#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 0.36 -0.46 2.03 -1.32 -1.26 -3.73 115.64 111.27 1sb6 s THR 2 Ca 0.00 0.10 -0.09 0.00 -1.21 0.00 0.00 61.69 60.49 1sb6 s THR 2 Cb 0.00 -0.50 0.11 0.00 -1.51 0.00 0.00 72.50 70.60 1sb6 s THR 2 CO 0.00 0.24 0.32 -0.63 -2.21 0.00 0.00 174.62 172.34 1sb6 s ILE 3 N 1.76 4.17 -0.31 5.08 1.09 0.53 -4.98 121.20 128.55 1sb6 s ILE 3 Ca 0.02 -1.70 -0.14 0.00 -1.10 0.00 0.00 60.65 57.72 1sb6 s ILE 3 Cb -0.13 -3.71 -0.03 0.00 -1.06 0.00 0.00 42.46 37.54 1sb6 s ILE 3 CO -0.04 -0.71 0.32 -1.58 -0.10 0.00 0.00 174.94 172.83 1sb6 s GLN 4 N 1.37 3.75 0.36 2.79 0.74 -1.26 -1.03 119.66 126.38 1sb6 s GLN 4 Ca 0.05 -0.30 0.09 0.00 0.05 0.00 0.00 55.36 55.25 1sb6 s GLN 4 Cb -0.25 -3.74 -0.06 0.00 1.10 0.00 0.00 33.01 30.06 1sb6 s GLN 4 CO -0.00 -0.39 -0.02 -0.51 -0.55 0.00 0.00 175.29 173.83 1sb6 s LEU 5 N 1.95 2.88 -0.23 3.68 1.02 -0.41 -4.99 118.68 122.57 1sb6 s LEU 5 Ca 0.11 -1.16 -0.01 0.00 0.02 0.00 0.00 54.13 53.09 1sb6 s LEU 5 Cb -0.16 -1.13 0.02 0.00 0.02 0.00 0.00 46.19 44.95 1sb6 s LEU 5 CO 0.11 -0.30 -0.10 -0.89 0.02 0.00 0.00 176.35 175.19 1sb6 s THR 6 N -2.60 2.65 -0.74 5.49 2.01 0.15 -1.16 115.64 121.44 1sb6 s THR 6 Ca 0.34 -1.02 0.01 0.00 0.31 0.00 0.00 61.69 61.34 1sb6 s THR 6 Cb 0.03 -2.30 0.18 0.00 0.01 0.00 0.00 72.50 70.42 1sb6 s THR 6 CO 0.18 0.28 0.56 0.54 -0.69 0.00 0.00 174.62 175.49 1sb6 s VAL 7 N 1.31 3.50 0.50 3.82 0.11 -0.54 -1.34 120.40 127.76 1sb6 s VAL 7 Ca 0.01 -3.85 0.18 0.00 -2.93 0.00 0.00 61.98 55.39 1sb6 s VAL 7 Cb -0.16 -3.25 0.25 0.00 -1.53 0.00 0.00 36.38 31.70 1sb6 s VAL 7 CO -0.06 -0.99 2.11 1.55 -3.33 0.00 0.00 175.10 174.37 1sb6 h PRO 8 N 5.96 0.00 -0.55 1.54 0.13 -1.78 -1.27 132.00 136.04 1sb6 h PRO 8 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1sb6 h PRO 8 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1sb6 h PRO 8 CO 0.76 0.06 0.00 -2.37 -0.23 0.00 0.00 178.00 176.23 1sb6 n THR 9 N -4.33 0.46 -1.54 1.56 5.66 -1.26 -4.94 114.28 109.87 1sb6 n THR 9 Ca -0.03 -0.29 -0.44 0.00 -3.05 0.00 0.00 64.05 60.25 1sb6 n THR 9 Cb 0.15 -0.17 -0.01 0.00 -1.55 0.00 0.00 70.33 68.75 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 0.09 2.03 -1.46 1.09 5.41 -0.48 -1.18 119.36 124.86 1sb6 n ILE 10 Ca 0.06 -0.50 -0.16 0.00 1.00 0.00 0.00 62.75 63.15 1sb6 n ILE 10 Cb 0.32 -0.83 -0.07 0.00 -0.71 0.00 0.00 39.64 38.35 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 -0.17 -0.25 -2.88 -1.39 0.00 -1.26 -4.84 120.51 109.72 1sb6 n ALA 11 Ca 0.11 0.26 -0.18 0.00 0.00 0.00 0.00 53.44 53.64 1sb6 n ALA 11 Cb 0.34 -1.78 -0.01 0.00 0.00 0.00 0.00 19.45 18.01 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 -0.02 0.00 -1.47 0.00 0.00 -1.26 -4.95 120.64 112.94 1sb6 n GLU 13 