USER MOD reduce.3.24.130724 H: found=0, std=0, add=1218, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1215 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 123 GLN : amide:sc= 0 X(o=-0.2,f=-0.24) USER MOD Set 1.2: A 127 HIS : no HE2:sc= -0.201 X(o=-0.2,f=-0.61) USER MOD Set 2.1: A 99 ASN : amide:sc= -0.134 K(o=0.63,f=-2.3) USER MOD Set 2.2: A 101 TYR OH : rot -65:sc= 0.763 USER MOD Set 3.1: A 74 ASN : amide:sc= 1.02 K(o=2.2,f=-7.6!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 142:sc= 1.23 (180deg=0) USER MOD Single : A 3 SER OG : rot 39:sc= 0.0433 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.144 X(o=-0.14,f=0) USER MOD Single : A 13 THR OG1 : rot 7:sc= 1.39 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0576 USER MOD Single : A 21 ASN : amide:sc= -2.06! C(o=-2.1!,f=-3.6!) USER MOD Single : A 24 ASN : amide:sc= -0.357 K(o=-0.36,f=-1.2) USER MOD Single : A 25 SER OG : rot 180:sc= 0.0731 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 CYS SG : rot 41:sc= 0.522 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -131:sc= 0.688 USER MOD Single : A 48 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 54 LYS NZ :NH3+ -151:sc= 1.05 (180deg=0.301) USER MOD Single : A 59 LYS NZ :NH3+ 152:sc= 1.22 (180deg=0.534) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -0.157 X(o=-0.16,f=-0.0026) USER MOD Single : A 67 HIS : no HE2:sc= -9.29! C(o=-9.3!,f=-9.9!) USER MOD Single : A 72 ASN : amide:sc= 0.126 K(o=0.13,f=-0.4) USER MOD Single : A 77 SER OG : rot 180:sc=0.000175 USER MOD Single : A 83 LYS NZ :NH3+ -116:sc= 1.2 (180deg=-1.09) USER MOD Single : A 84 GLN : amide:sc= 0.783 K(o=0.78,f=-5.3!) USER MOD Single : A 89 TYR OH : rot 42:sc= 0.722 USER MOD Single : A 91 SER OG : rot 81:sc= 0.558 USER MOD Single : A 94 LYS NZ :NH3+ -166:sc=-0.00195 (180deg=-0.091) USER MOD Single : A 97 ASN : amide:sc= -0.0568 K(o=-0.057,f=-2.5) USER MOD Single : A 100 ASN : amide:sc= -0.128 K(o=-0.13,f=-1.5!) USER MOD Single : A 102 LYS NZ :NH3+ 165:sc= 0.631 (180deg=0.503) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -139:sc= 0.314 USER MOD Single : A 111 THR OG1 : rot -79:sc= 0.65 USER MOD Single : A 115 SER OG : rot 164:sc= 0.69 USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 118 LYS NZ :NH3+ 167:sc= 1.09 (180deg=0.954) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.00331 USER MOD Single : A 124 SER OG : rot 63:sc= 0.487 USER MOD Single : A 126 ASN : amide:sc= -0.0259 X(o=-0.026,f=-0.29) USER MOD Single : A 130 THR OG1 : rot 71:sc= 0.858 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot -53:sc= 0.93 USER MOD Single : A 142 TYR OH : rot 108:sc= 0.655 USER MOD Single : A 143 CYS SG : rot 43:sc= 0.247 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0.00751 USER MOD Single : A 153 LYS NZ :NH3+ -166:sc=-0.00967 (180deg=-0.191) USER MOD ----------------------------------------------------------------- ATOM 25 N SER A 3 -14.016 -10.224 2.820 1.00 1.80 N ATOM 26 CA SER A 3 -14.675 -9.402 1.823 1.00 1.12 C ATOM 27 C SER A 3 -13.587 -8.631 1.100 1.00 0.95 C ATOM 28 O SER A 3 -12.640 -8.176 1.744 1.00 1.03 O ATOM 29 CB SER A 3 -15.678 -8.468 2.500 1.00 1.86 C ATOM 30 OG SER A 3 -16.708 -9.231 3.102 1.00 2.21 O ATOM 0 HA SER A 3 -15.237 -10.005 1.110 1.00 1.12 H new ATOM 0 HB2 SER A 3 -15.174 -7.861 3.252 1.00 1.86 H new ATOM 0 HB3 SER A 3 -16.102 -7.781 1.768 1.00 1.86 H new ATOM 0 HG SER A 3 -16.324 -10.036 3.509 1.00 2.21 H new ATOM 36 N TYR A 4 -13.666 -8.580 -0.233 1.00 1.02 N ATOM 37 CA TYR A 4 -12.587 -8.082 -1.049 1.00 0.92 C ATOM 38 C TYR A 4 -13.208 -7.281 -2.187 1.00 0.97 C ATOM 39 O TYR A 4 -14.087 -7.797 -2.878 1.00 1.17 O ATOM 40 CB TYR A 4 -11.792 -9.281 -1.589 1.00 1.09 C ATOM 41 CG TYR A 4 -11.908 -10.563 -0.774 1.00 1.36 C ATOM 42 CD1 TYR A 4 -12.946 -11.480 -1.030 1.00 2.40 C ATOM 43 CD2 TYR A 4 -10.999 -10.825 0.262 1.00 1.86 C ATOM 44 CE1 TYR A 4 -13.029 -12.687 -0.311 1.00 2.76 C ATOM 45 CE2 TYR A 4 -11.092 -12.013 1.006 1.00 2.18 C ATOM 46 CZ TYR A 4 -12.091 -12.960 0.707 1.00 2.23 C ATOM 47 OH TYR A 4 -12.149 -14.129 1.404 1.00 2.71 O ATOM 0 H TYR A 4 -14.483 -8.885 -0.763 1.00 1.02 H new ATOM 0 HA TYR A 4 -11.908 -7.444 -0.483 1.00 0.92 H new ATOM 0 HB2 TYR A 4 -12.124 -9.486 -2.607 1.00 1.09 H new ATOM 0 HB3 TYR A 4 -10.740 -9.001 -1.647 1.00 1.09 H new ATOM 0 HD1 TYR A 4 -13.685 -11.255 -1.785 1.00 2.40 H new ATOM 0 HD2 TYR A 4 -10.223 -10.109 0.489 1.00 1.86 H new ATOM 0 HE1 TYR A 4 -13.807 -13.401 -0.537 1.00 2.76 H new ATOM 0 HE2 TYR A 4 -10.395 -12.201 1.810 1.00 2.18 H new ATOM 0 HH TYR A 4 -11.427 -14.151 2.066 1.00 2.71 H new ATOM 57 N HIS A 5 -12.755 -6.048 -2.408 1.00 0.92 N ATOM 58 CA HIS A 5 -13.303 -5.173 -3.428 1.00 1.09 C ATOM 59 C HIS A 5 -12.166 -4.656 -4.301 1.00 1.01 C ATOM 60 O HIS A 5 -11.323 -3.868 -3.882 1.00 1.25 O ATOM 61 CB HIS A 5 -14.098 -4.037 -2.784 1.00 1.23 C ATOM 62 CG HIS A 5 -15.098 -3.385 -3.709 1.00 1.59 C ATOM 63 ND1 HIS A 5 -16.292 -2.825 -3.313 1.00 2.23 N ATOM 64 CD2 HIS A 5 -15.023 -3.271 -5.075 1.00 1.40 C ATOM 65 CE1 HIS A 5 -16.920 -2.386 -4.417 1.00 2.39 C ATOM 66 NE2 HIS A 5 -16.188 -2.639 -5.514 1.00 1.89 N ATOM 0 H HIS A 5 -11.991 -5.630 -1.877 1.00 0.92 H new ATOM 0 HA HIS A 5 -13.997 -5.724 -4.062 1.00 1.09 H new ATOM 0 HB2 HIS A 5 -14.624 -4.425 -1.912 1.00 1.23 H new ATOM 0 HB3 HIS A 5 -13.402 -3.279 -2.425 1.00 1.23 H new ATOM 0 HD2 HIS A 5 -14.209 -3.610 -5.698 1.00 1.40 H new ATOM 0 HE1 HIS A 5 -17.883 -1.896 -4.421 1.00 2.39 H new ATOM 0 HE2 HIS A 5 -16.434 -2.414 -6.478 1.00 1.89 H new ATOM 74 N VAL A 6 -12.143 -5.127 -5.538 1.00 0.74 N ATOM 75 CA VAL A 6 -11.127 -4.781 -6.514 1.00 0.59 C ATOM 76 C VAL A 6 -11.633 -3.613 -7.352 1.00 0.71 C ATOM 77 O VAL A 6 -12.702 -3.702 -7.955 1.00 0.87 O ATOM 78 CB VAL A 6 -10.876 -6.026 -7.363 1.00 0.71 C ATOM 79 CG1 VAL A 6 -9.807 -5.839 -8.436 1.00 1.32 C ATOM 80 CG2 VAL A 6 -10.428 -7.151 -6.429 1.00 1.62 C ATOM 0 H VAL A 6 -12.846 -5.774 -5.897 1.00 0.74 H new ATOM 0 HA VAL A 6 -10.192 -4.472 -6.048 1.00 0.59 H new ATOM 0 HB VAL A 6 -11.807 -6.253 -7.883 1.00 0.71 H new ATOM 0 HG11 VAL A 6 -9.687 -6.767 -8.996 1.00 1.32 H new ATOM 0 HG12 VAL A 6 -10.109 -5.042 -9.115 1.00 1.32 H new ATOM 0 HG13 VAL A 6 -8.860 -5.575 -7.964 1.00 1.32 H new ATOM 0 HG21 VAL A 6 -10.242 -8.054 -7.010 1.00 1.62 H new ATOM 0 HG22 VAL A 6 -9.513 -6.855 -5.915 1.00 1.62 H new ATOM 0 HG23 VAL A 6 -11.209 -7.347 -5.695 1.00 1.62 H new ATOM 90 N VAL A 7 -10.864 -2.525 -7.407 1.00 0.73 N ATOM 91 CA VAL A 7 -11.288 -1.296 -8.074 1.00 0.92 C ATOM 92 C VAL A 7 -10.168 -0.811 -8.993 1.00 0.93 C ATOM 93 O VAL A 7 -9.091 -0.433 -8.549 1.00 1.06 O ATOM 94 CB VAL A 7 -11.701 -0.230 -7.042 1.00 1.05 C ATOM 95 CG1 VAL A 7 -12.333 0.975 -7.753 1.00 1.61 C ATOM 96 CG2 VAL A 7 -12.730 -0.785 -6.048 1.00 1.65 C ATOM 0 H VAL A 7 -9.934 -2.472 -6.992 1.00 0.73 H new ATOM 0 HA VAL A 7 -12.168 -1.492 -8.686 1.00 0.92 H new ATOM 0 HB VAL A 7 -10.800 0.068 -6.505 1.00 1.05 H new ATOM 0 HG11 VAL A 7 -12.622 1.723 -7.014 1.00 1.61 H new ATOM 0 HG12 VAL A 7 -11.611 1.408 -8.446 1.00 1.61 H new ATOM 0 HG13 VAL A 7 -13.215 0.650 -8.304 1.00 1.61 H new ATOM 0 HG21 VAL A 7 -13.001 -0.008 -5.333 1.00 1.65 H new ATOM 0 HG22 VAL A 7 -13.620 -1.108 -6.588 1.00 1.65 H new ATOM 0 HG23 VAL A 7 -12.301 -1.634 -5.516 1.00 1.65 H new ATOM 106 N ARG A 8 -10.400 -0.831 -10.304 1.00 0.88 N ATOM 107 CA ARG A 8 -9.365 -0.504 -11.276 1.00 0.91 C ATOM 108 C ARG A 8 -9.358 1.006 -11.462 1.00 0.93 C ATOM 109 O ARG A 8 -10.190 1.550 -12.181 1.00 1.03 O ATOM 110 CB ARG A 8 -9.584 -1.273 -12.596 1.00 1.05 C ATOM 111 CG ARG A 8 -10.926 -0.982 -13.290 1.00 1.54 C ATOM 112 CD ARG A 8 -11.437 -2.181 -14.104 1.00 1.97 C ATOM 113 NE ARG A 8 -12.908 -2.188 -14.132 1.00 2.96 N ATOM 114 CZ ARG A 8 -13.689 -2.594 -13.119 1.00 4.05 C ATOM 115 NH1 ARG A 8 -15.006 -2.389 -13.172 1.00 4.99 N ATOM 116 NH2 ARG A 8 -13.152 -3.181 -12.048 1.00 4.96 N ATOM 0 H ARG A 8 -11.301 -1.072 -10.717 1.00 0.88 H new ATOM 0 HA ARG A 8 -8.384 -0.816 -10.917 1.00 0.91 H new ATOM 0 HB2 ARG A 8 -8.774 -1.028 -13.283 1.00 1.05 H new ATOM 0 HB3 ARG A 8 -9.518 -2.342 -12.394 1.00 1.05 H new ATOM 0 HG2 ARG A 8 -11.669 -0.713 -12.539 1.00 1.54 H new ATOM 0 HG3 ARG A 8 -10.812 -0.121 -13.949 1.00 1.54 H new ATOM 0 HD2 ARG A 8 -11.047 -2.132 -15.121 1.00 1.97 H new ATOM 0 HD3 ARG A 8 -11.070 -3.109 -13.666 1.00 1.97 H new ATOM 0 HE ARG A 8 -13.367 -1.861 -14.982 1.00 2.96 H new ATOM 0 HH11 ARG A 8 -15.418 -1.924 -13.981 1.00 4.99 H new ATOM 0 HH12 ARG A 8 -15.601 -2.697 -12.403 1.00 4.99 H new ATOM 0 HH21 ARG A 8 -12.143 -3.323 -11.996 1.00 4.96 H new ATOM 0 HH22 ARG A 8 -13.750 -3.488 -11.281 1.00 4.96 H new ATOM 130 N GLY A 9 -8.430 1.684 -10.795 1.00 0.93 N ATOM 131 CA GLY A 9 -8.256 3.110 -10.893 1.00 0.97 C ATOM 132 C GLY A 9 -6.853 3.453 -10.420 1.00 0.93 C ATOM 133 O GLY A 9 -6.001 2.578 -10.264 1.00 1.10 O ATOM 0 H GLY A 9 -7.768 1.238 -10.160 1.00 0.93 H new ATOM 0 HA2 GLY A 9 -8.401 3.440 -11.921 1.00 0.97 H new ATOM 0 HA3 GLY A 9 -8.999 3.626 -10.284 1.00 0.97 H new ATOM 137 N ASP A 10 -6.639 4.740 -10.194 1.00 0.94 N ATOM 138 CA ASP A 10 -5.377 5.329 -9.798 1.00 0.92 C ATOM 139 C ASP A 10 -5.394 5.621 -8.307 1.00 0.78 C ATOM 140 O ASP A 10 -6.443 5.744 -7.678 1.00 0.73 O ATOM 141 CB ASP A 10 -5.137 6.639 -10.569 1.00 1.07 C ATOM 142 CG ASP A 10 -4.290 6.396 -11.811 1.00 1.45 C ATOM 143 OD1 ASP A 10 -3.147 5.932 -11.611 1.00 2.57 O ATOM 144 OD2 ASP A 10 -4.784 6.690 -12.921 1.00 2.43 O ATOM 0 H ASP A 10 -7.381 5.434 -10.288 1.00 0.94 H new ATOM 0 HA ASP A 10 -4.575 4.627 -10.026 1.00 0.92 H new ATOM 0 HB2 ASP A 10 -6.093 7.076 -10.857 1.00 1.07 H new ATOM 0 HB3 ASP A 10 -4.639 7.360 -9.921 1.00 1.07 H new ATOM 149 N ILE A 11 -4.201 5.812 -7.756 1.00 0.79 N ATOM 150 CA ILE A 11 -3.996 6.191 -6.365 1.00 0.77 C ATOM 151 C ILE A 11 -4.684 7.518 -6.068 1.00 0.76 C ATOM 152 O ILE A 11 -5.341 7.668 -5.045 1.00 0.74 O ATOM 153 CB ILE A 11 -2.479 6.229 -6.088 1.00 0.84 C ATOM 154 CG1 ILE A 11 -1.890 4.800 -6.162 1.00 1.63 C ATOM 155 CG2 ILE A 11 -2.116 6.882 -4.743 1.00 1.68 C ATOM 156 CD1 ILE A 11 -0.611 4.714 -6.984 1.00 3.16 C ATOM 0 H ILE A 11 -3.330 5.705 -8.277 1.00 0.79 H new ATOM 0 HA ILE A 11 -4.447 5.459 -5.695 1.00 0.77 H new ATOM 0 HB ILE A 11 -2.039 6.857 -6.863 1.00 0.84 H new ATOM 0 HG12 ILE A 11 -1.688 4.446 -5.151 1.00 1.63 H new ATOM 0 HG13 ILE A 11 -2.635 4.130 -6.592 1.00 1.63 H new ATOM 0 HG21 ILE A 11 -1.034 6.874 -4.615 1.00 1.68 H new ATOM 0 HG22 ILE A 11 -2.475 7.911 -4.729 1.00 1.68 H new ATOM 0 HG23 ILE A 11 -2.582 6.324 -3.930 1.00 1.68 H new ATOM 0 HD11 ILE A 11 -0.253 3.684 -6.994 1.00 3.16 H new ATOM 0 HD12 ILE A 11 -0.812 5.038 -8.005 1.00 3.16 H new ATOM 0 HD13 ILE A 11 0.149 5.358 -6.542 1.00 3.16 H new ATOM 168 N ALA A 12 -4.561 8.489 -6.969 1.00 0.86 N ATOM 169 CA ALA A 12 -5.150 9.806 -6.772 1.00 0.94 C ATOM 170 C ALA A 12 -6.672 9.774 -6.946 1.00 0.88 C ATOM 171 O ALA A 12 -7.324 10.806 -6.800 1.00 0.92 O ATOM 172 CB ALA A 12 -4.511 10.817 -7.724 1.00 1.16 C ATOM 0 H ALA A 12 -4.054 8.385 -7.848 1.00 0.86 H new ATOM 0 HA ALA A 12 -4.949 10.117 -5.747 1.00 0.94 H new ATOM 0 HB1 ALA A 12 -4.959 11.798 -7.567 1.00 1.16 H new ATOM 0 HB2 ALA A 12 -3.440 10.873 -7.530 1.00 1.16 H new ATOM 0 HB3 ALA A 12 -4.677 10.502 -8.754 1.00 1.16 H new ATOM 178 N THR A 13 -7.242 8.605 -7.247 1.00 0.84 N ATOM 179 CA THR A 13 -8.679 8.395 -7.317 1.00 0.82 C ATOM 180 C THR A 13 -9.126 7.288 -6.358 1.00 0.76 C ATOM 181 O THR A 13 -10.277 6.871 -6.414 1.00 0.78 O ATOM 182 CB THR A 13 -9.074 8.069 -8.764 1.00 0.90 C ATOM 183 OG1 THR A 13 -8.337 6.968 -9.257 1.00 0.96 O ATOM 184 CG2 THR A 13 -8.792 9.255 -9.689 1.00 0.98 C ATOM 0 H THR A 13 -6.701 7.765 -7.452 1.00 0.84 H new ATOM 0 HA THR A 13 -9.186 9.309 -7.007 1.00 0.82 H new ATOM 0 HB THR A 13 -10.139 7.838 -8.752 1.00 0.90 H new ATOM 0 HG1 THR A 13 -7.805 6.579 -8.532 1.00 0.96 H new ATOM 0 HG21 THR A 13 -9.081 8.998 -10.708 1.00 0.98 H new ATOM 0 HG22 THR A 13 -9.366 10.120 -9.357 1.00 0.98 H new ATOM 0 HG23 THR A 13 -7.729 9.493 -9.662 1.00 0.98 H new ATOM 192 N ALA A 14 -8.244 6.800 -5.480 1.00 0.73 N ATOM 193 CA ALA A 14 -8.549 5.730 -4.540 1.00 0.68 C ATOM 194 C ALA A 14 -9.190 6.333 -3.295 1.00 0.63 C ATOM 195 O ALA A 14 -8.698 6.187 -2.182 1.00 0.68 O ATOM 196 CB ALA A 14 -7.255 4.986 -4.202 1.00 0.70 C ATOM 0 H ALA A 14 -7.287 7.145 -5.406 1.00 0.73 H new ATOM 0 HA ALA A 14 -9.251 5.018 -4.974 1.00 0.68 H new ATOM 0 HB1 ALA A 14 -7.471 4.182 -3.498 1.00 0.70 H new ATOM 0 HB2 ALA A 14 -6.828 4.566 -5.113 1.00 0.70 H new ATOM 0 HB3 ALA A 14 -6.543 5.679 -3.754 1.00 0.70 H new ATOM 202 N THR A 15 -10.273 7.079 -3.464 1.00 0.65 N ATOM 203 CA THR A 15 -10.871 7.873 -2.407 1.00 0.67 C ATOM 204 C THR A 15 -11.743 7.034 -1.466 1.00 0.62 C ATOM 205 O THR A 15 -12.789 7.503 -1.019 1.00 0.64 O ATOM 206 CB THR A 15 -11.647 9.022 -3.062 1.00 0.77 C ATOM 207 OG1 THR A 15 -12.410 8.547 -4.150 1.00 1.22 O ATOM 208 CG2 THR A 15 -10.674 10.079 -3.591 1.00 1.21 C ATOM 0 H THR A 15 -10.766 7.149 -4.354 1.00 0.65 H new ATOM 0 HA THR A 15 -10.088 8.281 -1.767 1.00 0.67 H new ATOM 0 HB THR A 15 -12.304 9.455 -2.308 1.00 0.77 H new ATOM 0 HG1 THR A 15 -12.900 9.292 -4.556 1.00 1.22 H new ATOM 0 HG21 THR A 15 -11.235 10.891 -4.054 1.00 1.21 H new ATOM 0 HG22 THR A 15 -10.081 10.473 -2.766 1.00 1.21 H new ATOM 0 HG23 THR A 15 -10.013 9.627 -4.330 1.00 1.21 H new ATOM 216 N GLU A 16 -11.291 5.841 -1.079 1.00 0.62 N ATOM 217 CA GLU A 16 -11.929 4.923 -0.139 1.00 0.65 C ATOM 218 C GLU A 16 -11.718 5.368 1.315 1.00 0.72 C ATOM 219 O GLU A 16 -11.444 4.569 2.208 1.00 0.84 O ATOM 220 CB GLU A 16 -11.314 3.538 -0.371 1.00 0.65 C ATOM 221 CG GLU A 16 -11.982 2.780 -1.521 1.00 0.87 C ATOM 222 CD GLU A 16 -11.929 3.554 -2.838 1.00 2.10 C ATOM 223 OE1 GLU A 16 -13.017 3.806 -3.399 1.00 2.81 O ATOM 224 OE2 GLU A 16 -10.802 3.921 -3.244 1.00 3.41 O ATOM 0 H GLU A 16 -10.412 5.467 -1.438 1.00 0.62 H new ATOM 0 HA GLU A 16 -13.006 4.906 -0.307 1.00 0.65 H new ATOM 0 HB2 GLU A 16 -10.251 3.648 -0.583 1.00 0.65 H new ATOM 0 HB3 GLU A 16 -11.397 2.950 0.543 1.00 0.65 H new ATOM 0 HG2 GLU A 16 -11.492 1.815 -1.650 1.00 0.87 H new ATOM 0 HG3 GLU A 16 -13.022 2.577 -1.263 1.00 0.87 H new ATOM 231 N GLY A 17 -11.787 6.669 1.578 1.00 0.72 N ATOM 232 CA GLY A 17 -11.472 7.237 2.877 1.00 0.77 C ATOM 233 C GLY A 17 -9.963 7.358 3.077 1.00 0.70 C ATOM 234 O GLY A 17 -9.498 8.378 3.581 1.00 0.76 O ATOM 0 H GLY A 17 -12.067 7.363 0.885 1.00 0.72 H new ATOM 0 HA2 GLY A 17 -11.933 8.220 2.968 1.00 0.77 H new ATOM 0 HA3 GLY A 17 -11.896 6.612 3.663 1.00 0.77 H new ATOM 238 N VAL A 18 -9.211 6.326 2.690 1.00 0.64 N ATOM 239 CA VAL A 18 -7.845 6.079 3.099 1.00 0.65 C ATOM 240 C VAL A 18 -7.074 5.637 1.862 1.00 0.58 C ATOM 241 O VAL A 18 -7.570 4.813 1.096 1.00 0.67 O ATOM 242 CB VAL A 18 -7.846 4.958 4.150 1.00 0.84 C ATOM 243 CG1 VAL A 18 -6.471 4.815 4.809 1.00 0.73 C ATOM 244 CG2 VAL A 18 -8.881 5.217 5.247 1.00 1.48 C ATOM 0 H VAL A 18 -9.563 5.612 2.053 1.00 0.64 H new ATOM 0 HA VAL A 18 -7.386 6.969 3.530 1.00 0.65 H new ATOM 0 HB VAL A 18 -8.099 4.039 3.621 1.00 0.84 H new ATOM 0 HG11 VAL A 18 -6.503 4.014 5.548 1.00 0.73 H new ATOM 0 HG12 VAL A 18 -5.726 4.578 4.049 1.00 0.73 H new ATOM 0 HG13 VAL A 18 -6.204 5.751 5.300 1.00 0.73 H new ATOM 0 HG21 VAL A 18 -8.853 4.404 5.973 1.00 1.48 H new ATOM 0 HG22 VAL A 18 -8.653 6.158 5.748 1.00 1.48 H new ATOM 0 HG23 VAL A 18 -9.875 5.274 4.803 1.00 1.48 H new ATOM 254 N ILE A 19 -5.869 6.175 1.683 1.00 0.55 N ATOM 255 CA ILE A 19 -5.000 5.915 0.546 1.00 0.63 C ATOM 256 C ILE A 19 -3.642 5.550 1.117 1.00 0.62 C ATOM 257 O ILE A 19 -3.211 6.204 2.061 1.00 0.59 O ATOM 258 CB ILE A 19 -4.925 7.177 -0.339 1.00 0.70 C ATOM 259 CG1 ILE A 19 -6.307 7.390 -0.963 1.00 0.61 C ATOM 260 CG2 ILE A 19 -3.867 7.045 -1.446 1.00 1.05 C ATOM 261 CD1 ILE A 19 -6.452 8.636 -1.841 1.00 1.26 C ATOM 0 H ILE A 19 -5.460 6.827 2.352 1.00 0.55 H new ATOM 0 HA ILE A 19 -5.371 5.104 -0.081 1.00 0.63 H new ATOM 0 HB ILE A 19 -4.633 8.027 0.277 1.00 0.70 H new ATOM 0 HG12 ILE A 19 -6.554 6.514 -1.563 1.00 0.61 H new ATOM 0 HG13 ILE A 19 -7.043 7.445 -0.161 1.00 0.61 H new ATOM 0 HG21 ILE A 19 -3.850 7.956 -2.044 1.00 1.05 H new ATOM 0 HG22 ILE A 19 -2.887 6.888 -0.996 1.00 1.05 H new ATOM 0 HG23 ILE A 19 -4.113 6.197 -2.085 1.00 1.05 H new ATOM 0 HD11 ILE A 19 -7.468 8.690 -2.232 1.00 1.26 H new ATOM 0 HD12 ILE A 19 -6.244 9.526 -1.247 1.00 1.26 H new ATOM 0 HD13 ILE A 19 -5.747 8.581 -2.670 1.00 1.26 H new ATOM 273 N ILE A 20 -2.967 4.537 0.567 1.00 0.67 N ATOM 274 CA ILE A 20 -1.655 4.123 1.038 1.00 0.63 C ATOM 275 C ILE A 20 -0.693 4.182 -0.144 1.00 0.69 C ATOM 276 O ILE A 20 -0.972 3.658 -1.220 1.00 0.80 O ATOM 277 CB ILE A 20 -1.698 2.718 1.676 1.00 0.63 C ATOM 278 CG1 ILE A 20 -2.544 2.679 2.961 1.00 0.71 C ATOM 279 CG2 ILE A 20 -0.286 2.277 2.091 1.00 0.72 C ATOM 280 CD1 ILE A 20 -4.024 2.410 2.737 1.00 0.65 C ATOM 0 H ILE A 20 -3.319 3.986 -0.216 1.00 0.67 H new ATOM 0 HA ILE A 20 -1.312 4.796 1.824 1.00 0.63 H new ATOM 0 HB ILE A 20 -2.132 2.064 0.920 1.00 0.63 H new ATOM 0 HG12 ILE A 20 -2.144 1.909 3.620 1.00 0.71 H new ATOM 0 HG13 ILE A 20 -2.436 3.631 3.481 1.00 0.71 H new ATOM 0 HG21 ILE