#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ptl n ASN 2 N 0.00 -3.87 -4.06 1.62 2.85 -1.26 -5.08 115.26 105.46 2ptl n ASN 2 Ca 0.00 0.18 -0.17 0.00 -0.11 0.00 0.00 54.58 54.49 2ptl n ASN 2 Cb 0.00 -2.38 -0.13 0.00 1.24 0.00 0.00 39.78 38.51 2ptl n ASN 2 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 2ptl s LYS 3 N -1.45 0.66 -0.45 1.20 1.02 -1.26 -5.03 119.74 114.43 2ptl s LYS 3 Ca 0.07 -0.58 0.04 0.00 0.02 0.00 0.00 55.97 55.53 2ptl s LYS 3 Cb -0.02 -0.58 0.56 0.00 -0.52 0.00 0.00 37.83 37.27 2ptl s LYS 3 CO 0.24 0.14 1.78 -0.85 -0.92 0.00 0.00 175.35 175.75 2ptl n GLU 4 N 2.10 2.35 -2.88 1.68 -0.00 -1.26 -4.98 120.64 117.65 2ptl n GLU 4 Ca -0.18 -3.21 -0.01 0.00 -0.00 0.00 0.00 57.16 53.76 2ptl n GLU 4 Cb 0.56 -2.12 -0.01 0.00 -0.00 0.00 0.00 31.44 29.86 2ptl n GLU 4 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2ptl n GLU 5 N -1.06 -2.55 0.00 3.44 2.13 -1.26 -4.93 120.64 116.41 2ptl n GLU 5 Ca 0.53 2.17 0.10 0.00 0.66 0.00 0.00 57.16 60.63 2ptl n GLU 5 Cb 1.23 -3.49 0.07 0.00 0.27 0.00 0.00 31.44 29.52 2ptl n GLU 5 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 2ptl n THR 6 N 1.34 0.00 0.32 6.31 5.66 -1.26 -4.40 114.28 122.24 2ptl n THR 6 Ca -0.09 -0.46 0.21 0.00 -3.05 0.00 0.00 64.05 60.66 2ptl n THR 6 Cb 0.27 1.40 1.10 0.00 -1.55 0.00 0.00 70.33 71.55 2ptl n THR 6 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2ptl h PRO 7 N 3.74 0.00 -6.66 1.09 0.14 -2.05 -3.42 132.00 124.84 2ptl h PRO 7 Ca 0.00 0.00 -0.52 0.00 0.14 0.00 0.00 66.00 65.62 2ptl h PRO 7 Cb 0.83 0.00 0.06 0.00 0.14 0.00 0.00 31.00 32.03 2ptl h PRO 7 CO 0.00 0.00 0.99 -1.21 0.14 0.00 0.00 178.00 177.92 2ptl s GLU 8 N -4.03 4.14 0.02 0.86 8.01 -1.26 -4.96 118.70 121.48 2ptl s GLU 8 Ca -0.04 2.58 -0.29 0.00 0.01 0.00 0.00 54.97 57.23 2ptl s GLU 8 Cb 0.12 -3.08 0.10 0.00 -4.31 0.00 0.00 34.13 26.96 2ptl s GLU 8 CO 0.41 -0.72 0.98 0.95 0.01 0.00 0.00 175.26 176.88 2ptl s THR 9 N 1.07 0.00 0.00 3.63 -4.23 -1.26 -5.17 115.64 109.68 2ptl s THR 9 Ca 0.73 -0.21 0.00 0.00 -1.18 0.00 0.00 61.69 61.03 2ptl s THR 9 Cb -0.49 -1.37 0.00 0.00 1.34 0.00 0.00 72.50 71.98 2ptl s THR 9 CO 0.33 0.00 0.00 -2.65 -0.54 0.00 0.00 174.62 171.76 2ptl n PRO 10 N -0.31 0.42 0.00 3.99 -0.02 -1.26 -5.01 135.00 132.80 2ptl n PRO 10 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 2ptl n PRO 10 Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.09 2ptl n PRO 10 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2ptl n GLU 11 N -0.39 0.00 -1.85 -0.52 2.13 -1.26 -5.14 120.64 113.60 2ptl n GLU 11 Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 