#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wib n SER -5 N 0.00 0.04 -4.03 1.61 2.88 -1.26 -5.04 113.62 107.83 1wib n SER -5 Ca 0.00 0.11 -0.31 0.00 -1.33 0.00 0.00 58.87 57.34 1wib n SER -5 Cb 0.00 0.06 -0.00 0.00 -0.75 0.00 0.00 64.21 63.51 1wib n SER -5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1wib n SER -4 N -2.86 -2.89 0.00 -3.46 2.88 -1.26 -4.79 113.62 101.24 1wib n SER -4 Ca 0.00 -0.92 0.00 0.00 -1.33 0.00 0.00 58.87 56.62 1wib n SER -4 Cb 0.10 -3.27 0.00 0.00 -0.75 0.00 0.00 64.21 60.29 1wib n SER -4 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wib n GLY -3 N -1.64 -1.82 3.56 0.46 0.00 -1.26 -5.09 105.19 99.39 1wib n GLY -3 Ca -0.06 0.77 -0.31 0.00 0.00 0.00 0.00 46.02 46.42 1wib n GLY -3 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wib s SER -2 N 0.00 5.24 0.91 1.61 0.01 -1.26 -4.95 113.70 115.25 1wib s SER -2 Ca 0.00 -0.33 -0.12 0.00 1.31 0.00 0.00 55.95 56.81 1wib s SER -2 Cb 0.00 -2.55 0.08 0.00 0.21 0.00 0.00 66.02 63.76 1wib s SER -2 CO 0.00 -2.57 0.79 -1.20 0.41 0.00 0.00 173.24 170.67 1wib n SER -1 N 13.34 -0.74 -3.67 2.44 7.64 -1.26 -5.04 113.62 126.32 1wib n SER -1 Ca 0.32 0.41 -0.15 0.00 1.01 0.00 0.00 58.87 60.47 1wib n SER -1 Cb 0.49 -1.35 -0.08 0.00 -1.01 0.00 0.00 64.21 62.26 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 -2.24 -0.36 0.51 0.23 0.00 -1.26 -5.16 107.32 99.05 1wib s GLY 1 Ca 0.63 1.03 -0.21 0.00 0.00 0.00 0.00 44.72 46.18 1wib s GLY 1 CO 0.61 0.79 1.14 2.56 0.00 0.00 0.00 173.10 178.21 1wib s PRO 2 N -0.65 3.51 -0.10 2.90 0.04 -1.26 -4.97 135.00 134.47 1wib s PRO 2 Ca -0.07 1.67 -0.29 0.00 0.04 0.00 0.00 61.00 62.34 1wib s PRO 2 Cb -0.03 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 1wib s PRO 2 CO 0.04 -0.74 1.53 -1.25 0.04 0.00 0.00 177.00 176.62 1wib s PRO 3 N -3.07 4.16 -0.47 0.56 0.04 -1.26 -4.98 135.00 129.98 1wib s PRO 3 Ca 0.69 1.97 -0.17 0.00 0.04 0.00 0.00 61.00 63.54 1wib s PRO 3 Cb -0.26 -3.92 0.06 0.00 0.04 0.00 0.00 34.50 30.43 1wib s PRO 3 CO 0.30 -0.84 0.45 0.21 0.04 0.00 0.00 177.00 177.16 1wib s LYS 4 N 3.93 3.02 -1.35 4.56 2.20 -1.26 -4.98 119.74 125.86 1wib s LYS 4 Ca 0.67 -1.17 -0.11 0.00 -0.36 0.00 0.00 55.97 55.00 1wib s LYS 4 Cb -0.29 -4.11 0.12 0.00 -1.51 0.00 0.00 37.83 32.05 1wib s LYS 4 CO 0.25 -1.05 2.01 1.19 -0.36 0.00 0.00 175.35 177.38 1wib n PHE 5 N 5.48 3.14 0.37 4.03 3.72 -1.26 -4.76 117.46 128.18 1wib n PHE 5 Ca -0.10 -2.85 -0.15 0.00 -0.05 0.00 0.00 57.45 54.29 1wib n PHE 5 Cb 0.45 -2.17 -0.07 0.00 -0.94 0.00 0.00 39.48 36.75 1wib n PHE 5 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 1wib h ASP 6 N 5.82 -0.81 0.00 4.37 3.58 -1.93 -2.49 116.42 124.96 1wib h ASP 6 Ca 0.46 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.94 1wib h ASP 6 Cb 0.63 0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.89 1wib h ASP 6 CO 1.72 -0.45 0.00 -0.81 -2.88 0.00 0.00 179.24 176.83 1wib n PRO 7 N -5.33 0.49 -0.10 0.28 -0.04 -1.26 -2.79 135.00 126.25 