#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tnp n SER 2 N 0.00 2.33 0.13 0.00 3.41 -1.26 -4.87 113.62 113.36 1tnp n SER 2 Ca 0.00 -3.18 0.00 0.00 -0.26 0.00 0.00 58.87 55.43 1tnp n SER 2 Cb 0.00 -0.56 0.10 0.00 -0.26 0.00 0.00 64.21 63.49 1tnp n SER 2 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1tnp h MET 3 N 2.94 0.00 0.00 4.33 4.05 -2.09 -2.55 114.93 121.61 1tnp h MET 3 Ca 0.08 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.50 1tnp h MET 3 Cb 0.92 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.72 1tnp h MET 3 CO 0.62 0.61 0.00 -2.37 0.23 0.00 0.00 176.91 176.00 1tnp n THR 4 N -3.44 1.95 -2.66 -0.77 5.66 -1.26 -2.27 114.28 111.48 1tnp n THR 4 Ca 0.00 0.50 -0.09 0.00 -3.05 0.00 0.00 64.05 61.41 1tnp n THR 4 Cb 0.70 -1.50 0.03 0.00 -1.55 0.00 0.00 70.33 68.02 1tnp n THR 4 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1tnp n ASP 5 N -1.52 1.82 0.02 1.09 2.03 -0.96 -4.83 116.55 114.20 1tnp n ASP 5 Ca 0.00 -2.69 -0.14 0.00 0.52 0.00 0.00 54.79 52.48 1tnp n ASP 5 Cb 0.00 -0.51 -0.14 0.00 -0.72 0.00 0.00 41.12 39.76 1tnp n ASP 5 CO 0.00 0.00 0.00 0.06 -1.92 0.00 0.00 177.20 175.34 1tnp h GLN 6 N 2.87 0.15 -0.53 -0.67 -0.00 -1.46 -3.28 115.11 112.19 1tnp h GLN 6 Ca -0.06 -0.25 0.10 0.00 -0.00 0.00 0.00 58.65 58.44 1tnp h GLN 6 Cb 1.18 0.09 -0.08 0.00 -0.00 0.00 0.00 27.48 28.67 1tnp h GLN 6 CO 0.47 0.92 0.02 1.96 -0.00 0.00 0.00 178.83 182.20 1tnp h GLN 7 N 0.04 0.14 0.00 0.06 4.20 -1.88 -1.91 115.11 115.76 1tnp h GLN 7 Ca -0.27 -0.01 -0.16 0.00 0.06 0.00 0.00 58.65 58.27 1tnp h GLN 7 Cb 2.00 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 29.72 1tnp h GLN 7 CO 0.12 0.09 -0.76 0.00 -0.67 0.00 0.00 178.83 177.61 1tnp h ALA 8 N 1.46 0.63 -0.65 3.87 0.00 -1.95 -3.02 119.26 119.59 1tnp h ALA 8 Ca 0.27 -0.69 0.10 0.00 0.00 0.00 0.00 54.91 54.59 1tnp h ALA 8 Cb 0.40 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1tnp h ALA 8 CO -0.42 0.95 0.43 1.49 0.00 0.00 0.00 179.25 181.70 1tnp h GLU 9 N 0.00 0.46 0.41 0.00 4.81 -1.42 -2.73 114.58 116.12 1tnp h GLU 9 Ca -0.01 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1tnp h GLU 9 Cb 1.45 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.71 1tnp h GLU 9 CO 0.10 0.31 -0.40 0.00 -0.73 0.00 0.00 179.01 178.28 1tnp h ALA 10 N 1.67 -1.08 -0.40 2.92 0.00 -1.34 -2.92 119.26 118.12 1tnp h ALA 10 Ca 0.30 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1tnp h ALA 10 Cb 0.54 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1tnp h ALA 10 CO -0.09 -1.10 -0.11 0.07 0.00 0.00 0.00 179.25 178.02 1tnp h ARG 11 N -0.81 0.70 -1.05 0.00 -0.00 -1.72 -2.61 114.38 108.89 1tnp h ARG 11 Ca -0.05 -0.22 0.27 0.00 -0.00 0.00 0.00 59.98 59.98 1tnp h ARG 11 Cb 0.70 -0.06 -0.08 0.00 -0.00 0.00 0.00 29.97 30.52 1tnp h ARG 11 CO -0.04 0.78 0.69 0.00 -0.00 0.00 0.00 179.97 181.40 1tnp h ALA 12 N 1.25 2.37 0.14 0.08 0.00 -1.31 -2.16 119.26 119.63 1tnp h ALA 12 Ca 0.11 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1tnp h ALA 12 Cb 0.55 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1tnp