#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 4.98 -0.31 1.61 0.01 -1.26 -5.06 113.70 113.68 1wib s SER -5 Ca 0.00 -2.45 -0.02 0.00 1.31 0.00 0.00 55.95 54.79 1wib s SER -5 Cb 0.00 -1.76 0.05 0.00 0.21 0.00 0.00 66.02 64.52 1wib s SER -5 CO 0.00 -0.41 0.01 -0.44 0.41 0.00 0.00 173.24 172.82 1wib s SER -4 N 0.95 4.91 0.00 2.44 0.01 -1.26 -5.05 113.70 115.71 1wib s SER -4 Ca 0.13 -1.33 0.00 0.00 1.31 0.00 0.00 55.95 56.06 1wib s SER -4 Cb -0.22 -1.72 0.00 0.00 0.21 0.00 0.00 66.02 64.29 1wib s SER -4 CO -0.04 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 173.94 1wib n GLY -3 N 4.62 -0.25 3.26 3.44 0.00 -1.26 -5.00 105.19 110.00 1wib n GLY -3 Ca -0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.49 -0.33 -0.42 1.61 1.04 -1.26 -5.05 113.70 107.79 1wib s SER -2 Ca 0.00 0.94 0.05 0.00 0.48 0.00 0.00 55.95 57.42 1wib s SER -2 Cb 0.00 1.10 0.43 0.00 0.10 0.00 0.00 66.02 67.65 1wib s SER -2 CO 0.00 -0.22 1.29 -1.20 0.98 0.00 0.00 173.24 174.09 1wib n SER -1 N 4.94 5.27 0.00 7.02 7.64 -1.26 -4.89 113.62 132.34 1wib n SER -1 Ca -0.14 -3.75 0.00 0.00 1.01 0.00 0.00 58.87 55.99 1wib n SER -1 Cb 0.52 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1wib n SER -1 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wib n GLY 1 N -0.62 1.19 3.77 0.23 0.00 -1.26 -5.13 105.19 103.38 1wib n GLY 1 Ca 0.44 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.95 1wib n GLY 1 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wib s PRO 2 N 0.50 3.32 0.55 1.61 0.04 -1.26 -5.01 135.00 134.75 1wib s PRO 2 Ca 0.00 1.60 -0.19 0.00 0.04 0.00 0.00 61.00 62.45 1wib s PRO 2 Cb 0.00 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 1wib s PRO 2 CO 0.00 -0.87 1.13 -1.25 0.04 0.00 0.00 177.00 176.04 1wib s PRO 3 N -3.33 3.30 -0.22 0.56 0.04 -1.26 -5.03 135.00 129.06 1wib s PRO 3 Ca 0.72 1.59 -0.17 0.00 0.04 0.00 0.00 61.00 63.18 1wib s PRO 3 Cb -0.24 -2.00 0.06 0.00 0.04 0.00 0.00 34.50 32.36 1wib s PRO 3 CO 0.28 -0.89 0.56 0.15 0.04 0.00 0.00 177.00 177.14 1wib s LYS 4 N -3.37 0.62 -0.01 4.56 1.02 -1.26 -5.05 119.74 116.24 1wib s LYS 4 Ca 0.72 0.87 -0.04 0.00 0.02 0.00 0.00 55.97 57.54 1wib s LYS 4 Cb -0.23 0.22 -0.28 0.00 -0.52 0.00 0.00 37.83 37.02 1wib s LYS 4 CO 0.28 -0.11 0.80 0.27 -0.92 0.00 0.00 175.35 175.67 1wib h PHE 5 N 5.94 0.47 -3.07 3.18 -5.15 -1.97 -3.41 116.94 112.94 1wib h PHE 5 Ca -0.30 -0.35 -0.63 0.00 -0.20 0.00 0.00 57.97 56.49 1wib h PHE 5 Cb 1.18 -0.02 -0.41 0.00 0.22 0.00 0.00 35.95 36.93 1wib h PHE 5 CO 0.30 1.43 -0.48 -0.25 -2.00 0.00 0.00 178.31 177.31 1wib n ASP 6 N -3.46 3.30 0.15 -0.68 8.00 -1.26 -2.70 116.55 119.90 1wib n ASP 6 Ca -0.18 -3.22 0.13 0.00 0.71 0.00 0.00 54.79 52.22 1wib n ASP 6 Cb 1.05 -0.81 0.52 0.00 -0.02 0.00 0.00 41.12 41.86 1wib n ASP 6 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1wib h PRO 7 N 5.41 0.00 0.00 -0.24 0.13 -2.01 -3.40 132.00 131.88 1wib h PRO 7 