A 20 -0.332 1.285 2.539 1.00 0.72 H new ATOM 0 HG22 ILE A 20 0.359 2.249 1.213 1.00 0.72 H new ATOM 0 HG23 ILE A 20 0.118 2.984 2.816 1.00 0.72 H new ATOM 0 HD11 ILE A 20 -4.541 2.400 3.696 1.00 0.65 H new ATOM 0 HD12 ILE A 20 -4.445 3.193 2.106 1.00 0.65 H new ATOM 0 HD13 ILE A 20 -4.148 1.444 2.248 1.00 0.65 H new ATOM 292 N ASN A 21 0.473 4.783 0.070 1.00 0.66 N ATOM 293 CA ASN A 21 1.535 4.797 -0.924 1.00 0.72 C ATOM 294 C ASN A 21 2.802 4.221 -0.319 1.00 0.61 C ATOM 295 O ASN A 21 3.177 4.600 0.789 1.00 0.75 O ATOM 296 CB ASN A 21 1.784 6.224 -1.427 1.00 0.89 C ATOM 297 CG ASN A 21 0.852 6.553 -2.578 1.00 1.18 C ATOM 298 OD1 ASN A 21 -0.035 7.386 -2.455 1.00 2.92 O ATOM 299 ND2 ASN A 21 1.040 5.889 -3.713 1.00 1.75 N ATOM 0 H ASN A 21 0.706 5.272 0.935 1.00 0.66 H new ATOM 0 HA ASN A 21 1.233 4.186 -1.775 1.00 0.72 H new ATOM 0 HB2 ASN A 21 1.632 6.934 -0.614 1.00 0.89 H new ATOM 0 HB3 ASN A 21 2.820 6.326 -1.750 1.00 0.89 H new ATOM 0 HD21 ASN A 21 0.435 6.068 -4.515 1.00 1.75 H new ATOM 0 HD22 ASN A 21 1.789 5.200 -3.783 1.00 1.75 H new ATOM 306 N ALA A 22 3.473 3.335 -1.062 1.00 0.63 N ATOM 307 CA ALA A 22 4.793 2.827 -0.719 1.00 0.73 C ATOM 308 C ALA A 22 5.837 3.900 -1.014 1.00 1.09 C ATOM 309 O ALA A 22 6.555 3.838 -2.014 1.00 2.46 O ATOM 310 CB ALA A 22 5.089 1.571 -1.527 1.00 1.17 C ATOM 0 H ALA A 22 3.103 2.949 -1.931 1.00 0.63 H new ATOM 0 HA ALA A 22 4.824 2.576 0.341 1.00 0.73 H new ATOM 0 HB1 ALA A 22 6.078 1.195 -1.266 1.00 1.17 H new ATOM 0 HB2 ALA A 22 4.341 0.810 -1.304 1.00 1.17 H new ATOM 0 HB3 ALA A 22 5.060 1.807 -2.591 1.00 1.17 H new ATOM 316 N ALA A 23 5.876 4.911 -0.154 1.00 0.64 N ATOM 317 CA ALA A 23 6.731 6.073 -0.312 1.00 1.00 C ATOM 318 C ALA A 23 8.116 5.813 0.282 1.00 0.77 C ATOM 319 O ALA A 23 9.087 6.479 -0.070 1.00 0.78 O ATOM 320 CB ALA A 23 6.029 7.296 0.272 1.00 1.78 C ATOM 0 H ALA A 23 5.301 4.943 0.688 1.00 0.64 H new ATOM 0 HA ALA A 23 6.903 6.276 -1.369 1.00 1.00 H new ATOM 0 HB1 ALA A 23 6.667 8.172 0.156 1.00 1.78 H new ATOM 0 HB2 ALA A 23 5.088 7.461 -0.253 1.00 1.78 H new ATOM 0 HB3 ALA A 23 5.830 7.130 1.331 1.00 1.78 H new ATOM 326 N ASN A 24 8.238 4.772 1.104 1.00 0.75 N ATOM 327 CA ASN A 24 9.512 4.251 1.582 1.00 0.73 C ATOM 328 C ASN A 24 10.075 5.196 2.641 1.00 0.83 C ATOM 329 O ASN A 24 9.541 6.273 2.887 1.00 0.91 O ATOM 330 CB ASN A 24 10.532 4.038 0.444 1.00 0.74 C ATOM 331 CG ASN A 24 9.914 3.427 -0.806 1.00 1.21 C ATOM 332 OD1 ASN A 24 9.698 2.229 -0.861 1.00 1.45 O ATOM 333 ND2 ASN A 24 9.620 4.224 -1.825 1.00 1.94 N ATOM 0 H ASN A 24 7.434 4.257 1.463 1.00 0.75 H new ATOM 0 HA ASN A 24 9.330 3.269 2.018 1.00 0.73 H new ATOM 0 HB2 ASN A 24 10.986 4.995 0.187 1.00 0.74 H new ATOM 0 HB3 ASN A 24 11.334 3.391 0.799 1.00 0.74 H new ATOM 0 HD21 ASN A 24 9.206 3.836 -2.673 1.00 1.94 H new ATOM 0 HD22 ASN A 24 9.808 5.224 -1.761 1.00 1.94 H new ATOM 340 N SER A 25 11.222 4.871 3.223 1.00 0.96 N ATOM 341 CA SER A 25 11.892 5.788 4.135 1.00 1.20 C ATOM 342 C SER A 25 12.309 7.101 3.457 1.00 1.19 C ATOM 343 O SER A 25 12.728 8.033 4.133 1.00 1.38 O ATOM 344 CB SER A 25 13.096 5.068 4.730 1.00 1.45 C ATOM 345 OG SER A 25 13.744 4.304 3.724 1.00 1.68 O ATOM 0 H SER A 25 11.706 3.984 3.081 1.00 0.96 H new ATOM 0 HA SER A 25 11.194 6.075 4.921 1.00 1.20 H new ATOM 0 HB2 SER A 25 13.791 5.792 5.154 1.00 1.45 H new ATOM 0 HB3 SER A 25 12.777 4.418 5.544 1.00 1.45 H new ATOM 0 HG SER A 25 14.518 3.844 4.110 1.00 1.68 H new ATOM 351 N LYS A 26 12.199 7.193 2.128 1.00 1.12 N ATOM 352 CA LYS A 26 12.509 8.380 1.342 1.00 1.29 C ATOM 353 C LYS A 26 11.294 9.296 1.172 1.00 1.23 C ATOM 354 O LYS A 26 11.449 10.412 0.689 1.00 1.40 O ATOM 355 CB LYS A 26 13.030 7.926 -0.027 1.00 1.33 C ATOM 356 CG LYS A 26 14.417 7.280 0.122 1.00 1.62 C ATOM 357 CD LYS A 26 14.818 6.533 -1.153 1.00 1.82 C ATOM 358 CE LYS A 26 14.221 5.120 -1.120 1.00 2.05 C ATOM 359 NZ LYS A 26 14.207 4.485 -2.454 1.00 2.44 N ATOM 0 H LYS A 26 11.880 6.412 1.554 1.00 1.12 H new ATOM 0 HA LYS A 26 13.265 8.962 1.869 1.00 1.29 H new ATOM 0 HB2 LYS A 26 12.335 7.214 -0.471 1.00 1.33 H new ATOM 0 HB3 LYS A 26 13.088 8.779 -0.703 1.00 1.33 H new ATOM 0 HG2 LYS A 26 15.157 8.048 0.345 1.00 1.62 H new ATOM 0 HG3 LYS A 26 14.411 6.589 0.965 1.00 1.62 H new ATOM 0 HD2 LYS A 26 14.461 7.071 -2.031 1.00 1.82 H new ATOM 0 HD3 LYS A 26 15.904 6.480 -1.231 1.00 1.82 H new ATOM 0 HE2 LYS A 26 14.796 4.501 -0.432 1.00 2.05 H new ATOM 0 HE3 LYS A 26 13.204 5.167 -0.732 1.00 2.05 H new ATOM 0 HZ1 LYS A 26 13.795 3.533 -2.381 1.00 2.44 H new ATOM 0 HZ2 LYS A 26 13.636 5.060 -3.106 1.00 2.44 H new ATOM 0 HZ3 LYS A 26 15.180 4.415 -2.815 1.00 2.44 H new ATOM 373 N GLY A 27 10.084 8.833 1.494 1.00 1.11 N ATOM 374 CA GLY A 27 8.872 9.624 1.344 1.00 1.19 C ATOM 375 C GLY A 27 8.435 9.764 -0.116 1.00 1.17 C ATOM 376 O GLY A 27 7.514 10.522 -0.412 1.00 1.35 O ATOM 0 H GLY A 27 9.922 7.897 1.866 1.00 1.11 H new ATOM 0 HA2 GLY A 27 8.068 9.162 1.917 1.00 1.19 H new ATOM 0 HA3 GLY A 27 9.035 10.615 1.767 1.00 1.19 H new ATOM 380 N GLN A 28 9.053 9.029 -1.040 1.00 1.06 N ATOM 381 CA GLN A 28 8.830 9.170 -2.466 1.00 1.16 C ATOM 382 C GLN A 28 8.368 7.826 -3.035 1.00 1.09 C ATOM 383 O GLN A 28 9.105 6.843 -2.948 1.00 1.08 O ATOM 384 CB GLN A 28 10.130 9.666 -3.107 1.00 1.36 C ATOM 385 CG GLN A 28 9.925 9.921 -4.598 1.00 1.36 C ATOM 386 CD GLN A 28 11.116 10.657 -5.200 1.00 1.70 C ATOM 387 OE1 GLN A 28 12.199 10.103 -5.331 1.00 2.17 O ATOM 388 NE2 GLN A 28 10.939 11.919 -5.573 1.00 2.78 N ATOM 0 H GLN A 28 9.735 8.307 -0.807 1.00 1.06 H new ATOM 0 HA GLN A 28 8.048 9.898 -2.682 1.00 1.16 H new ATOM 0 HB2 GLN A 28 10.458 10.583 -2.617 1.00 1.36 H new ATOM 0 HB3 GLN A 28 10.919 8.928 -2.963 1.00 1.36 H new ATOM 0 HG2 GLN A 28 9.781 8.973 -5.115 1.00 1.36 H new ATOM 0 HG3 GLN A 28 9.018 10.507 -4.748 1.00 1.36 H new ATOM 0 HE21 GLN A 28 10.028 12.363 -5.455 1.00 2.78 H new ATOM 0 HE22 GLN A 28 11.714 12.445 -5.977 1.00 2.78 H new ATOM 397 N PRO A 29 7.150 7.750 -3.593 1.00 1.08 N ATOM 398 CA PRO A 29 6.580 6.505 -4.077 1.00 1.00 C ATOM 399 C PRO A 29 7.338 6.001 -5.297 1.00 1.03 C ATOM 400 O PRO A 29 7.602 6.751 -6.235 1.00 1.28 O ATOM 401 CB PRO A 29 5.108 6.798 -4.366 1.00 1.02 C ATOM 402 CG PRO A 29 5.089 8.299 -4.642 1.00 1.25 C ATOM 403 CD PRO A 29 6.198 8.835 -3.740 1.00 1.20 C ATOM 0 HA PRO A 29 6.661 5.703 -3.343 1.00 1.00 H new ATOM 0 HB2 PRO A 29 4.746 6.228 -5.222 1.00 1.02 H new ATOM 0 HB3 PRO A 29 4.473 6.538 -3.519 1.00 1.02 H new ATOM 0 HG2 PRO A 29 5.283 8.518 -5.692 1.00 1.25 H new ATOM 0 HG3 PRO A 29 4.123 8.741 -4.398 1.00 1.25 H new ATOM 0 HD2 PRO A 29 6.671 9.712 -4.181 1.00 1.20 H new ATOM 0 HD3 PRO A 29 5.801 9.140 -2.772 1.00 1.20 H new ATOM 411 N GLY A 30 7.681 4.713 -5.280 1.00 0.94 N ATOM 412 CA GLY A 30 8.455 4.106 -6.345 1.00 1.05 C ATOM 413 C GLY A 30 7.610 3.979 -7.608 1.00 1.34 C ATOM 414 O GLY A 30 6.672 3.188 -7.643 1.00 2.00 O ATOM 0 H GLY A 30 7.428 4.070 -4.529 1.00 0.94 H new ATOM 0 HA2 GLY A 30 9.339 4.709 -6.550 1.00 1.05 H new ATOM 0 HA3 GLY A 30 8.806 3.122 -6.034 1.00 1.05 H new ATOM 418 N GLY A 31 7.951 4.746 -8.643 1.00 1.28 N ATOM 419 CA GLY A 31 7.271 4.731 -9.925 1.00 1.72 C ATOM 420 C GLY A 31 7.211 6.156 -10.460 1.00 1.52 C ATOM 421 O GLY A 31 7.915 7.033 -9.966 1.00 2.86 O ATOM 0 H GLY A 31 8.726 5.408 -8.606 1.00 1.28 H new ATOM 0 HA2 GLY A 31 7.800 4.086 -10.626 1.00 1.72 H new ATOM 0 HA3 GLY A 31 6.265 4.326 -9.815 1.00 1.72 H new ATOM 425 N GLY A 32 6.344 6.404 -11.443 1.00 1.47 N ATOM 426 CA GLY A 32 6.122 7.747 -11.962 1.00 2.07 C ATOM 427 C GLY A 32 4.870 8.383 -11.367 1.00 1.92 C ATOM 428 O GLY A 32 4.489 9.480 -11.768 1.00 1.91 O ATOM 0 H GLY A 32 5.782 5.683 -11.896 1.00 1.47 H new ATOM 0 HA2 GLY A 32 6.988 8.371 -11.739 1.00 2.07 H new ATOM 0 HA3 GLY A 32 6.029 7.707 -13.047 1.00 2.07 H new ATOM 432 N VAL A 33 4.219 7.732 -10.394 1.00 1.84 N ATOM 433 CA VAL A 33 2.981 8.254 -9.830 1.00 1.77 C ATOM 434 C VAL A 33 3.204 9.573 -9.100 1.00 1.76 C ATOM 435 O VAL A 33 2.241 10.297 -8.877 1.00 1.65 O ATOM 436 CB VAL A 33 2.289 7.212 -8.938 1.00 1.78 C ATOM 437 CG1 VAL A 33 2.986 7.044 -7.582 1.00 3.23 C ATOM 438 CG2 VAL A 33 0.816 7.588 -8.736 1.00 2.99 C ATOM 0 H VAL A 33 4.531 6.850 -9.988 1.00 1.84 H new ATOM 0 HA VAL A 33 2.307 8.465 -10.661 1.00 1.77 H new ATOM 0 HB VAL A 33 2.355 6.253 -9.451 1.00 1.78 H new ATOM 0 HG11 VAL A 33 2.457 6.296 -6.991 1.00 3.23 H new ATOM 0 HG12 VAL A 33 4.015 6.720 -7.739 1.00 3.23 H new ATOM 0 HG13 VAL A 33 2.982 7.996 -7.051 1.00 3.23 H new ATOM 0 HG21 VAL A 33 0.334 6.843 -8.102 1.00 2.99 H new ATOM 0 HG22 VAL A 33 0.752 8.566 -8.259 1.00 2.99 H new ATOM 0 HG23 VAL A 33 0.313 7.622 -9.703 1.00 2.99 H new ATOM 448 N CYS A 34 4.452 9.931 -8.781 1.00 1.90 N ATOM 449 CA CYS A 34 4.762 11.260 -8.282 1.00 1.95 C ATOM 450 C CYS A 34 4.046 12.323 -9.125 1.00 1.78 C ATOM 451 O CYS A 34 3.455 13.251 -8.584 1.00 1.64 O ATOM 452 CB CYS A 34 6.282 11.466 -8.256 1.00 2.23 C ATOM 453 SG CYS A 34 6.681 12.972 -7.328 1.00 3.01 S ATOM 0 H CYS A 34 5.259 9.313 -8.862 1.00 1.90 H new ATOM 0 HA CYS A 34 4.399 11.362 -7.259 1.00 1.95 H new ATOM 0 HB2 CYS A 34 6.767 10.605 -7.796 1.00 2.23 H new ATOM 0 HB3 CYS A 34 6.665 11.542 -9.273 1.00 2.23 H new ATOM 0 HG CYS A 34 5.917 13.051 -6.279 1.00 3.01 H new ATOM 459 N GLY A 35 4.033 12.143 -10.449 1.00 1.80 N ATOM 460 CA GLY A 35 3.336 13.035 -11.356 1.00 1.68 C ATOM 461 C GLY A 35 1.835 13.074 -11.084 1.00 1.35 C ATOM 462 O GLY A 35 1.276 14.153 -10.926 1.00 1.31 O ATOM 0 H GLY A 35 4.509 11.370 -10.915 1.00 1.80 H new ATOM 0 HA2 GLY A 35 3.747 14.040 -11.262 1.00 1.68 H new ATOM 0 HA3 GLY A 35 3.509 12.714 -12.383 1.00 1.68 H new ATOM 466 N ALA A 36 1.154 11.925 -11.055 1.00 1.20 N ATOM 467 CA ALA A 36 -0.303 11.889 -10.949 1.00 0.98 C ATOM 468 C ALA A 36 -0.752 12.460 -9.612 1.00 0.92 C ATOM 469 O ALA A 36 -1.642 13.306 -9.550 1.00 0.82 O ATOM 470 CB ALA A 36 -0.819 10.454 -11.108 1.00 0.97 C ATOM 0 H ALA A 36 1.593 11.005 -11.104 1.00 1.20 H new ATOM 0 HA ALA A 36 -0.720 12.500 -11.750 1.00 0.98 H new ATOM 0 HB1 ALA A 36 -1.906 10.447 -11.026 1.00 0.97 H new ATOM 0 HB2 ALA A 36 -0.526 10.068 -12.084 1.00 0.97 H new ATOM 0 HB3 ALA A 36 -0.392 9.825 -10.327 1.00 0.97 H new ATOM 476 N LEU A 37 -0.132 11.995 -8.533 1.00 1.01 N ATOM 477 CA LEU A 37 -0.467 12.426 -7.195 1.00 0.99 C ATOM 478 C LEU A 37 -0.225 13.922 -7.052 1.00 1.01 C ATOM 479 O LEU A 37 -1.057 14.612 -6.488 1.00 0.99 O ATOM 480 CB LEU A 37 0.329 11.597 -6.186 1.00 1.16 C ATOM 481 CG LEU A 37 -0.142 11.814 -4.740 1.00 1.20 C ATOM 482 CD1 LEU A 37 -1.592 11.349 -4.583 1.00 1.17 C ATOM 483 CD2 LEU A 37 0.729 10.973 -3.802 1.00 1.37 C ATOM 0 H LEU A 37 0.619 11.306 -8.570 1.00 1.01 H new ATOM 0 HA LEU A 37 -1.526 12.260 -6.995 1.00 0.99 H new ATOM 0 HB2 LEU A 37 0.240 10.540 -6.439 1.00 1.16 H new ATOM 0 HB3 LEU A 37 1.385 11.855 -6.263 1.00 1.16 H new ATOM 0 HG LEU A 37 -0.065 12.874 -4.499 1.00 1.20 H new ATOM 0 HD11 LEU A 37 -1.916 11.507 -3.554 1.00 1.17 H new ATOM 0 HD12 LEU A 37 -2.232 11.919 -5.256 1.00 1.17 H new ATOM 0 HD13 LEU A 37 -1.662 10.289 -4.826 1.00 1.17 H new ATOM 0 HD21 LEU A 37 0.402 11.120 -2.773 1.00 1.37 H new ATOM 0 HD22 LEU A 37 0.635 9.919 -4.065 1.00 1.37 H new ATOM 0 HD23 LEU A 37 1.770 11.280 -3.900 1.00 1.37 H new ATOM 495 N TYR A 38 0.859 14.450 -7.613 1.00 1.14 N ATOM 496 CA TYR A 38 1.097 15.888 -7.658 1.00 1.23 C ATOM 497 C TYR A 38 0.066 16.606 -8.533 1.00 1.18 C ATOM 498 O TYR A 38 -0.280 17.754 -8.282 1.00 1.29 O ATOM 499 CB TYR A 38 2.511 16.097 -8.204 1.00 1.40 C ATOM 500 CG TYR A 38 3.011 17.523 -8.353 1.00 1.66 C ATOM 501 CD1 TYR A 38 2.571 18.320 -9.426 1.00 3.09 C ATOM 502 CD2 TYR A 38 3.973 18.031 -7.457 1.00 2.29 C ATOM 503 CE1 TYR A 38 3.059 19.629 -9.586 1.00 3.40 C ATOM 504 CE2 TYR A 38 4.467 19.338 -7.609 1.00 2.65 C ATOM 505 CZ TYR A 38 4.007 20.145 -8.676 1.00 2.56 C ATOM 506 OH TYR A 38 4.478 21.411 -8.849 1.00 3.07 O ATOM 0 H TYR A 38 1.595 13.894 -8.048 1.00 1.14 H new ATOM 0 HA TYR A 38 1.000 16.312 -6.659 1.00 1.23 H new ATOM 0 HB2 TYR A 38 3.204 15.566 -7.551 1.00 1.40 H new ATOM 0 HB3 TYR A 38 2.566 15.619 -9.182 1.00 1.40 H new ATOM 0 HD1 TYR A 38 1.855 17.924 -10.131 1.00 3.09 H new ATOM 0 HD2 TYR A 38 4.333 17.412 -6.648 1.00 2.29 H new ATOM 0 HE1 TYR A 38 2.709 20.240 -10.405 1.00 3.40 H new ATOM 0 HE2 TYR A 38 5.196 19.725 -6.913 1.00 2.65 H new ATOM 0 HH TYR A 38 5.122 21.620 -8.141 1.00 3.07 H new ATOM 516 N LYS A 39 -0.407 15.971 -9.605 1.00 1.06 N ATOM 517 CA LYS A 39 -1.272 16.603 -10.588 1.00 1.10 C ATOM 518 C LYS A 39 -2.672 16.739 -10.008 1.00 1.05 C ATOM 519 O LYS A 39 -3.408 17.647 -10.385 1.00 1.22 O ATOM 520 CB LYS A 39 -1.258 15.741 -11.861 1.00 1.06 C ATOM 521 CG LYS A 39 -2.040 16.278 -13.063 1.00 1.32 C ATOM 522 CD LYS A 39 -1.226 17.200 -13.981 1.00 1.93 C ATOM 523 CE LYS A 39 -1.060 18.608 -13.400 1.00 3.03 C ATOM 524 NZ LYS A 39 -0.253 19.474 -14.288 1.00 4.41 N ATOM 0 H LYS A 39 -0.196 14.995 -9.813 1.00 1.06 H new ATOM 0 HA LYS A 39 -0.923 17.604 -10.841 1.00 1.10 H new ATOM 0 HB2 LYS A 39 -0.221 15.600 -12.165 1.00 1.06 H new ATOM 0 HB3 LYS A 39 -1.653 14.757 -11.610 1.00 1.06 H new ATOM 0 HG2 LYS A 39 -2.410 15.436 -13.648 1.00 1.32 H new ATOM 0 HG3 LYS A 39 -2.912 16.822 -12.701 1.00 1.32 H new ATOM 0 HD2 LYS A 39 -0.242 16.762 -14.151 1.00 1.93 H new ATOM 0 HD3 LYS A 39 -1.717 17.267 -14.952 1.00 1.93 H new ATOM 0 HE2 LYS A 39 -2.041 19.057 -13.247 1.00 3.03 H new ATOM 0 HE3 LYS A 39 -0.583 18.544 -12.422 1.00 3.03 H new ATOM 0 HZ1 LYS A 39 -0.162 20.419 -13.862 1.00 4.41 H new ATOM 0 HZ2 LYS A 39 0.692 19.058 -14.413 1.00 4.41 H new ATOM 0 HZ3 LYS A 39 -0.721 19.555 -15.213 1.00 4.41 H new ATOM 538 N LYS A 40 -3.056 15.822 -9.120 1.00 0.88 N ATOM 539 CA LYS A 40 -4.363 15.820 -8.500 1.00 0.84 C ATOM 540 C LYS A 40 -4.287 16.615 -7.199 1.00 0.93 C ATOM 541 O LYS A 40 -5.214 17.358 -6.895 1.00 1.10 O ATOM 542 CB LYS A 40 -4.780 14.362 -8.272 1.00 0.75 C ATOM 543 CG LYS A 40 -6.284 14.202 -7.986 1.00 0.92 C ATOM 544 CD LYS A 40 -7.073 13.584 -9.142 1.00 1.18 C ATOM 545 CE LYS A 40 -7.034 14.469 -10.389 1.00 1.30 C ATOM 546 NZ LYS A 40 -8.057 14.054 -11.372 1.00 1.82 N ATOM 0 H LYS A 40 -2.456 15.056 -8.814 1.00 0.88 H new ATOM 0 HA LYS A 40 -5.115 16.293 -9.132 1.00 0.84 H new ATOM 0 HB2 LYS A 40 -4.519 13.774 -9.152 1.00 0.75 H new ATOM 0 HB3 LYS A 40 -4.212 13.954 -7.436 1.00 0.75 H new ATOM 0 HG2 LYS A 40 -6.411 13.581 -7.099 1.00 0.92 H new ATOM 0 HG3 LYS A 40 -6.706 15.180 -7.753 1.00 0.92 H new ATOM 0 HD2 LYS A 40 -6.663 12.602 -9.379 1.00 1.18 H new ATOM 0 HD3 LYS A 40 -8.108 13.431 -8.836 1.00 1.18 H new ATOM 0 HE2 LYS A 40 -7.199 15.508 -10.106 1.00 1.30 H new ATOM 0 HE3 LYS A 40 -6.045 14.416 -10.845 1.00 1.30 H new ATOM 0 HZ1 LYS A 40 -8.007 14.672 -12.207 1.00 1.82 H new ATOM 0 HZ2 LYS A 40 -7.884 13.070 -11.659 1.00 1.82 H new ATOM 0 HZ3 LYS A 40 -9.001 14.128 -10.943 1.00 1.82 H new ATOM 560 N PHE A 41 -3.216 16.435 -6.420 1.00 0.95 N ATOM 561 CA PHE A 41 -3.040 17.055 -5.121 1.00 1.25 C ATOM 562 C PHE A 41 -1.614 16.863 -4.565 1.00 0.87 C ATOM 563 O PHE A 41 -1.347 15.928 -3.817 1.00 0.86 O ATOM 564 CB PHE A 41 -4.084 16.524 -4.134 1.00 1.74 C ATOM 565 CG PHE A 41 -4.252 15.022 -3.955 1.00 1.03 C ATOM 566 CD1 PHE A 41 -5.159 14.312 -4.761 1.00 1.02 C ATOM 567 CD2 PHE A 41 -3.586 14.344 -2.919 1.00 1.85 C ATOM 568 CE1 PHE A 41 -5.385 12.939 -4.555 1.00 1.02 C ATOM 569 CE2 PHE A 41 -3.789 12.967 -2.732 1.00 2.66 C ATOM 570 CZ PHE A 41 -4.691 12.261 -3.542 1.00 2.17 C ATOM 0 H PHE A 41 -2.434 15.838 -6.690 1.00 0.95 H new ATOM 0 HA PHE A 41 -3.185 18.127 -5.251 1.00 1.25 H new ATOM 0 HB2 PHE A 41 -3.852 16.945 -3.156 1.00 1.74 H new ATOM 0 HB3 PHE A 41 -5.051 16.927 -4.434 1.00 1.74 H new ATOM 0 HD1 PHE A 41 -5.689 14.827 -5.548 1.00 1.02 H new ATOM 0 HD2 PHE A 41 -2.917 14.883 -2.265 1.00 1.85 H new ATOM 0 HE1 PHE A 41 -6.092 12.408 -5.176 1.00 1.02 H new ATOM 0 HE2 PHE A 41 -3.246 12.447 -1.957 1.00 2.66 H new ATOM 0 HZ PHE A 41 -4.850 11.204 -3.387 1.00 2.17 H new ATOM 580 N PRO A 42 -0.689 17.801 -4.803 1.00 0.91 N ATOM 581 CA PRO A 42 0.629 17.764 -4.181 1.00 0.88 C ATOM 582 C PRO A 42 0.586 18.195 -2.711 1.00 0.81 C ATOM 583 O PRO A 42 1.593 18.134 -2.014 1.00 0.92 O ATOM 584 CB PRO A 42 1.473 18.719 -5.022 1.00 1.39 C ATOM 585 CG PRO A 42 0.475 19.734 -5.585 1.00 1.67 C ATOM 586 CD PRO A 42 -0.892 19.045 -5.521 1.00 1.28 C ATOM 0 HA PRO A 42 1.040 16.755 -4.161 1.00 0.88 H new ATOM 0 HB2 PRO A 42 2.236 19.209 -4.417 1.00 1.39 H new ATOM 0 HB3 PRO A 42 1.991 18.189 -5.821 1.00 1.39 H new ATOM 0 HG2 PRO A 42 0.478 20.654 -5.000 1.00 1.67 H new ATOM 0 HG3 PRO A 42 0.729 20.007 -6.609 1.00 1.67 H new ATOM 0 HD2 PRO A 42 -1.621 19.674 -5.010 1.00 1.28 H new ATOM 0 HD3 PRO A 42 -1.280 18.857 -6.522 1.00 1.28 H new ATOM 594 N GLU A 43 -0.584 18.614 -2.226 1.00 1.02 N ATOM 595 CA GLU A 43 -0.795 19.098 -0.868 1.00 1.39 C ATOM 596 C GLU A 43 -0.482 18.007 0.153 1.00 1.50 C ATOM 597 O GLU A 43 -0.051 18.294 1.265 1.00 1.84 O ATOM 598 CB GLU A 43 -2.249 19.574 -0.738 1.00 1.67 C ATOM 599 CG GLU A 43 -2.319 21.092 -0.562 1.00 1.81 C ATOM 600 CD GLU A 43 -1.818 21.503 0.819 1.00 2.72 C ATOM 601 OE1 GLU A 43 -0.825 22.257 0.875 1.00 3.74 O