#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ptl s ASN 2 N 0.00 4.89 0.79 4.31 2.47 -1.26 -5.11 114.94 121.04 2ptl s ASN 2 Ca 0.00 -0.16 -0.05 0.00 0.42 0.00 0.00 52.86 53.07 2ptl s ASN 2 Cb 0.00 -1.83 0.15 0.00 -1.45 0.00 0.00 41.25 38.12 2ptl s ASN 2 CO 0.00 0.10 0.96 2.29 -3.72 0.00 0.00 177.10 176.73 2ptl n LYS 3 N 4.03 -0.37 -3.01 0.43 2.85 -1.26 -5.11 118.16 115.72 2ptl n LYS 3 Ca -0.17 -2.19 -0.18 0.00 -1.05 0.00 0.00 58.31 54.72 2ptl n LYS 3 Cb 0.52 -0.77 0.02 0.00 -0.65 0.00 0.00 35.03 34.15 2ptl n LYS 3 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2ptl n GLU 4 N -2.88 0.78 -2.69 -1.58 -0.58 -1.26 -5.10 120.64 107.33 2ptl n GLU 4 Ca 0.14 -2.62 -0.05 0.00 -0.42 0.00 0.00 57.16 54.22 2ptl n GLU 4 Cb 0.51 0.09 0.05 0.00 -0.57 0.00 0.00 31.44 31.52 2ptl n GLU 4 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 2ptl n GLU 5 N -1.72 0.25 -1.43 3.49 0.28 -1.26 -5.13 120.64 115.11 2ptl n GLU 5 Ca 0.05 -1.01 0.00 0.00 -0.16 0.00 0.00 57.16 56.04 2ptl n GLU 5 Cb 0.49 -0.41 0.00 0.00 1.43 0.00 0.00 31.44 32.94 2ptl n GLU 5 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 2ptl n THR 6 N 2.03 -3.35 -1.84 3.84 -1.04 -1.26 -4.77 114.28 107.89 2ptl n THR 6 Ca 0.07 1.59 -0.42 0.00 -2.04 0.00 0.00 64.05 63.26 2ptl n THR 6 Cb 0.66 -2.46 -0.02 0.00 -1.82 0.00 0.00 70.33 66.69 2ptl n THR 6 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2ptl s PRO 7 N -4.86 4.16 0.07 -2.82 0.04 -1.26 -4.86 135.00 125.46 2ptl s PRO 7 Ca 0.00 2.50 -0.37 0.00 0.04 0.00 0.00 61.00 63.17 2ptl s PRO 7 Cb 0.00 -3.05 -0.18 0.00 0.04 0.00 0.00 34.50 31.31 2ptl s PRO 7 CO 0.00 -0.59 1.13 0.39 0.04 0.00 0.00 177.00 177.97 2ptl n GLU 8 N 2.40 0.52 -1.28 4.56 -0.58 -1.26 -4.56 120.64 120.43 2ptl n GLU 8 Ca 0.09 0.19 -0.58 0.00 -0.42 0.00 0.00 57.16 56.43 2ptl n GLU 8 Cb 0.38 -1.69 -0.11 0.00 -0.57 0.00 0.00 31.44 29.44 2ptl n GLU 8 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 2ptl n THR 9 N 1.71 0.03 -1.57 2.62 5.66 -1.26 -4.72 114.28 116.75 2ptl n THR 9 Ca 0.19 -0.04 -0.43 0.00 -3.05 0.00 0.00 64.05 60.72 2ptl n THR 9 Cb 0.15 -0.69 -0.04 0.00 -1.55 0.00 0.00 70.33 68.21 2ptl n THR 9 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2ptl n PRO 10 N 7.62 1.61 -1.12 1.09 -0.02 -1.26 -4.83 135.00 138.09 2ptl n PRO 10 Ca 0.53 0.38 -0.26 0.00 -2.02 0.00 0.00 63.50 62.13 2ptl n PRO 10 Cb 0.00 -3.16 0.09 0.00 -0.02 0.00 0.00 33.50 30.42 2ptl n PRO 10 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2ptl n GLU 11 N 8.74 2.26 0.05 -0.52 1.02 -1.26 -4.40 120.64 126.54 2ptl n GLU 11 Ca 0.34 -2.62 0.00 0.00 -0.02 0.00 