#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 2.35 -0.03 1.61 0.15 -1.26 -5.16 113.70 111.37 1wib s SER -5 Ca 0.00 -0.97 -0.02 0.00 0.70 0.00 0.00 55.95 55.66 1wib s SER -5 Cb 0.00 -0.10 0.02 0.00 -1.71 0.00 0.00 66.02 64.22 1wib s SER -5 CO 0.00 -0.18 0.08 -0.44 1.20 0.00 0.00 173.24 173.90 1wib s SER -4 N -3.10 -0.05 0.00 5.45 0.01 -1.26 -5.12 113.70 109.63 1wib s SER -4 Ca 0.19 0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.60 1wib s SER -4 Cb -0.01 0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.33 1wib s SER -4 CO 0.05 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.24 1wib n GLY -3 N 3.55 1.13 0.12 3.44 0.00 -1.26 -5.03 105.19 107.13 1wib n GLY -3 Ca -0.19 0.53 -0.21 0.00 0.00 0.00 0.00 46.02 46.15 1wib n GLY -3 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1wib h SER -2 N 0.00 0.30 0.00 1.61 0.87 -2.06 -3.41 113.55 110.86 1wib h SER -2 Ca 0.00 -0.81 -0.01 0.00 -1.23 0.00 0.00 61.79 59.74 1wib h SER -2 Cb 0.00 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1wib h SER -2 CO 0.00 1.60 -0.23 0.28 -0.53 0.00 0.00 176.83 177.94 1wib h SER -1 N -0.42 0.00 -1.90 6.23 0.02 -2.08 -3.51 113.55 111.89 1wib h SER -1 Ca -0.31 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1wib h SER -1 Cb 1.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.21 1wib h SER -1 CO 0.01 0.64 0.00 0.61 -1.14 0.00 0.00 176.83 176.95 1wib n GLY 1 N 1.70 2.60 3.77 -3.77 0.00 -1.26 -5.13 105.19 103.10 1wib n GLY 1 Ca -0.04 -1.40 -0.36 0.00 0.00 0.00 0.00 46.02 44.22 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 -2.00 3.50 0.52 1.61 0.04 -1.26 -5.01 135.00 132.40 1wib s PRO 2 Ca 0.00 1.67 -0.20 0.00 0.04 0.00 0.00 61.00 62.50 1wib s PRO 2 Cb 0.00 -2.15 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 1wib s PRO 2 CO 0.00 -0.74 1.14 -1.25 0.04 0.00 0.00 177.00 176.19 1wib s PRO 3 N -3.08 3.46 1.04 0.56 0.04 -1.26 -5.01 135.00 130.75 1wib s PRO 3 Ca 0.70 1.65 -0.16 0.00 0.04 0.00 0.00 61.00 63.23 1wib s PRO 3 Cb -0.25 -2.11 0.14 0.00 0.04 0.00 0.00 34.50 32.32 1wib s PRO 3 CO 0.30 -0.77 0.15 1.63 0.04 0.00 0.00 177.00 178.34 1wib n LYS 4 N -1.09 -2.02 -3.63 4.56 4.76 -1.26 -5.05 118.16 114.43 1wib n LYS 4 Ca 0.11 -0.59 -0.10 0.00 -2.87 0.00 0.00 58.31 54.85 1wib n LYS 4 Cb 0.50 -1.50 -0.07 0.00 -1.84 0.00 0.00 35.03 32.12 1wib n LYS 4 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1wib s PHE 5 N -2.11 -0.50 0.28 2.13 5.36 -1.26 -5.14 117.98 116.74 1wib s PHE 5 Ca 0.41 1.19 -0.21 0.00 -0.96 0.00 0.00 56.93 57.35 1wib s PHE 5 Cb -0.06 0.36 -0.14 0.00 -0.34 0.00 0.00 43.02 42.83 1wib s PHE 5 CO 0.43 -0.26 0.24 -0.40 -1.46 0.00 0.00 175.22 173.76 1wib n ASP 6 N 2.09 -1.93 -0.07 6.13 5.75 -1.26 -4.87 116.55 122.38 1wib n ASP 6 Ca -0.13 0.84 -0.13 0.00 -0.01 0.00 0.00 54.79 55.36 1wib n ASP 6 Cb 0.56 -0.80 -0.06 0.00 -1.03 0.00 0.00 41.12 39.79 1wib n ASP 6 CO 0.00 0.00 0.00 1.55 -0.11 0.00 0.00 177.20 178.64 1wib h PRO 7 N 0.54 0.53 -7.04 0.11 0.13 -2.01 -3.46 132.00 120.80 1wib h PRO 7 Ca -0.29 -0.28 -0.60 0.00 -0.87 0.00 0.00 66.00 63.96 1wib h PRO 7 Cb 1.27 0.01 -0.30 0.00 0.13 0.00 0.00 31.00 32.11 1wib h PRO 7 CO 0.45 0.86 -0.90 0.09 -0.23 0.00 0.00 178.00 178.28 1wib n ASN 8 N -4.41 -1.71 -3.55 1.44 5.03 -1.26 -4.89 115.26 105.91 1wib n ASN 8 Ca -0.05 -1.18 -0.17 0.00 0.87 0.00 0.00 54.58 54.05 1wib n ASN 8 Cb 0.42 -1.96 -0.06 0.00 -1.02 0.00 0.00 39.78 37.15 1wib n ASN 8 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1wib s GLU 9 N -7.16 1.02 0.23 3.52 2.12 -1.26 -5.14 118.70 112.03 1wib s GLU 9 Ca 0.65 0.17 -0.20 0.00 0.36 0.00 0.00 54.97 55.95 1wib s GLU 9 Cb -0.37 0.48 -0.13 0.00 0.26 0.00 0.00 34.13 34.37 1wib s GLU 9 CO 0.99 -0.32 0.27 0.28 -0.54 0.00 0.00 175.26 175.94 1wib n VAL 10 N 0.90 1.13 -5.14 3.70 0.31 -1.26 -4.95 118.33 113.02 1wib n VAL 10 Ca -0.19 -0.40 -0.30 0.00 -0.01 0.00 0.00 64.34 63.44 1wib n VAL 10 Cb 0.57 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 33.34 1wib n VAL 10 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1wib s LYS 11 N -0.79 2.34 0.04 5.55 2.20 -1.26 -5.12 119.74 122.69 1wib s LYS 11 Ca 0.49 -0.82 0.08 0.00 -0.36 0.00 0.00 55.97 55.36 1wib s LYS 11 Cb -0.64 -1.98 -0.03 0.00 -1.51 0.00 0.00 37.83 33.67 1wib s LYS 11 CO 0.47 0.33 -0.22 0.08 -0.36 0.00 0.00 175.35 175.65 1wib s VAL 12 N -0.08 2.50 -0.02 4.02 1.01 -1.26 -3.99 120.40 122.58 1wib s VAL 12 Ca -0.04 -1.25 0.07 0.00 0.00 0.00 0.00 61.98 60.76 1wib s VAL 12 Cb -0.13 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 1wib s VAL 12 CO 0.03 0.37 -0.23 -0.69 0.00 0.00 0.00 175.10 174.58 1wib s VAL 13 N -0.86 1.82 -0.07 2.92 1.01 -1.03 -4.97 120.40 119.22 1wib s VAL 13 Ca 0.13 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1wib s VAL 13 Cb -0.10 -1.51 0.00 0.00 0.00 0.00 0.00 36.38 34.77 1wib s VAL 13 CO 0.03 0.51 -0.19 -0.31 0.00 0.00 0.00 175.10 175.14 1wib s TYR 14 N -0.55 2.02 0.02 5.22 1.51 -1.26 -2.25 117.35 122.05 1wib s TYR 14 Ca 0.09 -0.74 0.00 0.00 -1.01 0.00 0.00 57.07 55.41 1wib s TYR 14 Cb -0.09 -1.38 -0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1wib s TYR 14 CO -0.01 -0.31 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.59 1wib s LEU 15 N 0.35 2.16 -0.31 -1.29 1.43 -1.26 -5.11 118.68 114.64 1wib s LEU 15 Ca -0.13 -0.34 -0.20 0.00 -1.03 0.00 0.00 54.13 52.43 1wib s LEU 15 Cb -0.16 0.00 -0.01 0.00 0.03 0.00 0.00 46.19 46.06 1wib s LEU 15 CO 0.05 -0.17 0.60 -0.60 0.23 0.00 0.00 176.35 176.46 1wib s ARG 16 N -0.97 3.86 0.19 1.70 3.00 -1.26 -4.64 118.95 120.83 1wib s ARG 16 Ca -0.09 0.21 -0.20 0.00 -1.00 0.00 0.00 55.73 54.65 1wib s ARG 16 Cb -0.07 -3.74 0.04 0.00 0.00 0.00 0.00 34.95 31.19 1wib s ARG 16 CO -0.00 -0.58 0.58 0.00 0.00 0.00 0.00 175.30 175.30 1wib s THR 18 N -3.83 4.78 0.61 0.00 2.01 -1.26 -4.30 115.64 113.65 1wib s THR 18 Ca 0.06 0.98 -0.18 0.00 0.31 0.00 0.00 61.69 62.86 1wib s THR 18 Cb -0.02 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 1wib s THR 18 CO -0.05 0.29 1.19 -0.83 -0.69 0.00 0.00 174.62 174.53 1wib s GLY 19 N -1.59 2.62 -1.26 4.40 0.00 -0.78 -3.61 107.32 107.10 1wib s GLY 19 Ca 0.37 0.92 -0.27 0.00 0.00 0.00 0.00 44.72 45.75 1wib s GLY 19 CO 0.19 1.31 0.60 0.61 0.00 0.00 0.00 173.10 175.81 1wib n GLY 20 N 0.35 -0.73 3.42 0.20 0.00 -1.26 -1.94 105.19 105.22 1wib n GLY 20 Ca 0.13 0.32 -0.45 0.00 0.00 0.00 0.00 46.02 46.03 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 -7.18 3.80 -0.27 1.61 2.12 -1.24 -4.45 118.70 113.08 1wib s GLU 21 Ca 0.40 -2.25 -0.42 0.00 0.36 0.00 0.00 54.97 53.06 1wib s GLU 21 Cb -0.21 -4.84 -0.17 0.00 0.26 0.00 0.00 34.13 29.17 1wib s GLU 21 CO 0.96 -1.64 1.59 0.28 -0.54 0.00 0.00 175.26 175.91 1wib n VAL 22 N 4.71 0.15 0.00 3.70 0.31 -1.26 -4.85 118.33 121.08 1wib n VAL 22 Ca 0.26 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.56 1wib n VAL 22 Cb 0.46 -0.84 0.00 0.00 -0.91 0.00 0.00 33.84 32.55 1wib n VAL 22 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wib n GLY 23 N 3.67 3.11 3.84 2.92 0.00 -1.26 -5.16 105.19 112.31 1wib n GLY 23 Ca 0.26 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 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 1.99 -0.64 4.61 0.00 -1.26 -5.00 121.76 119.46 1wib s ALA 24 Ca 0.00 -0.84 -0.19 0.00 0.00 0.00 0.00 51.96 50.93 1wib s ALA 24 Cb 0.00 -2.91 0.11 0.00 0.00 0.00 0.00 23.12 20.32 1wib s ALA 24 CO 0.00 -2.37 0.77 0.95 0.00 0.00 0.00 175.76 175.11 1wib s THR 25 N -3.53 4.81 -0.18 0.00 -4.23 -1.26 -4.81 115.64 106.45 1wib s THR 25 Ca 0.68 -1.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.11 1wib s THR 25 Cb -0.09 -4.53 -0.11 0.00 1.34 0.00 0.00 72.50 69.11 1wib s THR 25 CO 0.53 -1.18 -0.17 -0.24 -0.54 0.00 0.00 174.62 173.01 1wib n SER 26 N 6.34 2.41 0.02 3.99 2.88 -1.26 -4.01 113.62 124.00 1wib n SER 26 Ca -0.05 -0.04 -0.13 0.00 -1.33 0.00 0.00 58.87 57.33 1wib n SER 26 Cb 0.43 -0.32 -0.14 0.00 -0.75 0.00 0.00 64.21 63.43 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 -0.12 0.50 0.00 -1.46 0.00 -2.03 -3.35 119.26 112.80 1wib h ALA 27 Ca -0.40 -1.26 -0.17 0.00 0.00 0.00 0.00 54.91 53.08 1wib h ALA 27 Cb 1.57 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 19.69 1wib h ALA 27 CO -0.10 1.35 -0.82 -0.07 0.00 0.00 0.00 179.25 179.61 1wib h LEU 28 N 0.03 0.00 -0.44 0.00 3.38 -1.94 -3.25 115.31 113.09 1wib h LEU 28 Ca -0.25 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.79 1wib h LEU 28 Cb 1.98 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.64 1wib h LEU 28 CO 0.12 0.82 -0.46 0.00 0.09 0.00 0.00 178.44 179.00 1wib h ALA 29 N 1.18 -0.49 0.00 1.53 0.00 -1.70 0.16 119.26 119.95 1wib h ALA 29 Ca -0.01 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1wib h ALA 29 Cb 1.50 0.96 -0.00 0.00 0.00 0.00 0.00 17.79 20.25 1wib h ALA 29 CO 0.11 -0.90 -0.08 -1.00 0.00 0.00 0.00 179.25 177.38 1wib h PRO 30 N -0.32 0.00 -0.09 0.00 0.13 -1.75 -0.93 132.00 129.03 1wib h PRO 30 Ca 0.13 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.17 