#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 -0.49 0.00 -1.84 0.23 -1.26 -5.09 115.26 106.80 2ptl n ASN 2 Ca 0.00 -1.40 0.00 0.00 -0.53 0.00 0.00 54.58 52.65 2ptl n ASN 2 Cb 0.00 0.15 0.00 0.00 -2.08 0.00 0.00 39.78 37.85 2ptl n ASN 2 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 2ptl n LYS 3 N 0.00 0.00 -3.09 -3.83 4.81 -1.26 -4.98 118.16 109.81 2ptl n LYS 3 Ca -0.14 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.12 2ptl n LYS 3 Cb 0.56 0.00 0.04 0.00 0.02 0.00 0.00 35.03 35.66 2ptl n LYS 3 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2ptl n GLU 4 N 0.00 -4.98 -1.53 1.64 -0.58 -1.26 -4.96 120.64 108.97 2ptl n GLU 4 Ca 0.00 0.68 -0.01 0.00 -0.42 0.00 0.00 57.16 57.41 2ptl n GLU 4 Cb 0.00 -5.14 0.00 0.00 -0.57 0.00 0.00 31.44 25.73 2ptl n GLU 4 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2ptl n GLU 5 N -3.64 0.15 -3.62 3.49 4.71 -1.26 -5.17 120.64 115.30 2ptl n GLU 5 Ca -0.04 -0.30 -0.01 0.00 -0.01 0.00 0.00 57.16 56.79 2ptl n GLU 5 Cb 0.57 0.39 -0.04 0.00 -1.01 0.00 0.00 31.44 31.35 2ptl n GLU 5 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 2ptl s THR 6 N -2.76 -0.86 0.00 2.62 2.01 -1.26 -4.99 115.64 110.40 2ptl s THR 6 Ca 0.03 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.03 2ptl s THR 6 Cb -0.01 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.50 2ptl s THR 6 CO 0.02 0.00 0.65 -2.65 -0.69 0.00 0.00 174.62 171.94 2ptl n PRO 7 N 5.30 0.00 0.00 4.92 -0.02 -1.26 -4.90 135.00 139.04 2ptl n PRO 7 Ca -0.12 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 2ptl n PRO 7 Cb 0.50 -1.17 0.00 0.00 -0.02 0.00 0.00 33.50 32.82 2ptl n PRO 7 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2ptl n GLU 8 N -1.12 0.00 0.07 -0.52 0.28 -1.26 -5.05 120.64 113.04 2ptl n GLU 8 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2ptl n GLU 8 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2ptl n GLU 8 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2ptl n THR 9 N 0.00 0.00 0.00 3.84 -2.24 -1.26 -5.14 114.28 109.48 2ptl n THR 9 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2ptl n THR 9 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2ptl n THR 9 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2ptl n PRO 10 N -2.86 1.57 -0.43 -0.78 -0.01 -1.26 -4.73 135.00 126.50 2ptl n PRO 10 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 63.50 63.55 2ptl n PRO 10 Cb 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 33.50 33.48 2ptl n PRO 10 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 175.50 