#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sb6 s THR 2 N 0.00 3.54 -0.32 2.03 -1.32 -1.26 -4.51 115.64 113.79 1sb6 s THR 2 Ca 0.00 1.41 -0.10 0.00 -1.21 0.00 0.00 61.69 61.79 1sb6 s THR 2 Cb 0.00 -3.90 -0.00 0.00 -1.51 0.00 0.00 72.50 67.09 1sb6 s THR 2 CO 0.00 0.28 0.17 -0.63 -2.21 0.00 0.00 174.62 172.22 1sb6 s ILE 3 N -0.59 4.62 -0.62 5.08 -1.09 0.43 -4.94 121.20 124.10 1sb6 s ILE 3 Ca 0.49 -0.49 -0.21 0.00 -2.23 0.00 0.00 60.65 58.20 1sb6 s ILE 3 Cb -0.32 -3.40 0.08 0.00 -1.58 0.00 0.00 42.46 37.23 1sb6 s ILE 3 CO 0.39 0.01 0.85 -1.10 -1.23 0.00 0.00 174.94 173.86 1sb6 s GLN 4 N 1.61 3.11 0.35 2.79 -0.21 -1.26 -1.21 119.66 124.84 1sb6 s GLN 4 Ca 0.04 -0.94 0.03 0.00 0.02 0.00 0.00 55.36 54.51 1sb6 s GLN 4 Cb -0.17 -4.21 -0.02 0.00 1.00 0.00 0.00 33.01 29.60 1sb6 s GLN 4 CO 0.06 -1.65 0.52 -0.51 -2.12 0.00 0.00 175.29 171.60 1sb6 s LEU 5 N 3.50 3.97 -0.25 2.90 1.43 -0.26 -4.94 118.68 125.03 1sb6 s LEU 5 Ca 0.19 0.16 0.01 0.00 -1.03 0.00 0.00 54.13 53.46 1sb6 s LEU 5 Cb -0.19 -3.03 0.06 0.00 0.03 0.00 0.00 46.19 43.06 1sb6 s LEU 5 CO 0.10 -0.39 -0.06 -0.89 0.23 0.00 0.00 176.35 175.33 1sb6 s THR 6 N -2.27 1.73 -0.79 5.49 2.01 -1.26 -0.86 115.64 119.68 1sb6 s THR 6 Ca 0.42 -1.39 -0.07 0.00 0.31 0.00 0.00 61.69 60.96 1sb6 s THR 6 Cb -0.10 -1.97 0.20 0.00 0.01 0.00 0.00 72.50 70.65 1sb6 s THR 6 CO 0.34 -0.11 0.68 0.54 -0.69 0.00 0.00 174.62 175.37 1sb6 s VAL 7 N 1.29 4.70 0.45 3.82 0.11 -1.22 -3.92 120.40 125.63 1sb6 s VAL 7 Ca -0.06 -3.00 0.22 0.00 -2.93 0.00 0.00 61.98 56.22 1sb6 s VAL 7 Cb -0.19 -3.95 0.25 0.00 -1.53 0.00 0.00 36.38 30.97 1sb6 s VAL 7 CO -0.06 -1.00 2.06 1.55 -3.33 0.00 0.00 175.10 174.32 1sb6 h PRO 8 N 7.07 0.00 -0.71 1.54 0.13 -1.84 -2.16 132.00 136.03 1sb6 h PRO 8 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1sb6 h PRO 8 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1sb6 h PRO 8 CO 0.78 0.13 0.00 -2.37 -0.23 0.00 0.00 178.00 176.31 1sb6 n THR 9 N -3.94 0.58 -1.28 1.56 5.66 -1.26 -4.93 114.28 110.67 1sb6 n THR 9 Ca -0.02 -0.32 -0.38 0.00 -3.05 0.00 0.00 64.05 60.28 1sb6 n THR 9 Cb 0.22 -0.30 0.04 0.00 -1.55 0.00 0.00 70.33 68.74 1sb6 n THR 9 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 1sb6 n ILE 10 N 0.13 1.04 -1.91 1.09 5.41 -0.81 -2.74 119.36 121.57 1sb6 n ILE 10 Ca 0.07 -0.47 -0.20 0.00 1.00 0.00 0.00 62.75 63.15 1sb6 n ILE 10 Cb 0.40 -0.37 -0.05 0.00 -0.71 0.00 0.00 39.64 38.91 1sb6 n ILE 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1sb6 n ALA 11 N -1.91 -0.42 -0.01 -1.39 0.00 -1.26 -4.91 120.51 110.61 1sb6 n ALA 11 Ca 0.08 0.25 -0.01 0.00 0.00 0.00 0.00 53.44 53.77 1sb6 n ALA 11 Cb 0.49 -2.02 -0.00 0.00 0.00 0.00 0.00 19.45 17.91 1sb6 n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sb6 n GLU 13 N -2.74 0.00 -2.13 0.00 0.00 -1.26 -4.86 120.64 109.65 1sb6 n GLU 13 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 57.16 56.91 1sb6 n GLU 13 Cb 0.05 0.00 0.02 0.00 0.00 0.00 0.00 31.44 31.51 1sb6 n GLU 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1sb6 n ALA 14 N -3.00 4.91 -0.94 4.31 0.00 -1.26 -5.08 120.51 119.45 1sb6 n ALA 14 Ca 0.00 -3.82 0.06 0.00 0.00 0.00 0.00 53.44 49.68 1sb6 n ALA 14 Cb 0.00 -0.38 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 1sb6 n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sb6 h ALA 16 N -0.43 2.46 -0.32 0.00 0.00 -1.94 0.13 119.26 119.16 1sb6 h ALA 16 Ca -0.07 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.92 1sb6 h ALA 16 Cb 0.74 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1sb6 h ALA 16 CO 0.03 -0.66 0.36 1.05 0.00 0.00 0.00 179.25 180.03 1sb6 h GLU 17 N 0.13 0.00 -0.59 0.00 4.11 -1.99 0.65 114.58 116.89 1sb6 h GLU 17 Ca 0.34 0.00 0.12 0.00 0.07 0.00 0.00 59.36 59.89 1sb6 h GLU 17 Cb 1.14 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.28 1sb6 h GLU 17 CO -0.05 0.00 -0.19 0.00 0.07 0.00 0.00 179.01 178.84 1sb6 h ALA 18 N 1.58 0.30 -0.15 1.06 0.00 -0.79 0.10 119.26 121.36 1sb6 h ALA 18 Ca 0.15 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1sb6 h ALA 18 Cb 0.88 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1sb6 h ALA 18 CO -0.00 -0.48 0.04 -0.24 0.00 0.00 0.00 179.25 178.57 1sb6 h VAL 19 N -0.05 1.19 -0.68 0.00 3.04 -1.05 -2.39 116.25 116.31 1sb6 h VAL 19 Ca 0.28 -0.58 0.13 0.00 -1.01 0.00 0.00 66.70 65.52 1sb6 h VAL 19 Cb 0.47 1.30 -0.13 0.00 -2.01 0.00 0.00 31.29 30.92 1sb6 h VAL 19 CO -0.63 0.18 -0.22 0.74 -1.01 0.00 0.00 177.57 176.63 1sb6 h THR 20 N 0.05 0.26 -0.20 3.17 2.02 -1.08 0.46 112.91 117.59 1sb6 h THR 20 Ca 0.05 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.17 1sb6 h THR 20 Cb 0.24 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1sb6 h THR 20 CO -0.00 0.00 -0.12 0.11 0.37 0.00 0.00 175.52 175.88 1sb6 h LYS 21 N -0.04 0.32 0.27 6.66 1.57 -0.93 -1.07 116.57 123.34 1sb6 h LYS 21 Ca 0.31 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 1sb6 h LYS 21 Cb 0.53 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1sb6 h LYS 21 CO -0.72 0.45 -0.13 0.00 -0.57 0.00 0.00 179.45 178.48 1sb6 h ALA 22 N 1.58 -0.36 -0.92 3.86 0.00 0.23 -3.27 119.26 120.38 1sb6 h ALA 22 Ca 0.06 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 54.92 1sb6 h ALA 22 Cb 0.40 0.14 -0.09 0.00 0.00 0.00 0.00 17.79 18.23 1sb6 h ALA 22 CO 0.02 -0.45 0.53 0.28 0.00 0.00 0.00 179.25 179.63 1sb6 h VAL 23 N -0.85 0.79 0.00 0.00 2.07 -0.25 0.88 116.25 118.88 1sb6 h VAL 23 Ca -0.04 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1sb6 h VAL 23 Cb 0.51 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1sb6 h VAL 23 CO 0.06 0.14 0.28 1.56 