ATOM 602 OE2 GLU A 43 -2.450 21.044 1.797 1.00 3.86 O ATOM 0 H GLU A 43 -1.435 18.625 -2.788 1.00 1.02 H new ATOM 0 HA GLU A 43 -0.121 19.930 -0.666 1.00 1.39 H new ATOM 0 HB2 GLU A 43 -2.811 19.282 -1.625 1.00 1.67 H new ATOM 0 HB3 GLU A 43 -2.720 19.084 0.114 1.00 1.67 H new ATOM 0 HG2 GLU A 43 -1.719 21.579 -1.331 1.00 1.81 H new ATOM 0 HG3 GLU A 43 -3.346 21.431 -0.696 1.00 1.81 H new ATOM 609 N SER A 44 -0.682 16.745 -0.221 1.00 1.41 N ATOM 610 CA SER A 44 -0.416 15.629 0.666 1.00 1.75 C ATOM 611 C SER A 44 0.888 14.943 0.264 1.00 1.56 C ATOM 612 O SER A 44 1.015 13.728 0.411 1.00 1.73 O ATOM 613 CB SER A 44 -1.604 14.672 0.604 1.00 2.24 C ATOM 614 OG SER A 44 -2.814 15.393 0.771 1.00 3.73 O ATOM 0 H SER A 44 -1.030 16.475 -1.141 1.00 1.41 H new ATOM 0 HA SER A 44 -0.295 15.973 1.693 1.00 1.75 H new ATOM 0 HB2 SER A 44 -1.611 14.149 -0.352 1.00 2.24 H new ATOM 0 HB3 SER A 44 -1.512 13.914 1.381 1.00 2.24 H new ATOM 0 HG SER A 44 -3.367 14.952 1.450 1.00 3.73 H new ATOM 620 N PHE A 45 1.864 15.707 -0.238 1.00 1.50 N ATOM 621 CA PHE A 45 3.122 15.187 -0.729 1.00 1.46 C ATOM 622 C PHE A 45 4.235 15.876 0.053 1.00 1.36 C ATOM 623 O PHE A 45 4.836 16.855 -0.371 1.00 1.81 O ATOM 624 CB PHE A 45 3.204 15.377 -2.251 1.00 1.96 C ATOM 625 CG PHE A 45 3.710 14.182 -3.030 1.00 2.71 C ATOM 626 CD1 PHE A 45 3.298 14.028 -4.363 1.00 2.76 C ATOM 627 CD2 PHE A 45 4.570 13.227 -2.450 1.00 4.28 C ATOM 628 CE1 PHE A 45 3.740 12.930 -5.113 1.00 4.24 C ATOM 629 CE2 PHE A 45 5.003 12.121 -3.198 1.00 5.64 C ATOM 630 CZ PHE A 45 4.584 11.969 -4.531 1.00 5.59 C ATOM 0 H PHE A 45 1.790 16.722 -0.311 1.00 1.50 H new ATOM 0 HA PHE A 45 3.221 14.113 -0.570 1.00 1.46 H new ATOM 0 HB2 PHE A 45 2.212 15.637 -2.621 1.00 1.96 H new ATOM 0 HB3 PHE A 45 3.855 16.226 -2.459 1.00 1.96 H new ATOM 0 HD1 PHE A 45 2.639 14.757 -4.811 1.00 2.76 H new ATOM 0 HD2 PHE A 45 4.896 13.347 -1.428 1.00 4.28 H new ATOM 0 HE1 PHE A 45 3.431 12.822 -6.142 1.00 4.24 H new ATOM 0 HE2 PHE A 45 5.657 11.388 -2.750 1.00 5.64 H new ATOM 0 HZ PHE A 45 4.910 11.115 -5.107 1.00 5.59 H new ATOM 640 N ASP A 46 4.460 15.336 1.244 1.00 1.31 N ATOM 641 CA ASP A 46 5.413 15.824 2.233 1.00 1.84 C ATOM 642 C ASP A 46 6.808 15.369 1.827 1.00 1.82 C ATOM 643 O ASP A 46 7.784 16.089 2.004 1.00 2.63 O ATOM 644 CB ASP A 46 5.051 15.253 3.616 1.00 2.35 C ATOM 645 CG ASP A 46 5.063 16.318 4.710 1.00 3.30 C ATOM 646 OD1 ASP A 46 5.979 17.168 4.680 1.00 4.24 O ATOM 647 OD2 ASP A 46 4.150 16.253 5.562 1.00 3.73 O ATOM 0 H ASP A 46 3.959 14.506 1.562 1.00 1.31 H new ATOM 0 HA ASP A 46 5.383 16.912 2.284 1.00 1.84 H new ATOM 0 HB2 ASP A 46 4.063 14.796 3.569 1.00 2.35 H new ATOM 0 HB3 ASP A 46 5.756 14.463 3.875 1.00 2.35 H new ATOM 652 N LEU A 47 6.881 14.156 1.257 1.00 1.16 N ATOM 653 CA LEU A 47 8.087 13.523 0.730 1.00 1.06 C ATOM 654 C LEU A 47 9.295 13.736 1.645 1.00 0.96 C ATOM 655 O LEU A 47 10.413 13.994 1.208 1.00 1.04 O ATOM 656 CB LEU A 47 8.285 13.833 -0.768 1.00 1.12 C ATOM 657 CG LEU A 47 7.966 15.274 -1.210 1.00 1.44 C ATOM 658 CD1 LEU A 47 9.118 16.240 -0.954 1.00 1.82 C ATOM 659 CD2 LEU A 47 7.606 15.275 -2.692 1.00 1.85 C ATOM 0 H LEU A 47 6.056 13.566 1.149 1.00 1.16 H new ATOM 0 HA LEU A 47 7.958 12.441 0.747 1.00 1.06 H new ATOM 0 HB2 LEU A 47 9.321 13.615 -1.029 1.00 1.12 H new ATOM 0 HB3 LEU A 47 7.660 13.151 -1.345 1.00 1.12 H new ATOM 0 HG LEU A 47 7.125 15.623 -0.611 1.00 1.44 H new ATOM 0 HD11 LEU A 47 8.835 17.239 -1.285 1.00 1.82 H new ATOM 0 HD12 LEU A 47 9.345 16.262 0.112 1.00 1.82 H new ATOM 0 HD13 LEU A 47 9.999 15.910 -1.505 1.00 1.82 H new ATOM 0 HD21 LEU A 47 7.379 16.292 -3.011 1.00 1.85 H new ATOM 0 HD22 LEU A 47 8.447 14.892 -3.271 1.00 1.85 H new ATOM 0 HD23 LEU A 47 6.735 14.641 -2.855 1.00 1.85 H new ATOM 671 N GLN A 48 9.037 13.557 2.942 1.00 0.92 N ATOM 672 CA GLN A 48 10.021 13.639 4.007 1.00 0.95 C ATOM 673 C GLN A 48 10.562 12.251 4.354 1.00 0.87 C ATOM 674 O GLN A 48 9.901 11.242 4.102 1.00 0.87 O ATOM 675 CB GLN A 48 9.368 14.266 5.248 1.00 1.17 C ATOM 676 CG GLN A 48 9.384 15.795 5.162 1.00 2.33 C ATOM 677 CD GLN A 48 8.964 16.440 6.480 1.00 2.91 C ATOM 678 OE1 GLN A 48 8.447 15.788 7.380 1.00 2.89 O ATOM 679 NE2 GLN A 48 9.244 17.726 6.646 1.00 3.96 N ATOM 0 H GLN A 48 8.101 13.343 3.285 1.00 0.92 H new ATOM 0 HA GLN A 48 10.854 14.257 3.672 1.00 0.95 H new ATOM 0 HB2 GLN A 48 8.341 13.914 5.340 1.00 1.17 H new ATOM 0 HB3 GLN A 48 9.897 13.943 6.144 1.00 1.17 H new ATOM 0 HG2 GLN A 48 10.385 16.134 4.894 1.00 2.33 H new ATOM 0 HG3 GLN A 48 8.713 16.122 4.367 1.00 2.33 H new ATOM 0 HE21 GLN A 48 9.674 18.256 5.888 1.00 3.96 H new ATOM 0 HE22 GLN A 48 9.029 18.185 7.531 1.00 3.96 H new ATOM 688 N PRO A 49 11.751 12.195 4.972 1.00 0.89 N ATOM 689 CA PRO A 49 12.356 10.953 5.413 1.00 0.89 C ATOM 690 C PRO A 49 11.593 10.382 6.611 1.00 0.92 C ATOM 691 O PRO A 49 11.231 11.121 7.524 1.00 1.09 O ATOM 692 CB PRO A 49 13.797 11.314 5.781 1.00 0.99 C ATOM 693 CG PRO A 49 13.691 12.777 6.211 1.00 1.06 C ATOM 694 CD PRO A 49 12.610 13.326 5.282 1.00 0.99 C ATOM 0 HA PRO A 49 12.328 10.182 4.643 1.00 0.89 H new ATOM 0 HB2 PRO A 49 14.177 10.684 6.585 1.00 0.99 H new ATOM 0 HB3 PRO A 49 14.472 11.191 4.934 1.00 0.99 H new ATOM 0 HG2 PRO A 49 13.409 12.871 7.260 1.00 1.06 H new ATOM 0 HG3 PRO A 49 14.637 13.304 6.087 1.00 1.06 H new ATOM 0 HD2 PRO A 49 12.047 14.125 5.764 1.00 0.99 H new ATOM 0 HD3 PRO A 49 13.048 13.746 4.376 1.00 0.99 H new ATOM 702 N ILE A 50 11.372 9.066 6.622 1.00 0.87 N ATOM 703 CA ILE A 50 10.682 8.324 7.672 1.00 0.95 C ATOM 704 C ILE A 50 11.525 7.074 7.958 1.00 0.75 C ATOM 705 O ILE A 50 12.434 6.750 7.191 1.00 0.69 O ATOM 706 CB ILE A 50 9.222 8.048 7.222 1.00 1.17 C ATOM 707 CG1 ILE A 50 8.387 9.331 7.426 1.00 1.82 C ATOM 708 CG2 ILE A 50 8.530 6.895 7.965 1.00 0.91 C ATOM 709 CD1 ILE A 50 7.160 9.405 6.520 1.00 1.63 C ATOM 0 H ILE A 50 11.685 8.463 5.862 1.00 0.87 H new ATOM 0 HA ILE A 50 10.589 8.874 8.608 1.00 0.95 H new ATOM 0 HB ILE A 50 9.281 7.750 6.175 1.00 1.17 H new ATOM 0 HG12 ILE A 50 8.066 9.385 8.466 1.00 1.82 H new ATOM 0 HG13 ILE A 50 9.019 10.200 7.242 1.00 1.82 H new ATOM 0 HG21 ILE A 50 7.515 6.775 7.585 1.00 0.91 H new ATOM 0 HG22 ILE A 50 9.089 5.973 7.806 1.00 0.91 H new ATOM 0 HG23 ILE A 50 8.494 7.119 9.031 1.00 0.91 H new ATOM 0 HD11 ILE A 50 6.619 10.331 6.715 1.00 1.63 H new ATOM 0 HD12 ILE A 50 7.476 9.382 5.477 1.00 1.63 H new ATOM 0 HD13 ILE A 50 6.508 8.555 6.720 1.00 1.63 H new ATOM 721 N GLU A 51 11.257 6.403 9.081 1.00 0.73 N ATOM 722 CA GLU A 51 11.949 5.201 9.529 1.00 0.66 C ATOM 723 C GLU A 51 11.705 4.035 8.557 1.00 0.57 C ATOM 724 O GLU A 51 11.120 4.218 7.492 1.00 0.81 O ATOM 725 CB GLU A 51 11.440 4.866 10.941 1.00 0.70 C ATOM 726 CG GLU A 51 12.468 4.085 11.773 1.00 1.19 C ATOM 727 CD GLU A 51 12.897 4.891 12.998 1.00 1.72 C ATOM 728 OE1 GLU A 51 12.470 4.519 14.112 1.00 2.56 O ATOM 729 OE2 GLU A 51 13.625 5.885 12.787 1.00 2.35 O ATOM 0 H GLU A 51 10.523 6.697 9.725 1.00 0.73 H new ATOM 0 HA GLU A 51 13.026 5.370 9.553 1.00 0.66 H new ATOM 0 HB2 GLU A 51 11.186 5.790 11.460 1.00 0.70 H new ATOM 0 HB3 GLU A 51 10.523 4.282 10.863 1.00 0.70 H new ATOM 0 HG2 GLU A 51 12.040 3.134 12.089 1.00 1.19 H new ATOM 0 HG3 GLU A 51 13.339 3.854 11.160 1.00 1.19 H new ATOM 736 N VAL A 52 12.116 2.813 8.911 1.00 0.53 N ATOM 737 CA VAL A 52 12.024 1.677 8.002 1.00 0.52 C ATOM 738 C VAL A 52 11.233 0.554 8.654 1.00 0.57 C ATOM 739 O VAL A 52 11.775 -0.217 9.442 1.00 0.78 O ATOM 740 CB VAL A 52 13.421 1.217 7.535 1.00 0.63 C ATOM 741 CG1 VAL A 52 13.291 0.303 6.310 1.00 1.04 C ATOM 742 CG2 VAL A 52 14.348 2.370 7.133 1.00 0.89 C ATOM 0 H VAL A 52 12.515 2.590 9.823 1.00 0.53 H new ATOM 0 HA VAL A 52 11.488 1.985 7.105 1.00 0.52 H new ATOM 0 HB VAL A 52 13.857 0.703 8.392 1.00 0.63 H new ATOM 0 HG11 VAL A 52 14.282 -0.017 5.988 1.00 1.04 H new ATOM 0 HG12 VAL A 52 12.695 -0.571 6.570 1.00 1.04 H new ATOM 0 HG13 VAL A 52 12.804 0.847 5.500 1.00 1.04 H new ATOM 0 HG21 VAL A 52 15.311 1.969 6.816 1.00 0.89 H new ATOM 0 HG22 VAL A 52 13.899 2.928 6.311 1.00 0.89 H new ATOM 0 HG23 VAL A 52 14.494 3.034 7.985 1.00 0.89 H new ATOM 752 N GLY A 53 9.943 0.497 8.321 1.00 0.57 N ATOM 753 CA GLY A 53 8.993 -0.465 8.861 1.00 0.70 C ATOM 754 C GLY A 53 7.746 0.271 9.324 1.00 0.72 C ATOM 755 O GLY A 53 6.624 -0.213 9.210 1.00 1.21 O ATOM 0 H GLY A 53 9.522 1.139 7.649 1.00 0.57 H new ATOM 0 HA2 GLY A 53 8.734 -1.203 8.102 1.00 0.70 H new ATOM 0 HA3 GLY A 53 9.440 -1.008 9.694 1.00 0.70 H new ATOM 759 N LYS A 54 7.934 1.488 9.835 1.00 0.42 N ATOM 760 CA LYS A 54 6.873 2.273 10.401 1.00 0.39 C ATOM 761 C LYS A 54 6.165 2.986 9.256 1.00 0.39 C ATOM 762 O LYS A 54 6.816 3.596 8.409 1.00 0.44 O ATOM 763 CB LYS A 54 7.544 3.267 11.354 1.00 0.40 C ATOM 764 CG LYS A 54 6.532 4.125 12.098 1.00 1.54 C ATOM 765 CD LYS A 54 5.892 3.403 13.299 1.00 1.99 C ATOM 766 CE LYS A 54 4.359 3.332 13.250 1.00 3.81 C ATOM 767 NZ LYS A 54 3.728 4.662 13.111 1.00 4.64 N ATOM 0 H LYS A 54 8.844 1.949 9.861 1.00 0.42 H new ATOM 0 HA LYS A 54 6.135 1.682 10.944 1.00 0.39 H new ATOM 0 HB2 LYS A 54 8.154 2.722 12.074 1.00 0.40 H new ATOM 0 HB3 LYS A 54 8.218 3.911 10.789 1.00 0.40 H new ATOM 0 HG2 LYS A 54 7.023 5.033 12.448 1.00 1.54 H new ATOM 0 HG3 LYS A 54 5.747 4.432 11.407 1.00 1.54 H new ATOM 0 HD2 LYS A 54 6.289 2.389 13.353 1.00 1.99 H new ATOM 0 HD3 LYS A 54 6.191 3.912 14.215 1.00 1.99 H new ATOM 0 HE2 LYS A 54 4.056 2.702 12.414 1.00 3.81 H new ATOM 0 HE3 LYS A 54 3.993 2.854 14.159 1.00 3.81 H new ATOM 0 HZ1 LYS A 54 2.788 4.648 13.556 1.00 4.64 H new ATOM 0 HZ2 LYS A 54 4.321 5.378 13.577 1.00 4.64 H new ATOM 0 HZ3 LYS A 54 3.630 4.896 12.102 1.00 4.64 H new ATOM 781 N ALA A 55 4.836 2.992 9.275 1.00 0.39 N ATOM 782 CA ALA A 55 4.054 3.826 8.369 1.00 0.39 C ATOM 783 C ALA A 55 3.718 5.139 9.081 1.00 0.41 C ATOM 784 O ALA A 55 3.520 5.152 10.300 1.00 0.46 O ATOM 785 CB ALA A 55 2.761 3.097 7.988 1.00 0.41 C ATOM 0 H ALA A 55 4.276 2.425 9.912 1.00 0.39 H new ATOM 0 HA ALA A 55 4.624 4.031 7.463 1.00 0.39 H new ATOM 0 HB1 ALA A 55 2.177 3.721 7.311 1.00 0.41 H new ATOM 0 HB2 ALA A 55 3.006 2.156 7.494 1.00 0.41 H new ATOM 0 HB3 ALA A 55 2.179 2.894 8.887 1.00 0.41 H new ATOM 791 N ARG A 56 3.644 6.247 8.341 1.00 0.39 N ATOM 792 CA ARG A 56 3.313 7.558 8.887 1.00 0.39 C ATOM 793 C ARG A 56 2.277 8.195 7.968 1.00 0.36 C ATOM 794 O ARG A 56 2.483 8.270 6.761 1.00 0.43 O ATOM 795 CB ARG A 56 4.597 8.402 8.996 1.00 0.56 C ATOM 796 CG ARG A 56 4.859 8.893 10.424 1.00 1.12 C ATOM 797 CD ARG A 56 3.963 10.079 10.795 1.00 2.41 C ATOM 798 NE ARG A 56 4.222 10.520 12.173 1.00 2.99 N ATOM 799 CZ ARG A 56 3.786 11.665 12.714 1.00 3.92 C ATOM 800 NH1 ARG A 56 4.097 11.966 13.976 1.00 4.40 N ATOM 801 NH2 ARG A 56 3.043 12.505 11.992 1.00 4.89 N ATOM 0 H ARG A 56 3.815 6.256 7.335 1.00 0.39 H new ATOM 0 HA ARG A 56 2.892 7.484 9.890 1.00 0.39 H new ATOM 0 HB2 ARG A 56 5.447 7.809 8.658 1.00 0.56 H new ATOM 0 HB3 ARG A 56 4.521 9.260 8.329 1.00 0.56 H new ATOM 0 HG2 ARG A 56 4.689 8.076 11.125 1.00 1.12 H new ATOM 0 HG3 ARG A 56 5.905 9.184 10.521 1.00 1.12 H new ATOM 0 HD2 ARG A 56 4.141 10.904 10.105 1.00 2.41 H new ATOM 0 HD3 ARG A 56 2.916 9.796 10.690 1.00 2.41 H new ATOM 0 HE ARG A 56 4.779 9.904 12.765 1.00 2.99 H new ATOM 0 HH11 ARG A 56 4.666 11.324 14.528 1.00 4.40 H new ATOM 0 HH12 ARG A 56 3.765 12.838 14.389 1.00 4.40 H new ATOM 0 HH21 ARG A 56 2.806 12.276 11.027 1.00 4.89 H new ATOM 0 HH22 ARG A 56 2.712 13.377 12.405 1.00 4.89 H new ATOM 815 N LEU A 57 1.139 8.615 8.518 1.00 0.35 N ATOM 816 CA LEU A 57 0.121 9.293 7.730 1.00 0.40 C ATOM 817 C LEU A 57 0.529 10.735 7.453 1.00 0.50 C ATOM 818 O LEU A 57 1.239 11.336 8.259 1.00 0.59 O ATOM 819 CB LEU A 57 -1.252 9.183 8.408 1.00 0.49 C ATOM 820 CG LEU A 57 -1.396 9.938 9.741 1.00 0.86 C ATOM 821 CD1 LEU A 57 -2.064 11.301 9.535 1.00 1.81 C ATOM 822 CD2 LEU A 57 -2.260 9.111 10.697 1.00 1.33 C ATOM 0 H LEU A 57 0.903 8.497 9.503 1.00 0.35 H new ATOM 0 HA LEU A 57 0.033 8.800 6.762 1.00 0.40 H new ATOM 0 HB2 LEU A 57 -2.009 9.553 7.717 1.00 0.49 H new ATOM 0 HB3 LEU A 57 -1.468 8.129 8.583 1.00 0.49 H new ATOM 0 HG LEU A 57 -0.400 10.093 10.155 1.00 0.86 H new ATOM 0 HD11 LEU A 57 -2.152 11.812 10.494 1.00 1.81 H new ATOM 0 HD12 LEU A 57 -1.459 11.904 8.857 1.00 1.81 H new ATOM 0 HD13 LEU A 57 -3.056 11.159 9.107 1.00 1.81 H new ATOM 0 HD21 LEU A 57 -2.365 9.641 11.643 1.00 1.33 H new ATOM 0 HD22 LEU A 57 -3.245 8.956 10.256 1.00 1.33 H new ATOM 0 HD23 LEU A 57 -1.786 8.145 10.873 1.00 1.33 H new ATOM 834 N VAL A 58 0.063 11.289 6.329 1.00 0.58 N ATOM 835 CA VAL A 58 0.373 12.633 5.888 1.00 0.71 C ATOM 836 C VAL A 58 -0.955 13.362 5.655 1.00 0.65 C ATOM 837 O VAL A 58 -1.723 13.053 4.743 1.00 0.78 O ATOM 838 CB VAL A 58 1.322 12.586 4.674 1.00 0.91 C ATOM 839 CG1 VAL A 58 2.569 11.757 5.007 1.00 1.56 C ATOM 840 CG2 VAL A 58 0.714 12.008 3.392 1.00 0.93 C ATOM 0 H VAL A 58 -0.557 10.792 5.690 1.00 0.58 H new ATOM 0 HA VAL A 58 0.922 13.203 6.638 1.00 0.71 H new ATOM 0 HB VAL A 58 1.557 13.632 4.476 1.00 0.91 H new ATOM 0 HG11 VAL A 58 3.231 11.732 4.141 1.00 1.56 H new ATOM 0 HG12 VAL A 58 3.092 12.209 5.850 1.00 1.56 H new ATOM 0 HG13 VAL A 58 2.272 10.741 5.266 1.00 1.56 H new ATOM 0 HG21 VAL A 58 1.461 12.019 2.598 1.00 0.93 H new ATOM 0 HG22 VAL A 58 0.391 10.983 3.573 1.00 0.93 H new ATOM 0 HG23 VAL A 58 -0.143 12.611 3.092 1.00 0.93 H new ATOM 850 N LYS A 59 -1.284 14.294 6.550 1.00 0.86 N ATOM 851 CA LYS A 59 -2.551 15.007 6.514 1.00 0.90 C ATOM 852 C LYS A 59 -2.336 16.295 5.729 1.00 1.07 C ATOM 853 O LYS A 59 -1.759 17.232 6.271 1.00 1.60 O ATOM 854 CB LYS A 59 -2.985 15.295 7.960 1.00 1.49 C ATOM 855 CG LYS A 59 -4.360 15.978 8.065 1.00 2.66 C ATOM 856 CD LYS A 59 -4.327 17.248 8.930 1.00 3.14 C ATOM 857 CE LYS A 59 -3.955 18.496 8.120 1.00 4.34 C ATOM 858 NZ LYS A 59 -5.060 18.932 7.237 1.00 6.27 N ATOM 0 H LYS A 59 -0.675 14.573 7.320 1.00 0.86 H new ATOM 0 HA LYS A 59 -3.335 14.424 6.030 1.00 0.90 H new ATOM 0 HB2 LYS A 59 -3.010 14.358 8.517 1.00 1.49 H new ATOM 0 HB3 LYS A 59 -2.236 15.928 8.436 1.00 1.49 H new ATOM 0 HG2 LYS A 59 -4.712 16.233 7.065 1.00 2.66 H new ATOM 0 HG3 LYS A 59 -5.079 15.275 8.486 1.00 2.66 H new ATOM 0 HD2 LYS A 59 -5.303 17.395 9.392 1.00 3.14 H new ATOM 0 HD3 LYS A 59 -3.608 17.115 9.739 1.00 3.14 H new ATOM 0 HE2 LYS A 59 -3.694 19.306 8.801 1.00 4.34 H new ATOM 0 HE3 LYS A 59 -3.070 18.288 7.518 1.00 4.34 H new ATOM 0 HZ1 LYS A 59 -4.996 19.958 7.082 1.00 6.27 H new ATOM 0 HZ2 LYS A 59 -4.990 18.439 6.324 1.00 6.27 H new ATOM 0 HZ3 LYS A 59 -5.971 18.705 7.684 1.00 6.27 H new ATOM 872 N GLY A 60 -2.822 16.375 4.490 1.00 1.09 N ATOM 873 CA GLY A 60 -2.803 17.619 3.748 1.00 1.62 C ATOM 874 C GLY A 60 -4.143 18.313 3.937 1.00 1.60 C ATOM 875 O GLY A 60 -5.021 17.822 4.652 1.00 1.92 O ATOM 0 H GLY A 60 -3.232 15.589 3.986 1.00 1.09 H new ATOM 0 HA2 GLY A 60 -1.993 18.258 4.100 1.00 1.62 H new ATOM 0 HA3 GLY A 60 -2.622 17.427 2.691 1.00 1.62 H new ATOM 879 N ALA A 61 -4.300 19.470 3.310 1.00 1.36 N ATOM 880 CA ALA A 61 -5.568 20.179 3.225 1.00 1.27 C ATOM 881 C ALA A 61 -6.440 19.578 2.130 1.00 1.14 C ATOM 882 O ALA A 61 -7.658 19.540 2.267 1.00 1.08 O ATOM 883 CB ALA A 61 -5.332 21.671 2.969 1.00 1.43 C ATOM 0 H ALA A 61 -3.535 19.951 2.837 1.00 1.36 H new ATOM 0 HA ALA A 61 -6.089 20.073 4.177 1.00 1.27 H new ATOM 0 HB1 ALA A 61 -6.291 22.186 2.908 1.00 1.43 H new ATOM 0 HB2 ALA A 61 -4.745 22.092 3.785 1.00 1.43 H new ATOM 0 HB3 ALA A 61 -4.792 21.798 2.031 1.00 1.43 H new ATOM 889 N ALA A 62 -5.819 19.090 1.053 1.00 1.18 N ATOM 890 CA ALA A 62 -6.551 18.496 -0.055 1.00 1.19 C ATOM 891 C ALA A 62 -7.292 17.244 0.417 1.00 1.13 C ATOM 892 O ALA A 62 -8.496 17.119 0.205 1.00 1.18 O ATOM 893 CB ALA A 62 -5.584 18.156 -1.193 1.00 1.29 C ATOM 0 H ALA A 62 -4.806 19.098 0.930 1.00 1.18 H new ATOM 0 HA ALA A 62 -7.286 19.211 -0.425 1.00 1.19 H new ATOM 0 HB1 ALA A 62 -6.137 17.711 -2.020 1.00 1.29 H new ATOM 0 HB2 ALA A 62 -5.090 19.066 -1.534 1.00 1.29 H new ATOM 0 HB3 ALA A 62 -4.836 17.449 -0.835 1.00 1.29 H new ATOM 899 N LYS A 63 -6.576 16.303 1.039 1.00 1.05 N ATOM 900 CA LYS A 63 -7.178 15.106 1.615 1.00 0.99 C ATOM 901 C LYS A 63 -6.173 14.469 2.576 1.00 0.92 C ATOM 902 O LYS A 63 -4.976 14.761 2.521 1.00 1.01 O ATOM 903 CB LYS A 63 -7.607 14.142 0.483 1.00 1.07 C ATOM 904 CG LYS A 63 -8.381 12.888 0.926 1.00 1.38 C ATOM 905 CD LYS A 63 -9.639 13.187 1.757 1.00 2.35 C ATOM 906 CE LYS A 63 -10.240 11.887 2.310 1.00 3.05 C ATOM 907 NZ LYS A 63 -11.290 11.328 1.433 1.00 3.08 N ATOM 0 H LYS A 63 -5.564 16.353 1.155 1.00 1.05 H new ATOM 0 HA LYS A 63 -8.077 15.354 2.180 1.00 0.99 H new ATOM 0 HB2 LYS A 63 -8.224 14.695 -0.225 1.00 1.07 H new ATOM 0 HB3 LYS A 63 -6.714 13.823 -0.054 1.00 1.07 H new ATOM 0 HG2 LYS A 63 -8.670 12.321 0.041 1.00 1.38 H new ATOM 0 HG3 LYS A 63 -7.716 12.251 1.510 1.00 1.38 H new ATOM 0 HD2 LYS A 63 -9.388 13.857 2.579 1.00 2.35 H new ATOM 0 HD3 LYS A 63 -10.376 13.702 1.140 1.00 2.35 H new ATOM 0 HE2 LYS A 63 -9.447 11.150 2.437 1.00 3.05 H new ATOM 0 HE3 LYS A 63 -10.660 12.077 3.298 1.00 3.05 H new ATOM 0 HZ1 LYS A 63 -11.662 10.452 1.852 1.00 3.08 H new ATOM 0 HZ2 LYS A 63 -12.061 12.018 