Browse entries in the PDBbind-CN Database
HEADER 6PY0_COMPLEX COMPND 6PY0_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 71 ARG TRP VAL GLN PHE MET LYS GLU ALA GLY GLN GLY SER SEQRES 2 A 71 ARG ASP MET TRP ARG ALA TYR SER ASP MET LYS LYS ALA SEQRES 3 A 71 ASN TRP LYS ASN SER ASP LYS TYR PHE HIS ALA ARG GLY SEQRES 4 A 71 ASN TYR ASP ALA ALA ARG ARG GLY PRO GLY GLY ALA TRP SEQRES 5 A 71 ALA ALA LYS VAL ILE SER ASP ALA ARG GLU ALA VAL GLN SEQRES 6 A 71 LYS PHE THR GLY HIS GLY SEQRES 1 A 30 ASP SER ARG ALA ASP GLN PHE ALA ASN GLU TRP GLY ARG SEQRES 2 A 30 SER GLY LYS ASP PRO ASN HIS PHE ARG PRO ALA GLY LEU SEQRES 3 A 30 PRO LYS ARG TYR SEQRES 1 B 70 ARG TRP VAL GLN PHE MET LYS GLU ALA GLY GLN GLY SER SEQRES 2 B 70 ARG ASP MET TRP ARG ALA TYR SER ASP MET LYS LYS ALA SEQRES 3 B 70 ASN TRP LYS ASN SER ASP LYS TYR PHE HIS ALA ARG GLY SEQRES 4 B 70 ASN TYR ASP ALA ALA ARG ARG GLY PRO GLY GLY ALA TRP SEQRES 5 B 70 ALA ALA LYS VAL ILE SER ASP ALA ARG GLU ALA VAL GLN SEQRES 6 B 70 LYS PHE THR GLY HIS SEQRES 1 B 30 ASP SER ARG ALA ASP GLN PHE ALA ASN GLU TRP GLY ARG SEQRES 2 B 30 SER GLY LYS ASP PRO ASN HIS PHE ARG PRO ALA GLY LEU SEQRES 3 B 30 PRO LYS ARG TYR SEQRES 1 C 68 ARG TRP VAL GLN PHE MET LYS GLU ALA GLY GLN GLY SER SEQRES 2 C 68 ARG ASP MET TRP ARG ALA TYR SER ASP MET LYS LYS ALA SEQRES 3 C 68 ASN TRP LYS ASN SER ASP LYS TYR PHE HIS ALA ARG GLY SEQRES 4 C 68 ASN TYR ASP ALA ALA ARG ARG GLY PRO GLY GLY ALA TRP SEQRES 5 C 68 ALA ALA LYS VAL ILE SER ASP ALA ARG GLU ALA VAL GLN SEQRES 6 C 68 LYS PHE THR SEQRES 1 C 30 ASP SER ARG ALA ASP GLN PHE ALA ASN GLU TRP GLY ARG SEQRES 2 C 30 SER GLY LYS ASP PRO ASN HIS PHE ARG PRO ALA GLY LEU SEQRES 3 C 30 PRO LYS ARG TYR HET RTL A 401 53 ATOM 1 N ARG A 20 14.663 9.699 -18.451 1.00 57.90 N ATOM 2 CA ARG A 20 15.089 9.691 -17.057 1.00 51.37 C ATOM 3 C ARG A 20 13.922 9.382 -16.126 1.00 61.40 C ATOM 4 O ARG A 20 12.941 10.124 -16.076 1.00 53.35 O ATOM 5 CB ARG A 20 15.719 11.034 -16.682 1.00 49.99 C ATOM 6 CG ARG A 20 16.345 11.060 -15.297 1.00 45.99 C ATOM 7 CD ARG A 20 17.662 10.301 -15.272 1.00 47.37 C ATOM 8 NE ARG A 20 17.474 8.891 -14.942 1.00 53.95 N ATOM 9 CZ ARG A 20 18.110 7.893 -15.545 1.00 67.90 C ATOM 10 NH1 ARG A 20 18.978 8.146 -16.515 1.00 69.21 N ATOM 11 NH2 ARG A 20 17.876 6.640 -15.180 1.00 60.75 N ATOM 12 HE ARG A 20 16.799 8.653 -14.187 1.00 0.00 H ATOM 13 HH12 ARG A 20 19.475 7.363 -16.986 1.00 0.00 H ATOM 14 HH11 ARG A 20 19.162 9.128 -16.805 1.00 0.00 H ATOM 15 HH22 ARG A 20 18.374 5.859 -15.653 1.00 0.00 H ATOM 16 HH21 ARG A 20 17.194 6.438 -14.421 1.00 0.00 H ATOM 17 HN3 ARG A 20 13.930 10.425 -18.584 1.00 0.00 H ATOM 18 HN2 ARG A 20 14.277 8.766 -18.700 1.00 0.00 H ATOM 19 HN1 ARG A 20 15.479 9.912 -19.060 1.00 0.00 H ATOM 20 N TRP A 21 14.035 8.281 -15.389 1.00 51.93 N ATOM 21 CA TRP A 21 12.992 7.873 -14.460 1.00 47.50 C ATOM 22 C TRP A 21 12.779 8.923 -13.380 1.00 46.83 C ATOM 23 O TRP A 21 11.646 9.198 -12.982 1.00 46.76 O ATOM 24 CB TRP A 21 13.335 6.529 -13.821 1.00 51.61 C ATOM 25 CG TRP A 21 12.561 5.393 -14.394 1.00 53.33 C ATOM 26 CD1 TRP A 21 12.968 4.531 -15.369 1.00 54.62 C ATOM 27 CD2 TRP A 21 11.231 4.995 -14.035 1.00 53.77 C ATOM 28 NE1 TRP A 21 11.976 3.617 -15.636 1.00 55.48 N ATOM 29 CE2 TRP A 21 10.900 3.881 -14.832 1.00 55.24 C ATOM 30 CE3 TRP A 21 10.290 5.473 -13.117 1.00 52.86 C ATOM 31 CZ2 TRP A 21 9.669 3.238 -14.737 1.00 55.72 C ATOM 32 CZ3 TRP A 21 9.069 4.832 -13.025 1.00 53.69 C ATOM 33 CH2 TRP A 21 8.770 3.727 -13.830 1.00 55.07 C ATOM 34 HE1 TRP A 21 12.034 2.850 -16.335 1.00 0.00 H ATOM 35 H TRP A 21 14.891 7.697 -15.479 1.00 0.00 H ATOM 36 N VAL A 22 13.881 9.503 -12.913 1.00 37.65 N ATOM 37 CA VAL A 22 13.842 10.556 -11.908 1.00 40.15 C ATOM 38 C VAL A 22 12.933 11.707 -12.331 1.00 42.98 C ATOM 39 O VAL A 22 12.114 12.181 -11.544 1.00 39.62 O ATOM 40 CB VAL A 22 15.255 11.101 -11.631 1.00 33.63 C ATOM 41 CG1 VAL A 22 15.190 12.315 -10.722 1.00 33.71 C ATOM 42 CG2 VAL A 22 16.124 10.019 -11.018 1.00 42.01 C ATOM 43 H VAL A 22 14.804 9.193 -13.279 1.00 0.00 H ATOM 44 N GLN A 23 13.073 12.142 -13.579 1.00 41.62 N ATOM 45 CA GLN A 23 12.257 13.230 -14.110 1.00 46.34 C ATOM 46 C GLN A 23 10.792 12.809 -14.209 1.00 40.33 C ATOM 47 O GLN A 23 9.890 13.606 -13.963 1.00 42.61 O ATOM 48 CB GLN A 23 12.777 13.669 -15.482 1.00 45.92 C ATOM 49 CG GLN A 23 11.888 14.678 -16.205 1.00 46.32 C ATOM 50 CD GLN A 23 11.837 16.029 -15.513 1.00 50.28 C ATOM 51 OE1 GLN A 23 12.762 16.410 -14.795 1.00 47.92 O ATOM 52 NE2 GLN A 23 10.750 16.761 -15.728 1.00 48.81 N ATOM 53 HE22 GLN A 23 9.993 16.399 -16.342 1.00 0.00 H ATOM 54 HE21 GLN A 23 10.656 17.696 -15.282 1.00 0.00 H ATOM 55 H GLN A 23 13.783 11.695 -14.194 1.00 0.00 H ATOM 56 N PHE A 24 10.535 11.587 -14.624 1.00 36.00 N ATOM 57 CA PHE A 24 9.186 11.083 -14.741 1.00 37.97 C ATOM 58 C PHE A 24 8.538 11.028 -13.387 1.00 36.67 C ATOM 59 O PHE A 24 7.417 11.362 -13.243 1.00 32.50 O ATOM 60 CB PHE A 24 9.189 9.703 -15.369 1.00 34.70 C ATOM 61 CG PHE A 24 7.837 9.116 -15.565 1.00 35.00 C ATOM 62 CD1 PHE A 24 7.154 9.295 -16.747 1.00 35.20 C ATOM 63 CD2 PHE A 24 7.258 8.358 -14.593 1.00 36.20 C ATOM 64 CE1 PHE A 24 5.913 8.758 -16.950 1.00 24.86 C ATOM 65 CE2 PHE A 24 6.021 7.803 -14.793 1.00 32.57 C ATOM 66 CZ PHE A 24 5.348 8.004 -15.975 1.00 26.87 C ATOM 67 H PHE A 24 11.329 10.964 -14.876 1.00 0.00 H ATOM 68 N MET A 25 9.285 10.586 -12.400 1.00 34.71 N ATOM 69 CA MET A 25 8.779 10.505 -11.051 1.00 39.48 C ATOM 70 C MET A 25 8.534 11.882 -10.487 1.00 35.99 C ATOM 71 O MET A 25 7.673 12.043 -9.675 1.00 37.87 O ATOM 72 CB MET A 25 9.688 9.669 -10.141 1.00 36.51 C ATOM 73 CG MET A 25 9.746 8.198 -10.519 1.00 39.89 C ATOM 74 SD MET A 25 8.207 7.255 -10.460 1.00 60.29 S ATOM 75 CE MET A 25 8.306 6.096 -11.808 1.00 56.05 C ATOM 76 H MET A 25 10.262 10.288 -12.596 1.00 0.00 H ATOM 77 N LYS A 26 9.280 12.869 -10.941 1.00 28.74 N ATOM 78 CA LYS A 26 9.127 14.202 -10.444 1.00 29.15 C ATOM 79 C LYS A 26 7.874 14.835 -10.994 1.00 33.21 C ATOM 80 O LYS A 26 7.194 15.519 -10.309 1.00 33.35 O ATOM 81 CB LYS A 26 10.326 15.040 -10.795 1.00 29.30 C ATOM 82 CG LYS A 26 10.553 16.245 -9.916 1.00 37.61 C ATOM 83 CD LYS A 26 11.159 17.422 -10.688 1.00 36.55 C ATOM 84 CE LYS A 26 10.602 17.560 -12.097 1.00 38.53 C ATOM 85 NZ LYS A 26 11.443 18.346 -13.031 1.00 40.90 N ATOM 86 HZ1 LYS A 26 11.560 19.311 -12.661 1.00 0.00 H ATOM 87 HZ2 LYS A 26 12.375 17.893 -13.122 1.00 0.00 H ATOM 88 HZ3 LYS A 26 10.982 18.384 -13.962 1.00 0.00 H ATOM 89 H LYS A 26 9.993 12.676 -11.673 1.00 0.00 H ATOM 90 N GLU A 27 7.601 14.595 -12.245 1.00 32.62 N ATOM 91 CA GLU A 27 6.399 15.078 -12.918 1.00 34.64 C ATOM 92 C GLU A 27 5.150 14.424 -12.330 1.00 33.81 C ATOM 93 O GLU A 27 4.128 15.080 -12.131 1.00 26.77 O ATOM 94 CB GLU A 27 6.487 14.807 -14.420 1.00 27.85 C ATOM 95 CG GLU A 27 7.615 15.561 -15.106 1.00 42.50 C ATOM 96 CD GLU A 27 8.008 14.953 -16.442 1.00 46.34 C ATOM 97 OE1 GLU A 27 7.405 13.933 -16.840 1.00 39.64 O ATOM 98 OE2 GLU A 27 8.925 15.494 -17.094 1.00 50.39 O ATOM 99 H GLU A 27 8.277 14.028 -12.795 1.00 0.00 H ATOM 100 N ALA A 28 5.249 13.129 -12.042 1.00 31.43 N ATOM 101 CA ALA A 28 4.142 12.386 -11.449 1.00 32.66 C ATOM 102 C ALA A 28 3.775 12.941 -10.080 1.00 25.08 C ATOM 103 O ALA A 28 2.599 13.027 -9.733 1.00 24.77 O ATOM 104 CB ALA A 28 4.482 10.905 -11.355 1.00 27.33 C ATOM 105 H ALA A 28 6.140 12.632 -12.245 1.00 0.00 H ATOM 106 N GLY A 29 4.786 13.317 -9.304 1.00 27.86 N ATOM 107 CA GLY A 29 4.555 13.881 -7.986 1.00 29.23 C ATOM 108 C GLY A 29 3.854 15.222 -8.086 1.00 27.82 C ATOM 109 O GLY A 29 2.924 15.508 -7.338 1.00 34.54 O ATOM 110 H GLY A 29 5.761 13.205 -9.647 1.00 0.00 H ATOM 111 N GLN A 30 4.303 16.042 -9.029 1.00 30.66 N ATOM 112 CA GLN A 30 3.700 17.347 -9.272 1.00 30.03 C ATOM 113 C GLN A 30 2.256 17.218 -9.749 1.00 24.70 C ATOM 114 O GLN A 30 1.364 17.926 -9.273 1.00 27.02 O ATOM 115 CB GLN A 30 4.509 18.110 -10.317 1.00 39.63 C ATOM 116 CG GLN A 30 5.918 18.466 -9.878 1.00 39.32 C ATOM 117 CD GLN A 30 6.707 19.149 -10.979 1.00 38.93 C ATOM 118 OE1 GLN A 30 6.737 18.682 -12.117 1.00 37.05 O ATOM 119 NE2 GLN A 30 7.344 20.265 -10.647 1.00 41.37 N ATOM 120 HE22 GLN A 30 7.291 20.624 -9.672 1.00 0.00 H ATOM 121 HE21 GLN A 30 7.896 20.781 -11.362 1.00 0.00 H ATOM 122 H GLN A 30 5.110 15.744 -9.613 1.00 0.00 H ATOM 123 N GLY A 31 2.039 16.313 -10.699 1.00 21.73 N ATOM 124 CA GLY A 31 0.720 16.080 -11.256 1.00 21.25 C ATOM 125 C GLY A 31 -0.242 15.568 -10.206 1.00 24.88 C ATOM 126 O GLY A 31 -1.413 15.938 -10.196 1.00 25.33 O ATOM 127 H GLY A 31 2.841 15.754 -11.054 1.00 0.00 H ATOM 128 N SER A 32 0.255 14.712 -9.317 1.00 18.17 N ATOM 129 CA SER A 32 -0.547 14.214 -8.205 1.00 24.45 C ATOM 130 C SER A 32 -0.988 15.365 -7.311 1.00 19.54 C ATOM 131 O SER A 32 -2.129 15.410 -6.856 1.00 19.59 O ATOM 132 CB SER A 32 0.237 13.187 -7.386 1.00 20.56 C ATOM 133 OG SER A 32 0.626 12.095 -8.193 1.00 26.06 O ATOM 134 HG SER A 32 1.199 12.420 -8.932 1.00 0.00 H ATOM 135 H SER A 32 1.239 14.390 -9.417 1.00 0.00 H ATOM 136 N ARG A 33 -0.079 16.275 -7.053 1.00 21.57 N ATOM 137 CA ARG A 33 -0.375 17.450 -6.289 1.00 19.57 C ATOM 138 C ARG A 33 -1.394 18.314 -6.989 1.00 19.82 C ATOM 139 O ARG A 33 -2.244 18.836 -6.357 1.00 25.95 O ATOM 140 CB ARG A 33 0.880 18.227 -5.939 1.00 24.50 C ATOM 141 CG ARG A 33 1.667 17.597 -4.811 1.00 30.63 C ATOM 142 CD ARG A 33 2.922 18.362 -4.394 1.00 35.76 C ATOM 143 NE ARG A 33 4.107 17.726 -4.941 1.00 46.82 N ATOM 144 CZ ARG A 33 4.919 18.277 -5.824 1.00 47.27 C ATOM 145 NH1 ARG A 33 4.716 19.511 -6.247 1.00 54.32 N ATOM 146 NH2 ARG A 33 5.942 17.595 -6.270 1.00 47.01 N ATOM 147 HE ARG A 33 4.333 16.765 -4.613 1.00 0.00 H ATOM 148 HH12 ARG A 33 5.362 19.935 -6.943 1.00 0.00 H ATOM 149 HH11 ARG A 33 3.910 20.059 -5.884 1.00 0.00 H ATOM 150 HH22 ARG A 33 6.587 18.021 -6.966 1.00 0.00 H ATOM 151 HH21 ARG A 33 6.110 16.627 -5.929 1.00 0.00 H ATOM 152 H ARG A 33 0.887 16.139 -7.414 1.00 0.00 H ATOM 153 N ASP A 34 -1.317 18.429 -8.308 1.00 20.72 N ATOM 154 CA ASP A 34 -2.298 19.169 -9.088 1.00 17.94 C ATOM 155 C ASP A 34 -3.657 18.532 -8.987 1.00 16.96 C ATOM 156 O ASP A 34 -4.623 19.178 -8.904 1.00 20.04 O ATOM 157 CB ASP A 34 -1.920 19.275 -10.564 1.00 21.68 C ATOM 158 CG ASP A 34 -0.684 20.110 -10.805 1.00 29.83 C ATOM 159 OD1 ASP A 34 -0.465 21.054 -10.083 1.00 27.07 O ATOM 160 OD2 ASP A 34 0.065 19.804 -11.708 1.00 23.55 O ATOM 161 H ASP A 34 -0.525 17.973 -8.804 1.00 0.00 H ATOM 162 N MET A 35 -3.689 17.225 -8.995 1.00 17.03 N ATOM 163 CA MET A 35 -4.909 16.493 -8.770 1.00 17.70 C ATOM 164 C MET A 35 -5.470 16.750 -7.341 1.00 20.94 C ATOM 165 O MET A 35 -6.643 17.017 -7.209 1.00 20.43 O ATOM 166 CB MET A 35 -4.747 15.012 -9.109 1.00 19.21 C ATOM 167 CG MET A 35 -4.534 14.694 -10.585 1.00 15.73 C ATOM 168 SD MET A 35 -5.783 15.120 -11.757 1.00 17.78 S ATOM 169 CE MET A 35 -7.060 14.002 -11.300 1.00 21.85 C ATOM 170 H MET A 35 -2.809 16.699 -9.169 1.00 0.00 H ATOM 171 N TRP A 36 -4.635 16.707 -6.309 1.00 18.82 N ATOM 172 CA TRP A 36 -5.135 16.918 -4.974 1.00 25.29 C ATOM 173 C TRP A 36 -5.595 18.335 -4.816 1.00 19.31 C ATOM 174 O TRP A 36 -6.497 18.582 -4.126 1.00 22.47 O ATOM 175 CB TRP A 36 -4.167 16.517 -3.881 1.00 19.83 C ATOM 176 CG TRP A 36 -3.523 15.184 -4.035 1.00 25.88 C ATOM 177 CD1 TRP A 36 -2.244 14.907 -3.822 1.00 25.29 C ATOM 178 CD2 TRP A 36 -4.128 13.969 -4.409 1.00 22.48 C ATOM 179 NE1 TRP A 36 -1.990 13.624 -4.059 1.00 26.51 N ATOM 180 CE2 TRP A 36 -3.141 13.017 -4.427 1.00 23.28 C ATOM 181 CE3 TRP A 36 -5.409 13.601 -4.777 1.00 27.35 C ATOM 182 CZ2 TRP A 36 -3.383 11.721 -4.760 1.00 25.40 C ATOM 183 CZ3 TRP A 36 -5.638 12.329 -5.104 1.00 25.98 C ATOM 184 CH2 TRP A 36 -4.639 11.398 -5.088 1.00 26.75 C ATOM 185 HE1 TRP A 36 -1.061 13.164 -3.975 1.00 0.00 H ATOM 186 H TRP A 36 -3.623 16.522 -6.464 1.00 0.00 H ATOM 187 N ARG A 37 -4.987 19.238 -5.535 1.00 15.74 N ATOM 188 CA ARG A 37 -5.322 20.652 -5.449 1.00 22.78 C ATOM 189 C ARG A 37 -6.691 20.922 -6.075 1.00 19.82 C ATOM 190 O ARG A 37 -7.474 21.716 -5.556 1.00 23.20 O ATOM 191 CB ARG A 37 -4.240 21.500 -6.116 1.00 22.74 C ATOM 192 CG ARG A 37 -4.379 22.995 -5.885 1.00 26.49 C ATOM 193 CD ARG A 37 -3.052 23.714 -6.142 1.00 31.38 C ATOM 194 NE ARG A 37 -2.399 23.259 -7.368 1.00 33.31 N ATOM 195 CZ ARG A 37 -2.751 23.651 -8.588 1.00 27.02 C ATOM 196 NH1 ARG A 37 -3.758 24.499 -8.747 1.00 29.33 N ATOM 197 NH2 ARG A 37 -2.105 23.189 -9.649 1.00 27.88 N ATOM 198 HE ARG A 37 -1.610 22.587 -7.280 1.00 0.00 H ATOM 199 HH12 ARG A 37 -4.034 24.806 -9.702 1.00 0.00 H ATOM 200 HH11 ARG A 37 -4.272 24.857 -7.917 1.00 0.00 H ATOM 201 HH22 ARG A 37 -2.383 23.498 -10.602 1.00 0.00 H ATOM 202 HH21 ARG A 37 -1.320 22.518 -9.528 1.00 0.00 H ATOM 203 H ARG A 37 -4.238 18.938 -6.191 1.00 0.00 H ATOM 204 N ALA A 38 -6.972 20.250 -7.186 1.00 17.96 N ATOM 205 CA ALA A 38 -8.265 20.367 -7.849 1.00 13.35 C ATOM 206 C ALA A 38 -9.392 19.860 -6.956 1.00 15.42 C ATOM 207 O ALA A 38 -10.411 20.524 -6.797 1.00 22.27 O ATOM 208 CB ALA A 38 -8.259 19.615 -9.160 1.00 10.09 C ATOM 209 H ALA A 38 -6.249 19.623 -7.594 1.00 0.00 H ATOM 210 N TYR A 39 -9.211 18.672 -6.391 1.00 17.95 N ATOM 211 CA TYR A 39 -10.204 18.098 -5.489 1.00 21.26 C ATOM 212 C TYR A 39 -10.405 18.994 -4.265 1.00 17.86 C ATOM 213 O TYR A 39 -11.525 19.194 -3.802 1.00 23.65 O ATOM 214 CB TYR A 39 -9.791 16.689 -5.056 1.00 21.06 C ATOM 215 CG TYR A 39 -9.770 15.663 -6.185 1.00 24.50 C ATOM 216 CD1 TYR A 39 -10.608 15.786 -7.291 1.00 27.19 C ATOM 217 CD2 TYR A 39 -8.917 14.569 -6.136 1.00 18.71 C ATOM 218 CE1 TYR A 39 -10.592 14.842 -8.320 1.00 24.20 C ATOM 219 CE2 TYR A 39 -8.889 13.625 -7.150 1.00 19.26 C ATOM 220 CZ TYR A 39 -9.721 13.763 -8.240 1.00 26.06 C ATOM 221 OH TYR A 39 -9.677 12.812 -9.236 1.00 22.90 O ATOM 222 HH TYR A 39 -10.327 13.048 -9.945 1.00 0.00 H ATOM 223 H TYR A 39 -8.342 18.139 -6.596 1.00 0.00 H ATOM 224 N SER A 40 -9.311 19.543 -3.757 1.00 21.42 N ATOM 225 CA SER A 40 -9.369 20.431 -2.607 1.00 23.93 C ATOM 226 C SER A 40 -10.108 21.713 -2.968 1.00 29.97 C ATOM 227 O SER A 40 -10.928 22.205 -2.191 1.00 21.94 O ATOM 228 CB SER A 40 -7.960 20.756 -2.127 1.00 19.16 C ATOM 229 OG SER A 40 -7.994 21.665 -1.045 1.00 38.03 O ATOM 230 HG SER A 40 -7.069 21.861 -0.751 1.00 0.00 H ATOM 231 H SER A 40 -8.389 19.334 -4.191 1.00 0.00 H ATOM 232 N ASP A 41 -9.814 22.249 -4.148 1.00 20.03 N ATOM 233 CA ASP A 41 -10.458 23.470 -4.617 1.00 22.90 C ATOM 234 C ASP A 41 -11.956 23.258 -4.802 1.00 22.18 C ATOM 235 O ASP A 41 -12.762 24.126 -4.468 1.00 19.92 O ATOM 236 CB ASP A 41 -9.826 23.940 -5.928 1.00 18.56 C ATOM 237 CG ASP A 41 -8.624 24.836 -5.708 1.00 21.86 C ATOM 238 OD1 ASP A 41 -8.386 25.240 -4.550 1.00 20.27 O ATOM 239 OD2 ASP A 41 -7.916 25.136 -6.693 1.00 19.24 O ATOM 240 H ASP A 41 -9.106 21.785 -4.753 1.00 0.00 H ATOM 241 N MET A 42 -12.316 22.096 -5.309 1.00 21.76 N ATOM 242 CA MET A 42 -13.686 21.688 -5.532 1.00 22.32 C ATOM 243 C MET A 42 -14.467 21.666 -4.227 1.00 28.68 C ATOM 244 O MET A 42 -15.625 22.050 -4.165 1.00 26.26 O ATOM 245 CB MET A 42 -13.740 20.327 -6.228 1.00 16.04 C ATOM 246 CG MET A 42 -15.096 19.688 -6.264 1.00 21.33 C ATOM 247 SD MET A 42 -15.281 18.252 -7.333 1.00 39.12 S ATOM 248 CE MET A 42 -13.850 17.323 -6.991 1.00 27.62 C ATOM 249 H MET A 42 -11.563 21.426 -5.567 1.00 0.00 H ATOM 250 N LYS A 43 -13.793 21.236 -3.192 1.00 22.72 N ATOM 251 CA LYS A 43 -14.395 21.124 -1.869 1.00 25.61 C ATOM 252 C LYS A 43 -14.635 22.501 -1.260 1.00 21.36 C ATOM 253 O LYS A 43 -15.717 22.782 -0.745 1.00 26.92 O ATOM 254 CB LYS A 43 -13.506 20.288 -0.945 1.00 29.72 C ATOM 255 CG LYS A 43 -14.206 19.087 -0.331 1.00 33.51 C ATOM 256 CD LYS A 43 -14.369 17.965 -1.343 1.00 30.22 C ATOM 257 CE LYS A 43 -15.833 17.732 -1.678 1.00 30.33 C ATOM 258 NZ LYS A 43 -16.005 17.143 -3.034 1.00 31.11 N ATOM 259 HZ1 LYS A 43 -15.607 17.790 -3.745 1.00 0.00 H ATOM 260 HZ2 LYS A 43 -15.511 16.229 -3.079 1.00 0.00 H ATOM 261 HZ3 LYS A 43 -17.018 17.000 -3.223 1.00 0.00 H ATOM 262 H LYS A 43 -12.797 20.966 -3.317 1.00 0.00 H ATOM 263 N LYS A 44 -13.640 23.344 -1.328 1.00 23.74 N ATOM 264 CA LYS A 44 -13.714 24.673 -0.807 1.00 26.20 C ATOM 265 C LYS A 44 -14.770 25.490 -1.517 1.00 31.31 C ATOM 266 O LYS A 44 -15.538 26.134 -0.883 1.00 33.13 O ATOM 267 CB LYS A 44 -12.383 25.369 -0.909 1.00 22.58 C ATOM 268 CG LYS A 44 -11.412 24.992 0.146 1.00 34.20 C ATOM 269 CD LYS A 44 -10.283 25.974 0.248 1.00 36.03 C ATOM 270 CE LYS A 44 -9.006 25.382 -0.281 1.00 48.13 C ATOM 271 NZ LYS A 44 -7.890 25.567 0.664 1.00 45.60 N ATOM 272 HZ1 LYS A 44 -7.739 26.583 0.826 1.00 0.00 H ATOM 273 HZ2 LYS A 44 -8.120 25.102 1.565 1.00 0.00 H ATOM 274 HZ3 LYS A 44 -7.026 25.146 0.265 1.00 0.00 H ATOM 275 H LYS A 44 -12.756 23.035 -1.781 1.00 0.00 H ATOM 276 N ALA A 45 -14.815 25.385 -2.829 1.00 27.87 N ATOM 277 CA ALA A 45 -15.729 26.146 -3.642 1.00 30.89 C ATOM 278 C ALA A 45 -17.164 25.780 -3.386 1.00 30.28 C ATOM 279 O ALA A 45 -17.998 26.621 -3.373 1.00 23.87 O ATOM 280 CB ALA A 45 -15.396 25.997 -5.107 1.00 20.17 C ATOM 281 H ALA A 45 -14.163 24.725 -3.298 1.00 0.00 H ATOM 282 N ASN A 46 -17.407 24.505 -3.169 1.00 27.13 N ATOM 283 CA ASN A 46 -18.730 23.942 -3.020 1.00 25.48 C ATOM 284 C ASN A 46 -19.728 24.575 -3.953 1.00 28.85 C ATOM 285 O ASN A 46 -20.708 25.081 -3.543 1.00 30.97 O ATOM 286 CB ASN A 46 -19.204 24.025 -1.563 1.00 38.19 C ATOM 287 CG ASN A 46 -20.463 23.231 -1.304 1.00 41.78 C ATOM 288 OD1 ASN A 46 -20.637 22.157 -1.801 1.00 39.88 O ATOM 289 ND2 ASN A 46 -21.347 23.789 -0.548 1.00 40.88 N ATOM 290 HD22 ASN A 46 -21.161 24.724 -0.133 1.00 0.00 H ATOM 291 HD21 ASN A 46 -22.246 23.304 -0.354 1.00 0.00 H ATOM 292 H ASN A 46 -16.594 23.860 -3.100 1.00 0.00 H ATOM 293 N TRP A 47 -19.421 24.545 -5.223 1.00 26.95 N ATOM 294 CA TRP A 47 -20.170 25.248 -6.199 1.00 21.50 C ATOM 295 C TRP A 47 -20.923 24.284 -7.042 1.00 36.90 C ATOM 296 O TRP A 47 -20.419 23.296 -7.466 1.00 38.42 O ATOM 297 CB TRP A 47 -19.250 26.083 -7.057 1.00 31.99 C ATOM 298 CG TRP A 47 -19.905 27.212 -7.713 1.00 31.95 C ATOM 299 CD1 TRP A 47 -20.651 27.169 -8.801 1.00 31.15 C ATOM 300 CD2 TRP A 47 -19.887 28.562 -7.292 1.00 30.76 C ATOM 301 NE1 TRP A 47 -21.102 28.399 -9.119 1.00 34.44 N ATOM 302 CE2 TRP A 47 -20.637 29.284 -8.205 1.00 32.13 C ATOM 303 CE3 TRP A 47 -19.295 29.227 -6.239 1.00 25.76 C ATOM 304 CZ2 TRP A 47 -20.818 30.613 -8.101 1.00 30.59 C ATOM 305 CZ3 TRP A 47 -19.460 30.535 -6.142 1.00 38.00 C ATOM 306 CH2 TRP A 47 -20.222 31.236 -7.063 1.00 33.29 C ATOM 307 HE1 TRP A 47 -21.707 28.630 -9.932 1.00 0.00 H ATOM 308 H TRP A 47 -18.599 23.986 -5.528 1.00 0.00 H ATOM 309 N LYS A 48 -22.155 24.639 -7.329 1.00 43.74 N ATOM 310 CA LYS A 48 -23.038 23.766 -8.059 1.00 44.62 C ATOM 311 C LYS A 48 -22.606 23.511 -9.478 1.00 45.32 C ATOM 312 O LYS A 48 -22.184 24.420 -10.151 1.00 44.00 O ATOM 313 CB LYS A 48 -24.453 24.299 -8.026 1.00 46.85 C ATOM 314 CG LYS A 48 -25.411 23.358 -7.313 1.00 44.19 C ATOM 315 CD LYS A 48 -24.787 22.722 -6.061 1.00 43.34 C ATOM 316 CE LYS A 48 -24.970 23.587 -4.817 1.00 41.95 C ATOM 317 NZ LYS A 48 -23.876 24.560 -4.603 1.00 39.18 N ATOM 318 HZ1 LYS A 48 -22.976 24.050 -4.497 1.00 0.00 H ATOM 319 HZ2 LYS A 48 -23.818 25.200 -5.420 1.00 0.00 H ATOM 320 HZ3 LYS A 48 -24.067 25.111 -3.742 1.00 0.00 H ATOM 321 H LYS A 48 -22.500 25.571 -7.022 1.00 0.00 H ATOM 322 N ASN A 49 -22.694 22.255 -9.896 1.00 43.01 N ATOM 323 CA ASN A 49 -22.313 21.877 -11.256 1.00 41.80 C ATOM 324 C ASN A 49 -20.861 22.200 -11.603 1.00 33.31 C ATOM 325 O ASN A 49 -20.572 22.635 -12.716 1.00 33.34 O ATOM 326 CB ASN A 49 -23.256 22.516 -12.283 1.00 38.04 C ATOM 327 CG ASN A 49 -24.688 22.053 -12.124 1.00 47.32 C ATOM 328 OD1 ASN A 49 -24.946 20.878 -11.857 1.00 56.39 O ATOM 329 ND2 ASN A 49 -25.631 22.977 -12.283 1.00 46.12 N ATOM 330 HD22 ASN A 49 -25.366 23.957 -12.508 1.00 0.00 H ATOM 331 HD21 ASN A 49 -26.634 22.719 -12.182 1.00 0.00 H ATOM 332 H ASN A 49 -23.041 21.524 -9.243 1.00 0.00 H ATOM 333 N SER A 50 -19.953 21.972 -10.659 1.00 27.35 N ATOM 334 CA SER A 50 -18.560 22.374 -10.841 1.00 29.96 C ATOM 335 C SER A 50 -17.549 21.231 -10.916 1.00 22.80 C ATOM 336 O SER A 50 -16.377 21.477 -11.197 1.00 24.38 O ATOM 337 CB SER A 50 -18.128 23.350 -9.740 1.00 31.97 C ATOM 338 OG SER A 50 -17.793 22.664 -8.546 1.00 24.16 O ATOM 339 HG SER A 50 -17.519 23.319 -7.856 1.00 0.00 H ATOM 340 H SER A 50 -20.239 21.500 -9.777 1.00 0.00 H ATOM 341 N ASP A 51 -17.978 19.995 -10.668 1.00 24.84 N ATOM 342 CA ASP A 51 -17.020 18.884 -10.613 1.00 26.54 C ATOM 343 C ASP A 51 -16.299 18.622 -11.928 1.00 23.95 C ATOM 344 O ASP A 51 -15.096 18.364 -11.921 1.00 25.54 O ATOM 345 CB ASP A 51 -17.638 17.580 -10.091 1.00 31.33 C ATOM 346 CG ASP A 51 -19.083 17.727 -9.706 1.00 44.48 C ATOM 347 OD1 ASP A 51 -19.947 17.422 -10.555 1.00 58.77 O ATOM 348 OD2 ASP A 51 -19.353 18.127 -8.553 1.00 50.63 O ATOM 349 H ASP A 51 -18.991 19.817 -10.513 1.00 0.00 H ATOM 350 N LYS A 52 -17.032 18.675 -13.021 1.00 24.92 N ATOM 351 CA LYS A 52 -16.459 18.422 -14.310 1.00 22.28 C ATOM 352 C LYS A 52 -15.300 19.417 -14.552 1.00 21.96 C ATOM 353 O LYS A 52 -14.304 19.035 -15.066 1.00 23.45 O ATOM 354 CB LYS A 52 -17.501 18.516 -15.412 1.00 25.27 C ATOM 355 CG LYS A 52 -18.260 17.272 -15.810 1.00 31.43 C ATOM 356 CD LYS A 52 -18.457 16.297 -14.680 1.00 36.07 C ATOM 357 CE LYS A 52 -19.737 15.508 -14.800 1.00 43.89 C ATOM 358 NZ LYS A 52 -20.815 16.031 -13.944 1.00 49.80 N ATOM 359 HZ1 LYS A 52 -20.513 15.997 -12.949 1.00 0.00 H ATOM 360 HZ2 LYS A 52 -21.022 17.014 -14.211 1.00 0.00 H ATOM 361 HZ3 LYS A 52 -21.668 15.449 -14.069 1.00 0.00 H ATOM 362 H LYS A 52 -18.044 18.904 -12.947 1.00 0.00 H ATOM 363 N TYR A 53 -15.451 20.662 -14.134 1.00 14.81 N ATOM 364 CA TYR A 53 -14.411 21.676 -14.251 1.00 17.08 C ATOM 365 C TYR A 53 -13.169 21.252 -13.490 1.00 15.24 C ATOM 366 O TYR A 53 -12.075 21.198 -14.047 1.00 18.22 O ATOM 367 CB TYR A 53 -14.879 23.039 -13.738 1.00 18.17 C ATOM 368 CG TYR A 53 -13.740 24.044 -13.690 1.00 21.16 C ATOM 369 CD1 TYR A 53 -13.245 24.614 -14.856 1.00 20.74 C ATOM 370 CD2 TYR A 53 -13.142 24.396 -12.485 1.00 17.91 C ATOM 371 CE1 TYR A 53 -12.193 25.518 -14.825 1.00 19.50 C ATOM 372 CE2 TYR A 53 -12.088 25.298 -12.443 1.00 21.44 C ATOM 373 CZ TYR A 53 -11.618 25.854 -13.619 1.00 16.84 C ATOM 374 OH TYR A 53 -10.574 26.747 -13.584 1.00 16.16 O ATOM 375 HH TYR A 53 -10.828 27.529 -13.032 1.00 0.00 H ATOM 376 H TYR A 53 -16.357 20.931 -13.700 1.00 0.00 H ATOM 377 N PHE A 54 -13.345 20.939 -12.210 1.00 16.28 N ATOM 378 CA PHE A 54 -12.216 20.564 -11.366 1.00 15.39 C ATOM 379 C PHE A 54 -11.566 19.255 -11.801 1.00 12.69 C ATOM 380 O PHE A 54 -10.345 19.120 -11.749 1.00 17.08 O ATOM 381 CB PHE A 54 -12.632 20.527 -9.896 1.00 15.69 C ATOM 382 CG PHE A 54 -12.909 21.886 -9.328 1.00 18.23 C ATOM 383 CD1 PHE A 54 -11.871 22.772 -9.098 1.00 19.14 C ATOM 384 CD2 PHE A 54 -14.204 22.286 -9.042 1.00 14.54 C ATOM 385 CE1 PHE A 54 -12.119 24.035 -8.582 1.00 22.69 C ATOM 386 CE2 PHE A 54 -14.457 23.543 -8.519 1.00 16.25 C ATOM 387 CZ PHE A 54 -13.411 24.420 -8.291 1.00 16.04 C ATOM 388 H PHE A 54 -14.302 20.962 -11.804 1.00 0.00 H ATOM 389 N HIS A 55 -12.380 18.302 -12.240 1.00 17.88 N ATOM 390 CA HIS A 55 -11.859 17.081 -12.836 1.00 19.41 C ATOM 391 C HIS A 55 -11.004 17.437 -14.048 1.00 19.22 C ATOM 392 O HIS A 55 -9.869 