1wib h PRO 30 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 1wib h PRO 30 CO -0.60 0.08 -0.28 0.87 -0.23 0.00 0.00 178.00 177.83 1wib h LYS 31 N 0.00 0.35 0.00 0.86 1.79 -0.84 -3.23 116.57 115.49 1wib h LYS 31 Ca -0.00 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 1wib h LYS 31 Cb 0.55 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1wib h LYS 31 CO 0.01 0.88 -0.31 0.82 -1.08 0.00 0.00 179.45 179.77 1wib h ILE 32 N -0.11 0.00 -0.71 1.86 2.04 -0.76 -3.38 117.51 116.44 1wib h ILE 32 Ca -0.01 -0.87 0.07 0.00 1.00 0.00 0.00 64.86 65.05 1wib h ILE 32 Cb 0.90 1.70 -0.09 0.00 -0.74 0.00 0.00 36.82 38.60 1wib h ILE 32 CO 0.06 0.00 -0.41 0.61 0.00 0.00 0.00 178.15 178.41 1wib n GLY 33 N 1.18 -1.83 0.18 5.37 0.00 -0.36 0.94 105.19 110.66 1wib n GLY 33 Ca 0.03 0.84 -0.01 0.00 0.00 0.00 0.00 46.02 46.88 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 0.13 0.07 1.61 0.13 -1.77 -3.22 132.00 128.95 1wib h PRO 34 Ca 0.12 -0.07 0.01 0.00 -0.87 0.00 0.00 66.00 65.19 1wib h PRO 34 Cb 0.30 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.41 1wib h PRO 34 CO -0.67 0.58 -0.13 -0.07 -0.23 0.00 0.00 178.00 177.48 1wib h LEU 35 N 0.11 -0.36 0.00 1.56 4.07 0.37 -3.47 115.31 117.59 1wib h LEU 35 Ca 0.00 0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1wib h LEU 35 Cb 0.88 0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.76 1wib h LEU 35 CO 0.07 -0.19 0.00 0.61 -1.08 0.00 0.00 178.44 177.85 1wib n GLY 36 N -1.25 3.59 3.56 0.83 0.00 -0.22 -5.08 105.19 106.61 1wib n GLY 36 Ca -0.06 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 1wib n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wib s LEU 37 N 0.00 1.63 0.01 0.99 1.02 -1.26 -4.98 118.68 116.09 1wib s LEU 37 Ca 0.00 1.80 -0.16 0.00 0.02 0.00 0.00 54.13 55.79 1wib s LEU 37 Cb 0.00 -3.89 -0.06 0.00 0.02 0.00 0.00 46.19 42.26 1wib s LEU 37 CO 0.00 -3.79 0.45 -0.55 0.02 0.00 0.00 176.35 172.48 1wib s SER 38 N -2.57 6.86 0.35 2.29 0.15 -1.26 -4.71 113.70 114.81 1wib s SER 38 Ca 0.68 1.02 0.14 0.00 0.70 0.00 0.00 55.95 58.49 1wib s SER 38 Cb -0.24 -2.28 0.63 0.00 -1.71 0.00 0.00 66.02 62.42 1wib s SER 38 CO 0.62 0.30 1.75 1.55 1.20 0.00 0.00 173.24 178.66 1wib h PRO 39 N 4.76 0.00 -0.36 5.44 0.13 -1.91 -3.00 132.00 137.06 1wib h PRO 39 Ca -0.51 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 1wib h PRO 39 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1wib h PRO 39 CO 0.62 0.44 0.04 -0.22 -0.23 0.00 0.00 178.00 178.65 1wib h LYS 40 N 0.00 0.61 -0.23 0.86 3.64 -1.95 0.37 116.57 119.87 1wib h LYS 40 Ca -0.00 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 1wib h LYS 40 Cb 0.83 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 1wib h LYS 40 CO 0.06 0.70 0.09 0.87 -2.27 0.00 0.00 179.45 178.90 1wib h LYS 41 N 0.44 0.35 -0.34 1.90 1.57 -1.97 -0.14 116.57 118.38 1wib h LYS 41 Ca 0.11 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 1wib h LYS 41 Cb 0.40 