#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 -3.16 -4.46 1.61 2.88 -1.26 -5.01 113.62 104.22 1wib n SER -5 Ca 0.00 -0.37 -0.36 0.00 -1.33 0.00 0.00 58.87 56.80 1wib n SER -5 Cb 0.00 -3.43 -0.12 0.00 -0.75 0.00 0.00 64.21 59.91 1wib n SER -5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wib s SER -4 N -3.60 5.15 -0.26 -3.46 1.04 -1.26 -5.05 113.70 106.27 1wib s SER -4 Ca 0.15 -0.19 -0.28 0.00 0.48 0.00 0.00 55.95 56.11 1wib s SER -4 Cb -0.07 -1.92 -0.04 0.00 0.10 0.00 0.00 66.02 64.10 1wib s SER -4 CO 0.47 -0.02 1.97 -0.83 0.98 0.00 0.00 173.24 175.80 1wib s GLY -3 N 1.52 0.74 -0.26 7.32 0.00 -1.26 -4.92 107.32 110.47 1wib s GLY -3 Ca 0.06 0.55 -0.26 0.00 0.00 0.00 0.00 44.72 45.07 1wib s GLY -3 CO 0.04 3.48 1.06 -0.45 0.00 0.00 0.00 173.10 177.22 1wib s SER -2 N 6.78 -0.40 0.73 1.64 0.15 -1.26 -5.17 113.70 116.17 1wib s SER -2 Ca 0.88 0.71 -0.11 0.00 0.70 0.00 0.00 55.95 58.13 1wib s SER -2 Cb -0.28 0.70 0.03 0.00 -1.71 0.00 0.00 66.02 64.76 1wib s SER -2 CO 0.34 -0.18 1.09 -0.55 1.20 0.00 0.00 173.24 175.14 1wib s SER -1 N -0.07 5.14 0.00 5.45 0.15 -1.26 -5.06 113.70 118.05 1wib s SER -1 Ca 0.03 1.27 0.00 0.00 0.70 0.00 0.00 55.95 57.94 1wib s SER -1 Cb -0.04 -2.07 0.00 0.00 -1.71 0.00 0.00 66.02 62.20 1wib s SER -1 CO -0.05 -1.55 0.00 0.61 1.20 0.00 0.00 173.24 173.45 1wib n GLY 1 N -2.55 0.77 3.77 9.45 0.00 -1.26 -5.09 105.19 110.28 1wib n GLY 1 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 1wib n GLY 1 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wib s PRO 2 N 0.37 3.51 0.42 1.61 0.04 -1.26 -5.05 135.00 134.65 1wib s PRO 2 Ca 0.00 1.67 -0.07 0.00 0.04 0.00 0.00 61.00 62.64 1wib s PRO 2 Cb 0.00 -2.16 0.10 0.00 0.04 0.00 0.00 34.50 32.49 1wib s PRO 2 CO 0.00 -0.73 0.37 -0.35 0.04 0.00 0.00 177.00 176.33 1wib n PRO 3 N -0.99 -1.76 -4.18 0.56 -0.04 -1.26 -5.10 135.00 122.23 1wib n PRO 3 Ca 0.10 -0.60 -0.11 0.00 -0.04 0.00 0.00 63.50 62.85 1wib n PRO 3 Cb 0.50 -0.56 -0.10 0.00 -0.04 0.00 0.00 33.50 33.30 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 -3.85 0.96 0.11 0.54 -0.14 -1.26 -5.17 119.74 110.93 1wib s LYS 4 Ca 0.24 -1.44 0.10 0.00 -1.36 0.00 0.00 55.97 53.51 1wib s LYS 4 Cb -0.02 -0.02 -0.04 0.00 -1.68 0.00 0.00 37.83 36.07 1wib s LYS 4 CO 0.19 -0.16 -0.26 -0.06 -0.76 0.00 0.00 175.35 174.30 1wib s PHE 5 N -3.82 2.20 -0.11 3.18 0.08 -1.26 -5.14 117.98 113.11 1wib s PHE 5 Ca 0.21 -0.39 -0.17 0.00 0.12 0.00 0.00 56.93 56.69 1wib s PHE 5 Cb 0.07 -1.21 0.04 0.00 -0.57 0.00 0.00 43.02 41.34 1wib s PHE 5 CO 0.01 0.28 0.44 -0.51 -0.10 0.00 0.00 175.22 175.33 1wib s ASP 6 N -1.90 -0.41 0.26 1.36 1.11 -1.26 -5.03 116.67 110.79 1wib s ASP 6 Ca 0.12 0.65 0.23 0.00 0.18 0.00 0.00 52.55 53.73 1wib s ASP 6 Cb -0.10 0.70 0.98 0.00 1.07 0.00 0.00 42.92 45.57 1wib s ASP 6 CO 0.05 -0.29 1.71 -0.81 1.18 0.00 0.00 175.17 177.00 1wib n PRO 7 N 2.16 0.19 0.00 8.23 -0.04 -1.26 -3.81 135.00 140.47 1wib n PRO 7 Ca -0.16 0.43 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1wib n PRO 7 Cb 0.57 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 1wib n PRO 7 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1wib n ASN 8 N -2.23 0.00 -4.13 3.54 4.13 -1.26 -4.48 115.26 110.83 1wib n ASN 8 Ca 0.02 0.44 -0.36 0.00 1.68 0.00 0.00 54.58 56.37 1wib n ASN 8 Cb 0.23 -0.48 0.08 0.00 -1.54 0.00 0.00 39.78 38.06 1wib n ASN 8 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 1wib n GLU 9 N -1.98 -0.32 -5.25 3.52 -0.00 -1.25 -4.71 120.64 110.64 1wib n GLU 9 Ca 0.00 -0.08 -0.30 0.00 -0.00 0.00 0.00 57.16 56.77 1wib n GLU 9 Cb 0.00 -1.28 -0.16 0.00 -0.00 0.00 0.00 31.44 30.00 1wib n GLU 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1wib s VAL 10 N -2.12 1.97 -0.00 3.84 0.11 -1.26 -4.91 120.40 118.03 1wib s VAL 10 Ca 0.45 -1.07 0.05 0.00 -2.93 0.00 0.00 61.98 58.48 1wib s VAL 10 Cb -0.10 -1.63 -0.01 0.00 -1.53 0.00 0.00 36.38 33.11 1wib s VAL 10 CO 0.72 0.56 -0.15 -0.75 -3.33 0.00 0.00 175.10 172.15 1wib s LYS 11 N -0.58 1.15 -0.10 1.54 2.20 -1.26 -5.04 119.74 117.64 1wib s LYS 11 Ca 0.10 -0.57 -0.01 0.00 -0.36 0.00 0.00 55.97 55.12 1wib s LYS 11 Cb -0.10 -1.12 -0.03 0.00 -1.51 0.00 0.00 37.83 35.07 1wib s LYS 11 CO -0.01 0.30 -0.04 0.08 -0.36 0.00 0.00 175.35 175.32 1wib s VAL 12 N -0.44 3.89 -0.04 4.02 1.01 -1.26 -3.51 120.40 124.07 1wib s VAL 12 Ca 0.05 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 61.69 1wib s VAL 12 Cb -0.06 -2.64 -0.01 0.00 0.00 0.00 0.00 36.38 33.67 1wib s VAL 12 CO -0.00 0.56 -0.20 -0.69 0.00 0.00 0.00 175.10 174.77 1wib s VAL 13 N -0.39 1.64 -0.08 2.92 1.01 -0.34 -4.95 120.40 120.22 1wib s VAL 13 Ca 0.06 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.20 1wib s VAL 13 Cb -0.12 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 1wib s VAL 13 CO 0.02 0.47 -0.05 -0.31 0.00 0.00 0.00 175.10 175.22 1wib s TYR 14 N -0.11 2.98 -0.00 5.22 1.51 -1.26 -0.85 117.35 124.84 1wib s TYR 14 Ca -0.02 0.04 -0.09 0.00 -1.01 0.00 0.00 57.07 55.99 1wib s TYR 14 Cb -0.12 -1.74 0.01 0.00 -0.11 0.00 0.00 41.96 40.00 1wib s TYR 14 CO 0.02 0.34 0.19 -0.51 -1.11 0.00 0.00 175.55 174.48 1wib s LEU 15 N -0.77 1.35 -0.23 -1.29 1.43 -1.22 -5.05 118.68 112.90 1wib s LEU 15 Ca 0.12 -0.11 -0.05 0.00 -1.03 0.00 0.00 54.13 53.06 1wib s LEU 15 Cb -0.11 0.83 -0.02 0.00 0.03 0.00 0.00 46.19 46.92 1wib s LEU 15 CO 0.02 -0.38 0.00 -0.13 0.23 0.00 0.00 176.35 176.09 1wib s ARG 16 N -1.31 3.49 0.09 1.70 3.00 -1.26 -3.67 118.95 120.99 1wib s ARG 16 Ca -0.14 -0.57 -0.23 0.00 0.00 0.00 0.00 55.73 54.80 1wib s ARG 16 Cb -0.07 -3.13 0.06 0.00 0.00 0.00 0.00 34.95 31.81 1wib s ARG 16 CO 0.02 -0.18 0.55 0.00 0.00 0.00 0.00 175.30 175.69 1wib s THR 18 N -3.01 3.65 0.40 0.00 2.01 -1.26 -3.60 115.64 113.82 1wib s THR 18 Ca -0.02 1.61 -0.27 0.00 0.31 0.00 0.00 61.69 63.31 1wib s THR 18 Cb -0.00 -4.03 -0.10 0.00 0.01 0.00 0.00 72.50 68.38 1wib s THR 18 