USER MOD reduce.3.24.130724 H: found=0, std=0, add=1125, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1125 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 17 ASN : amide:sc= -0.543! C(o=0.71!,f=-11!) USER MOD Set 1.2: A 132 LYS NZ :NH3+ 166:sc= 1.26 (180deg=-0.202) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -173:sc= 0 (180deg=-0.0313) USER MOD Single : A 5 THR OG1 : rot -54:sc= 0.242 USER MOD Single : A 7 TYR OH : rot 43:sc= 0.527 USER MOD Single : A 10 TYR OH : rot -122:sc= 1.29 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.0341 X(o=-0.034,f=-0.034) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot 30:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 153:sc= -3.06! (180deg=-5.15!) USER MOD Single : A 31 LYS NZ :NH3+ -157:sc= 1.28 (180deg=0.932) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.107 X(o=-0.11,f=-0.11) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.453 USER MOD Single : A 48 MET CE :methyl -160:sc= -0.186 (180deg=-0.705) USER MOD Single : A 50 ASN : amide:sc= -0.52 X(o=-0.52,f=-0.1) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -179:sc= 1.11 (180deg=1.05) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 HIS : no HE2:sc= 0.103 K(o=0.1,f=-5.1!) USER MOD Single : A 78 TYR OH : rot 19:sc= -1.17! USER MOD Single : A 86 THR OG1 : rot -86:sc= 0.372 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0516) USER MOD Single : A 93 ASN : amide:sc= -0.267 K(o=-0.27,f=-3!) USER MOD Single : A 96 THR OG1 : rot -170:sc= 0.306 USER MOD Single : A 97 GLN : amide:sc= -0.556 K(o=-0.56,f=-5.1!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -110:sc= -0.703 (180deg=-2.85!) USER MOD Single : A 103 MET CE :methyl -165:sc= -0.0595 (180deg=-0.386) USER MOD Single : A 104 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 105 GLN : amide:sc= -0.929! K(o=-0.93!,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= -0.0112 USER MOD Single : A 111 SER OG : rot 96:sc= 0.745 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 165:sc= -0.013 (180deg=-0.236) USER MOD Single : A 118 HIS : no HD1:sc=-0.000514 X(o=-0.00051,f=-0.066) USER MOD Single : A 119 SER OG : rot -148:sc= 0.731 USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 ASN : amide:sc= 0.808 K(o=0.81,f=-4!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl -132:sc= -2.89! (180deg=-5.09!) USER MOD Single : A 130 LYS NZ :NH3+ -173:sc= 0.363 (180deg=0.341) USER MOD Single : A 133 SER OG : rot 80:sc= 1.17 USER MOD Single : A 142 HIS : no HE2:sc= 1.05 K(o=1,f=-4.6!) USER MOD Single : A 143 HIS : no HD1:sc= 0.632 K(o=0.63,f=-4.8!) USER MOD Single : A 144 HIS : no HE2:sc= 0.147! C(o=0.15!,f=-6.1!) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=-0.0087) USER MOD Single : A 147 HIS : no HD1:sc= -0.0821 X(o=-0.082,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.222 13.499 5.669 1.00 22.13 N ATOM 2 CA MET A 1 -15.930 13.524 4.946 1.00 73.32 C ATOM 3 C MET A 1 -16.142 13.148 3.489 1.00 62.35 C ATOM 4 O MET A 1 -16.411 11.988 3.169 1.00 41.34 O ATOM 5 CB MET A 1 -14.921 12.565 5.590 1.00 23.41 C ATOM 6 CG MET A 1 -14.448 13.008 6.965 1.00 25.31 C ATOM 7 SD MET A 1 -13.279 11.851 7.703 1.00 73.21 S ATOM 8 CE MET A 1 -12.950 12.661 9.267 1.00 13.21 C ATOM 0 H1 MET A 1 -17.089 13.870 6.631 1.00 22.13 H new ATOM 0 H2 MET A 1 -17.914 14.088 5.163 1.00 22.13 H new ATOM 0 H3 MET A 1 -17.572 12.521 5.721 1.00 22.13 H new ATOM 0 HA MET A 1 -15.527 14.535 5.004 1.00 73.32 H new ATOM 0 HB2 MET A 1 -15.374 11.577 5.672 1.00 23.41 H new ATOM 0 HB3 MET A 1 -14.057 12.466 4.933 1.00 23.41 H new ATOM 0 HG2 MET A 1 -13.981 13.990 6.885 1.00 25.31 H new ATOM 0 HG3 MET A 1 -15.310 13.118 7.624 1.00 25.31 H new ATOM 0 HE1 MET A 1 -12.241 12.066 9.843 1.00 13.21 H new ATOM 0 HE2 MET A 1 -12.529 13.650 9.083 1.00 13.21 H new ATOM 0 HE3 MET A 1 -13.879 12.761 9.828 1.00 13.21 H new ATOM 20 N ASP A 2 -16.041 14.131 2.611 1.00 52.23 N ATOM 21 CA ASP A 2 -16.215 13.895 1.189 1.00 24.55 C ATOM 22 C ASP A 2 -14.901 14.081 0.447 1.00 22.35 C ATOM 23 O ASP A 2 -14.297 15.155 0.478 1.00 13.33 O ATOM 24 CB ASP A 2 -17.291 14.812 0.600 1.00 35.52 C ATOM 25 CG ASP A 2 -18.689 14.392 1.004 1.00 32.43 C ATOM 26 OD1 ASP A 2 -19.224 13.436 0.405 1.00 4.41 O ATOM 27 OD2 ASP A 2 -19.265 15.016 1.919 1.00 32.53 O ATOM 0 H ASP A 2 -15.839 15.100 2.858 1.00 52.23 H new ATOM 0 HA ASP A 2 -16.544 12.863 1.064 1.00 24.55 H new ATOM 0 HB2 ASP A 2 -17.112 15.836 0.929 1.00 35.52 H new ATOM 0 HB3 ASP A 2 -17.213 14.808 -0.487 1.00 35.52 H new ATOM 32 N ASP A 3 -14.472 13.019 -0.210 1.00 51.54 N ATOM 33 CA ASP A 3 -13.246 13.015 -0.983 1.00 21.15 C ATOM 34 C ASP A 3 -13.627 13.093 -2.452 1.00 31.13 C ATOM 35 O ASP A 3 -13.906 12.075 -3.088 1.00 4.01 O ATOM 36 CB ASP A 3 -12.440 11.731 -0.725 1.00 20.52 C ATOM 37 CG ASP A 3 -12.271 11.388 0.745 1.00 23.44 C ATOM 38 OD1 ASP A 3 -13.293 11.144 1.425 1.00 22.01 O ATOM 39 OD2 ASP A 3 -11.117 11.284 1.215 1.00 33.33 O ATOM 0 H ASP A 3 -14.969 12.129 -0.222 1.00 51.54 H new ATOM 0 HA ASP A 3 -12.624 13.863 -0.695 1.00 21.15 H new ATOM 0 HB2 ASP A 3 -12.933 10.898 -1.227 1.00 20.52 H new ATOM 0 HB3 ASP A 3 -11.454 11.837 -1.178 1.00 20.52 H new ATOM 44 N ARG A 4 -13.687 14.305 -2.974 1.00 72.21 N ATOM 45 CA ARG A 4 -14.275 14.529 -4.291 1.00 51.45 C ATOM 46 C ARG A 4 -13.240 14.520 -5.413 1.00 4.41 C ATOM 47 O ARG A 4 -13.597 14.673 -6.581 1.00 64.14 O ATOM 48 CB ARG A 4 -15.042 15.852 -4.324 1.00 20.24 C ATOM 49 CG ARG A 4 -16.039 16.029 -3.188 1.00 24.42 C ATOM 50 CD ARG A 4 -16.995 17.177 -3.470 1.00 14.50 C ATOM 51 NE ARG A 4 -17.668 17.648 -2.259 1.00 45.22 N ATOM 52 CZ ARG A 4 -18.986 17.612 -2.063 1.00 64.43 C ATOM 53 NH1 ARG A 4 -19.777 16.985 -2.921 1.00 61.33 N ATOM 54 NH2 ARG A 4 -19.507 18.178 -0.981 1.00 61.41 N ATOM 0 H ARG A 4 -13.340 15.146 -2.514 1.00 72.21 H new ATOM 0 HA ARG A 4 -14.958 13.697 -4.463 1.00 51.45 H new ATOM 0 HB2 ARG A 4 -14.326 16.674 -4.294 1.00 20.24 H new ATOM 0 HB3 ARG A 4 -15.574 15.926 -5.273 1.00 20.24 H new ATOM 0 HG2 ARG A 4 -16.604 15.107 -3.050 1.00 24.42 H new ATOM 0 HG3 ARG A 4 -15.504 16.218 -2.257 1.00 24.42 H new ATOM 0 HD2 ARG A 4 -16.445 18.002 -3.922 1.00 14.50 H new ATOM 0 HD3 ARG A 4 -17.741 16.856 -4.196 1.00 14.50 H new ATOM 0 HE ARG A 4 -17.088 18.031 -1.512 1.00 45.22 H new ATOM 0 HH11 ARG A 4 -19.379 16.525 -3.739 1.00 61.33 H new ATOM 0 HH12 ARG A 4 -20.784 16.962 -2.763 1.00 61.33 H new ATOM 0 HH21 ARG A 4 -18.899 18.638 -0.303 1.00 61.41 H new ATOM 0 HH22 ARG A 4 -20.515 18.153 -0.827 1.00 61.41 H new ATOM 68 N THR A 5 -11.974 14.353 -5.079 1.00 74.11 N ATOM 69 CA THR A 5 -10.931 14.335 -6.101 1.00 70.35 C ATOM 70 C THR A 5 -10.446 12.914 -6.356 1.00 32.22 C ATOM 71 O THR A 5 -10.711 12.010 -5.562 1.00 44.02 O ATOM 72 CB THR A 5 -9.732 15.236 -5.725 1.00 32.31 C ATOM 73 OG1 THR A 5 -9.107 14.768 -4.526 1.00 12.43 O ATOM 74 CG2 THR A 5 -10.175 16.677 -5.533 1.00 21.44 C ATOM 0 H THR A 5 -11.641 14.229 -4.123 1.00 74.11 H new ATOM 0 HA THR A 5 -11.377 14.732 -7.013 1.00 70.35 H new ATOM 0 HB THR A 5 -9.015 15.192 -6.545 1.00 32.31 H new ATOM 0 HG1 THR A 5 -9.779 14.684 -3.818 1.00 12.43 H new ATOM 0 HG21 THR A 5 -9.313 17.290 -5.269 1.00 21.44 H new ATOM 0 HG22 THR A 5 -10.615 17.049 -6.458 1.00 21.44 H new ATOM 0 HG23 THR A 5 -10.914 16.727 -4.734 1.00 21.44 H new ATOM 82 N GLU A 6 -9.768 12.715 -7.484 1.00 74.44 N ATOM 83 CA GLU A 6 -9.176 11.423 -7.804 1.00 43.14 C ATOM 84 C GLU A 6 -8.234 10.995 -6.689 1.00 25.13 C ATOM 85 O GLU A 6 -7.499 11.813 -6.135 1.00 63.55 O ATOM 86 CB GLU A 6 -8.417 11.464 -9.137 1.00 12.43 C ATOM 87 CG GLU A 6 -9.280 11.815 -10.338 1.00 31.41 C ATOM 88 CD GLU A 6 -9.501 13.306 -10.500 1.00 64.21 C ATOM 89 OE1 GLU A 6 -10.456 13.843 -9.902 1.00 43.41 O ATOM 90 OE2 GLU A 6 -8.723 13.945 -11.239 1.00 1.10 O ATOM 0 H GLU A 6 -9.616 13.434 -8.191 1.00 74.44 H new ATOM 0 HA GLU A 6 -9.986 10.700 -7.900 1.00 43.14 H new ATOM 0 HB2 GLU A 6 -7.609 12.192 -9.060 1.00 12.43 H new ATOM 0 HB3 GLU A 6 -7.955 10.492 -9.308 1.00 12.43 H new ATOM 0 HG2 GLU A 6 -8.811 11.424 -11.241 1.00 31.41 H new ATOM 0 HG3 GLU A 6 -10.246 11.320 -10.240 1.00 31.41 H new ATOM 97 N TYR A 7 -8.250 9.713 -6.366 1.00 4.45 N ATOM 98 CA TYR A 7 -7.509 9.229 -5.220 1.00 0.42 C ATOM 99 C TYR A 7 -6.087 8.864 -5.604 1.00 1.34 C ATOM 100 O TYR A 7 -5.848 8.122 -6.561 1.00 1.22 O ATOM 101 CB TYR A 7 -8.228 8.046 -4.576 1.00 31.22 C ATOM 102 CG TYR A 7 -9.625 8.398 -4.114 1.00 41.42 C ATOM 103 CD1 TYR A 7 -9.874 9.602 -3.470 1.00 4.03 C ATOM 104 CD2 TYR A 7 -10.689 7.537 -4.326 1.00 22.13 C ATOM 105 CE1 TYR A 7 -11.144 9.938 -3.055 1.00 42.51 C ATOM 106 CE2 TYR A 7 -11.966 7.866 -3.911 1.00 44.32 C ATOM 107 CZ TYR A 7 -12.188 9.068 -3.276 1.00 51.43 C ATOM 108 OH TYR A 7 -13.457 9.406 -2.863 1.00 44.33 O ATOM 0 H TYR A 7 -8.764 8.996 -6.878 1.00 4.45 H new ATOM 0 HA TYR A 7 -7.455 10.032 -4.485 1.00 0.42 H new ATOM 0 HB2 TYR A 7 -8.281 7.225 -5.291 1.00 31.22 H new ATOM 0 HB3 TYR A 7 -7.646 7.691 -3.725 1.00 31.22 H new ATOM 0 HD1 TYR A 7 -9.058 10.287 -3.291 1.00 4.03 H new ATOM 0 HD2 TYR A 7 -10.518 6.594 -4.823 1.00 22.13 H new ATOM 0 HE1 TYR A 7 -11.320 10.881 -2.558 1.00 42.51 H new ATOM 0 HE2 TYR A 7 -12.785 7.184 -4.084 1.00 44.32 H new ATOM 0 HH TYR A 7 -13.630 10.347 -3.074 1.00 44.33 H new ATOM 118 N ASP A 8 -5.152 9.410 -4.854 1.00 41.21 N ATOM 119 CA ASP A 8 -3.738 9.237 -5.119 1.00 20.34 C ATOM 120 C ASP A 8 -3.065 8.417 -4.018 1.00 0.33 C ATOM 121 O ASP A 8 -2.672 8.938 -2.984 1.00 53.12 O ATOM 122 CB ASP A 8 -3.077 10.617 -5.264 1.00 71.33 C ATOM 123 CG ASP A 8 -3.277 11.519 -4.047 1.00 74.44 C ATOM 124 OD1 ASP A 8 -4.435 11.656 -3.574 1.00 53.44 O ATOM 125 OD2 ASP A 8 -2.284 12.121 -3.576 1.00 3.43 O ATOM 0 H ASP A 8 -5.352 9.990 -4.039 1.00 41.21 H new ATOM 0 HA ASP A 8 -3.616 8.683 -6.050 1.00 20.34 H new ATOM 0 HB2 ASP A 8 -2.009 10.483 -5.436 1.00 71.33 H new ATOM 0 HB3 ASP A 8 -3.482 11.114 -6.145 1.00 71.33 H new ATOM 130 N VAL A 9 -2.960 7.115 -4.246 1.00 31.13 N ATOM 131 CA VAL A 9 -2.335 6.211 -3.285 1.00 60.24 C ATOM 132 C VAL A 9 -0.939 5.844 -3.768 1.00 70.13 C ATOM 133 O VAL A 9 -0.792 5.140 -4.762 1.00 32.44 O ATOM 134 CB VAL A 9 -3.161 4.918 -3.118 1.00 21.12 C ATOM 135 CG1 VAL A 9 -2.613 4.077 -1.976 1.00 40.02 C ATOM 136 CG2 VAL A 9 -4.630 5.240 -2.897 1.00 52.22 C ATOM 0 H VAL A 9 -3.301 6.658 -5.092 1.00 31.13 H new ATOM 0 HA VAL A 9 -2.284 6.721 -2.323 1.00 60.24 H new ATOM 0 HB VAL A 9 -3.078 4.339 -4.038 1.00 21.12 H new ATOM 0 HG11 VAL A 9 -3.208 3.170 -1.874 1.00 40.02 H new ATOM 0 HG12 VAL A 9 -1.577 3.810 -2.186 1.00 40.02 H new ATOM 0 HG13 VAL A 9 -2.660 4.648 -1.049 1.00 40.02 H new ATOM 0 HG21 VAL A 9 -5.192 4.313 -2.782 1.00 52.22 H new ATOM 0 HG22 VAL A 9 -4.739 5.844 -1.996 1.00 52.22 H new ATOM 0 HG23 VAL A 9 -5.014 5.793 -3.754 1.00 52.22 H new ATOM 146 N TYR A 10 0.081 6.318 -3.073 1.00 32.43 N ATOM 147 CA TYR A 10 1.456 6.031 -3.460 1.00 22.32 C ATOM 148 C TYR A 10 2.397 6.106 -2.268 1.00 15.02 C ATOM 149 O TYR A 10 2.236 6.950 -1.386 1.00 72.45 O ATOM 150 CB TYR A 10 1.931 6.986 -4.567 1.00 4.11 C ATOM 151 CG TYR A 10 1.533 8.431 -4.353 1.00 53.15 C ATOM 152 CD1 TYR A 10 2.191 9.233 -3.430 1.00 31.13 C ATOM 153 CD2 TYR A 10 0.492 8.989 -5.080 1.00 22.05 C ATOM 154 CE1 TYR A 10 1.817 10.548 -3.232 1.00 71.34 C ATOM 155 CE2 TYR A 10 0.117 10.302 -4.890 1.00 40.52 C ATOM 156 CZ TYR A 10 0.779 11.077 -3.967 1.00 5.32 C ATOM 157 OH TYR A 10 0.390 12.383 -3.769 1.00 51.44 O ATOM 0 H TYR A 10 -0.014 6.901 -2.241 1.00 32.43 H new ATOM 0 HA TYR A 10 1.475 5.012 -3.847 1.00 22.32 H new ATOM 0 HB2 TYR A 10 3.017 6.927 -4.641 1.00 4.11 H new ATOM 0 HB3 TYR A 10 1.528 6.647 -5.521 1.00 4.11 H new ATOM 0 HD1 TYR A 10 3.009 8.822 -2.857 1.00 31.13 H new ATOM 0 HD2 TYR A 10 -0.033 8.386 -5.806 1.00 22.05 H new ATOM 0 HE1 TYR A 10 2.335 11.157 -2.506 1.00 71.34 H new ATOM 0 HE2 TYR A 10 -0.695 10.721 -5.465 1.00 40.52 H new ATOM 0 HH TYR A 10 -0.559 12.408 -3.524 1.00 51.44 H new ATOM 167 N THR A 11 3.365 5.205 -2.250 1.00 70.25 N ATOM 168 CA THR A 11 4.407 5.190 -1.240 1.00 71.14 C ATOM 169 C THR A 11 5.731 4.793 -1.880 1.00 53.04 C ATOM 170 O THR A 11 5.765 4.425 -3.057 1.00 64.34 O ATOM 171 CB THR A 11 4.071 4.218 -0.088 1.00 3.32 C ATOM 172 OG1 THR A 11 3.612 2.964 -0.614 1.00 52.43 O ATOM 173 CG2 THR A 11 3.014 4.809 0.830 1.00 12.45 C ATOM 0 H THR A 11 3.449 4.459 -2.941 1.00 70.25 H new ATOM 0 HA THR A 11 4.483 6.192 -0.818 1.00 71.14 H new ATOM 0 HB THR A 11 4.980 4.053 0.491 1.00 3.32 H new ATOM 0 HG1 THR A 11 3.404 2.356 0.126 1.00 52.43 H new ATOM 0 HG21 THR A 11 2.795 4.105 1.633 1.00 12.45 H new ATOM 0 HG22 THR A 11 3.383 5.742 1.256 1.00 12.45 H new ATOM 0 HG23 THR A 11 2.105 5.004 0.260 1.00 12.45 H new ATOM 181 N ASP A 12 6.817 4.884 -1.129 1.00 40.01 N ATOM 182 CA ASP A 12 8.120 4.502 -1.652 1.00 50.31 C ATOM 183 C ASP A 12 8.385 3.035 -1.363 1.00 44.31 C ATOM 184 O ASP A 12 7.929 2.500 -0.352 1.00 24.41 O ATOM 185 CB ASP A 12 9.234 5.368 -1.057 1.00 65.01 C ATOM 186 CG ASP A 12 10.575 5.121 -1.725 1.00 41.53 C ATOM 187 OD1 ASP A 12 11.290 4.187 -1.312 1.00 74.35 O ATOM 188 OD2 ASP A 12 10.909 5.858 -2.677 1.00 5.45 O ATOM 0 H ASP A 12 6.824 5.216 -0.164 1.00 40.01 H new ATOM 0 HA ASP A 12 8.113 4.661 -2.730 1.00 50.31 H new ATOM 0 HB2 ASP A 12 8.968 6.420 -1.160 1.00 65.01 H new ATOM 0 HB3 ASP A 12 9.319 5.164 0.010 1.00 65.01 H new ATOM 193 N GLY A 13 9.106 2.387 -2.263 1.00 53.33 N ATOM 194 CA GLY A 13 9.432 0.991 -2.089 1.00 3.12 C ATOM 195 C GLY A 13 10.842 0.685 -2.539 1.00 12.53 C ATOM 196 O GLY A 13 11.112 -0.385 -3.087 1.00 54.24 O ATOM 0 H GLY A 13 9.473 2.808 -3.117 1.00 53.33 H new ATOM 0 HA2 GLY A 13 9.318 0.719 -1.040 1.00 3.12 H new ATOM 0 HA3 GLY A 13 8.729 0.380 -2.655 1.00 3.12 H new ATOM 200 N SER A 14 11.740 1.632 -2.326 1.00 20.22 N ATOM 201 CA SER A 14 13.129 1.464 -2.707 1.00 3.11 C ATOM 202 C SER A 14 13.971 1.153 -1.477 1.00 21.43 C ATOM 203 O SER A 14 13.979 1.918 -0.511 1.00 33.14 O ATOM 204 CB SER A 14 13.637 2.737 -3.398 1.00 62.23 C ATOM 205 OG SER A 14 14.938 2.560 -3.943 1.00 3.44 O ATOM 0 H SER A 14 11.529 2.529 -1.889 1.00 20.22 H new ATOM 0 HA SER A 14 13.212 0.631 -3.405 1.00 3.11 H new ATOM 0 HB2 SER A 14 12.946 3.020 -4.192 1.00 62.23 H new ATOM 0 HB3 SER A 14 13.652 3.558 -2.681 1.00 62.23 H new ATOM 0 HG SER A 14 15.227 3.390 -4.376 1.00 3.44 H new ATOM 211 N TYR A 15 14.667 0.019 -1.501 1.00 45.34 N ATOM 212 CA TYR A 15 15.558 -0.337 -0.408 1.00 64.31 C ATOM 213 C TYR A 15 16.746 0.616 -0.382 1.00 73.03 C ATOM 214 O TYR A 15 17.641 0.549 -1.224 1.00 1.15 O ATOM 215 CB TYR A 15 16.016 -1.805 -0.505 1.00 4.51 C ATOM 216 CG TYR A 15 16.360 -2.285 -1.903 1.00 10.33 C ATOM 217 CD1 TYR A 15 15.369 -2.772 -2.748 1.00 23.33 C ATOM 218 CD2 TYR A 15 17.670 -2.273 -2.372 1.00 73.41 C ATOM 219 CE1 TYR A 15 15.672 -3.228 -4.016 1.00 41.30 C ATOM 220 CE2 TYR A 15 17.979 -2.725 -3.641 1.00 12.20 C ATOM 221 CZ TYR A 15 16.977 -3.204 -4.458 1.00 51.43 C ATOM 222 OH TYR A 15 17.279 -3.663 -5.723 1.00 41.14 O ATOM 0 H TYR A 15 14.630 -0.662 -2.260 1.00 45.34 H new ATOM 0 HA TYR A 15 15.011 -0.240 0.530 1.00 64.31 H new ATOM 0 HB2 TYR A 15 16.890 -1.939 0.133 1.00 4.51 H new ATOM 0 HB3 TYR A 15 15.228 -2.442 -0.103 1.00 4.51 H new ATOM 0 HD1 TYR A 15 14.345 -2.794 -2.407 1.00 23.33 H new ATOM 0 HD2 TYR A 15 18.459 -1.904 -1.733 1.00 73.41 H new ATOM 0 HE1 TYR A 15 14.889 -3.602 -4.659 1.00 41.30 H new ATOM 0 HE2 TYR A 15 19.000 -2.703 -3.991 1.00 12.20 H new ATOM 0 HH TYR A 15 18.242 -3.577 -5.881 1.00 41.14 H new ATOM 232 N VAL A 16 16.736 1.514 0.588 1.00 74.53 N ATOM 233 CA VAL A 16 17.716 2.578 0.656 1.00 60.54 C ATOM 234 C VAL A 16 18.816 2.244 1.661 1.00 15.04 C ATOM 235 O VAL A 16 18.545 1.863 2.802 1.00 4.42 O ATOM 236 CB VAL A 16 17.042 3.931 0.999 1.00 14.33 C ATOM 237 CG1 VAL A 16 16.264 3.846 2.306 1.00 72.12 C ATOM 238 CG2 VAL A 16 18.065 5.054 1.050 1.00 61.02 C ATOM 0 H VAL A 16 16.052 1.525 1.345 1.00 74.53 H new ATOM 0 HA VAL A 16 18.178 2.673 -0.327 1.00 60.54 H new ATOM 0 HB VAL A 16 16.333 4.157 0.203 1.00 14.33 H new ATOM 0 HG11 VAL A 16 15.803 4.811 2.519 1.00 72.12 H new ATOM 0 HG12 VAL A 16 15.489 3.085 2.219 1.00 72.12 H new ATOM 0 HG13 VAL A 16 16.943 3.582 3.117 1.00 72.12 H new ATOM 0 HG21 VAL A 16 17.564 5.991 1.293 1.00 61.02 H new ATOM 0 HG22 VAL A 16 18.811 4.833 1.814 1.00 61.02 H new ATOM 0 HG23 VAL A 16 18.555 5.144 0.080 1.00 61.02 H new ATOM 248 N ASN A 17 20.058 2.368 1.201 1.00 21.30 N ATOM 249 CA ASN A 17 21.244 2.030 1.992 1.00 11.24 C ATOM 250 C ASN A 17 21.259 0.547 2.328 1.00 71.11 C ATOM 251 O ASN