173.58 2ptl n GLU 11 N 0.00 -0.86 -3.52 -0.52 2.13 -1.26 -4.52 120.64 112.08 2ptl n GLU 11 Ca 0.00 0.56 -0.41 0.00 0.66 0.00 0.00 57.16 57.98 2ptl n GLU 11 Cb 0.00 -1.05 -0.05 0.00 0.27 0.00 0.00 31.44 30.61 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 -1.05 4.78 0.00 6.31 -4.23 -1.26 -4.65 115.64 115.54 2ptl s THR 12 Ca 0.00 -3.07 0.00 0.00 -1.18 0.00 0.00 61.69 57.44 2ptl s THR 12 Cb 0.00 -3.98 0.00 0.00 1.34 0.00 0.00 72.50 69.86 2ptl s THR 12 CO 0.00 -1.01 0.53 -0.90 -0.54 0.00 0.00 174.62 172.69 2ptl n ASP 13 N 3.27 -0.49 0.00 3.99 5.75 -1.26 -5.09 116.55 122.72 2ptl n ASP 13 Ca 0.15 -1.06 0.00 0.00 -0.01 0.00 0.00 54.79 53.87 2ptl n ASP 13 Cb 0.41 0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.65 2ptl n ASP 13 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2ptl n SER 14 N 0.00 0.00 -3.98 -1.12 2.88 -1.26 -5.03 113.62 105.11 2ptl n SER 14 Ca -0.14 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.12 2ptl n SER 14 Cb 0.48 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.91 2ptl n SER 14 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2ptl n GLU 15 N 0.00 -2.44 -2.32 -1.46 1.02 -1.26 -3.98 120.64 110.19 2ptl n GLU 15 Ca 0.00 0.34 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 2ptl n GLU 15 Cb 0.00 -4.19 0.00 0.00 -0.02 0.00 0.00 31.44 27.23 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 -4.45 -5.23 -0.04 3.49 -0.58 -1.26 -4.89 120.64 107.69 2ptl n GLU 16 Ca -0.27 3.79 -0.14 0.00 -0.42 0.00 0.00 57.16 60.12 2ptl n GLU 16 Cb 0.67 -4.68 -0.09 0.00 -0.57 0.00 0.00 31.44 26.76 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 4.26 0.20 -5.77 3.49 5.08 -1.90 -3.46 114.58 116.48 2ptl h GLU 17 Ca 0.00 -0.14 -0.60 0.00 -1.00 0.00 0.00 59.36 57.63 2ptl h GLU 17 Cb 0.00 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.19 2ptl h GLU 17 CO 0.00 0.73 -0.39 0.08 -1.00 0.00 0.00 179.01 178.43 2ptl s VAL 18 N -3.92 1.71 -0.30 3.13 1.01 -1.26 -5.01 120.40 115.76 2ptl s VAL 18 Ca -0.15 -1.64 -0.07 0.00 0.00 0.00 0.00 61.98 60.12 2ptl s VAL 18 Cb 0.03 -2.35 0.15 0.00 0.00 0.00 0.00 36.38 34.21 2ptl s VAL 18 CO 0.73 0.00 0.64 -0.89 0.00 0.00 0.00 175.10 175.58 2ptl s THR 19 N -2.75 -0.99 -0.36 3.92 2.01 -1.26 -2.79 115.64 113.42 2ptl s THR 19 Ca 0.30 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 62.26 2ptl s THR 19 Cb -0.00 -1.00 0.07 0.00 0.01 0.00 0.00 72.50 71.58 2ptl s THR 19 CO 0.18 0.00 0.13 -0.51 -0.69 0.00 0.00 174.62 173.72 2ptl s ILE 20 N 2.88 3.38 -0.18 1.82 2.07 -1.24 -4.95 121.20 124.99 2ptl s ILE 20 Ca 0.03 -1.60 -0.09 0.00 -1.41 0.00 0.00 60.65 57.58 2ptl s ILE 20 Cb -0.13 -3.10 -0.05 0.00 0.13 0.00 0.00 42.46 39.32 2ptl s ILE 20 CO -0.20 -0.39 0.12 -0.75 -1.91 0.00 0.00 174.94 171.82 2ptl s LYS 21 N 1.26 3.95 0.00 3.50 2.20 -1.26 -1.68 119.74 127.70 2ptl s LYS 21 Ca 0.01 -0.22 0.00 0.00 -0.36 0.00 0.00 55.97 55.41 2ptl s LYS 21 Cb -0.21 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 32.79 2ptl s LYS 21 CO -0.01 0.42 0.00 0.00 -0.36 0.00 0.00 175.35 175.40 2ptl n ALA 22 N 3.12 0.00 -3.61 3.13 0.00 -0.02 -3.94 120.51 119.19 2ptl n ALA 22 Ca -0.17 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.12 2ptl n ALA 22 Cb 0.53 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.91 2ptl n ALA 22 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2ptl s ASN 23 N -0.77 -0.73 -0.30 0.00 0.01 -1.18 -1.35 114.94 110.63 2ptl s ASN 23 Ca 0.00 1.32 0.02 0.00 -0.71 0.00 0.00 52.86 53.49 2ptl s ASN 23 Cb 0.00 1.30 0.09 0.00 0.41 0.00 0.00 41.25 43.05 2ptl s ASN 23 CO 0.00 -0.31 0.01 -0.76 -1.51 0.00 0.00 177.10 174.54 2ptl s LEU 24 N 0.12 3.62 0.13 0.60 1.43 -0.42 -2.07 118.68 122.09 2ptl s LEU 24 Ca -0.02 -1.74 -0.03 0.00 -1.03 0.00 0.00 54.13 51.31 2ptl s LEU 24 Cb -0.04 -1.37 -0.05 0.00 0.03 0.00 0.00 46.19 44.75 2ptl s LEU 24 CO 0.02 -0.33 0.34 -0.63 0.23 0.00 0.00 176.35 175.98 2ptl s ILE 25 N 1.17 5.23 0.36 -0.59 1.09 -0.82 -1.38 121.20 126.26 2ptl s ILE 25 Ca 0.04 -0.13 0.08 0.00 -1.10 0.00 0.00 60.65 59.55 2ptl s ILE 25 Cb -0.19 -3.64 -0.05 0.00 -1.06 0.00 0.00 42.46 37.52 2ptl s ILE 25 CO -0.10 0.04 0.12 -0.36 -0.10 0.00 0.00 174.94 174.53 2ptl s PHE 26 N -1.65 2.63 -0.09 3.97 0.08 -1.11 -2.91 117.98 118.89 2ptl s PHE 26 Ca 0.39 -0.46 0.14 0.00 0.12 0.00 0.00 56.93 57.12 2ptl s PHE 26 Cb -0.12 -1.70 -0.05 0.00 -0.57 0.00 0.00 43.02 40.59 2ptl s PHE 26 CO 0.26 0.33 1.24 0.00 -0.10 0.00 0.00 175.22 176.95 2ptl h ALA 27 N 1.58 0.61 -0.31 5.36 0.00 -1.80 -3.29 119.26 121.41 2ptl h ALA 27 Ca -0.43 -0.67 -0.09 0.00 0.00 0.00 0.00 54.91 53.71 2ptl h ALA 27 Cb 1.25 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2ptl h ALA 27 CO 0.66 0.85 -0.20 -2.95 0.00 0.00 0.00 179.25 177.61 2ptl h ASN 28 N 0.00 0.57 0.00 0.00 -1.07 -1.91 -3.47 115.58 109.70 2ptl h ASN 28 Ca -0.05 -0.18 0.00 0.00 0.07 0.00 0.00 56.30 56.13 2ptl h ASN 28 Cb 1.53 -0.16 0.00 0.00 -2.07 0.00 0.00 38.32 37.62 2ptl h ASN 28 CO 0.07 0.78 0.00 0.61 0.07 0.00 0.00 177.43 178.96 2ptl n GLY 29 N -0.42 1.23 3.64 9.14 0.00 -1.24 -5.10 105.19 112.44 2ptl n GLY 29 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.65 