USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1048 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 125 ASN : amide:sc= -0.0758 X(o=-0.076,f=-0.19) USER MOD Set 1.2: A 127 GLN : amide:sc= 0 X(o=-0.076,f=-0.082) USER MOD Set 2.1: A 86 TYR OH : rot -89:sc= 0.14 USER MOD Set 2.2: A 90 GLN : amide:sc= 0.133 X(o=0.27,f=0) USER MOD Set 3.1: A 65 GLN : amide:sc= 0.265 K(o=-0.21,f=-2.1) USER MOD Set 3.2: A 79 TYR OH : rot 180:sc= -0.471 USER MOD Set 4.1: A 29 TYR OH : rot 70:sc= 0.361 USER MOD Set 4.2: A 97 THR OG1 : rot -109:sc= 0.48 USER MOD Single : A 6 SER OG : rot 180:sc= 0.00304 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN :FLIP amide:sc= 0.293 F(o=-0.41,f=0.29) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -2.64! C(o=-2.6!,f=-11!) USER MOD Single : A 38 SER OG : rot -68:sc= 0.0179 USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.379 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot -170:sc= -0.744 USER MOD Single : A 59 GLN : amide:sc= -0.0797 X(o=-0.08,f=-0.08) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 SER OG : rot 91:sc= 0.286 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.0093) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0393 USER MOD Single : A 72 SER OG : rot -133:sc= 0.96 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN :FLIP amide:sc= -3.82! C(o=-4.4!,f=-3.8!) USER MOD Single : A 81 THR OG1 : rot 80:sc= 0.98 USER MOD Single : A 87 CYS SG : rot 180:sc= -0.106 USER MOD Single : A 89 HIS : +bothHN:sc= 0.998 K(o=1,f=-6.6!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN : amide:sc= -0.0954 K(o=-0.095,f=-2!) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.187 K(o=-0.19,f=-0.85) USER MOD Single : A 117 GLN : amide:sc= -0.745 K(o=-0.74,f=-3.6!) USER MOD Single : A 122 THR OG1 : rot 37:sc= 0.161 USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 SER OG : rot 180:sc= -0.0506 USER MOD Single : A 129 SER OG : rot 180:sc= 0.0147 USER MOD Single : A 130 GLN : amide:sc=-0.000597 X(o=-0.0006,f=-0.054) USER MOD Single : A 131 ASN : amide:sc= -0.436 X(o=-0.44,f=-0.75) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 22.218 -2.051 -2.205 1.00 13.00 N ATOM 2 CA GLY A 2 21.548 -2.085 -3.491 1.00 45.03 C ATOM 3 C GLY A 2 20.926 -0.751 -3.856 1.00 53.50 C ATOM 4 O GLY A 2 21.626 0.252 -3.989 1.00 74.32 O ATOM 0 HA2 GLY A 2 22.263 -2.372 -4.262 1.00 45.03 H new ATOM 0 HA3 GLY A 2 20.773 -2.851 -3.473 1.00 45.03 H new ATOM 8 N ALA A 3 19.607 -0.740 -4.020 1.00 73.32 N ATOM 9 CA ALA A 3 18.891 0.481 -4.372 1.00 14.45 C ATOM 10 C ALA A 3 17.385 0.247 -4.387 1.00 70.33 C ATOM 11 O ALA A 3 16.885 -0.597 -5.131 1.00 14.05 O ATOM 12 CB ALA A 3 19.362 0.998 -5.723 1.00 4.12 C ATOM 0 H ALA A 3 19.013 -1.562 -3.915 1.00 73.32 H new ATOM 0 HA ALA A 3 19.108 1.233 -3.613 1.00 14.45 H new ATOM 0 HB1 ALA A 3 18.819 1.910 -5.973 1.00 4.12 H new ATOM 0 HB2 ALA A 3 20.430 1.212 -5.678 1.00 4.12 H new ATOM 0 HB3 ALA A 3 19.175 0.243 -6.487 1.00 4.12 H new ATOM 18 N ARG A 4 16.666 1.002 -3.562 1.00 11.12 N ATOM 19 CA ARG A 4 15.215 0.876 -3.480 1.00 55.33 C ATOM 20 C ARG A 4 14.551 1.412 -4.745 1.00 13.35 C ATOM 21 O ARG A 4 14.738 2.571 -5.112 1.00 23.51 O ATOM 22 CB ARG A 4 14.686 1.624 -2.256 1.00 41.21 C ATOM 23 CG ARG A 4 13.533 0.918 -1.561 1.00 43.13 C ATOM 24 CD ARG A 4 13.433 1.318 -0.098 1.00 55.35 C ATOM 25 NE ARG A 4 14.568 0.829 0.681 1.00 33.12 N ATOM 26 CZ ARG A 4 14.752 -0.449 0.988 1.00 1.11 C ATOM 27 NH1 ARG A 4 13.880 -1.364 0.585 1.00 75.22 N ATOM 28 NH2 ARG A 4 15.810 -0.817 1.701 1.00 25.44 N ATOM 0 H ARG A 4 17.064 1.707 -2.941 1.00 11.12 H new ATOM 0 HA ARG A 4 14.971 -0.182 -3.383 1.00 55.33 H new ATOM 0 HB2 ARG A 4 15.500 1.759 -1.544 1.00 41.21 H new ATOM 0 HB3 ARG A 4 14.361 2.619 -2.561 1.00 41.21 H new ATOM 0 HG2 ARG A 4 12.599 1.158 -2.069 1.00 43.13 H new ATOM 0 HG3 ARG A 4 13.668 -0.161 -1.635 1.00 43.13 H new ATOM 0 HD2 ARG A 4 13.382 2.404 -0.022 1.00 55.35 H new ATOM 0 HD3 ARG A 4 12.508 0.925 0.323 1.00 55.35 H new ATOM 0 HE ARG A 4 15.257 1.507 1.007 1.00 33.12 H new ATOM 0 HH11 ARG A 4 13.065 -1.086 0.038 1.00 75.22 H new ATOM 0 HH12 ARG A 4 14.024 -2.345 0.823 1.00 75.22 H new ATOM 0 HH21 ARG A 4 16.483 -0.117 2.014 1.00 25.44 H new ATOM 0 HH22 ARG A 4 15.950 -1.800 1.936 1.00 25.44 H new ATOM 42 N ALA A 5 13.776 0.560 -5.406 1.00 43.40 N ATOM 43 CA ALA A 5 13.082 0.947 -6.629 1.00 31.45 C ATOM 44 C ALA A 5 11.811 1.728 -6.314 1.00 4.13 C ATOM 45 O ALA A 5 10.892 1.208 -5.680 1.00 23.10 O ATOM 46 CB ALA A 5 12.756 -0.282 -7.463 1.00 72.52 C ATOM 0 H ALA A 5 13.612 -0.404 -5.116 1.00 43.40 H new ATOM 0 HA ALA A 5 13.743 1.596 -7.203 1.00 31.45 H new ATOM 0 HB1 ALA A 5 12.238 0.022 -8.373 1.00 72.52 H new ATOM 0 HB2 ALA A 5 13.679 -0.798 -7.726 1.00 72.52 H new ATOM 0 HB3 ALA A 5 12.117 -0.952 -6.889 1.00 72.52 H new ATOM 52 N SER A 6 11.764 2.979 -6.759 1.00 65.11 N ATOM 53 CA SER A 6 10.606 3.834 -6.521 1.00 12.33 C ATOM 54 C SER A 6 10.080 4.414 -7.830 1.00 41.34 C ATOM 55 O SER A 6 10.615 4.139 -8.904 1.00 54.50 O ATOM 56 CB SER A 6 10.971 4.965 -5.559 1.00 23.01 C ATOM 57 OG SER A 6 9.832 5.409 -4.840 1.00 34.04 O ATOM 0 H SER A 6 12.515 3.424 -7.287 1.00 65.11 H new ATOM 0 HA SER A 6 9.821 3.224 -6.073 1.00 12.33 H new ATOM 0 HB2 SER A 6 11.735 4.621 -4.861 1.00 23.01 H new ATOM 0 HB3 SER A 6 11.400 5.797 -6.117 1.00 23.01 H new ATOM 0 HG SER A 6 10.091 6.131 -4.230 1.00 34.04 H new ATOM 63 N VAL A 7 9.027 5.218 -7.733 1.00 31.21 N ATOM 64 CA VAL A 7 8.428 5.840 -8.908 1.00 51.55 C ATOM 65 C VAL A 7 9.096 7.172 -9.227 1.00 25.55 C ATOM 66 O VAL A 7 9.644 7.362 -10.312 1.00 55.32 O ATOM 67 CB VAL A 7 6.918 6.068 -8.714 1.00 44.43 C ATOM 68 CG1 VAL A 7 6.284 6.579 -10.000 1.00 13.43 C ATOM 69 CG2 VAL A 7 6.241 4.787 -8.250 1.00 51.43 C ATOM 0 H VAL A 7 8.570 5.454 -6.852 1.00 31.21 H new ATOM 0 HA VAL A 7 8.580 5.153 -9.741 1.00 51.55 H new ATOM 0 HB VAL A 7 6.780 6.826 -7.943 1.00 44.43 H new ATOM 0 HG11 VAL A 7 5.217 6.734 -9.843 1.00 13.43 H new ATOM 0 HG12 VAL A 7 6.750 7.522 -10.285 1.00 13.43 H new ATOM 0 HG13 VAL A 7 6.431 5.847 -10.794 1.00 13.43 H new ATOM 0 HG21 VAL A 7 5.174 4.967 -8.118 1.00 51.43 H new ATOM 0 HG22 VAL A 7 6.388 4.007 -8.997 1.00 51.43 H new ATOM 0 HG23 VAL A 7 6.675 4.469 -7.302 1.00 51.43 H new ATOM 79 N LEU A 8 9.045 8.095 -8.271 1.00 51.04 N ATOM 80 CA LEU A 8 9.646 9.413 -8.449 1.00 1.31 C ATOM 81 C LEU A 8 10.979 9.507 -7.714 1.00 54.52 C ATOM 82 O LEU A 8 11.141 8.953 -6.627 1.00 13.00 O ATOM 83 CB LEU A 8 8.696 10.500 -7.944 1.00 24.42 C ATOM 84 CG LEU A 8 7.236 10.372 -8.381 1.00 53.50 C ATOM 85 CD1 LEU A 8 6.440 11.593 -7.948 1.00 1.32 C ATOM 86 CD2 LEU A 8 7.146 10.181 -9.889 1.00 32.25 C ATOM 0 H LEU A 8 8.595 7.955 -7.367 1.00 51.04 H new ATOM 0 HA LEU A 8 9.827 9.562 -9.513 1.00 1.31 H new ATOM 0 HB2 LEU A 8 8.729 10.506 -6.855 1.00 24.42 H new ATOM 0 HB3 LEU A 8 9.071 11.467 -8.279 1.00 24.42 H new ATOM 0 HG LEU A 8 6.807 9.494 -7.897 1.00 53.50 H new ATOM 0 HD11 LEU A 8 5.404 11.484 -8.268 1.00 1.32 H new ATOM 0 HD12 LEU A 8 6.477 11.685 -6.863 1.00 1.32 H new ATOM 0 HD13 LEU A 8 6.868 12.486 -8.403 1.00 1.32 H new ATOM 0 HD21 LEU A 8 6.100 10.092 -10.183 1.00 32.25 H new ATOM 0 HD22 LEU A 8 7.592 11.039 -10.392 1.00 32.25 H new ATOM 0 HD23 LEU A 8 7.681 9.275 -10.174 1.00 32.25 H new ATOM 98 N SER A 9 11.932 10.212 -8.315 1.00 71.51 N ATOM 99 CA SER A 9 13.252 10.378 -7.720 1.00 13.34 C ATOM 100 C SER A 9 13.268 11.556 -6.750 1.00 44.22 C ATOM 101 O SER A 9 12.276 12.270 -6.607 1.00 50.14 O ATOM 102 CB SER A 9 14.305 10.587 -8.810 1.00 42.10 C ATOM 103 OG SER A 9 14.565 11.965 -9.011 1.00 33.11 O ATOM 0 H SER A 9 11.814 10.678 -9.215 1.00 71.51 H new ATOM 0 HA SER A 9 13.489 9.470 -7.166 1.00 13.34 H new ATOM 0 HB2 SER A 9 15.227 10.077 -8.532 1.00 42.10 H new ATOM 0 HB3 SER A 9 13.962 10.139 -9.742 1.00 42.10 H new ATOM 0 HG SER A 9 15.242 12.071 -9.711 1.00 33.11 H new ATOM 109 N GLY A 10 14.402 11.753 -6.086 1.00 1.12 N ATOM 110 CA GLY A 10 14.527 12.845 -5.138 1.00 25.15 C ATOM 111 C GLY A 10 14.107 14.176 -5.728 1.00 71.14 C ATOM 112 O GLY A 10 13.432 14.969 -5.074 1.00 12.42 O ATOM 0 H GLY A 10 15.237 11.176 -6.187 1.00 1.12 H new ATOM 0 HA2 GLY A 10 13.917 12.632 -4.260 1.00 25.15 H new ATOM 0 HA3 GLY A 10 15.561 12.911 -4.799 1.00 25.15 H new ATOM 116 N GLY A 11 14.509 14.423 -6.971 1.00 61.43 N ATOM 117 CA GLY A 11 14.163 15.670 -7.629 1.00 53.12 C ATOM 118 C GLY A 11 12.705 15.723 -8.040 1.00 73.35 C ATOM 119 O GLY A 11 12.010 16.699 -7.762 1.00 61.21 O ATOM 0 H GLY A 11 15.068 13.782 -7.534 1.00 61.43 H new ATOM 0 HA2 GLY A 11 14.379 16.503 -6.960 1.00 53.12 H new ATOM 0 HA3 GLY A 11 14.791 15.798 -8.511 1.00 53.12 H new ATOM 123 N GLU A 12 12.242 14.670 -8.707 1.00 24.30 N ATOM 124 CA GLU A 12 10.857 14.603 -9.160 1.00 31.32 C ATOM 125 C GLU A 12 9.894 14.678 -7.979 1.00 21.05 C ATOM 126 O GLU A 12 8.857 15.340 -8.048 1.00 71.14 O ATOM 127 CB GLU A 12 10.617 13.313 -9.947 1.00 5.45 C ATOM 128 CG GLU A 12 11.700 13.011 -10.967 1.00 65.34 C ATOM 129 CD GLU A 12 11.410 11.760 -11.774 1.00 71.34 C ATOM 130 OE1 GLU A 12 11.320 10.672 -11.169 1.00 62.41 O ATOM 131 OE2 GLU A 12 11.272 11.870 -13.010 1.00 51.03 O ATOM 0 H GLU A 12 12.804 13.853 -8.945 1.00 24.30 H new ATOM 0 HA GLU A 12 10.673 15.457 -9.811 1.00 31.32 H new ATOM 0 HB2 GLU A 12 10.545 12.479 -9.248 1.00 5.45 H new ATOM 0 HB3 GLU A 12 9.657 13.383 -10.459 1.00 5.45 H new ATOM 0 HG2 GLU A 12 11.803 13.859 -11.644 1.00 65.34 H new ATOM 0 HG3 GLU A 12 12.655 12.895 -10.454 1.00 65.34 H new ATOM 138 N LEU A 13 10.243 13.996 -6.893 1.00 41.24 N ATOM 139 CA LEU A 13 9.411 13.984 -5.695 1.00 51.35 C ATOM 140 C LEU A 13 9.061 15.403 -5.262 1.00 22.42 C ATOM 141 O LEU A 13 7.909 15.700 -4.944 1.00 13.23 O ATOM 142 CB LEU A 13 10.129 13.253 -4.560 1.00 24.33 C ATOM 143 CG LEU A 13 9.236 12.707 -3.444 1.00 52.13 C ATOM 144 CD1 LEU A 13 10.050 11.863 -2.475 1.00 43.10 C ATOM 145 CD2 LEU A 13 8.542 13.844 -2.710 1.00 74.53 C ATOM 0 H LEU A 13 11.097 13.444 -6.818 1.00 41.24 H new ATOM 0 HA LEU A 13 8.486 13.458 -5.929 1.00 51.35 H new ATOM 0 HB2 LEU A 13 10.691 12.423 -4.987 1.00 24.33 H new ATOM 0 HB3 LEU A 13 10.855 13.935 -4.117 1.00 24.33 H new ATOM 0 HG LEU A 13 8.472 12.073 -3.894 1.00 52.13 H new ATOM 0 HD11 LEU A 13 9.399 11.483 -1.688 1.00 43.10 H new ATOM 0 HD12 LEU A 13 10.499 11.026 -3.010 1.00 43.10 H new ATOM 0 HD13 LEU A 13 10.836 12.474 -2.032 1.00 43.10 H new ATOM 0 HD21 LEU A 13 7.911 13.436 -1.920 1.00 74.53 H new ATOM 0 HD22 LEU A 13 9.290 14.505 -2.272 1.00 74.53 H new ATOM 0 HD23 LEU A 13 7.926 14.407 -3.411 1.00 74.53 H new ATOM 157 N ASP A 14 10.061 16.278 -5.253 1.00 15.54 N ATOM 158 CA ASP A 14 9.859 17.668 -4.860 1.00 53.44 C ATOM 159 C ASP A 14 8.700 18.287 -5.635 1.00 13.21 C ATOM 160 O ASP A 14 7.753 18.809 -5.045 1.00 54.10 O ATOM 161 CB ASP A 14 11.136 18.476 -5.096 1.00 62.01 C ATOM 162 CG ASP A 14 11.121 19.806 -4.367 1.00 64.33 C ATOM 163 OD1 ASP A 14 10.711 19.832 -3.189 1.00 2.32 O ATOM 164 OD2 ASP A 14 11.518 20.821 -4.977 1.00 10.02 O ATOM 0 H ASP A 14 11.020 16.049 -5.514 1.00 15.54 H new ATOM 0 HA ASP A 14 9.615 17.690 -3.798 1.00 53.44 H new ATOM 0 HB2 ASP A 14 11.997 17.894 -4.767 1.00 62.01 H new ATOM 0 HB3 ASP A 14 11.259 18.652 -6.165 1.00 62.01 H new ATOM 169 N LYS A 15 8.780 18.227 -6.959 1.00 55.34 N ATOM 170 CA LYS A 15 7.739 18.781 -7.816 1.00 4.14 C ATOM 171 C LYS A 15 6.378 18.185 -7.472 1.00 45.02 C ATOM 172 O LYS A 15 5.404 18.912 -7.271 1.00 50.33 O ATOM 173 CB LYS A 15 8.065 18.517 -9.287 1.00 75.43 C ATOM 174 CG LYS A 15 9.026 19.529 -9.888 1.00 62.12 C ATOM 175 CD LYS A 15 10.072 18.856 -10.760 1.00 23.35 C ATOM 176 CE LYS A 15 10.681 19.832 -11.754 1.00 73.41 C ATOM 177 NZ LYS A 15 12.005 19.365 -12.251 1.00 54.31 N ATOM 0 H LYS A 15 9.557 17.799 -7.463 1.00 55.34 H new ATOM 0 HA LYS A 15 7.699 19.857 -7.647 1.00 4.14 H new ATOM 0 HB2 LYS A 15 8.494 17.520 -9.382 1.00 75.43 H new ATOM 0 HB3 LYS A 15 7.139 18.521 -9.862 1.00 75.43 H new ATOM 0 HG2 LYS A 15 8.468 20.254 -10.481 1.00 62.12 H new ATOM 0 HG3 LYS A 15 9.519 20.083 -9.089 1.00 62.12 H new ATOM 0 HD2 LYS A 15 10.858 18.438 -10.131 1.00 23.35 H new ATOM 0 HD3 LYS A 15 9.618 18.023 -11.298 1.00 23.35 H new ATOM 0 HE2 LYS A 15 10.002 19.963 -12.597 1.00 73.41 H new ATOM 0 HE3 LYS A 15 10.794 20.808 -11.282 1.00 73.41 H new ATOM 0 HZ1 LYS A 15 12.387 20.058 -12.926 1.00 54.31 H new ATOM 0 HZ2 LYS A 15 12.661 19.265 -11.450 1.00 54.31 H new ATOM 0 HZ3 LYS A 15 11.894 18.446 -12.724 1.00 54.31 H new ATOM 191 N TRP A 16 6.317 16.859 -7.405 1.00 30.32 N ATOM 192 CA TRP A 16 5.075 16.167 -7.083 1.00 43.13 C ATOM 193 C TRP A 16 4.418 16.771 -5.847 1.00 71.13 C ATOM 194 O TRP A 16 3.274 17.221 -5.899 1.00 60.51 O ATOM 195 CB TRP A 16 5.341 14.678 -6.858 1.00 42.50 C ATOM 196 CG TRP A 16 4.111 13.904 -6.487 1.00 20.13 C ATOM 197 CD1 TRP A 16 3.769 13.456 -5.243 1.00 41.21 C ATOM 198 CD2 TRP A 16 3.063 13.486 -7.369 1.00 73.11 C ATOM 199 NE1 TRP A 16 2.571 12.785 -5.299 1.00 30.03 N ATOM 200 CE2 TRP A 16 2.118 12.790 -6.591 1.00 64.31 C ATOM 201 CE3 TRP A 16 2.832 13.633 -8.739 1.00 61.41 C ATOM 202 CZ2 TRP A 16 0.961 12.243 -7.141 1.00 32.51 C ATOM 203 CZ3 TRP A 16 1.683 13.091 -9.283 1.00 11.23 C ATOM 204 CH2 TRP A 16 0.759 12.403 -8.484 1.00 75.13 C ATOM 0 H TRP A 16 7.113 16.243 -7.569 1.00 30.32 H new ATOM 0 HA TRP A 16 4.394 16.285 -7.926 1.00 43.13 H new ATOM 0 HB2 TRP A 16 5.770 14.252 -7.765 1.00 42.50 H new ATOM 0 HB3 TRP A 16 6.085 14.564 -6.069 1.00 42.50 H new ATOM 0 HD1 TRP A 16 4.354 13.607 -4.348 1.00 41.21 H new ATOM 0 HE1 TRP A 16 2.096 12.353 -4.506 1.00 30.03 H new ATOM 0 HE3 TRP A 16 3.539 14.161 -9.362 1.00 61.41 H new ATOM 0 HZ2 TRP A 16 0.248 11.711 -6.528 1.00 32.51 H new ATOM 0 HZ3 TRP A 16 1.494 13.199 -10.341 1.00 11.23 H new ATOM 0 HH2 TRP A 16 -0.130 11.991 -8.938 1.00 75.13 H new ATOM 215 N GLU A 17 5.150 16.779 -4.737 1.00 50.24 N ATOM 216 CA GLU A 17 4.636 17.328 -3.488 1.00 71.41 C ATOM 217 C GLU A 17 4.216 18.784 -3.666 1.00 70.55 C ATOM 218 O GLU A 17 3.413 19.310 -2.895 1.00 43.20 O ATOM 219 CB GLU A 17 5.692 17.221 -2.385 1.00 61.25 C ATOM 220 CG GLU A 17 5.675 15.891 -1.653 1.00 13.25 C ATOM 221 CD GLU A 17 6.153 16.009 -0.218 1.00 44.41 C ATOM 222 OE1 GLU A 17 5.393 16.543 0.616 1.00 24.22 O ATOM 223 OE2 GLU A 17 7.284 15.567 0.070 1.00 70.22 O ATOM 0 H GLU A 17 6.100 16.412 -4.678 1.00 50.24 H new ATOM 0 HA GLU A 17 3.760 16.748 -3.199 1.00 71.41 H new ATOM 0 HB2 GLU A 17 6.679 17.373 -2.823 1.00 61.25 H new ATOM 0 HB3 GLU A 17 5.536 18.024 -1.665 1.00 61.25 H new ATOM 0 HG2 GLU A 17 4.662 15.488 -1.663 1.00 13.25 H new ATOM 0 HG3 GLU A 17 6.306 15.179 -2.185 1.00 13.25 H new ATOM 230 N LYS A 18 4.766 19.431 -4.687 1.00 63.04 N ATOM 231 CA LYS A 18 4.450 20.827 -4.970 1.00 3.41 C ATOM 232 C LYS A 18 3.030 20.964 -5.511 1.00 12.40 C ATOM 233 O LYS A 18 2.145 21.486 -4.832 1.00 21.30 O ATOM 234 CB LYS A 18 5.448 21.404 -5.976 1.00 52.32 C ATOM 235 CG LYS A 18 5.918 22.806 -5.629 1.00 61.24 C ATOM 236 CD LYS A 18 7.085 23.234 -6.503 1.00 74.32 C ATOM 237 CE LYS A 18 7.009 24.713 -6.850 1.00 24.04 