#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 -0.08 -0.22 1.61 0.01 -1.26 -5.08 113.70 108.69 1wib s SER -5 Ca 0.00 -0.44 -0.08 0.00 1.31 0.00 0.00 55.95 56.74 1wib s SER -5 Cb 0.00 0.41 -0.10 0.00 0.21 0.00 0.00 66.02 66.53 1wib s SER -5 CO 0.00 -0.78 -0.26 -0.24 0.41 0.00 0.00 173.24 172.38 1wib n SER -4 N -0.08 1.77 0.00 2.44 2.88 -1.26 -5.10 113.62 114.27 1wib n SER -4 Ca -0.16 0.17 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 1wib n SER -4 Cb 0.63 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 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 1.86 0.42 3.35 0.46 0.00 -1.26 -5.16 105.19 104.87 1wib n GLY -3 Ca -0.41 -0.68 -0.21 0.00 0.00 0.00 0.00 46.02 44.72 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 1.86 -0.16 1.61 0.01 -1.26 -5.15 113.70 110.61 1wib s SER -2 Ca 0.00 -1.68 -0.02 0.00 1.31 0.00 0.00 55.95 55.56 1wib s SER -2 Cb 0.00 0.51 -0.01 0.00 0.21 0.00 0.00 66.02 66.72 1wib s SER -2 CO 0.00 -0.99 -0.09 -0.94 0.41 0.00 0.00 173.24 171.64 1wib s SER -1 N -3.42 4.25 0.00 2.44 1.04 -1.26 -5.03 113.70 111.71 1wib s SER -1 Ca 0.35 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.47 1wib s SER -1 Cb 0.03 -1.68 0.00 0.00 0.10 0.00 0.00 66.02 64.47 1wib s SER -1 CO 0.21 0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.15 1wib n GLY 1 N 3.92 0.57 3.77 7.32 0.00 -1.26 -5.12 105.19 114.39 1wib n GLY 1 Ca -0.18 -1.63 -0.36 0.00 0.00 0.00 0.00 46.02 43.85 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 0.46 1.61 0.04 -1.26 -5.01 135.00 132.35 1wib s PRO 2 Ca 0.00 1.67 -0.23 0.00 0.04 0.00 0.00 61.00 62.48 1wib s PRO 2 Cb 0.00 -2.15 -0.07 0.00 0.04 0.00 0.00 34.50 32.32 1wib s PRO 2 CO 0.00 -0.74 1.16 -1.25 0.04 0.00 0.00 177.00 176.22 1wib s PRO 3 N -3.07 3.74 -0.15 0.56 0.04 -1.26 -5.04 135.00 129.81 1wib s PRO 3 Ca 0.69 1.77 -0.30 0.00 0.04 0.00 0.00 61.00 63.20 1wib s PRO 3 Cb -0.25 -2.39 0.13 0.00 0.04 0.00 0.00 34.50 32.03 1wib s PRO 3 CO 0.30 -0.57 1.05 -1.59 0.04 0.00 0.00 177.00 176.22 1wib s LYS 4 N -2.72 0.53 -0.30 4.56 0.00 -1.26 -5.16 119.74 115.38 1wib s LYS 4 Ca 0.64 0.02 -0.11 0.00 0.00 0.00 0.00 55.97 56.52 1wib s LYS 4 Cb -0.28 0.25 0.15 0.00 0.00 0.00 0.00 37.83 37.95 1wib s LYS 4 CO 0.34 -0.19 0.78 -0.59 0.00 0.00 0.00 175.35 175.70 1wib s PHE 5 N -1.59 -1.10 -0.24 1.78 -0.71 -1.26 -5.10 117.98 109.75 1wib s PHE 5 Ca 0.02 1.79 -0.27 0.00 -1.04 0.00 0.00 56.93 57.43 1wib s PHE 5 Cb -0.01 0.62 0.14 0.00 -1.21 0.00 0.00 43.02 42.56 1wib s PHE 5 CO -0.02 -0.56 1.11 0.16 -1.34 0.00 0.00 175.22 174.57 1wib s ASP 6 N 2.74 -0.33 0.02 1.98 -4.77 -1.26 -4.84 116.67 110.21 1wib s ASP 6 Ca -0.02 0.54 -0.22 0.00 -3.30 0.00 0.00 52.55 49.55 1wib s ASP 6 Cb -0.10 0.51 -0.16 0.00 -1.09 0.00 0.00 42.92 42.08 1wib s ASP 6 CO -0.18 -0.18 1.33 1.55 0.70 0.00 0.00 175.17 178.38 1wib h PRO 7 N 3.35 0.26 0.00 2.11 0.13 -2.02 -3.43 132.00 132.40 1wib h PRO 7 Ca -0.23 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1wib