#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 0.17 -0.93 1.62 -0.87 -1.26 -4.77 114.94 108.89 2ptl s ASN 2 Ca 0.00 -0.21 0.00 0.00 -1.57 0.00 0.00 52.86 51.08 2ptl s ASN 2 Cb 0.00 0.03 0.00 0.00 -0.02 0.00 0.00 41.25 41.26 2ptl s ASN 2 CO 0.00 -0.11 0.00 1.17 -2.57 0.00 0.00 177.10 175.59 2ptl n LYS 3 N 2.48 -1.67 -4.15 -0.60 4.81 -1.26 -4.91 118.16 112.86 2ptl n LYS 3 Ca -0.17 0.80 -0.11 0.00 -0.87 0.00 0.00 58.31 57.95 2ptl n LYS 3 Cb 0.58 -5.19 -0.09 0.00 0.02 0.00 0.00 35.03 30.36 2ptl n LYS 3 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2ptl s GLU 4 N -2.69 1.32 0.77 1.64 2.02 -1.26 -4.96 118.70 115.53 2ptl s GLU 4 Ca 0.00 -1.54 0.00 0.00 0.02 0.00 0.00 54.97 53.45 2ptl s GLU 4 Cb 0.00 0.33 0.00 0.00 0.10 0.00 0.00 34.13 34.56 2ptl s GLU 4 CO 0.00 -0.47 0.00 -1.91 0.02 0.00 0.00 175.26 172.90 2ptl n GLU 5 N -0.31 0.00 -3.38 1.61 4.07 -1.26 -4.17 120.64 117.20 2ptl n GLU 5 Ca 0.01 0.00 -0.14 0.00 -0.06 0.00 0.00 57.16 56.97 2ptl n GLU 5 Cb 0.65 0.00 -0.09 0.00 -0.06 0.00 0.00 31.44 31.94 2ptl n GLU 5 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 2ptl s THR 6 N 0.00 -0.48 0.05 6.31 2.01 -1.26 -5.04 115.64 117.23 2ptl s THR 6 Ca 0.00 -0.35 -0.35 0.00 0.31 0.00 0.00 61.69 61.30 2ptl s THR 6 Cb 0.00 -0.94 -0.20 0.00 0.01 0.00 0.00 72.50 71.38 2ptl s THR 6 CO 0.00 -0.35 1.50 1.55 -0.69 0.00 0.00 174.62 176.63 2ptl h PRO 7 N 8.23 -1.20 0.00 4.92 0.13 -1.93 -3.48 132.00 138.66 2ptl h PRO 7 Ca -0.13 0.08 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2ptl h PRO 7 Cb 1.10 0.27 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2ptl h PRO 7 CO 0.30 -0.80 0.00 -0.85 -0.23 0.00 0.00 178.00 176.43 2ptl n GLU 8 N -5.61 0.00 -1.55 0.86 0.28 -1.26 -5.02 120.64 108.34 2ptl n GLU 8 Ca -0.16 0.00 -0.61 0.00 -0.16 0.00 0.00 57.16 56.24 2ptl n GLU 8 Cb 0.49 0.00 -0.09 0.00 1.43 0.00 0.00 31.44 33.28 2ptl n GLU 8 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 2ptl n THR 9 N 0.00 0.00 -1.81 3.84 5.66 -1.26 -4.74 114.28 115.96 2ptl n THR 9 Ca 0.00 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.57 2ptl n THR 9 Cb 0.00 -0.20 -0.03 0.00 -1.55 0.00 0.00 70.33 68.56 2ptl n THR 9 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2ptl s PRO 10 N 1.18 3.68 0.90 1.09 0.04 -1.26 -4.75 135.00 135.88 2ptl s PRO 10 Ca 0.94 2.08 0.00 0.00 0.04 0.00 0.00 61.00 64.05 2ptl s PRO 10 Cb -1.32 -4.19 0.00 0.00 0.04 0.00 0.00 34.50 29.03 2ptl s PRO 10 CO 0.65 -1.46 0.00 0.39 0.04 0.00 0.00 177.00 176.63 2ptl n GLU 11 N 7.98 -0.92 -3.13 