C ATOM 238 NZ LYS A 18 7.841 25.048 -8.038 1.00 42.52 N ATOM 0 H LYS A 18 5.434 19.011 -5.334 1.00 63.04 H new ATOM 0 HA LYS A 18 4.521 21.386 -4.037 1.00 3.41 H new ATOM 0 HB2 LYS A 18 6.313 20.744 -6.036 1.00 52.32 H new ATOM 0 HB3 LYS A 18 4.988 21.418 -6.964 1.00 52.32 H new ATOM 0 HG2 LYS A 18 5.093 23.508 -5.752 1.00 61.24 H new ATOM 0 HG3 LYS A 18 6.214 22.843 -4.581 1.00 61.24 H new ATOM 0 HD2 LYS A 18 8.022 23.028 -5.986 1.00 74.32 H new ATOM 0 HD3 LYS A 18 7.090 22.644 -7.420 1.00 74.32 H new ATOM 0 HE2 LYS A 18 5.972 24.988 -7.044 1.00 24.04 H new ATOM 0 HE3 LYS A 18 7.341 25.304 -5.996 1.00 24.04 H new ATOM 0 HZ1 LYS A 18 7.762 26.065 -8.242 1.00 42.52 H new ATOM 0 HZ2 LYS A 18 8.835 24.810 -7.844 1.00 42.52 H new ATOM 0 HZ3 LYS A 18 7.508 24.504 -8.859 1.00 42.52 H new ATOM 252 N ILE A 19 2.819 20.491 -6.734 1.00 33.21 N ATOM 253 CA ILE A 19 1.507 20.559 -7.364 1.00 22.25 C ATOM 254 C ILE A 19 0.401 20.227 -6.367 1.00 2.34 C ATOM 255 O ILE A 19 0.574 19.376 -5.493 1.00 52.22 O ATOM 256 CB ILE A 19 1.407 19.598 -8.563 1.00 31.52 C ATOM 257 CG1 ILE A 19 2.469 19.941 -9.610 1.00 34.24 C ATOM 258 CG2 ILE A 19 0.015 19.657 -9.174 1.00 62.33 C ATOM 259 CD1 ILE A 19 2.907 18.755 -10.438 1.00 13.42 C ATOM 0 H ILE A 19 3.541 20.056 -7.309 1.00 33.21 H new ATOM 0 HA ILE A 19 1.380 21.582 -7.718 1.00 22.25 H new ATOM 0 HB ILE A 19 1.586 18.582 -8.211 1.00 31.52 H new ATOM 0 HG12 ILE A 19 2.077 20.712 -10.274 1.00 34.24 H new ATOM 0 HG13 ILE A 19 3.339 20.364 -9.108 1.00 34.24 H new ATOM 0 HG21 ILE A 19 -0.040 18.972 -10.020 1.00 62.33 H new ATOM 0 HG22 ILE A 19 -0.723 19.369 -8.426 1.00 62.33 H new ATOM 0 HG23 ILE A 19 -0.190 20.672 -9.514 1.00 62.33 H new ATOM 0 HD11 ILE A 19 3.660 19.073 -11.159 1.00 13.42 H new ATOM 0 HD12 ILE A 19 3.329 17.991 -9.785 1.00 13.42 H new ATOM 0 HD13 ILE A 19 2.048 18.344 -10.969 1.00 13.42 H new ATOM 271 N ARG A 20 -0.736 20.902 -6.505 1.00 55.41 N ATOM 272 CA ARG A 20 -1.869 20.677 -5.617 1.00 23.31 C ATOM 273 C ARG A 20 -2.980 19.916 -6.335 1.00 52.14 C ATOM 274 O ARG A 20 -3.002 19.841 -7.564 1.00 63.32 O ATOM 275 CB ARG A 20 -2.407 22.011 -5.095 1.00 23.31 C ATOM 276 CG ARG A 20 -1.533 22.642 -4.024 1.00 11.12 C ATOM 277 CD ARG A 20 -1.969 24.066 -3.716 1.00 55.23 C ATOM 278 NE ARG A 20 -0.867 24.878 -3.205 1.00 73.42 N ATOM 279 CZ ARG A 20 -1.020 26.108 -2.728 1.00 24.50 C ATOM 280 NH1 ARG A 20 -2.223 26.665 -2.696 1.00 70.04 N ATOM 281 NH2 ARG A 20 0.031 26.783 -2.282 1.00 31.34 N ATOM 0 H ARG A 20 -0.896 21.609 -7.223 1.00 55.41 H new ATOM 0 HA ARG A 20 -1.525 20.076 -4.775 1.00 23.31 H new ATOM 0 HB2 ARG A 20 -2.504 22.706 -5.929 1.00 23.31 H new ATOM 0 HB3 ARG A 20 -3.408 21.857 -4.691 1.00 23.31 H new ATOM 0 HG2 ARG A 20 -1.579 22.042 -3.115 1.00 11.12 H new ATOM 0 HG3 ARG A 20 -0.494 22.642 -4.354 1.00 11.12 H new ATOM 0 HD2 ARG A 20 -2.369 24.526 -4.619 1.00 55.23 H new ATOM 0 HD3 ARG A 20 -2.776 24.048 -2.983 1.00 55.23 H new ATOM 0 HE ARG A 20 0.071 24.478 -3.215 1.00 73.42 H new ATOM 0 HH11 ARG A 20 -3.033 26.149 -3.038 1.00 70.04 H new ATOM 0 HH12 ARG A 20 -2.338 27.610 -2.329 1.00 70.04 H new ATOM 0 HH21 ARG A 20 0.958 26.357 -2.305 1.00 31.34 H new ATOM 0 HH22 ARG A 20 -0.087 27.728 -1.916 1.00 31.34 H new ATOM 295 N LEU A 21 -3.900 19.352 -5.561 1.00 20.01 N ATOM 296 CA LEU A 21 -5.013 18.595 -6.123 1.00 1.13 C ATOM 297 C LEU A 21 -6.031 19.526 -6.774 1.00 73.01 C ATOM 298 O LEU A 21 -6.541 19.243 -7.857 1.00 43.52 O ATOM 299 CB LEU A 21 -5.692 17.763 -5.032 1.00 51.20 C ATOM 300 CG LEU A 21 -4.796 16.767 -4.294 1.00 44.53 C ATOM 301 CD1 LEU A 21 -5.273 16.580 -2.863 1.00 31.33 C ATOM 302 CD2 LEU A 21 -4.766 15.433 -5.026 1.00 24.31 C ATOM 0 H LEU A 21 -3.897 19.404 -4.542 1.00 20.01 H new ATOM 0 HA LEU A 21 -4.617 17.927 -6.888 1.00 1.13 H new ATOM 0 HB2 LEU A 21 -6.125 18.444 -4.299 1.00 51.20 H new ATOM 0 HB3 LEU A 21 -6.518 17.213 -5.483 1.00 51.20 H new ATOM 0 HG LEU A 21 -3.783 17.168 -4.269 1.00 44.53 H new ATOM 0 HD11 LEU A 21 -4.624 15.868 -2.353 1.00 31.33 H new ATOM 0 HD12 LEU A 21 -5.243 17.537 -2.341 1.00 31.33 H new ATOM 0 HD13 LEU A 21 -6.295 16.201 -2.867 1.00 31.33 H new ATOM 0 HD21 LEU A 21 -4.124 14.737 -4.487 1.00 24.31 H new ATOM 0 HD22 LEU A 21 -5.776 15.026 -5.082 1.00 24.31 H new ATOM 0 HD23 LEU A 21 -4.377 15.580 -6.034 1.00 24.31 H new ATOM 314 N ARG A 22 -6.319 20.640 -6.107 1.00 52.42 N ATOM 315 CA ARG A 22 -7.274 21.613 -6.621 1.00 40.42 C ATOM 316 C ARG A 22 -6.589 22.943 -6.918 1.00 60.21 C ATOM 317 O ARG A 22 -5.506 23.238 -6.410 1.00 23.40 O ATOM 318 CB ARG A 22 -8.410 21.824 -5.618 1.00 62.52 C ATOM 319 CG ARG A 22 -9.680 21.064 -5.966 1.00 12.10 C ATOM 320 CD ARG A 22 -9.632 19.635 -5.449 1.00 41.31 C ATOM 321 NE ARG A 22 -10.838 19.282 -4.706 1.00 45.42 N ATOM 322 CZ ARG A 22 -11.992 18.966 -5.285 1.00 61.12 C ATOM 323 NH1 ARG A 22 -12.095 18.960 -6.607 1.00 33.21 N ATOM 324 NH2 ARG A 22 -13.046 18.656 -4.541 1.00 1.15 N ATOM 0 H ARG A 22 -5.904 20.890 -5.209 1.00 52.42 H new ATOM 0 HA ARG A 22 -7.688 21.222 -7.551 1.00 40.42 H new ATOM 0 HB2 ARG A 22 -8.072 21.515 -4.629 1.00 62.52 H new ATOM 0 HB3 ARG A 22 -8.638 22.888 -5.559 1.00 62.52 H new ATOM 0 HG2 ARG A 22 -10.541 21.578 -5.539 1.00 12.10 H new ATOM 0 HG3 ARG A 22 -9.816 21.057 -7.047 1.00 12.10 H new ATOM 0 HD2 ARG A 22 -9.509 18.950 -6.288 1.00 41.31 H new ATOM 0 HD3 ARG A 22 -8.761 19.511 -4.806 1.00 41.31 H new ATOM 0 HE ARG A 22 -10.793 19.278 -3.687 1.00 45.42 H new ATOM 0 HH11 ARG A 22 -11.287 19.198 -7.183 1.00 33.21 H new ATOM 0 HH12 ARG A 22 -12.982 18.717 -7.048 1.00 33.21 H new ATOM 0 HH21 ARG A 22 -12.971 18.660 -3.524 1.00 1.15 H new ATOM 0 HH22 ARG A 22 -13.931 18.414 -4.986 1.00 1.15 H new ATOM 338 N PRO A 23 -7.232 23.766 -7.759 1.00 42.22 N ATOM 339 CA PRO A 23 -6.702 25.079 -8.142 1.00 41.33 C ATOM 340 C PRO A 23 -6.733 26.075 -6.988 1.00 44.25 C ATOM 341 O PRO A 23 -5.764 26.796 -6.752 1.00 44.51 O ATOM 342 CB PRO A 23 -7.644 25.528 -9.262 1.00 43.13 C ATOM 343 CG PRO A 23 -8.918 24.802 -9.000 1.00 3.20 C ATOM 344 CD PRO A 23 -8.526 23.479 -8.402 1.00 33.43 C ATOM 0 HA PRO A 23 -5.656 25.025 -8.443 1.00 41.33 H new ATOM 0 HB2 PRO A 23 -7.793 26.608 -9.245 1.00 43.13 H new ATOM 0 HB3 PRO A 23 -7.240 25.278 -10.243 1.00 43.13 H new ATOM 0 HG2 PRO A 23 -9.555 25.365 -8.318 1.00 3.20 H new ATOM 0 HG3 PRO A 23 -9.484 24.662 -9.921 1.00 3.20 H new ATOM 0 HD2 PRO A 23 -9.265 23.129 -7.681 1.00 33.43 H new ATOM 0 HD3 PRO A 23 -8.433 22.705 -9.164 1.00 33.43 H new ATOM 352 N GLY A 24 -7.853 26.111 -6.272 1.00 1.53 N ATOM 353 CA GLY A 24 -7.988 27.022 -5.151 1.00 63.22 C ATOM 354 C GLY A 24 -7.993 26.303 -3.817 1.00 15.14 C ATOM 355 O GLY A 24 -8.824 26.585 -2.955 1.00 15.22 O ATOM 0 H GLY A 24 -8.669 25.525 -6.449 1.00 1.53 H new ATOM 0 HA2 GLY A 24 -7.168 27.740 -5.170 1.00 63.22 H new ATOM 0 HA3 GLY A 24 -8.912 27.590 -5.258 1.00 63.22 H new ATOM 359 N GLY A 25 -7.061 25.370 -3.646 1.00 13.22 N ATOM 360 CA GLY A 25 -6.979 24.622 -2.404 1.00 64.24 C ATOM 361 C GLY A 25 -5.622 24.744 -1.742 1.00 1.15 C ATOM 362 O GLY A 25 -4.708 25.359 -2.291 1.00 32.01 O ATOM 0 H GLY A 25 -6.362 25.119 -4.345 1.00 13.22 H new ATOM 0 HA2 GLY A 25 -7.748 24.978 -1.718 1.00 64.24 H new ATOM 0 HA3 GLY A 25 -7.190 23.571 -2.602 1.00 64.24 H new ATOM 366 N LYS A 26 -5.489 24.158 -0.556 1.00 61.31 N ATOM 367 CA LYS A 26 -4.233 24.205 0.183 1.00 3.45 C ATOM 368 C LYS A 26 -3.653 22.804 0.356 1.00 5.05 C ATOM 369 O LYS A 26 -2.657 22.616 1.056 1.00 2.11 O ATOM 370 CB LYS A 26 -4.449 24.852 1.553 1.00 12.53 C ATOM 371 CG LYS A 26 -3.357 25.836 1.939 1.00 4.11 C ATOM 372 CD LYS A 26 -3.902 27.248 2.072 1.00 21.51 C ATOM 373 CE LYS A 26 -2.943 28.146 2.838 1.00 2.52 C ATOM 374 NZ LYS A 26 -3.568 28.700 4.071 1.00 21.34 N ATOM 0 H LYS A 26 -6.236 23.645 -0.087 1.00 61.31 H new ATOM 0 HA LYS A 26 -3.525 24.805 -0.388 1.00 3.45 H new ATOM 0 HB2 LYS A 26 -5.409 25.368 1.555 1.00 12.53 H new ATOM 0 HB3 LYS A 26 -4.506 24.070 2.310 1.00 12.53 H new ATOM 0 HG2 LYS A 26 -2.906 25.529 2.882 1.00 4.11 H new ATOM 0 HG3 LYS A 26 -2.568 25.819 1.187 1.00 4.11 H new ATOM 0 HD2 LYS A 26 -4.080 27.665 1.081 1.00 21.51 H new ATOM 0 HD3 LYS A 26 -4.864 27.221 2.584 1.00 21.51 H new ATOM 0 HE2 LYS A 26 -2.051 27.580 3.106 1.00 2.52 H new ATOM 0 HE3 LYS A 26 -2.620 28.965 2.195 1.00 2.52 H new ATOM 0 HZ1 LYS A 26 -2.883 29.307 4.565 1.00 21.34 H new ATOM 0 HZ2 LYS A 26 -4.405 29.261 3.814 1.00 21.34 H new ATOM 0 HZ3 LYS A 26 -3.853 27.920 4.696 1.00 21.34 H new ATOM 388 N LYS A 27 -4.281 21.824 -0.285 1.00 74.34 N ATOM 389 CA LYS A 27 -3.825 20.442 -0.205 1.00 2.43 C ATOM 390 C LYS A 27 -2.904 20.104 -1.373 1.00 13.44 C ATOM 391 O LYS A 27 -3.301 20.196 -2.534 1.00 12.44 O ATOM 392 CB LYS A 27 -5.023 19.489 -0.194 1.00 32.43 C ATOM 393 CG LYS A 27 -5.909 19.641 1.030 1.00 60.03 C ATOM 394 CD LYS A 27 -6.740 18.393 1.275 1.00 63.21 C ATOM 395 CE LYS A 27 -8.214 18.729 1.443 1.00 31.01 C ATOM 396 NZ LYS A 27 -9.008 17.544 1.873 1.00 54.53 N ATOM 0 H LYS A 27 -5.108 21.962 -0.866 1.00 74.34 H new ATOM 0 HA LYS A 27 -3.265 20.323 0.722 1.00 2.43 H new ATOM 0 HB2 LYS A 27 -5.621 19.660 -1.089 1.00 32.43 H new ATOM 0 HB3 LYS A 27 -4.660 18.462 -0.245 1.00 32.43 H new ATOM 0 HG2 LYS A 27 -5.291 19.845 1.904 1.00 60.03 H new ATOM 0 HG3 LYS A 27 -6.569 20.499 0.898 1.00 60.03 H new ATOM 0 HD2 LYS A 27 -6.616 17.702 0.441 1.00 63.21 H new ATOM 0 HD3 LYS A 27 -6.378 17.883 2.168 1.00 63.21 H new ATOM 0 HE2 LYS A 27 -8.323 19.526 2.179 1.00 31.01 H new ATOM 0 HE3 LYS A 27 -8.610 19.109 0.501 1.00 31.01 H new ATOM 0 HZ1 LYS A 27 -10.007 17.814 1.976 1.00 54.53 H new ATOM 0 HZ2 LYS A 27 -8.925 16.793 1.159 1.00 54.53 H new ATOM 0 HZ3 LYS A 27 -8.647 17.197 2.785 1.00 54.53 H new ATOM 410 N GLN A 28 -1.674 19.713 -1.056 1.00 1.41 N ATOM 411 CA GLN A 28 -0.697 19.360 -2.081 1.00 3.41 C ATOM 412 C GLN A 28 -0.724 17.862 -2.365 1.00 32.14 C ATOM 413 O GLN A 28 -1.397 17.099 -1.671 1.00 33.15 O ATOM 414 CB GLN A 28 0.706 19.783 -1.644 1.00 63.20 C ATOM 415 CG GLN A 28 0.726 21.053 -0.809 1.00 61.11 C ATOM 416 CD GLN A 28 2.125 21.447 -0.379 1.00 15.54 C ATOM 417 OE1 GLN A 28 2.216 22.405 0.536 1.00 51.44 O flip ATOM 418 NE2 GLN A 28 3.114 20.896 -0.863 1.00 53.30 N flip ATOM 0 H GLN A 28 -1.330 19.632 -0.099 1.00 1.41 H new ATOM 0 HA GLN A 28 -0.960 19.890 -2.997 1.00 3.41 H new ATOM 0 HB2 GLN A 28 1.158 18.974 -1.071 1.00 63.20 H new ATOM 0 HB3 GLN A 28 1.324 19.930 -2.529 1.00 63.20 H new ATOM 0 HG2 GLN A 28 0.284 21.867 -1.383 1.00 61.11 H new ATOM 0 HG3 GLN A 28 0.105 20.912 0.075 1.00 61.11 H new ATOM 0 HE21 GLN A 28 2.998 20.164 -1.564 1.00 53.30 H new ATOM 0 HE22 GLN A 28 4.049 21.171 -0.563 1.00 53.30 H new ATOM 427 N TYR A 29 0.011 17.447 -3.390 1.00 55.12 N ATOM 428 CA TYR A 29 0.070 16.040 -3.769 1.00 12.33 C ATOM 429 C TYR A 29 0.967 15.256 -2.815 1.00 54.15 C ATOM 430 O TYR A 29 1.968 15.774 -2.319 1.00 71.20 O ATOM 431 CB TYR A 29 0.583 15.897 -5.203 1.00 5.31 C ATOM 432 CG TYR A 29 -0.516 15.674 -6.218 1.00 54.42 C ATOM 433 CD1 TYR A 29 -1.233 14.484 -6.244 1.00 4.14 C ATOM 434 CD2 TYR A 29 -0.835 16.650 -7.153 1.00 33.21 C ATOM 435 CE1 TYR A 29 -2.237 14.274 -7.170 1.00 23.21 C ATOM 436 CE2 TYR A 29 -1.837 16.451 -8.082 1.00 41.15 C ATOM 437 CZ TYR A 29 -2.535 15.262 -8.086 1.00 41.34 C ATOM 438 OH TYR A 29 -3.534 15.058 -9.011 1.00 42.31 O ATOM 0 H TYR A 29 0.575 18.065 -3.974 1.00 55.12 H new ATOM 0 HA TYR A 29 -0.939 15.631 -3.709 1.00 12.33 H new ATOM 0 HB2 TYR A 29 1.139 16.795 -5.473 1.00 5.31 H new ATOM 0 HB3 TYR A 29 1.283 15.063 -5.248 1.00 5.31 H new ATOM 0 HD1 TYR A 29 -1.001 13.709 -5.528 1.00 4.14 H new ATOM 0 HD2 TYR A 29 -0.289 17.582 -7.154 1.00 33.21 H new ATOM 0 HE1 TYR A 29 -2.785 13.343 -7.177 1.00 23.21 H new ATOM 0 HE2 TYR A 29 -2.072 17.222 -8.801 1.00 41.15 H new ATOM 0 HH TYR A 29 -4.403 15.058 -8.559 1.00 42.31 H new ATOM 448 N LYS A 30 0.603 14.003 -2.565 1.00 25.40 N ATOM 449 CA LYS A 30 1.373 13.146 -1.674 1.00 53.43 C ATOM 450 C LYS A 30 1.442 11.721 -2.215 1.00 43.43 C ATOM 451 O LYS A 30 0.729 11.367 -3.155 1.00 65.41 O ATOM 452 CB LYS A 30 0.754 13.141 -0.274 1.00 43.20 C ATOM 453 CG LYS A 30 1.700 13.626 0.811 1.00 61.12 C ATOM 454 CD LYS A 30 0.944 14.073 2.051 1.00 62.15 C ATOM 455 CE LYS A 30 1.866 14.751 3.051 1.00 32.14 C ATOM 456 NZ LYS A 30 1.639 16.221 3.107 1.00 73.34 N ATOM 0 H LYS A 30 -0.222 13.559 -2.968 1.00 25.40 H new ATOM 0 HA LYS A 30 2.386 13.544 -1.615 1.00 53.43 H new ATOM 0 HB2 LYS A 30 -0.136 13.771 -0.277 1.00 43.20 H new ATOM 0 HB3 LYS A 30 0.427 12.129 -0.034 1.00 43.20 H new ATOM 0 HG2 LYS A 30 2.393 12.827 1.075 1.00 61.12 H new ATOM 0 HG3 LYS A 30 2.298 14.454 0.430 1.00 61.12 H new ATOM 0 HD2 LYS A 30 0.148 14.760 1.765 1.00 62.15 H new ATOM 0 HD3 LYS A 30 0.469 13.211 2.519 1.00 62.15 H new ATOM 0 HE2 LYS A 30 1.708 14.321 4.040 1.00 32.14 H new ATOM 0 HE3 LYS A 30 2.903 14.554 2.780 1.00 32.14 H new ATOM 0 HZ1 LYS A 30 2.287 16.646 3.800 1.00 73.34 H new ATOM 0 HZ2 LYS A 30 1.815 16.635 2.169 1.00 73.34 H new ATOM 0 HZ3 LYS A 30 0.656 16.410 3.390 1.00 73.34 H new ATOM 470 N LEU A 31 2.302 10.906 -1.615 1.00 73.14 N ATOM 471 CA LEU A 31 2.463 9.518 -2.036 1.00 71.15 C ATOM 472 C LEU A 31 1.116 8.802 -2.076 1.00 31.12 C ATOM 473 O LEU A 31 0.852 8.002 -2.974 1.00 20.24 O ATOM 474 CB LEU A 31 3.416 8.785 -1.091 1.00 14.01 C ATOM 475 CG LEU A 31 4.818 8.509 -1.634 1.00 75.02 C ATOM 476 CD1 LEU A 31 4.748 7.633 -2.875 1.00 42.43 C ATOM 477 CD2 LEU A 31 5.539 9.814 -1.941 1.00 10.13 C ATOM 0 H LEU A 31 2.899 11.182 -0.835 1.00 73.14 H new ATOM 0 HA LEU A 31 2.885 9.515 -3.041 1.00 71.15 H new ATOM 0 HB2 LEU A 31 3.511 9.371 -0.177 1.00 14.01 H new ATOM 0 HB3 LEU A 31 2.961 7.834 -0.814 1.00 14.01 H new ATOM 0 HG LEU A 31 5.383 7.976 -0.869 1.00 75.02 H new ATOM 0 HD11 LEU A 31 5.756 7.448 -3.247 1.00 42.43 H new ATOM 0 HD12 LEU A 31 4.273 6.684 -2.624 1.00 42.43 H new ATOM 0 HD13 LEU A 31 4.165 8.138 -3.645 1.00 42.43 H new ATOM 0 HD21 LEU A 31 6.535 9.597 -2.326 1.00 10.13 H new ATOM 0 HD22 LEU A 31 4.975 10.374 -2.687 1.00 10.13 H new ATOM 0 HD23 LEU A 31 5.623 10.406 -1.030 1.00 10.13 H new ATOM 489 N LYS A 32 0.267 9.095 -1.097 1.00 32.05 N ATOM 490 CA LYS A 32 -1.054 8.483 -1.019 1.00 54.44 C ATOM 491 C LYS A 32 -1.740 8.496 -2.382 1.00 34.31 C ATOM 492 O LYS A 32 -2.506 7.591 -2.711 1.00 4.32 O ATOM 493 CB LYS A 32 -1.920 9.216 0.007 1.00 33.11 C ATOM 494 CG LYS A 32 -1.898 8.580 1.387 1.00 51.12 C ATOM 495 CD LYS A 32 -3.143 7.744 1.634 1.00 53.21 C ATOM 496 CE LYS A 32 -3.288 7.384 3.104 1.00 22.44 C ATOM 497 NZ LYS A 32 -4.598 6.737 3.390 1.00 44.22 N ATOM 0 H LYS A 32 0.471 9.754 -0.345 1.00 32.05 H new ATOM 0 HA LYS A 32 -0.929 7.447 -0.704 1.00 54.44 H new ATOM 0 HB2 LYS A 32 -1.579 10.248 0.086 1.00 33.11 H new ATOM 0 HB3 LYS A 32 -2.948 9.247 -0.353 1.00 33.11 H new ATOM 0 HG2 LYS A 32 -1.012 7.953 1.486 1.00 51.12 H new ATOM 0 HG3 LYS A 32 -1.824 9.358 2.147 1.00 51.12 H new ATOM 0 HD2 LYS A 32 -4.024 8.295 1.304 1.00 53.21 H new ATOM 0 HD3 LYS A 32 -3.095 6.833 1.038 1.00 53.21 H new ATOM 0 HE2 LYS A 32 -2.480 6.712 3.395 1.00 22.44 H new ATOM 0 HE3 LYS