#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k7i s TYR 2 N 0.00 1.88 0.31 1.12 -0.85 -1.26 -4.97 117.35 113.57 2k7i s TYR 2 Ca 0.00 1.15 -0.18 0.00 -0.52 0.00 0.00 57.07 57.52 2k7i s TYR 2 Cb 0.00 -3.19 0.06 0.00 0.38 0.00 0.00 41.96 39.21 2k7i s TYR 2 CO 0.00 -3.11 0.87 -1.59 -1.52 0.00 0.00 175.55 170.21 2k7i s LYS 3 N -4.78 1.90 -0.26 -3.49 0.00 -1.26 -4.99 119.74 106.85 2k7i s LYS 3 Ca 0.66 -1.21 -0.12 0.00 0.00 0.00 0.00 55.97 55.30 2k7i s LYS 3 Cb -0.21 0.54 -0.05 0.00 0.00 0.00 0.00 37.83 38.11 2k7i s LYS 3 CO 0.60 -0.89 0.22 -0.06 0.00 0.00 0.00 175.35 175.22 2k7i s PHE 4 N -2.33 3.26 -0.41 1.78 0.40 -1.26 -1.67 117.98 117.75 2k7i s PHE 4 Ca 0.17 0.22 -0.18 0.00 -0.60 0.00 0.00 56.93 56.55 2k7i s PHE 4 Cb -0.04 -2.38 0.02 0.00 0.51 0.00 0.00 43.02 41.12 2k7i s PHE 4 CO 0.09 -0.10 0.46 -1.21 0.70 0.00 0.00 175.22 175.17 2k7i s GLU 5 N 1.58 3.20 -0.26 0.44 2.02 -0.75 -4.94 118.70 119.99 2k7i s GLU 5 Ca 0.09 -0.64 -0.10 0.00 0.02 0.00 0.00 54.97 54.34 2k7i s GLU 5 Cb -0.15 -3.94 -0.05 0.00 0.10 0.00 0.00 34.13 30.09 2k7i s GLU 5 CO 0.09 -0.83 0.16 0.42 0.02 0.00 0.00 175.26 175.12 2k7i s ILE 6 N 2.23 5.17 0.29 -1.63 1.01 -1.26 -1.45 121.20 125.56 2k7i s ILE 6 Ca 0.14 0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.94 2k7i s ILE 6 Cb -0.16 -3.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.86 2k7i s ILE 6 CO 0.14 0.30 0.31 0.00 0.00 0.00 0.00 174.94 175.69 2k7i n TYR 7 N 4.74 -0.92 -4.35 3.97 0.18 -0.47 -5.00 117.16 115.31 2k7i n TYR 7 Ca -0.15 -2.29 -0.27 0.00 1.88 0.00 0.00 57.90 57.07 2k7i n TYR 7 Cb 0.52 0.34 -0.13 0.00 -0.38 0.00 0.00 39.34 39.69 2k7i n TYR 7 CO 0.00 0.00 0.00 1.14 -2.08 0.00 0.00 176.86 175.92 2k7i s GLN 8 N -3.00 1.30 0.56 -3.48 -2.07 -1.26 -1.03 119.66 110.68 2k7i s GLN 8 Ca 0.31 -1.28 -0.08 0.00 -1.82 0.00 0.00 55.36 52.49 2k7i s GLN 8 Cb 0.01 -1.71 -0.03 0.00 -1.09 0.00 0.00 33.01 30.19 2k7i s GLN 8 CO 0.22 0.40 0.91 0.34 -1.32 0.00 0.00 175.29 175.85 2k7i s ASP 9 N -2.00 6.09 0.40 12.60 2.15 -0.14 -4.86 116.67 130.91 2k7i s ASP 9 Ca 0.11 1.08 0.15 0.00 0.43 0.00 0.00 52.55 54.33 2k7i s ASP 9 Cb -0.10 -2.22 1.01 0.00 -0.30 0.00 0.00 42.92 41.30 2k7i s ASP 9 CO 0.05 -0.81 1.87 0.50 -0.17 0.00 0.00 175.17 176.62 2k7i h LYS 10 N -0.09 0.47 0.00 4.34 3.64 -2.02 0.44 116.57 123.35 2k7i h LYS 10 Ca -0.46 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2k7i h LYS 10 Cb 1.21 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2k7i h LYS 10 CO 0.62 0.31 0.00 0.00 -2.27 0.00 0.00 179.45 178.11 2k7i n ALA 11 N -2.49 1.88 -1.17 5.00 0.00 -1.26 -4.80 120.51 117.67 2k7i n ALA 11 Ca 0.18 -0.03 -0.06 0.00 0.00 0.00 0.00 53.44 53.53 2k7i n ALA 11 Cb 0.61 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 18.96 2k7i