2ptl n GLU 11 Cb 0.00 0.00 0.20 0.00 0.27 0.00 0.00 31.44 31.91 2ptl n GLU 11 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2ptl s THR 12 N -0.62 1.95 0.00 6.31 -4.23 -1.26 -3.80 115.64 114.00 2ptl s THR 12 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 2ptl s THR 12 Cb 0.00 -2.95 0.00 0.00 1.34 0.00 0.00 72.50 70.89 2ptl s THR 12 CO 0.00 0.00 0.00 -0.90 -0.54 0.00 0.00 174.62 173.18 2ptl n ASP 13 N -3.93 0.00 -2.32 3.99 5.68 -1.26 -4.51 116.55 114.20 2ptl n ASP 13 Ca 0.16 0.00 -0.17 0.00 -0.50 0.00 0.00 54.79 54.28 2ptl n ASP 13 Cb 0.59 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.60 2ptl n ASP 13 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2ptl n SER 14 N 2.24 3.82 -3.99 -1.12 3.41 -1.26 -4.92 113.62 111.80 2ptl n SER 14 Ca 0.00 -3.21 -0.43 0.00 -0.26 0.00 0.00 58.87 54.97 2ptl n SER 14 Cb 0.00 -0.40 0.01 0.00 -0.26 0.00 0.00 64.21 63.56 2ptl n SER 14 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2ptl n GLU 15 N -0.63 4.51 -3.59 4.33 0.00 -1.25 -4.95 120.64 119.06 2ptl n GLU 15 Ca 0.32 -4.55 -0.05 0.00 0.00 0.00 0.00 57.16 52.88 2ptl n GLU 15 Cb 0.89 -2.52 -0.03 0.00 0.00 0.00 0.00 31.44 29.79 2ptl n GLU 15 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.13 175.30 2ptl s GLU 16 N -2.80 0.35 0.00 5.31 1.03 -1.26 -5.02 118.70 116.31 2ptl s GLU 16 Ca 0.31 -0.08 0.00 0.00 0.03 0.00 0.00 54.97 55.23 2ptl s GLU 16 Cb 0.05 0.16 0.00 0.00 -0.80 0.00 0.00 34.13 33.55 2ptl s GLU 16 CO 0.10 -0.14 0.00 0.39 -1.33 0.00 0.00 175.26 174.28 2ptl n GLU 17 N 0.07 0.00 -0.50 -4.83 1.02 -1.26 -5.00 120.64 110.14 2ptl n GLU 17 Ca -0.02 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2ptl n GLU 17 Cb 0.59 -0.46 0.00 0.00 -0.02 0.00 0.00 31.44 31.55 2ptl n GLU 17 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2ptl n VAL 18 N -1.31 0.00 -3.64 2.62 0.31 -1.00 -4.94 118.33 110.37 2ptl n VAL 18 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 2ptl n VAL 18 Cb 0.00 -1.20 -0.07 0.00 -0.91 0.00 0.00 33.84 31.67 2ptl n VAL 18 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2ptl s THR 19 N 0.98 -0.14 0.52 2.52 2.01 -1.26 -3.07 115.64 117.19 2ptl s THR 19 Ca 0.00 0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.05 2ptl s THR 19 Cb 0.00 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.53 2ptl s THR 19 CO 0.00 0.00 0.31 -0.51 -0.69 0.00 0.00 174.62 173.73 2ptl s ILE 20 N 1.81 1.71 -0.29 1.82 2.07 -1.26 -4.97 121.20 122.10 2ptl s ILE 20 Ca -0.09 -1.59 -0.12 0.00 -1.41 0.00 0.00 60.65 57.44 2ptl s ILE 20 Cb -0.06 -2.30 0.12 0.00 0.13 