USER MOD reduce.3.24.130724 H: found=0, std=0, add=1083, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1079 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 79 LYS NZ :NH3+ -108:sc= 0.675 (180deg=-1.57!) USER MOD Set 1.2: A 141 MET CE :methyl -162:sc= -0.0842 (180deg=-0.644) USER MOD Set 2.1: A 135 HIS : no HD1:sc=-0.00951 X(o=-0.47,f=-0.46) USER MOD Set 2.2: A 136 SER OG : rot 180:sc= -0.46 USER MOD Set 3.1: A 123 TYR OH : rot 180:sc= 0.451 USER MOD Set 3.2: A 138 LYS NZ :NH3+ -148:sc= 1.65 (180deg=1.26) USER MOD Set 4.1: A 105 SER OG : rot 116:sc= 0.0435 USER MOD Set 4.2: A 108 GLN : amide:sc= 0.131 X(o=0.17,f=-0.2) USER MOD Set 5.1: A 64 THR OG1 : rot 180:sc= -0.0888 USER MOD Set 5.2: A 65 THR OG1 : rot -150:sc= 1.28 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot -49:sc= 1.2 USER MOD Single : A 22 LYS NZ :NH3+ -132:sc= -0.771 (180deg=-1.8!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -89:sc= 1.26 USER MOD Single : A 34 LYS NZ :NH3+ 175:sc= 1.26 (180deg=1.11) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -3.55! C(o=-3.5!,f=-5.7!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc= 1.16 K(o=1.2,f=-4.8!) USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 HIS : no HE2:sc= -0.0604 X(o=-0.06,f=-0.49) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.415 X(o=-0.42,f=-0.2) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -0.362 X(o=-0.36,f=-0.4) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -1.13 K(o=-1.1,f=-0.096) USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ -156:sc= 1.24 (180deg=1.2) USER MOD Single : A 88 ASN : amide:sc= 0.726 K(o=0.73,f=-0.39) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 167:sc= -0.0258 (180deg=-0.22) USER MOD Single : A 99 TYR OH : rot 180:sc= -0.011 USER MOD Single : A 100 LYS NZ :NH3+ 165:sc= 1.24 (180deg=1.19) USER MOD Single : A 104 LYS NZ :NH3+ -165:sc= 1.27 (180deg=0.851) USER MOD Single : A 110 SER OG : rot 90:sc= -0.374 USER MOD Single : A 111 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 113 GLN : amide:sc= 0.956 K(o=0.96,f=-0.022) USER MOD Single : A 114 LYS NZ :NH3+ -147:sc= 1.08 (180deg=-0.736) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 19:sc= 0.901 USER MOD Single : A 132 CYS SG : rot -47:sc= -5.06! USER MOD Single : A 142 SER OG : rot 54:sc= 1.26 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 14 -25.458 14.205 6.931 1.00 11.00 N ATOM 2 CA ASP A 14 -26.380 13.356 7.712 1.00 43.05 C ATOM 3 C ASP A 14 -25.665 12.754 8.908 1.00 60.10 C ATOM 4 O ASP A 14 -25.989 13.065 10.051 1.00 24.34 O ATOM 5 CB ASP A 14 -27.000 12.253 6.842 1.00 21.43 C ATOM 6 CG ASP A 14 -27.888 11.305 7.635 1.00 42.52 C ATOM 7 OD1 ASP A 14 -29.063 11.638 7.901 1.00 33.42 O ATOM 8 OD2 ASP A 14 -27.439 10.201 7.973 1.00 5.02 O ATOM 0 HA ASP A 14 -27.191 13.989 8.072 1.00 43.05 H new ATOM 0 HB2 ASP A 14 -27.586 12.711 6.045 1.00 21.43 H new ATOM 0 HB3 ASP A 14 -26.203 11.683 6.364 1.00 21.43 H new ATOM 13 N MET A 15 -24.694 11.902 8.654 1.00 35.25 N ATOM 14 CA MET A 15 -23.908 11.315 9.715 1.00 21.34 C ATOM 15 C MET A 15 -22.682 12.162 9.955 1.00 23.13 C ATOM 16 O MET A 15 -22.259 12.921 9.074 1.00 4.42 O ATOM 17 CB MET A 15 -23.504 9.875 9.376 1.00 4.20 C ATOM 18 CG MET A 15 -24.675 8.916 9.294 1.00 75.12 C ATOM 19 SD MET A 15 -24.190 7.227 8.893 1.00 35.11 S ATOM 20 CE MET A 15 -25.790 6.412 8.948 1.00 21.12 C ATOM 0 H MET A 15 -24.430 11.600 7.716 1.00 35.25 H new ATOM 0 HA MET A 15 -24.513 11.283 10.621 1.00 21.34 H new ATOM 0 HB2 MET A 15 -22.975 9.870 8.423 1.00 4.20 H new ATOM 0 HB3 MET A 15 -22.804 9.516 10.131 1.00 4.20 H new ATOM 0 HG2 MET A 15 -25.204 8.918 10.247 1.00 75.12 H new ATOM 0 HG3 MET A 15 -25.376 9.274 8.540 1.00 75.12 H new ATOM 0 HE1 MET A 15 -25.667 5.353 8.721 1.00 21.12 H new ATOM 0 HE2 MET A 15 -26.220 6.522 9.943 1.00 21.12 H new ATOM 0 HE3 MET A 15 -26.455 6.866 8.213 1.00 21.12 H new ATOM 30 N VAL A 16 -22.136 12.086 11.134 1.00 10.54 N ATOM 31 CA VAL A 16 -20.941 12.833 11.449 1.00 72.30 C ATOM 32 C VAL A 16 -19.737 12.103 10.842 1.00 53.23 C ATOM 33 O VAL A 16 -19.651 10.876 10.924 1.00 11.41 O ATOM 34 CB VAL A 16 -20.764 12.998 12.990 1.00 40.42 C ATOM 35 CG1 VAL A 16 -19.525 13.822 13.322 1.00 72.44 C ATOM 36 CG2 VAL A 16 -22.003 13.642 13.605 1.00 5.44 C ATOM 0 H VAL A 16 -22.496 11.515 11.898 1.00 10.54 H new ATOM 0 HA VAL A 16 -21.021 13.835 11.027 1.00 72.30 H new ATOM 0 HB VAL A 16 -20.633 12.003 13.416 1.00 40.42 H new ATOM 0 HG11 VAL A 16 -19.431 13.918 14.404 1.00 72.44 H new ATOM 0 HG12 VAL A 16 -18.640 13.325 12.924 1.00 72.44 H new ATOM 0 HG13 VAL A 16 -19.617 14.813 12.876 1.00 72.44 H new ATOM 0 HG21 VAL A 16 -21.862 13.749 14.680 1.00 5.44 H new ATOM 0 HG22 VAL A 16 -22.161 14.624 13.160 1.00 5.44 H new ATOM 0 HG23 VAL A 16 -22.873 13.013 13.414 1.00 5.44 H new ATOM 46 N THR A 17 -18.835 12.851 10.225 1.00 2.23 N ATOM 47 CA THR A 17 -17.658 12.300 9.570 1.00 34.31 C ATOM 48 C THR A 17 -16.827 11.475 10.548 1.00 65.31 C ATOM 49 O THR A 17 -16.346 10.412 10.210 1.00 44.25 O ATOM 50 CB THR A 17 -16.805 13.433 8.990 1.00 33.10 C ATOM 51 OG1 THR A 17 -17.671 14.297 8.232 1.00 23.50 O ATOM 52 CG2 THR A 17 -15.715 12.889 8.068 1.00 10.23 C ATOM 0 H THR A 17 -18.900 13.867 10.164 1.00 2.23 H new ATOM 0 HA THR A 17 -17.989 11.646 8.763 1.00 34.31 H new ATOM 0 HB THR A 17 -16.322 13.971 9.806 1.00 33.10 H new ATOM 0 HG1 THR A 17 -18.218 13.759 7.623 1.00 23.50 H new ATOM 0 HG21 THR A 17 -15.127 13.717 7.672 1.00 10.23 H new ATOM 0 HG22 THR A 17 -15.065 12.218 8.629 1.00 10.23 H new ATOM 0 HG23 THR A 17 -16.174 12.344 7.244 1.00 10.23 H new ATOM 60 N ASP A 18 -16.722 11.955 11.768 1.00 52.35 N ATOM 61 CA ASP A 18 -15.985 11.258 12.815 1.00 61.14 C ATOM 62 C ASP A 18 -16.594 9.887 13.107 1.00 73.32 C ATOM 63 O ASP A 18 -15.881 8.884 13.278 1.00 41.35 O ATOM 64 CB ASP A 18 -15.955 12.104 14.064 1.00 45.03 C ATOM 65 CG ASP A 18 -15.287 11.415 15.224 1.00 3.54 C ATOM 66 OD1 ASP A 18 -15.936 11.220 16.248 1.00 1.12 O ATOM 67 OD2 ASP A 18 -14.119 11.027 15.118 1.00 12.40 O ATOM 0 H ASP A 18 -17.141 12.835 12.068 1.00 52.35 H new ATOM 0 HA ASP A 18 -14.965 11.094 12.468 1.00 61.14 H new ATOM 0 HB2 ASP A 18 -15.432 13.037 13.852 1.00 45.03 H new ATOM 0 HB3 ASP A 18 -16.975 12.367 14.343 1.00 45.03 H new ATOM 72 N LEU A 19 -17.908 9.839 13.113 1.00 5.22 N ATOM 73 CA LEU A 19 -18.632 8.605 13.327 1.00 21.20 C ATOM 74 C LEU A 19 -18.415 7.695 12.118 1.00 75.30 C ATOM 75 O LEU A 19 -18.218 6.495 12.262 1.00 30.31 O ATOM 76 CB LEU A 19 -20.142 8.925 13.578 1.00 22.45 C ATOM 77 CG LEU A 19 -21.135 7.762 13.883 1.00 63.45 C ATOM 78 CD1 LEU A 19 -21.511 6.967 12.636 1.00 44.25 C ATOM 79 CD2 LEU A 19 -20.574 6.836 14.954 1.00 33.12 C ATOM 0 H LEU A 19 -18.505 10.654 12.970 1.00 5.22 H new ATOM 0 HA LEU A 19 -18.266 8.081 14.210 1.00 21.20 H new ATOM 0 HB2 LEU A 19 -20.193 9.625 14.412 1.00 22.45 H new ATOM 0 HB3 LEU A 19 -20.515 9.450 12.699 1.00 22.45 H new ATOM 0 HG LEU A 19 -22.049 8.224 14.256 1.00 63.45 H new ATOM 0 HD11 LEU A 19 -22.204 6.171 12.907 1.00 44.25 H new ATOM 0 HD12 LEU A 19 -21.985 7.629 11.912 1.00 44.25 H new ATOM 0 HD13 LEU A 19 -20.613 6.532 12.197 1.00 44.25 H new ATOM 0 HD21 LEU A 19 -21.285 6.033 15.149 1.00 33.12 H new ATOM 0 HD22 LEU A 19 -19.631 6.411 14.610 1.00 33.12 H new ATOM 0 HD23 LEU A 19 -20.404 7.401 15.871 1.00 33.12 H new ATOM 91 N ASP A 20 -18.364 8.297 10.947 1.00 61.31 N ATOM 92 CA ASP A 20 -18.203 7.545 9.700 1.00 34.21 C ATOM 93 C ASP A 20 -16.812 6.928 9.621 1.00 4.14 C ATOM 94 O ASP A 20 -16.663 5.740 9.280 1.00 60.53 O ATOM 95 CB ASP A 20 -18.488 8.437 8.469 1.00 22.30 C ATOM 96 CG ASP A 20 -18.379 7.699 7.133 1.00 12.21 C ATOM 97 OD1 ASP A 20 -17.509 8.046 6.307 1.00 43.53 O ATOM 98 OD2 ASP A 20 -19.179 6.787 6.868 1.00 1.44 O ATOM 0 H ASP A 20 -18.431 9.307 10.823 1.00 61.31 H new ATOM 0 HA ASP A 20 -18.934 6.736 9.696 1.00 34.21 H new ATOM 0 HB2 ASP A 20 -19.490 8.857 8.561 1.00 22.30 H new ATOM 0 HB3 ASP A 20 -17.790 9.274 8.469 1.00 22.30 H new ATOM 103 N VAL A 21 -15.805 7.706 10.011 1.00 22.13 N ATOM 104 CA VAL A 21 -14.426 7.241 9.969 1.00 45.21 C ATOM 105 C VAL A 21 -14.164 6.168 11.016 1.00 10.12 C ATOM 106 O VAL A 21 -13.498 5.175 10.731 1.00 42.03 O ATOM 107 CB VAL A 21 -13.338 8.387 10.085 1.00 61.04 C ATOM 108 CG1 VAL A 21 -13.557 9.475 9.068 1.00 32.31 C ATOM 109 CG2 VAL A 21 -13.255 8.991 11.476 1.00 44.43 C ATOM 0 H VAL A 21 -15.920 8.658 10.358 1.00 22.13 H new ATOM 0 HA VAL A 21 -14.314 6.815 8.972 1.00 45.21 H new ATOM 0 HB VAL A 21 -12.385 7.900 9.880 1.00 61.04 H new ATOM 0 HG11 VAL A 21 -12.789 10.240 9.183 1.00 32.31 H new ATOM 0 HG12 VAL A 21 -13.501 9.052 8.065 1.00 32.31 H new ATOM 0 HG13 VAL A 21 -14.540 9.922 9.219 1.00 32.31 H new ATOM 0 HG21 VAL A 21 -12.492 9.769 11.490 1.00 44.43 H new ATOM 0 HG22 VAL A 21 -14.219 9.423 11.743 1.00 44.43 H new ATOM 0 HG23 VAL A 21 -12.994 8.214 12.195 1.00 44.43 H new ATOM 119 N LYS A 22 -14.699 6.336 12.227 1.00 21.13 N ATOM 120 CA LYS A 22 -14.442 5.343 13.250 1.00 45.31 C ATOM 121 C LYS A 22 -15.300 4.126 13.015 1.00 41.33 C ATOM 122 O LYS A 22 -14.959 3.029 13.433 1.00 15.13 O ATOM 123 CB LYS A 22 -14.627 5.887 14.675 1.00 21.55 C ATOM 124 CG LYS A 22 -16.055 6.228 15.078 1.00 53.44 C ATOM 125 CD LYS A 22 -16.154 6.765 16.517 1.00 14.44 C ATOM 126 CE LYS A 22 -15.774 8.250 16.661 1.00 0.43 C ATOM 127 NZ LYS A 22 -14.345 8.585 16.387 1.00 34.05 N ATOM 0 H LYS A 22 -15.288 7.119 12.509 1.00 21.13 H new ATOM 0 HA LYS A 22 -13.392 5.062 13.171 1.00 45.31 H new ATOM 0 HB2 LYS A 22 -14.238 5.150 15.378 1.00 21.55 H new ATOM 0 HB3 LYS A 22 -14.016 6.783 14.783 1.00 21.55 H new ATOM 0 HG2 LYS A 22 -16.455 6.972 14.389 1.00 53.44 H new ATOM 0 HG3 LYS A 22 -16.677 5.338 14.983 1.00 53.44 H new ATOM 0 HD2 LYS A 22 -17.174 6.625 16.876 1.00 14.44 H new ATOM 0 HD3 LYS A 22 -15.505 6.171 17.161 1.00 14.44 H new ATOM 0 HE2 LYS A 22 -16.400 8.833 15.985 1.00 0.43 H new ATOM 0 HE3 LYS A 22 -16.015 8.570 17.675 1.00 0.43 H new ATOM 0 HZ1 LYS A 22 -13.976 9.185 17.152 1.00 34.05 H new ATOM 0 HZ2 LYS A 22 -13.787 7.709 16.335 1.00 34.05 H new ATOM 0 HZ3 LYS A 22 -14.275 9.094 15.483 1.00 34.05 H new ATOM 141 N GLY A 23 -16.411 4.326 12.342 1.00 73.52 N ATOM 142 CA GLY A 23 -17.295 3.242 12.039 1.00 73.53 C ATOM 143 C GLY A 23 -16.687 2.294 11.034 1.00 73.12 C ATOM 144 O GLY A 23 -16.521 1.081 11.325 1.00 40.04 O ATOM 0 H GLY A 23 -16.718 5.235 11.997 1.00 73.52 H new ATOM 0 HA2 GLY A 23 -17.533 2.700 12.954 1.00 73.53 H new ATOM 0 HA3 GLY A 23 -18.233 3.635 11.648 1.00 73.53 H new ATOM 148 N LEU A 24 -16.274 2.834 9.875 1.00 61.12 N ATOM 149 CA LEU A 24 -15.708 1.982 8.847 1.00 65.54 C ATOM 150 C LEU A 24 -14.356 1.528 9.306 1.00 11.23 C ATOM 151 O LEU A 24 -13.965 0.407 9.052 1.00 72.00 O ATOM 152 CB LEU A 24 -15.637 2.688 7.449 1.00 2.33 C ATOM 153 CG LEU A 24 -14.407 3.578 7.108 1.00 75.35 C ATOM 154 CD1 LEU A 24 -13.188 2.762 6.650 1.00 24.21 C ATOM 155 CD2 LEU A 24 -14.769 4.581 6.055 1.00 33.51 C ATOM 0 H LEU A 24 -16.323 3.826 9.642 1.00 61.12 H new ATOM 0 HA LEU A 24 -16.361 1.121 8.702 1.00 65.54 H new ATOM 0 HB2 LEU A 24 -15.702 1.912 6.686 1.00 2.33 H new ATOM 0 HB3 LEU A 24 -16.528 3.308 7.349 1.00 2.33 H new ATOM 0 HG LEU A 24 -14.126 4.089 8.029 1.00 75.35 H new ATOM 0 HD11 LEU A 24 -12.362 3.437 6.426 1.00 24.21 H new ATOM 0 HD12 LEU A 24 -12.891 2.075 7.443 1.00 24.21 H new ATOM 0 HD13 LEU A 24 -13.445 2.194 5.756 1.00 24.21 H new ATOM 0 HD21 LEU A 24 -13.900 5.197 5.825 1.00 33.51 H new ATOM 0 HD22 LEU A 24 -15.093 4.061 5.154 1.00 33.51 H new ATOM 0 HD23 LEU A 24 -15.577 5.215 6.419 1.00 33.51 H new ATOM 167 N GLY A 25 -13.657 2.419 10.015 1.00 64.00 N ATOM 168 CA GLY A 25 -12.348 2.126 10.517 1.00 63.24 C ATOM 169 C GLY A 25 -12.352 0.949 11.438 1.00 43.30 C ATOM 170 O GLY A 25 -11.500 0.080 11.326 1.00 74.11 O ATOM 0 H GLY A 25 -13.996 3.353 10.246 1.00 64.00 H new ATOM 0 HA2 GLY A 25 -11.675 1.931 9.682 1.00 63.24 H new ATOM 0 HA3 GLY A 25 -11.958 2.997 11.044 1.00 63.24 H new ATOM 174 N TYR A 26 -13.328 0.895 12.323 1.00 71.43 N ATOM 175 CA TYR A 26 -13.443 -0.216 13.225 1.00 4.42 C ATOM 176 C TYR A 26 -13.843 -1.475 12.481 1.00 21.24 C ATOM 177 O TYR A 26 -13.289 -2.518 12.733 1.00 34.31 O ATOM 178 CB TYR A 26 -14.424 0.068 14.370 1.00 14.34 C ATOM 179 CG TYR A 26 -14.562 -1.084 15.344 1.00 23.41 C ATOM 180 CD1 TYR A 26 -15.657 -1.943 15.291 1.00 0.25 C ATOM 181 CD2 TYR A 26 -13.583 -1.331 16.293 1.00 32.53 C ATOM 182 CE1 TYR A 26 -15.770 -3.006 16.158 1.00 10.01 C ATOM 183 CE2 TYR A 26 -13.692 -2.392 17.166 1.00 52.41 C ATOM 184 CZ TYR A 26 -14.784 -3.228 17.094 1.00 22.10 C ATOM 185 OH TYR A 26 -14.889 -4.297 17.958 1.00 60.34 O ATOM 0 H TYR A 26 -14.048 1.610 12.431 1.00 71.43 H new ATOM 0 HA TYR A 26 -12.460 -0.370 13.670 1.00 4.42 H new ATOM 0 HB2 TYR A 26 -14.092 0.954 14.911 1.00 14.34 H new ATOM 0 HB3 TYR A 26 -15.403 0.299 13.951 1.00 14.34 H new ATOM 0 HD1 TYR A 26 -16.431 -1.772 14.557 1.00 0.25 H new ATOM 0 HD2 TYR A 26 -12.721 -0.682 16.349 1.00 32.53 H new ATOM 0 HE1 TYR A 26 -16.626 -3.662 16.105 1.00 10.01 H new ATOM 0 HE2 TYR A 26 -12.923 -2.567 17.904 1.00 52.41 H new ATOM 0 HH TYR A 26 -14.111 -4.313 18.554 1.00 60.34 H new ATOM 195 N ASP A 27 -14.783 -1.367 11.540 1.00 15.51 N ATOM 196 CA ASP A 27 -15.248 -2.557 10.791 1.00 3.40 C ATOM 197 C ASP A 27 -14.093 -3.140 9.986 1.00 62.51 C ATOM 198 O ASP A 27 -13.822 -4.362 10.043 1.00 41.31 O ATOM 199 CB ASP A 27 -16.441 -2.208 9.873 1.00 33.02 C ATOM 200 CG ASP A 27 -17.146 -3.428 9.273 1.00 54.43 C ATOM 201 OD1 ASP A 27 -18.238 -3.815 9.787 1.00 43.15 O ATOM 202 OD2 ASP A 27 -16.660 -4.009 8.286 1.00 74.20 O ATOM 0 H ASP A 27 -15.235 -0.492 11.275 1.00 15.51 H new ATOM 0 HA ASP A 27 -15.595 -3.305 11.504 1.00 3.40 H new ATOM 0 HB2 ASP A 27 -17.166 -1.627 10.443 1.00 33.02 H new ATOM 0 HB3 ASP A 27 -16.088 -1.571 9.062 1.00 33.02 H new ATOM 207 N PHE A 28 -13.375 -2.247 9.307 1.00 64.34 N ATOM 208 CA PHE A 28 -12.208 -2.585 8.519 1.00 4.21 C ATOM 209 C PHE A 28 -11.109 -3.163 9.407 1.00 42.32 C ATOM 210 O PHE A 28 -10.611 -4.249 9.156 1.00 32.32 O ATOM 211 CB PHE A 28 -11.736 -1.320 7.781 1.00 14.42 C ATOM 212 CG PHE A 28 -10.373 -1.367 7.157 1.00 11.33 C ATOM 213 CD1 PHE A 28 -10.182 -1.797 5.851 1.00 35.22 C ATOM 214 CD2 PHE A 28 -9.281 -0.929 7.878 1.00 61.25 C ATOM 215 CE1 PHE A 28 -8.917 -1.787 5.292 1.00 60.31 C ATOM 216 CE2 PHE A 28 -8.028 -0.928 7.325 1.00 33.32 C ATOM 217 CZ PHE A 28 -7.842 -1.351 6.030 1.00 3.21 C ATOM 0 H PHE A 28 -13.598 -1.252 9.294 1.00 64.34 H new ATOM 0 HA PHE A 28 -12.458 -3.352 7.786 1.00 4.21 H new ATOM 0 HB2 PHE A 28 -12.460 -1.094 6.998 1.00 14.42 H new ATOM 0 HB3 PHE A 28 -11.758 -0.488 8.485 1.00 14.42 H new ATOM 0 HD1 PHE A 28 -11.024 -2.141 5.269 1.00 35.22 H new ATOM 0 HD2 PHE A 28 -9.416 -0.582 8.892 1.00 61.25 H new ATOM 0 HE1 PHE A 28 -8.774 -2.122 4.275 1.00 60.31 H new ATOM 0 HE2 PHE A 28 -7.183 -0.594 7.908 1.00 33.32 H new ATOM 0 HZ PHE A 28 -6.854 -1.341 5.594 1.00 3.21 H new ATOM 227 N ILE A 29 -10.757 -2.444 10.455 1.00 14.34 N ATOM 228 CA ILE A 29 -9.721 -2.882 11.368 1.00 23.54 C ATOM 229 C ILE A 29 -10.072 -4.187 12.035 1.00 63.23 C ATOM 230 O ILE A 29 -9.211 -5.051 12.174 1.00 61.42 O ATOM 231 CB ILE A 29 -9.308 -1.771 12.385 1.00 52.15 C ATOM 232 CG1 ILE A 29 -8.336 -0.776 11.732 1.00 51.11 C ATOM 233 CG2 ILE A 29 -8.737 -2.317 13.703 1.00 33.44 C ATOM 234 CD1 ILE A 29 -7.052 -1.414 11.223 1.00 1.21 C ATOM 0 H ILE A 29 -11.178 -1.547 10.696 1.00 14.34 H new ATOM 0 HA ILE A 29 -8.833 -3.074 10.766 1.00 23.54 H new ATOM 0 HB ILE A 29 -10.227 -1.251 12.656 1.00 52.15 H new ATOM 0 HG12 ILE A 29 -8.840 -0.283 10.901 1.00 51.11 H new ATOM 0 HG13 ILE A 29 -8.083 -0.001 12.456 1.00 51.11 H new ATOM 0 HG21 ILE A 29 -8.473 -1.486 14.357 1.00 