0.00 57.16 54.86 2ptl n GLU 11 Cb 0.43 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.83 2ptl n GLU 11 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2ptl n THR 12 N -0.60 1.01 0.00 2.62 -1.04 -1.26 -5.14 114.28 109.87 2ptl n THR 12 Ca 0.51 0.33 0.00 0.00 -2.04 0.00 0.00 64.05 62.85 2ptl n THR 12 Cb 0.91 -1.51 0.00 0.00 -1.82 0.00 0.00 70.33 67.91 2ptl n THR 12 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2ptl n ASP 13 N -3.43 0.00 -3.58 8.00 8.00 -1.26 -5.01 116.55 119.26 2ptl n ASP 13 Ca 0.00 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.09 2ptl n ASP 13 Cb 0.06 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.15 2ptl n ASP 13 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2ptl n SER 14 N 0.00 6.44 0.00 -2.24 3.41 -1.26 -4.40 113.62 115.57 2ptl n SER 14 Ca 0.00 -2.88 0.00 0.00 -0.26 0.00 0.00 58.87 55.73 2ptl n SER 14 Cb 0.00 -1.53 0.00 0.00 -0.26 0.00 0.00 64.21 62.42 2ptl n SER 14 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2ptl n GLU 15 N 3.98 -0.87 -1.24 4.33 1.02 -1.26 -4.75 120.64 121.85 2ptl n GLU 15 Ca 0.60 0.22 0.14 0.00 -0.02 0.00 0.00 57.16 58.09 2ptl n GLU 15 Cb 0.31 -3.91 -0.06 0.00 -0.02 0.00 0.00 31.44 27.75 2ptl n GLU 15 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2ptl n GLU 16 N -1.16 -2.48 0.12 3.49 -0.58 -1.26 -4.56 120.64 114.20 2ptl n GLU 16 Ca 0.00 1.93 -0.12 0.00 -0.42 0.00 0.00 57.16 58.55 2ptl n GLU 16 Cb 0.22 -3.06 -0.08 0.00 -0.57 0.00 0.00 31.44 27.95 2ptl n GLU 16 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 2ptl h GLU 17 N -1.33 -0.34 -2.21 3.49 5.08 -1.86 -3.46 114.58 113.96 2ptl h GLU 17 Ca -0.11 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2ptl h GLU 17 Cb 1.20 0.08 -0.23 0.00 0.50 0.00 0.00 28.75 30.30 2ptl h GLU 17 CO 0.05 0.01 -0.19 0.14 -1.00 0.00 0.00 179.01 178.02 2ptl s VAL 18 N -4.19 -0.64 -0.27 3.13 -7.23 -1.17 -5.04 120.40 104.98 2ptl s VAL 18 Ca -0.13 0.06 -0.17 0.00 -1.81 0.00 0.00 61.98 59.92 2ptl s VAL 18 Cb 0.02 -0.87 -0.03 0.00 0.56 0.00 0.00 36.38 36.06 2ptl s VAL 18 CO 0.51 0.02 0.47 0.42 -0.31 0.00 0.00 175.10 176.22 2ptl s THR 19 N 2.46 5.09 0.52 5.32 -4.23 -1.26 -2.27 115.64 121.27 2ptl s THR 19 Ca -0.06 0.72 0.07 0.00 -1.18 0.00 0.00 61.69 61.24 2ptl s THR 19 Cb -0.10 -3.81 0.05 0.00 1.34 0.00 0.00 72.50 69.98 2ptl s THR 19 CO -0.17 0.07 0.72 -0.51 -0.54 0.00 0.00 174.62 174.19 2ptl s ILE 20 N 2.25 2.57 -0.28 2.99 2.07 -1.25 -4.91 121.20 124.64 2ptl s ILE 20 Ca 0.19 -0.91 -0.20 0.00 -1.41 0.00 0.00 60.65 58.33 2ptl s ILE 20 Cb -0.16 -2.66 0.08 0.00 0.13 0.00 0.00 42.46 39.85 2ptl