h ALA 12 CO 0.03 -0.76 -0.07 0.35 0.00 0.00 0.00 179.25 178.81 1tnp h PHE 13 N 0.33 -0.18 -4.40 0.00 3.57 -1.28 -3.45 116.94 111.52 1tnp h PHE 13 Ca 0.58 -0.00 -0.50 0.00 3.53 0.00 0.00 57.97 61.57 1tnp h PHE 13 Cb 1.60 0.06 0.08 0.00 2.79 0.00 0.00 35.95 40.47 1tnp h PHE 13 CO -0.00 0.27 0.40 -0.51 -2.23 0.00 0.00 178.31 176.24 1tnp s LEU 14 N -9.11 2.99 0.00 0.59 1.43 -0.81 -5.08 118.68 108.69 1tnp s LEU 14 Ca -0.14 1.30 -0.07 0.00 -1.03 0.00 0.00 54.13 54.19 1tnp s LEU 14 Cb 0.01 -4.17 0.10 0.00 0.03 0.00 0.00 46.19 42.16 1tnp s LEU 14 CO 0.54 -1.28 0.46 -1.20 0.23 0.00 0.00 176.35 175.10 1tnp n SER 15 N -2.99 -0.74 0.06 2.29 7.64 -1.26 -4.92 113.62 113.71 1tnp n SER 15 Ca 0.07 -0.96 -0.20 0.00 1.01 0.00 0.00 58.87 58.79 1tnp n SER 15 Cb 0.56 -0.39 -0.15 0.00 -1.01 0.00 0.00 64.21 63.22 1tnp n SER 15 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1tnp h GLU 16 N 0.00 0.32 0.11 1.43 4.57 -1.98 -3.35 114.58 115.68 1tnp h GLU 16 Ca -0.16 -0.54 -0.26 0.00 -1.18 0.00 0.00 59.36 57.22 1tnp h GLU 16 Cb 0.47 0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.26 1tnp h GLU 16 CO 0.11 1.20 -1.19 0.93 -1.18 0.00 0.00 179.01 178.88 1tnp h GLU 17 N 0.09 0.27 -0.75 1.92 4.39 -2.01 -3.28 114.58 115.20 1tnp h GLU 17 Ca -0.30 -0.43 0.15 0.00 0.34 0.00 0.00 59.36 59.12 1tnp h GLU 17 Cb 2.06 0.16 -0.10 0.00 -0.10 0.00 0.00 28.75 30.77 1tnp h GLU 17 CO 0.17 1.19 0.27 1.98 -1.16 0.00 0.00 179.01 181.46 1tnp h MET 18 N 0.09 0.39 -0.21 2.33 4.05 -1.95 0.69 114.93 120.30 1tnp h MET 18 Ca -0.12 -0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.33 1tnp h MET 18 Cb 1.91 -0.09 -0.06 0.00 -0.80 0.00 0.00 31.60 32.56 1tnp h MET 18 CO 0.19 0.25 -0.20 0.82 0.23 0.00 0.00 176.91 178.21 1tnp h ILE 19 N 0.40 0.48 -1.09 1.77 5.03 -1.69 -1.95 117.51 120.45 1tnp h ILE 19 Ca 0.41 0.00 0.30 0.00 -0.12 0.00 0.00 64.86 65.46 1tnp h ILE 19 Cb 0.65 0.48 -0.11 0.00 -3.03 0.00 0.00 36.82 34.81 1tnp h ILE 19 CO -0.43 0.00 0.69 0.00 -0.68 0.00 0.00 178.15 177.74 1tnp h ALA 20 N 0.87 2.29 0.02 1.87 0.00 -0.98 -0.30 119.26 123.03 1tnp h ALA 20 Ca 0.13 0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.95 1tnp h ALA 20 Cb 0.40 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1tnp h ALA 20 CO -0.34 -0.76 -0.68 1.05 0.00 0.00 0.00 179.25 178.52 1tnp h GLU 21 N 0.33 0.42 -0.55 0.00 4.11 -1.25 -3.29 114.58 114.36 1tnp h GLU 21 Ca 0.66 -0.48 0.05 0.00 0.07 0.00 0.00 59.36 59.65 1tnp h GLU 21 Cb 1.72 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 31.09 1tnp h GLU 21 CO -0.36 1.15 0.37 0.74 0.07 0.00 0.00 179.01 180.97 1tnp h PHE 22 N -0.10 0.57 -0.70 2.06 0.04 -0.75 -2.17 116.94 115.90 1tnp h PHE 22 Ca -0.09 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.67 1tnp h PHE 22 Cb 1.40 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 39.33 1tnp h PHE 22 CO 0.15 0.32 0.36 0.87 -0.60 0.00 0.00 178.31 179.41 1tnp h LYS 23 N 0.58 0.99 -0.99 1.51 1.57 -1.54 -2.74 116.57 115.96 1tnp h LYS 23 Ca 0.23 -0.13 0.23 0.00 -1.87 0.00 0.00 60.65 59.11 