4.56 1.02 -1.26 -4.42 120.64 124.46 2ptl n GLU 11 Ca 0.23 0.61 -0.26 0.00 -0.02 0.00 0.00 57.16 57.72 2ptl n GLU 11 Cb 0.44 -1.12 -0.05 0.00 -0.02 0.00 0.00 31.44 30.68 2ptl n GLU 11 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2ptl n THR 12 N -2.20 2.22 1.93 2.62 -2.24 -1.26 -4.84 114.28 110.51 2ptl n THR 12 Ca 0.00 -5.25 0.08 0.00 -2.27 0.00 0.00 64.05 56.61 2ptl n THR 12 Cb 0.21 -1.52 0.48 0.00 -2.10 0.00 0.00 70.33 67.40 2ptl n THR 12 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2ptl n ASP 13 N 0.26 0.00 -2.24 3.42 8.00 -1.26 -3.54 116.55 121.19 2ptl n ASP 13 Ca 0.29 -1.43 -0.30 0.00 0.71 0.00 0.00 54.79 54.07 2ptl n ASP 13 Cb 0.44 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.65 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 -0.76 6.06 -2.15 -2.24 3.41 -1.26 -4.53 113.62 112.15 2ptl n SER 14 Ca 0.12 -3.73 -0.28 0.00 -0.26 0.00 0.00 58.87 54.73 2ptl n SER 14 Cb 0.06 -0.89 0.11 0.00 -0.26 0.00 0.00 64.21 63.23 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 -1.00 2.57 -3.63 4.33 1.02 -1.23 -4.93 120.64 117.77 2ptl n GLU 15 Ca 0.60 -3.29 -0.04 0.00 -0.02 0.00 0.00 57.16 54.41 2ptl n GLU 15 Cb 1.03 -2.21 -0.04 0.00 -0.02 0.00 0.00 31.44 30.20 2ptl n GLU 15 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2ptl s GLU 16 N -3.60 0.18 -0.38 3.49 -1.05 -1.26 -5.08 118.70 111.01 2ptl s GLU 16 Ca 0.59 0.03 0.11 0.00 -0.15 0.00 0.00 54.97 55.55 2ptl s GLU 16 Cb 0.48 0.09 0.40 0.00 -0.44 0.00 0.00 34.13 34.66 2ptl s GLU 16 CO 0.03 -0.06 1.38 -1.91 0.95 0.00 0.00 175.26 175.65 2ptl n GLU 17 N 0.49 1.25 -3.36 -4.83 0.00 -1.26 -5.05 120.64 107.88 2ptl n GLU 17 Ca -0.02 -1.80 -0.17 0.00 0.00 0.00 0.00 57.16 55.18 2ptl n GLU 17 Cb 0.59 -0.04 -0.08 0.00 0.00 0.00 0.00 31.44 31.91 2ptl n GLU 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2ptl s VAL 18 N -0.14 -0.34 -0.23 6.31 0.11 -1.26 -5.09 120.40 119.76 2ptl s VAL 18 Ca 0.19 -0.97 -0.10 0.00 -2.93 0.00 0.00 61.98 58.17 2ptl s VAL 18 Cb 0.41 -0.68 -0.05 0.00 -1.53 0.00 0.00 36.38 34.54 2ptl s VAL 18 CO -0.09 -0.58 0.14 -0.89 -3.33 0.00 0.00 175.10 170.35 2ptl s THR 19 N 1.46 5.21 0.49 5.04 2.01 -1.26 -2.59 115.64 126.00 2ptl s THR 19 Ca 0.17 0.13 -0.05 0.00 0.31 0.00 0.00 61.69 62.24 2ptl s THR 19 Cb -0.15 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2ptl s THR 19 CO -0.04 0.36 0.80 -0.51 -0.69 0.00 0.00 174.62 174.54 2ptl s ILE 20 N 1.01 4.77 -0.29 1.82 2.07 -1.07 -4.95 121.20 124.56 2ptl s ILE 20 Ca 0.07 0.18 -0.01 0.00 -1.41 0.00 0.00 60.65 59.48 2ptl s