1wib n PRO 7 Ca -0.12 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.12 1wib n PRO 7 Cb 0.38 -1.39 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 1wib n PRO 7 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1wib n ASN 8 N -0.89 1.99 -4.72 3.54 4.05 -1.13 -4.84 115.26 113.26 1wib n ASN 8 Ca 0.09 0.15 -0.42 0.00 0.45 0.00 0.00 54.58 54.86 1wib n ASN 8 Cb 0.04 -0.71 -0.03 0.00 1.23 0.00 0.00 39.78 40.31 1wib n ASN 8 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 177.26 173.51 1wib s GLU 9 N -2.50 4.44 0.02 1.20 2.12 -0.95 -5.03 118.70 118.00 1wib s GLU 9 Ca -0.32 1.84 0.01 0.00 0.36 0.00 0.00 54.97 56.86 1wib s GLU 9 Cb 0.10 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 31.15 1wib s GLU 9 CO 0.61 -0.22 0.07 0.54 -0.54 0.00 0.00 175.26 175.72 1wib s VAL 10 N 0.72 4.59 -0.06 3.70 0.11 -1.26 -4.97 120.40 123.22 1wib s VAL 10 Ca 0.58 -0.55 -0.00 0.00 -2.93 0.00 0.00 61.98 59.07 1wib s VAL 10 Cb -0.31 -3.13 0.03 0.00 -1.53 0.00 0.00 36.38 31.43 1wib s VAL 10 CO 0.32 0.28 -0.02 -0.75 -3.33 0.00 0.00 175.10 171.59 1wib s LYS 11 N -1.94 0.71 -0.03 1.54 2.47 -1.26 -5.14 119.74 116.09 1wib s LYS 11 Ca 0.25 0.00 -0.03 0.00 -1.56 0.00 0.00 55.97 54.63 1wib s LYS 11 Cb -0.12 -0.90 -0.04 0.00 -1.46 0.00 0.00 37.83 35.32 1wib s LYS 11 CO 0.16 -0.19 0.14 0.08 0.16 0.00 0.00 175.35 175.70 1wib s VAL 12 N 1.43 5.19 -0.00 4.02 1.01 -1.26 -4.17 120.40 126.61 1wib s VAL 12 Ca -0.03 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 61.86 1wib s VAL 12 Cb -0.13 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 1wib s VAL 12 CO -0.03 0.40 -0.23 -0.69 0.00 0.00 0.00 175.10 174.55 1wib s VAL 13 N -1.21 1.84 -0.07 2.92 1.01 -0.73 -4.94 120.40 119.23 1wib s VAL 13 Ca 0.23 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 61.17 1wib s VAL 13 Cb -0.12 -1.54 0.01 0.00 0.00 0.00 0.00 36.38 34.73 1wib s VAL 13 CO 0.14 0.46 -0.12 -0.31 0.00 0.00 0.00 175.10 175.26 1wib s TYR 14 N -0.61 1.47 0.19 5.22 2.02 -1.26 -0.30 117.35 124.08 1wib s TYR 14 Ca 0.09 -0.55 0.09 0.00 -0.37 0.00 0.00 57.07 56.33 1wib s TYR 14 Cb -0.09 -1.08 -0.04 0.00 -0.40 0.00 0.00 41.96 40.34 1wib s TYR 14 CO -0.00 -0.29 -0.18 -0.51 -1.57 0.00 0.00 175.55 172.99 1wib s LEU 15 N 0.72 2.49 -0.24 -1.29 1.02 -1.22 -5.01 118.68 115.15 1wib s LEU 15 Ca -0.13 -0.92 -0.04 0.00 0.02 0.00 0.00 54.13 53.05 1wib s LEU 15 Cb -0.16 -0.87 0.00 0.00 0.02 0.00 0.00 46.19 45.19 1wib s LEU 15 CO 0.03 -0.04 -0.03 -0.13 0.02 0.00 0.00 176.35 176.20 1wib s ARG 16 N -3.09 3.20 0.20 1.70 0.52 -1.26 -3.93 118.95 116.30 1wib s ARG 16 Ca 0.20 -0.74 -0.22 0.00 -0.52 0.00 0.00 55.73 54.45 1wib s ARG 16 Cb -0.05 -3.05 0.05 0.00 0.52 0.00 0.00 34.95 32.42 1wib s ARG 16 CO 0.08 -0.28 0.63 0.00 0.02 0.00 0.00 175.30 175.75 1wib s THR 18 N -3.82 4.44 0.98 0.00 2.01 -1.26 -4.44 115.64 113.55 1wib s THR 18 Ca 0.05 1.55 -0.12 0.00 0.31 0.00 0.00 61.69 63.49 1wib s THR 18 Cb -0.03 -4.02 0.13 0.00 0.01 0.00 0.00 72.50 68.59 