#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wib s SER -5 N 0.00 -0.33 -0.19 1.61 0.15 -1.26 -5.18 113.70 108.51 1wib s SER -5 Ca 0.00 -0.40 -0.23 0.00 0.70 0.00 0.00 55.95 56.02 1wib s SER -5 Cb 0.00 0.61 0.06 0.00 -1.71 0.00 0.00 66.02 64.98 1wib s SER -5 CO 0.00 -1.08 0.62 -0.55 1.20 0.00 0.00 173.24 173.43 1wib s SER -4 N -2.85 -0.63 0.91 5.45 0.15 -1.26 -5.17 113.70 110.30 1wib s SER -4 Ca 0.08 1.09 -0.12 0.00 0.70 0.00 0.00 55.95 57.70 1wib s SER -4 Cb -0.02 1.08 0.14 0.00 -1.71 0.00 0.00 66.02 65.51 1wib s SER -4 CO -0.03 -0.31 1.09 -0.83 1.20 0.00 0.00 173.24 174.35 1wib s GLY -3 N -0.08 1.61 -0.09 9.45 0.00 -1.26 -5.02 107.32 111.93 1wib s GLY -3 Ca -0.03 -0.06 -0.05 0.00 0.00 0.00 0.00 44.72 44.58 1wib s GLY -3 CO 0.03 0.44 -0.13 -1.26 0.00 0.00 0.00 173.10 172.18 1wib n SER -2 N -3.95 0.74 -3.78 1.64 2.88 -1.26 -5.03 113.62 104.86 1wib n SER -2 Ca 0.07 0.13 -0.26 0.00 -1.33 0.00 0.00 58.87 57.47 1wib n SER -2 Cb 0.55 -0.30 0.04 0.00 -0.75 0.00 0.00 64.21 63.75 1wib n SER -2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wib n SER -1 N -3.47 -4.17 -4.89 -3.46 7.64 -1.26 -4.96 113.62 99.05 1wib n SER -1 Ca -0.19 -0.73 -0.29 0.00 1.01 0.00 0.00 58.87 58.67 1wib n SER -1 Cb 0.62 -4.23 0.03 0.00 -1.01 0.00 0.00 64.21 59.61 1wib n SER -1 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wib s GLY 1 N -3.61 1.61 0.88 0.23 0.00 -1.26 -5.06 107.32 100.10 1wib s GLY 1 Ca 0.46 -0.40 -0.11 0.00 0.00 0.00 0.00 44.72 44.67 1wib s GLY 1 CO 0.80 -0.12 1.09 2.56 0.00 0.00 0.00 173.10 177.43 1wib s PRO 2 N -5.11 1.40 0.34 2.90 0.04 -1.26 -5.06 135.00 128.26 1wib s PRO 2 Ca 0.54 0.87 -0.06 0.00 0.04 0.00 0.00 61.00 62.40 1wib s PRO 2 Cb -0.11 -1.82 0.09 0.00 0.04 0.00 0.00 34.50 32.70 1wib s PRO 2 CO 0.49 -2.16 0.31 -0.35 0.04 0.00 0.00 177.00 175.33 1wib n PRO 3 N -3.83 -1.61 -4.02 0.56 -0.04 -1.26 -5.10 135.00 119.70 1wib n PRO 3 Ca 0.07 -0.49 -0.08 0.00 -0.04 0.00 0.00 63.50 62.97 1wib n PRO 3 Cb 0.55 -0.46 -0.09 0.00 -0.04 0.00 0.00 33.50 33.46 1wib n PRO 3 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1wib s LYS 4 N -3.69 0.65 1.07 0.54 1.02 -1.26 -5.15 119.74 112.91 1wib s LYS 4 Ca 0.20 -1.09 -0.14 0.00 0.02 0.00 0.00 55.97 54.96 1wib s LYS 4 Cb -0.02 0.24 0.16 0.00 -0.52 0.00 0.00 37.83 37.68 1wib s LYS 4 CO 0.15 -0.15 0.61 1.19 -0.92 0.00 0.00 175.35 176.24 1wib n PHE 5 N 0.19 -0.97 -3.59 3.18 3.01 -1.26 -5.05 117.46 112.98 1wib n PHE 5 Ca -0.15 0.12 -0.15 0.00 1.01 0.00 0.00 57.45 58.28 1wib n PHE 5 Cb 0.61 -1.73 -0.07 0.00 -0.01 0.00 0.00 39.48 38.28 1wib n PHE 5 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1wib s ASP 6 N -2.20 -0.67 0.40 4.37 1.01 -1.26 -5.04 116.67 113.29 1wib s ASP 6 Ca 0.62 1.08 0.19 0.00 0.71 0.00 0.00 52.55 55.15 1wib s ASP 6 Cb -0.20 1.02 0.84 0.00 1.01 0.00 0.00 42.92 45.59 1wib s ASP 6 CO 0.65 -0.37 1.82 1.55 0.21 0.00 0.00 175.17 179.03 1wib h PRO 7 N 4.08 0.00 0.41 8.23 0.13 -2.00 -3.29 132.00 139.57 1wib h PRO 7 Ca -0.28 