0.00 0.00 42.46 40.35 2ptl s ILE 20 CO -0.20 0.00 0.69 -0.75 -1.91 0.00 0.00 174.94 172.77 2ptl s LYS 21 N -4.16 0.59 -0.26 3.50 2.20 -1.26 -4.10 119.74 116.25 2ptl s LYS 21 Ca 0.31 1.34 0.02 0.00 -0.36 0.00 0.00 55.97 57.28 2ptl s LYS 21 Cb -0.01 0.65 0.07 0.00 -1.51 0.00 0.00 37.83 37.02 2ptl s LYS 21 CO 0.19 -0.18 -0.07 0.00 -0.36 0.00 0.00 175.35 174.93 2ptl s ALA 22 N 2.52 2.39 0.84 3.13 0.00 -1.23 -1.44 121.76 127.97 2ptl s ALA 22 Ca -0.07 -1.73 -0.12 0.00 0.00 0.00 0.00 51.96 50.04 2ptl s ALA 22 Cb -0.10 -1.59 0.12 0.00 0.00 0.00 0.00 23.12 21.55 2ptl s ALA 22 CO -0.19 -1.27 1.20 -0.80 0.00 0.00 0.00 175.76 174.70 2ptl s ASN 23 N 1.18 4.11 -0.40 0.00 0.01 -0.77 0.51 114.94 119.58 2ptl s ASN 23 Ca -0.05 0.55 0.03 0.00 -0.71 0.00 0.00 52.86 52.68 2ptl s ASN 23 Cb -0.19 -0.92 0.16 0.00 0.41 0.00 0.00 41.25 40.71 2ptl s ASN 23 CO -0.06 -2.12 0.36 -0.76 -1.51 0.00 0.00 177.10 173.01 2ptl s LEU 24 N -5.62 0.70 0.26 0.60 1.43 -0.71 -0.99 118.68 114.35 2ptl s LEU 24 Ca 0.66 -2.44 -0.28 0.00 -1.03 0.00 0.00 54.13 51.03 2ptl s LEU 24 Cb -0.09 0.03 -0.09 0.00 0.03 0.00 0.00 46.19 46.08 2ptl s LEU 24 CO 0.50 -0.20 0.92 -0.63 0.23 0.00 0.00 176.35 177.16 2ptl s ILE 25 N 0.63 4.15 0.30 -0.59 1.09 -0.82 -1.14 121.20 124.82 2ptl s ILE 25 Ca 0.26 1.95 0.06 0.00 -1.10 0.00 0.00 60.65 61.83 2ptl s ILE 25 Cb -0.06 -4.20 -0.06 0.00 -1.06 0.00 0.00 42.46 37.07 2ptl s ILE 25 CO -0.10 0.39 -0.03 -0.36 -0.10 0.00 0.00 174.94 174.73 2ptl s PHE 26 N -1.32 1.99 -1.04 3.97 0.40 -1.24 -2.16 117.98 118.58 2ptl s PHE 26 Ca 0.43 -0.75 0.28 0.00 -0.60 0.00 0.00 56.93 56.30 2ptl s PHE 26 Cb -0.23 -1.19 1.06 0.00 0.51 0.00 0.00 43.02 43.16 2ptl s PHE 26 CO 0.29 0.24 1.80 0.00 0.70 0.00 0.00 175.22 178.24 2ptl n ALA 27 N -0.63 2.67 -1.82 5.36 0.00 -1.26 -3.98 120.51 120.85 2ptl n ALA 27 Ca -0.05 -0.17 -0.39 0.00 0.00 0.00 0.00 53.44 52.83 2ptl n ALA 27 Cb 0.64 -1.37 0.04 0.00 0.00 0.00 0.00 19.45 18.76 2ptl n ALA 27 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2ptl n ASN 28 N -1.47 7.54 -2.02 0.00 2.04 -1.26 -4.81 115.26 115.27 2ptl n ASN 28 Ca 0.07 -3.82 -0.03 0.00 -0.44 0.00 0.00 54.58 50.36 2ptl n ASN 28 Cb 0.33 -1.06 -0.01 0.00 -2.53 0.00 0.00 39.78 36.52 2ptl n ASN 28 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2ptl n GLY 29 N -0.56 -0.23 2.69 4.83 0.00 -1.26 -4.79 105.19 105.87 2ptl n GLY 29 Ca 0.55 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.26 2ptl n GLY 29 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ptl n SER 30 N -0.85 4.10 -4.80 1.61 2.88 -1.26 -5.04 113.62 110.26 2ptl n SER 30 Ca -0.04 -3.36 -0.35 0.00 -1.33 0.00 0.00 58.87 53.80 2ptl n SER 30 Cb 0.39 -0.83 -0.06 0.00 -0.75 0.00 0.00 64.21 62.95 2ptl n SER 30 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2ptl s THR 31 N -2.20 4.26 0.08 2.46 -4.23 -1.26 -3.64 115.64 111.11 2ptl s THR 31 Ca 0.34 1.58 0.00 0.00 -1.18 0.00 0.00 61.69 62.43 2ptl s THR 31 Cb 0.07 -3.74 -0.00 0.00 1.34 0.00 0.00 72.50 70.17 2ptl s THR 31 CO -0.04 -0.14 0.09 0.00 -0.54 0.00 0.00 174.62 174.00 2ptl n GLN 32 N -0.21 0.14 -3.65 3.99 1.13 -0.30 -4.95 117.38 113.53 2ptl n GLN 32 Ca 0.05 -0.68 -0.11 0.00 -1.94 0.00 0.00 57.00 54.33 2ptl n GLN 32 Cb 0.52 0.61 -0.05 0.00 0.11 0.00 0.00 30.24 31.43 2ptl n GLN 32 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 2ptl s THR 33 N -2.44 0.07 0.35 5.09 -1.32 -1.26 -1.74 115.64 114.39 2ptl s THR 33 Ca 0.07 -0.57 0.09 0.00 -1.21 0.00 0.00 61.69 60.08 2ptl s THR 33 Cb 0.00 -1.10 -0.06 0.00 -1.51 0.00 0.00 72.50 69.82 2ptl s THR 33 CO 0.05 -0.31 -0.07 0.00 -2.21 0.00 0.00 174.62 172.08 2ptl s ALA 34 N -3.37 3.01 -0.30 11.08 0.00 0.18 -4.81 121.76 127.56 2ptl s ALA 34 Ca 0.00 -2.08 -0.05 0.00 0.00 0.00 0.00 51.96 49.83 2ptl s ALA 34 Cb 0.01 -0.09 0.17 0.00 0.00 0.00 0.00 23.12 23.21 2ptl s ALA 34 CO -0.09 0.07 0.64 -1.83 0.00 0.00 0.00 175.76 174.55 2ptl s GLU 35 N -3.63 0.55 -0.37 0.00 1.03 -1.26 -3.51 118.70 111.51 2ptl s GLU 35 Ca 0.33 1.13 0.02 0.00 0.03 0.00 0.00 54.97 56.48 2ptl s GLU 35 Cb 0.02 0.65 0.15 0.00 -0.80 0.00 0.00 34.13 34.15 2ptl s GLU 35 CO 0.17 -0.45 0.31 -0.59 -1.33 0.00 0.00 175.26 173.36 2ptl s PHE 36 N 2.87 0.23 0.88 4.83 -0.12 -1.26 -5.06 117.98 120.35 2ptl s PHE 36 Ca 0.11 -1.30 -0.13 0.00 -0.05 0.00 0.00 56.93 55.56 2ptl s PHE 36 Cb -0.14 -0.65 0.13 0.00 -0.63 0.00 0.00 43.02 41.73 2ptl s PHE 36 CO -0.20 -0.90 1.19 0.15 -0.05 0.00 0.00 175.22 175.41 2ptl s LYS 37 N 1.14 1.38 0.00 1.99 1.02 -1.26 -4.01 119.74 119.99 2ptl s LYS 37 Ca 0.19 0.06 0.00 0.00 0.02 0.00 0.00 55.97 56.24 2ptl s LYS 37 Cb -0.17 -1.89 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 2ptl s LYS 37 CO -0.02 -1.99 0.00 0.41 -0.92 0.00 0.00 175.35 172.83 2ptl n GLY 38 N -3.02 0.29 0.00 -3.33 0.00 -1.17 -4.90 105.19 93.05 2ptl n GLY 38 Ca 0.09 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2ptl n GLY 38 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2ptl n THR 39 N 0.00 0.00 0.00 2.61 5.66 -1.26 -2.39 114.28 118.90 2ptl n THR 39 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2ptl n THR 39 Cb 0.00 -0.25 0.00 0.00 -1.55 0.00 0.00 70.33 68.53 2ptl n THR 39 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 