A 32 -3.188 8.284 3.710 1.00 22.44 H new ATOM 0 HZ1 LYS A 32 -4.658 6.507 4.402 1.00 44.22 H new ATOM 0 HZ2 LYS A 32 -5.369 7.387 3.136 1.00 44.22 H new ATOM 0 HZ3 LYS A 32 -4.683 5.864 2.831 1.00 44.22 H new ATOM 511 N HIS A 33 -1.459 9.530 -3.170 1.00 51.51 N ATOM 512 CA HIS A 33 -2.047 9.660 -4.499 1.00 41.31 C ATOM 513 C HIS A 33 -1.349 8.737 -5.495 1.00 24.45 C ATOM 514 O HIS A 33 -2.047 8.215 -6.365 1.00 33.21 O ATOM 515 CB HIS A 33 -1.958 11.109 -4.979 1.00 62.22 C ATOM 516 CG HIS A 33 -2.653 12.083 -4.079 1.00 4.43 C ATOM 517 ND1 HIS A 33 -1.984 13.036 -3.340 1.00 71.33 N ATOM 518 CD2 HIS A 33 -3.967 12.248 -3.799 1.00 4.43 C ATOM 519 CE1 HIS A 33 -2.856 13.744 -2.646 1.00 21.31 C ATOM 520 NE2 HIS A 33 -4.068 13.287 -2.907 1.00 51.41 N ATOM 0 H HIS A 33 -0.829 10.289 -2.911 1.00 51.51 H new ATOM 0 HA HIS A 33 -3.096 9.370 -4.436 1.00 41.31 H new ATOM 0 HB2 HIS A 33 -0.909 11.391 -5.064 1.00 62.22 H new ATOM 0 HB3 HIS A 33 -2.389 11.179 -5.978 1.00 62.22 H new ATOM 0 HD2 HIS A 33 -4.785 11.669 -4.203 1.00 4.43 H new ATOM 0 HE1 HIS A 33 -2.619 14.559 -1.978 1.00 21.31 H new ATOM 0 HE2 HIS A 33 -4.936 13.647 -2.511 1.00 51.41 H new ATOM 528 N ILE A 34 -0.041 8.532 -5.394 1.00 1.21 N ATOM 529 CA ILE A 34 0.667 7.659 -6.321 1.00 52.24 C ATOM 530 C ILE A 34 0.484 6.192 -5.946 1.00 22.32 C ATOM 531 O ILE A 34 0.046 5.381 -6.762 1.00 2.15 O ATOM 532 CB ILE A 34 2.172 7.983 -6.361 1.00 13.31 C ATOM 533 CG1 ILE A 34 2.390 9.462 -6.688 1.00 13.41 C ATOM 534 CG2 ILE A 34 2.878 7.100 -7.380 1.00 1.21 C ATOM 535 CD1 ILE A 34 3.835 9.897 -6.587 1.00 1.50 C ATOM 0 H ILE A 34 0.550 8.958 -4.680 1.00 1.21 H new ATOM 0 HA ILE A 34 0.239 7.835 -7.308 1.00 52.24 H new ATOM 0 HB ILE A 34 2.597 7.781 -5.378 1.00 13.31 H new ATOM 0 HG12 ILE A 34 2.029 9.659 -7.698 1.00 13.41 H new ATOM 0 HG13 ILE A 34 1.788 10.068 -6.010 1.00 13.41 H new ATOM 0 HG21 ILE A 34 3.941 7.341 -7.396 1.00 1.21 H new ATOM 0 HG22 ILE A 34 2.748 6.053 -7.106 1.00 1.21 H new ATOM 0 HG23 ILE A 34 2.452 7.272 -8.368 1.00 1.21 H new ATOM 0 HD11 ILE A 34 3.914 10.956 -6.832 1.00 1.50 H new ATOM 0 HD12 ILE A 34 4.195 9.732 -5.571 1.00 1.50 H new ATOM 0 HD13 ILE A 34 4.439 9.317 -7.285 1.00 1.50 H new ATOM 547 N VAL A 35 0.821 5.859 -4.704 1.00 3.21 N ATOM 548 CA VAL A 35 0.691 4.491 -4.218 1.00 32.44 C ATOM 549 C VAL A 35 -0.670 3.906 -4.580 1.00 54.51 C ATOM 550 O VAL A 35 -0.781 2.723 -4.904 1.00 22.15 O ATOM 551 CB VAL A 35 0.879 4.418 -2.690 1.00 45.02 C ATOM 552 CG1 VAL A 35 0.745 2.983 -2.204 1.00 13.14 C ATOM 553 CG2 VAL A 35 2.225 5.002 -2.291 1.00 3.10 C ATOM 0 H VAL A 35 1.186 6.518 -4.016 1.00 3.21 H new ATOM 0 HA VAL A 35 1.474 3.907 -4.702 1.00 32.44 H new ATOM 0 HB VAL A 35 0.097 5.011 -2.216 1.00 45.02 H new ATOM 0 HG11 VAL A 35 0.881 2.951 -1.123 1.00 13.14 H new ATOM 0 HG12 VAL A 35 -0.245 2.604 -2.457 1.00 13.14 H new ATOM 0 HG13 VAL A 35 1.503 2.364 -2.683 1.00 13.14 H new ATOM 0 HG21 VAL A 35 2.341 4.942 -1.209 1.00 3.10 H new ATOM 0 HG22 VAL A 35 3.024 4.438 -2.773 1.00 3.10 H new ATOM 0 HG23 VAL A 35 2.277 6.045 -2.605 1.00 3.10 H new ATOM 563 N TRP A 36 -1.700 4.742 -4.525 1.00 3.21 N ATOM 564 CA TRP A 36 -3.055 4.306 -4.848 1.00 74.32 C ATOM 565 C TRP A 36 -3.156 3.887 -6.310 1.00 23.40 C ATOM 566 O TRP A 36 -3.735 2.849 -6.628 1.00 40.11 O ATOM 567 CB TRP A 36 -4.055 5.425 -4.553 1.00 62.24 C ATOM 568 CG TRP A 36 -5.459 5.088 -4.958 1.00 35.42 C ATOM 569 CD1 TRP A 36 -6.274 4.155 -4.386 1.00 13.51 C ATOM 570 CD2 TRP A 36 -6.209 5.682 -6.022 1.00 52.05 C ATOM 571 NE1 TRP A 36 -7.487 4.131 -5.031 1.00 31.34 N ATOM 572 CE2 TRP A 36 -7.473 5.060 -6.038 1.00 55.31 C ATOM 573 CE3 TRP A 36 -5.938 6.679 -6.964 1.00 24.45 C ATOM 574 CZ2 TRP A 36 -8.460 5.403 -6.958 1.00 42.12 C ATOM 575 CZ3 TRP A 36 -6.918 7.018 -7.876 1.00 22.43 C ATOM 576 CH2 TRP A 36 -8.168 6.383 -7.868 1.00 55.10 C ATOM 0 H TRP A 36 -1.624 5.724 -4.260 1.00 3.21 H new ATOM 0 HA TRP A 36 -3.293 3.443 -4.226 1.00 74.32 H new ATOM 0 HB2 TRP A 36 -4.036 5.648 -3.486 1.00 62.24 H new ATOM 0 HB3 TRP A 36 -3.741 6.330 -5.074 1.00 62.24 H new ATOM 0 HD1 TRP A 36 -6.005 3.528 -3.549 1.00 13.51 H new ATOM 0 HE1 TRP A 36 -8.270 3.521 -4.798 1.00 31.34 H new ATOM 0 HE3 TRP A 36 -4.979 7.175 -6.978 1.00 24.45 H new ATOM 0 HZ2 TRP A 36 -9.422 4.913 -6.954 1.00 42.12 H new ATOM 0 HZ3 TRP A 36 -6.718 7.786 -8.609 1.00 22.43 H new ATOM 0 HH2 TRP A 36 -8.914 6.672 -8.593 1.00 55.10 H new ATOM 587 N ALA A 37 -2.592 4.702 -7.196 1.00 14.10 N ATOM 588 CA ALA A 37 -2.618 4.413 -8.625 1.00 30.05 C ATOM 589 C ALA A 37 -1.779 3.182 -8.951 1.00 63.34 C ATOM 590 O ALA A 37 -2.193 2.328 -9.734 1.00 53.44 O ATOM 591 CB ALA A 37 -2.124 5.616 -9.415 1.00 2.25 C ATOM 0 H ALA A 37 -2.112 5.567 -6.949 1.00 14.10 H new ATOM 0 HA ALA A 37 -3.649 4.203 -8.910 1.00 30.05 H new ATOM 0 HB1 ALA A 37 -2.149 5.387 -10.480 1.00 2.25 H new ATOM 0 HB2 ALA A 37 -2.767 6.473 -9.213 1.00 2.25 H new ATOM 0 HB3 ALA A 37 -1.102 5.852 -9.118 1.00 2.25 H new ATOM 597 N SER A 38 -0.598 3.099 -8.347 1.00 72.21 N ATOM 598 CA SER A 38 0.301 1.975 -8.578 1.00 72.34 C ATOM 599 C SER A 38 -0.368 0.657 -8.200 1.00 32.44 C ATOM 600 O SER A 38 -0.110 -0.381 -8.809 1.00 20.02 O ATOM 601 CB SER A 38 1.592 2.154 -7.776 1.00 61.02 C ATOM 602 OG SER A 38 1.612 1.298 -6.646 1.00 72.25 O ATOM 0 H SER A 38 -0.242 3.797 -7.694 1.00 72.21 H new ATOM 0 HA SER A 38 0.543 1.947 -9.641 1.00 72.34 H new ATOM 0 HB2 SER A 38 2.452 1.942 -8.412 1.00 61.02 H new ATOM 0 HB3 SER A 38 1.682 3.191 -7.453 1.00 61.02 H new ATOM 0 HG SER A 38 0.935 1.592 -6.001 1.00 72.25 H new ATOM 608 N ARG A 39 -1.229 0.708 -7.187 1.00 55.45 N ATOM 609 CA ARG A 39 -1.935 -0.481 -6.726 1.00 1.31 C ATOM 610 C ARG A 39 -3.056 -0.858 -7.691 1.00 33.44 C ATOM 611 O ARG A 39 -3.387 -2.033 -7.843 1.00 70.23 O ATOM 612 CB ARG A 39 -2.508 -0.249 -5.327 1.00 31.22 C ATOM 613 CG ARG A 39 -1.454 -0.231 -4.232 1.00 2.35 C ATOM 614 CD ARG A 39 -2.007 0.341 -2.935 1.00 52.44 C ATOM 615 NE ARG A 39 -2.524 -0.703 -2.053 1.00 60.53 N ATOM 616 CZ ARG A 39 -2.793 -0.511 -0.767 1.00 24.41 C ATOM 617 NH1 ARG A 39 -2.599 0.679 -0.215 1.00 75.25 N ATOM 618 NH2 ARG A 39 -3.261 -1.509 -0.029 1.00 42.14 N ATOM 0 H ARG A 39 -1.453 1.559 -6.671 1.00 55.45 H new ATOM 0 HA ARG A 39 -1.221 -1.304 -6.687 1.00 1.31 H new ATOM 0 HB2 ARG A 39 -3.046 0.699 -5.317 1.00 31.22 H new ATOM 0 HB3 ARG A 39 -3.235 -1.031 -5.107 1.00 31.22 H new ATOM 0 HG2 ARG A 39 -1.091 -1.244 -4.058 1.00 2.35 H new ATOM 0 HG3 ARG A 39 -0.600 0.363 -4.558 1.00 2.35 H new ATOM 0 HD2 ARG A 39 -1.223 0.895 -2.420 1.00 52.44 H new ATOM 0 HD3 ARG A 39 -2.803 1.051 -3.162 1.00 52.44 H new ATOM 0 HE ARG A 39 -2.687 -1.630 -2.447 1.00 60.53 H new ATOM 0 HH11 ARG A 39 -2.242 1.451 -0.779 1.00 75.25 H new ATOM 0 HH12 ARG A 39 -2.807 0.823 0.773 1.00 75.25 H new ATOM 0 HH21 ARG A 39 -3.415 -2.426 -0.449 1.00 42.14 H new ATOM 0 HH22 ARG A 39 -3.467 -1.360 0.959 1.00 42.14 H new ATOM 632 N GLU A 40 -3.635 0.149 -8.337 1.00 60.21 N ATOM 633 CA GLU A 40 -4.720 -0.077 -9.286 1.00 50.33 C ATOM 634 C GLU A 40 -4.207 -0.776 -10.542 1.00 33.32 C ATOM 635 O GLU A 40 -4.787 -1.762 -10.998 1.00 14.54 O ATOM 636 CB GLU A 40 -5.383 1.249 -9.662 1.00 25.42 C ATOM 637 CG GLU A 40 -6.858 1.118 -9.999 1.00 22.52 C ATOM 638 CD GLU A 40 -7.753 1.317 -8.791 1.00 65.43 C ATOM 639 OE1 GLU A 40 -7.412 2.154 -7.930 1.00 73.24 O ATOM 640 OE2 GLU A 40 -8.796 0.634 -8.707 1.00 33.52 O ATOM 0 H GLU A 40 -3.372 1.128 -8.221 1.00 60.21 H new ATOM 0 HA GLU A 40 -5.458 -0.721 -8.808 1.00 50.33 H new ATOM 0 HB2 GLU A 40 -5.269 1.950 -8.835 1.00 25.42 H new ATOM 0 HB3 GLU A 40 -4.860 1.677 -10.517 1.00 25.42 H new ATOM 0 HG2 GLU A 40 -7.118 1.850 -10.764 1.00 22.52 H new ATOM 0 HG3 GLU A 40 -7.043 0.132 -10.425 1.00 22.52 H new ATOM 647 N LEU A 41 -3.117 -0.257 -11.097 1.00 64.31 N ATOM 648 CA LEU A 41 -2.526 -0.829 -12.302 1.00 13.14 C ATOM 649 C LEU A 41 -2.303 -2.330 -12.138 1.00 63.14 C ATOM 650 O LEU A 41 -2.517 -3.103 -13.071 1.00 33.24 O ATOM 651 CB LEU A 41 -1.200 -0.137 -12.621 1.00 33.25 C ATOM 652 CG LEU A 41 -1.294 1.326 -13.053 1.00 15.11 C ATOM 653 CD1 LEU A 41 0.094 1.906 -13.283 1.00 51.54 C ATOM 654 CD2 LEU A 41 -2.143 1.458 -14.309 1.00 11.24 C ATOM 0 H LEU A 41 -2.625 0.558 -10.732 1.00 64.31 H new ATOM 0 HA LEU A 41 -3.219 -0.671 -13.128 1.00 13.14 H new ATOM 0 HB2 LEU A 41 -0.562 -0.194 -11.739 1.00 33.25 H new ATOM 0 HB3 LEU A 41 -0.702 -0.697 -13.412 1.00 33.25 H new ATOM 0 HG LEU A 41 -1.773 1.890 -12.253 1.00 15.11 H new ATOM 0 HD11 LEU A 41 0.007 2.948 -13.590 1.00 51.54 H new ATOM 0 HD12 LEU A 41 0.671 1.847 -12.360 1.00 51.54 H new ATOM 0 HD13 LEU A 41 0.600 1.339 -14.064 1.00 51.54 H new ATOM 0 HD21 LEU A 41 -2.199 2.506 -14.602 1.00 11.24 H new ATOM 0 HD22 LEU A 41 -1.692 0.879 -15.115 1.00 11.24 H new ATOM 0 HD23 LEU A 41 -3.147 1.083 -14.111 1.00 11.24 H new ATOM 666 N GLU A 42 -1.874 -2.733 -10.946 1.00 43.45 N ATOM 667 CA GLU A 42 -1.624 -4.141 -10.662 1.00 4.43 C ATOM 668 C GLU A 42 -2.870 -4.980 -10.930 1.00 32.01 C ATOM 669 O GLU A 42 -2.776 -6.144 -11.319 1.00 70.25 O ATOM 670 CB GLU A 42 -1.179 -4.319 -9.209 1.00 12.15 C ATOM 671 CG GLU A 42 0.272 -4.747 -9.064 1.00 43.41 C ATOM 672 CD GLU A 42 0.931 -4.167 -7.828 1.00 2.42 C ATOM 673 OE1 GLU A 42 0.210 -3.604 -6.979 1.00 25.41 O ATOM 674 OE2 GLU A 42 2.170 -4.277 -7.710 1.00 5.13 O ATOM 0 H GLU A 42 -1.693 -2.105 -10.163 1.00 43.45 H new ATOM 0 HA GLU A 42 -0.828 -4.483 -11.323 1.00 4.43 H new ATOM 0 HB2 GLU A 42 -1.327 -3.380 -8.675 1.00 12.15 H new ATOM 0 HB3 GLU A 42 -1.817 -5.062 -8.731 1.00 12.15 H new ATOM 0 HG2 GLU A 42 0.323 -5.835 -9.022 1.00 43.41 H new ATOM 0 HG3 GLU A 42 0.829 -4.436 -9.948 1.00 43.41 H new ATOM 681 N ARG A 43 -4.037 -4.381 -10.718 1.00 34.42 N ATOM 682 CA ARG A 43 -5.302 -5.071 -10.935 1.00 53.43 C ATOM 683 C ARG A 43 -5.708 -5.014 -12.405 1.00 22.14 C ATOM 684 O ARG A 43 -6.595 -5.746 -12.843 1.00 53.25 O ATOM 685 CB ARG A 43 -6.400 -4.456 -10.066 1.00 60.32 C ATOM 686 CG ARG A 43 -7.514 -5.427 -9.713 1.00 63.40 C ATOM 687 CD ARG A 43 -8.836 -5.010 -10.339 1.00 10.42 C ATOM 688 NE ARG A 43 -9.971 -5.701 -9.732 1.00 72.42 N ATOM 689 CZ ARG A 43 -10.235 -6.988 -9.922 1.00 43.11 C ATOM 690 NH1 ARG A 43 -9.449 -7.722 -10.698 1.00 21.35 N ATOM 691 NH2 ARG A 43 -11.287 -7.545 -9.335 1.00 71.52 N ATOM 0 H ARG A 43 -4.132 -3.418 -10.396 1.00 34.42 H new ATOM 0 HA ARG A 43 -5.169 -6.116 -10.653 1.00 53.43 H new ATOM 0 HB2 ARG A 43 -5.954 -4.078 -9.146 1.00 60.32 H new ATOM 0 HB3 ARG A 43 -6.828 -3.600 -10.588 1.00 60.32 H new ATOM 0 HG2 ARG A 43 -7.248 -6.427 -10.055 1.00 63.40 H new ATOM 0 HG3 ARG A 43 -7.623 -5.479 -8.630 1.00 63.40 H new ATOM 0 HD2 ARG A 43 -8.966 -3.933 -10.229 1.00 10.42 H new ATOM 0 HD3 ARG A 43 -8.813 -5.220 -11.408 1.00 10.42 H new ATOM 0 HE ARG A 43 -10.595 -5.165 -9.129 1.00 72.42 H new ATOM 0 HH11 ARG A 43 -8.639 -7.298 -11.151 1.00 21.35 H new ATOM 0 HH12 ARG A 43 -9.654 -8.711 -10.842 1.00 21.35 H new ATOM 0 HH21 ARG A 43 -11.894 -6.984 -8.737 1.00 71.52 H new ATOM 0 HH22 ARG A 43 -11.489 -8.534 -9.482 1.00 71.52 H new ATOM 705 N PHE A 44 -5.055 -4.137 -13.160 1.00 13.34 N ATOM 706 CA PHE A 44 -5.349 -3.982 -14.580 1.00 34.53 C ATOM 707 C PHE A 44 -4.292 -4.679 -15.433 1.00 31.54 C ATOM 708 O PHE A 44 -4.094 -4.334 -16.597 1.00 62.11 O ATOM 709 CB PHE A 44 -5.421 -2.499 -14.947 1.00 72.25 C ATOM 710 CG PHE A 44 -6.562 -1.774 -14.292 1.00 74.41 C ATOM 711 CD1 PHE A 44 -7.840 -2.310 -14.304 1.00 74.44 C ATOM 712 CD2 PHE A 44 -6.355 -0.557 -13.662 1.00 70.24 C ATOM 713 CE1 PHE A 44 -8.890 -1.644 -13.702 1.00 61.24 C ATOM 714 CE2 PHE A 44 -7.402 0.113 -13.058 1.00 65.44 C ATOM 715 CZ PHE A 44 -8.671 -0.432 -13.077 1.00 70.51 C ATOM 0 H PHE A 44 -4.319 -3.523 -12.812 1.00 13.34 H new ATOM 0 HA PHE A 44 -6.315 -4.446 -14.780 1.00 34.53 H new ATOM 0 HB2 PHE A 44 -4.485 -2.017 -14.665 1.00 72.25 H new ATOM 0 HB3 PHE A 44 -5.514 -2.405 -16.029 1.00 72.25 H new ATOM 0 HD1 PHE A 44 -8.017 -3.259 -14.789 1.00 74.44 H new ATOM 0 HD2 PHE A 44 -5.364 -0.127 -13.643 1.00 70.24 H new ATOM 0 HE1 PHE A 44 -9.882 -2.071 -13.720 1.00 61.24 H new ATOM 0 HE2 PHE A 44 -7.228 1.062 -12.572 1.00 65.44 H new ATOM 0 HZ PHE A 44 -9.491 0.089 -12.604 1.00 70.51 H new ATOM 725 N ALA A 45 -3.617 -5.659 -14.844 1.00 33.25 N ATOM 726 CA ALA A 45 -2.582 -6.405 -15.549 1.00 32.11 C ATOM 727 C ALA A 45 -1.400 -5.507 -15.900 1.00 23.20 C ATOM 728 O ALA A 45 -0.691 -5.750 -16.876 1.00 51.20 O ATOM 729 CB ALA A 45 -3.155 -7.043 -16.806 1.00 34.13 C ATOM 0 H ALA A 45 -3.768 -5.956 -13.880 1.00 33.25 H new ATOM 0 HA ALA A 45 -2.222 -7.193 -14.887 1.00 32.11 H new ATOM 0 HB1 ALA A 45 -2.371 -7.597 -17.323 1.00 34.13 H new ATOM 0 HB2 ALA A 45 -3.961 -7.724 -16.533 1.00 34.13 H new ATOM 0 HB3 ALA A 45 -3.544 -6.266 -17.464 1.00 34.13 H new ATOM 735 N VAL A 46 -1.195 -4.466 -15.099 1.00 12.54 N ATOM 736 CA VAL A 46 -0.099 -3.532 -15.325 1.00 33.11 C ATOM 737 C VAL A 46 0.753 -3.370 -14.071 1.00 11.10 C ATOM 738 O VAL A 46 0.232 -3.165 -12.976 1.00 32.21 O ATOM 739 CB VAL A 46 -0.622 -2.149 -15.759 1.00 33.21 C ATOM 740 CG1 VAL A 46 0.531 -1.168 -15.915 1.00 71.32 C ATOM 741 CG2 VAL A 46 -1.416 -2.261 -17.051 1.00 50.45 C ATOM 0 H VAL A 46 -1.774 -4.249 -14.288 1.00 12.54 H new ATOM 0 HA VAL A 46 0.513 -3.949 -16.125 1.00 33.11 H new ATOM 0 HB VAL A 46 -1.287 -1.771 -14.983 1.00 33.21 H new ATOM 0 HG11 VAL A 46 0.143 -0.197 -16.222 1.00 71.32 H new ATOM 0 HG12 VAL A 46 1.053 -1.066 -14.964 1.00 71.32 H new ATOM 0 HG13 VAL A 46 1.223 -1.538 -16.671 1.00 71.32 H new ATOM 0 HG21 VAL A 46 -1.778 -1.275 -17.342 1.00 50.45 H new ATOM 0 HG22 VAL A 46 -0.776 -2.660 -17.838 1.00 50.45 H new ATOM 0 HG23 VAL A 46 -2.264 -2.928 -16.900 1.00 50.45 H new ATOM 751 N ASN A 47 2.068 -3.465 -14.240 1.00 61.31 N ATOM 752 CA ASN A 47 2.995 -3.329 -13.122 1.00 3.42 C ATOM 753 C ASN A 47 3.200 -1.861 -12.761 1.00 54.03 C ATOM 754 O ASN A 47 3.330 -0.996 -13.627 1.00 74.40 O ATOM 755 CB ASN A 47 4.338 -3.976 -13.464 1.00 71.33 C ATOM 756 CG ASN A 47 4.603 -5.225 -12.647 1.00 14.55 C ATOM 757 OD1 ASN A 47 3.913 -6.234 -12.793 1.00 41.13 O ATOM 758 ND2 ASN A 47 5.607 -5.163 -11.780 1.00 31.24 N ATOM 0 H ASN A 47 2.516 -3.636 -15.140 1.00 61.31 H new ATOM 0 HA ASN A 47 2.564 -3.839 -12.260 1.00 3.42 H new ATOM 0 HB2 ASN A 47 4.357 -4.228 -14.524 1.00 71.33 H new ATOM 0 HB3 ASN A 47 5.139 -3.257 -13.293 1.00 71.33 H new ATOM 0 HD21 ASN A 47 5.832 -5.973 -11.202 1.00 31.24 H new ATOM 0 HD22 ASN A 47 6.153 -4.306 -11.692 1.00 31.24 H new ATOM 765 N PRO A 48 3.232 -1.572 -11.452 1.00 15.41 N ATOM 766 CA PRO A 48 3.424 -0.210 -10.946 1.00 30.32 C ATOM 767 C PRO A 48 4.837 0.307 -11.195 1.00 73.00 C ATOM 768 O PRO A 48 5.134 1.474 -10.943 1.00 71.23 O ATOM 769 CB PRO A 48 3.162 -0.349 -9.444 1.00 72.24 C ATOM 770 CG PRO A 48 3.467 -1.773 -9.136 1.00 50.34 C ATOM 771 CD PRO A 48 3.084 -2.553 -10.364 1.00 53.32 C ATOM 0 HA PRO A 48 2.768 0.505 -11.442 1.00 30.32 H new ATOM 0 HB2 PRO A 48 3.796 0.325 -8.868 1.00 72.24 H new ATOM 0 HB3 PRO A 48 2.129 -0.103 -9.198 1.00 72.24 H new ATOM 0 HG2 PRO A 48 4.524 -1.904 -8.904 1.00 50.34 H new ATOM 0 HG3 