#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tnp s SER 2 N 0.00 -0.20 0.31 0.00 0.15 -1.26 -5.03 113.70 107.68 1tnp s SER 2 Ca 0.00 0.01 0.11 0.00 0.70 0.00 0.00 55.95 56.77 1tnp s SER 2 Cb 0.00 0.20 0.50 0.00 -1.71 0.00 0.00 66.02 65.02 1tnp s SER 2 CO 0.00 -0.32 1.70 0.24 1.20 0.00 0.00 173.24 176.06 1tnp h MET 3 N 2.02 0.04 -0.29 5.44 0.00 -2.07 -1.69 114.93 118.37 1tnp h MET 3 Ca -0.12 -0.02 0.08 0.00 0.00 0.00 0.00 59.70 59.64 1tnp h MET 3 Cb 1.18 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.77 1tnp h MET 3 CO 0.25 0.53 0.49 0.00 0.00 0.00 0.00 176.91 178.18 1tnp h THR 4 N 0.03 0.20 -0.67 2.22 1.03 -2.07 -2.66 112.91 110.98 1tnp h THR 4 Ca -0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 66.41 66.08 1tnp h THR 4 Cb 0.89 0.58 -0.32 0.00 -1.07 0.00 0.00 68.15 68.23 1tnp h THR 4 CO 0.07 0.00 -0.92 -0.90 -0.01 0.00 0.00 175.52 173.76 1tnp n ASP 5 N -3.33 0.33 -0.02 0.00 5.75 -0.93 -4.91 116.55 113.45 1tnp n ASP 5 Ca 0.05 -2.63 -0.21 0.00 -0.01 0.00 0.00 54.79 51.99 1tnp n ASP 5 Cb 0.62 -0.02 -0.13 0.00 -1.03 0.00 0.00 41.12 40.56 1tnp n ASP 5 CO 0.00 0.00 0.00 -0.61 -0.11 0.00 0.00 177.20 176.48 1tnp h GLN 6 N 2.67 0.19 -0.36 0.11 4.15 -0.95 -3.24 115.11 117.68 1tnp h GLN 6 Ca -0.16 -0.33 0.06 0.00 0.77 0.00 0.00 58.65 59.00 1tnp h GLN 6 Cb 1.22 0.12 -0.06 0.00 0.21 0.00 0.00 27.48 28.97 1tnp h GLN 6 CO 0.31 1.16 -0.00 1.96 -1.93 0.00 0.00 178.83 180.33 1tnp h GLN 7 N -0.40 0.10 -0.03 1.69 1.08 -1.89 -2.24 115.11 113.42 1tnp h GLN 7 Ca -0.32 -0.01 -0.10 0.00 -1.45 0.00 0.00 58.65 56.77 1tnp h GLN 7 Cb 1.69 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 29.09 1tnp h GLN 7 CO 0.01 0.06 -0.44 0.00 -0.95 0.00 0.00 178.83 177.51 1tnp h ALA 8 N 1.32 1.20 -0.78 3.87 0.00 -1.94 -2.94 119.26 119.98 1tnp h ALA 8 Ca 0.18 -0.42 0.15 0.00 0.00 0.00 0.00 54.91 54.82 1tnp h ALA 8 Cb 0.24 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1tnp h ALA 8 CO -0.30 0.58 0.52 1.49 0.00 0.00 0.00 179.25 181.54 1tnp h GLU 9 N 0.06 0.44 0.84 0.00 4.81 -1.42 -2.44 114.58 116.86 1tnp h GLU 9 Ca 0.00 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1tnp h GLU 9 Cb 0.81 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1tnp h GLU 9 CO 0.06 0.29 -0.44 0.00 -0.73 0.00 0.00 179.01 178.19 1tnp h ALA 10 N 1.64 -1.20 0.00 2.92 0.00 -1.52 -2.46 119.26 118.64 1tnp h ALA 10 Ca 0.39 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1tnp h ALA 10 Cb 0.86 0.51 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 1tnp h ALA 10 CO -0.13 -1.18 -0.08 0.00 0.00 0.00 0.00 179.25 177.86 1tnp h ARG 11 N -1.18 0.00 -0.45 0.00 3.08 -1.69 -2.77 114.38 111.37 1tnp h ARG 11 Ca -0.11 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.07 1tnp h ARG 11 Cb 0.92 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.95 1tnp h ARG 11 CO 0.16 0.08 0.34 0.00 -1.07 0.00 0.00 179.97 179.48 1tnp h ALA 12 N 1.92 2.39 -0.67 0.04 0.00 -0.96 -1.66 119.26 120.32 1tnp h ALA 12 Ca -0.00 -0.02 -0.37 0.00 0.00 0.00 0.00 54.91 54.53 