h PRO 7 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1wib h PRO 7 CO 0.19 0.67 -0.47 0.27 -0.23 0.00 0.00 178.00 178.43 1wib n ASN 8 N -4.64 0.44 -3.77 1.44 6.94 -1.26 -5.14 115.26 109.27 1wib n ASN 8 Ca -0.07 0.09 -0.09 0.00 -0.02 0.00 0.00 54.58 54.49 1wib n ASN 8 Cb 0.33 -0.11 -0.03 0.00 -2.36 0.00 0.00 39.78 37.60 1wib n ASN 8 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1wib s GLU 9 N -2.00 1.73 0.01 -3.83 2.02 -1.26 -5.16 118.70 110.21 1wib s GLU 9 Ca 0.00 -1.24 -0.16 0.00 0.02 0.00 0.00 54.97 53.60 1wib s GLU 9 Cb 0.00 0.53 -0.06 0.00 0.10 0.00 0.00 34.13 34.70 1wib s GLU 9 CO 0.00 -0.76 0.44 0.08 0.02 0.00 0.00 175.26 175.05 1wib s VAL 10 N -3.72 4.98 -0.24 2.63 1.01 -1.26 -4.87 120.40 118.93 1wib s VAL 10 Ca 0.19 0.92 -0.05 0.00 0.00 0.00 0.00 61.98 63.03 1wib s VAL 10 Cb -0.03 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 1wib s VAL 10 CO 0.10 0.56 0.01 -0.75 0.00 0.00 0.00 175.10 175.02 1wib s LYS 11 N -0.98 3.40 0.03 2.72 2.20 -1.26 -5.10 119.74 120.76 1wib s LYS 11 Ca 0.25 -0.62 0.06 0.00 -0.36 0.00 0.00 55.97 55.29 1wib s LYS 11 Cb -0.17 -3.16 -0.03 0.00 -1.51 0.00 0.00 37.83 32.95 1wib s LYS 11 CO 0.14 -0.24 -0.14 0.08 -0.36 0.00 0.00 175.35 174.83 1wib s VAL 12 N 1.52 3.07 -0.04 4.02 1.01 -1.26 -2.97 120.40 125.74 1wib s VAL 12 Ca 0.05 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 60.99 1wib s VAL 12 Cb -0.15 -2.31 0.02 0.00 0.00 0.00 0.00 36.38 33.95 1wib s VAL 12 CO -0.00 0.35 -0.04 -0.69 0.00 0.00 0.00 175.10 174.72 1wib s VAL 13 N -0.95 0.50 -0.15 2.92 1.01 -0.65 -5.00 120.40 118.08 1wib s VAL 13 Ca 0.15 -0.10 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 1wib s VAL 13 Cb -0.11 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 1wib s VAL 13 CO 0.06 0.22 -0.07 -0.31 0.00 0.00 0.00 175.10 175.00 1wib s TYR 14 N 0.97 2.94 -0.02 5.22 1.51 -1.26 -2.34 117.35 124.36 1wib s TYR 14 Ca -0.10 -0.48 0.02 0.00 -1.01 0.00 0.00 57.07 55.49 1wib s TYR 14 Cb -0.14 -1.92 0.01 0.00 -0.11 0.00 0.00 41.96 39.79 1wib s TYR 14 CO -0.00 -0.14 -0.06 -0.51 -1.11 0.00 0.00 175.55 173.72 1wib s LEU 15 N 0.44 1.72 -0.31 -1.29 1.43 -1.25 -5.09 118.68 114.33 1wib s LEU 15 Ca -0.06 -0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 52.83 1wib s LEU 15 Cb -0.15 -0.40 0.00 0.00 0.03 0.00 0.00 46.19 45.67 1wib s LEU 15 CO 0.04 0.03 0.12 -0.60 0.23 0.00 0.00 176.35 176.16 1wib s ARG 16 N 0.30 3.17 0.22 1.70 6.06 -1.26 -4.13 118.95 125.01 1wib s ARG 16 Ca -0.04 -0.82 -0.09 0.00 -2.50 0.00 0.00 55.73 52.28 1wib s ARG 16 Cb -0.08 -3.48 -0.01 0.00 0.06 0.00 0.00 34.95 31.44 1wib s ARG 16 CO -0.00 -0.45 0.35 0.00 -2.50 0.00 0.00 175.30 172.70 1wib s THR 18 N -4.04 3.61 -0.18 0.00 2.01 -1.26 -4.23 115.64 111.55 1wib s THR 18 Ca 0.26 1.35 -0.32 0.00 0.31 0.00 0.00 61.69 63.29 1wib s THR 18 Cb 0.02 -3.76 -0.09 0.00 0.01 0.00 0.00 72.50 68.68 1wib s THR 18 CO 0.08 0.12 2.07 0.61 -0.69 0.00 0.00 174.62 176.81 