#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bwe s TYR 2 N 0.00 3.57 0.02 0.00 1.51 -1.26 -1.23 117.35 119.96 1bwe s TYR 2 Ca 0.00 0.43 0.02 0.00 -1.01 0.00 0.00 57.07 56.51 1bwe s TYR 2 Cb 0.00 -1.88 -0.02 0.00 -0.11 0.00 0.00 41.96 39.96 1bwe s TYR 2 CO 0.00 0.69 -0.07 0.08 -1.11 0.00 0.00 175.55 175.14 1bwe s VAL 3 N -1.19 0.48 -0.15 0.71 1.01 0.51 -4.66 120.40 117.11 1bwe s VAL 3 Ca 0.22 -0.71 -0.15 0.00 0.00 0.00 0.00 61.98 61.34 1bwe s VAL 3 Cb -0.12 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.72 1bwe s VAL 3 CO 0.12 -0.17 0.33 -0.63 0.00 0.00 0.00 175.10 174.75 1bwe s ILE 4 N -0.84 5.28 0.00 2.22 1.01 -1.26 -2.44 121.20 125.18 1bwe s ILE 4 Ca -0.05 0.62 0.00 0.00 0.00 0.00 0.00 60.65 61.22 1bwe s ILE 4 Cb -0.07 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.74 1bwe s ILE 4 CO 0.00 0.37 0.00 0.35 0.00 0.00 0.00 174.94 175.67 1bwe n THR 5 N 3.62 0.00 0.08 2.92 -2.24 -1.26 -4.86 114.28 112.54 1bwe n THR 5 Ca -0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1bwe n THR 5 Cb 0.52 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 1bwe n THR 5 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1bwe n GLU 6 N -0.71 0.00 -2.01 -0.78 2.13 -1.26 -4.90 120.64 113.11 1bwe n GLU 6 Ca 0.00 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.56 1bwe n GLU 6 Cb 0.00 -0.10 -0.06 0.00 0.27 0.00 0.00 31.44 31.55 1bwe n GLU 6 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1bwe s PRO 7 N -1.65 2.41 0.00 5.31 0.04 -1.26 -1.44 135.00 138.41 1bwe s PRO 7 Ca 0.00 -0.57 0.00 0.00 0.04 0.00 0.00 61.00 60.47 1bwe s PRO 7 Cb 0.00 -5.11 0.00 0.00 0.04 0.00 0.00 34.50 29.43 1bwe s PRO 7 CO 0.00 -3.76 0.00 0.00 0.04 0.00 0.00 177.00 173.28 1bwe n ILE 9 N 0.00 0.27 0.00 0.00 -0.00 -0.52 -4.86 119.36 114.25 1bwe n ILE 9 Ca 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 62.75 62.68 1bwe n ILE 9 Cb 0.00 -0.97 0.00 0.00 -0.00 0.00 0.00 39.64 38.67 1bwe n ILE 9 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1bwe n GLY 10 N 2.50 -1.69 5.00 7.39 0.00 -1.26 -5.06 105.19 112.07 1bwe n GLY 10 Ca 0.17 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.88 1bwe n GLY 10 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1bwe n THR 11 N 0.00 0.00 -3.57 2.61 5.66 -1.09 -4.62 114.28 113.27 1bwe n THR 11 Ca 0.00 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.88 1bwe n THR 11 Cb 0.00 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.72 1bwe n THR 11 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 1bwe s LYS 12 N 0.00 0.69 0.20 1.09 2.47 -0.96 -4.22 119.74 119.01 1bwe s LYS 12 Ca 0.00 