#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 1.57 -1.12 -1.84 6.94 -1.26 -5.14 115.26 114.41 2ptl n ASN 2 Ca 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 54.58 54.64 2ptl n ASN 2 Cb 0.00 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.40 2ptl n ASN 2 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2ptl n LYS 3 N 0.00 -1.12 -4.36 -3.83 5.02 -1.26 -4.76 118.16 107.86 2ptl n LYS 3 Ca 0.00 0.73 -0.35 0.00 -2.02 0.00 0.00 58.31 56.68 2ptl n LYS 3 Cb 0.00 -1.36 -0.10 0.00 -0.02 0.00 0.00 35.03 33.55 2ptl n LYS 3 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2ptl s GLU 4 N -0.87 3.05 0.56 1.97 -1.05 -1.26 -4.99 118.70 116.12 2ptl s GLU 4 Ca 0.00 -0.41 0.00 0.00 -0.15 0.00 0.00 54.97 54.41 2ptl s GLU 4 Cb 0.00 -2.82 0.00 0.00 -0.44 0.00 0.00 34.13 30.87 2ptl s GLU 4 CO 0.00 0.67 0.00 -1.91 0.95 0.00 0.00 175.26 174.97 2ptl n GLU 5 N 2.24 -3.13 -1.65 -4.83 4.07 -1.26 -4.67 120.64 111.40 2ptl n GLU 5 Ca -0.19 2.54 -0.43 0.00 -0.06 0.00 0.00 57.16 59.03 2ptl n GLU 5 Cb 0.54 -3.60 -0.01 0.00 -0.06 0.00 0.00 31.44 28.30 2ptl n GLU 5 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2ptl n THR 6 N -3.97 2.04 -0.20 6.31 -2.24 -1.26 -4.87 114.28 110.10 2ptl n THR 6 Ca -0.07 -0.50 -0.08 0.00 -2.27 0.00 0.00 64.05 61.13 2ptl n THR 6 Cb 0.59 -1.32 0.02 0.00 -2.10 0.00 0.00 70.33 67.52 2ptl n THR 6 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2ptl h PRO 7 N 2.25 0.82 -4.77 -0.78 0.13 -1.89 -3.31 132.00 124.44 2ptl h PRO 7 Ca -0.43 -0.15 -0.74 0.00 -0.87 0.00 0.00 66.00 63.81 2ptl h PRO 7 Cb 1.31 -0.14 -0.18 0.00 0.13 0.00 0.00 31.00 32.13 2ptl h PRO 7 CO 0.61 0.71 1.36 -1.83 -0.23 0.00 0.00 178.00 178.62 2ptl s GLU 8 N -5.58 4.08 -0.21 0.86 1.03 -1.26 -4.91 118.70 112.72 2ptl s GLU 8 Ca -0.13 -2.56 -0.11 0.00 0.03 0.00 0.00 54.97 52.20 2ptl s GLU 8 Cb 0.12 -5.07 0.07 0.00 -0.80 0.00 0.00 34.13 28.46 2ptl s GLU 8 CO 0.78 -1.77 0.49 0.95 -1.33 0.00 0.00 175.26 174.38 2ptl s THR 9 N 1.64 -0.14 0.06 1.83 -4.23 -1.25 -5.06 115.64 108.48 2ptl s THR 9 Ca 0.43 0.07 -0.32 0.00 -1.18 0.00 0.00 61.69 60.69 2ptl s THR 9 Cb -0.03 -0.73 -0.18 0.00 1.34 0.00 0.00 72.50 72.89 2ptl s THR 9 CO 0.00 0.03 1.52 -0.65 -0.54 0.00 0.00 174.62 174.98 2ptl h PRO 10 N 7.26 -0.89 -5.71 3.99 0.11 -1.93 -3.47 132.00 131.36 2ptl h PRO 10 Ca -0.32 0.06 -0.35 0.00 0.11 0.00 0.00 66.00 65.51 2ptl h PRO 10 Cb 1.18 0.20 0.16 0.00 0.11 0.00 0.00 31.00 32.65 2ptl h PRO 10 CO 0.23 -0.57 -0.76 0.39 -0.21 0.00 0.00 178.00 177.08 2ptl n GLU 11 N -5.46 -6.80 0.00 1.05 1.02 -1.26 -4.64 