PRO A 48 2.905 -2.113 -8.266 1.00 50.34 H new ATOM 0 HD2 PRO A 48 3.733 -3.416 -10.510 1.00 53.32 H new ATOM 0 HD3 PRO A 48 2.063 -2.929 -10.299 1.00 53.32 H new ATOM 779 N GLY A 49 5.705 -0.569 -11.691 1.00 1.01 N ATOM 780 CA GLY A 49 7.076 -0.181 -11.964 1.00 42.45 C ATOM 781 C GLY A 49 7.203 0.642 -13.231 1.00 51.14 C ATOM 782 O GLY A 49 8.289 1.119 -13.563 1.00 73.23 O ATOM 0 H GLY A 49 5.483 -1.540 -11.909 1.00 1.01 H new ATOM 0 HA2 GLY A 49 7.463 0.392 -11.122 1.00 42.45 H new ATOM 0 HA3 GLY A 49 7.693 -1.075 -12.052 1.00 42.45 H new ATOM 786 N LEU A 50 6.093 0.809 -13.941 1.00 3.24 N ATOM 787 CA LEU A 50 6.084 1.580 -15.179 1.00 14.40 C ATOM 788 C LEU A 50 5.951 3.071 -14.891 1.00 55.21 C ATOM 789 O LEU A 50 6.497 3.906 -15.615 1.00 4.31 O ATOM 790 CB LEU A 50 4.939 1.118 -16.083 1.00 35.34 C ATOM 791 CG LEU A 50 4.903 -0.375 -16.410 1.00 42.21 C ATOM 792 CD1 LEU A 50 3.551 -0.761 -16.988 1.00 50.03 C ATOM 793 CD2 LEU A 50 6.021 -0.737 -17.375 1.00 13.00 C ATOM 0 H LEU A 50 5.187 0.420 -13.680 1.00 3.24 H new ATOM 0 HA LEU A 50 7.032 1.411 -15.690 1.00 14.40 H new ATOM 0 HB2 LEU A 50 3.996 1.388 -15.608 1.00 35.34 H new ATOM 0 HB3 LEU A 50 4.995 1.673 -17.019 1.00 35.34 H new ATOM 0 HG LEU A 50 5.054 -0.934 -15.486 1.00 42.21 H new ATOM 0 HD11 LEU A 50 3.543 -1.827 -17.215 1.00 50.03 H new ATOM 0 HD12 LEU A 50 2.768 -0.539 -16.263 1.00 50.03 H new ATOM 0 HD13 LEU A 50 3.371 -0.194 -17.901 1.00 50.03 H new ATOM 0 HD21 LEU A 50 5.980 -1.804 -17.596 1.00 13.00 H new ATOM 0 HD22 LEU A 50 5.902 -0.170 -18.298 1.00 13.00 H new ATOM 0 HD23 LEU A 50 6.984 -0.497 -16.923 1.00 13.00 H new ATOM 805 N LEU A 51 5.224 3.400 -13.829 1.00 20.30 N ATOM 806 CA LEU A 51 5.021 4.792 -13.443 1.00 71.53 C ATOM 807 C LEU A 51 6.336 5.438 -13.020 1.00 13.10 C ATOM 808 O LEU A 51 6.425 6.658 -12.889 1.00 21.51 O ATOM 809 CB LEU A 51 4.005 4.883 -12.303 1.00 24.02 C ATOM 810 CG LEU A 51 2.603 4.356 -12.610 1.00 23.52 C ATOM 811 CD1 LEU A 51 1.816 4.153 -11.325 1.00 12.52 C ATOM 812 CD2 LEU A 51 1.868 5.308 -13.543 1.00 11.12 C ATOM 0 H LEU A 51 4.765 2.722 -13.220 1.00 20.30 H new ATOM 0 HA LEU A 51 4.636 5.330 -14.309 1.00 71.53 H new ATOM 0 HB2 LEU A 51 4.399 4.334 -11.448 1.00 24.02 H new ATOM 0 HB3 LEU A 51 3.921 5.927 -12.000 1.00 24.02 H new ATOM 0 HG LEU A 51 2.699 3.392 -13.109 1.00 23.52 H new ATOM 0 HD11 LEU A 51 0.821 3.778 -11.563 1.00 12.52 H new ATOM 0 HD12 LEU A 51 2.333 3.433 -10.691 1.00 12.52 H new ATOM 0 HD13 LEU A 51 1.729 5.103 -10.798 1.00 12.52 H new ATOM 0 HD21 LEU A 51 0.872 4.917 -13.751 1.00 11.12 H new ATOM 0 HD22 LEU A 51 1.783 6.287 -13.071 1.00 11.12 H new ATOM 0 HD23 LEU A 51 2.423 5.403 -14.477 1.00 11.12 H new ATOM 824 N GLU A 52 7.355 4.611 -12.810 1.00 72.03 N ATOM 825 CA GLU A 52 8.666 5.103 -12.403 1.00 1.15 C ATOM 826 C GLU A 52 9.392 5.755 -13.577 1.00 3.31 C ATOM 827 O GLU A 52 10.349 6.507 -13.390 1.00 41.41 O ATOM 828 CB GLU A 52 9.512 3.959 -11.839 1.00 11.20 C ATOM 829 CG GLU A 52 10.242 3.159 -12.904 1.00 72.45 C ATOM 830 CD GLU A 52 10.723 1.814 -12.397 1.00 4.22 C ATOM 831 OE1 GLU A 52 10.560 1.541 -11.189 1.00 70.42 O ATOM 832 OE2 GLU A 52 11.262 1.032 -13.209 1.00 22.24 O ATOM 0 H GLU A 52 7.298 3.598 -12.915 1.00 72.03 H new ATOM 0 HA GLU A 52 8.518 5.854 -11.627 1.00 1.15 H new ATOM 0 HB2 GLU A 52 10.242 4.368 -11.140 1.00 11.20 H new ATOM 0 HB3 GLU A 52 8.868 3.288 -11.271 1.00 11.20 H new ATOM 0 HG2 GLU A 52 9.579 3.006 -13.756 1.00 72.45 H new ATOM 0 HG3 GLU A 52 11.096 3.734 -13.263 1.00 72.45 H new ATOM 839 N THR A 53 8.928 5.461 -14.788 1.00 53.00 N ATOM 840 CA THR A 53 9.532 6.016 -15.992 1.00 40.01 C ATOM 841 C THR A 53 8.497 6.751 -16.838 1.00 14.25 C ATOM 842 O THR A 53 7.377 6.272 -17.020 1.00 34.22 O ATOM 843 CB THR A 53 10.191 4.918 -16.847 1.00 41.55 C ATOM 844 OG1 THR A 53 9.209 4.292 -17.683 1.00 35.40 O ATOM 845 CG2 THR A 53 10.856 3.871 -15.966 1.00 65.12 C ATOM 0 H THR A 53 8.136 4.842 -14.960 1.00 53.00 H new ATOM 0 HA THR A 53 10.297 6.720 -15.666 1.00 40.01 H new ATOM 0 HB THR A 53 10.955 5.383 -17.470 1.00 41.55 H new ATOM 0 HG1 THR A 53 9.636 3.596 -18.225 1.00 35.40 H new ATOM 0 HG21 THR A 53 11.314 3.106 -16.593 1.00 65.12 H new ATOM 0 HG22 THR A 53 11.622 4.345 -15.353 1.00 65.12 H new ATOM 0 HG23 THR A 53 10.108 3.411 -15.320 1.00 65.12 H new ATOM 853 N SER A 54 8.880 7.914 -17.353 1.00 23.42 N ATOM 854 CA SER A 54 7.983 8.717 -18.177 1.00 62.30 C ATOM 855 C SER A 54 7.389 7.881 -19.306 1.00 43.55 C ATOM 856 O SER A 54 6.238 8.075 -19.697 1.00 51.31 O ATOM 857 CB SER A 54 8.730 9.920 -18.757 1.00 43.00 C ATOM 858 OG SER A 54 9.157 9.665 -20.084 1.00 43.44 O ATOM 0 H SER A 54 9.805 8.322 -17.215 1.00 23.42 H new ATOM 0 HA SER A 54 7.170 9.073 -17.545 1.00 62.30 H new ATOM 0 HB2 SER A 54 8.081 10.796 -18.743 1.00 43.00 H new ATOM 0 HB3 SER A 54 9.593 10.152 -18.132 1.00 43.00 H new ATOM 0 HG SER A 54 9.630 10.450 -20.432 1.00 43.44 H new ATOM 864 N GLU A 55 8.183 6.950 -19.825 1.00 45.52 N ATOM 865 CA GLU A 55 7.736 6.083 -20.911 1.00 31.23 C ATOM 866 C GLU A 55 6.574 5.203 -20.460 1.00 45.32 C ATOM 867 O GLU A 55 5.612 5.001 -21.198 1.00 44.31 O ATOM 868 CB GLU A 55 8.890 5.210 -21.405 1.00 34.23 C ATOM 869 CG GLU A 55 9.196 5.384 -22.883 1.00 52.32 C ATOM 870 CD GLU A 55 10.291 6.400 -23.137 1.00 33.32 C ATOM 871 OE1 GLU A 55 11.262 6.436 -22.351 1.00 4.24 O ATOM 872 OE2 GLU A 55 10.179 7.161 -24.120 1.00 75.14 O ATOM 0 H GLU A 55 9.138 6.776 -19.512 1.00 45.52 H new ATOM 0 HA GLU A 55 7.394 6.716 -21.730 1.00 31.23 H new ATOM 0 HB2 GLU A 55 9.784 5.444 -20.828 1.00 34.23 H new ATOM 0 HB3 GLU A 55 8.651 4.164 -21.213 1.00 34.23 H new ATOM 0 HG2 GLU A 55 9.492 4.423 -23.304 1.00 52.32 H new ATOM 0 HG3 GLU A 55 8.290 5.694 -23.403 1.00 52.32 H new ATOM 879 N GLY A 56 6.673 4.680 -19.241 1.00 72.44 N ATOM 880 CA GLY A 56 5.626 3.827 -18.713 1.00 4.33 C ATOM 881 C GLY A 56 4.305 4.556 -18.559 1.00 61.34 C ATOM 882 O GLY A 56 3.251 4.029 -18.921 1.00 35.55 O ATOM 0 H GLY A 56 7.460 4.832 -18.610 1.00 72.44 H new ATOM 0 HA2 GLY A 56 5.490 2.972 -19.375 1.00 4.33 H new ATOM 0 HA3 GLY A 56 5.936 3.434 -17.744 1.00 4.33 H new ATOM 886 N CYS A 57 4.361 5.770 -18.023 1.00 2.52 N ATOM 887 CA CYS A 57 3.159 6.572 -17.821 1.00 30.24 C ATOM 888 C CYS A 57 2.471 6.864 -19.150 1.00 62.42 C ATOM 889 O CYS A 57 1.324 6.471 -19.367 1.00 12.22 O ATOM 890 CB CYS A 57 3.509 7.882 -17.114 1.00 63.12 C ATOM 891 SG CYS A 57 3.141 7.887 -15.344 1.00 34.14 S ATOM 0 H CYS A 57 5.225 6.220 -17.721 1.00 2.52 H new ATOM 0 HA CYS A 57 2.472 6.002 -17.195 1.00 30.24 H new ATOM 0 HB2 CYS A 57 4.571 8.085 -17.254 1.00 63.12 H new ATOM 0 HB3 CYS A 57 2.963 8.696 -17.590 1.00 63.12 H new ATOM 0 HG CYS A 57 3.272 9.093 -14.877 1.00 34.14 H new ATOM 897 N ARG A 58 3.177 7.559 -20.036 1.00 32.52 N ATOM 898 CA ARG A 58 2.633 7.907 -21.343 1.00 20.53 C ATOM 899 C ARG A 58 1.932 6.710 -21.976 1.00 44.13 C ATOM 900 O ARG A 58 0.892 6.856 -22.618 1.00 62.15 O ATOM 901 CB ARG A 58 3.746 8.407 -22.266 1.00 33.04 C ATOM 902 CG ARG A 58 3.246 9.274 -23.409 1.00 64.21 C ATOM 903 CD ARG A 58 3.841 8.839 -24.740 1.00 4.15 C ATOM 904 NE ARG A 58 3.668 9.855 -25.775 1.00 14.44 N ATOM 905 CZ ARG A 58 3.866 9.627 -27.068 1.00 53.23 C ATOM 906 NH1 ARG A 58 4.241 8.424 -27.483 1.00 62.20 N ATOM 907 NH2 ARG A 58 3.688 10.602 -27.950 1.00 40.02 N ATOM 0 H ARG A 58 4.127 7.892 -19.872 1.00 32.52 H new ATOM 0 HA ARG A 58 1.901 8.703 -21.204 1.00 20.53 H new ATOM 0 HB2 ARG A 58 4.466 8.976 -21.678 1.00 33.04 H new ATOM 0 HB3 ARG A 58 4.278 7.549 -22.678 1.00 33.04 H new ATOM 0 HG2 ARG A 58 2.159 9.219 -23.460 1.00 64.21 H new ATOM 0 HG3 ARG A 58 3.504 10.315 -23.217 1.00 64.21 H new ATOM 0 HD2 ARG A 58 4.903 8.630 -24.611 1.00 4.15 H new ATOM 0 HD3 ARG A 58 3.370 7.910 -25.061 1.00 4.15 H new ATOM 0 HE ARG A 58 3.379 10.791 -25.489 1.00 14.44 H new ATOM 0 HH11 ARG A 58 4.378 7.671 -26.808 1.00 62.20 H new ATOM 0 HH12 ARG A 58 4.392 8.252 -28.477 1.00 62.20 H new ATOM 0 HH21 ARG A 58 3.399 11.528 -27.635 1.00 40.02 H new ATOM 0 HH22 ARG A 58 3.840 10.426 -28.943 1.00 40.02 H new ATOM 921 N GLN A 59 2.508 5.527 -21.792 1.00 54.31 N ATOM 922 CA GLN A 59 1.939 4.304 -22.346 1.00 72.31 C ATOM 923 C GLN A 59 0.735 3.846 -21.530 1.00 52.14 C ATOM 924 O GLN A 59 -0.274 3.411 -22.086 1.00 33.00 O ATOM 925 CB GLN A 59 2.995 3.198 -22.387 1.00 5.32 C ATOM 926 CG GLN A 59 4.040 3.394 -23.474 1.00 41.41 C ATOM 927 CD GLN A 59 3.464 3.253 -24.870 1.00 14.35 C ATOM 928 OE1 GLN A 59 3.356 4.231 -25.609 1.00 45.44 O ATOM 929 NE2 GLN A 59 3.091 2.033 -25.236 1.00 25.01 N ATOM 0 H GLN A 59 3.369 5.389 -21.263 1.00 54.31 H new ATOM 0 HA GLN A 59 1.606 4.515 -23.362 1.00 72.31 H new ATOM 0 HB2 GLN A 59 3.494 3.148 -21.419 1.00 5.32 H new ATOM 0 HB3 GLN A 59 2.499 2.239 -22.540 1.00 5.32 H new ATOM 0 HG2 GLN A 59 4.488 4.382 -23.368 1.00 41.41 H new ATOM 0 HG3 GLN A 59 4.840 2.665 -23.340 1.00 41.41 H new ATOM 0 HE21 GLN A 59 3.199 1.251 -24.590 1.00 25.01 H new ATOM 0 HE22 GLN A 59 2.696 1.877 -26.163 1.00 25.01 H new ATOM 938 N ILE A 60 0.849 3.944 -20.210 1.00 75.25 N ATOM 939 CA ILE A 60 -0.231 3.540 -19.319 1.00 15.15 C ATOM 940 C ILE A 60 -1.486 4.368 -19.566 1.00 24.34 C ATOM 941 O ILE A 60 -2.601 3.844 -19.555 1.00 63.23 O ATOM 942 CB ILE A 60 0.179 3.678 -17.840 1.00 41.52 C ATOM 943 CG1 ILE A 60 1.188 2.590 -17.464 1.00 44.42 C ATOM 944 CG2 ILE A 60 -1.047 3.604 -16.942 1.00 70.11 C ATOM 945 CD1 ILE A 60 2.101 2.980 -16.323 1.00 44.14 C ATOM 0 H ILE A 60 1.678 4.300 -19.734 1.00 75.25 H new ATOM 0 HA ILE A 60 -0.442 2.492 -19.533 1.00 15.15 H new ATOM 0 HB ILE A 60 0.651 4.650 -17.698 1.00 41.52 H new ATOM 0 HG12 ILE A 60 0.648 1.683 -17.192 1.00 44.42 H new ATOM 0 HG13 ILE A 60 1.794 2.350 -18.338 1.00 44.42 H new ATOM 0 HG21 ILE A 60 -0.742 3.703 -15.900 1.00 70.11 H new ATOM 0 HG22 ILE A 60 -1.734 4.411 -17.197 1.00 70.11 H new ATOM 0 HG23 ILE A 60 -1.545 2.645 -17.084 1.00 70.11 H new ATOM 0 HD11 ILE A 60 2.789 2.161 -16.111 1.00 44.14 H new ATOM 0 HD12 ILE A 60 2.669 3.869 -16.599 1.00 44.14 H new ATOM 0 HD13 ILE A 60 1.504 3.191 -15.436 1.00 44.14 H new ATOM 957 N LEU A 61 -1.300 5.664 -19.788 1.00 71.42 N ATOM 958 CA LEU A 61 -2.418 6.567 -20.040 1.00 54.30 C ATOM 959 C LEU A 61 -3.084 6.249 -21.375 1.00 4.21 C ATOM 960 O LEU A 61 -4.239 6.605 -21.605 1.00 30.41 O ATOM 961 CB LEU A 61 -1.939 8.019 -20.029 1.00 65.43 C ATOM 962 CG LEU A 61 -1.433 8.550 -18.687 1.00 55.12 C ATOM 963 CD1 LEU A 61 -0.295 9.537 -18.898 1.00 45.12 C ATOM 964 CD2 LEU A 61 -2.566 9.198 -17.908 1.00 21.14 C ATOM 0 H LEU A 61 -0.385 6.114 -19.799 1.00 71.42 H new ATOM 0 HA LEU A 61 -3.152 6.427 -19.246 1.00 54.30 H new ATOM 0 HB2 LEU A 61 -1.139 8.122 -20.762 1.00 65.43 H new ATOM 0 HB3 LEU A 61 -2.760 8.654 -20.362 1.00 65.43 H new ATOM 0 HG LEU A 61 -1.054 7.710 -18.105 1.00 55.12 H new ATOM 0 HD11 LEU A 61 0.052 9.904 -17.932 1.00 45.12 H new ATOM 0 HD12 LEU A 61 0.527 9.040 -19.414 1.00 45.12 H new ATOM 0 HD13 LEU A 61 -0.647 10.375 -19.499 1.00 45.12 H new ATOM 0 HD21 LEU A 61 -2.187 9.570 -16.956 1.00 21.14 H new ATOM 0 HD22 LEU A 61 -2.976 10.027 -18.484 1.00 21.14 H new ATOM 0 HD23 LEU A 61 -3.349 8.462 -17.724 1.00 21.14 H new ATOM 976 N GLY A 62 -2.347 5.574 -22.252 1.00 64.33 N ATOM 977 CA GLY A 62 -2.885 5.217 -23.552 1.00 72.51 C ATOM 978 C GLY A 62 -3.939 4.132 -23.466 1.00 64.03 C ATOM 979 O GLY A 62 -4.749 3.971 -24.380 1.00 31.41 O ATOM 0 H GLY A 62 -1.388 5.268 -22.086 1.00 64.33 H new ATOM 0 HA2 GLY A 62 -3.317 6.102 -24.018 1.00 72.51 H new ATOM 0 HA3 GLY A 62 -2.074 4.880 -24.197 1.00 72.51 H new ATOM 983 N GLN A 63 -3.929 3.385 -22.367 1.00 64.21 N ATOM 984 CA GLN A 63 -4.892 2.308 -22.168 1.00 21.02 C ATOM 985 C GLN A 63 -6.185 2.840 -21.558 1.00 2.04 C ATOM 986 O GLN A 63 -7.279 2.533 -22.032 1.00 43.25 O ATOM 987 CB GLN A 63 -4.296 1.225 -21.266 1.00 25.11 C ATOM 988 CG GLN A 63 -3.885 -0.032 -22.015 1.00 53.15 C ATOM 989 CD GLN A 63 -3.924 -1.271 -21.143 1.00 62.15 C ATOM 990 OE1 GLN A 63 -4.628 -2.235 -21.446 1.00 2.42 O ATOM 991 NE2 GLN A 63 -3.166 -1.252 -20.053 1.00 43.54 N ATOM 0 H GLN A 63 -3.266 3.505 -21.602 1.00 64.21 H new ATOM 0 HA GLN A 63 -5.123 1.875 -23.141 1.00 21.02 H new ATOM 0 HB2 GLN A 63 -3.426 1.632 -20.750 1.00 25.11 H new ATOM 0 HB3 GLN A 63 -5.025 0.960 -20.500 1.00 25.11 H new ATOM 0 HG2 GLN A 63 -4.546 -0.173 -22.870 1.00 53.15 H new ATOM 0 HG3 GLN A 63 -2.877 0.098 -22.410 1.00 53.15 H new ATOM 0 HE21 GLN A 63 -2.598 -0.432 -19.841 1.00 43.54 H new ATOM 0 HE22 GLN A 63 -3.151 -2.058 -19.428 1.00 43.54 H new ATOM 1000 N LEU A 64 -6.052 3.638 -20.505 1.00 11.43 N ATOM 1001 CA LEU A 64 -7.210 4.213 -19.829 1.00 40.30 C ATOM 1002 C LEU A 64 -7.838 5.319 -20.670 1.00 35.34 C ATOM 1003 O LEU A 64 -9.043 5.557 -20.601 1.00 22.35 O ATOM 1004 CB LEU A 64 -6.806 4.764 -18.460 1.00 12.30 C ATOM 1005 CG LEU A 64 -5.861 3.888 -17.637 1.00 12.15 C ATOM 1006 CD1 LEU A 64 -5.421 4.615 -16.376 1.00 60.41 C ATOM 1007 CD2 LEU A 64 -6.528 2.565 -17.286 1.00 62.42 C ATOM 0 H LEU A 64 -5.154 3.902 -20.100 1.00 11.43 H new ATOM 0 HA LEU A 64 -7.948 3.423 -19.692 1.00 40.30 H new ATOM 0 HB2 LEU A 64 -6.334 5.735 -18.606 1.00 12.30 H new ATOM 0 HB3 LEU A 64 -7.711 4.934 -17.877 1.00 12.30 H new ATOM 0 HG LEU A 64 -4.977 3.678 -18.239 1.00 12.15 H new ATOM 0 HD11 LEU A 64 -4.749 3.976 -15.803 1.00 60.41 H new ATOM 0 HD12 LEU A 64 -4.903 5.535 -16.648 1.00 60.41 H new ATOM 0 HD13 LEU A 64 -6.295 4.856 -15.771 1.00 60.41 H new ATOM 0 HD21 LEU A 64 -5.840 1.955 -16.700 1.00 62.42 H new ATOM 0 HD22 LEU A 64 -7.430 2.755 -16.704 1.00 62.42 H new ATOM 0 HD23 LEU A 64 -6.792 2.036 -18.202 1.00 62.42 H new ATOM 1019 N GLN A 65 -7.012 5.992 -21.465 1.00 55.44 N ATOM 1020 CA GLN A 65 -7.487 7.072 -22.322 1.00 34.41 C ATOM 1021 C GLN A 65 -8.790 6.686 -23.013 1.00 72.24 C ATOM 1022 O GLN A 65 -9.828 7.323 -22.834 1.00 65.25 O ATOM 1023 CB GLN A 65 -6.427 7.428 -23.365 1.00 53.32 C ATOM 1024 CG GLN A 65 -5.734 8.754 -23.101 1.00 55.45 C ATOM 1025 CD GLN A 65 -4.678 9.079 -24.141 1.00 2.44 C ATOM 1026 OE1 GLN A 65 -4.307 8.229 -24.952 1.00 2.24 O ATOM 1027 NE2 GLN A 65 -4.189 10.313 -24.124 1.00 44.00 N ATOM 0 H GLN A 65 -6.011 5.808 -21.533 1.00 55.44 H new ATOM 0 HA GLN A 65 -7.675 7.943 -21.695 1.00 34.41 H new ATOM 0 HB2 GLN A 65 -5.679 6.636 -23.395 1.00 53.32 H new ATOM 0 HB3 GLN A 65 -6.895 7.462 -24.349 1.00 53.32 H new ATOM 0 HG2 GLN A 65 -6.478 9.551 -23.083 1.00 55.45 H new ATOM 0 HG3 GLN A 65 -5.271 8.727 -22.115 1.00 55.45 H new ATOM 0 HE21 GLN A 65 -4.525 10.985 -23.434 1.00 44.00 H new ATOM 0 HE22 GLN A 65 -3.477 10.589 -24.801 1.00 44.00 H new ATOM 1036 N PRO A 66 -8.736 5.618 -23.824 1.00 23.35 N ATOM 1037 CA PRO A 66 -9.904 5.123 -24.558 1.00 22.21 C ATOM 1038 C PRO A 66 -10.945 4.495 -23.638 1.00 22.30 C ATOM 1039 O PRO A 66 -12.040 4.141 -24.074 1.00 44.43 O ATOM 1040 CB PRO A 66 -9.312 4.067 -25.495 1.00 40.31 C ATOM 1041 CG PRO A 66 -8.068 3.611 -24.813 1.00 33.31 C ATOM 1042 CD PRO A 66 -7.532 4.812 -24.083 1.00 1.32 C ATOM 0 HA PRO A 66 -10.430 5.926 -25.075 1.00 22.21 H new ATOM 0 HB2 PRO A 66 -10.005 3.240 -25.648 1.00 40.31 H new