#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k50 s GLU 3 N 0.00 3.86 0.04 5.31 0.41 -1.26 -4.32 118.70 122.75 1k50 s GLU 3 Ca 0.00 0.33 0.04 0.00 -0.41 0.00 0.00 54.97 54.92 1k50 s GLU 3 Cb 0.00 -3.23 -0.02 0.00 -1.78 0.00 0.00 34.13 29.10 1k50 s GLU 3 CO 0.00 0.68 -0.11 0.14 -0.49 0.00 0.00 175.26 175.48 1k50 s VAL 4 N -1.00 0.86 -0.19 2.63 -7.23 0.11 -4.94 120.40 110.64 1k50 s VAL 4 Ca 0.22 -0.98 -0.05 0.00 -1.81 0.00 0.00 61.98 59.36 1k50 s VAL 4 Cb -0.16 -0.82 -0.03 0.00 0.56 0.00 0.00 36.38 35.93 1k50 s VAL 4 CO 0.12 -0.14 0.00 -0.89 -0.31 0.00 0.00 175.10 173.88 1k50 s THR 5 N -0.99 4.07 -0.27 5.32 2.01 -1.26 -1.62 115.64 122.90 1k50 s THR 5 Ca -0.02 -0.28 -0.03 0.00 0.31 0.00 0.00 61.69 61.67 1k50 s THR 5 Cb -0.08 -2.83 0.02 0.00 0.01 0.00 0.00 72.50 69.62 1k50 s THR 5 CO 0.01 0.44 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.74 1k50 s ILE 6 N 0.80 3.17 -0.34 1.82 -1.09 0.28 -4.98 121.20 120.86 1k50 s ILE 6 Ca 0.01 -0.99 -0.14 0.00 -2.23 0.00 0.00 60.65 57.30 1k50 s ILE 6 Cb -0.14 -2.65 -0.01 0.00 -1.58 0.00 0.00 42.46 38.07 1k50 s ILE 6 CO 0.02 0.12 0.29 -0.75 -1.23 0.00 0.00 174.94 173.40 1k50 s LYS 7 N 1.36 3.51 -0.27 2.79 2.20 -1.26 -0.98 119.74 127.09 1k50 s LYS 7 Ca 0.00 -0.55 -0.11 0.00 -0.36 0.00 0.00 55.97 54.95 1k50 s LYS 7 Cb -0.17 -3.81 -0.05 0.00 -1.51 0.00 0.00 37.83 32.29 1k50 s LYS 7 CO -0.02 -0.49 0.18 0.00 -0.36 0.00 0.00 175.35 174.66 1k50 s ALA 8 N 1.85 3.51 -0.40 3.13 0.00 0.27 -4.97 121.76 125.15 1k50 s ALA 8 Ca 0.09 -1.08 -0.12 0.00 0.00 0.00 0.00 51.96 50.85 1k50 s ALA 8 Cb -0.17 -2.44 0.04 0.00 0.00 0.00 0.00 23.12 20.55 1k50 s ALA 8 CO 0.11 -0.52 0.25 -0.80 0.00 0.00 0.00 175.76 174.80 1k50 s ASN 9 N 1.69 5.82 -0.07 0.00 0.01 -1.26 -1.42 114.94 119.70 1k50 s ASN 9 Ca 0.07 -1.10 -0.24 0.00 -0.71 0.00 0.00 52.86 50.88 1k50 s ASN 9 Cb -0.16 -2.05 -0.04 0.00 0.41 0.00 0.00 41.25 39.41 1k50 s ASN 9 CO 0.10 -0.45 0.71 -0.76 -1.51 0.00 0.00 177.10 175.19 1k50 s LEU 10 N 1.56 4.31 -0.19 0.60 1.02 0.30 -4.95 118.68 121.32 1k50 s LEU 10 Ca 0.03 1.19 0.00 0.00 0.02 0.00 0.00 54.13 55.37 1k50 s LEU 10 Cb -0.20 -3.09 0.04 0.00 0.02 0.00 0.00 46.19 42.96 1k50 s LEU 10 CO 0.06 -0.14 -0.08 -0.63 0.02 0.00 0.00 176.35 175.59 1k50 s ILE 11 N 0.89 1.44 0.56 -0.59 1.01 -1.26 -1.67 121.20 121.58 1k50 s ILE 11 Ca 0.38 -0.91 -0.06 0.00 0.00 0.00 0.00 60.65 60.06 1k50 s ILE 11 Cb -0.18 