#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 -0.41 -0.38 1.61 0.15 -1.26 -5.10 113.70 108.30 1wib s SER -5 Ca 0.00 0.33 -0.35 0.00 0.70 0.00 0.00 55.95 56.63 1wib s SER -5 Cb 0.00 0.36 -0.12 0.00 -1.71 0.00 0.00 66.02 64.55 1wib s SER -5 CO 0.00 -0.47 2.21 -0.24 1.20 0.00 0.00 173.24 175.95 1wib n SER -4 N 0.47 2.00 0.00 5.45 2.88 -1.26 -4.75 113.62 118.41 1wib n SER -4 Ca -0.11 0.38 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 1wib n SER -4 Cb 0.59 -1.25 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 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 6.58 1.29 3.43 0.46 0.00 -1.26 -5.10 105.19 110.59 1wib n GLY -3 Ca 0.43 0.42 -0.43 0.00 0.00 0.00 0.00 46.02 46.43 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 6.19 -0.84 1.61 0.01 -1.26 -4.98 113.70 114.43 1wib s SER -2 Ca 0.00 -1.14 -0.25 0.00 1.31 0.00 0.00 55.95 55.86 1wib s SER -2 Cb 0.00 -2.39 0.01 0.00 0.21 0.00 0.00 66.02 63.85 1wib s SER -2 CO 0.00 -1.34 1.60 -0.94 0.41 0.00 0.00 173.24 172.97 1wib s SER -1 N 3.67 5.85 -0.25 2.44 1.04 -1.26 -4.89 113.70 120.30 1wib s SER -1 Ca 0.20 -0.65 -0.28 0.00 0.48 0.00 0.00 55.95 55.70 1wib s SER -1 Cb -0.18 -2.56 0.16 0.00 0.10 0.00 0.00 66.02 63.54 1wib s SER -1 CO 0.08 -2.06 1.22 -0.83 0.98 0.00 0.00 173.24 172.64 1wib s GLY 1 N 5.99 0.01 0.70 7.32 0.00 -1.26 -5.17 107.32 114.91 1wib s GLY 1 Ca 0.53 2.73 -0.13 0.00 0.00 0.00 0.00 44.72 47.85 1wib s GLY 1 CO 0.05 1.38 1.10 2.56 0.00 0.00 0.00 173.10 178.20 1wib s PRO 2 N -0.62 2.59 -0.42 2.90 0.04 -1.26 -4.94 135.00 133.29 1wib s PRO 2 Ca 0.05 1.30 -0.28 0.00 0.04 0.00 0.00 61.00 62.11 1wib s PRO 2 Cb -0.02 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.57 1wib s PRO 2 CO -0.07 -1.40 1.75 -1.25 0.04 0.00 0.00 177.00 176.07 1wib s PRO 3 N -4.42 3.18 -0.07 0.56 0.04 -1.26 -4.98 135.00 128.06 1wib s PRO 3 Ca 0.65 1.11 -0.20 0.00 0.04 0.00 0.00 61.00 62.60 1wib s PRO 3 Cb -0.19 -4.22 -0.04 0.00 0.04 0.00 0.00 34.50 30.09 1wib s PRO 3 CO 0.47 -2.05 0.57 0.15 0.04 0.00 0.00 177.00 176.19 1wib s LYS 4 N 5.91 4.35 0.44 4.56 1.02 -1.26 -5.08 119.74 129.68 1wib s LYS 4 Ca 0.73 0.65 0.06 0.00 0.02 0.00 0.00 55.97 57.43 1wib s LYS 4 Cb -0.18 -3.41 -0.04 0.00 -0.52 0.00 0.00 37.83 33.68 1wib s LYS 4 CO 0.30 0.21 0.17 -0.06 -0.92 0.00 0.00 175.35 175.04 1wib s PHE 5 N 0.40 2.41 0.00 3.18 0.08 -1.26 -5.14 117.98 117.65 1wib s PHE 5 Ca 0.31 -0.66 0.03 0.00 0.12 0.00 0.00 56.93 56.72 1wib s PHE 5 Cb -0.17 -1.90 -0.03 0.00 -0.57 0.00 0.00 43.02 40.35 1wib s PHE 5 CO 0.14 0.14 -0.04 -0.51 -0.10 0.00 0.00 175.22 174.86 1wib s ASP 6 N -3.92 4.84 -0.02 1.36 1.01 -1.26 -5.05 116.67 113.63 1wib s ASP 6 Ca 0.36 -0.09 -0.25 0.00 0.71 0.00 0.00 52.55 53.27 1wib s ASP 6 Cb 0.04 -1.19 -0.20 0.00 1.01 0.00 0.00 42.92 42.58 1wib s ASP 6 CO 0.20 0.28 1.23 1.55 0.21 0.00 0.00 175.17 178.64 1wib h PRO 7 N 4.41 -0.05 -4.30 8.23 0.13 -2.03 -3.47 132.00 134.91 1wib h PRO 7 Ca -0.49 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.29 