1wib s THR 18 CO -0.05 0.39 0.82 0.61 -0.69 0.00 0.00 174.62 175.70 1wib n GLY 19 N 1.22 -1.27 3.97 4.40 0.00 -1.23 -3.06 105.19 109.21 1wib n GLY 19 Ca -0.04 -0.80 -0.26 0.00 0.00 0.00 0.00 46.02 44.92 1wib n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wib n GLY 20 N 0.88 -0.11 2.90 -0.02 0.00 -1.09 -4.23 105.19 103.52 1wib n GLY 20 Ca 0.08 0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 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 -6.50 1.73 -0.15 1.61 2.12 -1.17 -4.97 118.70 111.37 1wib s GLU 21 Ca 0.05 -2.36 -0.00 0.00 0.36 0.00 0.00 54.97 53.02 1wib s GLU 21 Cb -0.03 -3.05 -0.01 0.00 0.26 0.00 0.00 34.13 31.31 1wib s GLU 21 CO 0.81 -1.10 -0.13 0.54 -0.54 0.00 0.00 175.26 174.84 1wib s VAL 22 N 0.04 2.92 0.08 3.70 0.11 -1.26 -4.95 120.40 121.03 1wib s VAL 22 Ca 0.16 -0.69 0.00 0.00 -2.93 0.00 0.00 61.98 58.52 1wib s VAL 22 Cb -0.25 -2.24 0.00 0.00 -1.53 0.00 0.00 36.38 32.37 1wib s VAL 22 CO -0.01 0.51 0.00 0.61 -3.33 0.00 0.00 175.10 172.88 1wib n GLY 23 N 3.85 -0.20 3.43 6.54 0.00 -1.26 -5.15 105.19 112.40 1wib n GLY 23 Ca -0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.00 -1.44 -0.65 4.61 0.00 -1.26 -5.05 121.76 115.97 1wib s ALA 24 Ca 0.00 1.06 -0.02 0.00 0.00 0.00 0.00 51.96 53.00 1wib s ALA 24 Cb 0.00 -0.08 0.45 0.00 0.00 0.00 0.00 23.12 23.50 1wib s ALA 24 CO 0.00 -0.33 2.03 0.25 0.00 0.00 0.00 175.76 177.71 1wib n THR 25 N 1.21 3.59 0.15 0.00 -2.24 -1.26 -4.57 114.28 111.16 1wib n THR 25 Ca -0.19 -2.84 0.02 0.00 -2.27 0.00 0.00 64.05 58.77 1wib n THR 25 Cb 0.57 -1.13 0.35 0.00 -2.10 0.00 0.00 70.33 68.01 1wib n THR 25 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1wib h SER 26 N 1.93 0.11 0.42 3.42 0.02 -2.00 0.29 113.55 117.74 1wib h SER 26 Ca 0.60 -0.03 -0.28 0.00 -0.84 0.00 0.00 61.79 61.23 1wib h SER 26 Cb 0.91 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 63.37 1wib h SER 26 CO 1.55 0.42 -1.80 0.00 -1.14 0.00 0.00 176.83 175.85 1wib n ALA 27 N -2.48 1.59 0.16 3.77 0.00 -1.26 -4.09 120.51 118.20 1wib n ALA 27 Ca -0.02 -0.84 0.07 0.00 0.00 0.00 0.00 53.44 52.66 1wib n ALA 27 Cb 0.38 -0.74 0.07 0.00 0.00 0.00 0.00 19.45 19.16 1wib n ALA 27 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1wib h LEU 28 N 0.00 0.00 0.38 0.00 3.38 -1.84 -3.25 115.31 113.98 1wib h LEU 28 Ca -0.31 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.65 1wib h LEU 28 Cb 1.98 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.70 1wib h LEU 28 CO 0.06 0.26 -0.40 0.00 0.09 0.00 0.00 178.44 178.45 1wib h ALA 29 N 1.74 -0.86 0.00 1.53 0.00 -0.57 0.89 119.26 122.00 1wib h ALA 29 Ca -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1wib h ALA 29 Cb 1.21 0.58 -0.00 0.00 0.00 0.00 0.00 17.79 19.58 1wib h ALA 29 CO 0.03 -1.02 -0.03 -1.00 0.00 0.00 0.00 179.25 177.22 1wib h PRO 30 N -0.80 0.00 0.01 0.00 0.13 -1.76 0.75 132.00 130.32 1wib h PRO 30 Ca -0.03 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.98 1wib h PRO 30 Cb 0.73 