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 40.70 1k50 s ILE 11 CO 0.18 0.12 0.88 -0.36 0.00 0.00 0.00 174.94 175.75 1k50 s PHE 12 N 1.48 3.39 0.20 3.97 0.08 -0.22 -4.97 117.98 121.91 1k50 s PHE 12 Ca -0.01 0.76 -0.10 0.00 0.12 0.00 0.00 56.93 57.70 1k50 s PHE 12 Cb -0.16 -2.60 0.22 0.00 -0.57 0.00 0.00 43.02 39.91 1k50 s PHE 12 CO -0.08 -0.65 1.80 0.00 -0.10 0.00 0.00 175.22 176.20 1k50 h ALA 13 N -0.07 0.85 0.00 5.36 0.00 -1.88 -0.43 119.26 123.09 1k50 h ALA 13 Ca -0.46 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1k50 h ALA 13 Cb 1.23 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1k50 h ALA 13 CO 0.61 0.02 0.00 0.27 0.00 0.00 0.00 179.25 180.15 1k50 n ASN 14 N -4.81 0.00 0.00 0.00 6.94 -1.26 -4.85 115.26 111.28 1k50 n ASN 14 Ca 0.08 -0.90 0.00 0.00 -0.02 0.00 0.00 54.58 53.74 1k50 n ASN 14 Cb 0.17 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.59 1k50 n ASN 14 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1k50 n GLY 15 N 0.15 3.14 3.74 4.83 0.00 -0.17 -5.05 105.19 111.84 1k50 n GLY 15 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1k50 n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k50 s SER 16 N -1.13 4.20 0.27 1.61 1.04 -1.26 -4.74 113.70 113.69 1k50 s SER 16 Ca 0.00 1.97 0.03 0.00 0.48 0.00 0.00 55.95 58.43 1k50 s SER 16 Cb 0.00 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.54 1k50 s SER 16 CO 0.00 -2.24 0.20 0.42 0.98 0.00 0.00 173.24 172.59 1k50 s THR 17 N -2.71 0.05 -0.01 2.02 -4.23 -1.26 -1.06 115.64 108.44 1k50 s THR 17 Ca 0.64 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.94 1k50 s THR 17 Cb -0.20 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 71.18 1k50 s THR 17 CO 0.54 0.00 0.46 -1.10 -0.54 0.00 0.00 174.62 173.98 1k50 s GLN 18 N -3.82 0.86 -0.06 3.99 -0.21 -0.67 -4.99 119.66 114.76 1k50 s GLN 18 Ca 0.39 -0.09 0.01 0.00 0.02 0.00 0.00 55.36 55.70 1k50 s GLN 18 Cb 0.05 0.39 0.02 0.00 1.00 0.00 0.00 33.01 34.47 1k50 s GLN 18 CO 0.19 -0.27 -0.07 0.99 -2.12 0.00 0.00 175.29 174.01 1k50 s THR 19 N -1.59 0.78 0.08 -0.19 2.01 -1.26 -0.54 115.64 114.93 1k50 s THR 19 Ca -0.11 -0.25 0.05 0.00 0.31 0.00 0.00 61.69 61.69 1k50 s THR 19 Cb -0.02 -0.77 -0.03 0.00 0.01 0.00 0.00 72.50 71.69 1k50 s THR 19 CO 0.04 0.28 -0.14 0.00 -0.69 0.00 0.00 174.62 174.12 1k50 s ALA 20 N 0.92 1.18 0.01 7.40 0.00 -0.51 -4.99 121.76 125.77 1k50 s ALA 20 Ca -0.11 