#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bd6 s TYR 2 N 0.00 3.51 0.06 0.00 1.51 -1.26 -2.09 117.35 119.08 1bd6 s TYR 2 Ca 0.00 0.73 0.01 0.00 -1.01 0.00 0.00 57.07 56.80 1bd6 s TYR 2 Cb 0.00 -2.38 -0.03 0.00 -0.11 0.00 0.00 41.96 39.43 1bd6 s TYR 2 CO 0.00 0.29 -0.05 0.08 -1.11 0.00 0.00 175.55 174.75 1bd6 s VAL 3 N 0.27 0.41 0.88 0.71 1.01 0.38 -4.61 120.40 119.45 1bd6 s VAL 3 Ca 0.20 -1.49 -0.10 0.00 0.00 0.00 0.00 61.98 60.59 1bd6 s VAL 3 Cb -0.14 -1.10 0.12 0.00 0.00 0.00 0.00 36.38 35.27 1bd6 s VAL 3 CO 0.07 -0.72 1.13 -0.51 0.00 0.00 0.00 175.10 175.08 1bd6 s ILE 4 N -2.73 2.37 0.22 2.22 1.10 -1.26 -0.30 121.20 122.81 1bd6 s ILE 4 Ca -0.00 0.12 -0.00 0.00 -0.51 0.00 0.00 60.65 60.25 1bd6 s ILE 4 Cb -0.01 -2.26 -0.04 0.00 0.15 0.00 0.00 42.46 40.30 1bd6 s ILE 4 CO -0.04 -0.16 0.12 0.42 -2.11 0.00 0.00 174.94 173.17 1bd6 s THR 5 N -2.71 0.14 0.00 4.00 -4.23 -1.01 -4.70 115.64 107.13 1bd6 s THR 5 Ca 0.65 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.16 1bd6 s THR 5 Cb -0.21 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.09 1bd6 s THR 5 CO 0.57 0.00 0.00 1.21 -0.54 0.00 0.00 174.62 175.86 1bd6 n GLU 6 N -0.32 0.00 -0.15 3.99 4.07 -1.26 -2.17 120.64 124.79 1bd6 n GLU 6 Ca 0.02 0.00 0.28 0.00 -0.06 0.00 0.00 57.16 57.39 1bd6 n GLU 6 Cb 0.66 0.00 0.72 0.00 -0.06 0.00 0.00 31.44 32.76 1bd6 n GLU 6 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1bd6 h PRO 7 N 0.00 0.00 0.00 5.31 0.13 -1.98 0.15 132.00 135.62 1bd6 h PRO 7 Ca 0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.06 1bd6 h PRO 7 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1bd6 h PRO 7 CO 0.00 0.00 -0.33 0.00 -0.23 0.00 0.00 178.00 177.44 1bd6 n ILE 9 N -3.56 0.11 0.00 0.00 5.41 0.54 -0.52 119.36 121.35 1bd6 n ILE 9 Ca -0.00 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.73 1bd6 n ILE 9 Cb 0.47 -1.33 0.00 0.00 -0.71 0.00 0.00 39.64 38.07 1bd6 n ILE 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1bd6 n GLY 10 N 3.35 1.17 0.15 7.39 0.00 -1.26 -4.61 105.19 111.38 1bd6 n GLY 10 Ca 0.19 -0.05 -0.05 0.00 0.00 0.00 0.00 46.02 46.11 1bd6 n GLY 10 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1bd6 h THR 11 N 0.00 0.76 0.00 2.61 2.02 -1.56 -3.45 112.91 113.29 1bd6 h THR 11 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1bd6 h THR 11 Cb 0.00 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 1bd6 h THR 11 CO 0.00 0.02 0.00 1.17 0.37 0.00 0.00 175.52 177.08 1bd6 n LYS 12 N -5.16 0.00 -4.10 6.66 0.00 0.32 -4.74 118.16 111.15 1bd6 n LYS 12 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 58.31 58.22 1bd6 n LYS 12 Cb 0.18 -0.08 -0.09 0.00 