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Archive_CollaGNN_Database

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train · 129k rows

text stringlengths 6 81
ATOM 1 N GLY A 1 3.753 41.510 -31.202 1.00 85.63 N
ATOM 2 CA GLY A 1 2.380 41.184 -30.809 1.00 87.40 C
ATOM 3 C GLY A 1 2.279 40.855 -29.336 1.00 88.62 C
ATOM 4 O GLY A 1 3.301 40.718 -28.665 1.00 84.87 O
ATOM 5 N PRO A 2 1.073 40.688 -28.787 1.00 90.04 N
ATOM 6 CA PRO A 2 0.898 40.374 -27.369 1.00 90.65 C
ATOM 7 C PRO A 2 1.343 38.950 -27.057 1.00 90.51 C
ATOM 8 O PRO A 2 1.379 38.087 -27.927 1.00 86.75 O
ATOM 9 CB PRO A 2 -0.599 40.561 -27.137 1.00 86.31 C
ATOM 10 CG PRO A 2 -1.209 40.271 -28.463 1.00 83.06 C
ATOM 11 CD PRO A 2 -0.222 40.823 -29.458 1.00 84.69 C
HETATM 12 N HYP A 3 1.665 38.713 -25.840 1.00 90.96 N
HETATM 13 CA HYP A 3 2.026 37.400 -25.375 1.00 90.37 C
HETATM 14 C HYP A 3 0.847 36.382 -25.549 1.00 89.46 C
HETATM 15 O HYP A 3 -0.333 36.767 -25.515 1.00 91.20 O
HETATM 16 CB HYP A 3 2.294 37.575 -23.869 1.00 87.86 C
HETATM 17 CG HYP A 3 2.600 39.015 -23.731 1.00 86.19 C
HETATM 18 CD HYP A 3 1.732 39.672 -24.806 1.00 89.79 C
HETATM 19 OD1 HYP A 3 3.955 39.301 -24.010 1.00 88.21 O
ATOM 20 N GLY A 4 1.221 35.125 -25.747 1.00 95.04 N
ATOM 21 CA GLY A 4 0.215 34.108 -25.910 1.00 93.99 C
ATOM 22 C GLY A 4 -0.499 33.823 -24.593 1.00 94.40 C
ATOM 23 O GLY A 4 -0.103 34.328 -23.538 1.00 93.45 O
ATOM 24 N PRO A 5 -1.558 33.003 -24.635 1.00 94.92 N
ATOM 25 CA PRO A 5 -2.315 32.672 -23.424 1.00 94.48 C
ATOM 26 C PRO A 5 -1.506 31.770 -22.501 1.00 94.71 C
ATOM 27 O PRO A 5 -0.543 31.131 -22.915 1.00 93.59 O
ATOM 28 CB PRO A 5 -3.563 31.966 -23.956 1.00 91.93 C
ATOM 29 CG PRO A 5 -3.091 31.342 -25.220 1.00 89.88 C
ATOM 30 CD PRO A 5 -2.116 32.337 -25.812 1.00 92.86 C
HETATM 31 N HYP A 6 -1.902 31.731 -21.246 1.00 95.76 N
HETATM 32 CA HYP A 6 -1.277 30.807 -20.301 1.00 95.25 C
HETATM 33 C HYP A 6 -1.406 29.355 -20.730 1.00 95.77 C
HETATM 34 O HYP A 6 -2.370 28.979 -21.385 1.00 94.26 O
HETATM 35 CB HYP A 6 -2.016 31.079 -18.966 1.00 93.19 C
HETATM 36 CG HYP A 6 -2.489 32.489 -19.103 1.00 91.18 C
HETATM 37 CD HYP A 6 -2.841 32.576 -20.596 1.00 94.43 C
HETATM 38 OD1 HYP A 6 -1.475 33.414 -18.804 1.00 90.63 O
ATOM 39 N GLY A 7 -0.393 28.554 -20.380 1.00 96.62 N
ATOM 40 CA GLY A 7 -0.383 27.165 -20.755 1.00 96.16 C
ATOM 41 C GLY A 7 -1.461 26.372 -20.026 1.00 96.50 C
ATOM 42 O GLY A 7 -2.114 26.884 -19.110 1.00 96.22 O
ATOM 43 N PRO A 8 -1.647 25.105 -20.408 1.00 96.10 N
ATOM 44 CA PRO A 8 -2.658 24.269 -19.771 1.00 95.89 C
ATOM 45 C PRO A 8 -2.258 23.903 -18.350 1.00 96.42 C
ATOM 46 O PRO A 8 -1.091 23.986 -17.975 1.00 95.78 O
ATOM 47 CB PRO A 8 -2.726 23.041 -20.680 1.00 94.09 C
ATOM 48 CG PRO A 8 -1.361 22.961 -21.259 1.00 92.57 C
ATOM 49 CD PRO A 8 -0.940 24.398 -21.466 1.00 94.93 C