A 17 21.863 0.121 3.313 1.00 73.14 O ATOM 252 CB ASN A 17 21.311 2.854 3.282 1.00 43.43 C ATOM 253 CG ASN A 17 21.545 4.329 3.027 1.00 34.34 C ATOM 254 OD1 ASN A 17 20.603 5.119 2.945 1.00 32.32 O ATOM 255 ND2 ASN A 17 22.801 4.704 2.896 1.00 33.34 N ATOM 0 H ASN A 17 20.274 2.708 0.264 1.00 21.30 H new ATOM 0 HA ASN A 17 22.119 2.269 1.387 1.00 11.24 H new ATOM 0 HB2 ASN A 17 20.380 2.729 3.836 1.00 43.43 H new ATOM 0 HB3 ASN A 17 22.112 2.468 3.913 1.00 43.43 H new ATOM 0 HD21 ASN A 17 23.025 5.683 2.719 1.00 33.34 H new ATOM 0 HD22 ASN A 17 23.549 4.015 2.971 1.00 33.34 H new ATOM 262 N GLY A 18 20.625 -0.242 1.476 1.00 54.45 N ATOM 263 CA GLY A 18 20.576 -1.676 1.674 1.00 12.33 C ATOM 264 C GLY A 18 19.446 -2.105 2.591 1.00 12.42 C ATOM 265 O GLY A 18 19.015 -3.258 2.553 1.00 31.41 O ATOM 0 H GLY A 18 20.139 0.088 0.643 1.00 54.45 H new ATOM 0 HA2 GLY A 18 20.460 -2.168 0.708 1.00 12.33 H new ATOM 0 HA3 GLY A 18 21.525 -2.013 2.092 1.00 12.33 H new ATOM 269 N GLN A 19 18.966 -1.187 3.420 1.00 71.41 N ATOM 270 CA GLN A 19 17.892 -1.498 4.353 1.00 61.33 C ATOM 271 C GLN A 19 16.538 -1.431 3.662 1.00 71.41 C ATOM 272 O GLN A 19 16.292 -0.555 2.833 1.00 63.20 O ATOM 273 CB GLN A 19 17.904 -0.551 5.558 1.00 13.14 C ATOM 274 CG GLN A 19 18.902 -0.925 6.648 1.00 40.33 C ATOM 275 CD GLN A 19 20.347 -0.680 6.257 1.00 64.01 C ATOM 276 OE1 GLN A 19 20.881 0.409 6.467 1.00 2.15 O ATOM 277 NE2 GLN A 19 20.996 -1.697 5.715 1.00 52.34 N ATOM 0 H GLN A 19 19.302 -0.225 3.465 1.00 71.41 H new ATOM 0 HA GLN A 19 18.060 -2.514 4.711 1.00 61.33 H new ATOM 0 HB2 GLN A 19 18.128 0.457 5.209 1.00 13.14 H new ATOM 0 HB3 GLN A 19 16.905 -0.524 5.992 1.00 13.14 H new ATOM 0 HG2 GLN A 19 18.676 -0.353 7.548 1.00 40.33 H new ATOM 0 HG3 GLN A 19 18.776 -1.978 6.899 1.00 40.33 H new ATOM 0 HE21 GLN A 19 20.516 -2.583 5.558 1.00 52.34 H new ATOM 0 HE22 GLN A 19 21.977 -1.595 5.454 1.00 52.34 H new ATOM 286 N TYR A 20 15.666 -2.366 4.002 1.00 55.14 N ATOM 287 CA TYR A 20 14.324 -2.392 3.451 1.00 2.40 C ATOM 288 C TYR A 20 13.324 -2.764 4.535 1.00 51.45 C ATOM 289 O TYR A 20 13.670 -3.437 5.506 1.00 64.45 O ATOM 290 CB TYR A 20 14.229 -3.373 2.275 1.00 11.32 C ATOM 291 CG TYR A 20 14.443 -4.826 2.651 1.00 30.44 C ATOM 292 CD1 TYR A 20 15.722 -5.352 2.791 1.00 50.20 C ATOM 293 CD2 TYR A 20 13.361 -5.671 2.866 1.00 32.23 C ATOM 294 CE1 TYR A 20 15.915 -6.677 3.134 1.00 52.42 C ATOM 295 CE2 TYR A 20 13.546 -6.996 3.210 1.00 51.33 C ATOM 296 CZ TYR A 20 14.824 -7.494 3.343 1.00 3.03 C ATOM 297 OH TYR A 20 15.013 -8.812 3.689 1.00 65.02 O ATOM 0 H TYR A 20 15.866 -3.119 4.660 1.00 55.14 H new ATOM 0 HA TYR A 20 14.088 -1.396 3.076 1.00 2.40 H new ATOM 0 HB2 TYR A 20 13.248 -3.271 1.812 1.00 11.32 H new ATOM 0 HB3 TYR A 20 14.967 -3.093 1.524 1.00 11.32 H new ATOM 0 HD1 TYR A 20 16.579 -4.715 2.629 1.00 50.20 H new ATOM 0 HD2 TYR A 20 12.358 -5.285 2.762 1.00 32.23 H new ATOM 0 HE1 TYR A 20 16.915 -7.070 3.238 1.00 52.42 H new ATOM 0 HE2 TYR A 20 12.693 -7.638 3.374 1.00 51.33 H new ATOM 0 HH TYR A 20 14.143 -9.249 3.801 1.00 65.02 H new ATOM 307 N ALA A 21 12.090 -2.317 4.367 1.00 55.33 N ATOM 308 CA ALA A 21 11.038 -2.575 5.335 1.00 3.22 C ATOM 309 C ALA A 21 9.684 -2.503 4.656 1.00 3.21 C ATOM 310 O ALA A 21 9.592 -2.083 3.504 1.00 4.33 O ATOM 311 CB ALA A 21 11.108 -1.567 6.470 1.00 12.23 C ATOM 0 H ALA A 21 11.791 -1.768 3.561 1.00 55.33 H new ATOM 0 HA ALA A 21 11.176 -3.574 5.748 1.00 3.22 H new ATOM 0 HB1 ALA A 21 10.314 -1.772 7.188 1.00 12.23 H new ATOM 0 HB2 ALA A 21 12.075 -1.645 6.966 1.00 12.23 H new ATOM 0 HB3 ALA A 21 10.985 -0.560 6.071 1.00 12.23 H new ATOM 317 N TRP A 22 8.639 -2.914 5.355 1.00 24.55 N ATOM 318 CA TRP A 22 7.297 -2.777 4.823 1.00 43.41 C ATOM 319 C TRP A 22 6.667 -1.514 5.393 1.00 62.33 C ATOM 320 O TRP A 22 6.689 -1.286 6.604 1.00 14.12 O ATOM 321 CB TRP A 22 6.444 -4.021 5.128 1.00 55.41 C ATOM 322 CG TRP A 22 6.170 -4.251 6.584 1.00 23.13 C ATOM 323 CD1 TRP A 22 7.052 -4.685 7.530 1.00 0.52 C ATOM 324 CD2 TRP A 22 4.918 -4.073 7.256 1.00 44.02 C ATOM 325 NE1 TRP A 22 6.427 -4.781 8.749 1.00 64.12 N ATOM 326 CE2 TRP A 22 5.115 -4.409 8.608 1.00 74.01 C ATOM 327 CE3 TRP A 22 3.648 -3.658 6.842 1.00 43.14 C ATOM 328 CZ2 TRP A 22 4.089 -4.348 9.548 1.00 2.50 C ATOM 329 CZ3 TRP A 22 2.631 -3.593 7.778 1.00 1.10 C ATOM 330 CH2 TRP A 22 2.856 -3.936 9.116 1.00 61.31 C ATOM 0 H TRP A 22 8.694 -3.340 6.280 1.00 24.55 H new ATOM 0 HA TRP A 22 7.346 -2.693 3.737 1.00 43.41 H new ATOM 0 HB2 TRP A 22 5.493 -3.930 4.603 1.00 55.41 H new ATOM 0 HB3 TRP A 22 6.949 -4.899 4.724 1.00 55.41 H new ATOM 0 HD1 TRP A 22 8.090 -4.919 7.347 1.00 0.52 H new ATOM 0 HE1 TRP A 22 6.868 -5.081 9.619 1.00 64.12 H new ATOM 0 HE3 TRP A 22 3.465 -3.393 5.811 1.00 43.14 H new ATOM 0 HZ2 TRP A 22 4.259 -4.616 10.580 1.00 2.50 H new ATOM 0 HZ3 TRP A 22 1.647 -3.272 7.471 1.00 1.10 H new ATOM 0 HH2 TRP A 22 2.041 -3.875 9.822 1.00 61.31 H new ATOM 341 N ALA A 23 6.131 -0.687 4.519 1.00 60.34 N ATOM 342 CA ALA A 23 5.599 0.600 4.922 1.00 70.20 C ATOM 343 C ALA A 23 4.695 1.154 3.847 1.00 53.11 C ATOM 344 O ALA A 23 5.015 1.078 2.659 1.00 23.23 O ATOM 345 CB ALA A 23 6.735 1.571 5.197 1.00 12.23 C ATOM 0 H ALA A 23 6.052 -0.884 3.521 1.00 60.34 H new ATOM 0 HA ALA A 23 5.017 0.467 5.834 1.00 70.20 H new ATOM 0 HB1 ALA A 23 6.325 2.535 5.499 1.00 12.23 H new ATOM 0 HB2 ALA A 23 7.364 1.178 5.996 1.00 12.23 H new ATOM 0 HB3 ALA A 23 7.332 1.698 4.294 1.00 12.23 H new ATOM 351 N TYR A 24 3.564 1.702 4.259 1.00 14.11 N ATOM 352 CA TYR A 24 2.626 2.291 3.322 1.00 45.42 C ATOM 353 C TYR A 24 1.583 3.126 4.050 1.00 24.42 C ATOM 354 O TYR A 24 1.308 2.917 5.234 1.00 32.03 O ATOM 355 CB TYR A 24 1.938 1.207 2.478 1.00 42.32 C ATOM 356 CG TYR A 24 1.183 0.164 3.281 1.00 60.13 C ATOM 357 CD1 TYR A 24 1.828 -0.961 3.787 1.00 24.53 C ATOM 358 CD2 TYR A 24 -0.178 0.301 3.523 1.00 3.52 C ATOM 359 CE1 TYR A 24 1.138 -1.914 4.512 1.00 14.12 C ATOM 360 CE2 TYR A 24 -0.875 -0.648 4.245 1.00 4.24 C ATOM 361 CZ TYR A 24 -0.214 -1.753 4.735 1.00 2.15 C ATOM 362 OH TYR A 24 -0.907 -2.703 5.450 1.00 2.54 O ATOM 0 H TYR A 24 3.274 1.751 5.236 1.00 14.11 H new ATOM 0 HA TYR A 24 3.190 2.943 2.655 1.00 45.42 H new ATOM 0 HB2 TYR A 24 1.244 1.688 1.789 1.00 42.32 H new ATOM 0 HB3 TYR A 24 2.692 0.704 1.872 1.00 42.32 H new ATOM 0 HD1 TYR A 24 2.885 -1.091 3.610 1.00 24.53 H new ATOM 0 HD2 TYR A 24 -0.700 1.165 3.140 1.00 3.52 H new ATOM 0 HE1 TYR A 24 1.654 -2.779 4.902 1.00 14.12 H new ATOM 0 HE2 TYR A 24 -1.933 -0.524 4.425 1.00 4.24 H new ATOM 0 HH TYR A 24 -0.307 -3.126 6.100 1.00 2.54 H new ATOM 372 N ALA A 25 1.016 4.074 3.331 1.00 22.02 N ATOM 373 CA ALA A 25 -0.037 4.919 3.852 1.00 50.24 C ATOM 374 C ALA A 25 -1.049 5.189 2.752 1.00 43.31 C ATOM 375 O ALA A 25 -0.686 5.625 1.661 1.00 63.32 O ATOM 376 CB ALA A 25 0.535 6.225 4.387 1.00 11.14 C ATOM 0 H ALA A 25 1.274 4.280 2.366 1.00 22.02 H new ATOM 0 HA ALA A 25 -0.530 4.409 4.680 1.00 50.24 H new ATOM 0 HB1 ALA A 25 -0.274 6.845 4.774 1.00 11.14 H new ATOM 0 HB2 ALA A 25 1.243 6.011 5.188 1.00 11.14 H new ATOM 0 HB3 ALA A 25 1.046 6.755 3.583 1.00 11.14 H new ATOM 382 N PHE A 26 -2.314 4.918 3.024 1.00 35.35 N ATOM 383 CA PHE A 26 -3.341 5.126 2.025 1.00 15.41 C ATOM 384 C PHE A 26 -3.792 6.572 2.044 1.00 51.11 C ATOM 385 O PHE A 26 -4.637 6.975 2.850 1.00 30.00 O ATOM 386 CB PHE A 26 -4.537 4.196 2.258 1.00 24.23 C ATOM 387 CG PHE A 26 -4.198 2.732 2.181 1.00 14.31 C ATOM 388 CD1 PHE A 26 -3.664 2.193 1.019 1.00 41.53 C ATOM 389 CD2 PHE A 26 -4.423 1.893 3.261 1.00 21.12 C ATOM 390 CE1 PHE A 26 -3.357 0.847 0.941 1.00 52.54 C ATOM 391 CE2 PHE A 26 -4.118 0.549 3.188 1.00 41.12 C ATOM 392 CZ PHE A 26 -3.584 0.024 2.027 1.00 75.01 C ATOM 0 H PHE A 26 -2.649 4.558 3.918 1.00 35.35 H new ATOM 0 HA PHE A 26 -2.919 4.892 1.047 1.00 15.41 H new ATOM 0 HB2 PHE A 26 -4.964 4.409 3.238 1.00 24.23 H new ATOM 0 HB3 PHE A 26 -5.307 4.419 1.520 1.00 24.23 H new ATOM 0 HD1 PHE A 26 -3.486 2.832 0.166 1.00 41.53 H new ATOM 0 HD2 PHE A 26 -4.842 2.296 4.171 1.00 21.12 H new ATOM 0 HE1 PHE A 26 -2.940 0.440 0.032 1.00 52.54 H new ATOM 0 HE2 PHE A 26 -4.297 -0.092 4.038 1.00 41.12 H new ATOM 0 HZ PHE A 26 -3.345 -1.028 1.969 1.00 75.01 H new ATOM 402 N VAL A 27 -3.206 7.339 1.149 1.00 34.33 N ATOM 403 CA VAL A 27 -3.557 8.730 0.970 1.00 61.40 C ATOM 404 C VAL A 27 -4.560 8.858 -0.174 1.00 2.32 C ATOM 405 O VAL A 27 -4.571 8.045 -1.100 1.00 2.23 O ATOM 406 CB VAL A 27 -2.294 9.598 0.717 1.00 1.52 C ATOM 407 CG1 VAL A 27 -1.366 8.937 -0.292 1.00 51.41 C ATOM 408 CG2 VAL A 27 -2.666 11.006 0.264 1.00 74.25 C ATOM 0 H VAL A 27 -2.470 7.013 0.523 1.00 34.33 H new ATOM 0 HA VAL A 27 -4.020 9.101 1.885 1.00 61.40 H new ATOM 0 HB VAL A 27 -1.762 9.681 1.665 1.00 1.52 H new ATOM 0 HG11 VAL A 27 -0.491 9.568 -0.449 1.00 51.41 H new ATOM 0 HG12 VAL A 27 -1.050 7.965 0.087 1.00 51.41 H new ATOM 0 HG13 VAL A 27 -1.892 8.804 -1.238 1.00 51.41 H new ATOM 0 HG21 VAL A 27 -1.758 11.586 0.096 1.00 74.25 H new ATOM 0 HG22 VAL A 27 -3.238 10.951 -0.662 1.00 74.25 H new ATOM 0 HG23 VAL A 27 -3.268 11.489 1.034 1.00 74.25 H new ATOM 418 N LYS A 28 -5.468 9.808 -0.042 1.00 44.41 N ATOM 419 CA LYS A 28 -6.445 10.102 -1.074 1.00 2.12 C ATOM 420 C LYS A 28 -7.061 11.462 -0.810 1.00 33.40 C ATOM 421 O LYS A 28 -7.328 11.803 0.343 1.00 52.00 O ATOM 422 CB LYS A 28 -7.548 9.029 -1.143 1.00 43.01 C ATOM 423 CG LYS A 28 -8.312 8.797 0.159 1.00 14.22 C ATOM 424 CD LYS A 28 -7.542 7.926 1.148 1.00 15.01 C ATOM 425 CE LYS A 28 -7.497 6.457 0.732 1.00 35.33 C ATOM 426 NZ LYS A 28 -6.757 6.240 -0.544 1.00 33.31 N ATOM 0 H LYS A 28 -5.549 10.399 0.786 1.00 44.41 H new ATOM 0 HA LYS A 28 -5.931 10.104 -2.035 1.00 2.12 H new ATOM 0 HB2 LYS A 28 -8.260 9.312 -1.918 1.00 43.01 H new ATOM 0 HB3 LYS A 28 -7.097 8.087 -1.454 1.00 43.01 H new ATOM 0 HG2 LYS A 28 -8.531 9.759 0.623 1.00 14.22 H new ATOM 0 HG3 LYS A 28 -9.269 8.326 -0.065 1.00 14.22 H new ATOM 0 HD2 LYS A 28 -6.524 8.304 1.242 1.00 15.01 H new ATOM 0 HD3 LYS A 28 -8.004 8.006 2.132 1.00 15.01 H new ATOM 0 HE2 LYS A 28 -7.026 5.874 1.524 1.00 35.33 H new ATOM 0 HE3 LYS A 28 -8.515 6.083 0.624 1.00 35.33 H new ATOM 0 HZ1 LYS A 28 -6.361 5.278 -0.556 1.00 33.31 H new ATOM 0 HZ2 LYS A 28 -7.408 6.357 -1.347 1.00 33.31 H new ATOM 0 HZ3 LYS A 28 -5.985 6.933 -0.620 1.00 33.31 H new ATOM 440 N ASP A 29 -7.227 12.251 -1.870 1.00 41.53 N ATOM 441 CA ASP A 29 -7.834 13.583 -1.773 1.00 63.34 C ATOM 442 C ASP A 29 -6.927 14.513 -0.959 1.00 3.31 C ATOM 443 O ASP A 29 -7.312 15.620 -0.576 1.00 74.12 O ATOM 444 CB ASP A 29 -9.236 13.489 -1.144 1.00 51.24 C ATOM 445 CG ASP A 29 -10.096 14.717 -1.398 1.00 3.13 C ATOM 446 OD1 ASP A 29 -10.698 14.813 -2.493 1.00 13.05 O ATOM 447 OD2 ASP A 29 -10.189 15.582 -0.507 1.00 73.24 O ATOM 0 H ASP A 29 -6.948 11.990 -2.816 1.00 41.53 H new ATOM 0 HA ASP A 29 -7.943 13.999 -2.775 1.00 63.34 H new ATOM 0 HB2 ASP A 29 -9.745 12.610 -1.539 1.00 51.24 H new ATOM 0 HB3 ASP A 29 -9.134 13.342 -0.069 1.00 51.24 H new ATOM 452 N GLY A 30 -5.702 14.053 -0.716 1.00 65.11 N ATOM 453 CA GLY A 30 -4.750 14.815 0.066 1.00 42.32 C ATOM 454 C GLY A 30 -4.718 14.386 1.520 1.00 24.51 C ATOM 455 O GLY A 30 -3.907 14.883 2.302 1.00 64.33 O ATOM 0 H GLY A 30 -5.352 13.156 -1.052 1.00 65.11 H new ATOM 0 HA2 GLY A 30 -3.756 14.700 -0.365 1.00 42.32 H new ATOM 0 HA3 GLY A 30 -5.002 15.874 0.008 1.00 42.32 H new ATOM 459 N LYS A 31 -5.600 13.463 1.887 1.00 72.13 N ATOM 460 CA LYS A 31 -5.696 13.004 3.270 1.00 41.12 C ATOM 461 C LYS A 31 -5.123 11.607 3.425 1.00 65.32 C ATOM 462 O LYS A 31 -5.163 10.798 2.497 1.00 13.14 O ATOM 463 CB LYS A 31 -7.151 12.983 3.761 1.00 54.04 C ATOM 464 CG LYS A 31 -7.800 14.350 3.922 1.00 51.10 C ATOM 465 CD LYS A 31 -8.044 15.014 2.584 1.00 24.14 C ATOM 466 CE LYS A 31 -8.970 16.209 2.711 1.00 41.40 C ATOM 467 NZ LYS A 31 -9.128 16.925 1.419 1.00 44.52 N ATOM 0 H LYS A 31 -6.258 13.018 1.248 1.00 72.13 H new ATOM 0 HA LYS A 31 -5.121 13.711 3.869 1.00 41.12 H new ATOM 0 HB2 LYS A 31 -7.746 12.396 3.061 1.00 54.04 H new ATOM 0 HB3 LYS A 31 -7.187 12.466 4.720 1.00 54.04 H new ATOM 0 HG2 LYS A 31 -8.746 14.244 4.454 1.00 51.10 H new ATOM 0 HG3 LYS A 31 -7.161 14.987 4.533 1.00 51.10 H new ATOM 0 HD2 LYS A 31 -7.093 15.334 2.158 1.00 24.14 H new ATOM 0 HD3 LYS A 31 -8.476 14.291 1.892 1.00 24.14 H new ATOM 0 HE2 LYS A 31 -9.946 15.876 3.064 1.00 41.40 H new ATOM 0 HE3 LYS A 31 -8.577 16.895 3.461 1.00 41.40 H new ATOM 0 HZ1 LYS A 31 -9.420 17.907 1.600 1.00 44.52 H new ATOM 0 HZ2 LYS A 31 -8.223 16.922 0.907 1.00 44.52 H new ATOM 0 HZ3 LYS A 31 -9.852 16.448 0.844 1.00 44.52 H new ATOM 481 N VAL A 32 -4.613 11.326 4.609 1.00 42.43 N ATOM 482 CA VAL A 32 -4.132 9.996 4.943 1.00 63.44 C ATOM 483 C VAL A 32 -5.168 9.290 5.812 1.00 53.24 C ATOM 484 O VAL A 32 -5.409 9.685 6.953 1.00 71.10 O ATOM 485 CB VAL A 32 -2.778 10.038 5.683 1.00 32.31 C ATOM 486 CG1 VAL A 32 -2.252 8.630 5.919 1.00 4.32 C ATOM 487 CG2 VAL A 32 -1.768 10.867 4.905 1.00 35.35 C ATOM 0 H VAL A 32 -4.520 12.007 5.363 1.00 42.43 H new ATOM 0 HA VAL A 32 -3.981 9.451 4.011 1.00 63.44 H new ATOM 0 HB VAL A 32 -2.932 10.511 6.653 1.00 32.31 H new ATOM 0 HG11 VAL A 32 -1.297 8.681 6.442 1.00 4.32 H new ATOM 0 HG12 VAL A 32 -2.967 8.071 6.523 1.00 4.32 H new ATOM 0 HG13 VAL A 32 -2.115 8.128 4.961 1.00 4.32 H new ATOM 0 HG21 VAL A 32 -0.820 10.884 5.443 1.00 35.35 H new ATOM 0 HG22 VAL A 32 -1.618 10.426 3.919 1.00 35.35 H new ATOM 0 HG23 VAL A 32 -2.141 11.885 4.794 1.00 35.35 H new ATOM 497 N HIS A 33 -5.792 8.257 5.267 1.00 12.10 N ATOM 498 CA HIS A 33 -6.897 7.598 5.953 1.00 12.32 C ATOM 499 C HIS A 33 -6.411 6.391 6.753 1.00 44.05 C ATOM 500 O HIS A 33 -7.129 5.874 7.604 1.00 32.21 O ATOM 501 CB HIS A 33 -7.972 7.181 4.948 1.00 41.21 C ATOM 502 CG HIS A 33 -9.364 7.268 5.497 1.00 23.43 C ATOM 503 ND1 HIS A 33 -10.204 8.329 5.231 1.00 4.04 N ATOM 504 CD2 HIS A 33 -10.070 6.426 6.290 1.00 11.00 C ATOM 505 CE1 HIS A 33 -11.358 8.135 5.833 1.00 64.25 C ATOM 506 NE2 HIS A 33 -11.308 6.988 6.481 1.00 21.31 N ATOM 0 H HIS A 33 -5.556 7.858 4.359 1.00 12.10 H new ATOM 0 HA HIS A 33 -7.331 8.309 6.656 1.00 12.32 H new ATOM 0 HB2 HIS A 33 -7.898 7.814 4.064 1.00 41.21 H new ATOM 0 HB3 HIS A 33 -7.780 6.158 4.625 1.00 41.21 H new ATOM 0 HD2 HIS A 33 -9.723 5.487 6.696 1.00 11.00 H new ATOM 0 HE1 HIS A 33 -12.205 8.804 5.801 1.00 64.25 H new ATOM 0 HE2 HIS A 33 -12.065 6.584 7.033 1.00 21.31 H new ATOM 515 N TYR A 34 -5.199 5.945 6.455 1.00 63.53 N ATOM 516 CA TYR A 34 -4.564 4.844 7.174 1.00 14.33 C ATOM 517 C TYR A 34 -3.067 4.904 6.942 1.00 51.23 C ATOM 518 O TYR A 34 -2.623 5.252 5.847 1.00 71.24 O ATOM 519 CB TYR A 34 -5.108 3.491 6.717 1.00 61.30 C ATOM 520 CG TYR A 34 -5.623 2.620 7.845 1.00 33.13 C ATOM 521 CD1 TYR A 34 -6.931 2.738 8.301 1.00 55.11 C ATOM 522 CD2 TYR A 34 -4.807 1.671 8.443 1.00 45.34 C ATOM 523 CE1 TYR A 34 -7.408 1.935 9.320 1.00 2.41 C ATOM 524 CE2 TYR A 34 -5.279 0.861 9.459 1.00 21.32 C ATOM 525 CZ TYR A 34 -6.578 0.997 9.893 1.00 31.52 C ATOM 526 OH TYR A 34 -7.052 0.187 10.899 1.00 32.12 O ATOM 0 H TYR A 34 -4.625 6.335 5.707 1.00 63.53 H new ATOM 0 HA TYR A 34 -4.785 4.947 8.236 1.00 14.33 H new ATOM 0 HB2 TYR A 34 -5.915 3.658 6.003 1.00 61.30 H new ATOM 0 HB3 TYR A 34 -4.320 2.954 6.188 1.00 61.30 H new ATOM 0 HD1 TYR A 34 -7.586 3.470 7.851 1.00 55.11 H new ATOM 0 HD2 TYR A 34 -3.786 1.563 8.109 1.00 45.34 H new ATOM 0 HE1 TYR A 34 -8.426 2.043 9.665 1.00 2.41 H new ATOM 0 HE2 TYR A 34 -4.631 0.124 9.910 1.00 21.32 H new ATOM 0 HH TYR A 34 -6.341 -0.420 11.193 1.00 32.12 H new ATOM 536 N GLU A 35 -2.296 4.558 7.957 1.00 40.41 N ATOM 537 CA GLU A 35 -0.853 4.733 7.905 1.00 0.45 C ATOM 538 C GLU A 35 -0.135 3.767 8.845 1.00 1.02 C ATOM 539 O GLU A 35 -0.458 3.681 10.031 1.00 60.24 O ATOM 540 CB GLU A 35 -0.507 6.184 8.261 1.00 42.03 C ATOM 541 CG GLU A 35 -1.188 6.674 9.533 1.00 12.43 C ATOM 542 CD GLU A 35 -1.047 8.167 9.741 1.00 14.42 C ATOM 543 OE1 GLU A 35 -0.054 8.594 10.359 1.00 41.23 O ATOM 544 OE2 GLU A 35 -1.940 8.919 9.298 1.00 12.25 O ATOM 0 H GLU A 35 -2.643 4.154 8.827 1.00 40.41 H new ATOM 0 HA GLU A 35 -0.514 4.512 6.893 1.00 0.45 H new ATOM 0 HB2 GLU A 35 0.573 6.274 8.378 1.00 42.03 H new ATOM 0 HB3 GLU A 35 -0.793 6.832 7.432 1.00 42.03 H new ATOM 0 HG2 GLU A 35 -2.246 6.416 9.494 1.00 12.43 H new ATOM 0 HG3 GLU A 35 -0.764 6.151 10.390 1.00 12.43 H new ATOM 551 N ASP A 36 0.825 3.030 8.300 1.00 64.03 N ATOM 552 CA ASP A 36 1.667 2.145 9.100 1.00 4.53 C ATOM 553 C ASP A 36 3.001 1.935 8.395 1.00 71.11 C ATOM 554 O ASP A 36 3.042 1.725 7.182 