1wib h PRO 7 Cb 1.17 0.01 0.07 0.00 0.13 0.00 0.00 31.00 32.38 1wib h PRO 7 CO 0.55 0.42 -0.55 -1.71 -0.23 0.00 0.00 178.00 176.49 1wib n ASN 8 N -4.88 -5.66 -3.50 1.44 2.85 -1.26 -4.98 115.26 99.27 1wib n ASN 8 Ca -0.08 -0.31 -0.11 0.00 -0.11 0.00 0.00 54.58 53.96 1wib n ASN 8 Cb 0.25 -4.44 -0.03 0.00 1.24 0.00 0.00 39.78 36.80 1wib n ASN 8 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1wib s GLU 9 N -5.71 0.93 0.40 1.20 2.12 -1.26 -5.15 118.70 111.23 1wib s GLU 9 Ca 0.33 -0.18 -0.27 0.00 0.36 0.00 0.00 54.97 55.21 1wib s GLU 9 Cb -0.15 0.43 -0.10 0.00 0.26 0.00 0.00 34.13 34.58 1wib s GLU 9 CO 0.41 -0.38 1.41 0.08 -0.54 0.00 0.00 175.26 176.25 1wib s VAL 10 N -2.65 2.24 -0.02 3.70 1.01 -1.26 -5.03 120.40 118.39 1wib s VAL 10 Ca 0.00 0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.23 1wib s VAL 10 Cb -0.01 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1wib s VAL 10 CO -0.05 0.04 -0.07 -0.75 0.00 0.00 0.00 175.10 174.27 1wib s LYS 11 N -2.20 0.78 -0.07 2.72 2.47 -1.26 -5.11 119.74 117.08 1wib s LYS 11 Ca 0.56 -0.24 0.03 0.00 -1.56 0.00 0.00 55.97 54.76 1wib s LYS 11 Cb -0.43 -0.75 -0.02 0.00 -1.46 0.00 0.00 37.83 35.16 1wib s LYS 11 CO 0.57 0.09 -0.15 0.08 0.16 0.00 0.00 175.35 176.10 1wib s VAL 12 N 0.22 2.97 -0.06 4.02 1.01 -1.26 -3.86 120.40 123.43 1wib s VAL 12 Ca -0.03 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.24 1wib s VAL 12 Cb -0.08 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 34.13 1wib s VAL 12 CO 0.00 0.58 -0.16 -0.69 0.00 0.00 0.00 175.10 174.83 1wib s VAL 13 N -0.47 1.40 -0.03 2.92 1.01 -0.59 -4.94 120.40 119.70 1wib s VAL 13 Ca 0.06 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.39 1wib s VAL 13 Cb -0.12 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1wib s VAL 13 CO 0.02 0.41 -0.02 -0.31 0.00 0.00 0.00 175.10 175.20 1wib s TYR 14 N 0.38 3.05 0.12 5.22 1.51 -1.26 -0.38 117.35 125.99 1wib s TYR 14 Ca -0.12 0.08 0.02 0.00 -1.01 0.00 0.00 57.07 56.05 1wib s TYR 14 Cb -0.15 -1.70 -0.04 0.00 -0.11 0.00 0.00 41.96 39.96 1wib s TYR 14 CO 0.04 0.43 -0.06 -0.51 -1.11 0.00 0.00 175.55 174.35 1wib s LEU 15 N -1.25 2.44 -0.17 -1.29 2.01 -1.22 -5.04 118.68 114.16 1wib s LEU 15 Ca 0.17 -1.04 -0.02 0.00 0.01 0.00 0.00 54.13 53.25 1wib s LEU 15 Cb -0.11 -0.11 -0.01 0.00 0.01 0.00 0.00 46.19 45.97 1wib s LEU 15 CO 0.06 -0.47 -0.08 0.00 1.01 0.00 0.00 176.35 176.88 1wib s ARG 16 N -3.84 3.41 0.26 1.70 3.03 -1.26 -4.21 118.95 118.04 1wib s ARG 16 Ca 0.15 -0.64 -0.21 0.00 2.03 0.00 0.00 55.73 57.05 1wib s ARG 16 Cb 0.05 -2.83 0.03 0.00 -1.03 0.00 0.00 34.95 31.17 1wib s ARG 16 CO -0.02 0.03 0.70 0.00 -1.13 0.00 0.00 175.30 174.88 1wib s THR 18 N -3.90 5.43 0.71 0.00 2.01 -1.26 -4.43 115.64 114.21 1wib s THR 18 Ca 0.10 0.27 -0.16 0.00 0.31 0.00 0.00 61.69 62.20 1wib s THR 18 Cb -0.05 -3.46 0.03 0.00 0.01 0.00 0.00 72.50 69.03 1wib s THR 18 CO 0.04 0.54 1.24 -0.83 -0.69 0.00 0.00 174.62 174.92 