s ILE 20 CO 0.10 0.00 0.71 -0.75 -1.91 0.00 0.00 174.94 173.09 2ptl s LYS 21 N -4.60 0.75 0.50 3.50 2.20 -1.26 -3.02 119.74 117.81 2ptl s LYS 21 Ca 0.59 1.11 0.05 0.00 -0.36 0.00 0.00 55.97 57.36 2ptl s LYS 21 Cb -0.08 0.25 -0.00 0.00 -1.51 0.00 0.00 37.83 36.49 2ptl s LYS 21 CO 0.37 -0.13 0.23 0.00 -0.36 0.00 0.00 175.35 175.47 2ptl s ALA 22 N 1.10 4.11 -0.14 3.13 0.00 -0.55 -2.18 121.76 127.23 2ptl s ALA 22 Ca -0.06 -1.26 -0.10 0.00 0.00 0.00 0.00 51.96 50.55 2ptl s ALA 22 Cb -0.05 -0.43 0.04 0.00 0.00 0.00 0.00 23.12 22.68 2ptl s ALA 22 CO -0.11 -0.25 0.34 -0.80 0.00 0.00 0.00 175.76 174.94 2ptl s ASN 23 N -4.07 -0.38 -0.88 0.00 0.01 -1.10 -0.92 114.94 107.61 2ptl s ASN 23 Ca 0.28 0.71 -0.02 0.00 -0.71 0.00 0.00 52.86 53.13 2ptl s ASN 23 Cb 0.01 0.66 0.22 0.00 0.41 0.00 0.00 41.25 42.54 2ptl s ASN 23 CO 0.17 -0.15 0.76 -0.76 -1.51 0.00 0.00 177.10 175.60 2ptl s LEU 24 N 0.73 5.52 0.10 0.60 1.02 -0.24 -1.05 118.68 125.35 2ptl s LEU 24 Ca -0.05 -3.68 -0.17 0.00 0.02 0.00 0.00 54.13 50.25 2ptl s LEU 24 Cb -0.06 -1.90 -0.07 0.00 0.02 0.00 0.00 46.19 44.19 2ptl s LEU 24 CO -0.05 -0.19 0.55 -0.63 0.02 0.00 0.00 176.35 176.05 2ptl s ILE 25 N -1.29 4.80 0.29 -0.59 1.01 -1.01 0.06 121.20 124.48 2ptl s ILE 25 Ca 0.27 1.05 0.09 0.00 0.00 0.00 0.00 60.65 62.06 2ptl s ILE 25 Cb -0.08 -3.82 -0.06 0.00 0.01 0.00 0.00 42.46 38.51 2ptl s ILE 25 CO -0.12 0.44 -0.11 -0.36 0.00 0.00 0.00 174.94 174.79 2ptl s PHE 26 N -1.24 2.15 -0.21 3.97 0.40 -1.23 -1.46 117.98 120.36 2ptl s PHE 26 Ca 0.32 -0.54 0.18 0.00 -0.60 0.00 0.00 56.93 56.29 2ptl s PHE 26 Cb -0.18 -1.15 0.06 0.00 0.51 0.00 0.00 43.02 42.27 2ptl s PHE 26 CO 0.19 0.49 1.28 0.00 0.70 0.00 0.00 175.22 177.88 2ptl h ALA 27 N 2.22 0.71 0.00 5.36 0.00 -1.71 -3.27 119.26 122.57 2ptl h ALA 27 Ca -0.40 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.10 2ptl h ALA 27 Cb 1.24 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2ptl h ALA 27 CO 0.66 0.49 -0.05 -2.95 0.00 0.00 0.00 179.25 177.40 2ptl h ASN 28 N 0.00 0.00 0.00 0.00 -1.07 -1.93 -3.45 115.58 109.13 2ptl h ASN 28 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.33 2ptl h ASN 28 Cb 1.31 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.56 2ptl h ASN 28 CO 0.04 0.05 0.00 0.61 0.07 0.00 0.00 177.43 178.20 2ptl n GLY 29 N -0.69 1.12 3.19 9.14 0.00 -1.23 -5.05 105.19 111.66 2ptl n GLY 29 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 2ptl n GLY 29 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ptl s SER 30 N -0.97 6.44 0.52 1.61 0.01 -1.26 -4.99 113.70 115.06 2ptl s SER 30 Ca 0.00 -3.67 -0.15 