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1wib h PRO 7 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1wib h PRO 7 CO 0.75 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.61 1wib n ASN 8 N -2.35 0.00 -3.30 1.44 3.02 -1.26 -5.00 115.26 107.82 1wib n ASN 8 Ca 0.02 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.41 1wib n ASN 8 Cb 0.24 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.35 1wib n ASN 8 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1wib s GLU 9 N -0.60 1.86 0.12 3.52 -1.05 -1.26 -5.17 118.70 116.11 1wib s GLU 9 Ca 0.00 -1.81 0.06 0.00 -0.15 0.00 0.00 54.97 53.08 1wib s GLU 9 Cb 0.00 0.41 -0.04 0.00 -0.44 0.00 0.00 34.13 34.06 1wib s GLU 9 CO 0.00 -0.75 -0.04 0.08 0.95 0.00 0.00 175.26 175.50 1wib s VAL 10 N -3.17 3.65 -0.06 1.83 1.01 -1.26 -4.81 120.40 117.59 1wib s VAL 10 Ca 0.33 -1.23 -0.02 0.00 0.00 0.00 0.00 61.98 61.06 1wib s VAL 10 Cb 0.00 -2.75 0.03 0.00 0.00 0.00 0.00 36.38 33.66 1wib s VAL 10 CO 0.22 0.05 0.03 -0.75 0.00 0.00 0.00 175.10 174.65 1wib s LYS 11 N -2.43 0.25 -0.05 2.72 2.47 -1.26 -5.12 119.74 116.32 1wib s LYS 11 Ca 0.24 0.24 0.06 0.00 -1.56 0.00 0.00 55.97 54.95 1wib s LYS 11 Cb -0.11 -0.77 -0.02 0.00 -1.46 0.00 0.00 37.83 35.48 1wib s LYS 11 CO 0.16 -0.33 -0.23 0.08 0.16 0.00 0.00 175.35 175.20 1wib s VAL 12 N 2.07 2.31 -0.12 4.02 1.01 -1.26 -3.34 120.40 125.10 1wib s VAL 12 Ca 0.05 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.04 1wib s VAL 12 Cb -0.12 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 1wib s VAL 12 CO -0.04 0.57 -0.14 -0.69 0.00 0.00 0.00 175.10 174.80 1wib s VAL 13 N -0.39 3.01 -0.10 2.92 1.01 -0.41 -4.96 120.40 121.47 1wib s VAL 13 Ca 0.03 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.36 1wib s VAL 13 Cb -0.12 -2.24 0.01 0.00 0.00 0.00 0.00 36.38 34.02 1wib s VAL 13 CO 0.02 0.54 -0.21 -0.31 0.00 0.00 0.00 175.10 175.13 1wib s TYR 14 N 0.18 2.38 0.01 5.22 2.02 -1.26 -2.12 117.35 123.77 1wib s TYR 14 Ca -0.08 -1.03 -0.08 0.00 -0.37 0.00 0.00 57.07 55.51 1wib s TYR 14 Cb -0.15 -1.62 0.00 0.00 -0.40 0.00 0.00 41.96 39.79 1wib s TYR 14 CO 0.05 -0.45 0.15 -0.51 -1.57 0.00 0.00 175.55 173.23 1wib s LEU 15 N 0.55 1.50 -0.30 -1.29 1.43 -1.25 -5.10 118.68 114.21 1wib s LEU 15 Ca -0.15 -0.21 -0.06 0.00 -1.03 0.00 0.00 54.13 52.68 1wib s LEU 15 Cb -0.17 0.74 0.02 0.00 0.03 0.00 0.00 46.19 46.80 1wib s LEU 15 CO 0.05 -0.40 0.08 -0.60 0.23 0.00 0.00 176.35 175.71 1wib s ARG 16 N -1.51 2.99 0.22 1.70 6.06 -1.26 -4.07 118.95 123.08 1wib s ARG 16 Ca -0.14 -0.92 -0.12 0.00 -2.50 0.00 0.00 55.73 52.05 1wib s ARG 16 Cb -0.07 -3.36 -0.00 0.00 0.06 0.00 0.00 34.95 31.58 1wib s ARG 16 CO 0.01 -0.48 0.43 0.00 -2.50 0.00 0.00 175.30 172.77 1wib s THR 18 N -3.99 3.61 0.33 0.00 2.01 -1.26 -3.64 115.64 112.69 1wib s THR 18 Ca 0.20 1.60 -0.25 0.00 0.31 0.00 0.00 61.69 63.56 1wib s THR 18 Cb 0.00 -4.02 -0.10 0.00 0.01 0.00 0.00 72.50 68.39 1wib s THR 18 CO 0.06 0.38 0.93 -0.83 -0.69 0.00 