1wib s GLY 19 N -0.47 2.50 -1.40 4.40 0.00 -1.23 -2.83 107.32 108.28 1wib s GLY 19 Ca 0.13 1.00 -0.10 0.00 0.00 0.00 0.00 44.72 45.75 1wib s GLY 19 CO 0.03 1.42 0.63 0.61 0.00 0.00 0.00 173.10 175.78 1wib n GLY 20 N 0.61 -0.49 3.01 0.20 0.00 -0.36 -2.97 105.19 105.19 1wib n GLY 20 Ca 0.14 0.12 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 1wib n GLY 20 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wib s GLU 21 N -6.15 0.37 -0.05 1.61 0.41 -1.13 -4.88 118.70 108.88 1wib s GLU 21 Ca 0.46 -0.71 -0.15 0.00 -0.41 0.00 0.00 54.97 54.17 1wib s GLU 21 Cb -0.24 0.13 -0.05 0.00 -1.78 0.00 0.00 34.13 32.19 1wib s GLU 21 CO 0.57 -0.06 0.39 0.08 -0.49 0.00 0.00 175.26 175.75 1wib s VAL 22 N -1.90 5.12 0.00 2.63 1.01 -1.26 -4.87 120.40 121.13 1wib s VAL 22 Ca -0.12 0.78 0.00 0.00 0.00 0.00 0.00 61.98 62.65 1wib s VAL 22 Cb -0.07 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.61 1wib s VAL 22 CO -0.03 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.19 1wib n GLY 23 N 2.33 -3.45 3.85 4.51 0.00 -1.26 -4.99 105.19 106.17 1wib n GLY 23 Ca -0.13 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.42 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 -2.02 2.36 -0.43 4.61 0.00 -1.26 -4.93 121.76 120.09 1wib s ALA 24 Ca 0.00 -0.54 -0.27 0.00 0.00 0.00 0.00 51.96 51.15 1wib s ALA 24 Cb 0.00 -3.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 1wib s ALA 24 CO 0.00 -1.82 2.12 0.99 0.00 0.00 0.00 175.76 177.05 1wib s THR 25 N -3.42 3.18 -1.23 0.00 2.01 -1.26 -2.84 115.64 112.08 1wib s THR 25 Ca 0.62 0.15 -0.02 0.00 0.31 0.00 0.00 61.69 62.75 1wib s THR 25 Cb -0.13 -3.36 -0.01 0.00 0.01 0.00 0.00 72.50 69.01 1wib s THR 25 CO 0.51 -0.31 0.82 -0.24 -0.69 0.00 0.00 174.62 174.72 1wib n SER 26 N 13.18 -2.34 -0.03 3.53 2.88 -1.26 -4.92 113.62 124.67 1wib n SER 26 Ca 0.29 -0.76 -0.05 0.00 -1.33 0.00 0.00 58.87 57.01 1wib n SER 26 Cb 0.51 -4.48 -0.13 0.00 -0.75 0.00 0.00 64.21 59.36 1wib n SER 26 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wib n ALA 27 N -4.10 1.70 -0.02 -1.46 0.00 -1.13 -4.28 120.51 111.21 1wib n ALA 27 Ca -0.26 -0.84 -0.09 0.00 0.00 0.00 0.00 53.44 52.25 1wib n ALA 27 Cb 0.66 -0.69 -0.14 0.00 0.00 0.00 0.00 19.45 19.28 1wib n ALA 27 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wib n LEU 28 N -2.87 0.91 -0.24 0.00 4.77 -1.26 -3.93 117.00 114.38 1wib n LEU 28 Ca -0.18 0.40 -0.09 0.00 -0.03 0.00 0.00 56.01 56.10 1wib n LEU 28 Cb 0.99 0.13 -0.05 0.00 -2.33 0.00 0.00 43.42 42.16 1wib n LEU 28 CO 0.44 0.41 0.54 0.00 -1.33 0.00 0.00 177.39 177.45 1wib h ALA 29 N 0.97 -0.42 0.00 -1.18 0.00 -1.96 0.34 119.26 117.00 1wib h ALA 29 Ca -0.30 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1wib h ALA 29 Cb 2.02 1.06 -0.00 0.00 0.00 0.00 0.00 17.79 20.87 1wib h ALA 29 CO 0.08 -0.88 -0.12 -1.00 0.00 0.00 0.00 179.25 177.33 1wib h PRO 30 N -0.22 0.00 -0.08 0.00 0.13 -1.78 0.11 132.00 130.17 1wib h PRO 30 Ca 0.17 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.19 