2ptl n PHE 40 N 0.00 0.00 0.32 1.09 7.35 -1.26 -4.38 117.46 120.57 2ptl n PHE 40 Ca 0.00 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 56.84 2ptl n PHE 40 Cb 0.00 0.00 0.58 0.00 0.35 0.00 0.00 39.48 40.41 2ptl n PHE 40 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 2ptl h GLU 41 N 0.00 0.00 -0.89 -4.13 4.81 -1.98 -2.84 114.58 109.55 2ptl h GLU 41 Ca 0.00 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 2ptl h GLU 41 Cb 0.00 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 2ptl h GLU 41 CO 0.00 0.00 0.58 -0.22 -0.73 0.00 0.00 179.01 178.64 2ptl h LYS 42 N 0.00 0.91 0.00 1.92 3.64 -2.00 0.28 116.57 121.31 2ptl h LYS 42 Ca 0.00 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.24 2ptl h LYS 42 Cb 0.53 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2ptl h LYS 42 CO 0.00 0.60 -0.39 0.00 -2.27 0.00 0.00 179.45 177.39 2ptl h ALA 43 N 1.54 1.16 -0.73 5.00 0.00 -1.81 -2.62 119.26 121.79 2ptl h ALA 43 Ca 0.40 -0.36 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2ptl h ALA 43 Cb 0.32 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 2ptl h ALA 43 CO -0.16 0.49 0.44 0.00 0.00 0.00 0.00 179.25 180.02 2ptl h THR 44 N 0.00 1.04 0.17 0.00 1.03 -0.54 0.26 112.91 114.87 2ptl h THR 44 Ca -0.00 -0.29 -0.01 0.00 -0.01 0.00 0.00 66.41 66.10 2ptl h THR 44 Cb 0.79 0.14 0.00 0.00 -1.07 0.00 0.00 68.15 68.01 2ptl h THR 44 CO 0.05 0.15 -0.08 0.77 -0.01 0.00 0.00 175.52 176.40 2ptl h SER 45 N 0.83 -0.19 -0.38 0.00 4.64 -1.32 -0.13 113.55 117.01 2ptl h SER 45 Ca 0.31 -0.35 0.11 0.00 -0.47 0.00 0.00 61.79 61.39 2ptl h SER 45 Cb 0.11 0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 2ptl h SER 45 CO -0.15 0.33 0.55 -0.33 -0.87 0.00 0.00 176.83 176.36 2ptl h GLU 46 N -0.79 0.00 0.23 4.77 4.39 -1.22 0.82 114.58 122.78 2ptl h GLU 46 Ca -0.02 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.36 2ptl h GLU 46 Cb 0.53 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.21 2ptl h GLU 46 CO 0.04 0.00 -1.41 0.00 -1.16 0.00 0.00 179.01 176.48 2ptl h ALA 47 N 1.26 -0.10 -0.20 3.43 0.00 -0.08 -2.45 119.26 121.12 2ptl h ALA 47 Ca 0.18 -0.88 0.05 0.00 0.00 0.00 0.00 54.91 54.26 2ptl h ALA 47 Cb 1.28 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 2ptl h ALA 47 CO -0.00 0.68 0.14 -0.92 0.00 0.00 0.00 179.25 179.15 2ptl h TYR 48 N 0.04 0.05 0.00 0.00 3.20 0.25 0.35 116.97 120.86 2ptl h TYR 48 Ca -0.25 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.43 2ptl h TYR 48 Cb 2.07 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 40.29 2ptl h TYR 48 CO 0.14 0.03 -0.90 0.00 -1.64 