1.00 54.32 O ATOM 555 CB ASP A 36 0.987 0.791 9.340 1.00 11.44 C ATOM 556 CG ASP A 36 1.626 0.022 10.484 1.00 1.54 C ATOM 557 OD1 ASP A 36 2.813 -0.352 10.380 1.00 34.30 O ATOM 558 OD2 ASP A 36 0.944 -0.195 11.511 1.00 21.22 O ATOM 0 H ASP A 36 1.041 3.027 7.303 1.00 64.03 H new ATOM 0 HA ASP A 36 1.831 2.615 10.070 1.00 4.53 H new ATOM 0 HB2 ASP A 36 -0.069 0.950 9.557 1.00 11.44 H new ATOM 0 HB3 ASP A 36 1.039 0.194 8.430 1.00 11.44 H new ATOM 563 N ALA A 37 4.085 2.010 9.150 1.00 33.52 N ATOM 564 CA ALA A 37 5.419 1.887 8.587 1.00 45.32 C ATOM 565 C ALA A 37 6.397 1.413 9.648 1.00 63.45 C ATOM 566 O ALA A 37 6.553 2.067 10.679 1.00 24.24 O ATOM 567 CB ALA A 37 5.867 3.226 8.018 1.00 52.41 C ATOM 0 H ALA A 37 4.066 2.156 10.159 1.00 33.52 H new ATOM 0 HA ALA A 37 5.396 1.151 7.783 1.00 45.32 H new ATOM 0 HB1 ALA A 37 6.868 3.126 7.598 1.00 52.41 H new ATOM 0 HB2 ALA A 37 5.175 3.539 7.236 1.00 52.41 H new ATOM 0 HB3 ALA A 37 5.880 3.973 8.812 1.00 52.41 H new ATOM 573 N ASP A 38 7.045 0.279 9.409 1.00 15.15 N ATOM 574 CA ASP A 38 8.025 -0.236 10.354 1.00 64.32 C ATOM 575 C ASP A 38 8.851 -1.341 9.723 1.00 44.22 C ATOM 576 O ASP A 38 8.486 -1.887 8.683 1.00 42.23 O ATOM 577 CB ASP A 38 7.329 -0.761 11.607 1.00 43.22 C ATOM 578 CG ASP A 38 8.136 -0.497 12.860 1.00 14.52 C ATOM 579 OD1 ASP A 38 8.575 0.657 13.060 1.00 31.23 O ATOM 580 OD2 ASP A 38 8.331 -1.441 13.654 1.00 0.10 O ATOM 0 H ASP A 38 6.911 -0.296 8.577 1.00 15.15 H new ATOM 0 HA ASP A 38 8.690 0.581 10.632 1.00 64.32 H new ATOM 0 HB2 ASP A 38 6.350 -0.291 11.701 1.00 43.22 H new ATOM 0 HB3 ASP A 38 7.159 -1.833 11.505 1.00 43.22 H new ATOM 585 N VAL A 39 9.965 -1.671 10.349 1.00 50.42 N ATOM 586 CA VAL A 39 10.854 -2.685 9.821 1.00 41.13 C ATOM 587 C VAL A 39 10.480 -4.067 10.330 1.00 25.54 C ATOM 588 O VAL A 39 10.001 -4.222 11.457 1.00 11.41 O ATOM 589 CB VAL A 39 12.321 -2.394 10.181 1.00 2.12 C ATOM 590 CG1 VAL A 39 12.789 -1.120 9.504 1.00 63.34 C ATOM 591 CG2 VAL A 39 12.509 -2.303 11.689 1.00 24.42 C ATOM 0 H VAL A 39 10.275 -1.250 11.225 1.00 50.42 H new ATOM 0 HA VAL A 39 10.745 -2.662 8.737 1.00 41.13 H new ATOM 0 HB VAL A 39 12.929 -3.223 9.819 1.00 2.12 H new ATOM 0 HG11 VAL A 39 13.829 -0.928 9.769 1.00 63.34 H new ATOM 0 HG12 VAL A 39 12.704 -1.230 8.423 1.00 63.34 H new ATOM 0 HG13 VAL A 39 12.171 -0.285 9.833 1.00 63.34 H new ATOM 0 HG21 VAL A 39 13.555 -2.097 11.913 1.00 24.42 H new ATOM 0 HG22 VAL A 39 11.888 -1.500 12.085 1.00 24.42 H new ATOM 0 HG23 VAL A 39 12.219 -3.247 12.150 1.00 24.42 H new ATOM 601 N GLY A 40 10.682 -5.065 9.486 1.00 23.33 N ATOM 602 CA GLY A 40 10.445 -6.432 9.886 1.00 64.42 C ATOM 603 C GLY A 40 8.984 -6.823 9.818 1.00 43.13 C ATOM 604 O GLY A 40 8.157 -6.320 10.584 1.00 63.43 O ATOM 0 H GLY A 40 11.008 -4.950 8.526 1.00 23.33 H new ATOM 0 HA2 GLY A 40 11.024 -7.098 9.246 1.00 64.42 H new ATOM 0 HA3 GLY A 40 10.807 -6.575 10.904 1.00 64.42 H new ATOM 608 N LYS A 41 8.660 -7.708 8.889 1.00 1.54 N ATOM 609 CA LYS A 41 7.345 -8.300 8.830 1.00 44.03 C ATOM 610 C LYS A 41 7.376 -9.587 9.629 1.00 14.24 C ATOM 611 O LYS A 41 8.436 -10.013 10.086 1.00 2.51 O ATOM 612 CB LYS A 41 6.930 -8.583 7.381 1.00 52.24 C ATOM 613 CG LYS A 41 7.987 -9.337 6.591 1.00 13.20 C ATOM 614 CD LYS A 41 7.388 -10.422 5.704 1.00 41.50 C ATOM 615 CE LYS A 41 6.480 -9.853 4.627 1.00 40.14 C ATOM 616 NZ LYS A 41 5.973 -10.920 3.724 1.00 3.04 N ATOM 0 H LYS A 41 9.300 -8.030 8.163 1.00 1.54 H new ATOM 0 HA LYS A 41 6.613 -7.609 9.247 1.00 44.03 H new ATOM 0 HB2 LYS A 41 6.005 -9.160 7.381 1.00 52.24 H new ATOM 0 HB3 LYS A 41 6.716 -7.639 6.880 1.00 52.24 H new ATOM 0 HG2 LYS A 41 8.545 -8.634 5.973 1.00 13.20 H new ATOM 0 HG3 LYS A 41 8.699 -9.789 7.282 1.00 13.20 H new ATOM 0 HD2 LYS A 41 8.192 -10.989 5.235 1.00 41.50 H new ATOM 0 HD3 LYS A 41 6.822 -11.121 6.321 1.00 41.50 H new ATOM 0 HE2 LYS A 41 5.639 -9.339 5.092 1.00 40.14 H new ATOM 0 HE3 LYS A 41 7.025 -9.110 4.045 1.00 40.14 H new ATOM 0 HZ1 LYS A 41 5.356 -10.498 3.000 1.00 3.04 H new ATOM 0 HZ2 LYS A 41 6.775 -11.394 3.262 1.00 3.04 H new ATOM 0 HZ3 LYS A 41 5.432 -11.615 4.277 1.00 3.04 H new ATOM 630 N ASN A 42 6.234 -10.210 9.784 1.00 21.31 N ATOM 631 CA ASN A 42 6.133 -11.422 10.590 1.00 53.43 C ATOM 632 C ASN A 42 5.139 -12.391 9.973 1.00 71.21 C ATOM 633 O ASN A 42 4.134 -11.973 9.402 1.00 14.32 O ATOM 634 CB ASN A 42 5.696 -11.089 12.025 1.00 21.52 C ATOM 635 CG ASN A 42 6.714 -10.258 12.783 1.00 34.21 C ATOM 636 OD1 ASN A 42 7.628 -10.796 13.408 1.00 64.24 O ATOM 637 ND2 ASN A 42 6.557 -8.942 12.747 1.00 44.21 N ATOM 0 H ASN A 42 5.355 -9.905 9.366 1.00 21.31 H new ATOM 0 HA ASN A 42 7.119 -11.886 10.618 1.00 53.43 H new ATOM 0 HB2 ASN A 42 4.749 -10.551 11.994 1.00 21.52 H new ATOM 0 HB3 ASN A 42 5.518 -12.017 12.568 1.00 21.52 H new ATOM 0 HD21 ASN A 42 7.207 -8.337 13.249 1.00 44.21 H new ATOM 0 HD22 ASN A 42 5.786 -8.535 12.217 1.00 44.21 H new ATOM 644 N PRO A 43 5.408 -13.702 10.074 1.00 24.45 N ATOM 645 CA PRO A 43 4.475 -14.745 9.627 1.00 54.23 C ATOM 646 C PRO A 43 3.202 -14.755 10.472 1.00 22.23 C ATOM 647 O PRO A 43 2.180 -15.319 10.082 1.00 61.55 O ATOM 648 CB PRO A 43 5.259 -16.050 9.823 1.00 52.11 C ATOM 649 CG PRO A 43 6.685 -15.632 9.950 1.00 11.13 C ATOM 650 CD PRO A 43 6.654 -14.279 10.599 1.00 13.11 C ATOM 0 HA PRO A 43 4.148 -14.592 8.598 1.00 54.23 H new ATOM 0 HB2 PRO A 43 4.923 -16.581 10.713 1.00 52.11 H new ATOM 0 HB3 PRO A 43 5.120 -16.724 8.978 1.00 52.11 H new ATOM 0 HG2 PRO A 43 7.249 -16.343 10.553 1.00 11.13 H new ATOM 0 HG3 PRO A 43 7.169 -15.587 8.974 1.00 11.13 H new ATOM 0 HD2 PRO A 43 6.641 -14.351 11.687 1.00 13.11 H new ATOM 0 HD3 PRO A 43 7.524 -13.680 10.330 1.00 13.11 H new ATOM 658 N ALA A 44 3.276 -14.098 11.629 1.00 63.33 N ATOM 659 CA ALA A 44 2.134 -13.968 12.528 1.00 52.23 C ATOM 660 C ALA A 44 1.064 -13.057 11.929 1.00 64.40 C ATOM 661 O ALA A 44 -0.038 -12.932 12.470 1.00 41.55 O ATOM 662 CB ALA A 44 2.589 -13.437 13.879 1.00 73.44 C ATOM 0 H ALA A 44 4.125 -13.644 11.966 1.00 63.33 H new ATOM 0 HA ALA A 44 1.694 -14.956 12.667 1.00 52.23 H new ATOM 0 HB1 ALA A 44 1.729 -13.344 14.542 1.00 73.44 H new ATOM 0 HB2 ALA A 44 3.311 -14.126 14.316 1.00 73.44 H new ATOM 0 HB3 ALA A 44 3.054 -12.460 13.748 1.00 73.44 H new ATOM 668 N ALA A 45 1.396 -12.427 10.806 1.00 71.05 N ATOM 669 CA ALA A 45 0.455 -11.583 10.085 1.00 73.00 C ATOM 670 C ALA A 45 -0.762 -12.388 9.654 1.00 63.01 C ATOM 671 O ALA A 45 -1.889 -11.898 9.689 1.00 73.42 O ATOM 672 CB ALA A 45 1.131 -10.956 8.875 1.00 50.21 C ATOM 0 H ALA A 45 2.318 -12.488 10.375 1.00 71.05 H new ATOM 0 HA ALA A 45 0.122 -10.787 10.751 1.00 73.00 H new ATOM 0 HB1 ALA A 45 0.416 -10.327 8.344 1.00 50.21 H new ATOM 0 HB2 ALA A 45 1.975 -10.349 9.203 1.00 50.21 H new ATOM 0 HB3 ALA A 45 1.487 -11.742 8.209 1.00 50.21 H new ATOM 678 N ALA A 46 -0.525 -13.635 9.270 1.00 12.32 N ATOM 679 CA ALA A 46 -1.595 -14.515 8.831 1.00 61.22 C ATOM 680 C ALA A 46 -2.375 -15.052 10.025 1.00 72.01 C ATOM 681 O ALA A 46 -3.562 -15.363 9.913 1.00 42.22 O ATOM 682 CB ALA A 46 -1.028 -15.659 8.006 1.00 42.31 C ATOM 0 H ALA A 46 0.402 -14.059 9.254 1.00 12.32 H new ATOM 0 HA ALA A 46 -2.281 -13.942 8.208 1.00 61.22 H new ATOM 0 HB1 ALA A 46 -1.839 -16.311 7.683 1.00 42.31 H new ATOM 0 HB2 ALA A 46 -0.515 -15.258 7.132 1.00 42.31 H new ATOM 0 HB3 ALA A 46 -0.323 -16.229 8.611 1.00 42.31 H new ATOM 688 N THR A 47 -1.706 -15.135 11.170 1.00 11.22 N ATOM 689 CA THR A 47 -2.320 -15.654 12.381 1.00 1.33 C ATOM 690 C THR A 47 -3.448 -14.738 12.849 1.00 75.33 C ATOM 691 O THR A 47 -4.545 -15.198 13.171 1.00 42.42 O ATOM 692 CB THR A 47 -1.281 -15.799 13.511 1.00 53.53 C ATOM 693 OG1 THR A 47 -0.098 -16.435 13.007 1.00 44.22 O ATOM 694 CG2 THR A 47 -1.843 -16.619 14.663 1.00 11.45 C ATOM 0 H THR A 47 -0.734 -14.847 11.282 1.00 11.22 H new ATOM 0 HA THR A 47 -2.727 -16.637 12.146 1.00 1.33 H new ATOM 0 HB THR A 47 -1.036 -14.802 13.878 1.00 53.53 H new ATOM 0 HG1 THR A 47 0.559 -16.523 13.729 1.00 44.22 H new ATOM 0 HG21 THR A 47 -1.091 -16.707 15.448 1.00 11.45 H new ATOM 0 HG22 THR A 47 -2.729 -16.125 15.063 1.00 11.45 H new ATOM 0 HG23 THR A 47 -2.112 -17.613 14.305 1.00 11.45 H new ATOM 702 N MET A 48 -3.178 -13.437 12.867 1.00 34.41 N ATOM 703 CA MET A 48 -4.170 -12.463 13.299 1.00 32.22 C ATOM 704 C MET A 48 -4.892 -11.870 12.092 1.00 42.22 C ATOM 705 O MET A 48 -5.971 -12.328 11.724 1.00 63.32 O ATOM 706 CB MET A 48 -3.515 -11.355 14.130 1.00 14.10 C ATOM 707 CG MET A 48 -4.510 -10.414 14.793 1.00 51.15 C ATOM 708 SD MET A 48 -3.708 -9.136 15.781 1.00 61.34 S ATOM 709 CE MET A 48 -2.825 -10.133 16.983 1.00 12.01 C ATOM 0 H MET A 48 -2.283 -13.035 12.588 1.00 34.41 H new ATOM 0 HA MET A 48 -4.902 -12.972 13.926 1.00 32.22 H new ATOM 0 HB2 MET A 48 -2.892 -11.811 14.900 1.00 14.10 H new ATOM 0 HB3 MET A 48 -2.853 -10.775 13.487 1.00 14.10 H new ATOM 0 HG2 MET A 48 -5.124 -9.942 14.026 1.00 51.15 H new ATOM 0 HG3 MET A 48 -5.181 -10.991 15.429 1.00 51.15 H new ATOM 0 HE1 MET A 48 -2.581 -9.523 17.853 1.00 12.01 H new ATOM 0 HE2 MET A 48 -3.451 -10.970 17.292 1.00 12.01 H new ATOM 0 HE3 MET A 48 -1.906 -10.513 16.536 1.00 12.01 H new ATOM 719 N ARG A 49 -4.279 -10.872 11.460 1.00 5.43 N ATOM 720 CA ARG A 49 -4.853 -10.247 10.273 1.00 62.42 C ATOM 721 C ARG A 49 -3.823 -9.356 9.580 1.00 14.22 C ATOM 722 O ARG A 49 -3.597 -9.486 8.377 1.00 43.00 O ATOM 723 CB ARG A 49 -6.114 -9.429 10.622 1.00 21.31 C ATOM 724 CG ARG A 49 -5.870 -8.272 11.584 1.00 60.02 C ATOM 725 CD ARG A 49 -7.103 -7.401 11.745 1.00 11.44 C ATOM 726 NE ARG A 49 -6.837 -6.239 12.590 1.00 54.52 N ATOM 727 CZ ARG A 49 -7.614 -5.867 13.605 1.00 32.53 C ATOM 728 NH1 ARG A 49 -8.755 -6.504 13.840 1.00 61.14 N ATOM 729 NH2 ARG A 49 -7.273 -4.835 14.362 1.00 41.51 N ATOM 0 H ARG A 49 -3.384 -10.479 11.751 1.00 5.43 H new ATOM 0 HA ARG A 49 -5.145 -11.045 9.590 1.00 62.42 H new ATOM 0 HB2 ARG A 49 -6.543 -9.035 9.701 1.00 21.31 H new ATOM 0 HB3 ARG A 49 -6.856 -10.097 11.058 1.00 21.31 H new ATOM 0 HG2 ARG A 49 -5.573 -8.665 12.557 1.00 60.02 H new ATOM 0 HG3 ARG A 49 -5.042 -7.665 11.219 1.00 60.02 H new ATOM 0 HD2 ARG A 49 -7.444 -7.068 10.765 1.00 11.44 H new ATOM 0 HD3 ARG A 49 -7.910 -7.990 12.180 1.00 11.44 H new ATOM 0 HE ARG A 49 -6.007 -5.680 12.391 1.00 54.52 H new ATOM 0 HH11 ARG A 49 -9.038 -7.280 13.242 1.00 61.14 H new ATOM 0 HH12 ARG A 49 -9.348 -6.217 14.618 1.00 61.14 H new ATOM 0 HH21 ARG A 49 -6.413 -4.322 14.168 1.00 41.51 H new ATOM 0 HH22 ARG A 49 -7.871 -4.553 15.139 1.00 41.51 H new ATOM 743 N ASN A 50 -3.202 -8.468 10.362 1.00 32.03 N ATOM 744 CA ASN A 50 -2.230 -7.483 9.873 1.00 64.25 C ATOM 745 C ASN A 50 -2.759 -6.694 8.684 1.00 41.22 C ATOM 746 O ASN A 50 -3.394 -5.659 8.857 1.00 2.35 O ATOM 747 CB ASN A 50 -0.898 -8.148 9.522 1.00 65.01 C ATOM 748 CG ASN A 50 0.143 -8.009 10.621 1.00 71.21 C ATOM 749 OD1 ASN A 50 1.337 -7.905 10.344 1.00 2.35 O ATOM 750 ND2 ASN A 50 -0.291 -7.999 11.874 1.00 53.24 N ATOM 0 H ASN A 50 -3.362 -8.412 11.368 1.00 32.03 H new ATOM 0 HA ASN A 50 -2.063 -6.777 10.687 1.00 64.25 H new ATOM 0 HB2 ASN A 50 -1.068 -9.206 9.322 1.00 65.01 H new ATOM 0 HB3 ASN A 50 -0.510 -7.708 8.603 1.00 65.01 H new ATOM 0 HD21 ASN A 50 0.372 -7.903 12.643 1.00 53.24 H new ATOM 0 HD22 ASN A 50 -1.288 -8.087 12.069 1.00 53.24 H new ATOM 757 N VAL A 51 -2.561 -7.224 7.486 1.00 54.31 N ATOM 758 CA VAL A 51 -2.950 -6.531 6.270 1.00 44.03 C ATOM 759 C VAL A 51 -4.467 -6.391 6.194 1.00 5.14 C ATOM 760 O VAL A 51 -4.977 -5.351 5.793 1.00 23.12 O ATOM 761 CB VAL A 51 -2.431 -7.265 5.013 1.00 65.13 C ATOM 762 CG1 VAL A 51 -2.708 -6.459 3.754 1.00 74.42 C ATOM 763 CG2 VAL A 51 -0.944 -7.560 5.141 1.00 4.43 C ATOM 0 H VAL A 51 -2.131 -8.136 7.331 1.00 54.31 H new ATOM 0 HA VAL A 51 -2.499 -5.539 6.300 1.00 44.03 H new ATOM 0 HB VAL A 51 -2.967 -8.211 4.932 1.00 65.13 H new ATOM 0 HG11 VAL A 51 -2.332 -7.000 2.886 1.00 74.42 H new ATOM 0 HG12 VAL A 51 -3.782 -6.306 3.649 1.00 74.42 H new ATOM 0 HG13 VAL A 51 -2.209 -5.493 3.824 1.00 74.42 H new ATOM 0 HG21 VAL A 51 -0.597 -8.077 4.246 1.00 4.43 H new ATOM 0 HG22 VAL A 51 -0.396 -6.625 5.255 1.00 4.43 H new ATOM 0 HG23 VAL A 51 -0.772 -8.190 6.014 1.00 4.43 H new ATOM 773 N ALA A 52 -5.174 -7.432 6.630 1.00 31.44 N ATOM 774 CA ALA A 52 -6.636 -7.475 6.545 1.00 73.51 C ATOM 775 C ALA A 52 -7.290 -6.276 7.230 1.00 61.23 C ATOM 776 O ALA A 52 -8.320 -5.778 6.772 1.00 41.44 O ATOM 777 CB ALA A 52 -7.156 -8.770 7.144 1.00 32.30 C ATOM 0 H ALA A 52 -4.756 -8.263 7.049 1.00 31.44 H new ATOM 0 HA ALA A 52 -6.903 -7.430 5.489 1.00 73.51 H new ATOM 0 HB1 ALA A 52 -8.244 -8.792 7.076 1.00 32.30 H new ATOM 0 HB2 ALA A 52 -6.741 -9.616 6.597 1.00 32.30 H new ATOM 0 HB3 ALA A 52 -6.857 -8.833 8.190 1.00 32.30 H new ATOM 783 N GLY A 53 -6.689 -5.815 8.321 1.00 11.35 N ATOM 784 CA GLY A 53 -7.231 -4.679 9.042 1.00 33.43 C ATOM 785 C GLY A 53 -7.004 -3.380 8.302 1.00 45.13 C ATOM 786 O GLY A 53 -7.929 -2.587 8.113 1.00 35.30 O ATOM 0 H GLY A 53 -5.836 -6.208 8.719 1.00 11.35 H new ATOM 0 HA2 GLY A 53 -8.300 -4.825 9.199 1.00 33.43 H new ATOM 0 HA3 GLY A 53 -6.769 -4.621 10.028 1.00 33.43 H new ATOM 790 N GLU A 54 -5.771 -3.179 7.856 1.00 24.42 N ATOM 791 CA GLU A 54 -5.388 -1.962 7.156 1.00 14.44 C ATOM 792 C GLU A 54 -6.076 -1.871 5.789 1.00 62.22 C ATOM 793 O GLU A 54 -6.304 -0.774 5.270 1.00 54.13 O ATOM 794 CB GLU A 54 -3.864 -1.899 7.004 1.00 61.30 C ATOM 795 CG GLU A 54 -3.122 -1.460 8.268 1.00 32.04 C ATOM 796 CD GLU A 54 -3.224 -2.442 9.428 1.00 64.01 C ATOM 797 OE1 GLU A 54 -4.262 -2.452 10.128 1.00 21.25 O ATOM 798 OE2 GLU A 54 -2.250 -3.185 9.665 1.00 42.42 O ATOM 0 H GLU A 54 -5.012 -3.852 7.969 1.00 24.42 H new ATOM 0 HA GLU A 54 -5.716 -1.108 7.748 1.00 14.44 H new ATOM 0 HB2 GLU A 54 -3.500 -2.882 6.706 1.00 61.30 H new ATOM 0 HB3 GLU A 54 -3.620 -1.210 6.196 1.00 61.30 H new ATOM 0 HG2 GLU A 54 -2.070 -1.312 8.024 1.00 32.04 H new ATOM 0 HG3 GLU A 54 -3.514 -0.495 8.589 1.00 32.04 H new ATOM 805 N ILE A 55 -6.415 -3.032 5.226 1.00 2.34 N ATOM 806 CA ILE A 55 -7.144 -3.110 3.960 1.00 13.43 C ATOM 807 C ILE A 55 -8.453 -2.319 4.010 1.00 4.21 C ATOM 808 O ILE A 55 -8.893 -1.792 2.993 1.00 11.34 O ATOM 809 CB ILE A 55 -7.436 -4.585 3.566 1.00 31.55 C ATOM 810 CG1 ILE A 55 -6.157 -5.275 3.087 1.00 54.55 C ATOM 811 CG2 ILE A 55 -8.521 -4.683 2.498 1.00 11.44 C ATOM 812 CD1 ILE A 55 -5.520 -4.613 1.884 1.00 0.22 C ATOM 0 H ILE A 55 -6.193 -3.941 5.633 1.00 2.34 H new ATOM 0 HA ILE A 55 -6.502 -2.664 3.201 1.00 13.43 H new ATOM 0 HB ILE A 55 -7.803 -5.094 4.457 1.00 31.55 H new ATOM 0 HG12 ILE A 55 -5.436 -5.292 3.905 1.00 54.55 H new ATOM 0 HG13 ILE A 55 -6.385 -6.312 2.841 1.00 54.55 H new ATOM 0 HG21 ILE A 55 -8.695 -5.730 2.251 1.00 11.44 H new ATOM 0 HG22 ILE A 55 -9.443 -4.241 2.875 1.00 11.44 H new ATOM 0 HG23 ILE A 55 -8.201 -4.148 1.604 1.00 11.44 H new ATOM 0 HD11 ILE A 55 -4.619 -5.158 1.603 1.00 0.22 H new ATOM 0 HD12 ILE A 55 -6.223 -4.620 1.051 1.00 0.22 H new ATOM 0 HD13 ILE A 55 -5.259 -3.584 2.131 1.00 0.22 H new ATOM 824 N ALA A 56 -9.054 -2.222 5.196 1.00 22.41 N ATOM 825 CA ALA A 56 -10.343 -1.546 5.364 1.00 34.23 C ATOM 826 C ALA A 56 -10.359 -0.166 4.703 1.00 51.10 C ATOM 827 O ALA A 56 -11.301 0.176 3.986 1.00 51.11 O ATOM 828 CB ALA A 56 -10.686 -1.424 6.842 1.00 51.21 C ATOM 0 H ALA A 56 -8.668 -2.605 6.059 1.00 22.41 H new ATOM 0 HA ALA A 56 -11.097 -2.156 4.867 1.00 34.23 H new ATOM 0 HB1 ALA A 56 -11.646 -0.920 6.952 1.00 51.21 H new ATOM 0 HB2 ALA A 56 -10.745 -2.418 7.285 1.00 51.21 H new ATOM 0 HB3 ALA A 56 -9.913 -0.846 7.349 1.00 51.21 H new ATOM 834 N ALA A 57 -9.303 0.609 4.919 1.00 4.33 N ATOM 835 CA ALA A 57 -9.229 1.963 4.380 1.00 54.51 C ATOM 836 C ALA A 57 -9.101 1.955 2.860 1.00 35.53 C ATOM 837 O ALA A 57 -9.608 2.846 2.179 1.00 64.24 O ATOM 838 CB ALA A 57 -8.061 2.711 4.995 1.00 41.42 C ATOM 0 H ALA A 57 -8.488 0.325 5.462 1.00 4.33 H new ATOM 0 HA ALA A 57 -10.158 2.472 4.637 1.00 54.51 H new ATOM 0 HB1 ALA A 57 -8.018 3.720 4.584 1.00 41.42 H new ATOM 0 HB2 ALA A 57 -8.192 2.765 6.076 1.00 41.42 H new ATOM 0 HB3 ALA A 57 -7.133 2.187 4.768 1.00 41.42 H new ATOM 844 N ALA A 58 -8.416 0.949 2.337 1.00 14.10 N ATOM 845 CA ALA A 58 -8.228 0.817 0.900 1.00 22.14 C ATOM 846 C ALA A 58 -9.492 0.277 0.242 1.00 41.44 C ATOM 847 O ALA A 58 -9.888 0.737 -0.828 1.00 12.30 O ATOM 848 CB ALA A 58 -7.043 -0.092 0.602 1.00 20.00 C ATOM 0 H ALA A 58 -7.980 0.210 2.888 1.00 14.10 H new ATOM 0 HA ALA A 58 -8.021 1.804 0.487 1.00 22.14 H new ATOM 0 HB1 ALA A 58 -6.915 -0.181 -0.477 1.00 20.00 H new ATOM 0 HB2 ALA A 58 -6.140 