#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 2.77 -4.13 0.00 3.41 -1.26 -5.02 113.62 109.38 1tnp n SER 2 Ca 0.00 -0.08 -0.30 0.00 -0.26 0.00 0.00 58.87 58.23 1tnp n SER 2 Cb 0.00 -0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 63.70 1tnp n SER 2 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 1tnp n MET 3 N -2.94 -2.63 -0.13 4.33 3.85 -1.26 -4.84 117.12 113.50 1tnp n MET 3 Ca -0.27 0.32 0.03 0.00 -1.00 0.00 0.00 57.70 56.77 1tnp n MET 3 Cb 0.80 -4.48 0.09 0.00 -1.05 0.00 0.00 33.22 28.58 1tnp n MET 3 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1tnp n THR 4 N -4.42 0.36 -2.18 3.17 -2.24 -1.26 -3.79 114.28 103.92 1tnp n THR 4 Ca -0.20 -0.28 -0.03 0.00 -2.27 0.00 0.00 64.05 61.27 1tnp n THR 4 Cb 0.63 0.02 -0.04 0.00 -2.10 0.00 0.00 70.33 68.84 1tnp n THR 4 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1tnp n ASP 5 N 0.09 -0.39 0.06 3.42 2.03 -1.26 -4.90 116.55 115.61 1tnp n ASP 5 Ca 0.07 -2.01 -0.16 0.00 0.52 0.00 0.00 54.79 53.21 1tnp n ASP 5 Cb 0.23 0.12 -0.14 0.00 -0.72 0.00 0.00 41.12 40.61 1tnp n ASP 5 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 1tnp h GLN 6 N 0.36 0.22 -0.64 -0.67 5.75 -1.96 -3.38 115.11 114.79 1tnp h GLN 6 Ca -0.46 -0.37 0.13 0.00 -0.15 0.00 0.00 58.65 57.80 1tnp h GLN 6 Cb 1.55 0.14 -0.10 0.00 1.07 0.00 0.00 27.48 30.14 1tnp h GLN 6 CO -0.17 1.07 0.05 -0.56 -2.65 0.00 0.00 178.83 176.58 1tnp h GLN 7 N 0.06 0.16 -0.42 1.69 3.07 -1.90 -1.38 115.11 116.38 1tnp h GLN 7 Ca -0.23 -0.01 -0.11 0.00 0.09 0.00 0.00 58.65 58.39 1tnp h GLN 7 Cb 2.00 -0.04 -0.02 0.00 0.08 0.00 0.00 27.48 29.51 1tnp h GLN 7 CO 0.16 0.10 -0.18 0.00 0.09 0.00 0.00 178.83 179.00 1tnp h ALA 8 N 1.57 0.89 -1.03 0.06 0.00 -1.97 -3.12 119.26 115.65 1tnp h ALA 8 Ca 0.34 -0.36 0.28 0.00 0.00 0.00 0.00 54.91 55.17 1tnp h ALA 8 Cb 0.56 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 1tnp h ALA 8 CO -0.51 0.63 0.70 0.93 0.00 0.00 0.00 179.25 181.00 1tnp h GLU 9 N 0.72 0.22 0.51 0.00 5.08 -1.41 -2.19 114.58 117.51 1tnp h GLU 9 Ca 0.11 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1tnp h GLU 9 Cb 0.69 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.90 1tnp h GLU 9 CO 0.05 0.15 -0.25 0.00 -1.00 0.00 0.00 179.01 177.96 1tnp h ALA 10 N 1.56 -0.69 -0.67 3.43 0.00 -1.59 -3.22 119.26 118.08 1tnp h ALA 10 Ca 0.54 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.26 1tnp h ALA 10 Cb 1.68 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 19.71 1tnp h ALA 10 CO -0.16 -0.75 0.41 -0.09 0.00 0.00 0.00 179.25 178.67 1tnp h ARG 11 N -0.97 0.89 -0.42 0.00 2.43 -1.58 -2.39 114.38 112.36 1tnp h ARG 11 Ca -0.07 -0.07 0.07 0.00 -0.81 0.00 0.00 59.98 59.10 1tnp h ARG 11 Cb 0.61 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1tnp h ARG 11 CO 0.12 0.62 0.28 0.00 -1.51 0.00 0.00 179.97 179.48 1tnp h ALA 12 N 1.54 2.06 0.11 2.80 0.00 -1.50 -2.54 119.26 121.73 1tnp h ALA 12 Ca 0.24 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.96 1tnp h ALA 12 Cb -0.05 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1tnp h ALA 12 CO -0.05 -0.15 -0.86 0.35 0.00 0.00 0.00 179.25 178.54 1tnp h PHE 13 N 0.25 0.40 -4.35 0.00 3.04 -1.48 -3.47 116.94 111.34 1tnp h PHE 13 Ca 0.19 -0.30 -0.47 0.00 3.98 0.00 0.00 57.97 61.37 1tnp h PHE 13 Cb 0.42 -0.02 0.12 0.00 2.56 0.00 0.00 35.95 39.03 1tnp h PHE 13 CO -0.00 1.33 0.34 -0.51 -2.02 0.00 0.00 178.31 177.45 1tnp s LEU 14 N -7.85 2.32 0.00 0.59 1.43 -0.96 -5.10 118.68 109.11 1tnp s LEU 14 Ca -0.17 1.