ILE 20 Cb -0.13 -3.82 0.13 0.00 0.13 0.00 0.00 42.46 38.77 2ptl s ILE 20 CO 0.04 -0.81 0.28 -0.75 -1.91 0.00 0.00 174.94 171.79 2ptl s LYS 21 N -4.77 0.32 -0.34 3.50 2.20 -1.25 -3.59 119.74 115.80 2ptl s LYS 21 Ca 0.48 -0.19 -0.14 0.00 -0.36 0.00 0.00 55.97 55.77 2ptl s LYS 21 Cb -0.10 -0.69 -0.01 0.00 -1.51 0.00 0.00 37.83 35.51 2ptl s LYS 21 CO 0.45 -1.03 0.30 0.00 -0.36 0.00 0.00 175.35 174.70 2ptl s ALA 22 N 2.32 3.50 0.80 3.13 0.00 -1.25 -1.45 121.76 128.81 2ptl s ALA 22 Ca 0.09 -1.32 -0.07 0.00 0.00 0.00 0.00 51.96 50.66 2ptl s ALA 22 Cb -0.14 -2.75 0.14 0.00 0.00 0.00 0.00 23.12 20.37 2ptl s ALA 22 CO -0.33 -1.04 1.11 -0.80 0.00 0.00 0.00 175.76 174.71 2ptl s ASN 23 N 1.73 4.04 -0.45 0.00 0.01 -0.20 0.53 114.94 120.59 2ptl s ASN 23 Ca 0.09 0.06 0.06 0.00 -0.71 0.00 0.00 52.86 52.35 2ptl s ASN 23 Cb -0.17 -0.39 0.22 0.00 0.41 0.00 0.00 41.25 41.32 2ptl s ASN 23 CO 0.11 -2.10 0.48 0.18 -1.51 0.00 0.00 177.10 174.27 2ptl n LEU 24 N -3.18 0.58 -4.69 0.60 4.77 -0.66 -3.31 117.00 111.12 2ptl n LEU 24 Ca 0.13 -4.71 -0.42 0.00 -0.03 0.00 0.00 56.01 50.99 2ptl n LEU 24 Cb 0.60 0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 42.01 2ptl n LEU 24 CO 0.46 1.97 0.68 -0.63 -1.33 0.00 0.00 177.39 178.54 2ptl s ILE 25 N -0.93 4.85 0.39 -0.08 1.01 -0.38 -0.46 121.20 125.59 2ptl s ILE 25 Ca 0.34 1.90 0.08 0.00 0.00 0.00 0.00 60.65 62.96 2ptl s ILE 25 Cb 0.11 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 2ptl s ILE 25 CO -0.13 0.07 0.20 -0.36 0.00 0.00 0.00 174.94 174.72 2ptl s PHE 26 N 1.66 2.66 -1.33 3.97 0.08 -1.23 -1.19 117.98 122.61 2ptl s PHE 26 Ca 0.46 -0.50 0.28 0.00 0.12 0.00 0.00 56.93 57.30 2ptl s PHE 26 Cb -0.18 -1.88 1.13 0.00 -0.57 0.00 0.00 43.02 41.51 2ptl s PHE 26 CO 0.19 0.19 1.82 0.00 -0.10 0.00 0.00 175.22 177.32 2ptl n ALA 27 N -1.26 2.76 -1.58 5.36 0.00 -1.26 -3.97 120.51 120.57 2ptl n ALA 27 Ca -0.01 -0.22 -0.34 0.00 0.00 0.00 0.00 53.44 52.87 2ptl n ALA 27 Cb 0.63 -1.35 0.03 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 -1.24 7.28 -2.00 0.00 0.23 -1.26 -4.80 115.26 113.47 2ptl n ASN 28 Ca 0.11 -3.63 -0.04 0.00 -0.53 0.00 0.00 54.58 50.49 2ptl n ASN 28 Cb 0.30 -1.08 -0.01 0.00 -2.08 0.00 0.00 39.78 36.92 2ptl n ASN 28 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2ptl n GLY 29 N -0.28 -0.19 2.60 4.83 0.00 -1.25 -4.79 105.19 106.10 2ptl n GLY 29 Ca 0.53 0.00 -0.29 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 3.97 -4.83 1.61 2.88 -1.26 -5.04 113.62 110.10 2ptl n SER 30 Ca -0.05 -3.39 -0.32 0.00 -1.33 