.22 H new HETATM 0 HNAA ANW A 99 14.690 18.083 8.160 1.00 6.22 H new HETATM 0 HAEB ANW A 99 11.088 8.535 13.419 1.00 5.16 H new HETATM 0 HAEA ANW A 99 10.195 7.327 12.466 1.00 5.16 H new HETATM 0 HACB ANW A 99 8.111 8.693 12.686 1.00 5.26 H new HETATM 0 HACA ANW A 99 9.004 9.902 13.640 1.00 5.26 H new HETATM 0 HAO ANW A 99 11.917 14.596 7.077 1.00 4.25 H new HETATM 0 HAK ANW A 99 10.988 10.690 13.828 1.00 3.84 H new HETATM 0 HAJ ANW A 99 12.266 12.809 13.669 1.00 3.59 H new HETATM 0 HAG ANW A 99 10.606 10.601 9.551 1.00 3.13 H new HETATM 0 HAE ANW A 99 11.676 8.062 11.808 1.00 5.16 H new HETATM 0 HAD ANW A 99 9.650 9.057 10.779 1.00 4.51 H new HETATM 0 HAC ANW A 99 8.110 10.401 12.184 1.00 5.26 H new HETATM 3317 NAA ANW B 99 -15.575 -16.535 6.110 1.00 4.81 N HETATM 3318 NAB ANW B 99 -16.887 -18.264 5.287 1.00 6.57 N HETATM 3319 CAC ANW B 99 -8.887 -12.549 8.956 1.00 5.53 C HETATM 3320 CAD ANW B 99 -9.226 -12.517 7.463 1.00 4.77 C HETATM 3321 CAE ANW B 99 -9.158 -11.077 6.952 1.00 5.55 C HETATM 3322 CAF ANW B 99 -10.500 -13.037 7.257 1.00 3.85 C HETATM 3323 CAG ANW B 99 -10.647 -14.229 6.556 1.00 3.21 C HETATM 3324 CAH ANW B 99 -11.888 -14.846 6.474 1.00 2.83 C HETATM 3325 CAI ANW B 99 -12.997 -14.251 7.070 1.00 3.21 C HETATM 3326 CAJ ANW B 99 -12.857 -13.047 7.752 1.00 3.83 C HETATM 3327 CAK ANW B 99 -11.608 -12.444 7.851 1.00 4.12 C HETATM 3328 CAL ANW B 99 -14.357 -15.991 6.254 1.00 3.82 C HETATM 3329 CAM ANW B 99 -15.727 -17.823 5.763 1.00 5.45 C HETATM 3330 CAN ANW B 99 -14.625 -18.647 5.564 1.00 5.26 C HETATM 3331 CAO ANW B 99 -13.351 -18.103 5.693 1.00 4.33 C HETATM 3332 CAP ANW B 99 -13.220 -16.764 6.040 1.00 3.50 C HETATM 3333 CAQ ANW B 99 -11.980 -16.143 5.986 1.00 3.00 C HETATM 3334 CAR ANW B 99 -14.780 -20.022 5.438 1.00 6.31 C HETATM 3335 OAS ANW B 99 -14.225 -14.830 6.951 1.00 3.68 O HETATM 3336 OAT ANW B 99 -10.999 -16.716 5.513 1.00 3.40 O HETATM 3337 OAU ANW B 99 -13.782 -20.747 5.230 1.00 6.52 O HETATM 3338 OAV ANW B 99 -15.913 -20.539 5.546 1.00 7.25 O HETATM 0 HOAV ANW B 99 -15.886 -21.459 5.210 1.00 7.25 H new HETATM 0 HNAB ANW B 99 -17.673 -17.622 5.182 1.00 6.57 H new HETATM 0 HNAA ANW B 99 -16.992 -19.245 5.026 1.00 6.57 H new HETATM 0 HAEB ANW B 99 -9.873 -10.463 7.499 1.00 5.55 H new HETATM 0 HAEA ANW B 99 -8.152 -10.684 7.103 1.00 5.55 H new HETATM 0 HACB ANW B 99 -7.881 -12.158 9.109 1.00 5.53 H new HETATM 0 HACA ANW B 99 -9.602 -11.936 9.505 1.00 5.53 H new HETATM 0 HAO ANW B 99 -12.468 -18.719 5.524 1.00 4.33 H new HETATM 0 HAK ANW B 99 -11.498 -11.506 8.395 1.00 4.12 H new HETATM 0 HAJ ANW B 99 -13.727 -12.576 8.209 1.00 3.83 H new HETATM 0 HAG ANW B 99 -9.783 -14.681 6.068 1.00 3.21 H new HETATM 0 HAE ANW B 99 -9.400 -11.056 5.889 1.00 5.55 H new HETATM 0 HAD ANW B 99 -8.505 -13.124 6.916 1.00 4.77 H new HETATM 0 HAC ANW B 99 -8.936 -13.576 9.318 1.00 5.53 H new