120.64 104.55 2ptl n GLU 11 Ca -0.13 0.83 0.00 0.00 -0.02 0.00 0.00 57.16 57.84 2ptl n GLU 11 Cb 0.38 -5.84 0.00 0.00 -0.02 0.00 0.00 31.44 25.96 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 -4.31 0.00 -3.12 2.62 -2.24 -1.26 -5.02 114.28 100.96 2ptl n THR 12 Ca -0.23 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.31 2ptl n THR 12 Cb 0.65 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.83 2ptl n THR 12 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2ptl n ASP 13 N 0.00 2.65 0.00 3.42 5.75 -1.26 -4.78 116.55 122.33 2ptl n ASP 13 Ca 0.00 -3.31 0.00 0.00 -0.01 0.00 0.00 54.79 51.47 2ptl n ASP 13 Cb 0.00 -0.60 0.00 0.00 -1.03 0.00 0.00 41.12 39.49 2ptl n ASP 13 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2ptl n SER 14 N 0.25 1.27 0.00 -1.12 7.64 -1.26 -5.01 113.62 115.40 2ptl n SER 14 Ca 0.28 -1.40 0.00 0.00 1.01 0.00 0.00 58.87 58.75 2ptl n SER 14 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 2ptl n SER 14 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2ptl n GLU 15 N -0.20 0.00 -2.96 1.43 1.02 -1.26 -5.03 120.64 113.64 2ptl n GLU 15 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.84 2ptl n GLU 15 Cb 0.15 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.60 2ptl n GLU 15 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2ptl n GLU 16 N 0.00 -1.46 -0.07 3.49 0.28 -1.26 -4.89 120.64 116.72 2ptl n GLU 16 Ca 0.00 1.06 -0.09 0.00 -0.16 0.00 0.00 57.16 57.97 2ptl n GLU 16 Cb 0.00 -1.53 -0.07 0.00 1.43 0.00 0.00 31.44 31.27 2ptl n GLU 16 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2ptl n GLU 17 N -0.23 0.87 -3.71 3.44 0.28 -1.26 -4.83 120.64 115.19 2ptl n GLU 17 Ca -0.08 0.06 -0.28 0.00 -0.16 0.00 0.00 57.16 56.70 2ptl n GLU 17 Cb 0.53 -1.29 -0.12 0.00 1.43 0.00 0.00 31.44 31.99 2ptl n GLU 17 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2ptl s VAL 18 N -2.29 1.76 -0.32 3.84 -7.23 -1.26 -5.05 120.40 109.85 2ptl s VAL 18 Ca -0.16 -3.28 -0.18 0.00 -1.81 0.00 0.00 61.98 56.56 2ptl s VAL 18 Cb 0.05 -2.19 -0.01 0.00 0.56 0.00 0.00 36.38 34.79 2ptl s VAL 18 CO 0.37 -1.02 0.50 0.42 -0.31 0.00 0.00 175.10 175.06 2ptl s THR 19 N -0.45 5.05 0.59 5.32 -4.23 -1.26 -1.19 115.64 119.47 2ptl s THR 19 Ca 0.24 0.49 0.05 0.00 -1.18 0.00 0.00 61.69 61.29 2ptl s THR 19 Cb -0.09 -3.90 0.11 0.00 1.34 0.00 0.00 72.50 69.95 2ptl s THR 19 CO -0.11 -0.11 0.82 0.00 -0.54 0.00 0.00 174.62 174.67 2ptl n ILE 20 N 5.33 0.00 -3.93 2.99 3.06 -1.26 -4.93 119.36 120.62 2ptl n ILE 20 Ca -0.05 -1.61 -0.09 0.00 -2.50 0.00 0.00 62.75 58.51 2ptl