33.44 H new ATOM 0 HG22 ILE A 29 -9.485 -2.941 14.192 1.00 33.44 H new ATOM 0 HG23 ILE A 29 -7.847 -2.912 13.495 1.00 33.44 H new ATOM 0 HD11 ILE A 29 -6.418 -0.649 10.776 1.00 1.21 H new ATOM 0 HD12 ILE A 29 -6.524 -1.883 12.054 1.00 1.21 H new ATOM 0 HD13 ILE A 29 -7.293 -2.169 10.474 1.00 1.21 H new ATOM 246 N ASP A 30 -11.330 -4.359 12.390 1.00 41.21 N ATOM 247 CA ASP A 30 -11.790 -5.600 12.983 1.00 34.20 C ATOM 248 C ASP A 30 -11.566 -6.745 12.036 1.00 11.24 C ATOM 249 O ASP A 30 -10.920 -7.708 12.398 1.00 4.11 O ATOM 250 CB ASP A 30 -13.267 -5.518 13.389 1.00 52.52 C ATOM 251 CG ASP A 30 -13.843 -6.849 13.818 1.00 73.23 C ATOM 252 OD1 ASP A 30 -13.704 -7.222 15.001 1.00 55.35 O ATOM 253 OD2 ASP A 30 -14.458 -7.534 12.975 1.00 12.12 O ATOM 0 H ASP A 30 -12.056 -3.651 12.277 1.00 41.21 H new ATOM 0 HA ASP A 30 -11.209 -5.772 13.889 1.00 34.20 H new ATOM 0 HB2 ASP A 30 -13.373 -4.804 14.205 1.00 52.52 H new ATOM 0 HB3 ASP A 30 -13.847 -5.132 12.550 1.00 52.52 H new ATOM 258 N LEU A 31 -11.994 -6.590 10.790 1.00 24.45 N ATOM 259 CA LEU A 31 -11.883 -7.672 9.833 1.00 30.05 C ATOM 260 C LEU A 31 -10.415 -7.955 9.486 1.00 2.22 C ATOM 261 O LEU A 31 -10.051 -9.080 9.195 1.00 12.01 O ATOM 262 CB LEU A 31 -12.773 -7.421 8.589 1.00 75.12 C ATOM 263 CG LEU A 31 -12.426 -6.237 7.675 1.00 30.33 C ATOM 264 CD1 LEU A 31 -11.297 -6.574 6.719 1.00 10.25 C ATOM 265 CD2 LEU A 31 -13.644 -5.753 6.927 1.00 22.22 C ATOM 0 H LEU A 31 -12.415 -5.735 10.426 1.00 24.45 H new ATOM 0 HA LEU A 31 -12.267 -8.582 10.295 1.00 30.05 H new ATOM 0 HB2 LEU A 31 -12.759 -8.326 7.981 1.00 75.12 H new ATOM 0 HB3 LEU A 31 -13.798 -7.285 8.935 1.00 75.12 H new ATOM 0 HG LEU A 31 -12.078 -5.426 8.315 1.00 30.33 H new ATOM 0 HD11 LEU A 31 -11.082 -5.710 6.090 1.00 10.25 H new ATOM 0 HD12 LEU A 31 -10.406 -6.839 7.288 1.00 10.25 H new ATOM 0 HD13 LEU A 31 -11.591 -7.415 6.091 1.00 10.25 H new ATOM 0 HD21 LEU A 31 -13.369 -4.914 6.288 1.00 22.22 H new ATOM 0 HD22 LEU A 31 -14.040 -6.562 6.313 1.00 22.22 H new ATOM 0 HD23 LEU A 31 -14.405 -5.432 7.639 1.00 22.22 H new ATOM 277 N VAL A 32 -9.580 -6.927 9.552 1.00 32.31 N ATOM 278 CA VAL A 32 -8.163 -7.084 9.317 1.00 50.21 C ATOM 279 C VAL A 32 -7.502 -7.812 10.505 1.00 61.25 C ATOM 280 O VAL A 32 -6.534 -8.553 10.344 1.00 50.30 O ATOM 281 CB VAL A 32 -7.483 -5.700 9.060 1.00 11.12 C ATOM 282 CG1 VAL A 32 -5.970 -5.819 9.018 1.00 45.40 C ATOM 283 CG2 VAL A 32 -7.968 -5.115 7.741 1.00 55.43 C ATOM 0 H VAL A 32 -9.868 -5.973 9.768 1.00 32.31 H new ATOM 0 HA VAL A 32 -8.027 -7.692 8.422 1.00 50.21 H new ATOM 0 HB VAL A 32 -7.758 -5.044 9.886 1.00 11.12 H new ATOM 0 HG11 VAL A 32 -5.533 -4.837 8.837 1.00 45.40 H new ATOM 0 HG12 VAL A 32 -5.609 -6.207 9.970 1.00 45.40 H new ATOM 0 HG13 VAL A 32 -5.681 -6.498 8.216 1.00 45.40 H new ATOM 0 HG21 VAL A 32 -7.488 -4.151 7.572 1.00 55.43 H new ATOM 0 HG22 VAL A 32 -7.715 -5.794 6.927 1.00 55.43 H new ATOM 0 HG23 VAL A 32 -9.049 -4.980 7.778 1.00 55.43 H new ATOM 293 N THR A 33 -8.078 -7.672 11.682 1.00 15.31 N ATOM 294 CA THR A 33 -7.506 -8.263 12.871 1.00 43.15 C ATOM 295 C THR A 33 -8.400 -9.385 13.345 1.00 12.01 C ATOM 296 O THR A 33 -8.388 -9.776 14.526 1.00 72.23 O ATOM 297 CB THR A 33 -7.325 -7.203 13.985 1.00 0.53 C ATOM 298 OG1 THR A 33 -8.569 -6.537 14.240 1.00 11.01 O ATOM 299 CG2 THR A 33 -6.276 -6.177 13.590 1.00 2.05 C ATOM 0 H THR A 33 -8.942 -7.153 11.839 1.00 15.31 H new ATOM 0 HA THR A 33 -6.520 -8.661 12.632 1.00 43.15 H new ATOM 0 HB THR A 33 -6.994 -7.716 14.888 1.00 0.53 H new ATOM 0 HG1 THR A 33 -8.653 -5.763 13.645 1.00 11.01 H new ATOM 0 HG21 THR A 33 -6.166 -5.443 14.388 1.00 2.05 H new ATOM 0 HG22 THR A 33 -5.322 -6.677 13.424 1.00 2.05 H new ATOM 0 HG23 THR A 33 -6.586 -5.674 12.674 1.00 2.05 H new ATOM 307 N LYS A 34 -9.176 -9.890 12.410 1.00 71.21 N ATOM 308 CA LYS A 34 -10.121 -10.942 12.652 1.00 31.42 C ATOM 309 C LYS A 34 -9.377 -12.188 13.076 1.00 73.24 C ATOM 310 O LYS A 34 -8.323 -12.514 12.505 1.00 22.21 O ATOM 311 CB LYS A 34 -10.934 -11.214 11.378 1.00 0.24 C ATOM 312 CG LYS A 34 -12.358 -11.707 11.612 1.00 74.24 C ATOM 313 CD LYS A 34 -13.167 -10.646 12.345 1.00 52.40 C ATOM 314 CE LYS A 34 -14.628 -11.009 12.481 1.00 44.21 C ATOM 315 NZ LYS A 34 -15.347 -10.002 13.282 1.00 31.04 N ATOM 0 H LYS A 34 -9.162 -9.569 11.442 1.00 71.21 H new ATOM 0 HA LYS A 34 -10.808 -10.646 13.445 1.00 31.42 H new ATOM 0 HB2 LYS A 34 -10.976 -10.297 10.790 1.00 0.24 H new ATOM 0 HB3 LYS A 34 -10.404 -11.954 10.778 1.00 0.24 H new ATOM 0 HG2 LYS A 34 -12.831 -11.941 10.658 1.00 74.24 H new ATOM 0 HG3 LYS A 34 -12.341 -12.628 12.194 1.00 74.24 H new ATOM 0 HD2 LYS A 34 -12.742 -10.493 13.337 1.00 52.40 H new ATOM 0 HD3 LYS A 34 -13.081 -9.699 11.812 1.00 52.40 H new ATOM 0 HE2 LYS A 34 -15.082 -11.085 11.493 1.00 44.21 H new ATOM 0 HE3 LYS A 34 -14.722 -11.988 12.951 1.00 44.21 H new ATOM 0 HZ1 LYS A 34 -16.362 -10.226 13.291 1.00 31.04 H new ATOM 0 HZ2 LYS A 34 -14.982 -10.008 14.256 1.00 31.04 H new ATOM 0 HZ3 LYS A 34 -15.204 -9.060 12.865 1.00 31.04 H new ATOM 329 N SER A 35 -9.901 -12.843 14.082 1.00 51.21 N ATOM 330 CA SER A 35 -9.328 -14.041 14.627 1.00 30.02 C ATOM 331 C SER A 35 -9.195 -15.123 13.542 1.00 32.33 C ATOM 332 O SER A 35 -9.971 -15.129 12.566 1.00 20.34 O ATOM 333 CB SER A 35 -10.221 -14.514 15.771 1.00 20.34 C ATOM 334 OG SER A 35 -10.461 -13.458 16.695 1.00 5.40 O ATOM 0 H SER A 35 -10.757 -12.549 14.553 1.00 51.21 H new ATOM 0 HA SER A 35 -8.324 -13.841 15.002 1.00 30.02 H new ATOM 0 HB2 SER A 35 -11.168 -14.877 15.373 1.00 20.34 H new ATOM 0 HB3 SER A 35 -9.749 -15.352 16.284 1.00 20.34 H new ATOM 0 HG SER A 35 -11.037 -13.782 17.419 1.00 5.40 H new ATOM 340 N PRO A 36 -8.226 -16.068 13.709 1.00 74.24 N ATOM 341 CA PRO A 36 -7.943 -17.155 12.738 1.00 4.24 C ATOM 342 C PRO A 36 -9.147 -18.054 12.479 1.00 35.22 C ATOM 343 O PRO A 36 -9.117 -18.925 11.601 1.00 64.33 O ATOM 344 CB PRO A 36 -6.801 -17.945 13.387 1.00 12.33 C ATOM 345 CG PRO A 36 -6.800 -17.532 14.815 1.00 44.32 C ATOM 346 CD PRO A 36 -7.303 -16.130 14.846 1.00 12.12 C ATOM 0 HA PRO A 36 -7.689 -16.752 11.758 1.00 4.24 H new ATOM 0 HB2 PRO A 36 -6.960 -19.019 13.288 1.00 12.33 H new ATOM 0 HB3 PRO A 36 -5.847 -17.719 12.912 1.00 12.33 H new ATOM 0 HG2 PRO A 36 -7.437 -18.187 15.409 1.00 44.32 H new ATOM 0 HG3 PRO A 36 -5.797 -17.594 15.237 1.00 44.32 H new ATOM 0 HD2 PRO A 36 -7.809 -15.907 15.785 1.00 12.12 H new ATOM 0 HD3 PRO A 36 -6.491 -15.411 14.742 1.00 12.12 H new ATOM 354 N ASP A 37 -10.201 -17.832 13.258 1.00 32.34 N ATOM 355 CA ASP A 37 -11.486 -18.509 13.062 1.00 24.41 C ATOM 356 C ASP A 37 -12.040 -18.140 11.682 1.00 22.31 C ATOM 357 O ASP A 37 -12.752 -18.924 11.041 1.00 75.34 O ATOM 358 CB ASP A 37 -12.480 -18.085 14.149 1.00 11.15 C ATOM 359 CG ASP A 37 -13.851 -18.713 13.992 1.00 34.43 C ATOM 360 OD1 ASP A 37 -14.768 -18.062 13.444 1.00 60.40 O ATOM 361 OD2 ASP A 37 -14.041 -19.863 14.431 1.00 51.04 O ATOM 0 H ASP A 37 -10.192 -17.180 14.042 1.00 32.34 H new ATOM 0 HA ASP A 37 -11.339 -19.587 13.126 1.00 24.41 H new ATOM 0 HB2 ASP A 37 -12.076 -18.353 15.125 1.00 11.15 H new ATOM 0 HB3 ASP A 37 -12.582 -17.000 14.134 1.00 11.15 H new ATOM 366 N SER A 38 -11.660 -16.973 11.215 1.00 52.43 N ATOM 367 CA SER A 38 -11.973 -16.542 9.897 1.00 74.03 C ATOM 368 C SER A 38 -10.764 -16.912 9.054 1.00 24.34 C ATOM 369 O SER A 38 -9.625 -16.523 9.387 1.00 65.45 O ATOM 370 CB SER A 38 -12.224 -15.019 9.870 1.00 22.33 C ATOM 371 OG SER A 38 -12.704 -14.574 8.599 1.00 34.42 O ATOM 0 H SER A 38 -11.119 -16.298 11.756 1.00 52.43 H new ATOM 0 HA SER A 38 -12.882 -17.010 9.519 1.00 74.03 H new ATOM 0 HB2 SER A 38 -12.948 -14.758 10.642 1.00 22.33 H new ATOM 0 HB3 SER A 38 -11.299 -14.496 10.111 1.00 22.33 H new ATOM 0 HG SER A 38 -12.851 -13.606 8.626 1.00 34.42 H new ATOM 377 N VAL A 39 -10.994 -17.689 8.013 1.00 2.41 N ATOM 378 CA VAL A 39 -9.930 -18.202 7.170 1.00 44.14 C ATOM 379 C VAL A 39 -9.097 -17.098 6.563 1.00 71.31 C ATOM 380 O VAL A 39 -7.867 -17.138 6.620 1.00 50.51 O ATOM 381 CB VAL A 39 -10.469 -19.110 6.044 1.00 4.31 C ATOM 382 CG1 VAL A 39 -9.340 -19.548 5.107 1.00 61.31 C ATOM 383 CG2 VAL A 39 -11.178 -20.323 6.627 1.00 2.02 C ATOM 0 H VAL A 39 -11.928 -17.984 7.727 1.00 2.41 H new ATOM 0 HA VAL A 39 -9.295 -18.795 7.828 1.00 44.14 H new ATOM 0 HB VAL A 39 -11.190 -18.535 5.462 1.00 4.31 H new ATOM 0 HG11 VAL A 39 -9.746 -20.187 4.322 1.00 61.31 H new ATOM 0 HG12 VAL A 39 -8.879 -18.669 4.657 1.00 61.31 H new ATOM 0 HG13 VAL A 39 -8.591 -20.101 5.674 1.00 61.31 H new ATOM 0 HG21 VAL A 39 -11.551 -20.951 5.817 1.00 2.02 H new ATOM 0 HG22 VAL A 39 -10.479 -20.895 7.237 1.00 2.02 H new ATOM 0 HG23 VAL A 39 -12.013 -19.994 7.245 1.00 2.02 H new ATOM 393 N ASN A 40 -9.735 -16.110 6.001 1.00 41.44 N ATOM 394 CA ASN A 40 -8.974 -15.109 5.348 1.00 14.11 C ATOM 395 C ASN A 40 -9.549 -13.727 5.577 1.00 51.43 C ATOM 396 O ASN A 40 -10.646 -13.417 5.113 1.00 3.23 O ATOM 397 CB ASN A 40 -8.877 -15.396 3.856 1.00 33.05 C ATOM 398 CG ASN A 40 -7.761 -14.622 3.247 1.00 73.32 C ATOM 399 OD1 ASN A 40 -7.853 -14.150 2.142 1.00 60.42 O ATOM 400 ND2 ASN A 40 -6.661 -14.594 3.931 1.00 61.23 N ATOM 0 H ASN A 40 -10.747 -15.986 5.986 1.00 41.44 H new ATOM 0 HA ASN A 40 -7.973 -15.130 5.780 1.00 14.11 H new ATOM 0 HB2 ASN A 40 -8.718 -16.462 3.694 1.00 33.05 H new ATOM 0 HB3 ASN A 40 -9.816 -15.136 3.368 1.00 33.05 H new ATOM 0 HD21 ASN A 40 -5.826 -14.159 3.537 1.00 61.23 H new ATOM 0 HD22 ASN A 40 -6.630 -15.006 4.863 1.00 61.23 H new ATOM 407 N SER A 41 -8.799 -12.898 6.269 1.00 54.52 N ATOM 408 CA SER A 41 -9.194 -11.533 6.574 1.00 44.21 C ATOM 409 C SER A 41 -9.409 -10.725 5.277 1.00 31.23 C ATOM 410 O SER A 41 -10.296 -9.865 5.194 1.00 33.31 O ATOM 411 CB SER A 41 -8.098 -10.908 7.427 1.00 24.30 C ATOM 412 OG SER A 41 -7.791 -11.760 8.534 1.00 72.22 O ATOM 0 H SER A 41 -7.885 -13.153 6.642 1.00 54.52 H new ATOM 0 HA SER A 41 -10.139 -11.527 7.118 1.00 44.21 H new ATOM 0 HB2 SER A 41 -7.205 -10.746 6.824 1.00 24.30 H new ATOM 0 HB3 SER A 41 -8.420 -9.931 7.788 1.00 24.30 H new ATOM 0 HG SER A 41 -7.084 -11.351 9.076 1.00 72.22 H new ATOM 418 N GLU A 42 -8.631 -11.059 4.261 1.00 34.34 N ATOM 419 CA GLU A 42 -8.690 -10.437 2.954 1.00 33.12 C ATOM 420 C GLU A 42 -10.023 -10.724 2.279 1.00 51.13 C ATOM 421 O GLU A 42 -10.479 -9.950 1.443 1.00 41.45 O ATOM 422 CB GLU A 42 -7.530 -10.896 2.034 1.00 63.00 C ATOM 423 CG GLU A 42 -6.110 -10.593 2.534 1.00 13.11 C ATOM 424 CD GLU A 42 -5.703 -11.420 3.738 1.00 30.55 C ATOM 425 OE1 GLU A 42 -5.071 -12.484 3.566 1.00 4.21 O ATOM 426 OE2 GLU A 42 -6.033 -11.038 4.861 1.00 23.52 O ATOM 0 H GLU A 42 -7.923 -11.790 4.327 1.00 34.34 H new ATOM 0 HA GLU A 42 -8.588 -9.363 3.113 1.00 33.12 H new ATOM 0 HB2 GLU A 42 -7.618 -11.972 1.882 1.00 63.00 H new ATOM 0 HB3 GLU A 42 -7.658 -10.425 1.059 1.00 63.00 H new ATOM 0 HG2 GLU A 42 -5.402 -10.772 1.724 1.00 13.11 H new ATOM 0 HG3 GLU A 42 -6.041 -9.536 2.790 1.00 13.11 H new ATOM 433 N HIS A 43 -10.669 -11.812 2.676 1.00 63.14 N ATOM 434 CA HIS A 43 -11.960 -12.170 2.120 1.00 52.03 C ATOM 435 C HIS A 43 -12.993 -11.179 2.628 1.00 44.25 C ATOM 436 O HIS A 43 -13.823 -10.645 1.864 1.00 71.33 O ATOM 437 CB HIS A 43 -12.333 -13.606 2.534 1.00 53.13 C ATOM 438 CG HIS A 43 -13.650 -14.100 2.012 1.00 60.41 C ATOM 439 ND1 HIS A 43 -14.811 -14.110 2.748 1.00 71.42 N ATOM 440 CD2 HIS A 43 -13.965 -14.635 0.814 1.00 53.00 C ATOM 441 CE1 HIS A 43 -15.773 -14.640 1.996 1.00 73.11 C ATOM 442 NE2 HIS A 43 -15.308 -14.979 0.803 1.00 35.32 N ATOM 0 H HIS A 43 -10.317 -12.460 3.381 1.00 63.14 H new ATOM 0 HA HIS A 43 -11.924 -12.134 1.031 1.00 52.03 H new ATOM 0 HB2 HIS A 43 -11.549 -14.281 2.192 1.00 53.13 H new ATOM 0 HB3 HIS A 43 -12.348 -13.661 3.623 1.00 53.13 H new ATOM 0 HD1 HIS A 43 -14.917 -13.770 3.704 1.00 71.42 H new ATOM 0 HD2 HIS A 43 -13.278 -14.774 -0.008 1.00 53.00 H new ATOM 0 HE1 HIS A 43 -16.796 -14.775 2.316 1.00 73.11 H new ATOM 450 N GLU A 44 -12.884 -10.883 3.903 1.00 54.01 N ATOM 451 CA GLU A 44 -13.765 -9.984 4.566 1.00 23.23 C ATOM 452 C GLU A 44 -13.466 -8.569 4.098 1.00 42.34 C ATOM 453 O GLU A 44 -14.358 -7.720 4.026 1.00 21.10 O ATOM 454 CB GLU A 44 -13.538 -10.117 6.057 1.00 3.03 C ATOM 455 CG GLU A 44 -13.512 -11.566 6.524 1.00 55.53 C ATOM 456 CD GLU A 44 -14.785 -12.322 6.219 1.00 51.25 C ATOM 457 OE1 GLU A 44 -14.812 -13.108 5.244 1.00 34.41 O ATOM 458 OE2 GLU A 44 -15.768 -12.168 6.952 1.00 41.14 O ATOM 0 H GLU A 44 -12.163 -11.274 4.509 1.00 54.01 H new ATOM 0 HA GLU A 44 -14.806 -10.212 4.339 1.00 23.23 H new ATOM 0 HB2 GLU A 44 -12.595 -9.638 6.320 1.00 3.03 H new ATOM 0 HB3 GLU A 44 -14.326 -9.583 6.589 1.00 3.03 H new ATOM 0 HG2 GLU A 44 -12.673 -12.077 6.051 1.00 55.53 H new ATOM 0 HG3 GLU A 44 -13.334 -11.590 7.599 1.00 55.53 H new ATOM 465 N LEU A 45 -12.208 -8.332 3.757 1.00 60.45 N ATOM 466 CA LEU A 45 -11.780 -7.068 3.234 1.00 44.21 C ATOM 467 C LEU A 45 -12.334 -6.868 1.835 1.00 14.42 C ATOM 468 O LEU A 45 -12.797 -5.789 1.504 1.00 33.45 O ATOM 469 CB LEU A 45 -10.258 -6.972 3.226 1.00 63.13 C ATOM 470 CG LEU A 45 -9.691 -5.652 2.725 1.00 20.45 C ATOM 471 CD1 LEU A 45 -10.161 -4.503 3.588 1.00 70.25 C ATOM 472 CD2 LEU A 45 -8.174 -5.702 2.647 1.00 35.14 C ATOM 0 H LEU A 45 -11.461 -9.022 3.840 1.00 60.45 H new ATOM 0 HA LEU A 45 -12.164 -6.278 3.880 1.00 44.21 H new ATOM 0 HB2 LEU A 45 -9.895 -7.143 4.239 1.00 63.13 H new ATOM 0 HB3 LEU A 45 -9.863 -7.777 2.606 1.00 63.13 H new ATOM 0 HG LEU A 45 -10.065 -5.485 1.715 1.00 20.45 H new ATOM 0 HD11 LEU A 45 -9.743 -3.570 3.211 1.00 70.25 H new ATOM 0 HD12 LEU A 45 -11.249 -4.450 3.562 1.00 70.25 H new ATOM 0 HD13 LEU A 45 -9.830 -4.660 4.615 1.00 70.25 H new ATOM 0 HD21 LEU A 45 -7.797 -4.745 2.286 1.00 35.14 H new ATOM 0 HD22 LEU A 45 -7.765 -5.903 3.637 1.00 35.14 H new ATOM 0 HD23 LEU A 45 -7.871 -6.494 1.962 1.00 35.14 H new ATOM 484 N ALA A 46 -12.311 -7.926 1.030 1.00 51.42 N ATOM 485 CA ALA A 46 -12.872 -7.889 -0.318 1.00 63.50 C ATOM 486 C ALA A 46 -14.363 -7.619 -0.244 1.00 62.33 C ATOM 487 O ALA A 46 -14.933 -6.919 -1.078 1.00 44.34 O ATOM 488 CB ALA A 46 -12.594 -9.189 -1.058 1.00 32.12 C ATOM 0 H ALA A 46 -11.907 -8.826 1.290 1.00 51.42 H new ATOM 0 HA ALA A 46 -12.394 -7.083 -0.875 1.00 63.50 H new ATOM 0 HB1 ALA A 46 -13.022 -9.136 -2.059 1.00 32.12 H new ATOM 0 HB2 ALA A 46 -11.517 -9.343 -1.131 1.00 32.12 H new ATOM 0 HB3 ALA A 46 -13.043 -10.020 -0.515 1.00 32.12 H new ATOM 494 N HIS A 47 -14.970 -8.152 0.790 1.00 65.42 N ATOM 495 CA HIS A 47 -16.383 -7.935 1.058 1.00 54.41 C ATOM 496 C HIS A 47 -16.614 -6.469 1.465 1.00 75.33 C ATOM 497 O HIS A 47 -17.574 -5.837 1.036 1.00 1.12 O ATOM 498 CB HIS A 47 -16.862 -8.907 2.163 1.00 63.33 C ATOM 499 CG HIS A 47 -18.311 -8.771 2.555 1.00 22.34 C ATOM 500 ND1 HIS A 47 -18.735 -8.404 3.818 1.00 72.41 N ATOM 501 CD2 HIS A 47 -19.435 -8.982 1.830 1.00 13.45 C ATOM 502 CE1 HIS A 47 -20.069 -8.402 3.824 1.00 74.23 C ATOM 503 NE2 HIS A 47 -20.551 -8.749 2.636 1.00 52.20 N ATOM 0 H HIS A 47 -14.503 -8.749 1.473 1.00 65.42 H new ATOM 0 HA HIS A 47 -16.964 -8.134 0.157 1.00 54.41 H new ATOM 0 HB2 HIS A 47 -16.688 -9.929 1.826 1.00 63.33 H new ATOM 0 HB3 HIS A 47 -16.247 -8.755 3.050 1.00 63.33 H new ATOM 0 HD2 HIS A 47 -19.464 -9.283 0.793 1.00 13.45 H new ATOM 0 HE1 HIS A 47 -20.676 -8.151 4.681 1.00 74.23 H new ATOM 0 HE2 HIS A 47 -21.532 -8.829 2.368 1.00 52.20 H new ATOM 511 N PHE A 48 -15.690 -5.937 2.246 1.00 44.44 N ATOM 512 CA PHE A 48 -15.752 -4.578 2.734 1.00 34.42 C ATOM 513 C PHE A 48 -15.579 -3.571 1.594 1.00 3.20 C ATOM 514 O PHE A 48 -16.278 -2.563 1.525 1.00 65.54 O ATOM 515 CB PHE A 48 -14.658 -4.392 3.783 1.00 3.15 C ATOM 516 CG PHE A 48 -14.561 -3.015 4.354 1.00 62.41 C ATOM 517 CD1 PHE A 48 -15.392 -2.627 5.373 1.00 