0.00 174.62 174.46 1wib s GLY 19 N -0.88 2.73 -0.82 4.40 0.00 -0.51 -4.06 107.32 108.17 1wib s GLY 19 Ca 0.44 0.48 -0.01 0.00 0.00 0.00 0.00 44.72 45.63 1wib s GLY 19 CO 0.39 0.89 0.69 0.61 0.00 0.00 0.00 173.10 175.68 1wib n GLY 20 N 0.39 -0.09 3.89 0.20 0.00 -1.24 -1.30 105.19 107.04 1wib n GLY 20 Ca 0.02 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 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 -5.04 2.50 -0.12 1.61 -1.05 -1.26 -4.57 118.70 110.77 1wib s GLU 21 Ca 0.05 -1.58 -0.04 0.00 -0.15 0.00 0.00 54.97 53.25 1wib s GLU 21 Cb -0.02 -2.38 -0.04 0.00 -0.44 0.00 0.00 34.13 31.26 1wib s GLU 21 CO 0.49 -0.28 0.03 0.54 0.95 0.00 0.00 175.26 176.99 1wib s VAL 22 N -2.51 4.54 0.00 1.83 0.11 -1.26 -4.88 120.40 118.22 1wib s VAL 22 Ca 0.48 -0.15 0.00 0.00 -2.93 0.00 0.00 61.98 59.38 1wib s VAL 22 Cb -0.03 -2.96 0.00 0.00 -1.53 0.00 0.00 36.38 31.86 1wib s VAL 22 CO 0.28 0.56 0.00 0.61 -3.33 0.00 0.00 175.10 173.22 1wib n GLY 23 N 2.60 0.88 2.46 6.54 0.00 -1.26 -4.93 105.19 111.47 1wib n GLY 23 Ca -0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 1wib n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wib n ALA 24 N -2.27 -0.51 -3.60 4.61 0.00 -1.26 -4.97 120.51 112.51 1wib n ALA 24 Ca 0.00 0.22 -0.22 0.00 0.00 0.00 0.00 53.44 53.44 1wib n ALA 24 Cb 0.00 -2.13 -0.17 0.00 0.00 0.00 0.00 19.45 17.16 1wib n ALA 24 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1wib s THR 25 N -2.94 0.77 0.00 0.00 -4.23 -1.26 -5.03 115.64 102.95 1wib s THR 25 Ca 0.00 -0.24 -0.05 0.00 -1.18 0.00 0.00 61.69 60.22 1wib s THR 25 Cb 0.00 -0.76 -0.22 0.00 1.34 0.00 0.00 72.50 72.87 1wib s THR 25 CO 0.00 0.28 3.22 -1.54 -0.54 0.00 0.00 174.62 176.04 1wib n SER 26 N 4.09 4.96 -0.00 3.99 3.41 -1.26 -4.14 113.62 124.67 1wib n SER 26 Ca -0.22 -2.41 -0.09 0.00 -0.26 0.00 0.00 58.87 55.88 1wib n SER 26 Cb 0.51 -1.30 -0.14 0.00 -0.26 0.00 0.00 64.21 63.02 1wib n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wib h ALA 27 N 2.87 0.66 -0.00 7.33 0.00 -1.99 -3.32 119.26 124.80 1wib h ALA 27 Ca 0.15 -1.35 0.00 0.00 0.00 0.00 0.00 54.91 53.71 1wib h ALA 27 Cb 1.36 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1wib h ALA 27 CO 0.21 1.50 -0.22 1.28 0.00 0.00 0.00 179.25 182.02 1wib n LEU 28 N -3.14 0.65 0.34 0.00 4.77 -1.26 -4.12 117.00 114.24 1wib n LEU 28 Ca -0.15 -0.06 -0.18 0.00 -0.03 0.00 0.00 56.01 55.60 1wib n LEU 28 Cb 1.03 -0.19 -0.09 0.00 -2.33 0.00 0.00 43.42 41.84 1wib n LEU 28 CO 0.45 0.13 0.61 0.00 -1.33 0.00 0.00 177.39 177.25 1wib h ALA 29 N 3.50 -0.96 0.00 -1.18 0.00 -1.87 -1.45 119.26 117.30 1wib h ALA 29 Ca 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1wib h ALA 29 Cb 0.44 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1wib h ALA 29 CO 0.00 -1.06 -0.17 -1.00 0.00 0.00 0.00 179.25 177.03 1wib h PRO 30 N -0.94 0.00 -0.23 0.00 0.13 -1.80 0.54 132.00 129.71 1wib h PRO 30 Ca -0.07 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.96 