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.84 1wib h PRO 7 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1wib h PRO 7 CO 0.19 0.32 -0.30 -0.91 -0.23 0.00 0.00 178.00 177.07 1wib h ASN 8 N 0.00 -0.78 -3.99 1.44 4.21 -2.02 -3.43 115.58 111.01 1wib h ASN 8 Ca -0.00 0.05 -0.49 0.00 1.21 0.00 0.00 56.30 57.07 1wib h ASN 8 Cb 0.74 0.24 0.17 0.00 -1.12 0.00 0.00 38.32 38.35 1wib h ASN 8 CO 0.04 -0.44 0.20 -1.61 -1.29 0.00 0.00 177.43 174.34 1wib s GLU 9 N -4.72 0.84 -0.01 0.81 0.41 -1.24 -5.06 118.70 109.72 1wib s GLU 9 Ca -0.11 1.09 0.02 0.00 -0.41 0.00 0.00 54.97 55.56 1wib s GLU 9 Cb 0.02 -1.74 -0.00 0.00 -1.78 0.00 0.00 34.13 30.63 1wib s GLU 9 CO 0.36 -2.61 -0.07 0.54 -0.49 0.00 0.00 175.26 172.99 1wib s VAL 10 N -2.74 0.59 0.04 2.63 0.11 -1.26 -4.91 120.40 114.86 1wib s VAL 10 Ca 0.65 -0.29 0.05 0.00 -2.93 0.00 0.00 61.98 59.46 1wib s VAL 10 Cb -0.21 -0.52 -0.02 0.00 -1.53 0.00 0.00 36.38 34.10 1wib s VAL 10 CO 0.59 0.18 -0.14 -0.75 -3.33 0.00 0.00 175.10 171.65 1wib s LYS 11 N -0.00 0.91 0.01 1.54 2.20 -1.26 -5.11 119.74 118.01 1wib s LYS 11 Ca 0.00 -0.78 0.03 0.00 -0.36 0.00 0.00 55.97 54.86 1wib s LYS 11 Cb -0.05 -0.91 -0.03 0.00 -1.51 0.00 0.00 37.83 35.33 1wib s LYS 11 CO -0.00 0.22 -0.06 0.08 -0.36 0.00 0.00 175.35 175.23 1wib s VAL 12 N -0.92 3.71 -0.07 4.02 1.01 -1.26 -3.65 120.40 123.24 1wib s VAL 12 Ca 0.01 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.27 1wib s VAL 12 Cb -0.08 -2.62 -0.00 0.00 0.00 0.00 0.00 36.38 33.67 1wib s VAL 12 CO 0.01 0.38 -0.23 -0.69 0.00 0.00 0.00 175.10 174.57 1wib s VAL 13 N -1.02 1.95 -0.03 2.92 1.01 -0.12 -4.98 120.40 120.13 1wib s VAL 13 Ca 0.18 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.19 1wib s VAL 13 Cb -0.11 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 1wib s VAL 13 CO 0.08 0.54 -0.03 -0.31 0.00 0.00 0.00 175.10 175.38 1wib s TYR 14 N 0.10 3.01 -0.06 5.22 1.51 -1.26 -0.81 117.35 125.05 1wib s TYR 14 Ca -0.10 0.06 -0.05 0.00 -1.01 0.00 0.00 57.07 55.96 1wib s TYR 14 Cb -0.15 -1.68 0.02 0.00 -0.11 0.00 0.00 41.96 40.03 1wib s TYR 14 CO 0.06 0.41 0.16 -0.51 -1.11 0.00 0.00 175.55 174.56 1wib s LEU 15 N -1.25 1.29 -0.31 -1.29 1.02 -1.22 -5.04 118.68 111.88 1wib s LEU 15 Ca 0.16 0.32 -0.11 0.00 0.02 0.00 0.00 54.13 54.53 1wib s LEU 15 Cb -0.11 0.53 -0.02 0.00 0.02 0.00 0.00 46.19 46.61 1wib s LEU 15 CO 0.06 -0.07 0.20 -0.60 0.02 0.00 0.00 176.35 175.96 1wib s ARG 16 N 0.24 3.58 0.25 1.70 3.00 -1.26 -3.84 118.95 122.62 1wib s ARG 16 Ca -0.01 -0.57 -0.18 0.00 -1.00 0.00 0.00 55.73 53.96 1wib s ARG 16 Cb -0.02 -3.68 0.02 0.00 0.00 0.00 0.00 34.95 31.26 1wib s ARG 16 CO -0.01 -0.36 0.61 0.00 0.00 0.00 0.00 175.30 175.55 1wib s THR 18 N -3.94 3.60 0.39 0.00 2.01 -1.26 -4.11 115.64 112.32 1wib s THR 18 Ca 0.14 1.38 -0.25 0.00 0.31 0.00 0.00 61.69 63.27 1wib s THR 18 Cb -0.03 -3.79 -0.09 0.00 0.01 0.00 0.00 72.50 68.60 1wib s THR 18 CO 0.05 0.16 1.10 -0.83 -0.69 0.00 0.00 174.62 174.41 1wib s GLY 19 N -1.27 2.83 -1.19 4.40 0.00 -1.06 -3.86 107.32 107.16 1wib s GLY 19 Ca 0.52 0.82 -0.18 0.00 0.00 0.00 0.00 44.72 45.88 1wib s GLY 19 CO 0.34 1.31 0.72 0.61 0.00 0.00 0.00 173.10 176.07 1wib n GLY 20 N 0.56 -0.83 3.29 0.20 0.00 -1.26 -2.89 105.19 104.26 1wib n GLY 20 Ca 0.04 0.39 -0.43 0.00 0.00 0.00 0.00 46.02 46.01 1wib n GLY 20 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wib s GLU 21 N -6.22 3.98 0.06 1.61 2.12 -1.25 -4.75 118.70 114.25 1wib s GLU 21 Ca 0.39 -3.19 -0.22 0.00 0.36 0.00 0.00 54.97 52.31 1wib s GLU 21 Cb -0.15 -4.43 -0.13 0.00 0.26 0.00 0.00 34.13 29.68 1wib s GLU 21 CO 0.88 -1.25 1.55 0.28 -0.54 0.00 0.00 175.26 176.18 1wib h VAL 22 N 3.82 1.19 -0.88 3.70 2.07 -1.95 -3.44 116.25 120.77 1wib h VAL 22 Ca 0.17 -0.60 -0.76 0.00 0.82 0.00 0.00 66.70 66.33 1wib h VAL 22 Cb 0.87 1.38 0.01 0.00 -1.52 0.00 0.00 31.29 32.04 1wib h VAL 22 CO 0.97 0.18 0.52 0.61 0.02 0.00 0.00 177.57 179.86 1wib n GLY 23 N -0.51 0.10 3.59 2.17 0.00 -1.26 -4.89 105.19 104.39 1wib n GLY 23 Ca -0.06 0.85 -0.05 0.00 0.00 0.00 0.00 46.02 46.77 1wib n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wib s ALA 24 N 2.21 -2.05 -0.39 4.61 0.00 -1.26 -5.06 121.76 119.81 1wib s ALA 24 Ca 0.90 1.50 0.07 0.00 0.00 0.00 0.00 51.96 54.43 1wib s ALA 24 Cb -1.28 -0.04 0.44 0.00 0.00 0.00 0.00 23.12 22.24 1wib s ALA 24 CO 0.68 -0.63 1.11 0.25 0.00 0.00 0.00 175.76 177.18 1wib n THR 25 N -0.13 2.22 -3.56 0.00 -2.24 -1.26 -4.93 114.28 104.39 1wib n THR 25 Ca -0.01 -4.52 -0.20 0.00 -2.27 0.00 0.00 64.05 57.05 1wib n THR 25 Cb 0.59 -0.96 0.06 0.00 -2.10 0.00 0.00 70.33 67.93 1wib n THR 25 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1wib n SER 26 N -0.49 -2.12 0.11 3.42 2.88 -1.26 -4.90 113.62 111.26 1wib n SER 26 Ca 0.36 -0.70 0.08 0.00 -1.33 0.00 0.00 58.87 57.28 1wib n SER 26 Cb 0.75 -4.67 0.01 0.00 -0.75 0.00 0.00 64.21 59.55 1wib n SER 26 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wib h ALA 27 N 0.90 0.63 -0.00 -1.46 0.00 -2.00 -3.29 119.26 114.04 1wib h ALA 27 Ca -0.60 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1wib h ALA 27 Cb 1.35 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1wib h ALA 27 CO 0.54 0.30 -0.15 1.28 0.00 0.00 0.00 179.25 181.21 1wib n LEU 28 N -2.85 0.16 0.22 0.00 4.77 -1.26 -4.04 117.00 114.00 1wib n LEU 28 Ca -0.02 0.33 -0.16 0.00 -0.03 0.00 0.00 56.01 56.14 1wib n LEU 28 Cb 0.64 -0.41 -0.08 0.00 -2.33 0.00 0.00 43.42 41.24 1wib n LEU 28 CO 0.40 0.04 0.60 0.00 -1.33 0.00 0.00 177.39 177.10 1wib h ALA 29 N 3.02 -0.84 0.00 -1.18 0.00 -1.96 -0.69 119.26 117.61 1wib h ALA 29 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1wib h ALA 29 Cb 0.49 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1wib h ALA 29 CO 0.00 -1.02 -0.08 -1.00 0.00 0.00 0.00 179.25 177.16 1wib h PRO 30 N -0.79 0.00 -0.09 0.00 0.13 -1.81 0.53 132.00 129.96 1wib h PRO 30 Ca -0.02 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.03 1wib h PRO 30 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1wib h PRO 30 CO -0.09 0.08 -0.24 0.87 -0.23 0.00 0.00 178.00 178.39 1wib h LYS 31 N 0.00 0.32 -0.09 0.86 1.57 -1.56 -3.28 116.57 114.39 1wib h LYS 31 Ca -0.00 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1wib h LYS 31 Cb 0.55 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.89 1wib h LYS 31 CO 0.01 0.84 0.00 -0.89 -0.57 0.00 0.00 179.45 178.84 1wib n ILE 32 N -4.49 0.09 0.12 1.86 5.41 -0.31 -4.55 119.36 117.49 1wib n ILE 32 Ca -0.08 -0.55 -0.15 0.00 1.00 0.00 0.00 62.75 62.98 1wib n ILE 32 Cb 0.44 1.38 -0.09 0.00 -0.71 0.00 0.00 39.64 40.66 1wib n ILE 32 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1wib h GLY 33 N 4.40 -1.18 2.00 7.39 0.00 0.01 -1.55 103.07 114.15 1wib h GLY 33 Ca 0.00 0.63 -0.07 0.00 0.00 0.00 0.00 47.33 47.89 1wib h GLY 33 CO 0.00 -0.30 -0.32 -0.56 0.00 0.00 0.00 176.54 175.36 1wib h PRO 34 N -0.71 0.00 0.56 4.80 0.13 -1.81 -3.23 132.00 131.73 1wib h PRO 34 Ca -0.01 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 1wib h PRO 34 Cb 0.70 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.84 1wib h PRO 34 CO -0.23 0.32 -0.27 -0.07 -0.23 0.00 0.00 178.00 177.52 1wib h LEU 35 N 0.00 -0.64 0.00 1.56 4.07 -1.68 -3.48 115.31 115.14 1wib h LEU 35 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1wib h LEU 35 Cb 0.74 0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.64 1wib h LEU 35 CO 0.04 -0.42 0.00 0.61 -1.08 0.00 0.00 178.44 177.59 1wib n GLY 36 N -1.27 3.11 3.10 0.83 0.00 -0.63 -5.12 105.19 105.22 1wib n GLY 36 Ca -0.12 -0.59 -0.23 0.00 0.00 0.00 0.00 46.02 45.09 1wib n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wib n LEU 37 N 0.00 -1.12 -4.61 0.99 4.32 -1.26 -4.96 117.00 110.35 1wib n LEU 37 Ca 0.00 -0.51 -0.32 0.00 -0.02 0.00 0.00 56.01 55.16 1wib n LEU 37 Cb 0.00 -0.86 -0.10 0.00 -1.62 0.00 0.00 43.42 40.84 1wib n LEU 37 CO 0.00 -3.64 -0.37 -0.44 -1.22 0.00 0.00 177.39 171.72 1wib s SER 38 N -2.30 4.73 0.33 -1.43 0.01 -1.26 -4.73 113.70 109.05 1wib s SER 38 Ca 0.47 -0.12 0.12 0.00 1.31 0.00 0.00 55.95 57.73 1wib s SER 38 Cb -0.09 -1.13 0.56 0.00 0.21 0.00 0.00 66.02 65.57 1wib s SER 38 CO 0.43 0.28 1.73 1.55 0.41 0.00 0.00 173.24 177.64 1wib h PRO 39 N 4.49 0.00 0.09 12.44 0.13 -1.93 -2.64 132.00 144.58 1wib h PRO 39 Ca -0.49 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1wib h PRO 39 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1wib h PRO 39 CO 0.54 0.48 -0.04 0.87 -0.23 0.00 0.00 178.00 179.62 1wib h LYS 40 N 0.00 -0.12 -0.31 0.86 1.57 -1.97 0.43 116.57 117.03 1wib h LYS 40 Ca -0.00 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1wib h LYS 40 Cb 0.86 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.18 1wib h LYS 40 CO 0.06 0.26 0.20 0.87 -0.57 0.00 0.00 179.45 180.28 1wib h LYS 41 N -0.53 0.40 -0.25 3.15 1.79 -1.99 0.22 116.57 119.35 1wib h LYS 41 Ca -0.01 -0.02 -0.08 0.00 -2.18 0.00 0.00 60.65 58.35 1wib h LYS 41 Cb 0.44 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.00 1wib h LYS 41 CO 0.02 0.26 -0.15 0.28 -1.08 0.00 0.00 179.45 178.78 1wib h VAL 42 N 0.41 1.30 -0.61 0.50 2.07 -1.51 -2.28 116.25 116.14 1wib h VAL 42 Ca 0.12 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.35 1wib h VAL 42 Cb -0.03 1.