0.00 0.00 58.87 53.78 2ptl n SER 30 Cb 0.40 -0.77 -0.03 0.00 -0.75 0.00 0.00 64.21 63.05 2ptl n SER 30 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2ptl s THR 31 N -2.30 4.39 0.00 2.46 -1.32 -1.26 -3.48 115.64 114.13 2ptl s THR 31 Ca 0.36 1.20 0.00 0.00 -1.21 0.00 0.00 61.69 62.04 2ptl s THR 31 Cb 0.10 -3.65 0.00 0.00 -1.51 0.00 0.00 72.50 67.44 2ptl s THR 31 CO -0.03 -0.60 0.00 0.00 -2.21 0.00 0.00 174.62 171.78 2ptl n GLN 32 N -1.48 0.00 -3.84 7.08 3.00 0.39 -4.93 117.38 117.59 2ptl n GLN 32 Ca 0.07 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.99 2ptl n GLN 32 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 30.24 30.76 2ptl n GLN 32 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 2ptl s THR 33 N -1.97 0.00 0.29 5.09 -1.32 -1.26 -1.66 115.64 114.81 2ptl s THR 33 Ca 0.00 -0.97 0.02 0.00 -1.21 0.00 0.00 61.69 59.54 2ptl s THR 33 Cb 0.00 -2.12 -0.04 0.00 -1.51 0.00 0.00 72.50 68.83 2ptl s THR 33 CO 0.00 0.00 0.14 0.00 -2.21 0.00 0.00 174.62 172.55 2ptl s ALA 34 N -3.64 1.87 -0.27 11.08 0.00 0.19 -4.71 121.76 126.28 2ptl s ALA 34 Ca 0.12 -1.78 -0.15 0.00 0.00 0.00 0.00 51.96 50.15 2ptl s ALA 34 Cb -0.05 1.12 0.08 0.00 0.00 0.00 0.00 23.12 24.27 2ptl s ALA 34 CO 0.07 -0.49 0.66 -1.83 0.00 0.00 0.00 175.76 174.17 2ptl s GLU 35 N -3.90 0.66 -0.30 0.00 4.04 -1.26 -3.89 118.70 114.06 2ptl s GLU 35 Ca 0.36 1.22 0.02 0.00 0.04 0.00 0.00 54.97 56.61 2ptl s GLU 35 Cb 0.06 0.22 0.15 0.00 0.02 0.00 0.00 34.13 34.58 2ptl s GLU 35 CO 0.16 -0.16 0.38 -0.06 -1.84 0.00 0.00 175.26 173.74 2ptl s PHE 36 N 1.79 -0.82 0.63 4.83 0.40 -1.24 -5.05 117.98 118.53 2ptl s PHE 36 Ca -0.09 0.08 0.05 0.00 -0.60 0.00 0.00 56.93 56.37 2ptl s PHE 36 Cb -0.06 -0.25 0.10 0.00 0.51 0.00 0.00 43.02 43.32 2ptl s PHE 36 CO -0.19 -0.97 0.87 0.15 0.70 0.00 0.00 175.22 175.78 2ptl s LYS 37 N 2.38 2.04 0.00 0.44 3.01 -1.26 -2.59 119.74 123.75 2ptl s LYS 37 Ca 0.10 -1.42 0.00 0.00 -1.01 0.00 0.00 55.97 53.64 2ptl s LYS 37 Cb -0.13 -2.52 0.00 0.00 -1.01 0.00 0.00 37.83 34.17 2ptl s LYS 37 CO -0.28 -1.10 0.00 0.41 0.51 0.00 0.00 175.35 174.89 2ptl n GLY 38 N -2.49 1.00 0.83 -3.33 0.00 -1.07 -4.91 105.19 95.22 2ptl n GLY 38 Ca 0.15 -0.92 -0.06 0.00 0.00 0.00 0.00 46.02 45.20 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 -4.59 114.28 110.00 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 -0.18 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 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 -3.30 0.00 0.52 -1.42 -0.00 -1.26 -4.81 117.46 107.19 