1tnp h LYS 23 Cb 0.19 -0.19 -0.08 0.00 0.08 0.00 0.00 32.23 32.23 1tnp h LYS 23 CO -0.06 0.77 0.64 0.00 -0.57 0.00 0.00 179.45 180.22 1tnp h ALA 24 N 1.17 2.16 0.08 3.86 0.00 -1.51 -0.62 119.26 124.40 1tnp h ALA 24 Ca 0.24 0.05 -0.28 0.00 0.00 0.00 0.00 54.91 54.92 1tnp h ALA 24 Cb 0.08 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1tnp h ALA 24 CO -0.03 -0.51 -1.42 0.00 0.00 0.00 0.00 179.25 177.29 1tnp h ALA 25 N 1.62 0.33 -0.35 0.00 0.00 -1.61 -3.31 119.26 115.93 1tnp h ALA 25 Ca 0.54 -1.09 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1tnp h ALA 25 Cb 1.30 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 1tnp h ALA 25 CO -0.26 1.20 0.23 0.35 0.00 0.00 0.00 179.25 180.77 1tnp h PHE 26 N 0.05 0.44 0.00 0.00 3.57 -0.96 -2.23 116.94 117.80 1tnp h PHE 26 Ca -0.19 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.20 1tnp h PHE 26 Cb 1.96 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 40.54 1tnp h PHE 26 CO 0.04 0.28 -0.57 0.22 -2.23 0.00 0.00 178.31 176.05 1tnp h ASP 27 N 0.47 0.00 -0.89 0.41 1.82 -1.55 -2.63 116.42 114.05 1tnp h ASP 27 Ca 0.13 0.00 0.24 0.00 -0.39 0.00 0.00 57.03 57.01 1tnp h ASP 27 Cb -0.05 0.00 -0.14 0.00 0.68 0.00 0.00 39.33 39.82 1tnp h ASP 27 CO -0.03 0.57 0.26 -0.03 -1.61 0.00 0.00 179.24 178.41 1tnp h MET 28 N 0.00 0.21 0.01 0.28 4.05 -1.51 -1.56 114.93 116.41 1tnp h MET 28 Ca -0.01 -0.01 -0.35 0.00 -0.28 0.00 0.00 59.70 59.05 1tnp h MET 28 Cb 1.15 -0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 31.84 1tnp h MET 28 CO 0.07 0.14 -2.19 1.19 0.23 0.00 0.00 176.91 176.35 1tnp n PHE 29 N -5.21 0.38 -2.39 1.39 3.01 -1.22 -4.54 117.46 108.88 1tnp n PHE 29 Ca 0.22 0.12 -0.43 0.00 1.01 0.00 0.00 57.45 58.37 1tnp n PHE 29 Cb 0.71 -1.06 0.00 0.00 -0.01 0.00 0.00 39.48 39.12 1tnp n PHE 29 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1tnp n ASP 30 N -2.99 4.95 -0.15 4.37 2.03 -0.60 -4.81 116.55 119.35 1tnp n ASP 30 Ca -0.31 -3.04 0.21 0.00 0.52 0.00 0.00 54.79 52.17 1tnp n ASP 30 Cb 1.09 -1.53 0.61 0.00 -0.72 0.00 0.00 41.12 40.57 1tnp n ASP 30 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1tnp h ALA 31 N 6.13 2.44 0.18 -1.67 0.00 -1.77 -3.05 119.26 121.53 1tnp h ALA 31 Ca 0.41 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 1tnp h ALA 31 Cb 0.69 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1tnp h ALA 31 CO 1.58 -0.67 -0.09 0.22 0.00 0.00 0.00 179.25 180.29 1tnp h ASP 32 N 0.20 -0.21 0.00 0.00 3.58 -1.87 -3.49 116.42 114.62 1tnp h ASP 32 Ca 0.39 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.84 1tnp h ASP 32 Cb 1.22 0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.33 1tnp h ASP 32 CO -0.08 0.03 0.00 0.61 -2.88 0.00 0.00 179.24 176.93 1tnp n GLY 33 N 0.81 1.17 0.09 -0.78 0.00 -1.15 -5.05 105.19 100.28 1tnp n GLY 33 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 1tnp n GLY 33 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1tnp h GLY 34 N 0.00 0.16 0.00 -0.02 0.00 -1.95 -3.48 103.07 97.78 1tnp h GLY 34 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1tnp