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.95 1tnp s LEU 14 Cb 0.01 -3.48 0.00 0.00 0.03 0.00 0.00 46.19 42.76 1tnp s LEU 14 CO 0.78 -2.19 0.00 -0.24 0.23 0.00 0.00 176.35 174.93 1tnp n SER 15 N -3.54 0.15 0.01 2.29 2.88 -1.26 -4.92 113.62 109.24 1tnp n SER 15 Ca 0.07 -0.39 -0.21 0.00 -1.33 0.00 0.00 58.87 57.01 1tnp n SER 15 Cb 0.59 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.91 1tnp n SER 15 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1tnp h GLU 16 N 0.00 0.25 0.06 -1.46 5.08 -1.99 -3.31 114.58 113.21 1tnp h GLU 16 Ca 0.00 -0.42 -0.24 0.00 -1.00 0.00 0.00 59.36 57.70 1tnp h GLU 16 Cb 0.00 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1tnp h GLU 16 CO 0.00 1.20 -1.15 1.49 -1.00 0.00 0.00 179.01 179.55 1tnp h GLU 17 N -0.32 0.12 -0.86 2.33 4.81 -2.00 -3.18 114.58 115.47 1tnp h GLU 17 Ca -0.28 -0.21 0.01 0.00 -0.13 0.00 0.00 59.36 58.75 1tnp h GLU 17 Cb 1.74 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 31.15 1tnp h GLU 17 CO 0.07 1.07 0.57 1.98 -0.73 0.00 0.00 179.01 181.97 1tnp h MET 18 N 0.03 1.14 -0.28 1.92 4.05 -1.97 -2.11 114.93 117.70 1tnp h MET 18 Ca -0.08 -0.07 -0.02 0.00 -0.28 0.00 0.00 59.70 59.24 1tnp h MET 18 Cb 1.87 -0.26 -0.01 0.00 -0.80 0.00 0.00 31.60 32.41 1tnp h MET 18 CO 0.16 0.75 0.08 0.82 0.23 0.00 0.00 176.91 178.95 1tnp h ILE 19 N 1.17 1.21 -0.99 1.77 1.08 -1.63 -2.95 117.51 117.16 1tnp h ILE 19 Ca 0.32 -0.68 0.15 0.00 -0.39 0.00 0.00 64.86 64.26 1tnp h ILE 19 Cb -0.14 1.12 -0.09 0.00 -3.07 0.00 0.00 36.82 34.64 1tnp h ILE 19 CO -0.07 0.22 0.62 0.00 -0.69 0.00 0.00 178.15 178.24 1tnp h ALA 20 N 0.91 1.61 -0.39 1.87 0.00 -1.37 -1.32 119.26 120.57 1tnp h ALA 20 Ca 0.09 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 1tnp h ALA 20 Cb 0.26 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1tnp h ALA 20 CO -0.00 0.10 -0.29 0.93 0.00 0.00 0.00 179.25 179.98 1tnp h GLU 21 N 0.88 0.84 -0.22 0.00 4.39 -1.34 -3.12 114.58 116.02 1tnp h GLU 21 Ca 0.52 -0.38 0.00 0.00 0.34 0.00 0.00 59.36 59.84 1tnp h GLU 21 Cb 0.66 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.28 1tnp h GLU 21 CO -0.30 1.02 0.14 0.74 -1.16 0.00 0.00 179.01 179.46 1tnp h PHE 22 N 0.71 0.27 -0.63 4.33 0.04 -1.17 -2.76 116.94 117.73 1tnp h PHE 22 Ca 0.08 0.01 0.11 0.00 2.80 0.00 0.00 57.97 60.97 1tnp h PHE 22 Cb 0.84 -0.09 -0.08 0.00 2.20 0.00 0.00 35.95 38.82 1tnp h PHE 22 CO 0.05 0.17 0.21 0.87 -0.60 0.00 0.00 178.31 179.00 1tnp h LYS 23 N 0.29 0.35 -0.27 1.51 1.57 -1.44 -2.40 116.57 116.18 1tnp h LYS 23 Ca 0.08 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.90 