1wib h PRO 30 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 1wib h PRO 30 CO -0.73 0.12 -0.36 0.87 -0.23 0.00 0.00 178.00 177.67 1wib h LYS 31 N 0.00 0.38 0.00 0.86 1.79 -0.64 -3.25 116.57 115.71 1wib h LYS 31 Ca -0.00 -0.31 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 1wib h LYS 31 Cb 0.58 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1wib h LYS 31 CO 0.02 0.95 -0.56 -0.89 -1.08 0.00 0.00 179.45 177.89 1wib n ILE 32 N -4.38 0.14 -0.37 1.86 5.41 0.77 -4.39 119.36 118.40 1wib n ILE 32 Ca -0.08 -0.12 -0.10 0.00 1.00 0.00 0.00 62.75 63.45 1wib n ILE 32 Cb 0.53 0.07 -0.09 0.00 -0.71 0.00 0.00 39.64 39.44 1wib n ILE 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1wib n GLY 33 N 1.43 -2.55 0.16 7.39 0.00 0.38 -0.24 105.19 111.77 1wib n GLY 33 Ca 0.04 1.10 0.01 0.00 0.00 0.00 0.00 46.02 47.18 1wib n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wib h PRO 34 N 0.00 0.00 0.15 1.61 0.13 -1.77 -3.21 132.00 128.91 1wib h PRO 34 Ca 0.14 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.27 1wib h PRO 34 Cb 0.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.50 1wib h PRO 34 CO -0.84 0.48 -0.07 -0.07 -0.23 0.00 0.00 178.00 177.27 1wib h LEU 35 N 0.00 -0.17 0.00 1.56 4.07 -0.83 -3.48 115.31 116.46 1wib h LEU 35 Ca -0.00 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1wib h LEU 35 Cb 0.86 0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.65 1wib h LEU 35 CO 0.06 -0.09 0.00 0.61 -1.08 0.00 0.00 178.44 177.94 1wib n GLY 36 N -1.08 2.97 3.15 0.83 0.00 0.19 -4.98 105.19 106.27 1wib n GLY 36 Ca -0.09 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.66 -4.82 0.99 4.32 -1.26 -4.93 117.00 108.63 1wib n LEU 37 Ca 0.00 -0.06 -0.35 0.00 -0.02 0.00 0.00 56.01 55.58 1wib n LEU 37 Cb 0.00 -0.76 -0.07 0.00 -1.62 0.00 0.00 43.42 40.98 1wib n LEU 37 CO 0.00 -2.88 -0.22 -0.55 -1.22 0.00 0.00 177.39 172.52 1wib s SER 38 N -1.46 5.96 0.43 -1.43 0.15 -1.26 -4.72 113.70 111.36 1wib s SER 38 Ca 0.47 0.30 0.21 0.00 0.70 0.00 0.00 55.95 57.63 1wib s SER 38 Cb -0.02 -1.82 0.93 0.00 -1.71 0.00 0.00 66.02 63.40 1wib s SER 38 CO 0.66 0.34 1.85 1.55 1.20 0.00 0.00 173.24 178.84 1wib h PRO 39 N 4.59 0.00 0.23 5.44 0.13 -1.92 -2.49 132.00 137.98 1wib h PRO 39 Ca -0.52 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.60 1wib h PRO 39 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1wib h PRO 39 CO 0.60 0.28 -0.11 -0.22 -0.23 0.00 0.00 178.00 178.32 1wib h LYS 40 N 0.00 -0.30 -0.28 0.86 1.63 -1.97 0.54 116.57 117.06 1wib h LYS 40 Ca -0.00 0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.81 1wib h LYS 40 Cb 0.70 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.38 1wib h LYS 40 CO 0.04 0.07 0.15 -0.22 -3.45 0.00 0.00 179.45 176.04 1wib h LYS 41 N -0.79 0.39 -0.20 1.90 1.63 -1.99 0.77 116.57 118.27 1wib h LYS 41 Ca -0.03 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 59.66 1wib h LYS 41 Cb 0.51 