n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k7i n GLY 12 N -0.19 0.82 3.35 0.00 0.00 0.15 -4.99 105.19 104.34 2k7i n GLY 12 Ca 0.03 -0.51 -0.45 0.00 0.00 0.00 0.00 46.02 45.09 2k7i n GLY 12 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k7i s GLU 13 N -2.19 3.10 -0.28 1.61 2.02 -1.11 -4.74 118.70 117.11 2k7i s GLU 13 Ca 0.00 -1.55 -0.36 0.00 0.02 0.00 0.00 54.97 53.07 2k7i s GLU 13 Cb 0.00 -4.32 -0.12 0.00 0.10 0.00 0.00 34.13 29.79 2k7i s GLU 13 CO 0.00 -1.47 2.02 0.66 0.02 0.00 0.00 175.26 176.49 2k7i n TYR 14 N 5.83 1.87 -4.64 1.61 4.01 -1.26 -0.97 117.16 123.60 2k7i n TYR 14 Ca -0.07 0.28 -0.24 0.00 -0.16 0.00 0.00 57.90 57.70 2k7i n TYR 14 Cb 0.42 -2.54 -0.16 0.00 -0.31 0.00 0.00 39.34 36.75 2k7i n TYR 14 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2k7i s ARG 15 N 5.15 1.50 0.34 -0.72 1.81 -0.19 -3.95 118.95 122.88 2k7i s ARG 15 Ca 1.03 -0.47 0.09 0.00 -1.72 0.00 0.00 55.73 54.67 2k7i s ARG 15 Cb -0.87 -1.31 -0.06 0.00 -0.45 0.00 0.00 34.95 32.26 2k7i s ARG 15 CO 0.54 0.16 -0.07 -0.59 -0.68 0.00 0.00 175.30 174.66 2k7i s PHE 16 N 0.20 2.44 0.22 -0.53 -0.12 -1.26 -1.37 117.98 117.56 2k7i s PHE 16 Ca -0.06 -0.48 -0.03 0.00 -0.05 0.00 0.00 56.93 56.32 2k7i s PHE 16 Cb -0.11 -1.40 -0.03 0.00 -0.63 0.00 0.00 43.02 40.85 2k7i s PHE 16 CO 0.02 0.56 0.21 -0.98 -0.05 0.00 0.00 175.22 174.98 2k7i s ARG 17 N -3.63 1.31 -0.05 1.99 1.70 -0.53 -2.08 118.95 117.66 2k7i s ARG 17 Ca 0.33 -1.59 0.05 0.00 -0.47 0.00 0.00 55.73 54.04 2k7i s ARG 17 Cb 0.02 0.31 -0.00 0.00 -0.57 0.00 0.00 34.95 34.70 2k7i s ARG 17 CO 0.17 -0.46 -0.19 0.12 -1.08 0.00 0.00 175.30 173.87 2k7i s PHE 18 N -4.07 1.86 0.53 5.89 5.36 -1.01 -1.81 117.98 124.73 2k7i s PHE 18 Ca 0.36 -0.55 0.08 0.00 -0.96 0.00 0.00 56.93 55.86 2k7i s PHE 18 Cb 0.05 -1.25 0.08 0.00 -0.34 0.00 0.00 43.02 41.57 2k7i s PHE 18 CO 0.13 -0.18 0.69 1.63 -1.46 0.00 0.00 175.22 176.02 2k7i n LYS 19 N 3.13 0.65 -4.22 10.12 4.76 -0.67 -2.72 118.16 129.22 2k7i n LYS 19 Ca -0.18 -2.92 -0.17 0.00 -2.87 0.00 0.00 58.31 52.17 2k7i n LYS 19 Cb 0.53 -0.14 -0.11 0.00 -1.84 0.00 0.00 35.03 33.47 2k7i n LYS 19 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k7i s ALA 20 N -2.65 1.35 0.60 7.82 0.00 0.92 -4.55 121.76 125.25 2k7i s ALA 20 Ca 0.52 -1.25 0.28 0.00 0.00 0.00 0.00 51.96 51.51 2k7i s ALA 20 Cb -0.04 -0.03 1.27 0.00 0.00 0.00 0.00 23.12 24.32 2k7i s ALA 20 CO 0.33 0.05 1.67 0.66 0.00 0.00 0.00 175.76 178.47 2k7i h SER 21 N 3.53 0.00 -0.72 0.00 4.64 -1.93 0.29 113.55 119.35 2k7i h SER 21 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 2k7i h SER 21 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2k7i h SER 21 CO 0.52 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 177.07 2k7i n ASN 22 N -3.49 4.31 0.00 