16.972 -14.173 1.00 16.91 O ATOM 393 CB HIS A 55 -12.999 16.148 -13.240 1.00 18.49 C ATOM 394 CG HIS A 55 -13.721 15.539 -12.077 1.00 25.58 C ATOM 395 ND1 HIS A 55 -15.074 15.274 -12.096 1.00 27.94 N ATOM 396 CD2 HIS A 55 -13.277 15.142 -10.861 1.00 22.25 C ATOM 397 CE1 HIS A 55 -15.433 14.742 -10.942 1.00 27.93 C ATOM 398 NE2 HIS A 55 -14.361 14.650 -10.175 1.00 28.39 N ATOM 399 H HIS A 55 -13.409 18.431 -12.156 1.00 0.00 H ATOM 400 N ALA A 56 -11.549 18.281 -14.923 1.00 20.68 N ATOM 401 CA ALA A 56 -10.844 18.717 -16.128 1.00 22.79 C ATOM 402 C ALA A 56 -9.602 19.518 -15.770 1.00 17.52 C ATOM 403 O ALA A 56 -8.543 19.312 -16.353 1.00 19.95 O ATOM 404 CB ALA A 56 -11.769 19.548 -17.034 1.00 14.58 C ATOM 405 H ALA A 56 -12.508 18.642 -14.743 1.00 0.00 H ATOM 406 N ARG A 57 -9.733 20.417 -14.798 1.00 15.79 N ATOM 407 CA ARG A 57 -8.633 21.313 -14.444 1.00 16.07 C ATOM 408 C ARG A 57 -7.473 20.552 -13.838 1.00 16.23 C ATOM 409 O ARG A 57 -6.318 20.831 -14.142 1.00 22.62 O ATOM 410 CB ARG A 57 -9.086 22.397 -13.464 1.00 12.52 C ATOM 411 CG ARG A 57 -8.147 23.601 -13.397 1.00 18.85 C ATOM 412 CD ARG A 57 -8.347 24.399 -12.108 1.00 19.51 C ATOM 413 NE ARG A 57 -7.679 23.770 -10.973 1.00 17.77 N ATOM 414 CZ ARG A 57 -7.797 24.175 -9.710 1.00 21.58 C ATOM 415 NH1 ARG A 57 -8.563 25.215 -9.405 1.00 14.76 N ATOM 416 NH2 ARG A 57 -7.151 23.539 -8.743 1.00 15.67 N ATOM 417 HE ARG A 57 -7.069 22.949 -11.164 1.00 0.00 H ATOM 418 HH12 ARG A 57 -8.650 25.525 -8.416 1.00 0.00 H ATOM 419 HH11 ARG A 57 -9.077 25.720 -10.155 1.00 0.00 H ATOM 420 HH22 ARG A 57 -7.245 23.858 -7.758 1.00 0.00 H ATOM 421 HH21 ARG A 57 -6.550 22.721 -8.970 1.00 0.00 H ATOM 422 H ARG A 57 -10.633 20.484 -14.281 1.00 0.00 H ATOM 423 N GLY A 58 -7.783 19.601 -12.964 1.00 17.72 N ATOM 424 CA GLY A 58 -6.754 18.790 -12.342 1.00 13.70 C ATOM 425 C GLY A 58 -5.951 18.008 -13.363 1.00 16.82 C ATOM 426 O GLY A 58 -4.726 17.957 -13.296 1.00 21.19 O ATOM 427 H GLY A 58 -8.781 19.435 -12.722 1.00 0.00 H ATOM 428 N ASN A 59 -6.640 17.391 -14.315 1.00 18.10 N ATOM 429 CA ASN A 59 -5.963 16.657 -15.381 1.00 25.33 C ATOM 430 C ASN A 59 -5.168 17.574 -16.306 1.00 20.50 C ATOM 431 O ASN A 59 -4.082 17.215 -16.759 1.00 21.01 O ATOM 432 CB ASN A 59 -6.958 15.829 -16.189 1.00 18.12 C ATOM 433 CG ASN A 59 -7.270 14.493 -15.536 1.00 26.20 C ATOM 434 OD1 ASN A 59 -6.583 13.501 -15.776 1.00 22.96 O ATOM 435 ND2 ASN A 59 -8.313 14.462 -14.710 1.00 19.13 N ATOM 436 HD22 ASN A 59 -8.865 15.326 -14.537 1.00 0.00 H ATOM 437 HD21 ASN A 59 -8.576 13.574 -14.237 1.00 0.00 H ATOM 438 H ASN A 59 -7.679 17.431 -14.302 1.00 0.00 H ATOM 439 N TYR A 60 -5.712 18.757 -16.578 1.00 16.60 N ATOM 440 CA TYR A 60 -5.020 19.748 -17.404 1.00 22.36 C ATOM 441 C TYR A 60 -3.690 20.172 -16.778 1.00 23.84 C ATOM 442 O TYR A 60 -2.634 20.057 -17.398 1.00 30.16 O ATOM 443 CB TYR A 60 -5.918 20.967 -17.636 1.00 23.13 C ATOM 444 CG TYR A 60 -5.327 22.017 -18.550 1.00 23.96 C ATOM 445 CD1 TYR A 60 -5.379 21.875 -19.930 1.00 29.38 C ATOM 446 CD2 TYR A 60 -4.722 23.152 -18.031 1.00 25.55 C ATOM 447 CE1 TYR A 60 -4.839 22.832 -20.767 1.00 29.80 C ATOM 448 CE2 TYR A 60 -4.184 24.116 -18.861 1.00 34.32 C ATOM 449 CZ TYR A 60 -4.241 23.949 -20.228 1.00 36.43 C ATOM 450 OH TYR A 60 -3.705 24.904 -21.060 1.00 42.42 O ATOM 451 HH TYR A 60 -3.831 24.628 -22.002 1.00 0.00 H ATOM 452 H TYR A 60 -6.652 18.983 -16.195 1.00 0.00 H ATOM 453 N ASP A 61 -3.753 20.651 -15.542 1.00 26.36 N ATOM 454 CA ASP A 61 -2.563 21.069 -14.822 1.00 18.39 C ATOM 455 C ASP A 61 -1.565 19.924 -14.685 1.00 23.42 C ATOM 456 O ASP A 61 -0.354 20.133 -14.764 1.00 25.76 O ATOM 457 CB ASP A 61 -2.938 21.590 -13.440 1.00 19.45 C ATOM 458 CG ASP A 61 -3.783 22.848 -13.496 1.00 26.12 C ATOM 459 OD1 ASP A 61 -3.846 23.488 -14.570 1.00 29.00 O ATOM 460 OD2 ASP A 61 -4.376 23.202 -12.451 1.00 22.28 O ATOM 461 H ASP A 61 -4.680 20.729 -15.076 1.00 0.00 H ATOM 462 N ALA A 62 -2.077 18.714 -14.484 1.00 19.18 N ATOM 463 CA ALA A 62 -1.216 17.552 -14.303 1.00 18.94 C ATOM 464 C ALA A 62 -0.468 17.184 -15.584 1.00 24.51 C ATOM 465 O ALA A 62 0.744 16.972 -15.563 1.00 27.00 O ATOM 466 CB ALA A 62 -2.024 16.363 -13.802 1.00 17.17 C ATOM 467 H ALA A 62 -3.110 18.594 -14.455 1.00 0.00 H ATOM 468 N ALA A 63 -1.198 17.105 -16.694 1.00 23.47 N ATOM 469 CA ALA A 63 -0.609 16.745 -17.980 1.00 28.20 C ATOM 470 C ALA A 63 0.491 17.729 -18.368 1.00 30.23 C ATOM 471 O ALA A 63 1.511 17.340 -18.933 1.00 34.16 O ATOM 472 CB ALA A 63 -1.677 16.688 -19.056 1.00 15.51 C ATOM 473 H ALA A 63 -2.217 17.306 -16.644 1.00 0.00 H ATOM 474 N ARG A 64 0.323 18.986 -18.017 1.00 27.00 N ATOM 475 CA ARG A 64 1.261 20.032 -18.339 1.00 29.76 C ATOM 476 C ARG A 64 2.586 19.856 -17.672 1.00 41.57 C ATOM 477 O ARG A 64 3.546 20.423 -18.087 1.00 46.19 O ATOM 478 CB ARG A 64 0.704 21.404 -18.011 1.00 30.04 C ATOM 479 CG ARG A 64 -0.119 22.002 -19.115 1.00 35.74 C ATOM 480 CD ARG A 64 -0.784 23.306 -18.728 1.00 41.93 C ATOM 481 NE ARG A 64 0.145 24.432 -18.647 1.00 59.06 N ATOM 482 CZ ARG A 64 0.160 25.455 -19.487 1.00 54.15 C ATOM 483 NH1 ARG A 64 -0.699 25.515 -20.466 1.00 56.81 N ATOM 484 NH2 ARG A 64 1.038 26.414 -19.351 1.00 47.55 N ATOM 485 HE ARG A 64 0.843 24.429 -17.876 1.00 0.00 H ATOM 486 HH12 ARG A 64 -0.683 26.321 -21.123 1.00 0.00 H ATOM 487 HH11 ARG A 64 -1.400 24.757 -20.590 1.00 0.00 H ATOM 488 HH22 ARG A 64 1.042 27.214 -20.016 1.00 0.00 H ATOM 489 HH21 ARG A 64 1.733 26.377 -18.578 1.00 0.00 H ATOM 490 H ARG A 64 -0.531 19.238 -17.479 1.00 0.00 H ATOM 491 N ARG A 65 2.635 19.043 -16.646 1.00 32.30 N ATOM 492 CA ARG A 65 3.881 18.803 -15.929 1.00 37.41 C ATOM 493 C ARG A 65 4.863 17.995 -16.762 1.00 34.13 C ATOM 494 O ARG A 65 6.072 18.046 -16.537 1.00 39.93 O ATOM 495 CB ARG A 65 3.606 18.058 -14.627 1.00 27.67 C ATOM 496 CG ARG A 65 2.708 18.808 -13.675 1.00 27.12 C ATOM 497 CD ARG A 65 3.350 20.116 -13.252 1.00 33.65 C ATOM 498 NE ARG A 65 2.587 20.783 -12.202 1.00 33.62 N ATOM 499 CZ ARG A 65 3.033 21.820 -11.499 1.00 44.20 C ATOM 500 NH1 ARG A 65 4.244 22.310 -11.731 1.00 41.27 N ATOM 501 NH2 ARG A 65 2.269 22.364 -10.559 1.00 47.06 N ATOM 502 HE ARG A 65 1.634 20.425 -11.990 1.00 0.00 H ATOM 503 HH12 ARG A 65 4.591 23.121 -11.180 1.00 0.00 H ATOM 504 HH11 ARG A 65 4.846 21.883 -12.464 1.00 0.00 H ATOM 505 HH22 ARG A 65 2.619 23.175 -10.010 1.00 0.00 H ATOM 506 HH21 ARG A 65 1.321 21.979 -10.372 1.00 0.00 H ATOM 507 H ARG A 65 1.768 18.559 -16.337 1.00 0.00 H ATOM 508 N GLY A 66 4.334 17.242 -17.718 1.00 36.37 N ATOM 509 CA GLY A 66 5.121 16.288 -18.472 1.00 35.08 C ATOM 510 C GLY A 66 4.435 14.938 -18.432 1.00 41.08 C ATOM 511 O GLY A 66 3.417 14.783 -17.762 1.00 38.10 O ATOM 512 H GLY A 66 3.321 17.340 -17.933 1.00 0.00 H ATOM 513 N PRO A 67 4.992 13.951 -19.148 1.00 43.82 N ATOM 514 CA PRO A 67 4.430 12.597 -19.244 1.00 36.59 C ATOM 515 C PRO A 67 4.160 11.943 -17.886 1.00 29.72 C ATOM 516 O PRO A 67 3.187 11.201 -17.745 1.00 26.69 O ATOM 517 CB PRO A 67 5.519 11.829 -19.992 1.00 36.94 C ATOM 518 CG PRO A 67 6.198 12.873 -20.818 1.00 40.79 C ATOM 519 CD PRO A 67 6.213 14.098 -19.958 1.00 34.88 C ATOM 520 N GLY A 68 5.014 12.208 -16.904 1.00 28.30 N ATOM 521 CA GLY A 68 4.818 11.654 -15.578 1.00 31.99 C ATOM 522 C GLY A 68 3.555 12.203 -14.948 1.00 32.42 C ATOM 523 O GLY A 68 2.850 11.501 -14.225 1.00 31.34 O ATOM 524 H GLY A 68 5.834 12.821 -17.088 1.00 0.00 H ATOM 525 N GLY A 69 3.262 13.467 -15.235 1.00 27.68 N ATOM 526 CA GLY A 69 2.076 14.115 -14.710 1.00 27.71 C ATOM 527 C GLY A 69 0.798 13.608 -15.352 1.00 30.16 C ATOM 528 O GLY A 69 -0.183 13.342 -14.659 1.00 30.47 O ATOM 529 H GLY A 69 3.901 14.006 -15.853 1.00 0.00 H ATOM 530 N ALA A 70 0.809 13.484 -16.676 1.00 21.37 N ATOM 531 CA ALA A 70 -0.341 12.970 -17.407 1.00 25.64 C ATOM 532 C ALA A 70 -0.654 11.568 -16.922 1.00 23.91 C ATOM 533 O ALA A 70 -1.815 11.195 -16.745 1.00 30.17 O ATOM 534 CB ALA A 70 -0.058 12.962 -18.902 1.00 28.13 C ATOM 535 H ALA A 70 1.661 13.761 -17.203 1.00 0.00 H ATOM 536 N TRP A 71 0.401 10.796 -16.698 1.00 27.46 N ATOM 537 CA TRP A 71 0.259 9.424 -16.238 1.00 28.59 C ATOM 538 C TRP A 71 -0.342 9.355 -14.837 1.00 30.91 C ATOM 539 O TRP A 71 -1.245 8.559 -14.584 1.00 31.70 O ATOM 540 CB TRP A 71 1.609 8.708 -16.270 1.00 28.10 C ATOM 541 CG TRP A 71 1.544 7.330 -15.718 1.00 27.94 C ATOM 542 CD1 TRP A 71 1.106 6.211 -16.362 1.00 28.69 C ATOM 543 CD2 TRP A 71 1.919 6.917 -14.400 1.00 28.98 C ATOM 544 NE1 TRP A 71 1.188 5.122 -15.526 1.00 33.47 N ATOM 545 CE2 TRP A 71 1.685 5.530 -14.316 1.00 27.48 C ATOM 546 CE3 TRP A 71 2.433 7.585 -13.284 1.00 34.44 C ATOM 547 CZ2 TRP A 71 1.947 4.800 -13.164 1.00 22.18 C ATOM 548 CZ3 TRP A 71 2.691 6.856 -12.137 1.00 29.62 C ATOM 549 CH2 TRP A 71 2.447 5.479 -12.087 1.00 34.56 C ATOM 550 HE1 TRP A 71 0.917 4.148 -15.772 1.00 0.00 H ATOM 551 H TRP A 71 1.354 11.182 -16.855 1.00 0.00 H ATOM 552 N ALA A 72 0.162 10.189 -13.931 1.00 22.75 N ATOM 553 CA ALA A 72 -0.353 10.236 -12.568 1.00 30.00 C ATOM 554 C ALA A 72 -1.827 10.624 -12.559 1.00 26.01 C ATOM 555 O ALA A 72 -2.623 10.065 -11.809 1.00 22.34 O ATOM 556 CB ALA A 72 0.451 11.211 -11.731 1.00 24.01 C ATOM 557 H ALA A 72 0.941 10.822 -14.202 1.00 0.00 H ATOM 558 N ALA A 73 -2.183 11.581 -13.406 1.00 22.30 N ATOM 559 CA ALA A 73 -3.556 12.059 -13.486 1.00 26.00 C ATOM 560 C ALA A 73 -4.491 10.992 -14.036 1.00 26.31 C ATOM 561 O ALA A 73 -5.668 10.946 -13.683 1.00 22.80 O ATOM 562 CB ALA A 73 -3.628 13.303 -14.336 1.00 23.96 C ATOM 563 H ALA A 73 -1.463 12.000 -14.029 1.00 0.00 H ATOM 564 N LYS A 74 -3.971 10.142 -14.913 1.00 25.76 N ATOM 565 CA LYS A 74 -4.781 9.067 -15.463 1.00 25.62 C ATOM 566 C LYS A 74 -5.003 7.987 -14.412 1.00 23.03 C ATOM 567 O LYS A 74 -6.119 7.495 -14.240 1.00 25.42 O ATOM 568 CB LYS A 74 -4.137 8.471 -16.714 1.00 28.66 C ATOM 569 CG LYS A 74 -4.963 7.358 -17.322 1.00 29.86 C ATOM 570 CD LYS A 74 -4.319 6.777 -18.569 1.00 33.72 C ATOM 571 CE LYS A 74 -5.113 5.574 -19.061 1.00 37.04 C ATOM 572 NZ LYS A 74 -6.554 5.909 -19.248 1.00 43.68 N ATOM 573 HZ1 LYS A 74 -6.957 6.221 -18.341 1.00 0.00 H ATOM 574 HZ2 LYS A 74 -6.643 6.672 -19.949 1.00 0.00 H ATOM 575 HZ3 LYS A 74 -7.064 5.067 -19.583 1.00 0.00 H ATOM 576 H LYS A 74 -2.979 10.245 -15.208 1.00 0.00 H ATOM 577 N VAL A 75 -3.935 7.627 -13.711 1.00 23.68 N ATOM 578 CA VAL A 75 -4.009 6.630 -12.649 1.00 28.26 C ATOM 579 C VAL A 75 -5.015 7.058 -11.578 1.00 24.19 C ATOM 580 O VAL A 75 -5.822 6.260 -11.106 1.00 25.31 O ATOM 581 CB VAL A 75 -2.618 6.398 -12.004 1.00 27.79 C ATOM 582 CG1 VAL A 75 -2.732 5.509 -10.773 1.00 28.94 C ATOM 583 CG2 VAL A 75 -1.644 5.801 -13.021 1.00 29.72 C ATOM 584 H VAL A 75 -3.018 8.069 -13.925 1.00 0.00 H ATOM 585 N ILE A 76 -4.977 8.331 -11.213 1.00 21.18 N ATOM 586 CA ILE A 76 -5.870 8.848 -10.191 1.00 23.74 C ATOM 587 C ILE A 76 -7.309 8.906 -10.713 1.00 21.93 C ATOM 588 O ILE A 76 -8.251 8.512 -10.020 1.00 19.03 O ATOM 589 CB ILE A 76 -5.399 10.238 -9.706 1.00 23.29 C ATOM 590 CG1 ILE A 76 -4.060 10.115 -8.974 1.00 18.17 C ATOM 591 CG2 ILE A 76 -6.445 10.882 -8.814 1.00 17.70 C ATOM 592 CD1 ILE A 76 -3.377 11.456 -8.690 1.00 21.93 C ATOM 593 H ILE A 76 -4.295 8.972 -11.667 1.00 0.00 H ATOM 594 N SER A 77 -7.475 9.368 -11.950 1.00 18.27 N ATOM 595 CA SER A 77 -8.804 9.445 -12.547 1.00 19.44 C ATOM 596 C SER A 77 -9.436 8.057 -12.672 1.00 23.51 C ATOM 597 O SER A 77 -10.619 7.880 -12.384 1.00 21.52 O ATOM 598 CB SER A 77 -8.747 10.115 -13.923 1.00 21.85 C ATOM 599 OG SER A 77 -8.280 11.454 -13.835 1.00 20.44 O ATOM 600 HG SER A 77 -7.369 11.460 -13.446 1.00 0.00 H ATOM 601 H SER A 77 -6.647 9.678 -12.498 1.00 0.00 H ATOM 602 N ASP A 78 -8.638 7.078 -13.095 1.00 18.60 N ATOM 603 CA ASP A 78 -9.133 5.719 -13.305 1.00 22.22 C ATOM 604 C ASP A 78 -9.417 5.017 -11.983 1.00 24.34 C ATOM 605 O ASP A 78 -10.358 4.234 -11.876 1.00 23.39 O ATOM 606 CB ASP A 78 -8.145 4.898 -14.138 1.00 25.96 C ATOM 607 CG ASP A 78 -8.036 5.391 -15.572 1.00 29.60 C ATOM 608 OD1 ASP A 78 -8.943 6.119 -16.023 1.00 27.93 O ATOM 609 OD2 ASP A 78 -7.043 5.046 -16.249 1.00 34.14 O ATOM 610 H ASP A 78 -7.636 7.286 -13.281 1.00 0.00 H ATOM 611 N ALA A 79 -8.602 5.301 -10.974 1.00 21.07 N ATOM 612 CA ALA A 79 -8.843 4.758 -9.645 1.00 24.58 C ATOM 613 C ALA A 79 -10.155 5.305 -9.086 1.00 25.07 C ATOM 614 O ALA A 79 -10.918 4.584 -8.446 1.00 20.85 O ATOM 615 CB ALA A 79 -7.687 5.084 -8.720 1.00 21.26 C ATOM 616 H ALA A 79 -7.781 5.919 -11.135 1.00 0.00 H ATOM 617 N ARG A 80 -10.416 6.580 -9.344 1.00 24.47 N ATOM 618 CA ARG A 80 -11.647 7.206 -8.885 1.00 18.05 C ATOM 619 C ARG A 80 -12.857 6.540 -9.515 1.00 23.19 C ATOM 620 O ARG A 80 -13.823 6.206 -8.830 1.00 22.06 O ATOM 621 CB ARG A 80 -11.643 8.699 -9.214 1.00 24.31 C ATOM 622 CG ARG A 80 -12.880 9.421 -8.724 1.00 25.16 C ATOM 623 CD ARG A 80 -12.770 10.921 -8.914 1.00 31.34 C ATOM 624 NE ARG A 80 -14.039 11.570 -8.607 1.00 26.97 N ATOM 625 CZ ARG A 80 -15.034 11.682 -9.481 1.00 35.26 C ATOM 626 NH1 ARG A 80 -16.170 12.278 -9.136 1.00 27.30 N ATOM 627 NH2 ARG A 80 -14.889 11.195 -10.707 1.00 20.98 N ATOM 628 HE ARG A 80 -14.173 11.966 -7.655 1.00 0.00 H ATOM 629 HH12 ARG A 80 -16.944 12.362 -9.826 1.00 0.00 H ATOM 630 HH11 ARG A 80 -16.286 12.661 -8.176 1.00 0.00 H ATOM 631 HH22 ARG A 80 -15.664 11.280 -11.395 1.00 0.00 H ATOM 632 HH21 ARG A 80 -14.000 10.729 -10.980 1.00 0.00 H ATOM 633 H ARG A 80 -9.728 7.143 -9.884 1.00 0.00 H ATOM 634 N GLU A 81 -12.794 6.344 -10.826 1.00 19.85 N ATOM 635 CA GLU A 81 -13.875 5.692 -11.553 1.00 25.71 C ATOM 636 C GLU A 81 -14.128 4.295 -10.999 1.00 31.37 C ATOM 637 O GLU A 81 -15.274 3.869 -10.862 1.00 34.73 O ATOM 638 CB GLU A 81 -13.534 5.599 -13.038 1.00 20.03 C ATOM 639 CG GLU A 81 -14.653 5.039 -13.888 1.00 28.37 C ATOM 640 CD GLU A 81 -14.210 4.741 -15.305 1.00 33.82 C ATOM 641 OE1 GLU A 81 -13.000 4.505 -15.519 1.00 36.65 O ATOM 642 OE2 GLU A 81 -15.071 4.741 -16.208 1.00 40.25 O ATOM 643 H GLU A 81 -11.953 6.664 -11.347 1.00 0.00 H ATOM 644 N ALA A 82 -13.047 3.591 -10.677 1.00 31.71 N ATOM 645 CA ALA A 82 -13.136 2.234 -10.144 1.00 32.95 C ATOM 646 C ALA A 82 -13.915 2.184 -8.833 1.00 29.52 C ATOM 647 O ALA A 82 -14.751 1.306 -8.632 1.00 32.46 O ATOM 648 CB ALA A 82 -11.748 1.650 -9.954 1.00 27.29 C ATOM 649 H ALA A 82 -12.109 4.020 -10.809 1.00 0.00 H ATOM 650 N VAL A 83 -13.628 3.128 -7.945 1.00 31.08 N ATOM 651 CA VAL A 83 -14.276 3.185 -6.639 1.00 28.11 C ATOM 652 C VAL A 83 -15.752 3.569 -6.769 1.00 33.26 C ATOM 653 O VAL A 83 -16.591 3.097 -6.003 1.00 37.89 O ATOM 654 CB VAL A 83 -13.537 4.155 -5.695 1.00 29.95 C ATOM 655 CG1 VAL A 83 -14.247 4.266 -4.359 1.00 35.39 C ATOM 656 CG2 VAL A 83 -12.105 3.691 -5.493 1.00 35.04 C ATOM 657 H VAL A 83 -12.919 3.849 -8.188 1.00 0.00 H ATOM 658 N GLN A 84 -16.063 4.418 -7.745 1.00 31.90 N ATOM 659 CA GLN A 84 -17.447 4.779 -8.040 1.00 37.55 C ATOM 660 C GLN A 84 -18.252 3.532 -8.366 1.00 38.35 C ATOM 661 O GLN A 84 -19.362 3.348 -7.867 1.00 36.52 O ATOM 662 CB GLN A 84 -17.524 5.735 -9.235 1.00 30.96 C ATOM 663 CG GLN A 84 -17.095 7.165 -8.958 1.00 29.29 C ATOM 664 CD GLN A 84 -17.176 8.037 -10.197 1.00 25.49 C ATOM 665 OE1 GLN A 84 -16.908 7.583 -11.310 1.00 31.23 O ATOM 666 NE2 GLN A 84 -17.553 9.292 -10.011 1.00 26.88 N ATOM 667 HE22 GLN A 84 -17.770 9.633 -9.053 1.00 0.00 H ATOM 668 HE21 GLN A 84 -17.632 9.937 -10.823 1.00 0.00 H ATOM 669 H GLN A 84 -15.299 4.836 -8.314 1.00 0.00 H ATOM 670 N LYS A 85 -17.678 2.677 -9.205 1.00 32.80 N ATOM 671 CA LYS A 85 -18.371 1.491 -9.695 1.00 39.21 C ATOM 672 C LYS A 85 -18.617 0.444 -8.611 1.00 47.35 C ATOM 673 O LYS A 85 -19.684 -0.168 -8.567 1.00 52.03 O ATOM 674 CB LYS A 85 -17.599 0.871 -10.859 1.00 35.15 C ATOM 675 CG LYS A 85 -17.551 1.759 -12.089 1.00 42.64 C ATOM 676 CD LYS A 85 -16.948 1.036 -13.280 1.00 41.59 C ATOM 677 CE LYS A 85 -17.113 1.850 -14.552 1.00 44.10 C ATOM 678 NZ LYS A 85 -16.498 1.172 -15.724 1.00 45.52 N ATOM 679 HZ1 LYS A 85 -15.481 1.037 -15.551 1.00 0.00 H ATOM 680 HZ2 LYS A 85 -16.952 0.247 -15.866 1.00 0.00 H ATOM 681 HZ3 LYS A 85 -16.632 1.759 -16.572 1.00 0.00 H ATOM 682 H LYS A 85 -16.704 2.859 -9.522 1.00 0.00 H ATOM 683 N PHE A 86 -17.626 0.235 -7.749 1.00 39.48 N ATOM 684 CA PHE A 86 -17.762 -0.709 -6.645 1.00 41.07 C ATOM 685 C PHE A 86 -18.876 -0.281 -5.702 1.00 43.70 C ATOM 686 O PHE A 86 -19.514 -1.116 -5.067 1.00 52.35 O ATOM 687 CB PHE A 86 -16.458 -0.817 -5.847 1.00 35.40 C ATOM 688 CG PHE A 86 -15.323 -1.441 -6.604 1.00 36.20 C ATOM 689 CD1 PHE A 86 -15.558 -2.385 -7.589 1.00 34.35 C ATOM 690 CD2 PHE A 86 -14.013 -1.080 -6.327 1.00 37.65 C ATOM 691 CE1 PHE A 86 -14.506 -2.956 -8.284 1.00 37.94 C ATOM 692 CE2 PHE A 86 -12.959 -1.646 -7.018 1.00 39.18 C ATOM 693 CZ PHE A 86 -13.206 -2.586 -7.999 1.00 32.92 C ATOM 694 H PHE A 86 -16.734 0.756 -7.865 1.00 0.00 H ATOM 695 N THR A 87 -19.030 1.010 -5.531 1.00 46.89 N ATOM 696 CA THR A 87 -19.990 1.542 -4.598 1.00 49.75 C ATOM 697 C THR A 87 -21.099 2.130 -5.417 1.00 50.54 C ATOM 698 O THR A 87 -21.404 1.634 -6.464 1.00 49.51 O ATOM 699 CB THR A 87 -19.360 2.600 -3.685 1.00 48.10 C ATOM 700 OG1 THR A 87 -19.074 3.764 -4.444 1.00 42.09 O ATOM 701 CG2 THR A 87 -18.089 2.089 -3.047 1.00 36.05 C ATOM 702 HG1 THR A 87 -18.443 3.535 -5.172 1.00 0.00 H ATOM 703 H THR A 87 -18.443 1.667 -6.084 1.00 0.00 H ATOM 704 N GLY A 88 -21.691 3.209 -4.955 1.00 55.91 N ATOM 705 CA GLY A 88 -22.686 3.901 -5.740 1.00 61.23 C ATOM 706 C GLY A 88 -22.243 4.955 -6.737 1.00 59.32 C ATOM 707 O GLY A 88 -22.653 4.891 -7.889 1.00 65.08 O ATOM 708 H GLY A 88 -21.440 3.569 -4.012 1.00 0.00 H ATOM 709 N HIS A 89 -21.422 5.925 -6.329 1.00 65.03 N ATOM 710 CA HIS A 89 -21.042 7.066 -7.183 1.00 48.51 C ATOM 711 C HIS A 89 -21.206 7.021 -8.711 1.00 48.81 C ATOM 712 O HIS A 89 -20.998 8.016 -9.404 1.00 39.70 O ATOM 713 H HIS A 89 -21.033 5.874 -5.366 1.00 0.00 H ATOM 714 N GLY A 90 -21.592 5.856 -9.221 1.00 51.29 N ATOM 715 CA GLY A 90 -21.589 5.522 -10.629 1.00 55.62 C ATOM 716 C GLY A 90 -22.400 6.369 -11.574 1.00 56.10 C ATOM 717 O GLY A 90 -22.459 6.053 -12.755 1.00 57.05 O ATOM 718 H GLY A 90 -21.922 5.127 -8.556 1.00 0.00 H TER 719 GLY A 90 ATOM 720 N ASP A 93 -22.480 10.437 -12.603 1.00 50.21 N ATOM 721 CA ASP A 93 -22.115 9.399 -13.554 1.00 43.37 C ATOM 722 C ASP A 93 -20.615 9.389 -13.962 1.00 46.60 C ATOM 723 O ASP A 93 -20.008 10.428 -14.129 1.00 39.43 O ATOM 724 CB ASP A 93 -23.053 9.481 -14.760 1.00 40.55 C ATOM 725 CG ASP A 93 -22.575 8.685 -15.932 1.00 52.24 C ATOM 726 OD1 ASP A 93 -22.113 9.313 -16.893 1.00 44.52 O ATOM 727 OD2 ASP A 93 -22.665 7.432 -15.903 1.00 56.59 O ATOM 728 HN3 ASP A 93 -22.274 11.370 -13.014 1.00 0.00 H ATOM 729 HN2 ASP A 93 -21.931 10.313 -11.728 1.00 0.00 H ATOM 730 HN1 ASP A 93 -23.495 10.368 -12.389 1.00 0.00 H ATOM 731 N SER A 94 -20.059 8.190 -14.124 1.00 38.74 N ATOM 732 CA SER A 94 -18.631 7.952 -14.327 1.00 40.91 C ATOM 733 C SER A 94 -18.123 8.363 -15.705 1.00 29.30 C ATOM 734 O SER A 94 -17.089 9.020 -15.816 1.00 35.99 O ATOM 735 CB SER A 94 -18.301 6.479 -14.075 1.00 33.93 C ATOM 736 OG SER A 94 -18.640 6.113 -12.752 1.00 39.25 O ATOM 737 HG SER A 94 -18.127 6.671 -12.115 1.00 0.00 H ATOM 738 H SER A 94 -20.687 7.361 -14.105 1.00 0.00 H ATOM 739 N ARG A 95 -18.846 7.957 -16.744 1.00 32.47 N ATOM 740 CA ARG A 95 -18.480 8.269 -18.124 1.00 39.26 C ATOM 741 C ARG A 95 -18.303 9.765 -18.314 1.00 34.79 C ATOM 742 O ARG A 95 -17.356 10.210 -18.961 1.00 35.32 O ATOM 743 CB ARG A 95 -19.556 7.765 -19.086 1.00 41.63 C ATOM 744 CG ARG A 95 -19.063 6.788 -20.143 1.00 40.28 C ATOM 745 CD ARG A 95 -18.566 5.491 -19.522 1.00 40.85 C ATOM 746 NE ARG A 95 -19.362 5.097 -18.362 1.00 41.55 N ATOM 747 CZ ARG A 95 -20.522 4.448 -18.423 1.00 43.20 C ATOM 748 NH1 ARG A 95 -21.162 4.137 -17.303 1.00 43.56 N ATOM 749 NH2 ARG A 95 -21.045 4.112 -19.597 1.00 44.03 N ATOM 750 HE ARG A 95 -18.995 5.342 -17.420 1.00 0.00 H ATOM 751 HH12 ARG A 95 -22.069 3.630 -17.346 1.00 0.00 H ATOM 752 HH11 ARG A 95 -20.757 4.400 -16.382 1.00 0.00 H ATOM 753 HH22 ARG A 95 -21.952 3.605 -19.636 1.00 0.00 H ATOM 754 HH21 ARG A 95 -20.547 4.356 -20.477 1.00 0.00 H ATOM 755 H ARG A 95 -19.704 7.396 -16.568 1.00 0.00 H ATOM 756 N ALA A 96 -19.222 10.532 -17.734 1.00 35.77 N ATOM 757 CA ALA A 96 -19.200 11.988 -17.831 1.00 35.05 C ATOM 758 C ALA A 96 -18.002 12.584 -17.098 1.00 32.95 C ATOM 759 O ALA A 96 -17.426 13.570 -17.550 1.00 36.30 O ATOM 760 CB ALA A 96 -20.502 12.582 -17.303 1.00 32.85 C ATOM 761 H ALA A 96 -19.984 10.077 -17.192 1.00 0.00 H ATOM 762 N ASP A 97 -17.635 11.989 -15.965 1.00 28.69 N ATOM 763 CA ASP A 97 -16.444 12.416 -15.236 1.00 27.41 C ATOM 764 C ASP A 97 -15.193 12.129 -16.060 1.00 33.80 C ATOM 765 O ASP A 97 -14.317 12.989 -16.210 1.00 24.72 O ATOM 766 CB ASP A 97 -16.339 11.706 -13.889 1.00 26.13 C ATOM 767 CG ASP A 97 -17.262 12.299 -12.842 1.00 36.34 C ATOM 768 OD1 ASP A 97 -17.863 13.363 -13.105 1.00 37.33 O ATOM 769 OD2 ASP A 97 -17.376 11.710 -11.746 1.00 30.57 O ATOM 770 H ASP A 97 -18.208 11.205 -15.592 1.00 0.00 H ATOM 771 N GLN A 98 -15.118 10.914 -16.597 1.00 28.48 N ATOM 772 CA GLN A 98 -13.965 10.514 -17.390 1.00 29.10 C ATOM 773 C GLN A 98 -13.815 11.338 -18.665 1.00 24.97 C ATOM 774 O GLN A 98 -12.701 11.583 -19.120 1.00 26.67 O ATOM 775 CB GLN A 98 -14.010 9.018 -17.704 1.00 22.60 C ATOM 776 CG GLN A 98 -13.626 8.117 -16.532 1.00 28.94 C ATOM 777 CD GLN A 98 -12.128 8.126 -16.228 1.00 30.67 C ATOM 778 OE1 GLN A 98 -11.469 9.167 -16.284 1.00 28.87 O ATOM 779 NE2 GLN A 98 -11.586 6.956 -15.909 1.00 24.08 N ATOM 780 HE22 GLN A 98 -12.178 6.101 -15.873 1.00 0.00 H ATOM 781 HE21 GLN A 98 -10.570 6.895 -15.695 1.00 0.00 H ATOM 782 H GLN A 98 -15.895 10.240 -16.448 1.00 0.00 H ATOM 783 N PHE A 99 -14.935 11.772 -19.232 1.00 24.79 N ATOM 784 CA PHE A 99 -14.892 12.623 -20.415 1.00 22.82 C ATOM 785 C PHE A 99 -14.203 13.939 -20.077 1.00 24.05 C ATOM 786 O PHE A 99 -13.382 14.436 -20.846 1.00 30.64 O ATOM 787 CB PHE A 99 -16.304 12.887 -20.943 1.00 30.65 C ATOM 788 CG PHE A 99 -16.339 13.711 -22.201 1.00 37.73 C ATOM 789 CD1 PHE A 99 -16.330 13.101 -23.444 1.00 31.43 C ATOM 790 CD2 PHE A 99 -16.387 15.096 -22.140 1.00 36.53 C ATOM 791 CE1 PHE A 99 -16.363 13.856 -24.602 1.00 33.61 C ATOM 792 CE2 PHE A 99 -16.419 15.856 -23.294 1.00 34.34 C ATOM 793 CZ PHE A 99 -16.410 15.235 -24.526 1.00 33.23 C ATOM 794 H PHE A 99 -15.854 11.501 -18.827 1.00 0.00 H ATOM 795 N ALA A 100 -14.541 14.497 -18.920 1.00 20.20 N ATOM 796 CA ALA A 100 -13.922 15.735 -18.463 1.00 19.53 C ATOM 797 C ALA A 100 -12.441 15.519 -18.165 1.00 25.57 C ATOM 798 O ALA A 100 -11.603 16.325 -18.561 1.00 25.46 O ATOM 799 CB ALA A 100 -14.643 16.277 -17.238 1.00 20.51 C ATOM 800 H ALA A 100 -15.263 14.041 -18.327 1.00 0.00 H ATOM 801 N ASN A 101 -12.135 14.427 -17.467 1.00 28.10 N ATOM 802 CA ASN A 101 -10.758 14.059 -17.146 1.00 23.24 C ATOM 803 C ASN A 101 -9.873 13.998 -18.389 1.00 24.79 C ATOM 804 O ASN A 101 -8.806 14.610 -18.438 1.00 24.43 O ATOM 805 CB ASN A 101 -10.719 12.706 -16.425 1.00 24.00 C ATOM 806 CG ASN A 101 -11.249 12.781 -15.000 1.00 26.71 C ATOM 807 OD1 ASN A 101 -11.137 13.808 -14.338 1.00 29.93 O ATOM 808 ND2 ASN A 101 -11.816 11.682 -14.521 1.00 26.46 N ATOM 809 HD22 ASN A 101 -11.890 10.833 -15.117 1.00 0.00 H ATOM 810 HD21 ASN A 101 -12.186 11.669 -13.549 1.00 0.00 H ATOM 811 H ASN A 101 -12.906 13.812 -17.138 1.00 0.00 H ATOM 812 N GLU A 102 -10.335 