ATOM 0 HB3 PRO A 66 -9.094 4.486 -26.477 1.00 40.31 H new ATOM 0 HG2 PRO A 66 -8.279 2.796 -24.121 1.00 33.31 H new ATOM 0 HG3 PRO A 66 -7.342 3.237 -25.535 1.00 33.31 H new ATOM 0 HD2 PRO A 66 -7.031 4.529 -23.157 1.00 1.32 H new ATOM 0 HD3 PRO A 66 -6.805 5.357 -24.685 1.00 1.32 H new ATOM 1050 N SER A 67 -10.597 4.362 -22.362 1.00 71.32 N ATOM 1051 CA SER A 67 -11.500 3.774 -21.381 1.00 4.12 C ATOM 1052 C SER A 67 -12.154 4.856 -20.527 1.00 33.52 C ATOM 1053 O SER A 67 -13.124 4.599 -19.813 1.00 24.24 O ATOM 1054 CB SER A 67 -10.745 2.789 -20.486 1.00 3.14 C ATOM 1055 OG SER A 67 -10.162 1.748 -21.251 1.00 34.21 O ATOM 0 H SER A 67 -9.696 4.654 -21.984 1.00 71.32 H new ATOM 0 HA SER A 67 -12.282 3.238 -21.920 1.00 4.12 H new ATOM 0 HB2 SER A 67 -9.968 3.317 -19.933 1.00 3.14 H new ATOM 0 HB3 SER A 67 -11.428 2.365 -19.750 1.00 3.14 H new ATOM 0 HG SER A 67 -9.253 2.005 -21.514 1.00 34.21 H new ATOM 1061 N LEU A 68 -11.614 6.068 -20.605 1.00 65.10 N ATOM 1062 CA LEU A 68 -12.144 7.191 -19.839 1.00 61.23 C ATOM 1063 C LEU A 68 -13.639 7.364 -20.089 1.00 3.23 C ATOM 1064 O LEU A 68 -14.350 7.948 -19.273 1.00 21.41 O ATOM 1065 CB LEU A 68 -11.403 8.478 -20.206 1.00 31.35 C ATOM 1066 CG LEU A 68 -10.093 8.734 -19.459 1.00 12.22 C ATOM 1067 CD1 LEU A 68 -9.143 9.558 -20.313 1.00 61.13 C ATOM 1068 CD2 LEU A 68 -10.363 9.432 -18.133 1.00 11.30 C ATOM 0 H LEU A 68 -10.811 6.298 -21.190 1.00 65.10 H new ATOM 0 HA LEU A 68 -11.993 6.980 -18.780 1.00 61.23 H new ATOM 0 HB2 LEU A 68 -11.191 8.459 -21.275 1.00 31.35 H new ATOM 0 HB3 LEU A 68 -12.070 9.321 -20.028 1.00 31.35 H new ATOM 0 HG LEU A 68 -9.622 7.773 -19.252 1.00 12.22 H new ATOM 0 HD11 LEU A 68 -8.217 9.730 -19.765 1.00 61.13 H new ATOM 0 HD12 LEU A 68 -8.924 9.021 -21.236 1.00 61.13 H new ATOM 0 HD13 LEU A 68 -9.606 10.515 -20.552 1.00 61.13 H new ATOM 0 HD21 LEU A 68 -9.420 9.606 -17.615 1.00 11.30 H new ATOM 0 HD22 LEU A 68 -10.857 10.386 -18.318 1.00 11.30 H new ATOM 0 HD23 LEU A 68 -11.006 8.804 -17.516 1.00 11.30 H new ATOM 1080 N GLN A 69 -14.108 6.850 -21.221 1.00 71.12 N ATOM 1081 CA GLN A 69 -15.519 6.946 -21.577 1.00 52.03 C ATOM 1082 C GLN A 69 -16.263 5.668 -21.206 1.00 14.41 C ATOM 1083 O GLN A 69 -17.375 5.714 -20.680 1.00 40.31 O ATOM 1084 CB GLN A 69 -15.672 7.223 -23.073 1.00 74.24 C ATOM 1085 CG GLN A 69 -17.111 7.448 -23.507 1.00 22.44 C ATOM 1086 CD GLN A 69 -17.541 6.508 -24.615 1.00 41.32 C ATOM 1087 OE1 GLN A 69 -17.608 5.293 -24.423 1.00 10.13 O ATOM 1088 NE2 GLN A 69 -17.838 7.065 -25.784 1.00 14.11 N ATOM 0 H GLN A 69 -13.532 6.363 -21.907 1.00 71.12 H new ATOM 0 HA GLN A 69 -15.953 7.773 -21.015 1.00 52.03 H new ATOM 0 HB2 GLN A 69 -15.081 8.101 -23.333 1.00 74.24 H new ATOM 0 HB3 GLN A 69 -15.259 6.384 -23.633 1.00 74.24 H new ATOM 0 HG2 GLN A 69 -17.770 7.317 -22.649 1.00 22.44 H new ATOM 0 HG3 GLN A 69 -17.228 8.478 -23.844 1.00 22.44 H new ATOM 0 HE21 GLN A 69 -17.769 8.076 -25.899 1.00 14.11 H new ATOM 0 HE22 GLN A 69 -18.135 6.482 -26.566 1.00 14.11 H new ATOM 1097 N THR A 70 -15.641 4.526 -21.484 1.00 14.23 N ATOM 1098 CA THR A 70 -16.244 3.233 -21.181 1.00 30.45 C ATOM 1099 C THR A 70 -16.209 2.948 -19.684 1.00 32.21 C ATOM 1100 O THR A 70 -16.788 1.969 -19.214 1.00 73.24 O ATOM 1101 CB THR A 70 -15.530 2.091 -21.927 1.00 12.15 C ATOM 1102 OG1 THR A 70 -14.829 2.611 -23.062 1.00 15.14 O ATOM 1103 CG2 THR A 70 -16.527 1.035 -22.381 1.00 35.05 C ATOM 0 H THR A 70 -14.720 4.470 -21.919 1.00 14.23 H new ATOM 0 HA THR A 70 -17.281 3.282 -21.515 1.00 30.45 H new ATOM 0 HB THR A 70 -14.820 1.627 -21.242 1.00 12.15 H new ATOM 0 HG1 THR A 70 -14.376 1.879 -23.530 1.00 15.14 H new ATOM 0 HG21 THR A 70 -16.000 0.238 -22.906 1.00 35.05 H new ATOM 0 HG22 THR A 70 -17.039 0.621 -21.512 1.00 35.05 H new ATOM 0 HG23 THR A 70 -17.258 1.489 -23.051 1.00 35.05 H new ATOM 1111 N GLY A 71 -15.524 3.809 -18.937 1.00 23.54 N ATOM 1112 CA GLY A 71 -15.426 3.632 -17.500 1.00 51.51 C ATOM 1113 C GLY A 71 -16.108 4.745 -16.731 1.00 21.34 C ATOM 1114 O GLY A 71 -16.412 5.799 -17.288 1.00 61.24 O ATOM 0 H GLY A 71 -15.035 4.626 -19.302 1.00 23.54 H new ATOM 0 HA2 GLY A 71 -15.873 2.677 -17.223 1.00 51.51 H new ATOM 0 HA3 GLY A 71 -14.375 3.587 -17.213 1.00 51.51 H new ATOM 1118 N SER A 72 -16.352 4.511 -15.445 1.00 2.22 N ATOM 1119 CA SER A 72 -17.008 5.501 -14.599 1.00 3.22 C ATOM 1120 C SER A 72 -15.994 6.489 -14.032 1.00 21.31 C ATOM 1121 O SER A 72 -14.873 6.595 -14.526 1.00 75.15 O ATOM 1122 CB SER A 72 -17.757 4.810 -13.457 1.00 43.52 C ATOM 1123 OG SER A 72 -16.884 4.515 -12.380 1.00 23.11 O ATOM 0 H SER A 72 -16.105 3.645 -14.967 1.00 2.22 H new ATOM 0 HA SER A 72 -17.721 6.051 -15.212 1.00 3.22 H new ATOM 0 HB2 SER A 72 -18.566 5.451 -13.108 1.00 43.52 H new ATOM 0 HB3 SER A 72 -18.214 3.890 -13.822 1.00 43.52 H new ATOM 0 HG SER A 72 -17.032 3.593 -12.082 1.00 23.11 H new ATOM 1129 N GLU A 73 -16.398 7.211 -12.992 1.00 2.32 N ATOM 1130 CA GLU A 73 -15.525 8.193 -12.358 1.00 42.43 C ATOM 1131 C GLU A 73 -14.348 7.508 -11.669 1.00 60.33 C ATOM 1132 O GLU A 73 -13.339 8.143 -11.366 1.00 34.35 O ATOM 1133 CB GLU A 73 -16.309 9.026 -11.343 1.00 63.54 C ATOM 1134 CG GLU A 73 -16.321 10.513 -11.656 1.00 14.40 C ATOM 1135 CD GLU A 73 -15.427 11.311 -10.726 1.00 61.53 C ATOM 1136 OE1 GLU A 73 -15.580 11.173 -9.494 1.00 74.33 O ATOM 1137 OE2 GLU A 73 -14.576 12.073 -11.230 1.00 24.34 O ATOM 0 H GLU A 73 -17.324 7.135 -12.570 1.00 2.32 H new ATOM 0 HA GLU A 73 -15.137 8.852 -13.135 1.00 42.43 H new ATOM 0 HB2 GLU A 73 -17.336 8.663 -11.304 1.00 63.54 H new ATOM 0 HB3 GLU A 73 -15.880 8.875 -10.353 1.00 63.54 H new ATOM 0 HG2 GLU A 73 -15.998 10.667 -12.686 1.00 14.40 H new ATOM 0 HG3 GLU A 73 -17.342 10.888 -11.583 1.00 14.40 H new ATOM 1144 N GLU A 74 -14.485 6.209 -11.425 1.00 5.42 N ATOM 1145 CA GLU A 74 -13.435 5.439 -10.771 1.00 15.22 C ATOM 1146 C GLU A 74 -12.141 5.487 -11.579 1.00 30.01 C ATOM 1147 O GLU A 74 -11.045 5.513 -11.018 1.00 62.43 O ATOM 1148 CB GLU A 74 -13.877 3.986 -10.583 1.00 4.11 C ATOM 1149 CG GLU A 74 -14.822 3.785 -9.410 1.00 5.34 C ATOM 1150 CD GLU A 74 -15.733 2.586 -9.593 1.00 64.23 C ATOM 1151 OE1 GLU A 74 -16.307 2.441 -10.694 1.00 32.02 O ATOM 1152 OE2 GLU A 74 -15.872 1.794 -8.638 1.00 74.23 O ATOM 0 H GLU A 74 -15.314 5.668 -11.671 1.00 5.42 H new ATOM 0 HA GLU A 74 -13.250 5.884 -9.793 1.00 15.22 H new ATOM 0 HB2 GLU A 74 -14.365 3.642 -11.495 1.00 4.11 H new ATOM 0 HB3 GLU A 74 -12.995 3.362 -10.439 1.00 4.11 H new ATOM 0 HG2 GLU A 74 -14.240 3.658 -8.497 1.00 5.34 H new ATOM 0 HG3 GLU A 74 -15.429 4.681 -9.279 1.00 5.34 H new ATOM 1159 N LEU A 75 -12.277 5.497 -12.901 1.00 32.32 N ATOM 1160 CA LEU A 75 -11.120 5.542 -13.788 1.00 72.12 C ATOM 1161 C LEU A 75 -10.647 6.977 -13.995 1.00 42.31 C ATOM 1162 O LEU A 75 -9.509 7.214 -14.398 1.00 33.11 O ATOM 1163 CB LEU A 75 -11.462 4.906 -15.137 1.00 44.40 C ATOM 1164 CG LEU A 75 -10.288 4.682 -16.091 1.00 21.53 C ATOM 1165 CD1 LEU A 75 -9.929 3.207 -16.161 1.00 24.00 C ATOM 1166 CD2 LEU A 75 -10.619 5.219 -17.476 1.00 75.52 C ATOM 0 H LEU A 75 -13.176 5.475 -13.382 1.00 32.32 H new ATOM 0 HA LEU A 75 -10.313 4.977 -13.321 1.00 72.12 H new ATOM 0 HB2 LEU A 75 -11.942 3.945 -14.952 1.00 44.40 H new ATOM 0 HB3 LEU A 75 -12.196 5.537 -15.638 1.00 44.40 H new ATOM 0 HG LEU A 75 -9.424 5.225 -15.708 1.00 21.53 H new ATOM 0 HD11 LEU A 75 -9.092 3.068 -16.845 1.00 24.00 H new ATOM 0 HD12 LEU A 75 -9.650 2.853 -15.169 1.00 24.00 H new ATOM 0 HD13 LEU A 75 -10.788 2.640 -16.520 1.00 24.00 H new ATOM 0 HD21 LEU A 75 -9.773 5.052 -18.143 1.00 75.52 H new ATOM 0 HD22 LEU A 75 -11.496 4.703 -17.866 1.00 75.52 H new ATOM 0 HD23 LEU A 75 -10.825 6.287 -17.412 1.00 75.52 H new ATOM 1178 N ARG A 76 -11.529 7.931 -13.716 1.00 44.11 N ATOM 1179 CA ARG A 76 -11.203 9.343 -13.870 1.00 53.03 C ATOM 1180 C ARG A 76 -10.120 9.762 -12.881 1.00 21.15 C ATOM 1181 O ARG A 76 -9.168 10.453 -13.242 1.00 33.11 O ATOM 1182 CB ARG A 76 -12.452 10.203 -13.671 1.00 32.11 C ATOM 1183 CG ARG A 76 -12.666 11.231 -14.770 1.00 64.24 C ATOM 1184 CD ARG A 76 -13.936 12.035 -14.541 1.00 31.11 C ATOM 1185 NE ARG A 76 -15.100 11.410 -15.163 1.00 62.32 N ATOM 1186 CZ ARG A 76 -15.286 11.350 -16.477 1.00 23.44 C ATOM 1187 NH1 ARG A 76 -14.390 11.874 -17.302 1.00 45.22 N ATOM 1188 NH2 ARG A 76 -16.371 10.765 -16.968 1.00 5.45 N ATOM 0 H ARG A 76 -12.476 7.751 -13.382 1.00 44.11 H new ATOM 0 HA ARG A 76 -10.825 9.494 -14.881 1.00 53.03 H new ATOM 0 HB2 ARG A 76 -13.325 9.553 -13.618 1.00 32.11 H new ATOM 0 HB3 ARG A 76 -12.379 10.718 -12.713 1.00 32.11 H new ATOM 0 HG2 ARG A 76 -11.810 11.905 -14.811 1.00 64.24 H new ATOM 0 HG3 ARG A 76 -12.722 10.727 -15.735 1.00 64.24 H new ATOM 0 HD2 ARG A 76 -14.110 12.140 -13.470 1.00 31.11 H new ATOM 0 HD3 ARG A 76 -13.806 13.040 -14.943 1.00 31.11 H new ATOM 0 HE ARG A 76 -15.808 10.997 -14.556 1.00 62.32 H new ATOM 0 HH11 ARG A 76 -13.555 12.325 -16.928 1.00 45.22 H new ATOM 0 HH12 ARG A 76 -14.536 11.826 -18.310 1.00 45.22 H new ATOM 0 HH21 ARG A 76 -17.063 10.361 -16.336 1.00 5.45 H new ATOM 0 HH22 ARG A 76 -16.513 10.719 -17.977 1.00 5.45 H new ATOM 1202 N SER A 77 -10.273 9.340 -11.630 1.00 3.12 N ATOM 1203 CA SER A 77 -9.312 9.675 -10.585 1.00 52.45 C ATOM 1204 C SER A 77 -7.910 9.207 -10.968 1.00 63.32 C ATOM 1205 O SER A 77 -6.920 9.885 -10.692 1.00 31.13 O ATOM 1206 CB SER A 77 -9.728 9.041 -9.257 1.00 52.32 C ATOM 1207 OG SER A 77 -10.583 9.902 -8.527 1.00 34.35 O ATOM 0 H SER A 77 -11.054 8.765 -11.315 1.00 3.12 H new ATOM 0 HA SER A 77 -9.298 10.759 -10.472 1.00 52.45 H new ATOM 0 HB2 SER A 77 -10.235 8.094 -9.445 1.00 52.32 H new ATOM 0 HB3 SER A 77 -8.841 8.816 -8.664 1.00 52.32 H new ATOM 0 HG SER A 77 -10.836 9.473 -7.683 1.00 34.35 H new ATOM 1213 N LEU A 78 -7.835 8.045 -11.607 1.00 14.33 N ATOM 1214 CA LEU A 78 -6.555 7.485 -12.028 1.00 64.14 C ATOM 1215 C LEU A 78 -5.899 8.364 -13.087 1.00 23.41 C ATOM 1216 O LEU A 78 -4.762 8.807 -12.924 1.00 14.25 O ATOM 1217 CB LEU A 78 -6.751 6.069 -12.574 1.00 33.41 C ATOM 1218 CG LEU A 78 -6.261 4.931 -11.678 1.00 61.11 C ATOM 1219 CD1 LEU A 78 -4.809 5.150 -11.283 1.00 1.43 C ATOM 1220 CD2 LEU A 78 -7.139 4.809 -10.441 1.00 44.04 C ATOM 0 H LEU A 78 -8.645 7.472 -11.845 1.00 14.33 H new ATOM 0 HA LEU A 78 -5.899 7.445 -11.158 1.00 64.14 H new ATOM 0 HB2 LEU A 78 -7.813 5.920 -12.769 1.00 33.41 H new ATOM 0 HB3 LEU A 78 -6.238 5.997 -13.533 1.00 33.41 H new ATOM 0 HG LEU A 78 -6.327 3.999 -12.239 1.00 61.11 H new ATOM 0 HD11 LEU A 78 -4.478 4.330 -10.646 1.00 1.43 H new ATOM 0 HD12 LEU A 78 -4.190 5.186 -12.179 1.00 1.43 H new ATOM 0 HD13 LEU A 78 -4.717 6.091 -10.741 1.00 1.43 H new ATOM 0 HD21 LEU A 78 -6.775 3.994 -9.815 1.00 44.04 H new ATOM 0 HD22 LEU A 78 -7.106 5.742 -9.878 1.00 44.04 H new ATOM 0 HD23 LEU A 78 -8.166 4.604 -10.743 1.00 44.04 H new ATOM 1232 N TYR A 79 -6.624 8.615 -14.172 1.00 34.14 N ATOM 1233 CA TYR A 79 -6.111 9.443 -15.259 1.00 2.43 C ATOM 1234 C TYR A 79 -5.604 10.781 -14.732 1.00 23.12 C ATOM 1235 O TYR A 79 -4.473 11.181 -15.005 1.00 2.54 O ATOM 1236 CB TYR A 79 -7.200 9.674 -16.307 1.00 61.33 C ATOM 1237 CG TYR A 79 -6.658 10.033 -17.673 1.00 13.32 C ATOM 1238 CD1 TYR A 79 -5.892 9.129 -18.398 1.00 42.13 C ATOM 1239 CD2 TYR A 79 -6.911 11.277 -18.237 1.00 41.52 C ATOM 1240 CE1 TYR A 79 -5.394 9.452 -19.645 1.00 31.43 C ATOM 1241 CE2 TYR A 79 -6.419 11.609 -19.485 1.00 43.11 C ATOM 1242 CZ TYR A 79 -5.661 10.694 -20.184 1.00 44.43 C ATOM 1243 OH TYR A 79 -5.168 11.021 -21.426 1.00 61.42 O ATOM 0 H TYR A 79 -7.567 8.258 -14.323 1.00 34.14 H new ATOM 0 HA TYR A 79 -5.276 8.916 -15.721 1.00 2.43 H new ATOM 0 HB2 TYR A 79 -7.808 8.773 -16.392 1.00 61.33 H new ATOM 0 HB3 TYR A 79 -7.858 10.472 -15.965 1.00 61.33 H new ATOM 0 HD1 TYR A 79 -5.682 8.156 -17.979 1.00 42.13 H new ATOM 0 HD2 TYR A 79 -7.502 11.997 -17.691 1.00 41.52 H new ATOM 0 HE1 TYR A 79 -4.800 8.737 -20.195 1.00 31.43 H new ATOM 0 HE2 TYR A 79 -6.627 12.580 -19.910 1.00 43.11 H new ATOM 0 HH TYR A 79 -5.447 11.931 -21.660 1.00 61.42 H new ATOM 1253 N ASN A 80 -6.451 11.470 -13.973 1.00 20.04 N ATOM 1254 CA ASN A 80 -6.090 12.765 -13.406 1.00 75.13 C ATOM 1255 C ASN A 80 -4.763 12.680 -12.656 1.00 44.42 C ATOM 1256 O ASN A 80 -3.818 13.408 -12.959 1.00 24.32 O ATOM 1257 CB ASN A 80 -7.190 13.257 -12.465 1.00 71.40 C ATOM 1258 CG ASN A 80 -8.175 14.179 -13.160 1.00 43.32 C ATOM 1259 OD1 ASN A 80 -8.321 15.391 -12.638 1.00 65.05 O flip ATOM 1260 ND2 ASN A 80 -8.797 13.804 -14.154 1.00 13.52 N flip ATOM 0 H ASN A 80 -7.391 11.153 -13.737 1.00 20.04 H new ATOM 0 HA ASN A 80 -5.978 13.475 -14.226 1.00 75.13 H new ATOM 0 HB2 ASN A 80 -7.725 12.400 -12.056 1.00 71.40 H new ATOM 0 HB3 ASN A 80 -6.737 13.781 -11.623 1.00 71.40 H new ATOM 0 HD21 ASN A 80 -8.653 12.863 -14.521 1.00 13.52 H new ATOM 0 HD22 ASN A 80 -9.456 14.434 -14.611 1.00 13.52 H new ATOM 1267 N THR A 81 -4.702 11.784 -11.676 1.00 51.30 N ATOM 1268 CA THR A 81 -3.493 11.603 -10.881 1.00 51.33 C ATOM 1269 C THR A 81 -2.303 11.247 -11.765 1.00 34.21 C ATOM 1270 O THR A 81 -1.305 11.968 -11.798 1.00 73.14 O ATOM 1271 CB THR A 81 -3.678 10.502 -9.820 1.00 53.25 C ATOM 1272 OG1 THR A 81 -4.833 10.780 -9.022 1.00 41.21 O ATOM 1273 CG2 THR A 81 -2.451 10.400 -8.927 1.00 30.15 C ATOM 0 H THR A 81 -5.475 11.173 -11.414 1.00 51.30 H new ATOM 0 HA THR A 81 -3.299 12.551 -10.379 1.00 51.33 H new ATOM 0 HB THR A 81 -3.813 9.551 -10.335 1.00 53.25 H new ATOM 0 HG1 THR A 81 -5.639 10.508 -9.508 1.00 41.21 H new ATOM 0 HG21 THR A 81 -2.605 9.616 -8.186 1.00 30.15 H new ATOM 0 HG22 THR A 81 -1.578 10.159 -9.534 1.00 30.15 H new ATOM 0 HG23 THR A 81 -2.289 11.352 -8.421 1.00 30.15 H new ATOM 1281 N ILE A 82 -2.414 10.131 -12.479 1.00 63.54 N ATOM 1282 CA ILE A 82 -1.348 9.682 -13.365 1.00 15.44 C ATOM 1283 C ILE A 82 -0.872 10.812 -14.270 1.00 71.23 C ATOM 1284 O ILE A 82 0.326 10.979 -14.495 1.00 71.25 O ATOM 1285 CB ILE A 82 -1.801 8.496 -14.236 1.00 64.53 C ATOM 1286 CG1 ILE A 82 -2.239 7.325 -13.355 1.00 14.24 C ATOM 1287 CG2 ILE A 82 -0.682 8.070 -15.175 1.00 63.43 C ATOM 1288 CD1 ILE A 82 -3.192 6.373 -14.043 1.00 71.03 C ATOM 0 H ILE A 82 -3.232 9.522 -12.461 1.00 63.54 H new ATOM 0 HA ILE A 82 -0.524 9.359 -12.728 1.00 15.44 H new ATOM 0 HB ILE A 82 -2.653 8.812 -14.838 1.00 64.53 H new ATOM 0 HG12 ILE A 82 -1.356 6.773 -13.034 1.00 14.24 H new ATOM 0 HG13 ILE A 82 -2.715 7.716 -12.456 1.00 14.24 H new ATOM 0 HG21 ILE A 82 -1.018 7.231 -15.784 1.00 63.43 H new ATOM 0 HG22 ILE A 82 -0.414 8.904 -15.823 1.00 63.43 H new ATOM 0 HG23 ILE A 82 0.188 7.770 -14.591 1.00 63.43 H new ATOM 0 HD11 ILE A 82 -3.460 5.568 -13.358 1.00 71.03 H new ATOM 0 HD12 ILE A 82 -4.092 6.911 -14.340 1.00 71.03 H new ATOM 0 HD13 ILE A 82 -2.712 5.953 -14.927 1.00 71.03 H new ATOM 1300 N ALA A 83 -1.820 11.588 -14.787 1.00 74.40 N ATOM 1301 CA ALA A 83 -1.498 12.705 -15.666 1.00 33.30 C ATOM 1302 C ALA A 83 -0.502 13.654 -15.006 1.00 1.51 C ATOM 1303 O ALA A 83 0.509 14.023 -15.603 1.00 51.33 O ATOM 1304 CB ALA A 83 -2.765 13.453 -16.054 1.00 33.30 C ATOM 0 H ALA A 83 -2.817 11.463 -14.612 1.00 74.40 H new ATOM 0 HA ALA A 83 -1.035 12.304 -16.568 1.00 33.30 H new ATOM 0 HB1 ALA A 83 -2.510 14.285 -16.711 1.00 33.30 H new ATOM 0 HB2 ALA A 83 -3.443 12.776 -16.573 1.00 33.30 H new ATOM 0 HB3 ALA A 83 -3.251 13.835 -15.156 1.00 33.30 H new ATOM 1310 N VAL A 84 -0.795 14.045 -13.770 1.00 21.33 N ATOM 1311 CA VAL A 84 0.074 14.952 -13.029 1.00 2.45 C ATOM 1312 C VAL A 84 1.476 14.369 -12.880 1.00 62.23 C ATOM 1313 O VAL A 84 2.468 15.097 -12.910 1.00 33.12 O ATOM 1314 CB VAL A 84 -0.494 15.255 -11.630 1.00 0.14 C ATOM 1315 CG1 VAL A 84 0.423 16.206 -10.876 1.00 31.44 C ATOM 1316 CG2 VAL A 84 -1.898 15.829 -11.738 1.00 2.11 C ATOM 0 H VAL A 84 -1.627 13.748 -13.261 1.00 21.33 H new ATOM 0 HA VAL A 84 0.127 15.879 -13.601 1.00 2.45 H new ATOM 0 HB VAL A 84 -0.550 14.322 -11.070 1.00 0.14 H new ATOM 0 HG11 VAL A 84 0.005 16.409 -9.890 1.00 31.44 H new ATOM 0 HG12 VAL A 84 1.408 15.752 -10.767 1.00 31.44 H new ATOM 0 HG13 VAL A 84 0.514 17.140 -11.430 1.00 31.44 H new ATOM 0 HG21 VAL A 84 -2.284 16.037 -10.740 1.00 2.11 H new ATOM 0 HG22 VAL A 84 -1.870 16.753 -12.316 1.00 2.11 H new ATOM 0 HG23 VAL A 84 -2.548 15.109 -12.235 1.00 2.11 H new ATOM 1326 N LEU A 85 1.549 13.052 -12.723 1.00 13.22 N ATOM 1327 CA LEU A 85 2.830 12.371 -12.571 1.00 3.13 C ATOM 1328 C LEU A 85 3.617 12.394 -13.877 1.00 34.13 C ATOM 1329 O LEU A 85 4.798 12.743 -13.896 1.00 34.03 O ATOM 1330 CB LEU A 85 2.610 10.925 -12.120 1.00 35.21 C ATOM 1331 CG LEU A 85 3.768 10.276 -11.361 1.00 41.50 C ATOM 1332 CD1 LEU A 85 3.433 10.149 -9.883 1.00 21.41 C ATOM 1333 CD2 LEU A 85 4.097 8.914 -11.954 1.00 14.24 C ATOM 0 H LEU A 85 0.737 12.435 -12.698 1.00 13.22 H new ATOM 0 HA LEU A 85 3.407 12.899 -11.812 1.00 3.13 H new ATOM 0 HB2 LEU A 85 1.724 10.894 -11.486 1.00 35.21 H new ATOM 0 HB3 LEU A 85 2.394 10.320 -13.000 1.00 35.21 H new ATOM 0 HG LEU A 85 4.646 10.915 -11.460 1.00 41.50 H new ATOM 0 HD11 LEU A 85 4.269 9.685 -9.359 1.00 21.41 H new ATOM 0 HD12 LEU A 85 3.247 11.139 -9.466 1.00 21.41 H new ATOM 0 HD13 LEU A 85 2.542 9.532 -9.763 1.00 21.41 H new ATOM 0 HD21 LEU A 85 4.923 8.467 -11.402 1.00 14.24 H new ATOM 0 HD22 LEU A 85 3.223 8.267 -11.886 1.00 14.24 H new ATOM 0 HD23 LEU A 85 4.381 9.031 -13.000 1.00 14.24 H new ATOM 1345 N TYR A 86 2.956 12.021 -14.967 1.00 73.13 N ATOM 1346 CA TYR A 86 3.594 11.999 -16.278 1.00 24.20 C ATOM 1347 C TYR A 86 4.252 13.341 -16.586 1.00 52.11 C ATOM 1348 O TYR A 86 5.411 13.396 -17.000 1.00 1.12 O ATOM 1349 CB TYR A 86 2.569 11.660 -17.362 1.00 1.13 C ATOM 1350 CG TYR A 86 3.063 11.923 -18.767 1.00 31.05 C ATOM 1351 CD1 TYR A 86 4.034 11.116 -19.345 1.00 42.44 C ATOM 1352 CD2 TYR A 86 2.559 12.981 -19.515 1.00 3.45 C ATOM 1353 CE1 TYR A 86 4.488 11.352 -20.628 1.00 63.21 C ATOM 1354 CE2 TYR A 86 3.007 13.224 -20.798 1.00 5.20 C ATOM 1355 CZ TYR A 86 3.972 12.408 -21.351 1.00 3.43 C ATOM 1356 OH TYR A 86 4.421 12.647 -22.629 1.00 14.41 O ATOM 0 H TYR A 86 1.978 11.730 -14.969 1.00 73.13 H new ATOM 0 HA TYR A 86 4.367 11.230 -16.265 1.00 24.20 H new ATOM 0 HB2 TYR A 86 2.293 10.609 -17.274 1.00 1.13 H new ATOM 0 HB3 TYR A 86 1.664 12.242 -17.189 1.00 1.13 H new ATOM 0 HD1 TYR A 86 4.441 10.289 -18.782 1.00 42.44 H new ATOM 0 HD2 TYR A 86 1.805 13.623 -19.085 1.00 3.45 H new ATOM 0 HE1 TYR A 86 5.243 10.714 -21.063 1.00 63.21 H new ATOM 0 HE2 TYR A 86 2.604 14.049 -21.366 1.00 5.20 H new ATOM 0 HH TYR A 86 5.202 13.239 -22.596 1.00 14.41 H new ATOM 1366 N CYS A 87 3.504 14.420 -16.382 1.00 55.22 N ATOM 1367 CA CYS A 87 4.013 15.762 -16.638 1.00 74.45 C ATOM 1368 C CYS A 87 5.339 15.987 -15.917 1.00 23.43 C ATOM 1369 O CYS A 87 6.332 16.382 -16.529 1.00 23.32 O ATOM 1370 CB CYS A 87 2.992 16.810 -16.194 1.00 31.41 C ATOM 1371 SG CYS A 87 1.816 17.287 -17.481 1.00 60.13 S ATOM 0 H CYS A 87 2.543 14.391 -16.040 1.00 55.22 H new ATOM 0 HA CYS A 87 4.182 15.862 -17.710 1.00 74.45 H new ATOM 0 HB2 CYS A 87 2.440 16.423 -15.338 1.00 31.41 H new ATOM 0 HB3 CYS A 87 3.524 17.699 -15.855 1.00 31.41 H new ATOM 0 HG CYS A 87 0.993 18.175 -17.009 1.00 60.13 H new ATOM 1377 N VAL A 88 5.346 15.736 -14.612 1.00 11.13 N ATOM 1378 CA VAL A 88 6.549 15.912 -13.806 1.00 73.44 C ATOM 1379 C VAL A 88 7.729 15.157 -14.409 1.00 62.31 C ATOM 1380 O VAL A 88 8.850 15.667 -14.450 1.00 62.44 O ATOM 1381 CB VAL A 88 6.331 15.432 -12.360 1.00 10.32 C ATOM 1382 CG1 VAL A 88 7.600 15.612 -11.540 1.00 21.22 C ATOM 1383 CG2 VAL A 88 5.166 16.173 -11.722 1.00 65.35 C ATOM 0 H VAL A 88 4.533 15.410 -14.090 1.00 11.13 H new ATOM 0 HA VAL A 88 6.771 16.979 -13.796 1.00 73.44 H new ATOM 0 HB VAL A 88 6.088 14.370 -12.382 1.00 10.32 H new ATOM 0 HG11 VAL A 88 7.426 15.267 -10.521 1.00 21.22 H new ATOM 0 HG12 VAL A 88 8.407 15.032 -11.987 1.00 21.22 H new ATOM 0 HG13 VAL A 88 7.877 16.666 -11.524 1.00 21.22 H new ATOM 0 HG21 VAL A 88 5.027 15.821 -10.700 1.00 65.35 H new ATOM 0 HG22 VAL A 88 5.377 17.242 -11.712 1.00 65.35 H new ATOM 0 HG23 VAL A 88 4.258 15.988 -12.297 1.00 65.35 H new ATOM 1393 N HIS A 89 7.469 13.940 -14.874 1.00 55.35 N ATOM 1394 CA HIS A 89 8.510 13.113 -15.476 1.00 55.13 C ATOM 1395 C HIS A 89 9.096 13.792 -16.712 1.00 4.03 C ATOM 1396 O HIS A 89 10.301 13.653 -16.915 1.00 44.01 O ATOM 1397 CB HIS A 89 7.949 11.741 -15.852 1.00 41.02 C ATOM 1398 CG HIS A 89 7.873 10.789 -14.697 1.00 61.05 C ATOM 1399 ND1 HIS A 89 8.764 10.809 -13.646 1.00 25.11 N ATOM 1400 CD2 HIS A 89 7.003 9.786 -14.434 1.00 35.31 C ATOM 1401 CE1 HIS A 89 8.446 9.858 -12.785 1.00 31.44 C ATOM 1402 NE2 HIS A 89 7.381 9.223 -13.240 1.00 23.21 N ATOM 0 H HIS A 89 6.547 13.504 -14.846 1.00 55.35 H new ATOM 0 HA HIS A 89 9.305 12.983 -14.742 1.00 55.13 H new ATOM 0 HB2 HIS A 89 6.952 11.868 -16.274 1.00 41.02 H new ATOM 0 HB3 HIS A 89 8.572 11.304 -16.632 1.00 41.02 H new ATOM 0 HD1 HIS A 89 9.546 11.456 -13.548 1.00 25.11 H new ATOM 0 HD2 HIS A 89 6.168 9.485 -15.049 1.00 35.31 H new ATOM 0 HE1 HIS A 89 8.968 9.638 -11.866 1.00 31.44 H new ATOM 0 HE2 HIS A 89 6.915 8.441 -12.779 1.00 23.21 H new ATOM 1411 N GLN A 90 8.302 14.496 -17.513 1.00 74.10 N ATOM 1412 CA GLN A 90 8.816 15.161 -18.704 1.00 44.40 C ATOM 1413 C GLN A 90 9.229 16.595 -18.392 1.00 62.24 C ATOM 1414 O GLN A 90 9.145 17.476 -19.249 1.00 22.32 O ATOM 1415 CB GLN A 90 7.763 15.150 -19.814 1.00 31.43 C ATOM 1416 CG GLN A 90 7.708 13.843 -20.587 1.00 62.12 C ATOM 1417 CD GLN A 90 7.862 14.042 -22.082 1.00 52.20 C ATOM 1418 OE1 GLN A 90 6.960 14.550 -22.749 1.00 41.14 O ATOM 1419 NE2 GLN A 90 9.010 13.642 -22.617 1.00 22.40 N ATOM 0 H GLN A 90 7.301 14.620 -17.359 1.00 74.10 H new ATOM 0 HA GLN A 90 9.697 14.615 -19.043 1.00 44.40 H new ATOM 0 HB2 GLN A 90 6.784 15.345 -19.377 1.00 31.43 H new ATOM 0 HB3 GLN A 90 7.970 15.965 -20.508 1.00 31.43 H new ATOM 0 HG2 GLN A 90 8.496 13.180 -20.229 1.00 62.12 H new ATOM 0 HG3 GLN A 90 6.759 13.346 -20.386 1.00 62.12 H new ATOM 0 HE21 GLN A 90 9.730 13.226 -22.027 1.00 22.40 H new ATOM 0 HE22 GLN A 90 9.171 13.751 -23.618 1.00 22.40 H new ATOM 1428 N ARG A 91 9.675 16.823 -17.161 1.00 61.51 N ATOM 1429 CA ARG A 91 10.098 18.152 -16.736 1.00 55.30 C ATOM 1430 C ARG A 91 8.979 19.170 -16.932 1.00 43.44 C ATOM 1431 O ARG A 91 9.230 20.325 -17.274 1.00 73.41 O ATOM 1432 CB ARG A 91 11.341 18.587 -17.515 1.00 21.21 C ATOM 1433 CG ARG A 91 12.634 17.987 -16.986 1.00 3.02 C ATOM 1434 CD ARG A 91 13.442 17.337 -18.098 1.00 34.52 C ATOM 1435 NE ARG A 91 13.948 18.320 -19.052 1.00 64.23 N ATOM 1436 CZ ARG A 91 15.026 19.066 -18.838 1.00 2.11 C ATOM 1437 NH1 ARG A 91 15.708 18.941 -17.708 1.00 1.20 N ATOM 1438 NH2 ARG A 91 15.425 19.939 -19.754 1.00 42.21 N ATOM 0 H ARG A 91 9.753 16.105 -16.441 1.00 61.51 H new ATOM 0 HA ARG A 91 10.340 18.106 -15.674 1.00 55.30 H new ATOM 0 HB2 ARG A 91 11.221 18.305 -18.561 1.00 21.21 H new ATOM 0 HB3 ARG A 91 11.416 19.674 -17.485 1.00 21.21 H new ATOM 0 HG2 ARG A 91 13.230 18.766 -16.509 1.00 3.02 H new ATOM 0 HG3 ARG A 91 12.406 17.246 -16.220 1.00 3.02 H new ATOM 0 HD2 ARG A 91 14.278 16.788 -17.665 1.00 34.52 H new ATOM 0 HD3 ARG A 91 12.820 16.611 -18.621 1.00 34.52 H new ATOM 0 HE ARG A 91 13.446 18.440 -19.932 1.00 64.23 H new ATOM 0 HH11 ARG A 91 15.405 18.271 -17.001 1.00 1.20 H new ATOM 0 HH12 ARG A 91 16.536 19.515 -17.546 1.00 1.20 H new ATOM 0 HH21 ARG A 91 14.904 20.039 -20.625 1.00 42.21 H new ATOM 0 HH22 ARG A 91 16.253 20.511 -19.587 1.00 42.21 H new ATOM 1452 N ILE A 92 7.743 18.731 -16.715 1.00 14.30 N ATOM 1453 CA ILE A 92 6.586 19.603 -16.869 1.00 32.14 C ATOM 1454 C ILE A 92 6.012 19.999 -15.511 1.00 71.13 C ATOM 1455 O ILE A 92 5.518 19.153 -14.765 1.00 63.21 O ATOM 1456 CB ILE A 92 5.481 18.931 -17.704 1.00 62.22 C ATOM 1457 CG1 ILE A 92 6.079 18.286 -18.956 1.00 25.21 C ATOM 1458 CG2 ILE A 92 4.412 19.945 -18.083 1.00 71.52 C ATOM 1459 CD1 ILE A 92 5.055 17.592 -19.826 1.00 12.41 C ATOM 0 H ILE A 92 7.518 17.777 -16.432 1.00 14.30 H new ATOM 0 HA ILE A 92 6.931 20.496 -17.390 1.00 32.14 H new ATOM 0 HB ILE A 92 5.016 18.150 -17.102 1.00 62.22 H new ATOM 0 HG12 ILE A 92 6.584 19.053 -19.544 1.00 25.21 H new ATOM 0 HG13 ILE A 92 6.838 17.564 -18.656 1.00 25.21 H new ATOM 0 HG21 ILE A 92 3.638 19.454 -18.673 1.00 71.52 H new ATOM 0 HG22 ILE A 92 3.969 20.362 -17.179 1.00 71.52 H new ATOM 0 HG23 ILE A 92 4.862 20.746 -18.669 1.00 71.52 H new ATOM 0 HD11 ILE A 92 5.550 17.158 -20.695 1.00 12.41 H new ATOM 0 HD12 ILE A 92 4.567 16.803 -19.254 1.00 12.41 H new ATOM 0 HD13 ILE A 92 4.309 18.315 -20.157 1.00 12.41 H new ATOM 1471 N ASP A 93 6.081 21.288 -15.200 1.00 32.53 N ATOM 1472 CA ASP A 93 5.566 21.797 -13.934 1.00 3.12 C ATOM 1473 C ASP A 93 4.208 22.464 -14.129 1.00 2.32 C ATOM 1474 O ASP A 93 4.063 23.373 -14.945 1.00 63.44 O ATOM 1475 CB ASP A 93 6.553 22.791 -13.320 1.00 20.23 C ATOM 1476 CG ASP A 93 6.458 22.843 -11.808 1.00 1.32 C ATOM 1477 OD1 ASP A 93 5.366 22.557 -11.272 1.00 74.55 O ATOM 1478 OD2 ASP A 93 7.474 23.168 -11.160 1.00 12.35 O ATOM 0 H ASP A 93 6.488 22.000 -15.807 1.00 32.53 H new ATOM 0 HA ASP A 93 5.442 20.954 -13.255 1.00 3.12 H new ATOM 0 HB2 ASP A 93 7.568 22.516 -13.608 1.00 20.23 H new ATOM 0 HB3 ASP A 93 6.364 23.784 -13.727 1.00 20.23 H new ATOM 1483 N VAL A 94 3.215 22.004 -13.374 1.00 41.30 N ATOM 1484 CA VAL A 94 1.868 22.555 -13.463 1.00 22.42 C ATOM 1485 C VAL A 94 1.442 23.181 -12.140 1.00 64.53 C ATOM 1486 O VAL A 94 1.956 22.828 -11.078 1.00 63.31 O ATOM 1487 CB VAL A 94 0.844 21.476 -13.861 1.00 34.02 C ATOM 1488 CG1 VAL A 94 1.164 20.920 -15.241 1.00 24.23 C ATOM 1489 CG2 VAL A 94 0.814 20.364 -12.824 1.00 3.51 C ATOM 0 H VAL A 94 3.318 21.251 -12.694 1.00 41.30 H new ATOM 0 HA VAL A 94 1.892 23.324 -14.235 1.00 22.42 H new ATOM 0 HB VAL A 94 -0.145 21.933 -13.900 1.00 34.02 H new ATOM 0 HG11 VAL A 94 0.430 20.159 -15.506 1.00 24.23 H new ATOM 0 HG12 VAL A 94 1.132 21.726 -15.974 1.00 24.23 H new ATOM 0 HG13 VAL A 94 2.160 20.477 -15.233 1.00 24.23 H new ATOM 0 HG21 VAL A 94 0.085 19.610 -13.120 1.00 3.51 H new ATOM 0 HG22 VAL A 94 1.801 19.907 -12.752 1.00 3.51 H new ATOM 0 HG23 VAL A 94 0.534 20.778 -11.855 1.00 3.51 H new ATOM 1499 N LYS A 95 0.497 24.113 -12.210 1.00 73.01 N ATOM 1500 CA LYS A 95 -0.002 24.789 -11.018 1.00 33.10 C ATOM 1501 C LYS A 95 -0.870 23.851 -10.184 1.00 40.15 C ATOM 1502 O LYS A 95 -0.623 23.656 -8.994 1.00 54.22 O ATOM 1503 CB LYS A 95 -0.805 26.031 -11.409 1.00 21.45 C ATOM 1504 CG LYS A 95 0.027 27.301 -11.464 1.00 21.04 C ATOM 1505 CD LYS A 95 0.933 27.321 -12.683 1.00 43.31 C ATOM 1506 CE LYS A 95 1.687 28.637 -12.796 1.00 21.43 C ATOM 1507 NZ LYS A 95 2.029 28.962 -14.208 1.00 52.53 N ATOM 0 H LYS A 95 0.061 24.417 -13.080 1.00 73.01 H new ATOM 0 HA LYS A 95 0.855 25.093 -10.417 1.00 33.10 H new ATOM 0 HB2 LYS A 95 -1.264 25.865 -12.384 1.00 21.45 H new ATOM 0 HB3 LYS A 95 -1.616 26.169 -10.694 1.00 21.45 H new ATOM 0 HG2 LYS A 95 -0.633 28.169 -11.485 1.00 21.04 H new ATOM 0 HG3 LYS A 95 0.630 27.381 -10.560 1.00 21.04 H new ATOM 0 HD2 LYS A 95 1.644 26.497 -12.623 1.00 43.31 H new ATOM 0 HD3 LYS A 95 0.338 27.163 -13.582 1.00 43.31 H new ATOM 0 HE2 LYS A 95 1.081 29.440 -12.375 1.00 21.43 H new ATOM 0 HE3 LYS A 95 2.601 28.584 -12.204 1.00 21.43 H new ATOM 0 HZ1 LYS A 95 2.542 29.866 -14.242 1.00 52.53 H new ATOM 0 HZ2 LYS A 95 2.628 28.209 -14.602 1.00 52.53 H new ATOM 0 HZ3 LYS A 95 1.156 29.038 -14.768 1.00 52.53 H new ATOM 1521 N ASP A 96 -1.885 23.273 -10.817 1.00 33.45 N ATOM 1522 CA ASP A 96 -2.788 22.354 -10.134 1.00 34.52 C ATOM 1523 C ASP A 96 -3.104 21.149 -11.014 1.00 11.40 C ATOM 1524 O ASP A 96 -2.662 21.071 -12.161 1.00 4.32 O ATOM 1525 CB ASP A 96 -4.082 23.071 -9.745 1.00 41.12 C ATOM 1526 CG ASP A 96 -4.618 23.945 -10.863 1.00 53.41 C ATOM 1527 OD1 ASP A 96 -4.793 23.430 -11.987 1.00 45.42 O ATOM 1528 OD2 ASP A 96 -4.862 25.143 -10.613 1.00 65.03 O ATOM 0 H ASP A 96 -2.103 23.425 -11.802 1.00 33.45 H new ATOM 0 HA ASP A 96 -2.292 22.001 -9.230 1.00 34.52 H new ATOM 0 HB2 ASP A 96 -4.836 22.332 -9.472 1.00 41.12 H new ATOM 0 HB3 ASP A 96 -3.903 23.685 -8.862 1.00 41.12 H new ATOM 1533 N THR A 97 -3.870 20.209 -10.469 1.00 63.11 N ATOM 1534 CA THR A 97 -4.244 19.007 -11.202 1.00 54.42 C ATOM 1535 C THR A 97 -5.092 19.347 -12.422 1.00 24.05 C ATOM 1536 O THR A 97 -5.366 18.489 -13.260 1.00 4.01 O ATOM 1537 CB THR A 97 -5.021 18.022 -10.309 1.00 51.11 C ATOM 1538 OG1 THR A 97 -4.281 17.758 -9.111 1.00 53.54 O ATOM 1539 CG2 THR A 97 -5.287 16.717 -11.045 1.00 75.24 C ATOM 0 H THR A 97 -4.244 20.258 -9.521 1.00 63.11 H new ATOM 0 HA THR A 97 -3.317 18.536 -11.528 1.00 54.42 H new ATOM 0 HB THR A 97 -5.978 18.477 -10.052 1.00 51.11 H new ATOM 0 HG1 THR A 97 -3.928 16.844 -9.139 1.00 53.54 H new ATOM 0 HG21 THR A 97 -5.837 16.038 -10.394 1.00 75.24 H new ATOM 0 HG22 THR A 97 -5.876 16.918 -11.940 1.00 75.24 H new ATOM 0 HG23 THR A 97 -4.339 16.260 -11.329 1.00 75.24 H new ATOM 1547 N LYS A 98 -5.507 20.607 -12.515 1.00 53.33 N ATOM 1548 CA LYS A 98 -6.323 21.063 -13.633 1.00 42.23 C ATOM 1549 C LYS A 98 -5.454 21.395 -14.842 1.00 21.41 C ATOM 1550 O LYS A 98 -5.736 20.960 -15.958 1.00 43.33 O ATOM 1551 CB LYS A 98 -7.141 22.291 -13.226 1.00 51.12 C ATOM 1552 CG LYS A 98 -8.642 22.084 -13.331 1.00 74.33 C ATOM 1553 CD LYS A 98 -9.367 23.392 -13.608 1.00 54.33 C ATOM 1554 CE LYS A 98 -9.702 23.541 -15.084 1.00 73.44 C ATOM 1555 NZ LYS A 98 -11.117 23.179 -15.371 1.00 15.11 N ATOM 0 H LYS A 98 -5.291 21.330 -11.829 1.00 53.33 H new ATOM 0 HA LYS A 98 -7.002 20.256 -13.908 1.00 42.23 H new ATOM 0 HB2 LYS A 98 -6.891 22.560 -12.200 1.00 51.12 H new ATOM 0 HB3 LYS A 98 -6.854 23.133 -13.855 1.00 51.12 H new ATOM 0 HG2 LYS A 98 -8.857 21.372 -14.128 1.00 74.33 H new ATOM 0 HG3 LYS A 98 -9.016 21.649 -12.404 1.00 74.33 H new ATOM 0 HD2 LYS A 98 -10.284 23.433 -13.020 1.00 54.33 H new ATOM 0 HD3 LYS A 98 -8.746 24.229 -13.288 1.00 54.33 H new ATOM 0 HE2 LYS A 98 -9.520 24.570 -15.396 1.00 73.44 H new ATOM 0 HE3 LYS A 98 -9.039 22.907 -15.673 1.00 73.44 H new ATOM 0 HZ1 LYS A 98 -11.305 23.294 -16.387 1.00 15.11 H new ATOM 0 HZ2 LYS A 98 -11.285 22.190 -15.097 1.00 15.11 H new ATOM 0 HZ3 LYS A 98 -11.751 23.800 -14.829 1.00 15.11 H new ATOM 1569 N GLU A 99 -4.397 22.167 -14.611 1.00 53.34 N