1tnp h LYS 23 Cb -0.03 -0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.13 1tnp h LYS 23 CO -0.02 0.23 -0.21 0.00 -0.57 0.00 0.00 179.45 178.88 1tnp h ALA 24 N 1.46 -0.04 -0.23 3.86 0.00 -1.49 -1.73 119.26 121.09 1tnp h ALA 24 Ca 0.33 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.29 1tnp h ALA 24 Cb 0.45 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1tnp h ALA 24 CO -0.35 -0.62 -0.05 0.00 0.00 0.00 0.00 179.25 178.23 1tnp h ALA 25 N 0.93 1.50 -0.60 0.00 0.00 -1.45 -2.87 119.26 116.76 1tnp h ALA 25 Ca 0.15 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1tnp h ALA 25 Cb 0.42 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1tnp h ALA 25 CO -0.39 0.36 0.15 0.35 0.00 0.00 0.00 179.25 179.72 1tnp h PHE 26 N 0.34 1.01 0.00 0.00 3.04 -1.10 -2.81 116.94 117.41 1tnp h PHE 26 Ca 0.07 -0.12 -0.10 0.00 3.98 0.00 0.00 57.97 61.81 1tnp h PHE 26 Cb 0.30 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 38.51 1tnp h PHE 26 CO 0.01 0.85 -0.46 0.22 -2.02 0.00 0.00 178.31 176.91 1tnp h ASP 27 N 0.88 0.00 -1.06 0.41 1.82 -1.27 -2.68 116.42 114.52 1tnp h ASP 27 Ca 0.19 0.00 0.29 0.00 -0.39 0.00 0.00 57.03 57.12 1tnp h ASP 27 Cb 0.35 0.00 -0.11 0.00 0.68 0.00 0.00 39.33 40.25 1tnp h ASP 27 CO 0.00 0.46 0.66 0.24 -1.61 0.00 0.00 179.24 179.00 1tnp h MET 28 N 0.00 0.38 0.00 0.28 2.86 -1.45 -1.00 114.93 116.00 1tnp h MET 28 Ca -0.00 -0.02 -0.38 0.00 -2.06 0.00 0.00 59.70 57.23 1tnp h MET 28 Cb 0.85 -0.09 -0.07 0.00 0.06 0.00 0.00 31.60 32.35 1tnp h MET 28 CO 0.06 0.25 -2.43 1.19 1.06 0.00 0.00 176.91 177.05 1tnp n PHE 29 N -4.74 0.03 -2.79 -0.22 3.01 -1.20 -4.73 117.46 106.81 1tnp n PHE 29 Ca 0.28 0.01 -0.43 0.00 1.01 0.00 0.00 57.45 58.31 1tnp n PHE 29 Cb 0.92 -1.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.38 1tnp n PHE 29 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1tnp s ASP 30 N -6.07 6.82 0.00 4.37 2.15 -0.38 -4.91 116.67 118.64 1tnp s ASP 30 Ca -0.24 -2.39 0.00 0.00 0.43 0.00 0.00 52.55 50.35 1tnp s ASP 30 Cb 0.08 -2.47 0.00 0.00 -0.30 0.00 0.00 42.92 40.23 1tnp s ASP 30 CO 0.71 -1.05 0.48 0.00 -0.17 0.00 0.00 175.17 175.14 1tnp n ALA 31 N 7.03 0.00 -3.63 3.66 0.00 -1.24 -4.61 120.51 121.72 1tnp n ALA 31 Ca 0.36 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.52 1tnp n ALA 31 Cb 0.46 0.06 -0.16 0.00 0.00 0.00 0.00 19.45 19.82 1tnp n ALA 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1tnp s ASP 32 N -2.26 3.05 0.00 0.00 1.11 -1.26 -5.01 116.67 112.31 1tnp s ASP 32 Ca 0.00 -0.99 0.00 0.00 0.18 0.00 0.00 52.55 51.74 1tnp s ASP 32 Cb 0.00 -0.44 0.00 0.00 1.07 0.00 0.00 42.92 43.55 1tnp s ASP 32 CO 0.00 -0.37 0.00 0.61 1.18 0.00 0.00 175.17 176.59 1tnp n GLY 33 N 5.16 -0.96 0.25 0.21 0.00 -1.26 -5.12 105.19 103.47 1tnp n GLY 33 Ca -0.07 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1tnp n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tnp n GLY 34 N 0.05 -1.69 0.00 -0.02 0.00 -1.26 -5.05 105.19 97.21 1tnp n GLY 34 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1tnp