1tnp h ALA 12 Cb 0.25 0.03 -0.21 0.00 0.00 0.00 0.00 17.79 17.86 1tnp h ALA 12 CO 0.01 -0.58 0.24 0.34 0.00 0.00 0.00 179.25 179.27 1tnp n PHE 13 N -4.30 2.09 -4.03 0.00 7.35 -1.04 -4.97 117.46 112.55 1tnp n PHE 13 Ca 0.08 -1.84 -0.02 0.00 -0.76 0.00 0.00 57.45 54.91 1tnp n PHE 13 Cb 0.55 -0.74 -0.00 0.00 0.35 0.00 0.00 39.48 39.63 1tnp n PHE 13 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1tnp n LEU 14 N -1.10 0.00 -4.70 -2.13 7.99 -0.62 -5.10 117.00 111.33 1tnp n LEU 14 Ca 0.46 -0.18 -0.26 0.00 -0.01 0.00 0.00 56.01 56.02 1tnp n LEU 14 Cb 1.26 0.05 -0.08 0.00 -0.11 0.00 0.00 43.42 44.54 1tnp n LEU 14 CO 0.41 -0.03 -0.20 -0.44 -1.51 0.00 0.00 177.39 175.62 1tnp s SER 15 N -1.15 4.22 -0.00 -1.43 0.01 -1.26 -5.07 113.70 109.01 1tnp s SER 15 Ca 0.01 -1.23 -0.19 0.00 1.31 0.00 0.00 55.95 55.85 1tnp s SER 15 Cb 0.00 -0.35 -0.30 0.00 0.21 0.00 0.00 66.02 65.58 1tnp s SER 15 CO 0.01 -0.55 0.99 -0.08 0.41 0.00 0.00 173.24 174.02 1tnp h GLU 16 N 1.52 0.43 0.05 12.44 4.81 -2.02 -3.31 114.58 128.49 1tnp h GLU 16 Ca -0.43 -0.63 -0.27 0.00 -0.13 0.00 0.00 59.36 57.90 1tnp h GLU 16 Cb 1.25 0.22 -0.03 0.00 0.63 0.00 0.00 28.75 30.83 1tnp h GLU 16 CO 0.74 1.28 -1.41 1.49 -0.73 0.00 0.00 179.01 180.38 1tnp h GLU 17 N -0.11 0.10 -0.92 1.92 4.81 -2.02 -3.26 114.58 115.10 1tnp h GLU 17 Ca -0.16 -0.17 0.19 0.00 -0.13 0.00 0.00 59.36 59.09 1tnp h GLU 17 Cb 1.71 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 31.08 1tnp h GLU 17 CO 0.18 0.91 0.59 1.98 -0.73 0.00 0.00 179.01 181.95 1tnp h MET 18 N 0.03 0.50 -0.32 1.92 4.05 -1.99 -0.17 114.93 118.96 1tnp h MET 18 Ca -0.18 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.22 1tnp h MET 18 Cb 1.93 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 32.60 1tnp h MET 18 CO 0.13 0.33 0.19 0.82 0.23 0.00 0.00 176.91 178.61 1tnp h ILE 19 N 0.52 1.05 -1.01 1.77 1.08 -1.65 -2.32 117.51 116.95 1tnp h ILE 19 Ca 0.48 -0.14 0.25 0.00 -0.39 0.00 0.00 64.86 65.07 1tnp h ILE 19 Cb 1.04 0.61 -0.08 0.00 -3.07 0.00 0.00 36.82 35.32 1tnp h ILE 19 CO -0.21 0.07 0.66 0.00 -0.69 0.00 0.00 178.15 177.98 1tnp h ALA 20 N 1.14 2.27 -0.07 1.87 0.00 -1.17 -0.43 119.26 122.86 1tnp h ALA 20 Ca 0.12 0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 1tnp h ALA 20 Cb -0.01 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1tnp h ALA 20 CO -0.05 -0.63 -0.75 1.49 0.00 0.00 0.00 179.25 179.30 1tnp h GLU 21 N 0.38 0.63 -0.78 0.00 4.57 -1.43 -3.12 114.58 114.82 1tnp h GLU 21 Ca 0.55 -0.59 0.13 0.00 -1.18 0.00 0.00 59.36 58.27 1tnp h GLU 21 Cb 1.44 0.15 -0.05 0.00 -0.16 0.00 0.00 28.75 30.12 1tnp h GLU 21 CO -0.24 1.20 0.51 0.74 -1.18 0.00 0.00 179.01 180.04 1tnp h PHE 22 N 0.27 0.65 0.01 0.92 0.04 -0.93 -2.51 116.94 115.38 1tnp h PHE 22 Ca -0.08 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.73 1tnp h PHE 22 Cb 1.41 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 39.33 1tnp h PHE 22 CO 0.11 0.27 -0.11 0.87 -0.60 0.00 0.00 178.31 178.85 1tnp h LYS 23 N 0.57 -0.19 -0.76 1.51 1.57 -1.41 -2.64 116.57 115.21 1tnp h LYS 23 Ca 0.38 0.01 0.12 0.00 -1.87 0.00 0.00 60.65 59.30 1tnp h LYS 23 Cb 0.67 0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.93 1tnp h LYS 23 CO -0.14 -0.13 0.36 0.00 -0.57 0.00 0.00 179.45 178.97 1tnp h ALA 24 N 0.76 1.09 -0.53 3.86 0.00 -1.55 -1.92 119.26 120.97 1tnp h ALA 24 Ca 0.04 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1tnp h ALA 24 Cb 0.25 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1tnp h ALA 24 CO -0.11 -0.12 -0.07 0.00 0.00 0.00 0.00 179.25 178.95 1tnp h ALA 25 N 1.51 0.88 -0.31 0.00 0.00 -1.53 -2.91 119.26 116.90 1tnp h ALA 25 Ca 0.40 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1tnp h ALA 25 Cb 0.54 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1tnp h ALA 25 CO -0.34 0.65 -0.01 0.35 0.00 0.00 0.00 179.25 179.90 1tnp h PHE 26 N 0.86 0.49 -0.00 0.00 3.04 -1.06 -2.68 116.94 117.60 1tnp h PHE 26 Ca 0.15 -0.05 -0.12 0.00 3.98 0.00 0.00 57.97 61.93 1tnp h PHE 26 Cb 0.60 -0.14 -0.02 0.00 2.56 0.00 0.00 35.95 38.95 1tnp h PHE 26 CO 0.04 0.49 -0.58 0.22 -2.02 0.00 0.00 178.31 176.46 1tnp h ASP 27 N 0.46 0.00 -0.83 0.41 3.58 -1.29 -2.90 116.42 115.85 1tnp h ASP 27 Ca 0.10 -0.00 0.20 0.00 0.42 0.00 0.00 57.03 57.75 1tnp h ASP 27 Cb 0.31 -0.00 -0.12 0.00 1.72 0.00 0.00 39.33 41.24 1tnp h ASP 27 CO 0.01 0.58 0.26 0.24 -2.88 0.00 0.00 179.24 177.45 1tnp h MET 28 N 0.00 0.29 0.00 0.28 2.86 -1.45 -1.61 114.93 115.30 1tnp h MET 28 Ca -0.01 -0.02 -0.32 0.00 -2.06 0.00 0.00 59.70 57.29 1tnp h MET 28 Cb 1.03 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.56 1tnp h MET 28 CO 0.08 0.19 -1.97 1.19 1.06 0.00 0.00 176.91 177.46 1tnp n PHE 29 N -5.14 0.64 -2.12 -0.22 3.01 -1.22 -4.93 117.46 107.48 1tnp n PHE 29 Ca 0.19 0.23 -0.41 0.00 1.01 0.00 0.00 57.45 58.46 1tnp n PHE 29 Cb 0.58 -1.12 -0.03 0.00 -0.01 0.00 0.00 39.48 38.91 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 -5.91 6.78 0.00 4.37 -1.08 -0.61 -4.98 116.67 115.24 1tnp s ASP 30 Ca -0.07 2.52 0.00 0.00 -0.52 0.00 0.00 52.55 54.48 1tnp s ASP 30 Cb 0.07 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.92 1tnp s ASP 30 CO 0.82 -0.61 0.01 0.00 0.52 0.00 0.00 175.17 175.90 1tnp n ALA 31 N 2.56 0.00 -0.06 3.66 0.00 -1.26 -4.86 120.51 120.54 1tnp n ALA 31 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.48 1tnp n ALA 31 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.85 1tnp n ALA 31 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1tnp h ASP 32 N 0.00 0.00 0.00 0.00 3.58 -1.96 -3.51 116.42 114.52 1tnp h ASP 32 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1tnp h ASP 32 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1tnp h ASP 32 CO 0.00 0.63 0.00 0.61 -2.88 0.00 0.00 179.24 177.60 1tnp n GLY 33 N 1.67 -2.25 2.24 -0.78 0.00 -1.26 -5.02 105.19 99.80 1tnp n GLY 33 Ca -0.05 0.73 -0.16 0.00 0.00 0.00 0.00 46.02 46.54 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 0.00 1.24 2.90 -0.02 0.00 -1.26 -2.99 105.19 105.06 1tnp n GLY 34 