13.285 -19.399 1.00 21.59 N ATOM 813 CA GLU A 102 -9.598 13.090 -20.624 1.00 29.75 C ATOM 814 C GLU A 102 -9.488 14.398 -21.379 1.00 21.40 C ATOM 815 O GLU A 102 -8.459 14.728 -21.834 1.00 22.90 O ATOM 816 CB GLU A 102 -10.206 11.969 -21.508 1.00 31.02 C ATOM 817 CG GLU A 102 -10.159 10.601 -20.869 1.00 43.32 C ATOM 818 CD GLU A 102 -10.514 9.454 -21.796 1.00 51.43 C ATOM 819 OE1 GLU A 102 -9.976 9.394 -22.904 1.00 59.16 O ATOM 820 OE2 GLU A 102 -11.319 8.604 -21.398 1.00 49.70 O ATOM 821 H GLU A 102 -11.272 12.844 -19.308 1.00 0.00 H ATOM 822 N TRP A 103 -10.571 15.147 -21.405 1.00 21.57 N ATOM 823 CA TRP A 103 -10.625 16.463 -22.036 1.00 18.20 C ATOM 824 C TRP A 103 -9.499 17.353 -21.529 1.00 27.25 C ATOM 825 O TRP A 103 -8.717 17.894 -22.312 1.00 26.40 O ATOM 826 CB TRP A 103 -11.973 17.119 -21.737 1.00 20.66 C ATOM 827 CG TRP A 103 -12.133 18.529 -22.241 1.00 29.02 C ATOM 828 CD1 TRP A 103 -11.650 19.669 -21.662 1.00 27.78 C ATOM 829 CD2 TRP A 103 -12.860 18.947 -23.401 1.00 28.48 C ATOM 830 NE1 TRP A 103 -12.020 20.765 -22.395 1.00 27.05 N ATOM 831 CE2 TRP A 103 -12.761 20.351 -23.470 1.00 29.25 C ATOM 832 CE3 TRP A 103 -13.578 18.272 -24.393 1.00 32.48 C ATOM 833 CZ2 TRP A 103 -13.350 21.093 -24.495 1.00 29.39 C ATOM 834 CZ3 TRP A 103 -14.167 19.009 -25.405 1.00 25.67 C ATOM 835 CH2 TRP A 103 -14.048 20.405 -25.449 1.00 26.89 C ATOM 836 HE1 TRP A 103 -11.778 21.751 -22.172 1.00 0.00 H ATOM 837 H TRP A 103 -11.433 14.782 -20.952 1.00 0.00 H ATOM 838 N GLY A 104 -9.421 17.501 -20.213 1.00 24.66 N ATOM 839 CA GLY A 104 -8.385 18.317 -19.613 1.00 17.24 C ATOM 840 C GLY A 104 -7.002 17.727 -19.814 1.00 25.31 C ATOM 841 O GLY A 104 -6.042 18.453 -20.055 1.00 29.44 O ATOM 842 H GLY A 104 -10.114 17.024 -19.602 1.00 0.00 H ATOM 843 N ARG A 105 -6.899 16.404 -19.726 1.00 25.22 N ATOM 844 CA ARG A 105 -5.608 15.732 -19.848 1.00 26.24 C ATOM 845 C ARG A 105 -5.026 15.861 -21.257 1.00 27.33 C ATOM 846 O ARG A 105 -3.812 15.869 -21.435 1.00 25.72 O ATOM 847 CB ARG A 105 -5.719 14.258 -19.440 1.00 23.86 C ATOM 848 CG ARG A 105 -4.386 13.604 -19.077 1.00 21.05 C ATOM 849 CD ARG A 105 -4.580 12.393 -18.174 1.00 25.73 C ATOM 850 NE ARG A 105 -5.412 11.364 -18.790 1.00 30.31 N ATOM 851 CZ ARG A 105 -6.517 10.859 -18.248 1.00 26.54 C ATOM 852 NH1 ARG A 105 -6.939 11.283 -17.068 1.00 23.29 N ATOM 853 NH2 ARG A 105 -7.200 9.922 -18.892 1.00 39.20 N ATOM 854 HE ARG A 105 -5.120 10.999 -19.719 1.00 0.00 H ATOM 855 HH12 ARG A 105 -7.804 10.883 -16.651 1.00 0.00 H ATOM 856 HH11 ARG A 105 -6.406 12.016 -16.558 1.00 0.00 H ATOM 857 HH22 ARG A 105 -8.064 9.526 -18.470 1.00 0.00 H ATOM 858 HH21 ARG A 105 -6.871 9.583 -19.819 1.00 0.00 H ATOM 859 H ARG A 105 -7.756 15.836 -19.567 1.00 0.00 H ATOM 860 N SER A 106 -5.895 15.978 -22.253 1.00 27.61 N ATOM 861 CA SER A 106 -5.448 16.111 -23.635 1.00 29.20 C ATOM 862 C SER A 106 -4.951 17.528 -23.929 1.00 30.49 C ATOM 863 O SER A 106 -4.360 17.787 -24.976 1.00 44.95 O ATOM 864 CB SER A 106 -6.574 15.742 -24.595 1.00 19.91 C ATOM 865 OG SER A 106 -7.526 16.782 -24.665 1.00 28.35 O ATOM 866 HG SER A 106 -7.908 16.939 -23.765 1.00 0.00 H ATOM 867 H SER A 106 -6.914 15.975 -22.044 1.00 0.00 H ATOM 868 N GLY A 107 -5.193 18.445 -22.999 1.00 33.47 N ATOM 869 CA GLY A 107 -4.718 19.810 -23.138 1.00 23.55 C ATOM 870 C GLY A 107 -5.803 20.797 -23.518 1.00 28.08 C ATOM 871 O GLY A 107 -5.537 21.982 -23.707 1.00 29.12 O ATOM 872 H GLY A 107 -5.735 18.179 -22.152 1.00 0.00 H ATOM 873 N LYS A 108 -7.035 20.313 -23.629 1.00 29.42 N ATOM 874 CA LYS A 108 -8.156 21.184 -23.958 1.00 25.08 C ATOM 875 C LYS A 108 -8.607 21.995 -22.747 1.00 25.25 C ATOM 876 O LYS A 108 -8.385 21.602 -21.601 1.00 28.53 O ATOM 877 CB LYS A 108 -9.312 20.375 -24.546 1.00 22.77 C ATOM 878 CG LYS A 108 -8.887 19.507 -25.717 1.00 27.75 C ATOM 879 CD LYS A 108 -10.065 18.830 -26.391 1.00 31.55 C ATOM 880 CE LYS A 108 -9.607 17.602 -27.159 1.00 36.52 C ATOM 881 NZ LYS A 108 -10.627 17.143 -28.143 1.00 57.66 N ATOM 882 HZ1 LYS A 108 -11.506 16.903 -27.642 1.00 0.00 H ATOM 883 HZ2 LYS A 108 -10.813 17.903 -28.828 1.00 0.00 H ATOM 884 HZ3 LYS A 108 -10.271 16.303 -28.643 1.00 0.00 H ATOM 885 H LYS A 108 -7.202 19.298 -23.479 1.00 0.00 H ATOM 886 N ASP A 109 -9.238 23.131 -23.020 1.00 26.71 N ATOM 887 CA ASP A 109 -9.589 24.112 -21.996 1.00 25.79 C ATOM 888 C ASP A 109 -10.561 23.581 -20.941 1.00 24.46 C ATOM 889 O ASP A 109 -11.699 23.240 -21.260 1.00 22.23 O ATOM 890 CB ASP A 109 -10.187 25.347 -22.670 1.00 26.20 C ATOM 891 CG ASP A 109 -10.370 26.503 -21.714 1.00 27.95 C ATOM 892 OD1 ASP A 109 -9.680 26.537 -20.673 1.00 34.53 O ATOM 893 OD2 ASP A 109 -11.200 27.387 -22.011 1.00 33.16 O ATOM 894 H ASP A 109 -9.494 23.332 -24.008 1.00 0.00 H ATOM 895 N PRO A 110 -10.112 23.518 -19.676 1.00 23.96 N ATOM 896 CA PRO A 110 -10.971 23.120 -18.553 1.00 22.74 C ATOM 897 C PRO A 110 -12.189 24.031 -18.409 1.00 24.93 C ATOM 898 O PRO A 110 -13.232 23.590 -17.921 1.00 23.40 O ATOM 899 CB PRO A 110 -10.054 23.287 -17.338 1.00 21.09 C ATOM 900 CG PRO A 110 -8.684 23.151 -17.881 1.00 22.15 C ATOM 901 CD PRO A 110 -8.727 23.766 -19.244 1.00 20.80 C ATOM 902 N ASN A 111 -12.054 25.285 -18.834 1.00 22.19 N ATOM 903 CA ASN A 111 -13.138 26.264 -18.731 1.00 20.49 C ATOM 904 C ASN A 111 -14.361 25.926 -19.578 1.00 23.07 C ATOM 905 O ASN A 111 -15.406 26.564 -19.456 1.00 24.38 O ATOM 906 CB ASN A 111 -12.628 27.663 -19.075 1.00 23.83 C ATOM 907 CG ASN A 111 -11.828 28.278 -17.948 1.00 28.72 C ATOM 908 OD1 ASN A 111 -12.152 28.100 -16.772 1.00 31.16 O ATOM 909 ND2 ASN A 111 -10.773 29.002 -18.297 1.00 36.63 N ATOM 910 HD22 ASN A 111 -10.537 29.126 -19.302 1.00 0.00 H ATOM 911 HD21 ASN A 111 -10.182 29.446 -17.565 1.00 0.00 H ATOM 912 H ASN A 111 -11.149 25.579 -19.253 1.00 0.00 H ATOM 913 N HIS A 112 -14.222 24.918 -20.432 1.00 24.68 N ATOM 914 CA HIS A 112 -15.336 24.393 -21.206 1.00 29.01 C ATOM 915 C HIS A 112 -16.431 23.879 -20.273 1.00 28.15 C ATOM 916 O HIS A 112 -17.603 23.834 -20.642 1.00 25.86 O ATOM 917 CB HIS A 112 -14.840 23.267 -22.115 1.00 33.49 C ATOM 918 CG HIS A 112 -15.917 22.606 -22.921 1.00 33.39 C ATOM 919 ND1 HIS A 112 -16.522 21.427 -22.536 1.00 38.44 N ATOM 920 CD2 HIS A 112 -16.480 22.945 -24.105 1.00 31.06 C ATOM 921 CE1 HIS A 112 -17.417 21.076 -23.440 1.00 34.22 C ATOM 922 NE2 HIS A 112 -17.412 21.979 -24.405 1.00 35.86 N ATOM 923 H HIS A 112 -13.282 24.489 -20.552 1.00 0.00 H ATOM 924 N PHE A 113 -16.039 23.500 -19.059 1.00 22.41 N ATOM 925 CA PHE A 113 -16.979 22.970 -18.072 1.00 29.99 C ATOM 926 C PHE A 113 -17.278 23.963 -16.945 1.00 27.85 C ATOM 927 O PHE A 113 -18.006 23.638 -16.008 1.00 21.74 O ATOM 928 CB PHE A 113 -16.433 21.675 -17.459 1.00 24.48 C ATOM 929 CG PHE A 113 -16.161 20.591 -18.461 1.00 26.14 C ATOM 930 CD1 PHE A 113 -17.188 19.788 -18.926 1.00 22.61 C ATOM 931 CD2 PHE A 113 -14.877 20.365 -18.927 1.00 21.86 C ATOM 932 CE1 PHE A 113 -16.939 18.783 -19.845 1.00 22.42 C ATOM 933 CE2 PHE A 113 -14.623 19.363 -19.848 1.00 32.14 C ATOM 934 CZ PHE A 113 -15.658 18.569 -20.306 1.00 23.52 C ATOM 935 H PHE A 113 -15.034 23.583 -18.805 1.00 0.00 H ATOM 936 N ARG A 114 -16.711 25.162 -17.030 1.00 26.36 N ATOM 937 CA ARG A 114 -16.846 26.132 -15.947 1.00 26.60 C ATOM 938 C ARG A 114 -18.289 26.595 -15.780 1.00 29.10 C ATOM 939 O ARG A 114 -18.877 27.153 -16.703 1.00 30.98 O ATOM 940 CB ARG A 114 -15.933 27.335 -16.177 1.00 27.01 C ATOM 941 CG ARG A 114 -15.763 28.224 -14.955 1.00 21.19 C ATOM 942 CD ARG A 114 -14.860 29.419 -15.249 1.00 20.74 C ATOM 943 NE ARG A 114 -14.512 30.137 -14.023 1.00 24.38 N ATOM 944 CZ ARG A 114 -13.385 29.953 -13.344 1.00 17.14 C ATOM 945 NH1 ARG A 114 -12.480 29.081 -13.775 1.00 23.10 N ATOM 946 NH2 ARG A 114 -13.160 30.643 -12.235 1.00 17.21 N ATOM 947 HE ARG A 114 -15.190 30.836 -13.660 1.00 0.00 H ATOM 948 HH12 ARG A 114 -11.599 28.939 -13.241 1.00 0.00 H ATOM 949 HH11 ARG A 114 -12.653 28.540 -14.646 1.00 0.00 H ATOM 950 HH22 ARG A 114 -12.278 30.499 -11.703 1.00 0.00 H ATOM 951 HH21 ARG A 114 -13.866 31.328 -11.897 1.00 0.00 H ATOM 952 H ARG A 114 -16.164 25.412 -17.879 1.00 0.00 H ATOM 953 N PRO A 115 -18.872 26.357 -14.597 1.00 30.00 N ATOM 954 CA PRO A 115 -20.245 26.807 -14.373 1.00 23.62 C ATOM 955 C PRO A 115 -20.297 28.312 -14.164 1.00 30.12 C ATOM 956 O PRO A 115 -19.293 28.924 -13.804 1.00 32.03 O ATOM 957 CB PRO A 115 -20.639 26.085 -13.084 1.00 26.46 C ATOM 958 CG PRO A 115 -19.361 25.918 -12.354 1.00 25.04 C ATOM 959 CD PRO A 115 -18.310 25.687 -13.412 1.00 26.35 C ATOM 960 N ALA A 116 -21.466 28.893 -14.399 1.00 38.12 N ATOM 961 CA ALA A 116 -21.666 30.318 -14.196 1.00 33.88 C ATOM 962 C ALA A 116 -21.360 30.710 -12.757 1.00 30.55 C ATOM 963 O ALA A 116 -21.884 30.115 -11.817 1.00 32.58 O ATOM 964 CB ALA A 116 -23.090 30.699 -14.548 1.00 37.86 C ATOM 965 H ALA A 116 -22.260 28.313 -14.737 1.00 0.00 H ATOM 966 N GLY A 117 -20.491 31.701 -12.595 1.00 23.30 N ATOM 967 CA GLY A 117 -20.266 32.300 -11.296 1.00 29.23 C ATOM 968 C GLY A 117 -19.094 31.788 -10.483 1.00 31.52 C ATOM 969 O GLY A 117 -18.774 32.382 -9.453 1.00 29.08 O ATOM 970 H GLY A 117 -19.961 32.054 -13.418 1.00 0.00 H ATOM 971 N LEU A 118 -18.468 30.695 -10.916 1.00 24.63 N ATOM 972 CA LEU A 118 -17.322 30.143 -10.194 1.00 24.94 C ATOM 973 C LEU A 118 -16.264 31.225 -9.988 1.00 21.72 C ATOM 974 O LEU A 118 -15.846 31.865 -10.953 1.00 26.93 O ATOM 975 CB LEU A 118 -16.718 28.952 -10.946 1.00 18.05 C ATOM 976 CG LEU A 118 -15.694 28.136 -10.150 1.00 21.56 C ATOM 977 CD1 LEU A 118 -16.373 27.407 -9.002 1.00 13.27 C ATOM 978 CD2 LEU A 118 -14.936 27.155 -11.030 1.00 15.24 C ATOM 979 H LEU A 118 -18.800 30.226 -11.783 1.00 0.00 H ATOM 980 N PRO A 119 -15.866 31.432 -8.749 1.00 19.13 N ATOM 981 CA PRO A 119 -14.873 32.439 -8.430 1.00 22.06 C ATOM 982 C PRO A 119 -13.638 32.280 -9.251 1.00 25.68 C ATOM 983 O PRO A 119 -13.182 31.217 -9.533 1.00 22.15 O ATOM 984 CB PRO A 119 -14.602 32.236 -6.969 1.00 16.67 C ATOM 985 CG PRO A 119 -15.798 31.599 -6.476 1.00 20.67 C ATOM 986 CD PRO A 119 -16.351 30.775 -7.553 1.00 17.81 C ATOM 987 N LYS A 120 -13.154 33.409 -9.679 1.00 26.08 N ATOM 988 CA LYS A 120 -12.091 33.531 -10.611 1.00 22.35 C ATOM 989 C LYS A 120 -10.779 32.864 -10.230 1.00 27.21 C ATOM 990 O LYS A 120 -10.087 32.410 -11.080 1.00 26.96 O ATOM 991 CB LYS A 120 -11.907 35.000 -10.897 1.00 27.76 C ATOM 992 CG LYS A 120 -12.611 35.502 -12.133 1.00 39.91 C ATOM 993 CD LYS A 120 -14.043 35.072 -12.297 1.00 38.82 C ATOM 994 CE LYS A 120 -14.521 35.345 -13.715 1.00 40.45 C ATOM 995 NZ LYS A 120 -15.351 34.310 -14.342 1.00 38.68 N ATOM 996 HZ1 LYS A 120 -14.815 33.420 -14.391 1.00 0.00 H ATOM 997 HZ2 LYS A 120 -16.212 34.167 -13.776 1.00 0.00 H ATOM 998 HZ3 LYS A 120 -15.612 34.612 -15.302 1.00 0.00 H ATOM 999 H LYS A 120 -13.577 34.285 -9.312 1.00 0.00 H ATOM 1000 N ARG A 121 -10.479 32.783 -8.948 1.00 21.77 N ATOM 1001 CA ARG A 121 -9.264 32.137 -8.466 1.00 17.47 C ATOM 1002 C ARG A 121 -9.183 30.647 -8.683 1.00 23.83 C ATOM 1003 O ARG A 121 -8.164 30.090 -8.455 1.00 23.96 O ATOM 1004 CB ARG A 121 -9.003 32.398 -6.987 1.00 17.06 C ATOM 1005 CG ARG A 121 -9.960 31.767 -6.008 1.00 20.92 C ATOM 1006 CD ARG A 121 -9.918 32.549 -4.737 1.00 24.83 C ATOM 1007 NE ARG A 121 -10.789 32.053 -3.706 1.00 26.66 N ATOM 1008 CZ ARG A 121 -12.021 32.460 -3.500 1.00 27.06 C ATOM 1009 NH1 ARG A 121 -12.556 33.385 -4.249 1.00 19.19 N ATOM 1010 NH2 ARG A 121 -12.704 31.940 -2.547 1.00 19.24 N ATOM 1011 HE ARG A 121 -10.415 31.316 -3.075 1.00 0.00 H ATOM 1012 HH12 ARG A 121 -13.533 33.696 -4.073 1.00 0.00 H ATOM 1013 HH11 ARG A 121 -12.006 33.811 -5.022 1.00 0.00 H ATOM 1014 HH22 ARG A 121 -13.680 32.255 -2.375 1.00 0.00 H ATOM 1015 HH21 ARG A 121 -12.282 31.204 -1.946 1.00 0.00 H ATOM 1016 H ARG A 121 -11.135 33.196 -8.254 1.00 0.00 H ATOM 1017 N TYR A 122 -10.303 30.048 -9.054 1.00 19.87 N ATOM 1018 CA TYR A 122 -10.404 28.641 -9.352 1.00 19.21 C ATOM 1019 C TYR A 122 -10.372 28.398 -10.840 1.00 18.38 C ATOM 1020 O TYR A 122 -10.853 29.269 -11.593 1.00 19.93 O ATOM 1021 CB TYR A 122 -11.660 28.002 -8.757 1.00 15.49 C ATOM 1022 CG TYR A 122 -11.808 28.135 -7.308 1.00 21.22 C ATOM 1023 CD1 TYR A 122 -10.827 27.712 -6.460 1.00 21.33 C ATOM 1024 CD2 TYR A 122 -12.935 28.691 -6.771 1.00 19.40 C ATOM 1025 CE1 TYR A 122 -10.967 27.841 -5.121 1.00 19.96 C ATOM 1026 CE2 TYR A 122 -13.081 28.816 -5.434 1.00 21.83 C ATOM 1027 CZ TYR A 122 -12.089 28.393 -4.613 1.00 29.01 C ATOM 1028 OH TYR A 122 -12.225 28.531 -3.288 1.00 29.07 O ATOM 1029 OXT TYR A 122 -9.830 27.317 -11.143 1.00 18.96 O ATOM 1030 HH TYR A 122 -11.419 28.175 -2.836 1.00 0.00 H ATOM 1031 H TYR A 122 -11.163 30.627 -9.136 1.00 0.00 H TER 1032 TYR A 122 ATOM 1033 N ARG B 20 -11.687 10.761 2.692 1.00 51.85 N ATOM 1034 CA ARG B 20 -12.318 10.113 1.549 1.00 44.71 C ATOM 1035 C ARG B 20 -11.339 9.192 0.828 1.00 58.72 C ATOM 1036 O ARG B 20 -10.315 8.799 1.387 1.00 50.48 O ATOM 1037 CB ARG B 20 -12.871 11.158 0.578 1.00 51.80 C ATOM 1038 CG ARG B 20 -13.965 10.635 -0.339 1.00 57.96 C ATOM 1039 CD ARG B 20 -14.467 11.723 -1.275 1.00 52.00 C ATOM 1040 NE ARG B 20 -14.144 11.438 -2.669 1.00 63.08 N ATOM 1041 CZ ARG B 20 -14.013 12.366 -3.610 1.00 48.89 C ATOM 1042 NH1 ARG B 20 -14.175 13.647 -3.309 1.00 52.34 N ATOM 1043 NH2 ARG B 20 -13.717 12.014 -4.855 1.00 22.99 N ATOM 1044 HE ARG B 20 -14.008 10.444 -2.943 1.00 0.00 H ATOM 1045 HH12 ARG B 20 -14.072 14.372 -4.048 1.00 0.00 H ATOM 1046 HH11 ARG B 20 -14.405 13.927 -2.334 1.00 0.00 H ATOM 1047 HH22 ARG B 20 -13.615 12.742 -5.591 1.00 0.00 H ATOM 1048 HH21 ARG B 20 -13.587 11.010 -5.095 1.00 0.00 H ATOM 1049 HN3 ARG B 20 -10.878 11.326 2.365 1.00 0.00 H ATOM 1050 HN2 ARG B 20 -11.358 10.036 3.361 1.00 0.00 H ATOM 1051 HN1 ARG B 20 -12.377 11.381 3.162 1.00 0.00 H ATOM 1052 N TRP B 21 -11.659 8.855 -0.417 1.00 46.70 N ATOM 1053 CA TRP B 21 -10.816 7.989 -1.209 1.00 29.82 C ATOM 1054 C TRP B 21 -9.537 8.772 -1.502 1.00 32.67 C ATOM 1055 O TRP B 21 -8.486 8.195 -1.782 1.00 26.99 O ATOM 1056 CB TRP B 21 -11.575 7.622 -2.486 1.00 31.43 C ATOM 1057 CG TRP B 21 -10.761 7.425 -3.716 1.00 32.12 C ATOM 1058 CD1 TRP B 21 -10.240 6.251 -4.170 1.00 30.52 C ATOM 1059 CD2 TRP B 21 -10.412 8.420 -4.682 1.00 26.51 C ATOM 1060 NE1 TRP B 21 -9.577 6.454 -5.352 1.00 32.73 N ATOM 1061 CE2 TRP B 21 -9.668 7.778 -5.690 1.00 34.28 C ATOM 1062 CE3 TRP B 21 -10.648 9.794 -4.788 1.00 31.12 C ATOM 1063 CZ2 TRP B 21 -9.145 8.465 -6.786 1.00 26.17 C ATOM 1064 CZ3 TRP B 21 -10.137 10.471 -5.881 1.00 29.87 C ATOM 1065 CH2 TRP B 21 -9.394 9.806 -6.865 1.00 26.93 C ATOM 1066 HE1 TRP B 21 -9.085 5.722 -5.903 1.00 0.00 H ATOM 1067 H TRP B 21 -12.538 9.224 -0.832 1.00 0.00 H ATOM 1068 N VAL B 22 -9.641 10.096 -1.399 1.00 24.03 N ATOM 1069 CA VAL B 22 -8.510 10.998 -1.579 1.00 28.58 C ATOM 1070 C VAL B 22 -7.387 10.713 -0.579 1.00 31.59 C ATOM 1071 O VAL B 22 -6.220 10.620 -0.958 1.00 27.50 O ATOM 1072 CB VAL B 22 -8.949 12.473 -1.463 1.00 22.71 C ATOM 1073 CG1 VAL B 22 -7.747 13.384 -1.258 1.00 20.88 C ATOM 1074 CG2 VAL B 22 -9.745 12.891 -2.691 1.00 25.21 C ATOM 1075 H VAL B 22 -10.572 10.505 -1.180 1.00 0.00 H ATOM 1076 N GLN B 23 -7.742 10.536 0.670 1.00 25.89 N ATOM 1077 CA GLN B 23 -6.755 10.275 1.663 1.00 29.13 C ATOM 1078 C GLN B 23 -6.062 8.915 1.441 1.00 29.22 C ATOM 1079 O GLN B 23 -4.907 8.766 1.644 1.00 25.97 O ATOM 1080 CB GLN B 23 -7.393 10.371 3.020 1.00 29.58 C ATOM 1081 CG GLN B 23 -6.573 9.820 4.141 1.00 32.12 C ATOM 1082 CD GLN B 23 -5.294 10.582 4.333 1.00 47.25 C ATOM 1083 OE1 GLN B 23 -5.198 11.752 4.004 1.00 54.07 O ATOM 1084 NE2 GLN B 23 -4.302 9.921 4.880 1.00 50.02 N ATOM 1085 HE22 GLN B 23 -4.426 8.923 5.146 1.00 0.00 H ATOM 1086 HE21 GLN B 23 -3.391 10.395 5.048 1.00 0.00 H ATOM 1087 H GLN B 23 -8.746 10.586 0.936 1.00 0.00 H ATOM 1088 N PHE B 24 -6.822 7.905 1.082 1.00 21.82 N ATOM 1089 CA PHE B 24 -6.269 6.632 0.726 1.00 19.01 C ATOM 1090 C PHE B 24 -5.288 6.772 -0.430 1.00 25.00 C ATOM 1091 O PHE B 24 -4.235 6.238 -0.392 1.00 23.43 O ATOM 1092 CB PHE B 24 -7.373 5.666 0.392 1.00 18.28 C ATOM 1093 CG PHE B 24 -6.926 4.275 0.122 1.00 23.70 C ATOM 1094 CD1 PHE B 24 -6.871 3.358 1.129 1.00 17.88 C ATOM 1095 CD2 PHE B 24 -6.631 3.872 -1.148 1.00 19.80 C ATOM 1096 CE1 PHE B 24 -6.521 2.073 0.883 1.00 19.23 C ATOM 1097 CE2 PHE B 24 -6.261 2.586 -1.403 1.00 19.01 C ATOM 1098 CZ PHE B 24 -6.202 1.685 -0.380 1.00 23.71 C ATOM 1099 H PHE B 24 -7.854 8.033 1.056 1.00 0.00 H ATOM 1100 N MET B 25 -5.660 7.530 -1.437 1.00 22.07 N ATOM 1101 CA MET B 25 -4.829 7.715 -2.593 1.00 25.37 C ATOM 1102 C MET B 25 -3.573 8.497 -2.305 1.00 23.64 C ATOM 1103 O MET B 25 -2.581 8.212 -2.885 1.00 30.10 O ATOM 1104 CB MET B 25 -5.585 8.367 -3.736 1.00 17.92 C ATOM 1105 CG MET B 25 -6.699 7.527 -4.297 1.00 26.53 C ATOM 1106 SD MET B 25 -6.257 5.991 -5.089 1.00 32.74 S ATOM 1107 CE MET B 25 -5.174 6.468 -6.373 1.00 22.73 C ATOM 1108 H MET B 25 -6.582 8.009 -1.395 1.00 0.00 H ATOM 1109 N LYS B 26 -3.640 9.468 -1.424 1.00 18.60 N ATOM 1110 CA LYS B 26 -2.478 10.182 -1.039 1.00 21.36 C ATOM 1111 C LYS B 26 -1.542 9.252 -0.333 1.00 26.08 C ATOM 1112 O LYS B 26 -0.379 9.347 -0.518 1.00 27.92 O ATOM 1113 CB LYS B 26 -2.787 11.360 -0.150 1.00 22.11 C ATOM 1114 CG LYS B 26 -3.358 12.528 -0.886 1.00 28.23 C ATOM 1115 CD LYS B 26 -3.598 13.683 0.039 1.00 26.69 C ATOM 1116 CE LYS B 26 -4.413 14.740 -0.661 1.00 33.39 C ATOM 1117 NZ LYS B 26 -4.803 15.763 0.311 1.00 47.04 N ATOM 1118 HZ1 LYS B 26 -5.369 15.325 1.065 1.00 0.00 H ATOM 1119 HZ2 LYS B 26 -3.950 16.192 0.722 1.00 0.00 H ATOM 1120 HZ3 LYS B 26 -5.366 16.496 -0.166 1.00 0.00 H ATOM 1121 H LYS B 26 -4.558 9.717 -1.003 1.00 0.00 H ATOM 1122 N GLU B 27 -2.066 8.355 0.462 1.00 16.04 N ATOM 1123 CA GLU B 27 -1.178 7.416 1.136 1.00 18.48 C ATOM 1124 C GLU B 27 -0.532 6.477 0.126 1.00 16.75 C ATOM 1125 O GLU B 27 0.635 6.121 0.255 1.00 19.74 O ATOM 1126 CB GLU B 27 -1.947 6.619 2.188 1.00 23.31 C ATOM 1127 CG GLU B 27 -2.404 7.449 3.370 1.00 19.74 C ATOM 1128 CD GLU B 27 -3.443 6.742 4.219 1.00 27.36 C ATOM 1129 OE1 GLU B 27 -3.904 5.651 3.820 1.00 20.80 O ATOM 1130 OE2 GLU B 27 -3.802 7.281 5.287 1.00 34.05 O ATOM 1131 H GLU B 27 -3.095 8.313 0.610 1.00 0.00 H ATOM 1132 N ALA B 28 -1.304 6.090 -0.884 1.00 16.04 N ATOM 1133 CA ALA B 28 -0.803 5.242 -1.958 1.00 15.18 C ATOM 1134 C ALA B 28 0.313 5.940 -2.715 1.00 15.90 C ATOM 1135 O ALA B 28 1.319 5.321 -3.063 1.00 19.78 O ATOM 1136 CB ALA B 28 -1.928 4.868 -2.910 1.00 11.97 C ATOM 1137 H ALA B 28 -2.296 6.402 -0.909 1.00 0.00 H ATOM 1138 N GLY B 29 0.131 7.234 -2.962 1.00 15.70 N ATOM 1139 CA GLY B 29 1.138 8.030 -3.642 1.00 17.06 C ATOM 1140 C GLY B 29 2.425 8.101 -2.845 1.00 18.16 C ATOM 1141 O GLY B 29 3.520 7.961 -3.394 1.00 21.09 O ATOM 1142 H GLY B 29 -0.755 7.688 -2.661 1.00 0.00 H ATOM 1143 N GLN B 30 2.294 8.323 -1.542 1.00 14.59 N ATOM 1144 CA GLN B 30 3.449 8.317 -0.652 1.00 21.40 C ATOM 1145 C GLN B 30 4.105 6.937 -0.647 1.00 16.59 C ATOM 1146 O GLN B 30 5.323 6.820 -0.706 1.00 18.73 O ATOM 1147 CB GLN B 30 3.028 8.686 0.773 1.00 21.69 C ATOM 1148 CG GLN B 30 2.366 10.046 0.917 1.00 31.29 C ATOM 1149 CD GLN B 30 3.373 11.174 1.008 1.00 46.08 C ATOM 1150 OE1 GLN B 30 4.371 11.192 0.286 1.00 43.90 O ATOM 1151 NE2 GLN B 30 3.123 12.121 1.909 1.00 47.17 N ATOM 1152 HE22 GLN B 30 2.267 12.066 2.498 1.00 0.00 H ATOM 1153 HE21 GLN B 30 3.783 12.916 2.024 1.00 0.00 H ATOM 1154 H GLN B 30 1.349 8.505 -1.149 1.00 0.00 H ATOM 1155 N GLY B 31 3.282 5.895 -0.579 1.00 17.43 N ATOM 1156 CA GLY B 31 3.778 4.532 -0.538 1.00 21.55 C ATOM 1157 C GLY B 31 4.533 4.159 -1.796 1.00 17.72 C ATOM 1158 O GLY B 31 5.548 3.465 -1.736 1.00 16.09 O ATOM 1159 H GLY B 31 2.256 6.061 -0.555 1.00 0.00 H ATOM 1160 N SER B 32 4.043 4.624 -2.941 1.00 13.37 N ATOM 1161 CA SER B 32 4.726 4.391 -4.211 1.00 17.29 C ATOM 1162 C SER B 32 6.111 5.023 -4.229 1.00 20.88 C ATOM 1163 O SER B 32 7.055 4.431 -4.748 1.00 22.20 O ATOM 1164 CB SER B 32 3.901 4.935 -5.377 1.00 15.62 C ATOM 1165 OG SER B 32 2.623 4.309 -5.419 1.00 27.12 O ATOM 1166 HG SER B 32 2.141 4.488 -4.573 1.00 0.00 H ATOM 1167 H SER B 32 3.155 5.165 -2.932 1.00 0.00 H ATOM 1168 N ARG B 33 6.237 6.222 -3.661 1.00 16.16 N ATOM 1169 CA ARG B 33 7.529 6.897 -3.620 1.00 23.61 C ATOM 1170 C ARG B 33 8.499 6.176 -2.694 1.00 27.20 C ATOM 1171 O ARG B 33 9.699 6.127 -2.961 1.00 27.74 O ATOM 1172 CB ARG B 33 7.388 8.364 -3.207 1.00 22.95 C ATOM 1173 CG ARG B 33 8.714 9.117 -3.243 1.00 29.58 C ATOM 1174 CD ARG B 33 8.564 10.590 -3.605 1.00 31.42 C ATOM 1175 NE ARG B 33 7.299 10.899 -4.265 1.00 31.10 N ATOM 1176 CZ ARG B 33 6.308 11.565 -3.680 1.00 32.79 C ATOM 1177 NH1 ARG B 33 6.445 11.980 -2.428 1.00 34.42 N ATOM 1178 NH2 ARG B 33 5.186 11.815 -4.344 1.00 33.24 N ATOM 1179 HE ARG B 33 7.166 10.581 -5.246 1.00 0.00 H ATOM 1180 HH12 ARG B 33 5.673 12.501 -1.966 1.00 0.00 H ATOM 1181 HH11 ARG B 33 7.324 11.784 -1.909 1.00 0.00 H ATOM 1182 HH22 ARG B 33 4.414 12.336 -3.882 1.00 0.00 H ATOM 1183 HH21 ARG B 33 5.079 11.490 -5.326 1.00 0.00 H ATOM 1184 H ARG B 33 5.404 6.682 -3.242 1.00 0.00 H ATOM 1185 N ASP B 34 7.980 5.613 -1.610 1.00 23.09 N ATOM 1186 CA ASP B 34 8.777 4.827 -0.717 1.00 21.67 C ATOM 1187 C ASP B 34 9.313 3.625 -1.440 1.00 19.39 C ATOM 1188 O ASP B 34 10.414 3.288 -1.281 1.00 22.78 O ATOM 1189 CB ASP B 34 8.010 4.404 0.531 1.00 18.92 C ATOM 1190 CG ASP B 34 7.676 5.544 1.417 1.00 26.04 C ATOM 1191 OD1 ASP B 34 8.413 6.486 1.465 1.00 30.00 O ATOM 1192 OD2 ASP B 34 6.669 5.493 2.082 1.00 30.63 O ATOM 1193 H ASP B 34 6.969 5.746 -1.404 1.00 0.00 H ATOM 1194 N MET B 35 8.486 3.007 -2.251 1.00 20.21 N ATOM 1195 CA MET B 35 8.870 1.906 -3.123 1.00 26.09 C ATOM 1196 C MET B 35 9.972 2.280 -4.124 1.00 26.71 C ATOM 1197 O MET B 35 10.942 1.605 -4.236 1.00 20.42 O ATOM 1198 CB MET B 35 7.659 1.302 -3.824 1.00 19.51 C ATOM 1199 CG MET B 35 6.703 0.577 -2.911 1.00 17.75 C ATOM 1200 SD MET B 35 7.362 -0.717 -1.895 1.00 16.81 S ATOM 1201 CE MET B 35 7.480 -2.015 -3.049 1.00 14.00 C ATOM 1202 H MET B 35 7.496 3.323 -2.272 1.00 0.00 H ATOM 1203 N TRP B 36 9.803 3.392 -4.797 1.00 26.69 N ATOM 1204 CA TRP B 36 10.790 3.894 -5.700 1.00 31.30 C ATOM 1205 C TRP B 36 12.078 4.213 -4.959 1.00 32.48 C ATOM 1206 O TRP B 36 13.136 3.979 -5.466 1.00 33.19 O ATOM 1207 CB TRP B 36 10.226 5.077 -6.502 1.00 30.67 C ATOM 1208 CG TRP B 36 11.221 6.035 -6.951 1.00 45.30 C ATOM 1209 CD1 TRP B 36 11.571 7.173 -6.329 1.00 43.23 C ATOM 1210 CD2 TRP B 36 12.110 5.879 -8.045 1.00 47.92 C ATOM 1211 NE1 TRP B 36 12.580 7.787 -7.010 1.00 50.71 N ATOM 1212 CE2 TRP B 36 12.929 7.002 -8.071 1.00 51.13 C ATOM 1213 CE3 TRP B 36 12.271 4.907 -9.028 1.00 50.79 C ATOM 1214 CZ2 TRP B 36 13.897 7.180 -9.033 1.00 53.88 C ATOM 1215 CZ3 TRP B 36 13.219 5.088 -9.977 1.00 49.31 C ATOM 1216 CH2 TRP B 36 14.017 6.214 -9.984 1.00 53.36 C ATOM 1217 HE1 TRP B 36 13.012 8.700 -6.763 1.00 0.00 H ATOM 1218 H TRP B 36 8.920 3.927 -4.669 1.00 0.00 H ATOM 1219 N ARG B 37 11.951 4.847 -3.806 1.00 22.50 N ATOM 1220 CA ARG B 37 13.101 5.160 -2.995 1.00 27.42 C ATOM 1221 C ARG B 37 13.926 3.920 -2.677 1.00 28.72 C ATOM 1222 O ARG B 37 15.117 3.951 -2.706 1.00 32.61 O ATOM 1223 CB ARG B 37 12.727 5.904 -1.717 1.00 29.02 C ATOM 1224 CG ARG B 37 13.443 7.223 -1.559 1.00 44.78 C ATOM 1225 CD ARG B 37 12.797 8.130 -0.543 1.00 49.32 C ATOM 1226 NE ARG B 37 11.932 9.180 -1.062 1.00 39.16 N ATOM 1227 CZ ARG B 37 