1.332 1.00 3.08 H new ATOM 0 HZ3 LYS A 63 -10.886 11.120 0.497 1.00 3.08 H new ATOM 921 N HIS A 64 -6.653 13.605 3.467 1.00 0.87 N ATOM 922 CA HIS A 64 -5.815 12.788 4.329 1.00 0.81 C ATOM 923 C HIS A 64 -5.269 11.627 3.510 1.00 0.77 C ATOM 924 O HIS A 64 -6.036 10.972 2.810 1.00 0.84 O ATOM 925 CB HIS A 64 -6.668 12.234 5.477 1.00 0.87 C ATOM 926 CG HIS A 64 -7.271 13.295 6.368 1.00 1.02 C ATOM 927 ND1 HIS A 64 -8.221 13.076 7.340 1.00 1.32 N ATOM 928 CD2 HIS A 64 -7.014 14.642 6.337 1.00 1.01 C ATOM 929 CE1 HIS A 64 -8.523 14.269 7.885 1.00 1.44 C ATOM 930 NE2 HIS A 64 -7.809 15.251 7.310 1.00 1.25 N ATOM 0 H HIS A 64 -7.652 13.453 3.610 1.00 0.87 H new ATOM 0 HA HIS A 64 -4.996 13.383 4.734 1.00 0.81 H new ATOM 0 HB2 HIS A 64 -7.471 11.628 5.058 1.00 0.87 H new ATOM 0 HB3 HIS A 64 -6.052 11.571 6.085 1.00 0.87 H new ATOM 0 HD2 HIS A 64 -6.320 15.142 5.678 1.00 1.01 H new ATOM 0 HE1 HIS A 64 -9.242 14.417 8.677 1.00 1.44 H new ATOM 0 HE2 HIS A 64 -7.841 16.244 7.539 1.00 1.25 H new ATOM 938 N ILE A 65 -3.969 11.358 3.609 1.00 0.71 N ATOM 939 CA ILE A 65 -3.301 10.293 2.877 1.00 0.68 C ATOM 940 C ILE A 65 -2.451 9.531 3.882 1.00 0.61 C ATOM 941 O ILE A 65 -2.160 10.050 4.957 1.00 0.65 O ATOM 942 CB ILE A 65 -2.476 10.900 1.726 1.00 0.73 C ATOM 943 CG1 ILE A 65 -3.328 11.780 0.795 1.00 1.33 C ATOM 944 CG2 ILE A 65 -1.735 9.850 0.885 1.00 0.75 C ATOM 945 CD1 ILE A 65 -4.377 11.009 -0.008 1.00 0.97 C ATOM 0 H ILE A 65 -3.341 11.887 4.214 1.00 0.71 H new ATOM 0 HA ILE A 65 -4.005 9.601 2.415 1.00 0.68 H new ATOM 0 HB ILE A 65 -1.731 11.521 2.224 1.00 0.73 H new ATOM 0 HG12 ILE A 65 -3.831 12.541 1.392 1.00 1.33 H new ATOM 0 HG13 ILE A 65 -2.668 12.302 0.102 1.00 1.33 H new ATOM 0 HG21 ILE A 65 -1.175 10.347 0.093 1.00 0.75 H new ATOM 0 HG22 ILE A 65 -1.047 9.293 1.522 1.00 0.75 H new ATOM 0 HG23 ILE A 65 -2.456 9.163 0.443 1.00 0.75 H new ATOM 0 HD11 ILE A 65 -4.934 11.702 -0.639 1.00 0.97 H new ATOM 0 HD12 ILE A 65 -3.882 10.266 -0.634 1.00 0.97 H new ATOM 0 HD13 ILE A 65 -5.063 10.509 0.675 1.00 0.97 H new ATOM 957 N ILE A 66 -2.057 8.302 3.559 1.00 0.58 N ATOM 958 CA ILE A 66 -1.232 7.481 4.423 1.00 0.54 C ATOM 959 C ILE A 66 -0.007 7.065 3.618 1.00 0.53 C ATOM 960 O ILE A 66 -0.095 6.805 2.417 1.00 0.62 O ATOM 961 CB ILE A 66 -1.986 6.242 4.935 1.00 0.57 C ATOM 962 CG1 ILE A 66 -3.459 6.463 5.324 1.00 0.61 C ATOM 963 CG2 ILE A 66 -1.229 5.599 6.109 1.00 0.61 C ATOM 964 CD1 ILE A 66 -3.668 7.371 6.533 1.00 0.62 C ATOM 0 H ILE A 66 -2.307 7.849 2.680 1.00 0.58 H new ATOM 0 HA ILE A 66 -0.947 8.053 5.306 1.00 0.54 H new ATOM 0 HB ILE A 66 -2.018 5.573 4.075 1.00 0.57 H new ATOM 0 HG12 ILE A 66 -3.986 6.889 4.471 1.00 0.61 H new ATOM 0 HG13 ILE A 66 -3.916 5.495 5.530 1.00 0.61 H new ATOM 0 HG21 ILE A 66 -1.776 4.724 6.459 1.00 0.61 H new ATOM 0 HG22 ILE A 66 -0.235 5.297 5.779 1.00 0.61 H new ATOM 0 HG23 ILE A 66 -1.139 6.319 6.922 1.00 0.61 H new ATOM 0 HD11 ILE A 66 -4.735 7.470 6.734 1.00 0.62 H new ATOM 0 HD12 ILE A 66 -3.173 6.938 7.403 1.00 0.62 H new ATOM 0 HD13 ILE A 66 -3.245 8.354 6.327 1.00 0.62 H new ATOM 976 N HIS A 67 1.139 6.958 4.283 1.00 0.43 N ATOM 977 CA HIS A 67 2.354 6.488 3.651 1.00 0.44 C ATOM 978 C HIS A 67 2.849 5.280 4.446 1.00 0.56 C ATOM 979 O HIS A 67 3.032 5.358 5.658 1.00 0.62 O ATOM 980 CB HIS A 67 3.348 7.657 3.569 1.00 0.49 C ATOM 981 CG HIS A 67 4.790 7.240 3.542 1.00 2.34 C ATOM 982 ND1 HIS A 67 5.828 7.897 4.151 1.00 3.41 N ATOM 983 CD2 HIS A 67 5.297 6.109 2.974 1.00 3.99 C ATOM 984 CE1 HIS A 67 6.935 7.153 3.971 1.00 5.36 C ATOM 985 NE2 HIS A 67 6.652 6.048 3.262 1.00 5.82 N ATOM 0 H HIS A 67 1.245 7.195 5.269 1.00 0.43 H new ATOM 0 HA HIS A 67 2.204 6.153 2.625 1.00 0.44 H new ATOM 0 HB2 HIS A 67 3.133 8.239 2.673 1.00 0.49 H new ATOM 0 HB3 HIS A 67 3.188 8.315 4.423 1.00 0.49 H new ATOM 0 HD1 HIS A 67 5.772 8.786 4.649 1.00 3.41 H new ATOM 0 HD2 HIS A 67 4.739 5.385 2.399 1.00 3.99 H new ATOM 0 HE1 HIS A 67 7.915 7.409 4.345 1.00 5.36 H new ATOM 993 N ALA A 68 3.076 4.165 3.746 1.00 0.67 N ATOM 994 CA ALA A 68 3.697 2.966 4.279 1.00 0.63 C ATOM 995 C ALA A 68 5.118 2.865 3.737 1.00 0.58 C ATOM 996 O ALA A 68 5.351 3.080 2.547 1.00 0.67 O ATOM 997 CB ALA A 68 2.903 1.738 3.827 1.00 0.61 C ATOM 0 H ALA A 68 2.822 4.077 2.762 1.00 0.67 H new ATOM 0 HA ALA A 68 3.712 3.012 5.368 1.00 0.63 H new ATOM 0 HB1 ALA A 68 3.368 0.837 4.226 1.00 0.61 H new ATOM 0 HB2 ALA A 68 1.879 1.811 4.194 1.00 0.61 H new ATOM 0 HB3 ALA A 68 2.895 1.690 2.738 1.00 0.61 H new ATOM 1003 N VAL A 69 6.076 2.498 4.582 1.00 0.66 N ATOM 1004 CA VAL A 69 7.415 2.242 4.133 1.00 0.72 C ATOM 1005 C VAL A 69 7.463 0.778 3.706 1.00 0.70 C ATOM 1006 O VAL A 69 7.434 -0.112 4.549 1.00 0.74 O ATOM 1007 CB VAL A 69 8.366 2.601 5.277 1.00 0.84 C ATOM 1008 CG1 VAL A 69 9.777 2.171 4.903 1.00 1.38 C ATOM 1009 CG2 VAL A 69 8.290 4.110 5.517 1.00 1.75 C ATOM 0 H VAL A 69 5.936 2.374 5.585 1.00 0.66 H new ATOM 0 HA VAL A 69 7.722 2.842 3.276 1.00 0.72 H new ATOM 0 HB VAL A 69 8.085 2.086 6.195 1.00 0.84 H new ATOM 0 HG11 VAL A 69 10.461 2.423 5.713 1.00 1.38 H new ATOM 0 HG12 VAL A 69 9.796 1.094 4.734 1.00 1.38 H new ATOM 0 HG13 VAL A 69 10.086 2.687 3.994 1.00 1.38 H new ATOM 0 HG21 VAL A 69 8.962 4.383 6.330 1.00 1.75 H new ATOM 0 HG22 VAL A 69 8.584 4.638 4.610 1.00 1.75 H new ATOM 0 HG23 VAL A 69 7.269 4.385 5.782 1.00 1.75 H new ATOM 1019 N GLY A 70 7.494 0.531 2.395 1.00 0.88 N ATOM 1020 CA GLY A 70 7.478 -0.808 1.826 1.00 1.08 C ATOM 1021 C GLY A 70 8.697 -0.986 0.928 1.00 1.40 C ATOM 1022 O GLY A 70 8.685 -0.475 -0.187 1.00 2.09 O ATOM 0 H GLY A 70 7.531 1.270 1.693 1.00 0.88 H new ATOM 0 HA2 GLY A 70 7.485 -1.554 2.621 1.00 1.08 H new ATOM 0 HA3 GLY A 70 6.564 -0.962 1.253 1.00 1.08 H new ATOM 1026 N PRO A 71 9.755 -1.659 1.405 1.00 1.57 N ATOM 1027 CA PRO A 71 11.018 -1.776 0.691 1.00 2.00 C ATOM 1028 C PRO A 71 10.918 -2.761 -0.482 1.00 1.43 C ATOM 1029 O PRO A 71 9.831 -3.178 -0.877 1.00 1.31 O ATOM 1030 CB PRO A 71 12.024 -2.209 1.759 1.00 2.71 C ATOM 1031 CG PRO A 71 11.176 -3.017 2.734 1.00 2.64 C ATOM 1032 CD PRO A 71 9.835 -2.286 2.712 1.00 2.03 C ATOM 0 HA PRO A 71 11.323 -0.841 0.221 1.00 2.00 H new ATOM 0 HB2 PRO A 71 12.829 -2.809 1.334 1.00 2.71 H new ATOM 0 HB3 PRO A 71 12.488 -1.351 2.245 1.00 2.71 H new ATOM 0 HG2 PRO A 71 11.075 -4.055 2.417 1.00 2.64 H new ATOM 0 HG3 PRO A 71 11.612 -3.030 3.733 1.00 2.64 H new ATOM 0 HD2 PRO A 71 9.008 -2.979 2.866 1.00 2.03 H new ATOM 0 HD3 PRO A 71 9.780 -1.543 3.508 1.00 2.03 H new ATOM 1040 N ASN A 72 12.058 -3.132 -1.073 1.00 1.39 N ATOM 1041 CA ASN A 72 12.094 -3.760 -2.380 1.00 1.34 C ATOM 1042 C ASN A 72 12.919 -5.023 -2.210 1.00 1.24 C ATOM 1043 O ASN A 72 14.120 -4.904 -1.990 1.00 1.27 O ATOM 1044 CB ASN A 72 12.762 -2.829 -3.419 1.00 1.71 C ATOM 1045 CG ASN A 72 12.163 -1.426 -3.489 1.00 2.23 C ATOM 1046 OD1 ASN A 72 12.305 -0.642 -2.559 1.00 2.49 O ATOM 1047 ND2 ASN A 72 11.525 -1.053 -4.592 1.00 3.32 N ATOM 0 H ASN A 72 12.978 -3.002 -0.651 1.00 1.39 H new ATOM 0 HA ASN A 72 11.088 -3.975 -2.741 1.00 1.34 H new ATOM 0 HB2 ASN A 72 13.823 -2.746 -3.185 1.00 1.71 H new ATOM 0 HB3 ASN A 72 12.688 -3.292 -4.403 1.00 1.71 H new ATOM 0 HD21 ASN A 72 11.149 -0.108 -4.669 1.00 3.32 H new ATOM 0 HD22 ASN A 72 11.411 -1.712 -5.362 1.00 3.32 H new ATOM 1054 N PHE A 73 12.319 -6.214 -2.314 1.00 1.17 N ATOM 1055 CA PHE A 73 13.041 -7.477 -2.153 1.00 1.11 C ATOM 1056 C PHE A 73 14.175 -7.570 -3.184 1.00 1.11 C ATOM 1057 O PHE A 73 15.167 -8.251 -2.959 1.00 1.14 O ATOM 1058 CB PHE A 73 12.107 -8.691 -2.267 1.00 1.10 C ATOM 1059 CG PHE A 73 11.086 -8.942 -1.162 1.00 2.39 C ATOM 1060 CD1 PHE A 73 10.527 -7.907 -0.380 1.00 3.70 C ATOM 1061 CD2 PHE A 73 10.654 -10.266 -0.945 1.00 3.36 C ATOM 1062 CE1 PHE A 73 9.551 -8.197 0.592 1.00 5.19 C ATOM 1063 CE2 PHE A 73 9.684 -10.555 0.030 1.00 4.73 C ATOM 1064 CZ PHE A 73 9.131 -9.521 0.800 1.00 5.49 C ATOM 0 H PHE A 73 11.325 -6.328 -2.511 1.00 1.17 H new ATOM 0 HA PHE A 73 13.466 -7.491 -1.150 1.00 1.11 H new ATOM 0 HB2 PHE A 73 11.561 -8.599 -3.206 1.00 1.10 H new ATOM 0 HB3 PHE A 73 12.731 -9.581 -2.347 1.00 1.10 H new ATOM 0 HD1 PHE A 73 10.850 -6.887 -0.529 1.00 3.70 H new ATOM 0 HD2 PHE A 73 11.073 -11.068 -1.535 1.00 3.36 H new ATOM 0 HE1 PHE A 73 9.124 -7.398 1.180 1.00 5.19 H new ATOM 0 HE2 PHE A 73 9.364 -11.575 0.187 1.00 4.73 H new ATOM 0 HZ PHE A 73 8.386 -9.742 1.550 1.00 5.49 H new ATOM 1074 N ASN A 74 14.088 -6.812 -4.282 1.00 1.14 N ATOM 1075 CA ASN A 74 15.189 -6.608 -5.219 1.00 1.16 C ATOM 1076 C ASN A 74 16.519 -6.362 -4.491 1.00 1.21 C ATOM 1077 O ASN A 74 17.544 -6.942 -4.839 1.00 1.34 O ATOM 1078 CB ASN A 74 14.802 -5.437 -6.141 1.00 1.16 C ATOM 1079 CG ASN A 74 15.769 -5.146 -7.287 1.00 1.39 C ATOM 1080 OD1 ASN A 74 16.866 -5.681 -7.393 1.00 1.84 O ATOM 1081 ND2 ASN A 74 15.387 -4.236 -8.173 1.00 2.07 N ATOM 0 H ASN A 74 13.236 -6.317 -4.545 1.00 1.14 H new ATOM 0 HA ASN A 74 15.350 -7.507 -5.814 1.00 1.16 H new ATOM 0 HB2 ASN A 74 13.818 -5.642 -6.564 1.00 1.16 H new ATOM 0 HB3 ASN A 74 14.707 -4.537 -5.534 1.00 1.16 H new ATOM 0 HD21 ASN A 74 16.007 -3.982 -8.942 1.00 2.07 H new ATOM 0 HD22 ASN A 74 14.474 -3.790 -8.085 1.00 2.07 H new ATOM 1088 N LYS A 75 16.511 -5.478 -3.488 1.00 1.24 N ATOM 1089 CA LYS A 75 17.677 -5.097 -2.688 1.00 1.29 C ATOM 1090 C LYS A 75 17.457 -5.434 -1.207 1.00 1.23 C ATOM 1091 O LYS A 75 18.142 -4.889 -0.346 1.00 1.23 O ATOM 1092 CB LYS A 75 17.963 -3.592 -2.882 1.00 1.40 C ATOM 1093 CG LYS A 75 18.976 -3.299 -3.997 1.00 1.38 C ATOM 1094 CD LYS A 75 18.439 -3.621 -5.390 1.00 2.78 C ATOM 1095 CE LYS A 75 19.526 -3.488 -6.457 1.00 2.80 C ATOM 1096 NZ LYS A 75 19.326 -4.494 -7.524 1.00 4.64 N ATOM 0 H LYS A 75 15.662 -4.991 -3.202 1.00 1.24 H new ATOM 0 HA LYS A 75 18.544 -5.666 -3.025 1.00 1.29 H new ATOM 0 HB2 LYS A 75 17.028 -3.079 -3.108 1.00 1.40 H new ATOM 0 HB3 LYS A 75 18.336 -3.178 -1.945 1.00 1.40 H new ATOM 0 HG2 LYS A 75 19.258 -2.247 -3.957 1.00 1.38 H new ATOM 0 HG3 LYS A 75 19.882 -3.879 -3.819 1.00 1.38 H new ATOM 0 HD2 LYS A 75 18.040 -4.635 -5.401 1.00 2.78 H new ATOM 0 HD3 LYS A 75 17.613 -2.950 -5.626 1.00 2.78 H new ATOM 0 HE2 LYS A 75 19.504 -2.486 -6.885 1.00 2.80 H new ATOM 0 HE3 LYS A 75 20.508 -3.620 -6.003 1.00 2.80 H new ATOM 0 HZ1 LYS A 75 19.558 -4.073 -8.446 1.00 4.64 H new ATOM 0 HZ2 LYS A 75 19.945 -5.311 -7.351 1.00 4.64 H new ATOM 0 HZ3 LYS A 75 18.334 -4.806 -7.526 1.00 4.64 H new ATOM 1110 N VAL A 76 16.534 -6.340 -0.889 1.00 1.21 N ATOM 1111 CA VAL A 76 16.231 -6.708 0.492 1.00 1.24 C ATOM 1112 C VAL A 76 16.124 -8.228 0.593 1.00 1.15 C ATOM 1113 O VAL A 76 15.445 -8.858 -0.211 1.00 1.27 O ATOM 1114 CB VAL A 76 14.970 -5.948 0.961 1.00 1.34 C ATOM 1115 CG1 VAL A 76 14.261 -6.620 2.128 1.00 0.87 C ATOM 1116 CG2 VAL A 76 15.379 -4.541 1.390 1.00 1.90 C ATOM 0 H VAL A 76 15.976 -6.839 -1.581 1.00 1.21 H new ATOM 0 HA VAL A 76 17.031 -6.411 1.170 1.00 1.24 H new ATOM 0 HB VAL A 76 14.274 -5.935 0.123 1.00 1.34 H new ATOM 0 HG11 VAL A 76 13.385 -6.035 2.407 1.00 0.87 H new ATOM 0 HG12 VAL A 76 13.950 -7.623 1.836 1.00 0.87 H new ATOM 0 HG13 VAL A 76 14.940 -6.684 2.978 1.00 0.87 H new ATOM 0 HG21 VAL A 76 14.499 -3.992 1.724 1.00 1.90 H new ATOM 0 HG22 VAL A 76 16.098 -4.604 2.206 1.00 1.90 H new ATOM 0 HG23 VAL A 76 15.833 -4.021 0.546 1.00 1.90 H new ATOM 1126 N SER A 77 16.802 -8.834 1.574 1.00 1.03 N ATOM 1127 CA SER A 77 16.833 -10.266 1.752 1.00 0.93 C ATOM 1128 C SER A 77 15.432 -10.700 2.121 1.00 0.86 C ATOM 1129 O SER A 77 14.759 -9.983 2.845 1.00 0.80 O ATOM 1130 CB SER A 77 17.790 -10.585 2.904 1.00 1.00 C ATOM 1131 OG SER A 77 19.004 -9.885 2.717 1.00 1.77 O ATOM 0 H SER A 77 17.348 -8.325 2.269 1.00 1.03 H new ATOM 0 HA SER A 77 17.167 -10.779 0.850 1.00 0.93 H new ATOM 0 HB2 SER A 77 17.338 -10.303 3.855 1.00 1.00 H new ATOM 0 HB3 SER A 77 17.979 -11.658 2.947 1.00 1.00 H new ATOM 0 HG SER A 77 19.616 -10.088 3.455 1.00 1.77 H new ATOM 1137 N GLU A 78 15.014 -11.893 1.720 1.00 0.91 N ATOM 1138 CA GLU A 78 13.683 -12.416 2.005 1.00 0.93 C ATOM 1139 C GLU A 78 13.342 -12.363 3.497 1.00 0.90 C ATOM 1140 O GLU A 78 12.180 -12.236 3.859 1.00 0.91 O ATOM 1141 CB GLU A 78 13.611 -13.844 1.455 1.00 1.02 C ATOM 1142 CG GLU A 78 13.200 -13.798 -0.026 1.00 1.48 C ATOM 1143 CD GLU A 78 13.633 -15.044 -0.806 1.00 2.61 C ATOM 1144 OE1 GLU A 78 14.709 -14.977 -1.451 1.00 4.05 O ATOM 1145 OE2 GLU A 78 12.876 -16.037 -0.795 1.00 2.81 O ATOM 0 H GLU A 78 15.597 -12.534 1.181 1.00 0.91 H new ATOM 0 HA GLU A 78 12.936 -11.790 1.517 1.00 0.93 H new ATOM 0 HB2 GLU A 78 14.578 -14.336 1.561 1.00 1.02 H new ATOM 0 HB3 GLU A 78 12.891 -14.430 2.026 1.00 1.02 H new ATOM 0 HG2 GLU A 78 12.117 -13.692 -0.094 1.00 1.48 H new ATOM 0 HG3 GLU A 78 13.637 -12.915 -0.491 1.00 1.48 H new ATOM 1152 N VAL A 79 14.349 -12.427 4.367 1.00 0.90 N ATOM 1153 CA VAL A 79 14.137 -12.350 5.812 1.00 0.90 C ATOM 1154 C VAL A 79 13.723 -10.929 6.190 1.00 0.86 C ATOM 1155 O VAL A 79 12.773 -10.717 6.940 1.00 0.93 O ATOM 1156 CB VAL A 79 15.413 -12.787 6.553 1.00 0.94 C ATOM 1157 CG1 VAL A 79 15.313 -12.579 8.070 1.00 1.00 C ATOM 1158 CG2 VAL A 79 15.681 -14.273 6.288 1.00 0.96 C ATOM 0 H VAL A 79 15.326 -12.533 4.094 1.00 0.90 H new ATOM 0 HA VAL A 79 13.335 -13.027 6.107 1.00 0.90 H new ATOM 0 HB VAL A 79 16.226 -12.166 6.176 1.00 0.94 H new ATOM 0 HG11 VAL A 79 16.240 -12.903 8.544 1.00 1.00 H new ATOM 0 HG12 VAL A 79 15.147 -11.523 8.282 1.00 1.00 H new ATOM 0 HG13 VAL A 79 14.481 -13.163 8.463 1.00 1.00 H new ATOM 0 HG21 VAL A 79 16.585 -14.579 6.814 1.00 0.96 H new ATOM 0 HG22 VAL A 79 14.837 -14.864 6.643 1.00 0.96 H new ATOM 0 HG23 VAL A 79 15.812 -14.434 5.218 1.00 0.96 H new ATOM 1168 N GLU A 80 14.462 -9.942 5.688 1.00 0.79 N ATOM 1169 CA GLU A 80 14.214 -8.554 6.033 1.00 0.75 C ATOM 1170 C GLU A 80 12.920 -8.109 5.380 1.00 0.69 C ATOM 1171 O GLU A 80 12.092 -7.515 6.044 1.00 0.67 O ATOM 1172 CB GLU A 80 15.426 -7.708 5.618 1.00 0.83 C ATOM 1173 CG GLU A 80 15.206 -6.192 5.747 1.00 1.26 C ATOM 1174 CD GLU A 80 14.973 -5.731 7.187 1.00 1.96 C ATOM 1175 OE1 GLU A 80 15.122 -6.567 8.104 1.00 2.62 O ATOM 1176 OE2 GLU A 80 14.645 -4.534 7.355 1.00 3.12 O ATOM 0 H GLU A 80 15.237 -10.083 5.040 1.00 0.79 H new ATOM 0 HA GLU A 80 14.092 -8.426 7.109 1.00 0.75 H new ATOM 0 HB2 GLU A 80 16.282 -7.994 6.230 1.00 0.83 H new ATOM 0 HB3 GLU A 80 15.681 -7.941 4.584 1.00 0.83 H new ATOM 0 HG2 GLU A 80 16.074 -5.671 5.343 1.00 1.26 H new ATOM 0 HG3 GLU A 80 14.349 -5.904 5.138 1.00 1.26 H new ATOM 1183 N GLY A 81 12.710 -8.408 4.103 1.00 0.77 N ATOM 1184 CA GLY A 81 11.492 -8.071 3.399 1.00 0.73 C ATOM 1185 C GLY A 81 10.275 -8.798 3.938 1.00 0.73 C ATOM 1186 O GLY A 81 9.187 -8.252 3.827 1.00 0.70 O ATOM 0 H GLY A 81 13.394 -8.898 3.526 1.00 0.77 H new ATOM 0 HA2 GLY A 81 11.326 -6.996 3.467 1.00 0.73 H new ATOM 0 HA3 GLY A 81 11.612 -8.309 2.342 1.00 0.73 H new ATOM 1190 N ASP A 82 10.406 -9.994 4.510 1.00 0.79 N ATOM 1191 CA ASP A 82 9.276 -10.617 5.193 1.00 0.83 C ATOM 1192 C ASP A 82 8.867 -9.737 6.367 1.00 0.77 C ATOM 1193 O ASP A 82 7.709 -9.339 6.484 1.00 0.75 O ATOM 1194 CB ASP A 82 9.626 -12.027 5.672 1.00 0.94 C ATOM 1195 CG ASP A 82 8.503 -12.599 6.536 1.00 1.16 C ATOM 1196 OD1 ASP A 82 7.429 -12.880 5.960 1.00 2.26 O ATOM 1197 OD2 ASP A 82 8.733 -12.742 7.757 1.00 1.37 O ATOM 0 H ASP A 82 11.267 -10.542 4.515 1.00 0.79 H new ATOM 0 HA ASP A 82 8.444 -10.711 4.495 1.00 0.83 H new ATOM 0 HB2 ASP A 82 9.797 -12.676 4.813 1.00 0.94 H new ATOM 0 HB3 ASP A 82 10.554 -12.002 6.243 1.00 0.94 H new ATOM 1202 N LYS A 83 9.830 -9.367 7.216 1.00 0.76 N ATOM 1203 CA LYS A 83 9.516 -8.535 8.365 1.00 0.73 C ATOM 1204 C LYS A 83 8.967 -7.198 7.921 1.00 0.68 C ATOM 1205 O LYS A 83 7.955 -6.772 8.445 1.00 0.68 O ATOM 1206 CB LYS A 83 10.736 -8.328 9.268 1.00 0.76 C ATOM 1207 CG LYS A 83 10.786 -9.358 10.408 1.00 0.79 C ATOM 1208 CD LYS A 83 11.343 -8.709 11.680 1.00 1.75 C ATOM 1209 CE LYS A 83 10.300 -7.741 12.255 1.00 3.81 C ATOM 1210 NZ LYS A 83 10.873 -6.809 13.243 1.00 4.88 N ATOM 0 H LYS A 83 10.812 -9.627 7.127 1.00 0.76 H new ATOM 0 HA LYS A 83 8.755 -9.058 8.945 1.00 0.73 H new ATOM 0 HB2 LYS A 83 11.646 -8.402 8.672 1.00 0.76 H new ATOM 0 HB3 LYS A 83 10.711 -7.322 9.688 1.00 0.76 H new ATOM 0 HG2 LYS A 83 9.787 -9.750 10.598 1.00 0.79 H new ATOM 0 HG3 LYS A 83 11.411 -10.203 10.118 1.00 0.79 H new ATOM 0 HD2 LYS A 83 11.589 -9.475 12.415 1.00 1.75 H new ATOM 0 HD3 LYS A 83 12.266 -8.175 11.455 1.00 1.75 H new ATOM 0 HE2 LYS A 83 9.852 -7.171 11.441 1.00 3.81 H new ATOM 0 HE3 LYS A 83 9.499 -8.313 12.723 1.00 3.81 H new ATOM 0 HZ1 LYS A 83 10.444 -6.983 14.174 1.00 4.88 H new ATOM 0 HZ2 LYS A 83 11.901 -6.955 13.302 1.00 4.88 H new ATOM 0 HZ3 LYS A 83 10.679 -5.830 12.950 1.00 4.88 H new ATOM 1224 N GLN A 84 9.619 -6.528 6.983 1.00 0.66 N ATOM 1225 CA GLN A 84 9.240 -5.203 6.524 1.00 0.62 C ATOM 1226 C GLN A 84 7.876 -5.264 5.847 1.00 0.65 C ATOM 1227 O GLN A 84 7.080 -4.343 5.990 1.00 0.66 O ATOM 1228 CB GLN A 84 10.307 -4.676 5.564 1.00 0.62 C ATOM 1229 CG GLN A 84 11.620 -4.328 6.287 1.00 1.48 C ATOM 1230 CD GLN A 84 11.510 -3.050 7.114 1.00 2.32 C ATOM 1231 OE1 GLN A 84 10.572 -2.279 6.956 1.00 2.20 O ATOM 1232 NE2 GLN A 84 12.469 -2.791 