62.52 C ATOM 518 CD2 PHE A 48 -13.633 -2.120 3.868 1.00 53.40 C ATOM 519 CE1 PHE A 48 -15.312 -1.363 5.907 1.00 61.12 C ATOM 520 CE2 PHE A 48 -13.541 -0.852 4.390 1.00 75.20 C ATOM 521 CZ PHE A 48 -14.385 -0.471 5.415 1.00 74.31 C ATOM 0 H PHE A 48 -14.865 -6.448 2.561 1.00 44.44 H new ATOM 0 HA PHE A 48 -16.731 -4.398 3.178 1.00 34.42 H new ATOM 0 HB2 PHE A 48 -14.832 -5.096 4.597 1.00 3.15 H new ATOM 0 HB3 PHE A 48 -13.699 -4.653 3.336 1.00 3.15 H new ATOM 0 HD1 PHE A 48 -16.120 -3.324 5.762 1.00 62.52 H new ATOM 0 HD2 PHE A 48 -12.971 -2.418 3.068 1.00 53.40 H new ATOM 0 HE1 PHE A 48 -15.973 -1.070 6.709 1.00 61.12 H new ATOM 0 HE2 PHE A 48 -12.812 -0.157 4.001 1.00 75.20 H new ATOM 0 HZ PHE A 48 -14.318 0.524 5.830 1.00 74.31 H new ATOM 531 N LEU A 49 -14.660 -3.863 0.699 1.00 45.42 N ATOM 532 CA LEU A 49 -14.363 -2.970 -0.402 1.00 72.20 C ATOM 533 C LEU A 49 -15.355 -3.150 -1.541 1.00 1.20 C ATOM 534 O LEU A 49 -15.294 -2.434 -2.522 1.00 63.42 O ATOM 535 CB LEU A 49 -12.901 -3.147 -0.874 1.00 74.50 C ATOM 536 CG LEU A 49 -12.529 -4.505 -1.487 1.00 13.41 C ATOM 537 CD1 LEU A 49 -12.888 -4.594 -2.967 1.00 65.52 C ATOM 538 CD2 LEU A 49 -11.074 -4.829 -1.249 1.00 51.11 C ATOM 0 H LEU A 49 -14.102 -4.717 0.712 1.00 45.42 H new ATOM 0 HA LEU A 49 -14.469 -1.945 -0.047 1.00 72.20 H new ATOM 0 HB2 LEU A 49 -12.686 -2.372 -1.610 1.00 74.50 H new ATOM 0 HB3 LEU A 49 -12.245 -2.968 -0.022 1.00 74.50 H new ATOM 0 HG LEU A 49 -13.129 -5.259 -0.977 1.00 13.41 H new ATOM 0 HD11 LEU A 49 -12.604 -5.574 -3.352 1.00 65.52 H new ATOM 0 HD12 LEU A 49 -13.962 -4.453 -3.090 1.00 65.52 H new ATOM 0 HD13 LEU A 49 -12.355 -3.819 -3.518 1.00 65.52 H new ATOM 0 HD21 LEU A 49 -10.839 -5.796 -1.694 1.00 51.11 H new ATOM 0 HD22 LEU A 49 -10.451 -4.059 -1.704 1.00 51.11 H new ATOM 0 HD23 LEU A 49 -10.880 -4.866 -0.177 1.00 51.11 H new ATOM 550 N GLY A 50 -16.247 -4.119 -1.391 1.00 51.31 N ATOM 551 CA GLY A 50 -17.293 -4.387 -2.373 1.00 64.21 C ATOM 552 C GLY A 50 -18.022 -3.120 -2.826 1.00 25.14 C ATOM 553 O GLY A 50 -18.089 -2.856 -4.008 1.00 50.03 O ATOM 0 H GLY A 50 -16.267 -4.743 -0.585 1.00 51.31 H new ATOM 0 HA2 GLY A 50 -16.852 -4.877 -3.241 1.00 64.21 H new ATOM 0 HA3 GLY A 50 -18.015 -5.083 -1.947 1.00 64.21 H new ATOM 557 N PRO A 51 -18.636 -2.364 -1.897 1.00 52.51 N ATOM 558 CA PRO A 51 -19.231 -1.053 -2.175 1.00 60.54 C ATOM 559 C PRO A 51 -18.206 0.114 -2.082 1.00 14.45 C ATOM 560 O PRO A 51 -18.544 1.272 -2.328 1.00 41.05 O ATOM 561 CB PRO A 51 -20.315 -0.897 -1.089 1.00 30.22 C ATOM 562 CG PRO A 51 -20.199 -2.098 -0.195 1.00 55.34 C ATOM 563 CD PRO A 51 -18.884 -2.753 -0.500 1.00 23.14 C ATOM 0 HA PRO A 51 -19.617 -1.007 -3.193 1.00 60.54 H new ATOM 0 HB2 PRO A 51 -20.168 0.023 -0.524 1.00 30.22 H new ATOM 0 HB3 PRO A 51 -21.307 -0.841 -1.537 1.00 30.22 H new ATOM 0 HG2 PRO A 51 -20.248 -1.803 0.853 1.00 55.34 H new ATOM 0 HG3 PRO A 51 -21.023 -2.789 -0.371 1.00 55.34 H new ATOM 0 HD2 PRO A 51 -18.094 -2.400 0.163 1.00 23.14 H new ATOM 0 HD3 PRO A 51 -18.936 -3.836 -0.386 1.00 23.14 H new ATOM 571 N HIS A 52 -16.976 -0.194 -1.707 1.00 31.34 N ATOM 572 CA HIS A 52 -15.983 0.816 -1.328 1.00 64.42 C ATOM 573 C HIS A 52 -14.735 0.640 -2.152 1.00 54.43 C ATOM 574 O HIS A 52 -13.625 0.857 -1.674 1.00 62.04 O ATOM 575 CB HIS A 52 -15.643 0.715 0.183 1.00 51.12 C ATOM 576 CG HIS A 52 -16.771 1.081 1.108 1.00 52.25 C ATOM 577 ND1 HIS A 52 -16.875 2.293 1.758 1.00 4.14 N ATOM 578 CD2 HIS A 52 -17.857 0.370 1.481 1.00 41.13 C ATOM 579 CE1 HIS A 52 -17.993 2.280 2.484 1.00 11.23 C ATOM 580 NE2 HIS A 52 -18.632 1.132 2.350 1.00 52.12 N ATOM 0 H HIS A 52 -16.630 -1.152 -1.654 1.00 31.34 H new ATOM 0 HA HIS A 52 -16.403 1.804 -1.518 1.00 64.42 H new ATOM 0 HB2 HIS A 52 -15.328 -0.305 0.403 1.00 51.12 H new ATOM 0 HB3 HIS A 52 -14.793 1.364 0.394 1.00 51.12 H new ATOM 0 HD1 HIS A 52 -16.212 3.065 1.694 1.00 4.14 H new ATOM 0 HD2 HIS A 52 -18.088 -0.634 1.156 1.00 41.13 H new ATOM 0 HE1 HIS A 52 -18.331 3.100 3.100 1.00 11.23 H new ATOM 588 N ASP A 53 -14.962 0.305 -3.409 1.00 12.11 N ATOM 589 CA ASP A 53 -13.959 0.062 -4.425 1.00 62.44 C ATOM 590 C ASP A 53 -12.968 1.225 -4.573 1.00 50.12 C ATOM 591 O ASP A 53 -13.323 2.287 -5.097 1.00 54.13 O ATOM 592 CB ASP A 53 -14.685 -0.020 -5.768 1.00 51.30 C ATOM 593 CG ASP A 53 -15.638 -1.155 -5.963 1.00 62.41 C ATOM 594 OD1 ASP A 53 -16.797 -1.021 -5.569 1.00 14.42 O ATOM 595 OD2 ASP A 53 -15.270 -2.162 -6.607 1.00 62.33 O ATOM 0 H ASP A 53 -15.910 0.189 -3.768 1.00 12.11 H new ATOM 0 HA ASP A 53 -13.418 -0.841 -4.142 1.00 62.44 H new ATOM 0 HB2 ASP A 53 -15.234 0.910 -5.912 1.00 51.30 H new ATOM 0 HB3 ASP A 53 -13.933 -0.072 -6.556 1.00 51.30 H new ATOM 600 N PRO A 54 -11.720 1.051 -4.114 1.00 41.11 N ATOM 601 CA PRO A 54 -10.681 2.044 -4.257 1.00 43.34 C ATOM 602 C PRO A 54 -9.739 1.694 -5.420 1.00 41.33 C ATOM 603 O PRO A 54 -10.074 0.863 -6.277 1.00 62.23 O ATOM 604 CB PRO A 54 -9.943 1.904 -2.930 1.00 33.23 C ATOM 605 CG PRO A 54 -10.073 0.451 -2.557 1.00 52.40 C ATOM 606 CD PRO A 54 -11.222 -0.120 -3.367 1.00 64.51 C ATOM 0 HA PRO A 54 -11.056 3.045 -4.468 1.00 43.34 H new ATOM 0 HB2 PRO A 54 -8.897 2.193 -3.029 1.00 33.23 H new ATOM 0 HB3 PRO A 54 -10.380 2.547 -2.166 1.00 33.23 H new ATOM 0 HG2 PRO A 54 -9.148 -0.085 -2.770 1.00 52.40 H new ATOM 0 HG3 PRO A 54 -10.264 0.344 -1.489 1.00 52.40 H new ATOM 0 HD2 PRO A 54 -10.888 -0.913 -4.036 1.00 64.51 H new ATOM 0 HD3 PRO A 54 -11.993 -0.547 -2.726 1.00 64.51 H new ATOM 614 N GLU A 55 -8.593 2.334 -5.469 1.00 55.43 N ATOM 615 CA GLU A 55 -7.588 1.991 -6.443 1.00 2.12 C ATOM 616 C GLU A 55 -6.593 1.111 -5.763 1.00 4.45 C ATOM 617 O GLU A 55 -6.000 1.495 -4.759 1.00 30.11 O ATOM 618 CB GLU A 55 -6.931 3.239 -7.002 1.00 21.43 C ATOM 619 CG GLU A 55 -7.920 4.162 -7.692 1.00 63.14 C ATOM 620 CD GLU A 55 -7.293 5.420 -8.229 1.00 70.42 C ATOM 621 OE1 GLU A 55 -7.092 5.529 -9.454 1.00 62.23 O ATOM 622 OE2 GLU A 55 -6.999 6.337 -7.446 1.00 40.11 O ATOM 0 H GLU A 55 -8.335 3.097 -4.843 1.00 55.43 H new ATOM 0 HA GLU A 55 -8.034 1.469 -7.289 1.00 2.12 H new ATOM 0 HB2 GLU A 55 -6.439 3.779 -6.193 1.00 21.43 H new ATOM 0 HB3 GLU A 55 -6.155 2.950 -7.710 1.00 21.43 H new ATOM 0 HG2 GLU A 55 -8.396 3.624 -8.512 1.00 63.14 H new ATOM 0 HG3 GLU A 55 -8.707 4.430 -6.987 1.00 63.14 H new ATOM 629 N ILE A 56 -6.446 -0.064 -6.245 1.00 40.54 N ATOM 630 CA ILE A 56 -5.599 -1.011 -5.598 1.00 24.34 C ATOM 631 C ILE A 56 -4.269 -1.057 -6.316 1.00 72.11 C ATOM 632 O ILE A 56 -4.199 -1.431 -7.432 1.00 25.40 O ATOM 633 CB ILE A 56 -6.293 -2.392 -5.574 1.00 30.34 C ATOM 634 CG1 ILE A 56 -7.622 -2.278 -4.807 1.00 20.10 C ATOM 635 CG2 ILE A 56 -5.395 -3.417 -4.924 1.00 14.01 C ATOM 636 CD1 ILE A 56 -8.561 -3.432 -5.005 1.00 10.45 C ATOM 0 H ILE A 56 -6.902 -0.403 -7.092 1.00 40.54 H new ATOM 0 HA ILE A 56 -5.414 -0.717 -4.565 1.00 24.34 H new ATOM 0 HB ILE A 56 -6.494 -2.715 -6.595 1.00 30.34 H new ATOM 0 HG12 ILE A 56 -7.405 -2.182 -3.743 1.00 20.10 H new ATOM 0 HG13 ILE A 56 -8.125 -1.361 -5.113 1.00 20.10 H new ATOM 0 HG21 ILE A 56 -5.896 -4.385 -4.914 1.00 14.01 H new ATOM 0 HG22 ILE A 56 -4.465 -3.496 -5.487 1.00 14.01 H new ATOM 0 HG23 ILE A 56 -5.175 -3.111 -3.901 1.00 14.01 H new ATOM 0 HD11 ILE A 56 -9.470 -3.265 -4.427 1.00 10.45 H new ATOM 0 HD12 ILE A 56 -8.814 -3.518 -6.062 1.00 10.45 H new ATOM 0 HD13 ILE A 56 -8.082 -4.352 -4.670 1.00 10.45 H new ATOM 648 N TYR A 57 -3.244 -0.614 -5.685 1.00 64.54 N ATOM 649 CA TYR A 57 -1.938 -0.588 -6.300 1.00 22.24 C ATOM 650 C TYR A 57 -1.116 -1.768 -5.901 1.00 54.25 C ATOM 651 O TYR A 57 -0.597 -1.820 -4.832 1.00 70.44 O ATOM 652 CB TYR A 57 -1.215 0.708 -5.990 1.00 75.12 C ATOM 653 CG TYR A 57 -1.838 1.887 -6.682 1.00 13.13 C ATOM 654 CD1 TYR A 57 -2.832 2.631 -6.067 1.00 61.31 C ATOM 655 CD2 TYR A 57 -1.463 2.231 -7.965 1.00 11.45 C ATOM 656 CE1 TYR A 57 -3.428 3.687 -6.713 1.00 43.33 C ATOM 657 CE2 TYR A 57 -2.055 3.294 -8.615 1.00 21.12 C ATOM 658 CZ TYR A 57 -3.039 4.015 -7.986 1.00 71.14 C ATOM 659 OH TYR A 57 -3.642 5.068 -8.636 1.00 53.12 O ATOM 0 H TYR A 57 -3.270 -0.257 -4.730 1.00 64.54 H new ATOM 0 HA TYR A 57 -2.086 -0.643 -7.378 1.00 22.24 H new ATOM 0 HB2 TYR A 57 -1.221 0.876 -4.913 1.00 75.12 H new ATOM 0 HB3 TYR A 57 -0.172 0.621 -6.293 1.00 75.12 H new ATOM 0 HD1 TYR A 57 -3.143 2.377 -5.064 1.00 61.31 H new ATOM 0 HD2 TYR A 57 -0.696 1.660 -8.467 1.00 11.45 H new ATOM 0 HE1 TYR A 57 -4.201 4.257 -6.219 1.00 43.33 H new ATOM 0 HE2 TYR A 57 -1.745 3.558 -9.615 1.00 21.12 H new ATOM 0 HH TYR A 57 -3.251 5.169 -9.529 1.00 53.12 H new ATOM 669 N VAL A 58 -0.953 -2.677 -6.788 1.00 4.32 N ATOM 670 CA VAL A 58 -0.256 -3.906 -6.495 1.00 34.44 C ATOM 671 C VAL A 58 0.953 -3.962 -7.342 1.00 43.24 C ATOM 672 O VAL A 58 0.863 -3.798 -8.552 1.00 32.14 O ATOM 673 CB VAL A 58 -1.136 -5.144 -6.750 1.00 60.42 C ATOM 674 CG1 VAL A 58 -0.349 -6.443 -6.603 1.00 42.11 C ATOM 675 CG2 VAL A 58 -2.303 -5.147 -5.812 1.00 12.53 C ATOM 0 H VAL A 58 -1.295 -2.605 -7.746 1.00 4.32 H new ATOM 0 HA VAL A 58 0.009 -3.917 -5.438 1.00 34.44 H new ATOM 0 HB VAL A 58 -1.492 -5.087 -7.779 1.00 60.42 H new ATOM 0 HG11 VAL A 58 -1.008 -7.291 -6.791 1.00 42.11 H new ATOM 0 HG12 VAL A 58 0.471 -6.455 -7.321 1.00 42.11 H new ATOM 0 HG13 VAL A 58 0.052 -6.513 -5.592 1.00 42.11 H new ATOM 0 HG21 VAL A 58 -2.919 -6.026 -6.000 1.00 12.53 H new ATOM 0 HG22 VAL A 58 -1.943 -5.170 -4.783 1.00 12.53 H new ATOM 0 HG23 VAL A 58 -2.898 -4.247 -5.968 1.00 12.53 H new ATOM 685 N ASN A 59 2.088 -4.116 -6.691 1.00 10.32 N ATOM 686 CA ASN A 59 3.424 -4.164 -7.333 1.00 43.12 C ATOM 687 C ASN A 59 3.735 -2.808 -7.948 1.00 20.14 C ATOM 688 O ASN A 59 4.634 -2.679 -8.779 1.00 43.52 O ATOM 689 CB ASN A 59 3.508 -5.246 -8.458 1.00 72.51 C ATOM 690 CG ASN A 59 3.089 -6.657 -8.058 1.00 14.40 C ATOM 691 OD1 ASN A 59 2.604 -7.420 -8.883 1.00 34.50 O ATOM 692 ND2 ASN A 59 3.291 -7.034 -6.830 1.00 65.23 N ATOM 0 H ASN A 59 2.129 -4.215 -5.677 1.00 10.32 H new ATOM 0 HA ASN A 59 4.145 -4.424 -6.558 1.00 43.12 H new ATOM 0 HB2 ASN A 59 2.883 -4.925 -9.291 1.00 72.51 H new ATOM 0 HB3 ASN A 59 4.534 -5.283 -8.824 1.00 72.51 H new ATOM 0 HD21 ASN A 59 3.044 -7.980 -6.540 1.00 65.23 H new ATOM 0 HD22 ASN A 59 3.696 -6.384 -6.157 1.00 65.23 H new ATOM 699 N GLY A 60 3.026 -1.789 -7.477 1.00 31.53 N ATOM 700 CA GLY A 60 3.169 -0.467 -8.024 1.00 33.41 C ATOM 701 C GLY A 60 2.312 -0.288 -9.265 1.00 74.41 C ATOM 702 O GLY A 60 2.471 0.680 -9.998 1.00 62.42 O ATOM 0 H GLY A 60 2.349 -1.864 -6.717 1.00 31.53 H new ATOM 0 HA2 GLY A 60 2.886 0.272 -7.274 1.00 33.41 H new ATOM 0 HA3 GLY A 60 4.215 -0.285 -8.272 1.00 33.41 H new ATOM 706 N LYS A 61 1.418 -1.232 -9.502 1.00 63.44 N ATOM 707 CA LYS A 61 0.543 -1.213 -10.653 1.00 25.44 C ATOM 708 C LYS A 61 -0.881 -1.032 -10.218 1.00 44.45 C ATOM 709 O LYS A 61 -1.304 -1.606 -9.229 1.00 21.41 O ATOM 710 CB LYS A 61 0.696 -2.494 -11.485 1.00 55.41 C ATOM 711 CG LYS A 61 2.073 -2.699 -12.089 1.00 11.11 C ATOM 712 CD LYS A 61 2.407 -1.589 -13.060 1.00 12.23 C ATOM 713 CE LYS A 61 3.777 -1.769 -13.667 1.00 71.41 C ATOM 714 NZ LYS A 61 4.099 -0.682 -14.605 1.00 50.34 N ATOM 0 H LYS A 61 1.281 -2.039 -8.893 1.00 63.44 H new ATOM 0 HA LYS A 61 0.827 -0.370 -11.284 1.00 25.44 H new ATOM 0 HB2 LYS A 61 0.460 -3.351 -10.854 1.00 55.41 H new ATOM 0 HB3 LYS A 61 -0.040 -2.478 -12.289 1.00 55.41 H new ATOM 0 HG2 LYS A 61 2.821 -2.732 -11.297 1.00 11.11 H new ATOM 0 HG3 LYS A 61 2.110 -3.660 -12.602 1.00 11.11 H new ATOM 0 HD2 LYS A 61 1.659 -1.562 -13.852 1.00 12.23 H new ATOM 0 HD3 LYS A 61 2.361 -0.629 -12.545 1.00 12.23 H new ATOM 0 HE2 LYS A 61 4.525 -1.801 -12.875 1.00 71.41 H new ATOM 0 HE3 LYS A 61 3.822 -2.726 -14.188 1.00 71.41 H new ATOM 0 HZ1 LYS A 61 5.047 -0.837 -15.004 1.00 50.34 H new ATOM 0 HZ2 LYS A 61 3.398 -0.668 -15.373 1.00 50.34 H new ATOM 0 HZ3 LYS A 61 4.080 0.228 -14.102 1.00 50.34 H new ATOM 728 N ILE A 62 -1.609 -0.245 -10.953 1.00 72.34 N ATOM 729 CA ILE A 62 -2.974 0.053 -10.615 1.00 32.12 C ATOM 730 C ILE A 62 -3.862 -1.162 -10.980 1.00 15.42 C ATOM 731 O ILE A 62 -3.811 -1.702 -12.096 1.00 74.41 O ATOM 732 CB ILE A 62 -3.443 1.398 -11.305 1.00 71.12 C ATOM 733 CG1 ILE A 62 -4.650 2.070 -10.587 1.00 73.55 C ATOM 734 CG2 ILE A 62 -3.723 1.218 -12.788 1.00 72.00 C ATOM 735 CD1 ILE A 62 -5.958 1.321 -10.612 1.00 54.52 C ATOM 0 H ILE A 62 -1.276 0.209 -11.803 1.00 72.34 H new ATOM 0 HA ILE A 62 -3.068 0.221 -9.542 1.00 32.12 H new ATOM 0 HB ILE A 62 -2.599 2.081 -11.205 1.00 71.12 H new ATOM 0 HG12 ILE A 62 -4.375 2.239 -9.546 1.00 73.55 H new ATOM 0 HG13 ILE A 62 -4.811 3.050 -11.037 1.00 73.55 H new ATOM 0 HG21 ILE A 62 -4.042 2.168 -13.216 1.00 72.00 H new ATOM 0 HG22 ILE A 62 -2.817 0.879 -13.291 1.00 72.00 H new ATOM 0 HG23 ILE A 62 -4.511 0.477 -12.922 1.00 72.00 H new ATOM 0 HD11 ILE A 62 -6.716 1.895 -10.079 1.00 54.52 H new ATOM 0 HD12 ILE A 62 -6.274 1.175 -11.645 1.00 54.52 H new ATOM 0 HD13 ILE A 62 -5.831 0.351 -10.130 1.00 54.52 H new ATOM 747 N GLN A 63 -4.584 -1.620 -10.024 1.00 62.51 N ATOM 748 CA GLN A 63 -5.455 -2.743 -10.157 1.00 45.13 C ATOM 749 C GLN A 63 -6.845 -2.313 -9.753 1.00 4.24 C ATOM 750 O GLN A 63 -7.019 -1.492 -8.815 1.00 70.42 O ATOM 751 CB GLN A 63 -5.044 -3.877 -9.199 1.00 44.42 C ATOM 752 CG GLN A 63 -3.577 -4.271 -9.210 1.00 22.33 C ATOM 753 CD GLN A 63 -3.072 -4.757 -10.541 1.00 65.13 C ATOM 754 OE1 GLN A 63 -3.815 -5.313 -11.344 1.00 13.41 O ATOM 755 NE2 GLN A 63 -1.803 -4.564 -10.776 1.00 60.41 N ATOM 0 H GLN A 63 -4.589 -1.212 -9.089 1.00 62.51 H new ATOM 0 HA GLN A 63 -5.409 -3.095 -11.188 1.00 45.13 H new ATOM 0 HB2 GLN A 63 -5.311 -3.581 -8.184 1.00 44.42 H new ATOM 0 HB3 GLN A 63 -5.637 -4.759 -9.440 1.00 44.42 H new ATOM 0 HG2 GLN A 63 -2.981 -3.412 -8.901 1.00 22.33 H new ATOM 0 HG3 GLN A 63 -3.418 -5.053 -8.468 1.00 22.33 H new ATOM 0 HE21 GLN A 63 -1.221 -4.097 -10.081 1.00 60.41 H new ATOM 0 HE22 GLN A 63 -1.393 -4.880 -11.655 1.00 60.41 H new ATOM 764 N THR A 64 -7.814 -2.830 -10.443 1.00 22.44 N ATOM 765 CA THR A 64 -9.177 -2.625 -10.077 1.00 44.43 C ATOM 766 C THR A 64 -9.534 -3.636 -8.963 1.00 64.42 C ATOM 767 O THR A 64 -8.760 -4.575 -8.687 1.00 50.11 O ATOM 768 CB THR A 64 -10.133 -2.746 -11.322 1.00 52.02 C ATOM 769 OG1 THR A 64 -11.505 -2.641 -10.934 1.00 32.03 O ATOM 770 CG2 THR A 64 -9.921 -4.050 -12.076 1.00 64.32 C ATOM 0 H THR A 64 -7.680 -3.405 -11.275 1.00 22.44 H new ATOM 0 HA THR A 64 -9.313 -1.612 -9.698 1.00 44.43 H new ATOM 0 HB THR A 64 -9.883 -1.918 -11.986 1.00 52.02 H new ATOM 0 HG1 THR A 64 -12.076 -2.718 -11.727 1.00 32.03 H new ATOM 0 HG21 THR A 64 -10.600 -4.093 -12.927 1.00 64.32 H new ATOM 0 HG22 THR A 64 -8.892 -4.102 -12.430 1.00 64.32 H new ATOM 0 HG23 THR A 64 -10.119 -4.891 -11.411 1.00 64.32 H new ATOM 778 N THR A 65 -10.680 -3.464 -8.365 1.00 22.50 N ATOM 779 CA THR A 65 -11.136 -4.267 -7.245 1.00 10.11 C ATOM 780 C THR A 65 -11.359 -5.702 -7.681 1.00 4.22 C ATOM 781 O THR A 65 -11.081 -6.653 -6.945 1.00 15.31 O ATOM 782 CB THR A 65 -12.404 -3.624 -6.695 1.00 55.31 C ATOM 783 OG1 THR A 65 -13.366 -3.530 -7.741 1.00 73.14 O ATOM 784 CG2 THR A 65 -12.045 -2.233 -6.278 1.00 64.20 C ATOM 0 H THR A 65 -11.347 -2.744 -8.644 1.00 22.50 H new ATOM 0 HA THR A 65 -10.385 -4.299 -6.456 1.00 10.11 H new ATOM 0 HB THR A 65 -12.806 -4.207 -5.866 1.00 55.31 H new ATOM 0 HG1 THR A 65 -13.948 -2.758 -7.582 1.00 73.14 H new ATOM 0 HG21 THR A 65 -12.927 -1.734 -5.877 1.00 64.20 H new ATOM 0 HG22 THR A 65 -11.270 -2.271 -5.512 1.00 64.20 H new ATOM 0 HG23 THR A 65 -11.676 -1.678 -7.141 1.00 64.20 H new ATOM 792 N THR A 66 -11.794 -5.833 -8.905 1.00 11.31 N ATOM 793 CA THR A 66 -11.984 -7.112 -9.534 1.00 54.40 C ATOM 794 C THR A 66 -10.620 -7.838 -9.703 1.00 14.24 C ATOM 795 O THR A 66 -10.505 -9.040 -9.477 1.00 42.42 O ATOM 796 CB THR