#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 -1.23 -4.26 1.61 2.88 -1.26 -4.91 113.62 106.45 1wib n SER -5 Ca 0.00 -1.18 -0.33 0.00 -1.33 0.00 0.00 58.87 56.02 1wib n SER -5 Cb 0.00 -1.98 -0.15 0.00 -0.75 0.00 0.00 64.21 61.32 1wib n SER -5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wib s SER -4 N -3.68 3.64 0.00 -3.46 0.01 -1.26 -5.08 113.70 103.87 1wib s SER -4 Ca 0.51 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.29 1wib s SER -4 Cb -0.29 -1.56 0.00 0.00 0.21 0.00 0.00 66.02 64.38 1wib s SER -4 CO 0.99 0.09 0.00 0.61 0.41 0.00 0.00 173.24 175.33 1wib n GLY -3 N 4.05 1.36 3.12 3.44 0.00 -1.26 -5.18 105.19 110.71 1wib n GLY -3 Ca -0.19 0.33 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 1wib n GLY -3 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wib s SER -2 N 0.00 0.83 0.07 1.61 1.04 -1.26 -5.17 113.70 110.83 1wib s SER -2 Ca 0.00 -0.92 0.08 0.00 0.48 0.00 0.00 55.95 55.59 1wib s SER -2 Cb 0.00 0.12 -0.03 0.00 0.10 0.00 0.00 66.02 66.21 1wib s SER -2 CO 0.00 -0.47 -0.22 -0.94 0.98 0.00 0.00 173.24 172.59 1wib s SER -1 N -2.72 2.63 0.34 7.02 1.04 -1.26 -5.06 113.70 115.69 1wib s SER -1 Ca 0.06 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.88 1wib s SER -1 Cb 0.03 -0.19 0.00 0.00 0.10 0.00 0.00 66.02 65.96 1wib s SER -1 CO -0.06 0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.91 1wib n GLY 1 N 1.49 -3.73 3.77 7.32 0.00 -1.26 -4.92 105.19 107.87 1wib n GLY 1 Ca -0.18 -0.97 -0.35 0.00 0.00 0.00 0.00 46.02 44.51 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 -4.75 3.44 -0.68 1.61 0.04 -1.26 -4.93 135.00 128.47 1wib s PRO 2 Ca 0.00 1.64 -0.26 0.00 0.04 0.00 0.00 61.00 62.42 1wib s PRO 2 Cb 0.00 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 1wib s PRO 2 CO 0.00 -0.78 1.88 -1.25 0.04 0.00 0.00 177.00 176.89 1wib s PRO 3 N -3.16 2.61 1.05 0.56 0.04 -1.26 -4.97 135.00 129.86 1wib s PRO 3 Ca 0.71 0.41 -0.15 0.00 0.04 0.00 0.00 61.00 62.01 1wib s PRO 3 Cb -0.25 -4.54 0.12 0.00 0.04 0.00 0.00 34.50 29.88 1wib s PRO 3 CO 0.28 -2.88 0.46 1.63 0.04 0.00 0.00 177.00 176.54 1wib n LYS 4 N 9.12 -1.19 -0.01 4.56 5.02 -1.26 -4.95 118.16 129.44 1wib n LYS 4 Ca 0.25 -0.31 -0.12 0.00 -2.02 0.00 0.00 58.31 56.11 1wib n LYS 4 Cb 0.51 -1.92 -0.10 0.00 -0.02 0.00 0.00 35.03 33.50 1wib n LYS 4 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1wib h PHE 5 N -2.00 -0.07 -1.29 2.13 0.04 -1.97 -3.48 116.94 110.30 1wib h PHE 5 Ca -0.50 -0.00 0.15 0.00 2.80 0.00 0.00 57.97 60.41 1wib h PHE 5 Cb 1.32 0.02 -0.29 0.00 2.20 0.00 0.00 35.95 39.20 1wib h PHE 5 CO 0.29 0.54 0.72 0.16 -0.60 0.00 0.00 178.31 179.42 1wib s ASP 6 N -5.78 -0.21 0.52 2.17 -4.77 -1.26 -5.03 116.67 102.31 1wib s ASP 6 Ca -0.15 0.36 0.30 0.00 -3.30 0.00 0.00 52.55 49.76 1wib s ASP 6 Cb -0.00 0.34 1.26 0.00 -1.09 0.00 0.00 42.92 43.43 1wib s ASP 6 CO 0.57 -0.11 1.95 1.55 0.70 0.00 0.00 175.17 179.84 1wib h PRO 7 N 3.18 0.00 -0.92 2.11 0.13 -2.02 -3.30 132.00 