4.97 3.02 -1.26 -4.93 115.26 117.88 2k7i n ASN 22 Ca 0.13 -2.17 0.00 0.00 -0.03 0.00 0.00 54.58 52.52 2k7i n ASN 22 Cb 0.98 -0.53 0.00 0.00 -0.61 0.00 0.00 39.78 39.62 2k7i n ASN 22 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k7i n GLY 23 N 1.50 0.46 3.86 7.41 0.00 0.09 -5.07 105.19 113.44 2k7i n GLY 23 Ca 0.25 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 2k7i n GLY 23 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k7i s GLU 24 N -1.28 3.93 0.04 1.61 0.41 -1.24 -4.84 118.70 117.33 2k7i s GLU 24 Ca 0.00 0.65 0.03 0.00 -0.41 0.00 0.00 54.97 55.24 2k7i s GLU 24 Cb 0.00 -2.37 -0.04 0.00 -1.78 0.00 0.00 34.13 29.94 2k7i s GLU 24 CO 0.00 0.03 -0.00 0.99 -0.49 0.00 0.00 175.26 175.79 2k7i s THR 25 N -2.20 4.07 0.00 3.63 2.01 -1.26 -0.06 115.64 121.83 2k7i s THR 25 Ca 0.54 -0.78 0.00 0.00 0.31 0.00 0.00 61.69 61.76 2k7i s THR 25 Cb -0.10 -2.87 0.00 0.00 0.01 0.00 0.00 72.50 69.54 2k7i s THR 25 CO 0.24 0.26 0.00 1.15 -0.69 0.00 0.00 174.62 175.57 2k7i n MET 26 N 1.02 2.79 -3.97 4.92 0.00 -1.10 -4.98 117.12 115.79 2k7i n MET 26 Ca -0.13 0.00 -0.09 0.00 0.00 0.00 0.00 57.70 57.49 2k7i n MET 26 Cb 0.52 -0.95 -0.10 0.00 0.00 0.00 0.00 33.22 32.70 2k7i n MET 26 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 175.97 175.38 2k7i s PHE 27 N -1.90 0.29 0.34 3.17 -0.12 -1.26 -5.05 117.98 113.46 2k7i s PHE 27 Ca 0.00 -0.65 -0.11 0.00 -0.05 0.00 0.00 56.93 56.12 2k7i s PHE 27 Cb 0.00 -0.21 0.02 0.00 -0.63 0.00 0.00 43.02 42.21 2k7i s PHE 27 CO 0.00 -0.34 0.62 -1.12 -0.05 0.00 0.00 175.22 174.33 2k7i s SER 28 N -2.23 0.33 -1.07 1.98 0.01 -1.26 -2.42 113.70 109.05 2k7i s SER 28 Ca -0.04 -1.21 -0.01 0.00 1.31 0.00 0.00 55.95 56.01 2k7i s SER 28 Cb -0.00 0.74 0.00 0.00 0.21 0.00 0.00 66.02 66.96 2k7i s SER 28 CO -0.06 -1.44 0.89 -1.20 0.41 0.00 0.00 173.24 171.85 2k7i n SER 29 N -1.21 -2.31 -0.12 2.44 7.64 -0.88 -4.93 113.62 114.25 2k7i n SER 29 Ca -0.04 -0.54 -0.12 0.00 1.01 0.00 0.00 58.87 59.18 2k7i n SER 29 Cb 0.61 -4.58 -0.03 0.00 -1.01 0.00 0.00 64.21 59.20 2k7i n SER 29 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 2k7i h GLU 30 N -1.73 0.73 -5.04 1.43 -0.00 -1.89 -3.49 114.58 104.60 2k7i h GLU 30 Ca -0.52 -0.32 -0.25 0.00 -0.00 0.00 0.00 59.36 58.28 2k7i h GLU 30 Cb 1.30 -0.02 0.15 0.00 -0.00 0.00 0.00 28.75 30.18 2k7i h GLU 30 CO 0.44 0.92 -0.67 0.41 -0.00 0.00 0.00 179.01 180.12 2k7i n GLY 31 N -0.07 -0.46 0.16 1.06 0.00 -1.25 -4.99 105.19 99.65 2k7i n GLY 31 Ca -0.02 0.17 -0.06 0.00 0.00 0.00 0.00 46.02 46.11 2k7i n GLY 31 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2k7i h TYR 32 N -1.31 -0.29 0.00 1.61 3.20 -1.95 -3.49 116.97 114.74 2k7i h TYR 32 Ca -0.50 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.37 2k7i h TYR 32 Cb 1.27 