A 66 -12.637 -6.904 -10.906 1.00 60.02 C ATOM 797 OG1 THR A 66 -13.846 -6.147 -10.744 1.00 52.22 O ATOM 798 CG2 THR A 66 -12.942 -8.230 -11.570 1.00 4.52 C ATOM 0 H THR A 66 -12.030 -5.041 -9.503 1.00 11.31 H new ATOM 0 HA THR A 66 -12.629 -7.729 -8.909 1.00 54.40 H new ATOM 0 HB THR A 66 -11.942 -6.360 -11.546 1.00 60.02 H new ATOM 0 HG1 THR A 66 -14.266 -6.010 -11.619 1.00 52.22 H new ATOM 0 HG21 THR A 66 -13.404 -8.053 -12.541 1.00 4.52 H new ATOM 0 HG22 THR A 66 -12.017 -8.790 -11.705 1.00 4.52 H new ATOM 0 HG23 THR A 66 -13.625 -8.803 -10.942 1.00 4.52 H new ATOM 806 N ALA A 67 -9.598 -7.082 -10.076 1.00 44.21 N ATOM 807 CA ALA A 67 -8.251 -7.613 -10.265 1.00 33.22 C ATOM 808 C ALA A 67 -7.698 -8.094 -8.939 1.00 51.41 C ATOM 809 O ALA A 67 -7.167 -9.186 -8.854 1.00 51.52 O ATOM 810 CB ALA A 67 -7.338 -6.570 -10.894 1.00 34.42 C ATOM 0 H ALA A 67 -9.677 -6.081 -10.257 1.00 44.21 H new ATOM 0 HA ALA A 67 -8.300 -8.460 -10.950 1.00 33.22 H new ATOM 0 HB1 ALA A 67 -6.341 -6.990 -11.024 1.00 34.42 H new ATOM 0 HB2 ALA A 67 -7.737 -6.275 -11.865 1.00 34.42 H new ATOM 0 HB3 ALA A 67 -7.282 -5.697 -10.244 1.00 34.42 H new ATOM 816 N PHE A 68 -7.851 -7.269 -7.904 1.00 61.33 N ATOM 817 CA PHE A 68 -7.480 -7.639 -6.529 1.00 70.43 C ATOM 818 C PHE A 68 -8.118 -8.953 -6.160 1.00 73.30 C ATOM 819 O PHE A 68 -7.438 -9.883 -5.751 1.00 22.45 O ATOM 820 CB PHE A 68 -7.953 -6.561 -5.560 1.00 55.45 C ATOM 821 CG PHE A 68 -7.885 -6.917 -4.082 1.00 1.14 C ATOM 822 CD1 PHE A 68 -6.736 -6.714 -3.355 1.00 1.15 C ATOM 823 CD2 PHE A 68 -8.993 -7.460 -3.432 1.00 14.11 C ATOM 824 CE1 PHE A 68 -6.682 -7.047 -2.011 1.00 62.12 C ATOM 825 CE2 PHE A 68 -8.943 -7.790 -2.097 1.00 34.14 C ATOM 826 CZ PHE A 68 -7.786 -7.584 -1.384 1.00 34.25 C ATOM 0 H PHE A 68 -8.234 -6.327 -7.989 1.00 61.33 H new ATOM 0 HA PHE A 68 -6.396 -7.734 -6.470 1.00 70.43 H new ATOM 0 HB2 PHE A 68 -7.356 -5.664 -5.725 1.00 55.45 H new ATOM 0 HB3 PHE A 68 -8.984 -6.307 -5.805 1.00 55.45 H new ATOM 0 HD1 PHE A 68 -5.867 -6.291 -3.836 1.00 1.15 H new ATOM 0 HD2 PHE A 68 -9.906 -7.624 -3.986 1.00 14.11 H new ATOM 0 HE1 PHE A 68 -5.772 -6.885 -1.453 1.00 62.12 H new ATOM 0 HE2 PHE A 68 -9.811 -8.210 -1.610 1.00 34.14 H new ATOM 0 HZ PHE A 68 -7.742 -7.842 -0.336 1.00 34.25 H new ATOM 836 N LEU A 69 -9.433 -8.996 -6.308 1.00 62.42 N ATOM 837 CA LEU A 69 -10.242 -10.203 -6.047 1.00 55.30 C ATOM 838 C LEU A 69 -9.656 -11.426 -6.787 1.00 73.34 C ATOM 839 O LEU A 69 -9.571 -12.527 -6.230 1.00 21.42 O ATOM 840 CB LEU A 69 -11.729 -9.920 -6.433 1.00 23.25 C ATOM 841 CG LEU A 69 -12.839 -10.959 -6.080 1.00 14.43 C ATOM 842 CD1 LEU A 69 -12.761 -12.237 -6.913 1.00 73.15 C ATOM 843 CD2 LEU A 69 -12.832 -11.280 -4.593 1.00 15.15 C ATOM 0 H LEU A 69 -9.984 -8.194 -6.614 1.00 62.42 H new ATOM 0 HA LEU A 69 -10.213 -10.447 -4.985 1.00 55.30 H new ATOM 0 HB2 LEU A 69 -12.010 -8.975 -5.968 1.00 23.25 H new ATOM 0 HB3 LEU A 69 -11.760 -9.766 -7.512 1.00 23.25 H new ATOM 0 HG LEU A 69 -13.788 -10.486 -6.335 1.00 14.43 H new ATOM 0 HD11 LEU A 69 -13.561 -12.915 -6.616 1.00 73.15 H new ATOM 0 HD12 LEU A 69 -12.868 -11.990 -7.969 1.00 73.15 H new ATOM 0 HD13 LEU A 69 -11.797 -12.720 -6.749 1.00 73.15 H new ATOM 0 HD21 LEU A 69 -13.615 -12.006 -4.374 1.00 15.15 H new ATOM 0 HD22 LEU A 69 -11.863 -11.696 -4.315 1.00 15.15 H new ATOM 0 HD23 LEU A 69 -13.013 -10.369 -4.023 1.00 15.15 H new ATOM 855 N GLN A 70 -9.236 -11.218 -8.011 1.00 33.12 N ATOM 856 CA GLN A 70 -8.613 -12.246 -8.795 1.00 32.05 C ATOM 857 C GLN A 70 -7.294 -12.723 -8.167 1.00 63.42 C ATOM 858 O GLN A 70 -7.101 -13.916 -7.967 1.00 12.33 O ATOM 859 CB GLN A 70 -8.418 -11.760 -10.219 1.00 35.43 C ATOM 860 CG GLN A 70 -9.706 -11.689 -11.016 1.00 32.13 C ATOM 861 CD GLN A 70 -9.512 -11.087 -12.383 1.00 61.13 C ATOM 862 OE1 GLN A 70 -9.226 -11.785 -13.351 1.00 53.24 O ATOM 863 NE2 GLN A 70 -9.694 -9.799 -12.479 1.00 11.31 N ATOM 0 H GLN A 70 -9.319 -10.322 -8.491 1.00 33.12 H new ATOM 0 HA GLN A 70 -9.273 -13.113 -8.815 1.00 32.05 H new ATOM 0 HB2 GLN A 70 -7.959 -10.772 -10.197 1.00 35.43 H new ATOM 0 HB3 GLN A 70 -7.721 -12.425 -10.729 1.00 35.43 H new ATOM 0 HG2 GLN A 70 -10.119 -12.692 -11.121 1.00 32.13 H new ATOM 0 HG3 GLN A 70 -10.438 -11.099 -10.464 1.00 32.13 H new ATOM 0 HE21 GLN A 70 -9.931 -9.254 -11.650 1.00 11.31 H new ATOM 0 HE22 GLN A 70 -9.600 -9.337 -13.383 1.00 11.31 H new ATOM 872 N PHE A 71 -6.430 -11.797 -7.780 1.00 22.13 N ATOM 873 CA PHE A 71 -5.136 -12.164 -7.191 1.00 15.35 C ATOM 874 C PHE A 71 -5.353 -12.776 -5.813 1.00 62.04 C ATOM 875 O PHE A 71 -4.585 -13.627 -5.349 1.00 65.41 O ATOM 876 CB PHE A 71 -4.210 -10.959 -7.084 1.00 2.30 C ATOM 877 CG PHE A 71 -3.898 -10.279 -8.383 1.00 14.34 C ATOM 878 CD1 PHE A 71 -3.331 -10.978 -9.433 1.00 73.11 C ATOM 879 CD2 PHE A 71 -4.168 -8.932 -8.547 1.00 24.41 C ATOM 880 CE1 PHE A 71 -3.045 -10.343 -10.628 1.00 75.01 C ATOM 881 CE2 PHE A 71 -3.886 -8.293 -9.734 1.00 22.41 C ATOM 882 CZ PHE A 71 -3.325 -8.998 -10.778 1.00 44.33 C ATOM 0 H PHE A 71 -6.592 -10.793 -7.859 1.00 22.13 H new ATOM 0 HA PHE A 71 -4.661 -12.894 -7.846 1.00 15.35 H new ATOM 0 HB2 PHE A 71 -4.663 -10.231 -6.410 1.00 2.30 H new ATOM 0 HB3 PHE A 71 -3.274 -11.279 -6.625 1.00 2.30 H new ATOM 0 HD1 PHE A 71 -3.110 -12.029 -9.319 1.00 73.11 H new ATOM 0 HD2 PHE A 71 -4.606 -8.374 -7.733 1.00 24.41 H new ATOM 0 HE1 PHE A 71 -2.603 -10.898 -11.443 1.00 75.01 H new ATOM 0 HE2 PHE A 71 -4.104 -7.241 -9.847 1.00 22.41 H new ATOM 0 HZ PHE A 71 -3.105 -8.500 -11.711 1.00 44.33 H new ATOM 892 N PHE A 72 -6.404 -12.331 -5.172 1.00 22.21 N ATOM 893 CA PHE A 72 -6.845 -12.847 -3.906 1.00 11.45 C ATOM 894 C PHE A 72 -7.204 -14.324 -4.029 1.00 13.10 C ATOM 895 O PHE A 72 -6.673 -15.154 -3.295 1.00 24.32 O ATOM 896 CB PHE A 72 -8.030 -11.996 -3.399 1.00 22.32 C ATOM 897 CG PHE A 72 -8.943 -12.676 -2.433 1.00 23.22 C ATOM 898 CD1 PHE A 72 -10.116 -13.253 -2.889 1.00 45.45 C ATOM 899 CD2 PHE A 72 -8.638 -12.760 -1.100 1.00 50.44 C ATOM 900 CE1 PHE A 72 -10.963 -13.900 -2.035 1.00 32.05 C ATOM 901 CE2 PHE A 72 -9.488 -13.405 -0.235 1.00 63.05 C ATOM 902 CZ PHE A 72 -10.649 -13.978 -0.702 1.00 75.42 C ATOM 0 H PHE A 72 -6.992 -11.578 -5.529 1.00 22.21 H new ATOM 0 HA PHE A 72 -6.041 -12.780 -3.173 1.00 11.45 H new ATOM 0 HB2 PHE A 72 -7.633 -11.098 -2.926 1.00 22.32 H new ATOM 0 HB3 PHE A 72 -8.616 -11.672 -4.259 1.00 22.32 H new ATOM 0 HD1 PHE A 72 -10.366 -13.190 -3.938 1.00 45.45 H new ATOM 0 HD2 PHE A 72 -7.726 -12.317 -0.728 1.00 50.44 H new ATOM 0 HE1 PHE A 72 -11.873 -14.347 -2.406 1.00 32.05 H new ATOM 0 HE2 PHE A 72 -9.244 -13.463 0.816 1.00 63.05 H new ATOM 0 HZ PHE A 72 -11.312 -14.489 -0.019 1.00 75.42 H new ATOM 912 N ARG A 73 -8.044 -14.651 -4.997 1.00 22.31 N ATOM 913 CA ARG A 73 -8.481 -16.021 -5.191 1.00 3.01 C ATOM 914 C ARG A 73 -7.340 -16.870 -5.747 1.00 3.05 C ATOM 915 O ARG A 73 -7.328 -18.086 -5.604 1.00 1.30 O ATOM 916 CB ARG A 73 -9.730 -16.084 -6.077 1.00 45.31 C ATOM 917 CG ARG A 73 -9.509 -15.765 -7.545 1.00 52.14 C ATOM 918 CD ARG A 73 -10.825 -15.678 -8.283 1.00 35.14 C ATOM 919 NE ARG A 73 -11.638 -16.875 -8.081 1.00 31.52 N ATOM 920 CZ ARG A 73 -12.969 -16.913 -8.144 1.00 2.34 C ATOM 921 NH1 ARG A 73 -13.650 -15.874 -8.631 1.00 0.23 N ATOM 922 NH2 ARG A 73 -13.612 -18.015 -7.779 1.00 51.32 N ATOM 0 H ARG A 73 -8.437 -13.984 -5.661 1.00 22.31 H new ATOM 0 HA ARG A 73 -8.761 -16.437 -4.223 1.00 3.01 H new ATOM 0 HB2 ARG A 73 -10.157 -17.084 -6.001 1.00 45.31 H new ATOM 0 HB3 ARG A 73 -10.471 -15.390 -5.680 1.00 45.31 H new ATOM 0 HG2 ARG A 73 -8.972 -14.821 -7.639 1.00 52.14 H new ATOM 0 HG3 ARG A 73 -8.884 -16.534 -7.998 1.00 52.14 H new ATOM 0 HD2 ARG A 73 -11.376 -14.802 -7.942 1.00 35.14 H new ATOM 0 HD3 ARG A 73 -10.637 -15.541 -9.348 1.00 35.14 H new ATOM 0 HE ARG A 73 -11.150 -17.747 -7.876 1.00 31.52 H new ATOM 0 HH11 ARG A 73 -13.152 -15.046 -8.957 1.00 0.23 H new ATOM 0 HH12 ARG A 73 -14.668 -15.908 -8.677 1.00 0.23 H new ATOM 0 HH21 ARG A 73 -13.088 -18.827 -7.452 1.00 51.32 H new ATOM 0 HH22 ARG A 73 -14.630 -18.050 -7.825 1.00 51.32 H new ATOM 936 N GLN A 74 -6.364 -16.206 -6.364 1.00 71.52 N ATOM 937 CA GLN A 74 -5.155 -16.870 -6.823 1.00 72.23 C ATOM 938 C GLN A 74 -4.195 -17.142 -5.672 1.00 2.30 C ATOM 939 O GLN A 74 -3.125 -17.720 -5.868 1.00 70.04 O ATOM 940 CB GLN A 74 -4.456 -16.071 -7.899 1.00 1.43 C ATOM 941 CG GLN A 74 -5.236 -16.015 -9.176 1.00 4.32 C ATOM 942 CD GLN A 74 -4.518 -15.286 -10.259 1.00 41.44 C ATOM 943 OE1 GLN A 74 -3.739 -14.370 -10.011 1.00 3.01 O ATOM 944 NE2 GLN A 74 -4.748 -15.702 -11.460 1.00 32.43 N ATOM 0 H GLN A 74 -6.392 -15.205 -6.556 1.00 71.52 H new ATOM 0 HA GLN A 74 -5.464 -17.825 -7.248 1.00 72.23 H new ATOM 0 HB2 GLN A 74 -4.284 -15.057 -7.539 1.00 1.43 H new ATOM 0 HB3 GLN A 74 -3.478 -16.510 -8.094 1.00 1.43 H new ATOM 0 HG2 GLN A 74 -5.453 -17.030 -9.509 1.00 4.32 H new ATOM 0 HG3 GLN A 74 -6.194 -15.529 -8.990 1.00 4.32 H new ATOM 0 HE21 GLN A 74 -5.404 -16.467 -11.618 1.00 32.43 H new ATOM 0 HE22 GLN A 74 -4.274 -15.266 -12.250 1.00 32.43 H new ATOM 953 N GLY A 75 -4.561 -16.687 -4.481 1.00 34.34 N ATOM 954 CA GLY A 75 -3.788 -16.965 -3.301 1.00 0.44 C ATOM 955 C GLY A 75 -2.586 -16.072 -3.154 1.00 73.43 C ATOM 956 O GLY A 75 -1.628 -16.416 -2.456 1.00 52.50 O ATOM 0 H GLY A 75 -5.394 -16.122 -4.317 1.00 34.34 H new ATOM 0 HA2 GLY A 75 -4.425 -16.853 -2.423 1.00 0.44 H new ATOM 0 HA3 GLY A 75 -3.459 -18.004 -3.327 1.00 0.44 H new ATOM 960 N LEU A 76 -2.617 -14.925 -3.786 1.00 35.42 N ATOM 961 CA LEU A 76 -1.488 -14.030 -3.713 1.00 61.21 C ATOM 962 C LEU A 76 -1.543 -13.181 -2.449 1.00 12.41 C ATOM 963 O LEU A 76 -0.522 -12.981 -1.776 1.00 3.12 O ATOM 964 CB LEU A 76 -1.381 -13.147 -4.970 1.00 20.23 C ATOM 965 CG LEU A 76 -1.290 -13.885 -6.325 1.00 14.02 C ATOM 966 CD1 LEU A 76 -1.003 -12.916 -7.447 1.00 31.31 C ATOM 967 CD2 LEU A 76 -0.243 -14.984 -6.306 1.00 44.34 C ATOM 0 H LEU A 76 -3.399 -14.592 -4.349 1.00 35.42 H new ATOM 0 HA LEU A 76 -0.588 -14.643 -3.668 1.00 61.21 H new ATOM 0 HB2 LEU A 76 -2.248 -12.487 -4.998 1.00 20.23 H new ATOM 0 HB3 LEU A 76 -0.501 -12.512 -4.867 1.00 20.23 H new ATOM 0 HG LEU A 76 -2.260 -14.352 -6.498 1.00 14.02 H new ATOM 0 HD11 LEU A 76 -0.944 -13.459 -8.390 1.00 31.31 H new ATOM 0 HD12 LEU A 76 -1.803 -12.177 -7.503 1.00 31.31 H new ATOM 0 HD13 LEU A 76 -0.055 -12.411 -7.258 1.00 31.31 H new ATOM 0 HD21 LEU A 76 -0.214 -15.476 -7.278 1.00 44.34 H new ATOM 0 HD22 LEU A 76 0.734 -14.552 -6.088 1.00 44.34 H new ATOM 0 HD23 LEU A 76 -0.496 -15.715 -5.538 1.00 44.34 H new ATOM 979 N PHE A 77 -2.725 -12.699 -2.097 1.00 73.43 N ATOM 980 CA PHE A 77 -2.840 -11.842 -0.915 1.00 24.53 C ATOM 981 C PHE A 77 -3.360 -12.575 0.288 1.00 23.25 C ATOM 982 O PHE A 77 -3.330 -12.037 1.343 1.00 21.35 O ATOM 983 CB PHE A 77 -3.740 -10.634 -1.158 1.00 75.34 C ATOM 984 CG PHE A 77 -3.418 -9.850 -2.378 1.00 31.42 C ATOM 985 CD1 PHE A 77 -4.393 -9.618 -3.318 1.00 71.14 C ATOM 986 CD2 PHE A 77 -2.145 -9.357 -2.595 1.00 61.32 C ATOM 987 CE1 PHE A 77 -4.119 -8.909 -4.451 1.00 61.55 C ATOM 988 CE2 PHE A 77 -1.861 -8.645 -3.735 1.00 44.33 C ATOM 989 CZ PHE A 77 -2.856 -8.422 -4.666 1.00 24.41 C ATOM 0 H PHE A 77 -3.599 -12.876 -2.593 1.00 73.43 H new ATOM 0 HA PHE A 77 -1.821 -11.507 -0.719 1.00 24.53 H new ATOM 0 HB2 PHE A 77 -4.773 -10.976 -1.226 1.00 75.34 H new ATOM 0 HB3 PHE A 77 -3.679 -9.974 -0.293 1.00 75.34 H new ATOM 0 HD1 PHE A 77 -5.390 -10.002 -3.158 1.00 71.14 H new ATOM 0 HD2 PHE A 77 -1.369 -9.533 -1.864 1.00 61.32 H new ATOM 0 HE1 PHE A 77 -4.897 -8.732 -5.178 1.00 61.55 H new ATOM 0 HE2 PHE A 77 -0.865 -8.262 -3.902 1.00 44.33 H new ATOM 0 HZ PHE A 77 -2.639 -7.863 -5.564 1.00 24.41 H new ATOM 999 N LYS A 78 -3.779 -13.822 0.134 1.00 4.11 N ATOM 1000 CA LYS A 78 -4.397 -14.571 1.258 1.00 2.31 C ATOM 1001 C LYS A 78 -3.420 -14.801 2.436 1.00 43.55 C ATOM 1002 O LYS A 78 -3.799 -15.241 3.522 1.00 70.05 O ATOM 1003 CB LYS A 78 -5.134 -15.851 0.779 1.00 21.31 C ATOM 1004 CG LYS A 78 -4.281 -16.976 0.202 1.00 13.35 C ATOM 1005 CD LYS A 78 -3.696 -17.869 1.283 1.00 45.40 C ATOM 1006 CE LYS A 78 -2.951 -19.036 0.675 1.00 22.44 C ATOM 1007 NZ LYS A 78 -2.520 -20.006 1.696 1.00 14.51 N ATOM 0 H LYS A 78 -3.711 -14.345 -0.739 1.00 4.11 H new ATOM 0 HA LYS A 78 -5.177 -13.932 1.672 1.00 2.31 H new ATOM 0 HB2 LYS A 78 -5.695 -16.252 1.623 1.00 21.31 H new ATOM 0 HB3 LYS A 78 -5.862 -15.558 0.022 1.00 21.31 H new ATOM 0 HG2 LYS A 78 -4.887 -17.578 -0.475 1.00 13.35 H new ATOM 0 HG3 LYS A 78 -3.472 -16.548 -0.390 1.00 13.35 H new ATOM 0 HD2 LYS A 78 -3.021 -17.290 1.913 1.00 45.40 H new ATOM 0 HD3 LYS A 78 -4.494 -18.238 1.927 1.00 45.40 H new ATOM 0 HE2 LYS A 78 -3.591 -19.535 -0.053 1.00 22.44 H new ATOM 0 HE3 LYS A 78 -2.080 -18.668 0.134 1.00 22.44 H new ATOM 0 HZ1 LYS A 78 -2.013 -20.790 1.238 1.00 14.51 H new ATOM 0 HZ2 LYS A 78 -1.889 -19.537 2.376 1.00 14.51 H new ATOM 0 HZ3 LYS A 78 -3.353 -20.377 2.196 1.00 14.51 H new ATOM 1021 N LYS A 79 -2.162 -14.549 2.175 1.00 14.31 N ATOM 1022 CA LYS A 79 -1.120 -14.628 3.168 1.00 61.25 C ATOM 1023 C LYS A 79 -1.028 -13.348 4.035 1.00 64.30 C ATOM 1024 O LYS A 79 -0.311 -13.322 5.046 1.00 13.42 O ATOM 1025 CB LYS A 79 0.235 -14.981 2.536 1.00 32.21 C ATOM 1026 CG LYS A 79 0.638 -14.165 1.320 1.00 54.14 C ATOM 1027 CD LYS A 79 2.060 -14.525 0.897 1.00 14.10 C ATOM 1028 CE LYS A 79 2.441 -13.911 -0.442 1.00 43.24 C ATOM 1029 NZ LYS A 79 2.140 -12.479 -0.501 1.00 64.13 N ATOM 0 H LYS A 79 -1.827 -14.278 1.250 1.00 14.31 H new ATOM 0 HA LYS A 79 -1.393 -15.440 3.842 1.00 61.25 H new ATOM 0 HB2 LYS A 79 1.008 -14.868 3.296 1.00 32.21 H new ATOM 0 HB3 LYS A 79 0.218 -16.033 2.253 1.00 32.21 H new ATOM 0 HG2 LYS A 79 -0.053 -14.355 0.499 1.00 54.14 H new ATOM 0 HG3 LYS A 79 0.576 -13.101 1.549 1.00 54.14 H new ATOM 0 HD2 LYS A 79 2.760 -14.186 1.661 1.00 14.10 H new ATOM 0 HD3 LYS A 79 2.154 -15.609 0.836 1.00 14.10 H new ATOM 0 HE2 LYS A 79 3.505 -14.064 -0.620 1.00 43.24 H new ATOM 0 HE3 LYS A 79 1.907 -14.426 -1.241 1.00 43.24 H new ATOM 0 HZ1 LYS A 79 1.326 -12.321 -1.128 1.00 64.13 H new ATOM 0 HZ2 LYS A 79 1.915 -12.132 0.453 1.00 64.13 H new ATOM 0 HZ3 LYS A 79 2.966 -11.966 -0.870 1.00 64.13 H new ATOM 1043 N LEU A 80 -1.747 -12.313 3.641 1.00 54.33 N ATOM 1044 CA LEU A 80 -1.690 -11.004 4.289 1.00 45.32 C ATOM 1045 C LEU A 80 -2.503 -11.004 5.607 1.00 23.42 C ATOM 1046 O LEU A 80 -2.305 -10.154 6.442 1.00 43.45 O ATOM 1047 CB LEU A 80 -2.191 -9.925 3.254 1.00 62.01 C ATOM 1048 CG LEU A 80 -2.033 -8.395 3.536 1.00 5.11 C ATOM 1049 CD1 LEU A 80 -3.001 -7.865 4.586 1.00 15.22 C ATOM 1050 CD2 LEU A 80 -0.593 -8.047 3.893 1.00 22.13 C ATOM 0 H LEU A 80 -2.395 -12.352 2.855 1.00 54.33 H new ATOM 0 HA LEU A 80 -0.668 -10.759 4.577 1.00 45.32 H new ATOM 0 HB2 LEU A 80 -1.683 -10.129 2.311 1.00 62.01 H new ATOM 0 HB3 LEU A 80 -3.253 -10.110 3.090 1.00 62.01 H new ATOM 0 HG LEU A 80 -2.294 -7.891 2.605 1.00 5.11 H new ATOM 0 HD11 LEU A 80 -2.833 -6.798 4.729 1.00 15.22 H new ATOM 0 HD12 LEU A 80 -4.026 -8.030 4.253 1.00 15.22 H new ATOM 0 HD13 LEU A 80 -2.838 -8.388 5.528 1.00 15.22 H new ATOM 0 HD21 LEU A 80 -0.514 -6.977 4.084 1.00 22.13 H new ATOM 0 HD22 LEU A 80 -0.296 -8.598 4.786 1.00 22.13 H new ATOM 0 HD23 LEU A 80 0.063 -8.317 3.065 1.00 22.13 H new ATOM 1062 N LYS A 81 -3.351 -12.014 5.803 1.00 64.12 N ATOM 1063 CA LYS A 81 -4.266 -12.120 6.985 1.00 42.33 C ATOM 1064 C LYS A 81 -3.559 -11.998 8.351 1.00 30.22 C ATOM 1065 O LYS A 81 -4.204 -11.746 9.378 1.00 75.23 O ATOM 1066 CB LYS A 81 -5.050 -13.448 6.963 1.00 42.12 C ATOM 1067 CG LYS A 81 -4.274 -14.642 7.505 1.00 44.53 C ATOM 1068 CD LYS A 81 -5.113 -15.895 7.528 1.00 10.14 C ATOM 1069 CE LYS A 81 -4.544 -16.938 8.487 1.00 73.05 C ATOM 1070 NZ LYS A 81 -3.132 -17.295 8.205 1.00 74.21 N ATOM 