12.340 10.203 -1.793 1.00 48.68 C ATOM 1228 NH1 ARG B 37 13.600 10.321 -2.167 1.00 43.67 N ATOM 1229 NH2 ARG B 37 11.471 11.100 -2.173 1.00 45.72 N ATOM 1230 HE ARG B 37 10.917 9.121 -0.841 1.00 0.00 H ATOM 1231 HH12 ARG B 37 13.898 11.135 -2.742 1.00 0.00 H ATOM 1232 HH11 ARG B 37 14.295 9.600 -1.887 1.00 0.00 H ATOM 1233 HH22 ARG B 37 11.778 11.910 -2.748 1.00 0.00 H ATOM 1234 HH21 ARG B 37 10.472 11.004 -1.900 1.00 0.00 H ATOM 1235 H ARG B 37 11.004 5.125 -3.478 1.00 0.00 H ATOM 1236 N ALA B 38 13.260 2.842 -2.358 1.00 21.53 N ATOM 1237 CA ALA B 38 13.914 1.581 -2.040 1.00 25.89 C ATOM 1238 C ALA B 38 14.651 1.040 -3.260 1.00 25.41 C ATOM 1239 O ALA B 38 15.769 0.545 -3.152 1.00 25.71 O ATOM 1240 CB ALA B 38 12.897 0.571 -1.551 1.00 18.13 C ATOM 1241 H ALA B 38 12.221 2.887 -2.330 1.00 0.00 H ATOM 1242 N TYR B 39 14.012 1.139 -4.419 1.00 22.97 N ATOM 1243 CA TYR B 39 14.584 0.640 -5.664 1.00 34.23 C ATOM 1244 C TYR B 39 15.824 1.425 -6.083 1.00 37.49 C ATOM 1245 O TYR B 39 16.831 0.844 -6.480 1.00 39.00 O ATOM 1246 CB TYR B 39 13.537 0.671 -6.781 1.00 41.64 C ATOM 1247 CG TYR B 39 14.096 0.374 -8.156 1.00 56.97 C ATOM 1248 CD1 TYR B 39 14.332 1.396 -9.070 1.00 56.28 C ATOM 1249 CD2 TYR B 39 14.394 -0.926 -8.539 1.00 58.32 C ATOM 1250 CE1 TYR B 39 14.845 1.127 -10.325 1.00 56.19 C ATOM 1251 CE2 TYR B 39 14.903 -1.205 -9.792 1.00 63.17 C ATOM 1252 CZ TYR B 39 15.129 -0.177 -10.680 1.00 63.00 C ATOM 1253 OH TYR B 39 15.641 -0.461 -11.926 1.00 73.33 O ATOM 1254 HH TYR B 39 15.744 0.380 -12.439 1.00 0.00 H ATOM 1255 H TYR B 39 13.074 1.587 -4.440 1.00 0.00 H ATOM 1256 N SER B 40 15.744 2.748 -5.992 1.00 37.62 N ATOM 1257 CA SER B 40 16.848 3.605 -6.405 1.00 38.60 C ATOM 1258 C SER B 40 18.018 3.494 -5.436 1.00 40.61 C ATOM 1259 O SER B 40 19.177 3.525 -5.849 1.00 48.71 O ATOM 1260 CB SER B 40 16.391 5.060 -6.521 1.00 39.98 C ATOM 1261 OG SER B 40 16.203 5.644 -5.247 1.00 57.03 O ATOM 1262 HG SER B 40 15.513 5.136 -4.751 1.00 0.00 H ATOM 1263 H SER B 40 14.875 3.181 -5.618 1.00 0.00 H ATOM 1264 N ASP B 41 17.717 3.328 -4.159 1.00 38.64 N ATOM 1265 CA ASP B 41 18.732 3.212 -3.148 1.00 38.24 C ATOM 1266 C ASP B 41 19.444 1.923 -3.325 1.00 39.11 C ATOM 1267 O ASP B 41 20.594 1.814 -3.044 1.00 43.24 O ATOM 1268 CB ASP B 41 18.161 3.298 -1.745 1.00 34.92 C ATOM 1269 CG ASP B 41 17.952 4.692 -1.291 1.00 41.17 C ATOM 1270 OD1 ASP B 41 18.092 5.610 -2.075 1.00 36.91 O ATOM 1271 OD2 ASP B 41 17.622 4.873 -0.132 1.00 42.14 O ATOM 1272 H ASP B 41 16.717 3.280 -3.878 1.00 0.00 H ATOM 1273 N MET B 42 18.745 0.935 -3.809 1.00 35.98 N ATOM 1274 CA MET B 42 19.359 -0.348 -4.073 1.00 40.59 C ATOM 1275 C MET B 42 20.318 -0.371 -5.286 1.00 45.51 C ATOM 1276 O MET B 42 21.337 -0.999 -5.238 1.00 41.82 O ATOM 1277 CB MET B 42 18.308 -1.423 -4.208 1.00 33.69 C ATOM 1278 CG MET B 42 18.898 -2.746 -4.580 1.00 42.34 C ATOM 1279 SD MET B 42 17.679 -3.941 -5.021 1.00 50.32 S ATOM 1280 CE MET B 42 17.161 -3.227 -6.548 1.00 46.87 C ATOM 1281 H MET B 42 17.733 1.071 -4.008 1.00 0.00 H ATOM 1282 N LYS B 43 19.985 0.319 -6.356 1.00 36.69 N ATOM 1283 CA LYS B 43 20.927 0.482 -7.443 1.00 47.11 C ATOM 1284 C LYS B 43 22.115 1.314 -6.987 1.00 53.66 C ATOM 1285 O LYS B 43 23.239 0.920 -7.149 1.00 57.13 O ATOM 1286 CB LYS B 43 20.262 1.112 -8.629 1.00 42.10 C ATOM 1287 CG LYS B 43 19.585 0.094 -9.499 1.00 46.63 C ATOM 1288 CD LYS B 43 19.203 0.726 -10.817 1.00 51.27 C ATOM 1289 CE LYS B 43 18.158 -0.099 -11.544 1.00 55.39 C ATOM 1290 NZ LYS B 43 18.788 -0.851 -12.660 1.00 55.92 N ATOM 1291 HZ1 LYS B 43 19.220 -0.181 -13.328 1.00 0.00 H ATOM 1292 HZ2 LYS B 43 19.520 -1.484 -12.280 1.00 0.00 H ATOM 1293 HZ3 LYS B 43 18.063 -1.412 -13.151 1.00 0.00 H ATOM 1294 H LYS B 43 19.040 0.749 -6.421 1.00 0.00 H ATOM 1295 N LYS B 44 21.827 2.438 -6.361 1.00 50.31 N ATOM 1296 CA LYS B 44 22.842 3.355 -5.848 1.00 50.43 C ATOM 1297 C LYS B 44 23.813 2.668 -4.899 1.00 51.40 C ATOM 1298 O LYS B 44 25.020 2.890 -4.969 1.00 64.35 O ATOM 1299 CB LYS B 44 22.186 4.533 -5.128 1.00 48.51 C ATOM 1300 CG LYS B 44 21.691 5.634 -6.045 1.00 54.80 C ATOM 1301 CD LYS B 44 20.720 6.545 -5.313 1.00 49.98 C ATOM 1302 CE LYS B 44 20.668 7.932 -5.936 1.00 53.42 C ATOM 1303 NZ LYS B 44 21.736 8.828 -5.402 1.00 54.77 N ATOM 1304 HZ1 LYS B 44 21.619 8.930 -4.374 1.00 0.00 H ATOM 1305 HZ2 LYS B 44 22.668 8.415 -5.607 1.00 0.00 H ATOM 1306 HZ3 LYS B 44 21.662 9.761 -5.854 1.00 0.00 H ATOM 1307 H LYS B 44 20.826 2.685 -6.225 1.00 0.00 H ATOM 1308 N ALA B 45 23.282 1.839 -4.006 1.00 52.33 N ATOM 1309 CA ALA B 45 24.123 1.124 -3.054 1.00 53.13 C ATOM 1310 C ALA B 45 25.009 0.111 -3.765 1.00 51.99 C ATOM 1311 O ALA B 45 26.177 -0.050 -3.411 1.00 54.29 O ATOM 1312 CB ALA B 45 23.273 0.434 -2.004 1.00 39.97 C ATOM 1313 H ALA B 45 22.252 1.698 -3.986 1.00 0.00 H ATOM 1314 N ASN B 46 24.456 -0.515 -4.787 1.00 54.79 N ATOM 1315 CA ASN B 46 25.041 -1.655 -5.455 1.00 55.96 C ATOM 1316 C ASN B 46 25.787 -2.605 -4.546 1.00 56.45 C ATOM 1317 O ASN B 46 26.956 -2.826 -4.715 1.00 68.06 O ATOM 1318 CB ASN B 46 25.921 -1.202 -6.605 1.00 65.23 C ATOM 1319 CG ASN B 46 26.407 -2.359 -7.445 1.00 77.61 C ATOM 1320 OD1 ASN B 46 26.015 -3.501 -7.221 1.00 84.41 O ATOM 1321 ND2 ASN B 46 27.262 -2.078 -8.402 1.00 76.48 N ATOM 1322 HD22 ASN B 46 27.566 -1.095 -8.555 1.00 0.00 H ATOM 1323 HD21 ASN B 46 27.635 -2.838 -9.006 1.00 0.00 H ATOM 1324 H ASN B 46 23.540 -0.165 -5.134 1.00 0.00 H ATOM 1325 N TRP B 47 25.089 -3.186 -3.595 1.00 54.45 N ATOM 1326 CA TRP B 47 25.662 -4.015 -2.555 1.00 45.76 C ATOM 1327 C TRP B 47 25.174 -5.438 -2.769 1.00 53.86 C ATOM 1328 O TRP B 47 23.972 -5.665 -2.904 1.00 58.44 O ATOM 1329 CB TRP B 47 25.192 -3.498 -1.199 1.00 47.43 C ATOM 1330 CG TRP B 47 26.060 -3.871 -0.050 1.00 46.07 C ATOM 1331 CD1 TRP B 47 25.972 -4.998 0.716 1.00 43.43 C ATOM 1332 CD2 TRP B 47 27.136 -3.101 0.491 1.00 36.48 C ATOM 1333 NE1 TRP B 47 26.934 -4.980 1.695 1.00 40.45 N ATOM 1334 CE2 TRP B 47 27.663 -3.825 1.577 1.00 43.05 C ATOM 1335 CE3 TRP B 47 27.710 -1.870 0.159 1.00 38.53 C ATOM 1336 CZ2 TRP B 47 28.734 -3.362 2.331 1.00 43.67 C ATOM 1337 CZ3 TRP B 47 28.774 -1.413 0.908 1.00 44.33 C ATOM 1338 CH2 TRP B 47 29.277 -2.156 1.979 1.00 45.07 C ATOM 1339 HE1 TRP B 47 27.085 -5.721 2.409 1.00 0.00 H ATOM 1340 H TRP B 47 24.059 -3.041 -3.589 1.00 0.00 H ATOM 1341 N LYS B 48 26.101 -6.393 -2.820 1.00 54.40 N ATOM 1342 CA LYS B 48 25.733 -7.794 -3.007 1.00 55.97 C ATOM 1343 C LYS B 48 24.760 -8.244 -1.927 1.00 51.58 C ATOM 1344 O LYS B 48 24.930 -7.911 -0.755 1.00 50.04 O ATOM 1345 CB LYS B 48 26.967 -8.703 -2.994 1.00 54.91 C ATOM 1346 CG LYS B 48 26.624 -10.196 -2.963 1.00 56.79 C ATOM 1347 CD LYS B 48 27.856 -11.077 -2.819 1.00 57.86 C ATOM 1348 CE LYS B 48 27.482 -12.556 -2.748 1.00 59.77 C ATOM 1349 NZ LYS B 48 26.932 -12.951 -1.419 1.00 60.52 N ATOM 1350 HZ1 LYS B 48 27.643 -12.767 -0.682 1.00 0.00 H ATOM 1351 HZ2 LYS B 48 26.075 -12.396 -1.221 1.00 0.00 H ATOM 1352 HZ3 LYS B 48 26.696 -13.964 -1.430 1.00 0.00 H ATOM 1353 H LYS B 48 27.104 -6.137 -2.725 1.00 0.00 H ATOM 1354 N ASN B 49 23.755 -8.970 -2.353 1.00 54.34 N ATOM 1355 CA ASN B 49 22.773 -9.495 -1.460 1.00 55.38 C ATOM 1356 C ASN B 49 22.066 -8.441 -0.620 1.00 47.42 C ATOM 1357 O ASN B 49 21.837 -8.616 0.545 1.00 43.85 O ATOM 1358 CB ASN B 49 23.439 -10.523 -0.596 1.00 52.59 C ATOM 1359 CG ASN B 49 23.236 -11.916 -1.121 1.00 70.25 C ATOM 1360 OD1 ASN B 49 23.128 -12.143 -2.324 1.00 68.28 O ATOM 1361 ND2 ASN B 49 23.170 -12.856 -0.214 1.00 66.97 N ATOM 1362 HD22 ASN B 49 23.267 -12.615 0.793 1.00 0.00 H ATOM 1363 HD21 ASN B 49 23.020 -13.845 -0.500 1.00 0.00 H ATOM 1364 H ASN B 49 23.671 -9.169 -3.370 1.00 0.00 H ATOM 1365 N SER B 50 21.729 -7.338 -1.242 1.00 48.00 N ATOM 1366 CA SER B 50 21.027 -6.280 -0.543 1.00 42.41 C ATOM 1367 C SER B 50 19.542 -6.280 -0.877 1.00 43.01 C ATOM 1368 O SER B 50 18.766 -5.669 -0.191 1.00 39.19 O ATOM 1369 CB SER B 50 21.648 -4.918 -0.832 1.00 34.29 C ATOM 1370 OG SER B 50 21.423 -4.488 -2.138 1.00 33.84 O ATOM 1371 HG SER B 50 21.846 -3.603 -2.270 1.00 0.00 H ATOM 1372 H SER B 50 21.968 -7.221 -2.247 1.00 0.00 H ATOM 1373 N ASP B 51 19.180 -6.981 -1.939 1.00 31.30 N ATOM 1374 CA ASP B 51 17.842 -6.896 -2.477 1.00 42.82 C ATOM 1375 C ASP B 51 16.747 -7.139 -1.470 1.00 41.77 C ATOM 1376 O ASP B 51 15.842 -6.351 -1.387 1.00 35.70 O ATOM 1377 CB ASP B 51 17.626 -7.728 -3.727 1.00 49.87 C ATOM 1378 CG ASP B 51 18.454 -8.962 -3.757 1.00 63.12 C ATOM 1379 OD1 ASP B 51 18.249 -9.855 -2.916 1.00 57.81 O ATOM 1380 OD2 ASP B 51 19.316 -9.014 -4.634 1.00 59.27 O ATOM 1381 H ASP B 51 19.874 -7.607 -2.396 1.00 0.00 H ATOM 1382 N LYS B 52 16.861 -8.194 -0.698 1.00 31.70 N ATOM 1383 CA LYS B 52 15.829 -8.504 0.240 1.00 33.29 C ATOM 1384 C LYS B 52 15.668 -7.427 1.267 1.00 29.33 C ATOM 1385 O LYS B 52 14.590 -7.146 1.656 1.00 26.23 O ATOM 1386 CB LYS B 52 15.997 -9.878 0.811 1.00 39.82 C ATOM 1387 CG LYS B 52 16.022 -10.876 -0.325 1.00 41.34 C ATOM 1388 CD LYS B 52 15.321 -12.168 -0.036 1.00 46.54 C ATOM 1389 CE LYS B 52 15.813 -13.262 -0.969 1.00 51.98 C ATOM 1390 NZ LYS B 52 15.921 -12.973 -2.428 1.00 54.21 N ATOM 1391 HZ1 LYS B 52 14.985 -12.714 -2.799 1.00 0.00 H ATOM 1392 HZ2 LYS B 52 16.584 -12.185 -2.576 1.00 0.00 H ATOM 1393 HZ3 LYS B 52 16.270 -13.819 -2.923 1.00 0.00 H ATOM 1394 H LYS B 52 17.701 -8.803 -0.769 1.00 0.00 H ATOM 1395 N TYR B 53 16.742 -6.770 1.609 1.00 20.90 N ATOM 1396 CA TYR B 53 16.678 -5.667 2.562 1.00 23.25 C ATOM 1397 C TYR B 53 15.850 -4.515 2.003 1.00 19.90 C ATOM 1398 O TYR B 53 14.957 -3.998 2.673 1.00 24.94 O ATOM 1399 CB TYR B 53 18.068 -5.150 2.929 1.00 23.90 C ATOM 1400 CG TYR B 53 18.007 -3.813 3.635 1.00 22.43 C ATOM 1401 CD1 TYR B 53 17.638 -3.732 4.965 1.00 21.52 C ATOM 1402 CD2 TYR B 53 18.297 -2.632 2.963 1.00 20.59 C ATOM 1403 CE1 TYR B 53 17.568 -2.520 5.617 1.00 22.90 C ATOM 1404 CE2 TYR B 53 18.225 -1.410 3.606 1.00 25.83 C ATOM 1405 CZ TYR B 53 17.859 -1.363 4.936 1.00 22.19 C ATOM 1406 OH TYR B 53 17.782 -0.159 5.592 1.00 30.60 O ATOM 1407 HH TYR B 53 18.668 0.282 5.574 1.00 0.00 H ATOM 1408 H TYR B 53 17.658 -7.037 1.196 1.00 0.00 H ATOM 1409 N PHE B 54 16.159 -4.110 0.778 1.00 20.96 N ATOM 1410 CA PHE B 54 15.462 -2.994 0.155 1.00 18.19 C ATOM 1411 C PHE B 54 13.998 -3.313 -0.146 1.00 22.30 C ATOM 1412 O PHE B 54 13.138 -2.439 -0.054 1.00 20.65 O ATOM 1413 CB PHE B 54 16.198 -2.536 -1.104 1.00 20.26 C ATOM 1414 CG PHE B 54 17.489 -1.823 -0.817 1.00 29.51 C ATOM 1415 CD1 PHE B 54 17.484 -0.506 -0.394 1.00 28.03 C ATOM 1416 CD2 PHE B 54 18.704 -2.471 -0.958 1.00 29.88 C ATOM 1417 CE1 PHE B 54 18.665 0.153 -0.121 1.00 29.38 C ATOM 1418 CE2 PHE B 54 19.889 -1.815 -0.688 1.00 30.15 C ATOM 1419 CZ PHE B 54 19.867 -0.500 -0.269 1.00 32.40 C ATOM 1420 H PHE B 54 16.913 -4.598 0.253 1.00 0.00 H ATOM 1421 N HIS B 55 13.720 -4.566 -0.496 1.00 22.44 N ATOM 1422 CA HIS B 55 12.344 -5.012 -0.694 1.00 25.02 C ATOM 1423 C HIS B 55 11.542 -4.864 0.595 1.00 19.14 C ATOM 1424 O HIS B 55 10.426 -4.338 0.596 1.00 19.02 O ATOM 1425 CB HIS B 55 12.318 -6.472 -1.141 1.00 23.02 C ATOM 1426 CG HIS B 55 12.845 -6.688 -2.525 1.00 37.88 C ATOM 1427 ND1 HIS B 55 13.412 -7.879 -2.926 1.00 40.13 N ATOM 1428 CD2 HIS B 55 12.881 -5.872 -3.604 1.00 35.68 C ATOM 1429 CE1 HIS B 55 13.781 -7.784 -4.190 1.00 38.84 C ATOM 1430 NE2 HIS B 55 13.472 -6.575 -4.625 1.00 37.46 N ATOM 1431 H HIS B 55 14.499 -5.242 -0.631 1.00 0.00 H ATOM 1432 N ALA B 56 12.123 -5.335 1.690 1.00 12.87 N ATOM 1433 CA ALA B 56 11.492 -5.251 2.995 1.00 18.08 C ATOM 1434 C ALA B 56 11.323 -3.797 3.426 1.00 14.98 C ATOM 1435 O ALA B 56 10.256 -3.405 3.904 1.00 17.21 O ATOM 1436 CB ALA B 56 12.313 -6.019 4.021 1.00 17.37 C ATOM 1437 H ALA B 56 13.060 -5.779 1.612 1.00 0.00 H ATOM 1438 N ARG B 57 12.371 -3.002 3.227 1.00 17.48 N ATOM 1439 CA ARG B 57 12.390 -1.607 3.664 1.00 16.33 C ATOM 1440 C ARG B 57 11.353 -0.767 2.943 1.00 16.89 C ATOM 1441 O ARG B 57 10.662 0.036 3.561 1.00 19.01 O ATOM 1442 CB ARG B 57 13.768 -0.989 3.437 1.00 17.61 C ATOM 1443 CG ARG B 57 14.006 0.305 4.204 1.00 20.93 C ATOM 1444 CD ARG B 57 15.124 1.115 3.566 1.00 13.01 C ATOM 1445 NE ARG B 57 14.647 1.906 2.436 1.00 18.58 N ATOM 1446 CZ ARG B 57 15.409 2.700 1.695 1.00 22.57 C ATOM 1447 NH1 ARG B 57 16.701 2.803 1.950 1.00 24.92 N ATOM 1448 NH2 ARG B 57 14.875 3.389 0.695 1.00 21.53 N ATOM 1449 HE ARG B 57 13.637 1.843 2.194 1.00 0.00 H ATOM 1450 HH12 ARG B 57 17.298 3.426 1.369 1.00 0.00 H ATOM 1451 HH11 ARG B 57 17.121 2.261 2.732 1.00 0.00 H ATOM 1452 HH22 ARG B 57 15.473 4.011 0.115 1.00 0.00 H ATOM 1453 HH21 ARG B 57 13.858 3.307 0.491 1.00 0.00 H ATOM 1454 H ARG B 57 13.207 -3.387 2.743 1.00 0.00 H ATOM 1455 N GLY B 58 11.256 -0.943 1.631 1.00 13.70 N ATOM 1456 CA GLY B 58 10.287 -0.201 0.850 1.00 12.38 C ATOM 1457 C GLY B 58 8.857 -0.534 1.234 1.00 16.93 C ATOM 1458 O GLY B 58 8.011 0.353 1.325 1.00 13.22 O ATOM 1459 H GLY B 58 11.884 -1.623 1.157 1.00 0.00 H ATOM 1460 N ASN B 59 8.586 -1.819 1.451 1.00 16.61 N ATOM 1461 CA ASN B 59 7.267 -2.265 1.892 1.00 16.23 C ATOM 1462 C ASN B 59 6.962 -1.829 3.327 1.00 13.70 C ATOM 1463 O ASN B 59 5.825 -1.524 3.669 1.00 15.93 O ATOM 1464 CB ASN B 59 7.154 -3.789 1.781 1.00 12.57 C ATOM 1465 CG ASN B 59 6.862 -4.257 0.367 1.00 16.25 C ATOM 1466 OD1 ASN B 59 5.704 -4.346 -0.038 1.00 13.81 O ATOM 1467 ND2 ASN B 59 7.910 -4.568 -0.388 1.00 13.25 N ATOM 1468 HD22 ASN B 59 8.872 -4.478 -0.004 1.00 0.00 H ATOM 1469 HD21 ASN B 59 7.768 -4.902 -1.363 1.00 0.00 H ATOM 1470 H ASN B 59 9.335 -2.525 1.302 1.00 0.00 H ATOM 1471 N TYR B 60 7.992 -1.815 4.161 1.00 13.96 N ATOM 1472 CA TYR B 60 7.866 -1.366 5.541 1.00 15.60 C ATOM 1473 C TYR B 60 7.526 0.121 5.587 1.00 16.91 C ATOM 1474 O TYR B 60 6.510 0.506 6.156 1.00 17.01 O ATOM 1475 CB TYR B 60 9.164 -1.661 6.290 1.00 14.21 C ATOM 1476 CG TYR B 60 9.219 -1.228 7.735 1.00 19.92 C ATOM 1477 CD1 TYR B 60 8.676 -2.017 8.743 1.00 20.94 C ATOM 1478 CD2 TYR B 60 9.858 -0.049 8.098 1.00 21.43 C ATOM 1479 CE1 TYR B 60 8.747 -1.623 10.076 1.00 26.14 C ATOM 1480 CE2 TYR B 60 9.935 0.348 9.421 1.00 24.70 C ATOM 1481 CZ TYR B 60 9.381 -0.439 10.407 1.00 28.38 C ATOM 1482 OH TYR B 60 9.464 -0.036 11.723 1.00 41.40 O ATOM 1483 HH TYR B 60 9.021 -0.707 12.301 1.00 0.00 H ATOM 1484 H TYR B 60 8.921 -2.135 3.819 1.00 0.00 H ATOM 1485 N ASP B 61 8.367 0.951 4.972 1.00 14.98 N ATOM 1486 CA ASP B 61 8.108 2.390 4.887 1.00 16.46 C ATOM 1487 C ASP B 61 6.732 2.691 4.295 1.00 13.32 C ATOM 1488 O ASP B 61 5.979 3.495 4.842 1.00 17.12 O ATOM 1489 CB ASP B 61 9.181 3.096 4.048 1.00 15.88 C ATOM 1490 CG ASP B 61 10.552 3.055 4.692 1.00 20.44 C ATOM 1491 OD1 ASP B 61 10.655 2.634 5.865 1.00 17.78 O ATOM 1492 OD2 ASP B 61 11.528 3.454 4.025 1.00 19.90 O ATOM 1493 H ASP B 61 9.231 0.567 4.540 1.00 0.00 H ATOM 1494 N ALA B 62 6.405 2.039 3.183 1.00 14.59 N ATOM 1495 CA ALA B 62 5.139 2.289 2.501 1.00 13.75 C ATOM 1496 C ALA B 62 3.938 1.967 3.381 1.00 16.00 C ATOM 1497 O ALA B 62 2.997 2.754 3.463 1.00 19.41 O ATOM 1498 CB ALA B 62 5.060 1.509 1.203 1.00 13.10 C ATOM 1499 H ALA B 62 7.065 1.337 2.791 1.00 0.00 H ATOM 1500 N ALA B 63 3.971 0.812 4.039 1.00 16.36 N ATOM 1501 CA ALA B 63 2.841 0.375 4.849 1.00 17.84 C ATOM 1502 C ALA B 63 2.607 1.302 6.033 1.00 16.19 C ATOM 1503 O ALA B 63 1.479 1.477 6.484 1.00 19.91 O ATOM 1504 CB ALA B 63 3.042 -1.070 5.323 1.00 17.41 C ATOM 1505 H ALA B 63 4.817 0.211 3.975 1.00 0.00 H ATOM 1506 N ARG B 64 3.677 1.911 6.527 1.00 19.12 N ATOM 1507 CA ARG B 64 3.571 2.808 7.674 1.00 20.28 C ATOM 1508 C ARG B 64 3.097 4.202 7.266 1.00 19.20 C ATOM 1509 O ARG B 64 3.068 5.114 8.081 1.00 21.05 O ATOM 1510 CB ARG B 64 4.896 2.864 8.442 1.00 20.95 C ATOM 1511 CG ARG B 64 5.442 1.474 8.760 1.00 24.50 C ATOM 1512 CD ARG B 64 6.013 1.350 10.156 1.00 32.24 C ATOM 1513 NE ARG B 64 7.168 2.213 10.390 1.00 35.01 N ATOM 1514 CZ ARG B 64 7.704 2.424 11.589 1.00 40.90 C ATOM 1515 NH1 ARG B 64 8.752 3.228 11.720 1.00 45.34 N ATOM 1516 NH2 ARG B 64 7.188 1.834 12.661 1.00 27.98 N ATOM 1517 HE ARG B 64 7.596 2.690 9.571 1.00 0.00 H ATOM 1518 HH12 ARG B 64 9.168 3.391 12.659 1.00 0.00 H ATOM 1519 HH11 ARG B 64 9.157 3.695 10.884 1.00 0.00 H ATOM 1520 HH22 ARG B 64 7.608 1.999 13.598 1.00 0.00 H ATOM 1521 HH21 ARG B 64 6.364 1.207 12.563 1.00 0.00 H ATOM 1522 H ARG B 64 4.606 1.747 6.090 1.00 0.00 H ATOM 1523 N ARG B 65 2.726 4.355 5.997 1.00 16.98 N ATOM 1524 CA ARG B 65 2.041 5.557 5.541 1.00 18.47 C ATOM 1525 C ARG B 65 0.558 5.415 5.840 1.00 20.60 C ATOM 1526 O ARG B 65 -0.187 6.390 5.801 1.00 23.36 O ATOM 1527 CB ARG B 65 2.209 5.744 4.033 1.00 17.67 C ATOM 1528 CG ARG B 65 3.628 5.980 3.573 1.00 23.80 C ATOM 1529 CD ARG B 65 4.106 7.379 3.936 1.00 18.98 C ATOM 1530 NE ARG B 65 5.360 7.701 3.262 1.00 18.48 N ATOM 1531 CZ ARG B 65 5.875 8.922 3.174 1.00 20.03 C ATOM 1532 NH1 ARG B 65 5.239 9.951 3.718 1.00 23.83 N ATOM 1533 NH2 ARG B 65 7.026 9.112 2.540 1.00 18.87 N ATOM 1534 HE ARG B 65 5.887 6.920 2.820 1.00 0.00 H ATOM 1535 HH12 ARG B 65 5.642 10.907 3.649 1.00 0.00 H ATOM 1536 HH11 ARG B 65 4.337 9.802 4.214 1.00 0.00 H ATOM 1537 HH22 ARG B 65 7.430 10.068 2.471 1.00 0.00 H ATOM 1538 HH21 ARG B 65 7.524 8.305 2.113 1.00 0.00 H ATOM 1539 H ARG B 65 2.930 3.598 5.314 1.00 0.00 H ATOM 1540 N GLY B 66 0.131 4.191 6.121 1.00 23.44 N ATOM 1541 CA GLY B 66 -1.279 3.909 6.295 1.00 21.47 C ATOM 1542 C GLY B 66 -1.763 2.927 5.246 1.00 21.55 C ATOM 1543 O GLY B 66 -0.988 2.513 4.387 1.00 21.23 O ATOM 1544 H GLY B 66 0.822 3.419 6.218 1.00 0.00 H ATOM 1545 N PRO B 67 -3.054 2.565 5.303 1.00 25.79 N ATOM 1546 CA PRO B 67 -3.690 1.560 4.442 1.00 18.18 C ATOM 1547 C PRO B 67 -3.427 1.785 2.956 1.00 20.05 C ATOM 1548 O PRO B 67 -3.253 0.822 2.206 1.00 19.69 O ATOM 1549 CB PRO B 67 -5.182 1.739 4.744 1.00 21.59 C ATOM 1550 CG PRO B 67 -5.213 2.272 6.131 1.00 20.21 C ATOM 1551 CD PRO B 67 -4.022 3.182 6.228 1.00 19.20 C ATOM 1552 N GLY B 68 -3.408 3.043 2.533 1.00 18.34 N ATOM 1553 CA GLY B 68 -3.147 3.356 1.138 1.00 16.81 C ATOM 1554 C GLY B 68 -1.728 2.996 0.732 1.00 18.91 C ATOM 1555 O GLY B 68 -1.493 2.505 -0.371 1.00 16.54 O ATOM 1556 H GLY B 68 -3.582 3.814 3.208 1.00 0.00 H ATOM 1557 N GLY B 69 -0.781 3.247 1.631 1.00 13.98 N ATOM 1558 CA GLY B 69 0.613 2.931 1.390 1.00 17.32 C ATOM 1559 C GLY B 69 0.855 1.434 1.344 1.00 19.45 C ATOM 1560 O GLY B 69 1.595 0.951 0.488 1.00 15.74 O ATOM 1561 H GLY B 69 -1.049 3.684 2.536 1.00 0.00 H ATOM 1562 N ALA B 70 0.221 0.701 2.260 1.00 14.01 N ATOM 1563 CA ALA B 70 0.348 -0.749 2.308 1.00 15.53 C ATOM 1564 C ALA B 70 -0.218 -1.380 1.046 1.00 13.94 C ATOM 1565 O ALA B 70 0.329 -2.351 0.530 1.00 18.06 O ATOM 1566 CB ALA B 70 -0.350 -1.308 3.557 1.00 16.25 C ATOM 1567 H ALA B 70 -0.382 1.179 2.960 1.00 0.00 H ATOM 1568 N TRP B 71 -1.315 -0.816 0.553 1.00 14.31 N ATOM 1569 CA TRP B 71 -1.931 -1.281 -0.684 1.00 17.75 C ATOM 1570 C TRP B 71 -1.021 -1.033 -1.889 1.00 19.27 C ATOM 1571 O TRP B 71 -0.888 -1.894 -2.763 1.00 17.50 O ATOM 1572 CB TRP B 71 -3.289 -0.607 -0.911 1.00 13.88 C ATOM 1573 CG TRP B 71 -3.878 -0.933 -2.240 1.00 16.40 C ATOM 1574 CD1 TRP B 71 -4.519 -2.086 -2.587 1.00 17.40 C ATOM 1575 CD2 TRP B 71 -3.866 -0.110 -3.413 1.00 18.10 C ATOM 1576 NE1 TRP B 71 -4.907 -2.033 -3.911 1.00 18.47 N ATOM 1577 CE2 TRP B 71 -4.522 -0.829 -4.436 1.00 18.87 C ATOM 1578 CE3 TRP B 71 -3.364 1.165 -3.700 1.00 21.96 C ATOM 1579 CZ2 TRP B 71 -4.693 -0.317 -5.716 1.00 21.49 C ATOM 1580 CZ3 TRP B 71 -3.537 1.673 -4.981 1.00 23.21 C ATOM 1581 CH2 TRP B 71 -4.192 0.931 -5.971 1.00 20.45 C ATOM 1582 HE1 TRP B 71 -5.409 -2.785 -4.425 1.00 0.00 H ATOM 1583 H TRP B 71 -1.747 -0.020 1.064 1.00 0.00 H ATOM 1584 N ALA B 72 -0.397 0.141 -1.924 1.00 15.95 N ATOM 1585 CA ALA B 72 0.495 0.498 -3.022 1.00 16.76 C ATOM 1586 C ALA B 72 1.712 -0.418 -3.042 1.00 15.05 C ATOM 1587 O ALA B 72 2.128 -0.886 -4.098 1.00 12.22 O ATOM 1588 CB ALA B 72 0.915 1.954 -2.912 1.00 12.92 C ATOM 1589 H ALA B 72 -0.548 0.820 -1.151 1.00 0.00 H ATOM 1590 N ALA B 73 2.263 -0.690 -1.864 1.00 14.96 N ATOM 1591 CA ALA B 73 3.411 -1.584 -1.744 1.00 16.72 C ATOM 1592 C ALA B 73 3.095 -2.990 -2.253 1.00 15.79 C ATOM 1593 O ALA B 73 3.918 -3.614 -2.916 1.00 16.69 O ATOM 1594 CB ALA B 73 3.897 -1.642 -0.309 1.00 12.32 C ATOM 1595 H ALA B 73 1.867 -0.255 -1.006 1.00 0.00 H ATOM 1596 N LYS B 74 1.905 -3.488 -1.935 1.00 14.88 N ATOM 1597 CA LYS B 74 1.506 -4.812 -2.389 1.00 14.73 C ATOM 1598 C LYS B 74 1.367 -4.834 -3.909 1.00 16.35 C ATOM 1599 O LYS B 74 1.914 -5.699 -4.582 1.00 18.86 O ATOM 1600 CB LYS B 74 0.189 -5.232 -1.736 1.00 17.65 C ATOM 1601 CG LYS B 74 -0.366 -6.538 -2.280 1.00 24.53 C ATOM 1602 CD LYS B 74 -1.679 -6.917 -1.620 1.00 26.50 C ATOM 1603 CE LYS B 74 -2.292 -8.136 -2.292 1.00 38.28 C ATOM 1604 NZ LYS B 74 -1.356 -9.299 -2.323 1.00 45.19 N ATOM 1605 HZ1 LYS B 74 -0.498 -9.038 -2.850 1.00 0.00 H ATOM 1606 HZ2 LYS B 74 -1.100 -9.562 -1.350 1.00 0.00 H ATOM 1607 HZ3 LYS B 74 -1.820 -10.104 -2.791 1.00 0.00 H ATOM 1608 H LYS B 74 1.251 -2.925 -1.355 1.00 0.00 H ATOM 1609 N VAL B 75 0.628 -3.866 -4.433 1.00 17.89 N ATOM 1610 CA VAL B 75 0.371 -3.753 -5.863 1.00 16.86 C ATOM 1611 C VAL B 75 1.670 -3.626 -6.666 1.00 21.08 C ATOM 1612 O VAL B 75 1.829 -4.243 -7.725 1.00 20.82 O ATOM 1613 CB VAL B 75 -0.562 -2.549 -6.137 1.00 22.30 C ATOM 1614 CG1 VAL B 75 -0.241 -1.889 -7.452 1.00 30.98 C ATOM 1615 CG2 VAL B 75 -2.022 -2.983 -6.081 1.00 21.73 C ATOM 1616 H VAL B 75 0.214 -3.156 -3.796 1.00 0.00 H ATOM 1617 N ILE B 76 2.608 -2.844 -6.144 1.00 22.29 N ATOM 1618 CA ILE B 76 3.889 -2.645 -6.807 1.00 16.65 C ATOM 1619 C ILE B 76 4.723 -3.909 -6.712 1.00 19.96 C ATOM 1620 O ILE B 76 5.367 -4.304 -7.686 1.00 15.34 O ATOM 1621 CB ILE B 76 4.657 -1.445 -6.219 1.00 17.64 C ATOM 1622 CG1 ILE B 76 3.947 -0.145 -6.597 1.00 16.01 C ATOM 1623 CG2 ILE B 76 6.102 -1.429 -6.708 1.00 12.65 C ATOM 1624 CD1 ILE B 76 4.476 1.056 -5.877 1.00 21.42 C ATOM 1625 H ILE B 76 2.423 -2.363 -5.241 1.00 0.00 H ATOM 1626 N SER B 77 4.689 -4.558 -5.551 1.00 16.65 N ATOM 1627 CA SER B 77 5.436 -5.800 -5.350 1.00 20.47 C ATOM 1628 C SER B 77 4.968 -6.918 -6.279 1.00 25.57 C ATOM 1629 O SER B 77 5.777 -7.702 -6.784 1.00 21.31 O ATOM 1630 CB SER B 77 5.344 -6.271 -3.895 1.00 16.74 C ATOM 1631 OG SER B 77 6.036 -5.389 -3.017 1.00 17.88 O ATOM 1632 HG SER B 77 5.639 -4.484 -3.080 1.00 0.00 H ATOM 1633 H SER B 77 4.119 -4.174 -4.770 1.00 0.00 H ATOM 1634 N ASP B 78 3.659 -6.991 -6.500 1.00 19.08 N ATOM 1635 CA ASP B 78 3.085 -8.011 -7.375 1.00 18.69 C ATOM 1636 C ASP B 78 3.334 -7.686 -8.849 1.00 15.72 C ATOM 1637 O ASP B 78 3.504 -8.582 -9.667 1.00 21.86 O ATOM 1638 CB ASP B 78 1.590 -8.169 -7.098 1.00 16.62 C ATOM 1639 CG ASP B 78 1.308 -8.734 -5.711 1.00 27.48 C ATOM 1640 OD1 ASP B 78 2.258 -9.180 -5.027 1.00 21.37 O ATOM 1641 OD2 ASP B 78 0.129 -8.739 -5.308 1.00 24.66 O ATOM 1642 H ASP B 78 3.028 -6.305 -6.039 1.00 0.00 H ATOM 1643 N ALA B 79 3.356 -6.399 -9.179 1.00 14.28 N ATOM 1644 CA ALA B 79 3.739 -5.969 -10.520 1.00 18.93 C ATOM 1645 C ALA B 79 5.167 -6.415 -10.816 1.00 22.25 C ATOM 1646 O ALA B 79 5.474 -6.867 -11.921 1.00 18.55 O ATOM 1647 CB ALA B 79 3.616 -4.474 -10.652 1.00 16.92 C ATOM 1648 H ALA B 79 3.096 -5.685 -8.469 1.00 0.00 H ATOM 1649 N ARG B 80 6.031 -6.295 -9.814 1.00 21.68 N ATOM 1650 CA ARG B 80 7.418 -6.708 -9.956 1.00 26.92 C ATOM 1651 C ARG B 80 7.532 -8.225 -10.091 1.00 26.74 C ATOM 1652 O ARG B 80 8.319 -8.725 -10.894 1.00 23.54 O ATOM 1653 CB ARG B 80 8.262 -6.220 -8.776 1.00 30.07 C ATOM 1654 CG ARG B 80 9.732 -6.568 -8.929 1.00 40.07 C ATOM 1655 CD ARG B 80 10.525 -6.378 -7.649 1.00 48.17 C ATOM 1656 NE ARG B 80 11.078 -5.033 -7.538 1.00 71.67 N ATOM 1657 CZ ARG B 80 12.123 -4.590 -8.231 1.00 75.88 C ATOM 1658 NH1 ARG B 80 12.739 -5.376 -9.106 1.00 70.08 N ATOM 1659 NH2 ARG B 80 12.551 -3.349 -8.055 1.00 75.81 N ATOM 1660 HE ARG B 80 10.624 -4.376 -6.872 1.00 0.00 H ATOM 1661 HH12 ARG B 80 13.555 -5.018 -9.642 1.00 0.00 H ATOM 1662 HH11 ARG B 80 12.405 -6.350 -9.255 1.00 0.00 H ATOM 1663 HH22 ARG B 80 13.368 -2.999 -8.595 1.00 0.00 H ATOM 1664 HH21 ARG B 80 12.070 -2.724 -7.377 1.00 0.00 H ATOM 1665 H ARG B 80 5.709 -5.897 -8.909 1.00 0.00 H ATOM 1666 N GLU B 81 6.751 -8.955 -9.302 1.00 22.22 N ATOM 1667 CA GLU B 81 6.755 -10.411 -9.373 1.00 28.94 C ATOM 1668 C GLU B 81 6.308 -10.893 -10.752 1.00 26.57 C ATOM 1669 O GLU B 81 6.924 -11.778 -11.343 1.00 23.77 O ATOM 1670 CB GLU B 81 5.850 -11.014 -8.297 1.00 24.87 C ATOM 1671 CG GLU B 81 5.822 -12.536 -8.310 1.00 29.37 C ATOM 1672 CD GLU B 81 4.891 -13.124 -7.264 1.00 36.62 C ATOM 1673 OE1 GLU B 81 3.907 -12.455 -6.885 1.00 39.49 O ATOM 1674 OE2 GLU B 81 5.149 -14.261 -6.815 1.00 53.07 O ATOM 1675 H GLU B 81 6.125 -8.479 -8.621 1.00 0.00 H ATOM 1676 N ALA B 82 5.229 -10.301 -11.251 1.00 18.91 N ATOM 1677 CA ALA B 82 4.691 -10.647 -12.561 1.00 24.97 C ATOM 1678 C ALA B 82 5.733 -10.480 -13.673 1.00 27.90 C ATOM 1679 O ALA B 82 5.873 -11.348 -14.537 1.00 27.89 O ATOM 1680 CB ALA B 82 3.465 -9.812 -12.853 1.00 16.51 C ATOM 1681 H ALA B 82 4.752 -9.567 -10.689 1.00 0.00 H ATOM 1682 N VAL B 83 6.470 -9.375 -13.638 1.00 23.64 N ATOM 1683 CA VAL B 83 7.518 -9.140 -14.625 1.00 27.44 C ATOM 1684 C VAL B 83 8.660 -10.137 -14.458 1.00 33.08 C ATOM 1685 O VAL B 83 9.223 -10.614 -15.443 1.00 33.36 O ATOM 1686 CB VAL B 83 8.047 -7.696 -14.564 1.00 30.22 C ATOM 1687 CG1 VAL B 83 9.208 -7.501 -15.540 1.00 29.98 C ATOM 1688 CG2 VAL B 83 6.930 -6.724 -14.868 1.00 29.37 C ATOM 1689 H VAL B 83 6.297 -8.667 -12.896 1.00 0.00 H ATOM 1690 N GLN B 84 8.984 -10.460 -13.209 1.00 29.21 N ATOM 1691 CA GLN B 84 9.998 -11.472 -12.910 1.00 27.85 C ATOM 1692 C GLN B 84 9.649 -12.828 -13.509 1.00 32.57 C ATOM 1693 O GLN B 84 10.489 -13.472 -14.134 1.00 44.99 O ATOM 1694 CB GLN B 84 10.173 -11.631 -11.399 1.00 31.90 C ATOM 1695 CG GLN B 84 11.136 -10.656 -10.771 1.00 30.00 C ATOM 1696 CD GLN B 84 11.232 -10.837 -9.268 1.00 41.06 C ATOM 1697 OE1 GLN B 84 10.244 -11.155 -8.605 1.00 42.05 O ATOM 1698 NE2 GLN B 84 12.427 -10.644 -8.724 1.00 43.77 N ATOM 1699 HE22 GLN B 84 13.234 -10.376 -9.323 1.00 0.00 H ATOM 1700 HE21 GLN B 84 12.557 -10.761 -7.699 1.00 0.00 H ATOM 1701 H GLN B 84 8.503 -9.979 -12.422 1.00 0.00 H ATOM 1702 N LYS B 85 8.412 -13.263 -13.288 1.00 29.95 N ATOM 1703 CA LYS B 85 7.918 -14.520 -13.838 1.00 27.77 C ATOM 1704 C LYS B 85 8.086 -14.546 -15.354 1.00 33.26 C ATOM 1705 O LYS B 85 8.648 -15.486 -15.918 1.00 31.30 O ATOM 1706 CB LYS B 85 6.439 -14.701 -13.498 1.00 26.02 C ATOM 1707 CG LYS B 85 6.167 -15.618 -12.317 1.00 29.45 C ATOM 1708 CD LYS B 85 6.792 -15.089 -11.034 1.00 31.08 C ATOM 1709 CE LYS B 85 6.550 -16.033 -9.862 1.00 32.66 C ATOM 1710 NZ LYS B 85 5.141 -15.982 -9.379 1.00 33.77 N ATOM 1711 HZ1 LYS B 85 4.917 -15.015 -9.067 1.00 0.00 H ATOM 1712 HZ2 LYS B 85 4.501 -16.255 -10.152 1.00 0.00 H ATOM 1713 HZ3 LYS B 85 5.025 -16.640 -8.582 1.00 0.00 H ATOM 1714 H LYS B 85 7.775 -12.687 -12.702 1.00 0.00 H ATOM 1715 N PHE B 86 7.597 -13.491 -15.997 1.00 26.88 N ATOM 1716 CA PHE B 86 7.610 -13.358 -17.444 1.00 29.02 C ATOM 1717 C PHE B 86 9.014 -13.455 -18.046 1.00 36.25 C ATOM 1718 O PHE B 86 9.180 -13.960 -19.153 1.00 35.54 O ATOM 1719 CB PHE B 86 6.942 -12.039 -17.826 1.00 28.43 C ATOM 1720 CG PHE B 86 6.928 -11.760 -19.301 1.00 32.50 C ATOM 1721 CD1 PHE B 86 6.239 -12.581 -20.174 1.00 32.00 C ATOM 1722 CD2 PHE B 86 7.578 -10.647 -19.809 1.00 30.83 C ATOM 1723 CE1 PHE B 86 6.216 -12.308 -21.529 1.00 33.97 C ATOM 1724 CE2 PHE B 86 7.558 -10.369 -21.160 1.00 38.27 C ATOM 1725 CZ PHE B 86 6.876 -11.202 -22.021 1.00 26.73 C ATOM 1726 H PHE B 86 7.183 -12.720 -15.435 1.00 0.00 H ATOM 1727 N THR B 87 10.005 -12.922 -17.361 1.00 35.54 N ATOM 1728 CA THR B 87 11.368 -12.928 -17.838 1.00 28.21 C ATOM 1729 C THR B 87 12.227 -14.042 -17.289 1.00 34.77 C ATOM 1730 O THR B 87 13.388 -14.073 -17.545 1.00 44.50 O ATOM 1731 CB THR B 87 12.101 -11.593 -17.588 1.00 39.75 C ATOM 1732 OG1 THR B 87 12.651 -11.568 -16.286 1.00 44.04 O ATOM 1733 CG2 THR B 87 11.225 -10.432 -17.743 1.00 37.28 C ATOM 1734 HG1 THR B 87 13.295 -12.313 -16.187 1.00 0.00 H ATOM 1735 H THR B 87 9.798 -12.480 -16.442 1.00 0.00 H ATOM 1736 N GLY B 88 11.655 -14.952 -16.533 1.00 36.76 N ATOM 1737 CA GLY B 88 12.367 -16.071 -15.948 1.00 42.88 C ATOM 1738 C GLY B 88 12.988 -15.867 -14.581 1.00 49.53 C ATOM 1739 O GLY B 88 14.065 -15.363 -14.485 1.00 61.95 O ATOM 1740 H GLY B 88 10.636 -14.865 -16.344 1.00 0.00 H ATOM 1741 N HIS B 89 12.322 -16.273 -13.519 1.00 51.96 N ATOM 1742 CA HIS B 89 12.826 -16.045 -12.182 1.00 47.87 C ATOM 1743 C HIS B 89 13.113 -14.560 -11.925 1.00 52.81 C ATOM 1744 O HIS B 89 14.241 -14.107 -11.972 1.00 59.18 O ATOM 1745 H HIS B 89 11.416 -16.767 -13.644 1.00 0.00 H TER 1746 HIS B 89 ATOM 1747 N ASP B 93 15.047 -16.163 -5.238 1.00 66.31 N ATOM 1748 CA ASP B 93 14.111 -16.080 -6.353 1.00 50.74 C ATOM 1749 C ASP B 93 12.832 -15.324 -5.966 1.00 48.78 C ATOM 1750 O ASP B 93 12.826 -14.560 -5.000 1.00 45.96 O ATOM 1751 CB ASP B 93 13.798 -17.473 -6.899 1.00 39.77 C ATOM 1752 CG ASP B 93 12.921 -18.291 -5.970 1.00 49.73 C ATOM 1753 OD1 ASP B 93 12.902 -18.015 -4.751 1.00 42.65 O ATOM 1754 OD2 ASP B 93 12.248 -19.221 -6.465 1.00 45.79 O ATOM 1755 HN3 ASP B 93 14.597 -16.664 -4.446 1.00 0.00 H ATOM 1756 HN2 ASP B 93 15.312 -15.203 -4.937 1.00 0.00 H ATOM 1757 HN1 ASP B 93 15.898 -16.680 -5.539 1.00 0.00 H ATOM 1758 N SER B 94 11.753 -15.544 -6.712 1.00 34.12 N ATOM 1759 CA SER B 94 10.533 -14.752 -6.549 1.00 39.44 C ATOM 1760 C SER B 94 9.813 -14.925 -5.211 1.00 40.16 C ATOM 1761 O SER B 94 9.329 -13.947 -4.644 1.00 41.57 O ATOM 1762 CB SER B 94 9.568 -14.998 -7.711 1.00 31.44 C ATOM 1763 OG SER B 94 10.052 -14.389 -8.892 1.00 41.76 O ATOM 1764 HG SER B 94 10.140 -13.414 -8.747 1.00 0.00 H ATOM 1765 H SER B 94 11.777 -16.297 -7.429 1.00 0.00 H ATOM 1766 N ARG B 95 9.730 -16.159 -4.718 1.00 39.38 N ATOM 1767 CA ARG B 95 9.090 -16.418 -3.431 1.00 46.28 C ATOM 1768 C ARG B 95 9.858 -15.734 -2.318 1.00 32.46 C ATOM 1769 O ARG B 95 9.273 -15.138 -1.423 1.00 35.37 O ATOM 1770 CB ARG B 95 9.031 -17.914 -3.133 1.00 45.46 C ATOM 1771 CG ARG B 95 8.079 -18.711 -3.991 1.00 49.51 C ATOM 1772 CD ARG B 95 8.181 -20.175 -3.617 1.00 55.91 C ATOM 1773 NE ARG B 95 7.600 -21.056 -4.622 1.00 57.88 N ATOM 1774 CZ ARG B 95 7.960 -22.323 -4.787 1.00 68.54 C ATOM 1775 NH1 ARG B 95 8.903 -22.847 -4.016 1.00 71.80 N ATOM 1776 NH2 ARG B 95 7.384 -23.065 -5.723 1.00 74.57 N ATOM 1777 HE ARG B 95 6.862 -20.670 -5.245 1.00 0.00 H ATOM 1778 HH12 ARG B 95 9.187 -23.839 -4.143 1.00 0.00 H ATOM 1779 HH11 ARG B 95 9.359 -22.266 -3.284 1.00 0.00 H ATOM 1780 HH22 ARG B 95 7.669 -24.057 -5.849 1.00 0.00 H ATOM 1781 HH21 ARG B 95 6.647 -22.655 -6.331 1.00 0.00 H ATOM 1782 H ARG B 95 10.128 -16.953 -5.259 1.00 0.00 H ATOM 1783 N ALA B 96 11.180 -15.845 -2.383 1.00 36.04 N ATOM 1784 CA ALA B 96 12.062 -15.254 -1.385 1.00 36.07 C ATOM 1785 C ALA B 96 11.868 -13.746 -1.343 1.00 40.89 C ATOM 1786 O ALA B 96 11.826 -13.148 -0.269 1.00 37.49 O ATOM 1787 CB ALA B 96 13.508 -15.591 -1.693 1.00 36.79 C ATOM 1788 H ALA B 96 11.601 -16.373 -3.174 1.00 0.00 H ATOM 1789 N ASP B 97 11.755 -13.142 -2.523 1.00 34.97 N ATOM 1790 CA ASP B 97 11.493 -11.713 -2.636 1.00 35.19 C ATOM 1791 C ASP B 97 10.151 -11.342 -2.011 1.00 31.80 C ATOM 1792 O ASP B 97 10.059 -10.380 -1.241 1.00 22.87 O ATOM 1793 CB ASP B 97 11.538 -11.275 -4.100 1.00 33.75 C ATOM 1794 CG ASP B 97 12.958 -11.129 -4.619 1.00 40.91 C ATOM 1795 OD1 ASP B 97 13.900 -11.464 -3.870 1.00 38.54 O ATOM 1796 OD2 ASP B 97 13.134 -10.682 -5.772 1.00 43.23 O ATOM 1797 H ASP B 97 11.857 -13.706 -3.391 1.00 0.00 H ATOM 1798 N GLN B 98 9.114 -12.111 -2.338 1.00 27.18 N ATOM 1799 CA GLN B 98 7.785 -11.848 -1.802 1.00 23.38 C ATOM 1800 C GLN B 98 7.740 -12.062 -0.300 1.00 27.44 C ATOM 1801 O GLN B 98 6.970 -11.410 0.399 1.00 32.22 O ATOM 1802 CB GLN B 98 6.720 -12.691 -2.508 1.00 28.09 C ATOM 1803 CG GLN B 98 6.332 -12.178 -3.892 1.00 29.69 C ATOM 1804 CD GLN B 98 5.485 -10.902 -3.864 1.00 32.47 C ATOM 1805 OE1 GLN B 98 5.648 -10.035 -3.000 1.00 27.97 O ATOM 1806 NE2 GLN B 98 4.575 -10.789 -4.823 1.00 25.18 N ATOM 1807 HE22 GLN B 98 4.470 -11.543 -5.532 1.00 0.00 H ATOM 1808 HE21 GLN B 98 3.967 -9.947 -4.866 1.00 0.00 H ATOM 1809 H GLN B 98 9.255 -12.912 -2.986 1.00 0.00 H ATOM 1810 N PHE B 99 8.579 -12.969 0.195 1.00 29.50 N ATOM 1811 CA PHE B 99 8.697 -13.185 1.634 1.00 27.46 C ATOM 1812 C PHE B 99 9.265 -11.936 2.316 1.00 25.11 C ATOM 1813 O PHE B 99 8.778 -11.510 3.364 1.00 23.74 O ATOM 1814 CB PHE B 99 9.579 -14.407 1.935 1.00 31.36 C ATOM 1815 CG PHE B 99 9.737 -14.690 3.405 1.00 30.70 C ATOM 1816 CD1 PHE B 99 8.813 -15.474 4.076 1.00 28.48 C ATOM 1817 CD2 PHE B 99 10.805 -14.165 4.116 1.00 26.22 C ATOM 1818 CE1 PHE B 99 8.948 -15.727 5.430 1.00 41.87 C ATOM 1819 CE2 PHE B 99 10.945 -14.415 5.471 1.00 38.55 C ATOM 1820 CZ PHE B 99 10.018 -15.195 6.128 1.00 41.66 C ATOM 1821 H PHE B 99 9.161 -13.534 -0.455 1.00 0.00 H ATOM 1822 N ALA B 100 10.301 -11.361 1.710 1.00 19.71 N ATOM 1823 CA ALA B 100 10.910 -10.141 2.213 1.00 23.90 C ATOM 1824 C ALA B 100 9.918 -8.991 2.120 1.00 20.27 C ATOM 1825 O ALA B 100 9.778 -8.210 3.058 1.00 21.31 O ATOM 1826 CB ALA B 100 12.176 -9.825 1.432 1.00 27.06 C ATOM 1827 H ALA B 100 10.687 -11.799 0.849 1.00 0.00 H ATOM 1828 N ASN B 101 9.230 -8.897 0.985 1.00 16.39 N ATOM 1829 CA ASN B 101 8.187 -7.890 0.791 1.00 17.88 C ATOM 1830 C ASN B 101 7.156 -7.893 1.914 1.00 23.52 C ATOM 1831 O ASN B 101 6.905 -6.865 2.540 1.00 18.77 O ATOM 1832 CB ASN B 101 7.462 -8.104 -0.543 1.00 16.87 C ATOM 1833 CG ASN B 101 8.288 -7.680 -1.740 1.00 22.80 C ATOM 1834 OD1 ASN B 101 9.165 -6.822 -1.638 1.00 16.63 O ATOM 1835 ND2 ASN B 101 7.999 -8.274 -2.891 1.00 27.46 N ATOM 1836 HD22 ASN B 101 7.250 -8.994 -2.931 1.00 0.00 H ATOM 1837 HD21 ASN B 101 8.522 -8.020 -3.753 1.00 0.00 H ATOM 1838 H ASN B 101 9.440 -9.560 0.212 1.00 0.00 H ATOM 1839 N GLU B 102 6.590 -9.062 2.185 1.00 21.58 N ATOM 1840 CA GLU B 102 5.525 -9.207 3.145 1.00 21.71 C ATOM 1841 C GLU B 102 6.026 -9.053 4.575 1.00 21.66 C ATOM 1842 O GLU B 102 5.332 -8.598 5.417 1.00 24.19 O ATOM 1843 CB GLU B 102 4.726 -10.511 2.938 1.00 24.95 C ATOM 1844 CG GLU B 102 4.211 -10.707 1.522 1.00 40.28 C ATOM 1845 CD GLU B 102 3.279 -11.877 1.320 1.00 54.68 C ATOM 1846 OE1 GLU B 102 3.448 -12.909 1.979 1.00 62.45 O ATOM 1847 OE2 GLU B 102 2.388 -11.768 0.479 1.00 53.50 O ATOM 1848 H GLU B 102 6.929 -9.908 1.684 1.00 0.00 H ATOM 1849 N TRP B 103 7.272 -9.403 4.776 1.00 19.29 N ATOM 1850 CA TRP B 103 7.939 -9.230 6.061 1.00 22.09 C ATOM 1851 C TRP B 103 7.884 -7.767 6.490 1.00 22.10 C ATOM 1852 O TRP B 103 7.376 -7.445 7.561 1.00 24.41 O ATOM 1853 CB TRP B 103 9.393 -9.690 5.949 1.00 20.09 C ATOM 1854 CG TRP B 103 10.217 -9.567 7.198 1.00 30.87 C ATOM 1855 CD1 TRP B 103 10.967 -8.494 7.584 1.00 30.24 C ATOM 1856 CD2 TRP B 103 10.403 -10.569 8.204 1.00 33.70 C ATOM 1857 NE1 TRP B 103 11.599 -8.763 8.773 1.00 28.42 N ATOM 1858 CE2 TRP B 103 11.269 -10.030 9.175 1.00 30.37 C ATOM 1859 CE3 TRP B 103 9.916 -11.868 8.382 1.00 42.08 C ATOM 1860 CZ2 TRP B 103 11.658 -10.743 10.307 1.00 38.81 C ATOM 1861 CZ3 TRP B 103 10.303 -12.573 9.508 1.00 37.57 C ATOM 1862 CH2 TRP B 103 11.165 -12.007 10.456 1.00 33.65 C ATOM 1863 HE1 TRP B 103 12.226 -8.111 9.285 1.00 0.00 H ATOM 1864 H TRP B 103 7.807 -9.821 3.988 1.00 0.00 H ATOM 1865 N GLY B 104 8.399 -6.886 5.640 1.00 17.76 N ATOM 1866 CA GLY B 104 8.386 -5.462 5.915 1.00 18.87 C ATOM 1867 C GLY B 104 6.984 -4.877 5.943 1.00 20.02 C ATOM 1868 O GLY B 104 6.666 -4.054 6.801 1.00 22.54 O ATOM 1869 H GLY B 104 8.823 -7.226 4.753 1.00 0.00 H ATOM 1870 N ARG B 105 6.140 -5.309 5.012 1.00 17.69 N ATOM 1871 CA ARG B 105 4.773 -4.799 4.915 1.00 19.23 C ATOM 1872 C ARG B 105 3.967 -5.089 6.181 1.00 26.29 C ATOM 1873 O ARG B 105 3.083 -4.320 6.551 1.00 27.29 O ATOM 1874 CB ARG B 105 4.068 -5.385 3.687 1.00 17.26 C ATOM 1875 CG ARG B 105 2.874 -4.576 3.207 1.00 17.06 C ATOM 1876 CD ARG B 105 2.684 -4.695 1.695 1.00 25.13 C ATOM 1877 NE ARG B 105 2.008 -5.928 1.313 1.00 26.82 N ATOM 1878 CZ ARG B 105 2.470 -6.794 0.417 1.00 29.12 C ATOM 1879 NH1 ARG B 105 3.618 -6.568 -0.206 1.00 16.44 N ATOM 1880 NH2 ARG B 105 1.774 -7.885 0.136 1.00 31.21 N ATOM 1881 HE ARG B 105 1.101 -6.145 1.773 1.00 0.00 H ATOM 1882 HH12 ARG B 105 3.973 -7.250 -0.906 1.00 0.00 H ATOM 1883 HH11 ARG B 105 4.164 -5.708 0.005 1.00 0.00 H ATOM 1884 HH22 ARG B 105 2.133 -8.565 -0.565 1.00 0.00 H ATOM 1885 HH21 ARG B 105 0.869 -8.062 0.616 1.00 0.00 H ATOM 1886 H ARG B 105 6.460 -6.029 4.334 1.00 0.00 H ATOM 1887 N SER B 106 4.286 -6.195 6.847 1.00 22.33 N ATOM 1888 CA SER B 106 3.583 -6.591 8.062 1.00 22.36 C ATOM 1889 C SER B 106 4.105 -5.851 9.290 1.00 24.07 C ATOM 1890 O SER B 106 3.548 -5.985 10.378 1.00 31.61 O ATOM 1891 CB SER B 106 3.708 -8.097 8.282 1.00 19.95 C ATOM 1892 OG SER B 106 5.053 -8.449 8.537 1.00 28.61 O ATOM 1893 HG SER B 106 5.613 -8.188 7.764 1.00 0.00 H ATOM 1894 H SER B 106 5.058 -6.794 6.492 1.00 0.00 H ATOM 1895 N GLY B 107 5.178 -5.085 9.117 1.00 24.47 N ATOM 1896 CA GLY B 107 5.697 -4.249 10.186 1.00 15.74 C ATOM 1897 C GLY B 107 6.955 -4.783 10.839 1.00 28.18 C ATOM 1898 O GLY B 107 7.466 -4.201 11.796 1.00 35.52 O ATOM 1899 H GLY B 107 5.657 -5.084 8.194 1.00 0.00 H ATOM 1900 N LYS B 108 7.465 -5.895 10.324 1.00 21.09 N ATOM 1901 CA LYS B 108 8.695 -6.469 10.852 1.00 20.61 C ATOM 1902 C LYS B 108 9.938 -5.745 10.326 1.00 27.78 C ATOM 1903 O LYS B 108 9.944 -5.221 9.209 1.00 26.17 O ATOM 1904 CB LYS B 108 8.754 -7.964 10.545 1.00 26.42 C ATOM 1905 CG LYS B 108 7.599 -8.742 11.148 1.00 32.79 C ATOM 1906 CD LYS B 108 7.514 -10.153 10.592 1.00 45.74 C ATOM 1907 CE LYS B 108 6.160 -10.772 10.897 1.00 49.85 C ATOM 1908 NZ LYS B 108 5.905 -11.994 10.086 1.00 65.39 N ATOM 1909 HZ1 LYS B 108 5.929 -11.749 9.076 1.00 0.00 H ATOM 1910 HZ2 LYS B 108 6.638 -12.703 10.290 1.00 0.00 H ATOM 1911 HZ3 LYS B 108 4.970 -12.381 10.328 1.00 0.00 H ATOM 1912 H LYS B 108 6.979 -6.363 9.532 1.00 0.00 H ATOM 1913 N ASP B 109 10.985 -5.720 11.145 1.00 25.06 N ATOM 1914 CA ASP B 109 12.197 -4.959 10.852 1.00 25.61 C ATOM 1915 C ASP B 109 12.890 -5.456 9.586 1.00 25.87 C ATOM 1916 O ASP B 109 13.238 -6.631 9.488 1.00 27.47 O ATOM 1917 CB ASP B 109 13.160 -5.045 12.041 1.00 31.57 C ATOM 1918 CG ASP B 109 14.211 -3.948 12.036 1.00 34.11 C ATOM 1919 OD1 ASP B 109 14.536 -3.408 10.958 1.00 35.27 O ATOM 1920 OD2 ASP B 109 14.724 -3.628 13.130 1.00 40.01 O ATOM 1921 H ASP B 109 10.939 -6.264 12.030 1.00 0.00 H ATOM 1922 N PRO B 110 13.093 -4.555 8.610 1.00 23.65 N ATOM 1923 CA PRO B 110 13.829 -4.899 7.390 1.00 26.31 C ATOM 1924 C PRO B 110 15.289 -5.217 7.679 1.00 25.18 C ATOM 1925 O PRO B 110 15.930 -5.913 6.893 1.00 24.85 O ATOM 1926 CB PRO B 110 13.730 -3.621 6.548 1.00 23.33 C ATOM 1927 CG PRO B 110 12.536 -2.900 7.076 1.00 23.02 C ATOM 1928 CD PRO B 110 12.511 -3.203 8.542 1.00 25.81 C ATOM 1929 N ASN B 111 15.805 -4.722 8.802 1.00 28.90 N ATOM 1930 CA ASN B 111 17.217 -4.905 9.144 1.00 34.25 C ATOM 1931 C ASN B 111 17.628 -6.356 9.394 1.00 36.55 C ATOM 1932 O ASN B 111 18.815 -6.664 9.477 1.00 39.00 O ATOM 1933 CB ASN B 111 17.612 -4.027 10.335 1.00 25.00 C ATOM 1934 CG ASN B 111 17.781 -2.569 9.954 1.00 24.53 C ATOM 1935 OD1 ASN B 111 18.239 -2.251 8.856 1.00 36.28 O ATOM 1936 ND2 ASN B 111 17.411 -1.674 10.860 1.00 42.83 N ATOM 1937 HD22 ASN B 111 17.029 -1.988 11.775 1.00 0.00 H ATOM 1938 HD21 ASN B 111 17.503 -0.658 10.655 1.00 0.00 H ATOM 1939 H ASN B 111 15.190 -4.192 9.452 1.00 0.00 H ATOM 1940 N HIS B 112 16.650 -7.246 9.509 1.00 31.57 N ATOM 1941 CA HIS B 112 16.940 -8.668 9.626 1.00 34.63 C ATOM 1942 C HIS B 112 17.500 -9.212 8.314 1.00 42.09 C ATOM 1943 O HIS B 112 18.094 -10.289 8.283 1.00 44.07 O ATOM 1944 CB HIS B 112 15.691 -9.449 10.038 1.00 30.81 C ATOM 1945 CG HIS B 112 15.309 -9.262 11.473 1.00 36.68 C ATOM 1946 ND1 HIS B 112 14.137 -8.648 11.860 1.00 43.56 N ATOM 1947 CD2 HIS B 112 15.946 -9.611 12.616 1.00 34.91 C ATOM 1948 CE1 HIS B 112 14.068 -8.627 13.179 1.00 47.66 C ATOM 1949 NE2 HIS B 112 15.152 -9.204 13.662 1.00 44.36 N ATOM 1950 H HIS B 112 15.662 -6.923 9.516 1.00 0.00 H ATOM 1951 N PHE B 113 17.301 -8.463 7.232 1.00 29.95 N ATOM 1952 CA PHE B 113 17.836 -8.831 5.927 1.00 27.84 C ATOM 1953 C PHE B 113 19.047 -7.981 5.581 1.00 28.35 C ATOM 1954 O PHE B 113 19.550 -8.040 4.463 1.00 33.30 O ATOM 1955 CB PHE B 113 16.779 -8.643 4.833 1.00 34.41 C ATOM 1956 CG PHE B 113 15.598 -9.555 4.964 1.00 35.56 C ATOM 1957 CD1 PHE B 113 15.700 -10.895 4.627 1.00 40.50 C ATOM 1958 CD2 PHE B 113 14.383 -9.073 5.415 1.00 29.54 C ATOM 1959 CE1 PHE B 113 14.616 -11.735 4.747 1.00 35.81 C ATOM 1960 CE2 PHE B 113 13.296 -9.909 5.536 1.00 26.95 C ATOM 1961 CZ PHE B 113 13.411 -11.241 5.202 1.00 35.23 C ATOM 1962 H PHE B 113 16.746 -7.588 7.320 1.00 0.00 H ATOM 1963 N ARG B 114 19.506 -7.180 6.533 1.00 28.77 N ATOM 1964 CA ARG B 114 20.541 -6.200 6.243 1.00 35.78 C ATOM 1965 C ARG B 114 21.918 -6.833 6.106 1.00 38.29 C ATOM 1966 O ARG B 114 22.451 -7.375 7.073 1.00 35.77 O ATOM 1967 CB ARG B 114 20.575 -5.117 7.320 1.00 33.45 C ATOM 1968 CG ARG B 114 21.520 -3.975 6.997 1.00 29.53 C ATOM 1969 CD ARG B 114 21.545 -2.946 8.111 1.00 27.16 C ATOM 1970 NE ARG B 114 22.272 -1.755 7.691 1.00 36.74 N ATOM 1971 CZ ARG B 114 21.706 -0.704 7.107 1.00 36.50 C ATOM 1972 NH1 ARG B 114 20.397 -0.689 6.885 1.00 30.97 N ATOM 1973 NH2 ARG B 114 22.448 0.335 6.755 1.00 33.02 N ATOM 1974 HE ARG B 114 23.298 -1.726 7.859 1.00 0.00 H ATOM 1975 HH12 ARG B 114 19.957 0.135 6.428 1.00 0.00 H ATOM 1976 HH11 ARG B 114 19.812 -1.501 7.168 1.00 0.00 H ATOM 1977 HH22 ARG B 114 22.007 1.158 6.298 1.00 0.00 H ATOM 1978 HH21 ARG B 114 23.472 0.328 6.936 1.00 0.00 H ATOM 1979 H ARG B 114 19.122 -7.253 7.497 1.00 0.00 H ATOM 1980 N PRO B 115 22.502 -6.753 4.898 1.00 40.16 N ATOM 1981 CA PRO B 115 23.855 -7.261 4.659 1.00 38.47 C ATOM 1982 C PRO B 115 24.881 -6.465 5.459 1.00 41.70 C ATOM 1983 O PRO B 115 24.780 -5.240 5.542 1.00 45.59 O ATOM 1984 CB PRO B 115 24.053 -7.038 3.156 1.00 41.47 C ATOM 1985 CG PRO B 115 23.112 -5.934 2.807 1.00 40.93 C ATOM 1986 CD PRO B 115 21.925 -6.125 3.696 1.00 41.23 C ATOM 1987 N ALA B 116 25.845 -7.162 6.049 1.00 55.03 N ATOM 1988 CA ALA B 116 26.871 -6.532 6.872 1.00 46.41 C ATOM 1989 C ALA B 116 27.663 -5.503 6.076 1.00 40.72 C ATOM 1990 O ALA B 116 28.110 -5.776 4.961 1.00 44.26 O ATOM 1991 CB ALA B 116 27.800 -7.580 7.460 1.00 46.47 C ATOM 1992 H ALA B 116 25.869 -8.194 5.920 1.00 0.00 H ATOM 1993 N GLY B 117 27.826 -4.318 6.656 1.00 34.05 N ATOM 1994 CA GLY B 117 28.571 -3.253 6.019 1.00 34.59 C ATOM 1995 C GLY B 117 27.705 -2.282 5.239 1.00 46.00 C ATOM 1996 O GLY B 117 28.209 -1.294 4.706 1.00 49.31 O ATOM 1997 H GLY B 117 27.407 -4.152 7.593 1.00 0.00 H ATOM 1998 N LEU B 118 26.407 -2.556 5.154 1.00 50.71 N ATOM 1999 CA LEU B 118 25.502 -1.653 4.453 1.00 43.92 C ATOM 2000 C LEU B 118 25.482 -0.317 5.179 1.00 30.50 C ATOM 2001 O LEU B 118 25.160 -0.266 6.366 1.00 30.59 O ATOM 2002 CB LEU B 118 24.087 -2.229 4.380 1.00 39.03 C ATOM 2003 CG LEU B 118 23.151 -1.485 3.428 1.00 34.85 C ATOM 2004 CD1 LEU B 118 23.551 -1.726 1.977 1.00 31.72 C ATOM 2005 CD2 LEU B 118 21.707 -1.885 3.663 1.00 35.44 C ATOM 2006 H LEU B 118 26.034 -3.422 5.592 1.00 0.00 H ATOM 2007 N PRO B 119 25.843 0.762 4.467 1.00 20.94 N ATOM 2008 CA PRO B 119 25.965 2.113 5.029 1.00 34.11 C ATOM 2009 C PRO B 119 24.691 2.536 5.753 1.00 39.03 C ATOM 2010 O PRO B 119 23.593 2.199 5.313 1.00 38.88 O ATOM 2011 CB PRO B 119 26.192 2.986 3.792 1.00 30.39 C ATOM 2012 CG PRO B 119 26.797 2.063 2.789 1.00 25.49 C ATOM 2013 CD PRO B 119 26.135 0.737 3.024 1.00 28.27 C ATOM 2014 N LYS B 120 24.846 3.268 6.850 1.00 32.56 N ATOM 2015 CA LYS B 120 23.726 3.626 7.716 1.00 34.91 C ATOM 2016 C LYS B 120 22.633 4.439 7.018 1.00 28.90 C ATOM 2017 O LYS B 120 21.513 4.541 7.518 1.00 35.22 O ATOM 2018 CB LYS B 120 24.227 4.382 8.950 1.00 31.77 C ATOM 2019 CG LYS B 120 24.748 3.494 10.075 1.00 33.09 C ATOM 2020 CD LYS B 120 26.108 2.885 9.759 1.00 33.27 C ATOM 2021 CE LYS B 120 26.533 1.895 10.833 1.00 33.38 C ATOM 2022 NZ LYS B 120 27.212 0.708 10.238 1.00 33.23 N ATOM 2023 HZ1 LYS B 120 26.560 0.229 9.585 1.00 0.00 H ATOM 2024 HZ2 LYS B 120 28.059 1.018 9.720 1.00 0.00 H ATOM 2025 HZ3 LYS B 120 27.489 0.052 10.996 1.00 0.00 H ATOM 2026 H LYS B 120 25.800 3.598 7.102 1.00 0.00 H ATOM 2027 N ARG B 121 22.954 5.012 5.864 1.00 28.52 N ATOM 2028 CA ARG B 121 22.016 5.887 5.169 1.00 30.32 C ATOM 2029 C ARG B 121 20.977 5.126 4.345 1.00 36.80 C ATOM 2030 O ARG B 121 20.106 5.737 3.729 1.00 37.46 O ATOM 2031 CB ARG B 121 22.766 6.862 4.265 1.00 30.13 C ATOM 2032 CG ARG B 121 23.470 6.196 3.099 1.00 34.54 C ATOM 2033 CD ARG B 121 23.545 7.121 1.896 1.00 41.98 C ATOM 2034 NE ARG B 121 24.466 6.623 0.879 1.00 39.48 N ATOM 2035 CZ ARG B 121 25.769 6.886 0.866 1.00 39.71 C ATOM 2036 NH1 ARG B 121 26.301 7.643 1.817 1.00 39.22 N ATOM 2037 NH2 ARG B 121 26.542 6.394 -0.096 1.00 40.56 N ATOM 2038 HE ARG B 121 24.080 6.027 0.119 1.00 0.00 H ATOM 2039 HH12 ARG B 121 27.320 7.849 1.808 1.00 0.00 H ATOM 2040 HH11 ARG B 121 25.699 8.030 2.571 1.00 0.00 H ATOM 2041 HH22 ARG B 121 27.561 6.602 -0.102 1.00 0.00 H ATOM 2042 HH21 ARG B 121 26.128 5.800 -0.843 1.00 0.00 H ATOM 2043 H ARG B 121 23.891 4.834 5.448 1.00 0.00 H ATOM 2044 N TYR B 122 21.072 3.799 4.325 1.00 35.82 N ATOM 2045 CA TYR B 122 20.135 2.986 3.553 1.00 30.73 C ATOM 2046 C TYR B 122 19.193 2.206 4.460 1.00 33.41 C ATOM 2047 O TYR B 122 19.617 1.662 5.481 1.00 32.05 O ATOM 2048 CB TYR B 122 20.883 2.030 2.618 1.00 33.32 C ATOM 2049 CG TYR B 122 21.639 2.728 1.510 1.00 35.92 C ATOM 2050 CD1 TYR B 122 20.967 3.340 0.462 1.00 32.34 C ATOM 2051 CD2 TYR B 122 23.030 2.769 1.509 1.00 40.92 C ATOM 2052 CE1 TYR B 122 21.654 3.977 -0.553 1.00 41.07 C ATOM 2053 CE2 TYR B 122 23.727 3.404 0.498 1.00 33.01 C ATOM 2054 CZ TYR B 122 23.032 4.006 -0.531 1.00 48.10 C ATOM 2055 OH TYR B 122 23.717 4.642 -1.543 1.00 53.70 O ATOM 2056 OXT TYR B 122 17.999 2.089 4.187 1.00 35.06 O ATOM 2057 HH TYR B 122 23.071 5.016 -2.193 1.00 0.00 H ATOM 2058 H TYR B 122 21.826 3.332 4.868 1.00 0.00 H TER 2059 TYR B 122 ATOM 2060 N ARG C 20 8.567 -3.239 -22.435 1.00 53.28 N ATOM 2061 CA ARG C 20 8.829 -2.168 -21.515 1.00 60.08 C ATOM 2062 C ARG C 20 7.808 -2.198 -20.395 1.00 64.43 C ATOM 2063 O ARG C 20 7.126 -3.163 -20.205 1.00 54.21 O ATOM 2064 CB ARG C 20 8.750 -0.841 -22.248 1.00 55.73 C ATOM 2065 CG ARG C 20 10.044 -0.047 -22.233 1.00 62.42 C ATOM 2066 CD ARG C 20 10.334 0.621 -20.899 1.00 62.60 C ATOM 2067 NE ARG C 20 11.232 -0.156 -20.058 1.00 69.03 N ATOM 2068 CZ ARG C 20 12.521 -0.328 -20.303 1.00 65.02 C ATOM 2069 NH1 ARG C 20 13.049 0.230 -21.365 1.00 75.04 