1wib h PRO 30 Cb 0.76 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.89 1wib h PRO 30 CO 0.07 0.17 -0.22 0.87 -0.23 0.00 0.00 178.00 178.65 1wib h LYS 31 N 0.00 0.55 0.00 0.86 1.57 -1.65 -3.25 116.57 114.66 1wib h LYS 31 Ca -0.00 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1wib h LYS 31 Cb 0.62 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1wib h LYS 31 CO 0.02 0.88 -1.06 -0.89 -0.57 0.00 0.00 179.45 177.83 1wib n ILE 32 N -4.39 0.04 -0.38 1.86 5.41 -0.57 -4.52 119.36 116.80 1wib n ILE 32 Ca -0.05 -0.11 -0.10 0.00 1.00 0.00 0.00 62.75 63.49 1wib n ILE 32 Cb 0.42 0.61 -0.09 0.00 -0.71 0.00 0.00 39.64 39.87 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 1.44 -2.36 0.17 7.39 0.00 0.19 0.07 105.19 112.09 1wib n GLY 33 Ca 0.03 1.08 0.00 0.00 0.00 0.00 0.00 46.02 47.13 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 0.03 0.43 1.61 0.13 -1.80 -3.30 132.00 129.10 1wib h PRO 34 Ca 0.15 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.24 1wib h PRO 34 Cb 0.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.51 1wib h PRO 34 CO -0.86 0.51 -0.21 -0.07 -0.23 0.00 0.00 178.00 177.15 1wib h LEU 35 N 0.03 -0.49 0.00 1.56 4.07 -0.60 -3.49 115.31 116.40 1wib h LEU 35 Ca -0.00 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1wib h LEU 35 Cb 0.86 0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.73 1wib h LEU 35 CO 0.06 -0.32 0.00 0.61 -1.08 0.00 0.00 178.44 177.71 1wib n GLY 36 N -0.97 3.12 3.28 0.83 0.00 0.18 -5.04 105.19 106.59 1wib n GLY 36 Ca -0.07 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.32 -4.70 0.99 4.32 -1.26 -4.95 117.00 109.08 1wib n LEU 37 Ca 0.00 -0.15 -0.33 0.00 -0.02 0.00 0.00 56.01 55.50 1wib n LEU 37 Cb 0.00 -0.97 -0.09 0.00 -1.62 0.00 0.00 43.42 40.74 1wib n LEU 37 CO 0.00 -3.10 -0.30 -0.55 -1.22 0.00 0.00 177.39 172.22 1wib s SER 38 N -1.89 5.26 0.41 -1.43 0.15 -1.26 -4.71 113.70 110.22 1wib s SER 38 Ca 0.57 0.07 0.20 0.00 0.70 0.00 0.00 55.95 57.49 1wib s SER 38 Cb -0.13 -1.43 0.86 0.00 -1.71 0.00 0.00 66.02 63.61 1wib s SER 38 CO 0.66 0.31 1.82 1.55 1.20 0.00 0.00 173.24 178.78 1wib h PRO 39 N 4.56 0.00 0.24 5.44 0.13 -1.94 -2.56 132.00 137.88 1wib h PRO 39 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 1wib h PRO 39 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1wib h PRO 39 CO 0.57 0.31 -0.12 -0.22 -0.23 0.00 0.00 178.00 178.32 1wib h LYS 40 N 0.00 -0.31 -0.34 0.86 1.63 -1.97 0.58 116.57 117.02 1wib h LYS 40 Ca -0.00 0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1wib h LYS 40 Cb 0.73 0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.42 1wib h LYS 40 CO 0.04 0.04 0.19 0.87 -3.45 0.00 0.00 179.45 177.15 1wib h LYS 41 N -0.75 0.47 -0.34 1.90 1.79 -1.99 0.18 116.57 117.82 1wib h LYS 41 Ca -0.03 -0.05 -0.12 0.00 -2.18 0.00 0.00 60.65 58.27 1wib h LYS 41 Cb 0.50 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 1wib h LYS 41 CO 0.05 