0.00 1.31 0.00 0.00 55.95 53.44 2ptl s SER 30 Cb 0.00 -2.01 -0.07 0.00 0.21 0.00 0.00 66.02 64.15 2ptl s SER 30 CO 0.00 -0.22 0.96 0.42 0.41 0.00 0.00 173.24 174.81 2ptl s THR 31 N -1.30 4.60 0.37 1.44 -4.23 -1.26 -3.50 115.64 111.75 2ptl s THR 31 Ca 0.28 1.08 -0.06 0.00 -1.18 0.00 0.00 61.69 61.81 2ptl s THR 31 Cb -0.08 -3.75 0.02 0.00 1.34 0.00 0.00 72.50 70.03 2ptl s THR 31 CO -0.11 -0.75 0.59 -1.10 -0.54 0.00 0.00 174.62 172.71 2ptl s GLN 32 N -4.24 2.08 0.32 3.99 -0.21 0.11 -4.90 119.66 116.81 2ptl s GLN 32 Ca 0.57 -1.71 -0.02 0.00 0.02 0.00 0.00 55.36 54.22 2ptl s GLN 32 Cb -0.10 0.51 -0.01 0.00 1.00 0.00 0.00 33.01 34.41 2ptl s GLN 32 CO 0.35 -0.90 0.42 -0.08 -2.12 0.00 0.00 175.29 172.95 2ptl s THR 33 N -2.66 0.00 0.20 -0.19 -1.32 -1.26 -1.08 115.64 109.32 2ptl s THR 33 Ca 0.26 -1.68 -0.23 0.00 -1.21 0.00 0.00 61.69 58.84 2ptl s THR 33 Cb -0.02 -2.57 0.05 0.00 -1.51 0.00 0.00 72.50 68.45 2ptl s THR 33 CO 0.19 0.00 0.67 0.00 -2.21 0.00 0.00 174.62 173.27 2ptl s ALA 34 N -3.29 -1.47 -0.28 11.08 0.00 -0.09 -4.65 121.76 123.05 2ptl s ALA 34 Ca 0.32 0.21 -0.18 0.00 0.00 0.00 0.00 51.96 52.31 2ptl s ALA 34 Cb 0.01 0.84 0.08 0.00 0.00 0.00 0.00 23.12 24.05 2ptl s ALA 34 CO 0.20 -0.88 0.71 -1.83 0.00 0.00 0.00 175.76 173.96 2ptl s GLU 35 N -3.76 0.73 -0.33 0.00 -1.05 -1.26 -1.48 118.70 111.55 2ptl s GLU 35 Ca 0.05 1.15 -0.02 0.00 -0.15 0.00 0.00 54.97 56.01 2ptl s GLU 35 Cb -0.03 0.20 0.12 0.00 -0.44 0.00 0.00 34.13 33.99 2ptl s GLU 35 CO -0.05 -0.14 0.18 -0.06 0.95 0.00 0.00 175.26 176.14 2ptl s PHE 36 N 1.33 0.55 1.03 4.83 0.40 -1.17 -4.99 117.98 119.96 2ptl s PHE 36 Ca -0.08 -1.32 -0.17 0.00 -0.60 0.00 0.00 56.93 54.76 2ptl s PHE 36 Cb -0.05 -0.90 0.23 0.00 0.51 0.00 0.00 43.02 42.81 2ptl s PHE 36 CO -0.15 -0.83 1.30 -1.59 0.70 0.00 0.00 175.22 174.65 2ptl s LYS 37 N 1.49 0.11 0.00 0.44 0.00 -1.26 -3.75 119.74 116.76 2ptl s LYS 37 Ca 0.14 -0.42 0.00 0.00 0.00 0.00 0.00 55.97 55.69 2ptl s LYS 37 Cb -0.20 -1.79 0.00 0.00 0.00 0.00 0.00 37.83 35.84 2ptl s LYS 37 CO -0.14 -2.77 0.00 0.41 0.00 0.00 0.00 175.35 172.85 2ptl n GLY 38 N -3.31 0.74 0.00 0.59 0.00 -0.96 -4.88 105.19 97.37 2ptl n GLY 38 Ca 0.16 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2ptl n GLY 38 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2ptl n THR 39 N 0.00 0.00 0.00 2.61 -1.04 -1.26 -3.05 114.28 111.54 2ptl n THR 39 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2ptl n THR 39 Cb 0.00 -0.04 0.00 0.00 -1.82 0.00 0.00 70.33 68.47 2ptl n THR 39 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 2ptl n PHE 40 N -0.01 0.00 