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.87 1wib h PRO 30 CO -0.08 0.03 -0.50 0.87 -0.23 0.00 0.00 178.00 178.10 1wib h LYS 31 N 0.00 0.31 0.00 0.86 1.79 -1.45 -3.33 116.57 114.75 1wib h LYS 31 Ca -0.00 -0.35 0.00 0.00 -2.18 0.00 0.00 60.65 58.12 1wib h LYS 31 Cb 0.51 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.27 1wib h LYS 31 CO 0.00 1.06 -1.06 -0.89 -1.08 0.00 0.00 179.45 177.48 1wib n ILE 32 N -4.31 0.21 -0.34 1.86 5.41 0.26 -4.36 119.36 118.09 1wib n ILE 32 Ca -0.10 -0.29 -0.11 0.00 1.00 0.00 0.00 62.75 63.24 1wib n ILE 32 Cb 0.63 0.12 -0.09 0.00 -0.71 0.00 0.00 39.64 39.59 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 4.46 -0.85 1.83 7.39 0.00 0.41 0.40 103.07 116.71 1wib h GLY 33 Ca 0.00 0.76 -0.11 0.00 0.00 0.00 0.00 47.33 47.98 1wib h GLY 33 CO 0.00 -0.01 -0.47 -0.56 0.00 0.00 0.00 176.54 175.51 1wib h PRO 34 N -0.11 0.19 -0.32 4.80 0.13 -1.78 -3.19 132.00 131.72 1wib h PRO 34 Ca 0.14 -0.10 0.05 0.00 -0.87 0.00 0.00 66.00 65.22 1wib h PRO 34 Cb 0.47 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.56 1wib h PRO 34 CO -0.84 0.62 0.03 -0.07 -0.23 0.00 0.00 178.00 177.51 1wib h LEU 35 N 0.16 -0.05 0.00 1.56 4.07 -1.18 -3.47 115.31 116.39 1wib h LEU 35 Ca 0.01 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1wib h LEU 35 Cb 0.89 0.10 0.00 0.00 1.08 0.00 0.00 40.66 42.72 1wib h LEU 35 CO 0.07 0.01 0.00 0.61 -1.08 0.00 0.00 178.44 178.05 1wib n GLY 36 N -1.23 3.02 2.28 0.83 0.00 -0.42 -5.11 105.19 104.56 1wib n GLY 36 Ca 0.01 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 -4.52 0.99 4.32 -1.26 -4.95 117.00 111.58 1wib n LEU 37 Ca 0.00 -0.44 -0.32 0.00 -0.02 0.00 0.00 56.01 55.23 1wib n LEU 37 Cb 0.00 -0.62 -0.12 0.00 -1.62 0.00 0.00 43.42 41.06 1wib n LEU 37 CO 0.00 -2.27 -0.44 -0.44 -1.22 0.00 0.00 177.39 173.03 1wib s SER 38 N -2.22 4.20 0.30 -1.43 0.01 -1.26 -4.69 113.70 108.61 1wib s SER 38 Ca 0.34 -0.23 0.09 0.00 1.31 0.00 0.00 55.95 57.45 1wib s SER 38 Cb -0.06 -0.88 0.47 0.00 0.21 0.00 0.00 66.02 65.76 1wib s SER 38 CO 0.28 0.30 1.69 1.55 0.41 0.00 0.00 173.24 177.47 1wib h PRO 39 N 4.82 0.13 0.08 12.44 0.13 -1.93 -2.91 132.00 144.75 1wib h PRO 39 Ca -0.48 -0.07 -0.00 0.00 -0.87 0.00 0.00 66.00 64.58 1wib h PRO 39 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1wib h PRO 39 CO 0.51 0.58 -0.04 1.57 -0.23 0.00 0.00 178.00 180.39 1wib h LYS 40 N 0.10 -0.10 -0.26 0.86 2.10 -1.96 0.45 116.57 117.76 1wib h LYS 40 Ca 0.00 0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.65 1wib h LYS 40 Cb 0.88 0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 32.22 1wib h LYS 40 CO 0.07 -0.05 0.13 -0.22 -2.00 0.00 0.00 179.45 177.38 1wib h LYS 41 N -0.12 0.38 -0.62 0.07 1.63 -1.99 -1.76 116.57 114.16 1wib h LYS 41 Ca -0.01 -0.05 -0.06 0.00 -0.85 0.00 0.00 60.65 59.68 1wib h LYS 41 Cb 0.10 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1wib h LYS 41 CO 0.02 0.36 0.16 0.28 -3.45 0.00 0.00 179.45 176.82 1wib h VAL 