0.38 -0.24 0.28 -1.08 0.00 0.00 179.45 178.84 1wib h VAL 42 N 0.43 1.29 -0.35 0.50 2.07 -1.52 -1.98 116.25 116.69 1wib h VAL 42 Ca 0.12 -1.39 -0.04 0.00 0.82 0.00 0.00 66.70 66.21 1wib h VAL 42 Cb 0.04 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1wib h VAL 42 CO -0.02 0.46 0.07 1.23 0.02 0.00 0.00 177.57 179.32 1wib h GLY 43 N 0.55 0.61 1.53 2.17 0.00 0.34 -2.76 103.07 105.51 1wib h GLY 43 Ca 0.07 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 1wib h GLY 43 CO 0.07 0.37 -0.09 -1.80 0.00 0.00 0.00 176.54 175.09 1wib h ASP 44 N 0.41 0.55 -0.65 0.19 1.82 -0.67 -2.77 116.42 115.30 1wib h ASP 44 Ca 0.11 -0.14 0.01 0.00 -0.39 0.00 0.00 57.03 56.61 1wib h ASP 44 Cb 0.33 -0.15 -0.03 0.00 0.68 0.00 0.00 39.33 40.16 1wib h ASP 44 CO 0.00 0.68 0.43 0.44 -1.61 0.00 0.00 179.24 179.18 1wib h ASP 45 N 0.53 0.76 -0.24 2.28 3.32 -1.17 -0.78 116.42 121.11 1wib h ASP 45 Ca 0.10 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1wib h ASP 45 Cb 0.47 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1wib h ASP 45 CO 0.03 0.55 0.09 0.40 -1.72 0.00 0.00 179.24 178.59 1wib h ILE 46 N 0.89 1.18 -0.24 0.35 2.04 -1.25 -1.42 117.51 119.05 1wib h ILE 46 Ca 0.24 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 65.57 1wib h ILE 46 Cb -0.09 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1wib h ILE 46 CO -0.05 0.18 0.14 0.00 0.00 0.00 0.00 178.15 178.41 1wib h ALA 47 N 0.93 0.29 -0.99 1.87 0.00 -1.24 0.90 119.26 121.02 1wib h ALA 47 Ca 0.08 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1wib h ALA 47 Cb 0.19 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1wib h ALA 47 CO -0.01 -0.26 0.65 -0.22 0.00 0.00 0.00 179.25 179.42 1wib h LYS 48 N 0.28 1.28 -0.10 0.00 1.63 -1.06 -1.48 116.57 117.14 1wib h LYS 48 Ca 0.09 -0.08 -0.13 0.00 -0.85 0.00 0.00 60.65 59.69 1wib h LYS 48 Cb -0.00 -0.29 -0.01 0.00 -0.60 0.00 0.00 32.23 31.33 1wib h LYS 48 CO -0.04 0.85 -0.51 0.00 -3.45 0.00 0.00 179.45 176.30 1wib h ALA 49 N 1.37 0.96 -0.36 5.00 0.00 -0.83 -2.77 119.26 122.63 1wib h ALA 49 Ca 0.37 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1wib h ALA 49 Cb -0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1wib h ALA 49 CO -0.09 0.66 0.00 0.25 0.00 0.00 0.00 179.25 180.08 1wib n THR 50 N -3.95 1.50 0.20 0.00 -2.24 0.27 -4.12 114.28 105.94 1wib n THR 50 Ca -0.02 -0.80 0.09 0.00 -2.27 0.00 0.00 64.05 61.05 1wib n THR 50 Cb 0.55 -0.27 0.24 0.00 -2.10 0.00 0.00 70.33 68.76 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 4.52 0.00 2.00 3.38 0.00 -0.99 -2.97 103.07 109.01 1wib h GLY 51 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 1wib h GLY 51 CO 0.25 0.00 -0.28 -0.55 0.00 0.00 0.00 176.54 175.96 1wib h ASP 52 N 0.00 0.00 -1.19 0.19 5.19 -1.80 -3.22 116.42 115.59 1wib h ASP 52 Ca -0.00 0.00 -0.46 0.00 -0.62 0.00 0.00 57.03 55.95 1wib h ASP 52 Cb 1.02 0.00 -0.41 0.00 0.18 0.00 0.00 39.33 40.12 1wib h ASP 52 CO 0.03 0.28 -0.99 -2.67 -3.12 0.00 0.00 179.24 172.77 1wib n TRP 53 N -3.84 2.13 -1.93 4.55 2.14 -1.19 -5.07 117.44 114.23 1wib n TRP 53 Ca -0.01 -2.90 -0.43 0.00 2.07 0.00 0.00 57.50 56.23 1wib n TRP 53 Cb 0.37 -0.25 -0.03 0.00 -0.81 0.00 0.00 31.31 30.59 1wib n TRP 53 CO 0.00 0.00 0.00 0.21 2.07 0.00 0.00 177.69 179.97 1wib s LYS 54 N -3.32 3.77 0.00 -2.67 2.20 -1.13 -2.25 119.74 116.34 1wib s LYS 54 Ca 0.36 1.95 0.00 0.00 -0.36 0.00 0.00 55.97 57.93 1wib s LYS 54 Cb 0.43 -4.12 0.00 0.00 -1.51 0.00 0.00 37.83 32.63 1wib s LYS 54 CO -0.06 -1.34 0.00 0.41 -0.36 0.00 0.00 175.35 174.01 1wib n GLY 55 N 4.79 1.32 3.87 5.54 0.00 -0.42 -4.97 105.19 115.32 1wib n GLY 55 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 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 4.23 0.07 0.99 1.02 -0.95 -4.76 118.68 119.27 1wib s LEU 56 Ca 0.00 0.92 -0.25 0.00 0.02 0.00 0.00 54.13 54.82 1wib s LEU 56 Cb 0.00 -3.50 -0.06 0.00 0.02 0.00 0.00 46.19 42.66 1wib s LEU 56 CO 0.00 -0.00 0.78 0.00 0.02 0.00 0.00 176.35 177.15 1wib s ARG 57 N -2.52 4.52 0.10 1.70 1.04 -1.26 -1.42 118.95 121.11 1wib s ARG 57 Ca 0.43 1.11 -0.12 0.00 -1.04 0.00 0.00 55.73 56.11 1wib s ARG 57 Cb -0.12 -3.35 0.01 0.00 -2.04 0.00 0.00 34.95 29.45 1wib s ARG 57 CO 0.21 0.32 0.28 0.96 -0.04 0.00 0.00 175.30 177.02 1wib s ILE 58 N -0.21 0.11 -0.23 4.99 -5.25 -1.24 -4.92 121.20 114.46 1wib s ILE 58 Ca 0.39 -0.90 -0.11 0.00 -0.99 0.00 0.00 60.65 59.05 1wib s ILE 58 Cb -0.21 -1.22 -0.05 0.00 2.95 0.00 0.00 42.46 43.93 1wib s ILE 58 CO 0.24 -0.49 0.16 -0.89 -1.79 0.00 0.00 174.94 172.17 1wib s THR 59 N -3.67 5.37 -0.08 8.37 2.01 -1.26 -4.25 115.64 122.13 1wib s THR 59 Ca 0.03 0.20 0.04 0.00 0.31 0.00 0.00 61.69 62.27 1wib s THR 59 Cb 0.03 -3.50 -0.01 0.00 0.01 0.00 0.00 72.50 69.03 1wib s THR 59 CO -0.10 0.36 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.28 1wib s VAL 60 N 0.91 2.29 -0.22 3.82 1.01 -1.26 -2.30 120.40 124.65 1wib s VAL 60 Ca 0.08 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.06 1wib s VAL 60 Cb -0.13 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 1wib s VAL 60 CO 0.03 0.56 -0.03 -1.59 0.00 0.00 0.00 175.10 174.07 1wib s LYS 61 N 0.04 3.44 -0.24 2.72 -2.85 -1.03 -3.95 119.74 117.86 1wib s LYS 61 Ca -0.09 -0.60 -0.09 0.00 -1.00 0.00 0.00 55.97 54.19 1wib s LYS 61 Cb -0.15 -3.04 -0.04 0.00 -2.06 0.00 0.00 37.83 32.54 1wib s LYS 61 CO 0.05 -0.15 0.12 -0.51 0.10 0.00 0.00 175.35 174.96 1wib s LEU 62 N 1.39 3.84 -0.23 2.77 1.43 -0.90 -3.83 118.68 123.15 1wib s LEU 62 Ca 0.05 -0.00 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 1wib s LEU 62 Cb -0.14 -2.03 0.04 0.00 0.03 0.00 0.00 46.19 44.09 1wib s LEU 62 CO -0.02 0.04 -0.12 -0.89 0.23 0.00 0.00 176.35 175.60 1wib s THR 63 N 1.18 2.37 -0.24 5.49 2.01 -1.24 -1.29 115.64 123.92 1wib s THR 63 Ca 0.06 -1.23 -0.16 0.00 0.31 0.00 0.00 61.69 60.67 1wib s THR 63 Cb -0.14 -2.21 -0.03 0.00 0.01 0.00 0.00 72.50 70.12 1wib s THR 63 