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.37 -0.48 3.66 -0.02 0.00 -1.26 -4.83 105.19 101.88 1tnp n GLY 35 Ca -0.16 0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.26 -0.27 0.00 1.61 1.47 -1.16 -4.13 116.67 111.93 1tnp s ASP 36 Ca 0.17 -0.27 0.00 0.00 1.18 0.00 0.00 52.55 53.63 1tnp s ASP 36 Cb -0.10 0.48 0.00 0.00 -0.34 0.00 0.00 42.92 42.97 1tnp s ASP 36 CO 0.21 -0.85 0.00 2.30 0.68 0.00 0.00 175.17 177.50 1tnp n ILE 37 N -0.39 0.00 -2.64 2.11 -5.35 -1.04 -4.90 119.36 107.15 1tnp n ILE 37 Ca -0.07 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.05 1tnp n ILE 37 Cb 0.61 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 38.46 1tnp n ILE 37 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1tnp s SER 38 N -0.44 6.81 0.16 7.28 0.15 -1.26 -4.00 113.70 122.41 1tnp s SER 38 Ca 0.00 1.91 0.05 0.00 0.70 0.00 0.00 55.95 58.61 1tnp s SER 38 Cb 0.00 -2.57 -0.02 0.00 -1.71 0.00 0.00 66.02 61.72 1tnp s SER 38 CO 0.00 -0.45 1.38 0.71 1.20 0.00 0.00 173.24 176.08 1tnp h THR 39 N 2.09 1.55 -0.01 6.45 1.35 -1.92 -2.46 112.91 119.96 1tnp h THR 39 Ca -0.48 -2.78 -0.20 0.00 -0.55 0.00 0.00 66.41 62.39 1tnp h THR 39 Cb 1.20 2.54 -0.01 0.00 -1.73 0.00 0.00 68.15 70.16 1tnp h THR 39 CO 0.62 0.80 -0.88 0.11 -0.25 0.00 0.00 175.52 175.92 1tnp h LYS 40 N 0.06 0.29 0.00 4.72 1.79 -1.98 -3.29 116.57 118.16 1tnp h LYS 40 Ca -0.03 -0.30 -0.20 0.00 -2.18 0.00 0.00 60.65 57.93 1tnp h LYS 40 Cb 1.54 0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 32.24 1tnp h LYS 40 CO 0.13 1.00 -1.27 0.93 -1.08 0.00 0.00 179.45 179.16 1tnp h GLU 41 N 0.17 0.00 -0.99 3.15 3.07 -1.98 -3.39 114.58 114.62 1tnp h GLU 41 Ca -0.05 0.00 0.24 0.00 -0.50 0.00 0.00 59.36 59.05 1tnp h GLU 41 Cb 1.50 0.00 -0.18 0.00 -0.84 0.00 0.00 28.75 29.23 1tnp h GLU 41 CO 0.14 0.51 -0.08 1.25 -1.40 0.00 0.00 179.01 179.43 1tnp h LEU 42 N 0.00 -0.66 -0.28 1.33 5.85 -1.51 0.41 115.31 120.46 1tnp h LEU 42 Ca -0.14 0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 1tnp h LEU 42 Cb 1.71 0.54 -0.01 0.00 0.37 0.00 0.00 40.66 43.26 1tnp h LEU 42 CO 0.07 -0.34 0.07 1.23 -0.34 0.00 0.00 178.44 179.13 1tnp h GLY 43 N 0.00 0.49 0.13 3.75 0.00 -1.79 -1.97 103.07 103.70 1tnp h GLY 43 Ca 0.55 -0.31 0.21 0.00 0.00 0.00 0.00 47.33 47.78 1tnp h GLY 43 CO -0.96 0.29 0.73 -0.84 0.00 0.00 0.00 176.54 175.76 1tnp h THR 44 N 0.29 0.28 0.08 4.70 2.02 -0.43 0.36 112.91 120.22 1tnp h THR 44 Ca 0.09 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.26 1tnp h THR 44 Cb 0.30 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1tnp h THR 44 CO 0.00 0.00 -0.04 0.58 0.37 0.00 0.00 175.52 176.43 1tnp h VAL 45 N 0.00 1.17 -0.23 3.16 2.07 -0.74 -2.06 116.25 119.62 1tnp h VAL 45 Ca 0.35 -1.18 0.07 0.00 0.82 0.00 0.00 66.70 66.75 1tnp h VAL 45 Cb 1.80 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 33.47 1tnp h VAL 45 CO -0.00 0.28 0.20 0.24 0.02 0.00 0.00 177.57 178.31 1tnp h MET 46 N -0.68 0.00 0.04 1.57 2.86 -0.16 -2.27 114.93 116.29 1tnp h MET 46 Ca -0.01 