42 N 0.30 1.24 -0.63 2.00 2.07 -1.38 -2.38 116.25 117.47 1wib h VAL 42 Ca 0.09 -0.87 -0.07 0.00 0.82 0.00 0.00 66.70 66.68 1wib h VAL 42 Cb 0.11 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1wib h VAL 42 CO -0.01 0.33 0.13 1.23 0.02 0.00 0.00 177.57 179.27 1wib h GLY 43 N 1.03 1.08 1.00 2.17 0.00 0.18 -2.25 103.07 106.28 1wib h GLY 43 Ca 0.20 -0.67 -0.09 0.00 0.00 0.00 0.00 47.33 46.76 1wib h GLY 43 CO -0.00 0.63 -0.10 -1.80 0.00 0.00 0.00 176.54 175.26 1wib h ASP 44 N 0.96 0.81 -0.45 0.19 3.58 -1.06 -1.99 116.42 118.46 1wib h ASP 44 Ca 0.20 -0.36 0.00 0.00 0.42 0.00 0.00 57.03 57.29 1wib h ASP 44 Cb 0.37 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 1wib h ASP 44 CO 0.00 0.99 0.29 0.44 -2.88 0.00 0.00 179.24 178.08 1wib h ASP 45 N 0.63 0.52 -0.42 2.28 3.32 -1.27 -0.63 116.42 120.85 1wib h ASP 45 Ca 0.11 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1wib h ASP 45 Cb 0.63 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 1wib h ASP 45 CO 0.04 0.40 0.17 0.40 -1.72 0.00 0.00 179.24 178.53 1wib h ILE 46 N 0.60 1.20 -0.20 0.35 2.04 -1.35 -0.62 117.51 119.52 1wib h ILE 46 Ca 0.16 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.40 1wib h ILE 46 Cb -0.04 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1wib h ILE 46 CO -0.03 0.23 0.13 0.00 0.00 0.00 0.00 178.15 178.47 1wib h ALA 47 N 1.01 0.26 -0.73 1.87 0.00 -1.11 0.17 119.26 120.73 1wib h ALA 47 Ca 0.14 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1wib h ALA 47 Cb 0.19 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1wib h ALA 47 CO -0.01 -0.25 0.34 0.87 0.00 0.00 0.00 179.25 180.20 1wib h LYS 48 N 0.26 1.06 -0.47 0.00 1.79 -1.00 -1.73 116.57 116.48 1wib h LYS 48 Ca 0.07 -0.16 -0.09 0.00 -2.18 0.00 0.00 60.65 58.29 1wib h LYS 48 Cb -0.00 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 30.44 1wib h LYS 48 CO -0.01 0.84 -0.07 0.00 -1.08 0.00 0.00 179.45 179.12 1wib h ALA 49 N 1.17 0.64 -0.23 3.86 0.00 -0.83 -2.64 119.26 121.23 1wib h ALA 49 Ca 0.25 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1wib h ALA 49 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1wib h ALA 49 CO -0.03 0.50 0.02 0.25 0.00 0.00 0.00 179.25 179.99 1wib n THR 50 N -4.29 1.11 -0.16 0.00 -2.24 0.56 -4.22 114.28 105.04 1wib n THR 50 Ca 0.00 -0.54 -0.10 0.00 -2.27 0.00 0.00 64.05 61.14 1wib n THR 50 Cb 0.36 -0.46 -0.00 0.00 -2.10 0.00 0.00 70.33 68.13 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 4.48 0.91 2.00 3.38 0.00 -0.93 -2.83 103.07 110.07 1wib h GLY 51 Ca 0.02 -0.71 -0.05 0.00 0.00 0.00 0.00 47.33 46.60 1wib h GLY 51 CO 0.21 0.65 -0.22 -1.80 0.00 0.00 0.00 176.54 175.38 1wib h ASP 52 N 0.68 0.00 -0.54 0.19 1.82 -1.81 -3.05 116.42 113.70 1wib h ASP 52 Ca 0.12 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.60 1wib h ASP 52 Cb 0.58 0.00 -0.10 0.00 0.68 0.00 0.00 39.33 40.49 1wib h ASP 52 CO 0.03 0.22 0.21 0.79 -1.61 0.00 0.00 179.24 178.88 1wib n TRP 53 N -3.23 1.81 -1.67 