0.26 -0.11 0.00 -1.56 0.00 0.00 55.97 54.55 1bwe s LYS 12 Cb 0.00 0.33 -0.00 0.00 -1.46 0.00 0.00 37.83 36.70 1bwe s LYS 12 CO 0.00 -0.20 0.38 0.00 0.16 0.00 0.00 175.35 175.69 1bwe s ALA 14 N -3.97 0.94 0.00 0.00 0.00 -1.26 -4.83 121.76 112.64 1bwe s ALA 14 Ca 0.18 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.55 1bwe s ALA 14 Cb 0.02 1.24 0.00 0.00 0.00 0.00 0.00 23.12 24.38 1bwe s ALA 14 CO 0.03 -0.75 0.00 0.43 0.00 0.00 0.00 175.76 175.47 1bwe n SER 15 N -1.20 0.00 -1.21 0.00 7.64 -1.26 -4.84 113.62 112.75 1bwe n SER 15 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1bwe n SER 15 Cb 0.62 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 1bwe n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bwe n VAL 17 N 0.96 0.00 0.65 0.00 0.31 -1.26 -4.80 118.33 114.20 1bwe n VAL 17 Ca 0.00 0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 1bwe n VAL 17 Cb 0.35 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 1bwe n VAL 17 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1bwe n GLU 18 N -1.78 0.65 0.00 5.55 0.00 -1.26 -2.79 120.64 121.02 1bwe n GLU 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1bwe n GLU 18 Cb 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 31.44 30.24 1bwe n GLU 18 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.13 178.68 1bwe n VAL 19 N 0.59 0.00 -2.32 3.84 3.14 -1.26 -5.08 118.33 117.24 1bwe n VAL 19 Ca 0.00 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.96 1bwe n VAL 19 Cb 0.30 -0.29 -0.03 0.00 -1.06 0.00 0.00 33.84 32.77 1bwe n VAL 19 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1bwe s PRO 21 N 2.18 4.16 -0.38 0.00 0.04 -1.26 -2.00 135.00 137.75 1bwe s PRO 21 Ca 0.61 2.45 0.00 0.00 0.04 0.00 0.00 61.00 64.09 1bwe s PRO 21 Cb -0.29 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.32 1bwe s PRO 21 CO 0.25 -0.87 0.00 0.28 0.04 0.00 0.00 177.00 176.70 1bwe n VAL 22 N 5.26 -0.09 -4.07 -0.36 0.31 -1.26 -4.50 118.33 113.63 1bwe n VAL 22 Ca 0.18 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.16 1bwe n VAL 22 Cb 0.41 -0.87 -0.07 0.00 -0.91 0.00 0.00 33.84 32.40 1bwe n VAL 22 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1bwe n ASP 23 N 1.31 -1.38 -2.03 4.52 9.92 -0.85 -4.79 116.55 123.25 1bwe n ASP 23 Ca -0.04 -1.06 -0.17 0.00 -0.53 0.00 0.00 54.79 53.00 1bwe n ASP 23 Cb 0.31 -1.35 -0.03 0.00 -0.64 0.00 0.00 41.12 39.42 1bwe n ASP 23 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bwe s ILE 25 N -1.44 1.67 0.02 0.00 -5.25 -1.26 -0.66 121.20 114.27 1bwe s ILE 25 Ca 0.40 -0.72 0.04 0.00 -0.99 0.00 0.00 60.65 59.38 1bwe s ILE 25 