131.18 1wib h PRO 7 Ca -0.23 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.01 1wib h PRO 7 Cb 1.18 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.19 1wib h PRO 7 CO 0.18 0.09 -0.47 0.09 -0.23 0.00 0.00 178.00 177.66 1wib n ASN 8 N -3.25 -0.83 -4.01 1.44 4.13 -1.26 -3.77 115.26 107.71 1wib n ASN 8 Ca 0.00 1.63 -0.31 0.00 1.68 0.00 0.00 54.58 57.57 1wib n ASN 8 Cb 0.33 -0.27 -0.15 0.00 -1.54 0.00 0.00 39.78 38.15 1wib n ASN 8 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1wib s GLU 9 N -5.61 1.78 -0.06 3.52 2.12 -1.24 -5.09 118.70 114.12 1wib s GLU 9 Ca -0.12 -1.43 -0.02 0.00 0.36 0.00 0.00 54.97 53.76 1wib s GLU 9 Cb 0.13 -2.88 0.04 0.00 0.26 0.00 0.00 34.13 31.68 1wib s GLU 9 CO 0.60 -0.72 0.12 0.08 -0.54 0.00 0.00 175.26 174.80 1wib s VAL 10 N 1.13 -0.08 -0.06 3.70 1.01 -1.25 -4.88 120.40 119.97 1wib s VAL 10 Ca -0.01 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.22 1wib s VAL 10 Cb -0.19 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 35.99 1wib s VAL 10 CO -0.07 0.09 -0.16 -0.75 0.00 0.00 0.00 175.10 174.20 1wib s LYS 11 N 1.30 1.98 -0.04 2.72 2.47 -1.26 -5.13 119.74 121.79 1wib s LYS 11 Ca -0.07 -0.58 0.07 0.00 -1.56 0.00 0.00 55.97 53.82 1wib s LYS 11 Cb -0.12 -1.63 -0.02 0.00 -1.46 0.00 0.00 37.83 34.60 1wib s LYS 11 CO -0.05 0.14 -0.24 0.08 0.16 0.00 0.00 175.35 175.45 1wib s VAL 12 N 0.35 2.23 -0.07 4.02 1.01 -1.26 -3.57 120.40 123.10 1wib s VAL 12 Ca -0.11 -1.03 0.05 0.00 0.00 0.00 0.00 61.98 60.89 1wib s VAL 12 Cb -0.14 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 1wib s VAL 12 CO 0.04 0.58 -0.22 -0.69 0.00 0.00 0.00 175.10 174.81 1wib s VAL 13 N -0.48 2.37 -0.04 2.92 1.01 -0.09 -4.95 120.40 121.13 1wib s VAL 13 Ca 0.06 -0.95 0.07 0.00 0.00 0.00 0.00 61.98 61.15 1wib s VAL 13 Cb -0.11 -1.89 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 1wib s VAL 13 CO 0.01 0.57 -0.25 -0.31 0.00 0.00 0.00 175.10 175.12 1wib s TYR 14 N -0.20 2.30 -0.08 5.22 2.02 -1.26 -0.10 117.35 125.25 1wib s TYR 14 Ca -0.02 -0.57 -0.09 0.00 -0.37 0.00 0.00 57.07 56.02 1wib s TYR 14 Cb -0.13 -1.50 0.02 0.00 -0.40 0.00 0.00 41.96 39.95 1wib s TYR 14 CO 0.03 -0.13 0.25 -0.51 -1.57 0.00 0.00 175.55 173.62 1wib s LEU 15 N -0.35 1.05 -0.26 -1.29 1.43 -1.22 -5.05 118.68 112.99 1wib s LEU 15 Ca 0.03 0.43 -0.14 0.00 -1.03 0.00 0.00 54.13 53.42 1wib s LEU 15 Cb -0.12 0.89 -0.04 0.00 0.03 0.00 0.00 46.19 46.95 1wib s LEU 15 CO 0.01 -0.13 0.32 -0.60 0.23 0.00 0.00 176.35 176.18 1wib s ARG 16 N -0.07 4.02 0.19 1.70 3.00 -1.26 -3.90 118.95 122.63 1wib s ARG 16 Ca -0.02 -0.04 -0.19 0.00 -1.00 0.00 0.00 55.73 54.48 1wib s ARG 16 Cb -0.02 -3.64 0.04 0.00 0.00 0.00 0.00 34.95 31.32 1wib s ARG 16 CO 0.01 -0.21 0.55 0.00 0.00 0.00 0.00 175.30 175.65 1wib s THR 18 N -3.85 4.40 0.92 0.00 2.01 -1.26 -4.45 115.64 113.41 1wib s THR 18 Ca 0.08 1.65 -0.12 0.00 0.31 0.00 0.00 61.69 63.61 1wib s THR 18 Cb -0.01 -4.10 0.14 0.00 0.01 0.00 0.00 72.50 68.53 1wib s THR 