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1wib h LYS 41 CO 0.01 0.39 -0.20 0.28 -0.57 0.00 0.00 179.45 179.37 1wib h VAL 42 N 0.22 1.29 -0.64 0.50 2.07 -1.48 -2.31 116.25 115.91 1wib h VAL 42 Ca 0.08 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.25 1wib h VAL 42 Cb 0.18 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1wib h VAL 42 CO -0.01 0.43 0.30 1.23 0.02 0.00 0.00 177.57 179.55 1wib h GLY 43 N 0.50 0.99 0.99 2.17 0.00 -0.18 -2.05 103.07 105.51 1wib h GLY 43 Ca 0.07 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.84 1wib h GLY 43 CO 0.06 0.47 0.08 -1.80 0.00 0.00 0.00 176.54 175.35 1wib h ASP 44 N 0.89 0.81 -0.91 0.19 3.58 -1.00 -2.51 116.42 117.47 1wib h ASP 44 Ca 0.22 -0.26 0.01 0.00 0.42 0.00 0.00 57.03 57.42 1wib h ASP 44 Cb 0.13 -0.22 -0.04 0.00 1.72 0.00 0.00 39.33 40.92 1wib h ASP 44 CO -0.03 0.87 0.60 0.44 -2.88 0.00 0.00 179.24 178.24 1wib h ASP 45 N 0.73 1.04 -0.63 2.28 5.19 -1.21 -2.22 116.42 121.60 1wib h ASP 45 Ca 0.16 -0.03 -0.06 0.00 -0.62 0.00 0.00 57.03 56.48 1wib h ASP 45 Cb 0.40 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 39.62 1wib h ASP 45 CO 0.01 0.75 0.19 0.40 -3.12 0.00 0.00 179.24 177.47 1wib h ILE 46 N 1.23 1.25 -0.26 0.35 2.04 -1.18 -1.42 117.51 119.51 1wib h ILE 46 Ca 0.33 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1wib h ILE 46 Cb -0.14 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 1wib h ILE 46 CO -0.07 0.34 0.17 0.00 0.00 0.00 0.00 178.15 178.58 1wib h ALA 47 N 1.23 0.33 -0.16 1.87 0.00 -0.97 -0.50 119.26 121.06 1wib h ALA 47 Ca 0.21 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1wib h ALA 47 Cb 0.30 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1wib h ALA 47 CO -0.00 -0.19 -0.30 1.57 0.00 0.00 0.00 179.25 180.32 1wib h LYS 48 N 0.35 0.31 -0.32 0.00 2.10 -1.28 -2.56 116.57 115.15 1wib h LYS 48 Ca 0.09 -0.12 -0.12 0.00 -2.00 0.00 0.00 60.65 58.50 1wib h LYS 48 Cb -0.03 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.27 1wib h LYS 48 CO -0.02 0.59 -0.31 0.00 -2.00 0.00 0.00 179.45 177.71 1wib h ALA 49 N 1.42 0.86 -0.42 0.07 0.00 -0.80 -2.75 119.26 117.63 1wib h ALA 49 Ca 0.04 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 1wib h ALA 49 Cb 0.68 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1wib h ALA 49 CO 0.05 0.63 0.03 0.25 0.00 0.00 0.00 179.25 180.21 1wib n THR 50 N -4.08 1.99 0.03 0.00 -2.24 -0.24 -4.30 114.28 105.44 1wib n THR 50 Ca -0.01 -1.01 -0.09 0.00 -2.27 0.00 0.00 64.05 60.68 1wib n THR 50 Cb 0.47 -0.36 0.06 0.00 -2.10 0.00 0.00 70.33 68.40 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 4.18 0.53 2.00 3.38 0.00 -1.15 1.24 103.07 113.25 1wib h GLY 51 Ca 0.03 -0.64 -0.10 0.00 0.00 0.00 0.00 47.33 46.61 1wib h GLY 51 CO 0.38 0.57 -0.49 -0.55 0.00 0.00 0.00 176.54 176.45 1wib h ASP 52 N 0.36 0.00 -0.40 0.19 3.32 -1.80 -3.27 116.42 114.82 1wib h ASP 52 Ca -0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 1wib h ASP 52 Cb 1.13 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 