0.00 0.00 0.00 35.03 35.05 1bd6 n LYS 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1bd6 s ASP 13 N 0.00 0.12 0.02 3.14 1.01 -1.26 -4.28 116.67 115.42 1bd6 s ASP 13 Ca 0.00 -1.16 0.00 0.00 0.71 0.00 0.00 52.55 52.10 1bd6 s ASP 13 Cb 0.00 0.41 0.00 0.00 1.01 0.00 0.00 42.92 44.34 1bd6 s ASP 13 CO 0.00 -0.88 0.00 0.00 0.21 0.00 0.00 175.17 174.50 1bd6 n ALA 14 N -0.24 0.00 -2.23 5.23 0.00 -1.26 -5.03 120.51 116.98 1bd6 n ALA 14 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.32 1bd6 n ALA 14 Cb 0.64 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.00 1bd6 n ALA 14 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1bd6 s SER 15 N -2.00 0.27 -0.04 0.00 0.01 -1.26 -5.11 113.70 105.57 1bd6 s SER 15 Ca 0.00 -1.17 -0.02 0.00 1.31 0.00 0.00 55.95 56.07 1bd6 s SER 15 Cb 0.00 0.32 -0.01 0.00 0.21 0.00 0.00 66.02 66.54 1bd6 s SER 15 CO 0.00 -0.76 -0.04 0.00 0.41 0.00 0.00 173.24 172.86 1bd6 n VAL 17 N -2.89 0.00 0.29 0.00 3.14 -1.26 -1.57 118.33 116.04 1bd6 n VAL 17 Ca -0.02 0.00 0.14 0.00 -2.96 0.00 0.00 64.34 61.50 1bd6 n VAL 17 Cb 0.06 0.00 0.86 0.00 -1.06 0.00 0.00 33.84 33.70 1bd6 n VAL 17 CO 0.00 0.00 0.00 1.05 -6.46 0.00 0.00 176.83 171.42 1bd6 h GLU 18 N 0.00 0.00 0.00 1.45 4.11 -1.97 -2.76 114.58 115.41 1bd6 h GLU 18 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1bd6 h GLU 18 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1bd6 h GLU 18 CO 0.00 0.02 -0.04 -0.39 0.07 0.00 0.00 179.01 178.67 1bd6 h VAL 19 N 0.00 0.12 -3.05 -1.06 -1.51 -1.64 -3.45 116.25 105.65 1bd6 h VAL 19 Ca -0.00 -0.61 -0.56 0.00 -1.23 0.00 0.00 66.70 64.29 1bd6 h VAL 19 Cb 0.05 1.54 -0.04 0.00 -2.13 0.00 0.00 31.29 30.72 1bd6 h VAL 19 CO 0.00 0.04 0.77 0.00 -1.23 0.00 0.00 177.57 177.15 1bd6 h PRO 21 N 7.64 0.30 -0.20 0.00 0.11 -1.92 -0.89 132.00 137.04 1bd6 h PRO 21 Ca -0.27 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 1bd6 h PRO 21 Cb 1.12 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1bd6 h PRO 21 CO 0.93 0.20 -0.04 1.33 -0.21 0.00 0.00 178.00 180.22 1bd6 n VAL 22 N -4.56 2.23 -1.31 3.15 0.24 -1.26 -5.00 118.33 111.82 1bd6 n VAL 22 Ca 0.26 -2.20 -0.00 0.00 -2.04 0.00 0.00 64.34 60.35 1bd6 n VAL 22 Cb 0.96 -0.26 -0.00 0.00 -1.47 0.00 0.00 33.84 33.06 1bd6 n VAL 22 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1bd6 n ASP 23 N -0.89 -0.23 -1.17 -1.34 5.75 -0.34 -4.78 116.55 113.54 1bd6 n ASP 23 Ca 0.22 0.10 -0.04 0.00 -0.01 0.00 0.00 54.79 55.07 1bd6 n ASP 23 Cb 0.85 -0.62 0.04 0.00 -1.03 0.00 0.00 41.12 40.36 1bd6 n ASP 23 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bd6 s ILE 25 N -0.76 5.15 0.02 0.00 1.09 -1.26 -1.47 121.20 123.96 