Cb 0.26 -1.53 -0.02 0.00 2.95 0.00 0.00 42.46 44.12 1bwe s ILE 25 CO -0.07 0.48 -0.13 -1.00 -1.79 0.00 0.00 174.94 172.43 1bwe s HIS 26 N 1.20 1.13 0.16 1.37 3.76 0.52 -4.87 115.29 118.56 1bwe s HIS 26 Ca -0.01 -0.28 -0.30 0.00 -0.15 0.00 0.00 55.06 54.32 1bwe s HIS 26 Cb -0.14 -0.70 -0.07 0.00 1.11 0.00 0.00 32.58 32.78 1bwe s HIS 26 CO -0.07 0.00 1.09 -1.21 -0.85 0.00 0.00 174.74 173.70 1bwe s GLU 27 N -0.72 4.60 -0.55 1.40 2.02 -1.26 0.24 118.70 124.43 1bwe s GLU 27 Ca 0.03 1.68 0.01 0.00 0.02 0.00 0.00 54.97 56.71 1bwe s GLU 27 Cb -0.06 -3.29 0.48 0.00 0.10 0.00 0.00 34.13 31.35 1bwe s GLU 27 CO 0.00 0.07 1.83 0.41 0.02 0.00 0.00 175.26 177.60 1bwe n GLY 28 N 2.14 5.76 5.00 -1.39 0.00 0.19 -4.93 105.19 111.96 1bwe n GLY 28 Ca 0.03 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.88 1bwe n GLY 28 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1bwe n GLU 29 N -0.92 0.00 0.21 1.61 4.07 -1.26 -4.32 120.64 120.03 1bwe n GLU 29 Ca 0.57 0.00 0.06 0.00 -0.06 0.00 0.00 57.16 57.73 1bwe n GLU 29 Cb 0.86 0.00 0.45 0.00 -0.06 0.00 0.00 31.44 32.69 1bwe n GLU 29 CO 0.00 0.00 0.00 0.22 -0.06 0.00 0.00 177.13 177.29 1bwe h ASP 30 N 0.00 0.00 -5.04 4.31 1.82 -1.93 -3.43 116.42 112.15 1bwe h ASP 30 Ca 0.00 0.00 0.03 0.00 -0.39 0.00 0.00 57.03 56.67 1bwe h ASP 30 Cb 0.00 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 39.97 1bwe h ASP 30 CO 0.00 0.31 0.20 0.00 -1.61 0.00 0.00 179.24 178.13 1bwe s GLN 31 N -3.99 1.87 0.24 0.28 1.03 -1.26 -2.28 119.66 115.55 1bwe s GLN 31 Ca -0.02 -1.13 -0.08 0.00 0.04 0.00 0.00 55.36 54.17 1bwe s GLN 31 Cb 0.13 0.60 -0.06 0.00 0.03 0.00 0.00 33.01 33.70 1bwe s GLN 31 CO 0.68 -0.85 0.53 0.71 -2.54 0.00 0.00 175.29 173.81 1bwe s TYR 32 N -3.54 3.45 -0.07 9.60 1.51 -1.26 -0.64 117.35 126.39 1bwe s TYR 32 Ca 0.14 0.77 -0.03 0.00 -1.01 0.00 0.00 57.07 56.93 1bwe s TYR 32 Cb -0.05 -2.18 0.04 0.00 -0.11 0.00 0.00 41.96 39.66 1bwe s TYR 32 CO 0.09 0.26 0.15 0.71 -1.11 0.00 0.00 175.55 175.64 1bwe s TYR 33 N -1.88 -0.16 0.31 2.71 1.51 0.14 -4.87 117.35 115.11 1bwe s TYR 33 Ca 0.46 0.52 -0.28 0.00 -1.01 0.00 0.00 57.07 56.76 1bwe s TYR 33 Cb -0.11 -0.18 -0.09 0.00 -0.11 0.00 0.00 41.96 41.47 1bwe s TYR 33 CO 0.24 -0.21 1.02 0.42 -1.11 0.00 0.00 175.55 175.92 1bwe s ILE 34 N 1.69 3.80 -0.51 2.71 1.01 -1.26 -0.35 121.20 128.29 1bwe s ILE 34 Ca -0.03 1.64 -0.28 0.00 0.00 0.00 0.00 60.65 61.98 1bwe s ILE 34 Cb -0.12 -3.98 0.03 0.00 0.01 0.00 0.00 42.46 38.40 1bwe s ILE 34 CO -0.06 0.27 1.12 -0.62 0.00 0.00 0.00 174.94 175.66 1bwe s ASP 35 N -1.24 6.56 0.00 3.58 -1.08 0.16 -4.78 116.67 119.87 1bwe