N ATOM 2070 NH2 ARG C 20 13.278 -1.047 -19.498 1.00 55.48 N ATOM 2071 HE ARG C 20 10.835 -0.606 -19.209 1.00 0.00 H ATOM 2072 HH12 ARG C 20 14.061 0.104 -21.570 1.00 0.00 H ATOM 2073 HH11 ARG C 20 12.456 0.799 -22.002 1.00 0.00 H ATOM 2074 HH22 ARG C 20 14.289 -1.171 -19.708 1.00 0.00 H ATOM 2075 HH21 ARG C 20 12.864 -1.491 -18.653 1.00 0.00 H ATOM 2076 HN3 ARG C 20 7.613 -3.127 -22.833 1.00 0.00 H ATOM 2077 HN2 ARG C 20 8.630 -4.148 -21.934 1.00 0.00 H ATOM 2078 HN1 ARG C 20 9.269 -3.215 -23.202 1.00 0.00 H ATOM 2079 N TRP C 21 7.729 -1.114 -19.653 1.00 58.26 N ATOM 2080 CA TRP C 21 6.654 -0.945 -18.728 1.00 52.37 C ATOM 2081 C TRP C 21 5.553 -0.130 -19.376 1.00 55.32 C ATOM 2082 O TRP C 21 4.513 0.028 -18.820 1.00 56.38 O ATOM 2083 CB TRP C 21 7.152 -0.316 -17.429 1.00 66.55 C ATOM 2084 CG TRP C 21 7.991 -1.254 -16.571 1.00 67.30 C ATOM 2085 CD1 TRP C 21 9.293 -1.543 -16.729 1.00 60.74 C ATOM 2086 CD2 TRP C 21 7.559 -1.992 -15.423 1.00 63.18 C ATOM 2087 NE1 TRP C 21 9.703 -2.403 -15.775 1.00 53.06 N ATOM 2088 CE2 TRP C 21 8.656 -2.689 -14.949 1.00 56.48 C ATOM 2089 CE3 TRP C 21 6.349 -2.107 -14.743 1.00 51.21 C ATOM 2090 CZ2 TRP C 21 8.583 -3.511 -13.848 1.00 57.37 C ATOM 2091 CZ3 TRP C 21 6.292 -2.897 -13.661 1.00 42.69 C ATOM 2092 CH2 TRP C 21 7.387 -3.595 -13.218 1.00 50.77 C ATOM 2093 HE1 TRP C 21 10.665 -2.787 -15.683 1.00 0.00 H ATOM 2094 H TRP C 21 8.455 -0.375 -19.741 1.00 0.00 H ATOM 2095 N VAL C 22 5.799 0.352 -20.581 1.00 53.46 N ATOM 2096 CA VAL C 22 4.786 0.943 -21.404 1.00 50.32 C ATOM 2097 C VAL C 22 3.915 -0.164 -21.926 1.00 53.39 C ATOM 2098 O VAL C 22 2.749 0.026 -22.170 1.00 45.66 O ATOM 2099 CB VAL C 22 5.450 1.647 -22.587 1.00 57.29 C ATOM 2100 CG1 VAL C 22 4.470 2.008 -23.690 1.00 43.69 C ATOM 2101 CG2 VAL C 22 6.189 2.865 -22.094 1.00 57.87 C ATOM 2102 H VAL C 22 6.771 0.300 -20.948 1.00 0.00 H ATOM 2103 N GLN C 23 4.532 -1.312 -22.126 1.00 49.70 N ATOM 2104 CA GLN C 23 3.893 -2.471 -22.676 1.00 50.46 C ATOM 2105 C GLN C 23 3.074 -3.091 -21.569 1.00 49.55 C ATOM 2106 O GLN C 23 1.965 -3.514 -21.749 1.00 45.11 O ATOM 2107 CB GLN C 23 4.980 -3.429 -23.122 1.00 48.23 C ATOM 2108 CG GLN C 23 4.514 -4.745 -23.653 1.00 49.62 C ATOM 2109 CD GLN C 23 3.485 -4.589 -24.729 1.00 53.26 C ATOM 2110 OE1 GLN C 23 3.273 -3.514 -25.219 1.00 55.87 O ATOM 2111 NE2 GLN C 23 2.838 -5.666 -25.087 1.00 54.67 N ATOM 2112 HE22 GLN C 23 3.055 -6.577 -24.635 1.00 0.00 H ATOM 2113 HE21 GLN C 23 2.106 -5.612 -25.824 1.00 0.00 H ATOM 2114 H GLN C 23 5.538 -1.380 -21.871 1.00 0.00 H ATOM 2115 N PHE C 24 3.641 -3.094 -20.381 1.00 46.16 N ATOM 2116 CA PHE C 24 2.986 -3.631 -19.206 1.00 43.33 C ATOM 2117 C PHE C 24 1.709 -2.856 -18.946 1.00 43.51 C ATOM 2118 O PHE C 24 0.658 -3.412 -18.747 1.00 37.18 O ATOM 2119 CB PHE C 24 3.912 -3.518 -18.010 1.00 38.12 C ATOM 2120 CG PHE C 24 3.404 -4.193 -16.796 1.00 36.53 C ATOM 2121 CD1 PHE C 24 3.536 -5.531 -16.651 1.00 31.71 C ATOM 2122 CD2 PHE C 24 2.772 -3.484 -15.822 1.00 30.44 C ATOM 2123 CE1 PHE C 24 3.065 -6.163 -15.542 1.00 33.41 C ATOM 2124 CE2 PHE C 24 2.294 -4.106 -14.716 1.00 25.36 C ATOM 2125 CZ PHE C 24 2.447 -5.446 -14.570 1.00 25.75 C ATOM 2126 H PHE C 24 4.596 -2.695 -20.282 1.00 0.00 H ATOM 2127 N MET C 25 1.852 -1.547 -18.999 1.00 41.72 N ATOM 2128 CA MET C 25 0.789 -0.630 -18.713 1.00 41.77 C ATOM 2129 C MET C 25 -0.293 -0.689 -19.779 1.00 46.33 C ATOM 2130 O MET C 25 -1.448 -0.505 -19.485 1.00 44.78 O ATOM 2131 CB MET C 25 1.349 0.781 -18.574 1.00 37.66 C ATOM 2132 CG MET C 25 1.324 1.384 -17.177 1.00 57.38 C ATOM 2133 SD MET C 25 1.136 0.358 -15.683 1.00 76.45 S ATOM 2134 CE MET C 25 0.246 1.510 -14.646 1.00 54.85 C ATOM 2135 H MET C 25 2.781 -1.161 -19.261 1.00 0.00 H ATOM 2136 N LYS C 26 0.089 -0.943 -21.013 1.00 41.71 N ATOM 2137 CA LYS C 26 -0.882 -1.179 -22.051 1.00 37.63 C ATOM 2138 C LYS C 26 -1.738 -2.407 -21.742 1.00 33.38 C ATOM 2139 O LYS C 26 -2.926 -2.338 -21.773 1.00 41.43 O ATOM 2140 CB LYS C 26 -0.189 -1.319 -23.401 1.00 45.50 C ATOM 2141 CG LYS C 26 -1.112 -1.143 -24.580 1.00 56.06 C ATOM 2142 CD LYS C 26 -0.769 -2.043 -25.743 1.00 55.00 C ATOM 2143 CE LYS C 26 -2.011 -2.247 -26.584 1.00 64.47 C ATOM 2144 NZ LYS C 26 -1.939 -3.432 -27.480 1.00 59.71 N ATOM 2145 HZ1 LYS C 26 -1.137 -3.323 -28.133 1.00 0.00 H ATOM 2146 HZ2 LYS C 26 -1.808 -4.290 -26.908 1.00 0.00 H ATOM 2147 HZ3 LYS C 26 -2.822 -3.508 -28.024 1.00 0.00 H ATOM 2148 H LYS C 26 1.103 -0.974 -21.241 1.00 0.00 H ATOM 2149 N GLU C 27 -1.099 -3.514 -21.433 1.00 31.99 N ATOM 2150 CA GLU C 27 -1.745 -4.765 -21.047 1.00 32.87 C ATOM 2151 C GLU C 27 -2.655 -4.561 -19.841 1.00 29.57 C ATOM 2152 O GLU C 27 -3.749 -5.126 -19.771 1.00 28.28 O ATOM 2153 CB GLU C 27 -0.692 -5.829 -20.736 1.00 33.41 C ATOM 2154 CG GLU C 27 0.054 -6.325 -21.962 1.00 39.99 C ATOM 2155 CD GLU C 27 1.406 -6.921 -21.623 1.00 45.99 C ATOM 2156 OE1 GLU C 27 1.752 -6.977 -20.424 1.00 48.50 O ATOM 2157 OE2 GLU C 27 2.128 -7.327 -22.558 1.00 49.79 O ATOM 2158 H GLU C 27 -0.060 -3.497 -21.466 1.00 0.00 H ATOM 2159 N ALA C 28 -2.195 -3.741 -18.900 1.00 27.05 N ATOM 2160 CA ALA C 28 -2.980 -3.417 -17.719 1.00 29.81 C ATOM 2161 C ALA C 28 -4.243 -2.660 -18.106 1.00 31.58 C ATOM 2162 O ALA C 28 -5.327 -2.948 -17.603 1.00 28.59 O ATOM 2163 CB ALA C 28 -2.148 -2.604 -16.734 1.00 29.25 C ATOM 2164 H ALA C 28 -1.250 -3.321 -19.011 1.00 0.00 H ATOM 2165 N GLY C 29 -4.100 -1.694 -19.007 1.00 35.77 N ATOM 2166 CA GLY C 29 -5.244 -0.947 -19.499 1.00 34.70 C ATOM 2167 C GLY C 29 -6.273 -1.857 -20.143 1.00 27.24 C ATOM 2168 O GLY C 29 -7.456 -1.798 -19.814 1.00 32.32 O ATOM 2169 H GLY C 29 -3.151 -1.469 -19.367 1.00 0.00 H ATOM 2170 N GLN C 30 -5.817 -2.711 -21.053 1.00 31.98 N ATOM 2171 CA GLN C 30 -6.695 -3.655 -21.740 1.00 36.72 C ATOM 2172 C GLN C 30 -7.364 -4.607 -20.759 1.00 41.24 C ATOM 2173 O GLN C 30 -8.575 -4.824 -20.817 1.00 41.36 O ATOM 2174 CB GLN C 30 -5.904 -4.471 -22.761 1.00 36.76 C ATOM 2175 CG GLN C 30 -5.106 -3.638 -23.742 1.00 36.65 C ATOM 2176 CD GLN C 30 -4.406 -4.489 -24.776 1.00 45.62 C ATOM 2177 OE1 GLN C 30 -3.486 -5.242 -24.459 1.00 46.60 O ATOM 2178 NE2 GLN C 30 -4.848 -4.383 -26.022 1.00 56.12 N ATOM 2179 HE22 GLN C 30 -5.629 -3.733 -26.243 1.00 0.00 H ATOM 2180 HE21 GLN C 30 -4.414 -4.950 -26.778 1.00 0.00 H ATOM 2181 H GLN C 30 -4.803 -2.707 -21.283 1.00 0.00 H ATOM 2182 N GLY C 31 -6.563 -5.179 -19.866 1.00 35.63 N ATOM 2183 CA GLY C 31 -7.069 -6.101 -18.868 1.00 31.28 C ATOM 2184 C GLY C 31 -8.139 -5.455 -18.010 1.00 30.50 C ATOM 2185 O GLY C 31 -9.151 -6.078 -17.690 1.00 30.66 O ATOM 2186 H GLY C 31 -5.547 -4.960 -19.884 1.00 0.00 H ATOM 2187 N SER C 32 -7.912 -4.198 -17.646 1.00 30.11 N ATOM 2188 CA SER C 32 -8.882 -3.437 -16.871 1.00 33.14 C ATOM 2189 C SER C 32 -10.205 -3.343 -17.609 1.00 32.38 C ATOM 2190 O SER C 32 -11.260 -3.578 -17.029 1.00 31.71 O ATOM 2191 CB SER C 32 -8.354 -2.034 -16.578 1.00 28.96 C ATOM 2192 OG SER C 32 -7.135 -2.104 -15.862 1.00 43.43 O ATOM 2193 HG SER C 32 -6.465 -2.595 -16.401 1.00 0.00 H ATOM 2194 H SER C 32 -7.017 -3.745 -17.922 1.00 0.00 H ATOM 2195 N ARG C 33 -10.140 -3.049 -18.889 1.00 32.20 N ATOM 2196 CA ARG C 33 -11.316 -2.924 -19.715 1.00 35.93 C ATOM 2197 C ARG C 33 -12.061 -4.235 -19.780 1.00 35.61 C ATOM 2198 O ARG C 33 -13.261 -4.252 -19.695 1.00 36.62 O ATOM 2199 CB ARG C 33 -10.946 -2.442 -21.107 1.00 35.24 C ATOM 2200 CG ARG C 33 -10.793 -0.944 -21.228 1.00 38.95 C ATOM 2201 CD ARG C 33 -10.391 -0.567 -22.634 1.00 47.86 C ATOM 2202 NE ARG C 33 -8.946 -0.456 -22.778 1.00 58.26 N ATOM 2203 CZ ARG C 33 -8.235 -1.000 -23.746 1.00 51.31 C ATOM 2204 NH1 ARG C 33 -6.952 -0.820 -23.753 1.00 61.81 N ATOM 2205 NH2 ARG C 33 -8.795 -1.732 -24.685 1.00 54.94 N ATOM 2206 HE ARG C 33 -8.434 0.096 -22.060 1.00 0.00 H ATOM 2207 HH12 ARG C 33 -6.372 -1.240 -24.507 1.00 0.00 H ATOM 2208 HH11 ARG C 33 -6.502 -0.255 -23.004 1.00 0.00 H ATOM 2209 HH22 ARG C 33 -8.210 -2.149 -25.437 1.00 0.00 H ATOM 2210 HH21 ARG C 33 -9.822 -1.893 -24.675 1.00 0.00 H ATOM 2211 H ARG C 33 -9.206 -2.901 -19.322 1.00 0.00 H ATOM 2212 N ASP C 34 -11.330 -5.330 -19.968 1.00 34.95 N ATOM 2213 CA ASP C 34 -11.923 -6.646 -19.960 1.00 35.64 C ATOM 2214 C ASP C 34 -12.657 -6.848 -18.649 1.00 38.43 C ATOM 2215 O ASP C 34 -13.693 -7.436 -18.615 1.00 40.26 O ATOM 2216 CB ASP C 34 -10.878 -7.731 -20.143 1.00 33.83 C ATOM 2217 CG ASP C 34 -10.240 -7.703 -21.483 1.00 38.51 C ATOM 2218 OD1 ASP C 34 -10.917 -7.453 -22.450 1.00 50.63 O ATOM 2219 OD2 ASP C 34 -9.059 -7.940 -21.608 1.00 37.41 O ATOM 2220 H ASP C 34 -10.306 -5.236 -20.125 1.00 0.00 H ATOM 2221 N MET C 35 -12.118 -6.325 -17.575 1.00 31.16 N ATOM 2222 CA MET C 35 -12.727 -6.498 -16.280 1.00 34.17 C ATOM 2223 C MET C 35 -14.006 -5.710 -16.192 1.00 37.56 C ATOM 2224 O MET C 35 -15.002 -6.233 -15.748 1.00 33.65 O ATOM 2225 CB MET C 35 -11.763 -6.204 -15.115 1.00 30.84 C ATOM 2226 CG MET C 35 -10.662 -7.221 -14.955 1.00 31.27 C ATOM 2227 SD MET C 35 -11.202 -8.843 -14.432 1.00 28.24 S ATOM 2228 CE MET C 35 -11.764 -8.509 -12.805 1.00 24.59 C ATOM 2229 H MET C 35 -11.238 -5.777 -17.658 1.00 0.00 H ATOM 2230 N TRP C 36 -13.978 -4.457 -16.619 1.00 32.29 N ATOM 2231 CA TRP C 36 -15.130 -3.623 -16.455 1.00 41.13 C ATOM 2232 C TRP C 36 -16.208 -4.133 -17.386 1.00 44.10 C ATOM 2233 O TRP C 36 -17.358 -4.169 -17.062 1.00 44.35 O ATOM 2234 CB TRP C 36 -14.784 -2.158 -16.702 1.00 32.10 C ATOM 2235 CG TRP C 36 -13.779 -1.640 -15.744 1.00 35.53 C ATOM 2236 CD1 TRP C 36 -12.578 -1.164 -16.041 1.00 43.06 C ATOM 2237 CD2 TRP C 36 -13.883 -1.600 -14.335 1.00 33.85 C ATOM 2238 NE1 TRP C 36 -11.920 -0.808 -14.926 1.00 34.67 N ATOM 2239 CE2 TRP C 36 -12.710 -1.074 -13.855 1.00 34.66 C ATOM 2240 CE3 TRP C 36 -14.861 -1.964 -13.435 1.00 40.02 C ATOM 2241 CZ2 TRP C 36 -12.483 -0.889 -12.533 1.00 31.21 C ATOM 2242 CZ3 TRP C 36 -14.642 -1.767 -12.141 1.00 38.58 C ATOM 2243 CH2 TRP C 36 -13.466 -1.244 -11.687 1.00 37.50 C ATOM 2244 HE1 TRP C 36 -10.965 -0.397 -14.889 1.00 0.00 H ATOM 2245 H TRP C 36 -13.121 -4.080 -17.072 1.00 0.00 H ATOM 2246 N ARG C 37 -15.774 -4.567 -18.537 1.00 34.04 N ATOM 2247 CA ARG C 37 -16.644 -5.125 -19.489 1.00 41.05 C ATOM 2248 C ARG C 37 -17.307 -6.378 -18.979 1.00 46.36 C ATOM 2249 O ARG C 37 -18.427 -6.635 -19.287 1.00 48.89 O ATOM 2250 CB ARG C 37 -15.863 -5.387 -20.736 1.00 44.06 C ATOM 2251 CG ARG C 37 -16.725 -5.425 -21.951 1.00 52.56 C ATOM 2252 CD ARG C 37 -16.679 -6.785 -22.551 1.00 54.47 C ATOM 2253 NE ARG C 37 -15.350 -7.073 -23.034 1.00 47.22 N ATOM 2254 CZ ARG C 37 -14.922 -8.289 -23.302 1.00 52.53 C ATOM 2255 NH1 ARG C 37 -15.727 -9.317 -23.130 1.00 51.18 N ATOM 2256 NH2 ARG C 37 -13.702 -8.475 -23.727 1.00 44.16 N ATOM 2257 HE ARG C 37 -14.695 -6.278 -23.178 1.00 0.00 H ATOM 2258 HH12 ARG C 37 -15.394 -10.279 -23.340 1.00 0.00 H ATOM 2259 HH11 ARG C 37 -16.696 -9.166 -22.784 1.00 0.00 H ATOM 2260 HH22 ARG C 37 -13.366 -9.436 -23.938 1.00 0.00 H ATOM 2261 HH21 ARG C 37 -13.066 -7.662 -23.854 1.00 0.00 H ATOM 2262 H ARG C 37 -14.760 -4.498 -18.755 1.00 0.00 H ATOM 2263 N ALA C 38 -16.607 -7.151 -18.178 1.00 45.32 N ATOM 2264 CA ALA C 38 -17.212 -8.284 -17.523 1.00 41.28 C ATOM 2265 C ALA C 38 -18.292 -7.849 -16.582 1.00 47.77 C ATOM 2266 O ALA C 38 -19.341 -8.413 -16.580 1.00 51.73 O ATOM 2267 CB ALA C 38 -16.186 -9.088 -16.776 1.00 40.29 C ATOM 2268 H ALA C 38 -15.601 -6.942 -18.014 1.00 0.00 H ATOM 2269 N TYR C 39 -18.010 -6.841 -15.780 1.00 41.17 N ATOM 2270 CA TYR C 39 -18.947 -6.371 -14.789 1.00 46.72 C ATOM 2271 C TYR C 39 -20.142 -5.680 -15.440 1.00 49.87 C ATOM 2272 O TYR C 39 -21.218 -5.667 -14.906 1.00 47.71 O ATOM 2273 CB TYR C 39 -18.275 -5.402 -13.820 1.00 47.01 C ATOM 2274 CG TYR C 39 -17.176 -5.981 -12.954 1.00 51.51 C ATOM 2275 CD1 TYR C 39 -16.047 -5.251 -12.648 1.00 51.07 C ATOM 2276 CD2 TYR C 39 -17.263 -7.245 -12.442 1.00 47.55 C ATOM 2277 CE1 TYR C 39 -15.042 -5.770 -11.872 1.00 38.28 C ATOM 2278 CE2 TYR C 39 -16.262 -7.759 -11.653 1.00 47.83 C ATOM 2279 CZ TYR C 39 -15.162 -7.013 -11.369 1.00 41.17 C ATOM 2280 OH TYR C 39 -14.202 -7.541 -10.621 1.00 34.01 O ATOM 2281 HH TYR C 39 -13.846 -8.350 -11.066 1.00 0.00 H ATOM 2282 H TYR C 39 -17.086 -6.372 -15.864 1.00 0.00 H ATOM 2283 N SER C 40 -19.925 -5.083 -16.596 1.00 52.03 N ATOM 2284 CA SER C 40 -20.997 -4.408 -17.283 1.00 57.14 C ATOM 2285 C SER C 40 -21.975 -5.454 -17.780 1.00 65.25 C ATOM 2286 O SER C 40 -23.165 -5.338 -17.569 1.00 64.92 O ATOM 2287 CB SER C 40 -20.477 -3.571 -18.442 1.00 57.36 C ATOM 2288 OG SER C 40 -21.208 -2.373 -18.562 1.00 67.97 O ATOM 2289 HG SER C 40 -21.121 -1.850 -17.726 1.00 0.00 H ATOM 2290 H SER C 40 -18.973 -5.100 -17.015 1.00 0.00 H ATOM 2291 N ASP C 41 -21.427 -6.477 -18.421 1.00 60.33 N ATOM 2292 CA ASP C 41 -22.203 -7.528 -19.020 1.00 58.18 C ATOM 2293 C ASP C 41 -23.069 -8.175 -17.987 1.00 63.76 C ATOM 2294 O ASP C 41 -24.214 -8.458 -18.229 1.00 71.03 O ATOM 2295 CB ASP C 41 -21.293 -8.554 -19.678 1.00 46.19 C ATOM 2296 CG ASP C 41 -20.833 -8.125 -21.033 1.00 48.49 C ATOM 2297 OD1 ASP C 41 -21.098 -6.984 -21.424 1.00 53.19 O ATOM 2298 OD2 ASP C 41 -20.223 -8.924 -21.729 1.00 45.37 O ATOM 2299 H ASP C 41 -20.390 -6.521 -18.494 1.00 0.00 H ATOM 2300 N MET C 42 -22.536 -8.373 -16.807 1.00 59.88 N ATOM 2301 CA MET C 42 -23.281 -9.016 -15.753 1.00 60.38 C ATOM 2302 C MET C 42 -24.529 -8.261 -15.312 1.00 65.80 C ATOM 2303 O MET C 42 -25.549 -8.870 -15.023 1.00 71.68 O ATOM 2304 CB MET C 42 -22.352 -9.261 -14.597 1.00 56.10 C ATOM 2305 CG MET C 42 -22.988 -9.542 -13.282 1.00 57.15 C ATOM 2306 SD MET C 42 -21.630 -9.939 -12.220 1.00 65.90 S ATOM 2307 CE MET C 42 -22.478 -10.360 -10.724 1.00 55.10 C ATOM 2308 H MET C 42 -21.560 -8.062 -16.627 1.00 0.00 H ATOM 2309 N LYS C 43 -24.442 -6.942 -15.226 1.00 65.17 N ATOM 2310 CA LYS C 43 -25.590 -6.134 -14.844 1.00 67.56 C ATOM 2311 C LYS C 43 -26.651 -6.194 -15.944 1.00 73.38 C ATOM 2312 O LYS C 43 -27.822 -6.026 -15.677 1.00 62.71 O ATOM 2313 CB LYS C 43 -25.160 -4.693 -14.565 1.00 66.36 C ATOM 2314 CG LYS C 43 -24.183 -4.574 -13.403 1.00 65.97 C ATOM 2315 CD LYS C 43 -24.863 -4.194 -12.098 1.00 67.39 C ATOM 2316 CE LYS C 43 -23.947 -4.318 -10.890 1.00 68.82 C ATOM 2317 NZ LYS C 43 -23.885 -3.094 -10.039 1.00 69.88 N ATOM 2318 HZ1 LYS C 43 -23.535 -2.296 -10.607 1.00 0.00 H ATOM 2319 HZ2 LYS C 43 -24.836 -2.875 -9.680 1.00 0.00 H ATOM 2320 HZ3 LYS C 43 -23.241 -3.261 -9.240 1.00 0.00 H ATOM 2321 H LYS C 43 -23.536 -6.475 -15.435 1.00 0.00 H ATOM 2322 N LYS C 44 -26.174 -6.355 -17.176 1.00 70.83 N ATOM 2323 CA LYS C 44 -26.955 -6.493 -18.389 1.00 69.48 C ATOM 2324 C LYS C 44 -27.437 -7.940 -18.483 1.00 74.41 C ATOM 2325 O LYS C 44 -27.307 -8.596 -19.520 1.00 74.30 O ATOM 2326 CB LYS C 44 -26.079 -6.202 -19.609 1.00 63.62 C ATOM 2327 CG LYS C 44 -25.688 -4.787 -19.914 1.00 56.62 C ATOM 2328 CD LYS C 44 -24.623 -4.853 -20.999 1.00 62.77 C ATOM 2329 CE LYS C 44 -23.986 -3.513 -21.337 1.00 61.35 C ATOM 2330 NZ LYS C 44 -23.332 -2.851 -20.179 1.00 61.09 N ATOM 2331 HZ1 LYS C 44 -24.038 -2.679 -19.435 1.00 0.00 H ATOM 2332 HZ2 LYS C 44 -22.580 -3.466 -19.809 1.00 0.00 H ATOM 2333 HZ3 LYS C 44 -22.922 -1.946 -20.485 1.00 0.00 H ATOM 2334 H LYS C 44 -25.139 -6.385 -17.278 1.00 0.00 H ATOM 2335 N ALA C 45 -27.984 -8.451 -17.397 1.00 72.94 N ATOM 2336 CA ALA C 45 -28.356 -9.837 -17.425 1.00 78.53 C ATOM 2337 C ALA C 45 -28.850 -10.385 -16.119 1.00 81.57 C ATOM 2338 O ALA C 45 -28.850 -11.578 -15.948 1.00 85.16 O ATOM 2339 CB ALA C 45 -27.186 -10.660 -17.924 1.00 71.68 C ATOM 2340 H ALA C 45 -28.140 -7.869 -16.549 1.00 0.00 H ATOM 2341 N ASN C 46 -29.226 -9.476 -15.232 1.00 82.97 N ATOM 2342 CA ASN C 46 -29.855 -9.769 -13.954 1.00 88.07 C ATOM 2343 C ASN C 46 -30.275 -11.210 -13.879 1.00 90.38 C ATOM 2344 O ASN C 46 -31.417 -11.516 -14.212 1.00 93.74 O ATOM 2345 CB ASN C 46 -31.064 -8.863 -13.828 1.00 81.45 C ATOM 2346 CG ASN C 46 -31.796 -9.062 -12.555 1.00 93.23 C ATOM 2347 OD1 ASN C 46 -31.526 -10.000 -11.811 1.00 98.68 O ATOM 2348 ND2 ASN C 46 -32.746 -8.180 -12.291 1.00 88.82 N ATOM 2349 HD22 ASN C 46 -32.934 -7.403 -12.957 1.00 0.00 H ATOM 2350 HD21 ASN C 46 -33.305 -8.263 -11.418 1.00 0.00 H ATOM 2351 H ASN C 46 -29.059 -8.477 -15.467 1.00 0.00 H ATOM 2352 N TRP C 47 -29.350 -12.059 -13.470 1.00 90.97 N ATOM 2353 CA TRP C 47 -29.423 -13.454 -13.785 1.00 87.34 C ATOM 2354 C TRP C 47 -29.702 -14.471 -12.701 1.00 89.98 C ATOM 2355 O TRP C 47 -29.722 -14.209 -11.512 1.00 92.22 O ATOM 2356 CB TRP C 47 -28.212 -13.881 -14.580 1.00 77.67 C ATOM 2357 CG TRP C 47 -28.562 -14.982 -15.419 1.00 85.68 C ATOM 2358 CD1 TRP C 47 -28.260 -16.290 -15.216 1.00 89.28 C ATOM 2359 CD2 TRP C 47 -29.360 -14.929 -16.593 1.00 91.98 C ATOM 2360 NE1 TRP C 47 -28.818 -17.058 -16.188 1.00 93.89 N ATOM 2361 CE2 TRP C 47 -29.500 -16.245 -17.054 1.00 98.10 C ATOM 2362 CE3 TRP C 47 -29.973 -13.897 -17.303 1.00 88.00 C ATOM 2363 CZ2 TRP C 47 -30.221 -16.554 -18.206 1.00 90.07 C ATOM 2364 CZ3 TRP C 47 -30.682 -14.205 -18.432 1.00 90.60 C ATOM 2365 CH2 TRP C 47 -30.794 -15.521 -18.880 1.00 87.00 C ATOM 2366 HE1 TRP C 47 -28.740 -18.092 -16.262 1.00 0.00 H ATOM 2367 H TRP C 47 -28.550 -11.706 -12.906 1.00 0.00 H ATOM 2368 N LYS C 48 -29.957 -15.665 -13.176 1.00 90.40 N ATOM 2369 CA LYS C 48 -29.979 -16.814 -12.338 1.00 86.86 C ATOM 2370 C LYS C 48 -28.516 -17.104 -12.052 1.00 80.09 C ATOM 2371 O LYS C 48 -27.832 -17.613 -12.899 1.00 78.28 O ATOM 2372 CB LYS C 48 -30.673 -17.972 -13.086 1.00 86.71 C ATOM 2373 CG LYS C 48 -30.249 -19.390 -12.700 1.00 85.97 C ATOM 2374 CD LYS C 48 -29.972 -20.258 -13.922 1.00 86.92 C ATOM 2375 CE LYS C 48 -29.328 -21.579 -13.537 1.00 86.97 C ATOM 2376 NZ LYS C 48 -28.594 -22.203 -14.667 1.00 87.44 N ATOM 2377 HZ1 LYS C 48 -29.254 -22.384 -15.450 1.00 0.00 H ATOM 2378 HZ2 LYS C 48 -27.842 -21.560 -14.987 1.00 0.00 H ATOM 2379 HZ3 LYS C 48 -28.174 -23.101 -14.352 1.00 0.00 H ATOM 2380 H LYS C 48 -30.148 -15.776 -14.192 1.00 0.00 H ATOM 2381 N ASN C 49 -28.040 -16.747 -10.864 1.00 78.38 N ATOM 2382 CA ASN C 49 -26.783 -17.282 -10.346 1.00 83.11 C ATOM 2383 C ASN C 49 -25.583 -17.139 -11.290 1.00 78.65 C ATOM 2384 O ASN C 49 -24.774 -18.053 -11.455 1.00 73.32 O ATOM 2385 CB ASN C 49 -27.003 -18.759 -10.048 1.00 75.46 C ATOM 2386 CG ASN C 49 -26.206 -19.249 -8.871 1.00 78.13 C ATOM 2387 OD1 ASN C 49 -25.104 -19.764 -9.037 1.00 72.15 O ATOM 2388 ND2 ASN C 49 -26.774 -19.137 -7.679 1.00 73.66 N ATOM 2389 HD22 ASN C 49 -27.710 -18.693 -7.589 1.00 0.00 H ATOM 2390 HD21 ASN C 49 -26.284 -19.494 -6.834 1.00 0.00 H ATOM 2391 H ASN C 49 -28.577 -16.068 -10.287 1.00 0.00 H ATOM 2392 N SER C 50 -25.488 -15.986 -11.915 1.00 71.13 N ATOM 2393 CA SER C 50 -24.531 -15.772 -12.999 1.00 65.29 C ATOM 2394 C SER C 50 -23.152 -15.277 -12.570 1.00 61.18 C ATOM 2395 O SER C 50 -22.219 -15.291 -13.372 1.00 56.75 O ATOM 2396 CB SER C 50 -25.103 -14.795 -14.025 1.00 70.02 C ATOM 2397 OG SER C 50 -25.064 -13.467 -13.534 1.00 76.50 O ATOM 2398 HG SER C 50 -25.439 -12.854 -14.215 1.00 0.00 H ATOM 2399 H SER C 50 -26.112 -15.204 -11.630 1.00 0.00 H ATOM 2400 N ASP C 51 -23.044 -14.826 -11.331 1.00 52.76 N ATOM 2401 CA ASP C 51 -21.845 -14.226 -10.768 1.00 52.23 C ATOM 2402 C ASP C 51 -20.538 -14.804 -11.247 1.00 52.43 C ATOM 2403 O ASP C 51 -19.823 -14.196 -12.006 1.00 50.15 O ATOM 2404 CB ASP C 51 -21.848 -14.365 -9.246 1.00 48.69 C ATOM 2405 CG ASP C 51 -22.767 -13.401 -8.571 1.00 61.90 C ATOM 2406 OD1 ASP C 51 -23.345 -12.558 -9.258 1.00 61.19 O ATOM 2407 OD2 ASP C 51 -22.935 -13.495 -7.349 1.00 67.71 O ATOM 2408 H ASP C 51 -23.878 -14.906 -10.714 1.00 0.00 H ATOM 2409 N LYS C 52 -20.238 -15.985 -10.755 1.00 48.11 N ATOM 2410 CA LYS C 52 -18.942 -16.639 -10.937 1.00 47.94 C ATOM 2411 C LYS C 52 -18.461 -16.726 -12.387 1.00 45.47 C ATOM 2412 O LYS C 52 -17.259 -16.730 -12.642 1.00 49.72 O ATOM 2413 CB LYS C 52 -18.944 -18.025 -10.288 1.00 45.67 C ATOM 2414 CG LYS C 52 -18.934 -17.986 -8.770 1.00 41.37 C ATOM 2415 CD LYS C 52 -19.183 -19.360 -8.176 1.00 44.40 C ATOM 2416 CE LYS C 52 -20.604 -19.834 -8.453 1.00 45.79 C ATOM 2417 NZ LYS C 52 -20.894 -21.130 -7.776 1.00 45.17 N ATOM 2418 HZ1 LYS C 52 -20.233 -21.855 -8.121 1.00 0.00 H ATOM 2419 HZ2 LYS C 52 -20.781 -21.016 -6.749 1.00 0.00 H ATOM 2420 HZ3 LYS C 52 -21.870 -21.420 -7.988 1.00 0.00 H ATOM 2421 H LYS C 52 -20.965 -16.484 -10.204 1.00 0.00 H ATOM 2422 N TYR C 53 -19.393 -16.789 -13.335 1.00 49.31 N ATOM 2423 CA TYR C 53 -19.015 -16.817 -14.745 1.00 47.49 C ATOM 2424 C TYR C 53 -18.396 -15.493 -15.182 1.00 39.57 C ATOM 2425 O TYR C 53 -17.361 -15.469 -15.848 1.00 44.51 O ATOM 2426 CB TYR C 53 -20.207 -17.144 -15.651 1.00 47.79 C ATOM 2427 CG TYR C 53 -19.889 -16.911 -17.112 1.00 46.27 C ATOM 2428 CD1 TYR C 53 -19.066 -17.785 -17.807 1.00 48.28 C ATOM 2429 CD2 TYR C 53 -20.382 -15.799 -17.787 1.00 43.76 C ATOM 2430 CE1 TYR C 53 -18.753 -17.571 -19.135 1.00 53.73 C ATOM 2431 CE2 TYR C 53 -20.073 -15.577 -19.118 1.00 40.47 C ATOM 2432 CZ TYR C 53 -19.259 -16.467 -19.785 1.00 41.61 C ATOM 2433 OH TYR C 53 -18.945 -16.259 -21.109 1.00 52.82 O ATOM 2434 HH TYR C 53 -19.776 -16.248 -21.646 1.00 0.00 H ATOM 2435 H TYR C 53 -20.398 -16.819 -13.069 1.00 0.00 H ATOM 2436 N PHE C 54 -19.043 -14.394 -14.812 1.00 43.43 N ATOM 2437 CA PHE C 54 -18.577 -13.070 -15.202 1.00 48.85 C ATOM 2438 C PHE C 54 -17.244 -12.724 -14.547 1.00 43.04 C ATOM 2439 O PHE C 54 -16.389 -12.086 -15.157 1.00 43.68 O ATOM 2440 CB PHE C 54 -19.626 -12.010 -14.863 1.00 57.79 C ATOM 2441 CG PHE C 54 -20.820 -12.024 -15.774 1.00 57.98 C ATOM 2442 CD1 PHE C 54 -20.704 -11.610 -17.090 1.00 58.44 C ATOM 2443 CD2 PHE C 54 -22.058 -12.440 -15.314 1.00 60.05 C ATOM 2444 CE1 PHE C 54 -21.799 -11.617 -17.933 1.00 63.92 C ATOM 2445 CE2 PHE C 54 -23.158 -12.448 -16.152 1.00 63.12 C ATOM 2446 CZ PHE C 54 -23.027 -12.035 -17.464 1.00 65.91 C ATOM 2447 H PHE C 54 -19.901 -14.480 -14.231 1.00 0.00 H ATOM 2448 N HIS C 55 -17.075 -13.151 -13.302 1.00 34.09 N ATOM 2449 CA HIS C 55 -15.836 -12.917 -12.578 1.00 34.27 C ATOM 2450 C HIS C 55 -14.685 -13.688 -13.211 1.00 36.82 C ATOM 2451 O HIS C 55 -13.579 -13.166 -13.357 1.00 31.58 O ATOM 2452 CB HIS C 55 -15.995 -13.315 -11.116 1.00 32.44 C ATOM 2453 CG HIS C 55 -16.861 -12.386 -10.329 1.00 41.51 C ATOM 2454 ND1 HIS C 55 -17.116 -11.088 -10.728 1.00 36.14 N ATOM 2455 CD2 HIS C 55 -17.535 -12.556 -9.168 1.00 46.59 C ATOM 2456 CE1 HIS C 55 -17.905 -10.506 -9.848 1.00 42.61 C ATOM 2457 NE2 HIS C 55 -18.177 -11.377 -8.889 1.00 43.69 N ATOM 2458 H HIS C 55 -17.847 -13.665 -12.833 1.00 0.00 H ATOM 2459 N ALA C 56 -14.954 -14.933 -13.586 1.00 38.01 N ATOM 2460 CA ALA C 56 -13.945 -15.774 -14.213 1.00 33.75 C ATOM 2461 C ALA C 56 -13.592 -15.264 -15.604 1.00 27.80 C ATOM 2462 O ALA C 56 -12.424 -15.239 -15.984 1.00 34.35 O ATOM 2463 CB ALA C 56 -14.429 -17.222 -14.282 1.00 35.82 C ATOM 2464 H ALA C 56 -15.908 -15.316 -13.428 1.00 0.00 H ATOM 2465 N ARG C 57 -14.606 -14.852 -16.355 1.00 34.79 N ATOM 2466 CA ARG C 57 -14.404 -14.417 -17.730 1.00 36.63 C ATOM 2467 C ARG C 57 -13.558 -13.157 -17.792 1.00 30.64 C ATOM 2468 O ARG C 57 -12.667 -13.044 -18.631 1.00 39.80 O ATOM 2469 CB ARG C 57 -15.740 -14.169 -18.425 1.00 39.30 C ATOM 2470 CG ARG C 57 -15.612 -13.978 -19.926 1.00 45.01 C ATOM 2471 CD ARG C 57 -16.868 -13.356 -20.511 1.00 53.39 C ATOM 2472 NE ARG C 57 -16.726 -11.915 -20.703 1.00 51.55 N ATOM 2473 CZ ARG C 57 -17.749 -11.079 -20.852 1.00 57.08 C ATOM 2474 