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 50.85 1k50 s ALA 20 Cb -0.15 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1k50 s ALA 20 CO 0.01 0.14 -0.12 -1.21 0.00 0.00 0.00 175.76 174.58 1k50 s GLU 21 N -1.92 0.87 0.02 0.00 2.02 -1.26 0.95 118.70 119.38 1k50 s GLU 21 Ca -0.01 -0.53 0.04 0.00 0.02 0.00 0.00 54.97 54.49 1k50 s GLU 21 Cb -0.09 -0.84 -0.02 0.00 0.10 0.00 0.00 34.13 33.28 1k50 s GLU 21 CO 0.02 0.22 -0.11 -0.06 0.02 0.00 0.00 175.26 175.35 1k50 s PHE 22 N -0.51 0.96 0.03 1.61 0.40 -0.15 -4.98 117.98 115.34 1k50 s PHE 22 Ca 0.02 -0.30 0.04 0.00 -0.60 0.00 0.00 56.93 56.10 1k50 s PHE 22 Cb -0.06 -0.58 -0.02 0.00 0.51 0.00 0.00 43.02 42.87 1k50 s PHE 22 CO 0.00 -0.00 -0.13 0.15 0.70 0.00 0.00 175.22 175.94 1k50 s LYS 23 N -0.86 0.91 0.00 0.44 1.02 -1.26 -0.56 119.74 119.43 1k50 s LYS 23 Ca 0.00 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.30 1k50 s LYS 23 Cb -0.06 -0.90 0.00 0.00 -0.52 0.00 0.00 37.83 36.34 1k50 s LYS 23 CO 0.01 0.23 0.00 0.41 -0.92 0.00 0.00 175.35 175.07 1k50 n GLY 24 N 2.03 -0.49 3.77 -3.33 0.00 -0.64 -4.71 105.19 101.82 1k50 n GLY 24 Ca -0.17 -1.01 -0.32 0.00 0.00 0.00 0.00 46.02 44.52 1k50 n GLY 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k50 s THR 25 N -3.32 3.28 0.19 2.61 -4.23 -1.26 0.06 115.64 112.98 1k50 s THR 25 Ca 0.00 0.46 -0.15 0.00 -1.18 0.00 0.00 61.69 60.82 1k50 s THR 25 Cb 0.00 -2.95 0.17 0.00 1.34 0.00 0.00 72.50 71.06 1k50 s THR 25 CO 0.00 -0.50 1.64 0.15 -0.54 0.00 0.00 174.62 175.38 1k50 h PHE 26 N -0.82 -0.30 0.04 3.99 3.04 -1.91 0.95 116.94 121.93 1k50 h PHE 26 Ca -0.44 0.05 0.02 0.00 3.98 0.00 0.00 57.97 61.57 1k50 h PHE 26 Cb 1.24 0.22 -0.02 0.00 2.56 0.00 0.00 35.95 39.94 1k50 h PHE 26 CO 0.57 -0.23 -0.13 1.49 -2.02 0.00 0.00 178.31 177.98 1k50 h GLU 27 N -0.01 -0.24 -0.26 1.11 4.81 -1.97 -2.30 114.58 115.73 1k50 h GLU 27 Ca 0.25 0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 1k50 h GLU 27 Cb 0.39 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1k50 h GLU 27 CO -0.55 -0.16 -0.05 -0.22 -0.73 0.00 0.00 179.01 177.30 1k50 h LYS 28 N -0.25 0.49 -0.41 1.92 3.64 -1.75 -1.12 116.57 119.10 1k50 h LYS 28 Ca 0.04 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.15 1k50 h LYS 28 Cb 0.29 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1k50 h LYS 28 CO -0.11 0.71 -0.05 0.00 -2.27 0.00 0.00 179.45 177.73 1k50 h ALA 29 N 0.77 0.56 0.12 5.00 0.00 -0.87 0.19 119.26 125.03 1k50 h ALA 29 Ca 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1k50 h ALA 29 Cb 0.52 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1k50 h ALA 29 CO 0.02 0.40 -0.06 1.15 0.00 0.00 0.00 179.25 180.76 1k50 h THR 30 N 0.59 0.93 -0.84 0.00 2.02 -1.46 -2.23 112.91 111.91 1k50 h THR 30 Ca 0.11 -0.16 0.05 0.00 0.77 0.00 0.00 66.41 67.18 1k50 h THR 30 Cb 0.56 1.03 -0.05 0.00 -1.74 0.00 0.00 68.15 67.95 1k50 h THR 30 CO 0.03 0.04 0.55 0.28 0.37 0.00 0.00 175.52 176.79 1k50 h SER 31 N -0.23 0.87 -0.07 4.18 0.02 -1.06 -0.83 113.55 116.44 1k50 h SER 31 Ca -0.02 -0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.83 1k50 h SER 31 Cb 0.18 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 1k50 h SER 31 CO 0.03 0.58 -0.26 -0.33 -1.14 0.00 0.00 176.83 175.71 1k50 h GLU 32 N 1.00 0.50 -0.20 3.45 5.08 -0.75 -1.00 114.58 122.65 1k50 h GLU 32 Ca 0.35 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1k50 h GLU 32 Cb 0.11 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1k50 h GLU 32 CO -0.11 0.72 0.06 0.00 -1.00 0.00 0.00 179.01 178.68 1k50 h ALA 33 N 1.29 0.26 -0.66 3.43 0.00 -0.63 -0.15 119.26 122.80 1k50 h ALA 33 Ca 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1k50 h ALA 33 Cb 0.68 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 1k50 h ALA 33 CO 0.05 -0.11 0.38 1.88 0.00 0.00 0.00 179.25 181.45 1k50 h TYR 34 N 0.15 0.88 -0.60 0.00 0.05 -0.99 -1.26 116.97 115.20 1k50 h TYR 34 Ca 0.06 -0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.79 1k50 h TYR 34 Cb 0.23 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.66 1k50 h TYR 34 CO 0.00 0.61 0.18 0.00 -1.05 0.00 0.00 178.16 177.90 1k50 h ALA 35 N 1.19 1.18 -0.15 3.88 0.00 -0.97 -0.35 119.26 124.05 1k50 h ALA 35 Ca 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1k50 h ALA 35 Cb -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1k50 h ALA 35 CO -0.04 0.57 0.05 -0.92 0.00 0.00 0.00 179.25 178.91 1k50 h TYR 36 N 0.89 0.23 -0.87 0.00 3.20 -0.62 -2.35 116.97 117.46 1k50 h TYR 36 Ca 0.20 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.12 1k50 h TYR 36 Cb 0.27 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.42 1k50 h TYR 36 CO 0.02 0.33 0.56 0.00 -1.64 0.00 0.00 178.16 177.43 1k50 h ALA 37 N 0.87 1.57 0.00 1.82 0.00 -0.80 -1.47 119.26 121.25 1k50 h ALA 37 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1k50 