s ASP 35 Ca 0.48 0.31 0.23 0.00 -0.52 0.00 0.00 52.55 53.05 1bwe s ASP 35 Cb -0.26 -2.54 1.27 0.00 -1.46 0.00 0.00 42.92 39.93 1bwe s ASP 35 CO 0.33 -1.29 1.76 -0.81 0.52 0.00 0.00 175.17 175.67 1bwe n PRO 36 N 7.92 0.51 -0.05 4.34 -0.05 -1.26 -0.80 135.00 145.61 1bwe n PRO 36 Ca 0.10 0.04 -0.18 0.00 -0.05 0.00 0.00 63.50 63.41 1bwe n PRO 36 Cb 0.49 -1.50 -0.13 0.00 -0.05 0.00 0.00 33.50 32.30 1bwe n PRO 36 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 175.50 171.98 1bwe n ASP 37 N -1.16 1.78 0.06 3.54 2.03 -1.26 -4.51 116.55 117.04 1bwe n ASP 37 Ca 0.14 0.09 -0.13 0.00 0.52 0.00 0.00 54.79 55.42 1bwe n ASP 37 Cb 0.14 -0.48 -0.13 0.00 -0.72 0.00 0.00 41.12 39.92 1bwe n ASP 37 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1bwe h VAL 38 N 0.03 1.35 -2.14 5.18 2.07 -1.86 -3.45 116.25 117.44 1bwe h VAL 38 Ca -0.47 -3.03 -0.60 0.00 0.82 0.00 0.00 66.70 63.42 1bwe h VAL 38 Cb 2.00 2.77 0.03 0.00 -1.52 0.00 0.00 31.29 34.58 1bwe h VAL 38 CO 0.02 0.83 1.01 0.00 0.02 0.00 0.00 177.57 179.46 1bwe n ILE 40 N 4.61 2.41 -4.14 0.00 -5.35 -1.26 -4.65 119.36 110.97 1bwe n ILE 40 Ca 0.21 -1.27 -0.30 0.00 -0.27 0.00 0.00 62.75 61.12 1bwe n ILE 40 Cb 0.30 -1.11 -0.05 0.00 -1.74 0.00 0.00 39.64 37.04 1bwe n ILE 40 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1bwe n ASP 41 N 0.17 -0.33 -4.32 7.28 8.00 -1.26 -4.98 116.55 121.11 1bwe n ASP 41 Ca 0.27 -1.11 -0.28 0.00 0.71 0.00 0.00 54.79 54.38 1bwe n ASP 41 Cb 0.75 -2.44 0.16 0.00 -0.02 0.00 0.00 41.12 39.57 1bwe n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bwe s GLY 43 N -4.85 1.56 0.33 0.00 0.00 -1.26 -4.91 107.32 98.19 1bwe s GLY 43 Ca 0.71 -1.99 0.00 0.00 0.00 0.00 0.00 44.72 43.44 1bwe s GLY 43 CO 0.50 1.06 0.00 0.00 0.00 0.00 0.00 173.10 174.66 1bwe n ALA 44 N 4.50 0.00 -0.19 3.20 0.00 -1.26 -4.94 120.51 121.82 1bwe n ALA 44 Ca -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.33 1bwe n ALA 44 Cb 0.42 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.89 1bwe n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bwe n GLU 46 N -4.49 1.93 0.00 0.00 0.28 -1.26 -1.41 120.64 115.69 1bwe n GLU 46 Ca 0.03 0.68 0.00 0.00 -0.16 0.00 0.00 57.16 57.71 1bwe n GLU 46 Cb 0.17 -2.27 0.00 0.00 1.43 0.00 0.00 31.44 30.78 1bwe n GLU 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1bwe n ALA 47 N 1.15 0.00 0.03 -1.84 0.00 -1.26 -4.69 120.51 113.89 1bwe n ALA 47 Ca 0.09 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.40 1bwe n ALA 47 Cb 0.33 -0.03 -0.01 0.00 0.00 0.00 0.00 19.45 19.73 1bwe n ALA 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1bwe h