#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 2.21 -0.17 2.03 -1.32 -1.26 -1.80 115.64 115.33 1sb6 s THR 2 Ca 0.00 -0.92 -0.03 0.00 -1.21 0.00 0.00 61.69 59.53 1sb6 s THR 2 Cb 0.00 -1.91 -0.02 0.00 -1.51 0.00 0.00 72.50 69.06 1sb6 s THR 2 CO 0.00 0.54 -0.04 -0.63 -2.21 0.00 0.00 174.62 172.27 1sb6 s ILE 3 N 0.97 3.72 -0.42 5.08 -1.09 0.13 -4.97 121.20 124.62 1sb6 s ILE 3 Ca -0.03 -0.41 -0.11 0.00 -2.23 0.00 0.00 60.65 57.87 1sb6 s ILE 3 Cb -0.15 -2.64 0.07 0.00 -1.58 0.00 0.00 42.46 38.16 1sb6 s ILE 3 CO -0.05 0.48 0.28 -1.10 -1.23 0.00 0.00 174.94 173.32 1sb6 s GLN 4 N 0.63 2.73 0.21 2.79 -0.21 -1.26 -0.64 119.66 123.90 1sb6 s GLN 4 Ca -0.03 -1.36 0.04 0.00 0.02 0.00 0.00 55.36 54.03 1sb6 s GLN 4 Cb -0.15 -3.85 -0.03 0.00 1.00 0.00 0.00 33.01 29.98 1sb6 s GLN 4 CO 0.02 -0.92 0.33 -0.51 -2.12 0.00 0.00 175.29 172.09 1sb6 s LEU 5 N 1.50 4.31 -0.18 2.90 1.02 0.40 -4.95 118.68 123.67 1sb6 s LEU 5 Ca 0.03 0.09 -0.03 0.00 0.02 0.00 0.00 54.13 54.25 1sb6 s LEU 5 Cb -0.23 -2.86 -0.01 0.00 0.02 0.00 0.00 46.19 43.11 1sb6 s LEU 5 CO 0.04 -0.03 -0.07 -0.89 0.02 0.00 0.00 176.35 175.42 1sb6 s THR 6 N -1.91 3.35 -0.70 5.49 2.01 -1.26 -1.24 115.64 121.37 1sb6 s THR 6 Ca 0.34 -0.53 0.04 0.00 0.31 0.00 0.00 61.69 61.86 1sb6 s THR 6 Cb -0.10 -2.47 0.17 0.00 0.01 0.00 0.00 72.50 70.11 1sb6 s THR 6 CO 0.29 0.47 0.50 0.54 -0.69 0.00 0.00 174.62 175.73 1sb6 s VAL 7 N 0.89 2.99 0.30 3.82 0.11 -0.06 -2.03 120.40 126.43 1sb6 s VAL 7 Ca -0.02 -4.17 0.17 0.00 -2.93 0.00 0.00 61.98 55.03 1sb6 s VAL 7 Cb -0.15 -2.96 0.14 0.00 -1.53 0.00 0.00 36.38 31.88 1sb6 s VAL 7 CO 0.01 -0.99 1.82 1.55 -3.33 0.00 0.00 175.10 174.16 1sb6 h PRO 8 N 5.54 0.00 0.00 1.54 0.13 -1.78 -3.29 132.00 134.14 1sb6 h PRO 8 Ca 0.13 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.22 1sb6 h PRO 8 Cb 0.77 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 1sb6 h PRO 8 CO 0.73 0.34 -0.23 0.00 -0.23 0.00 0.00 178.00 178.61 1sb6 h THR 9 N 0.00 1.40 -2.87 1.56 1.03 -1.93 -3.49 112.91 108.61 1sb6 h THR 9 Ca -0.00 -2.14 0.00 0.00 -0.01 0.00 0.00 66.41 64.26 1sb6 h THR 9 Cb 0.71 2.74 0.00 0.00 -1.07 0.00 0.00 68.15 70.53 1sb6 h THR 9 CO 0.04 0.48 -0.66 -0.38 -0.01 0.00 0.00 175.52 174.99 1sb6 n ILE 10 N -4.60 -4.58 1.44 0.00 5.41 -1.24 -4.78 119.36 111.01 1sb6 n ILE 10 Ca -0.13 1.87 0.12 0.00 1.00 0.00 0.00 62.75 65.61 1sb6 n ILE 10 Cb 0.46 -2.79 0.69 0.00 -0.71 0.00 0.00 39.64 37.29 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 0.26 2.36 -0.28 -1.39 0.00 -1.26 -4.81 120.51 115.39 1sb6 n ALA 11 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1sb6 n ALA 11 Cb 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.07 1sb6 n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sb6 