CO -0.06 0.36 1.49 -0.83 -0.69 0.00 0.00 174.62 174.89 1wib s GLY 19 N -0.78 2.94 -1.26 4.40 0.00 -1.06 -3.06 107.32 108.50 1wib s GLY 19 Ca 0.45 1.58 -0.12 0.00 0.00 0.00 0.00 44.72 46.63 1wib s GLY 19 CO 0.38 2.25 0.64 0.61 0.00 0.00 0.00 173.10 176.98 1wib n GLY 20 N 0.46 -0.63 2.29 0.20 0.00 -1.26 -3.13 105.19 103.12 1wib n GLY 20 Ca 0.02 0.31 -0.26 0.00 0.00 0.00 0.00 46.02 46.09 1wib n GLY 20 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wib n GLU 21 N -4.30 2.26 -1.05 1.61 4.07 -1.17 -4.86 120.64 117.19 1wib n GLU 21 Ca -0.20 -2.33 -0.34 0.00 -0.06 0.00 0.00 57.16 54.24 1wib n GLU 21 Cb 0.63 -1.98 0.01 0.00 -0.06 0.00 0.00 31.44 30.04 1wib n GLU 21 CO 0.00 0.00 0.00 1.55 -0.06 0.00 0.00 177.13 178.62 1wib n VAL 22 N 0.24 0.00 -2.33 6.31 3.14 -1.26 -4.42 118.33 120.00 1wib n VAL 22 Ca 0.45 -0.44 0.00 0.00 -2.96 0.00 0.00 64.34 61.39 1wib n VAL 22 Cb 0.55 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.33 1wib n VAL 22 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1wib n GLY 23 N 2.34 -5.75 3.64 7.55 0.00 -1.26 -5.08 105.19 106.63 1wib n GLY 23 Ca 0.05 0.06 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.59 -2.08 0.33 4.61 0.00 -1.26 -5.15 121.76 117.62 1wib s ALA 24 Ca 0.00 1.92 -0.24 0.00 0.00 0.00 0.00 51.96 53.64 1wib s ALA 24 Cb 0.00 -1.55 -0.16 0.00 0.00 0.00 0.00 23.12 21.41 1wib s ALA 24 CO 0.00 -0.24 0.28 -2.37 0.00 0.00 0.00 175.76 173.44 1wib n THR 25 N 2.43 1.23 -1.54 0.00 5.66 -1.26 -4.61 114.28 116.20 1wib n THR 25 Ca -0.13 -0.50 -0.36 0.00 -3.05 0.00 0.00 64.05 60.01 1wib n THR 25 Cb 0.56 -0.04 -0.07 0.00 -1.55 0.00 0.00 70.33 69.24 1wib n THR 25 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1wib n SER 26 N 2.14 1.70 -0.02 1.09 7.64 -1.26 -4.64 113.62 120.27 1wib n SER 26 Ca 0.14 -0.40 -0.02 0.00 1.01 0.00 0.00 58.87 59.60 1wib n SER 26 Cb 0.34 -1.40 -0.03 0.00 -1.01 0.00 0.00 64.21 62.11 1wib n SER 26 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wib n ALA 27 N 14.55 1.90 0.10 -0.43 0.00 -1.26 -4.67 120.51 130.70 1wib n ALA 27 Ca 0.46 -0.23 0.09 0.00 0.00 0.00 0.00 53.44 53.76 1wib n ALA 27 Cb 0.40 0.26 0.00 0.00 0.00 0.00 0.00 19.45 20.11 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 0.04 0.00 3.38 -1.95 -3.33 115.31 113.44 1wib h LEU 28 Ca -0.10 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1wib h LEU 28 Cb 1.20 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.90 1wib h LEU 28 CO -0.00 0.13 -0.43 0.00 0.09 0.00 0.00 178.44 178.23 1wib h ALA 29 N 1.87 -0.71 0.00 1.53 0.00 -1.94 0.90 119.26 120.90 1wib h ALA 29 Ca -0.03 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 1wib h ALA 29 Cb 1.13 0.75 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 1wib h ALA 29 CO 0.01 -0.98 -0.27 -1.00 0.00 0.00 0.00 179.25 177.01 1wib h PRO 30 N -0.61 0.00 -0.14 0.00 0.13 -1.86 0.23 132.00 129.75 1wib h PRO 30 Ca 0.04 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.11 