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.28 1tnp h MET 46 Cb 0.54 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.16 1tnp h MET 46 CO 0.02 0.00 -2.03 -2.13 1.06 0.00 0.00 176.91 173.83 1tnp n ARG 47 N -4.08 0.69 0.00 1.72 0.63 -0.86 -4.17 116.66 110.60 1tnp n ARG 47 Ca 0.03 0.22 0.09 0.00 -0.92 0.00 0.00 57.85 57.26 1tnp n ARG 47 Cb 0.34 -1.68 0.47 0.00 0.45 0.00 0.00 32.46 32.04 1tnp n ARG 47 CO 0.00 0.00 0.00 -0.12 -2.51 0.00 0.00 177.63 175.00 1tnp n MET 48 N -3.18 0.37 0.09 -0.14 1.56 -0.78 -1.63 117.12 113.42 1tnp n MET 48 Ca -0.29 0.07 -0.23 0.00 -0.27 0.00 0.00 57.70 56.99 1tnp n MET 48 Cb 1.06 -1.50 -0.15 0.00 2.15 0.00 0.00 33.22 34.78 1tnp n MET 48 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 1tnp h LEU 49 N 0.00 0.65 0.00 -0.89 3.38 -1.71 -3.48 115.31 113.26 1tnp h LEU 49 Ca 0.00 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.08 1tnp h LEU 49 Cb 0.09 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1tnp h LEU 49 CO 0.00 1.74 0.00 0.61 0.09 0.00 0.00 178.44 180.88 1tnp n GLY 50 N 1.81 -0.45 1.08 0.83 0.00 -0.64 -5.19 105.19 102.63 1tnp n GLY 50 Ca -0.22 -0.06 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 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 0.54 0.00 1.61 3.00 -1.05 -5.06 117.38 116.43 1tnp n GLN 51 Ca 0.00 -1.12 0.00 0.00 -0.01 0.00 0.00 57.00 55.88 1tnp n GLN 51 Cb 0.00 0.73 0.00 0.00 0.00 0.00 0.00 30.24 30.97 1tnp n GLN 51 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1tnp n ASN 52 N -2.17 0.65 -3.65 1.08 5.15 -1.26 -4.90 115.26 110.16 1tnp n ASN 52 Ca -0.00 -0.82 -0.44 0.00 -0.60 0.00 0.00 54.58 52.71 1tnp n ASN 52 Cb 0.20 0.42 -0.05 0.00 -0.53 0.00 0.00 39.78 39.82 1tnp n ASN 52 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1tnp n PRO 53 N -0.40 0.00 -2.52 1.20 -0.02 -1.26 -4.97 135.00 127.03 1tnp n PRO 53 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.27 1tnp n PRO 53 Cb 0.02 -1.05 0.11 0.00 -0.02 0.00 0.00 33.50 32.56 1tnp n PRO 53 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1tnp n THR 54 N 0.68 0.00 -0.04 3.45 -1.04 -1.26 -4.97 114.28 111.10 1tnp n THR 54 Ca 0.16 -1.54 -0.21 0.00 -2.04 0.00 0.00 64.05 60.42 1tnp n THR 54 Cb 0.13 -0.88 -0.13 0.00 -1.82 0.00 0.00 70.33 67.63 1tnp n THR 54 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1tnp h LYS 55 N 0.00 0.14 -0.06 -2.82 6.56 -1.98 -2.80 116.57 115.61 1tnp h LYS 55 Ca -0.31 -0.24 -0.04 0.00 -1.06 0.00 0.00 60.65 59.00 1tnp h LYS 55 Cb 1.17 0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 32.91 1tnp h LYS 55 CO 0.34 1.11 -0.15 1.49 -2.06 0.00 0.00 179.45 180.18 1tnp h GLU 56 N -0.57 0.09 0.00 3.15 4.81 -2.01 -1.51 114.58 118.54 1tnp h GLU 56 Ca -0.30 -0.02 -0.19 0.00 -0.13 0.00 0.00 59.36 58.72 1tnp h GLU 56 Cb 1.56 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.89 1tnp h GLU 56 CO -0.04 0.25 -0.98 0.93 -0.73 0.00 0.00 179.01 178.44 1tnp h GLU 57 N 0.09 0.00 -0.37 1.92 4.39 -1.98 -3.28 114.58 115.35 1tnp h GLU 57 Ca 0.02 