0 H LYS A 81 -3.438 -12.796 5.154 1.00 64.12 H new ATOM 0 HA LYS A 81 -4.938 -11.267 6.886 1.00 42.33 H new ATOM 0 HB2 LYS A 81 -5.963 -13.327 7.546 1.00 42.12 H new ATOM 0 HB3 LYS A 81 -5.353 -13.661 5.938 1.00 42.12 H new ATOM 0 HG2 LYS A 81 -3.389 -14.809 6.891 1.00 44.53 H new ATOM 0 HG3 LYS A 81 -3.925 -14.420 8.513 1.00 44.53 H new ATOM 0 HD2 LYS A 81 -6.132 -15.645 7.825 1.00 10.14 H new ATOM 0 HD3 LYS A 81 -5.167 -16.315 6.524 1.00 10.14 H new ATOM 0 HE2 LYS A 81 -4.618 -16.561 9.507 1.00 73.05 H new ATOM 0 HE3 LYS A 81 -5.155 -17.839 8.435 1.00 73.05 H new ATOM 0 HZ1 LYS A 81 -2.931 -18.243 8.583 1.00 74.21 H new ATOM 0 HZ2 LYS A 81 -2.971 -17.291 7.177 1.00 74.21 H new ATOM 0 HZ3 LYS A 81 -2.502 -16.602 8.657 1.00 74.21 H new ATOM 1084 N ASP A 82 -2.268 -12.203 8.369 1.00 51.22 N ATOM 1085 CA ASP A 82 -1.506 -12.173 9.608 1.00 72.10 C ATOM 1086 C ASP A 82 -0.795 -10.833 9.771 1.00 1.42 C ATOM 1087 O ASP A 82 0.046 -10.665 10.655 1.00 32.44 O ATOM 1088 CB ASP A 82 -0.491 -13.335 9.659 1.00 73.35 C ATOM 1089 CG ASP A 82 -1.141 -14.715 9.725 1.00 21.42 C ATOM 1090 OD1 ASP A 82 -1.292 -15.382 8.667 1.00 43.33 O ATOM 1091 OD2 ASP A 82 -1.493 -15.165 10.823 1.00 23.35 O ATOM 0 H ASP A 82 -1.711 -12.395 7.537 1.00 51.22 H new ATOM 0 HA ASP A 82 -2.204 -12.295 10.436 1.00 72.10 H new ATOM 0 HB2 ASP A 82 0.148 -13.286 8.778 1.00 73.35 H new ATOM 0 HB3 ASP A 82 0.154 -13.205 10.528 1.00 73.35 H new ATOM 1096 N ALA A 83 -1.149 -9.881 8.928 1.00 53.20 N ATOM 1097 CA ALA A 83 -0.539 -8.564 8.935 1.00 51.23 C ATOM 1098 C ALA A 83 -0.889 -7.749 10.157 1.00 13.02 C ATOM 1099 O ALA A 83 -1.989 -7.834 10.701 1.00 41.20 O ATOM 1100 CB ALA A 83 -0.886 -7.785 7.686 1.00 24.20 C ATOM 0 H ALA A 83 -1.870 -10.000 8.217 1.00 53.20 H new ATOM 0 HA ALA A 83 0.536 -8.744 8.961 1.00 51.23 H new ATOM 0 HB1 ALA A 83 -0.412 -6.804 7.726 1.00 24.20 H new ATOM 0 HB2 ALA A 83 -0.529 -8.325 6.809 1.00 24.20 H new ATOM 0 HB3 ALA A 83 -1.967 -7.663 7.622 1.00 24.20 H new ATOM 1106 N GLU A 84 0.058 -6.964 10.569 1.00 63.02 N ATOM 1107 CA GLU A 84 -0.069 -6.077 11.695 1.00 63.44 C ATOM 1108 C GLU A 84 0.010 -4.662 11.176 1.00 4.54 C ATOM 1109 O GLU A 84 0.591 -4.439 10.113 1.00 2.42 O ATOM 1110 CB GLU A 84 1.057 -6.345 12.659 1.00 44.50 C ATOM 1111 CG GLU A 84 1.059 -7.761 13.179 1.00 35.23 C ATOM 1112 CD GLU A 84 2.265 -8.048 13.984 1.00 4.35 C ATOM 1113 OE1 GLU A 84 2.299 -7.675 15.168 1.00 31.01 O ATOM 1114 OE2 GLU A 84 3.213 -8.653 13.444 1.00 14.02 O ATOM 0 H GLU A 84 0.972 -6.918 10.119 1.00 63.02 H new ATOM 0 HA GLU A 84 -1.016 -6.230 12.213 1.00 63.44 H new ATOM 0 HB2 GLU A 84 2.007 -6.143 12.165 1.00 44.50 H new ATOM 0 HB3 GLU A 84 0.982 -5.655 13.499 1.00 44.50 H new ATOM 0 HG2 GLU A 84 0.169 -7.927 13.786 1.00 35.23 H new ATOM 0 HG3 GLU A 84 1.007 -8.456 12.341 1.00 35.23 H new ATOM 1121 N PHE A 85 -0.530 -3.719 11.905 1.00 12.30 N ATOM 1122 CA PHE A 85 -0.611 -2.356 11.415 1.00 5.15 C ATOM 1123 C PHE A 85 0.356 -1.418 12.101 1.00 23.44 C ATOM 1124 O PHE A 85 0.468 -1.397 13.332 1.00 4.51 O ATOM 1125 CB PHE A 85 -2.056 -1.807 11.479 1.00 1.22 C ATOM 1126 CG PHE A 85 -2.728 -1.858 12.831 1.00 12.51 C ATOM 1127 CD1 PHE A 85 -3.371 -3.012 13.258 1.00 62.33 C ATOM 1128 CD2 PHE A 85 -2.733 -0.750 13.664 1.00 4.35 C ATOM 1129 CE1 PHE A 85 -4.001 -3.060 14.484 1.00 43.14 C ATOM 1130 CE2 PHE A 85 -3.360 -0.793 14.894 1.00 34.24 C ATOM 1131 CZ PHE A 85 -3.993 -1.950 15.304 1.00 71.11 C ATOM 0 H PHE A 85 -0.920 -3.863 12.836 1.00 12.30 H new ATOM 0 HA PHE A 85 -0.311 -2.401 10.368 1.00 5.15 H new ATOM 0 HB2 PHE A 85 -2.044 -0.771 11.141 1.00 1.22 H new ATOM 0 HB3 PHE A 85 -2.667 -2.367 10.771 1.00 1.22 H new ATOM 0 HD1 PHE A 85 -3.378 -3.884 12.621 1.00 62.33 H new ATOM 0 HD2 PHE A 85 -2.241 0.158 13.347 1.00 4.35 H new ATOM 0 HE1 PHE A 85 -4.499 -3.964 14.802 1.00 43.14 H new ATOM 0 HE2 PHE A 85 -3.355 0.077 15.534 1.00 34.24 H new ATOM 0 HZ PHE A 85 -4.482 -1.986 16.266 1.00 71.11 H new ATOM 1141 N ALA A 86 1.047 -0.655 11.303 1.00 5.04 N ATOM 1142 CA ALA A 86 1.940 0.358 11.775 1.00 32.23 C ATOM 1143 C ALA A 86 1.249 1.693 11.606 1.00 2.43 C ATOM 1144 O ALA A 86 0.869 2.072 10.480 1.00 62.20 O ATOM 1145 CB ALA A 86 3.248 0.329 10.998 1.00 23.22 C ATOM 0 H ALA A 86 1.003 -0.723 10.286 1.00 5.04 H new ATOM 0 HA ALA A 86 2.184 0.187 12.824 1.00 32.23 H new ATOM 0 HB1 ALA A 86 3.912 1.108 11.374 1.00 23.22 H new ATOM 0 HB2 ALA A 86 3.723 -0.644 11.122 1.00 23.22 H new ATOM 0 HB3 ALA A 86 3.047 0.503 9.941 1.00 23.22 H new ATOM 1151 N ILE A 87 1.042 2.385 12.695 1.00 10.52 N ATOM 1152 CA ILE A 87 0.340 3.641 12.642 1.00 70.30 C ATOM 1153 C ILE A 87 1.258 4.793 12.251 1.00 73.25 C ATOM 1154 O ILE A 87 2.202 5.142 12.960 1.00 31.21 O ATOM 1155 CB ILE A 87 -0.460 3.962 13.943 1.00 3.31 C ATOM 1156 CG1 ILE A 87 0.452 3.977 15.188 1.00 40.43 C ATOM 1157 CG2 ILE A 87 -1.598 2.959 14.117 1.00 2.01 C ATOM 1158 CD1 ILE A 87 -0.252 4.365 16.477 1.00 23.22 C ATOM 0 H ILE A 87 1.348 2.102 13.626 1.00 10.52 H new ATOM 0 HA ILE A 87 -0.403 3.526 11.852 1.00 70.30 H new ATOM 0 HB ILE A 87 -0.880 4.963 13.841 1.00 3.31 H new ATOM 0 HG12 ILE A 87 0.893 2.988 15.313 1.00 40.43 H new ATOM 0 HG13 ILE A 87 1.273 4.672 15.013 1.00 40.43 H new ATOM 0 HG21 ILE A 87 -2.151 3.190 15.027 1.00 2.01 H new ATOM 0 HG22 ILE A 87 -2.269 3.018 13.260 1.00 2.01 H new ATOM 0 HG23 ILE A 87 -1.188 1.952 14.188 1.00 2.01 H new ATOM 0 HD11 ILE A 87 0.462 4.350 17.300 1.00 23.22 H new ATOM 0 HD12 ILE A 87 -0.669 5.367 16.377 1.00 23.22 H new ATOM 0 HD13 ILE A 87 -1.055 3.657 16.680 1.00 23.22 H new ATOM 1170 N ASN A 88 1.004 5.339 11.101 1.00 71.43 N ATOM 1171 CA ASN A 88 1.744 6.483 10.616 1.00 52.33 C ATOM 1172 C ASN A 88 1.147 7.732 11.219 1.00 24.22 C ATOM 1173 O ASN A 88 -0.091 7.843 11.344 1.00 50.13 O ATOM 1174 CB ASN A 88 1.682 6.577 9.086 1.00 62.24 C ATOM 1175 CG ASN A 88 2.408 5.457 8.353 1.00 42.23 C ATOM 1176 OD1 ASN A 88 3.433 4.936 8.808 1.00 12.10 O ATOM 1177 ND2 ASN A 88 1.873 5.066 7.228 1.00 41.10 N ATOM 0 H ASN A 88 0.278 5.009 10.465 1.00 71.43 H new ATOM 0 HA ASN A 88 2.789 6.376 10.906 1.00 52.33 H new ATOM 0 HB2 ASN A 88 0.637 6.578 8.777 1.00 62.24 H new ATOM 0 HB3 ASN A 88 2.107 7.532 8.776 1.00 62.24 H new ATOM 0 HD21 ASN A 88 2.301 4.309 6.696 1.00 41.10 H new ATOM 0 HD22 ASN A 88 1.027 5.518 6.881 1.00 41.10 H new ATOM 1184 N VAL A 89 1.987 8.655 11.609 1.00 20.00 N ATOM 1185 CA VAL A 89 1.528 9.896 12.204 1.00 2.43 C ATOM 1186 C VAL A 89 1.217 10.907 11.110 1.00 52.44 C ATOM 1187 O VAL A 89 1.598 10.703 9.946 1.00 15.54 O ATOM 1188 CB VAL A 89 2.550 10.490 13.220 1.00 30.41 C ATOM 1189 CG1 VAL A 89 2.778 9.531 14.377 1.00 42.15 C ATOM 1190 CG2 VAL A 89 3.871 10.838 12.547 1.00 50.44 C ATOM 0 H VAL A 89 3.001 8.575 11.527 1.00 20.00 H new ATOM 0 HA VAL A 89 0.622 9.672 12.767 1.00 2.43 H new ATOM 0 HB VAL A 89 2.124 11.413 13.612 1.00 30.41 H new ATOM 0 HG11 VAL A 89 3.495 9.966 15.074 1.00 42.15 H new ATOM 0 HG12 VAL A 89 1.834 9.351 14.892 1.00 42.15 H new ATOM 0 HG13 VAL A 89 3.169 8.588 13.996 1.00 42.15 H new ATOM 0 HG21 VAL A 89 4.559 11.249 13.286 1.00 50.44 H new ATOM 0 HG22 VAL A 89 4.304 9.939 12.109 1.00 50.44 H new ATOM 0 HG23 VAL A 89 3.697 11.575 11.763 1.00 50.44 H new ATOM 1200 N SER A 90 0.536 11.969 11.459 1.00 65.55 N ATOM 1201 CA SER A 90 0.149 12.965 10.488 1.00 22.15 C ATOM 1202 C SER A 90 1.344 13.848 10.107 1.00 15.24 C ATOM 1203 O SER A 90 1.497 14.240 8.939 1.00 30.01 O ATOM 1204 CB SER A 90 -1.004 13.792 11.044 1.00 31.13 C ATOM 1205 OG SER A 90 -2.061 12.928 11.451 1.00 62.11 O ATOM 0 H SER A 90 0.236 12.168 12.413 1.00 65.55 H new ATOM 0 HA SER A 90 -0.187 12.470 9.577 1.00 22.15 H new ATOM 0 HB2 SER A 90 -0.662 14.388 11.890 1.00 31.13 H new ATOM 0 HB3 SER A 90 -1.362 14.490 10.287 1.00 31.13 H new ATOM 0 HG SER A 90 -2.800 13.462 11.810 1.00 62.11 H new ATOM 1211 N GLY A 91 2.195 14.131 11.087 1.00 23.12 N ATOM 1212 CA GLY A 91 3.380 14.939 10.879 1.00 31.11 C ATOM 1213 C GLY A 91 3.064 16.420 10.854 1.00 3.21 C ATOM 1214 O GLY A 91 3.467 17.180 11.740 1.00 51.52 O ATOM 0 H GLY A 91 2.078 13.804 12.046 1.00 23.12 H new ATOM 0 HA2 GLY A 91 4.100 14.736 11.672 1.00 31.11 H new ATOM 0 HA3 GLY A 91 3.852 14.654 9.939 1.00 31.11 H new ATOM 1218 N LYS A 92 2.325 16.808 9.867 1.00 21.10 N ATOM 1219 CA LYS A 92 1.936 18.172 9.643 1.00 5.11 C ATOM 1220 C LYS A 92 0.535 18.145 9.088 1.00 11.04 C ATOM 1221 O LYS A 92 0.249 17.330 8.211 1.00 54.40 O ATOM 1222 CB LYS A 92 2.898 18.802 8.610 1.00 24.41 C ATOM 1223 CG LYS A 92 2.618 20.251 8.135 1.00 14.13 C ATOM 1224 CD LYS A 92 2.976 21.350 9.158 1.00 71.01 C ATOM 1225 CE LYS A 92 1.939 21.533 10.254 1.00 62.23 C ATOM 1226 NZ LYS A 92 2.308 22.633 11.169 1.00 44.35 N ATOM 0 H LYS A 92 1.959 16.164 9.166 1.00 21.10 H new ATOM 0 HA LYS A 92 1.974 18.757 10.562 1.00 5.11 H new ATOM 0 HB2 LYS A 92 3.902 18.779 9.033 1.00 24.41 H new ATOM 0 HB3 LYS A 92 2.908 18.159 7.730 1.00 24.41 H new ATOM 0 HG2 LYS A 92 3.178 20.432 7.218 1.00 14.13 H new ATOM 0 HG3 LYS A 92 1.561 20.338 7.885 1.00 14.13 H new ATOM 0 HD2 LYS A 92 3.935 21.108 9.616 1.00 71.01 H new ATOM 0 HD3 LYS A 92 3.104 22.295 8.631 1.00 71.01 H new ATOM 0 HE2 LYS A 92 0.967 21.741 9.806 1.00 62.23 H new ATOM 0 HE3 LYS A 92 1.838 20.606 10.819 1.00 62.23 H new ATOM 0 HZ1 LYS A 92 1.580 22.731 11.905 1.00 44.35 H new ATOM 0 HZ2 LYS A 92 3.224 22.422 11.614 1.00 44.35 H new ATOM 0 HZ3 LYS A 92 2.380 23.521 10.633 1.00 44.35 H new ATOM 1240 N VAL A 93 -0.343 18.956 9.631 1.00 75.22 N ATOM 1241 CA VAL A 93 -1.682 19.079 9.104 1.00 2.12 C ATOM 1242 C VAL A 93 -1.638 19.663 7.694 1.00 14.15 C ATOM 1243 O VAL A 93 -1.126 20.762 7.468 1.00 11.34 O ATOM 1244 CB VAL A 93 -2.630 19.916 10.036 1.00 61.44 C ATOM 1245 CG1 VAL A 93 -2.078 21.313 10.331 1.00 41.33 C ATOM 1246 CG2 VAL A 93 -4.039 20.008 9.443 1.00 11.22 C ATOM 0 H VAL A 93 -0.152 19.544 10.443 1.00 75.22 H new ATOM 0 HA VAL A 93 -2.108 18.076 9.062 1.00 2.12 H new ATOM 0 HB VAL A 93 -2.683 19.385 10.987 1.00 61.44 H new ATOM 0 HG11 VAL A 93 -2.772 21.849 10.979 1.00 41.33 H new ATOM 0 HG12 VAL A 93 -1.112 21.225 10.828 1.00 41.33 H new ATOM 0 HG13 VAL A 93 -1.957 21.861 9.397 1.00 41.33 H new ATOM 0 HG21 VAL A 93 -4.676 20.592 10.107 1.00 11.22 H new ATOM 0 HG22 VAL A 93 -3.992 20.491 8.467 1.00 11.22 H new ATOM 0 HG23 VAL A 93 -4.453 19.006 9.332 1.00 11.22 H new ATOM 1256 N LYS A 94 -2.099 18.895 6.761 1.00 14.44 N ATOM 1257 CA LYS A 94 -2.148 19.303 5.392 1.00 1.31 C ATOM 1258 C LYS A 94 -3.563 19.105 4.908 1.00 52.34 C ATOM 1259 O LYS A 94 -4.223 18.136 5.315 1.00 4.43 O ATOM 1260 CB LYS A 94 -1.170 18.466 4.546 1.00 1.02 C ATOM 1261 CG LYS A 94 0.284 18.536 5.023 1.00 34.11 C ATOM 1262 CD LYS A 94 1.224 17.682 4.174 1.00 14.10 C ATOM 1263 CE LYS A 94 1.305 18.176 2.735 1.00 31.41 C ATOM 1264 NZ LYS A 94 1.794 19.568 2.651 1.00 24.30 N ATOM 0 H LYS A 94 -2.457 17.955 6.929 1.00 14.44 H new ATOM 0 HA LYS A 94 -1.855 20.349 5.296 1.00 1.31 H new ATOM 0 HB2 LYS A 94 -1.495 17.426 4.556 1.00 1.02 H new ATOM 0 HB3 LYS A 94 -1.219 18.805 3.511 1.00 1.02 H new ATOM 0 HG2 LYS A 94 0.620 19.573 4.999 1.00 34.11 H new ATOM 0 HG3 LYS A 94 0.338 18.207 6.061 1.00 34.11 H new ATOM 0 HD2 LYS A 94 2.220 17.691 4.616 1.00 14.10 H new ATOM 0 HD3 LYS A 94 0.881 16.648 4.183 1.00 14.10 H new ATOM 0 HE2 LYS A 94 1.968 17.525 2.165 1.00 31.41 H new ATOM 0 HE3 LYS A 94 0.320 18.110 2.274 1.00 31.41 H new ATOM 0 HZ1 LYS A 94 2.043 19.790 1.666 1.00 24.30 H new ATOM 0 HZ2 LYS A 94 1.049 20.218 2.975 1.00 24.30 H new ATOM 0 HZ3 LYS A 94 2.635 19.678 3.253 1.00 24.30 H new ATOM 1278 N GLU A 95 -4.049 20.018 4.107 1.00 51.44 N ATOM 1279 CA GLU A 95 -5.379 19.910 3.573 1.00 15.25 C ATOM 1280 C GLU A 95 -5.425 18.770 2.566 1.00 60.42 C ATOM 1281 O GLU A 95 -4.513 18.612 1.737 1.00 32.50 O ATOM 1282 CB GLU A 95 -5.846 21.240 2.982 1.00 22.41 C ATOM 1283 CG GLU A 95 -7.301 21.241 2.560 1.00 24.30 C ATOM 1284 CD GLU A 95 -7.808 22.620 2.261 1.00 63.14 C ATOM 1285 OE1 GLU A 95 -7.850 23.018 1.088 1.00 22.41 O ATOM 1286 OE2 GLU A 95 -8.180 23.334 3.209 1.00 32.42 O ATOM 0 H GLU A 95 -3.538 20.849 3.810 1.00 51.44 H new ATOM 0 HA GLU A 95 -6.078 19.677 4.376 1.00 15.25 H new ATOM 0 HB2 GLU A 95 -5.690 22.029 3.717 1.00 22.41 H new ATOM 0 HB3 GLU A 95 -5.226 21.481 2.119 1.00 22.41 H new ATOM 0 HG2 GLU A 95 -7.421 20.613 1.677 1.00 24.30 H new ATOM 0 HG3 GLU A 95 -7.906 20.798 3.351 1.00 24.30 H new ATOM 1293 N GLY A 96 -6.460 17.989 2.660 1.00 1.44 N ATOM 1294 CA GLY A 96 -6.549 16.775 1.915 1.00 61.03 C ATOM 1295 C GLY A 96 -6.410 15.652 2.893 1.00 64.21 C ATOM 1296 O GLY A 96 -5.541 14.782 2.763 1.00 4.20 O ATOM 0 H GLY A 96 -7.265 18.178 3.257 1.00 1.44 H new ATOM 0 HA2 GLY A 96 -7.502 16.714 1.390 1.00 61.03 H new ATOM 0 HA3 GLY A 96 -5.765 16.728 1.159 1.00 61.03 H new ATOM 1300 N GLU A 97 -7.261 15.702 3.896 1.00 24.43 N ATOM 1301 CA GLU A 97 -7.215 14.816 5.019 1.00 73.00 C ATOM 1302 C GLU A 97 -7.470 13.411 4.622 1.00 45.13 C ATOM 1303 O GLU A 97 -8.478 13.097 3.985 1.00 35.14 O ATOM 1304 CB GLU A 97 -8.193 15.270 6.061 1.00 72.55 C ATOM 1305 CG GLU A 97 -7.838 16.610 6.647 1.00 73.45 C ATOM 1306 CD GLU A 97 -8.971 17.197 7.398 1.00 52.52 C ATOM 1307 OE1 GLU A 97 -9.107 16.926 8.610 1.00 52.54 O ATOM 1308 OE2 GLU A 97 -9.758 17.939 6.776 1.00 4.52 O ATOM 0 H GLU A 97 -8.020 16.381 3.945 1.00 24.43 H new ATOM 0 HA GLU A 97 -6.210 14.847 5.439 1.00 73.00 H new ATOM 0 HB2 GLU A 97 -9.189 15.323 5.620 1.00 72.55 H new ATOM 0 HB3 GLU A 97 -8.237 14.529 6.859 1.00 72.55 H new ATOM 0 HG2 GLU A 97 -6.979 16.501 7.310 1.00 73.45 H new ATOM 0 HG3 GLU A 97 -7.540 17.289 5.848 1.00 73.45 H new ATOM 1315 N GLY A 98 -6.560 12.585 4.972 1.00 21.40 N ATOM 1316 CA GLY A 98 -6.661 11.233 4.660 1.00 12.32 C ATOM 1317 C GLY A 98 -5.806 10.432 5.560 1.00 44.22 C ATOM 1318 O GLY A 98 -4.872 10.968 6.176 1.00 11.41 O ATOM 0 H GLY A 98 -5.719 12.842 5.489 1.00 21.40 H new ATOM 0 HA2 GLY A 98 -7.698 10.909 4.749 1.00 12.32 H new ATOM 0 HA3 GLY A 98 -6.364 11.069 3.624 1.00 12.32 H new ATOM 1322 N TYR A 99 -6.084 9.177 5.623 1.00 21.44 N ATOM 1323 CA TYR A 99 -5.394 8.285 6.500 1.00 73.50 C ATOM 1324 C TYR A 99 -4.488 7.419 5.672 1.00 52.10 C ATOM 1325 O TYR A 99 -4.940 6.785 4.720 1.00 21.44 O ATOM 1326 CB TYR A 99 -6.397 7.422 7.275 1.00 42.41 C ATOM 1327 CG TYR A 99 -7.465 8.232 7.982 1.00 75.22 C ATOM 1328 CD1 TYR A 99 -8.794 8.175 7.576 1.00 20.41 C ATOM 1329 CD2 TYR A 99 -7.141 9.069 9.036 1.00 33.12 C ATOM 1330 CE1 TYR A 99 -9.767 8.925 8.206 1.00 5.11 C ATOM 1331 CE2 TYR A 99 -8.107 9.822 9.671 1.00 1.43 C ATOM 1332 CZ TYR A 99 -9.414 9.749 9.259 1.00 65.01 C ATOM 1333 OH TYR A 99 -10.375 10.496 9.910 1.00 50.30 O ATOM 0 H TYR A 99 -6.808 8.730 5.060 1.00 21.44 H new ATOM 0 HA TYR A 99 -4.808 8.850 7.224 1.00 73.50 H new ATOM 0 HB2 TYR A 99 -6.875 6.726 6.586 1.00 42.41 H new ATOM 0 HB3 TYR A 99 -5.859 6.823 8.010 1.00 42.41 H new ATOM 0 HD1 TYR A 99 -9.070 7.532 6.753 1.00 20.41 H new ATOM 0 HD2 TYR A 99 -6.115 9.134 9.367 1.00 33.12 H new ATOM 0 HE1 TYR A 99 -10.795 8.869 7.879 1.00 5.11 H new ATOM 0 HE2 TYR A 99 -7.835 10.469 10.492 1.00 1.43 H new ATOM 0 HH TYR A 99 -9.955 11.018 10.625 1.00 50.30 H new ATOM 1343 N LYS A 100 -3.219 7.447 5.992 1.00 72.43 N ATOM 1344 CA LYS A 100 -2.219 6.664 5.294 1.00 51.44 C ATOM 1345 C LYS A 100 -1.599 5.697 6.283 1.00 23.21 C ATOM 1346 O LYS A 100 -0.800 6.104 7.120 1.00 63.34 O ATOM 1347 CB LYS A 100 -1.101 7.560 4.675 1.00 3.34 C ATOM 1348 CG LYS A 100 -1.528 8.517 3.540 1.00 13.42 C ATOM 1349 CD LYS A 100 -2.365 9.721 4.002 1.00 43.34 C ATOM 1350 CE LYS A 100 -1.568 10.692 4.881 1.00 62.51 C ATOM 1351 NZ LYS A 100 -2.376 11.868 5.286 1.00 44.21 N ATOM 0 H LYS A 100 -2.843 8.017 6.750 1.00 72.43 H new ATOM 0 HA LYS A 100 -2.703 6.134 4.474 1.00 51.44 H new