ATOM 1570 CA GLU A 99 -3.487 22.555 -15.682 1.00 64.43 C ATOM 1571 C GLU A 99 -2.659 21.363 -16.153 1.00 3.22 C ATOM 1572 O GLU A 99 -2.074 21.389 -17.235 1.00 14.13 O ATOM 1573 CB GLU A 99 -2.560 23.679 -15.212 1.00 4.11 C ATOM 1574 CG GLU A 99 -2.372 24.782 -16.240 1.00 60.13 C ATOM 1575 CD GLU A 99 -3.603 25.656 -16.390 1.00 51.15 C ATOM 1576 OE1 GLU A 99 -3.727 26.643 -15.635 1.00 52.34 O ATOM 1577 OE2 GLU A 99 -4.442 25.352 -17.264 1.00 62.15 O ATOM 0 H GLU A 99 -4.150 22.536 -13.693 1.00 53.34 H new ATOM 0 HA GLU A 99 -4.086 22.913 -16.520 1.00 64.43 H new ATOM 0 HB2 GLU A 99 -2.963 24.112 -14.296 1.00 4.11 H new ATOM 0 HB3 GLU A 99 -1.587 23.256 -14.963 1.00 4.11 H new ATOM 0 HG2 GLU A 99 -1.524 25.402 -15.951 1.00 60.13 H new ATOM 0 HG3 GLU A 99 -2.127 24.337 -17.204 1.00 60.13 H new ATOM 1584 N ALA A 100 -2.616 20.319 -15.331 1.00 61.42 N ATOM 1585 CA ALA A 100 -1.863 19.116 -15.663 1.00 73.43 C ATOM 1586 C ALA A 100 -2.610 18.263 -16.682 1.00 74.43 C ATOM 1587 O ALA A 100 -2.010 17.449 -17.384 1.00 44.53 O ATOM 1588 CB ALA A 100 -1.576 18.309 -14.405 1.00 64.55 C ATOM 0 H ALA A 100 -3.094 20.283 -14.431 1.00 61.42 H new ATOM 0 HA ALA A 100 -0.917 19.422 -16.109 1.00 73.43 H new ATOM 0 HB1 ALA A 100 -1.013 17.413 -14.668 1.00 64.55 H new ATOM 0 HB2 ALA A 100 -0.993 18.913 -13.710 1.00 64.55 H new ATOM 0 HB3 ALA A 100 -2.516 18.022 -13.935 1.00 64.55 H new ATOM 1594 N LEU A 101 -3.922 18.455 -16.758 1.00 31.31 N ATOM 1595 CA LEU A 101 -4.753 17.703 -17.692 1.00 42.41 C ATOM 1596 C LEU A 101 -4.784 18.378 -19.059 1.00 61.54 C ATOM 1597 O LEU A 101 -4.936 17.716 -20.087 1.00 34.41 O ATOM 1598 CB LEU A 101 -6.175 17.568 -17.146 1.00 13.55 C ATOM 1599 CG LEU A 101 -6.404 16.434 -16.144 1.00 73.30 C ATOM 1600 CD1 LEU A 101 -7.609 16.734 -15.266 1.00 55.02 C ATOM 1601 CD2 LEU A 101 -6.586 15.110 -16.871 1.00 2.44 C ATOM 0 H LEU A 101 -4.434 19.125 -16.184 1.00 31.31 H new ATOM 0 HA LEU A 101 -4.318 16.710 -17.807 1.00 42.41 H new ATOM 0 HB2 LEU A 101 -6.451 18.509 -16.669 1.00 13.55 H new ATOM 0 HB3 LEU A 101 -6.854 17.426 -17.987 1.00 13.55 H new ATOM 0 HG LEU A 101 -5.525 16.356 -15.504 1.00 73.30 H new ATOM 0 HD11 LEU A 101 -7.757 15.917 -14.560 1.00 55.02 H new ATOM 0 HD12 LEU A 101 -7.438 17.661 -14.718 1.00 55.02 H new ATOM 0 HD13 LEU A 101 -8.497 16.839 -15.890 1.00 55.02 H new ATOM 0 HD21 LEU A 101 -6.748 14.315 -16.143 1.00 2.44 H new ATOM 0 HD22 LEU A 101 -7.448 15.175 -17.535 1.00 2.44 H new ATOM 0 HD23 LEU A 101 -5.693 14.890 -17.456 1.00 2.44 H new ATOM 1613 N ASP A 102 -4.636 19.698 -19.065 1.00 25.21 N ATOM 1614 CA ASP A 102 -4.644 20.463 -20.306 1.00 65.53 C ATOM 1615 C ASP A 102 -3.297 20.364 -21.015 1.00 35.34 C ATOM 1616 O ASP A 102 -3.233 20.256 -22.240 1.00 24.44 O ATOM 1617 CB ASP A 102 -4.980 21.929 -20.024 1.00 72.34 C ATOM 1618 CG ASP A 102 -4.673 22.830 -21.204 1.00 61.44 C ATOM 1619 OD1 ASP A 102 -5.120 22.512 -22.327 1.00 60.33 O ATOM 1620 OD2 ASP A 102 -3.986 23.855 -21.006 1.00 44.43 O ATOM 0 H ASP A 102 -4.509 20.261 -18.224 1.00 25.21 H new ATOM 0 HA ASP A 102 -5.409 20.042 -20.959 1.00 65.53 H new ATOM 0 HB2 ASP A 102 -6.037 22.014 -19.771 1.00 72.34 H new ATOM 0 HB3 ASP A 102 -4.415 22.268 -19.155 1.00 72.34 H new ATOM 1625 N LYS A 103 -2.221 20.403 -20.236 1.00 34.02 N ATOM 1626 CA LYS A 103 -0.874 20.317 -20.787 1.00 2.01 C ATOM 1627 C LYS A 103 -0.668 18.994 -21.518 1.00 43.30 C ATOM 1628 O LYS A 103 0.065 18.926 -22.505 1.00 34.25 O ATOM 1629 CB LYS A 103 0.165 20.463 -19.673 1.00 53.42 C ATOM 1630 CG LYS A 103 1.301 21.410 -20.021 1.00 14.31 C ATOM 1631 CD LYS A 103 0.892 22.861 -19.839 1.00 71.41 C ATOM 1632 CE LYS A 103 0.839 23.244 -18.368 1.00 60.51 C ATOM 1633 NZ LYS A 103 1.367 24.617 -18.133 1.00 10.12 N ATOM 0 H LYS A 103 -2.256 20.494 -19.221 1.00 34.02 H new ATOM 0 HA LYS A 103 -0.749 21.130 -21.502 1.00 2.01 H new ATOM 0 HB2 LYS A 103 -0.330 20.820 -18.770 1.00 53.42 H new ATOM 0 HB3 LYS A 103 0.579 19.481 -19.443 1.00 53.42 H new ATOM 0 HG2 LYS A 103 2.163 21.192 -19.391 1.00 14.31 H new ATOM 0 HG3 LYS A 103 1.610 21.245 -21.053 1.00 14.31 H new ATOM 0 HD2 LYS A 103 1.599 23.507 -20.359 1.00 71.41 H new ATOM 0 HD3 LYS A 103 -0.085 23.025 -20.294 1.00 71.41 H new ATOM 0 HE2 LYS A 103 -0.190 23.185 -18.014 1.00 60.51 H new ATOM 0 HE3 LYS A 103 1.418 22.528 -17.785 1.00 60.51 H new ATOM 0 HZ1 LYS A 103 1.314 24.840 -17.119 1.00 10.12 H new ATOM 0 HZ2 LYS A 103 2.357 24.667 -18.447 1.00 10.12 H new ATOM 0 HZ3 LYS A 103 0.799 25.304 -18.669 1.00 10.12 H new ATOM 1647 N ILE A 104 -1.321 17.945 -21.029 1.00 4.34 N ATOM 1648 CA ILE A 104 -1.212 16.626 -21.639 1.00 3.44 C ATOM 1649 C ILE A 104 -2.208 16.463 -22.782 1.00 1.04 C ATOM 1650 O ILE A 104 -2.069 15.570 -23.616 1.00 52.13 O ATOM 1651 CB ILE A 104 -1.447 15.507 -20.605 1.00 32.22 C ATOM 1652 CG1 ILE A 104 -0.502 15.677 -19.414 1.00 2.42 C ATOM 1653 CG2 ILE A 104 -1.256 14.142 -21.250 1.00 23.32 C ATOM 1654 CD1 ILE A 104 -0.795 14.730 -18.271 1.00 25.54 C ATOM 0 H ILE A 104 -1.931 17.983 -20.212 1.00 4.34 H new ATOM 0 HA ILE A 104 -0.198 16.543 -22.030 1.00 3.44 H new ATOM 0 HB ILE A 104 -2.473 15.576 -20.243 1.00 32.22 H new ATOM 0 HG12 ILE A 104 0.524 15.523 -19.749 1.00 2.42 H new ATOM 0 HG13 ILE A 104 -0.568 16.703 -19.051 1.00 2.42 H new ATOM 0 HG21 ILE A 104 -1.425 13.362 -20.508 1.00 23.32 H new ATOM 0 HG22 ILE A 104 -1.966 14.024 -22.069 1.00 23.32 H new ATOM 0 HG23 ILE A 104 -0.240 14.061 -21.636 1.00 23.32 H new ATOM 0 HD11 ILE A 104 -0.087 14.907 -17.462 1.00 25.54 H new ATOM 0 HD12 ILE A 104 -1.809 14.899 -17.909 1.00 25.54 H new ATOM 0 HD13 ILE A 104 -0.700 13.701 -18.618 1.00 25.54 H new ATOM 1666 N GLU A 105 -3.212 17.335 -22.813 1.00 11.53 N ATOM 1667 CA GLU A 105 -4.230 17.287 -23.855 1.00 63.42 C ATOM 1668 C GLU A 105 -3.786 18.072 -25.086 1.00 73.12 C ATOM 1669 O GLU A 105 -3.876 17.583 -26.212 1.00 55.45 O ATOM 1670 CB GLU A 105 -5.554 17.849 -23.332 1.00 0.53 C ATOM 1671 CG GLU A 105 -6.777 17.269 -24.024 1.00 30.43 C ATOM 1672 CD GLU A 105 -8.051 17.480 -23.229 1.00 45.50 C ATOM 1673 OE1 GLU A 105 -7.994 18.168 -22.189 1.00 24.45 O ATOM 1674 OE2 GLU A 105 -9.104 16.954 -23.645 1.00 62.25 O ATOM 0 H GLU A 105 -3.341 18.081 -22.130 1.00 11.53 H new ATOM 0 HA GLU A 105 -4.372 16.244 -24.140 1.00 63.42 H new ATOM 0 HB2 GLU A 105 -5.625 17.653 -22.262 1.00 0.53 H new ATOM 0 HB3 GLU A 105 -5.555 18.932 -23.458 1.00 0.53 H new ATOM 0 HG2 GLU A 105 -6.886 17.728 -25.007 1.00 30.43 H new ATOM 0 HG3 GLU A 105 -6.626 16.202 -24.186 1.00 30.43 H new ATOM 1681 N GLU A 106 -3.306 19.292 -24.863 1.00 10.34 N ATOM 1682 CA GLU A 106 -2.848 20.144 -25.954 1.00 4.44 C ATOM 1683 C GLU A 106 -1.781 19.438 -26.785 1.00 31.20 C ATOM 1684 O GLU A 106 -1.664 19.668 -27.988 1.00 1.13 O ATOM 1685 CB GLU A 106 -2.295 21.460 -25.405 1.00 21.35 C ATOM 1686 CG GLU A 106 -2.323 22.599 -26.410 1.00 32.13 C ATOM 1687 CD GLU A 106 -2.209 23.961 -25.753 1.00 31.21 C ATOM 1688 OE1 GLU A 106 -1.993 24.011 -24.524 1.00 53.54 O ATOM 1689 OE2 GLU A 106 -2.336 24.977 -26.468 1.00 74.25 O ATOM 0 H GLU A 106 -3.224 19.712 -23.937 1.00 10.34 H new ATOM 0 HA GLU A 106 -3.702 20.357 -26.597 1.00 4.44 H new ATOM 0 HB2 GLU A 106 -2.872 21.748 -24.526 1.00 21.35 H new ATOM 0 HB3 GLU A 106 -1.268 21.303 -25.075 1.00 21.35 H new ATOM 0 HG2 GLU A 106 -1.505 22.473 -27.119 1.00 32.13 H new ATOM 0 HG3 GLU A 106 -3.250 22.552 -26.981 1.00 32.13 H new ATOM 1696 N GLU A 107 -1.004 18.578 -26.132 1.00 73.44 N ATOM 1697 CA GLU A 107 0.055 17.840 -26.811 1.00 23.41 C ATOM 1698 C GLU A 107 -0.529 16.847 -27.811 1.00 0.13 C ATOM 1699 O GLU A 107 0.070 16.573 -28.850 1.00 2.43 O ATOM 1700 CB GLU A 107 0.926 17.104 -25.792 1.00 53.41 C ATOM 1701 CG GLU A 107 2.119 17.913 -25.310 1.00 64.32 C ATOM 1702 CD GLU A 107 3.416 17.490 -25.971 1.00 33.21 C ATOM 1703 OE1 GLU A 107 3.684 16.272 -26.024 1.00 74.22 O ATOM 1704 OE2 GLU A 107 4.164 18.377 -26.433 1.00 64.21 O ATOM 0 H GLU A 107 -1.088 18.376 -25.136 1.00 73.44 H new ATOM 0 HA GLU A 107 0.671 18.556 -27.355 1.00 23.41 H new ATOM 0 HB2 GLU A 107 0.313 16.831 -24.933 1.00 53.41 H new ATOM 0 HB3 GLU A 107 1.284 16.175 -26.237 1.00 53.41 H new ATOM 0 HG2 GLU A 107 1.941 18.970 -25.510 1.00 64.32 H new ATOM 0 HG3 GLU A 107 2.214 17.805 -24.230 1.00 64.32 H new ATOM 1711 N GLN A 108 -1.701 16.310 -27.486 1.00 72.45 N ATOM 1712 CA GLN A 108 -2.366 15.346 -28.356 1.00 75.32 C ATOM 1713 C GLN A 108 -3.212 16.054 -29.409 1.00 32.21 C ATOM 1714 O GLN A 108 -3.369 15.564 -30.526 1.00 53.33 O ATOM 1715 CB GLN A 108 -3.242 14.402 -27.530 1.00 71.41 C ATOM 1716 CG GLN A 108 -3.476 13.054 -28.193 1.00 25.43 C ATOM 1717 CD GLN A 108 -4.749 12.384 -27.714 1.00 54.32 C ATOM 1718 OE1 GLN A 108 -5.670 13.043 -27.231 1.00 72.35 O ATOM 1719 NE2 GLN A 108 -4.807 11.063 -27.845 1.00 21.53 N ATOM 0 H GLN A 108 -2.209 16.526 -26.628 1.00 72.45 H new ATOM 0 HA GLN A 108 -1.598 14.765 -28.866 1.00 75.32 H new ATOM 0 HB2 GLN A 108 -2.775 14.243 -26.558 1.00 71.41 H new ATOM 0 HB3 GLN A 108 -4.205 14.880 -27.347 1.00 71.41 H new ATOM 0 HG2 GLN A 108 -3.524 13.188 -29.274 1.00 25.43 H new ATOM 0 HG3 GLN A 108 -2.627 12.401 -27.990 1.00 25.43 H new ATOM 0 HE21 GLN A 108 -4.021 10.556 -28.251 1.00 21.53 H new ATOM 0 HE22 GLN A 108 -5.638 10.556 -27.540 1.00 21.53 H new ATOM 1728 N ASN A 109 -3.755 17.211 -29.044 1.00 24.43 N ATOM 1729 CA ASN A 109 -4.587 17.987 -29.956 1.00 45.31 C ATOM 1730 C ASN A 109 -3.787 18.431 -31.177 1.00 13.30 C ATOM 1731 O ASN A 109 -4.343 18.650 -32.252 1.00 62.12 O ATOM 1732 CB ASN A 109 -5.165 19.208 -29.240 1.00 4.31 C ATOM 1733 CG ASN A 109 -6.446 18.887 -28.493 1.00 21.01 C ATOM 1734 OD1 ASN A 109 -6.579 17.819 -27.897 1.00 14.44 O ATOM 1735 ND2 ASN A 109 -7.395 19.815 -28.522 1.00 23.21 N ATOM 0 H ASN A 109 -3.634 17.632 -28.123 1.00 24.43 H new ATOM 0 HA ASN A 109 -5.406 17.350 -30.291 1.00 45.31 H new ATOM 0 HB2 ASN A 109 -4.427 19.598 -28.539 1.00 4.31 H new ATOM 0 HB3 ASN A 109 -5.360 19.995 -29.969 1.00 4.31 H new ATOM 0 HD21 ASN A 109 -8.278 19.657 -28.037 1.00 23.21 H new ATOM 0 HD22 ASN A 109 -7.241 20.686 -29.029 1.00 23.21 H new ATOM 1742 N LYS A 110 -2.476 18.561 -31.002 1.00 71.43 N ATOM 1743 CA LYS A 110 -1.596 18.978 -32.088 1.00 52.14 C ATOM 1744 C LYS A 110 -1.463 17.875 -33.133 1.00 73.20 C ATOM 1745 O LYS A 110 -1.248 18.149 -34.315 1.00 11.24 O ATOM 1746 CB LYS A 110 -0.215 19.347 -31.541 1.00 51.32 C ATOM 1747 CG LYS A 110 0.246 20.737 -31.941 1.00 31.14 C ATOM 1748 CD LYS A 110 0.873 20.741 -33.324 1.00 51.00 C ATOM 1749 CE LYS A 110 2.107 21.629 -33.375 1.00 51.34 C ATOM 1750 NZ LYS A 110 2.185 22.398 -34.648 1.00 42.10 N ATOM 0 H LYS A 110 -1.999 18.383 -30.118 1.00 71.43 H new ATOM 0 HA LYS A 110 -2.037 19.854 -32.564 1.00 52.14 H new ATOM 0 HB2 LYS A 110 -0.234 19.279 -30.453 1.00 51.32 H new ATOM 0 HB3 LYS A 110 0.513 18.616 -31.893 1.00 51.32 H new ATOM 0 HG2 LYS A 110 -0.602 21.421 -31.923 1.00 31.14 H new ATOM 0 HG3 LYS A 110 0.968 21.105 -31.212 1.00 31.14 H new ATOM 0 HD2 LYS A 110 1.144 19.723 -33.604 1.00 51.00 H new ATOM 0 HD3 LYS A 110 0.143 21.089 -34.055 1.00 51.00 H new ATOM 0 HE2 LYS A 110 2.091 22.321 -32.533 1.00 51.34 H new ATOM 0 HE3 LYS A 110 3.001 21.015 -33.266 1.00 51.34 H new ATOM 0 HZ1 LYS A 110 3.040 22.991 -34.644 1.00 42.10 H new ATOM 0 HZ2 LYS A 110 2.226 21.738 -35.451 1.00 42.10 H new ATOM 0 HZ3 LYS A 110 1.344 23.003 -34.740 1.00 42.10 H new ATOM 1764 N SER A 111 -1.593 16.628 -32.692 1.00 24.52 N ATOM 1765 CA SER A 111 -1.486 15.484 -33.590 1.00 33.14 C ATOM 1766 C SER A 111 -2.855 15.091 -34.135 1.00 73.35 C ATOM 1767 O SER A 111 -2.966 14.554 -35.238 1.00 22.41 O ATOM 1768 CB SER A 111 -0.854 14.296 -32.862 1.00 31.52 C ATOM 1769 OG SER A 111 0.559 14.328 -32.965 1.00 1.55 O ATOM 0 H SER A 111 -1.773 16.384 -31.718 1.00 24.52 H new ATOM 0 HA SER A 111 -0.849 15.769 -34.428 1.00 33.14 H new ATOM 0 HB2 SER A 111 -1.146 14.312 -31.812 1.00 31.52 H new ATOM 0 HB3 SER A 111 -1.232 13.364 -33.284 1.00 31.52 H new ATOM 0 HG SER A 111 0.939 13.559 -32.490 1.00 1.55 H new ATOM 1775 N LYS A 112 -3.896 15.363 -33.356 1.00 54.03 N ATOM 1776 CA LYS A 112 -5.259 15.039 -33.760 1.00 20.31 C ATOM 1777 C LYS A 112 -5.720 15.948 -34.895 1.00 2.21 C ATOM 1778 O LYS A 112 -6.285 15.483 -35.885 1.00 71.41 O ATOM 1779 CB LYS A 112 -6.210 15.172 -32.569 1.00 5.43 C ATOM 1780 CG LYS A 112 -7.052 13.932 -32.322 1.00 13.55 C ATOM 1781 CD LYS A 112 -8.522 14.189 -32.605 1.00 32.11 C ATOM 1782 CE LYS A 112 -9.316 12.893 -32.651 1.00 44.34 C ATOM 1783 NZ LYS A 112 -10.673 13.051 -32.060 1.00 34.44 N ATOM 0 H LYS A 112 -3.822 15.807 -32.441 1.00 54.03 H new ATOM 0 HA LYS A 112 -5.272 14.008 -34.115 1.00 20.31 H new ATOM 0 HB2 LYS A 112 -5.629 15.391 -31.673 1.00 5.43 H new ATOM 0 HB3 LYS A 112 -6.871 16.023 -32.736 1.00 5.43 H new ATOM 0 HG2 LYS A 112 -6.696 13.118 -32.954 1.00 13.55 H new ATOM 0 HG3 LYS A 112 -6.931 13.609 -31.288 1.00 13.55 H new ATOM 0 HD2 LYS A 112 -8.933 14.842 -31.835 1.00 32.11 H new ATOM 0 HD3 LYS A 112 -8.624 14.713 -33.555 1.00 32.11 H new ATOM 0 HE2 LYS A 112 -9.407 12.560 -33.685 1.00 44.34 H new ATOM 0 HE3 LYS A 112 -8.774 12.116 -32.112 1.00 44.34 H new ATOM 0 HZ1 LYS A 112 -11.181 12.145 -32.111 1.00 34.44 H new ATOM 0 HZ2 LYS A 112 -10.587 13.344 -31.066 1.00 34.44 H new ATOM 0 HZ3 LYS A 112 -11.200 13.774 -32.590 1.00 34.44 H new ATOM 1797 N LYS A 113 -5.474 17.246 -34.745 1.00 43.33 N ATOM 1798 CA LYS A 113 -5.861 18.220 -35.759 1.00 60.10 C ATOM 1799 C LYS A 113 -5.033 18.043 -37.028 1.00 14.14 C ATOM 1800 O LYS A 113 -5.478 18.382 -38.125 1.00 20.45 O ATOM 1801 CB LYS A 113 -5.692 19.641 -35.221 1.00 34.34 C ATOM 1802 CG LYS A 113 -6.848 20.105 -34.350 1.00 72.13 C ATOM 1803 CD LYS A 113 -7.232 21.543 -34.653 1.00 71.41 C ATOM 1804 CE LYS A 113 -7.598 22.301 -33.385 1.00 41.11 C ATOM 1805 NZ LYS A 113 -8.427 23.502 -33.678 1.00 23.24 N ATOM 0 H LYS A 113 -5.008 17.647 -33.931 1.00 43.33 H new ATOM 0 HA LYS A 113 -6.910 18.054 -36.005 1.00 60.10 H new ATOM 0 HB2 LYS A 113 -4.769 19.694 -34.643 1.00 34.34 H new ATOM 0 HB3 LYS A 113 -5.583 20.327 -36.061 1.00 34.34 H new ATOM 0 HG2 LYS A 113 -7.709 19.456 -34.510 1.00 72.13 H new ATOM 0 HG3 LYS A 113 -6.572 20.015 -33.299 1.00 72.13 H new ATOM 0 HD2 LYS A 113 -6.403 22.045 -35.152 1.00 71.41 H new ATOM 0 HD3 LYS A 113 -8.075 21.558 -35.343 1.00 71.41 H new ATOM 0 HE2 LYS A 113 -8.142 21.640 -32.711 1.00 41.11 H new ATOM 0 HE3 LYS A 113 -6.688 22.605 -32.868 1.00 41.11 H new ATOM 0 HZ1 LYS A 113 -8.656 23.991 -32.789 1.00 23.24 H new ATOM 0 HZ2 LYS A 113 -7.898 24.145 -34.301 1.00 23.24 H new ATOM 0 HZ3 LYS A 113 -9.307 23.210 -34.149 1.00 23.24 H new ATOM 1819 N LYS A 114 -3.827 17.509 -36.872 1.00 33.12 N ATOM 1820 CA LYS A 114 -2.936 17.284 -38.005 1.00 25.34 C ATOM 1821 C LYS A 114 -3.045 15.848 -38.505 1.00 41.00 C ATOM 1822 O LYS A 114 -2.070 15.273 -38.987 1.00 75.11 O ATOM 1823 CB LYS A 114 -1.489 17.590 -37.611 1.00 21.31 C ATOM 1824 CG LYS A 114 -0.564 17.787 -38.799 1.00 42.12 C ATOM 1825 CD LYS A 114 -0.475 19.250 -39.199 1.00 73.44 C ATOM 1826 CE LYS A 114 -0.880 19.457 -40.650 1.00 62.10 C ATOM 1827 NZ LYS