h GLU 13 N 0.00 -0.14 0.00 0.00 3.07 -2.00 -2.53 114.58 112.97 1sb6 h GLU 13 Ca 0.00 0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 58.81 1sb6 h GLU 13 Cb 0.00 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.93 1sb6 h GLU 13 CO 0.00 -0.09 -0.67 0.00 -1.40 0.00 0.00 179.01 176.85 1sb6 h ALA 14 N 0.86 0.72 -2.43 3.43 0.00 -0.81 -3.51 119.26 117.52 1sb6 h ALA 14 Ca 0.05 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1sb6 h ALA 14 Cb 0.21 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1sb6 h ALA 14 CO -0.12 0.35 -0.60 0.00 0.00 0.00 0.00 179.25 178.88 1sb6 h ALA 16 N 0.85 2.39 0.00 0.00 0.00 -1.89 0.76 119.26 121.37 1sb6 h ALA 16 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1sb6 h ALA 16 Cb 0.15 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1sb6 h ALA 16 CO 0.00 -0.82 0.00 -0.85 0.00 0.00 0.00 179.25 177.58 1sb6 n GLU 17 N -4.59 0.13 -0.29 0.00 -0.00 -1.26 -0.28 120.64 114.35 1sb6 n GLU 17 Ca 0.27 0.62 0.11 0.00 -0.00 0.00 0.00 57.16 58.16 1sb6 n GLU 17 Cb 0.99 -1.92 0.25 0.00 -0.00 0.00 0.00 31.44 30.75 1sb6 n GLU 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1sb6 h ALA 18 N 2.01 1.09 -0.47 -1.84 0.00 -0.98 0.12 119.26 119.19 1sb6 h ALA 18 Ca 0.00 0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1sb6 h ALA 18 Cb 0.01 0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1sb6 h ALA 18 CO 0.00 -0.47 0.30 -0.24 0.00 0.00 0.00 179.25 178.84 1sb6 h VAL 19 N 0.14 1.09 -0.06 0.00 3.04 -0.86 -0.04 116.25 119.56 1sb6 h VAL 19 Ca 0.51 -0.21 0.04 0.00 -1.01 0.00 0.00 66.70 66.04 1sb6 h VAL 19 Cb 1.00 0.43 -0.06 0.00 -2.01 0.00 0.00 31.29 30.66 1sb6 h VAL 19 CO -0.70 0.11 -0.35 0.74 -1.01 0.00 0.00 177.57 176.36 1sb6 h THR 20 N 0.60 0.25 -0.86 3.17 2.02 -0.95 0.19 112.91 117.33 1sb6 h THR 20 Ca 0.18 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.36 1sb6 h THR 20 Cb -0.03 0.25 -0.04 0.00 -1.74 0.00 0.00 68.15 66.59 1sb6 h THR 20 CO -0.06 0.00 0.52 0.11 0.37 0.00 0.00 175.52 176.46 1sb6 h LYS 21 N -0.47 1.17 0.94 6.66 1.57 -0.71 0.89 116.57 126.62 1sb6 h LYS 21 Ca 0.07 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 1sb6 h LYS 21 Cb 0.58 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1sb6 h LYS 21 CO -0.32 0.82 -0.49 0.00 -0.57 0.00 0.00 179.45 178.89 1sb6 h ALA 22 N 1.28 -1.33 -0.77 3.86 0.00 -0.43 -3.00 119.26 118.88 1sb6 h ALA 22 Ca 0.31 -0.28 0.08 0.00 0.00 0.00 0.00 54.91 55.02 1sb6 h ALA 22 Cb -0.05 0.56 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 1sb6 h ALA 22 CO -0.06 -1.26 0.43 0.28 0.00 0.00 0.00 179.25 178.65 1sb6 h VAL 23 N -1.31 0.93 -0.11 0.00 2.07 -0.44 0.12 116.25 117.52 1sb6 h VAL 23 Ca -0.13 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.16 