6.82 0.44 1.61 0.01 -1.26 -4.89 113.70 115.79 2ptl s SER 30 Ca 0.00 1.00 0.07 0.00 1.31 0.00 0.00 55.95 58.33 2ptl s SER 30 Cb 0.00 -2.44 -0.02 0.00 0.21 0.00 0.00 66.02 63.77 2ptl s SER 30 CO 0.00 -0.53 0.29 0.28 0.41 0.00 0.00 173.24 173.69 2ptl s THR 31 N 2.87 2.27 0.30 1.44 -1.32 -1.26 -2.76 115.64 117.17 2ptl s THR 31 Ca 0.35 -1.53 -0.19 0.00 -1.21 0.00 0.00 61.69 59.11 2ptl s THR 31 Cb -0.15 -2.80 0.06 0.00 -1.51 0.00 0.00 72.50 68.10 2ptl s THR 31 CO 0.08 0.00 0.86 0.00 -2.21 0.00 0.00 174.62 173.35 2ptl s GLN 32 N -4.07 1.83 0.40 7.08 -2.07 -0.48 -4.96 119.66 117.40 2ptl s GLN 32 Ca 0.41 -1.15 0.04 0.00 -1.82 0.00 0.00 55.36 52.84 2ptl s GLN 32 Cb 0.00 0.53 -0.03 0.00 -1.09 0.00 0.00 33.01 32.43 2ptl s GLN 32 CO 0.24 -0.85 0.12 0.95 -1.32 0.00 0.00 175.29 174.42 2ptl s THR 33 N -2.58 0.66 0.07 3.63 -4.23 -1.26 -1.31 115.64 110.61 2ptl s THR 33 Ca 0.16 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.63 2ptl s THR 33 Cb -0.04 -2.38 -0.02 0.00 1.34 0.00 0.00 72.50 71.40 2ptl s THR 33 CO 0.08 0.00 0.07 0.00 -0.54 0.00 0.00 174.62 174.23 2ptl s ALA 34 N -3.21 0.20 -0.30 3.99 0.00 -0.46 -4.64 121.76 117.34 2ptl s ALA 34 Ca 0.24 -0.96 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 2ptl s ALA 34 Cb 0.03 0.37 0.18 0.00 0.00 0.00 0.00 23.12 23.70 2ptl s ALA 34 CO 0.14 -0.43 0.65 -2.00 0.00 0.00 0.00 175.76 174.12 2ptl s GLU 35 N -3.90 0.54 -0.55 0.00 2.12 -1.26 -0.84 118.70 114.81 2ptl s GLU 35 Ca 0.06 1.02 0.04 0.00 0.36 0.00 0.00 54.97 56.45 2ptl s GLU 35 Cb 0.07 0.57 0.14 0.00 0.26 0.00 0.00 34.13 35.17 2ptl s GLU 35 CO -0.10 -0.52 0.32 -0.06 -0.54 0.00 0.00 175.26 174.35 2ptl s PHE 36 N 2.86 2.99 0.67 5.30 0.40 -0.68 -4.99 117.98 124.54 2ptl s PHE 36 Ca 0.15 -3.06 -0.11 0.00 -0.60 0.00 0.00 56.93 53.32 2ptl s PHE 36 Cb -0.14 -2.56 -0.01 0.00 0.51 0.00 0.00 43.02 40.82 2ptl s PHE 36 CO -0.20 -0.70 1.05 0.15 0.70 0.00 0.00 175.22 176.22 2ptl s LYS 37 N -0.46 3.17 0.00 0.44 1.02 -1.26 -3.60 119.74 119.04 2ptl s LYS 37 Ca 0.20 0.81 0.00 0.00 0.02 0.00 0.00 55.97 57.00 2ptl s LYS 37 Cb -0.19 -2.03 0.00 0.00 -0.52 0.00 0.00 37.83 35.09 2ptl s LYS 37 CO -0.05 -0.89 0.00 0.41 -0.92 0.00 0.00 175.35 173.90 2ptl n GLY 38 N -2.40 1.37 3.04 -3.33 0.00 -1.12 -4.91 105.19 97.84 2ptl n GLY 38 Ca 0.07 -0.98 -0.19 0.00 0.00 0.00 0.00 46.02 44.91 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 -4.29 114.28 117.00 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 -0.62 0.00 0.00 -1.55 0.00 0.00 70.33 68.16 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 -4.79 0.00 0.66 1.09 7.35 -1.26 -4.70 117.46 115.82 2ptl n PHE 40 Ca 0.09 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.89 2ptl n PHE 40 Cb 0.38 0.00 0.46 0.00 0.35 0.00 0.00 39.48 40.67 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 0.20 -4.13 2.13 -1.26 -2.27 120.64 115.41 2ptl n GLU 41 Ca 0.00 0.20 0.04 0.00 0.66 0.00 0.00 57.16 58.06 2ptl n GLU 41 Cb 0.00 -1.64 0.47 0.00 0.27 0.00 0.00 31.44 30.54 2ptl n GLU 41 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2ptl h LYS 42 N 0.00 0.03 0.00 5.31 1.63 -1.99 0.12 116.57 121.67 2ptl h LYS 42 Ca 0.00 -0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 59.73 2ptl h LYS 42 Cb 0.45 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.07 2ptl h LYS 42 CO 0.00 0.23 -0.31 0.00 -3.45 0.00 0.00 179.45 175.92 2ptl h ALA 43 N 1.77 1.07 -0.69 5.00 0.00 -1.74 -2.72 119.26 121.95 2ptl h ALA 43 Ca 0.00 -0.29 0.07 0.00 0.00 0.00 0.00 54.91 54.70 2ptl h ALA 43 Cb 0.38 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2ptl h ALA 43 CO 0.03 0.39 0.45 1.15 0.00 0.00 0.00 179.25 181.27 2ptl h THR 44 N 0.00 1.01 0.21 0.00 2.02 -0.85 0.43 112.91 115.72 2ptl h THR 44 Ca -0.00 -0.24 -0.32 0.00 0.77 0.00 0.00 66.41 66.62 2ptl h THR 44 Cb 0.77 0.25 0.03 0.00 -1.74 0.00 0.00 68.15 67.47 2ptl h THR 44 CO 0.04 0.13 -1.40 0.28 0.37 0.00 0.00 175.52 174.94 2ptl h SER 45 N 0.69 0.84 0.84 4.18 0.02 -1.51 -1.47 113.55 117.15 2ptl h SER 45 Ca 0.30 -0.86 -0.01 0.00 -0.84 0.00 0.00 61.79 60.38 2ptl h SER 45 Cb 0.29 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 2ptl h SER 45 CO -0.10 1.66 -0.05 -0.08 -1.14 0.00 0.00 176.83 177.12 2ptl h GLU 46 N 0.19 0.00 0.09 3.45 4.81 -1.26 -0.39 114.58 121.45 2ptl h GLU 46 Ca -0.23 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 58.86 2ptl h GLU 46 Cb 2.08 0.00 0.01 0.00 0.63 0.00 0.00 28.75 31.47 2ptl h GLU 46 CO 0.26 0.05 -0.67 0.00 -0.73 0.00 0.00 179.01 177.93 2ptl h ALA 47 N 1.95 -0.01 -0.08 2.92 0.00 -0.12 -0.56 119.26 123.36 2ptl h ALA 47 Ca -0.00 -0.72 0.01 0.00 0.00 0.00 0.00 54.91 54.20 2ptl h ALA 47 Cb 0.49 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2ptl h ALA 47 CO 0.01 0.34 0.06 -0.92 0.00 0.00 0.00 179.25 178.74 2ptl h TYR 48 N -0.60 0.04 0.00 0.00 3.20 -0.94 0.25 116.97 118.93 2ptl h TYR 48 Ca -0.13 0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.56 2ptl h TYR 48 Cb 1.44 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.67 2ptl h TYR 48 CO 0.21 0.03 -0.89 0.00 -1.64 0.00 0.00 178.16 175.86 2ptl h ALA 49 N 1.96 0.49 0.03 1.82 0.00 -1.08 -2.75 