1wib h PRO 30 Cb 0.67 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 1wib h PRO 30 CO -0.30 0.27 -0.12 0.87 -0.23 0.00 0.00 178.00 178.50 1wib h LYS 31 N 0.00 0.32 -0.11 0.86 1.57 -1.46 -3.12 116.57 114.63 1wib h LYS 31 Ca -0.00 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1wib h LYS 31 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1wib h LYS 31 CO 0.04 0.70 0.00 -0.89 -0.57 0.00 0.00 179.45 178.73 1wib n ILE 32 N -4.60 0.13 0.10 1.86 5.41 0.23 -4.45 119.36 118.05 1wib n ILE 32 Ca -0.06 -0.39 -0.10 0.00 1.00 0.00 0.00 62.75 63.20 1wib n ILE 32 Cb 0.34 0.72 -0.06 0.00 -0.71 0.00 0.00 39.64 39.93 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 4.83 -1.14 2.00 7.39 0.00 -0.88 -1.35 103.07 113.92 1wib h GLY 33 Ca 0.00 0.56 -0.04 0.00 0.00 0.00 0.00 47.33 47.85 1wib h GLY 33 CO 0.00 -0.34 -0.18 -0.56 0.00 0.00 0.00 176.54 175.45 1wib h PRO 34 N -0.49 0.00 0.68 4.80 0.13 -1.78 -3.27 132.00 132.07 1wib h PRO 34 Ca -0.02 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.08 1wib h PRO 34 Cb 0.47 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.60 1wib h PRO 34 CO -0.12 0.18 -0.33 -0.07 -0.23 0.00 0.00 178.00 177.43 1wib h LEU 35 N 0.00 -0.77 0.00 1.56 4.07 -1.69 -3.49 115.31 114.99 1wib h LEU 35 Ca -0.00 0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.98 1wib h LEU 35 Cb 0.63 0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.57 1wib h LEU 35 CO 0.02 -0.48 0.00 0.61 -1.08 0.00 0.00 178.44 177.52 1wib n GLY 36 N -0.92 3.46 3.13 0.83 0.00 -0.54 -5.13 105.19 106.02 1wib n GLY 36 Ca -0.11 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.71 -4.57 0.99 4.32 -1.26 -4.97 117.00 109.80 1wib n LEU 37 Ca 0.00 -0.31 -0.33 0.00 -0.02 0.00 0.00 56.01 55.35 1wib n LEU 37 Cb 0.00 -0.85 -0.11 0.00 -1.62 0.00 0.00 43.42 40.84 1wib n LEU 37 CO 0.00 -3.26 -0.40 -0.55 -1.22 0.00 0.00 177.39 171.96 1wib s SER 38 N -1.98 4.50 0.46 -1.43 0.15 -1.26 -4.75 113.70 109.39 1wib s SER 38 Ca 0.46 -0.13 0.24 0.00 0.70 0.00 0.00 55.95 57.23 1wib s SER 38 Cb -0.08 -1.04 1.04 0.00 -1.71 0.00 0.00 66.02 64.22 1wib s SER 38 CO 0.49 0.32 1.88 1.55 1.20 0.00 0.00 173.24 178.68 1wib h PRO 39 N 4.87 0.00 0.21 5.44 0.13 -1.93 -2.61 132.00 138.11 1wib h PRO 39 Ca -0.48 0.00 -0.01 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 0.52 0.21 -0.10 -0.22 -0.23 0.00 0.00 178.00 178.18 1wib h LYS 40 N 0.00 -0.27 -0.26 0.86 3.64 -1.96 0.62 116.57 119.20 1wib h LYS 40 Ca -0.00 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1wib h LYS 40 Cb 0.65 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 1wib h LYS 40 CO 0.03 0.10 0.12 -0.22 -2.27 0.00 0.00 179.45 177.20 1wib h LYS 41 N -0.72 0.38 -0.30 1.90 3.64 -1.98 0.22 116.57 119.70 1wib h LYS 41 Ca -0.03 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.19 1wib h LYS 41 Cb 0.49 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1wib h LYS 41 CO 0.05 0.39 -0.20 0.28 -2.27 