Ca 0.22 0.00 -0.19 0.00 0.00 0.00 0.00 57.16 57.20 1sb6 n GLU 13 Cb 0.67 0.00 0.09 0.00 0.00 0.00 0.00 31.44 32.21 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 4.98 -0.54 4.31 0.00 -1.26 -5.05 120.51 119.95 1sb6 n ALA 14 Ca 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 53.44 49.91 1sb6 n ALA 14 Cb 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 18.75 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 0.50 0.69 -1.20 0.00 0.00 -1.95 0.95 119.26 118.26 1sb6 h ALA 16 Ca 0.00 0.24 0.35 0.00 0.00 0.00 0.00 54.91 55.50 1sb6 h ALA 16 Cb 0.04 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 1sb6 h ALA 16 CO 0.00 -0.42 1.02 0.93 0.00 0.00 0.00 179.25 180.79 1sb6 h GLU 17 N 0.08 0.00 -0.83 0.00 5.08 -1.99 0.96 114.58 117.88 1sb6 h GLU 17 Ca 0.38 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.95 1sb6 h GLU 17 Cb 0.65 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.77 1sb6 h GLU 17 CO -0.66 0.00 0.18 0.00 -1.00 0.00 0.00 179.01 177.53 1sb6 h ALA 18 N 1.08 1.12 0.10 3.43 0.00 -0.96 0.11 119.26 124.14 1sb6 h ALA 18 Ca 0.57 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.69 1sb6 h ALA 18 Cb 2.61 0.32 0.00 0.00 0.00 0.00 0.00 17.79 20.72 1sb6 h ALA 18 CO -0.01 -0.43 -0.05 -0.24 0.00 0.00 0.00 179.25 178.53 1sb6 h VAL 19 N 0.20 1.08 -0.60 0.00 3.04 -1.00 -3.16 116.25 115.81 1sb6 h VAL 19 Ca 0.50 -0.77 0.12 0.00 -1.01 0.00 0.00 66.70 65.54 1sb6 h VAL 19 Cb 0.96 1.57 -0.12 0.00 -2.01 0.00 0.00 31.29 31.69 1sb6 h VAL 19 CO -0.63 0.18 -0.19 0.74 -1.01 0.00 0.00 177.57 176.67 1sb6 h THR 20 N -0.50 0.34 -0.45 3.17 2.02 -1.20 0.16 112.91 116.46 1sb6 h THR 20 Ca -0.01 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.22 1sb6 h THR 20 Cb 0.41 0.34 -0.05 0.00 -1.74 0.00 0.00 68.15 67.12 1sb6 h THR 20 CO 0.02 0.00 0.19 0.11 0.37 0.00 0.00 175.52 176.21 1sb6 h LYS 21 N -0.04 0.37 -0.19 6.66 1.79 -0.92 0.21 116.57 124.45 1sb6 h LYS 21 Ca 0.28 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.70 1sb6 h LYS 21 Cb 0.47 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1sb6 h LYS 21 CO -0.64 0.24 -0.01 0.00 -1.08 0.00 0.00 179.45 177.97 1sb6 h ALA 22 N 1.27 0.26 -0.77 3.86 0.00 -0.99 0.55 119.26 123.43 1sb6 h ALA 22 Ca 0.21 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1sb6 h ALA 22 Cb 0.17 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1sb6 h ALA 22 CO -0.18 -0.02 0.51 0.28 0.00 0.00 0.00 179.25 179.84 1sb6 h VAL 23 N 0.09 1.17 0.00 0.00 2.07 -0.39 -0.45 116.25 118.74 1sb6 h VAL 23 Ca 0.05 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.17 1sb6 h VAL 23 Cb 0.41 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1sb6 h VAL 23 CO 0.01 0.19 -0.24 1.56 0.02 0.00 0.00 177.57 179.11 1sb6 h GLN 24 N 1.02 