1wib n GLY 19 N 0.63 1.14 2.65 4.40 0.00 0.83 -3.14 105.19 111.69 1wib n GLY 19 Ca 0.03 0.85 -0.02 0.00 0.00 0.00 0.00 46.02 46.89 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 5.34 -1.06 2.67 -0.02 0.00 -1.25 -1.85 105.19 109.02 1wib n GLY 20 Ca 0.29 0.48 -0.23 0.00 0.00 0.00 0.00 46.02 46.56 1wib n GLY 20 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wib s GLU 21 N -2.80 0.14 -0.37 1.61 4.04 -1.19 -4.82 118.70 115.32 1wib s GLU 21 Ca 0.05 0.12 -0.13 0.00 0.04 0.00 0.00 54.97 55.05 1wib s GLU 21 Cb -0.01 -1.15 0.00 0.00 0.02 0.00 0.00 34.13 32.99 1wib s GLU 21 CO 0.58 -0.46 0.25 0.08 -1.84 0.00 0.00 175.26 173.87 1wib s VAL 22 N 2.10 5.16 0.00 1.83 1.01 -1.26 -4.95 120.40 124.29 1wib s VAL 22 Ca 0.04 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1wib s VAL 22 Cb -0.14 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1wib s VAL 22 CO -0.06 -0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.53 1wib n GLY 23 N 5.11 -0.28 2.99 4.51 0.00 -1.26 -5.15 105.19 111.11 1wib n GLY 23 Ca -0.12 0.79 -0.08 0.00 0.00 0.00 0.00 46.02 46.61 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 0.00 -1.20 -1.06 4.61 0.00 -1.26 -5.09 121.76 117.77 1wib s ALA 24 Ca 0.00 1.09 -0.22 0.00 0.00 0.00 0.00 51.96 52.82 1wib s ALA 24 Cb 0.00 -1.66 0.04 0.00 0.00 0.00 0.00 23.12 21.50 1wib s ALA 24 CO 0.00 -1.18 1.57 0.99 0.00 0.00 0.00 175.76 177.14 1wib s THR 25 N 2.58 3.88 -1.72 0.00 2.01 -1.26 -4.30 115.64 116.84 1wib s THR 25 Ca 0.11 -0.90 -0.19 0.00 0.31 0.00 0.00 61.69 61.02 1wib s THR 25 Cb -0.15 -4.94 0.19 0.00 0.01 0.00 0.00 72.50 67.61 1wib s THR 25 CO -0.16 -1.80 0.47 -1.20 -0.69 0.00 0.00 174.62 171.24 1wib n SER 26 N 9.61 -1.27 -0.01 3.53 7.64 -1.26 -4.78 113.62 127.09 1wib n SER 26 Ca 0.37 -1.18 -0.08 0.00 1.01 0.00 0.00 58.87 58.99 1wib n SER 26 Cb 0.50 -1.50 -0.14 0.00 -1.01 0.00 0.00 64.21 62.06 1wib n SER 26 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wib h ALA 27 N 0.93 0.74 0.00 -0.43 0.00 -1.99 -3.34 119.26 115.17 1wib h ALA 27 Ca -0.57 -1.41 0.00 0.00 0.00 0.00 0.00 54.91 52.93 1wib h ALA 27 Cb 1.31 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1wib h ALA 27 CO 0.81 1.54 -0.52 1.28 0.00 0.00 0.00 179.25 182.37 1wib n LEU 28 N -3.06 0.52 0.11 0.00 4.77 -1.26 -4.19 117.00 113.90 1wib n LEU 28 Ca -0.15 0.08 -0.14 0.00 -0.03 0.00 0.00 56.01 55.77 1wib n LEU 28 Cb 1.04 -0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.81 1wib n LEU 28 CO 0.45 0.07 0.59 0.00 -1.33 0.00 0.00 177.39 177.17 1wib h ALA 29 N 2.87 -0.75 0.00 -1.18 0.00 -1.95 0.30 119.26 118.55 1wib h ALA 29 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1wib h ALA 29 Cb 0.57 0.70 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1wib h ALA 29 CO 0.00 -0.99 -0.07 -1.00 0.00 0.00 0.00 179.25 177.20 1wib h PRO 30 N -0.65 0.00 0.09 0.00 0.13 -1.80 0.37 132.00 130.14 1wib h PRO 30 Ca 0.02 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.90 