n ILE 20 Cb 0.49 -0.74 -0.08 0.00 0.54 0.00 0.00 39.64 39.86 2ptl n ILE 20 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 2ptl s LYS 21 N -4.62 0.86 -0.46 9.51 1.02 -1.02 -3.88 119.74 121.16 2ptl s LYS 21 Ca 0.58 -1.07 0.07 0.00 0.02 0.00 0.00 55.97 55.57 2ptl s LYS 21 Cb -0.04 0.32 0.18 0.00 -0.52 0.00 0.00 37.83 37.77 2ptl s LYS 21 CO 0.37 -0.27 0.68 0.00 -0.92 0.00 0.00 175.35 175.22 2ptl s ALA 22 N -3.90 -2.29 0.40 5.17 0.00 0.34 -3.44 121.76 118.04 2ptl s ALA 22 Ca 0.09 -0.06 -0.23 0.00 0.00 0.00 0.00 51.96 51.76 2ptl s ALA 22 Cb 0.05 -2.74 -0.10 0.00 0.00 0.00 0.00 23.12 20.34 2ptl s ALA 22 CO -0.08 -2.23 0.98 -0.80 0.00 0.00 0.00 175.76 173.62 2ptl s ASN 23 N 1.39 6.94 -0.36 0.00 0.01 -0.73 -0.14 114.94 122.06 2ptl s ASN 23 Ca 0.22 1.82 0.03 0.00 -0.71 0.00 0.00 52.86 54.23 2ptl s ASN 23 Cb -0.02 -2.56 0.10 0.00 0.41 0.00 0.00 41.25 39.18 2ptl s ASN 23 CO -0.06 -0.36 0.08 -0.76 -1.51 0.00 0.00 177.10 174.49 2ptl s LEU 24 N -2.83 4.42 -0.27 0.60 1.43 -0.37 -2.01 118.68 119.64 2ptl s LEU 24 Ca 0.59 -2.20 -0.08 0.00 -1.03 0.00 0.00 54.13 51.41 2ptl s LEU 24 Cb -0.15 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.51 2ptl s LEU 24 CO 0.19 -0.37 0.10 -0.63 0.23 0.00 0.00 176.35 175.88 2ptl s ILE 25 N 0.85 4.46 0.34 -0.59 1.01 -0.54 -1.31 121.20 125.42 2ptl s ILE 25 Ca 0.12 -0.25 0.07 0.00 0.00 0.00 0.00 60.65 60.58 2ptl s ILE 25 Cb -0.20 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.11 2ptl s ILE 25 CO -0.09 0.24 0.46 -0.36 0.00 0.00 0.00 174.94 175.19 2ptl s PHE 26 N 1.62 3.08 0.09 3.97 0.08 -0.82 -1.08 117.98 124.92 2ptl s PHE 26 Ca 0.06 -0.24 0.05 0.00 0.12 0.00 0.00 56.93 56.92 2ptl s PHE 26 Cb -0.16 -2.00 -0.23 0.00 -0.57 0.00 0.00 43.02 40.06 2ptl s PHE 26 CO 0.05 -0.02 1.17 0.00 -0.10 0.00 0.00 175.22 176.32 2ptl h ALA 27 N 0.90 0.35 0.00 5.36 0.00 -1.77 -3.43 119.26 120.67 2ptl h ALA 27 Ca -0.45 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 53.48 2ptl h ALA 27 Cb 1.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2ptl h ALA 27 CO 0.53 1.23 0.00 0.27 0.00 0.00 0.00 179.25 181.28 2ptl n ASN 28 N -3.36 0.00 -0.32 0.00 0.23 -1.26 -4.88 115.26 105.67 2ptl n ASN 28 Ca -0.04 0.00 0.17 0.00 -0.53 0.00 0.00 54.58 54.18 2ptl n ASN 28 Cb 0.97 0.00 0.34 0.00 -2.08 0.00 0.00 39.78 39.02 2ptl n ASN 28 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2ptl h GLY 29 N 0.00 1.48 0.00 4.83 0.00 -2.00 -3.45 103.07 103.93 2ptl h GLY 29 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2ptl h GLY 29 CO 0.00 -0.51 0.00 1.44 0.00 0.00 0.00 176.54 