119.26 119.73 2ptl h ALA 49 Ca 0.04 -0.79 -0.00 0.00 0.00 0.00 0.00 54.91 54.15 2ptl h ALA 49 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2ptl h ALA 49 CO -0.00 1.06 -0.02 -0.92 0.00 0.00 0.00 179.25 179.37 2ptl h TYR 50 N 0.00 -0.04 0.00 0.00 3.20 0.12 -1.22 116.97 119.02 2ptl h TYR 50 Ca -0.03 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.84 2ptl h TYR 50 Cb 1.65 0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.94 2ptl h TYR 50 CO 0.00 0.08 0.00 0.00 -1.64 0.00 0.00 178.16 176.60 2ptl n ALA 51 N -2.16 2.63 -0.11 1.82 0.00 -0.65 -3.71 120.51 118.31 2ptl n ALA 51 Ca -0.08 -0.16 -0.25 0.00 0.00 0.00 0.00 53.44 52.95 2ptl n ALA 51 Cb 0.09 -1.42 -0.11 0.00 0.00 0.00 0.00 19.45 18.01 2ptl n ALA 51 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ptl n ASP 52 N -0.91 1.92 0.24 0.00 -0.08 -0.55 -4.12 116.55 113.04 2ptl n ASP 52 Ca 0.19 0.35 0.16 0.00 -1.51 0.00 0.00 54.79 53.98 2ptl n ASP 52 Cb 0.09 -0.88 0.70 0.00 2.34 0.00 0.00 41.12 43.37 2ptl n ASP 52 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 2ptl h THR 53 N -0.89 0.11 0.00 5.18 1.35 -1.39 -2.60 112.91 114.66 2ptl h THR 53 Ca -0.51 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 2ptl h THR 53 Cb 1.51 0.56 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 2ptl h THR 53 CO -0.27 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.18 2ptl n LEU 54 N -3.10 0.00 -2.59 3.87 7.99 -1.26 -4.70 117.00 117.21 2ptl n LEU 54 Ca 0.02 0.93 -0.15 0.00 -0.01 0.00 0.00 56.01 56.81 2ptl n LEU 54 Cb 0.57 -0.43 -0.03 0.00 -0.11 0.00 0.00 43.42 43.42 2ptl n LEU 54 CO 0.16 -0.43 -0.06 2.29 -1.51 0.00 0.00 177.39 177.85 2ptl n LYS 55 N -1.84 -1.30 -0.27 3.23 2.85 -0.98 -4.67 118.16 115.17 2ptl n LYS 55 Ca 0.00 0.05 -0.03 0.00 -1.05 0.00 0.00 58.31 57.28 2ptl n LYS 55 Cb 0.00 -2.54 0.01 0.00 -0.65 0.00 0.00 35.03 31.85 2ptl n LYS 55 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2ptl n LYS 56 N -2.05 1.13 -1.25 -1.58 0.00 -1.26 -4.73 118.16 108.43 2ptl n LYS 56 Ca 0.04 -0.29 -0.09 0.00 0.00 0.00 0.00 58.31 57.97 2ptl n LYS 56 Cb 0.26 -1.12 -0.04 0.00 0.00 0.00 0.00 35.03 34.13 2ptl n LYS 56 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2ptl n ASP 57 N 0.66 -4.71 -0.17 3.14 2.03 -1.26 -4.83 116.55 111.40 2ptl n ASP 57 Ca 0.06 0.21 0.15 0.00 0.52 0.00 0.00 54.79 55.73 2ptl n ASP 57 Cb 0.58 -2.96 0.75 0.00 -0.72 0.00 0.00 41.12 38.77 2ptl n ASP 57 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2ptl n ASN 58 N -0.32 0.55 -0.03 1.67 3.02 -1.26 -4.99 115.26 113.90 2ptl n ASN 58 