h GLY 34 CO 0.00 0.37 0.00 0.61 0.00 0.00 0.00 176.54 177.52 1tnp n GLY 35 N 1.54 1.36 3.50 4.60 0.00 -1.26 -5.12 105.19 109.81 1tnp n GLY 35 Ca -0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.74 1tnp n GLY 35 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1tnp s ASP 36 N -2.00 -0.63 0.10 1.61 -4.77 -1.26 -3.85 116.67 105.86 1tnp s ASP 36 Ca 0.00 0.70 -0.10 0.00 -3.30 0.00 0.00 52.55 49.84 1tnp s ASP 36 Cb 0.00 0.55 0.01 0.00 -1.09 0.00 0.00 42.92 42.38 1tnp s ASP 36 CO 0.00 -0.59 0.24 0.27 0.70 0.00 0.00 175.17 175.78 1tnp s ILE 37 N -1.16 0.13 0.78 2.11 -5.25 -1.22 -4.77 121.20 111.82 1tnp s ILE 37 Ca -0.11 -1.04 -0.14 0.00 -0.99 0.00 0.00 60.65 58.37 1tnp s ILE 37 Cb -0.00 -1.30 0.07 0.00 2.95 0.00 0.00 42.46 44.18 1tnp s ILE 37 CO 0.09 -0.58 1.21 -0.94 -1.79 0.00 0.00 174.94 172.93 1tnp s SER 38 N -2.84 3.80 0.09 4.36 1.04 -1.26 -3.42 113.70 115.46 1tnp s SER 38 Ca 0.04 2.36 0.04 0.00 0.48 0.00 0.00 55.95 58.87 1tnp s SER 38 Cb 0.04 -2.59 -0.24 0.00 0.10 0.00 0.00 66.02 63.34 1tnp s SER 38 CO -0.11 -2.53 1.18 0.00 0.98 0.00 0.00 173.24 172.75 1tnp h THR 39 N -0.71 1.57 -0.57 2.02 1.03 -1.93 -2.65 112.91 111.67 1tnp h THR 39 Ca -0.47 -3.25 0.00 0.00 -0.01 0.00 0.00 66.41 62.69 1tnp h THR 39 Cb 1.30 2.84 -0.03 0.00 -1.07 0.00 0.00 68.15 71.19 1tnp h THR 39 CO 0.47 0.91 0.36 0.50 -0.01 0.00 0.00 175.52 177.76 1tnp h LYS 40 N 0.02 0.76 0.01 0.00 3.64 -1.98 -2.94 116.57 116.08 1tnp h LYS 40 Ca -0.08 -0.05 -0.35 0.00 -1.27 0.00 0.00 60.65 58.90 1tnp h LYS 40 Cb 1.86 -0.17 -0.06 0.00 -0.41 0.00 0.00 32.23 33.45 1tnp h LYS 40 CO 0.15 0.51 -2.19 0.39 -2.27 0.00 0.00 179.45 176.04 1tnp n GLU 41 N -4.44 0.67 -0.32 1.90 1.02 -1.25 -4.37 120.64 113.85 1tnp n GLU 41 Ca 0.05 0.10 0.27 0.00 -0.02 0.00 0.00 57.16 57.57 1tnp n GLU 41 Cb 0.06 -1.60 0.52 0.00 -0.02 0.00 0.00 31.44 30.39 1tnp n GLU 41 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1tnp h LEU 42 N 0.00 0.23 0.42 -4.62 5.85 -1.27 0.41 115.31 116.33 1tnp h LEU 42 Ca -0.47 0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 1tnp h LEU 42 Cb 2.14 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 43.42 1tnp h LEU 42 CO 0.03 -0.36 -0.51 1.23 -0.34 0.00 0.00 178.44 178.49 1tnp h GLY 43 N 0.07 -1.25 -0.80 3.75 0.00 -1.76 -2.98 103.07 100.10 1tnp h GLY 43 Ca 0.78 0.61 0.20 0.00 0.00 0.00 0.00 47.33 48.91 1tnp h GLY 43 CO -0.76 -0.35 -0.16 -0.84 0.00 0.00 0.00 176.54 174.43 1tnp h THR 44 N -0.95 0.10 -0.67 4.70 2.02 -0.44 -0.72 112.91 116.94 1tnp h THR 44 Ca -0.05 -0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.26 1tnp h THR 44 Cb 0.85 0.09 -0.10 0.00 -1.74 0.00 0.00 68.15 67.25 1tnp h THR 44 CO -0.11 0.00 0.14 1.62 0.37 0.00 0.00 175.52 177.54 1tnp h VAL 45 N 0.01 0.56 -0.58 3.16 3.04 -1.33 -0.56 116.25 120.56 1tnp h VAL 45 Ca 0.46 -0.09 0.12 0.00 -1.01 0.00 0.00 66.70 66.18 1tnp h VAL 45 Cb 0.76 0.29 -0.11 0.00 -2.01 0.00 0.00 31.29 30.22 1tnp h VAL 45 CO -0.91 0.05 -0.14 0.24 -1.01 0.00 0.00 177.57 175.80 1tnp h MET 46 N 0.25 0.00 -0.22 4.17 2.86 -1.15 -0.64 114.93 120.20 1tnp h MET 46 Ca 0.37 -0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.92 1tnp h MET 46 Cb 0.59 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 1tnp h MET 46 CO -0.47 0.00 -0.23 -0.09 1.06 0.00 0.00 176.91 177.18 1tnp h ARG 47 N 0.00 0.41 0.00 1.72 2.43 -1.18 -2.66 114.38 115.10 1tnp h ARG 47 Ca 0.28 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1tnp h ARG 47 Cb 0.42 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1tnp h ARG 47 CO -0.59 0.61 0.00 -1.33 -1.51 0.00 0.00 179.97 177.15 1tnp n MET 48 N -4.15 0.97 -0.03 0.20 2.81 -0.27 -2.56 117.12 114.09 1tnp n MET 48 Ca -0.00 0.00 -0.16 0.00 -1.81 0.00 0.00 57.70 55.73 1tnp n MET 48 Cb 0.38 -1.23 -0.14 0.00 -0.71 0.00 0.00 33.22 31.52 1tnp n MET 48 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1tnp n LEU 49 N -0.73 1.90 0.00 4.03 4.77 -1.00 -4.99 117.00 120.99 1tnp n LEU 49 Ca 0.10 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 1tnp n LEU 49 Cb 0.05 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 1tnp n LEU 49 CO 0.08 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 1tnp n GLY 50 N 1.88 0.00 3.51 -0.72 0.00 -1.06 -5.17 105.19 103.63 1tnp n GLY 50 Ca -0.29 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.48 1tnp n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tnp s GLN 51 N 0.00 1.80 -0.38 1.61 -0.21 -1.15 -5.08 119.66 116.26 1tnp s GLN 51 Ca 0.00 -2.05 0.11 0.00 0.02 0.00 0.00 55.36 53.44 1tnp s GLN 51 Cb 0.00 -0.91 0.33 0.00 1.00 0.00 0.00 33.01 33.43 1tnp s GLN 51 CO 0.00 -0.28 0.69 -1.71 -2.12 0.00 0.00 175.29 171.88 1tnp n ASN 52 N -0.94 0.64 -2.33 5.90 5.15 -1.26 -4.78 115.26 117.64 1tnp n ASN 52 Ca -0.05 -2.95 0.00 0.00 -0.60 0.00 0.00 54.58 50.97 1tnp n ASN 52 Cb 0.66 -0.58 0.00 0.00 -0.53 0.00 0.00 39.78 39.33 1tnp n ASN 52 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1tnp n PRO 53 N 0.52 1.98 -4.38 1.20 -0.04 -1.26 -5.13 135.00 127.89 1tnp n PRO 53 Ca 0.24 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.47 1tnp n PRO 53 Cb 0.63 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.98 1tnp n PRO 53 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1tnp s THR 54 N 0.51 2.05 0.20 0.52 2.01 -1.26 -5.06 115.64 114.62 1tnp s THR 54 Ca 0.00 -2.06 0.03 0.00 0.31 0.00 0.00 61.69 59.98 1tnp s THR 54 Cb 0.00 -2.01 -0.10 0.00 0.01 0.00 0.00 72.50 70.40 1tnp s THR 54 CO 0.00 -0.31 1.46 0.11 -0.69 0.00 0.00 174.62 175.20 1tnp h LYS 55 N 3.01 0.22 -0.62 4.92 6.56 -2.00 -2.93 116.57 125.72 1tnp h LYS 55 Ca -0.42 -0.19 -0.01 0.00 -1.06 0.00 0.00 60.65 58.97 1tnp h LYS 55 Cb 1.22 0.04 -0.03 0.00 -0.57 0.00 0.00 32.23 32.89 1tnp h LYS 55 CO 0.53 0.87 0.36 1.49 -2.06 0.00 0.00 179.45 180.63 1tnp h GLU 56 N 0.14 0.85 -0.41 3.15 4.57 -2.01 -2.48 114.58 118.39 1tnp h GLU 56 Ca -0.03 -0.08 -0.13 0.00 -1.18 0.00 0.00 59.36 57.95 1tnp h GLU 56 Cb 1.31 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.71 1tnp h GLU 56 CO 0.11 0.61 -0.26 0.93 -1.18 0.00 0.00 179.01 179.22 1tnp h GLU 57 N 0.86 0.85 -0.71 1.92 