n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tnp n GLY 35 N -1.20 -1.32 3.48 -0.02 0.00 -1.26 -5.17 105.19 99.70 1tnp n GLY 35 Ca 0.00 0.52 -0.15 0.00 0.00 0.00 0.00 46.02 46.40 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 0.00 -0.59 0.28 1.61 1.47 -1.26 -4.04 116.67 114.14 1tnp s ASP 36 Ca 0.00 0.37 -0.03 0.00 1.18 0.00 0.00 52.55 54.07 1tnp s ASP 36 Cb 0.00 0.54 -0.02 0.00 -0.34 0.00 0.00 42.92 43.10 1tnp s ASP 36 CO 0.00 -0.73 0.35 0.27 0.68 0.00 0.00 175.17 175.74 1tnp s ILE 37 N -2.31 0.00 0.79 2.11 -5.25 -1.04 -4.89 121.20 110.61 1tnp s ILE 37 Ca -0.05 -1.72 -0.11 0.00 -0.99 0.00 0.00 60.65 57.78 1tnp s ILE 37 Cb -0.00 -2.48 0.07 0.00 2.95 0.00 0.00 42.46 43.00 1tnp s ILE 37 CO -0.01 0.00 1.09 -0.55 -1.79 0.00 0.00 174.94 173.68 1tnp s SER 38 N -3.18 4.46 0.18 4.36 0.15 -1.26 -2.83 113.70 115.57 1tnp s SER 38 Ca 0.32 1.47 0.05 0.00 0.70 0.00 0.00 55.95 58.49 1tnp s SER 38 Cb 0.02 -2.22 0.02 0.00 -1.71 0.00 0.00 66.02 62.13 1tnp s SER 38 CO 0.16 -2.01 1.40 0.71 1.20 0.00 0.00 173.24 174.70 1tnp h THR 39 N -1.12 1.52 -0.22 6.45 1.35 -1.92 -2.75 112.91 116.23 1tnp h THR 39 Ca -0.46 -2.66 -0.10 0.00 -0.55 0.00 0.00 66.41 62.63 1tnp h THR 39 Cb 1.25 2.47 -0.01 0.00 -1.73 0.00 0.00 68.15 70.13 1tnp h THR 39 CO 0.57 0.77 -0.30 0.50 -0.25 0.00 0.00 175.52 176.81 1tnp h LYS 40 N 0.07 0.44 0.16 4.72 3.64 -1.98 -3.23 116.57 120.39 1tnp h LYS 40 Ca -0.03 -0.18 -0.34 0.00 -1.27 0.00 0.00 60.65 58.84 1tnp h LYS 40 Cb 1.47 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.28 1tnp h LYS 40 CO 0.12 0.69 -1.70 0.93 -2.27 0.00 0.00 179.45 177.23 1tnp h GLU 41 N 0.38 0.34 -1.03 1.90 5.08 -1.96 -3.36 114.58 115.93 1tnp h GLU 41 Ca 0.05 -0.58 0.42 0.00 -1.00 0.00 0.00 59.36 58.25 1tnp h GLU 41 Cb 0.72 0.22 -0.18 0.00 0.50 0.00 0.00 28.75 30.01 1tnp h GLU 41 CO 0.05 1.28 0.57 1.25 -1.00 0.00 0.00 179.01 181.16 1tnp h LEU 42 N -0.00 0.32 0.00 1.33 5.85 -1.50 0.14 115.31 121.44 1tnp h LEU 42 Ca -0.35 0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1tnp h LEU 42 Cb 2.01 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 43.29 1tnp h LEU 42 CO 0.14 -0.41 -0.06 1.23 -0.34 0.00 0.00 178.44 178.99 1tnp h GLY 43 N 0.01 -1.36 -1.34 3.75 0.00 -1.71 -2.36 103.07 100.07 1tnp h GLY 43 Ca 0.85 0.60 0.46 0.00 0.00 0.00 0.00 47.33 49.24 1tnp h GLY 43 CO -0.74 -0.50 1.22 -0.84 0.00 0.00 0.00 176.54 175.68 1tnp h THR 44 N -0.08 0.12 0.42 4.70 2.02 -0.95 -0.34 112.91 118.80 1tnp h THR 44 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1tnp h THR 44 Cb 0.08 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.63 1tnp h THR 44 CO -0.04 0.00 -0.20 0.58 0.37 0.00 0.00 175.52 176.23 1tnp h VAL 45 N 0.00 0.53 -0.34 3.16 2.07 -1.29 -1.84 116.25 118.55 1tnp h VAL 45 Ca 0.76 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 67.78 1tnp h VAL 45 Cb 3.20 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 33.67 1tnp h VAL 45 CO -0.01 0.07 -0.08 0.00 0.02 0.00 0.00 177.57 177.58 1tnp h MET 46 N -0.83 0.57 -0.01 1.57 -0.00 -1.03 -2.84 114.93 112.36 1tnp h MET 