7.990 1.00 3.62 N ATOM 0 H GLN A 84 10.443 -6.899 6.511 1.00 0.66 H new ATOM 0 HA GLN A 84 9.169 -4.522 7.372 1.00 0.62 H new ATOM 0 HB2 GLN A 84 10.504 -5.425 4.797 1.00 0.62 H new ATOM 0 HB3 GLN A 84 9.929 -3.790 5.055 1.00 0.62 H new ATOM 0 HG2 GLN A 84 11.903 -5.155 6.938 1.00 1.48 H new ATOM 0 HG3 GLN A 84 12.417 -4.214 5.552 1.00 1.48 H new ATOM 0 HE21 GLN A 84 13.243 -3.445 8.108 1.00 3.62 H new ATOM 0 HE22 GLN A 84 12.434 -1.937 8.547 1.00 3.62 H new ATOM 1241 N LEU A 85 7.570 -6.348 5.129 1.00 0.68 N ATOM 1242 CA LEU A 85 6.247 -6.512 4.532 1.00 0.68 C ATOM 1243 C LEU A 85 5.212 -6.615 5.647 1.00 0.68 C ATOM 1244 O LEU A 85 4.153 -5.996 5.573 1.00 0.67 O ATOM 1245 CB LEU A 85 6.240 -7.728 3.584 1.00 0.72 C ATOM 1246 CG LEU A 85 4.935 -7.985 2.805 1.00 0.71 C ATOM 1247 CD1 LEU A 85 4.386 -6.695 2.189 1.00 0.96 C ATOM 1248 CD2 LEU A 85 5.227 -8.964 1.665 1.00 1.03 C ATOM 0 H LEU A 85 8.215 -7.117 4.949 1.00 0.68 H new ATOM 0 HA LEU A 85 5.988 -5.647 3.921 1.00 0.68 H new ATOM 0 HB2 LEU A 85 7.049 -7.604 2.864 1.00 0.72 H new ATOM 0 HB3 LEU A 85 6.469 -8.618 4.170 1.00 0.72 H new ATOM 0 HG LEU A 85 4.198 -8.386 3.501 1.00 0.71 H new ATOM 0 HD11 LEU A 85 3.466 -6.913 1.647 1.00 0.96 H new ATOM 0 HD12 LEU A 85 4.179 -5.974 2.980 1.00 0.96 H new ATOM 0 HD13 LEU A 85 5.122 -6.278 1.501 1.00 0.96 H new ATOM 0 HD21 LEU A 85 4.311 -9.155 1.105 1.00 1.03 H new ATOM 0 HD22 LEU A 85 5.976 -8.535 1.000 1.00 1.03 H new ATOM 0 HD23 LEU A 85 5.602 -9.901 2.077 1.00 1.03 H new ATOM 1260 N ALA A 86 5.527 -7.351 6.713 1.00 0.68 N ATOM 1261 CA ALA A 86 4.632 -7.484 7.847 1.00 0.67 C ATOM 1262 C ALA A 86 4.604 -6.216 8.692 1.00 0.63 C ATOM 1263 O ALA A 86 3.628 -5.993 9.390 1.00 0.59 O ATOM 1264 CB ALA A 86 5.064 -8.678 8.699 1.00 0.70 C ATOM 0 H ALA A 86 6.403 -7.865 6.808 1.00 0.68 H new ATOM 0 HA ALA A 86 3.623 -7.648 7.469 1.00 0.67 H new ATOM 0 HB1 ALA A 86 4.392 -8.779 9.551 1.00 0.70 H new ATOM 0 HB2 ALA A 86 5.026 -9.586 8.098 1.00 0.70 H new ATOM 0 HB3 ALA A 86 6.082 -8.521 9.056 1.00 0.70 H new ATOM 1270 N GLU A 87 5.640 -5.384 8.655 1.00 0.65 N ATOM 1271 CA GLU A 87 5.720 -4.149 9.422 1.00 0.62 C ATOM 1272 C GLU A 87 4.918 -3.058 8.718 1.00 0.59 C ATOM 1273 O GLU A 87 4.256 -2.239 9.355 1.00 0.58 O ATOM 1274 CB GLU A 87 7.185 -3.759 9.648 1.00 0.52 C ATOM 1275 CG GLU A 87 7.707 -4.523 10.873 1.00 0.68 C ATOM 1276 CD GLU A 87 9.046 -4.013 11.409 1.00 0.87 C ATOM 1277 OE1 GLU A 87 9.782 -4.854 11.982 1.00 2.10 O ATOM 1278 OE2 GLU A 87 9.313 -2.799 11.298 1.00 1.51 O ATOM 0 H GLU A 87 6.464 -5.555 8.078 1.00 0.65 H new ATOM 0 HA GLU A 87 5.279 -4.291 10.409 1.00 0.62 H new ATOM 0 HB2 GLU A 87 7.782 -4.000 8.768 1.00 0.52 H new ATOM 0 HB3 GLU A 87 7.271 -2.684 9.807 1.00 0.52 H new ATOM 0 HG2 GLU A 87 6.964 -4.463 11.668 1.00 0.68 H new ATOM 0 HG3 GLU A 87 7.811 -5.576 10.613 1.00 0.68 H new ATOM 1285 N ALA A 88 4.895 -3.096 7.388 1.00 0.62 N ATOM 1286 CA ALA A 88 4.029 -2.233 6.609 1.00 0.63 C ATOM 1287 C ALA A 88 2.585 -2.631 6.902 1.00 0.63 C ATOM 1288 O ALA A 88 1.765 -1.805 7.292 1.00 0.64 O ATOM 1289 CB ALA A 88 4.367 -2.358 5.120 1.00 0.64 C ATOM 0 H ALA A 88 5.474 -3.723 6.829 1.00 0.62 H new ATOM 0 HA ALA A 88 4.172 -1.187 6.880 1.00 0.63 H new ATOM 0 HB1 ALA A 88 3.712 -1.706 4.542 1.00 0.64 H new ATOM 0 HB2 ALA A 88 5.404 -2.066 4.957 1.00 0.64 H new ATOM 0 HB3 ALA A 88 4.226 -3.390 4.800 1.00 0.64 H new ATOM 1295 N TYR A 89 2.278 -3.916 6.732 1.00 0.63 N ATOM 1296 CA TYR A 89 0.966 -4.482 6.955 1.00 0.64 C ATOM 1297 C TYR A 89 0.515 -4.375 8.405 1.00 0.64 C ATOM 1298 O TYR A 89 -0.680 -4.238 8.625 1.00 0.65 O ATOM 1299 CB TYR A 89 0.985 -5.942 6.480 1.00 0.64 C ATOM 1300 CG TYR A 89 0.916 -6.184 4.977 1.00 0.67 C ATOM 1301 CD1 TYR A 89 1.406 -7.401 4.464 1.00 1.96 C ATOM 1302 CD2 TYR A 89 0.330 -5.250 4.093 1.00 2.08 C ATOM 1303 CE1 TYR A 89 1.296 -7.697 3.094 1.00 2.05 C ATOM 1304 CE2 TYR A 89 0.237 -5.531 2.719 1.00 2.07 C ATOM 1305 CZ TYR A 89 0.706 -6.760 2.217 1.00 0.85 C ATOM 1306 OH TYR A 89 0.557 -7.048 0.897 1.00 0.98 O ATOM 0 H TYR A 89 2.963 -4.606 6.425 1.00 0.63 H new ATOM 0 HA TYR A 89 0.236 -3.909 6.383 1.00 0.64 H new ATOM 0 HB2 TYR A 89 1.896 -6.408 6.856 1.00 0.64 H new ATOM 0 HB3 TYR A 89 0.146 -6.460 6.945 1.00 0.64 H new ATOM 0 HD1 TYR A 89 1.871 -8.114 5.129 1.00 1.96 H new ATOM 0 HD2 TYR A 89 -0.049 -4.314 4.476 1.00 2.08 H new ATOM 0 HE1 TYR A 89 1.662 -8.639 2.713 1.00 2.05 H new ATOM 0 HE2 TYR A 89 -0.195 -4.803 2.048 1.00 2.07 H new ATOM 0 HH TYR A 89 0.248 -7.973 0.797 1.00 0.98 H new ATOM 1316 N GLU A 90 1.400 -4.415 9.398 1.00 0.64 N ATOM 1317 CA GLU A 90 0.968 -4.304 10.789 1.00 0.71 C ATOM 1318 C GLU A 90 0.778 -2.840 11.131 1.00 0.57 C ATOM 1319 O GLU A 90 -0.172 -2.504 11.824 1.00 0.59 O ATOM 1320 CB GLU A 90 1.879 -5.042 11.781 1.00 0.97 C ATOM 1321 CG GLU A 90 3.211 -4.328 12.029 1.00 1.70 C ATOM 1322 CD GLU A 90 3.224 -3.325 13.189 1.00 2.63 C ATOM 1323 OE1 GLU A 90 4.316 -2.783 13.460 1.00 3.61 O ATOM 1324 OE2 GLU A 90 2.154 -3.108 13.797 1.00 3.01 O ATOM 0 H GLU A 90 2.406 -4.522 9.269 1.00 0.64 H new ATOM 0 HA GLU A 90 0.012 -4.817 10.890 1.00 0.71 H new ATOM 0 HB2 GLU A 90 1.354 -5.156 12.729 1.00 0.97 H new ATOM 0 HB3 GLU A 90 2.077 -6.045 11.404 1.00 0.97 H new ATOM 0 HG2 GLU A 90 3.976 -5.081 12.216 1.00 1.70 H new ATOM 0 HG3 GLU A 90 3.496 -3.804 11.117 1.00 1.70 H new ATOM 1331 N SER A 91 1.602 -1.948 10.577 1.00 0.53 N ATOM 1332 CA SER A 91 1.376 -0.530 10.754 1.00 0.50 C ATOM 1333 C SER A 91 0.009 -0.184 10.190 1.00 0.46 C ATOM 1334 O SER A 91 -0.756 0.534 10.822 1.00 0.48 O ATOM 1335 CB SER A 91 2.448 0.316 10.056 1.00 0.54 C ATOM 1336 OG SER A 91 3.714 0.266 10.683 1.00 0.91 O ATOM 0 H SER A 91 2.417 -2.187 10.012 1.00 0.53 H new ATOM 0 HA SER A 91 1.426 -0.305 11.819 1.00 0.50 H new ATOM 0 HB2 SER A 91 2.550 -0.023 9.025 1.00 0.54 H new ATOM 0 HB3 SER A 91 2.112 1.352 10.019 1.00 0.54 H new ATOM 0 HG SER A 91 4.184 -0.548 10.407 1.00 0.91 H new ATOM 1342 N ILE A 92 -0.321 -0.681 8.999 1.00 0.45 N ATOM 1343 CA ILE A 92 -1.556 -0.306 8.347 1.00 0.43 C ATOM 1344 C ILE A 92 -2.717 -0.995 9.052 1.00 0.47 C ATOM 1345 O ILE A 92 -3.746 -0.373 9.273 1.00 0.46 O ATOM 1346 CB ILE A 92 -1.461 -0.601 6.838 1.00 0.54 C ATOM 1347 CG1 ILE A 92 -1.075 0.665 6.066 1.00 0.63 C ATOM 1348 CG2 ILE A 92 -2.784 -1.052 6.250 1.00 0.66 C ATOM 1349 CD1 ILE A 92 0.366 1.050 6.336 1.00 1.03 C ATOM 0 H ILE A 92 0.253 -1.341 8.475 1.00 0.45 H new ATOM 0 HA ILE A 92 -1.738 0.766 8.425 1.00 0.43 H new ATOM 0 HB ILE A 92 -0.714 -1.389 6.742 1.00 0.54 H new ATOM 0 HG12 ILE A 92 -1.217 0.501 4.998 1.00 0.63 H new ATOM 0 HG13 ILE A 92 -1.734 1.485 6.353 1.00 0.63 H new ATOM 0 HG21 ILE A 92 -2.661 -1.246 5.185 1.00 0.66 H new ATOM 0 HG22 ILE A 92 -3.112 -1.963 6.750 1.00 0.66 H new ATOM 0 HG23 ILE A 92 -3.531 -0.271 6.392 1.00 0.66 H new ATOM 0 HD11 ILE A 92 0.613 1.952 5.775 1.00 1.03 H new ATOM 0 HD12 ILE A 92 0.499 1.237 7.402 1.00 1.03 H new ATOM 0 HD13 ILE A 92 1.024 0.238 6.025 1.00 1.03 H new ATOM 1361 N ALA A 93 -2.574 -2.268 9.412 1.00 0.56 N ATOM 1362 CA ALA A 93 -3.666 -3.038 9.998 1.00 0.62 C ATOM 1363 C ALA A 93 -4.004 -2.486 11.381 1.00 0.59 C ATOM 1364 O ALA A 93 -5.166 -2.307 11.740 1.00 0.58 O ATOM 1365 CB ALA A 93 -3.287 -4.520 10.065 1.00 0.79 C ATOM 0 H ALA A 93 -1.705 -2.791 9.307 1.00 0.56 H new ATOM 0 HA ALA A 93 -4.553 -2.948 9.371 1.00 0.62 H new ATOM 0 HB1 ALA A 93 -4.109 -5.086 10.504 1.00 0.79 H new ATOM 0 HB2 ALA A 93 -3.087 -4.890 9.059 1.00 0.79 H new ATOM 0 HB3 ALA A 93 -2.395 -4.640 10.679 1.00 0.79 H new ATOM 1371 N LYS A 94 -2.985 -2.171 12.174 1.00 0.59 N ATOM 1372 CA LYS A 94 -3.204 -1.505 13.440 1.00 0.59 C ATOM 1373 C LYS A 94 -3.786 -0.126 13.197 1.00 0.50 C ATOM 1374 O LYS A 94 -4.714 0.230 13.902 1.00 0.48 O ATOM 1375 CB LYS A 94 -1.932 -1.462 14.291 1.00 0.64 C ATOM 1376 CG LYS A 94 -1.676 -2.862 14.861 1.00 1.32 C ATOM 1377 CD LYS A 94 -0.528 -2.859 15.876 1.00 1.79 C ATOM 1378 CE LYS A 94 -0.746 -3.922 16.954 1.00 3.11 C ATOM 1379 NZ LYS A 94 -1.799 -3.516 17.911 1.00 4.49 N ATOM 0 H LYS A 94 -2.007 -2.367 11.959 1.00 0.59 H new ATOM 0 HA LYS A 94 -3.926 -2.081 14.018 1.00 0.59 H new ATOM 0 HB2 LYS A 94 -1.084 -1.139 13.687 1.00 0.64 H new ATOM 0 HB3 LYS A 94 -2.042 -0.739 15.099 1.00 0.64 H new ATOM 0 HG2 LYS A 94 -2.583 -3.232 15.339 1.00 1.32 H new ATOM 0 HG3 LYS A 94 -1.441 -3.549 14.048 1.00 1.32 H new ATOM 0 HD2 LYS A 94 0.416 -3.044 15.363 1.00 1.79 H new ATOM 0 HD3 LYS A 94 -0.451 -1.876 16.340 1.00 1.79 H new ATOM 0 HE2 LYS A 94 -1.024 -4.866 16.485 1.00 3.11 H new ATOM 0 HE3 LYS A 94 0.187 -4.095 17.490 1.00 3.11 H new ATOM 0 HZ1 LYS A 94 -1.761 -4.130 18.750 1.00 4.49 H new ATOM 0 HZ2 LYS A 94 -1.645 -2.528 18.198 1.00 4.49 H new ATOM 0 HZ3 LYS A 94 -2.732 -3.604 17.459 1.00 4.49 H new ATOM 1393 N ILE A 95 -3.322 0.632 12.200 1.00 0.45 N ATOM 1394 CA ILE A 95 -3.897 1.948 11.911 1.00 0.39 C ATOM 1395 C ILE A 95 -5.369 1.809 11.519 1.00 0.37 C ATOM 1396 O ILE A 95 -6.177 2.676 11.830 1.00 0.36 O ATOM 1397 CB ILE A 95 -3.063 2.688 10.842 1.00 0.38 C ATOM 1398 CG1 ILE A 95 -1.796 3.262 11.505 1.00 0.58 C ATOM 1399 CG2 ILE A 95 -3.833 3.832 10.159 1.00 0.75 C ATOM 1400 CD1 ILE A 95 -0.739 3.722 10.492 1.00 0.57 C ATOM 0 H ILE A 95 -2.556 0.360 11.584 1.00 0.45 H new ATOM 0 HA ILE A 95 -3.861 2.560 12.812 1.00 0.39 H new ATOM 0 HB ILE A 95 -2.814 1.962 10.068 1.00 0.38 H new ATOM 0 HG12 ILE A 95 -2.075 4.105 12.137 1.00 0.58 H new ATOM 0 HG13 ILE A 95 -1.360 2.505 12.157 1.00 0.58 H new ATOM 0 HG21 ILE A 95 -3.192 4.311 9.419 1.00 0.75 H new ATOM 0 HG22 ILE A 95 -4.719 3.431 9.666 1.00 0.75 H new ATOM 0 HG23 ILE A 95 -4.135 4.565 10.907 1.00 0.75 H new ATOM 0 HD11 ILE A 95 0.127 4.115 11.024 1.00 0.57 H new ATOM 0 HD12 ILE A 95 -0.433 2.876 9.876 1.00 0.57 H new ATOM 0 HD13 ILE A 95 -1.159 4.501 9.856 1.00 0.57 H new ATOM 1412 N VAL A 96 -5.745 0.722 10.854 1.00 0.42 N ATOM 1413 CA VAL A 96 -7.113 0.462 10.445 1.00 0.44 C ATOM 1414 C VAL A 96 -7.970 0.324 11.690 1.00 0.45 C ATOM 1415 O VAL A 96 -9.068 0.866 11.751 1.00 0.47 O ATOM 1416 CB VAL A 96 -7.148 -0.785 9.539 1.00 0.54 C ATOM 1417 CG1 VAL A 96 -8.520 -1.464 9.456 1.00 0.68 C ATOM 1418 CG2 VAL A 96 -6.725 -0.401 8.121 1.00 0.56 C ATOM 0 H VAL A 96 -5.093 -0.014 10.581 1.00 0.42 H new ATOM 0 HA VAL A 96 -7.519 1.285 9.857 1.00 0.44 H new ATOM 0 HB VAL A 96 -6.460 -1.498 9.994 1.00 0.54 H new ATOM 0 HG11 VAL A 96 -8.457 -2.332 8.799 1.00 0.68 H new ATOM 0 HG12 VAL A 96 -8.829 -1.784 10.451 1.00 0.68 H new ATOM 0 HG13 VAL A 96 -9.251 -0.760 9.058 1.00 0.68 H new ATOM 0 HG21 VAL A 96 -6.750 -1.284 7.482 1.00 0.56 H new ATOM 0 HG22 VAL A 96 -7.409 0.351 7.728 1.00 0.56 H new ATOM 0 HG23 VAL A 96 -5.713 0.004 8.140 1.00 0.56 H new ATOM 1428 N ASN A 97 -7.470 -0.367 12.706 1.00 0.51 N ATOM 1429 CA ASN A 97 -8.268 -0.614 13.894 1.00 0.60 C ATOM 1430 C ASN A 97 -8.271 0.630 14.772 1.00 0.58 C ATOM 1431 O ASN A 97 -9.275 0.946 15.399 1.00 0.66 O ATOM 1432 CB ASN A 97 -7.714 -1.809 14.680 1.00 0.70 C ATOM 1433 CG ASN A 97 -7.982 -3.147 13.996 1.00 0.92 C ATOM 1434 OD1 ASN A 97 -8.646 -3.221 12.969 1.00 1.72 O ATOM 1435 ND2 ASN A 97 -7.484 -4.236 14.569 1.00 1.12 N ATOM 0 H ASN A 97 -6.529 -0.760 12.730 1.00 0.51 H new ATOM 0 HA ASN A 97 -9.288 -0.848 13.590 1.00 0.60 H new ATOM 0 HB2 ASN A 97 -6.639 -1.683 14.812 1.00 0.70 H new ATOM 0 HB3 ASN A 97 -8.159 -1.820 15.675 1.00 0.70 H new ATOM 0 HD21 ASN A 97 -7.652 -5.153 14.154 1.00 1.12 H new ATOM 0 HD22 ASN A 97 -6.933 -4.156 15.424 1.00 1.12 H new ATOM 1442 N ASP A 98 -7.144 1.339 14.803 1.00 0.54 N ATOM 1443 CA ASP A 98 -6.922 2.514 15.637 1.00 0.59 C ATOM 1444 C ASP A 98 -7.859 3.622 15.173 1.00 0.60 C ATOM 1445 O ASP A 98 -8.497 4.310 15.965 1.00 0.69 O ATOM 1446 CB ASP A 98 -5.456 2.946 15.513 1.00 0.59 C ATOM 1447 CG ASP A 98 -5.061 3.931 16.607 1.00 1.21 C ATOM 1448 OD1 ASP A 98 -5.129 5.149 16.339 1.00 2.35 O ATOM 1449 OD2 ASP A 98 -4.660 3.437 17.684 1.00 2.12 O ATOM 0 H ASP A 98 -6.335 1.102 14.229 1.00 0.54 H new ATOM 0 HA ASP A 98 -7.128 2.292 16.684 1.00 0.59 H new ATOM 0 HB2 ASP A 98 -4.813 2.068 15.565 1.00 0.59 H new ATOM 0 HB3 ASP A 98 -5.293 3.403 14.537 1.00 0.59 H new ATOM 1454 N ASN A 99 -7.980 3.746 13.850 1.00 0.52 N ATOM 1455 CA ASN A 99 -8.850 4.729 13.222 1.00 0.56 C ATOM 1456 C ASN A 99 -10.255 4.170 13.015 1.00 0.59 C ATOM 1457 O ASN A 99 -11.169 4.907 12.647 1.00 0.66 O ATOM 1458 CB ASN A 99 -8.250 5.133 11.879 1.00 0.53 C ATOM 1459 CG ASN A 99 -8.428 6.612 11.573 1.00 0.65 C ATOM 1460 OD1 ASN A 99 -7.485 7.280 11.164 1.00 0.98 O ATOM 1461 ND2 ASN A 99 -9.631 7.154 11.712 1.00 2.09 N ATOM 0 H ASN A 99 -7.473 3.162 13.185 1.00 0.52 H new ATOM 0 HA ASN A 99 -8.929 5.598 13.876 1.00 0.56 H new ATOM 0 HB2 ASN A 99 -7.187 4.891 11.874 1.00 0.53 H new ATOM 0 HB3 ASN A 99 -8.714 4.545 11.087 1.00 0.53 H new ATOM 0 HD21 ASN A 99 -9.778 8.136 11.478 1.00 2.09 H new ATOM 0 HD22 ASN A 99 -10.409 6.589 12.053 1.00 2.09 H new ATOM 1468 N ASN A 100 -10.422 2.866 13.229 1.00 0.60 N ATOM 1469 CA ASN A 100 -11.684 2.149 13.159 1.00 0.67 C ATOM 1470 C ASN A 100 -12.298 2.221 11.766 1.00 0.61 C ATOM 1471 O ASN A 100 -13.488 2.491 11.613 1.00 0.67 O ATOM 1472 CB ASN A 100 -12.631 2.702 14.226 1.00 0.81 C ATOM 1473 CG ASN A 100 -13.816 1.778 14.466 1.00 1.09 C ATOM 1474 OD1 ASN A 100 -13.817 0.623 14.068 1.00 1.23 O ATOM 1475 ND2 ASN A 100 -14.856 2.274 15.124 1.00 2.37 N ATOM 0 H ASN A 100 -9.640 2.256 13.467 1.00 0.60 H new ATOM 0 HA ASN A 100 -11.504 1.092 13.356 1.00 0.67 H new ATOM 0 HB2 ASN A 100 -12.085 2.842 15.159 1.00 0.81 H new ATOM 0 HB3 ASN A 100 -12.992 3.683 13.918 1.00 0.81 H new ATOM 0 HD21 ASN A 100 -15.672 1.689 15.304 1.00 2.37 H new ATOM 0 HD22 ASN A 100 -14.840 3.240 15.450 1.00 2.37 H new ATOM 1482 N TYR A 101 -11.494 2.013 10.730 1.00 0.56 N ATOM 1483 CA TYR A 101 -11.989 1.966 9.366 1.00 0.54 C ATOM 1484 C TYR A 101 -12.681 0.640 9.052 1.00 0.73 C ATOM 1485 O TYR A 101 -12.220 -0.429 9.433 1.00 0.99 O ATOM 1486 CB TYR A 101 -10.840 2.219 8.401 1.00 0.63 C ATOM 1487 CG TYR A 101 -10.168 3.570 8.557 1.00 0.58 C ATOM 1488 CD1 TYR A 101 -8.766 3.674 8.509 1.00 1.46 C ATOM 1489 CD2 TYR A 101 -10.946 4.735 8.700 1.00 1.92 C ATOM 1490 CE1 TYR A 101 -8.145 4.937 8.527 1.00 1.47 C ATOM 1491 CE2 TYR A 101 -10.339 5.998 8.675 1.00 2.17 C ATOM 1492 CZ TYR A 101 -8.936 6.108 8.562 1.00 1.16 C ATOM 1493 OH TYR A 101 -8.361 7.342 8.534 1.00 1.59 O ATOM 0 H TYR A 101 -10.487 1.873 10.814 1.00 0.56 H new ATOM 0 HA TYR A 101 -12.740 2.747 9.249 1.00 0.54 H new ATOM 0 HB2 TYR A 101 -10.091 1.438 8.536 1.00 0.63 H new ATOM 0 HB3 TYR A 101 -11.214 2.130 7.381 1.00 0.63 H new ATOM 0 HD1 TYR A 101 -8.163 2.780 8.458 1.00 1.46 H new ATOM 0 HD2 TYR A 101 -12.015 4.655 8.830 1.00 1.92 H new ATOM 0 HE1 TYR A 101 -7.068 5.011 8.514 1.00 1.47 H new ATOM 0 HE2 TYR A 101 -10.946 6.889 8.742 1.00 2.17 H new ATOM 0 HH TYR A 101 -7.832 7.475 9.348 1.00 1.59 H new ATOM 1503 N LYS A 102 -13.798 0.732 8.321 1.00 0.79 N ATOM 1504 CA LYS A 102 -14.603 -0.400 7.889 1.00 1.08 C ATOM 1505 C LYS A 102 -14.018 -1.053 6.639 1.00 0.96 C ATOM 1506 O LYS A 102 -14.344 -2.195 6.337 1.00 1.18 O ATOM 1507 CB LYS A 102 -16.034 0.055 7.570 1.00 1.48 C ATOM 1508 CG LYS A 102 -16.899 0.378 8.796 1.00 1.76 C ATOM 1509 CD LYS A 102 -16.943 1.857 9.201 1.00 2.48 C ATOM 1510 CE LYS A 102 -15.690 2.288 9.966 1.00 2.52 C ATOM 1511 NZ LYS A 102 -15.981 3.338 10.964 1.00 3.52 N ATOM 0 H LYS A 102 -14.172 1.628 8.008 1.00 0.79 H new ATOM 0 HA LYS A 102 -14.608 -1.123 8.705 1.00 1.08 H new ATOM 0 HB2 LYS A 102 -15.985 0.940 6.935 1.00 1.48 H new ATOM 0 HB3 LYS A 102 -16.527 -0.726 6.991 1.00 1.48 H new ATOM 0 HG2 LYS A 102 -17.917 0.043 8.599 1.00 1.76 H new ATOM 0 HG3 LYS A 102 -16.530 -0.202 9.642 1.00 1.76 H new ATOM 0 HD2 LYS A 102 -17.050 2.473 8.308 1.00 2.48 H new ATOM 0 HD3 LYS A 102 -17.823 2.036 9.819 1.00 2.48 H new ATOM 0 HE2 LYS A 102 -15.256 1.423 10.467 1.00 2.52 H new ATOM 0 HE3 LYS A 102 -14.944 2.655 9.261 1.00 2.52 H new ATOM 0 HZ1 LYS A 102 -15.182 3.421 11.624 1.00 3.52 H new ATOM 0 HZ2 LYS A 102 -16.125 4.247 10.480 1.00 3.52 H new ATOM 0 HZ3 LYS A 102 -16.841 3.087 11.492 1.00 3.52 H new ATOM 1525 N SER A 103 -13.202 -0.317 5.891 1.00 0.85 N ATOM 1526 CA SER A 103 -12.551 -0.777 4.677 1.00 0.96 C ATOM 1527 C SER A 103 -11.420 0.204 4.388 1.00 0.92 C ATOM 1528 O SER A 103 -11.449 1.329 4.888 1.00 1.02 O ATOM 1529 CB SER A 103 -13.563 -0.811 3.526 1.00 1.23 C ATOM 1530 OG SER A 103 -14.334 0.375 3.496 1.00 1.43 O ATOM 0 H SER A 103 -12.970 0.648 6.124 1.00 0.85 H new ATOM 0 HA SER A 103 -12.156 -1.787 4.789 1.00 0.96 H new ATOM 0 HB2 SER A 103 -13.038 -0.932 2.578 1.00 1.23 H new ATOM 0 HB3 SER A 103 -14.220 -1.674 3.639 1.00 1.23 H new ATOM 0 HG SER A 103 -14.972 0.332 2.753 1.00 1.43 H new ATOM 1536 N VAL A 104 -10.415 -0.208 3.615 1.00 0.86 N ATOM 1537 CA VAL A 104 -9.301 0.650 3.240 1.00 0.90 C ATOM 1538 C VAL A 104 -8.805 0.195 1.880 1.00 0.87 C ATOM 1539 O VAL A 104 -8.732 -1.007 1.623 1.00 0.96 O ATOM 1540 CB VAL A 104 -8.183 0.561 4.297 1.00 1.00 C ATOM 1541 CG1 VAL A 104 -6.827 1.062 3.794 1.00 1.91 C ATOM 1542 CG2 VAL A 104 -8.568 1.389 5.529 1.00 1.53 C ATOM 0 H VAL A 104 -10.354 -1.151 3.232 1.00 0.86 H new ATOM 