0.00 0.00 179.45 177.69 1wib h VAL 42 N 0.28 1.30 -0.37 2.00 2.07 -1.54 -2.18 116.25 117.81 1wib h VAL 42 Ca 0.09 -1.34 -0.05 0.00 0.82 0.00 0.00 66.70 66.23 1wib h VAL 42 Cb 0.14 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1wib h VAL 42 CO -0.01 0.43 0.05 1.23 0.02 0.00 0.00 177.57 179.29 1wib h GLY 43 N 0.42 0.67 1.53 2.17 0.00 0.36 -2.58 103.07 105.64 1wib h GLY 43 Ca 0.06 -0.45 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 1wib h GLY 43 CO 0.06 0.42 0.04 -1.80 0.00 0.00 0.00 176.54 175.25 1wib h ASP 44 N 0.46 0.55 -0.27 0.19 1.82 -0.59 -2.34 116.42 116.24 1wib h ASP 44 Ca 0.11 -0.10 -0.07 0.00 -0.39 0.00 0.00 57.03 56.58 1wib h ASP 44 Cb 0.37 -0.14 -0.02 0.00 0.68 0.00 0.00 39.33 40.22 1wib h ASP 44 CO 0.01 0.60 -0.06 0.44 -1.61 0.00 0.00 179.24 178.61 1wib h ASP 45 N 0.57 0.62 -0.26 2.28 5.19 -1.20 -2.59 116.42 121.03 1wib h ASP 45 Ca 0.12 -0.15 -0.10 0.00 -0.62 0.00 0.00 57.03 56.28 1wib h ASP 45 Cb 0.31 -0.16 -0.00 0.00 0.18 0.00 0.00 39.33 39.65 1wib h ASP 45 CO 0.01 0.73 -0.24 0.40 -3.12 0.00 0.00 179.24 177.02 1wib h ILE 46 N 0.60 1.31 -0.38 0.35 2.04 -1.04 -2.07 117.51 118.33 1wib h ILE 46 Ca 0.11 -1.40 0.04 0.00 1.00 0.00 0.00 64.86 64.61 1wib h ILE 46 Cb 0.47 1.62 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 1wib h ILE 46 CO 0.02 0.44 0.16 0.00 0.00 0.00 0.00 178.15 178.78 1wib h ALA 47 N 0.69 0.46 -0.51 1.87 0.00 -1.28 -1.77 119.26 118.71 1wib h ALA 47 Ca 0.04 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1wib h ALA 47 Cb 0.79 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1wib h ALA 47 CO 0.06 -0.21 0.01 1.57 0.00 0.00 0.00 179.25 180.67 1wib h LYS 48 N 0.34 0.86 0.00 0.00 2.10 -1.47 -2.38 116.57 116.02 1wib h LYS 48 Ca 0.17 -0.24 -0.02 0.00 -2.00 0.00 0.00 60.65 58.56 1wib h LYS 48 Cb 0.11 -0.10 -0.00 0.00 -0.90 0.00 0.00 32.23 31.34 1wib h LYS 48 CO -0.14 0.86 -0.11 0.00 -2.00 0.00 0.00 179.45 178.06 1wib h ALA 49 N 1.20 1.54 -0.69 0.07 0.00 -0.76 -1.41 119.26 119.21 1wib h ALA 49 Ca 0.15 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 1wib h ALA 49 Cb 0.47 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.15 1wib h ALA 49 CO 0.02 0.13 0.20 0.25 0.00 0.00 0.00 179.25 179.86 1wib n THR 50 N -4.00 2.84 -0.23 0.00 -2.24 -0.72 -4.50 114.28 105.42 1wib n THR 50 Ca -0.02 -1.52 -0.08 0.00 -2.27 0.00 0.00 64.05 60.16 1wib n THR 50 Cb 0.19 -0.35 0.03 0.00 -2.10 0.00 0.00 70.33 68.11 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 3.12 1.08 2.00 3.38 0.00 -1.15 0.49 103.07 111.99 1wib h GLY 51 Ca 0.20 -0.65 -0.07 0.00 0.00 0.00 0.00 47.33 46.81 1wib h GLY 51 CO 0.67 0.61 -0.35 -0.55 0.00 0.00 0.00 176.54 176.91 1wib h ASP 52 N 0.93 0.00 -1.20 0.19 3.32 -1.82 -3.19 116.42 114.65 1wib h ASP 52 Ca 0.21 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.76 1wib h ASP 52 Cb 0.31 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.44 1wib h ASP 52 CO -0.00 0.35 -0.91 -2.67 -1.72 0.00 0.00 179.24 174.29 1wib n TRP 53 N -4.10 2.52 -2.07 4.55 2.14 -1.00 -5.03 117.44 114.44 1wib n TRP 53 Ca -0.02 -2.85 -0.35 0.00 2.07 0.00 0.00 57.50 56.34 1wib n TRP 53 Cb 0.39 -0.21 -0.04 0.00 -0.81 0.00 0.00 31.31 30.65 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 -3.44 2.64 0.00 -2.67 2.20 0.17 -2.85 119.74 115.79 1wib s LYS 54 Ca 0.41 0.31 0.00 0.00 -0.36 0.00 0.00 55.97 56.32 1wib s LYS 54 Cb 0.41 -4.58 0.00 0.00 -1.51 0.00 0.00 37.83 32.16 1wib s LYS 54 CO -0.08 -2.88 0.00 0.41 -0.36 0.00 0.00 175.35 172.44 1wib n GLY 55 N 6.02 3.76 3.79 5.54 0.00 -1.18 -4.98 105.19 118.14 1wib n GLY 55 Ca 0.25 -0.55 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 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 4.40 -0.06 0.99 1.43 -1.13 -4.58 118.68 119.73 1wib s LEU 56 Ca 0.00 1.62 -0.24 0.00 -1.03 0.00 0.00 54.13 54.48 1wib s LEU 56 Cb 0.00 -3.69 -0.04 0.00 0.03 0.00 0.00 46.19 42.50 1wib s LEU 56 CO 0.00 0.03 0.74 0.00 0.23 0.00 0.00 176.35 177.36 1wib s ARG 57 N -1.83 4.46 0.06 1.70 1.04 -1.26 -2.56 118.95 120.57 1wib s ARG 57 Ca 0.44 0.97 -0.00 0.00 -1.04 0.00 0.00 55.73 56.09 1wib s ARG 57 Cb -0.19 -3.45 -0.04 0.00 -2.04 0.00 0.00 34.95 29.23 1wib s ARG 57 CO 0.23 0.05 -0.04 0.96 -0.04 0.00 0.00 175.30 176.46 1wib s ILE 58 N 0.83 0.34 -0.16 4.99 -0.00 -1.24 -4.99 121.20 120.97 1wib s ILE 58 Ca 0.40 -1.82 -0.20 0.00 -0.00 0.00 0.00 60.65 59.03 1wib s ILE 58 Cb -0.18 -1.53 -0.03 0.00 -0.00 0.00 0.00 42.46 40.72 1wib s ILE 58 CO 0.20 -0.95 0.58 -0.89 -0.00 0.00 0.00 174.94 173.87 1wib s THR 59 N -3.77 5.08 -0.02 8.37 2.01 -1.26 -4.20 115.64 121.85 1wib s THR 59 Ca 0.08 1.11 0.08 0.00 0.31 0.00 0.00 61.69 63.27 1wib s THR 59 Cb 0.07 -3.90 -0.02 0.00 0.01 0.00 0.00 72.50 68.65 1wib s THR 59 CO -0.08 0.19 -0.26 -0.69 -0.69 0.00 0.00 174.62 173.09 1wib s VAL 60 N 1.40 2.07 -0.24 3.82 1.01 -1.24 -2.90 120.40 124.33 1wib s VAL 60 Ca 0.28 -1.10 -0.08 0.00 0.00 0.00 0.00 61.98 61.08 1wib s VAL 60 Cb -0.16 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 1wib s VAL 60 CO 0.11 0.58 0.08 -1.59 0.00 0.00 0.00 175.10 174.28 1wib s LYS 61 N -0.59 3.75 -0.33 2.72 -2.85 -1.19 -3.43 119.74 117.81 1wib s LYS 61 Ca 0.09 -0.44 -0.13 0.00 -1.00 0.00 0.00 55.97 54.49 1wib s LYS 61 Cb -0.10 -3.34 -0.02 0.00 -2.06 0.00 0.00 37.83 32.31 1wib s LYS 61 CO -0.01 -0.10 0.28 -0.51 0.10 0.00 0.00 175.35 175.11 1wib s LEU 62 N 1.39 4.41 -0.21 2.77 1.43 -0.03 -3.90 118.68 124.54 1wib s LEU 62 Ca 0.05 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 1wib s LEU 62 Cb -0.15 -2.21 0.03 0.00 0.03 0.00 0.00 46.19 43.89 1wib s LEU 62 CO 0.04 -0.24 -0.16 -0.89 0.23 0.00 0.00 176.35 175.33 1wib s THR 63 N 1.83 2.19 -0.23 5.49 2.01 -1.22 -1.20 115.64 124.51 1wib s THR 63 Ca 0.08 -1.11 -0.09 0.00 0.31 0.00 0.00 61.69 60.88 1wib s THR 63 Cb -0.17 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.27 1wib s THR 63 CO 0.11 0.36 0.12 -0.63 -0.69 