1sb6 h VAL 23 Cb 1.02 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1sb6 h VAL 23 CO 0.18 0.14 0.30 1.56 0.02 0.00 0.00 177.57 179.77 1sb6 h GLN 24 N 0.75 0.00 0.36 1.57 1.08 -0.76 0.28 115.11 118.39 1sb6 h GLN 24 Ca 0.36 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.54 1sb6 h GLN 24 Cb 0.29 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 1sb6 h GLN 24 CO -0.22 0.00 -0.17 -0.91 -0.95 0.00 0.00 178.83 176.58 1sb6 h ASN 25 N 0.00 -0.40 0.34 1.46 2.35 -0.61 -2.99 115.58 115.73 1sb6 h ASN 25 Ca 0.05 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.68 1sb6 h ASN 25 Cb 0.65 0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.13 1sb6 h ASN 25 CO -0.00 -0.12 -0.16 -0.33 -1.65 0.00 0.00 177.43 175.17 1sb6 h GLU 26 N -0.70 -0.44 -2.98 0.81 5.08 -1.31 -3.38 114.58 111.66 1sb6 h GLU 26 Ca -0.05 0.03 -0.79 0.00 -1.00 0.00 0.00 59.36 57.55 1sb6 h GLU 26 Cb 0.49 0.10 -0.24 0.00 0.50 0.00 0.00 28.75 29.60 1sb6 h GLU 26 CO 0.08 -0.22 1.17 -3.47 -1.00 0.00 0.00 179.01 175.57 1sb6 n ASP 27 N -5.08 6.26 0.21 1.42 -0.08 0.87 -4.81 116.55 115.34 1sb6 n ASP 27 Ca -0.07 -3.36 0.15 0.00 -1.51 0.00 0.00 54.79 50.00 1sb6 n ASP 27 Cb 0.22 -1.31 0.65 0.00 2.34 0.00 0.00 41.12 43.02 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 5.36 1.00 -0.55 -1.67 0.00 -1.71 -1.27 119.26 120.42 1sb6 h ALA 28 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1sb6 h ALA 28 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1sb6 h ALA 28 CO 1.40 0.00 0.00 0.00 0.00 0.00 0.00 179.25 180.65 1sb6 n GLN 29 N -2.61 2.45 -1.97 0.00 10.64 -1.26 -4.97 117.38 119.65 1sb6 n GLN 29 Ca 0.00 -2.04 -0.30 0.00 -1.83 0.00 0.00 57.00 52.83 1sb6 n GLN 29 Cb 0.21 -1.49 0.02 0.00 -0.86 0.00 0.00 30.24 28.11 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 -1.36 3.10 0.00 2.61 0.00 -0.48 -4.99 121.76 120.64 1sb6 s ALA 30 Ca 0.38 -0.21 0.08 0.00 0.00 0.00 0.00 51.96 52.21 1sb6 s ALA 30 Cb 0.21 -3.00 -0.02 0.00 0.00 0.00 0.00 23.12 20.30 1sb6 s ALA 30 CO 0.24 -0.75 -0.25 0.99 0.00 0.00 0.00 175.76 175.98 1sb6 s THR 31 N -3.16 2.14 -0.02 0.00 2.01 -0.13 -5.04 115.64 111.43 1sb6 s THR 31 Ca 0.55 -1.20 0.05 0.00 0.31 0.00 0.00 61.69 61.40 1sb6 s THR 31 Cb -0.11 -1.78 -0.01 0.00 0.01 0.00 0.00 72.50 70.61 1sb6 s THR 31 CO 0.52 0.50 -0.18 0.68 -0.69 0.00 0.00 174.62 175.46 1sb6 s VAL 32 N -0.69 1.41 -0.29 3.82 -7.23 -1.26 -0.39 120.40 115.76 1sb6 s VAL 32 Ca 0.11 -0.74 -0.03 0.00 -1.81 0.00 0.00 61.98 59.51 1sb6 s VAL 32 Cb -0.10 -1.18 0.11 0.00 0.56 0.00 0.00 36.38 35.77 1sb6 s VAL 32 CO 0.00 0.40 0.19 -1.10 -0.31 0.00 0.00 175.10 174.29 1sb6 s GLN 33 N -0.27 0.25 -0.10 4.82 -0.21 0.51 -4.97 119.66 119.69 1sb6 s GLN 33 Ca 0.04 -0.42 0.00 0.00 0.02 0.00 0.00 55.36 55.00 1sb6 s GLN 33 Cb -0.08 -0.98 -0.02 0.00 1.00 0.00 0.00 33.01 32.92 1sb6 s GLN 33 CO 0.00 -1.03 -0.10 0.54 -2.12 0.00 0.00 175.29 172.58 1sb6 s VAL 34 N 2.15 3.39 -0.87 1.09 0.11 -1.26 -0.34 120.40 124.67 1sb6 s VAL 34 Ca 0.09 -0.57 -0.17 0.00 -2.93 0.00 0.00 61.98 58.41 1sb6 s VAL 34 Cb -0.15 -2.40 0.17 0.00 -1.53 0.00 0.00 36.38 32.46 1sb6 s VAL 34 CO -0.34 0.55 0.95 -1.81 -3.33 0.00 0.00 175.10 171.12 1sb6 s ASP 35 N -0.22 6.67 -0.86 3.54 1.11 -0.93 -4.93 116.67 121.05 1sb6 s ASP 35 Ca 0.02 -2.29 -0.22 0.00 0.18 0.00 0.00 52.55 50.23 1sb6 s ASP 35 Cb -0.13 -2.31 -0.14 0.00 1.07 0.00 0.00 42.92 41.40 1sb6 s ASP 35 CO 0.03 -0.85 1.92 0.18 1.18 0.00 0.00 175.17 177.62 1sb6 n LEU 36 N 5.43 3.79 0.00 1.23 4.32 -1.26 -2.81 117.00 127.70 1sb6 n LEU 36 Ca 0.18 -2.95 0.00 0.00 -0.02 0.00 0.00 56.01 53.22 1sb6 n LEU 36 Cb 0.48 -1.26 0.00 0.00 -1.62 0.00 0.00 43.42 41.02 1sb6 n LEU 36 CO 0.43 -0.75 0.00 0.41 -1.22 0.00 0.00 177.39 176.27 1sb6 n THR 37 N 6.46 0.00 0.00 -5.08 -1.04 -1.26 -5.12 114.28 108.25 1sb6 n THR 37 Ca 0.48 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.49 1sb6 n THR 37 Cb 0.42 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.93 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 -1.37 0.00 -2.69 8.00 7.64 -1.12 -5.09 113.62 118.99 1sb6 n SER 38 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1sb6 n SER 38 Cb 0.00 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.32 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 1.40 -4.45 1.43 2.85 -1.26 -4.99 118.16 113.14 1sb6 n LYS 39 Ca 0.00 -1.55 -0.22 0.00 -1.05 0.00 0.00 58.31 55.49 1sb6 n LYS 39 Cb 0.00 0.14 -0.16 0.00 -0.65 0.00 0.00 35.03 34.36 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 -0.37 1.23 -0.01 -1.58 -2.85 -1.26 -0.88 119.74 114.02 1sb6 s LYS 40 Ca 0.12 -0.33 0.00 0.00 -1.00 0.00 0.00 55.97 54.77 1sb6 s LYS 40 Cb 0.43 -1.10 0.02 0.00 -2.06 0.00 0.00 37.83 35.12 1sb6 s LYS 40 CO -0.11 0.06 0.01 0.54 0.10 0.00 0.00 175.35 175.95 1sb6 s VAL 41 N 0.46 0.04 -0.22 1.79 0.11 -0.37 -2.18 120.40 120.02 1sb6 s VAL 41 Ca -0.08 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.06 1sb6 s VAL 41 Cb -0.12 -0.11 0.03 0.00 -1.53 0.00 0.00 36.38 34.65 1sb6 s VAL 41 CO 0.02 0.07 -0.13 -0.89 -3.33 0.00 0.00 175.10 170.84 1sb6 s THR 42 N 0.62 2.41 -0.23 5.04 2.01 0.54 -0.46 115.64 125.57 1sb6 s THR 42 Ca -0.05 -1.13 -0.06 0.00 0.31 0.00 0.00 61.69 60.76 1sb6 s THR 42 Cb -0.08 -2.19 -0.02 0.00 0.01 0.00 0.00 72.50 70.22 1sb6 s THR 42 CO -0.02 0.28 0.02 -0.63 -0.69 0.00 0.00 174.62 173.58 1sb6 s ILE 43 N 1.26 3.92 -0.63 1.82 -1.09 0.18 -0.36 121.20 126.30 1sb6 s ILE 43 Ca -0.00 -0.31 -0.12 0.00 -2.23 