40.32 1wib h ASP 52 CO 0.11 0.49 -0.94 -2.67 -1.72 0.00 0.00 179.24 174.51 1wib n TRP 53 N -3.65 1.35 -1.87 4.55 2.14 -1.16 -5.09 117.44 113.71 1wib n TRP 53 Ca -0.01 -1.82 -0.38 0.00 2.07 0.00 0.00 57.50 57.37 1wib n TRP 53 Cb 0.56 -0.25 0.03 0.00 -0.81 0.00 0.00 31.31 30.84 1wib n TRP 53 CO 0.00 0.00 0.00 -1.59 2.07 0.00 0.00 177.69 178.17 1wib s LYS 54 N -3.05 3.22 0.00 -2.67 0.00 0.43 -2.57 119.74 115.09 1wib s LYS 54 Ca 0.37 2.13 0.00 0.00 0.00 0.00 0.00 55.97 58.47 1wib s LYS 54 Cb 0.37 -2.25 0.00 0.00 0.00 0.00 0.00 37.83 35.94 1wib s LYS 54 CO -0.04 -1.09 0.00 0.41 0.00 0.00 0.00 175.35 174.62 1wib n GLY 55 N 0.67 2.91 3.88 0.59 0.00 -0.82 -4.95 105.19 107.47 1wib n GLY 55 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 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 3.85 -0.14 0.99 1.43 -1.06 -4.70 118.68 119.05 1wib s LEU 56 Ca 0.00 1.08 -0.25 0.00 -1.03 0.00 0.00 54.13 53.94 1wib s LEU 56 Cb 0.00 -3.96 -0.02 0.00 0.03 0.00 0.00 46.19 42.24 1wib s LEU 56 CO 0.00 -0.38 0.80 -0.60 0.23 0.00 0.00 176.35 176.40 1wib s ARG 57 N -3.83 4.34 0.04 1.70 6.06 -1.26 -1.86 118.95 124.13 1wib s ARG 57 Ca 0.50 0.98 -0.06 0.00 -2.50 0.00 0.00 55.73 54.66 1wib s ARG 57 Cb -0.10 -3.54 -0.01 0.00 0.06 0.00 0.00 34.95 31.36 1wib s ARG 57 CO 0.31 -0.22 0.10 0.96 -2.50 0.00 0.00 175.30 173.95 1wib s ILE 58 N 1.78 0.13 -0.19 4.11 -5.25 -1.26 -4.97 121.20 115.55 1wib s ILE 58 Ca 0.38 -1.05 -0.17 0.00 -0.99 0.00 0.00 60.65 58.82 1wib s ILE 58 Cb -0.17 -0.86 -0.04 0.00 2.95 0.00 0.00 42.46 44.34 1wib s ILE 58 CO 0.14 -0.58 0.45 -0.89 -1.79 0.00 0.00 174.94 172.27 1wib s THR 59 N -2.53 5.17 -0.11 8.37 2.01 -1.26 -4.71 115.64 122.58 1wib s THR 59 Ca -0.06 0.83 0.03 0.00 0.31 0.00 0.00 61.69 62.80 1wib s THR 59 Cb -0.02 -3.78 0.01 0.00 0.01 0.00 0.00 72.50 68.72 1wib s THR 59 CO -0.04 0.24 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.25 1wib s VAL 60 N 1.30 1.70 -0.14 3.82 1.01 -1.26 -3.44 120.40 123.38 1wib s VAL 60 Ca 0.22 -0.78 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 1wib s VAL 60 Cb -0.15 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 1wib s VAL 60 CO 0.09 0.48 0.08 -1.59 0.00 0.00 0.00 175.10 174.16 1wib s LYS 61 N 0.74 3.63 -0.28 2.72 -2.85 -1.22 -4.34 119.74 118.14 1wib s LYS 61 Ca -0.11 -0.28 -0.10 0.00 -1.00 0.00 0.00 55.97 54.48 1wib s LYS 61 Cb -0.16 -3.14 -0.03 0.00 -2.06 0.00 0.00 37.83 32.44 1wib s LYS 61 CO 0.02 0.52 0.14 -0.51 0.10 0.00 0.00 175.35 175.62 1wib s LEU 62 N -0.31 3.86 -0.22 2.77 1.43 -0.95 -3.86 118.68 121.40 1wib s LEU 62 Ca 0.09 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 1wib s LEU 62 Cb -0.12 -2.03 0.02 0.00 0.03 0.00 0.00 46.19 44.09 1wib s LEU 62 CO 0.01 -0.08 -0.10 -0.89 0.23 0.00 0.00 176.35 175.52 1wib s THR 63 N 1.68 2.70 -0.18 5.49 2.01 -1.17 -2.47 115.64 123.70 1wib s THR 63 Ca 0.06 -0.89 -0.07 0.00 0.31 0.00 0.00 61.69 61.10 1wib s THR 63 Cb -0.16 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.03 