46 Ca -0.06 -0.15 -0.14 0.00 -0.00 0.00 0.00 59.70 59.34 1tnp h MET 46 Cb 0.55 -0.06 -0.02 0.00 -0.00 0.00 0.00 31.60 32.07 1tnp h MET 46 CO 0.09 0.65 -0.67 -0.09 -0.00 0.00 0.00 176.91 176.89 1tnp h ARG 47 N 0.53 0.04 -0.61 -0.10 2.43 -1.46 -3.08 114.38 112.12 1tnp h ARG 47 Ca 0.10 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1tnp h ARG 47 Cb 0.46 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1tnp h ARG 47 CO 0.02 0.69 0.00 -0.12 -1.51 0.00 0.00 179.97 179.06 1tnp n MET 48 N -3.76 1.99 -0.08 0.20 1.56 -0.70 -3.16 117.12 113.18 1tnp n MET 48 Ca -0.01 -0.96 -0.09 0.00 -0.27 0.00 0.00 57.70 56.36 1tnp n MET 48 Cb 0.66 -1.52 -0.09 0.00 2.15 0.00 0.00 33.22 34.42 1tnp n MET 48 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 1tnp n LEU 49 N 0.20 1.77 0.00 -0.89 4.77 -1.16 -5.02 117.00 116.68 1tnp n LEU 49 Ca 0.09 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1tnp n LEU 49 Cb 0.42 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1tnp n LEU 49 CO 0.09 0.59 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 1tnp n GLY 50 N 2.50 -0.11 1.64 -0.72 0.00 -1.19 -5.18 105.19 102.14 1tnp n GLY 50 Ca -0.26 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 1tnp n GLY 50 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tnp n GLN 51 N 0.00 1.22 -2.69 1.61 6.02 -1.22 -5.07 117.38 117.25 1tnp n GLN 51 Ca 0.00 -1.53 -0.04 0.00 -0.01 0.00 0.00 57.00 55.42 1tnp n GLN 51 Cb 0.00 0.23 0.12 0.00 1.02 0.00 0.00 30.24 31.61 1tnp n GLN 51 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1tnp n ASN 52 N -1.73 -1.32 -4.94 1.08 5.15 -1.26 -4.93 115.26 107.30 1tnp n ASN 52 Ca -0.03 -2.30 -0.24 0.00 -0.60 0.00 0.00 54.58 51.41 1tnp n ASN 52 Cb 0.28 0.68 0.03 0.00 -0.53 0.00 0.00 39.78 40.24 1tnp n ASN 52 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1tnp s PRO 53 N -0.20 2.79 0.62 1.20 0.04 -1.26 -5.09 135.00 133.11 1tnp s PRO 53 Ca 0.15 -0.39 -0.14 0.00 0.04 0.00 0.00 61.00 60.66 1tnp s PRO 53 Cb 0.43 -2.41 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 1tnp s PRO 53 CO -0.11 -0.62 1.05 0.99 0.04 0.00 0.00 177.00 178.35 1tnp s THR 54 N -2.82 3.98 0.15 1.26 2.01 -1.26 -4.97 115.64 113.99 1tnp s THR 54 Ca 0.54 0.82 0.00 0.00 0.31 0.00 0.00 61.69 63.35 1tnp s THR 54 Cb -0.10 -3.43 -0.16 0.00 0.01 0.00 0.00 72.50 68.81 1tnp s THR 54 CO 0.41 -0.67 1.35 0.50 -0.69 0.00 0.00 174.62 175.52 1tnp h LYS 55 N 0.03 0.26 0.03 4.92 3.64 -1.98 -2.58 116.57 120.90 1tnp h LYS 55 Ca -0.46 -0.29 -0.25 0.00 -1.27 0.00 0.00 60.65 58.38 1tnp h LYS 55 Cb 1.21 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 33.09 1tnp h LYS 55 CO 0.58 1.01 -1.29 1.49 -2.27 0.00 0.00 179.45 178.96 1tnp h GLU 56 N 0.15 0.07 -0.30 1.90 4.81 -1.98 -2.31 114.58 116.92 1tnp h GLU 56 Ca -0.06 -0.13 -0.08 0.00 -0.13 0.00 0.00 59.36 58.96 1tnp h GLU 56 Cb 1.54 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.96 1tnp h GLU 56 CO 0.14 0.92 -0.13 1.05 -0.73 0.00 0.00 179.01 180.27 1tnp h GLU 57 N 0.02 0.62 -0.16 1.92 4.11 -1.96 -2.30 114.58 116.83 1tnp