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1wib h VAL 42 CO -0.04 0.39 0.26 1.23 0.02 0.00 0.00 177.57 179.44 1wib h GLY 43 N 0.27 0.96 1.63 2.17 0.00 0.04 -2.64 103.07 105.50 1wib h GLY 43 Ca 0.05 -0.51 -0.07 0.00 0.00 0.00 0.00 47.33 46.81 1wib h GLY 43 CO 0.04 0.48 -0.14 -1.80 0.00 0.00 0.00 176.54 175.12 1wib h ASP 44 N 0.84 0.43 -0.38 0.19 3.58 -0.57 -2.11 116.42 118.39 1wib h ASP 44 Ca 0.20 -0.11 0.03 0.00 0.42 0.00 0.00 57.03 57.57 1wib h ASP 44 Cb 0.17 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 1wib h ASP 44 CO -0.02 0.60 0.18 0.44 -2.88 0.00 0.00 179.24 177.56 1wib h ASP 45 N 0.41 0.26 -0.29 2.28 5.19 -1.04 0.14 116.42 123.37 1wib h ASP 45 Ca 0.08 0.02 -0.13 0.00 -0.62 0.00 0.00 57.03 56.38 1wib h ASP 45 Cb 0.50 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 39.98 1wib h ASP 45 CO 0.03 0.19 -0.31 0.40 -3.12 0.00 0.00 179.24 176.43 1wib h ILE 46 N 0.37 1.30 -0.31 0.35 5.03 -1.37 -2.32 117.51 120.56 1wib h ILE 46 Ca 0.16 -1.48 0.03 0.00 -0.12 0.00 0.00 64.86 63.45 1wib h ILE 46 Cb 0.08 1.60 -0.03 0.00 -3.03 0.00 0.00 36.82 35.44 1wib h ILE 46 CO -0.12 0.48 0.12 0.00 -0.68 0.00 0.00 178.15 177.94 1wib h ALA 47 N 0.70 0.36 -0.18 1.87 0.00 -1.08 0.14 119.26 121.06 1wib h ALA 47 Ca 0.04 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1wib h ALA 47 Cb 0.89 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1wib h ALA 47 CO 0.08 -0.28 0.09 0.87 0.00 0.00 0.00 179.25 180.01 1wib h LYS 48 N 0.26 0.27 -0.71 0.00 1.57 -0.98 -2.18 116.57 114.79 1wib h LYS 48 Ca 0.14 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1wib h LYS 48 Cb 0.10 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.32 1wib h LYS 48 CO -0.13 0.31 0.47 0.00 -0.57 0.00 0.00 179.45 179.52 1wib h ALA 49 N 0.95 0.91 -0.26 3.86 0.00 -1.13 -1.37 119.26 122.21 1wib h ALA 49 Ca 0.06 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1wib h ALA 49 Cb 0.13 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 1wib h ALA 49 CO -0.01 0.30 0.09 0.25 0.00 0.00 0.00 179.25 179.89 1wib n THR 50 N -4.60 1.30 0.06 0.00 -2.24 0.46 -4.14 114.28 105.11 1wib n THR 50 Ca 0.07 -0.57 -0.10 0.00 -2.27 0.00 0.00 64.05 61.18 1wib n THR 50 Cb 0.03 -0.57 0.03 0.00 -2.10 0.00 0.00 70.33 67.72 1wib n THR 50 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1wib h GLY 51 N 3.99 0.43 2.00 3.38 0.00 -0.59 -0.69 103.07 111.58 1wib h GLY 51 Ca 0.09 -0.62 -0.11 0.00 0.00 0.00 0.00 47.33 46.70 1wib h GLY 51 CO 0.26 0.55 -0.51 -1.80 0.00 0.00 0.00 176.54 175.04 1wib h ASP 52 N 0.26 0.00 -0.99 0.19 1.82 -1.79 -3.22 116.42 112.68 1wib h ASP 52 Ca -0.03 0.00 -0.51 0.00 -0.39 0.00 0.00 57.03 56.10 1wib h ASP 52 Cb 1.32 0.00 -0.42 0.00 0.68 0.00 0.00 39.33 40.91 1wib h ASP 52 CO 0.13 0.51 -0.86 -2.67 -1.61 0.00 0.00 179.24 174.73 1wib n TRP 53 