0.00 0.39 1.57 1.08 -0.40 0.42 115.11 119.18 1sb6 h GLN 24 Ca 0.29 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.47 1sb6 h GLN 24 Cb -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 1sb6 h GLN 24 CO -0.08 0.24 -0.19 -0.91 -0.95 0.00 0.00 178.83 176.94 1sb6 h ASN 25 N 0.00 -0.44 0.24 1.46 2.35 0.74 -3.15 115.58 116.78 1sb6 h ASN 25 Ca -0.00 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.61 1sb6 h ASN 25 Cb 0.72 0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.21 1sb6 h ASN 25 CO 0.03 -0.08 -0.11 -0.33 -1.65 0.00 0.00 177.43 175.29 1sb6 h GLU 26 N -0.84 -0.31 -2.98 0.81 4.39 -1.29 -3.38 114.58 110.99 1sb6 h GLU 26 Ca -0.05 0.02 -0.78 0.00 0.34 0.00 0.00 59.36 58.89 1sb6 h GLU 26 Cb 0.54 0.07 -0.21 0.00 -0.10 0.00 0.00 28.75 29.05 1sb6 h GLU 26 CO 0.09 -0.20 1.56 -3.47 -1.16 0.00 0.00 179.01 175.82 1sb6 n ASP 27 N -4.01 6.35 0.23 1.42 -0.08 0.15 -4.81 116.55 115.80 1sb6 n ASP 27 Ca -0.04 -3.30 0.07 0.00 -1.51 0.00 0.00 54.79 50.02 1sb6 n ASP 27 Cb 0.13 -1.35 0.56 0.00 2.34 0.00 0.00 41.12 42.80 1sb6 n ASP 27 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1sb6 h ALA 28 N 5.23 1.49 0.00 -1.67 0.00 -1.69 0.10 119.26 122.72 1sb6 h ALA 28 Ca 0.40 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1sb6 h ALA 28 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1sb6 h ALA 28 CO 1.45 0.24 0.00 0.00 0.00 0.00 0.00 179.25 180.94 1sb6 n GLN 29 N -4.04 0.64 -2.04 0.00 10.64 -1.26 -4.88 117.38 116.44 1sb6 n GLN 29 Ca -0.02 0.00 -0.29 0.00 -1.83 0.00 0.00 57.00 54.86 1sb6 n GLN 29 Cb 0.27 -1.38 0.04 0.00 -0.86 0.00 0.00 30.24 28.30 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 -2.00 3.04 0.03 2.61 0.00 0.36 -4.91 121.76 120.89 1sb6 s ALA 30 Ca 0.24 -0.40 0.05 0.00 0.00 0.00 0.00 51.96 51.85 1sb6 s ALA 30 Cb 0.11 -2.91 -0.02 0.00 0.00 0.00 0.00 23.12 20.29 1sb6 s ALA 30 CO 0.18 -0.96 -0.15 0.99 0.00 0.00 0.00 175.76 175.83 1sb6 s THR 31 N -3.22 1.17 0.06 0.00 2.01 -0.12 -5.00 115.64 110.54 1sb6 s THR 31 Ca 0.56 -0.97 0.09 0.00 0.31 0.00 0.00 61.69 61.68 1sb6 s THR 31 Cb -0.11 -1.04 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 1sb6 s THR 31 CO 0.50 0.06 -0.25 0.68 -0.69 0.00 0.00 174.62 174.92 1sb6 s VAL 32 N -0.78 2.07 -0.32 3.82 -7.23 -1.26 -0.41 120.40 116.29 1sb6 s VAL 32 Ca 0.03 -1.44 -0.01 0.00 -1.81 0.00 0.00 61.98 58.75 1sb6 s VAL 32 Cb -0.08 -1.79 0.13 0.00 0.56 0.00 0.00 36.38 35.21 1sb6 s VAL 32 CO 0.01 0.27 0.24 -1.10 -0.31 0.00 0.00 175.10 174.21 1sb6 s GLN 33 N -1.41 0.37 -0.17 4.82 -0.21 0.68 -4.98 119.66 118.76 1sb6 s GLN 33 Ca 0.11 -0.62 -0.01 0.00 0.02 0.00 0.00 55.36 54.86 1sb6 s GLN 33 Cb -0.10 -0.96 -0.00 0.00 1.00 0.00 0.00 33.01 32.95 1sb6 s GLN 33 CO 0.03 -1.09 -0.12 0.54 -2.12 0.00 