1wib h PRO 30 Cb 0.68 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.83 1wib h PRO 30 CO -0.24 0.07 -1.02 0.87 -0.23 0.00 0.00 178.00 177.44 1wib h LYS 31 N 0.00 0.53 -0.19 0.86 1.57 -1.49 -3.30 116.57 114.55 1wib h LYS 31 Ca -0.00 -0.69 0.00 0.00 -1.87 0.00 0.00 60.65 58.09 1wib h LYS 31 Cb 0.54 0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1wib h LYS 31 CO 0.01 1.30 0.00 -0.89 -0.57 0.00 0.00 179.45 179.29 1wib n ILE 32 N -3.95 0.23 0.36 1.86 5.41 0.96 -4.49 119.36 119.74 1wib n ILE 32 Ca -0.13 -0.61 -0.19 0.00 1.00 0.00 0.00 62.75 62.82 1wib n ILE 32 Cb 0.88 1.25 -0.10 0.00 -0.71 0.00 0.00 39.64 40.97 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 4.64 -1.29 2.00 7.39 0.00 -0.34 -2.52 103.07 112.95 1wib h GLY 33 Ca 0.00 0.56 -0.09 0.00 0.00 0.00 0.00 47.33 47.81 1wib h GLY 33 CO 0.00 -0.41 -0.42 -0.56 0.00 0.00 0.00 176.54 175.15 1wib h PRO 34 N -1.10 0.00 0.23 4.80 0.13 -1.80 -3.31 132.00 130.95 1wib h PRO 34 Ca -0.08 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.04 1wib h PRO 34 Cb 0.92 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.04 1wib h PRO 34 CO 0.02 0.42 -0.15 -0.07 -0.23 0.00 0.00 178.00 177.99 1wib h LEU 35 N 0.00 -0.39 0.00 1.56 4.07 -1.74 -3.48 115.31 115.33 1wib h LEU 35 Ca -0.00 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.98 1wib h LEU 35 Cb 0.81 0.12 0.00 0.00 1.08 0.00 0.00 40.66 42.66 1wib h LEU 35 CO 0.05 -0.23 0.00 0.61 -1.08 0.00 0.00 178.44 177.80 1wib n GLY 36 N -1.19 1.57 2.72 0.83 0.00 -0.97 -5.00 105.19 103.15 1wib n GLY 36 Ca -0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.66 0.99 4.32 -1.24 -5.11 117.00 111.30 1wib n LEU 37 Ca 0.00 -2.57 -0.33 0.00 -0.02 0.00 0.00 56.01 53.09 1wib n LEU 37 Cb 0.00 0.96 -0.10 0.00 -1.62 0.00 0.00 43.42 42.67 1wib n LEU 37 CO 0.00 -0.40 -0.33 -0.55 -1.22 0.00 0.00 177.39 174.89 1wib s SER 38 N -3.02 5.05 0.18 -1.43 0.15 -1.26 -4.78 113.70 108.59 1wib s SER 38 Ca 0.20 0.03 -0.06 0.00 0.70 0.00 0.00 55.95 56.82 1wib s SER 38 Cb 0.01 -1.33 0.09 0.00 -1.71 0.00 0.00 66.02 63.07 1wib s SER 38 CO 0.14 0.33 1.53 1.55 1.20 0.00 0.00 173.24 177.99 1wib h PRO 39 N 4.76 0.74 -0.68 5.44 0.13 -1.95 -2.78 132.00 137.66 1wib h PRO 39 Ca -0.49 -0.39 -0.06 0.00 -0.87 0.00 0.00 66.00 64.19 1wib h PRO 39 Cb 1.18 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 1wib h PRO 39 CO 0.55 1.01 0.20 1.57 -0.23 0.00 0.00 178.00 181.10 1wib h LYS 40 N 0.60 1.04 -0.18 0.86 5.09 -1.98 0.29 116.57 122.30 1wib h LYS 40 Ca 0.05 -0.22 -0.03 0.00 0.09 0.00 0.00 60.65 60.54 1wib h LYS 40 Cb 0.96 -0.15 -0.01 0.00 0.10 0.00 0.00 32.23 33.13 1wib h LYS 40 CO 0.09 0.90 0.00 0.87 -2.09 0.00 0.00 179.45 179.22 1wib h LYS 41 N 1.00 0.32 -0.32 0.07 1.79 -1.97 -1.27 116.57 116.20 1wib h LYS 41 Ca 0.22 -0.10 -0.11 0.00 -2.18 0.00 0.00 60.65 58.48 1wib h LYS 41 Cb 0.30 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.92 1wib h LYS 41 CO -0.01 0.53 -0.23 0.28 -1.08 0.00 0.00 