1bd6 s ILE 25 Ca 0.11 0.64 0.03 0.00 -1.10 0.00 0.00 60.65 60.32 1bd6 s ILE 25 Cb 0.09 -3.74 -0.01 0.00 -1.06 0.00 0.00 42.46 37.74 1bd6 s ILE 25 CO 0.02 0.13 -0.08 -1.00 -0.10 0.00 0.00 174.94 173.91 1bd6 s HIS 26 N 2.13 0.73 0.55 3.97 3.76 0.14 -4.97 115.29 121.60 1bd6 s HIS 26 Ca 0.16 -0.27 -0.19 0.00 -0.15 0.00 0.00 55.06 54.61 1bd6 s HIS 26 Cb -0.16 -0.45 -0.06 0.00 1.11 0.00 0.00 32.58 33.03 1bd6 s HIS 26 CO 0.10 -0.02 1.12 -1.21 -0.85 0.00 0.00 174.74 173.88 1bd6 s GLU 27 N -0.76 3.34 0.00 1.40 0.41 -1.26 -0.09 118.70 121.74 1bd6 s GLU 27 Ca -0.01 1.58 0.00 0.00 -0.41 0.00 0.00 54.97 56.13 1bd6 s GLU 27 Cb -0.06 -2.01 0.00 0.00 -1.78 0.00 0.00 34.13 30.29 1bd6 s GLU 27 CO 0.00 -0.85 0.00 0.41 -0.49 0.00 0.00 175.26 174.33 1bd6 n GLY 28 N 0.09 4.10 0.43 -1.39 0.00 -0.06 -4.72 105.19 103.63 1bd6 n GLY 28 Ca 0.11 -1.10 -0.17 0.00 0.00 0.00 0.00 46.02 44.86 1bd6 n GLY 28 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1bd6 h GLU 29 N 0.00 -1.04 0.00 1.61 3.07 -1.97 -3.43 114.58 112.82 1bd6 h GLU 29 Ca 0.00 0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1bd6 h GLU 29 Cb 0.00 0.24 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 1bd6 h GLU 29 CO 0.00 -0.70 0.00 -3.47 -1.40 0.00 0.00 179.01 173.44 1bd6 n ASP 30 N -5.06 0.00 -4.54 1.42 2.03 -1.26 -5.09 116.55 104.05 1bd6 n ASP 30 Ca -0.13 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 54.90 1bd6 n ASP 30 Cb 0.43 -0.19 0.13 0.00 -0.72 0.00 0.00 41.12 40.77 1bd6 n ASP 30 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bd6 s GLN 31 N -0.77 1.39 0.72 -0.67 -2.07 -1.26 -4.90 119.66 112.10 1bd6 s GLN 31 Ca 0.00 -0.35 -0.11 0.00 -1.82 0.00 0.00 55.36 53.07 1bd6 s GLN 31 Cb 0.00 -2.00 0.02 0.00 -1.09 0.00 0.00 33.01 29.94 1bd6 s GLN 31 CO 0.00 -1.87 1.09 0.71 -1.32 0.00 0.00 175.29 173.90 1bd6 s TYR 32 N -3.59 3.23 0.39 9.60 1.51 -1.26 -0.88 117.35 126.35 1bd6 s TYR 32 Ca 0.67 1.10 0.04 0.00 -1.01 0.00 0.00 57.07 57.88 1bd6 s TYR 32 Cb -0.07 -3.05 -0.05 0.00 -0.11 0.00 0.00 41.96 38.69 1bd6 s TYR 32 CO 0.49 -1.27 0.07 0.71 -1.11 0.00 0.00 175.55 174.44 1bd6 s TYR 33 N -3.29 1.96 0.00 2.71 1.51 0.87 -4.74 117.35 116.37 1bd6 s TYR 33 Ca 0.58 -1.02 0.03 0.00 -1.01 0.00 0.00 57.07 55.65 1bd6 s TYR 33 Cb -0.12 -1.35 -0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1bd6 s TYR 33 CO 0.53 -0.00 -0.08 0.42 -1.11 0.00 0.00 175.55 175.30 1bd6 s ILE 34 N -3.14 0.65 -0.54 2.71 1.01 -1.26 -0.69 121.20 119.94 1bd6 s ILE 34 Ca 0.28 -0.44 -0.28 0.00 0.00 0.00 0.00 60.65 60.21 1bd6 s ILE 34 Cb 0.06 -0.57 0.03 0.00 0.01 0.00 0.00 42.46 41.99 1bd6 s ILE 34 CO 0.14 0.12 1.14 -0.62 0.00 0.00 0.00 174.94 