0.332 1.041 1.00 20.00 H new ATOM 0 HB3 ALA A 58 -7.225 -1.079 1.028 1.00 20.00 H new ATOM 854 N LEU A 59 -10.130 -0.681 0.906 1.00 61.44 N ATOM 855 CA LEU A 59 -11.314 -1.350 0.380 1.00 71.14 C ATOM 856 C LEU A 59 -12.440 -0.352 0.125 1.00 2.22 C ATOM 857 O LEU A 59 -13.013 -0.315 -0.964 1.00 53.44 O ATOM 858 CB LEU A 59 -11.762 -2.446 1.359 1.00 73.30 C ATOM 859 CG LEU A 59 -12.965 -3.291 0.924 1.00 24.23 C ATOM 860 CD1 LEU A 59 -12.844 -4.702 1.478 1.00 33.45 C ATOM 861 CD2 LEU A 59 -14.264 -2.660 1.403 1.00 63.01 C ATOM 0 H LEU A 59 -9.840 -1.016 1.825 1.00 61.44 H new ATOM 0 HA LEU A 59 -11.064 -1.810 -0.576 1.00 71.14 H new ATOM 0 HB2 LEU A 59 -10.919 -3.114 1.534 1.00 73.30 H new ATOM 0 HB3 LEU A 59 -12.000 -1.976 2.313 1.00 73.30 H new ATOM 0 HG LEU A 59 -12.977 -3.334 -0.165 1.00 24.23 H new ATOM 0 HD11 LEU A 59 -13.704 -5.292 1.162 1.00 33.45 H new ATOM 0 HD12 LEU A 59 -11.930 -5.163 1.103 1.00 33.45 H new ATOM 0 HD13 LEU A 59 -12.810 -4.664 2.567 1.00 33.45 H new ATOM 0 HD21 LEU A 59 -15.106 -3.274 1.084 1.00 63.01 H new ATOM 0 HD22 LEU A 59 -14.256 -2.592 2.491 1.00 63.01 H new ATOM 0 HD23 LEU A 59 -14.362 -1.661 0.977 1.00 63.01 H new ATOM 873 N TYR A 60 -12.750 0.463 1.125 1.00 44.14 N ATOM 874 CA TYR A 60 -13.801 1.461 0.980 1.00 62.53 C ATOM 875 C TYR A 60 -13.375 2.546 0.005 1.00 61.25 C ATOM 876 O TYR A 60 -14.210 3.144 -0.662 1.00 10.22 O ATOM 877 CB TYR A 60 -14.170 2.074 2.334 1.00 53.30 C ATOM 878 CG TYR A 60 -14.822 1.091 3.284 1.00 72.23 C ATOM 879 CD1 TYR A 60 -15.988 0.426 2.928 1.00 60.32 C ATOM 880 CD2 TYR A 60 -14.268 0.823 4.529 1.00 51.21 C ATOM 881 CE1 TYR A 60 -16.582 -0.480 3.785 1.00 42.21 C ATOM 882 CE2 TYR A 60 -14.854 -0.084 5.392 1.00 24.20 C ATOM 883 CZ TYR A 60 -16.011 -0.731 5.016 1.00 0.01 C ATOM 884 OH TYR A 60 -16.596 -1.641 5.868 1.00 34.43 O ATOM 0 H TYR A 60 -12.293 0.453 2.037 1.00 44.14 H new ATOM 0 HA TYR A 60 -14.685 0.962 0.583 1.00 62.53 H new ATOM 0 HB2 TYR A 60 -13.270 2.475 2.800 1.00 53.30 H new ATOM 0 HB3 TYR A 60 -14.846 2.914 2.172 1.00 53.30 H new ATOM 0 HD1 TYR A 60 -16.438 0.620 1.965 1.00 60.32 H new ATOM 0 HD2 TYR A 60 -13.364 1.332 4.828 1.00 51.21 H new ATOM 0 HE1 TYR A 60 -17.489 -0.989 3.493 1.00 42.21 H new ATOM 0 HE2 TYR A 60 -14.408 -0.284 6.355 1.00 24.20 H new ATOM 0 HH TYR A 60 -16.070 -1.703 6.692 1.00 34.43 H new ATOM 894 N ALA A 61 -12.074 2.781 -0.091 1.00 1.14 N ATOM 895 CA ALA A 61 -11.547 3.754 -1.035 1.00 4.33 C ATOM 896 C ALA A 61 -11.797 3.298 -2.467 1.00 22.04 C ATOM 897 O ALA A 61 -12.090 4.114 -3.339 1.00 45.33 O ATOM 898 CB ALA A 61 -10.065 3.987 -0.797 1.00 43.35 C ATOM 0 H ALA A 61 -11.365 2.311 0.473 1.00 1.14 H new ATOM 0 HA ALA A 61 -12.068 4.699 -0.879 1.00 4.33 H new ATOM 0 HB1 ALA A 61 -9.692 4.718 -1.514 1.00 43.35 H new ATOM 0 HB2 ALA A 61 -9.914 4.362 0.215 1.00 43.35 H new ATOM 0 HB3 ALA A 61 -9.525 3.049 -0.921 1.00 43.35 H new ATOM 904 N VAL A 62 -11.688 1.989 -2.701 1.00 75.24 N ATOM 905 CA VAL A 62 -12.016 1.415 -4.003 1.00 32.50 C ATOM 906 C VAL A 62 -13.478 1.684 -4.323 1.00 71.21 C ATOM 907 O VAL A 62 -13.828 2.095 -5.427 1.00 24.33 O ATOM 908 CB VAL A 62 -11.788 -0.117 -4.040 1.00 60.04 C ATOM 909 CG1 VAL A 62 -12.020 -0.665 -5.442 1.00 3.22 C ATOM 910 CG2 VAL A 62 -10.397 -0.483 -3.555 1.00 30.41 C ATOM 0 H VAL A 62 -11.376 1.310 -2.007 1.00 75.24 H new ATOM 0 HA VAL A 62 -11.358 1.882 -4.736 1.00 32.50 H new ATOM 0 HB VAL A 62 -12.511 -0.572 -3.363 1.00 60.04 H new ATOM 0 HG11 VAL A 62 -11.854 -1.742 -5.444 1.00 3.22 H new ATOM 0 HG12 VAL A 62 -13.044 -0.455 -5.750 1.00 3.22 H new ATOM 0 HG13 VAL A 62 -11.328 -0.190 -6.137 1.00 3.22 H new ATOM 0 HG21 VAL A 62 -10.271 -1.565 -3.594 1.00 30.41 H new ATOM 0 HG22 VAL A 62 -9.652 -0.008 -4.193 1.00 30.41 H new ATOM 0 HG23 VAL A 62 -10.267 -0.139 -2.529 1.00 30.41 H new ATOM 920 N LYS A 63 -14.320 1.461 -3.328 1.00 44.34 N ATOM 921 CA LYS A 63 -15.755 1.632 -3.467 1.00 51.24 C ATOM 922 C LYS A 63 -16.122 3.099 -3.676 1.00 33.23 C ATOM 923 O LYS A 63 -16.944 3.427 -4.532 1.00 71.45 O ATOM 924 CB LYS A 63 -16.447 1.077 -2.227 1.00 74.50 C ATOM 925 CG LYS A 63 -16.221 -0.412 -2.042 1.00 61.10 C ATOM 926 CD LYS A 63 -17.163 -0.990 -1.006 1.00 4.41 C ATOM 927 CE LYS A 63 -17.030 -2.502 -0.915 1.00 75.20 C ATOM 928 NZ LYS A 63 -18.215 -3.120 -0.268 1.00 23.50 N ATOM 0 H LYS A 63 -14.027 1.156 -2.400 1.00 44.34 H new ATOM 0 HA LYS A 63 -16.091 1.085 -4.348 1.00 51.24 H new ATOM 0 HB2 LYS A 63 -16.084 1.607 -1.346 1.00 74.50 H new ATOM 0 HB3 LYS A 63 -17.517 1.271 -2.297 1.00 74.50 H new ATOM 0 HG2 LYS A 63 -16.365 -0.924 -2.993 1.00 61.10 H new ATOM 0 HG3 LYS A 63 -15.190 -0.590 -1.738 1.00 61.10 H new ATOM 0 HD2 LYS A 63 -16.953 -0.546 -0.033 1.00 4.41 H new ATOM 0 HD3 LYS A 63 -18.190 -0.729 -1.260 1.00 4.41 H new ATOM 0 HE2 LYS A 63 -16.904 -2.917 -1.915 1.00 75.20 H new ATOM 0 HE3 LYS A 63 -16.133 -2.755 -0.349 1.00 75.20 H new ATOM 0 HZ1 LYS A 63 -18.088 -4.151 -0.224 1.00 23.50 H new ATOM 0 HZ2 LYS A 63 -18.321 -2.743 0.695 1.00 23.50 H new ATOM 0 HZ3 LYS A 63 -19.067 -2.900 -0.822 1.00 23.50 H new ATOM 942 N LYS A 64 -15.501 3.975 -2.897 1.00 61.14 N ATOM 943 CA LYS A 64 -15.735 5.413 -3.015 1.00 24.52 C ATOM 944 C LYS A 64 -15.320 5.925 -4.391 1.00 32.11 C ATOM 945 O LYS A 64 -16.020 6.732 -4.997 1.00 55.14 O ATOM 946 CB LYS A 64 -14.989 6.172 -1.911 1.00 2.31 C ATOM 947 CG LYS A 64 -15.531 5.888 -0.516 1.00 72.24 C ATOM 948 CD LYS A 64 -14.684 6.529 0.576 1.00 30.25 C ATOM 949 CE LYS A 64 -14.666 8.044 0.460 1.00 61.25 C ATOM 950 NZ LYS A 64 -14.011 8.680 1.633 1.00 74.42 N ATOM 0 H LYS A 64 -14.829 3.717 -2.174 1.00 61.14 H new ATOM 0 HA LYS A 64 -16.804 5.591 -2.897 1.00 24.52 H new ATOM 0 HB2 LYS A 64 -13.933 5.904 -1.945 1.00 2.31 H new ATOM 0 HB3 LYS A 64 -15.053 7.242 -2.108 1.00 2.31 H new ATOM 0 HG2 LYS A 64 -16.554 6.258 -0.444 1.00 72.24 H new ATOM 0 HG3 LYS A 64 -15.570 4.810 -0.357 1.00 72.24 H new ATOM 0 HD2 LYS A 64 -15.074 6.244 1.553 1.00 30.25 H new ATOM 0 HD3 LYS A 64 -13.665 6.148 0.516 1.00 30.25 H new ATOM 0 HE2 LYS A 64 -14.141 8.333 -0.450 1.00 61.25 H new ATOM 0 HE3 LYS A 64 -15.687 8.414 0.369 1.00 61.25 H new ATOM 0 HZ1 LYS A 64 -14.034 9.714 1.525 1.00 74.42 H new ATOM 0 HZ2 LYS A 64 -14.517 8.412 2.501 1.00 74.42 H new ATOM 0 HZ3 LYS A 64 -13.023 8.360 1.695 1.00 74.42 H new ATOM 964 N ALA A 65 -14.192 5.437 -4.896 1.00 23.32 N ATOM 965 CA ALA A 65 -13.722 5.829 -6.219 1.00 15.05 C ATOM 966 C ALA A 65 -14.602 5.222 -7.305 1.00 1.51 C ATOM 967 O ALA A 65 -14.799 5.822 -8.359 1.00 74.52 O ATOM 968 CB ALA A 65 -12.275 5.420 -6.416 1.00 20.31 C ATOM 0 H ALA A 65 -13.589 4.772 -4.412 1.00 23.32 H new ATOM 0 HA ALA A 65 -13.785 6.915 -6.294 1.00 15.05 H new ATOM 0 HB1 ALA A 65 -11.944 5.722 -7.410 1.00 20.31 H new ATOM 0 HB2 ALA A 65 -11.654 5.906 -5.663 1.00 20.31 H new ATOM 0 HB3 ALA A 65 -12.186 4.338 -6.317 1.00 20.31 H new ATOM 974 N SER A 66 -15.131 4.035 -7.032 1.00 22.31 N ATOM 975 CA SER A 66 -16.059 3.373 -7.940 1.00 21.35 C ATOM 976 C SER A 66 -17.325 4.215 -8.102 1.00 5.54 C ATOM 977 O SER A 66 -17.854 4.358 -9.207 1.00 42.45 O ATOM 978 CB SER A 66 -16.404 1.976 -7.405 1.00 2.23 C ATOM 979 OG SER A 66 -17.268 1.271 -8.282 1.00 3.42 O ATOM 0 H SER A 66 -14.931 3.508 -6.182 1.00 22.31 H new ATOM 0 HA SER A 66 -15.589 3.266 -8.918 1.00 21.35 H new ATOM 0 HB2 SER A 66 -15.486 1.405 -7.263 1.00 2.23 H new ATOM 0 HB3 SER A 66 -16.876 2.068 -6.427 1.00 2.23 H new ATOM 0 HG SER A 66 -17.463 0.387 -7.908 1.00 3.42 H new ATOM 985 N GLN A 67 -17.796 4.778 -6.995 1.00 22.21 N ATOM 986 CA GLN A 67 -18.968 5.640 -7.010 1.00 60.45 C ATOM 987 C GLN A 67 -18.622 7.018 -7.575 1.00 53.45 C ATOM 988 O GLN A 67 -19.459 7.679 -8.192 1.00 21.23 O ATOM 989 CB GLN A 67 -19.536 5.783 -5.597 1.00 44.23 C ATOM 990 CG GLN A 67 -21.003 6.176 -5.570 1.00 55.24 C ATOM 991 CD GLN A 67 -21.484 6.536 -4.181 1.00 63.43 C ATOM 992 OE1 GLN A 67 -21.964 5.684 -3.433 1.00 41.22 O ATOM 993 NE2 GLN A 67 -21.356 7.803 -3.828 1.00 31.23 N ATOM 0 H GLN A 67 -17.380 4.651 -6.072 1.00 22.21 H new ATOM 0 HA GLN A 67 -19.720 5.182 -7.653 1.00 60.45 H new ATOM 0 HB2 GLN A 67 -19.411 4.839 -5.067 1.00 44.23 H new ATOM 0 HB3 GLN A 67 -18.958 6.532 -5.056 1.00 44.23 H new ATOM 0 HG2 GLN A 67 -21.160 7.024 -6.236 1.00 55.24 H new ATOM 0 HG3 GLN A 67 -21.603 5.352 -5.956 1.00 55.24 H new ATOM 0 HE21 GLN A 67 -20.952 8.476 -4.480 1.00 31.23 H new ATOM 0 HE22 GLN A 67 -21.661 8.108 -2.904 1.00 31.23 H new ATOM 1002 N LEU A 68 -17.384 7.446 -7.358 1.00 2.24 N ATOM 1003 CA LEU A 68 -16.920 8.736 -7.854 1.00 2.45 C ATOM 1004 C LEU A 68 -16.686 8.672 -9.361 1.00 2.35 C ATOM 1005 O LEU A 68 -16.758 9.686 -10.055 1.00 3.42 O ATOM 1006 CB LEU A 68 -15.633 9.150 -7.131 1.00 24.33 C ATOM 1007 CG LEU A 68 -15.163 10.586 -7.386 1.00 43.53 C ATOM 1008 CD1 LEU A 68 -16.201 11.587 -6.901 1.00 34.01 C ATOM 1009 CD2 LEU A 68 -13.825 10.836 -6.704 1.00 11.03 C ATOM 0 H LEU A 68 -16.682 6.917 -6.841 1.00 2.24 H new ATOM 0 HA LEU A 68 -17.688 9.484 -7.654 1.00 2.45 H new ATOM 0 HB2 LEU A 68 -15.782 9.020 -6.059 1.00 24.33 H new ATOM 0 HB3 LEU A 68 -14.836 8.468 -7.427 1.00 24.33 H new ATOM 0 HG LEU A 68 -15.036 10.718 -8.460 1.00 43.53 H new ATOM 0 HD11 LEU A 68 -15.847 12.600 -7.092 1.00 34.01 H new ATOM 0 HD12 LEU A 68 -17.139 11.425 -7.432 1.00 34.01 H new ATOM 0 HD13 LEU A 68 -16.362 11.455 -5.831 1.00 34.01 H new ATOM 0 HD21 LEU A 68 -13.505 11.860 -6.895 1.00 11.03 H new ATOM 0 HD22 LEU A 68 -13.930 10.683 -5.630 1.00 11.03 H new ATOM 0 HD23 LEU A 68 -13.081 10.144 -7.098 1.00 11.03 H new ATOM 1021 N GLY A 69 -16.414 7.470 -9.857 1.00 62.44 N ATOM 1022 CA GLY A 69 -16.233 7.263 -11.282 1.00 0.31 C ATOM 1023 C GLY A 69 -14.834 7.603 -11.752 1.00 73.24 C ATOM 1024 O GLY A 69 -14.657 8.167 -12.834 1.00 34.40 O ATOM 0 H GLY A 69 -16.315 6.627 -9.291 1.00 62.44 H new ATOM 0 HA2 GLY A 69 -16.450 6.222 -11.524 1.00 0.31 H new ATOM 0 HA3 GLY A 69 -16.953 7.873 -11.827 1.00 0.31 H new ATOM 1028 N VAL A 70 -13.839 7.265 -10.941 1.00 23.44 N ATOM 1029 CA VAL A 70 -12.444 7.539 -11.282 1.00 20.15 C ATOM 1030 C VAL A 70 -11.563 6.327 -11.003 1.00 71.44 C ATOM 1031 O VAL A 70 -12.038 5.300 -10.511 1.00 41.02 O ATOM 1032 CB VAL A 70 -11.885 8.752 -10.504 1.00 14.42 C ATOM 1033 CG1 VAL A 70 -12.602 10.032 -10.907 1.00 55.34 C ATOM 1034 CG2 VAL A 70 -11.995 8.525 -9.002 1.00 74.23 C ATOM 0 H VAL A 70 -13.970 6.801 -10.042 1.00 23.44 H new ATOM 0 HA VAL A 70 -12.427 7.768 -12.347 1.00 20.15 H new ATOM 0 HB VAL A 70 -10.830 8.860 -10.758 1.00 14.42 H new ATOM 0 HG11 VAL A 70 -12.191 10.871 -10.346 1.00 55.34 H new ATOM 0 HG12 VAL A 70 -12.463 10.206 -11.974 1.00 55.34 H new ATOM 0 HG13 VAL A 70 -13.666 9.937 -10.690 1.00 55.34 H new ATOM 0 HG21 VAL A 70 -11.596 9.391 -8.473 1.00 74.23 H new ATOM 0 HG22 VAL A 70 -13.041 8.385 -8.731 1.00 74.23 H new ATOM 0 HG23 VAL A 70 -11.426 7.637 -8.726 1.00 74.23 H new ATOM 1044 N LYS A 71 -10.289 6.445 -11.347 1.00 51.40 N ATOM 1045 CA LYS A 71 -9.311 5.403 -11.073 1.00 53.43 C ATOM 1046 C LYS A 71 -8.238 5.923 -10.128 1.00 61.33 C ATOM 1047 O LYS A 71 -8.101 7.134 -9.933 1.00 34.44 O ATOM 1048 CB LYS A 71 -8.639 4.947 -12.364 1.00 52.40 C ATOM 1049 CG LYS A 71 -9.611 4.583 -13.465 1.00 25.12 C ATOM 1050 CD LYS A 71 -8.886 4.369 -14.780 1.00 51.24 C ATOM 1051 CE LYS A 71 -9.865 4.158 -15.916 1.00 61.32 C ATOM 1052 NZ LYS A 71 -9.178 3.990 -17.223 1.00 31.30 N ATOM 0 H LYS A 71 -9.905 7.262 -11.822 1.00 51.40 H new ATOM 0 HA LYS A 71 -9.835 4.564 -10.616 1.00 53.43 H new ATOM 0 HB2 LYS A 71 -7.982 5.741 -12.720 1.00 52.40 H new ATOM 0 HB3 LYS A 71 -8.009 4.084 -12.149 1.00 52.40 H new ATOM 0 HG2 LYS A 71 -10.152 3.677 -13.192 1.00 25.12 H new ATOM 0 HG3 LYS A 71 -10.351 5.375 -13.578 1.00 25.12 H new ATOM 0 HD2 LYS A 71 -8.255 5.231 -14.995 1.00 51.24 H new ATOM 0 HD3 LYS A 71 -8.227 3.505 -14.699 1.00 51.24 H new ATOM 0 HE2 LYS A 71 -10.473 3.277 -15.711 1.00 61.32 H new ATOM 0 HE3 LYS A 71 -10.544 5.009 -15.971 1.00 61.32 H new ATOM 0 HZ1 LYS A 71 -9.886 3.848 -17.972 1.00 31.30 H new ATOM 0 HZ2 LYS A 71 -8.618 4.841 -17.433 1.00 31.30 H new ATOM 0 HZ3 LYS A 71 -8.549 3.163 -17.181 1.00 31.30 H new ATOM 1066 N ILE A 72 -7.478 5.008 -9.550 1.00 51.33 N ATOM 1067 CA ILE A 72 -6.330 5.375 -8.737 1.00 45.51 C ATOM 1068 C ILE A 72 -5.076 4.712 -9.301 1.00 44.30 C ATOM 1069 O ILE A 72 -5.169 3.722 -10.024 1.00 0.21 O ATOM 1070 CB ILE A 72 -6.512 4.967 -7.251 1.00 1.25 C ATOM 1071 CG1 ILE A 72 -6.314 3.461 -7.051 1.00 23.25 C ATOM 1072 CG2 ILE A 72 -7.888 5.378 -6.752 1.00 14.55 C ATOM 1073 CD1 ILE A 72 -4.923 3.081 -6.575 1.00 52.23 C ATOM 0 H ILE A 72 -7.636 4.003 -9.629 1.00 51.33 H new ATOM 0 HA ILE A 72 -6.232 6.460 -8.770 1.00 45.51 H new ATOM 0 HB ILE A 72 -5.749 5.488 -6.673 1.00 1.25 H new ATOM 0 HG12 ILE A 72 -7.046 3.101 -6.328 1.00 23.25 H new ATOM 0 HG13 ILE A 72 -6.518 2.950 -7.992 1.00 23.25 H new ATOM 0 HG21 ILE A 72 -7.999 5.084 -5.708 1.00 14.55 H new ATOM 0 HG22 ILE A 72 -7.999 6.459 -6.839 1.00 14.55 H new ATOM 0 HG23 ILE A 72 -8.654 4.886 -7.351 1.00 14.55 H new ATOM 0 HD11 ILE A 72 -4.862 1.999 -6.457 1.00 52.23 H new ATOM 0 HD12 ILE A 72 -4.186 3.408 -7.308 1.00 52.23 H new ATOM 0 HD13 ILE A 72 -4.722 3.562 -5.618 1.00 52.23 H new ATOM 1085 N ARG A 73 -3.914 5.256 -8.977 1.00 12.41 N ATOM 1086 CA ARG A 73 -2.650 4.661 -9.405 1.00 61.31 C ATOM 1087 C ARG A 73 -1.752 4.427 -8.199 1.00 51.21 C ATOM 1088 O ARG A 73 -1.288 5.385 -7.581 1.00 35.34 O ATOM 1089 CB ARG A 73 -1.912 5.558 -10.414 1.00 52.31 C ATOM 1090 CG ARG A 73 -2.590 5.703 -11.774 1.00 52.10 C ATOM 1091 CD ARG A 73 -3.796 6.629 -11.715 1.00 14.30 C ATOM 1092 NE ARG A 73 -4.347 6.900 -13.039 1.00 73.43 N ATOM 1093 CZ ARG A 73 -5.152 7.920 -13.315 1.00 34.32 C ATOM 1094 NH1 ARG A 73 -5.544 8.746 -12.350 1.00 71.22 N ATOM 1095 NH2 ARG A 73 -5.575 8.104 -14.557 1.00 41.42 N ATOM 0 H ARG A 73 -3.816 6.106 -8.421 1.00 12.41 H new ATOM 0 HA ARG A 73 -2.882 3.714 -9.892 1.00 61.31 H new ATOM 0 HB2 ARG A 73 -1.796 6.550 -9.977 1.00 52.31 H new ATOM 0 HB3 ARG A 73 -0.910 5.157 -10.567 1.00 52.31 H new ATOM 0 HG2 ARG A 73 -1.872 6.089 -12.498 1.00 52.10 H new ATOM 0 HG3 ARG A 73 -2.904 4.721 -12.129 1.00 52.10 H new ATOM 0 HD2 ARG A 73 -4.566 6.181 -11.087 1.00 14.30 H new ATOM 0 HD3 ARG A 73 -3.508 7.569 -11.244 1.00 14.30 H new ATOM 0 HE ARG A 73 -4.099 6.267 -13.799 1.00 73.43 H new ATOM 0 HH11 ARG A 73 -5.227 8.598 -11.392 1.00 71.22 H new ATOM 0 HH12 ARG A 73 -6.162 9.528 -12.568 1.00 71.22 H new ATOM 0 HH21 ARG A 73 -5.282 7.464 -15.295 1.00 41.42 H new ATOM 0 HH22 ARG A 73 -6.193 8.886 -14.775 1.00 41.42 H new ATOM 1109 N ILE A 74 -1.524 3.167 -7.848 1.00 22.41 N ATOM 1110 CA ILE A 74 -0.608 2.851 -6.764 1.00 74.04 C ATOM 1111 C ILE A 74 0.733 2.397 -7.359 1.00 22.45 C ATOM 1112 O ILE A 74 0.822 1.401 -8.085 1.00 74.34 O ATOM 1113 CB ILE A 74 -1.222 1.809 -5.770 1.00 24.32 C ATOM 1114 CG1 ILE A 74 -0.562 1.896 -4.379 1.00 74.14 C ATOM 1115 CG2 ILE A 74 -1.151 0.382 -6.300 1.00 53.33 C ATOM 1116 CD1 ILE A 74 0.877 1.426 -4.322 1.00 71.31 C ATOM 0 H ILE A 74 -1.956 2.357 -8.293 1.00 22.41 H new ATOM 0 HA ILE A 74 -0.429 3.744 -6.166 1.00 74.04 H new ATOM 0 HB ILE A 74 -2.276 2.070 -5.672 1.00 24.32 H new ATOM 0 HG12 ILE A 74 -0.604 2.930 -4.038 1.00 74.14 H new ATOM 0 HG13 ILE A 74 -1.150 1.304 -3.677 1.00 74.14 H new ATOM 0 HG21 ILE A 74 -1.590 -0.299 -5.571 1.00 53.33 H new ATOM 0 HG22 ILE A 74 -1.702 0.314 -7.238 1.00 53.33 H new ATOM 0 HG23 ILE A 74 -0.110 0.109 -6.470 1.00 53.33 H new ATOM 0 HD11 ILE A 74 1.252 1.526 -3.304 1.00 71.31 H new ATOM 0 HD12 ILE A 74 0.931 0.381 -4.628 1.00 71.31 H new ATOM 0 HD13 ILE A 74 1.485 2.032 -4.994 1.00 71.31 H new ATOM 1128 N LEU A 75 1.768 3.174 -7.087 1.00 45.44 N ATOM 1129 CA LEU A 75 3.069 2.955 -7.703 1.00 15.44 C ATOM 1130 C LEU A 75 3.943 2.049 -6.849 1.00 1.32 C ATOM 1131 O LEU A 75 4.238 2.368 -5.698 1.00 11.01 O ATOM 1132 CB LEU A 75 3.789 4.292 -7.939 1.00 34.14 C ATOM 1133 CG LEU A 75 3.149 5.234 -8.971 1.00 54.45 C ATOM 1134 CD1 LEU A 75 1.897 5.900 -8.417 1.00 71.33 C ATOM 1135 CD2 LEU A 75 4.151 6.286 -9.414 1.00 42.43 C ATOM 0 H LEU A 75 1.734 3.964 -6.443 1.00 45.44 H new ATOM 0 HA LEU A 75 2.897 2.465 -8.661 1.00 15.44 H new ATOM 0 HB2 LEU A 75 3.853 4.819 -6.987 1.00 34.14 H new ATOM 0 HB3 LEU A 75 4.810 4.080 -8.255 1.00 34.14 H new ATOM 0 HG LEU A 75 2.855 4.635 -9.833 1.00 54.45 H new ATOM 0 HD11 LEU A 75 1.471 6.559 -9.173 1.00 71.33 H new ATOM 0 HD12 LEU A 75 1.167 5.136 -8.148 1.00 71.33 H new ATOM 0 HD13 LEU A 75 2.156 6.482 -7.533 1.00 71.33 H new ATOM 0 HD21 LEU A 75 3.685 6.947 -10.145 