HETATM 50 N HYP A 9 -3.219 23.473 -17.568 1.00 96.68 N
HETATM 51 CA HYP A 9 -2.940 23.002 -16.223 1.00 96.69 C
HETATM 52 C HYP A 9 -2.011 21.819 -16.200 1.00 96.18 C
HETATM 53 O HYP A 9 -1.972 21.035 -17.118 1.00 95.54 O
HETATM 54 CB HYP A 9 -4.351 22.590 -15.658 1.00 94.61 C
HETATM 55 CG HYP A 9 -5.313 23.385 -16.464 1.00 93.03 C
HETATM 56 CD HYP A 9 -4.617 23.445 -17.827 1.00 95.25 C
HETATM 57 OD1 HYP A 9 -5.479 24.696 -15.970 1.00 90.50 O
ATOM 58 N GLY A 10 -1.180 21.723 -15.123 1.00 97.00 N
ATOM 59 CA GLY A 10 -0.225 20.656 -14.996 1.00 96.58 C
ATOM 60 C GLY A 10 -0.906 19.304 -14.812 1.00 97.11 C
ATOM 61 O GLY A 10 -2.126 19.227 -14.636 1.00 97.16 O
ATOM 62 N PRO A 11 -0.124 18.227 -14.839 1.00 97.02 N
ATOM 63 CA PRO A 11 -0.685 16.886 -14.680 1.00 97.06 C
ATOM 64 C PRO A 11 -1.132 16.647 -13.244 1.00 97.40 C
ATOM 65 O PRO A 11 -0.718 17.337 -12.318 1.00 97.06 O
ATOM 66 CB PRO A 11 0.468 15.969 -15.071 1.00 95.85 C
ATOM 67 CG PRO A 11 1.672 16.770 -14.709 1.00 94.50 C
ATOM 68 CD PRO A 11 1.316 18.193 -15.047 1.00 96.24 C
HETATM 69 N HYP A 12 -1.968 15.685 -13.063 1.00 97.25 N
HETATM 70 CA HYP A 12 -2.379 15.258 -11.712 1.00 97.08 C
HETATM 71 C HYP A 12 -1.229 14.867 -10.875 1.00 96.47 C
HETATM 72 O HYP A 12 -0.266 14.326 -11.391 1.00 95.51 O
HETATM 73 CB HYP A 12 -3.365 14.097 -11.944 1.00 95.70 C
HETATM 74 CG HYP A 12 -3.864 14.266 -13.351 1.00 94.84 C
HETATM 75 CD HYP A 12 -2.655 14.906 -14.041 1.00 96.32 C
HETATM 76 OD1 HYP A 12 -4.959 15.165 -13.421 1.00 93.26 O
ATOM 77 N GLY A 13 -1.287 15.104 -9.550 1.00 97.24 N
ATOM 78 CA GLY A 13 -0.228 14.764 -8.635 1.00 96.66 C
ATOM 79 C GLY A 13 -0.018 13.253 -8.549 1.00 96.90 C
ATOM 80 O GLY A 13 -0.820 12.471 -9.059 1.00 96.93 O
ATOM 81 N PRO A 14 1.071 12.834 -7.878 1.00 96.97 N
ATOM 82 CA PRO A 14 1.347 11.408 -7.751 1.00 96.46 C
ATOM 83 C PRO A 14 0.360 10.718 -6.825 1.00 96.26 C
ATOM 84 O PRO A 14 -0.267 11.339 -5.961 1.00 94.95 O
ATOM 85 CB PRO A 14 2.767 11.374 -7.190 1.00 94.89 C
ATOM 86 CG PRO A 14 2.851 12.637 -6.411 1.00 94.04 C
ATOM 87 CD PRO A 14 2.078 13.652 -7.224 1.00 96.04 C
ATOM 88 N GLN A 15 0.240 9.392 -6.991 1.00 96.32 N
ATOM 89 CA GLN A 15 -0.637 8.599 -6.143 1.00 96.04 C
ATOM 90 C GLN A 15 -0.131 8.650 -4.701 1.00 96.36 C
ATOM 91 O GLN A 15 1.072 8.628 -4.454 1.00 94.82 O
ATOM 92 CB GLN A 15 -0.668 7.153 -6.654 1.00 94.13 C
ATOM 93 CG GLN A 15 -1.601 6.242 -5.867 1.00 89.84 C
ATOM 94 CD GLN A 15 -1.676 4.850 -6.444 1.00 85.42 C
ATOM 95 OE1 GLN A 15 -0.951 4.506 -7.373 1.00 81.10 O
ATOM 96 NE2 GLN A 15 -2.554 4.026 -5.899 1.00 77.60 N
ATOM 97 N GLY A 16 -1.057 8.746 -3.755 1.00 96.57 N
ATOM 98 CA GLY A 16 -0.690 8.803 -2.354 1.00 95.95 C
ATOM 99 C GLY A 16 -0.080 7.496 -1.871 1.00 96.30 C
ATOM 100 O GLY A 16 -0.124 6.480 -2.559 1.00 96.12 O

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