4.39 -1.94 -2.62 114.58 117.32 1tnp h GLU 57 Ca 0.22 -0.37 0.10 0.00 0.34 0.00 0.00 59.36 59.65 1tnp h GLU 57 Cb -0.01 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.57 1tnp h GLU 57 CO -0.04 1.01 0.47 1.25 -1.16 0.00 0.00 179.01 180.55 1tnp h LEU 58 N 0.73 0.53 -0.72 1.33 6.46 -1.37 -1.17 115.31 121.11 1tnp h LEU 58 Ca 0.09 0.01 -0.11 0.00 -0.12 0.00 0.00 57.88 57.75 1tnp h LEU 58 Cb 0.81 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.62 1tnp h LEU 58 CO 0.07 0.32 -0.19 0.44 -0.62 0.00 0.00 178.44 178.46 1tnp h ASP 59 N 0.59 0.80 -0.03 1.25 3.32 -1.37 -3.21 116.42 117.76 1tnp h ASP 59 Ca 0.33 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 1tnp h ASP 59 Cb 0.50 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 1tnp h ASP 59 CO -0.11 0.97 0.01 0.00 -1.72 0.00 0.00 179.24 178.39 1tnp h ALA 60 N 1.09 0.04 -1.08 3.45 0.00 -1.18 -2.22 119.26 119.37 1tnp h ALA 60 Ca 0.10 -0.11 0.29 0.00 0.00 0.00 0.00 54.91 55.20 1tnp h ALA 60 Cb 0.69 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.38 1tnp h ALA 60 CO 0.05 -0.35 0.71 0.82 0.00 0.00 0.00 179.25 180.48 1tnp h ILE 61 N -0.15 0.47 -0.14 0.00 5.03 -1.52 0.21 117.51 121.40 1tnp h ILE 61 Ca 0.01 -0.10 -0.06 0.00 -0.12 0.00 0.00 64.86 64.59 1tnp h ILE 61 Cb 0.21 0.14 -0.00 0.00 -3.03 0.00 0.00 36.82 34.14 1tnp h ILE 61 CO -0.00 0.06 -0.13 -0.29 -0.68 0.00 0.00 178.15 177.10 1tnp h ILE 62 N 0.30 1.34 -0.95 -0.67 -0.00 -1.44 -2.38 117.51 113.72 1tnp h ILE 62 Ca 0.61 -1.28 0.21 0.00 -0.00 0.00 0.00 64.86 64.40 1tnp h ILE 62 Cb 1.71 1.86 -0.08 0.00 -0.00 0.00 0.00 36.82 40.32 1tnp h ILE 62 CO -0.26 0.38 0.62 -0.08 -0.00 0.00 0.00 178.15 178.80 1tnp h GLU 63 N -0.02 0.44 0.10 2.19 4.81 -0.27 0.11 114.58 121.93 1tnp h GLU 63 Ca 0.02 -0.03 -0.27 0.00 -0.13 0.00 0.00 59.36 58.96 1tnp h GLU 63 Cb 0.66 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.95 1tnp h GLU 63 CO 0.03 0.29 -1.17 1.49 -0.73 0.00 0.00 179.01 178.93 1tnp h GLU 64 N 0.45 0.37 -1.03 1.92 4.81 -1.26 -3.22 114.58 116.62 1tnp h GLU 64 Ca 0.51 -0.53 -0.56 0.00 -0.13 0.00 0.00 59.36 58.65 1tnp h GLU 64 Cb 1.20 0.18 -0.28 0.00 0.63 0.00 0.00 28.75 30.48 1tnp h GLU 64 CO -0.22 1.22 0.72 0.28 -0.73 0.00 0.00 179.01 180.28 1tnp n VAL 65 N -3.64 3.31 -2.65 0.32 0.31 -0.09 -4.02 118.33 111.86 1tnp n VAL 65 Ca -0.09 -2.29 -0.01 0.00 -0.01 0.00 0.00 64.34 61.94 1tnp n VAL 65 Cb 0.97 -0.83 0.07 0.00 -0.91 0.00 0.00 33.84 33.14 1tnp n VAL 65 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1tnp n ASP 66 N -0.93 -0.02 0.00 4.52 -0.08 -0.49 -4.71 116.55 114.84 1tnp n ASP 66 Ca 0.58 -2.10 0.00 0.00 -1.51 0.00 0.00 54.79 51.76 1tnp n ASP 66 Cb 1.14 0.11 0.00 0.00 2.34 0.00 0.00 41.12 44.71 1tnp n ASP 66 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1tnp n GLU 67 N -0.85 0.00 0.00 -0.67 4.07 -1.26 -4.84 120.64 117.09 1tnp n GLU 67 Ca -0.07 0.30 0.00 0.00 -0.06 0.00 0.00 57.16 57.33 1tnp n GLU 67 Cb 0.86 -1.28 0.00 0.00 -0.06 0.00 0.00 31.44 30.96 1tnp n GLU 67 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1tnp n