1.00 42.43 H new ATOM 0 HD22 LEU A 75 4.472 6.869 -8.551 1.00 42.43 H new ATOM 0 HD23 LEU A 75 5.015 5.798 -9.865 1.00 42.43 H new ATOM 1147 N HIS A 76 4.345 0.915 -7.422 1.00 50.45 N ATOM 1148 CA HIS A 76 5.269 -0.008 -6.768 1.00 64.41 C ATOM 1149 C HIS A 76 5.574 -1.188 -7.689 1.00 64.52 C ATOM 1150 O HIS A 76 5.260 -1.156 -8.878 1.00 62.44 O ATOM 1151 CB HIS A 76 4.717 -0.511 -5.416 1.00 2.10 C ATOM 1152 CG HIS A 76 3.606 -1.513 -5.518 1.00 12.42 C ATOM 1153 ND1 HIS A 76 3.763 -2.841 -5.188 1.00 52.14 N ATOM 1154 CD2 HIS A 76 2.316 -1.372 -5.898 1.00 52.33 C ATOM 1155 CE1 HIS A 76 2.621 -3.473 -5.358 1.00 21.42 C ATOM 1156 NE2 HIS A 76 1.722 -2.605 -5.789 1.00 3.24 N ATOM 0 H HIS A 76 4.041 0.612 -8.347 1.00 50.45 H new ATOM 0 HA HIS A 76 6.191 0.536 -6.563 1.00 64.41 H new ATOM 0 HB2 HIS A 76 5.535 -0.955 -4.849 1.00 2.10 H new ATOM 0 HB3 HIS A 76 4.361 0.346 -4.844 1.00 2.10 H new ATOM 0 HD1 HIS A 76 4.630 -3.268 -4.862 1.00 52.14 H new ATOM 0 HD2 HIS A 76 1.841 -0.459 -6.226 1.00 52.33 H new ATOM 0 HE1 HIS A 76 2.448 -4.523 -5.176 1.00 21.42 H new ATOM 1165 N ASP A 77 6.181 -2.216 -7.112 1.00 53.35 N ATOM 1166 CA ASP A 77 6.577 -3.428 -7.830 1.00 35.30 C ATOM 1167 C ASP A 77 5.376 -4.211 -8.366 1.00 3.53 C ATOM 1168 O ASP A 77 4.216 -3.875 -8.106 1.00 1.24 O ATOM 1169 CB ASP A 77 7.351 -4.337 -6.880 1.00 71.12 C ATOM 1170 CG ASP A 77 6.461 -4.872 -5.772 1.00 53.13 C ATOM 1171 OD1 ASP A 77 6.105 -4.092 -4.856 1.00 12.12 O ATOM 1172 OD2 ASP A 77 6.085 -6.059 -5.830 1.00 3.15 O ATOM 0 H ASP A 77 6.417 -2.236 -6.120 1.00 53.35 H new ATOM 0 HA ASP A 77 7.186 -3.118 -8.679 1.00 35.30 H new ATOM 0 HB2 ASP A 77 7.778 -5.170 -7.439 1.00 71.12 H new ATOM 0 HB3 ASP A 77 8.184 -3.785 -6.444 1.00 71.12 H new ATOM 1177 N TYR A 78 5.676 -5.278 -9.104 1.00 30.03 N ATOM 1178 CA TYR A 78 4.657 -6.198 -9.603 1.00 54.52 C ATOM 1179 C TYR A 78 4.873 -7.602 -9.043 1.00 64.30 C ATOM 1180 O TYR A 78 4.319 -8.579 -9.550 1.00 12.11 O ATOM 1181 CB TYR A 78 4.684 -6.262 -11.131 1.00 73.15 C ATOM 1182 CG TYR A 78 4.050 -5.077 -11.820 1.00 30.25 C ATOM 1183 CD1 TYR A 78 2.671 -4.982 -11.938 1.00 31.21 C ATOM 1184 CD2 TYR A 78 4.824 -4.059 -12.360 1.00 45.11 C ATOM 1185 CE1 TYR A 78 2.080 -3.909 -12.573 1.00 11.34 C ATOM 1186 CE2 TYR A 78 4.237 -2.981 -12.995 1.00 44.50 C ATOM 1187 CZ TYR A 78 2.867 -2.911 -13.097 1.00 41.12 C ATOM 1188 OH TYR A 78 2.277 -1.838 -13.729 1.00 44.21 O ATOM 0 H TYR A 78 6.628 -5.528 -9.372 1.00 30.03 H new ATOM 0 HA TYR A 78 3.688 -5.823 -9.274 1.00 54.52 H new ATOM 0 HB2 TYR A 78 5.720 -6.346 -11.460 1.00 73.15 H new ATOM 0 HB3 TYR A 78 4.173 -7.169 -11.453 1.00 73.15 H new ATOM 0 HD1 TYR A 78 2.049 -5.762 -11.525 1.00 31.21 H new ATOM 0 HD2 TYR A 78 5.900 -4.110 -12.283 1.00 45.11 H new ATOM 0 HE1 TYR A 78 1.005 -3.853 -12.658 1.00 11.34 H new ATOM 0 HE2 TYR A 78 4.852 -2.196 -13.410 1.00 44.50 H new ATOM 0 HH TYR A 78 1.336 -1.779 -13.463 1.00 44.21 H new ATOM 1198 N ALA A 79 5.678 -7.704 -7.999 1.00 10.02 N ATOM 1199 CA ALA A 79 6.017 -8.996 -7.423 1.00 63.25 C ATOM 1200 C ALA A 79 5.087 -9.341 -6.266 1.00 73.02 C ATOM 1201 O ALA A 79 4.552 -10.450 -6.192 1.00 34.55 O ATOM 1202 CB ALA A 79 7.466 -9.005 -6.966 1.00 0.04 C ATOM 0 H ALA A 79 6.110 -6.907 -7.532 1.00 10.02 H new ATOM 0 HA ALA A 79 5.889 -9.757 -8.193 1.00 63.25 H new ATOM 0 HB1 ALA A 79 7.706 -9.978 -6.537 1.00 0.04 H new ATOM 0 HB2 ALA A 79 8.118 -8.814 -7.819 1.00 0.04 H new ATOM 0 HB3 ALA A 79 7.615 -8.230 -6.214 1.00 0.04 H new ATOM 1208 N GLY A 80 4.883 -8.382 -5.373 1.00 30.33 N ATOM 1209 CA GLY A 80 4.088 -8.623 -4.185 1.00 0.13 C ATOM 1210 C GLY A 80 2.598 -8.645 -4.457 1.00 52.45 C ATOM 1211 O GLY A 80 1.811 -9.020 -3.589 1.00 4.22 O ATOM 0 H GLY A 80 5.256 -7.436 -5.451 1.00 30.33 H new ATOM 0 HA2 GLY A 80 4.384 -9.575 -3.745 1.00 0.13 H new ATOM 0 HA3 GLY A 80 4.305 -7.850 -3.448 1.00 0.13 H new ATOM 1215 N ILE A 81 2.207 -8.266 -5.667 1.00 11.10 N ATOM 1216 CA ILE A 81 0.794 -8.205 -6.023 1.00 1.52 C ATOM 1217 C ILE A 81 0.195 -9.603 -6.148 1.00 14.12 C ATOM 1218 O ILE A 81 -1.018 -9.781 -6.044 1.00 71.12 O ATOM 1219 CB ILE A 81 0.563 -7.398 -7.329 1.00 33.52 C ATOM 1220 CG1 ILE A 81 1.357 -7.974 -8.514 1.00 61.41 C ATOM 1221 CG2 ILE A 81 0.939 -5.941 -7.111 1.00 32.05 C ATOM 1222 CD1 ILE A 81 0.658 -9.100 -9.252 1.00 30.14 C ATOM 0 H ILE A 81 2.845 -7.997 -6.416 1.00 11.10 H new ATOM 0 HA ILE A 81 0.284 -7.683 -5.213 1.00 1.52 H new ATOM 0 HB ILE A 81 -0.496 -7.472 -7.578 1.00 33.52 H new ATOM 0 HG12 ILE A 81 1.567 -7.170 -9.219 1.00 61.41 H new ATOM 0 HG13 ILE A 81 2.318 -8.337 -8.149 1.00 61.41 H new ATOM 0 HG21 ILE A 81 0.774 -5.381 -8.032 1.00 32.05 H new ATOM 0 HG22 ILE A 81 0.323 -5.521 -6.316 1.00 32.05 H new ATOM 0 HG23 ILE A 81 1.990 -5.875 -6.829 1.00 32.05 H new ATOM 0 HD11 ILE A 81 1.289 -9.445 -10.071 1.00 30.14 H new ATOM 0 HD12 ILE A 81 0.472 -9.925 -8.565 1.00 30.14 H new ATOM 0 HD13 ILE A 81 -0.290 -8.740 -9.651 1.00 30.14 H new ATOM 1234 N ALA A 82 1.055 -10.596 -6.351 1.00 14.40 N ATOM 1235 CA ALA A 82 0.612 -11.975 -6.519 1.00 75.35 C ATOM 1236 C ALA A 82 0.098 -12.552 -5.206 1.00 24.12 C ATOM 1237 O ALA A 82 -0.713 -13.480 -5.197 1.00 50.04 O ATOM 1238 CB ALA A 82 1.747 -12.829 -7.061 1.00 74.02 C ATOM 0 H ALA A 82 2.066 -10.470 -6.403 1.00 14.40 H new ATOM 0 HA ALA A 82 -0.210 -11.981 -7.235 1.00 75.35 H new ATOM 0 HB1 ALA A 82 1.404 -13.856 -7.182 1.00 74.02 H new ATOM 0 HB2 ALA A 82 2.068 -12.438 -8.026 1.00 74.02 H new ATOM 0 HB3 ALA A 82 2.585 -12.806 -6.364 1.00 74.02 H new ATOM 1244 N PHE A 83 0.556 -11.979 -4.098 1.00 63.44 N ATOM 1245 CA PHE A 83 0.208 -12.484 -2.777 1.00 3.35 C ATOM 1246 C PHE A 83 -1.228 -12.104 -2.415 1.00 71.14 C ATOM 1247 O PHE A 83 -1.815 -12.659 -1.487 1.00 10.40 O ATOM 1248 CB PHE A 83 1.191 -11.948 -1.730 1.00 15.43 C ATOM 1249 CG PHE A 83 1.140 -12.680 -0.416 1.00 43.21 C ATOM 1250 CD1 PHE A 83 1.741 -13.922 -0.280 1.00 13.54 C ATOM 1251 CD2 PHE A 83 0.501 -12.127 0.682 1.00 71.23 C ATOM 1252 CE1 PHE A 83 1.704 -14.598 0.924 1.00 64.40 C ATOM 1253 CE2 PHE A 83 0.460 -12.799 1.889 1.00 21.03 C ATOM 1254 CZ PHE A 83 1.064 -14.037 2.009 1.00 2.44 C ATOM 0 H PHE A 83 1.169 -11.164 -4.090 1.00 63.44 H new ATOM 0 HA PHE A 83 0.276 -13.572 -2.792 1.00 3.35 H new ATOM 0 HB2 PHE A 83 2.203 -12.010 -2.130 1.00 15.43 H new ATOM 0 HB3 PHE A 83 0.981 -10.893 -1.555 1.00 15.43 H new ATOM 0 HD1 PHE A 83 2.244 -14.366 -1.126 1.00 13.54 H new ATOM 0 HD2 PHE A 83 0.029 -11.159 0.594 1.00 71.23 H new ATOM 0 HE1 PHE A 83 2.176 -15.565 1.016 1.00 64.40 H new ATOM 0 HE2 PHE A 83 -0.043 -12.358 2.737 1.00 21.03 H new ATOM 0 HZ PHE A 83 1.035 -14.564 2.951 1.00 2.44 H new ATOM 1264 N TRP A 84 -1.795 -11.157 -3.154 1.00 44.14 N ATOM 1265 CA TRP A 84 -3.190 -10.790 -2.958 1.00 24.02 C ATOM 1266 C TRP A 84 -4.079 -11.897 -3.510 1.00 41.34 C ATOM 1267 O TRP A 84 -4.963 -12.408 -2.817 1.00 2.32 O ATOM 1268 CB TRP A 84 -3.513 -9.463 -3.655 1.00 2.32 C ATOM 1269 CG TRP A 84 -4.817 -8.852 -3.215 1.00 1.12 C ATOM 1270 CD1 TRP A 84 -6.056 -9.435 -3.245 1.00 31.31 C ATOM 1271 CD2 TRP A 84 -5.014 -7.533 -2.693 1.00 20.02 C ATOM 1272 NE1 TRP A 84 -6.999 -8.567 -2.753 1.00 0.02 N ATOM 1273 CE2 TRP A 84 -6.387 -7.390 -2.414 1.00 31.24 C ATOM 1274 CE3 TRP A 84 -4.160 -6.458 -2.429 1.00 21.34 C ATOM 1275 CZ2 TRP A 84 -6.922 -6.219 -1.884 1.00 42.40 C ATOM 1276 CZ3 TRP A 84 -4.692 -5.297 -1.904 1.00 72.20 C ATOM 1277 CH2 TRP A 84 -6.063 -5.185 -1.637 1.00 62.20 C ATOM 0 H TRP A 84 -1.315 -10.635 -3.887 1.00 44.14 H new ATOM 0 HA TRP A 84 -3.374 -10.663 -1.891 1.00 24.02 H new ATOM 0 HB2 TRP A 84 -2.707 -8.755 -3.462 1.00 2.32 H new ATOM 0 HB3 TRP A 84 -3.543 -9.626 -4.732 1.00 2.32 H new ATOM 0 HD1 TRP A 84 -6.261 -10.433 -3.604 1.00 31.31 H new ATOM 0 HE1 TRP A 84 -7.995 -8.767 -2.656 1.00 0.02 H new ATOM 0 HE3 TRP A 84 -3.102 -6.534 -2.632 1.00 21.34 H new ATOM 0 HZ2 TRP A 84 -7.978 -6.131 -1.676 1.00 42.40 H new ATOM 0 HZ3 TRP A 84 -4.040 -4.461 -1.696 1.00 72.20 H new ATOM 0 HH2 TRP A 84 -6.449 -4.263 -1.228 1.00 62.20 H new ATOM 1288 N ALA A 85 -3.816 -12.271 -4.756 1.00 35.21 N ATOM 1289 CA ALA A 85 -4.571 -13.319 -5.429 1.00 13.51 C ATOM 1290 C ALA A 85 -4.411 -14.654 -4.706 1.00 12.32 C ATOM 1291 O ALA A 85 -5.372 -15.400 -4.537 1.00 51.10 O ATOM 1292 CB ALA A 85 -4.118 -13.439 -6.874 1.00 33.04 C ATOM 0 H ALA A 85 -3.077 -11.859 -5.326 1.00 35.21 H new ATOM 0 HA ALA A 85 -5.627 -13.051 -5.411 1.00 13.51 H new ATOM 0 HB1 ALA A 85 -4.688 -14.225 -7.370 1.00 33.04 H new ATOM 0 HB2 ALA A 85 -4.284 -12.492 -7.387 1.00 33.04 H new ATOM 0 HB3 ALA A 85 -3.057 -13.687 -6.903 1.00 33.04 H new ATOM 1298 N THR A 86 -3.194 -14.932 -4.257 1.00 22.41 N ATOM 1299 CA THR A 86 -2.907 -16.170 -3.544 1.00 41.32 C ATOM 1300 C THR A 86 -3.160 -16.014 -2.044 1.00 65.52 C ATOM 1301 O THR A 86 -2.659 -16.794 -1.234 1.00 65.44 O ATOM 1302 CB THR A 86 -1.453 -16.624 -3.783 1.00 54.40 C ATOM 1303 OG1 THR A 86 -0.544 -15.540 -3.537 1.00 75.32 O ATOM 1304 CG2 THR A 86 -1.270 -17.130 -5.205 1.00 74.25 C ATOM 0 H THR A 86 -2.389 -14.316 -4.374 1.00 22.41 H new ATOM 0 HA THR A 86 -3.581 -16.933 -3.935 1.00 41.32 H new ATOM 0 HB THR A 86 -1.238 -17.438 -3.091 1.00 54.40 H new ATOM 0 HG1 THR A 86 -0.453 -14.999 -4.349 1.00 75.32 H new ATOM 0 HG21 THR A 86 -0.236 -17.444 -5.349 1.00 74.25 H new ATOM 0 HG22 THR A 86 -1.934 -17.977 -5.378 1.00 74.25 H new ATOM 0 HG23 THR A 86 -1.508 -16.332 -5.909 1.00 74.25 H new ATOM 1312 N GLY A 87 -3.967 -15.016 -1.684 1.00 14.41 N ATOM 1313 CA GLY A 87 -4.283 -14.768 -0.287 1.00 32.54 C ATOM 1314 C GLY A 87 -5.225 -15.807 0.293 1.00 33.31 C ATOM 1315 O GLY A 87 -5.498 -15.806 1.492 1.00 15.31 O ATOM 0 H GLY A 87 -4.409 -14.372 -2.340 1.00 14.41 H new ATOM 0 HA2 GLY A 87 -3.360 -14.755 0.293 1.00 32.54 H new ATOM 0 HA3 GLY A 87 -4.734 -13.780 -0.190 1.00 32.54 H new ATOM 1319 N GLU A 88 -5.739 -16.672 -0.567 1.00 54.21 N ATOM 1320 CA GLU A 88 -6.573 -17.781 -0.132 1.00 63.43 C ATOM 1321 C GLU A 88 -5.698 -19.026 -0.026 1.00 40.04 C ATOM 1322 O GLU A 88 -5.551 -19.620 1.044 1.00 61.24 O ATOM 1323 CB GLU A 88 -7.708 -18.004 -1.143 1.00 74.12 C ATOM 1324 CG GLU A 88 -8.959 -18.660 -0.567 1.00 25.54 C ATOM 1325 CD GLU A 88 -8.720 -20.056 -0.025 1.00 52.34 C ATOM 1326 OE1 GLU A 88 -8.583 -21.001 -0.829 1.00 21.41 O ATOM 1327 OE2 GLU A 88 -8.693 -20.216 1.214 1.00 62.24 O ATOM 0 H GLU A 88 -5.592 -16.627 -1.575 1.00 54.21 H new ATOM 0 HA GLU A 88 -7.019 -17.564 0.838 1.00 63.43 H new ATOM 0 HB2 GLU A 88 -7.985 -17.042 -1.575 1.00 74.12 H new ATOM 0 HB3 GLU A 88 -7.333 -18.623 -1.958 1.00 74.12 H new ATOM 0 HG2 GLU A 88 -9.353 -18.032 0.232 1.00 25.54 H new ATOM 0 HG3 GLU A 88 -9.724 -18.707 -1.342 1.00 25.54 H new ATOM 1334 N TRP A 89 -5.098 -19.385 -1.151 1.00 62.41 N ATOM 1335 CA TRP A 89 -4.182 -20.505 -1.231 1.00 34.14 C ATOM 1336 C TRP A 89 -3.238 -20.259 -2.403 1.00 23.20 C ATOM 1337 O TRP A 89 -3.533 -19.427 -3.263 1.00 51.04 O ATOM 1338 CB TRP A 89 -4.960 -21.818 -1.413 1.00 14.30 C ATOM 1339 CG TRP A 89 -4.096 -23.044 -1.391 1.00 74.23 C ATOM 1340 CD1 TRP A 89 -3.283 -23.455 -0.375 1.00 40.01 C ATOM 1341 CD2 TRP A 89 -3.973 -24.029 -2.425 1.00 74.34 C ATOM 1342 NE1 TRP A 89 -2.647 -24.622 -0.723 1.00 14.53 N ATOM 1343 CE2 TRP A 89 -3.059 -24.996 -1.974 1.00 31.43 C ATOM 1344 CE3 TRP A 89 -4.546 -24.183 -3.691 1.00 34.45 C ATOM 1345 CZ2 TRP A 89 -2.704 -26.101 -2.744 1.00 31.42 C ATOM 1346 CZ3 TRP A 89 -4.194 -25.280 -4.452 1.00 34.30 C ATOM 1347 CH2 TRP A 89 -3.282 -26.227 -3.977 1.00 75.23 C ATOM 0 H TRP A 89 -5.236 -18.902 -2.039 1.00 62.41 H new ATOM 0 HA TRP A 89 -3.607 -20.594 -0.309 1.00 34.14 H new ATOM 0 HB2 TRP A 89 -5.708 -21.898 -0.624 1.00 14.30 H new ATOM 0 HB3 TRP A 89 -5.498 -21.782 -2.360 1.00 14.30 H new ATOM 0 HD1 TRP A 89 -3.158 -22.938 0.565 1.00 40.01 H new ATOM 0 HE1 TRP A 89 -1.977 -25.128 -0.144 1.00 14.53 H new ATOM 0 HE3 TRP A 89 -5.251 -23.457 -4.067 1.00 34.45 H new ATOM 0 HZ2 TRP A 89 -1.997 -26.832 -2.380 1.00 31.42 H new ATOM 0 HZ3 TRP A 89 -4.631 -25.409 -5.431 1.00 34.30 H new ATOM 0 HH2 TRP A 89 -3.029 -27.075 -4.596 1.00 75.23 H new ATOM 1358 N LYS A 90 -2.107 -20.946 -2.434 1.00 74.24 N ATOM 1359 CA LYS A 90 -1.142 -20.755 -3.507 1.00 11.10 C ATOM 1360 C LYS A 90 -1.683 -21.333 -4.810 1.00 71.12 C ATOM 1361 O LYS A 90 -2.125 -22.480 -4.850 1.00 3.14 O ATOM 1362 CB LYS A 90 0.197 -21.403 -3.148 1.00 71.42 C ATOM 1363 CG LYS A 90 1.296 -21.121 -4.163 1.00 54.12 C ATOM 1364 CD LYS A 90 2.659 -21.565 -3.656 1.00 12.20 C ATOM 1365 CE LYS A 90 3.021 -20.863 -2.356 1.00 61.41 C ATOM 1366 NZ LYS A 90 4.413 -21.159 -1.924 1.00 13.04 N ATOM 0 H LYS A 90 -1.835 -21.636 -1.734 1.00 74.24 H new ATOM 0 HA LYS A 90 -0.979 -19.686 -3.641 1.00 11.10 H new ATOM 0 HB2 LYS A 90 0.515 -21.044 -2.169 1.00 71.42 H new ATOM 0 HB3 LYS A 90 0.059 -22.481 -3.062 1.00 71.42 H new ATOM 0 HG2 LYS A 90 1.070 -21.636 -5.097 1.00 54.12 H new ATOM 0 HG3 LYS A 90 1.321 -20.054 -4.385 1.00 54.12 H new ATOM 0 HD2 LYS A 90 2.658 -22.644 -3.501 1.00 12.20 H new ATOM 0 HD3 LYS A 90 3.417 -21.352 -4.410 1.00 12.20 H new ATOM 0 HE2 LYS A 90 2.903 -19.787 -2.482 1.00 61.41 H new ATOM 0 HE3 LYS A 90 2.327 -21.171 -1.574 1.00 61.41 H new ATOM 0 HZ1 LYS A 90 4.614 -20.659 -1.034 1.00 13.04 H new ATOM 0 HZ2 LYS A 90 4.521 -22.183 -1.778 1.00 13.04 H new ATOM 0 HZ3 LYS A 90 5.079 -20.842 -2.657 1.00 13.04 H new ATOM 1380 N ALA A 91 -1.653 -20.526 -5.866 1.00 32.23 N ATOM 1381 CA ALA A 91 -2.181 -20.925 -7.167 1.00 41.11 C ATOM 1382 C ALA A 91 -1.422 -22.122 -7.725 1.00 23.13 C ATOM 1383 O ALA A 91 -0.333 -21.982 -8.285 1.00 62.32 O ATOM 1384 CB ALA A 91 -2.130 -19.752 -8.138 1.00 72.52 C ATOM 0 H ALA A 91 -1.265 -19.583 -5.845 1.00 32.23 H new ATOM 0 HA ALA A 91 -3.221 -21.225 -7.036 1.00 41.11 H new ATOM 0 HB1 ALA A 91 -2.527 -20.062 -9.105 1.00 72.52 H new ATOM 0 HB2 ALA A 91 -2.729 -18.930 -7.747 1.00 72.52 H new ATOM 0 HB3 ALA A 91 -1.098 -19.424 -8.258 1.00 72.52 H new ATOM 1390 N LYS A 92 -1.999 -23.303 -7.550 1.00 31.22 N ATOM 1391 CA LYS A 92 -1.341 -24.536 -7.952 1.00 20.43 C ATOM 1392 C LYS A 92 -2.210 -25.347 -8.910 1.00 53.20 C ATOM 1393 O LYS A 92 -1.699 -25.954 -9.850 1.00 5.24 O ATOM 1394 CB LYS A 92 -1.007 -25.371 -6.709 1.00 24.02 C ATOM 1395 CG LYS A 92 -0.112 -26.579 -6.968 1.00 14.42 C ATOM 1396 CD LYS A 92 1.286 -26.172 -7.415 1.00 1.41 C ATOM 1397 CE LYS A 92 1.382 -26.025 -8.925 1.00 42.44 C ATOM 1398 NZ LYS A 92 1.397 -27.344 -9.611 1.00 65.30 N ATOM 0 H LYS A 92 -2.921 -23.432 -7.133 1.00 31.22 H new ATOM 0 HA LYS A 92 -0.422 -24.276 -8.477 1.00 20.43 H new ATOM 0 HB2 LYS A 92 -0.520 -24.727 -5.977 1.00 24.02 H new ATOM 0 HB3 LYS A 92 -1.938 -25.717 -6.260 1.00 24.02 H new ATOM 0 HG2 LYS A 92 -0.042 -27.178 -6.060 1.00 14.42 H new ATOM 0 HG3 LYS A 92 -0.567 -27.209 -7.732 1.00 14.42 H new ATOM 0 HD2 LYS A 92 1.558 -25.229 -6.941 1.00 1.41 H new ATOM 0 HD3 LYS A 92 2.006 -26.917 -7.077 1.00 1.41 H new ATOM 0 HE2 LYS A 92 0.538 -25.437 -9.287 1.00 42.44 H new ATOM 0 HE3 LYS A 92 2.287 -25.473 -9.179 1.00 42.44 H new ATOM 0 HZ1 LYS A 92 1.665 -27.214 -10.607 1.00 65.30 H new ATOM 0 HZ2 LYS A 92 2.085 -27.969 -9.146 1.00 65.30 H new ATOM 0 HZ3 LYS A 92 0.451 -27.772 -9.560 1.00 65.30 H new ATOM 1412 N ASN A 93 -3.520 -25.352 -8.680 1.00 12.45 N ATOM 1413 CA ASN A 93 -4.415 -26.207 -9.456 1.00 15.00 C ATOM 1414 C ASN A 93 -5.654 -25.447 -9.923 1.00 60.31 C ATOM 1415 O ASN A 93 -6.539 -25.151 -9.124 1.00 33.12 O ATOM 1416 CB ASN A 93 -4.827 -27.422 -8.613 1.00 10.44 C ATOM 1417 CG ASN A 93 -5.509 -28.521 -9.416 1.00 1.44 C ATOM 1418 OD1 ASN A 93 -6.191 -28.271 -10.409 1.00 2.41 O ATOM 1419 ND2 ASN A 93 -5.331 -29.756 -8.979 1.00 40.21 N ATOM 0 H ASN A 93 -3.982 -24.781 -7.972 1.00 12.45 H new ATOM 0 HA ASN A 93 -3.879 -26.541 -10.344 1.00 15.00 H new ATOM 0 HB2 ASN A 93 -3.942 -27.834 -8.129 1.00 10.44 H new ATOM 0 HB3 ASN A 93 -5.499 -27.092 -7.821 1.00 10.44 H new ATOM 0 HD21 ASN A 93 -5.766 -30.538 -9.469 1.00 40.21 H new ATOM 0 HD22 ASN A 93 -4.759 -29.927 -8.152 1.00 40.21 H new ATOM 1426 N GLU A 94 -5.663 -25.112 -11.214 1.00 11.51 N ATOM 1427 CA GLU A 94 -6.828 -24.558 -11.926 1.00 65.33 C ATOM 1428 C GLU A 94 -7.580 -23.460 -11.176 1.00 74.43 C ATOM 1429 O GLU A 94 -7.338 -22.281 -11.414 1.00 11.31 O ATOM 1430 CB GLU A 94 -7.795 -25.668 -12.331 1.00 64.05 C ATOM 1431 CG GLU A 94 -7.275 -26.522 -13.475 1.00 3.45 C ATOM 1432 CD GLU A 94 -6.870 -25.695 -14.683 1.00 2.32 C ATOM 1433 OE1 GLU A 94 -7.759 -25.274 -15.452 1.00 24.23 O ATOM 1434 OE2 GLU A 94 -5.654 -25.465 -14.875 1.00 42.45 O ATOM 0 H GLU A 94 -4.844 -25.219 -11.812 1.00 11.51 H new ATOM 0 