0.00 175.29 172.52 1sb6 s VAL 34 N 1.87 2.86 -1.11 1.09 0.11 -1.26 -0.80 120.40 123.15 1sb6 s VAL 34 Ca 0.12 -0.69 -0.16 0.00 -2.93 0.00 0.00 61.98 58.32 1sb6 s VAL 34 Cb -0.17 -2.23 0.15 0.00 -1.53 0.00 0.00 36.38 32.60 1sb6 s VAL 34 CO -0.23 0.50 1.34 -1.81 -3.33 0.00 0.00 175.10 171.57 1sb6 s ASP 35 N 0.95 6.90 0.64 3.54 1.01 -0.50 -4.79 116.67 124.43 1sb6 s ASP 35 Ca -0.02 -2.62 0.34 0.00 0.71 0.00 0.00 52.55 50.96 1sb6 s ASP 35 Cb -0.15 -2.41 1.87 0.00 1.01 0.00 0.00 42.92 43.24 1sb6 s ASP 35 CO -0.01 -0.88 2.12 -0.07 0.21 0.00 0.00 175.17 176.53 1sb6 h LEU 36 N 10.11 0.00 -1.73 1.23 4.07 -1.97 0.67 115.31 127.69 1sb6 h LEU 36 Ca 0.26 0.00 0.08 0.00 0.08 0.00 0.00 57.88 58.30 1sb6 h LEU 36 Cb 0.93 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.66 1sb6 h LEU 36 CO 1.21 0.00 0.52 0.74 -1.08 0.00 0.00 178.44 179.83 1sb6 h THR 37 N 0.00 0.15 0.00 0.22 2.02 -1.96 -3.43 112.91 109.91 1sb6 h THR 37 Ca 0.04 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.22 1sb6 h THR 37 Cb 0.42 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1sb6 h THR 37 CO -0.00 0.00 0.00 -1.20 0.37 0.00 0.00 175.52 174.69 1sb6 n SER 38 N -3.23 0.00 -2.02 4.18 7.64 0.23 -5.09 113.62 115.33 1sb6 n SER 38 Ca 0.04 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.89 1sb6 n SER 38 Cb 0.64 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.88 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 0.83 -4.94 1.43 2.85 -1.23 -4.91 118.16 112.18 1sb6 n LYS 39 Ca 0.00 -1.42 -0.31 0.00 -1.05 0.00 0.00 58.31 55.53 1sb6 n LYS 39 Cb 0.00 0.22 -0.17 0.00 -0.65 0.00 0.00 35.03 34.43 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 -0.31 2.81 0.04 -1.58 -2.85 -1.26 -1.47 119.74 115.13 1sb6 s LYS 40 Ca 0.09 -0.79 0.07 0.00 -1.00 0.00 0.00 55.97 54.34 1sb6 s LYS 40 Cb 0.27 -2.19 -0.03 0.00 -2.06 0.00 0.00 37.83 33.82 1sb6 s LYS 40 CO -0.08 0.09 -0.18 0.54 0.10 0.00 0.00 175.35 175.82 1sb6 s VAL 41 N 0.55 2.77 -0.06 1.79 0.11 -0.31 -1.40 120.40 123.85 1sb6 s VAL 41 Ca -0.14 -1.19 -0.02 0.00 -2.93 0.00 0.00 61.98 57.70 1sb6 s VAL 41 Cb -0.17 -2.16 0.03 0.00 -1.53 0.00 0.00 36.38 32.55 1sb6 s VAL 41 CO 0.05 0.34 0.04 -0.89 -3.33 0.00 0.00 175.10 171.31 1sb6 s THR 42 N -0.92 0.07 -0.19 5.04 2.01 0.02 -1.29 115.64 120.38 1sb6 s THR 42 Ca 0.14 0.27 -0.05 0.00 0.31 0.00 0.00 61.69 62.37 1sb6 s THR 42 Cb -0.10 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 72.05 1sb6 s THR 42 CO 0.05 0.18 0.01 -0.63 -0.69 0.00 0.00 174.62 173.54 1sb6 s ILE 43 N 2.09 4.13 -0.50 1.82 1.09 -0.20 -0.23 121.20 129.40 1sb6 s ILE 43 Ca 0.05 -0.26 -0.09 0.00 -1.10 0.00 0.00 60.65 59.24 1sb6 s ILE 43 Cb -0.12 -2.85 0.13 0.00 -1.06 0.00 0.00 42.46 38.55 1sb6 s ILE 43 CO -0.04 0.45 0.38 -0.89 -0.10 