177.47 2ptl n SER 30 N -5.35 0.00 -4.27 0.19 7.64 -1.26 -5.06 113.62 105.51 2ptl n SER 30 Ca 0.25 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.82 2ptl n SER 30 Cb 0.83 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.86 2ptl n SER 30 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2ptl s THR 31 N -1.99 2.02 0.27 0.44 -1.32 -1.26 -1.94 115.64 111.86 2ptl s THR 31 Ca 0.00 -1.05 -0.10 0.00 -1.21 0.00 0.00 61.69 59.33 2ptl s THR 31 Cb 0.00 -1.71 -0.00 0.00 -1.51 0.00 0.00 72.50 69.28 2ptl s THR 31 CO 0.00 0.56 0.46 -1.58 -2.21 0.00 0.00 174.62 171.86 2ptl s GLN 32 N -0.20 1.64 -0.21 7.08 0.74 -0.43 -5.00 119.66 123.29 2ptl s GLN 32 Ca -0.02 -1.41 -0.03 0.00 0.05 0.00 0.00 55.36 53.94 2ptl s GLN 32 Cb -0.13 0.46 0.07 0.00 1.10 0.00 0.00 33.01 34.50 2ptl s GLN 32 CO 0.03 -0.68 0.07 0.95 -0.55 0.00 0.00 175.29 175.11 2ptl s THR 33 N -3.71 0.33 -0.18 -0.34 -4.23 -1.26 -1.24 115.64 105.00 2ptl s THR 33 Ca 0.25 -0.55 -0.09 0.00 -1.18 0.00 0.00 61.69 60.13 2ptl s THR 33 Cb -0.00 -0.96 -0.05 0.00 1.34 0.00 0.00 72.50 72.83 2ptl s THR 33 CO 0.12 -0.32 0.11 0.00 -0.54 0.00 0.00 174.62 173.99 2ptl s ALA 34 N 1.94 3.63 0.10 3.99 0.00 0.80 -4.89 121.76 127.33 2ptl s ALA 34 Ca 0.02 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.29 2ptl s ALA 34 Cb -0.17 -2.07 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 2ptl s ALA 34 CO -0.13 0.22 -0.05 -1.83 0.00 0.00 0.00 175.76 173.98 2ptl s GLU 35 N 0.19 0.84 -0.36 0.00 1.03 -1.26 0.13 118.70 119.27 2ptl s GLU 35 Ca 0.08 -1.35 0.01 0.00 0.03 0.00 0.00 54.97 53.74 2ptl s GLU 35 Cb -0.11 -0.14 0.15 0.00 -0.80 0.00 0.00 34.13 33.22 2ptl s GLU 35 CO -0.01 -0.05 0.29 -0.06 -1.33 0.00 0.00 175.26 174.10 2ptl s PHE 36 N -3.69 0.24 1.03 4.83 0.40 -1.25 -4.94 117.98 114.60 2ptl s PHE 36 Ca 0.13 -1.25 -0.17 0.00 -0.60 0.00 0.00 56.93 55.04 2ptl s PHE 36 Cb 0.06 -0.67 0.24 0.00 0.51 0.00 0.00 43.02 43.16 2ptl s PHE 36 CO -0.04 -0.90 1.33 -1.59 0.70 0.00 0.00 175.22 174.72 2ptl s LYS 37 N 1.23 0.10 0.00 0.44 0.00 -1.26 -4.01 119.74 116.24 2ptl s LYS 37 Ca 0.18 -0.50 0.00 0.00 0.00 0.00 0.00 55.97 55.65 2ptl s LYS 37 Cb -0.19 -1.79 0.00 0.00 0.00 0.00 0.00 37.83 35.84 2ptl s LYS 37 CO -0.01 -2.76 0.00 0.41 0.00 0.00 0.00 175.35 172.99 2ptl n GLY 38 N -3.55 2.46 3.08 0.59 0.00 -0.33 -4.88 105.19 102.56 2ptl n GLY 38 Ca 0.17 -0.69 -0.18 0.00 0.00 0.00 0.00 46.02 45.32 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 -4.64 114.28 116.65 2ptl n THR 39 Ca 0.00 -1.30 0.00 0.00 -3.05 0.00 0.00 64.05 59.70 2ptl n THR 39 Cb 0.00 -0.93 