N -3.91 2.64 -2.16 0.28 2.14 -1.19 -5.06 117.44 110.18 1wib n TRP 53 Ca -0.01 -2.57 -0.42 0.00 2.07 0.00 0.00 57.50 56.57 1wib n TRP 53 Cb 0.53 -0.24 -0.03 0.00 -0.81 0.00 0.00 31.31 30.75 1wib n TRP 53 CO 0.00 0.00 0.00 0.21 2.07 0.00 0.00 177.69 179.97 1wib s LYS 54 N -3.56 4.28 0.00 -2.67 2.20 -0.27 -2.59 119.74 117.13 1wib s LYS 54 Ca 0.45 2.06 0.00 0.00 -0.36 0.00 0.00 55.97 58.12 1wib s LYS 54 Cb 0.40 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 33.26 1wib s LYS 54 CO -0.05 -0.55 0.00 0.41 -0.36 0.00 0.00 175.35 174.80 1wib n GLY 55 N 3.65 1.45 3.91 5.54 0.00 -1.14 -5.01 105.19 113.58 1wib n GLY 55 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1wib n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wib s LEU 56 N 0.00 4.27 -0.25 0.99 1.02 -1.07 -4.81 118.68 118.83 1wib s LEU 56 Ca 0.00 0.48 -0.24 0.00 0.02 0.00 0.00 54.13 54.38 1wib s LEU 56 Cb 0.00 -3.21 -0.00 0.00 0.02 0.00 0.00 46.19 42.99 1wib s LEU 56 CO 0.00 0.04 0.82 -0.60 0.02 0.00 0.00 176.35 176.63 1wib s ARG 57 N -2.85 4.15 0.06 1.70 6.06 -1.26 -2.57 118.95 124.25 1wib s ARG 57 Ca 0.39 0.88 -0.03 0.00 -2.50 0.00 0.00 55.73 54.47 1wib s ARG 57 Cb -0.12 -3.66 -0.03 0.00 0.06 0.00 0.00 34.95 31.21 1wib s ARG 57 CO 0.27 -0.53 0.03 0.96 -2.50 0.00 0.00 175.30 173.52 1wib s ILE 58 N 2.85 0.20 -0.19 4.11 -5.25 -1.26 -5.02 121.20 116.64 1wib s ILE 58 Ca 0.34 -1.62 -0.09 0.00 -0.99 0.00 0.00 60.65 58.29 1wib s ILE 58 Cb -0.15 -1.43 -0.05 0.00 2.95 0.00 0.00 42.46 43.78 1wib s ILE 58 CO 0.08 -0.89 0.12 -0.89 -1.79 0.00 0.00 174.94 171.56 1wib s THR 59 N -3.81 5.29 -0.06 8.37 2.01 -1.26 -4.33 115.64 121.85 1wib s THR 59 Ca 0.06 0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.25 1wib s THR 59 Cb 0.07 -3.40 -0.01 0.00 0.01 0.00 0.00 72.50 69.17 1wib s THR 59 CO -0.10 0.47 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.38 1wib s VAL 60 N 0.19 2.28 -0.30 3.82 1.01 -1.25 -3.14 120.40 123.01 1wib s VAL 60 Ca 0.08 -0.98 -0.10 0.00 0.00 0.00 0.00 61.98 60.98 1wib s VAL 60 Cb -0.11 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 1wib s VAL 60 CO -0.01 0.57 0.16 -1.59 0.00 0.00 0.00 175.10 174.22 1wib s LYS 61 N -0.17 3.51 -0.27 2.72 -2.85 -1.10 -3.40 119.74 118.16 1wib s LYS 61 Ca -0.03 -0.61 -0.07 0.00 -1.00 0.00 0.00 55.97 54.26 1wib s LYS 61 Cb -0.14 -3.57 -0.01 0.00 -2.06 0.00 0.00 37.83 32.05 1wib s LYS 61 CO 0.04 -0.34 0.08 -0.51 0.10 0.00 0.00 175.35 174.71 1wib s LEU 62 N 1.65 3.66 -0.16 2.77 1.43 0.01 -3.72 118.68 124.32 1wib s LEU 62 Ca 0.05 -0.44 -0.03 0.00 -1.03 0.00 0.00 54.13 52.68 1wib s LEU 62 Cb -0.17 -1.91 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 1wib s LEU 62 CO 0.07 -0.11 -0.05 0.28 0.23 0.00 0.00 176.35 176.76 1wib s THR 63 N 1.57 3.70 -0.25 5.49 -1.32 -1.20 -0.94 115.64 122.69 1wib s THR 63 Ca 0.05 -0.42 -0.08 0.00 -1.21 0.00 0.00 61.69 60.02 1wib s THR 63 Cb -0.16 -2.62 -0.04 0.00 -1.51 0.00 0.00 72.50 68.17 1wib s THR 63 CO 0.03 0.49 0.10 -0.63 -2.21 0.00 0.00 174.62 172.40 