0.00 0.00 174.62 173.89 1wib s ILE 64 N 1.25 4.95 -0.10 1.82 -1.09 -1.23 -2.89 121.20 123.91 1wib s ILE 64 Ca 0.01 0.04 -0.05 0.00 -2.23 0.00 0.00 60.65 58.41 1wib s ILE 64 Cb -0.15 -3.30 0.04 0.00 -1.58 0.00 0.00 42.46 37.47 1wib s ILE 64 CO -0.10 0.36 0.24 -1.58 -1.23 0.00 0.00 174.94 172.62 1wib s GLN 65 N 1.15 0.20 -1.27 2.79 0.74 -0.77 -4.15 119.66 118.36 1wib s GLN 65 Ca 0.06 0.51 -0.01 0.00 0.05 0.00 0.00 55.36 55.97 1wib s GLN 65 Cb -0.14 -0.11 -0.00 0.00 1.10 0.00 0.00 33.01 33.85 1wib s GLN 65 CO 0.04 -0.16 0.77 -1.71 -0.55 0.00 0.00 175.29 173.68 1wib n ASN 66 N 4.16 -1.69 -2.12 6.67 2.85 -1.26 -0.93 115.26 122.94 1wib n ASN 66 Ca -0.25 -0.79 -0.15 0.00 -0.11 0.00 0.00 54.58 53.29 1wib n ASN 66 Cb 0.53 -4.28 -0.03 0.00 1.24 0.00 0.00 39.78 37.25 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 -4.20 -1.83 -4.41 1.20 1.74 -1.26 -4.95 116.66 102.96 1wib n ARG 67 Ca -0.28 0.78 -0.25 0.00 -0.77 0.00 0.00 57.85 57.34 1wib n ARG 67 Cb 0.67 -5.30 -0.10 0.00 -1.02 0.00 0.00 32.46 26.71 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 -4.49 1.82 -0.01 5.56 0.74 -0.11 -5.05 119.66 118.11 1wib s GLN 68 Ca 0.00 -1.61 0.04 0.00 0.05 0.00 0.00 55.36 53.84 1wib s GLN 68 Cb 0.00 -1.90 -0.01 0.00 1.10 0.00 0.00 33.01 32.20 1wib s GLN 68 CO 0.00 0.36 -0.14 0.00 -0.55 0.00 0.00 175.29 174.96 1wib s ALA 69 N -2.25 1.16 0.01 1.58 0.00 -1.26 -1.84 121.76 119.15 1wib s ALA 69 Ca 0.28 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.67 1wib s ALA 69 Cb -0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 1wib s ALA 69 CO 0.15 0.28 -0.07 -1.14 0.00 0.00 0.00 175.76 174.98 1wib s GLN 70 N -0.29 0.53 -0.10 0.00 2.00 -1.14 -5.04 119.66 115.61 1wib s GLN 70 Ca 0.05 -0.38 0.02 0.00 -2.00 0.00 0.00 55.36 53.04 1wib s GLN 70 Cb -0.06 -0.47 0.01 0.00 0.80 0.00 0.00 33.01 33.30 1wib s GLN 70 CO -0.00 0.12 -0.14 0.96 -0.50 0.00 0.00 175.29 175.72 1wib s ILE 71 N -0.49 1.42 -0.03 -2.34 -4.36 -1.26 -3.41 121.20 110.74 1wib s ILE 71 Ca -0.01 -0.60 0.00 0.00 -0.26 0.00 0.00 60.65 59.79 1wib s ILE 71 Cb -0.05 -1.31 0.03 0.00 1.25 0.00 0.00 42.46 42.38 1wib s ILE 71 CO 0.00 0.43 0.00 -0.70 0.24 0.00 0.00 174.94 174.91 1wib s GLU 72 N 0.98 0.27 0.05 0.37 2.12 -1.25 -5.05 118.70 116.19 1wib s GLU 72 Ca -0.07 0.08 -0.26 0.00 0.36 0.00 0.00 54.97 55.08 1wib s GLU 72 Cb -0.15 -0.45 -0.05 0.00 0.26 0.00 0.00 34.13 33.74 1wib s GLU 72 CO -0.01 -0.13 0.80 0.08 -0.54 0.00 0.00 175.26 175.46 1wib s VAL 73 N 0.99 4.71 0.01 3.70 1.01 -1.26 -3.18 120.40 126.38 1wib s VAL 73 Ca -0.10 1.71 -0.06 0.00 0.00 0.00 0.00 61.98 63.53 1wib s VAL 73 Cb -0.13 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 1wib s VAL 73 CO -0.02 0.35 0.27 0.68 0.00 0.00 0.00 175.10 176.37 1wib s VAL 74 N 0.01 5.31 0.00 2.92 -7.23 -1.14 -5.05 120.40 115.22 1wib s VAL 74 Ca 0.40 0.13 0.00 0.00 -1.81 0.00 0.00 61.98 60.70 1wib s VAL 74 Cb -0.21 -3.57 0.00 0.00 0.56 0.00 0.00 36.38 