A 114 -1.230 20.877 -40.931 1.00 74.31 N ATOM 0 H LYS A 114 -3.443 17.223 -35.971 1.00 33.12 H new ATOM 0 HA LYS A 114 -3.236 17.954 -38.810 1.00 25.34 H new ATOM 0 HB2 LYS A 114 -1.471 18.489 -36.995 1.00 21.31 H new ATOM 0 HB3 LYS A 114 -1.108 16.774 -36.996 1.00 21.31 H new ATOM 0 HG2 LYS A 114 0.430 17.415 -38.553 1.00 42.12 H new ATOM 0 HG3 LYS A 114 -0.924 17.199 -39.643 1.00 42.12 H new ATOM 0 HD2 LYS A 114 -1.120 19.845 -38.552 1.00 73.44 H new ATOM 0 HD3 LYS A 114 0.544 19.608 -39.050 1.00 73.44 H new ATOM 0 HE2 LYS A 114 -0.063 19.148 -41.303 1.00 62.10 H new ATOM 0 HE3 LYS A 114 -1.733 18.820 -40.883 1.00 62.10 H new ATOM 0 HZ1 LYS A 114 -1.500 20.977 -41.930 1.00 74.31 H new ATOM 0 HZ2 LYS A 114 -2.026 21.165 -40.327 1.00 74.31 H new ATOM 0 HZ3 LYS A 114 -0.408 21.483 -40.733 1.00 74.31 H new ATOM 1841 N ALA A 115 -4.238 15.274 -38.390 1.00 65.31 N ATOM 1842 CA ALA A 115 -4.476 13.907 -38.834 1.00 73.41 C ATOM 1843 C ALA A 115 -5.928 13.709 -39.251 1.00 43.45 C ATOM 1844 O ALA A 115 -6.501 12.638 -39.050 1.00 43.02 O ATOM 1845 CB ALA A 115 -4.100 12.922 -37.737 1.00 24.55 C ATOM 0 H ALA A 115 -5.056 15.736 -37.992 1.00 65.31 H new ATOM 0 HA ALA A 115 -3.848 13.721 -39.705 1.00 73.41 H new ATOM 0 HB1 ALA A 115 -4.283 11.905 -38.083 1.00 24.55 H new ATOM 0 HB2 ALA A 115 -3.044 13.037 -37.491 1.00 24.55 H new ATOM 0 HB3 ALA A 115 -4.703 13.118 -36.850 1.00 24.55 H new ATOM 1851 N GLN A 116 -6.520 14.748 -39.832 1.00 75.32 N ATOM 1852 CA GLN A 116 -7.908 14.688 -40.276 1.00 14.20 C ATOM 1853 C GLN A 116 -8.008 14.913 -41.781 1.00 13.20 C ATOM 1854 O GLN A 116 -8.902 15.614 -42.255 1.00 35.10 O ATOM 1855 CB GLN A 116 -8.748 15.730 -39.536 1.00 34.02 C ATOM 1856 CG GLN A 116 -8.824 15.495 -38.035 1.00 70.13 C ATOM 1857 CD GLN A 116 -10.195 15.028 -37.588 1.00 2.42 C ATOM 1858 OE1 GLN A 116 -11.217 15.468 -38.115 1.00 1.23 O ATOM 1859 NE2 GLN A 116 -10.224 14.129 -36.610 1.00 62.01 N ATOM 0 H GLN A 116 -6.060 15.642 -40.006 1.00 75.32 H new ATOM 0 HA GLN A 116 -8.293 13.694 -40.049 1.00 14.20 H new ATOM 0 HB2 GLN A 116 -8.329 16.719 -39.720 1.00 34.02 H new ATOM 0 HB3 GLN A 116 -9.757 15.730 -39.947 1.00 34.02 H new ATOM 0 HG2 GLN A 116 -8.080 14.752 -37.749 1.00 70.13 H new ATOM 0 HG3 GLN A 116 -8.570 16.418 -37.513 1.00 70.13 H new ATOM 0 HE21 GLN A 116 -9.352 13.791 -36.202 1.00 62.01 H new ATOM 0 HE22 GLN A 116 -11.118 13.776 -36.268 1.00 62.01 H new ATOM 1868 N GLN A 117 -7.085 14.312 -42.527 1.00 61.23 N ATOM 1869 CA GLN A 117 -7.071 14.449 -43.979 1.00 15.10 C ATOM 1870 C GLN A 117 -7.333 13.107 -44.654 1.00 62.21 C ATOM 1871 O GLN A 117 -8.251 12.977 -45.462 1.00 4.41 O ATOM 1872 CB GLN A 117 -5.728 15.015 -44.446 1.00 11.25 C ATOM 1873 CG GLN A 117 -5.564 15.024 -45.957 1.00 12.53 C ATOM 1874 CD GLN A 117 -6.556 15.938 -46.646 1.00 60.41 C ATOM 1875 OE1 GLN A 117 -7.767 15.807 -46.470 1.00 10.43 O ATOM 1876 NE2 GLN A 117 -6.046 16.875 -47.438 1.00 31.12 N ATOM 0 H GLN A 117 -6.339 13.727 -42.150 1.00 61.23 H new ATOM 0 HA GLN A 117 -7.866 15.139 -44.262 1.00 15.10 H new ATOM 0 HB2 GLN A 117 -5.622 16.033 -44.071 1.00 11.25 H new ATOM 0 HB3 GLN A 117 -4.923 14.428 -44.005 1.00 11.25 H new ATOM 0 HG2 GLN A 117 -4.551 15.339 -46.207 1.00 12.53 H new ATOM 0 HG3 GLN A 117 -5.685 14.010 -46.338 1.00 12.53 H new ATOM 0 HE21 GLN A 117 -5.035 16.949 -47.556 1.00 31.12 H new ATOM 0 HE22 GLN A 117 -6.665 17.521 -47.928 1.00 31.12 H new ATOM 1885 N ALA A 118 -6.519 12.112 -44.317 1.00 42.35 N ATOM 1886 CA ALA A 118 -6.664 10.779 -44.890 1.00 63.34 C ATOM 1887 C ALA A 118 -7.879 10.063 -44.312 1.00 65.23 C ATOM 1888 O ALA A 118 -8.551 9.301 -45.007 1.00 64.21 O ATOM 1889 CB ALA A 118 -5.404 9.962 -44.650 1.00 53.30 C ATOM 0 H ALA A 118 -5.752 12.204 -43.650 1.00 42.35 H new ATOM 0 HA ALA A 118 -6.815 10.886 -45.964 1.00 63.34 H new ATOM 0 HB1 ALA A 118 -5.526 8.969 -45.083 1.00 53.30 H new ATOM 0 HB2 ALA A 118 -4.554 10.459 -45.117 1.00 53.30 H new ATOM 0 HB3 ALA A 118 -5.228 9.871 -43.578 1.00 53.30 H new ATOM 1895 N ALA A 119 -8.157 10.312 -43.037 1.00 65.24 N ATOM 1896 CA ALA A 119 -9.293 9.692 -42.367 1.00 0.15 C ATOM 1897 C ALA A 119 -10.481 10.645 -42.303 1.00 70.32 C ATOM 1898 O ALA A 119 -10.801 11.184 -41.244 1.00 0.54 O ATOM 1899 CB ALA A 119 -8.899 9.242 -40.967 1.00 60.51 C ATOM 0 H ALA A 119 -7.611 10.939 -42.447 1.00 65.24 H new ATOM 0 HA ALA A 119 -9.592 8.819 -42.947 1.00 0.15 H new ATOM 0 HB1 ALA A 119 -9.757 8.781 -40.478 1.00 60.51 H new ATOM 0 HB2 ALA A 119 -8.086 8.518 -41.033 1.00 60.51 H new ATOM 0 HB3 ALA A 119 -8.571 10.104 -40.387 1.00 60.51 H new ATOM 1905 N ALA A 120 -11.131 10.850 -43.444 1.00 61.55 N ATOM 1906 CA ALA A 120 -12.285 11.738 -43.517 1.00 71.13 C ATOM 1907 C ALA A 120 -13.059 11.527 -44.814 1.00 11.21 C ATOM 1908 O ALA A 120 -14.290 11.533 -44.821 1.00 15.53 O ATOM 1909 CB ALA A 120 -11.842 13.188 -43.395 1.00 62.43 C ATOM 0 H ALA A 120 -10.878 10.413 -44.330 1.00 61.55 H new ATOM 0 HA ALA A 120 -12.949 11.500 -42.686 1.00 71.13 H new ATOM 0 HB1 ALA A 120 -12.713 13.841 -43.451 1.00 62.43 H new ATOM 0 HB2 ALA A 120 -11.339 13.336 -42.439 1.00 62.43 H new ATOM 0 HB3 ALA A 120 -11.156 13.428 -44.207 1.00 62.43 H new ATOM 1915 N ASP A 121 -12.330 11.341 -45.909 1.00 1.50 N ATOM 1916 CA ASP A 121 -12.949 11.127 -47.212 1.00 23.11 C ATOM 1917 C ASP A 121 -13.303 9.656 -47.411 1.00 11.31 C ATOM 1918 O ASP A 121 -12.734 8.979 -48.268 1.00 33.04 O ATOM 1919 CB ASP A 121 -12.013 11.594 -48.327 1.00 72.14 C ATOM 1920 CG ASP A 121 -11.295 12.883 -47.978 1.00 41.14 C ATOM 1921 OD1 ASP A 121 -11.966 13.934 -47.900 1.00 1.22 O ATOM 1922 OD2 ASP A 121 -10.062 12.841 -47.784 1.00 44.31 O ATOM 0 H ASP A 121 -11.310 11.334 -45.920 1.00 1.50 H new ATOM 0 HA ASP A 121 -13.868 11.712 -47.251 1.00 23.11 H new ATOM 0 HB2 ASP A 121 -11.278 10.815 -48.530 1.00 72.14 H new ATOM 0 HB3 ASP A 121 -12.587 11.737 -49.243 1.00 72.14 H new ATOM 1927 N THR A 122 -14.246 9.166 -46.612 1.00 74.51 N ATOM 1928 CA THR A 122 -14.674 7.775 -46.698 1.00 73.52 C ATOM 1929 C THR A 122 -16.195 7.667 -46.691 1.00 32.44 C ATOM 1930 O THR A 122 -16.858 8.172 -45.786 1.00 71.21 O ATOM 1931 CB THR A 122 -14.106 6.940 -45.537 1.00 33.15 C ATOM 1932 OG1 THR A 122 -14.403 7.572 -44.286 1.00 52.13 O ATOM 1933 CG2 THR A 122 -12.601 6.768 -45.679 1.00 74.01 C ATOM 0 H THR A 122 -14.728 9.712 -45.898 1.00 74.51 H new ATOM 0 HA THR A 122 -14.289 7.383 -47.639 1.00 73.52 H new ATOM 0 HB THR A 122 -14.573 5.955 -45.566 1.00 33.15 H new ATOM 0 HG1 THR A 122 -15.291 7.985 -44.331 1.00 52.13 H new ATOM 0 HG21 THR A 122 -12.222 6.174 -44.847 1.00 74.01 H new ATOM 0 HG22 THR A 122 -12.380 6.260 -46.617 1.00 74.01 H new ATOM 0 HG23 THR A 122 -12.121 7.747 -45.675 1.00 74.01 H new ATOM 1941 N GLY A 123 -16.742 7.004 -47.706 1.00 34.13 N ATOM 1942 CA GLY A 123 -18.181 6.841 -47.796 1.00 12.22 C ATOM 1943 C GLY A 123 -18.632 6.433 -49.184 1.00 13.22 C ATOM 1944 O GLY A 123 -18.431 7.168 -50.150 1.00 31.11 O ATOM 0 H GLY A 123 -16.214 6.577 -48.467 1.00 34.13 H new ATOM 0 HA2 GLY A 123 -18.504 6.089 -47.076 1.00 12.22 H new ATOM 0 HA3 GLY A 123 -18.668 7.776 -47.519 1.00 12.22 H new ATOM 1948 N ASN A 124 -19.242 5.257 -49.285 1.00 2.14 N ATOM 1949 CA ASN A 124 -19.721 4.751 -50.566 1.00 42.00 C ATOM 1950 C ASN A 124 -20.842 5.629 -51.113 1.00 3.34 C ATOM 1951 O ASN A 124 -20.838 5.999 -52.286 1.00 32.41 O ATOM 1952 CB ASN A 124 -20.213 3.309 -50.417 1.00 71.35 C ATOM 1953 CG ASN A 124 -19.095 2.298 -50.574 1.00 14.10 C ATOM 1954 OD1 ASN A 124 -18.336 2.046 -49.638 1.00 55.53 O ATOM 1955 ND2 ASN A 124 -18.989 1.713 -51.762 1.00 0.42 N ATOM 0 H ASN A 124 -19.416 4.636 -48.495 1.00 2.14 H new ATOM 0 HA ASN A 124 -18.890 4.773 -51.271 1.00 42.00 H new ATOM 0 HB2 ASN A 124 -20.676 3.185 -49.438 1.00 71.35 H new ATOM 0 HB3 ASN A 124 -20.984 3.112 -51.162 1.00 71.35 H new ATOM 0 HD21 ASN A 124 -18.256 1.024 -51.927 1.00 0.42 H new ATOM 0 HD22 ASN A 124 -19.641 1.953 -52.509 1.00 0.42 H new ATOM 1962 N ASN A 125 -21.801 5.959 -50.253 1.00 75.05 N ATOM 1963 CA ASN A 125 -22.929 6.794 -50.650 1.00 32.20 C ATOM 1964 C ASN A 125 -23.745 7.220 -49.433 1.00 32.35 C ATOM 1965 O ASN A 125 -23.550 6.707 -48.331 1.00 35.12 O ATOM 1966 CB ASN A 125 -23.822 6.044 -51.639 1.00 62.14 C ATOM 1967 CG ASN A 125 -24.796 5.110 -50.946 1.00 55.54 C ATOM 1968 OD1 ASN A 125 -24.399 4.274 -50.134 1.00 25.30 O ATOM 1969 ND2 ASN A 125 -26.077 5.248 -51.266 1.00 53.33 N ATOM 0 H ASN A 125 -21.819 5.661 -49.278 1.00 75.05 H new ATOM 0 HA ASN A 125 -22.535 7.688 -51.133 1.00 32.20 H new ATOM 0 HB2 ASN A 125 -24.378 6.764 -52.240 1.00 62.14 H new ATOM 0 HB3 ASN A 125 -23.198 5.470 -52.325 1.00 62.14 H new ATOM 0 HD21 ASN A 125 -26.778 4.647 -50.833 1.00 53.33 H new ATOM 0 HD22 ASN A 125 -26.360 5.955 -51.945 1.00 53.33 H new ATOM 1976 N SER A 126 -24.659 8.162 -49.641 1.00 4.54 N ATOM 1977 CA SER A 126 -25.503 8.659 -48.561 1.00 3.01 C ATOM 1978 C SER A 126 -26.589 7.646 -48.209 1.00 63.55 C ATOM 1979 O SER A 126 -26.960 6.809 -49.031 1.00 21.41 O ATOM 1980 CB SER A 126 -26.142 9.992 -48.957 1.00 13.24 C ATOM 1981 OG SER A 126 -27.376 10.185 -48.288 1.00 13.32 O ATOM 0 H SER A 126 -24.834 8.596 -50.547 1.00 4.54 H new ATOM 0 HA SER A 126 -24.875 8.811 -47.683 1.00 3.01 H new ATOM 0 HB2 SER A 126 -25.463 10.810 -48.717 1.00 13.24 H new ATOM 0 HB3 SER A 126 -26.302 10.016 -50.035 1.00 13.24 H new ATOM 0 HG SER A 126 -27.763 11.044 -48.557 1.00 13.32 H new ATOM 1987 N GLN A 127 -27.094 7.731 -46.983 1.00 34.34 N ATOM 1988 CA GLN A 127 -28.137 6.823 -46.521 1.00 72.32 C ATOM 1989 C GLN A 127 -29.162 7.560 -45.665 1.00 31.11 C ATOM 1990 O GLN A 127 -28.807 8.407 -44.846 1.00 35.50 O ATOM 1991 CB GLN A 127 -27.523 5.670 -45.725 1.00 32.44 C ATOM 1992 CG GLN A 127 -27.665 4.318 -46.403 1.00 4.32 C ATOM 1993 CD GLN A 127 -26.334 3.624 -46.607 1.00 74.03 C ATOM 1994 OE1 GLN A 127 -25.522 4.043 -47.433 1.00 13.13 O ATOM 1995 NE2 GLN A 127 -26.101 2.555 -45.854 1.00 50.14 N ATOM 0 H GLN A 127 -26.798 8.420 -46.291 1.00 34.34 H new ATOM 0 HA GLN A 127 -28.646 6.420 -47.396 1.00 72.32 H new ATOM 0 HB2 GLN A 127 -26.465 5.876 -45.562 1.00 32.44 H new ATOM 0 HB3 GLN A 127 -27.995 5.626 -44.743 1.00 32.44 H new ATOM 0 HG2 GLN A 127 -28.314 3.681 -45.802 1.00 4.32 H new ATOM 0 HG3 GLN A 127 -28.153 4.450 -47.369 1.00 4.32 H new ATOM 0 HE21 GLN A 127 -26.802 2.242 -45.182 1.00 50.14 H new ATOM 0 HE22 GLN A 127 -25.222 2.047 -45.948 1.00 50.14 H new ATOM 2004 N VAL A 128 -30.435 7.231 -45.861 1.00 35.15 N ATOM 2005 CA VAL A 128 -31.511 7.861 -45.106 1.00 12.34 C ATOM 2006 C VAL A 128 -32.617 6.861 -44.785 1.00 53.01 C ATOM 2007 O VAL A 128 -33.800 7.199 -44.806 1.00 33.13 O ATOM 2008 CB VAL A 128 -32.117 9.049 -45.876 1.00 11.43 C ATOM 2009 CG1 VAL A 128 -31.052 10.096 -46.165 1.00 50.14 C ATOM 2010 CG2 VAL A 128 -32.771 8.570 -47.164 1.00 74.21 C ATOM 0 H VAL A 128 -30.746 6.532 -46.536 1.00 35.15 H new ATOM 0 HA VAL A 128 -31.073 8.225 -44.177 1.00 12.34 H new ATOM 0 HB VAL A 128 -32.885 9.510 -45.255 1.00 11.43 H new ATOM 0 HG11 VAL A 128 -31.498 10.928 -46.710 1.00 50.14 H new ATOM 0 HG12 VAL A 128 -30.635 10.459 -45.226 1.00 50.14 H new ATOM 0 HG13 VAL A 128 -30.259 9.652 -46.767 1.00 50.14 H new ATOM 0 HG21 VAL A 128 -33.194 9.422 -47.696 1.00 74.21 H new ATOM 0 HG22 VAL A 128 -32.024 8.084 -47.792 1.00 74.21 H new ATOM 0 HG23 VAL A 128 -33.563 7.860 -46.927 1.00 74.21 H new ATOM 2020 N SER A 129 -32.222 5.626 -44.489 1.00 31.10 N ATOM 2021 CA SER A 129 -33.180 4.575 -44.168 1.00 1.23 C ATOM 2022 C SER A 129 -33.403 4.485 -42.661 1.00 73.01 C ATOM 2023 O SER A 129 -32.631 3.847 -41.945 1.00 54.22 O ATOM 2024 CB SER A 129 -32.689 3.228 -44.702 1.00 63.02 C ATOM 2025 OG SER A 129 -31.600 3.399 -45.593 1.00 32.31 O ATOM 0 H SER A 129 -31.246 5.330 -44.465 1.00 31.10 H new ATOM 0 HA SER A 129 -34.128 4.824 -44.645 1.00 1.23 H new ATOM 0 HB2 SER A 129 -32.386 2.592 -43.870 1.00 63.02 H new ATOM 0 HB3 SER A 129 -33.505 2.717 -45.213 1.00 63.02 H new ATOM 0 HG SER A 129 -31.303 2.524 -45.919 1.00 32.31 H new ATOM 2031 N GLN A 130 -34.465 5.129 -42.187 1.00 52.10 N ATOM 2032 CA GLN A 130 -34.789 5.123 -40.765 1.00 61.54 C ATOM 2033 C GLN A 130 -36.299 5.130 -40.551 1.00 72.45 C ATOM 2034 O GLN A 130 -37.032 5.825 -41.255 1.00 72.31 O ATOM 2035 CB GLN A 130 -34.159 6.331 -40.071 1.00 74.54 C ATOM 2036 CG GLN A 130 -33.772 6.069 -38.625 1.00 24.42 C ATOM 2037 CD GLN A 130 -32.469 5.305 -38.498 1.00 73.15 C ATOM 2038 OE1 GLN A 130 -32.454 4.074 -38.510 1.00 11.10 O ATOM 2039 NE2 GLN A 130 -31.365 6.033 -38.375 1.00 60.01 N ATOM 0 H GLN A 130 -35.115 5.661 -42.766 1.00 52.10 H new ATOM 0 HA GLN A 130 -34.382 4.210 -40.330 1.00 61.54 H new ATOM 0 HB2 GLN A 130 -33.272 6.636 -40.626 1.00 74.54 H new ATOM 0 HB3 GLN A 130 -34.860 7.165 -40.105 1.00 74.54 H new ATOM 0 HG2 GLN A 130 -33.684 7.019 -38.099 1.00 24.42 H new ATOM 0 HG3 GLN A 130 -34.568 5.506 -38.136 1.00 24.42 H new ATOM 0 HE21 GLN A 130 -31.424 7.051 -38.370 1.00 60.01 H new ATOM 0 HE22 GLN A 130 -30.459 5.574 -38.286 1.00 60.01 H new ATOM 2048 N ASN A 131 -36.758 4.352 -39.577 1.00 64.01 N ATOM 2049 CA ASN A 131 -38.181 4.269 -39.272 1.00 2.10 C ATOM 2050 C ASN A 131 -38.404 3.954 -37.795 1.00 74.41 C ATOM 2051 O ASN A 131 -38.645 2.806 -37.424 1.00 14.11 O ATOM 2052 CB ASN A 131 -38.849 3.199 -40.138 1.00 53.33 C ATOM 2053 CG ASN A 131 -38.081 1.890 -40.133 1.00 31.52 C ATOM 2054 OD1 ASN A 131 -37.016 1.780 -40.740 1.00 43.22 O ATOM 2055 ND2 ASN A 131 -38.622 0.891 -39.445 1.00 13.34 N ATOM 0 H ASN A 131 -36.165 3.770 -38.985 1.00 64.01 H new ATOM 0 HA ASN A 131 -38.630 5.238 -39.491 1.00 2.10 H new ATOM 0 HB2 ASN A 131 -39.863 3.024 -39.777 1.00 53.33 H new ATOM 0 HB3 ASN A 131 -38.933 3.564 -41.162 1.00 53.33 H new ATOM 0 HD21 ASN A 131 -38.152 -0.014 -39.405 1.00 13.34 H new ATOM 0 HD22 ASN A 131 -39.507 1.028 -38.957 1.00 13.34 H new ATOM 2062 N TYR A 132 -38.322 4.983 -36.958 1.00 74.11 N ATOM 2063 CA TYR A 132 -38.512 4.817 -35.522 1.00 60.10 C ATOM 2064 C TYR A 132 -39.888 5.318 -35.094 1.00 11.35 C ATOM 2065 O TYR A 132 -40.821 4.533 -34.930 1.00 72.54 O ATOM 2066 CB TYR A 132 -37.422 5.564 -34.752 1.00 61.53 C ATOM 2067 CG TYR A 132 -37.419 5.272 -33.270 1.00 20.14 C ATOM 2068 CD1 TYR A 132 -37.415 3.963 -32.800 1.00 61.50 C ATOM 2069 CD2 TYR A 132 -37.421 6.302 -32.338 1.00 32.44 C ATOM 2070 CE1 TYR A 132 -37.413 3.691 -31.445 1.00 64.14 C ATOM 2071 CE2 TYR A 132 -37.417 6.038 -30.981 1.00 75.41 C ATOM 2072 CZ TYR A 132 -37.413 4.732 -30.540 1.00 3.50 C ATOM 2073 OH TYR A 132 -37.411 4.465 -29.190 1.00 52.45 O ATOM 0 H TYR A 132 -38.125 5.940 -37.250 1.00 74.11 H new ATOM 0 HA TYR A 132 -38.445 3.754 -35.292 1.00 60.10 H new ATOM 0 HB2 TYR A 132 -36.450 5.300 -35.168 1.00 61.53 H new ATOM 0 HB3 TYR A 132 -37.552 6.636 -34.902 1.00 61.53 H new ATOM 0 HD1 TYR A 132 -37.413 3.145 -33.506 1.00 61.50 H new ATOM 0 HD2 TYR A 132 -37.426 7.327 -32.679 1.00 32.44 H new ATOM 0 HE1 TYR A 132 -37.411 2.669 -31.097 1.00 64.14 H new ATOM 0 HE2 TYR A 132 -37.417 6.851 -30.270 1.00 75.41 H new ATOM 0 HH TYR A 132 -37.410 5.308 -28.690 1.00 52.45 H new TER 2083 TYR A 132