ASP 68 N -1.36 0.00 -3.43 4.31 2.03 -1.26 -5.08 116.55 111.76 1tnp n ASP 68 Ca 0.00 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.22 1tnp n ASP 68 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 1tnp n ASP 68 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1tnp s GLY 69 N -0.76 -0.40 -0.36 0.27 0.00 -1.26 -5.11 107.32 99.69 1tnp s GLY 69 Ca 0.00 1.08 -0.00 0.00 0.00 0.00 0.00 44.72 45.80 1tnp s GLY 69 CO 0.00 2.59 0.82 -0.45 0.00 0.00 0.00 173.10 176.06 1tnp s SER 70 N 2.56 -1.00 -0.56 1.64 0.15 -1.26 -5.04 113.70 110.19 1tnp s SER 70 Ca 0.09 -0.43 0.01 0.00 0.70 0.00 0.00 55.95 56.31 1tnp s SER 70 Cb -0.14 1.31 0.51 0.00 -1.71 0.00 0.00 66.02 65.99 1tnp s SER 70 CO -0.15 -0.12 1.90 0.61 1.20 0.00 0.00 173.24 176.68 1tnp n GLY 71 N 4.22 5.52 3.27 9.45 0.00 -1.26 -4.76 105.19 121.63 1tnp n GLY 71 Ca 0.08 -1.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 1tnp n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tnp s THR 72 N -4.33 0.05 0.16 2.61 -4.23 -1.26 -4.79 115.64 103.86 1tnp s THR 72 Ca 0.60 -0.41 -0.00 0.00 -1.18 0.00 0.00 61.69 60.70 1tnp s THR 72 Cb 0.49 -0.66 -0.04 0.00 1.34 0.00 0.00 72.50 73.62 1tnp s THR 72 CO 0.02 -0.22 0.06 -0.51 -0.54 0.00 0.00 174.62 173.43 1tnp s ILE 73 N -1.29 0.23 0.34 2.99 2.07 -1.22 -4.97 121.20 119.35 1tnp s ILE 73 Ca -0.13 -1.95 0.04 0.00 -1.41 0.00 0.00 60.65 57.20 1tnp s ILE 73 Cb -0.05 -2.18 -0.03 0.00 0.13 0.00 0.00 42.46 40.33 1tnp s ILE 73 CO 0.05 -0.35 0.17 1.51 -1.91 0.00 0.00 174.94 174.41 1tnp s ASP 74 N -3.11 1.97 0.39 4.50 -4.77 -1.26 -3.39 116.67 111.01 1tnp s ASP 74 Ca 0.28 -1.63 0.21 0.00 -3.30 0.00 0.00 52.55 48.10 1tnp s ASP 74 Cb 0.07 0.45 0.35 0.00 -1.09 0.00 0.00 42.92 42.70 1tnp s ASP 74 CO 0.05 -0.93 1.59 0.15 0.70 0.00 0.00 175.17 176.73 1tnp h PHE 75 N 2.06 0.00 0.39 2.11 3.57 -1.99 -1.98 116.94 121.11 1tnp h PHE 75 Ca -0.32 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.16 1tnp h PHE 75 Cb 1.25 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.00 1tnp h PHE 75 CO 1.31 0.18 -0.19 1.49 -2.23 0.00 0.00 178.31 178.87 1tnp h GLU 76 N 0.00 -0.51 -0.15 1.11 4.57 -1.97 -2.76 114.58 114.87 1tnp h GLU 76 Ca -0.00 0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.23 1tnp h GLU 76 Cb 1.08 0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.78 1tnp h GLU 76 CO 0.02 -0.23 0.10 0.93 -1.18 0.00 0.00 179.01 178.66 1tnp h GLU 77 N -1.04 0.14 -0.48 1.92 5.08 -1.93 -2.62 114.58 115.65 1tnp h GLU 77 Ca -0.05 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1tnp h GLU 77 Cb 0.51 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 1tnp h GLU 77 CO 0.09 0.09 0.26 0.35 -1.00 0.00 0.00 179.01 178.80 1tnp h PHE 78 N 0.14 0.48 -0.19 4.33 3.04 -1.29 -1.19 116.94 122.27 1tnp h PHE 78 Ca 0.06 0.02 -0.07 0.00 3.98 0.00 0.00 57.97 61.96 1tnp h PHE 78 Cb 0.08 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.43 1tnp h PHE 78 CO -0.00 0.26 -0.20 -0.07 -2.02 0.00 0.00 178.31 176.27 1tnp h LEU 79 N 0.52 0.32 -1.14 0.59 3.38 -1.17 -2.83 115.31 114.98 1tnp h