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.06 1wib h LYS 41 CO 0.05 0.33 -0.14 0.28 -3.45 0.00 0.00 179.45 176.53 1wib h VAL 42 N 0.33 1.32 -0.67 2.00 2.07 -1.53 -2.25 116.25 117.53 1wib h VAL 42 Ca 0.10 -1.25 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 1wib h VAL 42 Cb 0.06 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1wib h VAL 42 CO -0.02 0.38 0.41 1.23 0.02 0.00 0.00 177.57 179.59 1wib h GLY 43 N 0.13 0.97 1.28 2.17 0.00 0.20 -1.40 103.07 106.42 1wib h GLY 43 Ca 0.04 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 1wib h GLY 43 CO 0.04 0.39 -0.00 -1.80 0.00 0.00 0.00 176.54 175.16 1wib h ASP 44 N 0.91 0.84 -0.52 0.19 1.82 -0.85 -0.86 116.42 117.95 1wib h ASP 44 Ca 0.24 -0.21 -0.06 0.00 -0.39 0.00 0.00 57.03 56.60 1wib h ASP 44 Cb -0.04 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 39.73 1wib h ASP 44 CO -0.05 0.90 0.08 0.44 -1.61 0.00 0.00 179.24 179.01 1wib h ASP 45 N 0.81 0.83 -0.14 2.28 5.19 -1.00 -1.68 116.42 122.71 1wib h ASP 45 Ca 0.15 -0.26 -0.04 0.00 -0.62 0.00 0.00 57.03 56.26 1wib h ASP 45 Cb 0.48 -0.22 -0.00 0.00 0.18 0.00 0.00 39.33 39.77 1wib h ASP 45 CO 0.02 0.89 -0.08 0.40 -3.12 0.00 0.00 179.24 177.35 1wib h ILE 46 N 0.75 1.32 -0.46 0.35 2.04 -1.08 -1.43 117.51 119.00 1wib h ILE 46 Ca 0.16 -1.13 0.05 0.00 1.00 0.00 0.00 64.86 64.94 1wib h ILE 46 Cb 0.41 1.78 -0.05 0.00 -0.74 0.00 0.00 36.82 38.22 1wib h ILE 46 CO 0.01 0.33 0.20 0.00 0.00 0.00 0.00 178.15 178.69 1wib h ALA 47 N 0.65 0.57 -0.36 1.87 0.00 -1.12 0.78 119.26 121.65 1wib h ALA 47 Ca 0.03 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1wib h ALA 47 Cb 0.55 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1wib h ALA 47 CO 0.02 -0.18 -0.15 1.57 0.00 0.00 0.00 179.25 180.51 1wib h LYS 48 N 0.39 0.65 -0.50 0.00 2.10 -1.31 -2.68 116.57 115.23 1wib h LYS 48 Ca 0.21 -0.22 -0.10 0.00 -2.00 0.00 0.00 60.65 58.54 1wib h LYS 48 Cb 0.17 -0.05 -0.02 0.00 -0.90 0.00 0.00 32.23 31.43 1wib h LYS 48 CO -0.19 0.77 -0.08 0.00 -2.00 0.00 0.00 179.45 177.96 1wib h ALA 49 N 1.25 0.68 -0.35 0.07 0.00 -0.45 -2.70 119.26 117.75 1wib h ALA 49 Ca 0.10 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 1wib h ALA 49 Cb 0.59 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1wib h ALA 49 CO 0.04 0.57 0.12 0.25 0.00 0.00 0.00 179.25 180.23 1wib n THR 50 N -4.23 1.60 0.04 0.00 -2.24 0.19 -4.41 114.28 105.24 1wib n THR 50 Ca 0.01 -0.76 -0.12 0.00 -2.27 0.00 0.00 64.05 60.91 1wib n THR 50 Cb 0.37 -0.54 -0.07 0.00 -2.10 0.00 0.00 70.33 67.99 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 3.76 -0.02 2.00 3.38 0.00 -1.14 -0.84 103.07 110.22 1wib h GLY 51 Ca 0.12 0.01 -0.05 0.00 0.00 0.00 0.00 47.33 47.40 1wib h GLY 51 CO 0.35 -0.01 -0.25 1.29 0.00 0.00 0.00 176.54 177.92 1wib h ASP 52 N -0.03 0.00 -0.09 0.19 2.03 -1.83 -2.96 116.42 113.73 1wib h ASP 52 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1wib h ASP 52 Cb 0.02 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.52 