1wib s THR 63 CO 0.07 0.36 0.07 -0.63 -0.69 0.00 0.00 174.62 173.80 1wib s ILE 64 N 1.34 4.84 -0.10 1.82 -1.09 -1.26 -2.91 121.20 123.85 1wib s ILE 64 Ca 0.03 -0.02 -0.08 0.00 -2.23 0.00 0.00 60.65 58.35 1wib s ILE 64 Cb -0.15 -3.17 0.03 0.00 -1.58 0.00 0.00 42.46 37.58 1wib s ILE 64 CO -0.07 0.47 0.25 -1.10 -1.23 0.00 0.00 174.94 173.27 1wib s GLN 65 N 0.26 0.29 -1.61 2.79 -0.21 -0.66 -4.62 119.66 115.90 1wib s GLN 65 Ca 0.04 0.37 -0.20 0.00 0.02 0.00 0.00 55.36 55.59 1wib s GLN 65 Cb -0.12 0.12 0.20 0.00 1.00 0.00 0.00 33.01 34.21 1wib s GLN 65 CO 0.00 -0.05 0.51 0.27 -2.12 0.00 0.00 175.29 173.90 1wib n ASN 66 N 3.08 -1.71 -2.51 5.90 0.23 -1.26 0.16 115.26 119.14 1wib n ASN 66 Ca -0.14 -0.99 -0.14 0.00 -0.53 0.00 0.00 54.58 52.78 1wib n ASN 66 Cb 0.58 -1.52 0.05 0.00 -2.08 0.00 0.00 39.78 36.81 1wib n ASN 66 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1wib n ARG 67 N -3.83 -4.83 -4.36 -3.83 5.12 -1.26 -5.03 116.66 98.64 1wib n ARG 67 Ca 0.10 0.54 -0.19 0.00 -1.93 0.00 0.00 57.85 56.37 1wib n ARG 67 Cb 0.46 -4.67 -0.15 0.00 -1.16 0.00 0.00 32.46 26.94 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 -5.51 0.81 -0.14 5.56 -0.21 0.41 -5.00 119.66 115.58 1wib s GLN 68 Ca 0.25 -0.30 -0.05 0.00 0.02 0.00 0.00 55.36 55.28 1wib s GLN 68 Cb -0.11 -0.78 -0.04 0.00 1.00 0.00 0.00 33.01 33.09 1wib s GLN 68 CO 0.47 0.15 0.03 0.00 -2.12 0.00 0.00 175.29 173.82 1wib s ALA 69 N -0.01 3.33 -0.01 6.09 0.00 -1.26 -1.66 121.76 128.24 1wib s ALA 69 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.20 1wib s ALA 69 Cb -0.06 -1.71 0.02 0.00 0.00 0.00 0.00 23.12 21.37 1wib s ALA 69 CO -0.00 0.36 0.01 -0.65 0.00 0.00 0.00 175.76 175.48 1wib s GLN 70 N -0.18 0.07 -0.07 0.00 -0.21 -1.15 -5.04 119.66 113.08 1wib s GLN 70 Ca 0.06 0.07 0.03 0.00 0.02 0.00 0.00 55.36 55.54 1wib s GLN 70 Cb -0.12 -0.20 -0.02 0.00 1.00 0.00 0.00 33.01 33.66 1wib s GLN 70 CO 0.02 -0.08 -0.15 0.96 -2.12 0.00 0.00 175.29 173.92 1wib s ILE 71 N 0.55 2.96 -0.05 1.08 -4.36 -1.26 -3.07 121.20 117.06 1wib s ILE 71 Ca -0.05 -0.74 -0.07 0.00 -0.26 0.00 0.00 60.65 59.53 1wib s ILE 71 Cb -0.07 -2.18 0.01 0.00 1.25 0.00 0.00 42.46 41.48 1wib s ILE 71 CO -0.01 0.57 0.17 -0.70 0.24 0.00 0.00 174.94 175.21 1wib s GLU 72 N -0.40 0.29 -0.12 0.37 2.56 -1.25 -5.06 118.70 115.08 1wib s GLU 72 Ca 0.04 0.08 -0.17 0.00 0.00 0.00 0.00 54.97 54.92 1wib s GLU 72 Cb -0.12 0.13 -0.04 0.00 2.00 0.00 0.00 34.13 36.09 1wib s GLU 72 CO 0.02 -0.05 0.43 0.08 -0.56 0.00 0.00 175.26 175.17 1wib s VAL 73 N -0.31 5.20 0.32 3.70 1.01 -1.26 -3.44 120.40 125.63 1wib s VAL 73 Ca -0.04 0.84 -0.26 0.00 0.00 0.00 0.00 61.98 62.52 1wib s VAL 73 Cb -0.03 -3.76 -0.10 0.00 0.00 0.00 0.00 36.38 32.49 1wib s VAL 73 CO 0.01 0.36 0.95 0.68 0.00 0.00 0.00 175.10 177.10 1wib s VAL 74 N 0.44 4.20 0.02 2.92 -7.23 -1.22 -5.01 120.40 114.52 1wib s VAL 74 Ca 0.23 1.82 -0.30 0.00 -1.81 0.00 0.00 61.98 61.92 1wib s VAL 74 Cb -0.15 -4.01 -0.06 0.00 0.56 0.00 0.00 