ATOM 0 HB2 LYS A 100 -0.661 8.156 5.475 1.00 3.34 H new ATOM 0 HB3 LYS A 100 -0.315 6.908 4.293 1.00 3.34 H new ATOM 0 HG2 LYS A 100 -0.634 8.884 3.036 1.00 13.42 H new ATOM 0 HG3 LYS A 100 -2.101 7.954 2.803 1.00 13.42 H new ATOM 0 HD2 LYS A 100 -2.742 10.253 3.129 1.00 43.34 H new ATOM 0 HD3 LYS A 100 -3.233 9.364 4.556 1.00 43.34 H new ATOM 0 HE2 LYS A 100 -1.217 10.170 5.771 1.00 62.51 H new ATOM 0 HE3 LYS A 100 -0.684 11.029 4.339 1.00 62.51 H new ATOM 0 HZ1 LYS A 100 -1.902 12.362 6.069 1.00 44.21 H new ATOM 0 HZ2 LYS A 100 -2.476 12.515 4.478 1.00 44.21 H new ATOM 0 HZ3 LYS A 100 -3.318 11.552 5.595 1.00 44.21 H new ATOM 1365 N LEU A 101 -1.979 4.446 6.220 1.00 0.14 N ATOM 1366 CA LEU A 101 -1.481 3.448 7.176 1.00 32.42 C ATOM 1367 C LEU A 101 -0.848 2.286 6.434 1.00 75.54 C ATOM 1368 O LEU A 101 -1.159 2.071 5.264 1.00 72.34 O ATOM 1369 CB LEU A 101 -2.626 2.936 8.065 1.00 62.22 C ATOM 1370 CG LEU A 101 -3.366 3.978 8.918 1.00 32.54 C ATOM 1371 CD1 LEU A 101 -4.531 3.329 9.647 1.00 54.02 C ATOM 1372 CD2 LEU A 101 -2.421 4.633 9.918 1.00 65.11 C ATOM 0 H LEU A 101 -2.629 4.080 5.525 1.00 0.14 H new ATOM 0 HA LEU A 101 -0.730 3.921 7.809 1.00 32.42 H new ATOM 0 HB2 LEU A 101 -3.357 2.441 7.425 1.00 62.22 H new ATOM 0 HB3 LEU A 101 -2.222 2.176 8.734 1.00 62.22 H new ATOM 0 HG LEU A 101 -3.750 4.751 8.253 1.00 32.54 H new ATOM 0 HD11 LEU A 101 -5.047 4.078 10.248 1.00 54.02 H new ATOM 0 HD12 LEU A 101 -5.225 2.906 8.920 1.00 54.02 H new ATOM 0 HD13 LEU A 101 -4.158 2.537 10.296 1.00 54.02 H new ATOM 0 HD21 LEU A 101 -2.969 5.367 10.510 1.00 65.11 H new ATOM 0 HD22 LEU A 101 -2.005 3.872 10.578 1.00 65.11 H new ATOM 0 HD23 LEU A 101 -1.612 5.130 9.382 1.00 65.11 H new ATOM 1384 N VAL A 102 0.022 1.536 7.096 1.00 35.33 N ATOM 1385 CA VAL A 102 0.687 0.414 6.455 1.00 4.44 C ATOM 1386 C VAL A 102 0.668 -0.846 7.337 1.00 32.40 C ATOM 1387 O VAL A 102 0.886 -0.786 8.548 1.00 62.40 O ATOM 1388 CB VAL A 102 2.140 0.766 5.990 1.00 51.24 C ATOM 1389 CG1 VAL A 102 3.017 1.191 7.149 1.00 32.14 C ATOM 1390 CG2 VAL A 102 2.779 -0.385 5.215 1.00 11.54 C ATOM 0 H VAL A 102 0.282 1.684 8.071 1.00 35.33 H new ATOM 0 HA VAL A 102 0.113 0.191 5.556 1.00 4.44 H new ATOM 0 HB VAL A 102 2.055 1.616 5.313 1.00 51.24 H new ATOM 0 HG11 VAL A 102 4.016 1.426 6.782 1.00 32.14 H new ATOM 0 HG12 VAL A 102 2.589 2.073 7.625 1.00 32.14 H new ATOM 0 HG13 VAL A 102 3.079 0.380 7.875 1.00 32.14 H new ATOM 0 HG21 VAL A 102 3.786 -0.103 4.909 1.00 11.54 H new ATOM 0 HG22 VAL A 102 2.827 -1.269 5.851 1.00 11.54 H new ATOM 0 HG23 VAL A 102 2.180 -0.605 4.331 1.00 11.54 H new ATOM 1400 N TRP A 103 0.343 -1.948 6.717 1.00 34.04 N ATOM 1401 CA TRP A 103 0.305 -3.250 7.338 1.00 30.10 C ATOM 1402 C TRP A 103 1.479 -4.068 6.864 1.00 43.53 C ATOM 1403 O TRP A 103 1.928 -3.904 5.738 1.00 72.14 O ATOM 1404 CB TRP A 103 -1.007 -3.977 7.007 1.00 23.21 C ATOM 1405 CG TRP A 103 -2.202 -3.411 7.700 1.00 22.23 C ATOM 1406 CD1 TRP A 103 -2.838 -3.951 8.770 1.00 42.21 C ATOM 1407 CD2 TRP A 103 -2.895 -2.194 7.393 1.00 65.03 C ATOM 1408 NE1 TRP A 103 -3.878 -3.148 9.152 1.00 33.24 N ATOM 1409 CE2 TRP A 103 -3.931 -2.064 8.323 1.00 32.12 C ATOM 1410 CE3 TRP A 103 -2.735 -1.203 6.425 1.00 1.32 C ATOM 1411 CZ2 TRP A 103 -4.798 -0.990 8.319 1.00 74.33 C ATOM 1412 CZ3 TRP A 103 -3.597 -0.140 6.421 1.00 74.33 C ATOM 1413 CH2 TRP A 103 -4.616 -0.034 7.363 1.00 12.22 C ATOM 0 H TRP A 103 0.088 -1.967 5.730 1.00 34.04 H new ATOM 0 HA TRP A 103 0.360 -3.122 8.419 1.00 30.10 H new ATOM 0 HB2 TRP A 103 -1.171 -3.938 5.930 1.00 23.21 H new ATOM 0 HB3 TRP A 103 -0.907 -5.028 7.276 1.00 23.21 H new ATOM 0 HD1 TRP A 103 -2.564 -4.879 9.250 1.00 42.21 H new ATOM 0 HE1 TRP A 103 -4.512 -3.330 9.930 1.00 33.24 H new ATOM 0 HE3 TRP A 103 -1.945 -1.273 5.692 1.00 1.32 H new ATOM 0 HZ2 TRP A 103 -5.592 -0.909 9.047 1.00 74.33 H new ATOM 0 HZ3 TRP A 103 -3.484 0.631 5.673 1.00 74.33 H new ATOM 0 HH2 TRP A 103 -5.275 0.821 7.337 1.00 12.22 H new ATOM 1424 N LYS A 104 1.974 -4.921 7.717 1.00 42.44 N ATOM 1425 CA LYS A 104 3.115 -5.763 7.409 1.00 31.24 C ATOM 1426 C LYS A 104 2.761 -7.205 7.713 1.00 61.04 C ATOM 1427 O LYS A 104 2.305 -7.505 8.829 1.00 64.04 O ATOM 1428 CB LYS A 104 4.304 -5.360 8.281 1.00 73.31 C ATOM 1429 CG LYS A 104 4.725 -3.907 8.161 1.00 35.33 C ATOM 1430 CD LYS A 104 5.773 -3.575 9.203 1.00 21.21 C ATOM 1431 CE LYS A 104 6.191 -2.120 9.156 1.00 4.30 C ATOM 1432 NZ LYS A 104 6.923 -1.780 7.926 1.00 45.11 N ATOM 0 H LYS A 104 1.599 -5.059 8.656 1.00 42.44 H new ATOM 0 HA LYS A 104 3.374 -5.648 6.357 1.00 31.24 H new ATOM 0 HB2 LYS A 104 4.058 -5.566 9.323 1.00 73.31 H new ATOM 0 HB3 LYS A 104 5.154 -5.991 8.024 1.00 73.31 H new ATOM 0 HG2 LYS A 104 5.122 -3.718 7.164 1.00 35.33 H new ATOM 0 HG3 LYS A 104 3.858 -3.259 8.288 1.00 35.33 H new ATOM 0 HD2 LYS A 104 5.383 -3.807 10.194 1.00 21.21 H new ATOM 0 HD3 LYS A 104 6.648 -4.207 9.049 1.00 21.21 H new ATOM 0 HE2 LYS A 104 5.306 -1.489 9.233 1.00 4.30 H new ATOM 0 HE3 LYS A 104 6.817 -1.898 10.020 1.00 4.30 H new ATOM 0 HZ1 LYS A 104 7.401 -0.865 8.048 1.00 45.11 H new ATOM 0 HZ2 LYS A 104 7.630 -2.516 7.728 1.00 45.11 H new ATOM 0 HZ3 LYS A 104 6.256 -1.718 7.131 1.00 45.11 H new ATOM 1446 N SER A 105 2.939 -8.079 6.751 1.00 65.54 N ATOM 1447 CA SER A 105 2.669 -9.490 6.938 1.00 42.22 C ATOM 1448 C SER A 105 3.806 -10.141 7.772 1.00 41.01 C ATOM 1449 O SER A 105 4.768 -9.467 8.166 1.00 53.33 O ATOM 1450 CB SER A 105 2.498 -10.186 5.564 1.00 11.54 C ATOM 1451 OG SER A 105 2.099 -11.548 5.702 1.00 22.21 O ATOM 0 H SER A 105 3.274 -7.836 5.819 1.00 65.54 H new ATOM 0 HA SER A 105 1.737 -9.612 7.490 1.00 42.22 H new ATOM 0 HB2 SER A 105 1.755 -9.648 4.975 1.00 11.54 H new ATOM 0 HB3 SER A 105 3.437 -10.137 5.013 1.00 11.54 H new ATOM 0 HG SER A 105 1.205 -11.668 5.318 1.00 22.21 H new ATOM 1457 N ALA A 106 3.683 -11.424 8.032 1.00 23.32 N ATOM 1458 CA ALA A 106 4.649 -12.158 8.831 1.00 31.54 C ATOM 1459 C ALA A 106 5.844 -12.557 7.976 1.00 32.10 C ATOM 1460 O ALA A 106 5.786 -12.430 6.754 1.00 22.54 O ATOM 1461 CB ALA A 106 3.993 -13.381 9.457 1.00 23.24 C ATOM 0 H ALA A 106 2.907 -11.994 7.695 1.00 23.32 H new ATOM 0 HA ALA A 106 5.006 -11.515 9.635 1.00 31.54 H new ATOM 0 HB1 ALA A 106 4.727 -13.923 10.053 1.00 23.24 H new ATOM 0 HB2 ALA A 106 3.169 -13.065 10.096 1.00 23.24 H new ATOM 0 HB3 ALA A 106 3.613 -14.033 8.670 1.00 23.24 H new ATOM 1467 N ALA A 107 6.921 -13.005 8.613 1.00 55.23 N ATOM 1468 CA ALA A 107 8.115 -13.449 7.901 1.00 64.41 C ATOM 1469 C ALA A 107 7.798 -14.649 7.016 1.00 14.13 C ATOM 1470 O ALA A 107 7.487 -15.742 7.499 1.00 24.13 O ATOM 1471 CB ALA A 107 9.230 -13.793 8.875 1.00 44.03 C ATOM 0 H ALA A 107 6.992 -13.070 9.628 1.00 55.23 H new ATOM 0 HA ALA A 107 8.453 -12.629 7.267 1.00 64.41 H new ATOM 0 HB1 ALA A 107 10.109 -14.121 8.320 1.00 44.03 H new ATOM 0 HB2 ALA A 107 9.482 -12.912 9.466 1.00 44.03 H new ATOM 0 HB3 ALA A 107 8.900 -14.593 9.538 1.00 44.03 H new ATOM 1477 N GLN A 108 7.837 -14.425 5.740 1.00 35.42 N ATOM 1478 CA GLN A 108 7.545 -15.436 4.765 1.00 23.35 C ATOM 1479 C GLN A 108 8.846 -16.074 4.355 1.00 32.15 C ATOM 1480 O GLN A 108 9.814 -15.366 3.978 1.00 32.40 O ATOM 1481 CB GLN A 108 6.840 -14.825 3.538 1.00 2.05 C ATOM 1482 CG GLN A 108 5.609 -13.994 3.891 1.00 12.33 C ATOM 1483 CD GLN A 108 4.533 -14.786 4.612 1.00 51.53 C ATOM 1484 OE1 GLN A 108 4.347 -15.977 4.370 1.00 62.14 O ATOM 1485 NE2 GLN A 108 3.862 -14.147 5.527 1.00 33.25 N ATOM 0 H GLN A 108 8.077 -13.519 5.337 1.00 35.42 H new ATOM 0 HA GLN A 108 6.874 -16.181 5.192 1.00 23.35 H new ATOM 0 HB2 GLN A 108 7.549 -14.198 2.997 1.00 2.05 H new ATOM 0 HB3 GLN A 108 6.545 -15.628 2.862 1.00 2.05 H new ATOM 0 HG2 GLN A 108 5.913 -13.155 4.517 1.00 12.33 H new ATOM 0 HG3 GLN A 108 5.189 -13.574 2.977 1.00 12.33 H new ATOM 0 HE21 GLN A 108 4.046 -13.158 5.698 1.00 33.25 H new ATOM 0 HE22 GLN A 108 3.152 -14.635 6.073 1.00 33.25 H new ATOM 1494 N ARG A 109 8.889 -17.379 4.436 1.00 53.24 N ATOM 1495 CA ARG A 109 10.087 -18.112 4.131 1.00 52.41 C ATOM 1496 C ARG A 109 10.361 -18.111 2.656 1.00 1.44 C ATOM 1497 O ARG A 109 9.442 -18.185 1.831 1.00 5.12 O ATOM 1498 CB ARG A 109 10.069 -19.530 4.709 1.00 63.10 C ATOM 1499 CG ARG A 109 8.863 -20.374 4.360 1.00 40.43 C ATOM 1500 CD ARG A 109 8.956 -21.729 5.029 1.00 61.11 C ATOM 1501 NE ARG A 109 7.758 -22.549 4.815 1.00 54.14 N ATOM 1502 CZ ARG A 109 7.322 -23.485 5.677 1.00 21.34 C ATOM 1503 NH1 ARG A 109 7.963 -23.678 6.835 1.00 20.00 N ATOM 1504 NH2 ARG A 109 6.235 -24.204 5.394 1.00 51.23 N ATOM 0 H ARG A 109 8.098 -17.960 4.714 1.00 53.24 H new ATOM 0 HA ARG A 109 10.912 -17.595 4.621 1.00 52.41 H new ATOM 0 HB2 ARG A 109 10.963 -20.051 4.368 1.00 63.10 H new ATOM 0 HB3 ARG A 109 10.136 -19.459 5.795 1.00 63.10 H new ATOM 0 HG2 ARG A 109 7.952 -19.867 4.677 1.00 40.43 H new ATOM 0 HG3 ARG A 109 8.799 -20.499 3.279 1.00 40.43 H new ATOM 0 HD2 ARG A 109 9.828 -22.260 4.646 1.00 61.11 H new ATOM 0 HD3 ARG A 109 9.111 -21.592 6.099 1.00 61.11 H new ATOM 0 HE ARG A 109 7.223 -22.400 3.960 1.00 54.14 H new ATOM 0 HH11 ARG A 109 8.782 -23.115 7.064 1.00 20.00 H new ATOM 0 HH12 ARG A 109 7.632 -24.388 7.489 1.00 20.00 H new ATOM 0 HH21 ARG A 109 5.731 -24.045 4.521 1.00 51.23 H new ATOM 0 HH22 ARG A 109 5.907 -24.913 6.050 1.00 51.23 H new ATOM 1518 N SER A 110 11.600 -17.994 2.326 1.00 53.32 N ATOM 1519 CA SER A 110 12.019 -17.910 0.966 1.00 5.45 C ATOM 1520 C SER A 110 13.170 -18.882 0.754 1.00 65.22 C ATOM 1521 O SER A 110 13.950 -19.110 1.677 1.00 11.44 O ATOM 1522 CB SER A 110 12.460 -16.472 0.696 1.00 70.51 C ATOM 1523 OG SER A 110 11.432 -15.555 1.085 1.00 3.03 O ATOM 0 H SER A 110 12.364 -17.953 3.001 1.00 53.32 H new ATOM 0 HA SER A 110 11.212 -18.171 0.281 1.00 5.45 H new ATOM 0 HB2 SER A 110 13.376 -16.256 1.246 1.00 70.51 H new ATOM 0 HB3 SER A 110 12.687 -16.347 -0.363 1.00 70.51 H new ATOM 0 HG SER A 110 11.560 -15.299 2.022 1.00 3.03 H new ATOM 1529 N HIS A 111 13.304 -19.413 -0.466 1.00 53.24 N ATOM 1530 CA HIS A 111 14.345 -20.432 -0.796 1.00 53.55 C ATOM 1531 C HIS A 111 15.759 -19.851 -0.716 1.00 72.42 C ATOM 1532 O HIS A 111 16.753 -20.567 -0.795 1.00 21.44 O ATOM 1533 CB HIS A 111 14.117 -21.040 -2.208 1.00 32.12 C ATOM 1534 CG HIS A 111 14.244 -20.065 -3.365 1.00 11.43 C ATOM 1535 ND1 HIS A 111 15.383 -19.911 -4.133 1.00 53.24 N ATOM 1536 CD2 HIS A 111 13.345 -19.193 -3.867 1.00 35.43 C ATOM 1537 CE1 HIS A 111 15.144 -18.971 -5.046 1.00 41.23 C ATOM 1538 NE2 HIS A 111 13.913 -18.497 -4.929 1.00 15.10 N ATOM 0 H HIS A 111 12.708 -19.162 -1.255 1.00 53.24 H new ATOM 0 HA HIS A 111 14.251 -21.220 -0.049 1.00 53.55 H new ATOM 0 HB2 HIS A 111 14.832 -21.849 -2.357 1.00 32.12 H new ATOM 0 HB3 HIS A 111 13.122 -21.485 -2.237 1.00 32.12 H new ATOM 0 HD2 HIS A 111 12.338 -19.056 -3.500 1.00 35.43 H new ATOM 0 HE1 HIS A 111 15.859 -18.639 -5.784 1.00 41.23 H new ATOM 0 HE2 HIS A 111 13.474 -17.773 -5.498 1.00 15.10 H new ATOM 1546 N ASP A 112 15.817 -18.555 -0.570 1.00 41.53 N ATOM 1547 CA ASP A 112 17.059 -17.812 -0.514 1.00 35.52 C ATOM 1548 C ASP A 112 17.523 -17.651 0.942 1.00 12.41 C ATOM 1549 O ASP A 112 18.573 -17.084 1.218 1.00 42.13 O ATOM 1550 CB ASP A 112 16.832 -16.447 -1.177 1.00 24.32 C ATOM 1551 CG ASP A 112 18.081 -15.619 -1.316 1.00 42.23 C ATOM 1552 OD1 ASP A 112 18.292 -14.708 -0.500 1.00 73.32 O ATOM 1553 OD2 ASP A 112 18.847 -15.844 -2.278 1.00 63.34 O ATOM 0 H ASP A 112 14.987 -17.968 -0.484 1.00 41.53 H new ATOM 0 HA ASP A 112 17.844 -18.349 -1.046 1.00 35.52 H new ATOM 0 HB2 ASP A 112 16.399 -16.602 -2.165 1.00 24.32 H new ATOM 0 HB3 ASP A 112 16.101 -15.888 -0.593 1.00 24.32 H new ATOM 1558 N GLN A 113 16.706 -18.175 1.870 1.00 15.34 N ATOM 1559 CA GLN A 113 16.941 -18.108 3.328 1.00 24.20 C ATOM 1560 C GLN A 113 16.755 -16.657 3.835 1.00 64.32 C ATOM 1561 O GLN A 113 17.130 -16.286 4.954 1.00 24.52 O ATOM 1562 CB GLN A 113 18.317 -18.725 3.714 1.00 33.30 C ATOM 1563 CG GLN A 113 18.538 -18.931 5.210 1.00 60.23 C ATOM 1564 CD GLN A 113 19.839 -19.640 5.512 1.00 33.14 C ATOM 1565 OE1 GLN A 113 19.892 -20.864 5.586 1.00 11.33 O ATOM 1566 NE2 GLN A 113 20.885 -18.902 5.723 1.00 42.22 N ATOM 0 H GLN A 113 15.846 -18.667 1.627 1.00 15.34 H new ATOM 0 HA GLN A 113 16.195 -18.719 3.835 1.00 24.20 H new ATOM 0 HB2 GLN A 113 18.420 -19.687 3.212 1.00 33.30 H new ATOM 0 HB3 GLN A 113 19.107 -18.079 3.331 1.00 33.30 H new ATOM 0 HG2 GLN A 113 18.531 -17.963 5.712 1.00 60.23 H new ATOM 0 HG3 GLN A 113 17.710 -19.509 5.620 1.00 60.23 H new ATOM 0 HE21 GLN A 113 20.815 -17.887 5.655 1.00 42.22 H new ATOM 0 HE22 GLN A 113 21.777 -19.337 5.956 1.00 42.22 H new ATOM 1575 N LYS A 114 16.131 -15.850 3.005 1.00 2.11 N ATOM 1576 CA LYS A 114 15.791 -14.506 3.381 1.00 62.20 C ATOM 1577 C LYS A 114 14.355 -14.516 3.857 1.00 23.13 C ATOM 1578 O LYS A 114 13.599 -15.440 3.525 1.00 22.44 O ATOM 1579 CB LYS A 114 15.934 -13.500 2.203 1.00 25.52 C ATOM 1580 CG LYS A 114 14.920 -13.682 1.077 1.00 73.24 C ATOM 1581 CD LYS A 114 14.857 -12.480 0.113 1.00 40.41 C ATOM 1582 CE LYS A 114 15.951 -12.432 -0.977 1.00 43.51 C ATOM 1583 NZ LYS A 114 17.336 -12.305 -0.471 1.00 65.25 N ATOM 0 H LYS A 114 15.849 -16.109 2.060 1.00 2.11 H new ATOM 0 HA LYS A 114 16.478 -14.179 4.161 1.00 62.20 H new ATOM 0 HB2 LYS A 114 15.841 -12.487 2.596 1.00 25.52 H new ATOM 0 HB3 LYS A 114 16.937 -13.590 1.787 1.00 25.52 H new ATOM 0 HG2 LYS A 114 15.172 -14.579 0.512 1.00 73.24 H new ATOM 0 HG3 LYS A 114 13.933 -13.844 1.509 1.00 73.24 H new ATOM 0 HD2 LYS A 114 13.883 -12.482 -0.377 1.00 40.41 H new ATOM 0 HD3 LYS A 114 14.916 -11.564 0.701 1.00 40.41 H new ATOM 0 HE2 LYS A 114 15.882 -13.338 -1.579 1.00 43.51 H new ATOM 0 HE3 LYS A 114 15.745 -11.592 -1.640 1.00 43.51 H new ATOM 0 HZ1 LYS A 114 17.901 -11.748 -1.143 1.00 65.25 H new ATOM 0 HZ2 LYS A 114 17.326 -11.827 0.452 1.00 65.25 H new ATOM 0 HZ3 LYS A 114 17.755 -13.251 -0.366 1.00 65.25 H new ATOM 1597 N ILE A 115 13.971 -13.544 4.614 1.00 21.22 N ATOM 1598 CA ILE A 115 12.601 -13.447 5.033 1.00 21.11 C ATOM 1599 C ILE A 115 11.956 -12.294 4.329 1.00 45.32 C ATOM 1600 O ILE A 115 12.528 -11.194 4.248 1.00 64.25 O ATOM 1601 CB ILE A 115 12.417 -13.330 6.569 1.00 64.12 C ATOM 1602 CG1 ILE A 115 13.270 -12.190 7.148 1.00 61.44 C ATOM 1603 CG2 ILE A 115 12.711 -14.662 7.251 1.00 52.43 C ATOM 1604 CD1 ILE A 115 13.108 -11.981 8.638 1.00 40.24 C ATOM 0 H ILE A 115 14.581 -12.803 4.959 1.00 21.22 H new ATOM 0 HA ILE A 115 12.114 -14.383 4.759 1.00 21.11 H new ATOM 0 HB ILE A 115 11.375 -13.081 6.769 1.00 64.12 H new ATOM 0 HG12 ILE A 115 14.319 -12.393 6.934 1.00 61.44 H new ATOM 0 HG13 ILE A 115 13.014 -11.264 6.634 1.00 61.44 H new ATOM 0 HG21 ILE A 115 12.576 -14.557 8.328 1.00 52.43 H new ATOM 0 HG22 ILE A 115 12.029 -15.423 6.872 1.00 52.43 H new ATOM 0 HG23 ILE A 115 13.739 -14.959 7.042 1.00 52.43 H new ATOM 0 HD11 ILE A 115 13.745 -11.158 8.961 1.00 40.24 H new ATOM 0 HD12 ILE A 115 12.068 -11.744 8.861 1.00 40.24 H new ATOM 0 HD13 ILE A 115 13.394 -12.891 9.166 1.00 40.24 H new ATOM 1616 N ARG A 116 10.817 -12.546 3.763 1.00 1.23 N ATOM 1617 CA ARG A 116 10.110 -11.530 3.046 1.00 65.04 C ATOM 1618 C ARG A 116 8.759 -11.364 3.671 1.00 12.21 C ATOM 1619 O ARG A 116 8.397 -12.130 4.546 1.00 43.12 O ATOM 1620 CB ARG A 116 9.954 -11.892 1.562 1.00 22.34 C ATOM 1621 CG ARG A 116 11.252 -12.251 0.856 1.00 44.10 C ATOM 1622 CD ARG A 116 11.058 -12.344 -0.645 1.00 12.14 C ATOM 1623 NE ARG A 116 9.995 -13.277 -0.999 1.00 13.43 N ATOM 1624 CZ ARG A 116 9.268 -13.214 -2.113 1.00 3.13 C ATOM 1625 NH1 ARG A 116 9.586 -12.364 -3.078 1.00 15.31 N ATOM 1626 NH2 ARG A 116 8.251 -14.030 -2.275 1.00 53.54 N ATOM 0 H ARG A 116 10.353 -13.454 3.784 1.00 1.23 H new ATOM 0 HA ARG A 116 10.677 -10.601 3.099 1.00 65.04 H new ATOM 