2ptl n PHE 40 Ca 0.03 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.60 2ptl n PHE 40 Cb 0.11 0.00 0.17 0.00 -0.00 0.00 0.00 39.48 39.76 2ptl n PHE 40 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.76 178.25 2ptl h GLU 41 N 0.00 0.00 -0.19 -4.13 4.81 -1.96 -3.21 114.58 109.90 2ptl h GLU 41 Ca 0.00 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2ptl h GLU 41 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 2ptl h GLU 41 CO 0.00 0.00 0.29 1.57 -0.73 0.00 0.00 179.01 180.14 2ptl h LYS 42 N 0.00 0.00 0.02 1.92 5.09 -2.00 0.58 116.57 122.18 2ptl h LYS 42 Ca 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 60.65 60.47 2ptl h LYS 42 Cb 0.77 0.00 -0.04 0.00 0.10 0.00 0.00 32.23 33.07 2ptl h LYS 42 CO 0.00 0.00 -1.49 0.00 -2.09 0.00 0.00 179.45 175.87 2ptl h ALA 43 N 1.60 0.57 -0.94 0.07 0.00 -1.87 -2.96 119.26 115.73 2ptl h ALA 43 Ca 0.09 -1.25 0.05 0.00 0.00 0.00 0.00 54.91 53.80 2ptl h ALA 43 Cb 0.66 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 2ptl h ALA 43 CO -0.00 1.42 0.61 1.15 0.00 0.00 0.00 179.25 182.43 2ptl h THR 44 N 0.01 1.11 0.01 0.00 2.02 0.06 0.52 112.91 116.64 2ptl h THR 44 Ca -0.20 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 2ptl h THR 44 Cb 1.94 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2ptl h THR 44 CO 0.11 0.20 -0.00 0.28 0.37 0.00 0.00 175.52 176.48 2ptl h SER 45 N 1.12 -0.01 -0.07 4.18 0.02 -1.57 -1.19 113.55 116.04 2ptl h SER 45 Ca 0.39 -0.82 0.02 0.00 -0.84 0.00 0.00 61.79 60.55 2ptl h SER 45 Cb 0.12 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 2ptl h SER 45 CO -0.14 0.88 0.26 -0.08 -1.14 0.00 0.00 176.83 176.61 2ptl h GLU 46 N -0.96 0.00 0.16 3.45 4.57 -1.33 0.41 114.58 120.89 2ptl h GLU 46 Ca -0.00 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 57.93 2ptl h GLU 46 Cb 0.82 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 29.43 2ptl h GLU 46 CO 0.00 0.00 -1.12 0.00 -1.18 0.00 0.00 179.01 176.71 2ptl h ALA 47 N 1.54 -0.04 -0.24 2.92 0.00 0.13 -1.86 119.26 121.71 2ptl h ALA 47 Ca 0.03 -0.83 0.07 0.00 0.00 0.00 0.00 54.91 54.18 2ptl h ALA 47 Cb 0.56 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2ptl h ALA 47 CO -0.00 0.57 0.18 -0.92 0.00 0.00 0.00 179.25 179.08 2ptl h TYR 48 N -0.23 0.00 0.07 0.00 3.20 0.10 0.31 116.97 120.42 2ptl h TYR 48 Ca -0.21 0.00 -0.25 0.00 3.14 0.00 0.00 58.73 61.41 2ptl h TYR 48 Cb 1.80 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.06 2ptl h TYR 48 CO 0.16 0.00 -1.21 0.00 -1.64 0.00 0.00 178.16 175.47 2ptl h ALA 