VAL 48 N 0.00 1.34 -2.41 0.00 2.07 -1.35 -3.41 116.25 112.49 1bwe h VAL 48 Ca 0.00 -2.10 -0.55 0.00 0.82 0.00 0.00 66.70 64.87 1bwe h VAL 48 Cb 0.00 2.09 0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1bwe h VAL 48 CO 0.00 0.64 1.23 0.00 0.02 0.00 0.00 177.57 179.46 1bwe h PRO 50 N 10.99 0.00 0.00 0.00 0.13 -1.95 0.94 132.00 142.11 1bwe h PRO 50 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.62 1bwe h PRO 50 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1bwe h PRO 50 CO 0.95 0.01 -0.49 -0.39 -0.23 0.00 0.00 178.00 177.85 1bwe h VAL 51 N 0.00 0.41 -6.05 1.56 -1.51 -1.92 -3.48 116.25 105.26 1bwe h VAL 51 Ca -0.00 -1.62 -0.41 0.00 -1.23 0.00 0.00 66.70 63.45 1bwe h VAL 51 Cb 0.02 2.12 0.07 0.00 -2.13 0.00 0.00 31.29 31.37 1bwe h VAL 51 CO 0.00 0.24 -0.84 -1.20 -1.23 0.00 0.00 177.57 174.53 1bwe n SER 52 N -3.08 -1.87 0.15 4.19 7.64 0.32 -4.92 113.62 116.06 1bwe n SER 52 Ca 0.01 -0.83 0.12 0.00 1.01 0.00 0.00 58.87 59.18 1bwe n SER 52 Cb 0.65 -4.09 0.09 0.00 -1.01 0.00 0.00 64.21 59.86 1bwe n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bwe h ALA 53 N 0.80 0.73 -2.19 -0.43 0.00 -1.83 -3.46 119.26 112.88 1bwe h ALA 53 Ca -0.62 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 53.74 1bwe h ALA 53 Cb 1.36 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1bwe h ALA 53 CO 0.55 0.00 1.16 0.42 0.00 0.00 0.00 179.25 181.38 1bwe s ILE 54 N -3.28 3.47 0.25 0.00 1.01 -1.26 -4.68 121.20 116.70 1bwe s ILE 54 Ca 0.03 0.56 0.05 0.00 0.00 0.00 0.00 60.65 61.29 1bwe s ILE 54 Cb 0.08 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.08 1bwe s ILE 54 CO 0.73 -0.11 -0.03 -0.31 0.00 0.00 0.00 174.94 175.22 1bwe s TYR 55 N 4.80 1.71 0.49 3.97 2.02 -1.02 -4.83 117.35 124.49 1bwe s TYR 55 Ca 0.78 -0.82 -0.23 0.00 -0.37 0.00 0.00 57.07 56.42 1bwe s TYR 55 Cb -0.32 -0.98 -0.07 0.00 -0.40 0.00 0.00 41.96 40.19 1bwe s TYR 55 CO 0.32 0.10 1.34 -1.58 -1.57 0.00 0.00 175.55 174.16 1bwe s HIS 56 N -3.24 2.48 0.29 2.71 2.46 -1.26 -0.36 115.29 118.37 1bwe s HIS 56 Ca 0.28 1.37 0.04 0.00 0.47 0.00 0.00 55.06 57.22 1bwe s HIS 56 Cb 0.05 -3.76 0.67 0.00 -0.13 0.00 0.00 32.58 29.41 1bwe s HIS 56 CO 0.09 -2.62 1.79 1.05 -2.47 0.00 0.00 174.74 172.58 1bwe h GLU 57 N 1.94 0.77 -0.93 2.88 4.11 -1.50 0.26 114.58 122.12 1bwe h GLU 57 Ca -0.50 -0.05 0.07 0.00 0.07 0.00 0.00 59.36 58.95 1bwe h GLU 57 Cb 1.28 -0.17 -0.07 0.00 0.50 0.00 0.00 28.75 30.29 1bwe h GLU 57 CO 0.59 0.51 0.59 -0.44 0.07 0.00 0.00 179.01 180.33 1bwe h ASP 58 N 0.80 0.92 0.50 3.06 5.19 -1.91 -3.14 116.42 121.85 1bwe h ASP 58 Ca 0.55 0.02 -0.30 0.00 -0.62 