1wib s ILE 64 N 0.50 4.63 -0.11 5.08 -1.09 -1.24 -1.94 121.20 127.03 1wib s ILE 64 Ca -0.04 -0.07 -0.05 0.00 -2.23 0.00 0.00 60.65 58.26 1wib s ILE 64 Cb -0.15 -3.17 0.05 0.00 -1.58 0.00 0.00 42.46 37.62 1wib s ILE 64 CO 0.03 0.33 0.25 -1.58 -1.23 0.00 0.00 174.94 172.73 1wib s GLN 65 N 1.54 0.19 -1.44 2.79 0.74 0.49 -4.51 119.66 119.45 1wib s GLN 65 Ca 0.06 0.57 -0.02 0.00 0.05 0.00 0.00 55.36 56.02 1wib s GLN 65 Cb -0.15 -0.11 0.02 0.00 1.10 0.00 0.00 33.01 33.87 1wib s GLN 65 CO 0.05 -0.19 0.43 -1.71 -0.55 0.00 0.00 175.29 173.33 1wib n ASN 66 N 4.44 -0.55 -2.54 6.67 2.85 -1.26 0.38 115.26 125.25 1wib n ASN 66 Ca -0.22 -1.02 -0.21 0.00 -0.11 0.00 0.00 54.58 53.02 1wib n ASN 66 Cb 0.52 -2.96 0.00 0.00 1.24 0.00 0.00 39.78 38.58 1wib n ASN 66 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1wib n ARG 67 N -4.41 -2.42 -4.90 1.20 1.74 -1.26 -4.98 116.66 101.62 1wib n ARG 67 Ca -0.27 1.00 -0.26 0.00 -0.77 0.00 0.00 57.85 57.54 1wib n ARG 67 Cb 0.67 -5.71 -0.16 0.00 -1.02 0.00 0.00 32.46 26.24 1wib n ARG 67 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1wib s GLN 68 N -5.20 1.60 -0.05 5.56 0.74 0.16 -5.02 119.66 117.45 1wib s GLN 68 Ca 0.07 -0.66 0.04 0.00 0.05 0.00 0.00 55.36 54.86 1wib s GLN 68 Cb -0.03 -1.50 -0.03 0.00 1.10 0.00 0.00 33.01 32.55 1wib s GLN 68 CO 0.09 0.37 -0.14 0.00 -0.55 0.00 0.00 175.29 175.05 1wib s ALA 69 N -0.32 2.69 -0.02 1.58 0.00 -1.26 -0.38 121.76 124.06 1wib s ALA 69 Ca 0.04 -0.98 0.07 0.00 0.00 0.00 0.00 51.96 51.09 1wib s ALA 69 Cb -0.08 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 22.03 1wib s ALA 69 CO 0.00 0.56 -0.23 -1.14 0.00 0.00 0.00 175.76 174.95 1wib s GLN 70 N -0.78 2.16 -0.09 0.00 2.00 -0.82 -4.96 119.66 117.17 1wib s GLN 70 Ca 0.12 -0.90 0.04 0.00 -2.00 0.00 0.00 55.36 52.62 1wib s GLN 70 Cb -0.11 -2.12 0.00 0.00 0.80 0.00 0.00 33.01 31.59 1wib s GLN 70 CO 0.01 0.57 -0.23 0.96 -0.50 0.00 0.00 175.29 176.10 1wib s ILE 71 N -0.68 1.96 -0.18 -2.34 -4.36 -1.26 -3.25 121.20 111.09 1wib s ILE 71 Ca 0.11 -0.96 -0.15 0.00 -0.26 0.00 0.00 60.65 59.39 1wib s ILE 71 Cb -0.10 -1.69 0.05 0.00 1.25 0.00 0.00 42.46 41.96 1wib s ILE 71 CO 0.00 0.54 0.46 -0.70 0.24 0.00 0.00 174.94 175.47 1wib s GLU 72 N 0.34 0.51 -0.22 0.37 2.56 -1.24 -5.04 118.70 115.98 1wib s GLU 72 Ca -0.17 0.69 -0.10 0.00 0.00 0.00 0.00 54.97 55.38 1wib s GLU 72 Cb -0.17 0.20 -0.05 0.00 2.00 0.00 0.00 34.13 36.10 1wib s GLU 72 CO 0.08 -0.09 0.14 0.08 -0.56 0.00 0.00 175.26 174.91 1wib s VAL 73 N 0.53 5.33 0.23 3.70 1.01 -1.26 -2.72 120.40 127.22 1wib s VAL 73 Ca -0.02 0.16 -0.20 0.00 0.00 0.00 0.00 61.98 61.92 1wib s VAL 73 Cb -0.04 -3.46 -0.08 0.00 0.00 0.00 0.00 36.38 32.80 1wib s VAL 73 CO -0.03 0.39 0.74 0.68 0.00 0.00 0.00 175.10 176.88 1wib s VAL 74 N 0.72 4.54 0.15 2.92 -7.23 -1.19 -4.99 120.40 115.33 1wib s VAL 74 Ca 0.07 1.33 -0.09 0.00 -1.81 0.00 0.00 61.98 61.48 1wib s VAL 74 Cb -0.12 -3.88 -0.04 0.00 0.56 0.00 0.00 36.38 32.90 1wib s VAL 74 CO 0.01 0.22 1.49 1.55 -0.31 