HA GLU A 94 -6.410 -24.078 -12.811 1.00 65.33 H new ATOM 0 HB2 GLU A 94 -7.989 -26.305 -11.468 1.00 64.05 H new ATOM 0 HB3 GLU A 94 -8.748 -25.224 -12.620 1.00 64.05 H new ATOM 0 HG2 GLU A 94 -6.418 -27.101 -13.131 1.00 3.45 H new ATOM 0 HG3 GLU A 94 -8.044 -27.236 -13.769 1.00 3.45 H new ATOM 1441 N PHE A 95 -8.493 -23.850 -10.284 1.00 44.01 N ATOM 1442 CA PHE A 95 -9.397 -22.904 -9.629 1.00 72.31 C ATOM 1443 C PHE A 95 -8.642 -21.758 -8.961 1.00 71.12 C ATOM 1444 O PHE A 95 -9.089 -20.613 -8.992 1.00 11.54 O ATOM 1445 CB PHE A 95 -10.304 -23.622 -8.614 1.00 42.11 C ATOM 1446 CG PHE A 95 -9.588 -24.288 -7.468 1.00 70.43 C ATOM 1447 CD1 PHE A 95 -9.110 -25.583 -7.589 1.00 4.53 C ATOM 1448 CD2 PHE A 95 -9.410 -23.625 -6.264 1.00 33.43 C ATOM 1449 CE1 PHE A 95 -8.466 -26.202 -6.536 1.00 21.43 C ATOM 1450 CE2 PHE A 95 -8.763 -24.238 -5.208 1.00 34.54 C ATOM 1451 CZ PHE A 95 -8.291 -25.527 -5.343 1.00 23.20 C ATOM 0 H PHE A 95 -8.626 -24.820 -9.998 1.00 44.01 H new ATOM 0 HA PHE A 95 -10.024 -22.470 -10.408 1.00 72.31 H new ATOM 0 HB2 PHE A 95 -11.011 -22.898 -8.208 1.00 42.11 H new ATOM 0 HB3 PHE A 95 -10.888 -24.375 -9.143 1.00 42.11 H new ATOM 0 HD1 PHE A 95 -9.243 -26.115 -8.519 1.00 4.53 H new ATOM 0 HD2 PHE A 95 -9.781 -22.617 -6.150 1.00 33.43 H new ATOM 0 HE1 PHE A 95 -8.100 -27.212 -6.645 1.00 21.43 H new ATOM 0 HE2 PHE A 95 -8.627 -23.708 -4.277 1.00 34.54 H new ATOM 0 HZ PHE A 95 -7.786 -26.008 -4.518 1.00 23.20 H new ATOM 1461 N THR A 96 -7.493 -22.064 -8.376 1.00 60.35 N ATOM 1462 CA THR A 96 -6.679 -21.045 -7.728 1.00 22.44 C ATOM 1463 C THR A 96 -6.073 -20.095 -8.764 1.00 23.01 C ATOM 1464 O THR A 96 -6.031 -18.883 -8.562 1.00 55.33 O ATOM 1465 CB THR A 96 -5.549 -21.683 -6.906 1.00 1.24 C ATOM 1466 OG1 THR A 96 -5.872 -23.050 -6.609 1.00 60.22 O ATOM 1467 CG2 THR A 96 -5.339 -20.919 -5.607 1.00 11.11 C ATOM 0 H THR A 96 -7.104 -23.006 -8.336 1.00 60.35 H new ATOM 0 HA THR A 96 -7.331 -20.482 -7.060 1.00 22.44 H new ATOM 0 HB THR A 96 -4.631 -21.644 -7.492 1.00 1.24 H new ATOM 0 HG1 THR A 96 -5.229 -23.405 -5.960 1.00 60.22 H new ATOM 0 HG21 THR A 96 -4.535 -21.385 -5.037 1.00 11.11 H new ATOM 0 HG22 THR A 96 -5.074 -19.886 -5.831 1.00 11.11 H new ATOM 0 HG23 THR A 96 -6.258 -20.939 -5.021 1.00 11.11 H new ATOM 1475 N GLN A 97 -5.623 -20.665 -9.877 1.00 3.41 N ATOM 1476 CA GLN A 97 -5.071 -19.901 -10.982 1.00 14.24 C ATOM 1477 C GLN A 97 -6.145 -19.021 -11.609 1.00 24.33 C ATOM 1478 O GLN A 97 -5.908 -17.852 -11.916 1.00 30.20 O ATOM 1479 CB GLN A 97 -4.512 -20.869 -12.024 1.00 12.01 C ATOM 1480 CG GLN A 97 -3.168 -21.470 -11.650 1.00 62.32 C ATOM 1481 CD GLN A 97 -2.014 -20.554 -12.000 1.00 54.03 C ATOM 1482 OE1 GLN A 97 -1.599 -19.715 -11.204 1.00 20.21 O ATOM 1483 NE2 GLN A 97 -1.486 -20.715 -13.201 1.00 62.44 N ATOM 0 H GLN A 97 -5.632 -21.673 -10.035 1.00 3.41 H new ATOM 0 HA GLN A 97 -4.274 -19.256 -10.613 1.00 14.24 H new ATOM 0 HB2 GLN A 97 -5.229 -21.675 -12.178 1.00 12.01 H new ATOM 0 HB3 GLN A 97 -4.413 -20.346 -12.975 1.00 12.01 H new ATOM 0 HG2 GLN A 97 -3.151 -21.680 -10.581 1.00 62.32 H new ATOM 0 HG3 GLN A 97 -3.042 -22.423 -12.164 1.00 62.32 H new ATOM 0 HE21 GLN A 97 -1.860 -21.424 -13.832 1.00 62.44 H new ATOM 0 HE22 GLN A 97 -0.704 -20.131 -13.497 1.00 62.44 H new ATOM 1492 N ALA A 98 -7.324 -19.598 -11.789 1.00 61.12 N ATOM 1493 CA ALA A 98 -8.458 -18.876 -12.342 1.00 61.30 C ATOM 1494 C ALA A 98 -8.857 -17.726 -11.425 1.00 40.53 C ATOM 1495 O ALA A 98 -9.006 -16.592 -11.875 1.00 31.43 O ATOM 1496 CB ALA A 98 -9.632 -19.819 -12.564 1.00 74.24 C ATOM 0 H ALA A 98 -7.520 -20.572 -11.558 1.00 61.12 H new ATOM 0 HA ALA A 98 -8.166 -18.459 -13.306 1.00 61.30 H new ATOM 0 HB1 ALA A 98 -10.473 -19.262 -12.978 1.00 74.24 H new ATOM 0 HB2 ALA A 98 -9.340 -20.606 -13.259 1.00 74.24 H new ATOM 0 HB3 ALA A 98 -9.925 -20.265 -11.614 1.00 74.24 H new ATOM 1502 N TYR A 99 -9.000 -18.020 -10.137 1.00 21.10 N ATOM 1503 CA TYR A 99 -9.376 -17.013 -9.151 1.00 5.10 C ATOM 1504 C TYR A 99 -8.328 -15.912 -9.046 1.00 42.44 C ATOM 1505 O TYR A 99 -8.665 -14.747 -8.831 1.00 13.33 O ATOM 1506 CB TYR A 99 -9.603 -17.665 -7.787 1.00 12.33 C ATOM 1507 CG TYR A 99 -11.062 -17.917 -7.482 1.00 64.05 C ATOM 1508 CD1 TYR A 99 -11.756 -18.954 -8.094 1.00 60.11 C ATOM 1509 CD2 TYR A 99 -11.751 -17.105 -6.590 1.00 63.40 C ATOM 1510 CE1 TYR A 99 -13.094 -19.174 -7.824 1.00 45.14 C ATOM 1511 CE2 TYR A 99 -13.088 -17.318 -6.316 1.00 24.32 C ATOM 1512 CZ TYR A 99 -13.755 -18.353 -6.934 1.00 24.24 C ATOM 1513 OH TYR A 99 -15.090 -18.563 -6.668 1.00 63.12 O ATOM 0 H TYR A 99 -8.860 -18.953 -9.750 1.00 21.10 H new ATOM 0 HA TYR A 99 -10.306 -16.553 -9.484 1.00 5.10 H new ATOM 0 HB2 TYR A 99 -9.062 -18.611 -7.749 1.00 12.33 H new ATOM 0 HB3 TYR A 99 -9.182 -17.026 -7.011 1.00 12.33 H new ATOM 0 HD1 TYR A 99 -11.242 -19.598 -8.792 1.00 60.11 H new ATOM 0 HD2 TYR A 99 -11.232 -16.293 -6.102 1.00 63.40 H new ATOM 0 HE1 TYR A 99 -13.619 -19.985 -8.307 1.00 45.14 H new ATOM 0 HE2 TYR A 99 -13.608 -16.676 -5.620 1.00 24.32 H new ATOM 0 HH TYR A 99 -15.403 -17.898 -6.019 1.00 63.12 H new ATOM 1523 N ALA A 100 -7.063 -16.282 -9.202 1.00 2.15 N ATOM 1524 CA ALA A 100 -5.976 -15.314 -9.187 1.00 2.23 C ATOM 1525 C ALA A 100 -6.181 -14.256 -10.268 1.00 62.23 C ATOM 1526 O ALA A 100 -6.105 -13.054 -10.005 1.00 24.15 O ATOM 1527 CB ALA A 100 -4.638 -16.019 -9.377 1.00 61.44 C ATOM 0 H ALA A 100 -6.765 -17.248 -9.341 1.00 2.15 H new ATOM 0 HA ALA A 100 -5.972 -14.815 -8.218 1.00 2.23 H new ATOM 0 HB1 ALA A 100 -3.834 -15.283 -9.364 1.00 61.44 H new ATOM 0 HB2 ALA A 100 -4.487 -16.736 -8.570 1.00 61.44 H new ATOM 0 HB3 ALA A 100 -4.635 -16.542 -10.333 1.00 61.44 H new ATOM 1533 N LYS A 101 -6.470 -14.711 -11.480 1.00 44.41 N ATOM 1534 CA LYS A 101 -6.683 -13.809 -12.603 1.00 23.14 C ATOM 1535 C LYS A 101 -8.077 -13.188 -12.533 1.00 10.14 C ATOM 1536 O LYS A 101 -8.308 -12.097 -13.048 1.00 54.34 O ATOM 1537 CB LYS A 101 -6.494 -14.551 -13.930 1.00 70.20 C ATOM 1538 CG LYS A 101 -5.153 -15.266 -14.033 1.00 0.40 C ATOM 1539 CD LYS A 101 -4.887 -15.830 -15.425 1.00 62.31 C ATOM 1540 CE LYS A 101 -5.851 -16.949 -15.813 1.00 22.34 C ATOM 1541 NZ LYS A 101 -7.177 -16.438 -16.250 1.00 15.13 N ATOM 0 H LYS A 101 -6.562 -15.700 -11.710 1.00 44.41 H new ATOM 0 HA LYS A 101 -5.945 -13.009 -12.547 1.00 23.14 H new ATOM 0 HB2 LYS A 101 -7.296 -15.279 -14.049 1.00 70.20 H new ATOM 0 HB3 LYS A 101 -6.584 -13.841 -14.752 1.00 70.20 H new ATOM 0 HG2 LYS A 101 -4.355 -14.571 -13.769 1.00 0.40 H new ATOM 0 HG3 LYS A 101 -5.123 -16.077 -13.306 1.00 0.40 H new ATOM 0 HD2 LYS A 101 -4.961 -15.025 -16.157 1.00 62.31 H new ATOM 0 HD3 LYS A 101 -3.865 -16.208 -15.468 1.00 62.31 H new ATOM 0 HE2 LYS A 101 -5.411 -17.540 -16.616 1.00 22.34 H new ATOM 0 HE3 LYS A 101 -5.986 -17.618 -14.963 1.00 22.34 H new ATOM 0 HZ1 LYS A 101 -7.893 -16.674 -15.534 1.00 15.13 H new ATOM 0 HZ2 LYS A 101 -7.130 -15.406 -16.366 1.00 15.13 H new ATOM 0 HZ3 LYS A 101 -7.436 -16.876 -17.157 1.00 15.13 H new ATOM 1555 N LEU A 102 -8.997 -13.891 -11.882 1.00 64.11 N ATOM 1556 CA LEU A 102 -10.358 -13.401 -11.699 1.00 73.02 C ATOM 1557 C LEU A 102 -10.359 -12.157 -10.821 1.00 11.00 C ATOM 1558 O LEU A 102 -11.092 -11.202 -11.081 1.00 72.32 O ATOM 1559 CB LEU A 102 -11.236 -14.488 -11.068 1.00 21.11 C ATOM 1560 CG LEU A 102 -12.700 -14.102 -10.845 1.00 64.10 C ATOM 1561 CD1 LEU A 102 -13.397 -13.830 -12.170 1.00 12.20 C ATOM 1562 CD2 LEU A 102 -13.425 -15.197 -10.077 1.00 14.52 C ATOM 0 H LEU A 102 -8.823 -14.808 -11.470 1.00 64.11 H new ATOM 0 HA LEU A 102 -10.766 -13.143 -12.676 1.00 73.02 H new ATOM 0 HB2 LEU A 102 -11.204 -15.372 -11.705 1.00 21.11 H new ATOM 0 HB3 LEU A 102 -10.802 -14.770 -10.109 1.00 21.11 H new ATOM 0 HG LEU A 102 -12.725 -13.186 -10.254 1.00 64.10 H new ATOM 0 HD11 LEU A 102 -14.436 -13.558 -11.985 1.00 12.20 H new ATOM 0 HD12 LEU A 102 -12.893 -13.012 -12.685 1.00 12.20 H new ATOM 0 HD13 LEU A 102 -13.361 -14.726 -12.790 1.00 12.20 H new ATOM 0 HD21 LEU A 102 -14.465 -14.908 -9.926 1.00 14.52 H new ATOM 0 HD22 LEU A 102 -13.385 -16.127 -10.645 1.00 14.52 H new ATOM 0 HD23 LEU A 102 -12.945 -15.342 -9.109 1.00 14.52 H new ATOM 1574 N MET A 103 -9.533 -12.165 -9.780 1.00 2.22 N ATOM 1575 CA MET A 103 -9.421 -11.013 -8.899 1.00 12.31 C ATOM 1576 C MET A 103 -8.851 -9.822 -9.657 1.00 22.22 C ATOM 1577 O MET A 103 -9.344 -8.703 -9.528 1.00 24.03 O ATOM 1578 CB MET A 103 -8.547 -11.336 -7.684 1.00 14.12 C ATOM 1579 CG MET A 103 -9.160 -12.366 -6.750 1.00 44.13 C ATOM 1580 SD MET A 103 -10.774 -11.864 -6.115 1.00 25.13 S ATOM 1581 CE MET A 103 -10.340 -10.393 -5.188 1.00 31.33 C ATOM 0 H MET A 103 -8.935 -12.952 -9.528 1.00 2.22 H new ATOM 0 HA MET A 103 -10.419 -10.759 -8.543 1.00 12.31 H new ATOM 0 HB2 MET A 103 -7.580 -11.701 -8.029 1.00 14.12 H new ATOM 0 HB3 MET A 103 -8.361 -10.418 -7.127 1.00 14.12 H new ATOM 0 HG2 MET A 103 -9.262 -13.314 -7.279 1.00 44.13 H new ATOM 0 HG3 MET A 103 -8.483 -12.539 -5.913 1.00 44.13 H new ATOM 0 HE1 MET A 103 -11.164 -10.122 -4.528 1.00 31.33 H new ATOM 0 HE2 MET A 103 -9.448 -10.588 -4.593 1.00 31.33 H new ATOM 0 HE3 MET A 103 -10.144 -9.573 -5.878 1.00 31.33 H new ATOM 1591 N ASN A 104 -7.830 -10.079 -10.469 1.00 74.00 N ATOM 1592 CA ASN A 104 -7.196 -9.036 -11.276 1.00 70.01 C ATOM 1593 C ASN A 104 -8.177 -8.494 -12.315 1.00 72.42 C ATOM 1594 O ASN A 104 -8.207 -7.297 -12.594 1.00 72.21 O ATOM 1595 CB ASN A 104 -5.951 -9.589 -11.976 1.00 34.20 C ATOM 1596 CG ASN A 104 -5.184 -8.528 -12.744 1.00 13.04 C ATOM 1597 OD1 ASN A 104 -5.162 -7.355 -12.365 1.00 51.23 O ATOM 1598 ND2 ASN A 104 -4.554 -8.933 -13.836 1.00 10.12 N ATOM 0 H ASN A 104 -7.420 -11.006 -10.587 1.00 74.00 H new ATOM 0 HA ASN A 104 -6.899 -8.223 -10.614 1.00 70.01 H new ATOM 0 HB2 ASN A 104 -5.293 -10.039 -11.233 1.00 34.20 H new ATOM 0 HB3 ASN A 104 -6.248 -10.383 -12.661 1.00 34.20 H new ATOM 0 HD21 ASN A 104 -4.026 -8.265 -14.397 1.00 10.12 H new ATOM 0 HD22 ASN A 104 -4.597 -9.913 -14.116 1.00 10.12 H new ATOM 1605 N GLN A 105 -8.987 -9.395 -12.864 1.00 45.53 N ATOM 1606 CA GLN A 105 -10.008 -9.049 -13.854 1.00 42.33 C ATOM 1607 C GLN A 105 -10.940 -7.960 -13.323 1.00 74.44 C ATOM 1608 O GLN A 105 -11.358 -7.069 -14.062 1.00 41.23 O ATOM 1609 CB GLN A 105 -10.821 -10.302 -14.202 1.00 75.31 C ATOM 1610 CG GLN A 105 -10.892 -10.632 -15.689 1.00 71.24 C ATOM 1611 CD GLN A 105 -12.058 -9.974 -16.414 1.00 52.01 C ATOM 1612 OE1 GLN A 105 -12.627 -10.555 -17.339 1.00 64.55 O ATOM 1613 NE2 GLN A 105 -12.407 -8.756 -16.029 1.00 72.24 N ATOM 0 H GLN A 105 -8.955 -10.389 -12.636 1.00 45.53 H new ATOM 0 HA GLN A 105 -9.513 -8.667 -14.747 1.00 42.33 H new ATOM 0 HB2 GLN A 105 -10.390 -11.154 -13.676 1.00 75.31 H new ATOM 0 HB3 GLN A 105 -11.836 -10.175 -13.825 1.00 75.31 H new ATOM 0 HG2 GLN A 105 -9.961 -10.323 -16.164 1.00 71.24 H new ATOM 0 HG3 GLN A 105 -10.967 -11.713 -15.808 1.00 71.24 H new ATOM 0 HE21 GLN A 105 -11.914 -8.304 -15.259 1.00 72.24 H new ATOM 0 HE22 GLN A 105 -13.169 -8.270 -16.503 1.00 72.24 H new ATOM 1622 N TYR A 106 -11.263 -8.041 -12.041 1.00 63.35 N ATOM 1623 CA TYR A 106 -12.191 -7.101 -11.424 1.00 62.11 C ATOM 1624 C TYR A 106 -11.500 -5.785 -11.058 1.00 30.44 C ATOM 1625 O TYR A 106 -12.158 -4.760 -10.863 1.00 32.22 O ATOM 1626 CB TYR A 106 -12.834 -7.732 -10.183 1.00 33.53 C ATOM 1627 CG TYR A 106 -13.786 -6.811 -9.453 1.00 72.23 C ATOM 1628 CD1 TYR A 106 -14.859 -6.226 -10.114 1.00 5.10 C ATOM 1629 CD2 TYR A 106 -13.605 -6.517 -8.108 1.00 54.40 C ATOM 1630 CE1 TYR A 106 -15.724 -5.378 -9.455 1.00 51.15 C ATOM 1631 CE2 TYR A 106 -14.468 -5.669 -7.442 1.00 31.00 C ATOM 1632 CZ TYR A 106 -15.527 -5.102 -8.121 1.00 55.54 C ATOM 1633 OH TYR A 106 -16.392 -4.254 -7.465 1.00 62.01 O ATOM 0 H TYR A 106 -10.896 -8.749 -11.405 1.00 63.35 H new ATOM 0 HA TYR A 106 -12.969 -6.872 -12.152 1.00 62.11 H new ATOM 0 HB2 TYR A 106 -13.371 -8.632 -10.482 1.00 33.53 H new ATOM 0 HB3 TYR A 106 -12.047 -8.044 -9.496 1.00 33.53 H new ATOM 0 HD1 TYR A 106 -15.018 -6.439 -11.161 1.00 5.10 H new ATOM 0 HD2 TYR A 106 -12.776 -6.958 -7.574 1.00 54.40 H new ATOM 0 HE1 TYR A 106 -16.553 -4.932 -9.984 1.00 51.15 H new ATOM 0 HE2 TYR A 106 -14.315 -5.451 -6.395 1.00 31.00 H new ATOM 0 HH TYR A 106 -16.115 -4.164 -6.529 1.00 62.01 H new ATOM 1643 N ARG A 107 -10.177 -5.796 -10.980 1.00 33.54 N ATOM 1644 CA ARG A 107 -9.459 -4.600 -10.585 1.00 52.40 C ATOM 1645 C ARG A 107 -9.418 -3.604 -11.739 1.00 40.01 C ATOM 1646 O ARG A 107 -8.829 -3.869 -12.788 1.00 11.03 O ATOM 1647 CB ARG A 107 -8.038 -4.934 -10.123 1.00 21.23 C ATOM 1648 CG ARG A 107 -7.958 -6.060 -9.099 1.00 1.13 C ATOM 1649 CD ARG A 107 -9.007 -5.925 -8.000 1.00 52.34 C ATOM 1650 NE ARG A 107 -8.772 -4.782 -7.116 1.00 41.13 N ATOM 1651 CZ ARG A 107 -9.654 -4.366 -6.203 1.00 3.01 C ATOM 1652 NH1 ARG A 107 -10.834 -4.970 -6.097 1.00 43.24 N ATOM 1653 NH2 ARG A 107 -9.361 -3.347 -5.404 1.00 45.22 N ATOM 0 H ARG A 107 -9.590 -6.606 -11.182 1.00 33.54 H new ATOM 0 HA ARG A 107 -9.989 -4.150 -9.746 1.00 52.40 H new ATOM 0 HB2 ARG A 107 -7.441 -5.207 -10.993 1.00 21.23 H new ATOM 0 HB3 ARG A 107 -7.588 -4.038 -9.696 1.00 21.23 H new ATOM 0 HG2 ARG A 107 -8.087 -7.017 -9.605 1.00 1.13 H new ATOM 0 HG3 ARG A 107 -6.965 -6.069 -8.650 1.00 1.13 H new ATOM 0 HD2 ARG A 107 -9.992 -5.826 -8.457 1.00 52.34 H new ATOM 0 HD3 ARG A 107 -9.021 -6.839 -7.406 1.00 52.34 H new ATOM 0 HE ARG A 107 -7.890 -4.277 -7.202 1.00 41.13 H new ATOM 0 HH11 ARG A 107 -11.065 -5.750 -6.712 1.00 43.24 H new ATOM 0 HH12 ARG A 107 -11.508 -4.653 -5.400 1.00 43.24 H new ATOM 0 HH21 ARG A 107 -8.459 -2.878 -5.486 1.00 45.22 H new ATOM 0 HH22 ARG A 107 -10.038 -3.033 -4.709 1.00 45.22 H new ATOM 1667 N GLY A 108 -10.059 -2.469 -11.532 1.00 0.23 N ATOM 1668 CA GLY A 108 -10.079 -1.419 -12.530 1.00 34.23 C ATOM 1669 C GLY A 108 -10.050 -0.054 -11.886 1.00 21.14 C ATOM 1670 O GLY A 108 -9.332 0.840 -12.330 1.00 54.22 O ATOM 0 H GLY A 108 -10.574 -2.251 -10.679 1.00 0.23 H new ATOM 0 HA2 GLY A 108 -9.222 -1.529 -13.195 1.00 34.23 H new ATOM 0 HA3 GLY A 108 -10.974 -1.515 -13.145 1.00 34.23 H new ATOM 1674 N ILE A 109 -10.842 0.102 -10.833 1.00 21.02 N ATOM 1675 CA ILE A 109 -10.825 1.317 -10.034 1.00 43.24 C ATOM 1676 C ILE A 109 -9.467 1.454 -9.353 1.00 24.03 C ATOM 1677 O ILE A 109 -8.903 2.544 -9.257 1.00 41.43 O ATOM 1678 CB ILE A 109 -11.936 1.311 -8.956 1.00 73.52 C ATOM 1679 CG1 ILE A 109 -13.331 1.181 -9.586 1.00 41.10 C ATOM 1680 CG2 ILE A 109 -11.858 2.568 -8.107 1.00 35.24 C ATOM 1681 CD1 ILE A 109 -13.728 -0.242 -9.926 1.00 22.44 C ATOM 0 H ILE A 109 -11.507 -0.602 -10.513 1.00 21.02 H new ATOM 0 HA ILE A 109 -11.006 2.160 -10.701 1.00 43.24 H new ATOM 0 HB ILE A 109 -11.774 0.442 -8.319 1.00 73.52 H new ATOM 0 HG12 ILE A 109 -14.068 1.598 -8.900 1.00 41.10 H new ATOM 0 HG13 ILE A 109 -13.365 1.783 -10.494 1.00 41.10 H new ATOM 0 HG21 ILE A 109 -12.646 2.548 -7.354 1.00 35.24 H new ATOM 0 HG22 ILE A 109 -10.887 2.615 -7.615 1.00 35.24 H new ATOM 0 HG23 ILE A 109 -11.985 3.445 -8.742 1.00 35.24 H new ATOM 0 HD11 ILE A 109 -14.725 -0.246 -10.366 1.00 22.44 H new ATOM 0 HD12 ILE A 109 -13.015 -0.658 -10.638 1.00 22.44 H new ATOM 0 HD13 ILE A 109 -13.729 -0.846 -9.019 1.00 22.44 H new ATOM 1693 N TYR A 110 -8.945 0.330 -8.891 1.00 74.54 N ATOM 1694 CA TYR A 110 -7.608 0.281 -8.330 1.00 34.43 C ATOM 1695 C TYR A 110 -6.699 -0.507 -9.257 1.00 43.53 C ATOM 1696 O TYR A 110 -7.126 -1.495 -9.854 1.00 55.24 O ATOM 1697 CB TYR A 110 -7.630 -0.385 -6.946 1.00 33.11 C ATOM 1698 CG TYR A 110 -7.634 0.586 -5.783 1.00 15.35 C ATOM 1699 CD1 TYR A 110 -8.639 1.532 -5.633 1.00 20.12 C ATOM 1700 CD2 TYR A 110 -6.620 0.550 -4.832 1.00 12.45 C ATOM 1701 CE1 TYR A 110 -8.634 2.415 -4.568 1.00 43.04 C ATOM 1702 CE2 TYR A 110 -6.609 1.428 -3.765 1.00 52.23 C ATOM 1703 CZ TYR A 110 -7.617 2.358 -3.638 1.00 40.15 C ATOM 1704 OH TYR A 110 -7.613 3.233 -2.574 1.00 23.34 O ATOM 0 H TYR A 110 -9.432 -0.566 -8.894 1.00 74.54 H new ATOM 0 HA TYR A 110 -7.234 1.299 -8.224 1.00 34.43 H new ATOM 0 HB2 TYR A 110 -8.513 -1.020 -6.876 1.00 33.11 H new ATOM 0 HB3 TYR A 110 -6.761 -1.037 -6.856 1.00 33.11 H new ATOM 0 HD1 TYR A 110 -9.437 1.579 -6.359 1.00 20.12 H new ATOM 0 HD2 TYR A 110 -5.827 -0.177 -4.929 1.00 12.45 H new ATOM 0 HE1 TYR A 110 -9.423 3.146 -4.465 1.00 43.04 H new ATOM 0 HE2 TYR A 110 -5.814 1.385 -3.035 1.00 52.23 H new ATOM 0 HH TYR A 110 -6.829 3.060 -2.011 1.00 23.34 H new ATOM 1714 N SER A 111 -5.450 -0.084 -9.356 1.00 5.41 N ATOM 1715 CA SER A 111 -4.468 -0.790 -10.157 1.00 21.11 C ATOM 1716 C SER A 111 -3.073 -0.469 -9.646 