0.00 0.00 178.16 175.78 2ptl h ALA 49 N 1.90 0.45 -0.57 1.82 0.00 -1.19 -2.08 119.26 119.59 2ptl h ALA 49 Ca 0.09 -0.81 0.01 0.00 0.00 0.00 0.00 54.91 54.20 2ptl h ALA 49 Cb 0.30 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2ptl h ALA 49 CO -0.01 1.10 0.36 -0.92 0.00 0.00 0.00 179.25 179.79 2ptl h TYR 50 N 0.00 0.69 0.02 0.00 3.20 0.18 -0.99 116.97 120.07 2ptl h TYR 50 Ca -0.02 0.02 -0.23 0.00 3.14 0.00 0.00 58.73 61.64 2ptl h TYR 50 Cb 1.68 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.72 2ptl h TYR 50 CO 0.00 0.42 -0.98 0.00 -1.64 0.00 0.00 178.16 175.96 2ptl h ALA 51 N 1.22 0.35 -0.56 1.82 0.00 -1.38 -3.01 119.26 117.70 2ptl h ALA 51 Ca 0.22 -0.73 0.02 0.00 0.00 0.00 0.00 54.91 54.41 2ptl h ALA 51 Cb -0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2ptl h ALA 51 CO -0.07 0.85 0.37 0.22 0.00 0.00 0.00 179.25 180.62 2ptl h ASP 52 N 0.19 0.59 1.85 0.00 1.82 -0.85 0.25 116.42 120.28 2ptl h ASP 52 Ca -0.08 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.55 2ptl h ASP 52 Cb 1.62 -0.14 0.00 0.00 0.68 0.00 0.00 39.33 41.49 2ptl h ASP 52 CO 0.17 0.41 0.00 0.74 -1.61 0.00 0.00 179.24 178.95 2ptl h THR 53 N 0.69 0.00 -0.55 2.25 2.02 -1.18 -3.14 112.91 113.00 2ptl h THR 53 Ca 0.22 -0.90 -0.28 0.00 0.77 0.00 0.00 66.41 66.21 2ptl h THR 53 Cb 0.02 1.90 -0.17 0.00 -1.74 0.00 0.00 68.15 68.16 2ptl h THR 53 CO -0.05 0.00 0.36 0.18 0.37 0.00 0.00 175.52 176.37 2ptl n LEU 54 N -3.02 5.04 -2.37 2.58 4.77 0.07 -4.46 117.00 119.62 2ptl n LEU 54 Ca 0.04 -2.65 -0.30 0.00 -0.03 0.00 0.00 56.01 53.07 2ptl n LEU 54 Cb 0.50 -0.69 0.03 0.00 -2.33 0.00 0.00 43.42 40.93 2ptl n LEU 54 CO 0.33 0.80 1.44 1.17 -1.33 0.00 0.00 177.39 179.79 2ptl n LYS 55 N -0.39 2.41 -0.21 3.23 0.00 -1.19 -4.71 118.16 117.30 2ptl n LYS 55 Ca 0.33 -2.70 -0.06 0.00 0.00 0.00 0.00 58.31 55.87 2ptl n LYS 55 Cb 1.14 -2.08 -0.01 0.00 0.00 0.00 0.00 35.03 34.08 2ptl n LYS 55 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2ptl h LYS 56 N 2.26 -0.18 0.00 1.64 6.56 -1.90 -3.40 116.57 121.55 2ptl h LYS 56 Ca 0.48 0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 60.05 2ptl h LYS 56 Cb 0.66 0.04 -0.02 0.00 -0.57 0.00 0.00 32.23 32.33 2ptl h LYS 56 CO 1.21 -0.12 -0.05 -3.47 -2.06 0.00 0.00 179.45 174.96 2ptl n ASP 57 N -5.42 -0.22 0.15 0.86 -0.08 -1.26 -4.99 116.55 105.58 2ptl n ASP 57 Ca 0.03 -0.87 0.04 0.00 -1.51 0.00 0.00 54.79 52.48 2ptl n ASP 57 Cb 0.35 0.09 0.04 0.00 2.34 0.00 0.00 41.12 43.95 2ptl n ASP 57 CO 0.00 0.00 0.00 0.78 0.12 0.00 0.00 177.20 178.10 2ptl h ASN 58 N 0.10 0.00 0.00 1.67 2.35 -1.86 -3.47 115.58 