NH1 ARG C 57 -18.993 -11.539 -20.818 1.00 60.27 N ATOM 2475 NH2 ARG C 57 -17.528 -9.782 -21.026 1.00 51.57 N ATOM 2476 HE ARG C 57 -15.765 -11.518 -20.724 1.00 0.00 H ATOM 2477 HH12 ARG C 57 -19.793 -10.885 -20.935 1.00 0.00 H ATOM 2478 HH11 ARG C 57 -19.168 -12.554 -20.675 1.00 0.00 H ATOM 2479 HH22 ARG C 57 -18.329 -9.129 -21.142 1.00 0.00 H ATOM 2480 HH21 ARG C 57 -16.554 -9.419 -21.046 1.00 0.00 H ATOM 2481 H ARG C 57 -15.565 -14.840 -15.953 1.00 0.00 H ATOM 2482 N GLY C 58 -13.847 -12.210 -16.907 1.00 36.21 N ATOM 2483 CA GLY C 58 -13.092 -10.973 -16.847 1.00 31.87 C ATOM 2484 C GLY C 58 -11.620 -11.250 -16.630 1.00 32.10 C ATOM 2485 O GLY C 58 -10.773 -10.779 -17.389 1.00 29.24 O ATOM 2486 H GLY C 58 -14.633 -12.359 -16.242 1.00 0.00 H ATOM 2487 N ASN C 59 -11.326 -12.028 -15.592 1.00 26.68 N ATOM 2488 CA ASN C 59 -9.955 -12.412 -15.271 1.00 29.53 C ATOM 2489 C ASN C 59 -9.311 -13.212 -16.395 1.00 30.36 C ATOM 2490 O ASN C 59 -8.141 -13.017 -16.717 1.00 32.24 O ATOM 2491 CB ASN C 59 -9.915 -13.217 -13.973 1.00 24.89 C ATOM 2492 CG ASN C 59 -10.017 -12.342 -12.737 1.00 26.75 C ATOM 2493 OD1 ASN C 59 -9.004 -11.956 -12.151 1.00 32.59 O ATOM 2494 ND2 ASN C 59 -11.243 -12.026 -12.331 1.00 25.22 N ATOM 2495 HD22 ASN C 59 -12.071 -12.374 -12.856 1.00 0.00 H ATOM 2496 HD21 ASN C 59 -11.374 -11.431 -11.488 1.00 0.00 H ATOM 2497 H ASN C 59 -12.099 -12.374 -14.989 1.00 0.00 H ATOM 2498 N TYR C 60 -10.083 -14.117 -16.986 1.00 37.29 N ATOM 2499 CA TYR C 60 -9.597 -14.930 -18.094 1.00 33.14 C ATOM 2500 C TYR C 60 -9.263 -14.052 -19.291 1.00 27.50 C ATOM 2501 O TYR C 60 -8.182 -14.169 -19.867 1.00 28.32 O ATOM 2502 CB TYR C 60 -10.640 -15.978 -18.467 1.00 35.33 C ATOM 2503 CG TYR C 60 -10.297 -16.836 -19.660 1.00 41.03 C ATOM 2504 CD1 TYR C 60 -9.469 -17.943 -19.530 1.00 45.13 C ATOM 2505 CD2 TYR C 60 -10.825 -16.557 -20.913 1.00 48.84 C ATOM 2506 CE1 TYR C 60 -9.166 -18.740 -20.622 1.00 40.32 C ATOM 2507 CE2 TYR C 60 -10.528 -17.347 -22.007 1.00 43.54 C ATOM 2508 CZ TYR C 60 -9.698 -18.438 -21.856 1.00 46.44 C ATOM 2509 OH TYR C 60 -9.398 -19.225 -22.943 1.00 63.67 O ATOM 2510 HH TYR C 60 -8.795 -19.958 -22.662 1.00 0.00 H ATOM 2511 H TYR C 60 -11.058 -14.249 -16.650 1.00 0.00 H ATOM 2512 N ASP C 61 -10.189 -13.166 -19.651 1.00 28.95 N ATOM 2513 CA ASP C 61 -9.958 -12.197 -20.721 1.00 36.85 C ATOM 2514 C ASP C 61 -8.750 -11.329 -20.397 1.00 36.37 C ATOM 2515 O ASP C 61 -7.860 -11.152 -21.226 1.00 31.65 O ATOM 2516 CB ASP C 61 -11.187 -11.302 -20.920 1.00 40.66 C ATOM 2517 CG ASP C 61 -12.381 -12.059 -21.474 1.00 47.68 C ATOM 2518 OD1 ASP C 61 -12.170 -12.967 -22.304 1.00 45.89 O ATOM 2519 OD2 ASP C 61 -13.525 -11.748 -21.079 1.00 46.90 O ATOM 2520 H ASP C 61 -11.104 -13.163 -19.156 1.00 0.00 H ATOM 2521 N ALA C 62 -8.726 -10.800 -19.179 1.00 28.97 N ATOM 2522 CA ALA C 62 -7.665 -9.896 -18.764 1.00 27.03 C ATOM 2523 C ALA C 62 -6.299 -10.573 -18.781 1.00 28.46 C ATOM 2524 O ALA C 62 -5.311 -9.975 -19.207 1.00 27.85 O ATOM 2525 CB ALA C 62 -7.964 -9.323 -17.390 1.00 22.55 C ATOM 2526 H ALA C 62 -9.483 -11.038 -18.507 1.00 0.00 H ATOM 2527 N ALA C 63 -6.246 -11.817 -18.313 1.00 29.05 N ATOM 2528 CA ALA C 63 -4.995 -12.567 -18.280 1.00 25.89 C ATOM 2529 C ALA C 63 -4.494 -12.869 -19.691 1.00 29.92 C ATOM 2530 O ALA C 63 -3.291 -12.971 -19.920 1.00 27.17 O ATOM 2531 CB ALA C 63 -5.160 -13.852 -17.484 1.00 26.18 C ATOM 2532 H ALA C 63 -7.116 -12.265 -17.963 1.00 0.00 H ATOM 2533 N ARG C 64 -5.403 -12.911 -20.639 1.00 34.92 N ATOM 2534 CA ARG C 64 -5.059 -13.250 -21.997 1.00 37.74 C ATOM 2535 C ARG C 64 -4.307 -12.110 -22.627 1.00 40.71 C ATOM 2536 O ARG C 64 -3.603 -12.307 -23.560 1.00 43.97 O ATOM 2537 CB ARG C 64 -6.283 -13.641 -22.830 1.00 34.19 C ATOM 2538 CG ARG C 64 -6.640 -15.123 -22.789 1.00 36.36 C ATOM 2539 CD ARG C 64 -7.045 -15.701 -24.140 1.00 52.93 C ATOM 2540 NE ARG C 64 -5.914 -16.015 -25.007 1.00 54.78 N ATOM 2541 CZ ARG C 64 -5.417 -17.231 -25.209 1.00 64.24 C ATOM 2542 NH1 ARG C 64 -5.965 -18.247 -24.585 1.00 53.58 N ATOM 2543 NH2 ARG C 64 -4.349 -17.427 -26.028 1.00 66.35 N ATOM 2544 HE ARG C 64 -5.460 -15.224 -25.507 1.00 0.00 H ATOM 2545 HH12 ARG C 64 -5.592 -19.207 -24.728 1.00 0.00 H ATOM 2546 HH11 ARG C 64 -6.772 -18.092 -23.947 1.00 0.00 H ATOM 2547 HH22 ARG C 64 -3.974 -18.386 -26.173 1.00 0.00 H ATOM 2548 HH21 ARG C 64 -3.907 -16.618 -26.509 1.00 0.00 H ATOM 2549 H ARG C 64 -6.393 -12.695 -20.404 1.00 0.00 H ATOM 2550 N ARG C 65 -4.447 -10.920 -22.081 1.00 36.76 N ATOM 2551 CA ARG C 65 -3.714 -9.796 -22.586 1.00 34.63 C ATOM 2552 C ARG C 65 -2.257 -9.802 -22.280 1.00 38.29 C ATOM 2553 O ARG C 65 -1.521 -9.137 -22.912 1.00 35.25 O ATOM 2554 CB ARG C 65 -4.322 -8.523 -22.099 1.00 35.08 C ATOM 2555 CG ARG C 65 -5.807 -8.519 -22.252 1.00 38.98 C ATOM 2556 CD ARG C 65 -6.211 -8.262 -23.677 1.00 34.55 C ATOM 2557 NE ARG C 65 -7.558 -7.747 -23.697 1.00 40.95 N ATOM 2558 CZ ARG C 65 -8.126 -7.199 -24.749 1.00 44.15 C ATOM 2559 NH1 ARG C 65 -7.480 -7.085 -25.876 1.00 40.38 N ATOM 2560 NH2 ARG C 65 -9.351 -6.771 -24.658 1.00 52.06 N ATOM 2561 HE ARG C 65 -8.117 -7.813 -22.822 1.00 0.00 H ATOM 2562 HH12 ARG C 65 -7.943 -6.649 -26.699 1.00 0.00 H ATOM 2563 HH11 ARG C 65 -6.502 -7.430 -25.952 1.00 0.00 H ATOM 2564 HH22 ARG C 65 -9.812 -6.336 -25.482 1.00 0.00 H ATOM 2565 HH21 ARG C 65 -9.869 -6.864 -23.761 1.00 0.00 H ATOM 2566 H ARG C 65 -5.095 -10.794 -21.277 1.00 0.00 H ATOM 2567 N GLY C 66 -1.855 -10.576 -21.295 1.00 41.81 N ATOM 2568 CA GLY C 66 -0.461 -10.646 -20.902 1.00 36.15 C ATOM 2569 C GLY C 66 -0.275 -10.303 -19.436 1.00 33.91 C ATOM 2570 O GLY C 66 -1.251 -10.046 -18.734 1.00 34.32 O ATOM 2571 H GLY C 66 -2.555 -11.152 -20.785 1.00 0.00 H ATOM 2572 N PRO C 67 0.983 -10.298 -18.969 1.00 38.95 N ATOM 2573 CA PRO C 67 1.369 -10.064 -17.570 1.00 33.64 C ATOM 2574 C PRO C 67 0.727 -8.830 -16.943 1.00 32.67 C ATOM 2575 O PRO C 67 0.265 -8.888 -15.803 1.00 29.78 O ATOM 2576 CB PRO C 67 2.883 -9.880 -17.663 1.00 27.07 C ATOM 2577 CG PRO C 67 3.273 -10.736 -18.813 1.00 31.49 C ATOM 2578 CD PRO C 67 2.152 -10.600 -19.814 1.00 32.60 C ATOM 2579 N GLY C 68 0.705 -7.723 -17.674 1.00 28.58 N ATOM 2580 CA GLY C 68 0.085 -6.514 -17.170 1.00 26.46 C ATOM 2581 C GLY C 68 -1.410 -6.702 -17.009 1.00 25.36 C ATOM 2582 O GLY C 68 -2.029 -6.118 -16.121 1.00 25.56 O ATOM 2583 H GLY C 68 1.138 -7.723 -18.620 1.00 0.00 H ATOM 2584 N GLY C 69 -1.991 -7.524 -17.877 1.00 20.92 N ATOM 2585 CA GLY C 69 -3.411 -7.813 -17.819 1.00 27.78 C ATOM 2586 C GLY C 69 -3.758 -8.727 -16.657 1.00 24.79 C ATOM 2587 O GLY C 69 -4.759 -8.516 -15.970 1.00 26.56 O ATOM 2588 H GLY C 69 -1.413 -7.971 -18.617 1.00 0.00 H ATOM 2589 N ALA C 70 -2.933 -9.748 -16.441 1.00 23.59 N ATOM 2590 CA ALA C 70 -3.106 -10.648 -15.306 1.00 28.36 C ATOM 2591 C ALA C 70 -2.942 -9.868 -14.013 1.00 21.63 C ATOM 2592 O ALA C 70 -3.725 -10.025 -13.078 1.00 23.21 O ATOM 2593 CB ALA C 70 -2.095 -11.790 -15.369 1.00 19.43 C ATOM 2594 H ALA C 70 -2.144 -9.909 -17.099 1.00 0.00 H ATOM 2595 N TRP C 71 -1.922 -9.017 -13.975 1.00 25.67 N ATOM 2596 CA TRP C 71 -1.662 -8.176 -12.816 1.00 20.59 C ATOM 2597 C TRP C 71 -2.847 -7.266 -12.529 1.00 23.46 C ATOM 2598 O TRP C 71 -3.298 -7.181 -11.392 1.00 23.97 O ATOM 2599 CB TRP C 71 -0.392 -7.350 -13.015 1.00 20.73 C ATOM 2600 CG TRP C 71 -0.215 -6.285 -11.985 1.00 21.95 C ATOM 2601 CD1 TRP C 71 0.240 -6.445 -10.707 1.00 25.66 C ATOM 2602 CD2 TRP C 71 -0.493 -4.892 -12.141 1.00 22.05 C ATOM 2603 NE1 TRP C 71 0.259 -5.234 -10.056 1.00 19.09 N ATOM 2604 CE2 TRP C 71 -0.185 -4.265 -10.917 1.00 17.90 C ATOM 2605 CE3 TRP C 71 -0.971 -4.113 -13.197 1.00 23.79 C ATOM 2606 CZ2 TRP C 71 -0.338 -2.897 -10.723 1.00 20.51 C ATOM 2607 CZ3 TRP C 71 -1.126 -2.754 -13.000 1.00 31.02 C ATOM 2608 CH2 TRP C 71 -0.810 -2.160 -11.772 1.00 27.51 C ATOM 2609 HE1 TRP C 71 0.560 -5.079 -9.073 1.00 0.00 H ATOM 2610 H TRP C 71 -1.290 -8.950 -14.798 1.00 0.00 H ATOM 2611 N ALA C 72 -3.365 -6.617 -13.568 1.00 22.71 N ATOM 2612 CA ALA C 72 -4.497 -5.703 -13.425 1.00 20.61 C ATOM 2613 C ALA C 72 -5.762 -6.406 -12.949 1.00 20.00 C ATOM 2614 O ALA C 72 -6.487 -5.884 -12.094 1.00 22.49 O ATOM 2615 CB ALA C 72 -4.766 -4.982 -14.737 1.00 27.33 C ATOM 2616 H ALA C 72 -2.952 -6.764 -14.511 1.00 0.00 H ATOM 2617 N ALA C 73 -6.025 -7.586 -13.507 1.00 22.35 N ATOM 2618 CA ALA C 73 -7.189 -8.372 -13.120 1.00 17.43 C ATOM 2619 C ALA C 73 -7.141 -8.691 -11.630 1.00 23.88 C ATOM 2620 O ALA C 73 -8.172 -8.756 -10.959 1.00 27.08 O ATOM 2621 CB ALA C 73 -7.248 -9.655 -13.932 1.00 22.96 C ATOM 2622 H ALA C 73 -5.383 -7.956 -14.237 1.00 0.00 H ATOM 2623 N LYS C 74 -5.934 -8.878 -11.114 1.00 19.92 N ATOM 2624 CA LYS C 74 -5.761 -9.197 -9.707 1.00 23.17 C ATOM 2625 C LYS C 74 -5.969 -7.982 -8.802 1.00 19.49 C ATOM 2626 O LYS C 74 -6.611 -8.094 -7.758 1.00 17.74 O ATOM 2627 CB LYS C 74 -4.397 -9.839 -9.456 1.00 24.43 C ATOM 2628 CG LYS C 74 -4.155 -10.184 -8.001 1.00 22.46 C ATOM 2629 CD LYS C 74 -2.911 -11.034 -7.816 1.00 21.12 C ATOM 2630 CE LYS C 74 -2.526 -11.092 -6.346 1.00 25.11 C ATOM 2631 NZ LYS C 74 -3.703 -11.405 -5.483 1.00 31.66 N ATOM 2632 HZ1 LYS C 74 -4.427 -10.668 -5.605 1.00 0.00 H ATOM 2633 HZ2 LYS C 74 -4.097 -12.328 -5.757 1.00 0.00 H ATOM 2634 HZ3 LYS C 74 -3.403 -11.436 -4.488 1.00 0.00 H ATOM 2635 H LYS C 74 -5.097 -8.795 -11.726 1.00 0.00 H ATOM 2636 N VAL C 75 -5.443 -6.821 -9.186 1.00 17.51 N ATOM 2637 CA VAL C 75 -5.641 -5.643 -8.343 1.00 20.21 C ATOM 2638 C VAL C 75 -7.115 -5.239 -8.318 1.00 20.79 C ATOM 2639 O VAL C 75 -7.624 -4.830 -7.282 1.00 20.39 O ATOM 2640 CB VAL C 75 -4.722 -4.430 -8.701 1.00 23.42 C ATOM 2641 CG1 VAL C 75 -3.520 -4.861 -9.513 1.00 27.13 C ATOM 2642 CG2 VAL C 75 -5.493 -3.336 -9.416 1.00 29.22 C ATOM 2643 H VAL C 75 -4.900 -6.753 -10.071 1.00 0.00 H ATOM 2644 N ILE C 76 -7.799 -5.382 -9.448 1.00 26.27 N ATOM 2645 CA ILE C 76 -9.211 -5.034 -9.523 1.00 23.27 C ATOM 2646 C ILE C 76 -10.032 -6.018 -8.698 1.00 21.22 C ATOM 2647 O ILE C 76 -10.905 -5.620 -7.923 1.00 25.56 O ATOM 2648 CB ILE C 76 -9.713 -5.003 -10.977 1.00 26.95 C ATOM 2649 CG1 ILE C 76 -9.119 -3.798 -11.707 1.00 25.30 C ATOM 2650 CG2 ILE C 76 -11.237 -4.953 -11.019 1.00 27.97 C ATOM 2651 CD1 ILE C 76 -9.281 -3.846 -13.212 1.00 22.94 C ATOM 2652 H ILE C 76 -7.318 -5.749 -10.294 1.00 0.00 H ATOM 2653 N SER C 77 -9.730 -7.303 -8.853 1.00 20.16 N ATOM 2654 CA SER C 77 -10.415 -8.346 -8.097 1.00 22.08 C ATOM 2655 C SER C 77 -10.260 -8.133 -6.592 1.00 28.47 C ATOM 2656 O SER C 77 -11.244 -8.150 -5.854 1.00 26.93 O ATOM 2657 CB SER C 77 -9.887 -9.733 -8.479 1.00 27.35 C ATOM 2658 OG SER C 77 -10.145 -10.031 -9.844 1.00 23.57 O ATOM 2659 HG SER C 77 -9.701 -9.357 -10.417 1.00 0.00 H ATOM 2660 H SER C 77 -8.987 -7.572 -9.530 1.00 0.00 H ATOM 2661 N ASP C 78 -9.020 -7.933 -6.149 1.00 27.22 N ATOM 2662 CA ASP C 78 -8.726 -7.732 -4.731 1.00 28.97 C ATOM 2663 C ASP C 78 -9.347 -6.443 -4.193 1.00 27.61 C ATOM 2664 O ASP C 78 -9.771 -6.380 -3.038 1.00 27.87 O ATOM 2665 CB ASP C 78 -7.214 -7.721 -4.487 1.00 21.73 C ATOM 2666 CG ASP C 78 -6.559 -9.044 -4.834 1.00 32.13 C ATOM 2667 OD1 ASP C 78 -7.288 -10.039 -5.031 1.00 34.18 O ATOM 2668 OD2 ASP C 78 -5.313 -9.092 -4.907 1.00 33.92 O ATOM 2669 H ASP C 78 -8.237 -7.919 -6.833 1.00 0.00 H ATOM 2670 N ALA C 79 -9.393 -5.428 -5.018 1.00 25.17 N ATOM 2671 CA ALA C 79 -9.991 -4.179 -4.629 1.00 31.24 C ATOM 2672 C ALA C 79 -11.479 -4.345 -4.458 1.00 31.01 C ATOM 2673 O ALA C 79 -12.030 -3.969 -3.460 1.00 29.54 O ATOM 2674 CB ALA C 79 -9.672 -3.092 -5.621 1.00 23.89 C ATOM 2675 H ALA C 79 -8.990 -5.526 -5.972 1.00 0.00 H ATOM 2676 N ARG C 80 -12.101 -4.941 -5.446 1.00 26.63 N ATOM 2677 CA ARG C 80 -13.484 -5.280 -5.348 1.00 30.72 C ATOM 2678 C ARG C 80 -13.777 -5.994 -4.040 1.00 33.67 C ATOM 2679 O ARG C 80 -14.655 -5.609 -3.332 1.00 32.13 O ATOM 2680 CB ARG C 80 -13.912 -6.107 -6.533 1.00 28.90 C ATOM 2681 CG ARG C 80 -15.280 -6.696 -6.413 1.00 36.40 C ATOM 2682 CD ARG C 80 -15.684 -7.341 -7.707 1.00 43.71 C ATOM 2683 NE ARG C 80 -17.051 -7.740 -7.601 1.00 44.67 N ATOM 2684 CZ ARG C 80 -17.452 -8.820 -6.973 1.00 50.13 C ATOM 2685 NH1 ARG C 80 -16.576 -9.641 -6.438 1.00 43.03 N ATOM 2686 NH2 ARG C 80 -18.735 -9.075 -6.892 1.00 48.01 N ATOM 2687 HE ARG C 80 -17.772 -7.139 -8.048 1.00 0.00 H ATOM 2688 HH12 ARG C 80 -16.900 -10.495 -5.941 1.00 0.00 H ATOM 2689 HH11 ARG C 80 -15.559 -9.436 -6.511 1.00 0.00 H ATOM 2690 HH22 ARG C 80 -19.065 -9.928 -6.397 1.00 0.00 H ATOM 2691 HH21 ARG C 80 -19.423 -8.425 -7.323 1.00 0.00 H ATOM 2692 H ARG C 80 -11.578 -5.171 -6.315 1.00 0.00 H ATOM 2693 N GLU C 81 -13.016 -7.013 -3.724 1.00 24.19 N ATOM 2694 CA GLU C 81 -13.209 -7.745 -2.510 1.00 30.94 C ATOM 2695 C GLU C 81 -13.072 -6.863 -1.283 1.00 36.63 C ATOM 2696 O GLU C 81 -13.775 -7.031 -0.335 1.00 33.03 O ATOM 2697 CB GLU C 81 -12.223 -8.896 -2.408 1.00 28.80 C ATOM 2698 CG GLU C 81 -12.163 -9.551 -1.059 1.00 34.16 C ATOM 2699 CD GLU C 81 -11.245 -10.739 -0.975 1.00 46.19 C ATOM 2700 OE1 GLU C 81 -10.177 -10.736 -1.568 1.00 47.21 O ATOM 2701 OE2 GLU C 81 -11.581 -11.677 -0.267 1.00 59.16 O ATOM 2702 H GLU C 81 -12.253 -7.297 -4.372 1.00 0.00 H ATOM 2703 N ALA C 82 -12.117 -5.959 -1.315 1.00 31.79 N ATOM 2704 CA ALA C 82 -11.863 -5.034 -0.218 1.00 35.70 C ATOM 2705 C ALA C 82 -13.062 -4.133 0.070 1.00 35.98 C ATOM 2706 O ALA C 82 -13.396 -3.884 1.228 1.00 38.23 O ATOM 2707 CB ALA C 82 -10.624 -4.199 -0.507 1.00 33.90 C ATOM 2708 H ALA C 82 -11.516 -5.902 -2.162 1.00 0.00 H ATOM 2709 N VAL C 83 -13.708 -3.646 -0.982 1.00 39.44 N ATOM 2710 CA VAL C 83 -14.888 -2.806 -0.816 1.00 36.70 C ATOM 2711 C VAL C 83 -16.056 -3.636 -0.288 1.00 40.58 C ATOM 2712 O VAL C 83 -16.892 -3.141 0.468 1.00 53.88 O ATOM 2713 CB VAL C 83 -15.276 -2.109 -2.139 1.00 45.63 C ATOM 2714 CG1 VAL C 83 -16.502 -1.215 -1.946 1.00 35.72 C ATOM 2715 CG2 VAL C 83 -14.095 -1.305 -2.671 1.00 33.67 C ATOM 2716 H VAL C 83 -13.367 -3.867 -1.939 1.00 0.00 H ATOM 2717 N GLN C 84 -16.100 -4.908 -0.676 1.00 39.61 N ATOM 2718 CA GLN C 84 -17.117 -5.825 -0.167 1.00 42.23 C ATOM 2719 C GLN C 84 -17.020 -5.982 1.345 1.00 51.70 C ATOM 2720 O GLN C 84 -18.018 -6.248 2.014 1.00 50.39 O ATOM 2721 CB GLN C 84 -16.990 -7.200 -0.822 1.00 36.28 C ATOM 2722 CG GLN C 84 -17.494 -7.268 -2.245 1.00 38.11 C ATOM 2723 CD GLN C 84 -17.162 -8.588 -2.906 1.00 40.28 C ATOM 2724 OE1 GLN C 84 -16.267 -9.310 -2.462 1.00 44.68 O ATOM 2725 NE2 GLN C 84 -17.881 -8.911 -3.974 1.00 39.32 N ATOM 2726 HE22 GLN C 84 -18.627 -8.270 -4.312 1.00 0.00 H ATOM 2727 HE21 GLN C 84 -17.699 -9.805 -4.472 1.00 0.00 H ATOM 2728 H GLN C 84 -15.395 -5.257 -1.356 1.00 0.00 H ATOM 2729 N LYS C 85 -15.824 -5.805 1.861 1.00 48.71 N ATOM 2730 CA LYS C 85 -15.576 -6.000 3.256 1.00 46.81 C ATOM 2731 C LYS C 85 -16.180 -4.910 4.145 1.00 57.69 C ATOM 2732 O LYS C 85 -15.869 -4.834 5.301 1.00 55.41 O ATOM 2733 CB LYS C 85 -14.090 -6.193 3.514 1.00 47.04 C ATOM 2734 CG LYS C 85 -13.503 -7.490 2.959 1.00 44.03 C ATOM 2735 CD LYS C 85 -12.071 -7.741 3.430 1.00 41.99 C ATOM 2736 CE LYS C 85 -11.109 -8.122 2.306 1.00 40.90 C ATOM 2737 NZ LYS C 85 -9.954 -8.912 2.822 1.00 43.21 N ATOM 2738 HZ1 LYS C 85 -9.435 -8.347 3.524 1.00 0.00 H ATOM 2739 HZ2 LYS C 85 -10.304 -9.784 3.268 1.00 0.00 H ATOM 2740 HZ3 LYS C 85 -9.321 -9.154 2.033 1.00 0.00 H ATOM 2741 H LYS C 85 -15.040 -5.517 1.241 1.00 0.00 H ATOM 2742 N PHE C 86 -17.094 -4.111 3.608 1.00 74.21 N ATOM 2743 CA PHE C 86 -17.971 -3.222 4.411 1.00 65.33 C ATOM 2744 C PHE C 86 -19.441 -3.573 4.180 1.00 61.25 C ATOM 2745 O PHE C 86 -20.330 -3.135 4.881 1.00 66.39 O ATOM 2746 CB PHE C 86 -17.811 -1.779 4.023 1.00 50.77 C ATOM 2747 CG PHE C 86 -16.435 -1.255 4.166 1.00 64.66 C ATOM 2748 CD1 PHE C 86 -15.348 -2.093 4.163 1.00 55.36 C ATOM 2749 CD2 PHE C 86 -16.225 0.117 4.251 1.00 66.91 C ATOM 2750 CE1 PHE C 86 -14.099 -1.575 4.282 1.00 65.50 C ATOM 2751 CE2 PHE C 86 -14.970 0.635 4.370 1.00 58.95 C ATOM 2752 CZ PHE C 86 -13.906 -0.215 4.386 1.00 64.10 C ATOM 2753 H PHE C 86 -17.201 -4.108 2.574 1.00 0.00 H ATOM 2754 N THR C 87 -19.698 -4.426 3.205 1.00 58.35 N ATOM 2755 CA THR C 87 -21.033 -4.922 2.949 1.00 52.14 C ATOM 2756 C THR C 87 -21.153 -6.347 3.363 1.00 39.21 C ATOM 2757 O THR C 87 -21.775 -7.094 2.654 1.00 48.20 O ATOM 2758 CB THR C 87 -21.542 -4.674 1.483 1.00 58.16 C ATOM 2759 OG1 THR C 87 -21.939 -5.882 0.830 1.00 43.72 O ATOM 2760 CG2 THR C 87 -20.528 -3.930 0.659 1.00 59.33 C ATOM 2761 HG1 THR C 87 -22.250 -5.673 -0.086 1.00 0.00 H ATOM 2762 H THR C 87 -18.916 -4.752 2.602 1.00 0.00 H TER 2763 THR C 87 ATOM 2764 N ASP C 93 -20.769 -14.610 -1.755 1.00 67.72 N ATOM 2765 CA ASP C 93 -19.791 -14.027 -0.853 1.00 53.06 C ATOM 2766 C ASP C 93 -18.380 -13.933 -1.462 1.00 57.02 C ATOM 2767 O ASP C 93 -18.107 -14.437 -2.542 1.00 52.97 O ATOM 2768 CB ASP C 93 -19.799 -14.736 0.496 1.00 55.79 C ATOM 2769 CG ASP C 93 -20.374 -13.875 1.587 1.00 68.28 C ATOM 2770 OD1 ASP C 93 -19.721 -13.677 2.618 1.00 66.51 O ATOM 2771 OD2 ASP C 93 -21.483 -13.367 1.410 1.00 75.09 O ATOM 2772 HN3 ASP C 93 -20.473 -15.574 -2.010 1.00 0.00 H ATOM 2773 HN2 ASP C 93 -20.836 -14.028 -2.614 1.00 0.00 H ATOM 2774 HN1 ASP C 93 -21.696 -14.644 -1.284 1.00 0.00 H ATOM 2775 N SER C 94 -17.506 -13.243 -0.751 1.00 57.49 N ATOM 2776 CA SER C 94 -16.252 -12.735 -1.287 1.00 52.67 C ATOM 2777 C SER C 94 -15.290 -13.807 -1.745 1.00 53.65 C ATOM 2778 O SER C 94 -14.727 -13.694 -2.802 1.00 51.86 O ATOM 2779 CB SER C 94 -15.568 -11.810 -0.278 1.00 51.96 C ATOM 2780 OG SER C 94 -14.861 -12.553 0.704 1.00 72.64 O ATOM 2781 HG SER C 94 -14.430 -11.930 1.341 1.00 0.00 H ATOM 2782 H SER C 94 -17.726 -13.052 0.247 1.00 0.00 H ATOM 2783 N ARG C 95 -15.108 -14.846 -0.953 1.00 45.83 N ATOM 2784 CA ARG C 95 -14.178 -15.877 -1.305 1.00 47.00 C ATOM 2785 C ARG C 95 -14.630 -16.654 -2.552 1.00 48.14 C ATOM 2786 O ARG C 95 -13.847 -17.051 -3.380 1.00 48.30 O ATOM 2787 CB ARG C 95 -13.986 -16.809 -0.114 1.00 48.86 C ATOM 2788 CG ARG C 95 -12.563 -16.941 0.388 1.00 57.90 C ATOM 2789 CD ARG C 95 -12.506 -17.579 1.767 1.00 60.27 C ATOM 2790 NE ARG C 95 -11.818 -18.857 1.747 1.00 66.52 N ATOM 2791 CZ ARG C 95 -10.891 -19.231 2.619 1.00 74.02 C ATOM 2792 NH1 ARG C 95 -10.561 -18.429 3.607 1.00 71.17 N ATOM 2793 NH2 ARG C 95 -10.301 -20.412 2.502 1.00 66.08 N ATOM 2794 HE ARG C 95 -12.070 -19.528 0.994 1.00 0.00 H ATOM 2795 HH12 ARG C 95 -9.835 -18.720 4.292 1.00 0.00 H ATOM 2796 HH11 ARG C 95 -11.026 -17.504 3.703 1.00 0.00 H ATOM 2797 HH22 ARG C 95 -9.575 -20.701 3.188 1.00 0.00 H ATOM 2798 HH21 ARG C 95 -10.564 -21.050 1.724 1.00 0.00 H ATOM 2799 H ARG C 95 -15.645 -14.917 -0.065 1.00 0.00 H ATOM 2800 N ALA C 96 -15.908 -16.880 -2.683 1.00 44.46 N ATOM 2801 CA ALA C 96 -16.386 -17.635 -3.836 1.00 48.21 C ATOM 2802 C ALA C 96 -16.148 -16.870 -5.132 1.00 48.41 C ATOM 2803 O ALA C 96 -15.923 -17.470 -6.181 1.00 51.48 O ATOM 2804 CB ALA C 96 -17.858 -17.964 -3.680 1.00 36.60 C ATOM 2805 H ALA C 96 -16.580 -16.525 -1.972 1.00 0.00 H ATOM 2806 N ASP C 97 -16.211 -15.544 -5.053 1.00 43.14 N ATOM 2807 CA ASP C 97 -15.877 -14.699 -6.193 1.00 47.35 C ATOM 2808 C ASP C 97 -14.401 -14.857 -6.517 1.00 40.79 C ATOM 2809 O ASP C 97 -14.022 -15.005 -7.681 1.00 37.87 O ATOM 2810 CB ASP C 97 -16.174 -13.230 -5.893 1.00 50.01 C ATOM 2811 CG ASP C 97 -17.653 -12.957 -5.711 1.00 55.98 C ATOM 2812 OD1 ASP C 97 -18.472 -13.799 -6.136 1.00 56.28 O ATOM 2813 OD2 ASP C 97 -17.994 -11.892 -5.153 1.00 54.84 O ATOM 2814 H ASP C 97 -16.505 -15.101 -4.159 1.00 0.00 H ATOM 2815 N GLN C 98 -13.576 -14.831 -5.475 1.00 41.60 N ATOM 2816 CA GLN C 98 -12.130 -14.914 -5.641 1.00 38.79 C ATOM 2817 C GLN C 98 -11.694 -16.236 -6.257 1.00 38.31 C ATOM 2818 O GLN C 98 -10.734 -16.277 -7.029 1.00 37.36 O ATOM 2819 CB GLN C 98 -11.410 -14.667 -4.312 1.00 30.68 C ATOM 2820 CG GLN C 98 -11.399 -13.206 -3.871 1.00 32.45 C ATOM 2821 CD GLN C 98 -10.450 -12.334 -4.689 1.00 34.84 C ATOM 2822 OE1 GLN C 98 -10.387 -12.430 -5.916 1.00 32.65 O ATOM 2823 NE2 GLN C 98 -9.704 -11.476 -4.004 1.00 32.02 N ATOM 2824 HE22 GLN C 98 -9.787 -11.426 -2.969 1.00 0.00 H ATOM 2825 HE21 GLN C 98 -9.036 -10.854 -4.503 1.00 0.00 H ATOM 2826 H GLN C 98 -13.972 -14.749 -4.517 1.00 0.00 H ATOM 2827 N PHE C 99 -12.402 -17.311 -5.929 1.00 39.93 N ATOM 2828 CA PHE C 99 -12.126 -18.599 -6.550 1.00 39.29 C ATOM 2829 C PHE C 99 -12.359 -18.507 -8.050 1.00 31.86 C ATOM 2830 O PHE C 99 -11.539 -18.956 -8.845 1.00 38.27 O ATOM 2831 CB PHE C 99 -13.002 -19.705 -5.961 1.00 43.34 C ATOM 2832 CG PHE C 99 -12.775 -21.056 -6.593 1.00 46.00 C ATOM 2833 CD1 PHE C 99 -11.764 -21.887 -6.138 1.00 44.52 C ATOM 2834 CD2 PHE C 99 -13.567 -21.492 -7.647 1.00 43.24 C ATOM 2835 CE1 PHE C 99 -11.547 -23.126 -6.717 1.00 47.79 C ATOM 2836 CE2 PHE C 99 -13.355 -22.729 -8.231 1.00 49.39 C ATOM 2837 CZ PHE C 99 -12.344 -23.548 -7.765 1.00 46.78 C ATOM 2838 H PHE C 99 -13.161 -17.232 -5.222 1.00 0.00 H ATOM 2839 N ALA C 100 -13.491 -17.923 -8.425 1.00 35.66 N ATOM 2840 CA ALA C 100 -13.838 -17.740 -9.827 1.00 35.66 C ATOM 2841 C ALA C 100 -12.862 -16.791 -10.517 1.00 39.14 C ATOM 2842 O ALA C 100 -12.508 -16.994 -11.679 1.00 40.96 O ATOM 2843 CB ALA C 100 -15.264 -17.233 -9.958 1.00 38.19 C ATOM 2844 H ALA C 100 -14.150 -17.586 -7.695 1.00 0.00 H ATOM 2845 N ASN C 101 -12.430 -15.758 -9.799 1.00 33.67 N ATOM 2846 CA ASN C 101 -11.438 -14.828 -10.331 1.00 35.31 C ATOM 2847 C ASN C 101 -10.146 -15.544 -10.708 1.00 34.30 C ATOM 2848 O ASN C 101 -9.649 -15.399 -11.823 1.00 27.25 O ATOM 2849 CB ASN C 101 -11.143 -13.708 -9.324 1.00 32.70 C ATOM 2850 CG ASN C 101 -12.269 -12.695 -9.229 1.00 34.16 C ATOM 2851 OD1 ASN C 101 -13.052 -12.531 -10.166 1.00 31.83 O ATOM 2852 ND2 ASN C 101 -12.350 -12.002 -8.101 1.00 28.29 N ATOM 2853 HD22 ASN C 101 -11.667 -12.173 -7.335 1.00 0.00 H ATOM 2854 HD21 ASN C 101 -13.096 -11.287 -7.982 1.00 0.00 H ATOM 2855 H ASN C 101 -12.806 -15.610 -8.841 1.00 0.00 H ATOM 2856 N GLU C 102 -9.614 -16.327 -9.775 1.00 31.36 N ATOM 2857 CA GLU C 102 -8.351 -17.020 -9.997 1.00 31.22 C ATOM 2858 C GLU C 102 -8.496 -18.150 -11.005 1.00 32.22 C ATOM 2859 O GLU C 102 -7.541 -18.500 -11.694 1.00 32.48 O ATOM 2860 CB GLU C 102 -7.796 -17.551 -8.679 1.00 32.90 C ATOM 2861 CG GLU C 102 -7.469 -16.458 -7.680 1.00 44.02 C ATOM 2862 CD GLU C 102 -6.932 -17.003 -6.378 1.00 49.90 C ATOM 2863 OE1 GLU C 102 -7.212 -18.180 -6.067 1.00 46.16 O ATOM 2864 OE2 GLU C 102 -6.227 -16.257 -5.666 1.00 50.08 O ATOM 2865 H GLU C 102 -10.109 -16.448 -8.868 1.00 0.00 H ATOM 2866 N TRP C 103 -9.696 -18.718 -11.081 1.00 36.53 N ATOM 2867 CA TRP C 103 -10.002 -19.744 -12.068 1.00 36.92 C ATOM 2868 C TRP C 103 -9.731 -19.210 -13.470 1.00 40.03 C ATOM 2869 O TRP C 103 -8.918 -19.762 -14.209 1.00 39.14 O ATOM 2870 CB TRP C 103 -11.465 -20.171 -11.942 1.00 36.43 C ATOM 2871 CG TRP C 103 -11.916 -21.207 -12.943 1.00 53.48 C ATOM 2872 CD1 TRP C 103 -12.228 -20.999 -14.258 1.00 49.36 C ATOM 2873 CD2 TRP C 103 -12.138 -22.601 -12.697 1.00 56.78 C ATOM 2874 NE1 TRP C 103 -12.612 -22.177 -14.848 1.00 48.05 N ATOM 2875 CE2 TRP C 103 -12.568 -23.176 -13.912 1.00 56.51 C ATOM 2876 CE3 TRP C 103 -12.008 -23.422 -11.573 1.00 56.01 C ATOM 2877 CZ2 TRP C 103 -12.870 -24.532 -14.032 1.00 51.90 C ATOM 2878 CZ3 TRP C 103 -12.306 -24.769 -11.695 1.00 55.69 C ATOM 2879 CH2 TRP C 103 -12.733 -25.310 -12.915 1.00 48.45 C ATOM 2880 HE1 TRP C 103 -12.891 -22.292 -15.843 1.00 0.00 H ATOM 2881 H TRP C 