h GLU 57 Ca -0.13 -0.27 -0.07 0.00 0.07 0.00 0.00 59.36 58.97 1tnp h GLU 57 Cb 1.89 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 31.11 1tnp h GLU 57 CO 0.13 0.84 -0.20 1.25 0.07 0.00 0.00 179.01 181.11 1tnp h LEU 58 N 0.38 0.26 -1.23 3.06 5.85 -1.50 -1.18 115.31 120.96 1tnp h LEU 58 Ca 0.07 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1tnp h LEU 58 Cb 0.65 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1tnp h LEU 58 CO 0.04 0.48 -0.07 0.44 -0.34 0.00 0.00 178.44 178.99 1tnp h ASP 59 N 0.25 0.42 0.18 1.25 3.32 -1.26 -3.14 116.42 117.43 1tnp h ASP 59 Ca 0.05 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1tnp h ASP 59 Cb 0.50 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1tnp h ASP 59 CO 0.03 0.54 -0.08 0.00 -1.72 0.00 0.00 179.24 178.01 1tnp h ALA 60 N 1.51 -0.24 -1.01 3.45 0.00 -0.64 -2.94 119.26 119.40 1tnp h ALA 60 Ca 0.09 -0.16 0.23 0.00 0.00 0.00 0.00 54.91 55.07 1tnp h ALA 60 Cb 0.39 0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.16 1tnp h ALA 60 CO 0.02 -0.49 0.61 0.82 0.00 0.00 0.00 179.25 180.21 1tnp h ILE 61 N -0.51 0.59 -0.21 0.00 5.03 -1.47 0.69 117.51 121.63 1tnp h ILE 61 Ca -0.02 -0.21 -0.00 0.00 -0.12 0.00 0.00 64.86 64.51 1tnp h ILE 61 Cb 0.39 -0.07 -0.01 0.00 -3.03 0.00 0.00 36.82 34.10 1tnp h ILE 61 CO 0.04 0.11 0.13 0.40 -0.68 0.00 0.00 178.15 178.15 1tnp h ILE 62 N 0.61 1.09 -1.03 -0.67 1.08 -1.48 -2.09 117.51 115.02 1tnp h ILE 62 Ca 0.61 -0.22 0.26 0.00 -0.39 0.00 0.00 64.86 65.12 1tnp h ILE 62 Cb 1.17 0.85 -0.11 0.00 -3.07 0.00 0.00 36.82 35.66 1tnp h ILE 62 CO -0.41 0.09 0.63 -0.08 -0.69 0.00 0.00 178.15 177.69 1tnp h GLU 63 N 0.25 0.48 -0.04 2.37 4.57 -0.73 0.12 114.58 121.61 1tnp h GLU 63 Ca 0.08 -0.03 -0.25 0.00 -1.18 0.00 0.00 59.36 57.98 1tnp h GLU 63 Cb 0.03 -0.11 0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1tnp h GLU 63 CO -0.01 0.32 -0.95 1.49 -1.18 0.00 0.00 179.01 178.67 1tnp h GLU 64 N 0.49 0.71 -0.93 1.92 4.81 -1.33 -3.21 114.58 117.04 1tnp h GLU 64 Ca 0.63 -0.71 -0.35 0.00 -0.13 0.00 0.00 59.36 58.79 1tnp h GLU 64 Cb 1.37 0.19 -0.21 0.00 0.63 0.00 0.00 28.75 30.74 1tnp h GLU 64 CO -0.40 1.30 0.45 1.33 -0.73 0.00 0.00 179.01 180.96 1tnp n VAL 65 N -3.90 2.77 -2.66 0.32 0.24 -0.10 -4.17 118.33 110.83 1tnp n VAL 65 Ca -0.10 -1.54 -0.04 0.00 -2.04 0.00 0.00 64.34 60.62 1tnp n VAL 65 Cb 0.84 -0.50 0.10 0.00 -1.47 0.00 0.00 33.84 32.80 1tnp n VAL 65 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1tnp n ASP 66 N -0.61 -1.42 0.04 -1.34 -0.08 -0.40 -4.94 116.55 107.79 1tnp n ASP 66 Ca 0.45 -2.11 -0.11 0.00 -1.51 0.00 0.00 54.79 51.51 1tnp n ASP 66 Cb 1.41 0.75 -0.08 0.00 2.34 0.00 0.00 41.12 45.54 1tnp n ASP 66 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1tnp h GLU 67 N 1.23 -0.17 0.00 -0.67 4.81 -1.72 -3.45 114.58 114.61 1tnp h GLU 67 Ca -0.36 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1tnp h GLU 67 Cb 1.26 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1tnp h GLU 67 CO -0.13 0.30 0.00 -0.40 -0.73 0.00 0.00 179.01 178.04 1tnp n