0.28 8.01 -1.10 -4.95 117.44 116.59 1wib n TRP 53 Ca 0.02 -0.93 -0.42 0.00 -1.31 0.00 0.00 57.50 54.85 1wib n TRP 53 Cb 0.53 -0.55 -0.03 0.00 -2.01 0.00 0.00 31.31 29.25 1wib n TRP 53 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.69 177.04 1wib n LYS 54 N -0.04 2.84 0.00 -0.99 2.85 -1.13 -0.92 118.16 120.77 1wib n LYS 54 Ca 0.30 1.04 0.00 0.00 -1.05 0.00 0.00 58.31 58.60 1wib n LYS 54 Cb 1.11 -2.97 0.00 0.00 -0.65 0.00 0.00 35.03 32.52 1wib n LYS 54 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1wib n GLY 55 N 4.45 2.04 3.81 2.58 0.00 -1.26 -4.96 105.19 111.86 1wib n GLY 55 Ca 0.19 0.00 -0.36 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 4.32 -0.27 0.99 1.02 -0.10 -4.90 118.68 119.74 1wib s LEU 56 Ca 0.00 0.43 -0.16 0.00 0.02 0.00 0.00 54.13 54.41 1wib s LEU 56 Cb 0.00 -2.14 -0.03 0.00 0.02 0.00 0.00 46.19 44.04 1wib s LEU 56 CO 0.00 0.30 0.45 -0.60 0.02 0.00 0.00 176.35 176.52 1wib s ARG 57 N -0.43 4.01 0.06 1.70 3.52 -1.26 -3.56 118.95 122.99 1wib s ARG 57 Ca 0.13 0.15 -0.05 0.00 -0.13 0.00 0.00 55.73 55.84 1wib s ARG 57 Cb -0.12 -3.67 -0.02 0.00 -1.56 0.00 0.00 34.95 29.58 1wib s ARG 57 CO 0.03 -0.34 0.07 0.96 -0.81 0.00 0.00 175.30 175.21 1wib s ILE 58 N 2.20 0.17 -0.10 4.11 -0.00 -1.26 -5.10 121.20 121.22 1wib s ILE 58 Ca 0.18 -1.44 -0.19 0.00 -0.00 0.00 0.00 60.65 59.20 1wib s ILE 58 Cb -0.16 -1.33 -0.04 0.00 -0.00 0.00 0.00 42.46 40.93 1wib s ILE 58 CO 0.10 -0.79 0.52 -0.89 -0.00 0.00 0.00 174.94 173.87 1wib s THR 59 N -3.64 5.15 -0.14 8.37 2.01 -1.26 -4.60 115.64 121.52 1wib s THR 59 Ca 0.04 1.05 -0.01 0.00 0.31 0.00 0.00 61.69 63.08 1wib s THR 59 Cb 0.05 -3.86 -0.02 0.00 0.01 0.00 0.00 72.50 68.68 1wib s THR 59 CO -0.09 0.32 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.36 1wib s VAL 60 N 0.62 3.21 -0.26 3.82 1.01 -1.25 -3.06 120.40 124.49 1wib s VAL 60 Ca 0.28 -0.60 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 1wib s VAL 60 Cb -0.16 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 1wib s VAL 60 CO 0.12 0.51 0.12 -1.59 0.00 0.00 0.00 175.10 174.26 1wib s LYS 61 N 0.49 3.79 -0.25 2.72 -2.85 -1.11 -3.41 119.74 119.12 1wib s LYS 61 Ca -0.08 -0.41 -0.10 0.00 -1.00 0.00 0.00 55.97 54.39 1wib s LYS 61 Cb -0.15 -3.46 -0.04 0.00 -2.06 0.00 0.00 37.83 32.11 1wib s LYS 61 CO 0.04 -0.17 0.14 -0.51 0.10 0.00 0.00 175.35 174.95 1wib s LEU 62 N 1.64 3.90 -0.29 2.77 1.43 0.59 -3.73 118.68 124.98 1wib s LEU 62 Ca 0.07 -0.01 -0.04 0.00 -1.03 0.00 0.00 54.13 53.12 1wib s LEU 62 Cb -0.15 -2.05 0.03 0.00 0.03 0.00 0.00 46.19 44.04 1wib s LEU 62 CO 0.07 0.01 0.03 -0.89 0.23 0.00 0.00 176.35 175.80 1wib s THR 63 N 1.37 3.42 -0.21 5.49 2.01 -1.20 -1.77 115.64 124.74 1wib s THR 63 Ca 0.07 -1.00 -0.06 0.00 0.31 0.00 0.00 61.69 61.01 1wib s THR 63 Cb -0.15 -2.82 -0.03 0.00 0.01 0.00 0.00 72.50 69.51 1wib s THR 63 CO 0.06 0.04 0.02 -0.63 -0.69 0.00 0.00 174.62 173.42 1wib s ILE 64 N 1.38 4.11 -0.08 1.82 1.09 -1.26 -3.03 121.20 125.23 1wib