0.00 0.00 -1.55 0.00 0.00 70.33 67.85 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 -2.46 0.00 1.44 1.09 -0.00 -1.26 -4.58 117.46 111.68 2ptl n PHE 40 Ca 0.13 0.00 0.14 0.00 -0.00 0.00 0.00 57.45 57.72 2ptl n PHE 40 Cb 0.47 0.00 0.75 0.00 -0.00 0.00 0.00 39.48 40.70 2ptl n PHE 40 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 2ptl n GLU 41 N 0.00 0.48 0.22 -4.13 2.13 -1.26 -2.50 120.64 115.57 2ptl n GLU 41 Ca 0.00 0.01 0.14 0.00 0.66 0.00 0.00 57.16 57.97 2ptl n GLU 41 Cb 0.00 -1.50 0.44 0.00 0.27 0.00 0.00 31.44 30.65 2ptl n GLU 41 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2ptl h LYS 42 N 0.00 0.00 0.00 5.31 1.57 -2.01 -2.77 116.57 118.68 2ptl h LYS 42 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ptl h LYS 42 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2ptl h LYS 42 CO 0.00 0.00 -1.11 0.00 -0.57 0.00 0.00 179.45 177.77 2ptl n ALA 43 N -2.02 3.23 0.01 3.86 0.00 -1.04 -3.74 120.51 120.80 2ptl n ALA 43 Ca 0.03 -0.39 -0.11 0.00 0.00 0.00 0.00 53.44 52.96 2ptl n ALA 43 Cb 0.40 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 18.82 2ptl n ALA 43 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2ptl h THR 44 N 0.00 1.03 -0.04 0.00 1.35 -1.56 0.39 112.91 114.08 2ptl h THR 44 Ca 0.00 -0.07 -0.18 0.00 -0.55 0.00 0.00 66.41 65.62 2ptl h THR 44 Cb 0.79 0.94 -0.01 0.00 -1.73 0.00 0.00 68.15 68.14 2ptl h THR 44 CO 0.00 0.03 -0.75 0.28 -0.25 0.00 0.00 175.52 174.82 2ptl h SER 45 N 0.09 0.33 0.54 5.36 0.02 -1.74 -1.36 113.55 116.80 2ptl h SER 45 Ca 0.03 -0.23 -0.03 0.00 -0.84 0.00 0.00 61.79 60.72 2ptl h SER 45 Cb 0.00 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.44 2ptl h SER 45 CO -0.01 0.97 -0.15 -0.08 -1.14 0.00 0.00 176.83 176.43 2ptl h GLU 46 N 0.18 0.00 0.14 3.45 4.57 -1.56 -0.54 114.58 120.82 2ptl h GLU 46 Ca -0.03 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 57.95 2ptl h GLU 46 Cb 1.33 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 29.94 2ptl h GLU 46 CO 0.12 0.15 -0.90 0.00 -1.18 0.00 0.00 179.01 177.20 2ptl h ALA 47 N 1.85 -0.05 -0.15 2.92 0.00 0.14 0.28 119.26 124.25 2ptl h ALA 47 Ca -0.00 -0.76 0.02 0.00 0.00 0.00 0.00 54.91 54.17 2ptl h ALA 47 Cb 0.46 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2ptl h ALA 47 CO 0.02 0.44 0.10 -0.92 0.00 0.00 0.00 179.25 178.89 2ptl h TYR 48 N -0.37 0.13 0.00 0.00 5.03 -0.85 0.62 116.97 121.53 2ptl h TYR 48 Ca -0.17 0.00 -0.18 0.00 2.58 0.00 0.00 58.73 60.96 2ptl h TYR 48 Cb 1.66 -0.05 -0.03 0.00 1.55 0.00 0.00 36.73 39.86 2ptl h TYR 48 CO 0.19 0.08 -0.87 