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 1tnp h GLU 57 Cb 0.33 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.96 1tnp h GLU 57 CO 0.02 0.78 0.05 1.25 -1.16 0.00 0.00 179.01 179.95 1tnp h LEU 58 N 0.00 0.51 -1.16 1.33 7.12 -1.00 -2.27 115.31 119.85 1tnp h LEU 58 Ca -0.05 -0.08 -0.09 0.00 0.13 0.00 0.00 57.88 57.79 1tnp h LEU 58 Cb 1.69 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 41.68 1tnp h LEU 58 CO 0.10 0.55 -0.42 -2.24 -0.13 0.00 0.00 178.44 176.30 1tnp h ASP 59 N 0.54 0.00 -0.21 1.25 3.04 -1.51 -2.42 116.42 117.10 1tnp h ASP 59 Ca 0.12 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 53.85 1tnp h ASP 59 Cb 0.27 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.55 1tnp h ASP 59 CO 0.00 0.42 -0.10 0.00 -2.04 0.00 0.00 179.24 177.52 1tnp h ALA 60 N 1.58 0.30 -1.00 4.15 0.00 -1.53 -3.11 119.26 119.65 1tnp h ALA 60 Ca -0.00 -0.29 0.22 0.00 0.00 0.00 0.00 54.91 54.84 1tnp h ALA 60 Cb 0.75 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.36 1tnp h ALA 60 CO 0.05 0.13 0.62 0.97 0.00 0.00 0.00 179.25 181.03 1tnp h ILE 61 N 0.15 0.62 -0.36 0.00 2.10 -1.14 -0.24 117.51 118.64 1tnp h ILE 61 Ca 0.05 -0.21 0.05 0.00 1.08 0.00 0.00 64.86 65.83 1tnp h ILE 61 Cb 0.58 -0.04 -0.05 0.00 -1.09 0.00 0.00 36.82 36.23 1tnp h ILE 61 CO 0.03 0.11 0.09 0.40 -1.08 0.00 0.00 178.15 177.70 1tnp h ILE 62 N 0.61 0.84 -0.80 2.19 2.04 -1.44 -1.46 117.51 119.49 1tnp h ILE 62 Ca 0.59 -0.08 0.19 0.00 1.00 0.00 0.00 64.86 66.56 1tnp h ILE 62 Cb 1.14 0.60 -0.13 0.00 -0.74 0.00 0.00 36.82 37.69 1tnp h ILE 62 CO -0.37 0.04 0.18 -0.08 0.00 0.00 0.00 178.15 177.92 1tnp h GLU 63 N 0.22 0.22 -0.50 2.37 4.22 -1.13 -0.28 114.58 119.71 1tnp h GLU 63 Ca 0.17 -0.01 -0.12 0.00 0.08 0.00 0.00 59.36 59.48 1tnp h GLU 63 Cb 0.18 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1tnp h GLU 63 CO -0.21 0.14 -0.16 1.49 -2.18 0.00 0.00 179.01 178.09 1tnp h GLU 64 N 0.22 0.99 0.00 1.92 4.57 -1.32 -2.70 114.58 118.26 1tnp h GLU 64 Ca 0.47 -0.40 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 1tnp h GLU 64 Cb 0.87 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.42 1tnp h GLU 64 CO -0.59 1.08 0.00 0.28 -1.18 0.00 0.00 179.01 178.59 1tnp n VAL 65 N -4.15 0.00 -3.24 0.32 0.31 -0.16 -4.21 118.33 107.20 1tnp n VAL 65 Ca 0.00 0.85 -0.45 0.00 -0.01 0.00 0.00 64.34 64.74 1tnp n VAL 65 Cb 0.43 -1.71 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 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 -0.48 5.57 -0.01 4.52 -0.08 -0.93 -4.80 116.55 120.34 1tnp n ASP 66 Ca 0.00 -3.07 -0.10 0.00 -1.51 0.00 0.00 54.79 50.12 1tnp n ASP 66 Cb 0.00 -1.40 -0.08 0.00 2.34 0.00 0.00 41.12 41.99 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 6.57 -0.09 -0.00 -0.67 4.81 -1.65 -3.44 114.58 120.11 1tnp h GLU 67 Ca 0.20 0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.30 1tnp h GLU 67 Cb 0.84 0.02 -0.14 0.00 0.63 0.00 0.00 28.75 30.10 1tnp h GLU 67 CO 1.09 0.44 -0.31 -0.25 -0.73 0.00 0.00 179.01 179.25 1tnp n ASP 68 N -4.79 -1.00 -0.78 1.04 8.00 -1.26 -5.09 116.55 112.67 1tnp n ASP 68 Ca -0.07 -2.03 0.00 0.00 0.71 0.00 0.00 54.79 53.40 1tnp n ASP 68 Cb 0.28 0.33 0.00 0.00 -0.02 0.00 0.00 41.12 41.71 1tnp n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tnp n GLY 69 N -0.18 1.24 7.00 0.44 0.00 -1.26 -5.17 105.19 107.25 1tnp n GLY 69 Ca -0.26 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1tnp n GLY 69 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1tnp n SER 70 N -0.35 -3.36 0.00 1.61 2.88 -1.26 -4.48 113.62 108.67 1tnp n SER 70 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1tnp n SER 70 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1tnp n SER 70 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1tnp n GLY 71 N 0.00 -0.86 0.00 0.46 0.00 -1.26 -5.04 105.19 98.48 1tnp n GLY 71 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.37 1tnp n GLY 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1tnp n THR 72 N -0.46 0.00 -3.88 2.61 -1.04 -1.26 -4.94 114.28 105.31 1tnp n THR 72 Ca 0.00 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.81 1tnp n THR 72 Cb 0.00 -0.39 -0.17 0.00 -1.82 0.00 0.00 70.33 67.95 1tnp n THR 72 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1tnp s ILE 73 N 1.87 0.28 0.52 12.58 -1.16 -1.26 -4.94 121.20 129.09 1tnp s ILE 73 Ca 0.00 0.10 0.08 0.00 -0.51 0.00 0.00 60.65 60.33 1tnp s ILE 73 Cb 0.00 -0.40 0.05 0.00 0.61 0.00 0.00 42.46 42.71 1tnp s ILE 73 CO 0.00 0.20 0.60 -1.81 -2.81 0.00 0.00 174.94 171.13 1tnp s ASP 74 N 1.48 5.07 0.29 4.50 1.11 -1.26 -2.48 116.67 125.38 1tnp s ASP 74 Ca -0.03 -0.86 0.11 0.00 0.18 0.00 0.00 52.55 51.96 1tnp s ASP 74 Cb -0.13 0.04 0.40 0.00 1.07 0.00 0.00 42.92 44.29 1tnp s ASP 74 CO -0.03 -1.09 1.63 0.15 1.18 0.00 0.00 175.17 177.02 1tnp h PHE 75 N 0.52 0.00 0.40 4.23 3.04 -1.99 -2.11 116.94 121.03 1tnp h PHE 75 Ca -0.35 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.58 1tnp h PHE 75 Cb 1.29 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.80 1tnp h PHE 75 CO 0.57 0.59 -0.19 1.05 -2.02 0.00 0.00 178.31 178.30 1tnp h GLU 76 N 0.00 -0.52 -0.90 1.11 4.11 -1.96 -2.40 114.58 114.02 1tnp h GLU 76 Ca -0.01 0.04 0.22 0.00 0.07 0.00 0.00 59.36 59.68 1tnp h GLU 76 Cb 1.06 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 30.37 1tnp h GLU 76 CO 0.08 -0.35 0.61 1.49 0.07 0.00 0.00 179.01 180.90 1tnp h GLU 77 N -0.63 0.28 -0.63 1.06 4.57 -1.96 -1.69 114.58 115.58 1tnp h GLU 77 Ca -0.06 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.10 1tnp h GLU 77 Cb 0.42 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.91 1tnp h GLU 77 CO 0.09 0.19 0.37 0.35 -1.18 0.00 0.00 179.01 178.82 1tnp h PHE 78 N 0.29 0.85 -0.20 0.92 3.57 -1.19 -1.67 116.94 119.51 1tnp h PHE 78 Ca 0.46 -0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.83 1tnp h PHE 78 Cb 1.32 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 1tnp h PHE 78 CO -0.00 0.59 -0.38 -0.07 -2.23 0.00 0.00 178.31 176.22 1tnp h LEU 79 N 0.86 0.47 -1.36 0.59 3.38 -0.80 -2.85 115.31 