1wib h ASP 52 CO 0.00 0.25 0.00 0.79 -1.03 0.00 0.00 179.24 179.25 1wib n TRP 53 N -3.30 0.31 -1.60 4.15 8.01 -0.98 -4.88 117.44 119.15 1wib n TRP 53 Ca 0.01 -0.11 -0.44 0.00 -1.31 0.00 0.00 57.50 55.65 1wib n TRP 53 Cb 0.50 -0.16 -0.03 0.00 -2.01 0.00 0.00 31.31 29.61 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 0.08 2.04 0.00 -0.99 2.85 -1.12 -0.56 118.16 120.47 1wib n LYS 54 Ca 0.04 0.61 0.00 0.00 -1.05 0.00 0.00 58.31 57.91 1wib n LYS 54 Cb 0.38 -3.12 0.00 0.00 -0.65 0.00 0.00 35.03 31.64 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 5.60 1.87 3.62 2.58 0.00 -1.16 -4.94 105.19 112.76 1wib n GLY 55 Ca 0.29 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.93 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 4.06 -0.13 0.99 1.02 0.28 -4.88 118.68 120.02 1wib s LEU 56 Ca 0.00 0.28 -0.24 0.00 0.02 0.00 0.00 54.13 54.19 1wib s LEU 56 Cb 0.00 -2.38 -0.02 0.00 0.02 0.00 0.00 46.19 43.81 1wib s LEU 56 CO 0.00 -0.13 0.77 0.00 0.02 0.00 0.00 176.35 177.01 1wib s ARG 57 N 1.80 4.35 0.07 1.70 3.03 -1.26 -3.50 118.95 125.13 1wib s ARG 57 Ca 0.14 0.93 -0.05 0.00 2.03 0.00 0.00 55.73 58.79 1wib s ARG 57 Cb -0.15 -3.52 -0.02 0.00 -1.03 0.00 0.00 34.95 30.22 1wib s ARG 57 CO 0.09 -0.16 0.07 0.96 -1.13 0.00 0.00 175.30 175.13 1wib s ILE 58 N 1.59 0.18 -0.23 4.99 -0.00 -1.26 -5.07 121.20 121.40 1wib s ILE 58 Ca 0.37 -1.49 -0.17 0.00 -0.00 0.00 0.00 60.65 59.36 1wib s ILE 58 Cb -0.17 -1.41 -0.03 0.00 -0.00 0.00 0.00 42.46 40.85 1wib s ILE 58 CO 0.15 -0.82 0.48 -0.89 -0.00 0.00 0.00 174.94 173.86 1wib s THR 59 N -3.84 5.12 -0.09 8.37 2.01 -1.26 -4.67 115.64 121.28 1wib s THR 59 Ca 0.06 0.85 0.02 0.00 0.31 0.00 0.00 61.69 62.93 1wib s THR 59 Cb 0.06 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.75 1wib s THR 59 CO -0.10 0.16 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.14 1wib s VAL 60 N 1.86 2.90 -0.17 3.82 1.01 -1.26 -2.88 120.40 125.68 1wib s VAL 60 Ca 0.21 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.37 1wib s VAL 60 Cb -0.15 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1wib s VAL 60 CO 0.09 0.56 0.05 -1.59 0.00 0.00 0.00 175.10 174.21 1wib s LYS 61 N -0.17 3.90 -0.27 2.72 -2.85 -1.20 -3.40 119.74 118.46 1wib s LYS 61 Ca -0.01 -0.35 -0.05 0.00 -1.00 0.00 0.00 55.97 54.56 1wib s LYS 61 Cb -0.13 -3.17 0.02 0.00 -2.06 0.00 0.00 37.83 32.48 1wib s LYS 61 CO 0.03 0.31 0.02 -0.51 0.10 0.00 0.00 175.35 175.30 1wib s LEU 62 N 0.26 3.57 -0.28 2.77 1.43 0.49 -3.98 118.68 122.94 1wib s LEU 62 Ca 0.03 -0.78 -0.03 0.00 -1.03 0.00 0.00 54.13 52.32 1wib s LEU 62 Cb -0.12 -1.79 0.03 0.00 0.03 0.00 0.00 46.19 44.34 1wib s LEU 62 CO 0.00 -0.16 -0.00 -0.89 0.23 0.00 0.00 176.35 175.53 1wib s THR 63 N 1.42 3.22 -0.20 5.49 2.01 -1.22 -1.54 115.64 124.82 1wib s THR 63 Ca 0.01 -1.03 -0.04 0.00 0.31 0.00 0.00 61.69 60.94 1wib s THR 63 Cb -0.17 -2.70 -0.01 0.00 0.01 0.00 0.00 72.50 69.62 1wib s THR 63 CO -0.00 0.08 