0.00 -1.32 0.00 0.00 178.16 176.24 2ptl h ALA 49 N 1.91 0.44 0.05 1.82 0.00 -1.09 -2.58 119.26 119.81 2ptl h ALA 49 Ca 0.06 -0.79 0.03 0.00 0.00 0.00 0.00 54.91 54.21 2ptl h ALA 49 Cb 0.08 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2ptl h ALA 49 CO -0.01 1.08 -0.25 -0.92 0.00 0.00 0.00 179.25 179.15 2ptl h TYR 50 N 0.00 -0.68 0.00 0.00 3.20 0.24 0.30 116.97 120.04 2ptl h TYR 50 Ca -0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2ptl h TYR 50 Cb 1.67 0.29 0.00 0.00 1.54 0.00 0.00 36.73 40.23 2ptl h TYR 50 CO 0.00 -0.35 0.00 0.00 -1.64 0.00 0.00 178.16 176.17 2ptl h ALA 51 N 0.37 1.00 -0.57 1.82 0.00 -1.32 -2.05 119.26 118.51 2ptl h ALA 51 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2ptl h ALA 51 Cb 0.48 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2ptl h ALA 51 CO -0.19 0.00 -0.01 0.22 0.00 0.00 0.00 179.25 179.27 2ptl h ASP 52 N 0.00 0.97 0.31 0.00 3.58 -0.05 -0.58 116.42 120.65 2ptl h ASP 52 Ca 0.00 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.18 2ptl h ASP 52 Cb 0.44 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.23 2ptl h ASP 52 CO 0.00 1.03 -0.02 1.07 -2.88 0.00 0.00 179.24 178.44 2ptl n THR 53 N -4.18 0.00 -0.75 2.25 5.66 -0.25 -3.73 114.28 113.27 2ptl n THR 53 Ca 0.03 -0.02 -0.11 0.00 -3.05 0.00 0.00 64.05 60.90 2ptl n THR 53 Cb 0.34 -0.40 0.02 0.00 -1.55 0.00 0.00 70.33 68.75 2ptl n THR 53 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 2ptl n LEU 54 N -1.08 6.06 -3.31 1.09 -0.00 -0.23 -4.70 117.00 114.83 2ptl n LEU 54 Ca 0.18 -2.98 -0.39 0.00 -0.00 0.00 0.00 56.01 52.83 2ptl n LEU 54 Cb 0.20 -1.09 -0.03 0.00 -0.00 0.00 0.00 43.42 42.51 2ptl n LEU 54 CO 0.21 1.15 3.19 2.29 -0.00 0.00 0.00 177.39 184.23 2ptl n LYS 55 N 0.78 3.83 -0.07 1.96 0.00 -1.24 -4.61 118.16 118.81 2ptl n LYS 55 Ca 0.19 -2.41 0.01 0.00 -0.00 0.00 0.00 58.31 56.10 2ptl n LYS 55 Cb 0.55 -2.75 0.04 0.00 -0.00 0.00 0.00 35.03 32.87 2ptl n LYS 55 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 2ptl n LYS 56 N 3.20 1.31 -1.36 -1.58 2.85 -1.26 -4.77 118.16 116.55 2ptl n LYS 56 Ca 0.75 -0.29 0.00 0.00 -1.05 0.00 0.00 58.31 57.72 2ptl n LYS 56 Cb 0.25 -1.39 0.00 0.00 -0.65 0.00 0.00 35.03 33.24 2ptl n LYS 56 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2ptl n ASP 57 N -0.06 -0.98 -0.01 -5.58 2.03 -1.26 -5.03 116.55 105.65 2ptl n ASP 57 Ca 0.03 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.33 2ptl n ASP 57 Cb 0.24 -0.29 -0.00 0.00 -0.72 0.00 0.00 41.12 40.35 2ptl n ASP 57 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 