0.00 0.00 60.65 57.99 1sb6 s ILE 43 Cb -0.16 -2.80 0.16 0.00 -1.58 0.00 0.00 42.46 38.08 1sb6 s ILE 43 CO -0.08 0.39 0.55 -0.89 -1.23 0.00 0.00 174.94 173.68 1sb6 s THR 44 N 1.39 4.93 0.37 2.92 2.01 0.48 -0.70 115.64 127.04 1sb6 s THR 44 Ca 0.05 -2.08 -0.12 0.00 0.31 0.00 0.00 61.69 59.85 1sb6 s THR 44 Cb -0.15 -4.14 0.04 0.00 0.01 0.00 0.00 72.50 68.26 1sb6 s THR 44 CO 0.01 -0.90 0.68 -0.94 -0.69 0.00 0.00 174.62 172.78 1sb6 s SER 45 N 2.54 0.27 -0.10 3.53 1.04 -0.75 -0.96 113.70 119.27 1sb6 s SER 45 Ca 0.10 -1.22 -0.26 0.00 0.48 0.00 0.00 55.95 55.05 1sb6 s SER 45 Cb -0.21 0.79 -0.23 0.00 0.10 0.00 0.00 66.02 66.47 1sb6 s SER 45 CO -0.03 -1.55 0.86 0.00 0.98 0.00 0.00 173.24 173.51 1sb6 h ALA 46 N 2.04 -0.02 -2.12 5.32 0.00 -1.95 -3.29 119.26 119.24 1sb6 h ALA 46 Ca -0.30 -0.39 -0.79 0.00 0.00 0.00 0.00 54.91 53.43 1sb6 h ALA 46 Cb 1.25 0.01 -0.30 0.00 0.00 0.00 0.00 17.79 18.75 1sb6 h ALA 46 CO 0.39 -0.09 0.56 1.47 0.00 0.00 0.00 179.25 181.59 1sb6 n LEU 47 N -4.70 5.93 0.00 0.00 -0.00 -1.26 -4.75 117.00 112.22 1sb6 n LEU 47 Ca -0.09 -5.20 0.00 0.00 -0.00 0.00 0.00 56.01 50.72 1sb6 n LEU 47 Cb 0.38 -1.26 0.00 0.00 -0.00 0.00 0.00 43.42 42.55 1sb6 n LEU 47 CO 0.32 1.65 0.00 0.61 -0.00 0.00 0.00 177.39 179.96 1sb6 n GLY 48 N 1.60 0.70 0.47 1.47 0.00 -1.26 -4.27 105.19 103.90 1sb6 n GLY 48 Ca 0.26 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.65 -0.12 1.61 4.81 -1.95 0.18 114.58 118.47 1sb6 h GLU 49 Ca 0.00 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1sb6 h GLU 49 Cb 0.00 0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.47 1sb6 h GLU 49 CO 0.00 -0.43 -0.21 0.93 -0.73 0.00 0.00 179.01 178.56 1sb6 h GLU 50 N -0.67 -0.26 0.20 1.92 5.08 -1.94 -0.26 114.58 118.64 1sb6 h GLU 50 Ca 0.02 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1sb6 h GLU 50 Cb 0.72 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1sb6 h GLU 50 CO -0.35 -0.18 -0.10 0.37 -1.00 0.00 0.00 179.01 177.76 1sb6 h GLN 51 N -0.27 -0.26 -0.87 2.33 -0.00 -1.56 -2.25 115.11 112.22 1sb6 h GLN 51 Ca 0.10 0.02 0.17 0.00 -0.00 0.00 0.00 58.65 58.94 1sb6 h GLN 51 Cb 0.42 0.06 -0.10 0.00 0.00 0.00 0.00 27.48 27.85 1sb6 h GLN 51 CO -0.28 -0.15 0.44 -0.07 0.00 0.00 0.00 178.83 178.77 1sb6 h LEU 52 N -0.30 0.49 -0.36 -2.39 3.38 -0.46 0.15 115.31 115.82 1sb6 h LEU 52 Ca -0.03 0.11 0.05 0.00 0.09 0.00 0.00 57.88 58.11 1sb6 h LEU 52 Cb 0.23 0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.94 1sb6 h LEU 52 CO 0.05 0.16 -0.50 -0.09 0.09 0.00 0.00 178.44 178.14 1sb6 h ARG 53 N 0.57 -0.39 -0.05 1.13 9.65 -0.43 0.40 114.38 125.26 1sb6 h ARG 53 Ca 0.50 0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 59.40 1sb6 h ARG 53 Cb 0.79 