0.00 0.00 174.94 174.74 1sb6 s THR 44 N 0.74 4.32 0.00 2.92 2.01 0.45 -0.35 115.64 125.73 1sb6 s THR 44 Ca 0.00 -1.88 0.00 0.00 0.31 0.00 0.00 61.69 60.13 1sb6 s THR 44 Cb -0.14 -3.83 0.00 0.00 0.01 0.00 0.00 72.50 68.54 1sb6 s THR 44 CO 0.02 -0.80 0.00 -1.54 -0.69 0.00 0.00 174.62 171.61 1sb6 n SER 45 N 4.80 0.00 0.09 3.53 3.41 -1.24 -0.94 113.62 123.26 1sb6 n SER 45 Ca -0.06 -0.75 -0.23 0.00 -0.26 0.00 0.00 58.87 57.57 1sb6 n SER 45 Cb 0.41 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.21 1sb6 n SER 45 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sb6 h ALA 46 N 1.25 -0.01 0.00 7.33 0.00 -1.92 -3.38 119.26 122.54 1sb6 h ALA 46 Ca 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 54.91 53.95 1sb6 h ALA 46 Cb 0.00 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1sb6 h ALA 46 CO 0.00 0.77 -0.45 1.47 0.00 0.00 0.00 179.25 181.04 1sb6 n LEU 47 N -3.77 2.58 -0.16 0.00 -0.00 -1.26 -4.90 117.00 109.50 1sb6 n LEU 47 Ca -0.20 -3.71 -0.06 0.00 -0.00 0.00 0.00 56.01 52.04 1sb6 n LEU 47 Cb 1.03 -0.49 -0.00 0.00 -0.00 0.00 0.00 43.42 43.95 1sb6 n LEU 47 CO 0.53 1.27 0.64 1.23 -0.00 0.00 0.00 177.39 181.07 1sb6 h GLY 48 N 0.86 -0.15 0.93 1.47 0.00 -1.91 0.92 103.07 105.18 1sb6 h GLY 48 Ca -0.01 0.41 0.01 0.00 0.00 0.00 0.00 47.33 47.74 1sb6 h GLY 48 CO 0.00 -0.21 -0.02 -2.09 0.00 0.00 0.00 176.54 174.22 1sb6 h GLU 49 N -0.20 -0.04 0.34 4.80 4.81 -1.94 0.21 114.58 122.57 1sb6 h GLU 49 Ca 0.21 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 1sb6 h GLU 49 Cb 0.54 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1sb6 h GLU 49 CO -0.61 -0.02 -0.22 0.93 -0.73 0.00 0.00 179.01 178.36 1sb6 h GLU 50 N -0.04 -0.52 0.31 1.92 5.08 -1.73 0.59 114.58 120.19 1sb6 h GLU 50 Ca 0.01 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1sb6 h GLU 50 Cb 0.06 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1sb6 h GLU 50 CO -0.03 -0.35 -0.47 0.37 -1.00 0.00 0.00 179.01 177.54 1sb6 h GLN 51 N -0.54 -0.80 -0.79 2.33 -0.00 -0.64 -2.12 115.11 112.56 1sb6 h GLN 51 Ca -0.03 0.05 0.16 0.00 -0.00 0.00 0.00 58.65 58.83 1sb6 h GLN 51 Cb 0.45 0.18 -0.10 0.00 0.00 0.00 0.00 27.48 28.01 1sb6 h GLN 51 CO 0.03 -0.53 0.31 -0.07 0.00 0.00 0.00 178.83 178.57 1sb6 h LEU 52 N -0.83 0.27 -0.80 -2.39 3.38 -0.50 0.13 115.31 114.56 1sb6 h LEU 52 Ca -0.02 0.12 0.14 0.00 0.09 0.00 0.00 57.88 58.21 1sb6 h LEU 52 Cb 0.78 0.10 -0.14 0.00 0.09 0.00 0.00 40.66 41.49 1sb6 h LEU 52 CO -0.15 0.08 -0.33 -0.09 0.09 0.00 0.00 178.44 178.03 1sb6 h ARG 53 N 0.43 -0.06 0.29 1.13 9.65 -0.19 0.44 114.38 126.07 1sb6 h ARG 53 Ca 0.45 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.32 1sb6 h ARG 53 Cb 0.72 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.32 1sb6 h ARG 53 CO -0.44 -0.04 -0.14 1.15 2.80 0.00 0.00 179.97 183.30 1sb6 h THR 54 N -0.07 0.54 0.42 0.20 2.02 -0.74 -2.87 112.91 112.43 1sb6 h THR 54 Ca 0.31 -0.81 -0.02 0.00 0.77 0.00 0.00 66.41 66.67 1sb6 h THR 54 Cb 0.58 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1sb6 h THR 54 CO -0.84 0.12 -0.24 0.00 0.37 0.00 0.00 175.52 174.94 1sb6 h ALA 55 N -0.55 -0.62 -0.64 6.16 0.00 -0.38 0.20 119.26 123.43 1sb6 h ALA 55 Ca -0.04 -0.13 0.14 0.00 0.00 0.00 0.00 54.91 54.88 1sb6 h ALA 55 Cb 0.51 0.28 -0.11 0.00 0.00 0.00 0.00 17.79 18.47 1sb6 h ALA 55 CO 0.07 -0.85 -0.00 0.82 0.00 0.00 0.00 179.25 179.28 1sb6 h ILE 56 N -0.62 0.46 -0.70 0.00 2.04 -0.30 -0.66 117.51 117.72 1sb6 h ILE 56 Ca -0.05 -0.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.71 1sb6 h ILE 56 Cb 0.50 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 1sb6 h ILE 56 CO 0.07 0.02 0.20 0.00 0.00 0.00 0.00 178.15 178.44 1sb6 h ALA 57 N 1.59 1.03 -0.47 1.87 0.00 -1.17 0.22 119.26 122.32 1sb6 h ALA 57 Ca 0.34 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 55.06 1sb6 h ALA 57 Cb 0.55 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1sb6 h ALA 57 CO -0.56 0.65 0.24 1.03 0.00 0.00 0.00 179.25 180.61 1sb6 h SER 58 N 1.05 0.36 0.38 0.00 0.87 0.75 -2.61 113.55 114.35 1sb6 h SER 58 Ca 0.23 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.79 1sb6 h SER 58 Cb 0.32 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.24 1sb6 h SER 58 CO -0.00 0.25 -0.18 0.00 -0.53 0.00 0.00 176.83 176.36 1sb6 h ALA 59 N 1.25 -0.51 0.00 6.23 0.00 -0.98 -3.49 119.26 121.75 1sb6 h ALA 59 Ca 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1sb6 h ALA 59 Cb 0.10 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1sb6 h ALA 59 CO -0.14 -0.66 0.00 0.41 0.00 0.00 0.00 179.25 178.86 1sb6 n GLY 60 N -0.58 0.74 3.63 0.00 0.00 0.74 -4.95 105.19 104.78 1sb6 n GLY 60 Ca -0.10 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.35 2.98 -1.40 1.61 4.02 -1.08 -5.02 115.29 115.04 1sb6 s HIS 61 Ca 0.00 0.03 -0.08 0.00 1.02 0.00 0.00 55.06 56.03 1sb6 s HIS 61 Cb 0.00 -1.66 -0.02 0.00 -1.02 0.00 0.00 32.58 29.88 1sb6 s HIS 61 CO 0.00 0.40 2.79 0.39 1.02 0.00 0.00 174.74 179.34 1sb6 n GLU 62 N 1.66 3.91 -2.95 1.40 -0.58 -1.26 -4.79 120.64 118.03 1sb6 n GLU 62 Ca -0.16 -2.60 -0.36 0.00 -0.42 0.00 0.00 57.16 53.63 1sb6 n GLU 62 Cb 0.53 -2.68 -0.06 0.00 -0.57 0.00 0.00 31.44 28.65 1sb6 n GLU 62 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1sb6 s VAL 63 N 0.79 4.41 0.00 2.62 1.01 -1.26 -4.45 120.40 123.52 1sb6 s VAL 63 Ca 0.64 1.51 0.00 0.00 0.00 0.00 0.00 61.98 64.12 1sb6 s VAL 63 Cb 0.19 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1sb6 s VAL 63 CO -0.07 0.11 0.40 -0.62 0.00 0.00 0.00 175.10 174.91