49 N 1.86 0.27 -0.81 1.82 0.00 -1.10 -2.62 119.26 118.68 2ptl h ALA 49 Ca 0.11 -0.96 0.11 0.00 0.00 0.00 0.00 54.91 54.17 2ptl h ALA 49 Cb 0.47 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 2ptl h ALA 49 CO -0.00 1.15 0.44 -0.92 0.00 0.00 0.00 179.25 179.92 2ptl h TYR 50 N 0.04 0.79 0.00 0.00 5.03 0.47 0.39 116.97 123.70 2ptl h TYR 50 Ca -0.11 0.03 -0.19 0.00 2.58 0.00 0.00 58.73 61.04 2ptl h TYR 50 Cb 1.90 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 39.92 2ptl h TYR 50 CO 0.03 0.28 -0.91 0.00 -1.32 0.00 0.00 178.16 176.25 2ptl h ALA 51 N 1.48 0.50 0.00 1.82 0.00 -1.43 -3.11 119.26 118.53 2ptl h ALA 51 Ca 0.41 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2ptl h ALA 51 Cb 0.44 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2ptl h ALA 51 CO -0.28 1.10 0.00 -3.47 0.00 0.00 0.00 179.25 176.60 2ptl n ASP 52 N -3.49 0.46 -0.03 0.00 2.03 -0.18 -2.71 116.55 112.63 2ptl n ASP 52 Ca -0.01 0.55 0.15 0.00 0.52 0.00 0.00 54.79 56.00 2ptl n ASP 52 Cb 0.86 -0.67 0.70 0.00 -0.72 0.00 0.00 41.12 41.29 2ptl n ASP 52 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2ptl n THR 53 N -1.94 0.00 -0.07 5.18 -2.24 0.12 -3.84 114.28 111.50 2ptl n THR 53 Ca 0.06 -0.01 -0.08 0.00 -2.27 0.00 0.00 64.05 61.74 2ptl n THR 53 Cb 0.36 -0.39 -0.06 0.00 -2.10 0.00 0.00 70.33 68.14 2ptl n THR 53 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2ptl h LEU 54 N 0.12 0.00 1.15 3.22 3.38 -1.65 -3.46 115.31 118.07 2ptl h LEU 54 Ca 0.00 -0.42 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 2ptl h LEU 54 Cb 0.32 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 2ptl h LEU 54 CO 0.00 0.83 -0.13 2.29 0.09 0.00 0.00 178.44 181.52 2ptl n LYS 55 N -4.66 -2.10 -0.41 1.13 2.85 -1.25 -4.67 118.16 109.05 2ptl n LYS 55 Ca -0.08 0.02 -0.04 0.00 -1.05 0.00 0.00 58.31 57.16 2ptl n LYS 55 Cb 0.29 -3.22 0.01 0.00 -0.65 0.00 0.00 35.03 31.46 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 -2.02 1.17 -2.34 -1.58 4.81 -1.26 -4.63 118.16 112.32 2ptl n LYS 56 Ca 0.02 -0.37 -0.01 0.00 -0.87 0.00 0.00 58.31 57.08 2ptl n LYS 56 Cb 0.35 -1.14 0.00 0.00 0.02 0.00 0.00 35.03 34.26 2ptl n LYS 56 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2ptl n ASP 57 N 0.85 -1.84 0.07 3.14 -0.08 -1.26 -4.95 116.55 112.49 2ptl n ASP 57 Ca 0.07 -0.02 -0.01 0.00 -1.51 0.00 0.00 54.79 53.32 2ptl n ASP 57 Cb 0.57 -0.74 -0.06 0.00 2.34 0.00 0.00 41.12 43.23 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 -0.09 0.00 0.00 1.67 2.35 -1.82 -3.44 115.58 114.25 2ptl h ASN 58 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2ptl h ASN 58 Cb 1.