0 HA VAL A 104 -9.617 1.692 3.188 1.00 0.90 H new ATOM 0 HB VAL A 104 -8.079 -0.497 4.538 1.00 1.00 H new ATOM 0 HG11 VAL A 104 -6.087 0.970 4.589 1.00 1.91 H new ATOM 0 HG12 VAL A 104 -6.514 0.466 2.937 1.00 1.91 H new ATOM 0 HG13 VAL A 104 -6.913 2.107 3.497 1.00 1.91 H new ATOM 0 HG21 VAL A 104 -7.775 1.323 6.274 1.00 1.53 H new ATOM 0 HG22 VAL A 104 -8.708 2.430 5.238 1.00 1.53 H new ATOM 0 HG23 VAL A 104 -9.496 1.003 5.952 1.00 1.53 H new ATOM 1552 N ALA A 105 -8.421 1.152 1.035 1.00 0.78 N ATOM 1553 CA ALA A 105 -7.762 0.848 -0.217 1.00 0.77 C ATOM 1554 C ALA A 105 -6.273 0.702 0.074 1.00 0.78 C ATOM 1555 O ALA A 105 -5.582 1.687 0.318 1.00 0.76 O ATOM 1556 CB ALA A 105 -8.036 1.969 -1.222 1.00 0.78 C ATOM 0 H ALA A 105 -8.560 2.148 1.205 1.00 0.78 H new ATOM 0 HA ALA A 105 -8.136 -0.078 -0.654 1.00 0.77 H new ATOM 0 HB1 ALA A 105 -7.540 1.741 -2.165 1.00 0.78 H new ATOM 0 HB2 ALA A 105 -9.110 2.054 -1.388 1.00 0.78 H new ATOM 0 HB3 ALA A 105 -7.653 2.911 -0.829 1.00 0.78 H new ATOM 1562 N ILE A 106 -5.772 -0.531 0.014 1.00 0.87 N ATOM 1563 CA ILE A 106 -4.387 -0.930 0.210 1.00 0.92 C ATOM 1564 C ILE A 106 -3.915 -1.557 -1.115 1.00 0.95 C ATOM 1565 O ILE A 106 -4.581 -2.445 -1.642 1.00 1.02 O ATOM 1566 CB ILE A 106 -4.319 -1.892 1.422 1.00 1.06 C ATOM 1567 CG1 ILE A 106 -3.015 -2.705 1.488 1.00 2.09 C ATOM 1568 CG2 ILE A 106 -5.510 -2.867 1.462 1.00 1.18 C ATOM 1569 CD1 ILE A 106 -1.868 -1.941 2.152 1.00 3.29 C ATOM 0 H ILE A 106 -6.370 -1.332 -0.188 1.00 0.87 H new ATOM 0 HA ILE A 106 -3.723 -0.098 0.445 1.00 0.92 H new ATOM 0 HB ILE A 106 -4.356 -1.234 2.290 1.00 1.06 H new ATOM 0 HG12 ILE A 106 -3.196 -3.628 2.039 1.00 2.09 H new ATOM 0 HG13 ILE A 106 -2.719 -2.989 0.478 1.00 2.09 H new ATOM 0 HG21 ILE A 106 -5.416 -3.520 2.330 1.00 1.18 H new ATOM 0 HG22 ILE A 106 -6.440 -2.303 1.531 1.00 1.18 H new ATOM 0 HG23 ILE A 106 -5.518 -3.469 0.554 1.00 1.18 H new ATOM 0 HD11 ILE A 106 -0.976 -2.567 2.169 1.00 3.29 H new ATOM 0 HD12 ILE A 106 -1.663 -1.031 1.588 1.00 3.29 H new ATOM 0 HD13 ILE A 106 -2.147 -1.680 3.173 1.00 3.29 H new ATOM 1581 N PRO A 107 -2.805 -1.087 -1.705 1.00 1.01 N ATOM 1582 CA PRO A 107 -2.312 -1.618 -2.964 1.00 1.01 C ATOM 1583 C PRO A 107 -1.516 -2.903 -2.717 1.00 1.01 C ATOM 1584 O PRO A 107 -1.313 -3.328 -1.581 1.00 1.12 O ATOM 1585 CB PRO A 107 -1.432 -0.503 -3.531 1.00 1.13 C ATOM 1586 CG PRO A 107 -0.817 0.095 -2.267 1.00 1.25 C ATOM 1587 CD PRO A 107 -1.947 -0.010 -1.242 1.00 1.19 C ATOM 0 HA PRO A 107 -3.109 -1.888 -3.657 1.00 1.01 H new ATOM 0 HB2 PRO A 107 -0.672 -0.889 -4.210 1.00 1.13 H new ATOM 0 HB3 PRO A 107 -2.014 0.232 -4.088 1.00 1.13 H new ATOM 0 HG2 PRO A 107 0.067 -0.458 -1.949 1.00 1.25 H new ATOM 0 HG3 PRO A 107 -0.508 1.129 -2.420 1.00 1.25 H new ATOM 0 HD2 PRO A 107 -1.554 -0.223 -0.248 1.00 1.19 H new ATOM 0 HD3 PRO A 107 -2.499 0.927 -1.172 1.00 1.19 H new ATOM 1595 N LEU A 108 -1.035 -3.527 -3.789 1.00 1.02 N ATOM 1596 CA LEU A 108 -0.264 -4.751 -3.696 1.00 1.08 C ATOM 1597 C LEU A 108 1.198 -4.351 -3.554 1.00 1.22 C ATOM 1598 O LEU A 108 1.767 -3.726 -4.445 1.00 1.39 O ATOM 1599 CB LEU A 108 -0.495 -5.611 -4.947 1.00 1.16 C ATOM 1600 CG LEU A 108 -1.965 -6.041 -5.071 1.00 1.31 C ATOM 1601 CD1 LEU A 108 -2.296 -6.389 -6.523 1.00 1.91 C ATOM 1602 CD2 LEU A 108 -2.288 -7.231 -4.161 1.00 1.70 C ATOM 0 H LEU A 108 -1.172 -3.194 -4.743 1.00 1.02 H new ATOM 0 HA LEU A 108 -0.568 -5.349 -2.837 1.00 1.08 H new ATOM 0 HB2 LEU A 108 -0.203 -5.050 -5.835 1.00 1.16 H new ATOM 0 HB3 LEU A 108 0.141 -6.495 -4.905 1.00 1.16 H new ATOM 0 HG LEU A 108 -2.580 -5.200 -4.752 1.00 1.31 H new ATOM 0 HD11 LEU A 108 -3.341 -6.692 -6.596 1.00 1.91 H new ATOM 0 HD12 LEU A 108 -2.126 -5.517 -7.154 1.00 1.91 H new ATOM 0 HD13 LEU A 108 -1.657 -7.207 -6.856 1.00 1.91 H new ATOM 0 HD21 LEU A 108 -3.337 -7.504 -4.278 1.00 1.70 H new ATOM 0 HD22 LEU A 108 -1.659 -8.079 -4.434 1.00 1.70 H new ATOM 0 HD23 LEU A 108 -2.098 -6.957 -3.123 1.00 1.70 H new ATOM 1614 N LEU A 109 1.806 -4.695 -2.422 1.00 1.36 N ATOM 1615 CA LEU A 109 3.242 -4.527 -2.235 1.00 1.61 C ATOM 1616 C LEU A 109 3.973 -5.672 -2.942 1.00 1.25 C ATOM 1617 O LEU A 109 3.330 -6.501 -3.584 1.00 1.11 O ATOM 1618 CB LEU A 109 3.566 -4.448 -0.736 1.00 2.34 C ATOM 1619 CG LEU A 109 2.944 -3.203 -0.078 1.00 2.03 C ATOM 1620 CD1 LEU A 109 3.140 -3.277 1.437 1.00 2.72 C ATOM 1621 CD2 LEU A 109 3.582 -1.906 -0.589 1.00 1.58 C ATOM 0 H LEU A 109 1.323 -5.094 -1.617 1.00 1.36 H new ATOM 0 HA LEU A 109 3.584 -3.592 -2.680 1.00 1.61 H new ATOM 0 HB2 LEU A 109 3.197 -5.344 -0.237 1.00 2.34 H new ATOM 0 HB3 LEU A 109 4.647 -4.429 -0.599 1.00 2.34 H new ATOM 0 HG LEU A 109 1.885 -3.191 -0.335 1.00 2.03 H new ATOM 0 HD11 LEU A 109 2.700 -2.396 1.904 1.00 2.72 H new ATOM 0 HD12 LEU A 109 2.655 -4.173 1.823 1.00 2.72 H new ATOM 0 HD13 LEU A 109 4.205 -3.315 1.665 1.00 2.72 H new ATOM 0 HD21 LEU A 109 3.114 -1.052 -0.099 1.00 1.58 H new ATOM 0 HD22 LEU A 109 4.649 -1.913 -0.365 1.00 1.58 H new ATOM 0 HD23 LEU A 109 3.438 -1.830 -1.667 1.00 1.58 H new ATOM 1633 N SER A 110 5.310 -5.659 -2.903 1.00 1.42 N ATOM 1634 CA SER A 110 6.201 -6.630 -3.536 1.00 1.31 C ATOM 1635 C SER A 110 5.708 -7.153 -4.884 1.00 1.27 C ATOM 1636 O SER A 110 5.771 -8.345 -5.163 1.00 1.63 O ATOM 1637 CB SER A 110 6.543 -7.765 -2.590 1.00 1.68 C ATOM 1638 OG SER A 110 7.023 -7.236 -1.371 1.00 1.80 O ATOM 0 H SER A 110 5.823 -4.933 -2.403 1.00 1.42 H new ATOM 0 HA SER A 110 7.114 -6.079 -3.761 1.00 1.31 H new ATOM 0 HB2 SER A 110 5.661 -8.380 -2.409 1.00 1.68 H new ATOM 0 HB3 SER A 110 7.296 -8.412 -3.039 1.00 1.68 H new ATOM 0 HG SER A 110 7.787 -7.767 -1.062 1.00 1.80 H new ATOM 1644 N THR A 111 5.273 -6.255 -5.763 1.00 1.17 N ATOM 1645 CA THR A 111 4.794 -6.637 -7.076 1.00 1.36 C ATOM 1646 C THR A 111 5.310 -5.607 -8.068 1.00 1.67 C ATOM 1647 O THR A 111 6.316 -5.875 -8.713 1.00 2.01 O ATOM 1648 CB THR A 111 3.269 -6.759 -7.054 1.00 1.52 C ATOM 1649 OG1 THR A 111 2.725 -5.665 -6.351 1.00 2.07 O ATOM 1650 CG2 THR A 111 2.808 -8.063 -6.400 1.00 1.50 C ATOM 0 H THR A 111 5.245 -5.252 -5.582 1.00 1.17 H new ATOM 0 HA THR A 111 5.165 -7.616 -7.381 1.00 1.36 H new ATOM 0 HB THR A 111 2.919 -6.763 -8.086 1.00 1.52 H new ATOM 0 HG1 THR A 111 2.807 -5.822 -5.387 1.00 2.07 H new ATOM 0 HG21 THR A 111 1.719 -8.108 -6.406 1.00 1.50 H new ATOM 0 HG22 THR A 111 3.209 -8.910 -6.956 1.00 1.50 H new ATOM 0 HG23 THR A 111 3.167 -8.101 -5.372 1.00 1.50 H new ATOM 1658 N GLY A 112 4.677 -4.427 -8.120 1.00 2.97 N ATOM 1659 CA GLY A 112 4.953 -3.347 -9.066 1.00 3.66 C ATOM 1660 C GLY A 112 6.430 -3.228 -9.437 1.00 2.66 C ATOM 1661 O GLY A 112 6.823 -3.609 -10.535 1.00 2.99 O ATOM 0 H GLY A 112 3.925 -4.193 -7.472 1.00 2.97 H new ATOM 0 HA2 GLY A 112 4.370 -3.510 -9.973 1.00 3.66 H new ATOM 0 HA3 GLY A 112 4.617 -2.403 -8.637 1.00 3.66 H new ATOM 1665 N ILE A 113 7.248 -2.696 -8.524 1.00 1.98 N ATOM 1666 CA ILE A 113 8.696 -2.640 -8.694 1.00 1.31 C ATOM 1667 C ILE A 113 9.389 -2.862 -7.345 1.00 1.28 C ATOM 1668 O ILE A 113 10.379 -2.203 -7.027 1.00 1.42 O ATOM 1669 CB ILE A 113 9.125 -1.306 -9.345 1.00 1.77 C ATOM 1670 CG1 ILE A 113 8.610 -0.069 -8.582 1.00 1.56 C ATOM 1671 CG2 ILE A 113 8.677 -1.227 -10.812 1.00 3.36 C ATOM 1672 CD1 ILE A 113 9.752 0.908 -8.299 1.00 2.31 C ATOM 0 H ILE A 113 6.921 -2.292 -7.646 1.00 1.98 H new ATOM 0 HA ILE A 113 9.004 -3.438 -9.369 1.00 1.31 H new ATOM 0 HB ILE A 113 10.214 -1.294 -9.298 1.00 1.77 H new ATOM 0 HG12 ILE A 113 7.836 0.428 -9.167 1.00 1.56 H new ATOM 0 HG13 ILE A 113 8.150 -0.380 -7.644 1.00 1.56 H new ATOM 0 HG21 ILE A 113 8.995 -0.276 -11.239 1.00 3.36 H new ATOM 0 HG22 ILE A 113 9.126 -2.046 -11.374 1.00 3.36 H new ATOM 0 HG23 ILE A 113 7.591 -1.303 -10.865 1.00 3.36 H new ATOM 0 HD11 ILE A 113 9.366 1.773 -7.760 1.00 2.31 H new ATOM 0 HD12 ILE A 113 10.512 0.414 -7.694 1.00 2.31 H new ATOM 0 HD13 ILE A 113 10.193 1.235 -9.241 1.00 2.31 H new ATOM 1684 N PHE A 114 8.890 -3.800 -6.531 1.00 1.35 N ATOM 1685 CA PHE A 114 9.378 -3.982 -5.177 1.00 1.41 C ATOM 1686 C PHE A 114 10.018 -5.365 -5.058 1.00 1.42 C ATOM 1687 O PHE A 114 11.184 -5.468 -4.685 1.00 1.42 O ATOM 1688 CB PHE A 114 8.249 -3.678 -4.188 1.00 1.57 C ATOM 1689 CG PHE A 114 7.856 -2.213 -4.193 1.00 1.46 C ATOM 1690 CD1 PHE A 114 8.574 -1.284 -3.420 1.00 1.60 C ATOM 1691 CD2 PHE A 114 6.796 -1.766 -5.005 1.00 2.70 C ATOM 1692 CE1 PHE A 114 8.257 0.083 -3.478 1.00 1.69 C ATOM 1693 CE2 PHE A 114 6.479 -0.398 -5.066 1.00 2.67 C ATOM 1694 CZ PHE A 114 7.214 0.529 -4.307 1.00 1.52 C ATOM 0 H PHE A 114 8.145 -4.443 -6.797 1.00 1.35 H new ATOM 0 HA PHE A 114 10.171 -3.279 -4.923 1.00 1.41 H new ATOM 0 HB2 PHE A 114 7.379 -4.286 -4.436 1.00 1.57 H new ATOM 0 HB3 PHE A 114 8.562 -3.964 -3.184 1.00 1.57 H new ATOM 0 HD1 PHE A 114 9.374 -1.623 -2.778 1.00 1.60 H new ATOM 0 HD2 PHE A 114 6.224 -2.477 -5.583 1.00 2.70 H new ATOM 0 HE1 PHE A 114 8.815 0.792 -2.885 1.00 1.69 H new ATOM 0 HE2 PHE A 114 5.670 -0.059 -5.696 1.00 2.67 H new ATOM 0 HZ PHE A 114 6.978 1.581 -4.361 1.00 1.52 H new ATOM 1704 N SER A 115 9.298 -6.425 -5.438 1.00 1.44 N ATOM 1705 CA SER A 115 9.806 -7.795 -5.461 1.00 1.50 C ATOM 1706 C SER A 115 11.142 -7.906 -6.198 1.00 1.24 C ATOM 1707 O SER A 115 12.054 -8.595 -5.744 1.00 1.20 O ATOM 1708 CB SER A 115 8.735 -8.705 -6.074 1.00 1.70 C ATOM 1709 OG SER A 115 9.175 -10.010 -6.386 1.00 2.53 O ATOM 0 H SER A 115 8.328 -6.351 -5.744 1.00 1.44 H new ATOM 0 HA SER A 115 10.010 -8.115 -4.439 1.00 1.50 H new ATOM 0 HB2 SER A 115 7.897 -8.775 -5.380 1.00 1.70 H new ATOM 0 HB3 SER A 115 8.357 -8.237 -6.983 1.00 1.70 H new ATOM 0 HG SER A 115 8.399 -10.591 -6.529 1.00 2.53 H new ATOM 1715 N GLY A 116 11.269 -7.259 -7.357 1.00 1.21 N ATOM 1716 CA GLY A 116 12.393 -7.511 -8.239 1.00 1.14 C ATOM 1717 C GLY A 116 12.100 -8.790 -9.006 1.00 1.28 C ATOM 1718 O GLY A 116 11.699 -8.735 -10.165 1.00 2.09 O ATOM 0 H GLY A 116 10.608 -6.562 -7.699 1.00 1.21 H new ATOM 0 HA2 GLY A 116 12.535 -6.677 -8.926 1.00 1.14 H new ATOM 0 HA3 GLY A 116 13.314 -7.611 -7.665 1.00 1.14 H new ATOM 1722 N ASN A 117 12.281 -9.942 -8.360 1.00 1.33 N ATOM 1723 CA ASN A 117 11.869 -11.218 -8.924 1.00 1.68 C ATOM 1724 C ASN A 117 11.879 -12.266 -7.813 1.00 1.80 C ATOM 1725 O ASN A 117 12.962 -12.711 -7.444 1.00 2.40 O ATOM 1726 CB ASN A 117 12.816 -11.613 -10.076 1.00 2.35 C ATOM 1727 CG ASN A 117 12.020 -11.914 -11.335 1.00 2.86 C ATOM 1728 OD1 ASN A 117 11.162 -12.788 -11.330 1.00 3.26 O ATOM 1729 ND2 ASN A 117 12.278 -11.200 -12.422 1.00 3.46 N ATOM 0 H ASN A 117 12.714 -10.013 -7.439 1.00 1.33 H new ATOM 0 HA ASN A 117 10.862 -11.146 -9.335 1.00 1.68 H new ATOM 0 HB2 ASN A 117 13.522 -10.805 -10.269 1.00 2.35 H new ATOM 0 HB3 ASN A 117 13.402 -12.487 -9.791 1.00 2.35 H new ATOM 0 HD21 ASN A 117 11.756 -11.373 -13.281 1.00 3.46 H new ATOM 0 HD22 ASN A 117 12.998 -10.478 -12.399 1.00 3.46 H new ATOM 1736 N LYS A 118 10.706 -12.637 -7.275 1.00 2.03 N ATOM 1737 CA LYS A 118 10.496 -13.735 -6.320 1.00 2.43 C ATOM 1738 C LYS A 118 9.094 -13.675 -5.723 1.00 2.30 C ATOM 1739 O LYS A 118 8.332 -14.627 -5.866 1.00 3.36 O ATOM 1740 CB LYS A 118 11.546 -13.756 -5.195 1.00 3.04 C ATOM 1741 CG LYS A 118 12.617 -14.825 -5.452 1.00 3.63 C ATOM 1742 CD LYS A 118 13.866 -14.452 -4.660 1.00 4.48 C ATOM 1743 CE LYS A 118 14.986 -15.465 -4.891 1.00 5.22 C ATOM 1744 NZ LYS A 118 16.085 -15.237 -3.932 1.00 6.38 N ATOM 0 H LYS A 118 9.837 -12.156 -7.506 1.00 2.03 H new ATOM 0 HA LYS A 118 10.609 -14.660 -6.886 1.00 2.43 H new ATOM 0 HB2 LYS A 118 12.018 -12.777 -5.117 1.00 3.04 H new ATOM 0 HB3 LYS A 118 11.056 -13.951 -4.241 1.00 3.04 H new ATOM 0 HG2 LYS A 118 12.254 -15.807 -5.148 1.00 3.63 H new ATOM 0 HG3 LYS A 118 12.846 -14.885 -6.516 1.00 3.63 H new ATOM 0 HD2 LYS A 118 14.204 -13.458 -4.954 1.00 4.48 H new ATOM 0 HD3 LYS A 118 13.627 -14.406 -3.598 1.00 4.48 H new ATOM 0 HE2 LYS A 118 14.599 -16.478 -4.778 1.00 5.22 H new ATOM 0 HE3 LYS A 118 15.360 -15.378 -5.911 1.00 5.22 H new ATOM 0 HZ1 LYS A 118 16.732 -16.051 -3.946 1.00 6.38 H new ATOM 0 HZ2 LYS A 118 16.605 -14.376 -4.198 1.00 6.38 H new ATOM 0 HZ3 LYS A 118 15.693 -15.123 -2.975 1.00 6.38 H new ATOM 1758 N ASP A 119 8.754 -12.591 -5.029 1.00 2.05 N ATOM 1759 CA ASP A 119 7.421 -12.432 -4.446 1.00 1.79 C ATOM 1760 C ASP A 119 6.424 -12.143 -5.579 1.00 1.10 C ATOM 1761 O ASP A 119 6.846 -11.752 -6.672 1.00 1.28 O ATOM 1762 CB ASP A 119 7.460 -11.310 -3.400 1.00 2.33 C ATOM 1763 CG ASP A 119 6.312 -11.392 -2.390 1.00 3.11 C ATOM 1764 OD1 ASP A 119 6.619 -11.584 -1.198 1.00 4.14 O ATOM 1765 OD2 ASP A 119 5.141 -11.263 -2.815 1.00 3.86 O ATOM 0 H ASP A 119 9.384 -11.808 -4.856 1.00 2.05 H new ATOM 0 HA ASP A 119 7.099 -13.341 -3.937 1.00 1.79 H new ATOM 0 HB2 ASP A 119 8.410 -11.351 -2.866 1.00 2.33 H new ATOM 0 HB3 ASP A 119 7.422 -10.346 -3.908 1.00 2.33 H new ATOM 1770 N ARG A 120 5.122 -12.356 -5.365 1.00 0.97 N ATOM 1771 CA ARG A 120 4.086 -12.091 -6.363 1.00 1.03 C ATOM 1772 C ARG A 120 2.828 -11.583 -5.669 1.00 0.98 C ATOM 1773 O ARG A 120 2.712 -11.590 -4.449 1.00 0.98 O ATOM 1774 CB ARG A 120 3.727 -13.341 -7.181 1.00 1.70 C ATOM 1775 CG ARG A 120 4.778 -13.787 -8.200 1.00 1.89 C ATOM 1776 CD ARG A 120 5.887 -14.648 -7.588 1.00 3.11 C ATOM 1777 NE ARG A 120 6.055 -15.907 -8.335 1.00 3.40 N ATOM 1778 CZ ARG A 120 6.583 -17.039 -7.852 1.00 4.78 C ATOM 1779 NH1 ARG A 120 6.563 -18.147 -8.594 1.00 5.09 N ATOM 1780 NH2 ARG A 120 7.123 -17.071 -6.637 1.00 6.39 N ATOM 0 H ARG A 120 4.756 -12.721 -4.485 1.00 0.97 H new ATOM 0 HA ARG A 120 4.483 -11.342 -7.048 1.00 1.03 H new ATOM 0 HB2 ARG A 120 3.543 -14.165 -6.491 1.00 1.70 H new ATOM 0 HB3 ARG A 120 2.792 -13.152 -7.709 1.00 1.70 H new ATOM 0 HG2 ARG A 120 4.288 -14.349 -8.995 1.00 1.89 H new ATOM 0 HG3 ARG A 120 5.224 -12.906 -8.661 1.00 1.89 H new ATOM 0 HD2 ARG A 120 6.825 -14.093 -7.589 1.00 3.11 H new ATOM 0 HD3 ARG A 120 5.648 -14.868 -6.547 1.00 3.11 H new ATOM 0 HE ARG A 120 5.741 -15.917 -9.306 1.00 3.40 H new ATOM 0 HH11 ARG A 120 6.147 -18.130 -9.525 1.00 5.09 H new ATOM 0 HH12 ARG A 120 6.964 -19.012 -8.230 1.00 5.09 H new ATOM 0 HH21 ARG A 120 7.138 -16.228 -6.063 1.00 6.39 H new ATOM 0 HH22 ARG A 120 7.522 -17.939 -6.279 1.00 6.39 H new ATOM 1794 N LEU A 121 1.820 -11.202 -6.453 1.00 1.01 N ATOM 1795 CA LEU A 121 0.648 -10.572 -5.882 1.00 0.97 C ATOM 1796 C LEU A 121 -0.169 -11.562 -5.106 1.00 0.96 C ATOM 1797 O LEU A 121 -0.689 -11.213 -4.064 1.00 0.93 O ATOM 1798 CB LEU A 121 -0.203 -9.846 -6.920 1.00 1.00 C ATOM 1799 CG LEU A 121 -0.895 -10.693 -8.007 1.00 1.26 C ATOM 1800 CD1 LEU A 121 -2.179 -11.377 -7.522 1.00 2.00 C ATOM 1801 CD2 LEU A 121 -1.261 -9.768 -9.172 1.00 1.74 C ATOM 0 H LEU A 121 1.797 -11.319 -7.466 1.00 1.01 H new ATOM 0 HA LEU A 121 1.010 -9.808 -5.194 1.00 0.97 H new ATOM 0 HB2 LEU A 121 -0.975 -9.289 -6.389 1.00 1.00 H new ATOM 0 HB3 LEU A 121 0.432 -9.114 -7.420 1.00 1.00 H new ATOM 0 HG LEU A 121 -0.198 -11.479 -8.297 1.00 1.26 H new ATOM 0 HD11 LEU A 121 -2.613 -11.956 -8.337 1.00 2.00 H new ATOM 0 HD12 LEU A 121 -1.945 -12.041 -6.690 1.00 2.00 H new ATOM 0 HD13 LEU A 121 -2.892 -10.621 -7.194 1.00 2.00 H new ATOM 0 HD21 LEU A 121 -1.753 -10.346 -9.955 1.00 1.74 H new ATOM 0 HD22 LEU A 121 -1.935 -8.988 -8.819 1.00 1.74 H new ATOM 0 HD23 LEU A 121 -0.356 -9.311 -9.572 1.00 1.74 H new ATOM 1813 N THR A 122 -0.237 -12.796 -5.576 1.00 0.98 N ATOM 1814 CA THR A 122 -0.890 -13.879 -4.892 1.00 0.98 C ATOM 1815 C THR A 122 -0.320 -14.040 -3.490 1.00 0.96 C ATOM 1816 O THR A 122 -1.051 -14.359 -2.557 1.00 0.95 O ATOM 1817 CB THR A 122 -0.650 -15.100 -5.778 1.00 1.04 C ATOM 1818 OG1 THR A 122 -1.251 -14.852 -7.031 1.00 1.09 O ATOM 1819 CG2 THR A 122 -1.211 -16.387 -5.182 1.00 1.14 C ATOM 0 H THR A 122 0.174 -13.071 -6.468 1.00 0.98 H new ATOM 0 HA THR A 122 -1.958 -13.715 -4.746 1.00 0.98 H new ATOM 0 HB THR A 122 0.426 -15.248 -5.872 1.00 1.04 H new ATOM 0 HG1 THR A 122 -1.109 -15.622 -7.620 1.00 1.09 H new ATOM 0 HG21 THR A 122 -1.009 -17.219 -5.857 1.00 1.14 H new ATOM 0 HG22 THR A 122 -0.738 -16.578 -4.219 1.00 1.14 H new ATOM 0 HG23 THR A 122 -2.287 -16.285 -5.043 1.00 1.14 H new ATOM 1827 N GLN A 123 0.983 -13.811 -3.328 1.00 0.98 N ATOM 1828 CA GLN A 123 1.628 -14.003 -2.060 1.00 1.00 C ATOM 1829 C GLN A 123 1.291 -12.807 -1.181 1.00 0.96 C ATOM 1830 O GLN A 123 0.816 -12.967 -0.058 1.00 0.94 O ATOM 1831 CB GLN A 123 3.127 -14.163 -2.324 1.00 1.08 C ATOM 1832 CG GLN A 123 3.910 -14.276 -1.022 1.00 1.80 C ATOM 1833 CD GLN A 123 4.711 -15.571 -0.950 1.00 1.63 C ATOM 1834 OE1 GLN A 123 5.495 -15.887 -1.837 1.00 1.78 O ATOM 1835 NE2 GLN A 123 4.485 -16.367 0.087 1.00 2.80 N ATOM 0 H GLN A 123 1.602 -13.491 -4.072 1.00 0.98 H new ATOM 0 HA GLN A 123 1.290 -14.897 -1.536 1.00 1.00 H new ATOM 0 HB2 GLN A 123 3.298 -15.051 -2.932 1.00 1.08 H new ATOM 0 HB3 GLN A 123 3.491 -13.310 -2.897 1.00 1.08 H new ATOM 0 HG2 GLN A 123 4.586 -13.426 -0.930 1.00 1.80 H new ATOM 0 HG3 GLN A 123 3.221 -14.228 -0.179 1.00 1.80 H new ATOM 0 HE21 GLN A 123 3.828 -16.083 0.814 1.00 2.80 H new ATOM 0 HE22 GLN A 123 4.968 -17.262 0.157 1.00 2.80 H new ATOM 1844 N SER A 124 1.504 -11.596 -1.695 1.00 0.96 N ATOM 1845 CA SER A 124 1.356 -10.408 -0.880 1.00 0.93 C ATOM 1846 C SER A 124 -0.100 -10.236 -0.444 1.00 0.87 C ATOM 1847 O SER A 124 -0.365 -9.804 0.676 1.00 0.87 O ATOM 1848 CB SER A 124 1.924 -9.217 -1.654 1.00 0.96 C ATOM 1849 OG SER A 124 3.337 -9.319 -1.709 1.00 1.49 O ATOM 0 H SER A 124 1.776 -11.420 -2.662 1.00 0.96 H new ATOM 0 HA SER A 124 1.922 -10.492 0.048 1.00 0.93 H new ATOM 0 HB2 SER A 124 1.511 -9.195 -2.662 1.00 0.96 H new ATOM 0 HB3 SER A 124 1.635 -8.284 -1.170 1.00 0.96 H new ATOM 0 HG SER A 124 3.588 -10.126 -2.205 1.00 1.49 H new ATOM 1855 N LEU A 125 -1.044 -10.629 -1.297 1.00 0.85 N ATOM 1856 CA LEU A 125 -2.468 -10.698 -1.015 1.00 0.85 C ATOM 1857 C LEU A 125 -2.724 -11.689 0.093 1.00 0.84 C ATOM 1858 O LEU A 125 -3.469 -11.393 1.015 1.00 0.80 O ATOM 1859 CB LEU A 125 -3.203 -11.056 -2.319 1.00 0.90 C ATOM 1860 CG LEU A 125 -4.623 -11.642 -2.285 1.00 1.18 C ATOM 1861 CD1 LEU A 125 -4.646 -13.162 -2.079 1.00 1.03 C ATOM 1862 CD2 LEU A 125 -5.571 -10.965 -1.298 1.00 2.32 C ATOM 0 H LEU A 125 -0.821 -10.921 -2.248 1.00 0.85 H new ATOM 0 HA LEU A 125 -2.847 -9.738 -0.665 1.00 0.85 H new ATOM 0 HB2 LEU A 125 -3.245 -10.149 -2.923 1.00 0.90 H new ATOM 0 HB3 LEU A 125 -2.575 -11.768 -2.856 1.00 0.90 H new ATOM 0 HG LEU A 125 -5.002 -11.423 -3.283 1.00 1.18 H new ATOM 0 HD11 LEU A 125 -5.678 -13.512 -2.065 1.00 1.03 H new ATOM 0 HD12 LEU A 125 -4.110 -13.648 -2.894 1.00 1.03 H new ATOM 0 HD13 LEU A 125 -4.166 -13.408 -1.132 1.00 1.03 H new ATOM 0 HD21 LEU A 125 -6.548 -11.445 -1.344 1.00 2.32 H new ATOM 0 HD22 LEU A 125 -5.170 -11.055 -0.288 1.00 2.32 H new ATOM 0 HD23 LEU A 125 -5.672 -9.911 -1.556 1.00 2.32 H new ATOM 1874 N ASN A 126 -2.094 -12.852 0.042 1.00 0.89 N ATOM 1875 CA ASN A 126 -2.315 -13.874 1.057 1.00 0.93 C ATOM 1876 C ASN A 126 -2.029 -13.310 2.441 1.00 0.95 C ATOM 1877 O ASN A 126 -2.795 -13.503 3.383 1.00 1.00 O ATOM 1878 CB ASN A 126 -1.443 -15.110 0.809 1.00 0.95 C ATOM 1879 CG ASN A 126 -2.163 -16.368 1.286 1.00 1.12 C ATOM 1880 OD1 ASN A 126 -3.293 -16.643 0.892 1.00 1.49 O ATOM 1881 ND2 ASN A 126 -1.534 -17.160 2.144 1.00 2.06 N ATOM 0 H ASN A 126 -1.429 -13.112 -0.686 1.00 0.89 H new ATOM 0 HA ASN A 126 -3.360 -14.179 0.998 1.00 0.93 H new ATOM 0 HB2 ASN A 126 -1.213 -15.195 -0.253 1.00 0.95 H new ATOM 0 HB3 ASN A 126 -0.493 -15.005 1.333 1.00 0.95 H new ATOM 0 HD21 ASN A 126 -1.989 -18.008 2.483 1.00 2.06 H new ATOM 0 HD22 ASN A 126 -0.595 -16.922 2.464 1.00 2.06 H new ATOM 1888 N HIS A 127 -0.917 -12.589 2.554 1.00 0.93 N ATOM 1889 CA HIS A 127 -0.504 -12.014 3.825 1.00 0.95 C ATOM 1890 C HIS A 127 -1.409 -10.850 4.185 1.00 0.94 C ATOM 1891 O HIS A 127 -1.687 -10.626 5.358 1.00 0.98 O ATOM 1892 CB HIS A 127 0.959 -11.574 3.748 1.00 0.96 C ATOM 1893 CG HIS A 127 1.887 -12.727 3.472 1.00 1.03 C ATOM 1894 ND1 HIS A 127 2.113 -13.805 4.299 1.00 1.25 N ATOM 1895 CD2 HIS A 127 2.620 -12.913 2.334 1.00 0.99 C ATOM 1896 CE1 HIS A 127 2.968 -14.625 3.661 1.00 1.32 C ATOM 1897 NE2 HIS A 127 3.287 -14.140 2.450 1.00 1.16 N ATOM 0 H HIS A 127 -0.286 -12.390 1.777 1.00 0.93 H new ATOM 0 HA HIS A 127 -0.591 -12.766 4.609 1.00 0.95 H new ATOM 0 HB2 HIS A 127 1.070 -10.825 2.964 1.00 0.96 H new ATOM 0 HB3 HIS A 127 1.243 -11.098 4.687 1.00 0.96 H new ATOM 0 HD1 HIS A 127 1.708 -13.954 5.223 1.00 1.25 H new ATOM 0 HD2 HIS A 127 2.675 -12.235 1.495 1.00 0.99 H new ATOM 0 HE1 HIS A 127 3.347 -15.550 4.069 1.00 1.32 H new ATOM 1905 N LEU A 128 -1.906 -10.129 3.184 1.00 0.91 N ATOM 1906 CA LEU A 128 -2.762 -8.982 3.418 1.00 0.94 C ATOM 1907 C LEU A 128 -4.085 -9.440 4.012 1.00 0.97 C ATOM 1908 O LEU A 128 -4.594 -8.830 4.944 1.00 0.97 O ATOM 1909 CB LEU A 128 -2.948 -8.221 2.103 1.00 0.94 C ATOM 1910 CG LEU A 128 -3.865 -7.001 2.218 1.00 1.01 C ATOM 1911 CD1 LEU A 128 -3.427 -6.062 3.342 1.00 2.04 C ATOM 1912 CD2 LEU A 128 -3.845 -6.275 0.871 1.00 0.99 C ATOM 0 H LEU A 128 -1.726 -10.325 2.199 1.00 0.91 H new ATOM 0 HA LEU A 128 -2.304 -8.303 4.137 1.00 0.94 H new ATOM 0 HB2 LEU A 128 -1.972 -7.897 1.741 1.00 0.94 H new ATOM 0 HB3 LEU A 128 -3.356 -8.901 1.355 1.00 0.94 H new ATOM 0 HG LEU A 128 -4.875 -7.329 2.465 1.00 1.01 H new ATOM 0 HD11 LEU A 128 -4.105 -5.210 3.389 1.00 2.04 H new ATOM 0 HD12 LEU A 128 -3.450 -6.596 4.292 1.00 2.04 H new ATOM 0 HD13 LEU A 128 -2.414 -5.710 3.148 1.00 2.04 H new ATOM 0 HD21 LEU A 128 -4.491 -5.398 0.921 1.00 0.99 H new ATOM 0 HD22 LEU A 128 -2.826 -5.963 0.641 1.00 0.99 H new ATOM 0 HD23 LEU A 128 -4.204 -6.946 0.091 1.00 0.99 H new ATOM 1924 N LEU A 129 -4.628 -10.541 3.505 1.00 1.01 N ATOM 1925 CA LEU A 129 -5.822 -11.168 4.025 1.00 1.07 C ATOM 1926 C LEU A 129 -5.555 -11.751 5.395 1.00 1.03 C ATOM 1927 O LEU A 129 -6.437 -11.741 6.239 1.00 1.04 O ATOM 1928 CB LEU A 129 -6.292 -12.258 3.049 1.00 1.15 C ATOM 1929 CG LEU A 129 -7.796 -12.180 2.807 1.00 2.03 C ATOM 1930 CD1 LEU A 129 -8.595 -12.316 4.105 1.00 3.23 C ATOM 1931 CD2 LEU A 129 -8.126 -10.876 2.069 1.00 2.23 C ATOM 0 H LEU A 129 -4.235 -11.029 2.700 1.00 1.01 H new ATOM 0 HA LEU A 129 -6.609 -10.421 4.126 1.00 1.07 H new ATOM 0 HB2 LEU A 129 -5.764 -12.152 2.101 1.00 1.15 H new ATOM 0 HB3 LEU A 129 -6.037 -13.240 3.448 1.00 1.15 H new ATOM 0 HG LEU A 129 -8.091 -13.023 2.182 1.00 2.03 H new ATOM 0 HD11 LEU A 129 -9.661 -12.255 3.884 1.00 3.23 H new ATOM 0 HD12 LEU A 129 -8.375 -13.278 4.568 1.00 3.23 H new ATOM 0 HD13 LEU A 129 -8.319 -11.513 4.788 1.00 3.23 H new ATOM 0 HD21 LEU A 129 -9.200 -10.818 1.895 1.00 2.23 H new ATOM 0 HD22 LEU A 129 -7.810 -10.026 2.674 1.00 2.23 H new ATOM 0 HD23 LEU A 129 -7.602 -10.856 1.113 1.00 2.23 H new ATOM 1943 N THR A 130 -4.344 -12.235 5.650 1.00 0.99 N ATOM 1944 CA THR A 130 -4.046 -12.755 6.973 1.00 0.98 C ATOM 1945 C THR A 130 -4.119 -11.610 7.974 1.00 0.96 C ATOM 1946 O THR A 130 -4.709 -11.744 9.043 1.00 1.00 O ATOM 1947 CB THR A 130 -2.687 -13.468 6.967 1.00 0.96 C ATOM 1948 OG1 THR A 130 -2.728 -14.543 6.054 1.00 0.93 O ATOM 1949 CG2 THR A 130 -2.332 -14.047 8.336 1.00 1.06 C ATOM 0 H THR A 130 -3.577 -12.277 4.979 1.00 0.99 H new ATOM 0 HA THR A 130 -4.780 -13.504 7.272 1.00 0.98 H new ATOM 0 HB THR A 130 -1.938 -12.726 6.690 1.00 0.96 H new ATOM 0 HG1 THR A 130 -2.753 -14.194 5.139 1.00 0.93 H new ATOM 0 HG21 THR A 130 -1.362 -14.541 8.282 1.00 1.06 H new ATOM 0 HG22 THR A 130 -2.289 -13.243 9.071 1.00 1.06 H new ATOM 0 HG23 THR A 130 -3.092 -14.770 8.633 1.00 1.06 H new ATOM 1957 N ALA A 131 -3.561 -10.455 7.613 1.00 0.95 N ATOM 1958 CA ALA A 131 -3.606 -9.306 8.498 1.00 0.96 C ATOM 1959 C ALA A 131 -5.034 -8.794 8.647 1.00 1.04 C ATOM 1960 O ALA A 131 -5.468 -8.455 9.745 1.00 1.10 O ATOM 1961 CB ALA A 131 -2.665 -8.215 7.976 1.00 0.99 C ATOM 0 H ALA A 131 -3.081 -10.297 6.727 1.00 0.95 H new ATOM 0 HA ALA A 131 -3.267 -9.604 9.490 1.00 0.96 H new ATOM 0 HB1 ALA A 131 -2.701 -7.354 8.643 1.00 0.99 H new ATOM 0 HB2 ALA A 131 -1.646 -8.601 7.937 1.00 0.99 H new ATOM 0 HB3 ALA A 131 -2.977 -7.913 6.976 1.00 0.99 H new ATOM 1967 N LEU A 132 -5.778 -8.733 7.546 1.00 1.05 N ATOM 1968 CA LEU A 132 -7.102 -8.121 7.558 1.00 1.05 C ATOM 1969 C LEU A 132 -8.155 -9.098 8.057 1.00 1.05 C ATOM 1970 O LEU A 132 -9.274 -8.701 8.380 1.00 1.07 O ATOM 1971 CB LEU A 132 -7.455 -7.558 6.178 1.00 1.10 C ATOM 1972 CG LEU A 132 -6.625 -6.301 5.864 1.00 1.48 C ATOM 1973 CD1 LEU A 132 -6.860 -5.898 4.416 1.00 1.92 C ATOM 1974 CD2 LEU A 132 -7.018 -5.104 6.738 1.00 2.00 C ATOM 0 H LEU A 132 -5.488 -9.098 6.639 1.00 1.05 H new ATOM 0 HA LEU A 132 -7.084 -7.285 8.257 1.00 1.05 H new ATOM 0 HB2 LEU A 132 -7.275 -8.316 5.416 1.00 1.10 H new ATOM 0 HB3 LEU A 132 -8.517 -7.315 6.142 1.00 1.10 H new ATOM 0 HG LEU A 132 -5.582 -6.552 6.059 1.00 1.48 H new ATOM 0 HD11 LEU A 132 -6.275 -5.008 4.187 1.00 1.92 H new ATOM 0 HD12 LEU A 132 -6.556 -6.712 3.758 1.00 1.92 H new ATOM 0 HD13 LEU A 132 -7.918 -5.685 4.265 1.00 1.92 H new ATOM 0 HD21 LEU A 132 -6.402 -4.244 6.475 1.00 2.00 H new ATOM 0 HD22 LEU A 132 -8.068 -4.862 6.573 1.00 2.00 H new ATOM 0 HD23 LEU A 132 -6.864 -5.354 7.788 1.00 2.00 H new ATOM 1986 N ASP A 133 -7.811 -10.376 8.203 1.00 1.05 N ATOM 1987 CA ASP A 133 -8.729 -11.259 8.906 1.00 1.03 C ATOM 1988 C ASP A 133 -8.739 -10.910 10.389 1.00 0.93 C ATOM 1989 O ASP A 133 -9.756 -11.096 11.052 1.00 0.95 O ATOM 1990 CB ASP A 133 -8.448 -12.745 8.635 1.00 1.19 C ATOM 1991 CG ASP A 133 -9.405 -13.313 7.575 1.00 1.38 C ATOM 1992 OD1 ASP A 133 -10.557 -12.811 7.497 1.00 2.24 O ATOM 1993 OD2 ASP A 133 -8.992 -14.265 6.876 1.00 2.21 O ATOM 0 H ASP A 133 -6.950 -10.804 7.863 1.00 1.05 H new ATOM 0 HA ASP A 133 -9.733 -11.096 8.516 1.00 1.03 H new ATOM 0 HB2 ASP A 133 -7.418 -12.867 8.300 1.00 1.19 H new ATOM 0 HB3 ASP A 133 -8.551 -13.311 9.561 1.00 1.19 H new ATOM 1998 N THR A 134 -7.648 -10.333 10.901 1.00 0.92 N ATOM 1999 CA THR A 134 -7.574 -9.887 12.282 1.00 0.96 C ATOM 2000 C THR A 134 -8.341 -8.581 12.532 1.00 0.89 C ATOM 2001 O THR A 134 -8.427 -8.164 13.686 1.00 1.01 O ATOM 2002 CB THR A 134 -6.100 -9.856 12.729 1.00 1.25 C ATOM 2003 OG1 THR A 134 -5.965 -10.589 13.928 1.00 1.61 O ATOM 2004 CG2 THR A 134 -5.533 -8.464 12.982 1.00 1.55 C ATOM 0 H THR A 134 -6.796 -10.165 10.365 1.00 0.92 H new ATOM 0 HA THR A 134 -8.092 -10.606 12.916 1.00 0.96 H new ATOM 0 HB THR A 134 -5.540 -10.284 11.898 1.00 1.25 H new ATOM 0 HG1 THR A 134 -5.029 -10.574 14.217 1.00 1.61 H new ATOM 0 HG21 THR A 134 -4.491 -8.546 13.292 1.00 1.55 H new ATOM 0 HG22 THR A 134 -5.594 -7.874 12.067 1.00 1.55 H new ATOM 0 HG23 THR A 134 -6.108 -7.974 13.768 1.00 1.55 H new ATOM 2012 N THR A 135 -8.895 -7.920 11.506 1.00 0.85 N ATOM 2013 CA THR A 135 -9.661 -6.700 11.738 1.00 1.06 C ATOM 2014 C THR A 135 -11.133 -7.067 11.921 1.00 1.53 C ATOM 2015 O THR A 135 -11.629 -7.006 13.040 1.00 3.43 O ATOM 2016 CB THR A 135 -9.402 -5.662 10.632 1.00 1.02 C ATOM 2017 OG1 THR A 135 -9.812 -6.135 9.365 1.00 1.19 O ATOM 2018 CG2 THR A 135 -7.907 -5.332 10.550 1.00 1.54 C ATOM 0 H THR A 135 -8.827 -8.206 10.529 1.00 0.85 H new ATOM 0 HA THR A 135 -9.334 -6.213 12.657 1.00 1.06 H new ATOM 0 HB THR A 135 -9.980 -4.774 10.891 1.00 1.02 H new ATOM 0 HG1 THR A 135 -9.400 -7.008 9.193 1.00 1.19 H new ATOM 0 HG21 THR A 135 -7.739 -4.596 9.763 1.00 1.54 H new ATOM 0 HG22 THR A 135 -7.571 -4.926 11.504 1.00 1.54 H new ATOM 0 HG23 THR A 135 -7.346 -6.239 10.324 1.00 1.54 H new ATOM 2026 N ASP A 136 -11.782 -7.473 10.822 1.00 1.24 N ATOM 2027 CA ASP A 136 -13.220 -7.706 10.607 1.00 1.17 C ATOM 2028 C ASP A 136 -13.816 -6.692 9.618 1.00 1.23 C ATOM 2029 O ASP A 136 -15.022 -6.688 9.388 1.00 1.58 O ATOM 2030 CB ASP A 136 -14.084 -7.821 11.877 1.00 1.43 C ATOM 2031 CG ASP A 136 -14.562 -6.493 12.483 1.00 2.31 C ATOM 2032 OD1 ASP A 136 -14.027 -5.424 12.108 1.00 3.21 O ATOM 2033 OD2 ASP A 136 -15.493 -6.574 13.318 1.00 3.08 O ATOM 0 H ASP A 136 -11.258 -7.668 9.969 1.00 1.24 H new ATOM 0 HA ASP A 136 -13.257 -8.703 10.168 1.00 1.17 H new ATOM 0 HB2 ASP A 136 -14.959 -8.428 11.645 1.00 1.43 H new ATOM 0 HB3 ASP A 136 -13.514 -8.360 12.634 1.00 1.43 H new ATOM 2038 N ALA A 137 -12.959 -5.889 8.982 1.00 1.24 N ATOM 2039 CA ALA A 137 -13.322 -4.882 8.004 1.00 1.45 C ATOM 2040 C ALA A 137 -13.526 -5.532 6.627 1.00 1.41 C ATOM 2041 O ALA A 137 -14.548 -6.162 6.366 1.00 1.40 O ATOM 2042 CB ALA A 137 -12.215 -3.811 8.019 1.00 1.73 C ATOM 0 H ALA A 137 -11.953 -5.931 9.147 1.00 1.24 H new ATOM 0 HA ALA A 137 -14.271 -4.403 8.245 1.00 1.45 H new ATOM 0 HB1 ALA A 137 -12.452 -3.033 7.294 1.00 1.73 H new ATOM 0 HB2 ALA A 137 -12.147 -3.371 9.014 1.00 1.73 H new ATOM 0 HB3 ALA A 137 -11.261 -4.270 7.760 1.00 1.73 H new ATOM 2048 N ASP A 138 -12.556 -5.365 5.731 1.00 1.53 N ATOM 2049 CA ASP A 138 -12.643 -5.637 4.302 1.00 1.40 C ATOM 2050 C ASP A 138 -11.251 -5.335 3.740 1.00 1.46 C ATOM 2051 O ASP A 138 -10.428 -4.724 4.429 1.00 1.70 O ATOM 2052 CB ASP A 138 -13.706 -4.697 3.701 1.00 1.36 C ATOM 2053 CG ASP A 138 -13.556 -4.475 2.198 1.00 1.68 C ATOM 2054 OD1 ASP A 138 -13.153 -3.350 1.829 1.00 2.77 O ATOM 2055 OD2 ASP A 138 -13.812 -5.443 1.448 1.00 2.30 O ATOM 0 H ASP A 138 -11.636 -5.016 6.000 1.00 1.53 H new ATOM 0 HA ASP A 138 -12.931 -6.663 4.071 1.00 1.40 H new ATOM 0 HB2 ASP A 138 -14.695 -5.108 3.901 1.00 1.36 H new ATOM 0 HB3 ASP A 138 -13.653 -3.733 4.208 1.00 1.36 H new ATOM 2060 N VAL A 139 -10.973 -5.726 2.500 1.00 1.27 N ATOM 2061 CA VAL A 139 -9.773 -5.286 1.805 1.00 1.22 C ATOM 2062 C VAL A 139 -10.209 -4.677 0.486 1.00 0.95 C ATOM 2063 O VAL A 139 -10.886 -5.342 -0.291 1.00 0.89 O ATOM 2064 CB VAL A 139 -8.790 -6.459 1.635 1.00 1.35 C ATOM 2065 CG1 VAL A 139 -9.277 -7.588 0.726 1.00 1.54 C ATOM 2066 CG2 VAL A 139 -7.447 -5.959 1.099 1.00 1.64 C ATOM 0 H VAL A 139 -11.568 -6.350 1.955 1.00 1.27 H new ATOM 0 HA VAL A 139 -9.233 -4.531 2.377 1.00 1.22 H new ATOM 0 HB VAL A 139 -8.695 -6.879 2.636 1.00 1.35 H new ATOM 0 HG11 VAL A 139 -8.515 -8.365 0.671 1.00 1.54 H new ATOM 0 HG12 VAL A 139 -10.197 -8.010 1.131 1.00 1.54 H new ATOM 0 HG13 VAL A 139 -9.467 -7.195 -0.273 1.00 1.54 H new ATOM 0 HG21 VAL A 139 -6.764 -6.801 0.985 1.00 1.64 H new ATOM 0 HG22 VAL A 139 -7.597 -5.480 0.131 1.00 1.64 H new ATOM 0 HG23 VAL A 139 -7.021 -5.239 1.798 1.00 1.64 H new ATOM 2076 N ALA A 140 -9.791 -3.447 0.189 1.00 0.91 N ATOM 2077 CA ALA A 140 -10.027 -2.887 -1.128 1.00 0.84 C ATOM 2078 C ALA A 140 -8.660 -2.756 -1.773 1.00 0.88 C ATOM 2079 O ALA A 140 -7.702 -2.400 -1.096 1.00 1.23 O ATOM 2080 CB ALA A 140 -10.787 -1.562 -1.034 1.00 0.91 C ATOM 0 H ALA A 140 -9.296 -2.833 0.835 1.00 0.91 H new ATOM 0 HA ALA A 140 -10.665 -3.524 -1.740 1.00 0.84 H new ATOM 0 HB1 ALA A 140 -10.950 -1.164 -2.036 1.00 0.91 H new ATOM 0 HB2 ALA A 140 -11.749 -1.728 -0.548 1.00 0.91 H new ATOM 0 HB3 ALA A 140 -10.204 -0.849 -0.451 1.00 0.91 H new ATOM 2086 N ILE A 141 -8.534 -3.093 -3.052 1.00 0.79 N ATOM 2087 CA ILE A 141 -7.269 -3.123 -3.744 1.00 0.79 C ATOM 2088 C ILE A 141 -7.508 -2.354 -5.035 1.00 0.82 C ATOM 2089 O ILE A 141 -8.577 -2.468 -5.620 1.00 0.90 O ATOM 2090 CB ILE A 141 -6.841 -4.579 -4.005 1.00 0.81 C ATOM 2091 CG1 ILE A 141 -6.975 -5.507 -2.778 1.00 1.05 C ATOM 2092 CG2 ILE A 141 -5.373 -4.558 -4.432 1.00 1.22 C ATOM 2093 CD1 ILE A 141 -6.903 -6.987 -3.165 1.00 1.13 C ATOM 0 H ILE A 141 -9.326 -3.356 -3.639 1.00 0.79 H new ATOM 0 HA ILE A 141 -6.460 -2.674 -3.168 1.00 0.79 H new ATOM 0 HB ILE A 141 -7.506 -4.979 -4.770 1.00 0.81 H new ATOM 0 HG12 ILE A 141 -6.183 -5.280 -2.064 1.00 1.05 H new ATOM 0 HG13 ILE A 141 -7.922 -5.310 -2.276 1.00 1.05 H new ATOM 0 HG21 ILE A 141 -5.036 -5.576 -4.626 1.00 1.22 H new ATOM 0 HG22 ILE A 141 -5.266 -3.962 -5.338 1.00 1.22 H new ATOM 0 HG23 ILE A 141 -4.769 -4.121 -3.637 1.00 1.22 H new ATOM 0 HD11 ILE A 141 -7.002 -7.602 -2.271 1.00 1.13 H new ATOM 0 HD12 ILE A 141 -7.711 -7.222 -3.858 1.00 1.13 H new ATOM 0 HD13 ILE A 141 -5.945 -7.192 -3.642 1.00 1.13 H new ATOM 2105 N TYR A 142 -6.528 -1.570 -5.466 1.00 0.86 N ATOM 2106 CA TYR A 142 -6.574 -0.645 -6.580 1.00 0.99 C ATOM 2107 C TYR A 142 -5.266 -0.735 -7.359 1.00 1.01 C ATOM 2108 O TYR A 142 -4.205 -0.471 -6.799 1.00 1.10 O ATOM 2109 CB TYR A 142 -6.859 0.781 -6.078 1.00 1.08 C ATOM 2110 CG TYR A 142 -5.871 1.349 -5.068 1.00 2.44 C ATOM 2111 CD1 TYR A 142 -5.748 0.768 -3.792 1.00 3.45 C ATOM 2112 CD2 TYR A 142 -5.105 2.492 -5.380 1.00 3.50 C ATOM 2113 CE1 TYR A 142 -4.871 1.316 -2.848 1.00 5.04 C ATOM 2114 CE2 TYR A 142 -4.265 3.066 -4.407 1.00 5.05 C ATOM 2115 CZ TYR A 142 -4.154 2.486 -3.131 1.00 5.72 C ATOM 2116 OH TYR A 142 -3.398 3.052 -2.153 1.00 7.31 O ATOM 0 H TYR A 142 -5.616 -1.568 -5.010 1.00 0.86 H new ATOM 0 HA TYR A 142 -7.388 -0.910 -7.255 1.00 0.99 H new ATOM 0 HB2 TYR A 142 -6.889 1.448 -6.940 1.00 1.08 H new ATOM 0 HB3 TYR A 142 -7.853 0.794 -5.630 1.00 1.08 H new ATOM 0 HD1 TYR A 142 -6.333 -0.104 -3.540 1.00 3.45 H new ATOM 0 HD2 TYR A 142 -5.163 2.927 -6.367 1.00 3.50 H new ATOM 0 HE1 TYR A 142 -4.746 0.831 -1.891 1.00 5.04 H new ATOM 0 HE2 TYR A 142 -3.702 3.957 -4.642 1.00 5.05 H new ATOM 0 HH TYR A 142 -2.449 2.907 -2.348 1.00 7.31 H new ATOM 2126 N CYS A 143 -5.333 -1.142 -8.628 1.00 0.98 N ATOM 2127 CA CYS A 143 -4.229 -1.151 -9.581 1.00 0.97 C ATOM 2128 C CYS A 143 -4.841 -1.207 -10.984 1.00 0.94 C ATOM 2129 O CYS A 143 -5.934 -1.737 -11.166 1.00 0.89 O ATOM 2130 CB CYS A 143 -3.323 -2.376 -9.367 1.00 0.98 C ATOM 2131 SG CYS A 143 -1.903 -1.986 -8.304 1.00 2.18 S ATOM 0 H CYS A 143 -6.201 -1.490 -9.035 1.00 0.98 H new ATOM 0 HA CYS A 143 -3.617 -0.259 -9.448 1.00 0.97 H new ATOM 0 HB2 CYS A 143 -3.902 -3.183 -8.918 1.00 0.98 H new ATOM 0 HB3 CYS A 143 -2.967 -2.738 -10.332 1.00 0.98 H new ATOM 0 HG CYS A 143 -2.298 -1.256 -7.303 1.00 2.18 H new ATOM 2137 N ARG A 144 -4.159 -0.660 -11.990 1.00 1.15 N ATOM 2138 CA ARG A 144 -4.469 -0.931 -13.392 1.00 1.32 C ATOM 2139 C ARG A 144 -3.613 -2.099 -13.879 1.00 1.42 C ATOM 2140 O ARG A 144 -2.397 -2.030 -13.740 1.00 1.65 O ATOM 2141 CB ARG A 144 -4.280 0.353 -14.216 1.00 1.48 C ATOM 2142 CG ARG A 144 -2.836 0.878 -14.232 1.00 2.26 C ATOM 2143 CD ARG A 144 -2.032 0.346 -15.425 1.00 3.72 C ATOM 2144 NE ARG A 144 -1.947 1.348 -16.496 1.00 3.98 N ATOM 2145 CZ ARG A 144 -1.065 1.317 -17.501 1.00 4.83 C ATOM 2146 NH1 ARG A 144 -0.968 2.357 -18.330 1.00 5.22 N ATOM 2147 NH2 ARG A 144 -0.279 0.253 -17.667 1.00 5.68 N ATOM 0 H ARG A 