1.00 52.32 C ATOM 1717 O SER A 111 -2.887 0.496 -8.898 1.00 44.34 O ATOM 1718 CB SER A 111 -4.602 -0.410 -11.636 1.00 52.24 C ATOM 1719 OG SER A 111 -4.437 0.984 -11.826 1.00 54.32 O ATOM 0 H SER A 111 -5.092 0.749 -8.889 1.00 5.41 H new ATOM 0 HA SER A 111 -4.642 -1.863 -10.070 1.00 21.11 H new ATOM 0 HB2 SER A 111 -3.857 -0.950 -12.221 1.00 52.24 H new ATOM 0 HB3 SER A 111 -5.581 -0.716 -12.005 1.00 52.24 H new ATOM 0 HG SER A 111 -3.507 1.173 -12.070 1.00 54.32 H new ATOM 1725 N PHE A 112 -2.104 -1.284 -10.024 1.00 61.52 N ATOM 1726 CA PHE A 112 -0.735 -1.071 -9.601 1.00 54.54 C ATOM 1727 C PHE A 112 0.148 -0.790 -10.803 1.00 14.52 C ATOM 1728 O PHE A 112 0.089 -1.498 -11.809 1.00 3.04 O ATOM 1729 CB PHE A 112 -0.227 -2.293 -8.825 1.00 11.42 C ATOM 1730 CG PHE A 112 -0.866 -3.589 -9.254 1.00 63.45 C ATOM 1731 CD1 PHE A 112 -0.397 -4.283 -10.357 1.00 32.53 C ATOM 1732 CD2 PHE A 112 -1.942 -4.109 -8.550 1.00 75.12 C ATOM 1733 CE1 PHE A 112 -0.985 -5.470 -10.750 1.00 20.11 C ATOM 1734 CE2 PHE A 112 -2.535 -5.294 -8.938 1.00 34.13 C ATOM 1735 CZ PHE A 112 -2.056 -5.976 -10.038 1.00 12.35 C ATOM 0 H PHE A 112 -2.242 -2.098 -10.623 1.00 61.52 H new ATOM 0 HA PHE A 112 -0.698 -0.205 -8.941 1.00 54.54 H new ATOM 0 HB2 PHE A 112 0.853 -2.370 -8.952 1.00 11.42 H new ATOM 0 HB3 PHE A 112 -0.413 -2.141 -7.762 1.00 11.42 H new ATOM 0 HD1 PHE A 112 0.439 -3.891 -10.917 1.00 32.53 H new ATOM 0 HD2 PHE A 112 -2.321 -3.580 -7.688 1.00 75.12 H new ATOM 0 HE1 PHE A 112 -0.608 -6.001 -11.612 1.00 20.11 H new ATOM 0 HE2 PHE A 112 -3.373 -5.687 -8.381 1.00 34.13 H new ATOM 0 HZ PHE A 112 -2.517 -6.904 -10.342 1.00 12.35 H new ATOM 1745 N GLU A 113 0.992 0.219 -10.677 1.00 3.32 N ATOM 1746 CA GLU A 113 1.831 0.662 -11.775 1.00 53.13 C ATOM 1747 C GLU A 113 3.274 0.824 -11.317 1.00 62.04 C ATOM 1748 O GLU A 113 3.541 1.341 -10.231 1.00 44.23 O ATOM 1749 CB GLU A 113 1.316 1.998 -12.336 1.00 31.34 C ATOM 1750 CG GLU A 113 0.403 1.885 -13.557 1.00 24.53 C ATOM 1751 CD GLU A 113 -0.934 1.224 -13.271 1.00 44.53 C ATOM 1752 OE1 GLU A 113 -1.746 1.810 -12.520 1.00 23.00 O ATOM 1753 OE2 GLU A 113 -1.190 0.134 -13.826 1.00 61.15 O ATOM 0 H GLU A 113 1.114 0.751 -9.816 1.00 3.32 H new ATOM 0 HA GLU A 113 1.792 -0.095 -12.558 1.00 53.13 H new ATOM 0 HB2 GLU A 113 0.776 2.521 -11.546 1.00 31.34 H new ATOM 0 HB3 GLU A 113 2.173 2.617 -12.600 1.00 31.34 H new ATOM 0 HG2 GLU A 113 0.225 2.883 -13.958 1.00 24.53 H new ATOM 0 HG3 GLU A 113 0.919 1.318 -14.332 1.00 24.53 H new ATOM 1760 N LYS A 114 4.202 0.362 -12.137 1.00 21.51 N ATOM 1761 CA LYS A 114 5.615 0.576 -11.877 1.00 74.34 C ATOM 1762 C LYS A 114 6.161 1.625 -12.837 1.00 5.23 C ATOM 1763 O LYS A 114 6.601 1.310 -13.944 1.00 74.35 O ATOM 1764 CB LYS A 114 6.410 -0.731 -12.002 1.00 14.14 C ATOM 1765 CG LYS A 114 7.914 -0.566 -11.817 1.00 33.34 C ATOM 1766 CD LYS A 114 8.271 -0.075 -10.420 1.00 0.43 C ATOM 1767 CE LYS A 114 9.767 0.176 -10.286 1.00 22.04 C ATOM 1768 NZ LYS A 114 10.146 0.603 -8.912 1.00 31.10 N ATOM 0 H LYS A 114 4.003 -0.164 -12.988 1.00 21.51 H new ATOM 0 HA LYS A 114 5.726 0.933 -10.853 1.00 74.34 H new ATOM 0 HB2 LYS A 114 6.040 -1.441 -11.262 1.00 14.14 H new ATOM 0 HB3 LYS A 114 6.221 -1.166 -12.984 1.00 14.14 H new ATOM 0 HG2 LYS A 114 8.408 -1.520 -12.002 1.00 33.34 H new ATOM 0 HG3 LYS A 114 8.294 0.139 -12.556 1.00 33.34 H new ATOM 0 HD2 LYS A 114 7.725 0.844 -10.205 1.00 0.43 H new ATOM 0 HD3 LYS A 114 7.956 -0.813 -9.682 1.00 0.43 H new ATOM 0 HE2 LYS A 114 10.310 -0.733 -10.545 1.00 22.04 H new ATOM 0 HE3 LYS A 114 10.070 0.943 -10.999 1.00 22.04 H new ATOM 0 HZ1 LYS A 114 11.173 0.762 -8.869 1.00 31.10 H new ATOM 0 HZ2 LYS A 114 9.649 1.485 -8.673 1.00 31.10 H new ATOM 0 HZ3 LYS A 114 9.882 -0.139 -8.233 1.00 31.10 H new ATOM 1782 N VAL A 115 6.085 2.875 -12.421 1.00 23.23 N ATOM 1783 CA VAL A 115 6.596 3.979 -13.213 1.00 74.24 C ATOM 1784 C VAL A 115 7.384 4.929 -12.314 1.00 54.24 C ATOM 1785 O VAL A 115 6.972 5.212 -11.188 1.00 3.24 O ATOM 1786 CB VAL A 115 5.450 4.733 -13.939 1.00 52.13 C ATOM 1787 CG1 VAL A 115 4.403 5.237 -12.949 1.00 44.22 C ATOM 1788 CG2 VAL A 115 5.998 5.880 -14.779 1.00 15.45 C ATOM 0 H VAL A 115 5.671 3.153 -11.531 1.00 23.23 H new ATOM 0 HA VAL A 115 7.258 3.579 -13.981 1.00 74.24 H new ATOM 0 HB VAL A 115 4.961 4.025 -14.609 1.00 52.13 H new ATOM 0 HG11 VAL A 115 3.614 5.761 -13.489 1.00 44.22 H new ATOM 0 HG12 VAL A 115 3.975 4.392 -12.410 1.00 44.22 H new ATOM 0 HG13 VAL A 115 4.872 5.919 -12.240 1.00 44.22 H new ATOM 0 HG21 VAL A 115 5.175 6.392 -15.277 1.00 15.45 H new ATOM 0 HG22 VAL A 115 6.526 6.583 -14.135 1.00 15.45 H new ATOM 0 HG23 VAL A 115 6.686 5.487 -15.527 1.00 15.45 H new ATOM 1798 N LYS A 116 8.529 5.391 -12.793 1.00 41.33 N ATOM 1799 CA LYS A 116 9.367 6.285 -12.014 1.00 35.25 C ATOM 1800 C LYS A 116 9.604 7.578 -12.788 1.00 70.31 C ATOM 1801 O LYS A 116 10.514 7.668 -13.610 1.00 10.54 O ATOM 1802 CB LYS A 116 10.704 5.610 -11.669 1.00 24.13 C ATOM 1803 CG LYS A 116 11.319 6.063 -10.347 1.00 40.55 C ATOM 1804 CD LYS A 116 11.617 7.555 -10.334 1.00 13.34 C ATOM 1805 CE LYS A 116 12.318 7.985 -9.053 1.00 12.13 C ATOM 1806 NZ LYS A 116 13.653 7.338 -8.903 1.00 1.04 N ATOM 0 H LYS A 116 8.897 5.161 -13.716 1.00 41.33 H new ATOM 0 HA LYS A 116 8.856 6.521 -11.080 1.00 35.25 H new ATOM 0 HB2 LYS A 116 10.554 4.531 -11.634 1.00 24.13 H new ATOM 0 HB3 LYS A 116 11.414 5.807 -12.472 1.00 24.13 H new ATOM 0 HG2 LYS A 116 10.638 5.823 -9.530 1.00 40.55 H new ATOM 0 HG3 LYS A 116 12.240 5.509 -10.168 1.00 40.55 H new ATOM 0 HD2 LYS A 116 12.241 7.808 -11.191 1.00 13.34 H new ATOM 0 HD3 LYS A 116 10.686 8.112 -10.442 1.00 13.34 H new ATOM 0 HE2 LYS A 116 12.438 9.068 -9.051 1.00 12.13 H new ATOM 0 HE3 LYS A 116 11.694 7.732 -8.196 1.00 12.13 H new ATOM 0 HZ1 LYS A 116 14.199 7.835 -8.171 1.00 1.04 H new ATOM 0 HZ2 LYS A 116 13.528 6.344 -8.626 1.00 1.04 H new ATOM 0 HZ3 LYS A 116 14.164 7.383 -9.807 1.00 1.04 H new ATOM 1820 N ALA A 117 8.756 8.561 -12.542 1.00 30.44 N ATOM 1821 CA ALA A 117 8.905 9.874 -13.149 1.00 42.13 C ATOM 1822 C ALA A 117 8.784 10.946 -12.074 1.00 44.15 C ATOM 1823 O ALA A 117 9.788 11.451 -11.573 1.00 3.32 O ATOM 1824 CB ALA A 117 7.874 10.088 -14.251 1.00 13.31 C ATOM 0 H ALA A 117 7.951 8.474 -11.922 1.00 30.44 H new ATOM 0 HA ALA A 117 9.891 9.941 -13.609 1.00 42.13 H new ATOM 0 HB1 ALA A 117 8.008 11.078 -14.688 1.00 13.31 H new ATOM 0 HB2 ALA A 117 8.004 9.330 -15.023 1.00 13.31 H new ATOM 0 HB3 ALA A 117 6.871 10.010 -13.831 1.00 13.31 H new ATOM 1830 N HIS A 118 7.552 11.259 -11.700 1.00 72.41 N ATOM 1831 CA HIS A 118 7.291 12.152 -10.573 1.00 0.44 C ATOM 1832 C HIS A 118 6.901 11.316 -9.365 1.00 24.42 C ATOM 1833 O HIS A 118 6.132 11.741 -8.510 1.00 51.21 O ATOM 1834 CB HIS A 118 6.188 13.173 -10.909 1.00 52.34 C ATOM 1835 CG HIS A 118 4.837 12.588 -11.229 1.00 61.21 C ATOM 1836 ND1 HIS A 118 4.466 12.211 -12.498 1.00 54.30 N ATOM 1837 CD2 HIS A 118 3.756 12.354 -10.442 1.00 70.44 C ATOM 1838 CE1 HIS A 118 3.222 11.773 -12.483 1.00 21.24 C ATOM 1839 NE2 HIS A 118 2.762 11.848 -11.248 1.00 43.34 N ATOM 0 H HIS A 118 6.712 10.908 -12.160 1.00 72.41 H new ATOM 0 HA HIS A 118 8.195 12.719 -10.351 1.00 0.44 H new ATOM 0 HB2 HIS A 118 6.079 13.854 -10.065 1.00 52.34 H new ATOM 0 HB3 HIS A 118 6.517 13.770 -11.760 1.00 52.34 H new ATOM 0 HD2 HIS A 118 3.688 12.532 -9.379 1.00 70.44 H new ATOM 0 HE1 HIS A 118 2.671 11.413 -13.339 1.00 21.24 H new ATOM 0 HE2 HIS A 118 1.827 11.577 -10.943 1.00 43.34 H new ATOM 1848 N SER A 119 7.481 10.129 -9.299 1.00 44.11 N ATOM 1849 CA SER A 119 7.113 9.124 -8.311 1.00 55.34 C ATOM 1850 C SER A 119 7.834 9.346 -6.980 1.00 62.42 C ATOM 1851 O SER A 119 8.090 8.397 -6.237 1.00 35.31 O ATOM 1852 CB SER A 119 7.462 7.749 -8.875 1.00 72.44 C ATOM 1853 OG SER A 119 7.107 7.671 -10.248 1.00 25.04 O ATOM 0 H SER A 119 8.224 9.832 -9.932 1.00 44.11 H new ATOM 0 HA SER A 119 6.044 9.198 -8.111 1.00 55.34 H new ATOM 0 HB2 SER A 119 8.529 7.561 -8.758 1.00 72.44 H new ATOM 0 HB3 SER A 119 6.939 6.975 -8.313 1.00 72.44 H new ATOM 0 HG SER A 119 6.845 6.752 -10.467 1.00 25.04 H new ATOM 1859 N GLY A 120 8.148 10.599 -6.687 1.00 22.13 N ATOM 1860 CA GLY A 120 8.796 10.939 -5.438 1.00 64.42 C ATOM 1861 C GLY A 120 8.116 12.114 -4.775 1.00 12.12 C ATOM 1862 O GLY A 120 8.659 13.218 -4.735 1.00 73.44 O ATOM 0 H GLY A 120 7.963 11.394 -7.299 1.00 22.13 H new ATOM 0 HA2 GLY A 120 8.777 10.079 -4.769 1.00 64.42 H new ATOM 0 HA3 GLY A 120 9.844 11.177 -5.621 1.00 64.42 H new ATOM 1866 N ASN A 121 6.910 11.881 -4.278 1.00 71.30 N ATOM 1867 CA ASN A 121 6.119 12.927 -3.648 1.00 63.31 C ATOM 1868 C ASN A 121 6.409 13.000 -2.154 1.00 34.43 C ATOM 1869 O ASN A 121 7.256 12.265 -1.638 1.00 11.21 O ATOM 1870 CB ASN A 121 4.623 12.683 -3.877 1.00 32.22 C ATOM 1871 CG ASN A 121 4.230 12.762 -5.340 1.00 1.22 C ATOM 1872 OD1 ASN A 121 4.267 11.767 -6.057 1.00 34.25 O ATOM 1873 ND2 ASN A 121 3.846 13.949 -5.793 1.00 32.51 N ATOM 0 H ASN A 121 6.455 10.968 -4.300 1.00 71.30 H new ATOM 0 HA ASN A 121 6.396 13.878 -4.104 1.00 63.31 H new ATOM 0 HB2 ASN A 121 4.356 11.701 -3.487 1.00 32.22 H new ATOM 0 HB3 ASN A 121 4.049 13.417 -3.312 1.00 32.22 H new ATOM 0 HD21 ASN A 121 3.568 14.057 -6.768 1.00 32.51 H new ATOM 0 HD22 ASN A 121 3.829 14.753 -5.166 1.00 32.51 H new ATOM 1880 N GLU A 122 5.686 13.874 -1.461 1.00 31.01 N ATOM 1881 CA GLU A 122 5.881 14.080 -0.028 1.00 13.31 C ATOM 1882 C GLU A 122 5.608 12.799 0.754 1.00 2.53 C ATOM 1883 O GLU A 122 6.263 12.514 1.759 1.00 1.24 O ATOM 1884 CB GLU A 122 4.966 15.206 0.465 1.00 5.35 C ATOM 1885 CG GLU A 122 5.153 15.566 1.930 1.00 64.11 C ATOM 1886 CD GLU A 122 4.244 16.697 2.361 1.00 12.33 C ATOM 1887 OE1 GLU A 122 4.603 17.872 2.132 1.00 11.22 O ATOM 1888 OE2 GLU A 122 3.160 16.422 2.917 1.00 41.35 O ATOM 0 H GLU A 122 4.955 14.455 -1.871 1.00 31.01 H new ATOM 0 HA GLU A 122 6.921 14.361 0.140 1.00 13.31 H new ATOM 0 HB2 GLU A 122 5.143 16.094 -0.141 1.00 5.35 H new ATOM 0 HB3 GLU A 122 3.929 14.912 0.304 1.00 5.35 H new ATOM 0 HG2 GLU A 122 4.956 14.689 2.546 1.00 64.11 H new ATOM 0 HG3 GLU A 122 6.191 15.850 2.103 1.00 64.11 H new ATOM 1895 N PHE A 123 4.650 12.020 0.278 1.00 31.32 N ATOM 1896 CA PHE A 123 4.250 10.796 0.960 1.00 71.44 C ATOM 1897 C PHE A 123 5.291 9.693 0.776 1.00 51.12 C ATOM 1898 O PHE A 123 5.426 8.805 1.618 1.00 71.21 O ATOM 1899 CB PHE A 123 2.875 10.350 0.464 1.00 70.32 C ATOM 1900 CG PHE A 123 1.808 11.382 0.710 1.00 34.54 C ATOM 1901 CD1 PHE A 123 1.190 11.477 1.947 1.00 1.52 C ATOM 1902 CD2 PHE A 123 1.434 12.265 -0.292 1.00 62.53 C ATOM 1903 CE1 PHE A 123 0.218 12.431 2.179 1.00 52.04 C ATOM 1904 CE2 PHE A 123 0.459 13.221 -0.066 1.00 50.24 C ATOM 1905 CZ PHE A 123 -0.149 13.304 1.173 1.00 71.11 C ATOM 0 H PHE A 123 4.133 12.213 -0.580 1.00 31.32 H new ATOM 0 HA PHE A 123 4.184 10.999 2.029 1.00 71.44 H new ATOM 0 HB2 PHE A 123 2.930 10.137 -0.604 1.00 70.32 H new ATOM 0 HB3 PHE A 123 2.598 9.420 0.961 1.00 70.32 H new ATOM 0 HD1 PHE A 123 1.471 10.798 2.738 1.00 1.52 H new ATOM 0 HD2 PHE A 123 1.909 12.206 -1.260 1.00 62.53 H new ATOM 0 HE1 PHE A 123 -0.255 12.494 3.148 1.00 52.04 H new ATOM 0 HE2 PHE A 123 0.174 13.900 -0.856 1.00 50.24 H new ATOM 0 HZ PHE A 123 -0.909 14.050 1.354 1.00 71.11 H new ATOM 1915 N ASN A 124 6.037 9.762 -0.318 1.00 73.11 N ATOM 1916 CA ASN A 124 7.143 8.839 -0.545 1.00 41.42 C ATOM 1917 C ASN A 124 8.261 9.135 0.446 1.00 24.00 C ATOM 1918 O ASN A 124 8.826 8.231 1.061 1.00 53.44 O ATOM 1919 CB ASN A 124 7.670 8.973 -1.976 1.00 33.40 C ATOM 1920 CG ASN A 124 6.632 8.618 -3.025 1.00 24.51 C ATOM 1921 OD1 ASN A 124 5.836 9.462 -3.435 1.00 61.25 O ATOM 1922 ND2 ASN A 124 6.646 7.378 -3.484 1.00 64.53 N ATOM 0 H ASN A 124 5.898 10.446 -1.062 1.00 73.11 H new ATOM 0 HA ASN A 124 6.786 7.819 -0.402 1.00 41.42 H new ATOM 0 HB2 ASN A 124 8.008 9.996 -2.139 1.00 33.40 H new ATOM 0 HB3 ASN A 124 8.539 8.327 -2.099 1.00 33.40 H new ATOM 0 HD21 ASN A 124 5.981 7.093 -4.203 1.00 64.53 H new ATOM 0 HD22 ASN A 124 7.322 6.707 -3.119 1.00 64.53 H new ATOM 1929 N ASP A 125 8.549 10.424 0.607 1.00 41.13 N ATOM 1930 CA ASP A 125 9.551 10.892 1.559 1.00 71.55 C ATOM 1931 C ASP A 125 9.157 10.523 2.988 1.00 43.31 C ATOM 1932 O ASP A 125 10.009 10.203 3.818 1.00 4.20 O ATOM 1933 CB ASP A 125 9.710 12.410 1.427 1.00 54.13 C ATOM 1934 CG ASP A 125 10.543 13.023 2.535 1.00 24.32 C ATOM 1935 OD1 ASP A 125 11.786 12.939 2.472 1.00 71.42 O ATOM 1936 OD2 ASP A 125 9.953 13.619 3.460 1.00 70.21 O ATOM 0 H ASP A 125 8.095 11.172 0.082 1.00 41.13 H new ATOM 0 HA ASP A 125 10.502 10.407 1.336 1.00 71.55 H new ATOM 0 HB2 ASP A 125 10.171 12.638 0.466 1.00 54.13 H new ATOM 0 HB3 ASP A 125 8.723 12.873 1.425 1.00 54.13 H new ATOM 1941 N TYR A 126 7.854 10.544 3.252 1.00 12.42 N ATOM 1942 CA TYR A 126 7.319 10.216 4.570 1.00 22.55 C ATOM 1943 C TYR A 126 7.720 8.801 4.986 1.00 53.13 C ATOM 1944 O TYR A 126 8.088 8.562 6.138 1.00 21.02 O ATOM 1945 CB TYR A 126 5.792 10.355 4.559 1.00 45.23 C ATOM 1946 CG TYR A 126 5.143 10.208 5.917 1.00 22.22 C ATOM 1947 CD1 TYR A 126 5.093 11.277 6.800 1.00 24.50 C ATOM 1948 CD2 TYR A 126 4.570 9.005 6.311 1.00 53.04 C ATOM 1949 CE1 TYR A 126 4.495 11.155 8.039 1.00 23.13 C ATOM 1950 CE2 TYR A 126 3.969 8.874 7.549 1.00 42.32 C ATOM 1951 CZ TYR A 126 3.935 9.951 8.409 1.00 71.11 C ATOM 1952 OH TYR A 126 3.336 9.829 9.643 1.00 32.53 O ATOM 0 H TYR A 126 7.142 10.787 2.563 1.00 12.42 H new ATOM 0 HA TYR A 126 7.737 10.912 5.297 1.00 22.55 H new ATOM 0 HB2 TYR A 126 5.531 11.330 4.148 1.00 45.23 H new ATOM 0 HB3 TYR A 126 5.376 9.604 3.887 1.00 45.23 H new ATOM 0 HD1 TYR A 126 5.530 12.222 6.513 1.00 24.50 H new ATOM 0 HD2 TYR A 126 4.595 8.159 5.640 1.00 53.04 H new ATOM 0 HE1 TYR A 126 4.466 11.998 8.714 1.00 23.13 H new ATOM 0 HE2 TYR A 126 3.528 7.932 7.841 1.00 42.32 H new ATOM 0 HH TYR A 126 2.990 8.919 9.750 1.00 32.53 H new ATOM 1962 N VAL A 127 7.663 7.874 4.036 1.00 73.34 N ATOM 1963 CA VAL A 127 8.001 6.483 4.306 1.00 71.54 C ATOM 1964 C VAL A 127 9.503 6.320 4.555 1.00 35.45 C ATOM 1965 O VAL A 127 9.912 5.564 5.440 1.00 74.31 O ATOM 1966 CB VAL A 127 7.541 5.562 3.147 1.00 22.11 C ATOM 1967 CG1 VAL A 127 8.089 4.152 3.309 1.00 53.14 C ATOM 1968 CG2 VAL A 127 6.023 5.533 3.065 1.00 51.43 C ATOM 0 H VAL A 127 7.386 8.062 3.072 1.00 73.34 H new ATOM 0 HA VAL A 127 7.470 6.185 5.210 1.00 71.54 H new ATOM 0 HB VAL A 127 7.938 5.971 2.218 1.00 22.11 H new ATOM 0 HG11 VAL A 127 7.748 3.532 2.480 1.00 53.14 H new ATOM 0 HG12 VAL A 127 9.179 4.183 3.314 1.00 53.14 H new ATOM 0 HG13 VAL A 127 7.734 3.729 4.249 1.00 53.14 H new ATOM 0 HG21 VAL A 127 5.715 4.882 2.247 1.00 51.43 H new ATOM 0 HG22 VAL A 127 5.615 5.155 4.002 1.00 51.43 H new ATOM 0 HG23 VAL A 127 5.649 6.541 2.887 1.00 51.43 H new ATOM 1978 N ASP A 128 10.314 7.054 3.797 1.00 5.41 N ATOM 1979 CA ASP A 128 11.773 6.986 3.931 1.00 21.34 C ATOM 1980 C ASP A 128 12.213 7.339 5.352 1.00 41.35 C ATOM 1981 O ASP A 128 12.987 6.606 5.978 1.00 1.12 O ATOM 1982 CB ASP A 128 12.450 7.931 2.933 1.00 20.43 C ATOM 1983 CG ASP A 128 13.959 7.989 3.108 1.00 73.23 C ATOM 1984 OD1 ASP A 128 14.438 8.816 3.911 1.00 14.53 O ATOM 1985 OD2 ASP A 128 14.675 7.215 2.435 1.00 64.14 O ATOM 0 H ASP A 128 9.988 7.704 3.082 1.00 5.41 H new ATOM 0 HA ASP A 128 12.077 5.961 3.717 1.00 21.34 H new ATOM 0 HB2 ASP A 128 12.219 7.607 1.918 1.00 20.43 H new ATOM 0 HB3 ASP A 128 12.036 8.933 3.050 1.00 20.43 H new ATOM 1990 N MET A 129 11.695 8.453 5.861 1.00 3.14 N ATOM 1991 CA MET A 129 12.051 8.931 7.197 1.00 20.14 C ATOM 1992 C MET A 129 11.716 7.892 8.260 1.00 53.42 C ATOM 1993 O MET A 129 12.524 7.613 9.154 1.00 24.40 O ATOM 1994 CB MET A 129 11.311 10.227 7.525 1.00 62.21 C ATOM 1995 CG MET A 129 11.582 11.363 6.557 1.00 22.43 C ATOM 1996 SD MET A 129 10.701 12.868 7.016 1.00 1.14 S ATOM 1997 CE MET A 129 9.014 12.263 7.056 1.00 53.43 C ATOM 0 H MET A 129 11.025 9.044 5.369 1.00 3.14 H new ATOM 0 HA MET A 129 13.126 9.113 7.198 1.00 20.14 H new ATOM 0 HB2 MET A 129 10.240 10.026 7.540 1.00 62.21 H new ATOM 0 HB3 MET A 129 11.590 10.547 8.529 1.00 62.21 H new ATOM 0 HG2 MET A 129 12.653 11.565 6.526 1.00 22.43 H new ATOM 0 HG3 MET A 129 11.285 11.062 5.552 1.00 22.43 H new ATOM 0 HE1 MET A 129 8.370 12.945 6.501 1.00 53.43 H new ATOM 0 HE2 MET A 129 8.972 11.273 6.602 1.00 53.43 H new ATOM 0 HE3 MET A 129 8.674 12.203 8.090 1.00 53.43 H new ATOM 2007 N LYS A 130 10.521 7.324 8.159 1.00 73.23 N ATOM 2008 CA LYS A 130 10.051 6.356 9.137 1.00 62.33 C ATOM 2009 C LYS A 130 10.896 5.086 9.068 1.00 55.43 C ATOM 2010 O LYS A 130 