175.72 1bd6 s ASP 35 N -0.36 6.50 0.35 3.58 -1.08 -0.54 -4.59 116.67 120.53 1bd6 s ASP 35 Ca 0.02 0.19 0.27 0.00 -0.52 0.00 0.00 52.55 52.51 1bd6 s ASP 35 Cb -0.04 -2.54 0.91 0.00 -1.46 0.00 0.00 42.92 39.79 1bd6 s ASP 35 CO -0.00 -1.37 1.78 -0.65 0.52 0.00 0.00 175.17 175.44 1bd6 h PRO 36 N 9.40 0.00 0.00 4.34 0.11 -1.86 -0.40 132.00 143.59 1bd6 h PRO 36 Ca -0.24 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.66 1bd6 h PRO 36 Cb 1.06 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 1bd6 h PRO 36 CO 1.15 0.00 -1.74 -0.25 -0.21 0.00 0.00 178.00 176.95 1bd6 n ASP 37 N -2.61 0.56 -0.04 -2.05 8.00 -1.26 -3.63 116.55 115.52 1bd6 n ASP 37 Ca 0.03 0.25 -0.14 0.00 0.71 0.00 0.00 54.79 55.64 1bd6 n ASP 37 Cb 0.36 0.55 -0.11 0.00 -0.02 0.00 0.00 41.12 41.90 1bd6 n ASP 37 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1bd6 h VAL 38 N 0.00 1.55 -2.31 2.53 2.07 -1.98 -3.46 116.25 114.65 1bd6 h VAL 38 Ca -0.25 -1.69 -0.61 0.00 0.82 0.00 0.00 66.70 64.97 1bd6 h VAL 38 Cb 1.71 2.66 0.08 0.00 -1.52 0.00 0.00 31.29 34.23 1bd6 h VAL 38 CO 0.04 0.45 0.46 0.00 0.02 0.00 0.00 177.57 178.54 1bd6 n ILE 40 N 1.77 2.08 -3.28 0.00 -6.64 -1.26 -4.74 119.36 107.30 1bd6 n ILE 40 Ca 0.13 -1.06 -0.26 0.00 -1.77 0.00 0.00 62.75 59.80 1bd6 n ILE 40 Cb 0.28 -0.41 0.02 0.00 -1.44 0.00 0.00 39.64 38.09 1bd6 n ILE 40 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 1bd6 n ASP 41 N 0.19 -6.43 -4.49 7.28 8.00 -1.26 -5.01 116.55 114.84 1bd6 n ASP 41 Ca 0.25 0.03 -0.23 0.00 0.71 0.00 0.00 54.79 55.55 1bd6 n ASP 41 Cb 1.01 -3.14 -0.11 0.00 -0.02 0.00 0.00 41.12 38.86 1bd6 n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bd6 n GLY 43 N -0.72 1.48 0.18 0.00 0.00 -1.26 -4.70 105.19 100.17 1bd6 n GLY 43 Ca -0.04 -0.43 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 1bd6 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bd6 h ALA 44 N 2.55 -0.72 -0.66 4.61 0.00 -1.98 -2.83 119.26 120.24 1bd6 h ALA 44 Ca 0.00 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1bd6 h ALA 44 Cb 0.69 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 1bd6 h ALA 44 CO 0.00 -0.69 0.40 0.00 0.00 0.00 0.00 179.25 178.96 1bd6 h GLU 46 N 0.78 -0.04 -0.46 0.00 4.81 -1.84 0.11 114.58 117.94 1bd6 h GLU 46 Ca 0.27 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.39 1bd6 h GLU 46 Cb 0.04 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 1bd6 h GLU 46 CO -0.12 -0.03 -0.17 0.00 -0.73 0.00 0.00 179.01 177.97 1bd6 h ALA 47 N 1.48 0.82 0.04 2.92 0.00 -1.12 -3.27 119.26 120.13 1bd6 h ALA 47 Ca 0.35 -0.36 -0.27 0.00 0.00 0.00 0.00 54.91 54.62 1bd6 h ALA 47 Cb 0.60 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 