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.33 1wib s ILE 64 N 1.36 3.53 -0.09 1.82 1.09 -1.25 -2.83 121.20 124.82 1wib s ILE 64 Ca -0.01 -0.45 -0.05 0.00 -1.10 0.00 0.00 60.65 59.04 1wib s ILE 64 Cb -0.18 -2.59 0.04 0.00 -1.06 0.00 0.00 42.46 38.68 1wib s ILE 64 CO -0.02 0.44 0.22 -1.58 -0.10 0.00 0.00 174.94 173.90 1wib s GLN 65 N 1.14 0.19 -1.33 2.79 -0.44 -1.21 -4.61 119.66 116.19 1wib s GLN 65 Ca 0.02 0.46 -0.00 0.00 -2.50 0.00 0.00 55.36 53.33 1wib s GLN 65 Cb -0.15 -0.10 -0.00 0.00 -1.64 0.00 0.00 33.01 31.13 1wib s GLN 65 CO -0.00 -0.14 0.63 -1.71 0.50 0.00 0.00 175.29 174.57 1wib n ASN 66 N 4.03 -1.02 -3.51 6.67 2.85 -1.26 -2.02 115.26 121.00 1wib n ASN 66 Ca -0.24 -0.87 -0.18 0.00 -0.11 0.00 0.00 54.58 53.18 1wib n ASN 66 Cb 0.54 -3.82 0.07 0.00 1.24 0.00 0.00 39.78 37.81 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 -4.29 -6.01 -4.26 1.20 1.74 -1.26 -5.01 116.66 98.75 1wib n ARG 67 Ca -0.30 0.78 -0.15 0.00 -0.77 0.00 0.00 57.85 57.41 1wib n ARG 67 Cb 0.68 -5.65 -0.10 0.00 -1.02 0.00 0.00 32.46 26.36 1wib n ARG 67 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1wib s GLN 68 N -5.53 1.12 -0.01 5.56 -0.21 -0.86 -5.04 119.66 114.70 1wib s GLN 68 Ca 0.01 -1.51 0.01 0.00 0.02 0.00 0.00 55.36 53.89 1wib s GLN 68 Cb -0.00 -0.55 0.00 0.00 1.00 0.00 0.00 33.01 33.46 1wib s GLN 68 CO 0.76 -0.00 -0.03 0.00 -2.12 0.00 0.00 175.29 173.89 1wib s ALA 69 N -3.41 0.32 -0.03 6.09 0.00 -1.26 -3.29 121.76 120.18 1wib s ALA 69 Ca 0.20 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.05 1wib s ALA 69 Cb 0.04 -0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.07 1wib s ALA 69 CO 0.03 0.06 -0.05 -0.65 0.00 0.00 0.00 175.76 175.15 1wib s GLN 70 N 0.02 0.64 -0.08 0.00 -0.21 -1.13 -5.00 119.66 113.90 1wib s GLN 70 Ca 0.00 -0.14 0.02 0.00 0.02 0.00 0.00 55.36 55.27 1wib s GLN 70 Cb -0.03 -0.65 0.01 0.00 1.00 0.00 0.00 33.01 33.34 1wib s GLN 70 CO -0.00 0.01 -0.14 0.96 -2.12 0.00 0.00 175.29 173.99 1wib s ILE 71 N 0.47 1.32 -0.03 1.08 -4.36 -1.26 -3.46 121.20 114.96 1wib s ILE 71 Ca -0.06 -0.57 -0.20 0.00 -0.26 0.00 0.00 60.65 59.57 1wib s ILE 71 Cb -0.09 -1.20 0.04 0.00 1.25 0.00 0.00 42.46 42.46 1wib s ILE 71 CO -0.00 0.40 0.43 -0.70 0.24 0.00 0.00 174.94 175.30 1wib s GLU 72 N 0.73 0.78 -0.22 0.37 2.56 -1.26 -5.06 118.70 116.60 1wib s GLU 72 Ca -0.13 -0.02 -0.07 0.00 0.00 0.00 0.00 54.97 54.75 1wib s GLU 72 Cb -0.16 0.36 -0.03 0.00 2.00 0.00 0.00 34.13 36.29 1wib s GLU 72 CO 0.03 -0.22 0.07 0.08 -0.56 0.00 0.00 175.26 174.65 1wib s VAL 73 N -1.22 4.51 0.33 3.70 1.01 -1.26 -3.26 120.40 124.21 1wib s VAL 73 Ca -0.12 -0.12 -0.26 0.00 0.00 0.00 0.00 61.98 61.48 1wib s VAL 73 Cb -0.04 -3.08 -0.10 0.00 0.00 0.00 0.00 36.38 33.17 1wib s VAL 73 CO 0.06 0.38 0.96 0.68 0.00 0.00 0.00 175.10 177.18 1wib s VAL 74 N 1.11 4.14 -0.02 2.92 -7.23 -1.14 -5.00 120.40 115.18 1wib s VAL 74 Ca 0.04 1.77 -0.25 0.00 -1.81 0.00 0.00 61.98 61.73 1wib s VAL 74 Cb -0.14 -3.98 -0.20 0.00 0.56 0.00 