0.02 0.00 0.00 177.57 179.63 1sb6 h GLN 24 N 0.76 0.00 0.08 1.57 1.08 -1.25 0.24 115.11 117.60 1sb6 h GLN 24 Ca 0.49 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.69 1sb6 h GLN 24 Cb 0.64 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.07 1sb6 h GLN 24 CO -0.33 0.00 -0.04 -0.91 -0.95 0.00 0.00 178.83 176.60 1sb6 h ASN 25 N 0.00 -0.09 0.37 1.46 2.35 -0.90 -2.79 115.58 115.97 1sb6 h ASN 25 Ca 0.00 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.47 1sb6 h ASN 25 Cb 0.56 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.96 1sb6 h ASN 25 CO 0.00 0.21 -0.18 -0.33 -1.65 0.00 0.00 177.43 175.49 1sb6 h GLU 26 N -0.41 -0.48 -2.86 0.81 4.39 -0.97 -3.38 114.58 111.69 1sb6 h GLU 26 Ca -0.01 0.03 -0.70 0.00 0.34 0.00 0.00 59.36 59.02 1sb6 h GLU 26 Cb 0.35 0.11 -0.35 0.00 -0.10 0.00 0.00 28.75 28.75 1sb6 h GLU 26 CO 0.02 -0.16 0.00 -3.47 -1.16 0.00 0.00 179.01 174.24 1sb6 n ASP 27 N -5.15 4.69 0.07 1.42 -0.08 0.59 -4.88 116.55 113.22 1sb6 n ASP 27 Ca -0.09 -3.31 0.10 0.00 -1.51 0.00 0.00 54.79 49.98 1sb6 n ASP 27 Cb 0.28 -1.00 0.43 0.00 2.34 0.00 0.00 41.12 43.17 1sb6 n ASP 27 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1sb6 n ALA 28 N 1.58 1.76 -0.39 -1.67 0.00 -1.05 -2.11 120.51 118.64 1sb6 n ALA 28 Ca 0.25 0.02 0.11 0.00 0.00 0.00 0.00 53.44 53.82 1sb6 n ALA 28 Cb 0.37 -1.35 0.33 0.00 0.00 0.00 0.00 19.45 18.81 1sb6 n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sb6 n GLN 29 N -1.93 2.92 -2.86 0.00 10.64 -1.26 -4.99 117.38 119.89 1sb6 n GLN 29 Ca 0.03 -2.68 -0.29 0.00 -1.83 0.00 0.00 57.00 52.22 1sb6 n GLN 29 Cb 0.23 -1.64 -0.03 0.00 -0.86 0.00 0.00 30.24 27.95 1sb6 n GLN 29 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1sb6 s ALA 30 N -1.20 3.39 -0.08 2.61 0.00 -0.90 -5.02 121.76 120.56 1sb6 s ALA 30 Ca 0.49 -0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.16 1sb6 s ALA 30 Cb 0.27 -2.64 -0.02 0.00 0.00 0.00 0.00 23.12 20.73 1sb6 s ALA 30 CO 0.31 -0.05 -0.11 0.99 0.00 0.00 0.00 175.76 176.90 1sb6 s THR 31 N -2.42 3.31 -0.02 0.00 2.01 -0.38 -5.03 115.64 113.11 1sb6 s THR 31 Ca 0.50 -0.61 0.02 0.00 0.31 0.00 0.00 61.69 61.91 1sb6 s THR 31 Cb -0.10 -2.35 0.01 0.00 0.01 0.00 0.00 72.50 70.06 1sb6 s THR 31 CO 0.34 0.57 -0.05 0.68 -0.69 0.00 0.00 174.62 175.46 1sb6 s VAL 32 N -0.39 0.52 -0.05 3.82 -7.23 -1.26 -0.54 120.40 115.27 1sb6 s VAL 32 Ca 0.05 -0.20 -0.02 0.00 -1.81 0.00 0.00 61.98 60.00 1sb6 s VAL 32 Cb -0.12 -0.49 0.03 0.00 0.56 0.00 0.00 36.38 36.36 1sb6 s VAL 32 CO 0.02 0.18 0.08 -1.10 -0.31 0.00 0.00 175.10 173.97 1sb6 s GLN 33 N 0.36 -0.06 -0.11 4.82 -1.52 -0.05 -5.02 119.66 118.08 1sb6 s GLN 33 Ca -0.04 0.41 0.02 0.00 -1.95 0.00 0.00 55.36 53.80 1sb6 s GLN 33 Cb -0.08 -0.46 0.01 0.00 -0.22 0.00 0.00 33.01 32.25 1sb6 s GLN 33 CO -0.00 -0.32 -0.19 0.54 -0.25 0.00 0.00 175.29 175.07 1sb6 s VAL 34 N 2.17 1.73 -1.00 1.09 0.11 -1.26 -0.14 120.40 123.10 1sb6 s VAL 34 Ca 0.04 -0.79 -0.20 0.00 -2.93 0.00 0.00 61.98 58.10 1sb6 s VAL 34 Cb -0.12 -1.54 0.11 0.00 -1.53 0.00 0.00 36.38 33.30 1sb6 s VAL 34 CO -0.03 0.49 1.27 -1.81 -3.33 0.00 0.00 175.10 171.68 1sb6 s ASP 35 N 0.78 6.64 -0.89 3.54 1.11 -0.80 -4.89 116.67 122.15 1sb6 s ASP 35 Ca -0.10 -1.97 -0.10 0.00 0.18 0.00 0.00 52.55 50.56 1sb6 s ASP 35 Cb -0.16 -2.46 -0.08 0.00 1.07 0.00 0.00 42.92 41.30 1sb6 s ASP 35 CO 0.01 -1.17 2.07 0.18 1.18 0.00 0.00 175.17 177.44 1sb6 n LEU 36 N 7.23 4.78 0.00 1.23 4.77 -1.26 -3.12 117.00 130.62 1sb6 n LEU 36 Ca 0.29 -2.93 0.00 0.00 -0.03 0.00 0.00 56.01 53.34 1sb6 n LEU 36 Cb 0.49 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.47 1sb6 n LEU 36 CO 0.57 0.38 0.00 0.41 -1.33 0.00 0.00 177.39 177.42 1sb6 n THR 37 N 4.69 0.00 0.00 -5.08 -1.04 -1.26 -5.11 114.28 106.48 1sb6 n THR 37 Ca 0.46 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.47 1sb6 n THR 37 Cb 0.21 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.71 1sb6 n THR 37 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1sb6 n SER 38 N -1.52 0.00 -2.79 8.00 7.64 -1.18 -5.10 113.62 118.66 1sb6 n SER 38 Ca 0.00 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.78 1sb6 n SER 38 Cb 0.00 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.26 1sb6 n SER 38 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1sb6 n LYS 39 N 0.00 0.90 -3.70 1.43 2.85 -1.26 -4.79 118.16 113.59 1sb6 n LYS 39 Ca 0.00 -2.01 -0.11 0.00 -1.05 0.00 0.00 58.31 55.14 1sb6 n LYS 39 Cb 0.00 -1.26 -0.11 0.00 -0.65 0.00 0.00 35.03 33.01 1sb6 n LYS 39 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 1sb6 s LYS 40 N 0.19 0.35 0.03 -1.58 -2.85 -1.26 -3.41 119.74 111.20 1sb6 s LYS 40 Ca 0.28 0.76 0.02 0.00 -1.00 0.00 0.00 55.97 56.02 1sb6 s LYS 40 Cb 0.26 -0.02 -0.02 0.00 -2.06 0.00 0.00 37.83 35.99 1sb6 s LYS 40 CO -0.14 -0.17 -0.06 0.54 0.10 0.00 0.00 175.35 175.62 1sb6 s VAL 41 N 1.48 0.44 -0.20 1.79 0.11 -0.04 -1.91 120.40 122.07 1sb6 s VAL 41 Ca -0.09 -0.82 -0.03 0.00 -2.93 0.00 0.00 61.98 58.11 1sb6 s VAL 41 Cb -0.09 -0.48 0.06 0.00 -1.53 0.00 0.00 36.38 34.34 1sb6 s VAL 41 CO -0.12 -0.27 0.03 -0.89 -3.33 0.00 0.00 175.10 170.53 1sb6 s THR 42 N -1.05 0.57 -0.18 5.04 2.01 0.80 -1.10 115.64 121.73 1sb6 s THR 42 Ca -0.08 -0.61 -0.04 0.00 0.31 0.00 0.00 61.69 61.27 1sb6 s THR 42 Cb -0.08 -1.08 -0.02 0.00 0.01 0.00 0.00 72.50 71.33 1sb6 s THR 42 CO 0.00 -0.22 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.05 1sb6 s ILE 43 N 1.83 3.79 -0.46 1.82 -1.09 -0.35 -0.87 121.20 125.88 1sb6 s ILE 43 Ca -0.01 -0.38 -0.03 0.00 -2.23 0.00 0.00 60.65 58.01 1sb6 s ILE 43 Cb -0.17 -2.69 0.12 0.00 -1.58 0.00 0.00 42.46 38.14 1sb6 s