18.24 1bd6 h ALA 47 CO -0.88 0.65 -1.09 -0.24 0.00 0.00 0.00 179.25 177.69 1bd6 h VAL 48 N 0.79 1.30 -2.66 0.00 3.04 -0.78 -3.46 116.25 114.48 1bd6 h VAL 48 Ca 0.12 -2.35 -0.52 0.00 -1.01 0.00 0.00 66.70 62.93 1bd6 h VAL 48 Cb 0.71 2.48 0.05 0.00 -2.01 0.00 0.00 31.29 32.52 1bd6 h VAL 48 CO 0.05 0.72 1.02 0.00 -1.01 0.00 0.00 177.57 178.35 1bd6 n PRO 50 N 4.67 1.38 -1.70 0.00 -0.02 -1.26 -0.62 135.00 137.44 1bd6 n PRO 50 Ca 0.16 0.49 -0.21 0.00 -2.02 0.00 0.00 63.50 61.92 1bd6 n PRO 50 Cb 0.37 -2.30 -0.08 0.00 -0.02 0.00 0.00 33.50 31.47 1bd6 n PRO 50 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1bd6 n VAL 51 N 5.26 -0.12 -3.85 -1.45 0.31 -1.26 -2.78 118.33 114.45 1bd6 n VAL 51 Ca 0.29 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.33 1bd6 n VAL 51 Cb 0.19 -2.11 0.01 0.00 -0.91 0.00 0.00 33.84 31.01 1bd6 n VAL 51 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1bd6 n SER 52 N -1.45 -2.54 -0.21 4.52 7.64 0.21 -4.86 113.62 116.93 1bd6 n SER 52 Ca -0.21 -1.03 0.18 0.00 1.01 0.00 0.00 58.87 58.82 1bd6 n SER 52 Cb 0.69 -3.11 0.52 0.00 -1.01 0.00 0.00 64.21 61.30 1bd6 n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bd6 h ALA 53 N 0.89 2.19 -1.80 -0.43 0.00 -1.72 -3.31 119.26 115.08 1bd6 h ALA 53 Ca -0.65 0.01 -0.56 0.00 0.00 0.00 0.00 54.91 53.71 1bd6 h ALA 53 Cb 1.37 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 1bd6 h ALA 53 CO 0.56 -0.44 1.29 0.42 0.00 0.00 0.00 179.25 181.07 1bd6 s ILE 54 N -5.40 3.47 0.18 0.00 1.01 -1.26 -2.40 121.20 116.80 1bd6 s ILE 54 Ca -0.08 0.45 0.11 0.00 0.00 0.00 0.00 60.65 61.12 1bd6 s ILE 54 Cb 0.22 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.94 1bd6 s ILE 54 CO 0.78 -0.50 -0.20 -0.31 0.00 0.00 0.00 174.94 174.71 1bd6 s TYR 55 N 7.29 2.41 0.34 3.97 2.02 0.59 -4.75 117.35 129.22 1bd6 s TYR 55 Ca 0.77 -0.31 -0.27 0.00 -0.37 0.00 0.00 57.07 56.88 1bd6 s TYR 55 Cb -0.20 -1.20 -0.09 0.00 -0.40 0.00 0.00 41.96 40.07 1bd6 s TYR 55 CO 0.31 0.49 1.13 -1.58 -1.57 0.00 0.00 175.55 174.34 1bd6 s HIS 56 N -1.64 3.34 0.47 2.71 5.65 -1.26 -0.47 115.29 124.09 1bd6 s HIS 56 Ca 0.22 1.62 0.28 0.00 0.25 0.00 0.00 55.06 57.43 1bd6 s HIS 56 Cb -0.08 -3.33 1.34 0.00 -1.18 0.00 0.00 32.58 29.33 1bd6 s HIS 56 CO 0.11 -0.90 1.79 1.05 -0.65 0.00 0.00 174.74 176.15 1bd6 h GLU 57 N 3.23 0.18 0.14 2.88 4.11 -1.77 0.16 114.58 123.50 1bd6 h GLU 57 Ca -0.48 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 58.94 1bd6 h GLU 57 Cb 1.22 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1bd6 h GLU 57 CO 0.65 0.12 -0.07 0.22 0.07 0.00 0.00 179.01 180.00 1bd6 h ASP 58 N 0.18 -0.15 -0.42 3.06 3.58 -1.91 -3.30 116.42 117.47 1bd6 h ASP 58 Ca 0.57 -0.40 -0.02 0.00 0.42 0.00 0.00 57.03 57.61 1bd6 h ASP 58 Cb 1.87 0.04 -0.02 0.00 1.72 0.00 0.00 39.33 42.94 1bd6 h ASP 58 CO -0.15 0.41 0.21 -0.26 -2.88 0.00 0.00 179.24 176.58 1bd6 h PHE 59 N -0.82 0.62 -1.69 0.28 -1.00 -1.59 -3.43 116.94 109.32 1bd6 h PHE 59 Ca -0.02 -0.01 -0.69 0.00 2.81 0.00 0.00 57.97 60.05 1bd6 h PHE 59 Cb 0.54 -0.20 0.03 0.00 3.61 0.00 0.00 35.95 39.94 1bd6 h PHE 59 CO 0.09 0.46 0.72 0.28 -1.61 0.00 0.00 178.31 178.26 1bd6 n VAL 60 N -4.39 0.18 -1.80 -0.55 0.31 0.42 -4.90 118.33 107.60 1bd6 n VAL 60 Ca 0.03 -0.03 -0.37 0.00 -0.01 0.00 0.00 64.34 63.96 1bd6 n VAL 60 Cb 0.12 -1.12 0.06 0.00 -0.91 0.00 0.00 33.84 31.99 1bd6 n VAL 60 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1bd6 s PRO 61 N 2.08 2.77 0.27 5.55 0.04 -1.26 -4.55 135.00 139.91 1bd6 s PRO 61 Ca 0.91 2.07 -0.01 0.00 0.04 0.00 0.00 61.00 64.00 1bd6 s PRO 61 Cb -0.96 -1.96 0.61 0.00 0.04 0.00 0.00 34.50 32.23 1bd6 s PRO 61 CO 0.55 -1.43 1.64 0.93 0.04 0.00 0.00 177.00 178.72 1bd6 h GLU 62 N 0.83 0.15 -0.96 4.56 3.07 -1.91 0.53 114.58 120.84 1bd6 h GLU 62 Ca -0.51 -0.01 0.29 0.00 -0.50 0.00 0.00 59.36 58.63 1bd6 h GLU 62 Cb 1.32 -0.03 -0.17 0.00 -0.84 0.00 0.00 28.75 29.02 1bd6 h GLU 62 CO 0.54 0.10 0.16 1.49 -1.40 0.00 0.00 179.01 179.90 1bd6 h GLU 63 N 0.16 0.05 -0.02 2.33 4.81 -2.02 -1.61 114.58 118.28 1bd6 h GLU 63 Ca 0.50 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.73 1bd6 h GLU 63 Cb 0.98 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.35 1bd6 h GLU 63 CO -0.68 0.03 -0.11 0.91 -0.73 0.00 0.00 179.01 178.43 1bd6 n TRP 64 N -5.39 0.00 0.16 0.92 8.01 0.16 -4.07 117.44 117.22 1bd6 n TRP 64 Ca 0.25 0.00 0.18 0.00 -1.31 0.00 0.00 57.50 56.62 1bd6 n TRP 64 Cb 0.83 0.00 0.78 0.00 -2.01 0.00 0.00 31.31 30.91 1bd6 n TRP 64 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1bd6 h LYS 65 N 3.11 0.00 0.16 -0.99 1.57 0.28 -0.27 116.57 120.44 1bd6 h LYS 65 Ca 0.00 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1bd6 h LYS 65 Cb 0.72 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.98 1bd6 h LYS 65 CO 0.00 0.00 -0.49 0.66 -0.57 0.00 0.00 179.45 179.05 1bd6 h SER 66 N 0.00 -1.46 -0.94 0.86 4.64 -1.71 -0.90 113.55 114.05 1bd6 h SER 66 Ca 0.12 0.15 0.10 0.00 -0.47 0.00 0.00 61.79 61.70 1bd6 h SER 66 Cb 0.64 0.53 -0.07 0.00 -0.31 0.00 0.00 62.40 63.19 1bd6 h SER 66 CO -0.00 -0.55 0.60 1.88 -0.87 0.00 0.00 176.83 177.89 1bd6 h TYR 67 N -0.75 1.04 -0.31 4.77 0.05 -1.34 0.14 116.97 120.56 1bd6 h TYR 67 Ca -0.00 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.77 1bd6 h TYR 67 Cb 0.75 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 