h ALA 37 Cb 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1k50 h ALA 37 CO -0.00 0.30 -0.08 -0.44 0.00 0.00 0.00 179.25 179.02 1k50 h ASP 38 N 0.95 0.00 0.86 0.00 3.32 -0.54 -1.19 116.42 119.82 1k50 h ASP 38 Ca 0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 1k50 h ASP 38 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1k50 h ASP 38 CO -0.14 0.08 0.00 0.71 -1.72 0.00 0.00 179.24 178.17 1k50 h THR 39 N 0.00 0.00 -0.01 0.35 1.35 -0.94 -2.37 112.91 111.30 1k50 h THR 39 Ca -0.00 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 1k50 h THR 39 Cb 0.15 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 1k50 h THR 39 CO 0.01 0.00 -0.42 0.18 -0.25 0.00 0.00 175.52 175.04 1k50 n LEU 40 N -3.08 1.13 -0.19 3.87 4.77 -0.46 -4.29 117.00 118.76 1k50 n LEU 40 Ca 0.00 -0.34 -0.03 0.00 -0.03 0.00 0.00 56.01 55.62 1k50 n LEU 40 Cb 0.27 -0.11 0.18 0.00 -2.33 0.00 0.00 43.42 41.43 1k50 n LEU 40 CO 0.26 0.22 1.06 0.11 -1.33 0.00 0.00 177.39 177.72 1k50 h LYS 41 N 1.11 0.95 -0.80 3.23 1.57 -1.40 -1.14 116.57 120.09 1k50 h LYS 41 Ca 0.00 -0.15 0.18 0.00 -1.87 0.00 0.00 60.65 58.81 1k50 h LYS 41 Cb 0.56 -0.17 -0.15 0.00 0.08 0.00 0.00 32.23 32.56 1k50 h LYS 41 CO 0.00 0.77 -0.08 -0.22 -0.57 0.00 0.00 179.45 179.35 1k50 h LYS 42 N 0.93 0.04 -0.15 3.15 3.64 -1.76 0.03 116.57 122.45 1k50 h LYS 42 Ca 0.22 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1k50 h LYS 42 Cb 0.17 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1k50 h LYS 42 CO -0.02 0.03 0.00 -0.25 -2.27 0.00 0.00 179.45 176.94 1k50 n ASP 43 N -5.44 2.30 0.00 4.20 8.00 -1.10 -4.65 116.55 119.85 1k50 n ASP 43 Ca 0.14 -1.69 0.00 0.00 0.71 0.00 0.00 54.79 53.95 1k50 n ASP 43 Cb 0.48 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.48 1k50 n ASP 43 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1k50 n ASN 44 N 0.48 0.31 0.00 -2.24 3.02 -0.45 -5.15 115.26 111.23 1k50 n ASN 44 Ca 0.08 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.96 1k50 n ASN 44 Cb 0.32 0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.76 1k50 n ASN 44 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k50 n GLY 45 N 0.27 -3.03 3.80 7.41 0.00 -0.06 -4.83 105.19 108.76 1k50 n GLY 45 Ca 0.00 -1.89 -0.32 0.00 0.00 0.00 0.00 46.02 43.81 1k50 n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k50 s GLU 46 N -0.65 3.07 0.16 1.61 0.41 -1.26 -4.29 118.70 117.75 1k50 