144 -3.378 -0.018 -11.856 1.00 1.15 H new ATOM 0 HA ARG A 144 -5.510 -1.229 -13.514 1.00 1.32 H new ATOM 0 HB2 ARG A 144 -4.599 0.165 -15.241 1.00 1.48 H new ATOM 0 HB3 ARG A 144 -4.933 1.129 -13.816 1.00 1.48 H new ATOM 0 HG2 ARG A 144 -2.849 1.967 -14.263 1.00 2.26 H new ATOM 0 HG3 ARG A 144 -2.338 0.592 -13.306 1.00 2.26 H new ATOM 0 HD2 ARG A 144 -1.029 0.073 -15.098 1.00 3.72 H new ATOM 0 HD3 ARG A 144 -2.501 -0.561 -15.808 1.00 3.72 H new ATOM 0 HE ARG A 144 -2.609 2.124 -16.471 1.00 3.98 H new ATOM 0 HH11 ARG A 144 -1.565 3.173 -18.197 1.00 5.22 H new ATOM 0 HH12 ARG A 144 -0.296 2.337 -19.097 1.00 5.22 H new ATOM 0 HH21 ARG A 144 -0.350 -0.538 -17.027 1.00 5.68 H new ATOM 0 HH22 ARG A 144 0.393 0.230 -18.434 1.00 5.68 H new ATOM 2161 N ASP A 145 -4.213 -3.137 -14.472 1.00 1.42 N ATOM 2162 CA ASP A 145 -3.462 -4.258 -15.065 1.00 1.60 C ATOM 2163 C ASP A 145 -4.383 -5.216 -15.815 1.00 1.73 C ATOM 2164 O ASP A 145 -4.037 -5.781 -16.847 1.00 2.09 O ATOM 2165 CB ASP A 145 -2.707 -5.053 -13.980 1.00 1.55 C ATOM 2166 CG ASP A 145 -1.354 -5.562 -14.475 1.00 2.01 C ATOM 2167 OD1 ASP A 145 -1.281 -5.939 -15.663 1.00 1.93 O ATOM 2168 OD2 ASP A 145 -0.420 -5.596 -13.645 1.00 3.53 O ATOM 0 H ASP A 145 -5.226 -3.227 -14.556 1.00 1.42 H new ATOM 0 HA ASP A 145 -2.750 -3.821 -15.766 1.00 1.60 H new ATOM 0 HB2 ASP A 145 -2.557 -4.420 -13.106 1.00 1.55 H new ATOM 0 HB3 ASP A 145 -3.317 -5.898 -13.661 1.00 1.55 H new ATOM 2173 N LYS A 146 -5.581 -5.426 -15.269 1.00 1.55 N ATOM 2174 CA LYS A 146 -6.597 -6.359 -15.753 1.00 1.67 C ATOM 2175 C LYS A 146 -6.265 -7.825 -15.487 1.00 1.67 C ATOM 2176 O LYS A 146 -7.087 -8.527 -14.904 1.00 1.62 O ATOM 2177 CB LYS A 146 -6.953 -6.055 -17.206 1.00 1.90 C ATOM 2178 CG LYS A 146 -8.256 -6.745 -17.609 1.00 2.12 C ATOM 2179 CD LYS A 146 -8.877 -5.933 -18.742 1.00 2.64 C ATOM 2180 CE LYS A 146 -9.727 -4.808 -18.138 1.00 2.58 C ATOM 2181 NZ LYS A 146 -10.341 -3.965 -19.186 1.00 3.41 N ATOM 0 H LYS A 146 -5.884 -4.924 -14.434 1.00 1.55 H new ATOM 0 HA LYS A 146 -7.498 -6.196 -15.161 1.00 1.67 H new ATOM 0 HB2 LYS A 146 -7.051 -4.978 -17.342 1.00 1.90 H new ATOM 0 HB3 LYS A 146 -6.145 -6.386 -17.859 1.00 1.90 H new ATOM 0 HG2 LYS A 146 -8.063 -7.768 -17.932 1.00 2.12 H new ATOM 0 HG3 LYS A 146 -8.938 -6.802 -16.760 1.00 2.12 H new ATOM 0 HD2 LYS A 146 -8.097 -5.516 -19.379 1.00 2.64 H new ATOM 0 HD3 LYS A 146 -9.493 -6.575 -19.372 1.00 2.64 H new ATOM 0 HE2 LYS A 146 -10.509 -5.238 -17.512 1.00 2.58 H new ATOM 0 HE3 LYS A 146 -9.105 -4.189 -17.491 1.00 2.58 H new ATOM 0 HZ1 LYS A 146 -10.908 -3.215 -18.741 1.00 3.41 H new ATOM 0 HZ2 LYS A 146 -9.594 -3.535 -19.767 1.00 3.41 H new ATOM 0 HZ3 LYS A 146 -10.954 -4.551 -19.788 1.00 3.41 H new ATOM 2195 N LYS A 147 -5.049 -8.295 -15.760 1.00 1.76 N ATOM 2196 CA LYS A 147 -4.643 -9.596 -15.223 1.00 1.80 C ATOM 2197 C LYS A 147 -4.805 -9.628 -13.704 1.00 1.53 C ATOM 2198 O LYS A 147 -5.118 -10.677 -13.153 1.00 1.52 O ATOM 2199 CB LYS A 147 -3.222 -9.952 -15.673 1.00 1.98 C ATOM 2200 CG LYS A 147 -3.259 -10.427 -17.136 1.00 2.09 C ATOM 2201 CD LYS A 147 -2.050 -9.943 -17.942 1.00 2.49 C ATOM 2202 CE LYS A 147 -0.773 -10.721 -17.606 1.00 4.11 C ATOM 2203 NZ LYS A 147 -0.579 -11.881 -18.506 1.00 4.31 N ATOM 0 H LYS A 147 -4.349 -7.817 -16.328 1.00 1.76 H new ATOM 0 HA LYS A 147 -5.302 -10.365 -15.627 1.00 1.80 H new ATOM 0 HB2 LYS A 147 -2.569 -9.085 -15.576 1.00 1.98 H new ATOM 0 HB3 LYS A 147 -2.811 -10.734 -15.035 1.00 1.98 H new ATOM 0 HG2 LYS A 147 -3.295 -11.516 -17.160 1.00 2.09 H new ATOM 0 HG3 LYS A 147 -4.173 -10.068 -17.608 1.00 2.09 H new ATOM 0 HD2 LYS A 147 -2.263 -10.043 -19.006 1.00 2.49 H new ATOM 0 HD3 LYS A 147 -1.888 -8.883 -17.747 1.00 2.49 H new ATOM 0 HE2 LYS A 147 0.087 -10.056 -17.681 1.00 4.11 H new ATOM 0 HE3 LYS A 147 -0.820 -11.067 -16.573 1.00 4.11 H new ATOM 0 HZ1 LYS A 147 0.295 -12.380 -18.245 1.00 4.31 H new ATOM 0 HZ2 LYS A 147 -1.388 -12.529 -18.416 1.00 4.31 H new ATOM 0 HZ3 LYS A 147 -0.508 -11.550 -19.489 1.00 4.31 H new ATOM 2217 N TRP A 148 -4.675 -8.489 -13.019 1.00 1.29 N ATOM 2218 CA TRP A 148 -4.861 -8.459 -11.580 1.00 1.05 C ATOM 2219 C TRP A 148 -6.281 -8.827 -11.194 1.00 1.04 C ATOM 2220 O TRP A 148 -6.480 -9.473 -10.180 1.00 0.97 O ATOM 2221 CB TRP A 148 -4.478 -7.096 -10.985 1.00 0.96 C ATOM 2222 CG TRP A 148 -5.500 -6.011 -11.127 1.00 2.33 C ATOM 2223 CD1 TRP A 148 -6.208 -5.760 -12.243 1.00 3.32 C ATOM 2224 CD2 TRP A 148 -6.071 -5.144 -10.107 1.00 3.74 C ATOM 2225 NE1 TRP A 148 -7.176 -4.812 -12.006 1.00 5.19 N ATOM 2226 CE2 TRP A 148 -7.155 -4.418 -10.686 1.00 5.54 C ATOM 2227 CE3 TRP A 148 -5.829 -4.951 -8.734 1.00 3.85 C ATOM 2228 CZ2 TRP A 148 -7.959 -3.552 -9.941 1.00 7.26 C ATOM 2229 CZ3 TRP A 148 -6.620 -4.066 -7.984 1.00 5.55 C ATOM 2230 CH2 TRP A 148 -7.676 -3.367 -8.584 1.00 7.22 C ATOM 0 H TRP A 148 -4.444 -7.589 -13.439 1.00 1.29 H new ATOM 0 HA TRP A 148 -4.190 -9.209 -11.160 1.00 1.05 H new ATOM 0 HB2 TRP A 148 -4.264 -7.231 -9.925 1.00 0.96 H new ATOM 0 HB3 TRP A 148 -3.554 -6.762 -11.456 1.00 0.96 H new ATOM 0 HD1 TRP A 148 -6.039 -6.238 -13.196 1.00 3.32 H new ATOM 0 HE1 TRP A 148 -7.820 -4.451 -12.710 1.00 5.19 H new ATOM 0 HE3 TRP A 148 -5.026 -5.489 -8.252 1.00 3.85 H new ATOM 0 HZ2 TRP A 148 -8.785 -3.034 -10.405 1.00 7.26 H new ATOM 0 HZ3 TRP A 148 -6.412 -3.923 -6.934 1.00 5.55 H new ATOM 0 HH2 TRP A 148 -8.272 -2.684 -7.997 1.00 7.22 H new ATOM 2241 N GLU A 149 -7.285 -8.412 -11.960 1.00 1.23 N ATOM 2242 CA GLU A 149 -8.648 -8.654 -11.562 1.00 1.36 C ATOM 2243 C GLU A 149 -9.014 -10.069 -11.946 1.00 1.45 C ATOM 2244 O GLU A 149 -9.863 -10.661 -11.297 1.00 1.48 O ATOM 2245 CB GLU A 149 -9.605 -7.596 -12.109 1.00 1.48 C ATOM 2246 CG GLU A 149 -9.776 -7.575 -13.627 1.00 2.48 C ATOM 2247 CD GLU A 149 -10.963 -6.701 -14.043 1.00 2.89 C ATOM 2248 OE1 GLU A 149 -10.712 -5.686 -14.739 1.00 3.80 O ATOM 2249 OE2 GLU A 149 -12.097 -7.032 -13.627 1.00 3.10 O ATOM 0 H GLU A 149 -7.174 -7.915 -12.844 1.00 1.23 H new ATOM 0 HA GLU A 149 -8.743 -8.562 -10.480 1.00 1.36 H new ATOM 0 HB2 GLU A 149 -10.584 -7.749 -11.654 1.00 1.48 H new ATOM 0 HB3 GLU A 149 -9.254 -6.615 -11.788 1.00 1.48 H new ATOM 0 HG2 GLU A 149 -8.865 -7.199 -14.092 1.00 2.48 H new ATOM 0 HG3 GLU A 149 -9.925 -8.591 -13.992 1.00 2.48 H new ATOM 2256 N MET A 150 -8.339 -10.649 -12.942 1.00 1.61 N ATOM 2257 CA MET A 150 -8.498 -12.061 -13.194 1.00 1.86 C ATOM 2258 C MET A 150 -8.017 -12.829 -11.966 1.00 1.63 C ATOM 2259 O MET A 150 -8.798 -13.546 -11.352 1.00 1.57 O ATOM 2260 CB MET A 150 -7.739 -12.473 -14.456 1.00 2.22 C ATOM 2261 CG MET A 150 -8.552 -12.189 -15.720 1.00 2.39 C ATOM 2262 SD MET A 150 -7.792 -12.854 -17.229 1.00 3.22 S ATOM 2263 CE MET A 150 -8.672 -14.437 -17.378 1.00 4.37 C ATOM 0 H MET A 150 -7.694 -10.166 -13.567 1.00 1.61 H new ATOM 0 HA MET A 150 -9.548 -12.295 -13.369 1.00 1.86 H new ATOM 0 HB2 MET A 150 -6.792 -11.935 -14.503 1.00 2.22 H new ATOM 0 HB3 MET A 150 -7.500 -13.535 -14.407 1.00 2.22 H new ATOM 0 HG2 MET A 150 -9.549 -12.615 -15.606 1.00 2.39 H new ATOM 0 HG3 MET A 150 -8.676 -11.112 -15.829 1.00 2.39 H new ATOM 0 HE1 MET A 150 -8.317 -14.969 -18.261 1.00 4.37 H new ATOM 0 HE2 MET A 150 -8.485 -15.042 -16.491 1.00 4.37 H new ATOM 0 HE3 MET A 150 -9.742 -14.251 -17.472 1.00 4.37 H new ATOM 2273 N THR A 151 -6.750 -12.682 -11.575 1.00 1.57 N ATOM 2274 CA THR A 151 -6.194 -13.475 -10.496 1.00 1.55 C ATOM 2275 C THR A 151 -6.894 -13.219 -9.173 1.00 1.23 C ATOM 2276 O THR A 151 -7.237 -14.159 -8.460 1.00 1.23 O ATOM 2277 CB THR A 151 -4.696 -13.174 -10.401 1.00 1.72 C ATOM 2278 OG1 THR A 151 -4.129 -13.172 -11.694 1.00 1.95 O ATOM 2279 CG2 THR A 151 -3.971 -14.219 -9.565 1.00 1.94 C ATOM 0 H THR A 151 -6.096 -12.020 -11.994 1.00 1.57 H new ATOM 0 HA THR A 151 -6.349 -14.531 -10.715 1.00 1.55 H new ATOM 0 HB THR A 151 -4.585 -12.199 -9.927 1.00 1.72 H new ATOM 0 HG1 THR A 151 -3.171 -12.977 -11.631 1.00 1.95 H new ATOM 0 HG21 THR A 151 -2.910 -13.975 -9.518 1.00 1.94 H new ATOM 0 HG22 THR A 151 -4.386 -14.230 -8.557 1.00 1.94 H new ATOM 0 HG23 THR A 151 -4.098 -15.201 -10.020 1.00 1.94 H new ATOM 2287 N LEU A 152 -7.136 -11.956 -8.839 1.00 1.00 N ATOM 2288 CA LEU A 152 -7.842 -11.612 -7.623 1.00 0.80 C ATOM 2289 C LEU A 152 -9.248 -12.182 -7.680 1.00 0.76 C ATOM 2290 O LEU A 152 -9.745 -12.607 -6.648 1.00 0.73 O ATOM 2291 CB LEU A 152 -7.872 -10.095 -7.398 1.00 0.78 C ATOM 2292 CG LEU A 152 -6.613 -9.541 -6.709 1.00 1.01 C ATOM 2293 CD1 LEU A 152 -5.270 -10.056 -7.228 1.00 2.34 C ATOM 2294 CD2 LEU A 152 -6.616 -8.013 -6.805 1.00 2.33 C ATOM 0 H LEU A 152 -6.850 -11.154 -9.401 1.00 1.00 H new ATOM 0 HA LEU A 152 -7.311 -12.047 -6.776 1.00 0.80 H new ATOM 0 HB2 LEU A 152 -7.996 -9.598 -8.360 1.00 0.78 H new ATOM 0 HB3 LEU A 152 -8.744 -9.844 -6.794 1.00 0.78 H new ATOM 0 HG LEU A 152 -6.683 -9.904 -5.684 1.00 1.01 H new ATOM 0 HD11 LEU A 152 -4.460 -9.593 -6.664 1.00 2.34 H new ATOM 0 HD12 LEU A 152 -5.224 -11.138 -7.107 1.00 2.34 H new ATOM 0 HD13 LEU A 152 -5.167 -9.804 -8.284 1.00 2.34 H new ATOM 0 HD21 LEU A 152 -5.725 -7.616 -6.318 1.00 2.33 H new ATOM 0 HD22 LEU A 152 -6.620 -7.714 -7.853 1.00 2.33 H new ATOM 0 HD23 LEU A 152 -7.505 -7.619 -6.312 1.00 2.33 H new ATOM 2306 N LYS A 153 -9.908 -12.230 -8.841 1.00 0.95 N ATOM 2307 CA LYS A 153 -11.241 -12.825 -8.886 1.00 1.12 C ATOM 2308 C LYS A 153 -11.151 -14.337 -8.778 1.00 1.17 C ATOM 2309 O LYS A 153 -12.083 -14.954 -8.284 1.00 1.20 O ATOM 2310 CB LYS A 153 -12.009 -12.427 -10.148 1.00 1.48 C ATOM 2311 CG LYS A 153 -12.534 -10.991 -10.017 1.00 1.24 C ATOM 2312 CD LYS A 153 -13.127 -10.515 -11.348 1.00 2.46 C ATOM 2313 CE LYS A 153 -13.749 -9.120 -11.228 1.00 3.05 C ATOM 2314 NZ LYS A 153 -14.891 -9.107 -10.286 1.00 3.53 N ATOM 0 H LYS A 153 -9.555 -11.877 -9.731 1.00 0.95 H new ATOM 0 HA LYS A 153 -11.796 -12.437 -8.032 1.00 1.12 H new ATOM 0 HB2 LYS A 153 -11.358 -12.506 -11.019 1.00 1.48 H new ATOM 0 HB3 LYS A 153 -12.841 -13.113 -10.308 1.00 1.48 H new ATOM 0 HG2 LYS A 153 -13.293 -10.944 -9.236 1.00 1.24 H new ATOM 0 HG3 LYS A 153 -11.724 -10.327 -9.714 1.00 1.24 H new ATOM 0 HD2 LYS A 153 -12.347 -10.501 -12.109 1.00 2.46 H new ATOM 0 HD3 LYS A 153 -13.885 -11.223 -11.682 1.00 2.46 H new ATOM 0 HE2 LYS A 153 -12.992 -8.412 -10.891 1.00 3.05 H new ATOM 0 HE3 LYS A 153 -14.084 -8.785 -12.210 1.00 3.05 H new ATOM 0 HZ1 LYS A 153 -15.429 -8.225 -10.405 1.00 3.53 H new ATOM 0 HZ2 LYS A 153 -15.510 -9.920 -10.480 1.00 3.53 H new ATOM 0 HZ3 LYS A 153 -14.537 -9.167 -9.310 1.00 3.53 H new ATOM 2328 N GLU A 154 -10.054 -14.944 -9.221 1.00 1.27 N ATOM 2329 CA GLU A 154 -9.886 -16.390 -9.173 1.00 1.47 C ATOM 2330 C GLU A 154 -9.813 -16.788 -7.701 1.00 1.27 C ATOM 2331 O GLU A 154 -10.565 -17.627 -7.216 1.00 1.29 O ATOM 2332 CB GLU A 154 -8.630 -16.781 -9.978 1.00 1.82 C ATOM 2333 CG GLU A 154 -8.771 -18.104 -10.745 1.00 2.37 C ATOM 2334 CD GLU A 154 -8.372 -19.340 -9.933 1.00 3.60 C ATOM 2335 OE1 GLU A 154 -7.852 -20.289 -10.560 1.00 4.52 O ATOM 2336 OE2 GLU A 154 -8.577 -19.330 -8.700 1.00 4.38 O ATOM 0 H GLU A 154 -9.259 -14.447 -9.622 1.00 1.27 H new ATOM 0 HA GLU A 154 -10.719 -16.924 -9.630 1.00 1.47 H new ATOM 0 HB2 GLU A 154 -8.401 -15.984 -10.686 1.00 1.82 H new ATOM 0 HB3 GLU A 154 -7.782 -16.855 -9.297 1.00 1.82 H new ATOM 0 HG2 GLU A 154 -9.805 -18.215 -11.071 1.00 2.37 H new ATOM 0 HG3 GLU A 154 -8.156 -18.058 -11.644 1.00 2.37 H new ATOM 2343 N ALA A 155 -8.968 -16.088 -6.951 1.00 1.19 N ATOM 2344 CA ALA A 155 -8.748 -16.350 -5.546 1.00 1.23 C ATOM 2345 C ALA A 155 -9.950 -15.937 -4.717 1.00 1.04 C ATOM 2346 O ALA A 155 -10.318 -16.654 -3.796 1.00 1.18 O ATOM 2347 CB ALA A 155 -7.480 -15.630 -5.080 1.00 1.39 C ATOM 0 H ALA A 155 -8.412 -15.313 -7.314 1.00 1.19 H new ATOM 0 HA ALA A 155 -8.613 -17.423 -5.406 1.00 1.23 H new ATOM 0 HB1 ALA A 155 -7.317 -15.829 -4.021 1.00 1.39 H new ATOM 0 HB2 ALA A 155 -6.626 -15.990 -5.653 1.00 1.39 H new ATOM 0 HB3 ALA A 155 -7.593 -14.557 -5.234 1.00 1.39 H new ATOM 2353 N VAL A 156 -10.579 -14.806 -5.023 1.00 0.84 N ATOM 2354 CA VAL A 156 -11.778 -14.375 -4.330 1.00 0.87 C ATOM 2355 C VAL A 156 -12.909 -15.348 -4.664 1.00 0.95 C ATOM 2356 O VAL A 156 -13.809 -15.531 -3.851 1.00 1.19 O ATOM 2357 CB VAL A 156 -12.084 -12.909 -4.690 1.00 0.82 C ATOM 2358 CG1 VAL A 156 -13.484 -12.482 -4.256 1.00 0.96 C ATOM 2359 CG2 VAL A 156 -11.076 -11.979 -4.003 1.00 0.82 C ATOM 0 H VAL A 156 -10.269 -14.168 -5.756 1.00 0.84 H new ATOM 0 HA VAL A 156 -11.648 -14.396 -3.248 1.00 0.87 H new ATOM 0 HB VAL A 156 -12.015 -12.835 -5.775 1.00 0.82 H new ATOM 0 HG11 VAL A 156 -13.649 -11.441 -4.533 1.00 0.96 H new ATOM 0 HG12 VAL A 156 -14.225 -13.111 -4.749 1.00 0.96 H new ATOM 0 HG13 VAL A 156 -13.578 -12.589 -3.175 1.00 0.96 H new ATOM 0 HG21 VAL A 156 -11.300 -10.944 -4.263 1.00 0.82 H new ATOM 0 HG22 VAL A 156 -11.143 -12.104 -2.922 1.00 0.82 H new ATOM 0 HG23 VAL A 156 -10.068 -12.227 -4.335 1.00 0.82 H new ATOM 2369 N ALA A 157 -12.861 -16.016 -5.821 1.00 0.91 N ATOM 2370 CA ALA A 157 -13.899 -16.984 -6.148 1.00 1.06 C ATOM 2371 C ALA A 157 -13.684 -18.229 -5.299 1.00 1.12 C ATOM 2372 O ALA A 157 -14.594 -18.690 -4.621 1.00 1.23 O ATOM 2373 CB ALA A 157 -13.904 -17.318 -7.644 1.00 1.27 C ATOM 0 H ALA A 157 -12.133 -15.906 -6.527 1.00 0.91 H new ATOM 0 HA ALA A 157 -14.877 -16.557 -5.925 1.00 1.06 H new ATOM 0 HB1 ALA A 157 -14.691 -18.043 -7.852 1.00 1.27 H new ATOM 0 HB2 ALA A 157 -14.086 -16.410 -8.219 1.00 1.27 H new ATOM 0 HB3 ALA A 157 -12.939 -17.739 -7.926 1.00 1.27 H new ATOM 2379 N ARG A 158 -12.467 -18.773 -5.315 1.00 1.21 N ATOM 2380 CA ARG A 158 -12.129 -19.977 -4.572 1.00 1.46 C ATOM 2381 C ARG A 158 -12.107 -19.742 -3.063 1.00 1.53 C ATOM 2382 O ARG A 158 -12.086 -20.704 -2.302 1.00 1.80 O ATOM 2383 CB ARG A 158 -10.789 -20.544 -5.050 1.00 1.70 C ATOM 2384 CG ARG A 158 -10.914 -21.209 -6.428 1.00 1.59 C ATOM 2385 CD ARG A 158 -9.582 -21.793 -6.914 1.00 1.62 C ATOM 2386 NE ARG A 158 -9.075 -22.848 -6.014 1.00 2.53 N ATOM 2387 CZ ARG A 158 -8.215 -22.669 -5.002 1.00 3.90 C ATOM 2388 NH1 ARG A 158 -7.871 -23.700 -4.228 1.00 5.11 N ATOM 2389 NH2 ARG A 158 -7.707 -21.460 -4.755 1.00 4.56 N ATOM 0 H ARG A 158 -11.688 -18.386 -5.847 1.00 1.21 H new ATOM 0 HA ARG A 158 -12.914 -20.707 -4.769 1.00 1.46 H new ATOM 0 HB2 ARG A 158 -10.051 -19.743 -5.098 1.00 1.70 H new ATOM 0 HB3 ARG A 158 -10.423 -21.272 -4.326 1.00 1.70 H new ATOM 0 HG2 ARG A 158 -11.660 -22.002 -6.380 1.00 1.59 H new ATOM 0 HG3 ARG A 158 -11.273 -20.477 -7.151 1.00 1.59 H new ATOM 0 HD2 ARG A 158 -9.711 -22.203 -7.916 1.00 1.62 H new ATOM 0 HD3 ARG A 158 -8.843 -20.995 -6.989 1.00 1.62 H new ATOM 0 HE ARG A 158 -9.409 -23.798 -6.177 1.00 2.53 H new ATOM 0 HH11 ARG A 158 -8.263 -24.625 -4.407 1.00 5.11 H new ATOM 0 HH12 ARG A 158 -7.216 -23.563 -3.458 1.00 5.11 H new ATOM 0 HH21 ARG A 158 -7.973 -20.666 -5.338 1.00 4.56 H new ATOM 0 HH22 ARG A 158 -7.053 -21.330 -3.983 1.00 4.56 H new ATOM 2403 N ARG A 159 -12.063 -18.488 -2.612 1.00 1.37 N ATOM 2404 CA ARG A 159 -12.220 -18.172 -1.197 1.00 1.56 C ATOM 2405 C ARG A 159 -13.636 -18.474 -0.720 1.00 1.61 C ATOM 2406 O ARG A 159 -13.785 -18.822 0.449 1.00 1.89 O ATOM 2407 CB ARG A 159 -11.852 -16.707 -0.931 1.00 1.74 C ATOM 2408 CG ARG A 159 -10.331 -16.571 -0.795 1.00 1.98 C ATOM 2409 CD ARG A 159 -9.893 -16.890 0.637 1.00 2.38 C ATOM 2410 NE ARG A 159 -8.486 -17.316 0.687 1.00 2.80 N ATOM 2411 CZ ARG A 159 -7.775 -17.497 1.807 1.00 3.40 C ATOM 2412 NH1 ARG A 159 -6.521 -17.947 1.738 1.00 4.12 N ATOM 2413 NH2 ARG A 159 -8.321 -17.228 2.995 1.00 3.82 N ATOM 0 H ARG A 159 -11.919 -17.674 -3.210 1.00 1.37 H new ATOM 0 HA ARG A 159 -11.538 -18.806 -0.630 1.00 1.56 H new ATOM 0 HB2 ARG A 159 -12.211 -16.078 -1.746 1.00 1.74 H new ATOM 0 HB3 ARG A 159 -12.340 -16.359 -0.021 1.00 1.74 H new ATOM 0 HG2 ARG A 159 -9.835 -17.246 -1.493 1.00 1.98 H new ATOM 0 HG3 ARG A 159 -10.025 -15.559 -1.059 1.00 1.98 H new ATOM 0 HD2 ARG A 159 -10.031 -16.010 1.265 1.00 2.38 H new ATOM 0 HD3 ARG A 159 -10.527 -17.676 1.046 1.00 2.38 H new ATOM 0 HE ARG A 159 -8.015 -17.487 -0.201 1.00 2.80 H new ATOM 0 HH11 ARG A 159 -6.103 -18.154 0.831 1.00 4.12 H new ATOM 0 HH12 ARG A 159 -5.981 -18.084 2.592 1.00 4.12 H new ATOM 0 HH21 ARG A 159 -9.280 -16.885 3.050 1.00 3.82 H new ATOM 0 HH22 ARG A 159 -7.779 -17.366 3.848 1.00 3.82 H new ATOM 2427 N GLU A 160 -14.625 -18.368 -1.613 1.00 1.47 N ATOM 2428 CA GLU A 160 -16.043 -18.513 -1.313 1.00 1.69 C ATOM 2429 C GLU A 160 -16.428 -17.682 -0.084 1.00 2.95 C ATOM 2430 O GLU A 160 -17.277 -18.149 0.706 1.00 3.51 O ATOM 2431 CB GLU A 160 -16.399 -20.008 -1.232 1.00 2.16 C ATOM 2432 CG GLU A 160 -16.141 -20.716 -2.571 1.00 3.24 C ATOM 2433 CD GLU A 160 -16.568 -22.189 -2.551 1.00 4.87 C ATOM 2434 OE1 GLU A 160 -15.793 -23.016 -2.017 1.00 6.03 O ATOM 2435 OE2 GLU A 160 -17.654 -22.486 -3.101 1.00 5.53 O ATOM 0 H GLU A 160 -14.448 -18.172 -2.598 1.00 1.47 H new ATOM 0 HA GLU A 160 -16.653 -18.104 -2.118 1.00 1.69 H new ATOM 0 HB2 GLU A 160 -15.809 -20.483 -0.448 1.00 2.16 H new ATOM 0 HB3 GLU A 160 -17.447 -20.120 -0.955 1.00 2.16 H new ATOM 0 HG2 GLU A 160 -16.680 -20.196 -3.363 1.00 3.24 H new ATOM 0 HG3 GLU A 160 -15.080 -20.652 -2.813 1.00 3.24 H new