1bd6 h TYR 67 CO -0.40 0.46 0.07 0.82 -1.05 0.00 0.00 178.16 178.06 1bd6 h ILE 68 N 0.95 1.22 -0.90 -2.88 5.03 -1.04 0.26 117.51 120.15 1bd6 h ILE 68 Ca 0.44 -0.74 0.10 0.00 -0.12 0.00 0.00 64.86 64.54 1bd6 h ILE 68 Cb 0.42 1.12 -0.08 0.00 -3.03 0.00 0.00 36.82 35.25 1bd6 h ILE 68 CO -0.20 0.25 0.54 1.56 -0.68 0.00 0.00 178.15 179.61 1bd6 h GLN 69 N 0.34 0.85 0.28 2.37 4.20 -0.51 -0.66 115.11 121.99 1bd6 h GLN 69 Ca 0.10 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 1bd6 h GLN 69 Cb 0.30 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.89 1bd6 h GLN 69 CO 0.00 0.56 -0.16 -0.22 -0.67 0.00 0.00 178.83 178.34 1bd6 h LYS 70 N 0.88 -0.41 -0.79 1.46 3.64 0.59 0.29 116.57 122.23 1bd6 h LYS 70 Ca 0.44 0.03 0.15 0.00 -1.27 0.00 0.00 60.65 59.99 1bd6 h LYS 70 Cb 0.40 0.09 -0.10 0.00 -0.41 0.00 0.00 32.23 32.22 1bd6 h LYS 70 CO -0.25 -0.27 0.36 -0.91 -2.27 0.00 0.00 179.45 176.10 1bd6 h ASN 71 N -0.42 0.38 0.63 4.20 2.35 -0.31 0.16 115.58 122.57 1bd6 h ASN 71 Ca -0.03 0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 1bd6 h ASN 71 Cb 0.34 0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 1bd6 h ASN 71 CO 0.04 0.14 -0.42 0.03 -1.65 0.00 0.00 177.43 175.57 1bd6 h ARG 72 N 0.51 -0.97 -0.82 0.81 3.08 -0.60 -3.23 114.38 113.15 1bd6 h ARG 72 Ca 0.44 0.07 0.15 0.00 0.07 0.00 0.00 59.98 60.70 1bd6 h ARG 72 Cb 0.65 0.22 -0.09 0.00 0.08 0.00 0.00 29.97 30.83 1bd6 h ARG 72 CO -0.39 -0.65 0.39 0.22 -1.07 0.00 0.00 179.97 178.47 1bd6 h ASP 73 N -1.01 0.44 -0.92 7.04 3.58 0.12 0.40 116.42 126.08 1bd6 h ASP 73 Ca -0.08 0.10 0.27 0.00 0.42 0.00 0.00 57.03 57.74 1bd6 h ASP 73 Cb 0.83 0.04 -0.15 0.00 1.72 0.00 0.00 39.33 41.76 1bd6 h ASP 73 CO 0.06 0.18 0.29 -0.26 -2.88 0.00 0.00 179.24 176.62 1bd6 h PHE 74 N 0.56 0.44 -0.01 0.28 -1.00 -0.79 -1.98 116.94 114.44 1bd6 h PHE 74 Ca 0.45 0.05 0.00 0.00 2.81 0.00 0.00 57.97 61.28 1bd6 h PHE 74 Cb 0.65 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 40.17 1bd6 h PHE 74 CO -0.12 -0.25 -0.21 1.19 -1.61 0.00 0.00 178.31 177.32 1bd6 n PHE 75 N -5.23 0.00 -0.34 -0.55 3.72 0.44 -4.97 117.46 110.53 1bd6 n PHE 75 Ca 0.25 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.65 1bd6 n PHE 75 Cb 0.79 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.33 1bd6 n PHE 75 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1bd6 n LYS 76 N -0.28 2.60 0.00 -1.08 4.81 0.11 -5.11 118.16 119.21 1bd6 n LYS 76 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 1bd6 n LYS 76 Cb 0.20 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.25 1bd6 n LYS 76 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20