s GLU 46 Ca 0.00 1.15 0.09 0.00 -0.41 0.00 0.00 54.97 55.80 1k50 s GLU 46 Cb 0.00 -2.00 -0.04 0.00 -1.78 0.00 0.00 34.13 30.31 1k50 s GLU 46 CO 0.00 -1.01 -0.20 1.67 -0.49 0.00 0.00 175.26 175.24 1k50 s TRP 47 N -2.65 1.88 0.19 1.61 1.48 -1.26 -5.09 118.94 115.11 1k50 s TRP 47 Ca 0.62 -0.44 0.10 0.00 -1.06 0.00 0.00 56.10 55.32 1k50 s TRP 47 Cb -0.16 -0.96 -0.04 0.00 -1.16 0.00 0.00 33.47 31.15 1k50 s TRP 47 CO 0.44 0.33 -0.21 0.95 -4.06 0.00 0.00 176.95 174.40 1k50 s THR 48 N -1.81 2.09 0.13 0.66 -4.23 -1.26 -5.15 115.64 106.07 1k50 s THR 48 Ca 0.14 -2.02 0.08 0.00 -1.18 0.00 0.00 61.69 58.72 1k50 s THR 48 Cb -0.07 -2.00 -0.04 0.00 1.34 0.00 0.00 72.50 71.73 1k50 s THR 48 CO 0.07 -0.25 -0.19 0.00 -0.54 0.00 0.00 174.62 173.70 1k50 s ALA 49 N -1.96 1.90 -0.13 3.99 0.00 -1.26 -5.08 121.76 119.21 1k50 s ALA 49 Ca 0.19 -1.36 -0.05 0.00 0.00 0.00 0.00 51.96 50.74 1k50 s ALA 49 Cb -0.06 -0.21 0.06 0.00 0.00 0.00 0.00 23.12 22.90 1k50 s ALA 49 CO 0.09 0.30 0.28 0.34 0.00 0.00 0.00 175.76 176.76 1k50 s ASP 50 N -2.28 0.10 -0.62 0.00 -1.08 -1.26 -5.10 116.67 106.43 1k50 s ASP 50 Ca 0.11 0.62 -0.24 0.00 -0.52 0.00 0.00 52.55 52.52 1k50 s ASP 50 Cb -0.08 0.68 0.05 0.00 -1.46 0.00 0.00 42.92 42.11 1k50 s ASP 50 CO 0.05 -0.22 1.00 -0.69 0.52 0.00 0.00 175.17 175.83 1k50 s VAL 51 N 2.08 4.27 -0.12 1.11 1.01 -1.26 -4.89 120.40 122.60 1k50 s VAL 51 Ca -0.02 0.07 0.15 0.00 0.00 0.00 0.00 61.98 62.18 1k50 s VAL 51 Cb -0.11 -4.65 0.07 0.00 0.00 0.00 0.00 36.38 31.69 1k50 s VAL 51 CO -0.09 -1.34 1.48 0.00 0.00 0.00 0.00 175.10 175.14 1k50 h ALA 52 N 9.50 0.70 -2.42 5.51 0.00 -1.99 -3.47 119.26 127.10 1k50 h ALA 52 Ca -0.27 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.10 1k50 h ALA 52 Cb 1.07 -0.08 -0.18 0.00 0.00 0.00 0.00 17.79 18.60 1k50 h ALA 52 CO 1.15 0.62 -0.11 0.34 0.00 0.00 0.00 179.25 181.24 1k50 s ASP 53 N -6.45 -0.32 -0.07 0.00 2.15 -1.26 -5.14 116.67 105.57 1k50 s ASP 53 Ca 0.04 0.17 0.05 0.00 0.43 0.00 0.00 52.55 53.24 1k50 s ASP 53 Cb 0.08 0.40 -0.01 0.00 -0.30 0.00 0.00 42.92 43.09 1k50 s ASP 53 CO 0.74 -0.57 -0.24 -0.54 -0.17 0.00 0.00 175.17 174.39 1k50 s LYS 54 N -1.80 2.73 0.14 4.34 1.02 -1.26 -5.11 119.74 119.80 1k50 s LYS 54 Ca -0.10 -0.88 0.07 0.00 0.02 0.00 0.00 55.97 55.08 1k50 s LYS 54 Cb -0.02 -2.23 -0.04 0.00 -0.52 0.00 0.00 37.83 35.02 1k50 s LYS 54 CO 0.03 0.32 -0.15 0.20 -0.92 0.00 0.00 175.35 174.82 1k50 