115.60 1tnp h LEU 79 Ca 0.23 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1tnp h LEU 79 Cb 0.01 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1tnp h LEU 79 CO -0.04 0.81 0.45 0.58 0.09 0.00 0.00 178.44 180.33 1tnp h VAL 80 N 0.38 1.13 -0.02 1.22 2.07 -0.97 -2.03 116.25 118.01 1tnp h VAL 80 Ca 0.04 -0.29 -0.20 0.00 0.82 0.00 0.00 66.70 67.06 1tnp h VAL 80 Cb 0.84 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1tnp h VAL 80 CO 0.07 0.16 -0.85 0.24 0.02 0.00 0.00 177.57 177.20 1tnp h MET 81 N 0.85 0.34 0.30 1.57 2.86 -1.20 -2.86 114.93 116.79 1tnp h MET 81 Ca 0.26 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1tnp h MET 81 Cb -0.00 0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1tnp h MET 81 CO -0.07 1.01 -0.14 0.52 1.06 0.00 0.00 176.91 179.29 1tnp h MET 82 N 0.21 -0.39 -0.81 1.72 2.07 -1.25 -1.91 114.93 114.57 1tnp h MET 82 Ca -0.05 0.03 -0.04 0.00 -2.07 0.00 0.00 59.70 57.56 1tnp h MET 82 Cb 1.46 0.09 -0.04 0.00 -1.87 0.00 0.00 31.60 31.24 1tnp h MET 82 CO 0.14 -0.15 0.34 0.28 1.07 0.00 0.00 176.91 178.59 1tnp h VAL 83 N -0.56 1.26 -0.74 -2.22 2.07 -1.61 -2.32 116.25 112.13 1tnp h VAL 83 Ca -0.04 -0.80 0.09 0.00 0.82 0.00 0.00 66.70 66.77 1tnp h VAL 83 Cb 0.41 0.27 -0.05 0.00 -1.52 0.00 0.00 31.29 30.41 1tnp h VAL 83 CO 0.07 0.33 0.48 0.03 0.02 0.00 0.00 177.57 178.50 1tnp h ARG 84 N 1.17 0.62 0.03 1.57 3.08 -1.28 -2.54 114.38 117.04 1tnp h ARG 84 Ca 0.27 -0.04 -0.18 0.00 0.07 0.00 0.00 59.98 60.10 1tnp h ARG 84 Cb 0.19 -0.14 0.02 0.00 0.08 0.00 0.00 29.97 30.12 1tnp h ARG 84 CO -0.03 0.41 -0.72 0.37 -1.07 0.00 0.00 179.97 178.93 1tnp h GLN 85 N 0.64 0.43 -0.77 0.04 5.75 -0.81 -3.27 115.11 117.13 1tnp h GLN 85 Ca 0.34 -0.51 0.19 0.00 -0.15 0.00 0.00 58.65 58.52 1tnp h GLN 85 Cb 0.46 0.15 -0.04 0.00 1.07 0.00 0.00 27.48 29.12 1tnp h GLN 85 CO -0.12 1.17 0.53 0.52 -2.65 0.00 0.00 178.83 178.28 1tnp h MET 86 N -0.08 0.22 0.33 1.69 2.86 -1.11 -2.21 114.93 116.64 1tnp h MET 86 Ca -0.10 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1tnp h MET 86 Cb 1.45 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 33.06 1tnp h MET 86 CO 0.14 0.15 -0.16 -0.22 1.06 0.00 0.00 176.91 177.88 1tnp h LYS 87 N 0.23 -0.43 -7.40 1.72 3.64 -1.59 -3.44 116.57 109.28 1tnp h LYS 87 Ca 0.38 0.03 -0.41 0.00 -1.27 0.00 0.00 60.65 59.38 1tnp h LYS 87 Cb 1.15 0.10 0.20 0.00 -0.41 0.00 0.00 32.23 33.27 1tnp h LYS 87 CO -0.08 -0.29 0.13 -2.00 -2.27 0.00 0.00 179.45 174.94 1tnp s GLU 88 N -3.31 -1.43 -1.56 1.90 2.12 -0.83 -4.14 118.70 111.46 1tnp s GLU 88 Ca -0.07 -0.15 -0.12 0.00 0.36 0.00 0.00 54.97 54.99 1tnp s GLU 88 Cb 0.01 -1.58 0.09 0.00 0.26 0.00 0.00 34.13 32.91 1tnp s GLU 88 CO 0.20 -3.83 0.81 -0.25 -0.54 0.00 0.00 175.26 171.64 1tnp n ASP 89 N -4.83 -3.30 0.00 -1.70 8.00 -1.26 -4.91 116.55 108.55 1tnp n ASP 89 Ca 0.14 -0.90 0.15 0.00 0.71 0.00 0.00 54.79 54.89 1tnp n ASP 89 Cb 0.60 -3.38 0.88 0.00 -0.02 0.00 0.00 41.12 39.19 1tnp n ASP 89 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81