11.248 4.508 10.096 1.00 15.33 O ATOM 2011 CB LYS A 130 8.575 6.029 8.887 1.00 5.25 C ATOM 2012 CG LYS A 130 7.758 5.845 10.160 1.00 62.51 C ATOM 2013 CD LYS A 130 8.252 4.676 10.999 1.00 33.11 C ATOM 2014 CE LYS A 130 7.433 4.521 12.269 1.00 12.14 C ATOM 2015 NZ LYS A 130 7.878 3.363 13.090 1.00 51.24 N ATOM 0 H LYS A 130 9.860 7.519 7.407 1.00 73.23 H new ATOM 0 HA LYS A 130 10.149 6.785 10.134 1.00 62.33 H new ATOM 0 HB2 LYS A 130 8.131 6.829 8.295 1.00 5.25 H new ATOM 0 HB3 LYS A 130 8.511 5.118 8.291 1.00 5.25 H new ATOM 0 HG2 LYS A 130 7.802 6.759 10.753 1.00 62.51 H new ATOM 0 HG3 LYS A 130 6.712 5.685 9.898 1.00 62.51 H new ATOM 0 HD2 LYS A 130 8.197 3.758 10.414 1.00 33.11 H new ATOM 0 HD3 LYS A 130 9.300 4.828 11.256 1.00 33.11 H new ATOM 0 HE2 LYS A 130 7.508 5.433 12.861 1.00 12.14 H new ATOM 0 HE3 LYS A 130 6.382 4.396 12.008 1.00 12.14 H new ATOM 0 HZ1 LYS A 130 7.219 3.225 13.882 1.00 51.24 H new ATOM 0 HZ2 LYS A 130 7.895 2.506 12.501 1.00 51.24 H new ATOM 0 HZ3 LYS A 130 8.832 3.547 13.461 1.00 51.24 H new ATOM 2029 N ALA A 131 11.235 4.676 7.850 1.00 12.25 N ATOM 2030 CA ALA A 131 12.021 3.470 7.635 1.00 21.14 C ATOM 2031 C ALA A 131 13.364 3.557 8.349 1.00 0.43 C ATOM 2032 O ALA A 131 13.724 2.668 9.116 1.00 11.34 O ATOM 2033 CB ALA A 131 12.224 3.227 6.147 1.00 53.14 C ATOM 0 H ALA A 131 10.975 5.165 6.994 1.00 12.25 H new ATOM 0 HA ALA A 131 11.470 2.628 8.054 1.00 21.14 H new ATOM 0 HB1 ALA A 131 12.814 2.322 6.003 1.00 53.14 H new ATOM 0 HB2 ALA A 131 11.255 3.110 5.662 1.00 53.14 H new ATOM 0 HB3 ALA A 131 12.749 4.075 5.708 1.00 53.14 H new ATOM 2039 N LYS A 132 14.088 4.647 8.122 1.00 31.12 N ATOM 2040 CA LYS A 132 15.399 4.830 8.740 1.00 13.51 C ATOM 2041 C LYS A 132 15.287 4.899 10.259 1.00 22.54 C ATOM 2042 O LYS A 132 16.123 4.347 10.980 1.00 32.43 O ATOM 2043 CB LYS A 132 16.082 6.088 8.200 1.00 35.33 C ATOM 2044 CG LYS A 132 16.563 5.947 6.766 1.00 70.41 C ATOM 2045 CD LYS A 132 17.539 4.788 6.634 1.00 2.22 C ATOM 2046 CE LYS A 132 18.085 4.660 5.222 1.00 54.04 C ATOM 2047 NZ LYS A 132 18.843 5.867 4.808 1.00 52.23 N ATOM 0 H LYS A 132 13.793 5.414 7.518 1.00 31.12 H new ATOM 0 HA LYS A 132 16.010 3.965 8.483 1.00 13.51 H new ATOM 0 HB2 LYS A 132 15.386 6.925 8.261 1.00 35.33 H new ATOM 0 HB3 LYS A 132 16.931 6.333 8.838 1.00 35.33 H new ATOM 0 HG2 LYS A 132 15.710 5.787 6.106 1.00 70.41 H new ATOM 0 HG3 LYS A 132 17.044 6.871 6.447 1.00 70.41 H new ATOM 0 HD2 LYS A 132 18.365 4.929 7.331 1.00 2.22 H new ATOM 0 HD3 LYS A 132 17.040 3.860 6.915 1.00 2.22 H new ATOM 0 HE2 LYS A 132 18.734 3.786 5.162 1.00 54.04 H new ATOM 0 HE3 LYS A 132 17.261 4.494 4.528 1.00 54.04 H new ATOM 0 HZ1 LYS A 132 19.392 5.655 3.951 1.00 52.23 H new ATOM 0 HZ2 LYS A 132 18.179 6.643 4.611 1.00 52.23 H new ATOM 0 HZ3 LYS A 132 19.489 6.150 5.572 1.00 52.23 H new ATOM 2061 N SER A 133 14.241 5.556 10.738 1.00 24.42 N ATOM 2062 CA SER A 133 14.009 5.687 12.170 1.00 3.53 C ATOM 2063 C SER A 133 13.719 4.323 12.799 1.00 45.53 C ATOM 2064 O SER A 133 14.060 4.074 13.956 1.00 20.20 O ATOM 2065 CB SER A 133 12.850 6.655 12.421 1.00 60.24 C ATOM 2066 OG SER A 133 13.117 7.927 11.846 1.00 12.52 O ATOM 0 H SER A 133 13.537 6.008 10.154 1.00 24.42 H new ATOM 0 HA SER A 133 14.910 6.086 12.637 1.00 3.53 H new ATOM 0 HB2 SER A 133 11.932 6.246 11.999 1.00 60.24 H new ATOM 0 HB3 SER A 133 12.687 6.763 13.493 1.00 60.24 H new ATOM 0 HG SER A 133 12.931 7.897 10.884 1.00 12.52 H new ATOM 2072 N ALA A 134 13.115 3.433 12.020 1.00 31.04 N ATOM 2073 CA ALA A 134 12.770 2.104 12.502 1.00 33.23 C ATOM 2074 C ALA A 134 14.007 1.213 12.617 1.00 74.40 C ATOM 2075 O ALA A 134 14.000 0.230 13.357 1.00 11.54 O ATOM 2076 CB ALA A 134 11.727 1.467 11.600 1.00 15.31 C ATOM 0 H ALA A 134 12.854 3.610 11.050 1.00 31.04 H new ATOM 0 HA ALA A 134 12.347 2.209 13.501 1.00 33.23 H new ATOM 0 HB1 ALA A 134 11.480 0.474 11.974 1.00 15.31 H new ATOM 0 HB2 ALA A 134 10.829 2.085 11.590 1.00 15.31 H new ATOM 0 HB3 ALA A 134 12.123 1.385 10.588 1.00 15.31 H new ATOM 2082 N LEU A 135 15.069 1.565 11.894 1.00 54.43 N ATOM 2083 CA LEU A 135 16.339 0.853 12.009 1.00 20.12 C ATOM 2084 C LEU A 135 17.142 1.429 13.162 1.00 44.25 C ATOM 2085 O LEU A 135 18.181 0.894 13.543 1.00 45.11 O ATOM 2086 CB LEU A 135 17.179 0.945 10.722 1.00 30.21 C ATOM 2087 CG LEU A 135 16.868 -0.079 9.623 1.00 42.34 C ATOM 2088 CD1 LEU A 135 16.611 -1.457 10.217 1.00 72.42 C ATOM 2089 CD2 LEU A 135 15.698 0.370 8.766 1.00 73.31 C ATOM 0 H LEU A 135 15.075 2.335 11.226 1.00 54.43 H new ATOM 0 HA LEU A 135 16.107 -0.197 12.185 1.00 20.12 H new ATOM 0 HB2 LEU A 135 17.052 1.943 10.303 1.00 30.21 H new ATOM 0 HB3 LEU A 135 18.230 0.845 10.993 1.00 30.21 H new ATOM 0 HG LEU A 135 17.744 -0.148 8.978 1.00 42.34 H new ATOM 0 HD11 LEU A 135 16.393 -2.164 9.416 1.00 72.42 H new ATOM 0 HD12 LEU A 135 17.494 -1.788 10.763 1.00 72.42 H new ATOM 0 HD13 LEU A 135 15.761 -1.407 10.898 1.00 72.42 H new ATOM 0 HD21 LEU A 135 15.503 -0.377 7.997 1.00 73.31 H new ATOM 0 HD22 LEU A 135 14.813 0.487 9.391 1.00 73.31 H new ATOM 0 HD23 LEU A 135 15.937 1.323 8.294 1.00 73.31 H new ATOM 2101 N GLY A 136 16.651 2.530 13.711 1.00 52.10 N ATOM 2102 CA GLY A 136 17.358 3.202 14.775 1.00 4.45 C ATOM 2103 C GLY A 136 18.391 4.170 14.240 1.00 33.14 C ATOM 2104 O GLY A 136 19.283 4.610 14.966 1.00 31.51 O ATOM 0 H GLY A 136 15.773 2.969 13.436 1.00 52.10 H new ATOM 0 HA2 GLY A 136 16.646 3.740 15.401 1.00 4.45 H new ATOM 0 HA3 GLY A 136 17.847 2.463 15.410 1.00 4.45 H new ATOM 2108 N ILE A 137 18.268 4.503 12.965 1.00 31.01 N ATOM 2109 CA ILE A 137 19.197 5.413 12.321 1.00 54.04 C ATOM 2110 C ILE A 137 18.738 6.854 12.498 1.00 35.03 C ATOM 2111 O ILE A 137 17.695 7.251 11.979 1.00 51.14 O ATOM 2112 CB ILE A 137 19.344 5.104 10.816 1.00 63.22 C ATOM 2113 CG1 ILE A 137 19.822 3.663 10.609 1.00 63.34 C ATOM 2114 CG2 ILE A 137 20.308 6.086 10.166 1.00 64.43 C ATOM 2115 CD1 ILE A 137 19.896 3.253 9.154 1.00 12.43 C ATOM 0 H ILE A 137 17.529 4.154 12.354 1.00 31.01 H new ATOM 0 HA ILE A 137 20.168 5.276 12.797 1.00 54.04 H new ATOM 0 HB ILE A 137 18.368 5.213 10.342 1.00 63.22 H new ATOM 0 HG12 ILE A 137 20.807 3.547 11.061 1.00 63.34 H new ATOM 0 HG13 ILE A 137 19.148 2.986 11.135 1.00 63.34 H new ATOM 0 HG21 ILE A 137 20.402 5.856 9.105 1.00 64.43 H new ATOM 0 HG22 ILE A 137 19.929 7.101 10.285 1.00 64.43 H new ATOM 0 HG23 ILE A 137 21.285 6.006 10.642 1.00 64.43 H new ATOM 0 HD11 ILE A 137 20.242 2.222 9.084 1.00 12.43 H new ATOM 0 HD12 ILE A 137 18.908 3.336 8.702 1.00 12.43 H new ATOM 0 HD13 ILE A 137 20.592 3.906 8.627 1.00 12.43 H new ATOM 2127 N ARG A 138 19.512 7.623 13.246 1.00 2.22 N ATOM 2128 CA ARG A 138 19.209 9.027 13.466 1.00 60.23 C ATOM 2129 C ARG A 138 20.503 9.825 13.554 1.00 14.22 C ATOM 2130 O ARG A 138 21.593 9.241 13.587 1.00 64.33 O ATOM 2131 CB ARG A 138 18.383 9.230 14.746 1.00 4.12 C ATOM 2132 CG ARG A 138 19.165 9.029 16.038 1.00 13.31 C ATOM 2133 CD ARG A 138 19.328 7.560 16.393 1.00 64.10 C ATOM 2134 NE ARG A 138 18.137 7.012 17.046 1.00 43.45 N ATOM 2135 CZ ARG A 138 18.180 6.023 17.937 1.00 70.24 C ATOM 2136 NH1 ARG A 138 19.331 5.409 18.190 1.00 75.30 N ATOM 2137 NH2 ARG A 138 17.074 5.633 18.559 1.00 33.21 N ATOM 0 H ARG A 138 20.358 7.297 13.713 1.00 2.22 H new ATOM 0 HA ARG A 138 18.615 9.381 12.623 1.00 60.23 H new ATOM 0 HB2 ARG A 138 17.968 10.238 14.740 1.00 4.12 H new ATOM 0 HB3 ARG A 138 17.541 8.538 14.734 1.00 4.12 H new ATOM 0 HG2 ARG A 138 20.149 9.488 15.939 1.00 13.31 H new ATOM 0 HG3 ARG A 138 18.654 9.543 16.853 1.00 13.31 H new ATOM 0 HD2 ARG A 138 19.538 6.991 15.488 1.00 64.10 H new ATOM 0 HD3 ARG A 138 20.188 7.441 17.051 1.00 64.10 H new ATOM 0 HE ARG A 138 17.228 7.408 16.806 1.00 43.45 H new ATOM 0 HH11 ARG A 138 20.180 5.695 17.702 1.00 75.30 H new ATOM 0 HH12 ARG A 138 19.366 4.651 18.872 1.00 75.30 H new ATOM 0 HH21 ARG A 138 16.186 6.091 18.355 1.00 33.21 H new ATOM 0 HH22 ARG A 138 17.112 4.875 19.240 1.00 33.21 H new ATOM 2151 N ASP A 139 20.368 11.148 13.605 1.00 21.15 N ATOM 2152 CA ASP A 139 21.500 12.061 13.727 1.00 72.45 C ATOM 2153 C ASP A 139 22.514 11.844 12.618 1.00 43.11 C ATOM 2154 O ASP A 139 23.590 11.289 12.836 1.00 2.53 O ATOM 2155 CB ASP A 139 22.192 11.908 15.077 1.00 1.33 C ATOM 2156 CG ASP A 139 21.372 12.427 16.238 1.00 14.53 C ATOM 2157 OD1 ASP A 139 21.390 13.651 16.477 1.00 13.51 O ATOM 2158 OD2 ASP A 139 20.732 11.612 16.933 1.00 25.11 O ATOM 0 H ASP A 139 19.464 11.619 13.563 1.00 21.15 H new ATOM 0 HA ASP A 139 21.098 13.071 13.644 1.00 72.45 H new ATOM 0 HB2 ASP A 139 22.417 10.855 15.244 1.00 1.33 H new ATOM 0 HB3 ASP A 139 23.145 12.437 15.050 1.00 1.33 H new ATOM 2163 N LEU A 140 22.162 12.285 11.431 1.00 61.53 N ATOM 2164 CA LEU A 140 23.063 12.212 10.290 1.00 31.04 C ATOM 2165 C LEU A 140 23.878 13.493 10.216 1.00 12.24 C ATOM 2166 O LEU A 140 25.069 13.479 9.904 1.00 1.12 O ATOM 2167 CB LEU A 140 22.286 12.006 8.982 1.00 51.51 C ATOM 2168 CG LEU A 140 21.578 10.650 8.824 1.00 2.25 C ATOM 2169 CD1 LEU A 140 20.331 10.569 9.693 1.00 62.23 C ATOM 2170 CD2 LEU A 140 21.223 10.410 7.365 1.00 22.41 C ATOM 0 H LEU A 140 21.254 12.701 11.225 1.00 61.53 H new ATOM 0 HA LEU A 140 23.726 11.357 10.422 1.00 31.04 H new ATOM 0 HB2 LEU A 140 21.539 12.795 8.898 1.00 51.51 H new ATOM 0 HB3 LEU A 140 22.977 12.132 8.149 1.00 51.51 H new ATOM 0 HG LEU A 140 22.265 9.872 9.156 1.00 2.25 H new ATOM 0 HD11 LEU A 140 19.855 9.598 9.557 1.00 62.23 H new ATOM 0 HD12 LEU A 140 20.608 10.694 10.740 1.00 62.23 H new ATOM 0 HD13 LEU A 140 19.635 11.357 9.405 1.00 62.23 H new ATOM 0 HD21 LEU A 140 20.722 9.447 7.266 1.00 22.41 H new ATOM 0 HD22 LEU A 140 20.559 11.202 7.017 1.00 22.41 H new ATOM 0 HD23 LEU A 140 22.133 10.409 6.765 1.00 22.41 H new ATOM 2182 N GLU A 141 23.217 14.598 10.533 1.00 41.13 N ATOM 2183 CA GLU A 141 23.843 15.910 10.551 1.00 11.44 C ATOM 2184 C GLU A 141 24.289 16.255 11.975 1.00 14.11 C ATOM 2185 O GLU A 141 24.355 17.422 12.350 1.00 13.41 O ATOM 2186 CB GLU A 141 22.841 16.955 10.039 1.00 12.41 C ATOM 2187 CG GLU A 141 23.421 17.970 9.062 1.00 61.34 C ATOM 2188 CD GLU A 141 24.432 18.905 9.693 1.00 10.31 C ATOM 2189 OE1 GLU A 141 24.032 19.761 10.507 1.00 31.31 O ATOM 2190 OE2 GLU A 141 25.633 18.796 9.368 1.00 4.04 O ATOM 0 H GLU A 141 22.229 14.608 10.785 1.00 41.13 H new ATOM 0 HA GLU A 141 24.720 15.906 9.904 1.00 11.44 H new ATOM 0 HB2 GLU A 141 22.013 16.437 9.555 1.00 12.41 H new ATOM 0 HB3 GLU A 141 22.426 17.490 10.894 1.00 12.41 H new ATOM 0 HG2 GLU A 141 23.895 17.439 8.237 1.00 61.34 H new ATOM 0 HG3 GLU A 141 22.608 18.559 8.637 1.00 61.34 H new ATOM 2197 N HIS A 142 24.587 15.230 12.772 1.00 61.24 N ATOM 2198 CA HIS A 142 24.972 15.445 14.164 1.00 4.54 C ATOM 2199 C HIS A 142 26.373 16.044 14.248 1.00 52.54 C ATOM 2200 O HIS A 142 27.309 15.557 13.614 1.00 22.40 O ATOM 2201 CB HIS A 142 24.886 14.140 14.989 1.00 22.41 C ATOM 2202 CG HIS A 142 26.007 13.153 14.773 1.00 3.34 C ATOM 2203 ND1 HIS A 142 25.924 12.084 13.907 1.00 61.02 N ATOM 2204 CD2 HIS A 142 27.237 13.069 15.344 1.00 0.22 C ATOM 2205 CE1 HIS A 142 27.050 11.396 13.948 1.00 63.12 C ATOM 2206 NE2 HIS A 142 27.865 11.970 14.813 1.00 30.42 N ATOM 0 H HIS A 142 24.569 14.253 12.481 1.00 61.24 H new ATOM 0 HA HIS A 142 24.264 16.153 14.595 1.00 4.54 H new ATOM 0 HB2 HIS A 142 24.856 14.402 16.047 1.00 22.41 H new ATOM 0 HB3 HIS A 142 23.942 13.646 14.756 1.00 22.41 H new ATOM 0 HD1 HIS A 142 25.117 11.859 13.325 1.00 61.02 H new ATOM 0 HD2 HIS A 142 27.646 13.744 16.081 1.00 0.22 H new ATOM 0 HE1 HIS A 142 27.268 10.510 13.370 1.00 63.12 H new ATOM 2215 N HIS A 143 26.505 17.116 15.009 1.00 24.35 N ATOM 2216 CA HIS A 143 27.802 17.735 15.235 1.00 13.10 C ATOM 2217 C HIS A 143 28.264 17.468 16.658 1.00 23.13 C ATOM 2218 O HIS A 143 27.910 18.194 17.585 1.00 43.21 O ATOM 2219 CB HIS A 143 27.755 19.246 14.969 1.00 60.03 C ATOM 2220 CG HIS A 143 27.584 19.602 13.522 1.00 4.02 C ATOM 2221 ND1 HIS A 143 28.004 20.798 12.985 1.00 23.14 N ATOM 2222 CD2 HIS A 143 27.019 18.916 12.502 1.00 45.31 C ATOM 2223 CE1 HIS A 143 27.705 20.831 11.699 1.00 62.34 C ATOM 2224 NE2 HIS A 143 27.104 19.700 11.382 1.00 4.43 N ATOM 0 H HIS A 143 25.729 17.578 15.483 1.00 24.35 H new ATOM 0 HA HIS A 143 28.513 17.294 14.536 1.00 13.10 H new ATOM 0 HB2 HIS A 143 26.934 19.680 15.540 1.00 60.03 H new ATOM 0 HB3 HIS A 143 28.675 19.699 15.339 1.00 60.03 H new ATOM 0 HD2 HIS A 143 26.581 17.930 12.560 1.00 45.31 H new ATOM 0 HE1 HIS A 143 27.917 21.645 11.022 1.00 62.34 H new ATOM 0 HE2 HIS A 143 26.759 19.450 10.455 1.00 4.43 H new ATOM 2233 N HIS A 144 29.033 16.408 16.829 1.00 61.21 N ATOM 2234 CA HIS A 144 29.512 16.025 18.144 1.00 32.32 C ATOM 2235 C HIS A 144 31.022 15.863 18.105 1.00 14.20 C ATOM 2236 O HIS A 144 31.556 15.169 17.240 1.00 35.30 O ATOM 2237 CB HIS A 144 28.834 14.730 18.602 1.00 54.04 C ATOM 2238 CG HIS A 144 28.993 14.464 20.066 1.00 33.34 C ATOM 2239 ND1 HIS A 144 29.787 13.463 20.567 1.00 30.12 N ATOM 2240 CD2 HIS A 144 28.443 15.079 21.138 1.00 23.14 C ATOM 2241 CE1 HIS A 144 29.729 13.474 21.885 1.00 62.31 C ATOM 2242 NE2 HIS A 144 28.920 14.445 22.257 1.00 0.33 N ATOM 0 H HIS A 144 29.339 15.796 16.072 1.00 61.21 H new ATOM 0 HA HIS A 144 29.261 16.806 18.862 1.00 32.32 H new ATOM 0 HB2 HIS A 144 27.772 14.780 18.362 1.00 54.04 H new ATOM 0 HB3 HIS A 144 29.249 13.893 18.041 1.00 54.04 H new ATOM 0 HD1 HIS A 144 30.337 12.811 20.007 1.00 30.12 H new ATOM 0 HD2 HIS A 144 27.757 15.913 21.117 1.00 23.14 H new ATOM 0 HE1 HIS A 144 30.255 12.802 22.546 1.00 62.31 H new ATOM 2251 N HIS A 145 31.703 16.505 19.038 1.00 51.34 N ATOM 2252 CA HIS A 145 33.157 16.576 19.005 1.00 42.13 C ATOM 2253 C HIS A 145 33.794 15.368 19.680 1.00 20.20 C ATOM 2254 O HIS A 145 33.211 14.785 20.600 1.00 12.10 O ATOM 2255 CB HIS A 145 33.638 17.867 19.668 1.00 61.35 C ATOM 2256 CG HIS A 145 33.188 19.103 18.954 1.00 62.01 C ATOM 2257 ND1 HIS A 145 33.979 19.775 18.052 1.00 4.42 N ATOM 2258 CD2 HIS A 145 32.016 19.778 18.998 1.00 41.05 C ATOM 2259 CE1 HIS A 145 33.315 20.807 17.571 1.00 15.13 C ATOM 2260 NE2 HIS A 145 32.121 20.832 18.128 1.00 72.21 N ATOM 0 H HIS A 145 31.274 16.985 19.829 1.00 51.34 H new ATOM 0 HA HIS A 145 33.466 16.573 17.960 1.00 42.13 H new ATOM 0 HB2 HIS A 145 33.275 17.897 20.695 1.00 61.35 H new ATOM 0 HB3 HIS A 145 34.727 17.859 19.715 1.00 61.35 H new ATOM 0 HD2 HIS A 145 31.158 19.532 19.606 1.00 41.05 H new ATOM 0 HE1 HIS A 145 33.687 21.513 16.843 1.00 15.13 H new ATOM 0 HE2 HIS A 145 31.394 21.523 17.942 1.00 72.21 H new ATOM 2269 N HIS A 146 34.988 14.999 19.195 1.00 52.04 N ATOM 2270 CA HIS A 146 35.773 13.886 19.744 1.00 55.10 C ATOM 2271 C HIS A 146 35.151 12.534 19.383 1.00 21.34 C ATOM 2272 O HIS A 146 35.723 11.767 18.608 1.00 72.23 O ATOM 2273 CB HIS A 146 35.933 14.032 21.269 1.00 75.31 C ATOM 2274 CG HIS A 146 36.716 12.931 21.918 1.00 25.52 C ATOM 2275 ND1 HIS A 146 36.131 11.935 22.673 1.00 2.45 N ATOM 2276 CD2 HIS A 146 38.047 12.685 21.942 1.00 32.41 C ATOM 2277 CE1 HIS A 146 37.068 11.125 23.131 1.00 14.23 C ATOM 2278 NE2 HIS A 146 38.235 11.556 22.702 1.00 4.03 N ATOM 0 H HIS A 146 35.438 15.466 18.408 1.00 52.04 H new ATOM 0 HA HIS A 146 36.765 13.922 19.293 1.00 55.10 H new ATOM 0 HB2 HIS A 146 36.422 14.983 21.481 1.00 75.31 H new ATOM 0 HB3 HIS A 146 34.943 14.074 21.723 1.00 75.31 H new ATOM 0 HD2 HIS A 146 38.816 13.267 21.455 1.00 32.41 H new ATOM 0 HE1 HIS A 146 36.904 10.257 23.752 1.00 14.23 H new ATOM 0 HE2 HIS A 146 39.136 11.121 22.902 1.00 4.03 H new ATOM 2287 N HIS A 147 33.978 12.262 19.935 1.00 4.10 N ATOM 2288 CA HIS A 147 33.282 11.003 19.703 1.00 62.32 C ATOM 2289 C HIS A 147 31.839 11.135 20.159 1.00 34.41 C ATOM 2290 O HIS A 147 30.974 11.468 19.324 1.00 36.96 O ATOM 2291 CB HIS A 147 33.971 9.857 20.458 1.00 64.10 C ATOM 2292 CG HIS A 147 33.392 8.500 20.173 1.00 4.43 C ATOM 2293 ND1 HIS A 147 33.992 7.594 19.328 1.00 61.15 N ATOM 2294 CD2 HIS A 147 32.269 7.891 20.632 1.00 34.11 C ATOM 2295 CE1 HIS A 147 33.268 6.493 19.277 1.00 31.11 C ATOM 2296 NE2 HIS A 147 32.217 6.646 20.059 1.00 34.42 N ATOM 2297 OXT HIS A 147 31.585 10.947 21.364 1.00 36.96 O ATOM 0 H HIS A 147 33.483 12.904 20.554 1.00 4.10 H new ATOM 0 HA HIS A 147 33.308 10.774 18.638 1.00 62.32 H new ATOM 0 HB2 HIS A 147 35.030 9.850 20.199 1.00 64.10 H new ATOM 0 HB3 HIS A 147 33.906 10.051 21.529 1.00 64.10 H new ATOM 0 HD2 HIS A 147 31.550 8.309 21.321 1.00 34.11 H new ATOM 0 HE1 HIS A 147 33.497 5.614 18.693 1.00 31.11 H new ATOM 0 HE2 HIS A 147 31.485 5.952 20.212 1.00 34.42 H new TER 2306 HIS A 147