18 CO -0.04 0.50 1.10 -0.83 -0.69 0.00 0.00 174.62 174.65 1wib s GLY 19 N -1.19 1.60 -1.31 4.40 0.00 -1.26 -3.65 107.32 105.91 1wib s GLY 19 Ca 0.36 -0.21 -0.12 0.00 0.00 0.00 0.00 44.72 44.75 1wib s GLY 19 CO 0.25 0.32 0.30 0.61 0.00 0.00 0.00 173.10 174.58 1wib n GLY 20 N -1.31 -0.23 3.58 0.20 0.00 -1.20 -4.23 105.19 102.00 1wib n GLY 20 Ca 0.06 0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 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 -5.81 3.91 -0.09 1.61 4.04 -1.24 -4.90 118.70 116.22 1wib s GLU 21 Ca 0.42 -0.35 0.02 0.00 0.04 0.00 0.00 54.97 55.09 1wib s GLU 21 Cb -0.25 -3.44 0.01 0.00 0.02 0.00 0.00 34.13 30.48 1wib s GLU 21 CO 0.75 -0.01 -0.14 0.54 -1.84 0.00 0.00 175.26 174.56 1wib s VAL 22 N 1.21 1.33 0.00 1.83 0.11 -1.26 -4.91 120.40 118.71 1wib s VAL 22 Ca 0.06 -0.56 0.00 0.00 -2.93 0.00 0.00 61.98 58.55 1wib s VAL 22 Cb -0.14 -1.22 0.00 0.00 -1.53 0.00 0.00 36.38 33.48 1wib s VAL 22 CO 0.05 0.41 0.00 0.61 -3.33 0.00 0.00 175.10 172.83 1wib n GLY 23 N 4.11 1.74 3.21 6.54 0.00 -1.26 -5.13 105.19 114.41 1wib n GLY 23 Ca -0.20 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 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 -1.00 3.06 -0.09 4.61 0.00 -1.26 -5.06 121.76 122.02 1wib s ALA 24 Ca 0.00 -2.01 -0.30 0.00 0.00 0.00 0.00 51.96 49.65 1wib s ALA 24 Cb 0.00 -2.29 0.11 0.00 0.00 0.00 0.00 23.12 20.94 1wib s ALA 24 CO 0.00 -1.49 0.92 -0.08 0.00 0.00 0.00 175.76 175.12 1wib s THR 25 N 1.31 0.00 -0.35 0.00 -1.32 -1.26 -5.13 115.64 108.89 1wib s THR 25 Ca 0.01 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.51 1wib s THR 25 Cb -0.21 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 69.88 1wib s THR 25 CO 0.00 0.00 0.07 -0.44 -2.21 0.00 0.00 174.62 172.04 1wib s SER 26 N -1.64 4.83 0.00 8.08 0.01 -1.26 -4.89 113.70 118.84 1wib s SER 26 Ca -0.00 -2.10 0.00 0.00 1.31 0.00 0.00 55.95 55.16 1wib s SER 26 Cb -0.01 -1.66 0.00 0.00 0.21 0.00 0.00 66.02 64.57 1wib s SER 26 CO -0.02 -0.40 0.00 0.00 0.41 0.00 0.00 173.24 173.24 1wib n ALA 27 N 4.32 2.76 0.18 1.44 0.00 -1.26 -4.77 120.51 123.18 1wib n ALA 27 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.52 1wib n ALA 27 Cb 0.42 0.38 0.22 0.00 0.00 0.00 0.00 19.45 20.47 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 -0.27 0.00 3.38 -1.96 -3.28 115.31 113.18 1wib h LEU 28 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1wib h LEU 28 Cb 0.77 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.44 1wib h LEU 28 CO 0.00 0.34 -0.45 0.00 0.09 0.00 0.00 178.44 178.42 1wib h ALA 29 N 1.66 -0.58 0.00 1.53 0.00 -1.94 0.17 119.26 120.10 1wib h ALA 29 Ca -0.00 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1wib h ALA 29 Cb 1.08 0.89 -0.00 0.00 0.00 0.00 0.00 17.79 19.75 1wib h ALA 29 CO 0.04 -0.93 -0.13 -1.00 0.00 0.00 0.00 179.25 177.23 1wib h PRO 30 N -0.43 0.00 -0.12 0.00 0.13 -1.89 -0.05 132.00 129.64 1wib h PRO 30 Ca 0.10 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.11 