ASP 68 N -4.90 0.00 0.00 1.04 5.75 -1.26 -5.09 116.55 112.09 1tnp n ASP 68 Ca -0.08 -0.90 0.00 0.00 -0.01 0.00 0.00 54.79 53.80 1tnp n ASP 68 Cb 0.27 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 1tnp n ASP 68 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tnp n GLY 69 N 0.00 1.12 3.70 6.12 0.00 -1.26 -4.69 105.19 110.18 1tnp n GLY 69 Ca 0.00 0.57 -0.54 0.00 0.00 0.00 0.00 46.02 46.05 1tnp n GLY 69 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1tnp n SER 70 N 8.05 2.82 -0.08 1.61 3.41 -1.26 -4.88 113.62 123.29 1tnp n SER 70 Ca 0.00 1.03 -0.16 0.00 -0.26 0.00 0.00 58.87 59.48 1tnp n SER 70 Cb 0.00 -1.24 -0.13 0.00 -0.26 0.00 0.00 64.21 62.58 1tnp n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tnp n GLY 71 N 4.24 -0.59 0.00 5.00 0.00 -1.26 -4.71 105.19 107.86 1tnp n GLY 71 Ca 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1tnp n GLY 71 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tnp n THR 72 N -3.20 0.00 -3.95 2.61 -2.24 -1.26 -4.76 114.28 101.47 1tnp n THR 72 Ca -0.37 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.32 1tnp n THR 72 Cb 1.04 -1.14 -0.10 0.00 -2.10 0.00 0.00 70.33 68.04 1tnp n THR 72 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1tnp s ILE 73 N 1.29 0.13 0.00 2.28 2.07 -1.13 -4.93 121.20 120.91 1tnp s ILE 73 Ca 0.00 -1.05 0.00 0.00 -1.41 0.00 0.00 60.65 58.19 1tnp s ILE 73 Cb 0.00 -0.68 0.00 0.00 0.13 0.00 0.00 42.46 41.91 1tnp s ILE 73 CO 0.00 -0.58 0.00 0.47 -1.91 0.00 0.00 174.94 172.92 1tnp n ASP 74 N 1.08 1.80 0.06 4.50 8.00 -1.26 -2.49 116.55 128.23 1tnp n ASP 74 Ca -0.21 -0.66 -0.02 0.00 0.71 0.00 0.00 54.79 54.61 1tnp n ASP 74 Cb 0.57 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.60 1tnp n ASP 74 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1tnp h PHE 75 N 0.59 0.00 -0.04 1.24 3.57 -2.00 -3.16 116.94 117.15 1tnp h PHE 75 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1tnp h PHE 75 Cb 0.00 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1tnp h PHE 75 CO 0.00 0.71 -0.01 1.05 -2.23 0.00 0.00 178.31 177.83 1tnp h GLU 76 N 0.00 0.08 0.00 1.11 -0.00 -1.97 -2.18 114.58 111.61 1tnp h GLU 76 Ca -0.11 -0.03 -0.04 0.00 -0.00 0.00 0.00 59.36 59.17 1tnp h GLU 76 Cb 1.64 -0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 30.38 1tnp h GLU 76 CO 0.07 0.45 -0.19 1.49 -0.00 0.00 0.00 179.01 180.83 1tnp h GLU 77 N -0.29 0.00 -0.51 1.06 4.57 -1.97 -2.71 114.58 114.73 1tnp h GLU 77 Ca 0.01 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 1tnp h GLU 77 Cb 0.42 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 1tnp h GLU 77 CO 0.00 0.19 -0.09 0.35 -1.18 0.00 0.00 179.01 178.28 1tnp h PHE 78 N 0.00 1.07 0.00 0.92 3.57 -1.40 -2.24 116.94 118.86 1tnp h PHE 78 Ca -0.00 -0.22 -0.19 0.00 3.53 0.00 0.00 57.97 61.09 1tnp h PHE 78 Cb 0.36 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 1tnp h PHE 78 CO 0.00 1.01 -0.91 1.37 -2.23 0.00 0.00 178.31 177.55 1tnp h LEU 79 N 0.82 0.00 -1.28 0.59 8.10 -1.35 -3.11 115.31 119.08 1tnp h LEU 79 Ca 0.13 