Ca -0.09 -1.06 0.00 0.00 -0.03 0.00 0.00 54.58 53.40 2ptl n ASN 58 Cb 0.39 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 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 1.11 -0.58 3.50 7.41 0.00 -1.26 -3.56 105.19 111.81 2ptl n GLY 59 Ca 0.21 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 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 1.45 -1.89 -4.47 1.61 1.02 -1.26 -2.97 120.64 114.13 2ptl n GLU 60 Ca 0.00 -0.51 -0.23 0.00 -0.02 0.00 0.00 57.16 56.39 2ptl n GLU 60 Cb 0.00 -2.18 -0.10 0.00 -0.02 0.00 0.00 31.44 29.14 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 -2.45 2.18 -0.21 -0.32 -0.85 -1.26 0.29 117.35 114.74 2ptl s TYR 61 Ca 0.67 -0.50 -0.11 0.00 -0.52 0.00 0.00 57.07 56.61 2ptl s TYR 61 Cb -0.24 -1.13 -0.05 0.00 0.38 0.00 0.00 41.96 40.93 2ptl s TYR 61 CO 0.64 0.53 0.18 0.99 -1.52 0.00 0.00 175.55 176.37 2ptl s THR 62 N -2.71 5.36 -0.20 -3.49 2.01 -0.89 -4.79 115.64 110.92 2ptl s THR 62 Ca 0.30 0.28 -0.29 0.00 0.31 0.00 0.00 61.69 62.29 2ptl s THR 62 Cb 0.00 -3.52 0.00 0.00 0.01 0.00 0.00 72.50 68.99 2ptl s THR 62 CO 0.14 0.39 1.11 0.54 -0.69 0.00 0.00 174.62 176.10 2ptl s VAL 63 N 0.65 4.56 -0.30 3.82 0.11 -1.26 -3.06 120.40 124.91 2ptl s VAL 63 Ca 0.10 1.88 -0.27 0.00 -2.93 0.00 0.00 61.98 60.77 2ptl s VAL 63 Cb -0.12 -4.22 0.01 0.00 -1.53 0.00 0.00 36.38 30.52 2ptl s VAL 63 CO 0.02 -0.16 0.95 -1.81 -3.33 0.00 0.00 175.10 170.76 2ptl s ASP 64 N 1.43 6.84 -0.36 3.54 1.01 -1.04 -4.90 116.67 123.18 2ptl s ASP 64 Ca 0.47 0.92 -0.20 0.00 0.71 0.00 0.00 52.55 54.46 2ptl s ASP 64 Cb -0.17 -2.48 0.00 0.00 1.01 0.00 0.00 42.92 41.28 2ptl s ASP 64 CO 0.09 -0.74 0.62 -0.69 0.21 0.00 0.00 175.17 174.66 2ptl s VAL 65 N 3.30 4.91 0.24 -1.27 1.01 -1.26 -2.02 120.40 125.31 2ptl s VAL 65 Ca 0.40 0.54 -0.22 0.00 0.00 0.00 0.00 61.98 62.70 2ptl s VAL 65 Cb -0.13 -4.06 0.03 0.00 0.00 0.00 0.00 36.38 32.22 2ptl s VAL 65 CO 0.13 -0.31 0.72 0.00 0.00 0.00 0.00 175.10 175.64 2ptl s ALA 66 N 2.67 -1.33 -1.01 5.51 0.00 -1.26 -4.83 121.76 121.50 2ptl s ALA 66 Ca 0.24 -0.11 -0.07 0.00 0.00 0.00 0.00 51.96 52.02 2ptl s ALA 66 Cb -0.15 0.84 0.01 0.00 0.00 0.00 0.00 23.12 23.82 2ptl s ALA 66 CO 0.15 -0.98 0.88 -3.47 0.00 0.00 0.00 175.76 172.33 2ptl n ASP 67 N -0.44 -5.26 -2.26 0.00 -0.08 -1.26 -2.84 116.55 104.40 2ptl n ASP 67 Ca -0.07 -0.40 -0.09 0.00 -1.51 0.00 0.00 54.79 52.73 2ptl n ASP 67 Cb 0.60 -3.86 0.05 0.00 2.34 0.00 0.00 41.12 40.25 2ptl n ASP 67 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 2ptl n LYS 68 N -3.85 -3.26 -4.41 -0.67 3.00 -1.26 -2.95 118.16 104.77 2ptl n LYS 68 Ca 0.01 0.44 -0.40 0.00 -0.00 0.00 0.00 58.31 58.35 2ptl n LYS 68 Cb 0.54 -4.20 -0.06 0.00 0.00 0.00 0.00 35.03 31.31 2ptl n LYS 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2ptl n GLY 69 N -1.09 -0.42 1.04 3.14 0.00 -1.19 -4.74 105.19 101.94 2ptl n GLY 69 Ca -0.14 0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -4.14 -0.02 -1.41 1.61 9.36 -1.14 -4.76 117.16 116.66 2ptl n TYR 70 Ca 0.11 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 61.06 2ptl n TYR 70 Cb 0.46 0.01 -0.08 0.00 -0.63 0.00 0.00 39.34 39.11 2ptl n TYR 70 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 2ptl n THR 71 N -3.21 3.77 -1.65 2.97 -1.04 -1.13 -4.29 114.28 109.69 2ptl n THR 71 Ca 0.00 -2.73 -0.43 0.00 -2.04 0.00 0.00 64.05 58.85 2ptl n THR 71 Cb 0.28 -1.98 -0.03 0.00 -1.82 0.00 0.00 70.33 66.77 2ptl n THR 71 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ptl n LEU 72 N 1.99 4.02 0.00 -4.42 -0.00 -1.25 -4.56 117.00 112.78 2ptl n LEU 72 Ca 0.55 0.82 -0.19 0.00 -0.00 0.00 0.00 56.01 57.18 2ptl n LEU 72 Cb 0.55 -1.52 0.12 0.00 -0.00 0.00 0.00 43.42 42.57 2ptl n LEU 72 CO 0.42 0.08 0.52 0.59 -0.00 0.00 0.00 177.39 179.01 2ptl n ASN 73 N 8.03 0.57 -3.77 1.45 5.03 -0.85 -3.10 115.26 122.62 2ptl n ASN 73 Ca 0.21 -1.62 -0.13 0.00 0.87 0.00 0.00 54.58 53.92 2ptl n ASN 73 Cb 0.41 -0.61 -0.13 0.00 -1.02 0.00 0.00 39.78 38.43 2ptl n ASN 73 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2ptl s ILE 74 N -2.66 -0.03 -0.34 2.41 -1.09 -0.88 -2.50 121.20 116.11 2ptl s ILE 74 Ca 0.52 0.09 -0.00 0.00 -2.23 0.00 0.00 60.65 59.03 2ptl s ILE 74 Cb -0.02 -0.30 0.11 0.00 -1.58 0.00 0.00 42.46 40.67 2ptl s ILE 74 CO 0.36 0.04 0.14 -0.75 -1.23 0.00 0.00 174.94 173.50 2ptl s LYS 75 N 0.75 0.81 1.00 2.79 2.36 -1.17 -1.95 119.74 124.33 2ptl s LYS 75 Ca -0.05 -1.30 -0.11 0.00 -2.55 0.00 0.00 55.97 51.96 2ptl s LYS 75 Cb -0.07 -1.98 0.19 0.00 -1.05 0.00 0.00 37.83 34.93 2ptl s LYS 75 CO -0.04 -1.05 1.09 1.19 1.55 0.00 0.00 175.35 178.09 2ptl n PHE 76 N 4.48 0.16 0.00 4.03 3.01 -1.15 -2.09 117.46 125.90 2ptl n PHE 76 Ca 0.02 0.23 0.00 0.00 1.01 0.00 0.00 57.45 58.70 2ptl n PHE 76 Cb 0.40 -1.90 0.00 0.00 -0.01 0.00 0.00 39.48 37.96 2ptl n PHE 76 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ptl n ALA 77 N -4.48 0.00 -0.08 4.37 0.00 0.15 -4.61 120.51 115.85 2ptl n ALA 77 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2ptl n ALA 77 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2ptl n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91