1wib h PRO 30 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.75 1wib h PRO 30 CO -0.49 0.13 -0.36 0.87 -0.23 0.00 0.00 178.00 177.92 1wib h LYS 31 N 0.00 0.45 0.00 0.86 1.79 -1.13 -3.22 116.57 115.32 1wib h LYS 31 Ca -0.00 -0.33 0.00 0.00 -2.18 0.00 0.00 60.65 58.14 1wib h LYS 31 Cb 0.59 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 -0.48 -0.89 -1.08 0.00 0.00 179.45 177.97 1wib n ILE 32 N -4.35 0.11 -0.36 1.86 5.41 0.40 -4.38 119.36 118.05 1wib n ILE 32 Ca -0.07 -0.08 -0.09 0.00 1.00 0.00 0.00 62.75 63.50 1wib n ILE 32 Cb 0.51 0.04 -0.08 0.00 -0.71 0.00 0.00 39.64 39.40 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 1.45 -2.52 0.16 7.39 0.00 -0.04 -0.26 105.19 111.37 1wib n GLY 33 Ca 0.05 1.07 0.00 0.00 0.00 0.00 0.00 46.02 47.14 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 0.01 0.10 1.61 0.13 -1.78 -3.32 132.00 128.76 1wib h PRO 34 Ca 0.14 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1wib h PRO 34 Cb 0.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.48 1wib h PRO 34 CO -0.80 0.50 -0.05 -0.07 -0.23 0.00 0.00 178.00 177.36 1wib h LEU 35 N 0.01 -0.12 0.00 1.56 4.07 -0.84 -3.49 115.31 116.51 1wib h LEU 35 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1wib h LEU 35 Cb 0.87 0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.64 1wib h LEU 35 CO 0.06 -0.08 0.00 0.61 -1.08 0.00 0.00 178.44 177.95 1wib n GLY 36 N -1.05 2.99 3.28 0.83 0.00 -0.14 -5.12 105.19 105.99 1wib n GLY 36 Ca -0.02 -0.42 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.07 -4.84 0.99 4.32 -1.26 -4.97 117.00 109.16 1wib n LEU 37 Ca 0.00 -0.22 -0.35 0.00 -0.02 0.00 0.00 56.01 55.42 1wib n LEU 37 Cb 0.00 -1.00 -0.06 0.00 -1.62 0.00 0.00 43.42 40.74 1wib n LEU 37 CO 0.00 -3.24 -0.20 -0.94 -1.22 0.00 0.00 177.39 171.78 1wib s SER 38 N -2.03 6.06 0.38 -1.43 1.04 -1.26 -4.75 113.70 111.71 1wib s SER 38 Ca 0.58 0.32 0.17 0.00 0.48 0.00 0.00 55.95 57.50 1wib s SER 38 Cb -0.14 -1.87 0.76 0.00 0.10 0.00 0.00 66.02 64.87 1wib s SER 38 CO 0.63 0.34 1.79 1.55 0.98 0.00 0.00 173.24 178.53 1wib h PRO 39 N 4.52 0.00 0.03 4.02 0.13 -1.91 -2.79 132.00 136.01 1wib h PRO 39 Ca -0.52 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.61 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 0.61 0.37 -0.02 0.87 -0.23 0.00 0.00 178.00 179.61 1wib h LYS 40 N 0.00 -0.04 -0.35 0.86 6.56 -1.97 0.23 116.57 121.86 1wib h LYS 40 Ca -0.00 0.00 0.02 0.00 -1.06 0.00 0.00 60.65 59.61 1wib h LYS 40 Cb 0.77 0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 32.42 1wib h LYS 40 CO 0.05 0.45 0.19 -0.22 -2.06 0.00 0.00 179.45 177.86 1wib h LYS 41 N -0.57 0.38 -0.18 3.15 1.63 -1.98 0.25 116.57 119.25 1wib h LYS 41 Ca -0.00 -0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.71 1wib h LYS 41 Cb 0.52 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.06 1wib h LYS 41 CO 0.01 0.25 -0.13 0.28 -3.45 0.00 0.00 179.45 176.41 1wib h VAL 42 N 0.39 1.32 -0.77 2.00 2.07 -1.55 -2.77 116.25 116.94 1wib h VAL 42 Ca 0.14 -1.24 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 1wib h VAL 42 Cb 0.02 1.