0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.64 2k7i h TYR 32 CO 0.32 -0.13 0.00 1.17 -1.64 0.00 0.00 178.16 177.88 2k7i n LYS 33 N -4.98 0.00 -4.00 1.82 3.00 -1.26 -5.12 118.16 107.62 2k7i n LYS 33 Ca -0.05 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.13 2k7i n LYS 33 Cb 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.16 2k7i n LYS 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k7i s ALA 34 N -1.50 0.30 0.10 3.14 0.00 -1.26 -4.71 121.76 117.83 2k7i s ALA 34 Ca 0.00 -1.29 -0.16 0.00 0.00 0.00 0.00 51.96 50.51 2k7i s ALA 34 Cb 0.00 0.99 -0.08 0.00 0.00 0.00 0.00 23.12 24.03 2k7i s ALA 34 CO 0.00 -0.86 1.45 -0.22 0.00 0.00 0.00 175.76 176.13 2k7i h LYS 35 N 2.06 0.65 -0.81 0.00 3.11 -1.93 0.45 116.57 120.09 2k7i h LYS 35 Ca -0.30 -0.30 0.07 0.00 -2.81 0.00 0.00 60.65 57.31 2k7i h LYS 35 Cb 1.24 -0.01 -0.06 0.00 -1.00 0.00 0.00 32.23 32.40 2k7i h LYS 35 CO 0.39 0.89 0.49 0.00 -2.81 0.00 0.00 179.45 178.42 2k7i h ALA 36 N 0.74 1.12 0.00 5.00 0.00 -2.00 -0.64 119.26 123.47 2k7i h ALA 36 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 2k7i h ALA 36 Cb 0.73 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2k7i h ALA 36 CO 0.05 0.20 -0.45 0.77 0.00 0.00 0.00 179.25 179.82 2k7i h SER 37 N 0.88 0.00 -0.05 0.00 0.02 -1.94 -2.66 113.55 109.81 2k7i h SER 37 Ca 0.36 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.30 2k7i h SER 37 Cb 0.20 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 2k7i h SER 37 CO -0.18 0.45 -0.03 0.00 -1.14 0.00 0.00 176.83 175.93 2k7i h ALA 38 N 1.55 0.08 -0.17 3.77 0.00 0.51 -1.38 119.26 123.61 2k7i h ALA 38 Ca -0.00 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.71 2k7i h ALA 38 Cb 0.84 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 2k7i h ALA 38 CO 0.06 -0.18 -0.09 0.82 0.00 0.00 0.00 179.25 179.86 2k7i h ILE 39 N -0.28 0.72 -1.00 0.00 5.03 -1.17 -1.20 117.51 119.62 2k7i h ILE 39 Ca 0.01 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 64.81 2k7i h ILE 39 Cb 0.47 0.72 -0.06 0.00 -3.03 0.00 0.00 36.82 34.91 2k7i h ILE 39 CO 0.01 0.00 0.65 0.45 -0.68 0.00 0.00 178.15 178.58 2k7i h HIS 40 N -0.07 1.20 0.61 1.37 3.86 -1.46 0.21 115.15 120.87 2k7i h HIS 40 Ca 0.10 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.31 2k7i h HIS 40 Cb 0.22 -0.40 -0.00 0.00 1.06 0.00 0.00 27.41 28.29 2k7i h HIS 40 CO -0.24 0.65 -0.37 0.00 0.86 0.00 0.00 177.93 178.83 2k7i h ALA 41 N 1.45 -0.95 -0.20 2.45 0.00 -1.04 -2.68 119.26 118.29 2k7i h ALA 41 Ca 0.42 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.20 2k7i h ALA 41 Cb 0.11 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2k7i h ALA 41 CO -0.15 -1.05 0.20 0.82 0.00 0.00 0.00 179.25 179.07 2k7i h ILE 42 N -0.93 0.55 -0.10 0.00 2.04 -0.28 -0.09 117.51 118.70 2k7i h ILE 42 Ca -0.08 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.71 2k7i h ILE 42 Cb 0.75 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 2k7i h ILE 42 CO 0.08 0.00 -0.28 -0.33 0.00 0.00 0.00 178.15 177.62 2k7i h GLU 43 N 0.00 0.18 -0.99 2.37 5.08 -0.28 -0.31 114.58 120.63 2k7i h GLU 43 Ca 0.09 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.54 2k7i h GLU 43 Cb 0.49 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.64 2k7i h GLU 43 CO -0.00 0.45 0.62 0.77 -1.00 0.00 0.00 179.01 179.85 2k7i h SER 44 N 0.16 0.85 -0.13 1.42 0.02 -0.89 -2.41 113.55 112.57 2k7i h SER 44 Ca 0.02 0.06 -0.08 0.00 -0.84 0.00 0.00 61.79 60.95 2k7i h SER 44 Cb 0.58 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 2k7i h SER 44 CO 0.04 0.42 -0.23 0.40 -1.14 0.00 0.00 176.83 176.32 2k7i h ILE 45 N 0.89 1.37 -0.16 3.27 1.08 -1.15 -3.14 117.51 119.68 2k7i h ILE 45 Ca 0.51 -1.47 0.03 0.00 -0.39 0.00 0.00 64.86 63.54 2k7i h ILE 45 Cb 0.63 2.00 -0.01 0.00 -3.07 0.00 0.00 36.82 36.37 2k7i h ILE 45 CO -0.29 0.43 0.11 0.11 -0.69 0.00 0.00 178.15 177.83 2k7i h LYS 46 N -0.01 0.09 0.05 2.37 1.79 -1.20 -2.53 116.57 117.13 2k7i h LYS 46 Ca 0.01 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k7i h LYS 46 Cb 0.80 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 31.43 2k7i h LYS 46 CO 0.05 0.06 -0.03 0.00 -1.08 0.00 0.00 179.45 178.45 2k7i h ARG 47 N 0.09 -0.07 0.00 3.15 2.47 -1.38 -3.45 114.38 115.19 2k7i h ARG 47 Ca 0.07 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 2k7i h ARG 47 Cb 0.16 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2k7i h ARG 47 CO -0.01 -0.05 -0.04 -1.71 0.56 0.00 0.00 179.97 178.73 2k7i n ASN 48 N -2.29 0.00 0.09 7.04 5.15 -1.22 -4.98 115.26 119.05 2k7i n ASN 48 Ca -0.01 -1.07 0.00 0.00 -0.60 0.00 0.00 54.58 52.90 2k7i n ASN 48 Cb 0.03 -0.01 0.30 0.00 -0.53 0.00 0.00 39.78 39.57 2k7i n ASN 48 CO 0.00 0.00 0.00 -1.28 1.40 0.00 0.00 177.26 177.38 2k7i h SER 49 N 0.00 0.28 -0.10 1.20 0.87 -1.61 0.24 113.55 114.43 2k7i h SER 49 Ca 0.00 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.47 2k7i h SER 49 Cb 1.03 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.91 2k7i h SER 49 CO 0.00 0.52 0.05 0.00 -0.53 0.00 0.00 176.83 176.87 2k7i h ALA 50 N 1.51 1.85 -0.03 6.23 0.00 -1.94 -2.55 119.26 124.33 2k7i h ALA 50 Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k7i h ALA 50 Cb 0.55 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2k7i h ALA 50 CO 0.04 0.12 -0.06 0.41 0.00 0.00 0.00 179.25 179.77 2k7i n GLY 51 N -1.42 0.86 3.62 0.00 0.00 -0.13 -5.00 105.19 103.11 2k7i n GLY 51 Ca -0.01 -0.68 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 2k7i n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k7i s