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.39 2ptl h ASN 58 CO 0.03 0.68 0.00 0.61 -1.65 0.00 0.00 177.43 177.10 2ptl n GLY 59 N 1.34 0.57 0.18 2.83 0.00 -1.26 -1.87 105.19 106.98 2ptl n GLY 59 Ca -0.04 -0.80 0.02 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.45 -0.38 -3.85 1.61 1.02 -1.26 -4.54 120.64 110.81 2ptl n GLU 60 Ca 0.00 0.26 -0.10 0.00 -0.02 0.00 0.00 57.16 57.30 2ptl n GLU 60 Cb 0.07 -0.45 -0.08 0.00 -0.02 0.00 0.00 31.44 30.95 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 -1.60 0.07 -0.21 -0.32 -0.85 -1.26 -1.41 117.35 111.77 2ptl s TYR 61 Ca 0.00 -0.32 -0.19 0.00 -0.52 0.00 0.00 57.07 56.04 2ptl s TYR 61 Cb 0.00 -0.03 -0.03 0.00 0.38 0.00 0.00 41.96 42.28 2ptl s TYR 61 CO 0.00 -0.45 0.56 0.99 -1.52 0.00 0.00 175.55 175.14 2ptl s THR 62 N -2.74 5.07 -0.10 -3.49 2.01 -1.07 -4.81 115.64 110.51 2ptl s THR 62 Ca -0.04 1.03 -0.30 0.00 0.31 0.00 0.00 61.69 62.70 2ptl s THR 62 Cb -0.00 -3.88 -0.02 0.00 0.01 0.00 0.00 72.50 68.61 2ptl s THR 62 CO -0.05 0.14 1.05 0.54 -0.69 0.00 0.00 174.62 175.61 2ptl s VAL 63 N 1.83 4.66 0.32 3.82 0.11 -1.26 -3.33 120.40 126.55 2ptl s VAL 63 Ca 0.25 1.94 -0.06 0.00 -2.93 0.00 0.00 61.98 61.19 2ptl s VAL 63 Cb -0.16 -4.25 -0.05 0.00 -1.53 0.00 0.00 36.38 30.39 2ptl s VAL 63 CO 0.10 -0.00 0.60 -1.81 -3.33 0.00 0.00 175.10 170.66 2ptl s ASP 64 N 1.19 6.45 -0.23 3.54 1.11 -1.14 -4.98 116.67 122.61 2ptl s ASP 64 Ca 0.50 0.80 0.00 0.00 0.18 0.00 0.00 52.55 54.03 2ptl s ASP 64 Cb -0.20 -2.18 0.03 0.00 1.07 0.00 0.00 42.92 41.65 2ptl s ASP 64 CO 0.18 -0.25 -0.12 -0.69 1.18 0.00 0.00 175.17 175.47 2ptl s VAL 65 N -2.16 2.43 0.22 -1.27 1.01 -1.26 -3.89 120.40 115.47 2ptl s VAL 65 Ca 0.45 -1.15 0.01 0.00 0.00 0.00 0.00 61.98 61.29 2ptl s VAL 65 Cb -0.11 -2.21 -0.00 0.00 0.00 0.00 0.00 36.38 34.06 2ptl s VAL 65 CO 0.31 0.26 0.28 0.00 0.00 0.00 0.00 175.10 175.94 2ptl n ALA 66 N 4.59 -0.02 -4.10 5.51 0.00 -1.17 -4.80 120.51 120.51 2ptl n ALA 66 Ca -0.17 -1.10 -0.28 0.00 0.00 0.00 0.00 53.44 51.89 2ptl n ALA 66 Cb 0.47 0.89 -0.05 0.00 0.00 0.00 0.00 19.45 20.75 2ptl n ALA 66 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ptl n ASP 67 N -1.91 0.20 -3.52 0.00 -0.08 -1.26 -1.61 116.55 108.38 2ptl n ASP 67 Ca 0.02 -1.12 -0.16 0.00 -1.51 0.00 0.00 54.79 52.02 2ptl n ASP 67 Cb 0.38 -2.44 0.00 0.00 2.34 0.00 0.00 41.12 41.40 2ptl n ASP 67 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2ptl n LYS 68 N -4.48 -1.48 -4.13 -0.67 2.85 -1.26 -2.00 118.16 106.98 2ptl n LYS 68 Ca -0.32 1.05 -0.32 0.00 -1.05 0.00 0.00 58.31 57.67 2ptl n LYS 68 Cb 0.69 -3.55 -0.05 0.00 -0.65 0.00 0.00 35.03 31.47 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 -1.65 -0.31 1.69 2.58 0.00 -0.81 -4.78 105.19 101.90 2ptl n GLY 69 Ca -0.20 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -4.58 0.00 -2.73 1.61 9.36 -0.63 -4.98 117.16 115.21 2ptl n TYR 70 Ca -0.28 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.52 2ptl n TYR 70 Cb 0.67 0.38 -0.03 0.00 -0.63 0.00 0.00 39.34 39.73 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 -1.93 4.30 -0.79 2.97 2.01 -1.01 -3.75 115.64 117.44 2ptl s THR 71 Ca 0.00 0.76 -0.16 0.00 0.31 0.00 0.00 61.69 62.60 2ptl s THR 71 Cb 0.00 -4.56 0.17 0.00 0.01 0.00 0.00 72.50 68.13 2ptl s THR 71 CO 0.00 -1.05 0.81 -0.76 -0.69 0.00 0.00 174.62 172.93 2ptl s LEU 72 N 4.20 6.14 -0.76 4.42 1.43 -0.53 -3.04 118.68 130.55 2ptl s LEU 72 Ca 0.39 -2.28 -0.26 0.00 -1.03 0.00 0.00 54.13 50.94 2ptl s LEU 72 Cb -0.09 -2.26 0.03 0.00 0.03 0.00 0.00 46.19 43.89 2ptl s LEU 72 CO 0.26 -0.79 1.38 0.20 0.23 0.00 0.00 176.35 177.63 2ptl s ASN 73 N 2.84 6.08 0.40 2.29 0.02 -1.25 -1.04 114.94 124.28 2ptl s ASN 73 Ca 0.19 -0.47 -0.23 0.00 -1.02 0.00 0.00 52.86 51.33 2ptl s ASN 73 Cb -0.13 -2.56 -0.10 0.00 0.02 0.00 0.00 41.25 38.48 2ptl s ASN 73 CO -0.06 -1.88 0.97 -0.63 0.02 0.00 0.00 177.10 175.52 2ptl s ILE 74 N 6.11 4.21 -0.33 0.60 1.01 -1.21 -2.87 121.20 128.72 2ptl s ILE 74 Ca 0.40 1.53 -0.02 0.00 0.00 0.00 0.00 60.65 62.57 2ptl s ILE 74 Cb -0.08 -3.71 0.12 0.00 0.01 0.00 0.00 42.46 38.80 2ptl s ILE 74 CO 0.13 -0.15 0.16 -0.75 0.00 0.00 0.00 174.94 174.33 2ptl s LYS 75 N -2.80 0.46 0.53 2.79 2.47 -1.21 -1.25 119.74 120.73 2ptl s LYS 75 Ca 0.59 -1.00 -0.20 0.00 -1.56 0.00 0.00 55.97 53.80 2ptl s LYS 75 Cb -0.14 -1.39 -0.06 0.00 -1.46 0.00 0.00 37.83 34.78 2ptl s LYS 75 CO 0.18 -1.10 1.13 -0.06 0.16 0.00 0.00 175.35 175.66 2ptl s PHE 76 N 1.53 2.70 -0.80 4.03 0.40 -0.33 -2.59 117.98 122.92 2ptl s PHE 76 Ca 0.13 1.54 0.10 0.00 -0.60 0.00 0.00 56.93 58.10 2ptl s PHE 76 Cb -0.19 -3.29 0.46 0.00 0.51 0.00 0.00 43.02 40.51 2ptl s PHE 76 CO -0.18 -1.53 1.30 0.00 0.70 0.00 0.00 175.22 175.51 2ptl n ALA 77 N -1.21 1.23 0.00 5.36 0.00 -0.50 -4.00 120.51 121.39 2ptl n ALA 77 Ca 0.11 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2ptl n ALA 77 Cb 0.51 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.81 2ptl n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91