s ILE 64 Ca -0.00 -0.25 -0.05 0.00 -1.10 0.00 0.00 60.65 59.25 1wib s ILE 64 Cb -0.18 -2.88 0.04 0.00 -1.06 0.00 0.00 42.46 38.38 1wib s ILE 64 CO -0.00 0.40 0.20 -1.58 -0.10 0.00 0.00 174.94 173.86 1wib s GLN 65 N 1.14 0.17 -1.39 2.79 0.74 -1.23 -4.61 119.66 117.26 1wib s GLN 65 Ca 0.03 0.43 -0.03 0.00 0.05 0.00 0.00 55.36 55.84 1wib s GLN 65 Cb -0.14 -0.10 0.02 0.00 1.10 0.00 0.00 33.01 33.88 1wib s GLN 65 CO 0.02 -0.14 0.67 -1.71 -0.55 0.00 0.00 175.29 173.58 1wib n ASN 66 N 4.00 -1.60 -3.42 6.67 5.15 -1.26 -1.92 115.26 122.88 1wib n ASN 66 Ca -0.24 -0.87 -0.17 0.00 -0.60 0.00 0.00 54.58 52.70 1wib n ASN 66 Cb 0.53 -3.70 0.09 0.00 -0.53 0.00 0.00 39.78 36.17 1wib n ASN 66 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1wib n ARG 67 N -4.38 -6.23 -4.33 1.20 5.12 -1.26 -5.02 116.66 101.75 1wib n ARG 67 Ca -0.23 0.85 -0.17 0.00 -1.93 0.00 0.00 57.85 56.36 1wib n ARG 67 Cb 0.65 -5.85 -0.10 0.00 -1.16 0.00 0.00 32.46 25.99 1wib n ARG 67 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1wib s GLN 68 N -5.29 1.35 -0.01 5.56 -1.52 -0.81 -5.12 119.66 113.82 1wib s GLN 68 Ca 0.04 -1.68 0.00 0.00 -1.95 0.00 0.00 55.36 51.77 1wib s GLN 68 Cb -0.01 -0.64 0.01 0.00 -0.22 0.00 0.00 33.01 32.16 1wib s GLN 68 CO 0.73 -0.09 -0.00 0.00 -0.25 0.00 0.00 175.29 175.67 1wib s ALA 69 N -3.41 0.16 0.00 6.09 0.00 -1.26 -3.51 121.76 119.83 1wib s ALA 69 Ca 0.29 0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.30 1wib s ALA 69 Cb 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 1wib s ALA 69 CO 0.09 -0.01 -0.03 -0.65 0.00 0.00 0.00 175.76 175.15 1wib s GLN 70 N 0.38 0.26 -0.10 0.00 -1.52 -1.17 -5.01 119.66 112.51 1wib s GLN 70 Ca -0.03 -0.22 0.02 0.00 -1.95 0.00 0.00 55.36 53.17 1wib s GLN 70 Cb -0.05 -0.19 0.02 0.00 -0.22 0.00 0.00 33.01 32.56 1wib s GLN 70 CO -0.01 0.05 -0.14 0.96 -0.25 0.00 0.00 175.29 175.90 1wib s ILE 71 N -0.35 1.35 -0.05 1.08 -4.36 -1.26 -3.27 121.20 114.34 1wib s ILE 71 Ca -0.02 -0.56 -0.15 0.00 -0.26 0.00 0.00 60.65 59.66 1wib s ILE 71 Cb -0.03 -1.25 0.03 0.00 1.25 0.00 0.00 42.46 42.46 1wib s ILE 71 CO -0.00 0.41 0.34 -1.83 0.24 0.00 0.00 174.94 174.10 1wib s GLU 72 N 1.01 0.62 -0.08 0.37 -1.05 -1.24 -5.06 118.70 113.26 1wib s GLU 72 Ca -0.07 0.01 -0.15 0.00 -0.15 0.00 0.00 54.97 54.61 1wib s GLU 72 Cb -0.15 0.28 -0.05 0.00 -0.44 0.00 0.00 34.13 33.78 1wib s GLU 72 CO -0.01 -0.15 0.39 0.08 0.95 0.00 0.00 175.26 176.51 1wib s VAL 73 N -0.92 5.17 0.22 1.83 1.01 -1.26 -2.74 120.40 123.71 1wib s VAL 73 Ca -0.10 0.78 -0.21 0.00 0.00 0.00 0.00 61.98 62.45 1wib s VAL 73 Cb -0.04 -3.71 -0.08 0.00 0.00 0.00 0.00 36.38 32.54 1wib s VAL 73 CO 0.04 0.45 0.74 0.68 0.00 0.00 0.00 175.10 177.01 1wib s VAL 74 N -0.13 4.53 0.07 2.92 -7.23 -1.17 -5.01 120.40 114.38 1wib s VAL 74 Ca 0.22 1.36 -0.01 0.00 -1.81 0.00 0.00 61.98 61.74 1wib s VAL 74 Cb -0.15 -3.90 0.02 0.00 0.56 0.00 0.00 36.38 32.91 1wib s VAL 74 CO 0.10 0.24 0.07 -0.81 -0.31 0.00 0.00 175.10 174.38 