103 -10.438 -18.421 -10.416 1.00 0.00 H ATOM 2882 N GLY C 104 -10.421 -18.129 -13.821 1.00 40.75 N ATOM 2883 CA GLY C 104 -10.251 -17.497 -15.116 1.00 39.40 C ATOM 2884 C GLY C 104 -8.841 -16.984 -15.323 1.00 32.08 C ATOM 2885 O GLY C 104 -8.257 -17.173 -16.388 1.00 36.87 O ATOM 2886 H GLY C 104 -11.103 -17.725 -13.148 1.00 0.00 H ATOM 2887 N ARG C 105 -8.289 -16.353 -14.290 1.00 30.35 N ATOM 2888 CA ARG C 105 -6.972 -15.735 -14.377 1.00 35.08 C ATOM 2889 C ARG C 105 -5.885 -16.761 -14.673 1.00 33.84 C ATOM 2890 O ARG C 105 -4.886 -16.443 -15.315 1.00 31.91 O ATOM 2891 CB ARG C 105 -6.650 -14.963 -13.092 1.00 31.33 C ATOM 2892 CG ARG C 105 -5.513 -13.959 -13.240 1.00 30.92 C ATOM 2893 CD ARG C 105 -5.652 -12.800 -12.259 1.00 24.91 C ATOM 2894 NE ARG C 105 -5.350 -13.191 -10.890 1.00 31.92 N ATOM 2895 CZ ARG C 105 -6.197 -13.086 -9.873 1.00 30.72 C ATOM 2896 NH1 ARG C 105 -7.410 -12.591 -10.064 1.00 27.17 N ATOM 2897 NH2 ARG C 105 -5.824 -13.473 -8.660 1.00 38.94 N ATOM 2898 HE ARG C 105 -4.405 -13.580 -10.695 1.00 0.00 H ATOM 2899 HH12 ARG C 105 -8.071 -12.510 -9.265 1.00 0.00 H ATOM 2900 HH11 ARG C 105 -7.702 -12.283 -11.013 1.00 0.00 H ATOM 2901 HH22 ARG C 105 -6.486 -13.392 -7.862 1.00 0.00 H ATOM 2902 HH21 ARG C 105 -4.870 -13.858 -8.507 1.00 0.00 H ATOM 2903 H ARG C 105 -8.813 -16.299 -13.393 1.00 0.00 H ATOM 2904 N SER C 106 -6.090 -17.992 -14.214 1.00 28.04 N ATOM 2905 CA SER C 106 -5.131 -19.068 -14.453 1.00 34.04 C ATOM 2906 C SER C 106 -5.292 -19.655 -15.847 1.00 35.34 C ATOM 2907 O SER C 106 -4.443 -20.415 -16.308 1.00 37.68 O ATOM 2908 CB SER C 106 -5.289 -20.177 -13.411 1.00 34.82 C ATOM 2909 OG SER C 106 -6.569 -20.780 -13.508 1.00 41.59 O ATOM 2910 HG SER C 106 -7.267 -20.095 -13.355 1.00 0.00 H ATOM 2911 H SER C 106 -6.954 -18.194 -13.672 1.00 0.00 H ATOM 2912 N GLY C 107 -6.393 -19.313 -16.506 1.00 43.86 N ATOM 2913 CA GLY C 107 -6.627 -19.753 -17.867 1.00 42.83 C ATOM 2914 C GLY C 107 -7.658 -20.854 -17.984 1.00 45.85 C ATOM 2915 O GLY C 107 -8.048 -21.224 -19.091 1.00 48.21 O ATOM 2916 H GLY C 107 -7.103 -18.716 -16.035 1.00 0.00 H ATOM 2917 N LYS C 108 -8.095 -21.389 -16.849 1.00 47.33 N ATOM 2918 CA LYS C 108 -9.146 -22.400 -16.848 1.00 42.95 C ATOM 2919 C LYS C 108 -10.426 -21.792 -17.414 1.00 51.88 C ATOM 2920 O LYS C 108 -10.635 -20.585 -17.328 1.00 48.33 O ATOM 2921 CB LYS C 108 -9.370 -22.945 -15.439 1.00 40.64 C ATOM 2922 CG LYS C 108 -8.148 -23.641 -14.866 1.00 51.76 C ATOM 2923 CD LYS C 108 -8.328 -23.976 -13.396 1.00 49.50 C ATOM 2924 CE LYS C 108 -7.011 -24.420 -12.779 1.00 58.86 C ATOM 2925 NZ LYS C 108 -6.823 -23.856 -11.413 1.00 57.98 N ATOM 2926 HZ1 LYS C 108 -6.827 -22.817 -11.465 1.00 0.00 H ATOM 2927 HZ2 LYS C 108 -7.598 -24.176 -10.797 1.00 0.00 H ATOM 2928 HZ3 LYS C 108 -5.914 -24.182 -11.027 1.00 0.00 H ATOM 2929 H LYS C 108 -7.681 -21.082 -15.946 1.00 0.00 H ATOM 2930 N ASP C 109 -11.277 -22.624 -17.999 1.00 50.75 N ATOM 2931 CA ASP C 109 -12.386 -22.115 -18.797 1.00 49.74 C ATOM 2932 C ASP C 109 -13.524 -21.537 -17.961 1.00 53.28 C ATOM 2933 O ASP C 109 -14.077 -22.219 -17.100 1.00 53.80 O ATOM 2934 CB ASP C 109 -12.917 -23.196 -19.738 1.00 51.61 C ATOM 2935 CG ASP C 109 -13.713 -22.618 -20.885 1.00 65.85 C ATOM 2936 OD1 ASP C 109 -14.883 -22.246 -20.667 1.00 64.36 O ATOM 2937 OD2 ASP C 109 -13.170 -22.531 -22.005 1.00 87.65 O ATOM 2938 H ASP C 109 -11.152 -23.650 -17.887 1.00 0.00 H ATOM 2939 N PRO C 110 -13.876 -20.269 -18.224 1.00 54.97 N ATOM 2940 CA PRO C 110 -14.935 -19.535 -17.524 1.00 48.14 C ATOM 2941 C PRO C 110 -16.321 -20.149 -17.711 1.00 57.01 C ATOM 2942 O PRO C 110 -17.176 -19.974 -16.842 1.00 50.12 O ATOM 2943 CB PRO C 110 -14.884 -18.147 -18.171 1.00 41.10 C ATOM 2944 CG PRO C 110 -13.508 -18.035 -18.721 1.00 44.61 C ATOM 2945 CD PRO C 110 -13.163 -19.412 -19.186 1.00 52.01 C ATOM 2946 N ASN C 111 -16.540 -20.856 -18.818 1.00 58.68 N ATOM 2947 CA ASN C 111 -17.843 -21.468 -19.079 1.00 60.50 C ATOM 2948 C ASN C 111 -18.214 -22.532 -18.055 1.00 59.28 C ATOM 2949 O ASN C 111 -19.377 -22.921 -17.951 1.00 64.18 O ATOM 2950 CB ASN C 111 -17.915 -22.056 -20.488 1.00 50.46 C ATOM 2951 CG ASN C 111 -17.823 -21.001 -21.567 1.00 64.97 C ATOM 2952 OD1 ASN C 111 -18.800 -20.310 -21.863 1.00 50.51 O ATOM 2953 ND2 ASN C 111 -16.646 -20.873 -22.171 1.00 75.71 N ATOM 2954 HD22 ASN C 111 -15.848 -21.478 -21.889 1.00 0.00 H ATOM 2955 HD21 ASN C 111 -16.523 -20.168 -22.926 1.00 0.00 H ATOM 2956 H ASN C 111 -15.772 -20.975 -19.509 1.00 0.00 H ATOM 2957 N HIS C 112 -17.243 -23.024 -17.326 1.00 51.97 N ATOM 2958 CA HIS C 112 -17.474 -23.932 -16.241 1.00 54.04 C ATOM 2959 C HIS C 112 -18.473 -23.429 -15.218 1.00 58.59 C ATOM 2960 O HIS C 112 -19.017 -24.181 -14.439 1.00 63.26 O ATOM 2961 CB HIS C 112 -16.168 -24.146 -15.524 1.00 50.29 C ATOM 2962 CG HIS C 112 -15.668 -25.522 -15.641 1.00 61.63 C ATOM 2963 ND1 HIS C 112 -14.778 -25.900 -16.617 1.00 63.09 N ATOM 2964 CD2 HIS C 112 -15.994 -26.643 -14.964 1.00 59.60 C ATOM 2965 CE1 HIS C 112 -14.554 -27.194 -16.520 1.00 61.31 C ATOM 2966 NE2 HIS C 112 -15.281 -27.668 -15.524 1.00 72.97 N ATOM 2967 H HIS C 112 -16.265 -22.745 -17.543 1.00 0.00 H ATOM 2968 N PHE C 113 -18.642 -22.132 -15.168 1.00 54.22 N ATOM 2969 CA PHE C 113 -19.569 -21.521 -14.229 1.00 55.20 C ATOM 2970 C PHE C 113 -20.807 -20.979 -14.931 1.00 59.26 C ATOM 2971 O PHE C 113 -21.677 -20.392 -14.286 1.00 65.92 O ATOM 2972 CB PHE C 113 -18.889 -20.383 -13.472 1.00 53.13 C ATOM 2973 CG PHE C 113 -17.654 -20.797 -12.729 1.00 54.52 C ATOM 2974 CD1 PHE C 113 -16.407 -20.698 -13.322 1.00 46.39 C ATOM 2975 CD2 PHE C 113 -17.737 -21.271 -11.431 1.00 47.17 C ATOM 2976 CE1 PHE C 113 -15.267 -21.070 -12.636 1.00 47.13 C ATOM 2977 CE2 PHE C 113 -16.599 -21.643 -10.740 1.00 46.38 C ATOM 2978 CZ PHE C 113 -15.363 -21.542 -11.343 1.00 46.95 C ATOM 2979 H PHE C 113 -18.100 -21.524 -15.815 1.00 0.00 H ATOM 2980 N ARG C 114 -20.882 -21.147 -16.236 1.00 58.62 N ATOM 2981 CA ARG C 114 -22.041 -20.656 -16.956 1.00 65.90 C ATOM 2982 C ARG C 114 -23.327 -21.266 -16.434 1.00 79.59 C ATOM 2983 O ARG C 114 -23.445 -22.476 -16.267 1.00 84.66 O ATOM 2984 CB ARG C 114 -21.926 -20.932 -18.451 1.00 64.21 C ATOM 2985 CG ARG C 114 -22.915 -20.145 -19.297 1.00 66.14 C ATOM 2986 CD ARG C 114 -22.562 -20.225 -20.766 1.00 64.72 C ATOM 2987 NE ARG C 114 -23.195 -19.193 -21.572 1.00 70.73 N ATOM 2988 CZ ARG C 114 -22.664 -18.707 -22.688 1.00 75.15 C ATOM 2989 NH1 ARG C 114 -21.502 -19.169 -23.114 1.00 72.66 N ATOM 2990 NH2 ARG C 114 -23.293 -17.776 -23.385 1.00 69.75 N ATOM 2991 HE ARG C 114 -24.112 -18.816 -21.258 1.00 0.00 H ATOM 2992 HH12 ARG C 114 -21.081 -18.792 -23.987 1.00 0.00 H ATOM 2993 HH11 ARG C 114 -21.008 -19.909 -22.576 1.00 0.00 H ATOM 2994 HH22 ARG C 114 -22.867 -17.403 -24.257 1.00 0.00 H ATOM 2995 HH21 ARG C 114 -24.214 -17.417 -23.061 1.00 0.00 H ATOM 2996 H ARG C 114 -20.115 -21.629 -16.746 1.00 0.00 H ATOM 2997 N PRO C 115 -24.300 -20.411 -16.180 1.00 85.33 N ATOM 2998 CA PRO C 115 -25.624 -20.842 -15.718 1.00 90.33 C ATOM 2999 C PRO C 115 -26.432 -21.549 -16.807 1.00 91.84 C ATOM 3000 O PRO C 115 -25.911 -21.860 -17.879 1.00 89.84 O ATOM 3001 CB PRO C 115 -26.303 -19.521 -15.330 1.00 86.61 C ATOM 3002 CG PRO C 115 -25.583 -18.477 -16.118 1.00 84.71 C ATOM 3003 CD PRO C 115 -24.164 -18.944 -16.172 1.00 76.39 C ATOM 3004 N ALA C 116 -27.703 -21.804 -16.520 1.00 93.33 N ATOM 3005 CA ALA C 116 -28.584 -22.461 -17.475 1.00 84.94 C ATOM 3006 C ALA C 116 -28.955 -21.519 -18.613 1.00 83.67 C ATOM 3007 O ALA C 116 -29.661 -20.531 -18.404 1.00 79.02 O ATOM 3008 CB ALA C 116 -29.833 -22.964 -16.778 1.00 81.98 C ATOM 3009 H ALA C 116 -28.078 -21.528 -15.590 1.00 0.00 H ATOM 3010 N GLY C 117 -28.474 -21.834 -19.813 1.00 70.54 N ATOM 3011 CA GLY C 117 -28.812 -21.081 -21.005 1.00 66.42 C ATOM 3012 C GLY C 117 -28.533 -19.596 -20.898 1.00 80.91 C ATOM 3013 O GLY C 117 -29.448 -18.775 -20.953 1.00 73.02 O ATOM 3014 H GLY C 117 -27.833 -22.649 -19.899 1.00 0.00 H ATOM 3015 N LEU C 118 -27.256 -19.233 -20.774 1.00 85.37 N ATOM 3016 CA LEU C 118 -26.821 -17.839 -20.801 1.00 75.63 C ATOM 3017 C LEU C 118 -26.667 -17.355 -22.223 1.00 69.49 C ATOM 3018 O LEU C 118 -26.020 -17.964 -23.054 1.00 69.82 O ATOM 3019 CB LEU C 118 -25.490 -17.654 -20.048 1.00 80.90 C ATOM 3020 CG LEU C 118 -24.640 -16.400 -20.301 1.00 73.20 C ATOM 3021 CD1 LEU C 118 -25.371 -15.126 -19.956 1.00 72.35 C ATOM 3022 CD2 LEU C 118 -23.307 -16.431 -19.571 1.00 66.50 C ATOM 3023 H LEU C 118 -26.538 -19.975 -20.653 1.00 0.00 H ATOM 3024 N PRO C 119 -27.280 -16.238 -22.495 1.00 63.43 N ATOM 3025 CA PRO C 119 -27.208 -15.646 -23.836 1.00 65.39 C ATOM 3026 C PRO C 119 -25.812 -15.680 -24.463 1.00 64.93 C ATOM 3027 O PRO C 119 -24.795 -15.652 -23.769 1.00 69.36 O ATOM 3028 CB PRO C 119 -27.669 -14.211 -23.598 1.00 71.44 C ATOM 3029 CG PRO C 119 -28.674 -14.352 -22.505 1.00 68.80 C ATOM 3030 CD PRO C 119 -28.153 -15.452 -21.603 1.00 62.23 C ATOM 3031 N LYS C 120 -25.791 -15.722 -25.789 1.00 71.49 N ATOM 3032 CA LYS C 120 -24.607 -16.095 -26.555 1.00 72.54 C ATOM 3033 C LYS C 120 -23.449 -15.095 -26.507 1.00 71.61 C ATOM 3034 O LYS C 120 -22.288 -15.492 -26.600 1.00 66.51 O ATOM 3035 CB LYS C 120 -25.008 -16.380 -28.009 1.00 70.32 C ATOM 3036 CG LYS C 120 -24.320 -17.585 -28.628 1.00 69.15 C ATOM 3037 CD LYS C 120 -22.944 -17.217 -29.147 1.00 68.33 C ATOM 3038 CE LYS C 120 -22.025 -18.422 -29.184 1.00 67.53 C ATOM 3039 NZ LYS C 120 -20.601 -18.001 -29.307 1.00 66.12 N ATOM 3040 HZ1 LYS C 120 -20.476 -17.457 -30.185 1.00 0.00 H ATOM 3041 HZ2 LYS C 120 -20.344 -17.409 -28.492 1.00 0.00 H ATOM 3042 HZ3 LYS C 120 -19.992 -18.844 -29.330 1.00 0.00 H ATOM 3043 H LYS C 120 -26.659 -15.478 -26.306 1.00 0.00 H ATOM 3044 N ARG C 121 -23.751 -13.809 -26.365 1.00 70.69 N ATOM 3045 CA ARG C 121 -22.705 -12.788 -26.443 1.00 79.11 C ATOM 3046 C ARG C 121 -21.810 -12.758 -25.206 1.00 80.07 C ATOM 3047 O ARG C 121 -20.710 -12.209 -25.242 1.00 83.31 O ATOM 3048 CB ARG C 121 -23.303 -11.400 -26.690 1.00 77.77 C ATOM 3049 CG ARG C 121 -23.687 -10.650 -25.428 1.00 77.95 C ATOM 3050 CD ARG C 121 -24.367 -9.336 -25.773 1.00 79.13 C ATOM 3051 NE ARG C 121 -25.055 -8.751 -24.628 1.00 79.07 N ATOM 3052 CZ ARG C 121 -26.219 -9.186 -24.158 1.00 78.62 C ATOM 3053 NH1 ARG C 121 -26.822 -10.222 -24.727 1.00 78.57 N ATOM 3054 NH2 ARG C 121 -26.777 -8.591 -23.112 1.00 77.29 N ATOM 3055 HE ARG C 121 -24.607 -7.943 -24.150 1.00 0.00 H ATOM 3056 HH12 ARG C 121 -27.733 -10.561 -24.357 1.00 0.00 H ATOM 3057 HH11 ARG C 121 -26.383 -10.695 -25.543 1.00 0.00 H ATOM 3058 HH22 ARG C 121 -27.688 -8.932 -22.745 1.00 0.00 H ATOM 3059 HH21 ARG C 121 -26.303 -7.783 -22.659 1.00 0.00 H ATOM 3060 H ARG C 121 -24.738 -13.526 -26.197 1.00 0.00 H ATOM 3061 N TYR C 122 -22.284 -13.350 -24.117 1.00 74.85 N ATOM 3062 CA TYR C 122 -21.519 -13.373 -22.878 1.00 71.95 C ATOM 3063 C TYR C 122 -20.405 -14.409 -22.944 1.00 72.98 C ATOM 3064 O TYR C 122 -20.639 -15.563 -23.303 1.00 81.12 O ATOM 3065 CB TYR C 122 -22.437 -13.665 -21.693 1.00 67.69 C ATOM 3066 CG TYR C 122 -23.560 -12.667 -21.540 1.00 71.90 C ATOM 3067 CD1 TYR C 122 -23.360 -11.321 -21.814 1.00 73.08 C ATOM 3068 CD2 TYR C 122 -24.821 -13.073 -21.133 1.00 72.91 C ATOM 3069 CE1 TYR C 122 -24.384 -10.405 -21.677 1.00 75.62 C ATOM 3070 CE2 TYR C 122 -25.853 -12.166 -20.993 1.00 78.99 C ATOM 3071 CZ TYR C 122 -25.629 -10.834 -21.267 1.00 78.57 C ATOM 3072 OH TYR C 122 -26.651 -9.925 -21.131 1.00 72.77 O ATOM 3073 OXT TYR C 122 -19.254 -14.091 -22.659 1.00 71.55 O ATOM 3074 HH TYR C 122 -26.971 -9.928 -20.194 1.00 0.00 H ATOM 3075 H TYR C 122 -23.218 -13.806 -24.149 1.00 0.00 H TER 3076 TYR C 122 HETATM 3077 O HOH 1 -21.895 20.800 -9.130 1.00 49.45 O HETATM 3078 O HOH 2 -20.566 2.867 -21.057 1.00 50.08 O HETATM 3079 O HOH 3 -9.761 15.727 -29.555 1.00 42.16 O HETATM 3080 O HOH 4 -16.151 32.204 -13.487 1.00 28.16 O HETATM 3081 O HOH 5 -9.289 8.868 -17.318 1.00 34.75 O HETATM 3082 O HOH 6 -13.310 27.524 -23.312 1.00 41.60 O HETATM 3083 O HOH 7 -17.045 23.083 -6.056 1.00 33.01 O HETATM 3084 O HOH 8 -4.520 25.617 -10.946 1.00 37.98 O HETATM 3085 O HOH 9 -6.912 27.329 -4.037 1.00 34.74 O HETATM 3086 O HOH 10 -17.559 34.423 -8.305 1.00 31.06 O HETATM 3087 O HOH 11 -11.163 13.101 -11.398 1.00 26.01 O HETATM 3088 O HOH 12 -12.909 9.921 -11.925 1.00 24.56 O HETATM 3089 O HOH 13 6.090 22.324 -13.653 1.00 37.95 O HETATM 3090 O HOH 14 -0.162 21.834 -7.039 1.00 34.40 O HETATM 3091 O HOH 15 -18.377 21.628 -14.279 1.00 24.48 O HETATM 3092 O HOH 16 7.733 15.990 -7.468 1.00 41.16 O HETATM 3093 O HOH 17 -5.440 21.476 -10.050 1.00 23.05 O HETATM 3094 O HOH 18 -5.412 26.241 -6.873 1.00 39.35 O HETATM 3095 O HOH 19 -11.262 30.038 -21.277 1.00 33.75 O HETATM 3096 O HOH 20 2.178 9.792 -19.907 1.00 37.86 O HETATM 3097 O HOH 21 -5.295 25.864 -14.428 1.00 34.38 O HETATM 3098 O HOH 22 -18.665 15.434 -19.291 1.00 42.79 O HETATM 3099 O HOH 23 6.866 11.225 -7.079 1.00 37.39 O HETATM 3100 O HOH 24 7.630 19.677 -14.766 1.00 43.63 O HETATM 3101 O HOH 25 -11.803 34.645 -6.729 1.00 20.97 O HETATM 3102 O HOH 26 0.790 22.814 -14.633 1.00 36.50 O HETATM 3103 O HOH 27 -15.168 8.644 -13.469 1.00 26.61 O HETATM 3104 O HOH 28 -7.418 17.036 -1.755 1.00 27.60 O HETATM 3105 O HOH 29 -15.555 14.056 -6.722 1.00 45.39 O HETATM 3106 O HOH 30 -16.183 29.119 -21.048 1.00 50.56 O HETATM 3107 O HOH 31 -9.969 32.026 -14.205 1.00 45.82 O HETATM 3108 O HOH 32 17.862 4.714 -17.681 1.00 49.81 O HETATM 3109 O HOH 33 -9.871 30.242 -1.252 1.00 35.90 O HETATM 3110 O HOH 34 -15.349 29.480 -2.443 1.00 33.87 O HETATM 3111 O HOH 35 10.061 20.440 -15.654 1.00 40.83 O HETATM 3112 O HOH 36 -19.306 -3.299 -10.890 1.00 43.92 O HETATM 3113 O HOH 37 -14.801 12.344 -6.337 1.00 47.05 O HETATM 3114 O HOH 38 12.832 -20.747 -5.413 1.00 54.60 O HETATM 3115 O HOH 39 1.604 -10.128 -0.441 1.00 42.72 O HETATM 3116 O HOH 40 22.058 -3.025 -3.625 1.00 36.47 O HETATM 3117 O HOH 41 16.420 -2.123 13.485 1.00 43.80 O HETATM 3118 O HOH 42 9.946 8.601 0.045 1.00 34.79 O HETATM 3119 O HOH 43 13.927 -1.060 11.147 1.00 29.69 O HETATM 3120 O HOH 44 11.042 5.296 2.500 1.00 29.61 O HETATM 3121 O HOH 45 14.850 -13.279 -9.739 1.00 42.71 O HETATM 3122 O HOH 46 4.808 -14.506 3.368 1.00 45.82 O HETATM 3123 O HOH 47 4.912 -12.002 7.739 1.00 45.33 O HETATM 3124 O HOH 48 16.570 0.821 7.636 1.00 33.95 O HETATM 3125 O HOH 49 3.270 -8.811 -2.610 1.00 31.50 O HETATM 3126 O HOH 50 -6.000 -4.170 -5.041 1.00 25.31 O HETATM 3127 O HOH 51 -4.297 -1.620 2.559 1.00 33.62 O HETATM 3128 O HOH 52 8.844 -11.191 -6.294 1.00 36.32 O HETATM 3129 O HOH 53 12.608 2.284 7.728 1.00 17.64 O HETATM 3130 O HOH 54 8.325 -8.460 -5.655 1.00 31.63 O HETATM 3131 O HOH 55 -0.824 0.070 7.197 1.00 36.24 O HETATM 3132 O HOH 56 -1.762 -6.933 -6.398 1.00 23.02 O HETATM 3133 O HOH 57 12.047 2.897 1.279 1.00 25.11 O HETATM 3134 O HOH 58 0.263 -4.198 5.941 1.00 42.78 O HETATM 3135 O HOH 59 5.289 -1.558 7.788 1.00 28.34 O HETATM 3136 O HOH 60 3.367 14.078 -4.315 1.00 44.22 O HETATM 3137 O HOH 61 3.526 -12.808 -15.427 1.00 31.52 O HETATM 3138 O HOH 62 19.170 7.038 1.307 1.00 44.07 O HETATM 3139 O HOH 63 -2.377 -12.009 -2.611 1.00 35.11 O HETATM 3140 O HOH 64 10.754 -2.858 -5.568 1.00 43.50 O HETATM 3141 O HOH 65 7.901 1.301 15.481 1.00 39.05 O HETATM 3142 O HOH 66 2.295 -11.529 -9.206 1.00 41.18 O HETATM 3143 O HOH 67 1.049 -11.797 -3.731 1.00 43.73 O HETATM 3144 O HOH 68 9.499 -5.148 -4.326 1.00 45.85 O HETATM 3145 O HOH 69 19.555 8.385 5.475 1.00 37.92 O HETATM 3146 O HOH 70 -15.819 9.610 -5.741 1.00 46.71 O HETATM 3147 O HOH 71 0.305 -10.049 -9.895 1.00 32.30 O HETATM 3148 O HOH 72 1.666 12.390 -4.096 1.00 43.33 O HETATM 3149 O HOH 73 18.229 1.787 9.288 1.00 33.87 O HETATM 3150 O HOH 74 14.087 0.052 8.685 1.00 27.35 O HETATM 3151 O HOH 75 -17.570 -17.359 -21.820 1.00 52.36 O HETATM 3152 O HOH 76 8.258 0.699 -19.901 1.00 62.69 O HETATM 3153 O HOH 77 3.649 -8.512 -22.609 1.00 43.75 O HETATM 3154 O HOH 78 14.604 -2.585 -19.782 1.00 58.27 O HETATM 3155 O HOH 79 -22.564 -4.122 -0.489 1.00 50.23 O HETATM 3156 O HOH 80 -14.157 -9.774 -9.862 1.00 33.83 O HETATM 3157 O HOH 81 -20.639 -6.800 -0.948 1.00 50.38 O HETATM 3158 O HOH 82 -20.021 -15.926 -30.340 1.00 53.81 O HETATM 3159 O HOH 83 -2.260 -7.166 -25.271 1.00 42.23 O HETATM 3160 O HOH 84 -22.727 -0.857 -17.174 1.00 55.67 O HETATM 3161 O HOH 85 4.259 -6.838 -19.836 1.00 48.94 O HETATM 3162 O HOH 86 -7.537 -11.964 -6.896 1.00 30.99 O HETATM 3163 O HOH 87 -14.924 -9.637 -19.622 1.00 44.20 O HETATM 3164 O HOH 88 -4.023 -6.607 -5.026 1.00 25.85 O HETATM 3165 O HOH 89 -13.458 -9.877 -6.223 1.00 26.32 O HETATM 3166 O HOH 90 -2.831 -14.176 -10.044 1.00 40.01 O HETATM 3167 O HOH 91 -18.391 -5.198 -8.594 1.00 37.80 O HETATM 3168 O HOH 92 -2.969 2.006 -18.683 1.00 48.40 O HETATM 3169 O HOH 93 -1.779 -7.819 -8.833 1.00 27.86 O HETATM 3170 O HOH 94 -14.305 -11.000 -4.180 1.00 33.79 O HETATM 3171 O HOH 95 -9.515 -21.236 -8.378 1.00 40.92 O HETATM 3172 O HOH 96 -0.615 -13.487 -18.422 1.00 45.99 O HETATM 3173 O HOH 97 -20.422 -2.985 8.033 1.00 55.74 O HETATM 3174 O HOH 98 -4.582 -17.594 -10.887 1.00 48.76 O HETATM 3175 O HOH 99 -23.844 -5.055 -1.812 1.00 43.19 O HETATM 3176 O HOH 100 -6.823 -4.645 -2.189 1.00 37.23 O HETATM 3177 O HOH 101 6.352 -6.812 -20.094 1.00 51.46 O HETATM 3178 C1 RTL A 102 -5.081 1.349 -11.894 1.00 -0.02 C HETATM 3179 C2 RTL A 102 -3.893 0.454 -12.245 1.00 -0.05 C HETATM 3180 C3 RTL A 102 -4.206 -0.551 -13.368 1.00 -0.05 C HETATM 3181 C4 RTL A 102 -5.600 -1.147 -13.240 1.00 -0.05 C HETATM 3182 C5 RTL A 102 -6.522 0.037 -13.239 1.00 -0.03 C HETATM 3183 C6 RTL A 102 -6.435 0.714 -12.127 1.00 0.00 C HETATM 3184 C7 RTL A 102 -7.580 0.807 -11.206 1.00 -0.06 C HETATM 3185 C8 RTL A 102 -7.445 0.443 -9.952 1.00 -0.06 C HETATM 3186 C9 RTL A 102 -8.476 0.499 -8.911 1.00 -0.06 C HETATM 3187 C10 RTL A 102 -8.326 1.406 -7.952 1.00 -0.08 C HETATM 3188 C11 RTL A 102 -9.201 1.539 -6.813 1.00 -0.09 C HETATM 3189 C12 RTL A 102 -8.726 0.926 -5.734 1.00 -0.09 C HETATM 3190 C13 RTL A 102 -9.308 0.838 -4.394 1.00 -0.07 C HETATM 3191 C14 RTL A 102 -8.853 -0.087 -3.546 1.00 -0.06 C HETATM 3192 C15 RTL A 102 -9.417 -0.204 -2.153 1.00 0.06 C HETATM 3193 O1 RTL A 102 -8.663 -1.170 -1.404 1.00 -0.38 O HETATM 3194 H17 RTL A 102 -9.022 -1.240 -0.527 1.00 0.21 H HETATM 3195 H15 RTL A 102 -10.468 -0.525 -2.210 1.00 0.07 H HETATM 3196 H16 RTL A 102 -9.359 0.773 -1.652 1.00 0.07 H HETATM 3197 H14 RTL A 102 -8.064 -0.766 -3.865 1.00 0.05 H HETATM 3198 C20 RTL A 102 -10.370 1.781 -3.968 1.00 -0.04 C HETATM 3199 H30 RTL A 102 -10.610 2.462 -4.798 1.00 0.03 H HETATM 3200 H31 RTL A 102 -10.018 2.365 -3.105 1.00 0.03 H HETATM 3201 H32 RTL A 102 -11.271 1.216 -3.686 1.00 0.03 H HETATM 3202 H13 RTL A 102 -7.771 0.419 -5.865 1.00 0.04 H HETATM 3203 H12 RTL A 102 -10.145 2.081 -6.835 1.00 0.05 H HETATM 3204 H11 RTL A 102 -7.486 2.095 -8.031 1.00 0.04 H HETATM 3205 C19 RTL A 102 -9.614 -0.463 -8.918 1.00 -0.03 C HETATM 3206 H27 RTL A 102 -9.537 -1.116 -9.800 1.00 0.04 H HETATM 3207 H28 RTL A 102 -10.563 0.092 -8.955 1.00 0.04 H HETATM 3208 H29 RTL A 102 -9.582 -1.075 -8.005 1.00 0.04 H HETATM 3209 H10 RTL A 102 -6.469 0.061 -9.655 1.00 0.05 H HETATM 3210 H9 RTL A 102 -8.539 1.178 -11.565 1.00 0.08 H HETATM 3211 H8 RTL A 102 -6.787 1.628 -12.628 1.00 0.05 H HETATM 3212 C18 RTL A 102 -7.346 0.493 -14.398 1.00 -0.06 C HETATM 3213 H24 RTL A 102 -7.263 -0.237 -15.216 1.00 0.02 H HETATM 3214 H25 RTL A 102 -6.983 1.473 -14.743 1.00 0.02 H HETATM 3215 H26 RTL A 102 -8.398 0.580 -14.088 1.00 0.02 H HETATM 3216 H7 RTL A 102 -7.366 -0.565 -12.871 1.00 0.03 H HETATM 3217 H5 RTL A 102 -5.695 -1.713 -12.302 1.00 0.03 H HETATM 3218 H6 RTL A 102 -5.819 -1.808 -14.091 1.00 0.03 H HETATM 3219 H3 RTL A 102 -3.468 -1.366 -13.329 1.00 0.03 H HETATM 3220 H4 RTL A 102 -4.130 -0.034 -14.336 1.00 0.03 H HETATM 3221 H1 RTL A 102 -3.599 -0.107 -11.345 1.00 0.03 H HETATM 3222 H2 RTL A 102 -3.058 1.092 -12.569 1.00 0.03 H HETATM 3223 C16 RTL A 102 -4.990 2.574 -12.772 1.00 -0.06 C HETATM 3224 H18 RTL A 102 -4.014 3.059 -12.625 1.00 0.02 H HETATM 3225 H19 RTL A 102 -5.793 3.277 -12.505 1.00 0.02 H HETATM 3226 H20 RTL A 102 -5.097 2.278 -13.826 1.00 0.02 H HETATM 3227 C17 RTL A 102 -4.947 1.725 -10.436 1.00 -0.06 C HETATM 3228 H21 RTL A 102 -5.016 0.819 -9.816 1.00 0.02 H HETATM 3229 H22 RTL A 102 -5.754 2.420 -10.161 1.00 0.02 H HETATM 3230 H23 RTL A 102 -3.973 2.209 -10.270 1.00 0.02 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 720 721 728 729 730 CONECT 728 720 CONECT 729 720 CONECT 730 720 CONECT 1033 1034 1049 1050 1051 CONECT 1049 1033 CONECT 1050 1033 CONECT 1051 1033 CONECT 1747 1748 1755 1756 1757 CONECT 1755 1747 CONECT 1756 1747 CONECT 1757 1747 CONECT 2060 2061 2076 2077 2078 CONECT 2076 2060 CONECT 2077 2060 CONECT 2078 2060 CONECT 2764 2765 2772 2773 2774 CONECT 2772 2764 CONECT 2773 2764 CONECT 2774 2764 CONECT 3178 3179 3183 3223 3227 CONECT 3179 3178 3180 3221 3222 CONECT 3180 3179 3181 3219 3220 CONECT 3181 3180 3182 3217 3218 CONECT 3182 3181 3183 3212 3216 CONECT 3183 3178 3182 3184 3211 CONECT 3184 3183 3185 3210 CONECT 3185 3184 3186 3209 CONECT 3186 3185 3187 3205 CONECT 3187 3186 3188 3204 CONECT 3188 3187 3189 3203 CONECT 3189 3188 3190 3202 CONECT 3190 3189 3191 3198 CONECT 3191 3190 3192 3197 CONECT 3192 3191 3193 3195 3196 CONECT 3193 3192 3194 CONECT 3194 3193 CONECT 3195 3192 CONECT 3196 3192 CONECT 3197 3191 CONECT 3198 3190 3199 3200 3201 CONECT 3199 3198 CONECT 3200 3198 CONECT 3201 3198 CONECT 3202 3189 CONECT 3203 3188 CONECT 3204 3187 CONECT 3205 3186 3206 3207 3208 CONECT 3206 3205 CONECT 3207 3205 CONECT 3208 3205 CONECT 3209 3185 CONECT 3210 3184 CONECT 3211 3183 CONECT 3212 3182 3213 3214 3215 CONECT 3213 3212 CONECT 3214 3212 CONECT 3215 3212 CONECT 3216 3182 CONECT 3217 3181 CONECT 3218 3181 CONECT 3219 3180 CONECT 3220 3180 CONECT 3221 3179 CONECT 3222 3179 CONECT 3223 3178 3224 3225 3226 CONECT 3224 3223 CONECT 3225 3223 CONECT 3226 3223 CONECT 3227 3178 3228 3229 3230 CONECT 3228 3227 CONECT 3229 3227 CONECT 3230 3227 MASTER 0 0 0 0 0 0 0 0 3224 6 77 27 END
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Structure:
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Related entries of code: 6py0
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1fbm
RCSB PDB
PDBbind
RTL
1gx8
RCSB PDB
PDBbind
RTL
1rbp
RCSB PDB
PDBbind
RTL
5hbs
RCSB PDB
PDBbind
RTL
Entry Information
PDB ID
6py0
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
mouse Serum Amyloid A3 (SAA3)
Ligand Name
RTL
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=386nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Proc.Natl.Acad.Sci.USA Vol. 116: pp. 19077-19082
Ligand Properties
Formula
C
2
0
H
3
2
O
Molecular Weight
288.467
Exact Mass
288.245
No. of atoms
53
No. of bonds
53
Polar Surface Area
20.23
LOGP Value
6.66 (
Computed with XLOGP3
)
5.45 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 1
No. of Rings: 1
Canonical SMILES
OC/C=C(/C=C/C=C(/C=C/[C@@H]1[C@@H](C)CCCC1(C)C)\C)\C
InChI String
InChI=1S/C20H32O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,18-19,21H,7,10,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+/t18-,19+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P04918
Entrez Gene ID
NCBI Entrez Gene ID:
20210
ASD
Information of known allosteric effects of PDB entries
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