114.37 2ptl h ASN 58 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2ptl h ASN 58 Cb 0.89 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.26 2ptl h ASN 58 CO -0.04 0.44 0.00 0.61 -1.65 0.00 0.00 177.43 176.79 2ptl n GLY 59 N 1.21 1.51 0.21 2.83 0.00 -1.26 -3.83 105.19 105.86 2ptl n GLY 59 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.94 -0.43 -3.66 1.61 1.02 -1.26 -4.49 120.64 112.48 2ptl n GLU 60 Ca 0.00 0.29 -0.11 0.00 -0.02 0.00 0.00 57.16 57.32 2ptl n GLU 60 Cb 0.00 -0.53 -0.05 0.00 -0.02 0.00 0.00 31.44 30.84 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 -1.29 -0.21 -0.21 -0.32 -0.85 -1.26 -2.13 117.35 111.08 2ptl s TYR 61 Ca 0.00 0.01 -0.07 0.00 -0.52 0.00 0.00 57.07 56.49 2ptl s TYR 61 Cb 0.00 0.23 -0.04 0.00 0.38 0.00 0.00 41.96 42.53 2ptl s TYR 61 CO 0.00 -0.64 0.07 0.99 -1.52 0.00 0.00 175.55 174.45 2ptl s THR 62 N -3.22 4.59 0.09 -3.49 2.01 -0.64 -4.96 115.64 110.03 2ptl s THR 62 Ca -0.01 -0.09 -0.30 0.00 0.31 0.00 0.00 61.69 61.60 2ptl s THR 62 Cb 0.01 -3.10 -0.05 0.00 0.01 0.00 0.00 72.50 69.36 2ptl s THR 62 CO -0.08 0.40 1.01 0.54 -0.69 0.00 0.00 174.62 175.80 2ptl s VAL 63 N 0.95 4.44 0.17 3.82 0.11 -1.26 -3.41 120.40 125.22 2ptl s VAL 63 Ca 0.04 1.95 -0.04 0.00 -2.93 0.00 0.00 61.98 61.00 2ptl s VAL 63 Cb -0.14 -4.24 -0.05 0.00 -1.53 0.00 0.00 36.38 30.41 2ptl s VAL 63 CO 0.03 0.26 0.40 -1.81 -3.33 0.00 0.00 175.10 170.65 2ptl s ASP 64 N 0.29 6.46 -0.32 3.54 1.11 -1.10 -4.98 116.67 121.67 2ptl s ASP 64 Ca 0.49 0.56 -0.04 0.00 0.18 0.00 0.00 52.55 53.75 2ptl s ASP 64 Cb -0.24 -2.08 0.05 0.00 1.07 0.00 0.00 42.92 41.72 2ptl s ASP 64 CO 0.30 0.01 0.05 -0.69 1.18 0.00 0.00 175.17 176.02 2ptl s VAL 65 N -1.75 3.31 0.05 -1.27 1.01 -1.26 -3.61 120.40 116.87 2ptl s VAL 65 Ca 0.41 -1.33 -0.00 0.00 0.00 0.00 0.00 61.98 61.05 2ptl s VAL 65 Cb -0.12 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 2ptl s VAL 65 CO 0.26 -0.17 -0.04 0.00 0.00 0.00 0.00 175.10 175.15 2ptl s ALA 66 N 1.30 0.51 -0.69 5.51 0.00 -0.79 -4.71 121.76 122.89 2ptl s ALA 66 Ca -0.03 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.85 2ptl s ALA 66 Cb -0.20 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.14 2ptl s ALA 66 CO 0.00 -0.29 0.00 -3.47 0.00 0.00 0.00 175.76 172.01 2ptl n ASP 67 N 0.46 -2.99 0.00 0.00 2.03 -1.26 -1.23 116.55 113.56 2ptl n ASP 67 Ca -0.16 0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.17 2ptl n ASP 67 Cb 0.59 -2.15 0.00 0.00 -0.72 0.00 0.00 41.12 38.84 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 -1.89 0.00 -0.19 -0.67 2.85 -1.26 -3.36 118.16 