s GLY 55 N -0.02 1.21 0.04 -3.33 0.00 -1.26 -5.15 107.32 98.82 1k50 s GLY 55 Ca -0.08 -1.39 -0.08 0.00 0.00 0.00 0.00 44.72 43.17 1k50 s GLY 55 CO 0.05 -1.45 0.17 -0.19 0.00 0.00 0.00 173.10 171.68 1k50 s TYR 56 N -2.19 0.10 -0.17 1.90 2.02 -1.26 -5.08 117.35 112.67 1k50 s TYR 56 Ca 0.12 -0.36 -0.07 0.00 -0.37 0.00 0.00 57.07 56.40 1k50 s TYR 56 Cb -0.05 -0.06 -0.04 0.00 -0.40 0.00 0.00 41.96 41.42 1k50 s TYR 56 CO 0.04 -0.42 0.04 0.99 -1.57 0.00 0.00 175.55 174.63 1k50 s THR 57 N -2.70 4.62 -0.36 -0.71 2.01 -1.26 -5.07 115.64 112.17 1k50 s THR 57 Ca -0.04 -0.10 -0.06 0.00 0.31 0.00 0.00 61.69 61.81 1k50 s THR 57 Cb -0.00 -3.07 0.06 0.00 0.01 0.00 0.00 72.50 69.50 1k50 s THR 57 CO -0.05 0.47 0.14 -0.22 -0.69 0.00 0.00 174.62 174.28 1k50 s LEU 58 N 0.30 4.61 -0.35 4.42 2.96 -1.26 -5.06 118.68 124.31 1k50 s LEU 58 Ca 0.02 -1.40 -0.23 0.00 -0.22 0.00 0.00 54.13 52.30 1k50 s LEU 58 Cb -0.13 -1.86 0.01 0.00 0.50 0.00 0.00 46.19 44.71 1k50 s LEU 58 CO 0.01 -0.40 0.76 0.20 -1.32 0.00 0.00 176.35 175.59 1k50 s ASN 59 N 1.63 6.55 -0.23 3.68 0.01 -1.26 -5.03 114.94 120.29 1k50 s ASN 59 Ca 0.01 0.39 -0.04 0.00 -0.71 0.00 0.00 52.86 52.51 1k50 s ASN 59 Cb -0.21 -2.39 0.00 0.00 0.41 0.00 0.00 41.25 39.06 1k50 s ASN 59 CO 0.01 -0.68 -0.04 -0.63 -1.51 0.00 0.00 177.10 174.25 1k50 s ILE 60 N 3.00 3.29 -0.17 0.60 1.01 -1.26 -5.10 121.20 122.58 1k50 s ILE 60 Ca 0.30 -0.62 -0.01 0.00 0.00 0.00 0.00 60.65 60.32 1k50 s ILE 60 Cb -0.14 -2.55 -0.01 0.00 0.01 0.00 0.00 42.46 39.78 1k50 s ILE 60 CO 0.15 0.36 -0.10 -0.75 0.00 0.00 0.00 174.94 174.60 1k50 s LYS 61 N 1.45 3.37 0.00 2.79 2.20 -1.26 -5.11 119.74 123.17 1k50 s LYS 61 Ca 0.05 -0.67 -0.12 0.00 -0.36 0.00 0.00 55.97 54.87 1k50 s LYS 61 Cb -0.15 -2.77 -0.05 0.00 -1.51 0.00 0.00 37.83 33.35 1k50 s LYS 61 CO -0.03 0.04 0.35 -0.06 -0.36 0.00 0.00 175.35 175.29 1k50 s PHE 62 N 0.81 3.66 -0.32 4.03 0.40 -1.26 -5.01 117.98 120.29 1k50 s PHE 62 Ca -0.04 0.84 0.21 0.00 -0.60 0.00 0.00 56.93 57.34 1k50 s PHE 62 Cb -0.15 -2.18 0.18 0.00 0.51 0.00 0.00 43.02 41.38 1k50 s PHE 62 CO 0.01 0.63 1.41 0.00 0.70 0.00 0.00 175.22 177.97 1k50 h ALA 63 N 4.46 0.81 0.00 5.36 0.00 -2.08 -3.58 119.26 124.23 1k50 h ALA 63 Ca -0.51 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1k50 h ALA 63 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1k50 h ALA 63 CO 0.62 0.20 0.00 0.41 0.00 0.00 0.00 179.25 180.48