33.16 1wib s VAL 74 CO 0.24 0.34 0.00 -0.81 -0.31 0.00 0.00 175.10 174.56 1wib n PRO 75 N 1.04 -0.39 -3.22 4.82 -0.04 -1.26 -4.71 135.00 131.24 1wib n PRO 75 Ca -0.11 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 62.91 1wib n PRO 75 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 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 -2.06 5.65 -3.59 3.54 3.41 -1.26 -4.95 113.62 114.36 1wib n SER 76 Ca 0.00 -3.10 -0.06 0.00 -0.26 0.00 0.00 58.87 55.45 1wib n SER 76 Cb 0.00 -1.38 -0.02 0.00 -0.26 0.00 0.00 64.21 62.55 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 -1.25 -1.82 0.22 7.33 0.00 -1.26 -5.19 121.76 119.79 1wib s ALA 77 Ca 0.32 0.80 -0.14 0.00 0.00 0.00 0.00 51.96 52.94 1wib s ALA 77 Cb -0.06 0.43 0.00 0.00 0.00 0.00 0.00 23.12 23.49 1wib s ALA 77 CO -0.04 -0.80 0.47 -1.12 0.00 0.00 0.00 175.76 174.27 1wib s SER 78 N -2.61 -0.11 -0.74 0.00 0.01 -1.26 -5.08 113.70 103.90 1wib s SER 78 Ca 0.08 -0.81 -0.24 0.00 1.31 0.00 0.00 55.95 56.28 1wib s SER 78 Cb -0.01 0.57 -0.15 0.00 0.21 0.00 0.00 66.02 66.64 1wib s SER 78 CO -0.05 -1.09 2.41 0.00 0.41 0.00 0.00 173.24 174.91 1wib n ALA 79 N -0.35 0.53 -3.35 1.44 0.00 -1.26 -4.86 120.51 112.66 1wib n ALA 79 Ca -0.04 -1.16 -0.46 0.00 0.00 0.00 0.00 53.44 51.77 1wib n ALA 79 Cb 0.62 -3.13 -0.03 0.00 0.00 0.00 0.00 19.45 16.92 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 12.38 6.65 -0.01 0.00 1.43 -1.26 -4.78 118.68 133.10 1wib s LEU 80 Ca 1.00 -2.65 -0.03 0.00 -1.03 0.00 0.00 54.13 51.42 1wib s LEU 80 Cb -0.27 -2.19 -0.02 0.00 0.03 0.00 0.00 46.19 43.74 1wib s LEU 80 CO 0.20 -0.58 -0.08 -1.20 0.23 0.00 0.00 176.35 174.92 1wib n SER 81 N 4.02 0.86 -2.90 2.29 7.64 -1.26 -5.13 113.62 119.14 1wib n SER 81 Ca 0.12 0.13 -0.11 0.00 1.01 0.00 0.00 58.87 60.02 1wib n SER 81 Cb 0.46 -0.30 0.01 0.00 -1.01 0.00 0.00 64.21 63.37 1wib n SER 81 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wib s GLY 82 N -4.65 0.77 -0.31 0.23 0.00 -1.26 -5.12 107.32 96.97 1wib s GLY 82 Ca -0.07 -1.03 -0.29 0.00 0.00 0.00 0.00 44.72 43.33 1wib s GLY 82 CO 0.10 -0.54 1.68 2.56 0.00 0.00 0.00 173.10 176.90 1wib s PRO 83 N -2.34 3.51 -0.45 2.90 0.04 -1.26 -4.96 135.00 132.44 1wib s PRO 83 Ca 0.20 1.41 -0.27 0.00 0.04 0.00 0.00 61.00 62.38 1wib s PRO 83 Cb -0.04 -4.12 0.03 0.00 0.04 0.00 0.00 34.50 30.41 1wib s PRO 83 CO 0.15 -1.64 1.02 -1.12 0.04 0.00 0.00 177.00 175.44 1wib s SER 84 N 5.17 6.59 0.65 6.66 0.01 -1.26 -5.03 113.70 126.49 1wib s SER 84 Ca 0.74 0.36 -0.11 0.00 1.31 0.00 0.00 55.95 58.25 1wib s SER 84 Cb -0.22 -2.50 -0.01 0.00 0.21 0.00 0.00 66.02 63.51 1wib s SER 84 CO 0.32 -1.10 1.04 -0.94 0.41 0.00 0.00 173.24 172.98 1wib s SER 85 N 2.26 5.86 0.00 2.44 1.04 -1.26 -5.29 113.70 118.76 1wib s SER 85 Ca 0.42 1.23 0.00 0.00 0.48 0.00 0.00 55.95 58.08 1wib s SER 85 Cb -0.09 -2.19 0.00 0.00 0.10 0.00 0.00 66.02 63.84 1wib s SER 85 CO 0.27 -1.07 0.43 0.61 0.98 0.00 0.00 173.24 174.46