CO 0.05 0.22 0.43 -0.63 -0.69 0.00 0.00 174.62 173.99 1wib s ILE 64 N 1.23 5.15 -0.10 1.82 -1.09 -1.21 -3.46 121.20 123.54 1wib s ILE 64 Ca -0.02 0.72 -0.08 0.00 -2.23 0.00 0.00 60.65 59.04 1wib s ILE 64 Cb -0.17 -3.75 0.03 0.00 -1.58 0.00 0.00 42.46 36.99 1wib s ILE 64 CO -0.07 0.16 0.25 0.00 -1.23 0.00 0.00 174.94 174.05 1wib s GLN 65 N 1.91 0.28 -1.66 2.79 -2.07 -0.73 -4.52 119.66 115.66 1wib s GLN 65 Ca 0.18 0.38 -0.17 0.00 -1.82 0.00 0.00 55.36 53.93 1wib s GLN 65 Cb -0.15 0.10 0.14 0.00 -1.09 0.00 0.00 33.01 32.00 1wib s GLN 65 CO 0.09 -0.05 0.82 -1.71 -1.32 0.00 0.00 175.29 173.11 1wib n ASN 66 N 3.15 -3.51 -2.93 12.60 5.15 -1.10 0.46 115.26 129.08 1wib n ASN 66 Ca -0.15 -0.96 -0.22 0.00 -0.60 0.00 0.00 54.58 52.65 1wib n ASN 66 Cb 0.57 -3.01 0.03 0.00 -0.53 0.00 0.00 39.78 36.85 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 -4.45 -4.72 -4.85 1.20 1.74 -1.26 -4.99 116.66 99.33 1wib n ARG 67 Ca 0.05 0.90 -0.25 0.00 -0.77 0.00 0.00 57.85 57.79 1wib n ARG 67 Cb 0.51 -5.72 -0.15 0.00 -1.02 0.00 0.00 32.46 26.07 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 -5.65 1.44 -0.10 5.56 2.00 0.17 -4.89 119.66 118.18 1wib s GLN 68 Ca 0.29 -0.63 -0.02 0.00 -2.00 0.00 0.00 55.36 53.00 1wib s GLN 68 Cb -0.13 -1.39 -0.03 0.00 0.80 0.00 0.00 33.01 32.26 1wib s GLN 68 CO 0.36 0.38 -0.02 0.00 -0.50 0.00 0.00 175.29 175.50 1wib s ALA 69 N -0.41 3.15 0.01 1.58 0.00 -1.26 -1.77 121.76 123.05 1wib s ALA 69 Ca 0.07 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.24 1wib s ALA 69 Cb -0.07 -1.46 -0.01 0.00 0.00 0.00 0.00 23.12 21.58 1wib s ALA 69 CO -0.01 0.48 -0.13 -0.65 0.00 0.00 0.00 175.76 175.45 1wib s GLN 70 N -0.53 1.03 -0.07 0.00 -0.21 -1.22 -5.03 119.66 113.62 1wib s GLN 70 Ca 0.09 -0.56 0.05 0.00 0.02 0.00 0.00 55.36 54.95 1wib s GLN 70 Cb -0.12 -1.00 -0.00 0.00 1.00 0.00 0.00 33.01 32.88 1wib s GLN 70 CO 0.02 0.27 -0.23 0.96 -2.12 0.00 0.00 175.29 174.19 1wib s ILE 71 N -0.48 1.92 -0.14 1.08 -4.36 -1.26 -3.60 121.20 114.36 1wib s ILE 71 Ca 0.04 -0.97 -0.15 0.00 -0.26 0.00 0.00 60.65 59.31 1wib s ILE 71 Cb -0.06 -1.65 0.04 0.00 1.25 0.00 0.00 42.46 42.05 1wib s ILE 71 CO 0.00 0.53 0.42 -0.70 0.24 0.00 0.00 174.94 175.43 1wib s GLU 72 N 0.12 0.53 -0.20 0.37 2.12 -1.25 -5.05 118.70 115.34 1wib s GLU 72 Ca -0.11 0.50 -0.07 0.00 0.36 0.00 0.00 54.97 55.66 1wib s GLU 72 Cb -0.15 0.26 -0.04 0.00 0.26 0.00 0.00 34.13 34.46 1wib s GLU 72 CO 0.06 -0.08 0.05 0.08 -0.54 0.00 0.00 175.26 174.83 1wib s VAL 73 N 0.02 4.53 0.25 3.70 1.01 -1.26 -2.46 120.40 126.18 1wib s VAL 73 Ca -0.02 -0.12 -0.20 0.00 0.00 0.00 0.00 61.98 61.64 1wib s VAL 73 Cb -0.03 -3.06 -0.09 0.00 0.00 0.00 0.00 36.38 33.21 1wib s VAL 73 CO 0.01 0.43 0.76 0.68 0.00 0.00 0.00 175.10 176.98 1wib s VAL 74 N 0.74 4.52 0.71 2.92 -7.23 -0.97 -5.05 120.40 116.04 1wib s VAL 74 Ca 0.03 1.33 -0.13 0.00 -1.81 0.00 0.00 61.98 61.40 1wib s VAL 74 Cb -0.14 -3.85 0.03 0.00 0.56 0.00 0.00 