0.00 36.38 32.62 1wib s VAL 74 CO 0.03 0.14 1.24 1.55 -0.31 0.00 0.00 175.10 177.75 1wib h PRO 75 N 3.14 -0.05 -1.60 4.82 0.13 -1.98 -3.44 132.00 133.02 1wib h PRO 75 Ca -0.47 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.75 1wib h PRO 75 Cb 1.19 0.01 -0.26 0.00 0.13 0.00 0.00 31.00 32.07 1wib h PRO 75 CO 0.65 0.42 0.37 -1.54 -0.23 0.00 0.00 178.00 177.66 1wib s SER 76 N -5.62 -0.54 -0.27 1.44 1.04 -1.26 -5.09 113.70 103.41 1wib s SER 76 Ca -0.16 0.90 -0.07 0.00 0.48 0.00 0.00 55.95 57.10 1wib s SER 76 Cb 0.02 1.14 -0.01 0.00 0.10 0.00 0.00 66.02 67.26 1wib s SER 76 CO 0.65 -0.15 0.08 0.00 0.98 0.00 0.00 173.24 174.80 1wib s ALA 77 N 1.06 3.13 0.18 5.32 0.00 -1.26 -4.91 121.76 125.27 1wib s ALA 77 Ca -0.06 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.66 1wib s ALA 77 Cb -0.04 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 20.97 1wib s ALA 77 CO -0.13 -0.65 0.00 0.43 0.00 0.00 0.00 175.76 175.41 1wib n SER 78 N 4.91 0.19 -1.57 0.00 7.64 -1.26 -4.94 113.62 118.59 1wib n SER 78 Ca -0.16 0.30 -0.01 0.00 1.01 0.00 0.00 58.87 60.01 1wib n SER 78 Cb 0.50 0.13 0.08 0.00 -1.01 0.00 0.00 64.21 63.92 1wib n SER 78 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wib n ALA 79 N -3.27 3.30 -2.53 -0.43 0.00 -1.26 -4.99 120.51 111.33 1wib n ALA 79 Ca 0.00 -2.99 -0.41 0.00 0.00 0.00 0.00 53.44 50.04 1wib n ALA 79 Cb 0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 19.45 18.87 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 -2.38 3.71 -0.37 0.00 1.43 -1.26 -4.88 118.68 114.93 1wib s LEU 80 Ca 0.37 -2.20 0.03 0.00 -1.03 0.00 0.00 54.13 51.30 1wib s LEU 80 Cb 0.37 -2.58 0.11 0.00 0.03 0.00 0.00 46.19 44.12 1wib s LEU 80 CO -0.08 -1.41 0.11 -0.55 0.23 0.00 0.00 176.35 174.65 1wib s SER 81 N 4.60 4.45 0.00 2.29 0.15 -1.26 -5.01 113.70 118.91 1wib s SER 81 Ca 0.54 -2.20 0.00 0.00 0.70 0.00 0.00 55.95 55.00 1wib s SER 81 Cb 0.03 -1.41 0.00 0.00 -1.71 0.00 0.00 66.02 62.93 1wib s SER 81 CO 0.06 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.75 1wib n GLY 82 N 4.17 0.27 3.59 9.45 0.00 -1.26 -4.98 105.19 116.43 1wib n GLY 82 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 0.46 3.25 0.12 1.61 0.04 -1.26 -4.95 135.00 134.27 1wib s PRO 83 Ca 0.00 1.17 -0.31 0.00 0.04 0.00 0.00 61.00 61.90 1wib s PRO 83 Cb 0.00 -4.20 -0.10 0.00 0.04 0.00 0.00 34.50 30.24 1wib s PRO 83 CO 0.00 -1.97 1.86 -1.54 0.04 0.00 0.00 177.00 175.39 1wib s SER 84 N 6.04 6.41 -0.32 6.66 1.04 -1.26 -4.84 113.70 127.43 1wib s SER 84 Ca 0.73 2.78 -0.31 0.00 0.48 0.00 0.00 55.95 59.64 1wib s SER 84 Cb -0.19 -2.56 -0.08 0.00 0.10 0.00 0.00 66.02 63.29 1wib s SER 84 CO 0.31 -1.02 2.25 -0.24 0.98 0.00 0.00 173.24 175.51 1wib n SER 85 N 5.89 2.64 -0.86 7.02 2.88 -1.26 -5.24 113.62 124.69 1wib n SER 85 Ca 0.18 0.20 0.11 0.00 -1.33 0.00 0.00 58.87 58.03 1wib n SER 85 Cb 0.38 -1.43 0.09 0.00 -0.75 0.00 0.00 64.21 62.50 1wib n SER 85 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42