0.28 -1.42 7.35 -1.26 -4.18 117.46 118.22 2ptl n PHE 40 Ca 0.00 0.00 0.08 0.00 -0.76 0.00 0.00 57.45 56.77 2ptl n PHE 40 Cb 0.00 0.00 0.36 0.00 0.35 0.00 0.00 39.48 40.19 2ptl n PHE 40 CO 0.00 0.00 0.00 -1.91 -0.76 0.00 0.00 176.76 174.09 2ptl n GLU 41 N 0.00 0.09 0.29 -4.13 0.00 -1.26 -1.69 120.64 113.94 2ptl n GLU 41 Ca 0.00 0.44 0.18 0.00 0.00 0.00 0.00 57.16 57.78 2ptl n GLU 41 Cb 0.00 -1.71 0.98 0.00 0.00 0.00 0.00 31.44 30.71 2ptl n GLU 41 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 2ptl h LYS 42 N 0.00 0.00 0.00 5.31 3.11 -1.99 0.29 116.57 123.29 2ptl h LYS 42 Ca 0.00 0.00 -0.17 0.00 -2.81 0.00 0.00 60.65 57.67 2ptl h LYS 42 Cb 0.17 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.37 2ptl h LYS 42 CO 0.00 0.00 -1.37 0.00 -2.81 0.00 0.00 179.45 175.27 2ptl h ALA 43 N 1.90 0.66 -0.73 5.00 0.00 -1.63 -3.31 119.26 121.15 2ptl h ALA 43 Ca 0.02 -0.87 0.15 0.00 0.00 0.00 0.00 54.91 54.21 2ptl h ALA 43 Cb 0.16 0.27 -0.10 0.00 0.00 0.00 0.00 17.79 18.11 2ptl h ALA 43 CO -0.00 0.96 0.22 1.15 0.00 0.00 0.00 179.25 181.58 2ptl h THR 44 N 0.00 0.57 0.21 0.00 2.02 -0.50 0.13 112.91 115.34 2ptl h THR 44 Ca -0.16 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 66.90 2ptl h THR 44 Cb 1.61 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 2ptl h THR 44 CO 0.05 0.06 -0.10 0.28 0.37 0.00 0.00 175.52 176.18 2ptl h SER 45 N 0.33 -0.24 -0.83 4.18 0.02 -1.68 -1.39 113.55 113.95 2ptl h SER 45 Ca 0.41 -0.29 0.24 0.00 -0.84 0.00 0.00 61.79 61.31 2ptl h SER 45 Cb 0.67 0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.24 2ptl h SER 45 CO -0.46 0.24 0.87 -0.08 -1.14 0.00 0.00 176.83 176.26 2ptl h GLU 46 N -0.81 0.00 0.06 3.45 4.81 -1.46 0.56 114.58 121.19 2ptl h GLU 46 Ca -0.03 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.09 2ptl h GLU 46 Cb 0.51 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.90 2ptl h GLU 46 CO 0.05 0.00 -0.50 0.00 -0.73 0.00 0.00 179.01 177.83 2ptl h ALA 47 N 1.04 -0.00 -0.58 2.92 0.00 -0.43 -2.05 119.26 120.16 2ptl h ALA 47 Ca 0.39 -0.67 0.12 0.00 0.00 0.00 0.00 54.91 54.76 2ptl h ALA 47 Cb 2.13 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 20.01 2ptl h ALA 47 CO -0.00 0.25 0.40 -0.92 0.00 0.00 0.00 179.25 178.98 2ptl h TYR 48 N -0.71 0.29 0.00 0.00 5.03 0.12 0.52 116.97 122.22 2ptl h TYR 48 Ca -0.10 0.01 -0.20 0.00 2.58 0.00 0.00 58.73 61.01 2ptl h TYR 48 Cb 1.32 -0.09 -0.03 0.00 1.55 0.00 0.00 36.73 39.48 2ptl h TYR 48 CO 0.22 0.13 -0.99 0.00 -1.32 0.00 0.00 178.16 176.21 2ptl h ALA 49 N 1.71 0.40 -0.29 1.82 0.00 -1.22 -2.09 119.26 119.60 2ptl h ALA 49 Ca 