2ptl h ASN 58 N 0.00 0.00 0.00 1.67 2.35 -1.86 -3.45 115.58 114.29 2ptl h ASN 58 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2ptl h ASN 58 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.95 2ptl h ASN 58 CO 0.00 0.12 0.00 0.61 -1.65 0.00 0.00 177.43 176.51 2ptl n GLY 59 N 1.88 0.00 1.07 2.83 0.00 -1.26 -0.62 105.19 109.08 2ptl n GLY 59 Ca -0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.00 -2.15 -3.89 1.61 1.02 -1.26 -4.18 120.64 111.80 2ptl n GLU 60 Ca 0.00 1.41 -0.09 0.00 -0.02 0.00 0.00 57.16 58.46 2ptl n GLU 60 Cb 0.00 -2.62 -0.01 0.00 -0.02 0.00 0.00 31.44 28.80 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 -1.90 0.25 -0.14 -0.32 -0.85 -1.26 -1.51 117.35 111.62 2ptl s TYR 61 Ca 0.00 -0.76 -0.01 0.00 -0.52 0.00 0.00 57.07 55.77 2ptl s TYR 61 Cb 0.00 0.57 -0.02 0.00 0.38 0.00 0.00 41.96 42.89 2ptl s TYR 61 CO 0.00 -1.36 -0.10 -0.08 -1.52 0.00 0.00 175.55 172.50 2ptl s THR 62 N -2.99 3.37 -0.27 -3.49 -1.32 -1.22 -4.90 115.64 104.82 2ptl s THR 62 Ca 0.18 -0.55 -0.29 0.00 -1.21 0.00 0.00 61.69 59.82 2ptl s THR 62 Cb -0.04 -2.44 0.01 0.00 -1.51 0.00 0.00 72.50 68.53 2ptl s THR 62 CO 0.12 0.52 1.05 0.54 -2.21 0.00 0.00 174.62 174.64 2ptl s VAL 63 N 0.29 4.61 -0.29 5.08 0.11 -1.26 -3.59 120.40 125.36 2ptl s VAL 63 Ca -0.07 1.91 -0.22 0.00 -2.93 0.00 0.00 61.98 60.67 2ptl s VAL 63 Cb -0.15 -4.35 -0.01 0.00 -1.53 0.00 0.00 36.38 30.34 2ptl s VAL 63 CO 0.05 -0.30 0.70 -1.81 -3.33 0.00 0.00 175.10 170.41 2ptl s ASP 64 N 1.38 6.60 -0.35 3.54 1.01 -1.15 -4.94 116.67 122.76 2ptl s ASP 64 Ca 0.44 0.64 -0.19 0.00 0.71 0.00 0.00 52.55 54.15 2ptl s ASP 64 Cb -0.14 -2.37 0.00 0.00 1.01 0.00 0.00 42.92 41.43 2ptl s ASP 64 CO 0.10 -0.50 0.59 -0.69 0.21 0.00 0.00 175.17 174.88 2ptl s VAL 65 N 2.71 4.94 0.26 -1.27 1.01 -1.26 -2.68 120.40 124.11 2ptl s VAL 65 Ca 0.29 0.48 -0.07 0.00 0.00 0.00 0.00 61.98 62.67 2ptl s VAL 65 Cb -0.15 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 2ptl s VAL 65 CO 0.11 -0.28 0.38 0.00 0.00 0.00 0.00 175.10 175.31 2ptl s ALA 66 N 2.58 0.37 -0.97 5.51 0.00 -0.94 -4.82 121.76 123.49 2ptl s ALA 66 Ca 0.22 -1.25 -0.06 0.00 0.00 0.00 0.00 51.96 50.87 2ptl s ALA 66 Cb -0.15 1.18 0.01 0.00 0.00 0.00 0.00 23.12 24.16 2ptl s ALA 66 CO 0.14 -0.77 0.81 -3.47 0.00 0.00 0.00 175.76 172.47 2ptl n ASP 67 N -0.59 -5.09 -2.60 0.00 -0.08 -1.26 -1.53 116.55 105.41 2ptl n ASP 67 Ca 0.00 -0.37 -0.19 0.00 -1.51 0.00 0.00 54.79 52.72 2ptl n ASP 67 Cb 0.63 -3.70 0.03 0.00 2.34 0.00 0.00 41.12 40.41 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 -3.64 -4.01 -2.56 -0.67 2.85 -1.26 -2.57 118.16 106.30 2ptl n LYS 68 Ca 0.00 0.81 -0.04 0.00 -1.05 0.00 0.00 58.31 58.03 2ptl n LYS 68 Cb 0.55 -5.43 0.01 0.00 -0.65 0.00 0.00 35.03 29.51 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 -1.39 0.63 0.00 2.58 0.00 -1.09 -4.94 105.19 100.98 2ptl n GLY 69 Ca -0.11 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.11 0.00 -3.69 1.61 9.36 -0.91 -4.98 117.16 115.43 2ptl n TYR 70 Ca -0.01 0.00 -0.36 0.00 3.32 0.00 0.00 57.90 60.85 2ptl n TYR 70 Cb 0.51 0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 39.13 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 -1.77 5.28 -0.37 2.97 2.01 -0.58 -2.42 115.64 120.76 2ptl s THR 71 Ca 0.00 0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.15 2ptl s THR 71 Cb 0.00 -3.45 0.10 0.00 0.01 0.00 0.00 72.50 69.16 2ptl s THR 71 CO 0.00 0.36 0.12 -0.76 -0.69 0.00 0.00 174.62 173.64 2ptl s LEU 72 N 0.99 4.90 -0.82 4.42 1.43 -1.22 -2.21 118.68 126.17 2ptl s LEU 72 Ca 0.07 -2.01 -0.26 0.00 -1.03 0.00 0.00 54.13 50.90 2ptl s LEU 72 Cb -0.13 -1.73 0.04 0.00 0.03 0.00 0.00 46.19 44.40 2ptl s LEU 72 CO 0.04 -0.44 1.32 0.20 0.23 0.00 0.00 176.35 177.69 2ptl s ASN 73 N 1.38 6.26 0.31 2.29 0.02 -1.09 -1.77 114.94 122.33 2ptl s ASN 73 Ca 0.08 -0.76 -0.25 0.00 -1.02 0.00 0.00 52.86 50.91 2ptl s ASN 73 Cb -0.21 -2.56 -0.10 0.00 0.02 0.00 0.00 41.25 38.41 2ptl s ASN 73 CO -0.06 -1.73 0.91 -0.63 0.02 0.00 0.00 177.10 175.62 2ptl s ILE 74 N 5.46 4.26 -0.32 0.60 1.01 -0.85 -2.94 121.20 128.42 2ptl s ILE 74 Ca 0.38 1.75 -0.01 0.00 0.00 0.00 0.00 60.65 62.77 2ptl s ILE 74 Cb -0.06 -3.99 0.10 0.00 0.01 0.00 0.00 42.46 38.52 2ptl s ILE 74 CO 0.08 0.15 0.12 -0.75 0.00 0.00 0.00 174.94 174.53 2ptl s LYS 75 N -2.04 0.67 0.16 2.79 2.47 -1.24 -1.46 119.74 121.10 2ptl s LYS 75 Ca 0.49 -1.07 -0.30 0.00 -1.56 0.00 0.00 55.97 53.53 2ptl s LYS 75 Cb -0.18 -1.87 -0.07 0.00 -1.46 0.00 0.00 37.83 34.24 2ptl s LYS 75 CO 0.23 -1.01 1.14 -0.06 0.16 0.00 0.00 175.35 175.81 2ptl s PHE 76 N 1.58 3.53 0.05 4.03 0.40 -0.24 -3.41 117.98 123.91 2ptl s PHE 76 Ca 0.11 1.52 -0.32 0.00 -0.60 0.00 0.00 56.93 57.64 2ptl s PHE 76 Cb -0.18 -3.33 -0.18 0.00 0.51 0.00 0.00 43.02 39.84 2ptl s PHE 76 CO -0.24 -0.84 1.45 0.00 0.70 0.00 0.00 175.22 176.29 2ptl h ALA 77 N 5.37 -1.28 0.00 5.36 0.00 -1.43 -3.35 119.26 123.93 2ptl h ALA 77 Ca -0.44 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2ptl h ALA 77 Cb 1.21 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2ptl h ALA 77 CO 0.74 -1.20 0.00 0.41 0.00 0.00 0.00 179.25 179.20