LEU 79 Ca 0.20 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 1tnp h LEU 79 Cb 0.08 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1tnp h LEU 79 CO -0.12 0.55 0.09 0.58 0.09 0.00 0.00 178.44 179.62 1tnp h VAL 80 N 0.30 1.21 0.06 1.22 2.07 -1.09 -2.74 116.25 117.28 1tnp h VAL 80 Ca 0.05 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1tnp h VAL 80 Cb 0.54 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1tnp h VAL 80 CO 0.04 0.28 -0.03 0.24 0.02 0.00 0.00 177.57 178.12 1tnp h MET 81 N 0.67 -0.07 -0.78 1.57 2.86 -1.18 -2.83 114.93 115.17 1tnp h MET 81 Ca 0.15 0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.77 1tnp h MET 81 Cb 0.29 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 1tnp h MET 81 CO 0.00 0.37 0.41 0.52 1.06 0.00 0.00 176.91 179.27 1tnp h MET 82 N -0.54 1.10 -0.73 1.72 2.07 -1.53 -1.98 114.93 115.03 1tnp h MET 82 Ca -0.01 -0.13 -0.05 0.00 -2.07 0.00 0.00 59.70 57.43 1tnp h MET 82 Cb 0.47 -0.21 -0.03 0.00 -1.87 0.00 0.00 31.60 29.96 1tnp h MET 82 CO 0.01 0.82 0.25 0.28 1.07 0.00 0.00 176.91 179.34 1tnp h VAL 83 N 1.10 1.26 -0.09 -2.22 2.07 -1.52 -2.26 116.25 114.59 1tnp h VAL 83 Ca 0.28 -0.87 0.04 0.00 0.82 0.00 0.00 66.70 66.96 1tnp h VAL 83 Cb 0.06 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 30.21 1tnp h VAL 83 CO -0.04 0.35 -0.33 -0.09 0.02 0.00 0.00 177.57 177.47 1tnp h ARG 84 N 1.08 -0.42 -0.07 1.57 9.65 -1.09 -2.36 114.38 122.75 1tnp h ARG 84 Ca 0.24 0.03 -0.13 0.00 -1.10 0.00 0.00 59.98 59.02 1tnp h ARG 84 Cb 0.28 0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.94 1tnp h ARG 84 CO -0.01 -0.28 -0.53 0.37 2.80 0.00 0.00 179.97 182.32 1tnp h GLN 85 N -0.43 0.18 -0.86 0.20 4.15 -1.46 -3.19 115.11 113.71 1tnp h GLN 85 Ca 0.08 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 1tnp h GLN 85 Cb 0.56 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.22 1tnp h GLN 85 CO -0.33 0.67 0.48 1.98 -1.93 0.00 0.00 178.83 179.70 1tnp h MET 86 N 0.14 1.18 0.35 1.69 4.05 -0.88 -2.73 114.93 118.74 1tnp h MET 86 Ca 0.00 -0.13 -0.02 0.00 -0.28 0.00 0.00 59.70 59.28 1tnp h MET 86 Cb 0.98 -0.24 0.00 0.00 -0.80 0.00 0.00 31.60 31.55 1tnp h MET 86 CO 0.08 0.86 -0.17 -0.22 0.23 0.00 0.00 176.91 177.69 1tnp h LYS 87 N 1.19 -0.45 -1.05 0.39 1.63 -1.47 -3.50 116.57 113.31 1tnp h LYS 87 Ca 0.30 0.03 0.11 0.00 -0.85 0.00 0.00 60.65 60.25 1tnp h LYS 87 Cb 0.01 0.10 -0.05 0.00 -0.60 0.00 0.00 32.23 31.69 1tnp h LYS 87 CO -0.05 -0.27 -0.32 -1.91 -3.45 0.00 0.00 179.45 173.45 1tnp n GLU 88 N -5.27 -0.98 -2.79 1.90 4.07 -1.03 -5.03 120.64 111.50 1tnp n GLU 88 Ca -0.10 0.76 -0.01 0.00 -0.06 0.00 0.00 57.16 57.75 1tnp n GLU 88 Cb 0.22 -1.16 -0.01 0.00 -0.06 0.00 0.00 31.44 30.43 1tnp n GLU 88 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1tnp n ASP 89 N -2.94 -6.38 0.00 4.31 8.00 -1.26 -5.09 116.55 113.19 1tnp n ASP 89 Ca -0.02 1.25 0.14 0.00 0.71 0.00 0.00 54.79 56.87 1tnp n ASP 89 Cb 0.21 -4.59 0.83 0.00 -0.02 0.00 0.00 41.12 37.55 1tnp n ASP 89 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81