0.27 -0.89 0.04 0.00 0.00 0.00 0.00 54.91 54.33 2ptl h ALA 49 Cb 0.72 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 2ptl h ALA 49 CO -0.06 1.21 0.04 -0.92 0.00 0.00 0.00 179.25 179.52 2ptl h TYR 50 N 0.00 0.06 0.00 0.00 3.20 0.77 -0.51 116.97 120.50 2ptl h TYR 50 Ca -0.02 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 2ptl h TYR 50 Cb 1.74 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 40.03 2ptl h TYR 50 CO 0.00 -0.00 -0.00 0.00 -1.64 0.00 0.00 178.16 176.52 2ptl h ALA 51 N 1.22 1.00 -0.47 1.82 0.00 -1.34 -3.23 119.26 118.26 2ptl h ALA 51 Ca 0.14 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 2ptl h ALA 51 Cb 0.15 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2ptl h ALA 51 CO -0.19 0.00 0.10 0.22 0.00 0.00 0.00 179.25 179.38 2ptl h ASP 52 N 0.00 0.73 0.39 0.00 3.58 -0.40 -1.77 116.42 118.94 2ptl h ASP 52 Ca -0.00 -0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.20 2ptl h ASP 52 Cb 0.95 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.81 2ptl h ASP 52 CO 0.00 0.79 -0.04 0.00 -2.88 0.00 0.00 179.24 177.10 2ptl h THR 53 N 0.64 0.24 -0.24 2.25 1.03 -1.30 -0.59 112.91 114.93 2ptl h THR 53 Ca 0.15 -0.32 0.00 0.00 -0.01 0.00 0.00 66.41 66.22 2ptl h THR 53 Cb 0.35 1.25 0.00 0.00 -1.07 0.00 0.00 68.15 68.69 2ptl h THR 53 CO 0.00 0.04 0.00 -0.11 -0.01 0.00 0.00 175.52 175.45 2ptl n LEU 54 N -3.33 2.84 -3.95 0.00 0.00 -0.67 -4.65 117.00 107.24 2ptl n LEU 54 Ca -0.02 -1.44 -0.42 0.00 0.00 0.00 0.00 56.01 54.13 2ptl n LEU 54 Cb 0.19 -0.55 0.00 0.00 0.00 0.00 0.00 43.42 43.06 2ptl n LEU 54 CO 0.26 0.40 2.39 1.17 0.00 0.00 0.00 177.39 181.62 2ptl n LYS 55 N 0.27 3.05 -0.24 1.96 0.00 -0.23 -4.75 118.16 118.21 2ptl n LYS 55 Ca 0.11 -2.92 -0.02 0.00 0.00 0.00 0.00 58.31 55.48 2ptl n LYS 55 Cb 0.61 -3.27 0.01 0.00 0.00 0.00 0.00 35.03 32.38 2ptl n LYS 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2ptl n LYS 56 N 6.21 1.10 -1.78 1.64 4.76 -1.26 -4.67 118.16 124.17 2ptl n LYS 56 Ca 0.49 -0.23 -0.04 0.00 -2.87 0.00 0.00 58.31 55.66 2ptl n LYS 56 Cb 0.40 -1.09 -0.01 0.00 -1.84 0.00 0.00 35.03 32.49 2ptl n LYS 56 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2ptl n ASP 57 N 0.68 -2.37 0.07 4.39 -0.08 -1.26 -4.91 116.55 113.08 2ptl n ASP 57 Ca 0.05 0.03 0.13 0.00 -1.51 0.00 0.00 54.79 53.48 2ptl n ASP 57 Cb 0.56 -1.30 0.48 0.00 2.34 0.00 0.00 41.12 43.20 2ptl n ASP 57 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2ptl n ASN 58 N 1.31 0.52 0.00 1.67 3.02 -1.26 -4.86 115.26 115.66 2ptl n ASN 58 Ca -0.04 0.55 0.00 0.00 -0.03 0.00 0.00 54.58 55.06 2ptl n ASN 58 Cb 0.41 -0.69 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 2ptl n ASN 58 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ptl n GLY 59 N 1.28 1.34 6.78 7.41 0.00 -1.26 0.17 105.19 120.90 2ptl n GLY 59 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2ptl n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ptl n GLU 60 N -1.07 -0.05 -4.16 1.61 1.02 -1.26 -4.64 120.64 112.09 2ptl n GLU 60 Ca 0.00 0.03 -0.16 0.00 -0.02 0.00 0.00 57.16 57.01 2ptl n GLU 60 Cb 0.00 -0.06 -0.06 0.00 -0.02 0.00 0.00 31.44 31.31 2ptl n GLU 60 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 2ptl s TYR 61 N -0.05 1.33 -0.13 -0.32 -0.85 -1.26 -1.50 117.35 114.56 2ptl s TYR 61 Ca 0.00 -1.44 -0.00 0.00 -0.52 0.00 0.00 57.07 55.11 2ptl s TYR 61 Cb 0.00 -0.32 -0.01 0.00 0.38 0.00 0.00 41.96 42.00 2ptl s TYR 61 CO 0.00 -1.04 -0.13 -0.08 -1.52 0.00 0.00 175.55 172.78 2ptl s THR 62 N -3.19 3.00 -0.22 -3.49 -1.32 -0.88 -4.88 115.64 104.65 2ptl s THR 62 Ca 0.34 -0.68 -0.29 0.00 -1.21 0.00 0.00 61.69 59.86 2ptl s THR 62 Cb 0.01 -2.26 0.00 0.00 -1.51 0.00 0.00 72.50 68.74 2ptl s THR 62 CO 0.23 0.52 1.10 0.54 -2.21 0.00 0.00 174.62 174.80 2ptl s VAL 63 N 0.44 4.57 0.90 5.08 0.11 -1.26 -3.02 120.40 127.21 2ptl s VAL 63 Ca -0.10 1.89 -0.14 0.00 -2.93 0.00 0.00 61.98 60.69 2ptl s VAL 63 Cb -0.16 -4.24 0.15 0.00 -1.53 0.00 0.00 36.38 30.60 2ptl s VAL 63 CO 0.05 -0.20 1.26 -0.62 -3.33 0.00 0.00 175.10 172.27 2ptl s ASP 64 N 1.44 3.70 -0.29 3.54 2.15 -1.08 -4.88 116.67 121.25 2ptl s ASP 64 Ca 0.47 0.48 0.01 0.00 0.43 0.00 0.00 52.55 53.94 2ptl s ASP 64 Cb -0.16 -0.71 0.15 0.00 -0.30 0.00 0.00 42.92 41.90 2ptl s ASP 64 CO 0.09 -2.39 0.37 -0.69 -0.17 0.00 0.00 175.17 172.38 2ptl s VAL 65 N -3.76 -0.56 0.14 1.11 1.01 -1.26 -4.13 120.40 112.95 2ptl s VAL 65 Ca 0.69 -0.34 -0.01 0.00 0.00 0.00 0.00 61.98 62.31 2ptl s VAL 65 Cb -0.07 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2ptl s VAL 65 CO 0.51 -0.33 0.07 0.00 0.00 0.00 0.00 175.10 175.35 2ptl s ALA 66 N 2.49 0.83 -0.32 5.51 0.00 -0.62 -4.69 121.76 124.95 2ptl s ALA 66 Ca 0.10 -1.45 -0.01 0.00 0.00 0.00 0.00 51.96 50.59 2ptl s ALA 66 Cb -0.13 0.89 0.00 0.00 0.00 0.00 0.00 23.12 23.88 2ptl s ALA 66 CO -0.30 -0.50 0.18 -3.47 0.00 0.00 0.00 175.76 171.66 2ptl n ASP 67 N -0.11 -2.67 0.00 0.00 2.03 -1.26 -0.96 116.55 113.58 2ptl n ASP 67 Ca -0.05 -0.08 0.00 0.00 0.52 0.00 0.00 54.79 55.18 2ptl n ASP 67 Cb 0.64 -1.47 0.00 0.00 -0.72 0.00 0.00 41.12 39.57 2ptl n ASP 67 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 2ptl n LYS 68 N -1.46 0.00 0.00 -0.67 2.85 -1.26 -3.33 118.16 114.29 