0.00 0.00 57.03 56.68 1bwe h ASP 58 Cb 0.78 -0.18 0.02 0.00 0.18 0.00 0.00 39.33 40.13 1bwe h ASP 58 CO -0.36 0.58 -1.33 -0.26 -3.12 0.00 0.00 179.24 174.75 1bwe h PHE 59 N 1.05 0.67 -1.95 4.55 -1.00 -0.90 -3.45 116.94 115.91 1bwe h PHE 59 Ca 0.41 -0.49 -0.64 0.00 2.81 0.00 0.00 57.97 60.06 1bwe h PHE 59 Cb 0.20 -0.03 0.04 0.00 3.61 0.00 0.00 35.95 39.78 1bwe h PHE 59 CO -0.02 1.38 0.78 0.28 -1.61 0.00 0.00 178.31 179.13 1bwe n VAL 60 N -3.60 0.17 -1.59 -0.55 0.31 -0.28 -4.89 118.33 107.90 1bwe n VAL 60 Ca -0.12 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.77 1bwe n VAL 60 Cb 1.05 -1.37 0.01 0.00 -0.91 0.00 0.00 33.84 32.63 1bwe n VAL 60 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1bwe n PRO 61 N 4.16 1.21 -0.31 5.55 -0.02 -1.26 -4.48 135.00 139.85 1bwe n PRO 61 Ca 0.20 0.44 0.13 0.00 -2.02 0.00 0.00 63.50 62.24 1bwe n PRO 61 Cb 0.24 -1.99 0.27 0.00 -0.02 0.00 0.00 33.50 32.00 1bwe n PRO 61 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1bwe h GLU 62 N 1.34 0.09 -0.88 -0.52 3.07 -1.93 0.43 114.58 116.19 1bwe h GLU 62 Ca -0.44 -0.01 0.23 0.00 -0.50 0.00 0.00 59.36 58.64 1bwe h GLU 62 Cb 1.35 -0.02 -0.14 0.00 -0.84 0.00 0.00 28.75 29.10 1bwe h GLU 62 CO 0.56 0.06 0.28 0.93 -1.40 0.00 0.00 179.01 179.44 1bwe h GLU 63 N 0.10 0.24 -0.01 2.33 3.07 -2.02 -1.57 114.58 116.72 1bwe h GLU 63 Ca 0.55 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.40 1bwe h GLU 63 Cb 1.12 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.97 1bwe h GLU 63 CO -0.77 0.16 -0.59 0.91 -1.40 0.00 0.00 179.01 177.31 1bwe n TRP 64 N -5.18 0.00 0.31 4.33 8.01 0.12 -4.07 117.44 120.96 1bwe n TRP 64 Ca 0.22 0.00 0.19 0.00 -1.31 0.00 0.00 57.50 56.60 1bwe n TRP 64 Cb 0.68 -0.02 1.04 0.00 -2.01 0.00 0.00 31.31 31.00 1bwe n TRP 64 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1bwe h LYS 65 N 1.58 0.00 -0.76 -0.99 1.57 0.35 0.23 116.57 118.55 1bwe h LYS 65 Ca 0.00 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.93 1bwe h LYS 65 Cb 0.66 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.86 1bwe h LYS 65 CO 0.00 0.00 0.26 0.66 -0.57 0.00 0.00 179.45 179.80 1bwe h SER 66 N 0.00 0.19 0.31 0.86 4.64 -1.71 -0.00 113.55 117.83 1bwe h SER 66 Ca 0.01 0.13 -0.08 0.00 -0.47 0.00 0.00 61.79 61.38 1bwe h SER 66 Cb 0.14 0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 1bwe h SER 66 CO -0.00 0.04 -0.34 1.88 -0.87 0.00 0.00 176.83 177.54 1bwe h TYR 67 N 0.37 0.06 -0.14 4.77 0.05 -0.84 0.35 116.97 121.60 1bwe h TYR 67 Ca 0.42 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 59.18 1bwe h TYR 67 Cb 0.69 