36.38 32.98 1wib s VAL 74 CO 0.02 0.16 1.10 -2.16 -0.31 0.00 0.00 175.10 173.91 1wib s PRO 75 N -2.09 2.55 -0.30 4.82 0.04 -1.26 -4.61 135.00 134.15 1wib s PRO 75 Ca 0.45 1.29 -0.10 0.00 0.04 0.00 0.00 61.00 62.69 1wib s PRO 75 Cb -0.16 -1.93 0.18 0.00 0.04 0.00 0.00 34.50 32.63 1wib s PRO 75 CO 0.21 -1.43 0.91 -1.54 0.04 0.00 0.00 177.00 175.18 1wib s SER 76 N -2.95 -0.75 -0.04 6.66 1.04 -1.26 -5.05 113.70 111.35 1wib s SER 76 Ca 0.64 0.54 -0.24 0.00 0.48 0.00 0.00 55.95 57.37 1wib s SER 76 Cb -0.19 1.66 -0.19 0.00 0.10 0.00 0.00 66.02 67.40 1wib s SER 76 CO 0.48 -0.14 1.07 0.00 0.98 0.00 0.00 173.24 175.63 1wib h ALA 77 N 7.94 -0.13 -2.69 5.32 0.00 -2.03 -3.48 119.26 124.20 1wib h ALA 77 Ca -0.17 -0.25 -0.32 0.00 0.00 0.00 0.00 54.91 54.17 1wib h ALA 77 Cb 1.16 0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 1wib h ALA 77 CO 0.03 -0.29 -0.57 0.45 0.00 0.00 0.00 179.25 178.87 1wib s SER 78 N -5.58 0.71 -0.34 0.00 0.15 -1.26 -5.09 113.70 102.29 1wib s SER 78 Ca -0.15 -1.52 -0.31 0.00 0.70 0.00 0.00 55.95 54.68 1wib s SER 78 Cb 0.01 0.44 -0.08 0.00 -1.71 0.00 0.00 66.02 64.67 1wib s SER 78 CO 0.58 -0.91 2.26 0.00 1.20 0.00 0.00 173.24 176.37 1wib n ALA 79 N -0.40 1.31 -3.83 5.45 0.00 -1.26 -4.91 120.51 116.87 1wib n ALA 79 Ca 0.04 -0.29 -0.30 0.00 0.00 0.00 0.00 53.44 52.88 1wib n ALA 79 Cb 0.65 -2.81 -0.15 0.00 0.00 0.00 0.00 19.45 17.14 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 8.62 3.17 0.22 0.00 1.43 -1.26 -5.11 118.68 125.75 1wib s LEU 80 Ca 1.05 -1.91 0.10 0.00 -1.03 0.00 0.00 54.13 52.34 1wib s LEU 80 Cb -0.54 -1.15 -0.05 0.00 0.03 0.00 0.00 46.19 44.48 1wib s LEU 80 CO 0.39 -0.39 -0.19 -0.55 0.23 0.00 0.00 176.35 175.85 1wib s SER 81 N 1.25 3.06 0.00 2.29 0.15 -1.26 -4.74 113.70 114.46 1wib s SER 81 Ca 0.11 -0.96 0.00 0.00 0.70 0.00 0.00 55.95 55.80 1wib s SER 81 Cb -0.19 -0.21 0.00 0.00 -1.71 0.00 0.00 66.02 63.91 1wib s SER 81 CO -0.17 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 174.86 1wib n GLY 82 N -0.19 1.51 0.07 9.45 0.00 -1.26 -4.66 105.19 110.11 1wib n GLY 82 Ca -0.09 -0.77 0.09 0.00 0.00 0.00 0.00 46.02 45.25 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 0.00 0.10 -2.58 1.61 -0.04 -1.26 -4.36 135.00 128.46 1wib n PRO 83 Ca 0.00 0.34 -0.43 0.00 -0.04 0.00 0.00 63.50 63.37 1wib n PRO 83 Cb 0.00 -1.69 -0.00 0.00 -0.04 0.00 0.00 33.50 31.77 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 -3.64 6.84 0.56 3.54 0.15 -1.26 -4.94 113.70 114.96 1wib s SER 84 Ca 0.05 -2.46 0.06 0.00 0.70 0.00 0.00 55.95 54.30 1wib s SER 84 Cb 0.09 -2.58 0.05 0.00 -1.71 0.00 0.00 66.02 61.87 1wib s SER 84 CO 0.32 -1.17 0.44 -0.44 1.20 0.00 0.00 173.24 173.60 1wib s SER 85 N 4.21 4.64 0.00 5.45 0.01 -1.26 -5.00 113.70 121.76 1wib s SER 85 Ca 0.54 -1.26 0.00 0.00 1.31 0.00 0.00 55.95 56.54 1wib s SER 85 Cb 0.04 0.50 0.00 0.00 0.21 0.00 0.00 66.02 66.77 1wib s SER 85 CO 0.08 -1.17 0.00 0.61 0.41 0.00 0.00 173.24 173.17