1wib n PRO 75 N 0.82 -1.15 -1.53 4.82 -0.04 -1.26 -4.81 135.00 131.86 1wib n PRO 75 Ca -0.03 -0.11 -0.40 0.00 -0.04 0.00 0.00 63.50 62.93 1wib n PRO 75 Cb 0.51 -0.10 -0.06 0.00 -0.04 0.00 0.00 33.50 33.81 1wib n PRO 75 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1wib n SER 76 N -3.11 1.97 -4.71 3.54 3.41 -1.26 -4.92 113.62 108.53 1wib n SER 76 Ca 0.01 -0.15 -0.35 0.00 -0.26 0.00 0.00 58.87 58.11 1wib n SER 76 Cb 0.04 -1.40 -0.09 0.00 -0.26 0.00 0.00 64.21 62.50 1wib n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wib s ALA 77 N 10.41 3.46 -0.29 7.33 0.00 -1.26 -5.01 121.76 136.40 1wib s ALA 77 Ca 1.08 -0.74 0.08 0.00 0.00 0.00 0.00 51.96 52.38 1wib s ALA 77 Cb -0.52 -1.74 0.46 0.00 0.00 0.00 0.00 23.12 21.32 1wib s ALA 77 CO 0.35 0.47 1.18 0.45 0.00 0.00 0.00 175.76 178.21 1wib n SER 78 N 2.55 4.66 -4.28 0.00 2.88 -1.26 -4.95 113.62 113.22 1wib n SER 78 Ca -0.18 -3.61 -0.37 0.00 -1.33 0.00 0.00 58.87 53.38 1wib n SER 78 Cb 0.54 -0.35 -0.04 0.00 -0.75 0.00 0.00 64.21 63.60 1wib n SER 78 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wib n ALA 79 N -0.69 -1.35 -0.81 -1.46 0.00 -1.26 -4.79 120.51 110.14 1wib n ALA 79 Ca 0.41 -0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.63 1wib n ALA 79 Cb 0.95 -2.94 0.01 0.00 0.00 0.00 0.00 19.45 17.46 1wib n ALA 79 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wib n LEU 80 N -4.32 6.06 -4.72 0.00 4.77 -1.26 -4.93 117.00 112.60 1wib n LEU 80 Ca 0.03 -3.06 -0.41 0.00 -0.03 0.00 0.00 56.01 52.53 1wib n LEU 80 Cb 0.51 -1.11 -0.03 0.00 -2.33 0.00 0.00 43.42 40.46 1wib n LEU 80 CO 0.88 1.21 0.81 -0.55 -1.33 0.00 0.00 177.39 178.40 1wib s SER 81 N 0.85 7.22 0.00 -1.43 0.15 -1.26 -4.99 113.70 114.24 1wib s SER 81 Ca 0.25 1.99 0.00 0.00 0.70 0.00 0.00 55.95 58.89 1wib s SER 81 Cb 0.18 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.90 1wib s SER 81 CO -0.02 -0.31 0.18 0.61 1.20 0.00 0.00 173.24 174.90 1wib n GLY 82 N 2.60 -0.65 3.60 9.45 0.00 -1.26 -4.73 105.19 114.20 1wib n GLY 82 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1wib n GLY 82 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wib s PRO 83 N -1.19 3.41 0.81 1.61 0.04 -1.26 -5.00 135.00 133.41 1wib s PRO 83 Ca 0.00 1.31 -0.11 0.00 0.04 0.00 0.00 61.00 62.24 1wib s PRO 83 Cb 0.00 -4.15 0.09 0.00 0.04 0.00 0.00 34.50 30.48 1wib s PRO 83 CO 0.00 -1.77 1.16 -1.12 0.04 0.00 0.00 177.00 175.32 1wib s SER 84 N 5.50 4.43 0.01 6.66 0.01 -1.26 -5.04 113.70 124.00 1wib s SER 84 Ca 0.75 0.67 0.00 0.00 1.31 0.00 0.00 55.95 58.68 1wib s SER 84 Cb -0.20 -1.14 0.00 0.00 0.21 0.00 0.00 66.02 64.88 1wib s SER 84 CO 0.34 -1.93 0.00 -0.24 0.41 0.00 0.00 173.24 171.81 1wib n SER 85 N -3.29 0.04 0.00 2.44 2.88 -1.26 -5.26 113.62 109.17 1wib n SER 85 Ca 0.09 0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 1wib n SER 85 Cb 0.61 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 1wib n SER 85 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42