0.00 0.00 175.10 178.06 1wib h PRO 75 N 3.44 0.88 -3.66 4.82 0.13 -1.98 -3.44 132.00 132.18 1wib h PRO 75 Ca -0.48 -0.47 -0.06 0.00 -0.87 0.00 0.00 66.00 64.12 1wib h PRO 75 Cb 1.19 0.02 -0.09 0.00 0.13 0.00 0.00 31.00 32.25 1wib h PRO 75 CO 0.65 1.11 -0.13 -1.54 -0.23 0.00 0.00 178.00 177.86 1wib s SER 76 N -6.85 -0.09 -0.12 1.44 1.04 -1.26 -5.11 113.70 102.75 1wib s SER 76 Ca -0.10 -0.91 0.02 0.00 0.48 0.00 0.00 55.95 55.44 1wib s SER 76 Cb 0.11 0.57 -0.01 0.00 0.10 0.00 0.00 66.02 66.80 1wib s SER 76 CO 0.87 -1.11 -0.18 0.00 0.98 0.00 0.00 173.24 173.80 1wib s ALA 77 N -4.01 2.41 0.23 5.32 0.00 -1.26 -5.08 121.76 119.38 1wib s ALA 77 Ca 0.22 -0.93 -0.20 0.00 0.00 0.00 0.00 51.96 51.05 1wib s ALA 77 Cb -0.00 -1.03 0.03 0.00 0.00 0.00 0.00 23.12 22.12 1wib s ALA 77 CO 0.08 0.26 0.64 -1.12 0.00 0.00 0.00 175.76 175.62 1wib s SER 78 N 0.35 -0.31 -0.63 0.00 0.01 -1.26 -5.09 113.70 106.77 1wib s SER 78 Ca -0.14 -0.48 -0.26 0.00 1.31 0.00 0.00 55.95 56.38 1wib s SER 78 Cb -0.17 0.66 -0.11 0.00 0.21 0.00 0.00 66.02 66.61 1wib s SER 78 CO 0.07 -1.19 2.44 0.00 0.41 0.00 0.00 173.24 174.97 1wib n ALA 79 N -0.41 0.64 -3.78 1.44 0.00 -1.26 -4.87 120.51 112.27 1wib n ALA 79 Ca -0.08 -0.97 -0.34 0.00 0.00 0.00 0.00 53.44 52.05 1wib n ALA 79 Cb 0.61 -3.10 -0.10 0.00 0.00 0.00 0.00 19.45 16.86 1wib n ALA 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wib s LEU 80 N 12.04 5.03 -0.17 0.00 1.43 -1.26 -5.02 118.68 130.73 1wib s LEU 80 Ca 1.02 -3.17 -0.05 0.00 -1.03 0.00 0.00 54.13 50.90 1wib s LEU 80 Cb -0.31 -1.79 0.06 0.00 0.03 0.00 0.00 46.19 44.18 1wib s LEU 80 CO 0.26 -0.27 0.10 -0.55 0.23 0.00 0.00 176.35 176.12 1wib s SER 81 N 0.05 2.27 0.00 2.29 0.15 -1.26 -5.03 113.70 112.16 1wib s SER 81 Ca 0.20 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.26 1wib s SER 81 Cb -0.17 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 63.94 1wib s SER 81 CO -0.06 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 174.64 1wib n GLY 82 N 5.28 -1.04 0.26 9.45 0.00 -1.26 -5.05 105.19 112.83 1wib n GLY 82 Ca -0.07 0.59 -0.12 0.00 0.00 0.00 0.00 46.02 46.43 1wib n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wib h PRO 83 N 0.00 0.84 -6.89 1.61 0.13 -1.99 -3.46 132.00 122.25 1wib h PRO 83 Ca 0.00 -0.44 -0.50 0.00 -0.87 0.00 0.00 66.00 64.19 1wib h PRO 83 Cb 0.00 0.01 0.22 0.00 0.13 0.00 0.00 31.00 31.36 1wib h PRO 83 CO 0.00 1.08 -0.48 0.45 -0.23 0.00 0.00 178.00 178.82 1wib n SER 84 N -4.05 -1.66 -4.63 1.44 2.88 -1.26 -4.89 113.62 101.46 1wib n SER 84 Ca -0.02 0.20 -0.38 0.00 -1.33 0.00 0.00 58.87 57.35 1wib n SER 84 Cb 0.54 -1.21 0.05 0.00 -0.75 0.00 0.00 64.21 62.84 1wib n SER 84 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1wib n SER 85 N -2.31 0.90 0.00 -3.46 3.41 -1.26 -5.22 113.62 105.68 1wib n SER 85 Ca 0.06 0.81 0.00 0.00 -0.26 0.00 0.00 58.87 59.48 1wib n SER 85 Cb 0.55 -1.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.10 1wib n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49