2ptl n LYS 68 Ca -0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 2ptl n LYS 68 Cb 0.52 -1.76 0.00 0.00 -0.65 0.00 0.00 35.03 33.14 2ptl n LYS 68 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2ptl n GLY 69 N -2.00 1.14 0.13 2.58 0.00 -1.14 -4.99 105.19 100.92 2ptl n GLY 69 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 2ptl n GLY 69 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2ptl n TYR 70 N -1.45 0.86 -2.68 1.61 9.36 -1.13 -4.80 117.16 118.92 2ptl n TYR 70 Ca 0.00 0.22 -0.41 0.00 3.32 0.00 0.00 57.90 61.03 2ptl n TYR 70 Cb 0.00 -1.11 -0.05 0.00 -0.63 0.00 0.00 39.34 37.55 2ptl n TYR 70 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 2ptl s THR 71 N -2.52 4.20 -0.21 2.97 2.01 -0.13 -4.14 115.64 117.83 2ptl s THR 71 Ca -0.27 1.97 -0.04 0.00 0.31 0.00 0.00 61.69 63.66 2ptl s THR 71 Cb 0.08 -4.25 0.07 0.00 0.01 0.00 0.00 72.50 68.40 2ptl s THR 71 CO 0.68 0.37 0.07 -1.48 -0.69 0.00 0.00 174.62 173.58 2ptl s LEU 72 N -0.52 0.90 -0.76 4.42 0.05 -0.93 -1.59 118.68 120.25 2ptl s LEU 72 Ca 0.45 -0.87 -0.26 0.00 0.05 0.00 0.00 54.13 53.50 2ptl s LEU 72 Cb -0.26 -0.46 0.03 0.00 -2.05 0.00 0.00 46.19 43.45 2ptl s LEU 72 CO 0.32 -0.35 1.37 0.21 -0.55 0.00 0.00 176.35 177.35 2ptl s ASN 73 N 1.97 6.10 -0.62 1.48 3.04 -1.26 -2.71 114.94 122.94 2ptl s ASN 73 Ca 0.02 -0.49 -0.28 0.00 0.04 0.00 0.00 52.86 52.16 2ptl s ASN 73 Cb -0.17 -2.56 0.02 0.00 -1.54 0.00 0.00 41.25 37.01 2ptl s ASN 73 CO -0.13 -1.87 1.30 -0.63 -3.04 0.00 0.00 177.10 172.73 2ptl s ILE 74 N 6.04 3.85 -0.29 -5.21 1.01 -0.22 -2.62 121.20 123.76 2ptl s ILE 74 Ca 0.40 0.68 -0.10 0.00 0.00 0.00 0.00 60.65 61.63 2ptl s ILE 74 Cb -0.08 -4.68 -0.03 0.00 0.01 0.00 0.00 42.46 37.69 2ptl s ILE 74 CO 0.13 -1.42 0.16 -0.54 0.00 0.00 0.00 174.94 173.27 2ptl s LYS 75 N 5.39 3.65 0.18 2.79 -0.14 -1.17 -2.40 119.74 128.04 2ptl s LYS 75 Ca 0.44 -0.51 -0.30 0.00 -1.36 0.00 0.00 55.97 54.24 2ptl s LYS 75 Cb -0.09 -3.59 -0.08 0.00 -1.68 0.00 0.00 37.83 32.39 2ptl s LYS 75 CO 0.22 -0.29 0.93 -0.06 -0.76 0.00 0.00 175.35 175.39 2ptl s PHE 76 N 1.69 3.91 0.00 3.18 0.40 -0.53 -2.06 117.98 124.56 2ptl s PHE 76 Ca 0.06 1.84 0.00 0.00 -0.60 0.00 0.00 56.93 58.23 2ptl s PHE 76 Cb -0.16 -2.99 0.00 0.00 0.51 0.00 0.00 43.02 40.38 2ptl s PHE 76 CO 0.08 0.36 0.00 0.00 0.70 0.00 0.00 175.22 176.37 2ptl n ALA 77 N 2.02 0.00 -0.94 5.36 0.00 -0.56 -3.93 120.51 122.45 2ptl n ALA 77 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2ptl n ALA 77 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2ptl n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91