0 HB2 ARG A 116 9.266 -12.733 1.478 1.00 22.34 H new ATOM 0 HB3 ARG A 116 9.495 -11.051 1.043 1.00 22.34 H new ATOM 0 HG2 ARG A 116 12.010 -11.500 1.081 1.00 44.10 H new ATOM 0 HG3 ARG A 116 11.624 -13.203 1.236 1.00 44.10 H new ATOM 0 HD2 ARG A 116 10.822 -11.357 -1.042 1.00 12.14 H new ATOM 0 HD3 ARG A 116 11.990 -12.661 -1.113 1.00 12.14 H new ATOM 0 HE ARG A 116 9.793 -14.034 -0.345 1.00 13.43 H new ATOM 0 HH11 ARG A 116 10.394 -11.750 -2.971 1.00 15.31 H new ATOM 0 HH12 ARG A 116 9.023 -12.323 -3.928 1.00 15.31 H new ATOM 0 HH21 ARG A 116 8.021 -14.708 -1.549 1.00 53.54 H new ATOM 0 HH22 ARG A 116 7.692 -13.985 -3.127 1.00 53.54 H new ATOM 1640 N TRP A 117 8.054 -10.367 3.257 1.00 63.14 N ATOM 1641 CA TRP A 117 6.721 -10.106 3.705 1.00 63.44 C ATOM 1642 C TRP A 117 6.069 -9.152 2.739 1.00 54.13 C ATOM 1643 O TRP A 117 6.724 -8.646 1.797 1.00 24.34 O ATOM 1644 CB TRP A 117 6.689 -9.551 5.157 1.00 33.35 C ATOM 1645 CG TRP A 117 7.510 -8.320 5.363 1.00 13.01 C ATOM 1646 CD1 TRP A 117 7.114 -7.037 5.180 1.00 60.03 C ATOM 1647 CD2 TRP A 117 8.868 -8.265 5.801 1.00 43.53 C ATOM 1648 NE1 TRP A 117 8.145 -6.181 5.450 1.00 75.13 N ATOM 1649 CE2 TRP A 117 9.239 -6.912 5.837 1.00 33.21 C ATOM 1650 CE3 TRP A 117 9.810 -9.231 6.158 1.00 75.05 C ATOM 1651 CZ2 TRP A 117 10.512 -6.505 6.214 1.00 3.54 C ATOM 1652 CZ3 TRP A 117 11.065 -8.823 6.534 1.00 21.45 C ATOM 1653 CH2 TRP A 117 11.404 -7.472 6.557 1.00 23.33 C ATOM 0 H TRP A 117 8.396 -9.688 2.577 1.00 63.14 H new ATOM 0 HA TRP A 117 6.166 -11.044 3.729 1.00 63.44 H new ATOM 0 HB2 TRP A 117 5.656 -9.334 5.428 1.00 33.35 H new ATOM 0 HB3 TRP A 117 7.041 -10.326 5.838 1.00 33.35 H new ATOM 0 HD1 TRP A 117 6.126 -6.734 4.866 1.00 60.03 H new ATOM 0 HE1 TRP A 117 8.107 -5.164 5.376 1.00 75.13 H new ATOM 0 HE3 TRP A 117 9.556 -10.280 6.139 1.00 75.05 H new ATOM 0 HZ2 TRP A 117 10.783 -5.460 6.234 1.00 3.54 H new ATOM 0 HZ3 TRP A 117 11.801 -9.561 6.817 1.00 21.45 H new ATOM 0 HH2 TRP A 117 12.402 -7.185 6.855 1.00 23.33 H new ATOM 1664 N ASP A 118 4.822 -8.919 2.935 1.00 44.22 N ATOM 1665 CA ASP A 118 4.090 -8.030 2.096 1.00 53.00 C ATOM 1666 C ASP A 118 3.696 -6.868 2.936 1.00 3.23 C ATOM 1667 O ASP A 118 3.313 -7.052 4.110 1.00 54.24 O ATOM 1668 CB ASP A 118 2.803 -8.674 1.570 1.00 63.33 C ATOM 1669 CG ASP A 118 2.967 -10.099 1.103 1.00 70.30 C ATOM 1670 OD1 ASP A 118 3.615 -10.340 0.077 1.00 15.22 O ATOM 1671 OD2 ASP A 118 2.390 -11.024 1.727 1.00 41.43 O ATOM 0 H ASP A 118 4.274 -9.340 3.685 1.00 44.22 H new ATOM 0 HA ASP A 118 4.711 -7.754 1.244 1.00 53.00 H new ATOM 0 HB2 ASP A 118 2.049 -8.646 2.357 1.00 63.33 H new ATOM 0 HB3 ASP A 118 2.423 -8.075 0.743 1.00 63.33 H new ATOM 1676 N GLU A 119 3.801 -5.697 2.396 1.00 62.05 N ATOM 1677 CA GLU A 119 3.349 -4.528 3.091 1.00 72.12 C ATOM 1678 C GLU A 119 2.196 -3.905 2.351 1.00 3.51 C ATOM 1679 O GLU A 119 2.130 -3.948 1.117 1.00 42.35 O ATOM 1680 CB GLU A 119 4.479 -3.531 3.420 1.00 71.04 C ATOM 1681 CG GLU A 119 5.458 -4.095 4.440 1.00 52.24 C ATOM 1682 CD GLU A 119 6.452 -3.095 4.990 1.00 32.00 C ATOM 1683 OE1 GLU A 119 7.653 -3.406 5.044 1.00 23.53 O ATOM 1684 OE2 GLU A 119 6.045 -2.003 5.433 1.00 75.32 O ATOM 0 H GLU A 119 4.197 -5.521 1.473 1.00 62.05 H new ATOM 0 HA GLU A 119 2.987 -4.842 4.070 1.00 72.12 H new ATOM 0 HB2 GLU A 119 5.015 -3.276 2.506 1.00 71.04 H new ATOM 0 HB3 GLU A 119 4.047 -2.607 3.805 1.00 71.04 H new ATOM 0 HG2 GLU A 119 4.892 -4.517 5.270 1.00 52.24 H new ATOM 0 HG3 GLU A 119 6.008 -4.916 3.979 1.00 52.24 H new ATOM 1691 N ALA A 120 1.270 -3.390 3.088 1.00 3.10 N ATOM 1692 CA ALA A 120 0.066 -2.863 2.518 1.00 50.33 C ATOM 1693 C ALA A 120 -0.205 -1.481 3.027 1.00 74.10 C ATOM 1694 O ALA A 120 -0.362 -1.284 4.208 1.00 51.30 O ATOM 1695 CB ALA A 120 -1.083 -3.774 2.854 1.00 74.45 C ATOM 0 H ALA A 120 1.322 -3.320 4.104 1.00 3.10 H new ATOM 0 HA ALA A 120 0.183 -2.806 1.436 1.00 50.33 H new ATOM 0 HB1 ALA A 120 -2.001 -3.376 2.422 1.00 74.45 H new ATOM 0 HB2 ALA A 120 -0.891 -4.767 2.447 1.00 74.45 H new ATOM 0 HB3 ALA A 120 -1.190 -3.840 3.937 1.00 74.45 H new ATOM 1701 N GLU A 121 -0.281 -0.542 2.141 1.00 21.22 N ATOM 1702 CA GLU A 121 -0.499 0.835 2.524 1.00 31.11 C ATOM 1703 C GLU A 121 -1.881 1.276 2.079 1.00 72.31 C ATOM 1704 O GLU A 121 -2.128 1.427 0.901 1.00 74.40 O ATOM 1705 CB GLU A 121 0.554 1.757 1.885 1.00 64.34 C ATOM 1706 CG GLU A 121 1.988 1.366 2.182 1.00 33.13 C ATOM 1707 CD GLU A 121 2.989 2.372 1.680 1.00 2.12 C ATOM 1708 OE1 GLU A 121 3.339 3.301 2.440 1.00 50.04 O ATOM 1709 OE2 GLU A 121 3.475 2.244 0.541 1.00 74.22 O ATOM 0 H GLU A 121 -0.196 -0.695 1.136 1.00 21.22 H new ATOM 0 HA GLU A 121 -0.415 0.905 3.609 1.00 31.11 H new ATOM 0 HB2 GLU A 121 0.408 1.763 0.805 1.00 64.34 H new ATOM 0 HB3 GLU A 121 0.388 2.776 2.234 1.00 64.34 H new ATOM 0 HG2 GLU A 121 2.110 1.246 3.258 1.00 33.13 H new ATOM 0 HG3 GLU A 121 2.196 0.397 1.728 1.00 33.13 H new ATOM 1716 N ALA A 122 -2.759 1.477 3.006 1.00 2.32 N ATOM 1717 CA ALA A 122 -4.095 1.914 2.702 1.00 62.41 C ATOM 1718 C ALA A 122 -4.199 3.426 2.825 1.00 53.21 C ATOM 1719 O ALA A 122 -3.684 4.027 3.792 1.00 12.20 O ATOM 1720 CB ALA A 122 -5.110 1.240 3.611 1.00 61.11 C ATOM 0 H ALA A 122 -2.576 1.344 4.001 1.00 2.32 H new ATOM 0 HA ALA A 122 -4.318 1.629 1.674 1.00 62.41 H new ATOM 0 HB1 ALA A 122 -6.112 1.589 3.359 1.00 61.11 H new ATOM 0 HB2 ALA A 122 -5.057 0.160 3.477 1.00 61.11 H new ATOM 0 HB3 ALA A 122 -4.890 1.488 4.649 1.00 61.11 H new ATOM 1726 N TYR A 123 -4.824 4.019 1.839 1.00 63.55 N ATOM 1727 CA TYR A 123 -5.063 5.443 1.761 1.00 64.11 C ATOM 1728 C TYR A 123 -6.571 5.685 1.739 1.00 55.43 C ATOM 1729 O TYR A 123 -7.278 5.188 0.847 1.00 20.24 O ATOM 1730 CB TYR A 123 -4.494 6.019 0.451 1.00 11.12 C ATOM 1731 CG TYR A 123 -3.029 5.772 0.191 1.00 51.04 C ATOM 1732 CD1 TYR A 123 -2.588 4.554 -0.310 1.00 13.51 C ATOM 1733 CD2 TYR A 123 -2.095 6.764 0.407 1.00 21.42 C ATOM 1734 CE1 TYR A 123 -1.260 4.336 -0.579 1.00 13.13 C ATOM 1735 CE2 TYR A 123 -0.762 6.554 0.146 1.00 0.34 C ATOM 1736 CZ TYR A 123 -0.350 5.338 -0.348 1.00 41.41 C ATOM 1737 OH TYR A 123 0.977 5.133 -0.636 1.00 11.42 O ATOM 0 H TYR A 123 -5.195 3.507 1.038 1.00 63.55 H new ATOM 0 HA TYR A 123 -4.586 5.920 2.617 1.00 64.11 H new ATOM 0 HB2 TYR A 123 -5.063 5.604 -0.381 1.00 11.12 H new ATOM 0 HB3 TYR A 123 -4.665 7.096 0.448 1.00 11.12 H new ATOM 0 HD1 TYR A 123 -3.303 3.765 -0.491 1.00 13.51 H new ATOM 0 HD2 TYR A 123 -2.417 7.722 0.788 1.00 21.42 H new ATOM 0 HE1 TYR A 123 -0.933 3.384 -0.969 1.00 13.13 H new ATOM 0 HE2 TYR A 123 -0.043 7.339 0.328 1.00 0.34 H new ATOM 0 HH TYR A 123 1.488 5.940 -0.416 1.00 11.42 H new ATOM 1747 N ILE A 124 -7.057 6.401 2.695 1.00 42.40 N ATOM 1748 CA ILE A 124 -8.464 6.796 2.755 1.00 73.41 C ATOM 1749 C ILE A 124 -8.478 8.302 2.716 1.00 63.05 C ATOM 1750 O ILE A 124 -7.515 8.903 3.173 1.00 50.01 O ATOM 1751 CB ILE A 124 -9.126 6.318 4.094 1.00 71.21 C ATOM 1752 CG1 ILE A 124 -9.092 4.796 4.212 1.00 74.40 C ATOM 1753 CG2 ILE A 124 -10.562 6.839 4.259 1.00 74.20 C ATOM 1754 CD1 ILE A 124 -9.722 4.275 5.489 1.00 55.12 C ATOM 0 H ILE A 124 -6.499 6.744 3.477 1.00 42.40 H new ATOM 0 HA ILE A 124 -9.020 6.351 1.930 1.00 73.41 H new ATOM 0 HB ILE A 124 -8.533 6.745 4.903 1.00 71.21 H new ATOM 0 HG12 ILE A 124 -9.610 4.361 3.357 1.00 74.40 H new ATOM 0 HG13 ILE A 124 -8.057 4.459 4.163 1.00 74.40 H new ATOM 0 HG21 ILE A 124 -10.974 6.479 5.202 1.00 74.20 H new ATOM 0 HG22 ILE A 124 -10.556 7.929 4.258 1.00 74.20 H new ATOM 0 HG23 ILE A 124 -11.177 6.479 3.434 1.00 74.20 H new ATOM 0 HD11 ILE A 124 -9.663 3.187 5.506 1.00 55.12 H new ATOM 0 HD12 ILE A 124 -9.190 4.681 6.349 1.00 55.12 H new ATOM 0 HD13 ILE A 124 -10.767 4.582 5.531 1.00 55.12 H new ATOM 1766 N TRP A 125 -9.492 8.921 2.156 1.00 44.23 N ATOM 1767 CA TRP A 125 -9.542 10.353 2.194 1.00 35.20 C ATOM 1768 C TRP A 125 -10.890 10.815 2.727 1.00 72.32 C ATOM 1769 O TRP A 125 -11.931 10.125 2.545 1.00 44.22 O ATOM 1770 CB TRP A 125 -9.181 11.006 0.823 1.00 2.22 C ATOM 1771 CG TRP A 125 -10.326 11.320 -0.113 1.00 43.23 C ATOM 1772 CD1 TRP A 125 -10.825 12.563 -0.377 1.00 43.02 C ATOM 1773 CD2 TRP A 125 -11.105 10.410 -0.903 1.00 52.21 C ATOM 1774 NE1 TRP A 125 -11.843 12.486 -1.279 1.00 43.02 N ATOM 1775 CE2 TRP A 125 -12.041 11.184 -1.616 1.00 54.54 C ATOM 1776 CE3 TRP A 125 -11.107 9.034 -1.083 1.00 1.01 C ATOM 1777 CZ2 TRP A 125 -12.960 10.626 -2.487 1.00 32.33 C ATOM 1778 CZ3 TRP A 125 -12.024 8.477 -1.949 1.00 62.03 C ATOM 1779 CH2 TRP A 125 -12.940 9.281 -2.643 1.00 52.13 C ATOM 0 H TRP A 125 -10.271 8.465 1.682 1.00 44.23 H new ATOM 0 HA TRP A 125 -8.771 10.697 2.883 1.00 35.20 H new ATOM 0 HB2 TRP A 125 -8.642 11.933 1.021 1.00 2.22 H new ATOM 0 HB3 TRP A 125 -8.491 10.341 0.303 1.00 2.22 H new ATOM 0 HD1 TRP A 125 -10.463 13.479 0.067 1.00 43.02 H new ATOM 0 HE1 TRP A 125 -12.372 13.278 -1.643 1.00 43.02 H new ATOM 0 HE3 TRP A 125 -10.402 8.410 -0.554 1.00 1.01 H new ATOM 0 HZ2 TRP A 125 -13.668 11.241 -3.023 1.00 32.33 H new ATOM 0 HZ3 TRP A 125 -12.037 7.407 -2.095 1.00 62.03 H new ATOM 0 HH2 TRP A 125 -13.645 8.817 -3.317 1.00 52.13 H new ATOM 1790 N ARG A 126 -10.859 11.924 3.426 1.00 24.43 N ATOM 1791 CA ARG A 126 -12.028 12.546 3.967 1.00 32.53 C ATOM 1792 C ARG A 126 -12.681 13.340 2.858 1.00 14.20 C ATOM 1793 O ARG A 126 -12.114 14.311 2.352 1.00 14.44 O ATOM 1794 CB ARG A 126 -11.631 13.406 5.205 1.00 21.31 C ATOM 1795 CG ARG A 126 -12.719 14.306 5.803 1.00 75.35 C ATOM 1796 CD ARG A 126 -12.617 15.739 5.255 1.00 62.12 C ATOM 1797 NE ARG A 126 -13.694 16.629 5.733 1.00 54.41 N ATOM 1798 CZ ARG A 126 -13.533 17.923 6.098 1.00 62.05 C ATOM 1799 NH1 ARG A 126 -12.325 18.436 6.303 1.00 61.31 N ATOM 1800 NH2 ARG A 126 -14.595 18.675 6.339 1.00 73.14 N ATOM 0 H ARG A 126 -9.996 12.426 3.636 1.00 24.43 H new ATOM 0 HA ARG A 126 -12.754 11.818 4.327 1.00 32.53 H new ATOM 0 HB2 ARG A 126 -11.280 12.733 5.987 1.00 21.31 H new ATOM 0 HB3 ARG A 126 -10.787 14.036 4.924 1.00 21.31 H new ATOM 0 HG2 ARG A 126 -13.702 13.895 5.573 1.00 75.35 H new ATOM 0 HG3 ARG A 126 -12.626 14.321 6.889 1.00 75.35 H new ATOM 0 HD2 ARG A 126 -11.654 16.161 5.541 1.00 62.12 H new ATOM 0 HD3 ARG A 126 -12.640 15.706 4.166 1.00 62.12 H new ATOM 0 HE ARG A 126 -14.634 16.238 5.793 1.00 54.41 H new ATOM 0 HH11 ARG A 126 -11.497 17.853 6.186 1.00 61.31 H new ATOM 0 HH12 ARG A 126 -12.226 19.413 6.577 1.00 61.31 H new ATOM 0 HH21 ARG A 126 -15.531 18.279 6.250 1.00 73.14 H new ATOM 0 HH22 ARG A 126 -14.478 19.650 6.614 1.00 73.14 H new ATOM 1814 N ARG A 127 -13.838 12.898 2.462 1.00 24.52 N ATOM 1815 CA ARG A 127 -14.548 13.480 1.367 1.00 2.15 C ATOM 1816 C ARG A 127 -15.322 14.642 1.948 1.00 21.20 C ATOM 1817 O ARG A 127 -15.932 14.502 3.015 1.00 62.34 O ATOM 1818 CB ARG A 127 -15.509 12.407 0.810 1.00 70.20 C ATOM 1819 CG ARG A 127 -15.841 12.441 -0.684 1.00 51.41 C ATOM 1820 CD ARG A 127 -16.531 13.703 -1.149 1.00 63.42 C ATOM 1821 NE ARG A 127 -16.929 13.596 -2.557 1.00 60.41 N ATOM 1822 CZ ARG A 127 -16.829 14.567 -3.484 1.00 21.13 C ATOM 1823 NH1 ARG A 127 -16.304 15.747 -3.174 1.00 3.32 N ATOM 1824 NH2 ARG A 127 -17.254 14.347 -4.726 1.00 70.01 N ATOM 0 H ARG A 127 -14.320 12.112 2.898 1.00 24.52 H new ATOM 0 HA ARG A 127 -13.898 13.820 0.561 1.00 2.15 H new ATOM 0 HB2 ARG A 127 -15.083 11.429 1.035 1.00 70.20 H new ATOM 0 HB3 ARG A 127 -16.446 12.481 1.361 1.00 70.20 H new ATOM 0 HG2 ARG A 127 -14.918 12.318 -1.250 1.00 51.41 H new ATOM 0 HG3 ARG A 127 -16.476 11.587 -0.921 1.00 51.41 H new ATOM 0 HD2 ARG A 127 -17.410 13.890 -0.532 1.00 63.42 H new ATOM 0 HD3 ARG A 127 -15.864 14.555 -1.020 1.00 63.42 H new ATOM 0 HE ARG A 127 -17.317 12.703 -2.862 1.00 60.41 H new ATOM 0 HH11 ARG A 127 -15.972 15.924 -2.226 1.00 3.32 H new ATOM 0 HH12 ARG A 127 -16.233 16.476 -3.884 1.00 3.32 H new ATOM 0 HH21 ARG A 127 -17.655 13.443 -4.975 1.00 70.01 H new ATOM 0 HH22 ARG A 127 -17.178 15.082 -5.429 1.00 70.01 H new ATOM 1838 N LYS A 128 -15.318 15.765 1.269 1.00 3.41 N ATOM 1839 CA LYS A 128 -16.014 16.977 1.740 1.00 44.41 C ATOM 1840 C LYS A 128 -17.549 16.761 1.841 1.00 32.41 C ATOM 1841 O LYS A 128 -18.274 17.562 2.429 1.00 33.43 O ATOM 1842 CB LYS A 128 -15.663 18.169 0.829 1.00 52.12 C ATOM 1843 CG LYS A 128 -16.299 19.488 1.234 1.00 20.34 C ATOM 1844 CD LYS A 128 -15.873 20.613 0.326 1.00 45.12 C ATOM 1845 CE LYS A 128 -16.596 21.898 0.681 1.00 63.42 C ATOM 1846 NZ LYS A 128 -16.103 23.052 -0.099 1.00 2.43 N ATOM 0 H LYS A 128 -14.839 15.882 0.376 1.00 3.41 H new ATOM 0 HA LYS A 128 -15.670 17.201 2.750 1.00 44.41 H new ATOM 0 HB2 LYS A 128 -14.580 18.292 0.817 1.00 52.12 H new ATOM 0 HB3 LYS A 128 -15.969 17.932 -0.190 1.00 52.12 H new ATOM 0 HG2 LYS A 128 -17.384 19.392 1.210 1.00 20.34 H new ATOM 0 HG3 LYS A 128 -16.023 19.725 2.262 1.00 20.34 H new ATOM 0 HD2 LYS A 128 -14.796 20.763 0.406 1.00 45.12 H new ATOM 0 HD3 LYS A 128 -16.082 20.348 -0.711 1.00 45.12 H new ATOM 0 HE2 LYS A 128 -17.664 21.772 0.504 1.00 63.42 H new ATOM 0 HE3 LYS A 128 -16.471 22.101 1.745 1.00 63.42 H new ATOM 0 HZ1 LYS A 128 -16.626 23.907 0.178 1.00 2.43 H new ATOM 0 HZ2 LYS A 128 -15.089 23.190 0.089 1.00 2.43 H new ATOM 0 HZ3 LYS A 128 -16.246 22.872 -1.113 1.00 2.43 H new ATOM 1860 N ASP A 129 -18.014 15.647 1.301 1.00 44.25 N ATOM 1861 CA ASP A 129 -19.429 15.271 1.344 1.00 23.01 C ATOM 1862 C ASP A 129 -19.806 14.851 2.764 1.00 31.21 C ATOM 1863 O ASP A 129 -20.978 14.801 3.130 1.00 41.14 O ATOM 1864 CB ASP A 129 -19.706 14.129 0.360 1.00 54.12 C ATOM 1865 CG ASP A 129 -21.174 13.814 0.207 1.00 35.32 C ATOM 1866 OD1 ASP A 129 -21.902 14.622 -0.423 1.00 35.03 O ATOM 1867 OD2 ASP A 129 -21.623 12.746 0.654 1.00 13.31 O ATOM 0 H ASP A 129 -17.423 14.971 0.817 1.00 44.25 H new ATOM 0 HA ASP A 129 -20.035 16.129 1.054 1.00 23.01 H new ATOM 0 HB2 ASP A 129 -19.294 14.391 -0.615 1.00 54.12 H new ATOM 0 HB3 ASP A 129 -19.183 13.234 0.697 1.00 54.12 H new ATOM 1872 N GLY A 130 -18.793 14.582 3.570 1.00 62.41 N ATOM 1873 CA GLY A 130 -19.023 14.268 4.958 1.00 60.43 C ATOM 1874 C GLY A 130 -18.712 12.844 5.308 1.00 64.04 C ATOM 1875 O GLY A 130 -18.680 12.480 6.488 1.00 21.12 O ATOM 0 H GLY A 130 -17.814 14.576 3.285 1.00 62.41 H new ATOM 0 HA2 GLY A 130 -18.415 14.927 5.577 1.00 60.43 H new ATOM 0 HA3 GLY A 130 -20.065 14.474 5.201 1.00 60.43 H new ATOM 1879 N SER A 131 -18.514 12.036 4.323 1.00 10.50 N ATOM 1880 CA SER A 131 -18.135 10.688 4.531 1.00 61.11 C ATOM 1881 C SER A 131 -16.655 10.576 4.185 1.00 3.14 C ATOM 1882 O SER A 131 -16.065 11.517 3.662 1.00 65.22 O ATOM 1883 CB SER A 131 -19.002 9.758 3.655 1.00 65.15 C ATOM 1884 OG SER A 131 -18.765 8.375 3.921 1.00 12.34 O ATOM 0 H SER A 131 -18.613 12.299 3.342 1.00 10.50 H new ATOM 0 HA SER A 131 -18.291 10.384 5.566 1.00 61.11 H new ATOM 0 HB2 SER A 131 -20.055 9.982 3.826 1.00 65.15 H new ATOM 0 HB3 SER A 131 -18.799 9.962 2.604 1.00 65.15 H new ATOM 0 HG SER A 131 -18.339 8.279 4.798 1.00 12.34 H new ATOM 1890 N CYS A 132 -16.074 9.493 4.503 1.00 12.03 N ATOM 1891 CA CYS A 132 -14.729 9.197 4.119 1.00 61.33 C ATOM 1892 C CYS A 132 -14.760 7.947 3.268 1.00 72.15 C ATOM 1893 O CYS A 132 -15.603 7.054 3.494 1.00 13.25 O ATOM 1894 CB CYS A 132 -13.871 9.001 5.351 1.00 44.03 C ATOM 1895 SG CYS A 132 -14.535 7.788 6.491 1.00 62.55 S ATOM 0 H CYS A 132 -16.519 8.757 5.052 1.00 12.03 H new ATOM 0 HA CYS A 132 -14.296 10.019 3.549 1.00 61.33 H new ATOM 0 HB2 CYS A 132 -12.872 8.692 5.044 1.00 44.03 H new ATOM 0 HB3 CYS A 132 -13.765 9.955 5.867 1.00 44.03 H new ATOM 0 HG CYS A 132 -15.801 8.017 6.680 1.00 62.55 H new ATOM 1901 N TRP A 133 -13.903 7.870 2.297 1.00 22.42 N ATOM 1902 CA TRP A 133 -13.926 6.753 1.407 1.00 10.20 C ATOM 1903 C TRP A 133 -12.508 6.357 1.091 1.00 30.24 C ATOM 1904 O TRP A 133 -11.585 7.170 1.244 1.00 61.34 O