36.38 32.72 1wib s VAL 74 CO 0.09 0.14 1.43 -2.16 -0.31 0.00 0.00 175.10 174.30 1wib s PRO 75 N -2.05 4.28 -0.11 4.82 0.04 -1.26 -4.89 135.00 135.83 1wib s PRO 75 Ca 0.50 2.03 0.02 0.00 0.04 0.00 0.00 61.00 63.59 1wib s PRO 75 Cb -0.19 -3.54 0.01 0.00 0.04 0.00 0.00 34.50 30.82 1wib s PRO 75 CO 0.24 -0.58 -0.18 0.45 0.04 0.00 0.00 177.00 176.97 1wib s SER 76 N 1.87 2.62 -1.13 6.66 0.15 -1.26 -5.07 113.70 117.54 1wib s SER 76 Ca 0.65 -0.47 -0.12 0.00 0.70 0.00 0.00 55.95 56.71 1wib s SER 76 Cb -0.33 -1.19 0.22 0.00 -1.71 0.00 0.00 66.02 63.01 1wib s SER 76 CO 0.28 0.06 1.23 0.00 1.20 0.00 0.00 173.24 176.00 1wib s ALA 77 N 0.80 4.33 -0.08 5.45 0.00 -1.26 -4.81 121.76 126.19 1wib s ALA 77 Ca -0.10 -3.56 -0.04 0.00 0.00 0.00 0.00 51.96 48.26 1wib s ALA 77 Cb -0.16 -3.82 -0.01 0.00 0.00 0.00 0.00 23.12 19.13 1wib s ALA 77 CO 0.01 -2.48 -0.08 1.03 0.00 0.00 0.00 175.76 174.24 1wib h SER 78 N 7.04 0.00 -0.59 0.00 0.87 -2.03 -3.44 113.55 115.41 1wib h SER 78 Ca 0.23 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.45 1wib h SER 78 Cb 0.89 0.00 -0.41 0.00 -0.44 0.00 0.00 62.40 62.44 1wib h SER 78 CO 1.10 0.41 -1.03 0.00 -0.53 0.00 0.00 176.83 176.78 1wib n ALA 79 N -2.91 3.38 -1.17 6.23 0.00 -1.26 -4.89 120.51 119.88 1wib n ALA 79 Ca -0.03 -3.11 -0.25 0.00 0.00 0.00 0.00 53.44 50.06 1wib n ALA 79 Cb 0.12 -0.72 0.03 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.59 6.87 -4.56 0.00 4.77 -1.26 -4.92 117.00 117.31 1wib n LEU 80 Ca 0.18 -3.79 -0.21 0.00 -0.03 0.00 0.00 56.01 52.16 1wib n LEU 80 Cb 0.84 -1.07 -0.06 0.00 -2.33 0.00 0.00 43.42 40.81 1wib n LEU 80 CO 0.18 1.41 1.40 -0.55 -1.33 0.00 0.00 177.39 178.50 1wib s SER 81 N -0.40 4.33 0.00 -1.43 0.15 -1.26 -3.85 113.70 111.24 1wib s SER 81 Ca 0.46 0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.18 1wib s SER 81 Cb 0.35 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 1wib s SER 81 CO -0.07 -3.39 0.00 0.61 1.20 0.00 0.00 173.24 171.60 1wib n GLY 82 N 6.63 2.29 3.73 9.45 0.00 -1.26 -5.07 105.19 120.95 1wib n GLY 82 Ca 0.42 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 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 0.00 1.58 0.19 1.61 0.04 -1.25 -5.08 135.00 132.09 1wib s PRO 83 Ca 0.00 0.93 -0.04 0.00 0.04 0.00 0.00 61.00 61.92 1wib s PRO 83 Cb 0.00 -1.84 -0.03 0.00 0.04 0.00 0.00 34.50 32.67 1wib s PRO 83 CO 0.00 -2.05 0.21 -1.12 0.04 0.00 0.00 177.00 174.08 1wib s SER 84 N -3.42 0.11 0.00 6.66 0.01 -1.26 -4.79 113.70 111.02 1wib s SER 84 Ca 0.63 -1.20 0.00 0.00 1.31 0.00 0.00 55.95 56.69 1wib s SER 84 Cb -0.18 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.47 1wib s SER 84 CO 0.57 -0.89 0.00 -1.54 0.41 0.00 0.00 173.24 171.78 1wib n SER 85 N -0.26 1.80 0.00 2.44 3.41 -1.26 -5.22 113.62 114.53 1wib n SER 85 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1wib n SER 85 Cb 0.64 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.72 1wib n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49