113.64 2ptl n LYS 68 Ca -0.09 0.33 0.00 0.00 -1.05 0.00 0.00 58.31 57.50 2ptl n LYS 68 Cb 0.53 -3.23 0.00 0.00 -0.65 0.00 0.00 35.03 31.67 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 -2.86 0.61 0.07 2.58 0.00 -1.12 -4.95 105.19 99.52 2ptl n GLY 69 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2ptl n GLY 69 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2ptl h TYR 70 N 0.00 0.00 -3.32 1.61 3.20 -1.54 -3.44 116.97 113.49 2ptl h TYR 70 Ca 0.00 0.00 -0.57 0.00 3.14 0.00 0.00 58.73 61.30 2ptl h TYR 70 Cb 0.00 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.21 2ptl h TYR 70 CO 0.00 0.67 0.85 0.99 -1.64 0.00 0.00 178.16 179.04 2ptl s THR 71 N -2.05 4.48 -0.42 1.81 2.01 -0.36 -4.10 115.64 117.00 2ptl s THR 71 Ca -0.15 1.70 -0.03 0.00 0.31 0.00 0.00 61.69 63.53 2ptl s THR 71 Cb -0.00 -4.41 0.11 0.00 0.01 0.00 0.00 72.50 68.21 2ptl s THR 71 CO 0.42 -0.50 0.22 -0.76 -0.69 0.00 0.00 174.62 173.31 2ptl s LEU 72 N 3.71 5.24 -0.60 4.42 1.43 -0.52 -1.88 118.68 130.48 2ptl s LEU 72 Ca 0.46 -2.10 -0.28 0.00 -1.03 0.00 0.00 54.13 51.18 2ptl s LEU 72 Cb -0.12 -1.83 0.02 0.00 0.03 0.00 0.00 46.19 44.29 2ptl s LEU 72 CO 0.16 -0.53 1.31 0.20 0.23 0.00 0.00 176.35 177.73 2ptl s ASN 73 N 1.72 6.25 -1.04 2.29 0.02 -1.24 -1.86 114.94 121.08 2ptl s ASN 73 Ca 0.09 0.10 -0.23 0.00 -1.02 0.00 0.00 52.86 51.80 2ptl s ASN 73 Cb -0.23 -2.55 0.04 0.00 0.02 0.00 0.00 41.25 38.53 2ptl s ASN 73 CO -0.04 -1.65 1.54 -0.63 0.02 0.00 0.00 177.10 176.34 2ptl s ILE 74 N 5.61 3.89 -0.08 0.60 1.01 -0.16 -2.72 121.20 129.36 2ptl s ILE 74 Ca 0.46 -0.86 -0.24 0.00 0.00 0.00 0.00 60.65 60.01 2ptl s ILE 74 Cb -0.09 -4.96 -0.03 0.00 0.01 0.00 0.00 42.46 37.39 2ptl s ILE 74 CO 0.23 -1.83 0.74 -0.54 0.00 0.00 0.00 174.94 173.54 2ptl s LYS 75 N 5.12 4.42 0.01 2.79 -0.14 -1.22 -1.94 119.74 128.79 2ptl s LYS 75 Ca 0.50 0.94 0.00 0.00 -1.36 0.00 0.00 55.97 56.05 2ptl s LYS 75 Cb -0.00 -3.47 0.00 0.00 -1.68 0.00 0.00 37.83 32.68 2ptl s LYS 75 CO -0.06 -0.00 0.01 1.19 -0.76 0.00 0.00 175.35 175.72 2ptl n PHE 76 N 4.01 -3.16 -0.59 3.18 3.01 -0.92 -1.63 117.46 121.36 2ptl n PHE 76 Ca 0.00 -0.02 0.47 0.00 1.01 0.00 0.00 57.45 58.91 2ptl n PHE 76 Cb 0.51 -0.01 0.76 0.00 -0.01 0.00 0.00 39.48 40.73 2ptl n PHE 76 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ptl h ALA 77 N 0.08 3.37 0.00 4.37 0.00 -1.53 -3.46 119.26 122.10 2ptl h ALA 77 Ca -0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2ptl h ALA 77 Cb 0.01 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2ptl h ALA 77 CO 0.00 -1.99 0.00 0.41 0.00 0.00 0.00 179.25 177.67