0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 29.46 1sb6 h ARG 53 CO -0.41 -0.26 -0.01 1.15 2.80 0.00 0.00 179.97 183.24 1sb6 h THR 54 N -0.40 1.28 0.81 0.20 2.02 -1.01 -0.21 112.91 115.59 1sb6 h THR 54 Ca 0.09 -0.85 -0.04 0.00 0.77 0.00 0.00 66.41 66.39 1sb6 h THR 54 Cb 0.61 1.75 -0.00 0.00 -1.74 0.00 0.00 68.15 68.77 1sb6 h THR 54 CO -0.56 0.23 -0.49 0.00 0.37 0.00 0.00 175.52 175.07 1sb6 h ALA 55 N 0.68 -1.28 -0.68 6.16 0.00 -0.59 -1.59 119.26 121.96 1sb6 h ALA 55 Ca 0.01 -0.26 0.14 0.00 0.00 0.00 0.00 54.91 54.81 1sb6 h ALA 55 Cb 0.37 0.61 -0.13 0.00 0.00 0.00 0.00 17.79 18.65 1sb6 h ALA 55 CO 0.00 -1.24 -0.13 0.82 0.00 0.00 0.00 179.25 178.71 1sb6 h ILE 56 N -1.22 0.35 -0.47 0.00 1.08 -0.29 0.27 117.51 117.22 1sb6 h ILE 56 Ca -0.11 -0.01 0.14 0.00 -0.39 0.00 0.00 64.86 64.49 1sb6 h ILE 56 Cb 0.98 0.32 -0.02 0.00 -3.07 0.00 0.00 36.82 35.03 1sb6 h ILE 56 CO 0.11 0.00 0.39 0.00 -0.69 0.00 0.00 178.15 177.96 1sb6 h ALA 57 N 1.66 2.34 -0.93 1.87 0.00 -0.45 0.31 119.26 124.05 1sb6 h ALA 57 Ca 0.34 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.32 1sb6 h ALA 57 Cb 0.53 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.28 1sb6 h ALA 57 CO -0.67 -0.63 0.57 1.03 0.00 0.00 0.00 179.25 179.56 1sb6 h SER 58 N 0.00 0.86 0.17 0.00 0.87 0.03 -2.79 113.55 112.69 1sb6 h SER 58 Ca 0.22 0.04 -0.26 0.00 -1.23 0.00 0.00 61.79 60.56 1sb6 h SER 58 Cb 0.99 -0.14 0.02 0.00 -0.44 0.00 0.00 62.40 62.83 1sb6 h SER 58 CO -0.00 0.50 -1.20 0.00 -0.53 0.00 0.00 176.83 175.60 1sb6 h ALA 59 N 1.48 -0.04 -2.06 6.23 0.00 -0.58 -3.50 119.26 120.79 1sb6 h ALA 59 Ca 0.44 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1sb6 h ALA 59 Cb 0.34 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1sb6 h ALA 59 CO -0.23 0.61 0.00 0.41 0.00 0.00 0.00 179.25 180.04 1sb6 n GLY 60 N 1.71 -0.04 3.18 0.00 0.00 0.37 -5.13 105.19 105.29 1sb6 n GLY 60 Ca -0.18 -0.34 -0.20 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.06 1.34 -1.05 1.61 4.02 -1.25 -5.04 115.29 112.85 1sb6 s HIS 61 Ca 0.00 -0.40 -0.07 0.00 1.02 0.00 0.00 55.06 55.61 1sb6 s HIS 61 Cb 0.00 -0.77 -0.04 0.00 -1.02 0.00 0.00 32.58 30.74 1sb6 s HIS 61 CO 0.00 0.07 2.91 0.39 1.02 0.00 0.00 174.74 179.13 1sb6 n GLU 62 N 1.54 3.44 -2.90 1.40 -0.58 -1.26 -4.83 120.64 117.45 1sb6 n GLU 62 Ca -0.19 -2.34 -0.40 0.00 -0.42 0.00 0.00 57.16 53.80 1sb6 n GLU 62 Cb 0.54 -2.50 -0.05 0.00 -0.57 0.00 0.00 31.44 28.87 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 0.35 4.75 -2.12 2.62 1.01 -1.26 -4.45 120.40 121.29 1sb6 s VAL 63 Ca 0.63 1.75 0.31 0.00 0.00 0.00 0.00 61.98 64.67 1sb6 s VAL 63 Cb 0.24 -4.17 0.82 0.00 0.00 0.00 0.00 36.38 33.27 1sb6 s VAL 63 CO -0.08 0.31 2.11 1.21 0.00 0.00 0.00 175.10 178.66