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.41 1bwe h TYR 67 CO -0.20 0.39 0.06 0.82 -1.05 0.00 0.00 178.16 178.18 1bwe h ILE 68 N 0.05 1.15 -0.39 -2.88 5.03 -1.02 0.28 117.51 119.74 1bwe h ILE 68 Ca 0.00 -0.45 0.05 0.00 -0.12 0.00 0.00 64.86 64.35 1bwe h ILE 68 Cb 0.63 1.19 -0.05 0.00 -3.03 0.00 0.00 36.82 35.56 1bwe h ILE 68 CO 0.05 0.14 0.10 -0.61 -0.68 0.00 0.00 178.15 177.15 1bwe h GLN 69 N 0.08 0.24 -0.29 2.37 5.75 -0.86 -0.18 115.11 122.21 1bwe h GLN 69 Ca 0.05 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1bwe h GLN 69 Cb 0.17 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 1bwe h GLN 69 CO -0.00 0.16 0.14 -0.22 -2.65 0.00 0.00 178.83 176.25 1bwe h LYS 70 N 0.24 0.42 -0.75 1.69 1.63 -0.58 0.62 116.57 119.85 1bwe h LYS 70 Ca 0.18 -0.06 0.07 0.00 -0.85 0.00 0.00 60.65 59.99 1bwe h LYS 70 Cb 0.19 -0.08 -0.06 0.00 -0.60 0.00 0.00 32.23 31.69 1bwe h LYS 70 CO -0.22 0.40 0.43 -0.91 -3.45 0.00 0.00 179.45 175.71 1bwe h ASN 71 N 0.33 0.65 0.76 4.20 2.35 -0.18 0.23 115.58 123.93 1bwe h ASN 71 Ca 0.10 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 1bwe h ASN 71 Cb 0.12 -0.10 0.01 0.00 0.05 0.00 0.00 38.32 38.39 1bwe h ASN 71 CO -0.01 0.41 -0.37 -0.09 -1.65 0.00 0.00 177.43 175.72 1bwe h ARG 72 N 0.78 -0.98 -0.99 0.81 2.43 -0.61 -3.27 114.38 112.54 1bwe h ARG 72 Ca 0.34 0.07 0.09 0.00 -0.81 0.00 0.00 59.98 59.66 1bwe h ARG 72 Cb 0.22 0.22 -0.07 0.00 -0.42 0.00 0.00 29.97 29.92 1bwe h ARG 72 CO -0.19 -0.64 0.64 0.22 -1.51 0.00 0.00 179.97 178.48 1bwe h ASP 73 N -1.09 0.99 -0.94 -3.80 3.58 -0.58 -1.10 116.42 113.47 1bwe h ASP 73 Ca -0.10 0.02 0.15 0.00 0.42 0.00 0.00 57.03 57.52 1bwe h ASP 73 Cb 0.80 -0.18 -0.15 0.00 1.72 0.00 0.00 39.33 41.51 1bwe h ASP 73 CO 0.17 0.59 -0.36 0.49 -2.88 0.00 0.00 179.24 177.26 1bwe n PHE 74 N -4.54 0.06 -0.09 0.28 3.72 0.79 -2.81 117.46 114.87 1bwe n PHE 74 Ca 0.17 1.16 -0.08 0.00 -0.05 0.00 0.00 57.45 58.64 1bwe n PHE 74 Cb 0.25 -0.87 -0.15 0.00 -0.94 0.00 0.00 39.48 37.77 1bwe n PHE 74 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1bwe n PHE 75 N -5.41 0.00 -2.32 1.38 3.72 -1.01 -4.58 117.46 109.24 1bwe n PHE 75 Ca 0.10 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.10 1bwe n PHE 75 Cb 0.39 -0.91 -0.01 0.00 -0.94 0.00 0.00 39.48 38.00 1bwe n PHE 75 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1bwe n LYS 76 N -2.68 2.79 0.00 -1.08 4.01 -0.45 -5.16 118.16 115.59 1bwe n LYS 76 Ca -0.29 -2.99 0.00 0.00 -0.51 0.00 0.00 58.31 54.52 1bwe n LYS 76 Cb 1.09 -3.49 0.00 0.00 -0.51 0.00 0.00 35.03 32.11 1bwe n LYS 76 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46