ALA 52 N -2.03 0.73 0.45 4.61 0.00 0.67 -5.06 121.76 121.14 2k7i s ALA 52 Ca 0.26 0.07 -0.04 0.00 0.00 0.00 0.00 51.96 52.26 2k7i s ALA 52 Cb 0.19 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 20.01 2k7i s ALA 52 CO 0.33 -3.04 0.73 -0.51 0.00 0.00 0.00 175.76 173.26 2k7i s ASP 53 N -2.89 6.22 -0.35 0.00 1.11 -1.26 -5.03 116.67 114.48 2k7i s ASP 53 Ca 0.66 0.78 0.04 0.00 0.18 0.00 0.00 52.55 54.21 2k7i s ASP 53 Cb -0.22 -2.14 0.10 0.00 1.07 0.00 0.00 42.92 41.73 2k7i s ASP 53 CO 0.60 -0.54 0.07 -0.89 1.18 0.00 0.00 175.17 175.59 2k7i s THR 54 N -2.64 2.16 -0.22 -1.27 2.01 -1.26 -5.11 115.64 109.31 2k7i s THR 54 Ca 0.46 -2.32 -0.10 0.00 0.31 0.00 0.00 61.69 60.03 2k7i s THR 54 Cb -0.10 -2.59 -0.05 0.00 0.01 0.00 0.00 72.50 69.77 2k7i s THR 54 CO 0.42 -0.62 0.14 -0.69 -0.69 0.00 0.00 174.62 173.18 2k7i s VAL 55 N 0.89 5.31 -0.22 3.82 1.01 -1.26 -5.09 120.40 124.85 2k7i s VAL 55 Ca 0.11 0.16 -0.06 0.00 0.00 0.00 0.00 61.98 62.19 2k7i s VAL 55 Cb -0.19 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 2k7i s VAL 55 CO -0.09 0.39 0.02 -0.62 0.00 0.00 0.00 175.10 174.80 2k7i s ASP 56 N 0.77 4.87 -0.01 3.32 -1.08 -1.26 -4.99 116.67 118.29 2k7i s ASP 56 Ca 0.07 -0.22 0.20 0.00 -0.52 0.00 0.00 52.55 52.08 2k7i s ASP 56 Cb -0.13 -1.85 -0.26 0.00 -1.46 0.00 0.00 42.92 39.22 2k7i s ASP 56 CO 0.02 0.02 0.70 0.18 0.52 0.00 0.00 175.17 176.61 2k7i n LEU 57 N 4.54 0.56 0.00 -1.34 7.99 -1.26 -4.64 117.00 122.85 2k7i n LEU 57 Ca -0.17 -0.30 0.12 0.00 -0.01 0.00 0.00 56.01 55.65 2k7i n LEU 57 Cb 0.51 0.00 0.20 0.00 -0.11 0.00 0.00 43.42 44.03 2k7i n LEU 57 CO 0.31 0.14 0.39 1.07 -1.51 0.00 0.00 177.39 177.79 2k7i n THR 58 N -1.78 0.00 0.47 -5.08 5.66 -1.26 -3.98 114.28 108.31 2k7i n THR 58 Ca 0.01 -0.00 0.10 0.00 -3.05 0.00 0.00 64.05 61.10 2k7i n THR 58 Cb 0.41 0.34 0.42 0.00 -1.55 0.00 0.00 70.33 69.95 2k7i n THR 58 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2k7i n THR 59 N -1.51 0.86 0.10 1.09 -2.24 -1.26 -1.14 114.28 110.18 2k7i n THR 59 Ca 0.05 0.21 -0.04 0.00 -2.27 0.00 0.00 64.05 62.00 2k7i n THR 59 Cb 0.34 -1.05 0.05 0.00 -2.10 0.00 0.00 70.33 67.56 2k7i n THR 59 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k7i h MET 60 N 0.00 0.02 0.00 -0.78 -0.00 -1.93 -3.38 114.93 108.86 2k7i h MET 60 Ca 0.00 -0.02 -0.27 0.00 -0.00 0.00 0.00 59.70 59.41 2k7i h MET 60 Cb 0.34 0.01 -0.04 0.00 -0.00 0.00 0.00 31.60 31.90 2k7i h MET 60 CO 0.00 0.79 -1.77 0.25 -0.00 0.00 0.00 176.91 176.18 2k7i n THR 61 N -3.62 1.51 -1.81 -0.10 -2.24 -0.78 -5.25 114.28 102.00 2k7i n THR 61 Ca -0.01 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2k7i n THR 61 Cb 0.75 -2.07 0.00 0.00 -2.10 0.00 0.00 70.33 66.91 2k7i n THR 61 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50