ATOM 1905 CB TRP A 133 -14.710 7.112 0.141 1.00 35.24 C ATOM 1906 CG TRP A 133 -15.308 5.932 -0.570 1.00 44.44 C ATOM 1907 CD1 TRP A 133 -16.116 4.992 -0.022 1.00 10.43 C ATOM 1908 CD2 TRP A 133 -15.198 5.600 -1.956 1.00 23.22 C ATOM 1909 NE1 TRP A 133 -16.517 4.097 -0.971 1.00 24.13 N ATOM 1910 CE2 TRP A 133 -15.968 4.445 -2.167 1.00 32.31 C ATOM 1911 CE3 TRP A 133 -14.530 6.160 -3.033 1.00 44.31 C ATOM 1912 CZ2 TRP A 133 -16.085 3.849 -3.413 1.00 0.42 C ATOM 1913 CZ3 TRP A 133 -14.645 5.571 -4.269 1.00 63.44 C ATOM 1914 CH2 TRP A 133 -15.418 4.427 -4.449 1.00 72.32 C ATOM 0 H TRP A 133 -13.182 8.565 2.102 1.00 22.42 H new ATOM 0 HA TRP A 133 -14.428 5.905 1.872 1.00 10.20 H new ATOM 0 HB2 TRP A 133 -15.509 7.805 0.406 1.00 35.24 H new ATOM 0 HB3 TRP A 133 -14.047 7.638 -0.546 1.00 35.24 H new ATOM 0 HD1 TRP A 133 -16.402 4.956 1.019 1.00 10.43 H new ATOM 0 HE1 TRP A 133 -17.129 3.297 -0.810 1.00 24.13 H new ATOM 0 HE3 TRP A 133 -13.928 7.047 -2.903 1.00 44.31 H new ATOM 0 HZ2 TRP A 133 -16.682 2.961 -3.556 1.00 0.42 H new ATOM 0 HZ3 TRP A 133 -14.128 6.002 -5.114 1.00 63.44 H new ATOM 0 HH2 TRP A 133 -15.490 3.988 -5.433 1.00 72.32 H new ATOM 1925 N LEU A 134 -12.317 5.122 0.721 1.00 31.42 N ATOM 1926 CA LEU A 134 -11.013 4.628 0.409 1.00 51.51 C ATOM 1927 C LEU A 134 -10.521 5.233 -0.876 1.00 55.32 C ATOM 1928 O LEU A 134 -11.183 5.165 -1.918 1.00 0.11 O ATOM 1929 CB LEU A 134 -10.948 3.093 0.338 1.00 31.51 C ATOM 1930 CG LEU A 134 -11.055 2.310 1.657 1.00 34.03 C ATOM 1931 CD1 LEU A 134 -12.451 2.374 2.262 1.00 13.22 C ATOM 1932 CD2 LEU A 134 -10.614 0.875 1.439 1.00 62.31 C ATOM 0 H LEU A 134 -13.063 4.433 0.628 1.00 31.42 H new ATOM 0 HA LEU A 134 -10.361 4.928 1.229 1.00 51.51 H new ATOM 0 HB2 LEU A 134 -11.749 2.754 -0.319 1.00 31.51 H new ATOM 0 HB3 LEU A 134 -10.007 2.819 -0.139 1.00 31.51 H new ATOM 0 HG LEU A 134 -10.389 2.782 2.380 1.00 34.03 H new ATOM 0 HD11 LEU A 134 -12.471 1.805 3.191 1.00 13.22 H new ATOM 0 HD12 LEU A 134 -12.712 3.412 2.467 1.00 13.22 H new ATOM 0 HD13 LEU A 134 -13.171 1.951 1.562 1.00 13.22 H new ATOM 0 HD21 LEU A 134 -10.692 0.324 2.376 1.00 62.31 H new ATOM 0 HD22 LEU A 134 -11.253 0.408 0.690 1.00 62.31 H new ATOM 0 HD23 LEU A 134 -9.580 0.860 1.094 1.00 62.31 H new ATOM 1944 N HIS A 135 -9.378 5.826 -0.790 1.00 5.23 N ATOM 1945 CA HIS A 135 -8.759 6.470 -1.896 1.00 32.13 C ATOM 1946 C HIS A 135 -8.074 5.413 -2.729 1.00 24.34 C ATOM 1947 O HIS A 135 -8.391 5.213 -3.908 1.00 52.22 O ATOM 1948 CB HIS A 135 -7.755 7.530 -1.364 1.00 1.42 C ATOM 1949 CG HIS A 135 -6.919 8.264 -2.391 1.00 5.12 C ATOM 1950 ND1 HIS A 135 -5.747 8.914 -2.079 1.00 24.45 N ATOM 1951 CD2 HIS A 135 -7.106 8.458 -3.721 1.00 11.24 C ATOM 1952 CE1 HIS A 135 -5.262 9.469 -3.191 1.00 54.02 C ATOM 1953 NE2 HIS A 135 -6.049 9.224 -4.227 1.00 64.10 N ATOM 0 H HIS A 135 -8.836 5.877 0.073 1.00 5.23 H new ATOM 0 HA HIS A 135 -9.488 6.987 -2.520 1.00 32.13 H new ATOM 0 HB2 HIS A 135 -8.315 8.270 -0.792 1.00 1.42 H new ATOM 0 HB3 HIS A 135 -7.078 7.035 -0.668 1.00 1.42 H new ATOM 0 HD2 HIS A 135 -7.938 8.081 -4.298 1.00 11.24 H new ATOM 0 HE1 HIS A 135 -4.348 10.042 -3.240 1.00 54.02 H new ATOM 0 HE2 HIS A 135 -5.914 9.529 -5.191 1.00 64.10 H new ATOM 1961 N SER A 136 -7.191 4.692 -2.108 1.00 14.34 N ATOM 1962 CA SER A 136 -6.398 3.698 -2.775 1.00 24.24 C ATOM 1963 C SER A 136 -5.761 2.854 -1.715 1.00 42.31 C ATOM 1964 O SER A 136 -5.658 3.288 -0.600 1.00 22.21 O ATOM 1965 CB SER A 136 -5.265 4.360 -3.586 1.00 14.33 C ATOM 1966 OG SER A 136 -5.723 5.409 -4.427 1.00 1.13 O ATOM 0 H SER A 136 -6.996 4.777 -1.110 1.00 14.34 H new ATOM 0 HA SER A 136 -7.030 3.118 -3.448 1.00 24.24 H new ATOM 0 HB2 SER A 136 -4.516 4.754 -2.899 1.00 14.33 H new ATOM 0 HB3 SER A 136 -4.772 3.603 -4.195 1.00 14.33 H new ATOM 0 HG SER A 136 -4.964 5.792 -4.915 1.00 1.13 H new ATOM 1972 N VAL A 137 -5.382 1.663 -2.029 1.00 42.34 N ATOM 1973 CA VAL A 137 -4.608 0.879 -1.113 1.00 71.31 C ATOM 1974 C VAL A 137 -3.534 0.175 -1.932 1.00 53.31 C ATOM 1975 O VAL A 137 -3.792 -0.278 -3.044 1.00 44.34 O ATOM 1976 CB VAL A 137 -5.437 -0.133 -0.221 1.00 41.31 C ATOM 1977 CG1 VAL A 137 -6.651 0.501 0.451 1.00 45.23 C ATOM 1978 CG2 VAL A 137 -5.835 -1.360 -0.953 1.00 23.52 C ATOM 0 H VAL A 137 -5.593 1.204 -2.915 1.00 42.34 H new ATOM 0 HA VAL A 137 -4.174 1.549 -0.371 1.00 71.31 H new ATOM 0 HB VAL A 137 -4.744 -0.424 0.569 1.00 41.31 H new ATOM 0 HG11 VAL A 137 -7.171 -0.250 1.046 1.00 45.23 H new ATOM 0 HG12 VAL A 137 -6.325 1.315 1.099 1.00 45.23 H new ATOM 0 HG13 VAL A 137 -7.326 0.892 -0.311 1.00 45.23 H new ATOM 0 HG21 VAL A 137 -6.400 -2.013 -0.288 1.00 23.52 H new ATOM 0 HG22 VAL A 137 -6.455 -1.089 -1.808 1.00 23.52 H new ATOM 0 HG23 VAL A 137 -4.943 -1.881 -1.302 1.00 23.52 H new ATOM 1988 N LYS A 138 -2.357 0.174 -1.440 1.00 43.32 N ATOM 1989 CA LYS A 138 -1.219 -0.346 -2.148 1.00 61.22 C ATOM 1990 C LYS A 138 -0.758 -1.641 -1.514 1.00 22.33 C ATOM 1991 O LYS A 138 -0.676 -1.730 -0.298 1.00 43.13 O ATOM 1992 CB LYS A 138 -0.092 0.667 -2.045 1.00 62.23 C ATOM 1993 CG LYS A 138 1.124 0.379 -2.911 1.00 53.12 C ATOM 1994 CD LYS A 138 2.325 1.209 -2.456 1.00 44.24 C ATOM 1995 CE LYS A 138 2.011 2.697 -2.409 1.00 12.04 C ATOM 1996 NZ LYS A 138 3.095 3.472 -1.776 1.00 43.42 N ATOM 0 H LYS A 138 -2.136 0.539 -0.514 1.00 43.32 H new ATOM 0 HA LYS A 138 -1.490 -0.530 -3.188 1.00 61.22 H new ATOM 0 HB2 LYS A 138 -0.483 1.649 -2.312 1.00 62.23 H new ATOM 0 HB3 LYS A 138 0.229 0.724 -1.005 1.00 62.23 H new ATOM 0 HG2 LYS A 138 1.369 -0.682 -2.860 1.00 53.12 H new ATOM 0 HG3 LYS A 138 0.895 0.603 -3.953 1.00 53.12 H new ATOM 0 HD2 LYS A 138 2.642 0.875 -1.468 1.00 44.24 H new ATOM 0 HD3 LYS A 138 3.161 1.037 -3.134 1.00 44.24 H new ATOM 0 HE2 LYS A 138 1.846 3.065 -3.422 1.00 12.04 H new ATOM 0 HE3 LYS A 138 1.084 2.854 -1.858 1.00 12.04 H new ATOM 0 HZ1 LYS A 138 2.691 4.292 -1.280 1.00 43.42 H new ATOM 0 HZ2 LYS A 138 3.600 2.870 -1.095 1.00 43.42 H new ATOM 0 HZ3 LYS A 138 3.759 3.801 -2.506 1.00 43.42 H new ATOM 2010 N PHE A 139 -0.456 -2.622 -2.323 1.00 51.21 N ATOM 2011 CA PHE A 139 0.071 -3.866 -1.840 1.00 31.24 C ATOM 2012 C PHE A 139 1.411 -4.119 -2.457 1.00 51.23 C ATOM 2013 O PHE A 139 1.537 -4.301 -3.692 1.00 12.22 O ATOM 2014 CB PHE A 139 -0.868 -5.031 -2.125 1.00 13.13 C ATOM 2015 CG PHE A 139 -2.195 -4.869 -1.476 1.00 22.43 C ATOM 2016 CD1 PHE A 139 -2.290 -4.858 -0.111 1.00 63.53 C ATOM 2017 CD2 PHE A 139 -3.336 -4.709 -2.222 1.00 1.41 C ATOM 2018 CE1 PHE A 139 -3.493 -4.690 0.517 1.00 52.14 C ATOM 2019 CE2 PHE A 139 -4.552 -4.544 -1.604 1.00 34.00 C ATOM 2020 CZ PHE A 139 -4.632 -4.535 -0.228 1.00 33.04 C ATOM 0 H PHE A 139 -0.569 -2.579 -3.336 1.00 51.21 H new ATOM 0 HA PHE A 139 0.173 -3.789 -0.758 1.00 31.24 H new ATOM 0 HB2 PHE A 139 -1.004 -5.128 -3.202 1.00 13.13 H new ATOM 0 HB3 PHE A 139 -0.409 -5.956 -1.777 1.00 13.13 H new ATOM 0 HD1 PHE A 139 -1.397 -4.985 0.482 1.00 63.53 H new ATOM 0 HD2 PHE A 139 -3.278 -4.713 -3.300 1.00 1.41 H new ATOM 0 HE1 PHE A 139 -3.545 -4.680 1.596 1.00 52.14 H new ATOM 0 HE2 PHE A 139 -5.446 -4.421 -2.197 1.00 34.00 H new ATOM 0 HZ PHE A 139 -5.587 -4.407 0.260 1.00 33.04 H new ATOM 2030 N ILE A 140 2.415 -4.109 -1.640 1.00 33.42 N ATOM 2031 CA ILE A 140 3.735 -4.360 -2.110 1.00 33.21 C ATOM 2032 C ILE A 140 4.204 -5.690 -1.585 1.00 53.22 C ATOM 2033 O ILE A 140 4.638 -5.836 -0.436 1.00 4.13 O ATOM 2034 CB ILE A 140 4.736 -3.197 -1.811 1.00 14.44 C ATOM 2035 CG1 ILE A 140 4.670 -2.758 -0.333 1.00 55.44 C ATOM 2036 CG2 ILE A 140 4.472 -2.018 -2.751 1.00 42.53 C ATOM 2037 CD1 ILE A 140 5.617 -1.639 0.038 1.00 50.14 C ATOM 0 H ILE A 140 2.343 -3.928 -0.639 1.00 33.42 H new ATOM 0 HA ILE A 140 3.704 -4.406 -3.199 1.00 33.21 H new ATOM 0 HB ILE A 140 5.746 -3.564 -1.991 1.00 14.44 H new ATOM 0 HG12 ILE A 140 3.651 -2.443 -0.107 1.00 55.44 H new ATOM 0 HG13 ILE A 140 4.884 -3.621 0.298 1.00 55.44 H new ATOM 0 HG21 ILE A 140 5.175 -1.214 -2.533 1.00 42.53 H new ATOM 0 HG22 ILE A 140 4.599 -2.341 -3.784 1.00 42.53 H new ATOM 0 HG23 ILE A 140 3.453 -1.658 -2.606 1.00 42.53 H new ATOM 0 HD11 ILE A 140 5.500 -1.398 1.095 1.00 50.14 H new ATOM 0 HD12 ILE A 140 6.643 -1.953 -0.151 1.00 50.14 H new ATOM 0 HD13 ILE A 140 5.391 -0.757 -0.562 1.00 50.14 H new ATOM 2049 N MET A 141 4.071 -6.667 -2.423 1.00 52.44 N ATOM 2050 CA MET A 141 4.407 -8.008 -2.072 1.00 11.04 C ATOM 2051 C MET A 141 5.753 -8.374 -2.646 1.00 34.23 C ATOM 2052 O MET A 141 5.846 -8.789 -3.801 1.00 11.05 O ATOM 2053 CB MET A 141 3.289 -8.980 -2.539 1.00 21.12 C ATOM 2054 CG MET A 141 2.865 -8.840 -4.003 1.00 25.34 C ATOM 2055 SD MET A 141 1.564 -9.997 -4.496 1.00 35.32 S ATOM 2056 CE MET A 141 2.392 -11.565 -4.242 1.00 35.54 C ATOM 0 H MET A 141 3.724 -6.556 -3.376 1.00 52.44 H new ATOM 0 HA MET A 141 4.481 -8.092 -0.988 1.00 11.04 H new ATOM 0 HB2 MET A 141 3.628 -10.003 -2.373 1.00 21.12 H new ATOM 0 HB3 MET A 141 2.413 -8.828 -1.909 1.00 21.12 H new ATOM 0 HG2 MET A 141 2.518 -7.821 -4.176 1.00 25.34 H new ATOM 0 HG3 MET A 141 3.736 -8.993 -4.641 1.00 25.34 H new ATOM 0 HE1 MET A 141 1.864 -12.348 -4.787 1.00 35.54 H new ATOM 0 HE2 MET A 141 3.418 -11.498 -4.605 1.00 35.54 H new ATOM 0 HE3 MET A 141 2.399 -11.805 -3.179 1.00 35.54 H new ATOM 2066 N SER A 142 6.785 -8.179 -1.806 1.00 52.44 N ATOM 2067 CA SER A 142 8.240 -8.433 -2.086 1.00 20.43 C ATOM 2068 C SER A 142 9.150 -7.670 -1.103 1.00 51.42 C ATOM 2069 O SER A 142 10.347 -7.494 -1.373 1.00 51.21 O ATOM 2070 CB SER A 142 8.675 -8.028 -3.519 1.00 34.35 C ATOM 2071 OG SER A 142 8.274 -8.988 -4.490 1.00 43.20 O ATOM 0 H SER A 142 6.637 -7.822 -0.862 1.00 52.44 H new ATOM 0 HA SER A 142 8.353 -9.511 -1.970 1.00 20.43 H new ATOM 0 HB2 SER A 142 8.244 -7.059 -3.768 1.00 34.35 H new ATOM 0 HB3 SER A 142 9.758 -7.912 -3.550 1.00 34.35 H new ATOM 0 HG SER A 142 7.309 -9.141 -4.419 1.00 43.20 H new ATOM 2077 N LYS A 143 8.630 -7.259 0.037 1.00 71.32 N ATOM 2078 CA LYS A 143 9.432 -6.492 0.970 1.00 1.32 C ATOM 2079 C LYS A 143 10.286 -7.480 1.740 1.00 31.34 C ATOM 2080 O LYS A 143 9.794 -8.530 2.137 1.00 3.24 O ATOM 2081 CB LYS A 143 8.532 -5.722 1.920 1.00 51.32 C ATOM 2082 CG LYS A 143 9.225 -4.650 2.745 1.00 60.31 C ATOM 2083 CD LYS A 143 9.666 -3.465 1.905 1.00 72.51 C ATOM 2084 CE LYS A 143 10.202 -2.346 2.787 1.00 71.24 C ATOM 2085 NZ LYS A 143 10.608 -1.163 2.002 1.00 41.14 N ATOM 0 H LYS A 143 7.672 -7.439 0.336 1.00 71.32 H new ATOM 0 HA LYS A 143 10.057 -5.770 0.445 1.00 1.32 H new ATOM 0 HB2 LYS A 143 7.736 -5.254 1.341 1.00 51.32 H new ATOM 0 HB3 LYS A 143 8.058 -6.430 2.599 1.00 51.32 H new ATOM 0 HG2 LYS A 143 8.549 -4.305 3.528 1.00 60.31 H new ATOM 0 HG3 LYS A 143 10.094 -5.083 3.241 1.00 60.31 H new ATOM 0 HD2 LYS A 143 10.436 -3.779 1.201 1.00 72.51 H new ATOM 0 HD3 LYS A 143 8.826 -3.099 1.316 1.00 72.51 H new ATOM 0 HE2 LYS A 143 9.438 -2.057 3.508 1.00 71.24 H new ATOM 0 HE3 LYS A 143 11.056 -2.712 3.357 1.00 71.24 H new ATOM 0 HZ1 LYS A 143 10.966 -0.427 2.643 1.00 41.14 H new ATOM 0 HZ2 LYS A 143 11.356 -1.432 1.331 1.00 41.14 H new ATOM 0 HZ3 LYS A 143 9.788 -0.796 1.478 1.00 41.14 H new ATOM 2099 N ALA A 144 11.542 -7.178 1.926 1.00 44.32 N ATOM 2100 CA ALA A 144 12.438 -8.130 2.547 1.00 11.34 C ATOM 2101 C ALA A 144 13.625 -7.469 3.207 1.00 14.53 C ATOM 2102 O ALA A 144 14.160 -6.468 2.709 1.00 44.03 O ATOM 2103 CB ALA A 144 12.938 -9.121 1.505 1.00 73.30 C ATOM 0 H ALA A 144 11.970 -6.291 1.661 1.00 44.32 H new ATOM 0 HA ALA A 144 11.869 -8.641 3.324 1.00 11.34 H new ATOM 0 HB1 ALA A 144 13.612 -9.836 1.977 1.00 73.30 H new ATOM 0 HB2 ALA A 144 12.090 -9.653 1.072 1.00 73.30 H new ATOM 0 HB3 ALA A 144 13.470 -8.585 0.719 1.00 73.30 H new ATOM 2109 N ALA A 145 14.012 -8.004 4.326 1.00 34.33 N ATOM 2110 CA ALA A 145 15.220 -7.596 5.008 1.00 54.35 C ATOM 2111 C ALA A 145 16.328 -8.575 4.612 1.00 52.03 C ATOM 2112 O ALA A 145 16.017 -9.672 4.115 1.00 40.20 O ATOM 2113 CB ALA A 145 15.005 -7.629 6.513 1.00 3.43 C ATOM 0 H ALA A 145 13.498 -8.745 4.803 1.00 34.33 H new ATOM 0 HA ALA A 145 15.493 -6.578 4.728 1.00 54.35 H new ATOM 0 HB1 ALA A 145 15.920 -7.320 7.018 1.00 3.43 H new ATOM 0 HB2 ALA A 145 14.196 -6.949 6.780 1.00 3.43 H new ATOM 0 HB3 ALA A 145 14.744 -8.642 6.821 1.00 3.43 H new ATOM 2119 N PRO A 146 17.620 -8.183 4.753 1.00 52.35 N ATOM 2120 CA PRO A 146 18.770 -9.062 4.460 1.00 55.31 C ATOM 2121 C PRO A 146 18.646 -10.437 5.126 1.00 33.21 C ATOM 2122 O PRO A 146 18.267 -10.543 6.301 1.00 74.33 O ATOM 2123 CB PRO A 146 19.945 -8.296 5.061 1.00 15.11 C ATOM 2124 CG PRO A 146 19.554 -6.871 4.944 1.00 33.13 C ATOM 2125 CD PRO A 146 18.069 -6.832 5.164 1.00 2.41 C ATOM 0 HA PRO A 146 18.863 -9.270 3.394 1.00 55.31 H new ATOM 0 HB2 PRO A 146 20.113 -8.578 6.100 1.00 15.11 H new ATOM 0 HB3 PRO A 146 20.870 -8.500 4.522 1.00 15.11 H new ATOM 0 HG2 PRO A 146 20.074 -6.261 5.683 1.00 33.13 H new ATOM 0 HG3 PRO A 146 19.814 -6.474 3.963 1.00 33.13 H new ATOM 0 HD2 PRO A 146 17.823 -6.628 6.206 1.00 2.41 H new ATOM 0 HD3 PRO A 146 17.596 -6.053 4.566 1.00 2.41 H new ATOM 2133 N TYR A 147 18.948 -11.474 4.358 1.00 32.01 N ATOM 2134 CA TYR A 147 18.870 -12.845 4.798 1.00 63.35 C ATOM 2135 C TYR A 147 19.804 -13.124 5.960 1.00 64.53 C ATOM 2136 O TYR A 147 20.829 -12.432 6.147 1.00 73.41 O ATOM 2137 CB TYR A 147 19.200 -13.790 3.629 1.00 75.03 C ATOM 2138 CG TYR A 147 20.620 -13.701 3.088 1.00 42.32 C ATOM 2139 CD1 TYR A 147 20.964 -12.765 2.125 1.00 15.34 C ATOM 2140 CD2 TYR A 147 21.607 -14.568 3.537 1.00 50.21 C ATOM 2141 CE1 TYR A 147 22.251 -12.693 1.630 1.00 40.41 C ATOM 2142 CE2 TYR A 147 22.893 -14.502 3.048 1.00 15.34 C ATOM 2143 CZ TYR A 147 23.210 -13.567 2.095 1.00 30.12 C ATOM 2144 OH TYR A 147 24.502 -13.494 1.606 1.00 62.20 O ATOM 0 H TYR A 147 19.260 -11.375 3.392 1.00 32.01 H new ATOM 0 HA TYR A 147 17.851 -13.021 5.142 1.00 63.35 H new ATOM 0 HB2 TYR A 147 19.018 -14.815 3.952 1.00 75.03 H new ATOM 0 HB3 TYR A 147 18.507 -13.585 2.813 1.00 75.03 H new ATOM 0 HD1 TYR A 147 20.214 -12.081 1.756 1.00 15.34 H new ATOM 0 HD2 TYR A 147 21.362 -15.308 4.284 1.00 50.21 H new ATOM 0 HE1 TYR A 147 22.505 -11.956 0.883 1.00 40.41 H new ATOM 0 HE2 TYR A 147 23.648 -15.183 3.413 1.00 15.34 H new ATOM 0 HH TYR A 147 25.054 -14.179 2.037 1.00 62.20 H new ATOM 2154 N VAL A 148 19.472 -14.125 6.725 1.00 24.13 N ATOM 2155 CA VAL A 148 20.302 -14.523 7.814 1.00 22.12 C ATOM 2156 C VAL A 148 21.448 -15.369 7.289 1.00 53.53 C ATOM 2157 O VAL A 148 21.254 -16.273 6.466 1.00 14.42 O ATOM 2158 CB VAL A 148 19.519 -15.268 8.942 1.00 21.41 C ATOM 2159 CG1 VAL A 148 18.514 -14.333 9.597 1.00 12.14 C ATOM 2160 CG2 VAL A 148 18.807 -16.515 8.410 1.00 51.31 C ATOM 0 H VAL A 148 18.625 -14.681 6.609 1.00 24.13 H new ATOM 0 HA VAL A 148 20.695 -13.619 8.278 1.00 22.12 H new ATOM 0 HB VAL A 148 20.247 -15.591 9.686 1.00 21.41 H new ATOM 0 HG11 VAL A 148 17.977 -14.867 10.381 1.00 12.14 H new ATOM 0 HG12 VAL A 148 19.038 -13.482 10.032 1.00 12.14 H new ATOM 0 HG13 VAL A 148 17.805 -13.978 8.848 1.00 12.14 H new ATOM 0 HG21 VAL A 148 18.274 -17.005 9.225 1.00 51.31 H new ATOM 0 HG22 VAL A 148 18.098 -16.226 7.634 1.00 51.31 H new ATOM 0 HG23 VAL A 148 19.542 -17.203 7.992 1.00 51.31 H new ATOM 2170 N ALA A 149 22.618 -15.017 7.683 1.00 33.44 N ATOM 2171 CA ALA A 149 23.793 -15.729 7.323 1.00 45.01 C ATOM 2172 C ALA A 149 24.515 -16.011 8.592 1.00 2.25 C ATOM 2173 O ALA A 149 25.040 -15.065 9.204 1.00 3.42 O ATOM 2174 CB ALA A 149 24.660 -14.929 6.352 1.00 13.42 C ATOM 0 H ALA A 149 22.791 -14.207 8.279 1.00 33.44 H new ATOM 0 HA ALA A 149 23.543 -16.653 6.802 1.00 45.01 H new ATOM 0 HB1 ALA A 149 25.550 -15.505 6.099 1.00 13.42 H new ATOM 0 HB2 ALA A 149 24.093 -14.721 5.445 1.00 13.42 H new ATOM 0 HB3 ALA A 149 24.957 -13.990 6.818 1.00 13.42 H new TER 2180 ALA A 149