179.45 178.94 1wib h VAL 42 N 0.08 1.29 -0.46 0.50 2.07 -1.34 -2.51 116.25 115.88 1wib h VAL 42 Ca 0.05 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.19 1wib h VAL 42 Cb 0.38 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1wib h VAL 42 CO 0.01 0.45 0.28 1.23 0.02 0.00 0.00 177.57 179.56 1wib h GLY 43 N 0.48 0.67 1.16 2.17 0.00 -0.41 -1.41 103.07 105.73 1wib h GLY 43 Ca 0.06 -0.28 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 1wib h GLY 43 CO 0.06 0.27 0.24 -1.80 0.00 0.00 0.00 176.54 175.31 1wib h ASP 44 N 0.62 0.99 -0.46 0.19 1.82 -1.23 -1.78 116.42 116.57 1wib h ASP 44 Ca 0.17 -0.17 -0.07 0.00 -0.39 0.00 0.00 57.03 56.57 1wib h ASP 44 Cb -0.02 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 39.72 1wib h ASP 44 CO -0.03 0.91 0.03 0.44 -1.61 0.00 0.00 179.24 178.97 1wib h ASP 45 N 1.03 0.82 -0.35 2.28 5.19 -1.10 -1.96 116.42 122.32 1wib h ASP 45 Ca 0.23 -0.19 -0.10 0.00 -0.62 0.00 0.00 57.03 56.35 1wib h ASP 45 Cb 0.26 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.54 1wib h ASP 45 CO -0.01 0.86 -0.18 0.40 -3.12 0.00 0.00 179.24 177.20 1wib h ILE 46 N 0.80 1.29 -0.82 0.35 2.04 -0.88 -2.70 117.51 117.59 1wib h ILE 46 Ca 0.16 -1.30 -0.04 0.00 1.00 0.00 0.00 64.86 64.68 1wib h ILE 46 Cb 0.44 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 1wib h ILE 46 CO 0.02 0.43 0.36 0.00 0.00 0.00 0.00 178.15 178.96 1wib h ALA 47 N 0.78 1.06 -0.32 1.87 0.00 -1.17 -1.74 119.26 119.74 1wib h ALA 47 Ca 0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1wib h ALA 47 Cb 0.72 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1wib h ALA 47 CO 0.05 0.65 0.01 -0.22 0.00 0.00 0.00 179.25 179.74 1wib h LYS 48 N 1.17 0.49 -0.01 0.00 1.63 -1.29 -2.33 116.57 116.23 1wib h LYS 48 Ca 0.28 -0.10 -0.16 0.00 -0.85 0.00 0.00 60.65 59.82 1wib h LYS 48 Cb 0.16 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.70 1wib h LYS 48 CO -0.03 0.51 -0.74 0.00 -3.45 0.00 0.00 179.45 175.74 1wib h ALA 49 N 1.54 0.75 -0.33 5.00 0.00 -1.10 -3.05 119.26 122.08 1wib h ALA 49 Ca 0.10 -0.65 -0.09 0.00 0.00 0.00 0.00 54.91 54.27 1wib h ALA 49 Cb 0.29 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 1wib h ALA 49 CO 0.01 0.88 0.11 0.25 0.00 0.00 0.00 179.25 180.50 1wib n THR 50 N -3.71 1.54 0.31 0.00 -2.24 -0.70 -4.10 114.28 105.38 1wib n THR 50 Ca -0.02 -0.72 0.13 0.00 -2.27 0.00 0.00 64.05 61.17 1wib n THR 50 Cb 0.71 -0.54 0.29 0.00 -2.10 0.00 0.00 70.33 68.69 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 3.82 0.00 1.84 3.38 0.00 -1.41 -3.00 103.07 107.70 1wib h GLY 51 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1wib h GLY 51 CO 0.33 0.00 -0.16 -0.55 0.00 0.00 0.00 176.54 176.16 1wib h ASP 52 N 0.00 0.00 -1.38 0.19 3.32 -1.84 -3.34 116.42 113.36 1wib h ASP 52 Ca 0.00 -0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.59 1wib h ASP 52 Cb 0.87 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 40.01 1wib h ASP 52 CO 0.00 0.00 -1.02 -2.67 -1.72 0.00 0.00 179.24 173.83 1wib n TRP 53 N -3.00 1.92 -1.95 4.55 2.14 -1.18 -5.04 117.44 114.88 1wib n TRP 53 Ca 0.03 -3.11 -0.24 0.00 2.07 0.00 0.00 57.50 56.25 1wib n TRP 53 Cb 0.53 -0.30 -0.06 0.00 -0.81 0.00 0.00 31.31 30.67 1wib n TRP 53 CO 0.00 0.00 0.00 0.15 2.07 0.00 0.00 177.69 179.91 1wib s LYS 54 N -3.18 2.35 0.00 -2.67 1.02 -1.14 -1.79 119.74 114.32 1wib s LYS 54 Ca 0.37 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.19 1wib s LYS 54 Cb 0.41 -5.01 0.00 0.00 -0.52 0.00 0.00 37.83 32.71 1wib s LYS 54 CO -0.06 -3.64 0.00 0.41 -0.92 0.00 0.00 175.35 171.14 1wib n GLY 55 N 6.80 1.02 3.93 -3.33 0.00 -0.77 -4.98 105.19 107.86 1wib n GLY 55 Ca 0.42 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.16 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 4.30 -0.24 0.99 1.02 -0.74 -4.63 118.68 119.37 1wib s LEU 56 Ca 0.00 0.30 -0.12 0.00 0.02 0.00 0.00 54.13 54.33 1wib s LEU 56 Cb 0.00 -3.04 -0.05 0.00 0.02 0.00 0.00 46.19 43.12 1wib s LEU 56 CO 0.00 0.04 0.23 -0.13 0.02 0.00 0.00 176.35 176.51 1wib s ARG 57 N -3.11 4.06 0.04 1.70 3.00 -1.26 -0.12 118.95 123.26 1wib s ARG 57 Ca 0.36 -0.16 -0.01 0.00 0.00 0.00 0.00 55.73 55.93 1wib s ARG 57 Cb -0.11 -3.58 -0.04 0.00 0.00 0.00 0.00 34.95 31.22 1wib s ARG 57 CO 0.28 -0.05 -0.03 0.96 0.00 0.00 0.00 175.30 176.47 1wib s ILE 58 N 1.36 0.20 -0.17 1.52 -0.00 -1.26 -4.99 121.20 117.86 1wib s ILE 58 Ca 0.10 -1.60 -0.18 0.00 -0.00 0.00 0.00 60.65 58.97 1wib s ILE 58 Cb -0.14 -1.23 -0.04 0.00 -0.00 0.00 0.00 42.46 41.05 1wib s ILE 58 CO 0.07 -0.88 0.47 -0.89 -0.00 0.00 0.00 174.94 173.71 1wib s THR 59 N -3.34 5.16 -0.12 8.37 2.01 -1.26 -4.56 115.64 121.90 1wib s THR 59 Ca 0.02 0.88 0.00 0.00 0.31 0.00 0.00 61.69 62.90 1wib s THR 59 Cb 0.04 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 1wib s THR 59 CO -0.08 0.25 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.28 1wib s VAL 60 N 1.18 3.08 -0.33 3.82 1.01 -1.26 -2.35 120.40 125.55 1wib s VAL 60 Ca 0.23 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.45 1wib s VAL 60 Cb -0.15 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 1wib s VAL 60 CO 0.09 0.53 0.18 -0.75 0.00 0.00 0.00 175.10 175.16 1wib s LYS 61 N 0.23 3.31 -0.28 2.72 2.20 0.42 -3.92 119.74 124.42 1wib s LYS 61 Ca -0.08 -0.75 -0.06 0.00 -0.36 0.00 0.00 55.97 54.72 1wib s LYS 61 Cb -0.15 -3.65 0.00 0.00 -1.51 0.00 0.00 37.83 32.52 1wib s LYS 61 CO 0.05 -0.46 0.05 -0.51 -0.36 0.00 0.00 175.35 174.12 1wib s LEU 62 N 1.63 3.61 -0.24 5.43 1.43 -0.99 -2.71 118.68 126.84 1wib s LEU 62 Ca 0.05 -0.61 -0.02 0.00 -1.03 0.00 0.00 54.13 52.52 1wib s LEU 62 Cb -0.17 -1.85 0.02 0.00 0.03 0.00 0.00 46.19 44.22 1wib s LEU 62 CO 0.07 -0.14 -0.07 -0.89 0.23 0.00 0.00 176.35 175.56 1wib s THR 63 N 1.50 2.87 -0.25 5.49 2.01 -1.06 -1.63 115.64 124.58 1wib s THR 63 Ca 0.03 -0.99 -0.08 0.00 0.31 0.00 0.00 61.69 60.97 1wib s THR 63 Cb -0.16 -2.44 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 