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 1wib h VAL 42 CO -0.08 0.37 0.43 1.23 0.02 0.00 0.00 177.57 179.54 1wib h GLY 43 N 0.06 1.15 1.11 2.17 0.00 -0.36 -1.53 103.07 105.68 1wib h GLY 43 Ca 0.03 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 1wib h GLY 43 CO 0.03 0.49 0.47 -1.80 0.00 0.00 0.00 176.54 175.74 1wib h ASP 44 N 1.07 1.04 -0.12 0.19 3.58 -0.51 -1.45 116.42 120.21 1wib h ASP 44 Ca 0.27 -0.08 -0.13 0.00 0.42 0.00 0.00 57.03 57.50 1wib h ASP 44 Cb 0.02 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.80 1wib h ASP 44 CO -0.04 0.83 -0.38 -0.78 -2.88 0.00 0.00 179.24 175.98 1wib h ASP 45 N 1.17 0.68 -0.15 2.28 3.58 -1.16 -2.68 116.42 120.14 1wib h ASP 45 Ca 0.30 -0.30 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 1wib h ASP 45 Cb 0.01 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 40.87 1wib h ASP 45 CO -0.05 0.99 0.02 0.40 -2.88 0.00 0.00 179.24 177.72 1wib h ILE 46 N 0.53 1.23 -0.47 2.25 2.04 -0.77 0.63 117.51 122.95 1wib h ILE 46 Ca 0.05 -0.74 0.03 0.00 1.00 0.00 0.00 64.86 65.20 1wib h ILE 46 Cb 0.89 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 38.37 1wib h ILE 46 CO 0.08 0.22 0.25 0.00 0.00 0.00 0.00 178.15 178.70 1wib h ALA 47 N 0.80 0.60 -0.47 1.87 0.00 -1.27 0.25 119.26 121.03 1wib h ALA 47 Ca 0.04 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1wib h ALA 47 Cb 0.32 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1wib h ALA 47 CO 0.00 -0.09 -0.21 -0.22 0.00 0.00 0.00 179.25 178.74 1wib h LYS 48 N 0.50 0.96 -0.61 0.00 3.64 -1.42 -1.04 116.57 118.60 1wib h LYS 48 Ca 0.20 -0.40 -0.02 0.00 -1.27 0.00 0.00 60.65 59.15 1wib h LYS 48 Cb 0.09 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1wib h LYS 48 CO -0.13 1.07 0.29 0.00 -2.27 0.00 0.00 179.45 178.41 1wib h ALA 49 N 0.92 0.79 -0.44 5.00 0.00 -0.39 -2.19 119.26 122.96 1wib h ALA 49 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1wib h ALA 49 Cb 0.78 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1wib h ALA 49 CO 0.06 0.36 0.00 0.25 0.00 0.00 0.00 179.25 179.93 1wib n THR 50 N -4.50 1.29 -0.19 0.00 -2.24 0.03 -4.46 114.28 104.21 1wib n THR 50 Ca 0.04 -0.81 -0.00 0.00 -2.27 0.00 0.00 64.05 61.01 1wib n THR 50 Cb 0.13 -0.03 0.09 0.00 -2.10 0.00 0.00 70.33 68.42 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 4.62 0.64 2.00 3.38 0.00 -0.51 0.45 103.07 113.66 1wib h GLY 51 Ca 0.00 0.04 -0.09 0.00 0.00 0.00 0.00 47.33 47.28 1wib h GLY 51 CO 0.17 -0.16 -0.45 -0.55 0.00 0.00 0.00 176.54 175.56 1wib h ASP 52 N 0.16 0.00 -0.23 0.19 5.19 -1.81 -2.85 116.42 117.07 1wib h ASP 52 Ca 0.30 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.63 1wib h ASP 52 Cb 0.46 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.93 1wib h ASP 52 CO -0.46 0.45 0.10 0.79 -3.12 0.00 0.00 179.24 177.00 1wib n TRP 53 N -3.70 0.74 -1.96 4.55 8.01 0.12 -4.91 117.44 120.29 1wib n TRP 53 Ca -0.01 -0.55 -0.42 0.00 -1.31 0.00 0.00 57.50 55.21 1wib n TRP 53 Cb 0.52 -0.34 -0.03 0.00 -2.01 0.00 0.00 31.31 29.46 1wib n TRP 53 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.69 175.09 1wib s LYS 54 N -1.21 4.20 0.00 -0.99 0.00 -1.01 -1.81 119.74 118.92 1wib s LYS 54 Ca 0.16 2.28 0.00 0.00 0.00 0.00 0.00 55.97 58.41 1wib s LYS 54 Cb 0.13 -3.65 0.00 0.00 0.00 0.00 0.00 37.83 34.31 1wib s LYS 54 CO 0.04 -0.73 0.00 0.41 0.00 0.00 0.00 175.35 175.06 1wib n GLY 55 N 3.98 1.97 3.74 0.59 0.00 -1.26 -5.01 105.19 109.21 1wib n GLY 55 Ca 0.16 0.00 -0.35 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 4.22 -0.21 0.99 1.43 -0.75 -4.99 118.68 119.37 1wib s LEU 56 Ca 0.00 0.28 -0.28 0.00 -1.03 0.00 0.00 54.13 53.10 1wib s LEU 56 Cb 0.00 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 44.09 1wib s LEU 56 CO 0.00 0.18 1.00 -0.13 0.23 0.00 0.00 176.35 177.62 1wib s ARG 57 N 0.31 4.27 0.06 1.70 1.81 -1.26 -4.01 118.95 121.83 1wib s ARG 57 Ca 0.10 1.29 -0.05 0.00 -1.72 0.00 0.00 55.73 55.34 1wib s ARG 57 Cb -0.11 -3.63 -0.02 0.00 -0.45 0.00 0.00 34.95 30.74 1wib s ARG 57 CO -0.01 -0.56 0.08 0.96 -0.68 0.00 0.00 175.30 175.09 1wib s ILE 58 N 2.95 0.17 -0.17 1.52 -5.25 -1.26 -5.09 121.20 114.06 1wib s ILE 58 Ca 0.43 -1.38 -0.13 0.00 -0.99 0.00 0.00 60.65 58.58 1wib s ILE 58 Cb -0.16 -1.26 -0.05 0.00 2.95 0.00 0.00 42.46 43.95 1wib s ILE 58 CO 0.08 -0.76 0.24 -0.89 -1.79 0.00 0.00 174.94 171.82 1wib s THR 59 N -3.48 5.34 -0.15 8.37 2.01 -1.26 -4.51 115.64 121.95 1wib s THR 59 Ca 0.02 0.44 -0.02 0.00 0.31 0.00 0.00 61.69 62.44 1wib s THR 59 Cb 0.04 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 68.95 1wib s THR 59 CO -0.09 0.40 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.48 1wib s VAL 60 N 0.45 3.51 -0.24 3.82 1.01 -1.25 -3.40 120.40 124.30 1wib s VAL 60 Ca 0.14 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 1wib s VAL 60 Cb -0.12 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1wib s VAL 60 CO 0.02 0.50 0.07 -1.59 0.00 0.00 0.00 175.10 174.09 1wib s LYS 61 N 0.50 3.70 -0.35 2.72 -2.85 -1.21 -3.41 119.74 118.85 1wib s LYS 61 Ca -0.06 -0.46 -0.13 0.00 -1.00 0.00 0.00 55.97 54.33 1wib s LYS 61 Cb -0.15 -3.30 -0.01 0.00 -2.06 0.00 0.00 37.83 32.30 1wib s LYS 61 CO 0.03 -0.11 0.25 -0.51 0.10 0.00 0.00 175.35 175.11 1wib s LEU 62 N 1.41 4.57 -0.29 2.77 1.43 0.85 -3.97 118.68 125.47 1wib s LEU 62 Ca 0.05 -0.46 -0.06 0.00 -1.03 0.00 0.00 54.13 52.64 1wib s LEU 62 Cb -0.15 -2.15 0.01 0.00 0.03 0.00 0.00 46.19 43.93 1wib s LEU 62 CO 0.04 -0.26 0.06 -0.89 0.23 0.00 0.00 176.35 175.52 1wib s THR 63 N 1.73 3.80 -0.23 5.49 2.01 -1.23 -0.92 115.64 126.30 1wib s THR 63 Ca 0.06 -0.72 -0.08 0.00 0.31 0.00 0.00 61.69 61.26 1wib s THR 63 Cb -0.17 -2.95 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 1wib s THR 63 CO 0.11 0.11 0.10 -0.63 -0.69 0.00 0.00 174.62 173.61 1wib s ILE 64 N 