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 58.11 1tnp h LEU 79 Cb 0.65 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.84 1tnp h LEU 79 CO 0.04 0.91 0.33 1.62 -4.11 0.00 0.00 178.44 177.23 1tnp h VAL 80 N 0.00 1.18 -0.12 0.15 3.04 -1.26 -2.98 116.25 116.27 1tnp h VAL 80 Ca -0.01 -0.46 -0.11 0.00 -1.01 0.00 0.00 66.70 65.12 1tnp h VAL 80 Cb 1.67 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 1tnp h VAL 80 CO 0.12 0.20 -0.34 0.24 -1.01 0.00 0.00 177.57 176.78 1tnp h MET 81 N 0.83 0.44 0.11 4.17 2.86 -1.35 -3.11 114.93 118.88 1tnp h MET 81 Ca 0.21 -0.31 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1tnp h MET 81 Cb 0.02 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1tnp h MET 81 CO -0.03 0.93 -0.16 0.52 1.06 0.00 0.00 176.91 179.23 1tnp h MET 82 N 0.02 -0.31 -0.90 1.72 2.86 -1.48 -2.06 114.93 114.78 1tnp h MET 82 Ca -0.01 0.02 0.07 0.00 -2.06 0.00 0.00 59.70 57.72 1tnp h MET 82 Cb 0.96 0.07 -0.07 0.00 0.06 0.00 0.00 31.60 32.62 1tnp h MET 82 CO 0.07 -0.21 0.56 0.28 1.06 0.00 0.00 176.91 178.68 1tnp h VAL 83 N -0.32 1.02 -0.96 -2.22 2.07 -1.64 -1.65 116.25 112.55 1tnp h VAL 83 Ca 0.02 -0.34 0.05 0.00 0.82 0.00 0.00 66.70 67.25 1tnp h VAL 83 Cb 0.33 -0.06 -0.06 0.00 -1.52 0.00 0.00 31.29 29.98 1tnp h VAL 83 CO -0.08 0.18 0.62 -0.09 0.02 0.00 0.00 177.57 178.23 1tnp h ARG 84 N 1.00 1.12 -0.05 1.57 2.43 -1.32 -2.64 114.38 116.49 1tnp h ARG 84 Ca 0.40 -0.07 -0.21 0.00 -0.81 0.00 0.00 59.98 59.30 1tnp h ARG 84 Cb 0.23 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1tnp h ARG 84 CO -0.19 0.74 -0.83 0.37 -1.51 0.00 0.00 179.97 178.55 1tnp h GLN 85 N 1.15 0.44 -0.19 0.20 5.75 -0.76 -3.21 115.11 118.49 1tnp h GLN 85 Ca 0.40 -0.41 -0.06 0.00 -0.15 0.00 0.00 58.65 58.43 1tnp h GLN 85 Cb 0.11 0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.75 1tnp h GLN 85 CO -0.14 1.06 -0.17 0.52 -2.65 0.00 0.00 178.83 177.45 1tnp h MET 86 N 0.28 0.32 -0.53 1.69 2.86 -1.08 -2.40 114.93 116.07 1tnp h MET 86 Ca -0.05 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1tnp h MET 86 Cb 1.43 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 33.03 1tnp h MET 86 CO 0.15 0.49 0.34 -0.22 1.06 0.00 0.00 176.91 178.73 1tnp h LYS 87 N 0.30 0.67 -2.20 1.72 3.64 -1.52 -3.44 116.57 115.74 1tnp h LYS 87 Ca 0.06 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1tnp h LYS 87 Cb 0.47 -0.15 -0.22 0.00 -0.41 0.00 0.00 32.23 31.92 1tnp h LYS 87 CO 0.03 0.45 -0.01 -2.00 -2.27 0.00 0.00 179.45 175.64 1tnp s GLU 88 N -6.15 0.69 0.52 1.90 2.12 -0.90 -5.17 118.70 111.71 1tnp s GLU 88 Ca -0.13 0.97 -0.09 0.00 0.36 0.00 0.00 54.97 56.09 1tnp s GLU 88 Cb 0.13 0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.72 1tnp s GLU 88 CO 0.74 -0.11 0.87 -0.51 -0.54 0.00 0.00 175.26 175.71 1tnp s ASP 89 N 0.85 6.32 0.00 -1.70 1.11 -1.22 -4.56 116.67 117.47 1tnp s ASP 89 Ca -0.04 1.16 0.00 0.00 0.18 0.00 0.00 52.55 53.85 1tnp s ASP 89 Cb -0.05 -2.35 0.00 0.00 1.07 0.00 0.00 42.92 41.59 1tnp s ASP 89 CO -0.07 -0.64 0.00 0.00 1.18 0.00 0.00 175.17 175.64