1wib s THR 63 CO 0.01 0.23 0.09 -0.63 -0.69 0.00 0.00 174.62 173.63 1wib s ILE 64 N 1.33 4.58 -0.11 1.82 1.09 -1.16 -2.84 121.20 125.92 1wib s ILE 64 Ca 0.01 -0.08 -0.05 0.00 -1.10 0.00 0.00 60.65 59.42 1wib s ILE 64 Cb -0.16 -3.14 0.05 0.00 -1.06 0.00 0.00 42.46 38.15 1wib s ILE 64 CO -0.05 0.34 0.25 -1.58 -0.10 0.00 0.00 174.94 173.80 1wib s GLN 65 N 1.48 0.19 -0.72 2.79 2.00 -1.08 -4.37 119.66 119.95 1wib s GLN 65 Ca 0.06 0.58 -0.05 0.00 -2.00 0.00 0.00 55.36 53.95 1wib s GLN 65 Cb -0.15 -0.11 0.01 0.00 0.80 0.00 0.00 33.01 33.56 1wib s GLN 65 CO 0.05 -0.19 0.63 -1.71 -0.50 0.00 0.00 175.29 173.57 1wib n ASN 66 N 4.47 -4.33 -1.80 6.67 5.15 -1.26 -2.66 115.26 121.50 1wib n ASN 66 Ca -0.21 -0.29 -0.17 0.00 -0.60 0.00 0.00 54.58 53.31 1wib n ASN 66 Cb 0.52 -2.92 -0.03 0.00 -0.53 0.00 0.00 39.78 36.83 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 -2.90 -1.34 -4.36 1.20 1.74 -1.26 -4.99 116.66 104.74 1wib n ARG 67 Ca 0.00 0.93 -0.24 0.00 -0.77 0.00 0.00 57.85 57.77 1wib n ARG 67 Cb 0.53 -5.33 -0.09 0.00 -1.02 0.00 0.00 32.46 26.55 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 -4.46 2.02 -0.06 5.56 -0.44 -1.09 -5.10 119.66 116.10 1wib s GLN 68 Ca 0.00 -1.51 0.02 0.00 -2.50 0.00 0.00 55.36 51.37 1wib s GLN 68 Cb 0.00 -2.02 0.01 0.00 -1.64 0.00 0.00 33.01 29.37 1wib s GLN 68 CO 0.00 0.37 -0.10 0.00 0.50 0.00 0.00 175.29 176.05 1wib s ALA 69 N -2.26 1.11 -0.06 1.58 0.00 -1.26 -2.62 121.76 118.25 1wib s ALA 69 Ca 0.29 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 51.96 1wib s ALA 69 Cb -0.06 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.54 1wib s ALA 69 CO 0.17 0.09 -0.13 -1.14 0.00 0.00 0.00 175.76 174.75 1wib s GLN 70 N 0.70 1.73 -0.09 0.00 0.74 -1.13 -5.02 119.66 116.59 1wib s GLN 70 Ca -0.14 -0.45 0.02 0.00 0.05 0.00 0.00 55.36 54.84 1wib s GLN 70 Cb -0.15 -1.44 -0.02 0.00 1.10 0.00 0.00 33.01 32.50 1wib s GLN 70 CO 0.03 0.07 -0.16 0.42 -0.55 0.00 0.00 175.29 175.09 1wib s ILE 71 N 0.53 2.80 -0.09 -2.34 1.01 -1.26 -2.55 121.20 119.31 1wib s ILE 71 Ca -0.13 -0.78 -0.16 0.00 0.00 0.00 0.00 60.65 59.59 1wib s ILE 71 Cb -0.15 -2.12 0.04 0.00 0.01 0.00 0.00 42.46 40.24 1wib s ILE 71 CO 0.04 0.56 0.39 -1.83 0.00 0.00 0.00 174.94 174.09 1wib s GLU 72 N -0.09 0.59 -0.14 2.79 4.04 -1.10 -5.02 118.70 119.77 1wib s GLU 72 Ca -0.03 0.25 -0.04 0.00 0.04 0.00 0.00 54.97 55.20 1wib s GLU 72 Cb -0.14 0.27 -0.03 0.00 0.02 0.00 0.00 34.13 34.25 1wib s GLU 72 CO 0.04 -0.12 -0.02 0.08 -1.84 0.00 0.00 175.26 173.40 1wib s VAL 73 N -0.48 4.08 0.36 1.83 1.01 -1.26 -0.44 120.40 125.50 1wib s VAL 73 Ca -0.06 -0.30 -0.21 0.00 0.00 0.00 0.00 61.98 61.41 1wib s VAL 73 Cb -0.04 -2.77 -0.10 0.00 0.00 0.00 0.00 36.38 33.47 1wib s VAL 73 CO 0.03 0.52 0.89 0.68 0.00 0.00 0.00 175.10 177.21 1wib s VAL 74 N 0.07 4.40 0.91 2.92 -7.23 -0.99 -5.00 120.40 115.48 1wib s VAL 74 Ca 0.01 1.48 -0.12 0.00 -1.81 0.00 0.00 61.98 61.54 1wib s VAL 74 Cb -0.13 -3.74 0.14 0.00 0.56 0.00 0.00 36.38 33.21 1wib s VAL 74 CO 0.02 -0.12 1.09 -2.16 -0.31 0.00 0.00 175.10 173.62 1wib s PRO 75 N -2.73 1.16 0.05 4.82 0.04 -1.26 -4.74 135.00 132.34 1wib s PRO 75 Ca 0.56 0.78 -0.10 0.00 0.04 0.00 0.00 61.00 62.28 1wib s PRO 75 Cb -0.13 -1.80 -0.02 0.00 0.04 0.00 0.00 34.50 32.59 1wib s PRO 75 CO 0.17 -2.30 1.03 0.43 0.04 0.00 0.00 177.00 176.37 1wib n SER 76 N -3.92 -0.33 -4.10 6.66 7.64 -1.26 -4.20 113.62 114.12 1wib n SER 76 Ca 0.07 1.10 -0.32 0.00 1.01 0.00 0.00 58.87 60.73 1wib n SER 76 Cb 0.55 -0.35 -0.16 0.00 -1.01 0.00 0.00 64.21 63.24 1wib n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wib s ALA 77 N -4.42 2.18 -0.99 -0.43 0.00 -1.26 -5.05 121.76 111.79 1wib s ALA 77 Ca -0.04 -1.11 -0.03 0.00 0.00 0.00 0.00 51.96 50.79 1wib s ALA 77 Cb 0.03 -1.11 0.28 0.00 0.00 0.00 0.00 23.12 22.33 1wib s ALA 77 CO 0.19 -0.29 1.17 0.43 0.00 0.00 0.00 175.76 177.26 1wib n SER 78 N 4.54 5.44 -4.11 0.00 7.64 -1.26 -4.75 113.62 121.13 1wib n SER 78 Ca -0.20 -3.30 -0.34 0.00 1.01 0.00 0.00 58.87 56.05 1wib n SER 78 Cb 0.50 -1.16 -0.01 0.00 -1.01 0.00 0.00 64.21 62.54 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 1.67 -1.32 -2.39 -0.43 0.00 -1.26 -4.84 120.51 111.94 1wib n ALA 79 Ca 0.26 0.04 -0.39 0.00 0.00 0.00 0.00 53.44 53.34 1wib n ALA 79 Cb 0.36 -3.67 -0.03 0.00 0.00 0.00 0.00 19.45 16.11 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 -7.25 3.25 -0.03 0.00 1.43 -1.26 -4.98 118.68 109.83 1wib s LEU 80 Ca 0.67 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.34 1wib s LEU 80 Cb -0.35 -2.55 -0.03 0.00 0.03 0.00 0.00 46.19 43.28 1wib s LEU 80 CO 0.89 -1.99 -0.06 -0.55 0.23 0.00 0.00 176.35 174.88 1wib s SER 81 N 5.33 4.67 0.00 2.29 0.15 -1.26 -5.06 113.70 119.81 1wib s SER 81 Ca 0.47 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.05 1wib s SER 81 Cb -0.08 -1.14 0.00 0.00 -1.71 0.00 0.00 66.02 63.09 1wib s SER 81 CO 0.11 0.32 0.00 0.61 1.20 0.00 0.00 173.24 175.48 1wib n GLY 82 N 1.89 0.73 3.74 9.45 0.00 -1.26 -5.13 105.19 114.62 1wib n GLY 82 Ca -0.17 -1.90 -0.30 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.15 1.80 0.02 1.61 0.04 -1.26 -4.97 135.00 131.09 1wib s PRO 83 Ca 0.00 1.01 -0.30 0.00 0.04 0.00 0.00 61.00 61.75 1wib s PRO 83 Cb 0.00 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.63 1wib s PRO 83 CO 0.00 -1.92 1.40 -1.12 0.04 0.00 0.00 177.00 175.40 1wib s SER 84 N -3.40 6.85 -1.66 6.66 0.01 -1.26 -3.31 113.70 117.59 1wib s SER 84 Ca 0.62 2.14 -0.18 0.00 1.31 0.00 0.00 55.95 59.84 1wib s SER 84 Cb -0.18 -2.56 0.18 0.00 0.21 0.00 0.00 66.02 63.67 1wib s SER 84 CO 0.56 -0.71 0.45 -1.54 0.41 0.00 0.00 173.24 172.42 1wib n SER 85 N 5.17 -1.22 -0.18 2.44 3.41 -1.26 -5.32 113.62 116.65 1wib n SER 85 Ca 0.13 -1.14 0.15 0.00 -0.26 0.00 0.00 58.87 57.75 1wib n SER 85 Cb 0.43 -1.45 0.79 0.00 -0.26 0.00 0.00 64.21 63.73 1wib n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49