1.48 4.72 -0.12 1.82 -1.09 -1.23 -3.42 121.20 123.35 1wib s ILE 64 Ca 0.02 -0.04 -0.05 0.00 -2.23 0.00 0.00 60.65 58.35 1wib s ILE 64 Cb -0.17 -3.19 0.06 0.00 -1.58 0.00 0.00 42.46 37.58 1wib s ILE 64 CO 0.01 0.36 0.25 -1.58 -1.23 0.00 0.00 174.94 172.76 1wib s GLN 65 N 1.19 0.16 -0.94 2.79 0.74 -1.13 -4.49 119.66 117.97 1wib s GLN 65 Ca 0.05 0.67 -0.05 0.00 0.05 0.00 0.00 55.36 56.08 1wib s GLN 65 Cb -0.14 -0.07 0.01 0.00 1.10 0.00 0.00 33.01 33.90 1wib s GLN 65 CO 0.04 -0.25 0.82 -1.71 -0.55 0.00 0.00 175.29 173.64 1wib n ASN 66 N 4.99 -4.57 -3.30 6.67 5.15 -1.26 -2.65 115.26 120.28 1wib n ASN 66 Ca -0.12 -0.39 -0.23 0.00 -0.60 0.00 0.00 54.58 53.23 1wib n ASN 66 Cb 0.51 -3.73 0.06 0.00 -0.53 0.00 0.00 39.78 36.08 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 -3.62 -6.37 -4.34 1.20 1.74 -1.26 -5.00 116.66 99.02 1wib n ARG 67 Ca -0.03 0.87 -0.23 0.00 -0.77 0.00 0.00 57.85 57.69 1wib n ARG 67 Cb 0.56 -5.83 -0.11 0.00 -1.02 0.00 0.00 32.46 26.05 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 -6.01 1.28 -0.04 5.56 -1.52 -1.09 -5.00 119.66 112.86 1wib s GLN 68 Ca 0.44 -1.39 0.06 0.00 -1.95 0.00 0.00 55.36 52.52 1wib s GLN 68 Cb -0.20 -1.40 -0.01 0.00 -0.22 0.00 0.00 33.01 31.19 1wib s GLN 68 CO 0.55 0.29 -0.21 0.00 -0.25 0.00 0.00 175.29 175.66 1wib s ALA 69 N -1.90 1.83 0.01 6.09 0.00 -1.26 -2.85 121.76 123.68 1wib s ALA 69 Ca 0.15 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.21 1wib s ALA 69 Cb -0.06 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 1wib s ALA 69 CO 0.07 0.39 -0.02 -1.14 0.00 0.00 0.00 175.76 175.06 1wib s GLN 70 N -0.27 0.17 -0.06 0.00 0.74 -1.22 -5.05 119.66 113.97 1wib s GLN 70 Ca 0.02 -0.26 0.04 0.00 0.05 0.00 0.00 55.36 55.21 1wib s GLN 70 Cb -0.11 -0.01 -0.00 0.00 1.10 0.00 0.00 33.01 33.99 1wib s GLN 70 CO 0.01 -0.01 -0.19 0.96 -0.55 0.00 0.00 175.29 175.52 1wib s ILE 71 N -0.58 1.62 -0.02 -2.34 -4.36 -1.26 -3.50 121.20 110.77 1wib s ILE 71 Ca -0.06 -0.80 -0.17 0.00 -0.26 0.00 0.00 60.65 59.37 1wib s ILE 71 Cb -0.04 -1.40 0.03 0.00 1.25 0.00 0.00 42.46 42.30 1wib s ILE 71 CO -0.00 0.46 0.36 -0.70 0.24 0.00 0.00 174.94 175.30 1wib s GLU 72 N 0.20 0.73 -0.11 0.37 2.56 -1.25 -5.08 118.70 116.12 1wib s GLU 72 Ca -0.10 -0.14 -0.15 0.00 0.00 0.00 0.00 54.97 54.58 1wib s GLU 72 Cb -0.14 0.33 -0.05 0.00 2.00 0.00 0.00 34.13 36.27 1wib s GLU 72 CO 0.04 -0.21 0.38 0.08 -0.56 0.00 0.00 175.26 174.99 1wib s VAL 73 N -1.35 5.21 0.32 3.70 1.01 -1.26 -3.34 120.40 124.69 1wib s VAL 73 Ca -0.13 0.74 -0.17 0.00 0.00 0.00 0.00 61.98 62.42 1wib s VAL 73 Cb -0.04 -3.70 -0.09 0.00 0.00 0.00 0.00 36.38 32.54 1wib s VAL 73 CO 0.05 0.42 0.77 0.68 0.00 0.00 0.00 175.10 177.03 1wib s VAL 74 N 0.08 4.60 0.02 2.92 -7.23 -1.22 -5.02 120.40 114.55 1wib s VAL 74 Ca 0.21 1.12 -0.30 0.00 -1.81 0.00 0.00 61.98 61.20 1wib s VAL 74 Cb -0.15 -3.66 -0.06 0.00 0.56 0.00 0.00 36.38 33.07 1wib s VAL 74 CO 0.08 -0.13 1.43 -2.16 -0.31 0.00 0.00 175.10 174.01 