ILE 43 CO -0.08 0.46 0.26 -0.89 -1.23 0.00 0.00 174.94 173.46 1sb6 s THR 44 N 0.76 3.36 0.36 2.92 2.01 0.30 -0.43 115.64 124.93 1sb6 s THR 44 Ca -0.01 -2.31 -0.09 0.00 0.31 0.00 0.00 61.69 59.59 1sb6 s THR 44 Cb -0.14 -3.28 0.03 0.00 0.01 0.00 0.00 72.50 69.11 1sb6 s THR 44 CO 0.02 -0.74 0.62 -0.94 -0.69 0.00 0.00 174.62 172.89 1sb6 s SER 45 N 1.50 0.48 -0.11 3.53 1.04 -1.26 -1.25 113.70 117.62 1sb6 s SER 45 Ca 0.11 -1.31 -0.15 0.00 0.48 0.00 0.00 55.95 55.08 1sb6 s SER 45 Cb -0.22 0.75 -0.13 0.00 0.10 0.00 0.00 66.02 66.52 1sb6 s SER 45 CO -0.04 -1.47 0.41 0.00 0.98 0.00 0.00 173.24 173.12 1sb6 h ALA 46 N 2.06 -0.02 -1.02 5.32 0.00 -1.96 -3.40 119.26 120.25 1sb6 h ALA 46 Ca -0.30 -0.24 -0.77 0.00 0.00 0.00 0.00 54.91 53.60 1sb6 h ALA 46 Cb 1.24 0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.86 1sb6 h ALA 46 CO 0.39 -0.02 1.84 1.47 0.00 0.00 0.00 179.25 182.92 1sb6 n LEU 47 N -4.72 7.24 0.00 0.00 -0.00 -1.26 -4.57 117.00 113.69 1sb6 n LEU 47 Ca -0.05 -4.93 0.00 0.00 -0.00 0.00 0.00 56.01 51.03 1sb6 n LEU 47 Cb 0.23 -1.36 0.00 0.00 -0.00 0.00 0.00 43.42 42.30 1sb6 n LEU 47 CO 0.17 1.77 0.00 0.61 -0.00 0.00 0.00 177.39 179.95 1sb6 n GLY 48 N 1.77 1.03 0.36 1.47 0.00 -1.26 -4.19 105.19 104.37 1sb6 n GLY 48 Ca 0.47 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.36 1sb6 n GLY 48 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1sb6 h GLU 49 N 0.00 -0.54 -0.05 1.61 4.81 -1.93 0.20 114.58 118.67 1sb6 h GLU 49 Ca 0.00 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 1sb6 h GLU 49 Cb 0.00 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 1sb6 h GLU 49 CO 0.00 -0.36 -0.29 0.93 -0.73 0.00 0.00 179.01 178.56 1sb6 h GLU 50 N -0.57 -0.40 0.08 1.92 5.08 -1.91 0.62 114.58 119.41 1sb6 h GLU 50 Ca 0.04 0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1sb6 h GLU 50 Cb 0.61 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1sb6 h GLU 50 CO -0.23 -0.26 -0.04 0.37 -1.00 0.00 0.00 179.01 177.85 1sb6 h GLN 51 N -0.41 -0.11 -0.72 2.33 -0.00 -1.56 -2.37 115.11 112.28 1sb6 h GLN 51 Ca 0.08 0.01 0.16 0.00 -0.00 0.00 0.00 58.65 58.89 1sb6 h GLN 51 Cb 0.52 0.02 -0.13 0.00 0.00 0.00 0.00 27.48 27.90 1sb6 h GLN 51 CO -0.28 0.11 -0.04 -0.07 0.00 0.00 0.00 178.83 178.55 1sb6 h LEU 52 N -0.32 -0.42 -0.52 -2.39 3.38 -0.51 0.21 115.31 114.74 1sb6 h LEU 52 Ca -0.01 0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.21 1sb6 h LEU 52 Cb 0.27 0.36 -0.09 0.00 0.09 0.00 0.00 40.66 41.29 1sb6 h LEU 52 CO 0.02 -0.19 -0.56 -0.09 0.09 0.00 0.00 178.44 177.71 1sb6 h ARG 53 N 0.08 -0.31 0.13 1.13 9.65 -0.34 0.30 114.38 125.02 1sb6 h ARG 53 Ca 0.38 0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 59.28 1sb6 h ARG 53 Cb 0.65 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.30 1sb6 h ARG 53 CO -0.66 -0.21 -0.06 1.15 2.80 0.00 0.00 179.97 182.99 1sb6 h THR 54 N -0.32 1.00 -0.11 0.20 2.02 -1.09 -1.06 112.91 113.55 1sb6 h THR 54 Ca 0.09 -1.17 0.04 0.00 0.77 0.00 0.00 66.41 66.15 1sb6 h THR 54 Cb 0.56 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.59 1sb6 h THR 54 CO -0.66 0.25 -0.15 0.00 0.37 0.00 0.00 175.52 175.32 1sb6 h ALA 55 N -0.11 -0.09 -0.38 6.16 0.00 -0.56 0.21 119.26 124.50 1sb6 h ALA 55 Ca -0.02 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1sb6 h ALA 55 Cb 0.54 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1sb6 h ALA 55 CO 0.03 -0.61 0.19 0.82 0.00 0.00 0.00 179.25 179.68 1sb6 h ILE 56 N -0.20 0.98 -0.98 0.00 2.04 -0.50 -1.90 117.51 116.95 1sb6 h ILE 56 Ca 0.09 -0.13 0.19 0.00 1.00 0.00 0.00 64.86 66.00 1sb6 h ILE 56 Cb 0.33 0.56 -0.09 0.00 -0.74 0.00 0.00 36.82 36.87 1sb6 h ILE 56 CO -0.23 0.07 0.61 0.00 0.00 0.00 0.00 178.15 178.60 1sb6 h ALA 57 N 1.20 1.82 -0.62 1.87 0.00 -0.17 0.27 119.26 123.62 1sb6 h ALA 57 Ca 0.16 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.22 1sb6 h ALA 57 Cb 0.07 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 1sb6 h ALA 57 CO -0.11 -0.15 0.24 1.03 0.00 0.00 0.00 179.25 180.26 1sb6 h SER 58 N 0.69 0.25 0.00 0.00 0.87 -0.17 -2.46 113.55 112.72 1sb6 h SER 58 Ca 0.54 0.08 -0.22 0.00 -1.23 0.00 0.00 61.79 60.96 1sb6 h SER 58 Cb 0.94 0.05 0.01 0.00 -0.44 0.00 0.00 62.40 62.96 1sb6 h SER 58 CO -0.31 0.14 -0.81 0.00 -0.53 0.00 0.00 176.83 175.32 1sb6 h ALA 59 N 1.42 0.36 -1.89 6.23 0.00 -0.64 -3.49 119.26 121.25 1sb6 h ALA 59 Ca 0.31 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1sb6 h ALA 59 Cb 0.39 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1sb6 h ALA 59 CO -0.31 0.71 0.00 0.41 0.00 0.00 0.00 179.25 180.07 1sb6 n GLY 60 N 0.73 0.40 3.55 0.00 0.00 0.70 -5.05 105.19 105.52 1sb6 n GLY 60 Ca -0.07 -0.43 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 1sb6 n GLY 60 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1sb6 s HIS 61 N -2.63 2.83 -0.35 1.61 4.02 -1.25 -5.01 115.29 114.51 1sb6 s HIS 61 Ca 0.00 -0.07 -0.06 0.00 1.02 0.00 0.00 55.06 55.95 1sb6 s HIS 61 Cb 0.00 -1.63 -0.17 0.00 -1.02 0.00 0.00 32.58 29.75 1sb6 s HIS 61 CO 0.00 0.30 3.35 0.39 1.02 0.00 0.00 174.74 179.80 1sb6 n GLU 62 N 1.96 2.40 -4.20 1.40 -0.58 -1.26 -4.85 120.64 115.50 1sb6 n GLU 62 Ca -0.17 -1.49 -0.36 0.00 -0.42 0.00 0.00 57.16 54.73 1sb6 n GLU 62 Cb 0.53 -2.16 -0.08 0.00 -0.57 0.00 0.00 31.44 29.15 1sb6 n GLU 62 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1sb6 s VAL 63 N 0.52 4.71 -2.40 2.62 0.11 -1.26 -4.42 120.40 120.29 1sb6 s VAL 63 Ca 0.66 -0.09 0.29 0.00 -2.93 0.00 0.00 61.98 59.90 1sb6 s VAL 63 Cb 0.31 -3.01 0.62 0.00 -1.53 0.00 0.00 36.38 32.77 1sb6 s VAL 63 CO -0.05 0.61 1.85 -0.62 -3.33 0.00 0.00 175.10 173.55