1wib s PRO 75 N -2.82 4.27 -0.49 4.82 0.04 -1.26 -4.86 135.00 134.71 1wib s PRO 75 Ca 0.53 2.02 0.01 0.00 0.04 0.00 0.00 61.00 63.60 1wib s PRO 75 Cb -0.11 -3.56 0.50 0.00 0.04 0.00 0.00 34.50 31.37 1wib s PRO 75 CO 0.17 -0.59 1.92 0.45 0.04 0.00 0.00 177.00 178.99 1wib n SER 76 N 5.31 5.47 -0.05 6.66 2.88 -1.26 -4.48 113.62 128.15 1wib n SER 76 Ca 0.13 -3.51 -0.16 0.00 -1.33 0.00 0.00 58.87 54.00 1wib n SER 76 Cb 0.43 -0.89 -0.06 0.00 -0.75 0.00 0.00 64.21 62.94 1wib n SER 76 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wib h ALA 77 N 1.48 0.35 -2.93 -1.46 0.00 -2.03 -3.48 119.26 111.20 1wib h ALA 77 Ca 0.55 -0.54 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1wib h ALA 77 Cb 1.78 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 19.45 1wib h ALA 77 CO 1.18 0.61 0.10 -1.54 0.00 0.00 0.00 179.25 179.60 1wib s SER 78 N -6.95 -0.24 -0.72 0.00 1.04 -1.26 -5.08 113.70 100.49 1wib s SER 78 Ca -0.11 -0.61 -0.25 0.00 0.48 0.00 0.00 55.95 55.46 1wib s SER 78 Cb 0.09 0.65 -0.14 0.00 0.10 0.00 0.00 66.02 66.72 1wib s SER 78 CO 0.88 -1.21 2.41 0.00 0.98 0.00 0.00 173.24 176.31 1wib n ALA 79 N -0.41 0.54 -3.79 5.32 0.00 -1.26 -4.85 120.51 116.07 1wib n ALA 79 Ca -0.06 -1.15 -0.32 0.00 0.00 0.00 0.00 53.44 51.91 1wib n ALA 79 Cb 0.61 -3.14 -0.10 0.00 0.00 0.00 0.00 19.45 16.82 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 12.56 5.10 -0.15 0.00 1.43 -1.26 -5.06 118.68 131.29 1wib s LEU 80 Ca 1.00 -3.62 -0.03 0.00 -1.03 0.00 0.00 54.13 50.45 1wib s LEU 80 Cb -0.26 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 1wib s LEU 80 CO 0.20 -0.17 -0.06 -0.55 0.23 0.00 0.00 176.35 176.00 1wib s SER 81 N -0.62 4.61 -0.12 2.29 0.15 -1.26 -4.80 113.70 113.94 1wib s SER 81 Ca 0.24 -0.18 -0.04 0.00 0.70 0.00 0.00 55.95 56.67 1wib s SER 81 Cb -0.09 -1.74 0.01 0.00 -1.71 0.00 0.00 66.02 62.48 1wib s SER 81 CO -0.12 0.17 0.16 0.61 1.20 0.00 0.00 173.24 175.26 1wib n GLY 82 N 3.53 -1.17 0.13 9.45 0.00 -1.26 -4.92 105.19 110.94 1wib n GLY 82 Ca -0.18 0.26 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1wib n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wib n PRO 83 N -0.36 0.19 -2.51 1.61 -0.04 -1.26 -4.43 135.00 128.20 1wib n PRO 83 Ca 0.03 0.42 -0.40 0.00 -0.04 0.00 0.00 63.50 63.51 1wib n PRO 83 Cb 0.12 -1.87 -0.02 0.00 -0.04 0.00 0.00 33.50 31.69 1wib n PRO 83 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wib s SER 84 N -4.23 6.47 0.20 3.54 0.15 -1.26 -4.85 113.70 113.72 1wib s SER 84 Ca 0.04 -1.80 -0.12 0.00 0.70 0.00 0.00 55.95 54.77 1wib s SER 84 Cb 0.09 -2.57 0.24 0.00 -1.71 0.00 0.00 66.02 62.07 1wib s SER 84 CO 0.39 -1.53 1.27 -0.24 1.20 0.00 0.00 173.24 174.33 1wib n SER 85 N 9.29 -0.47 0.00 5.45 2.88 -1.26 -5.24 113.62 124.26 1wib n SER 85 Ca 0.40 1.42 0.00 0.00 -1.33 0.00 0.00 58.87 59.37 1wib n SER 85 Cb 0.49 -0.35 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 1wib n SER 85 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42