#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 1.91 0.36 1.12 -0.85 -1.26 -5.00 117.35 113.64 2k7i s TYR 2 Ca 0.00 1.68 -0.17 0.00 -0.52 0.00 0.00 57.07 58.07 2k7i s TYR 2 Cb 0.00 -3.37 0.05 0.00 0.38 0.00 0.00 41.96 39.02 2k7i s TYR 2 CO 0.00 -2.61 0.77 -1.59 -1.52 0.00 0.00 175.55 170.60 2k7i s LYS 3 N -4.35 2.14 -0.33 -3.49 0.00 -1.26 -4.97 119.74 107.48 2k7i s LYS 3 Ca 0.70 -1.35 -0.11 0.00 0.00 0.00 0.00 55.97 55.21 2k7i s LYS 3 Cb -0.25 0.62 -0.00 0.00 0.00 0.00 0.00 37.83 38.20 2k7i s LYS 3 CO 0.52 -1.00 0.18 -0.06 0.00 0.00 0.00 175.35 174.99 2k7i s PHE 4 N -2.64 3.20 -0.42 1.78 0.40 -1.26 -1.84 117.98 117.19 2k7i s PHE 4 Ca 0.15 -0.59 -0.18 0.00 -0.60 0.00 0.00 56.93 55.70 2k7i s PHE 4 Cb -0.05 -2.40 0.02 0.00 0.51 0.00 0.00 43.02 41.10 2k7i s PHE 4 CO 0.11 -0.48 0.49 -1.21 0.70 0.00 0.00 175.22 174.82 2k7i s GLU 5 N 1.62 3.15 -0.18 0.44 2.02 -0.80 -4.90 118.70 120.05 2k7i s GLU 5 Ca 0.04 -0.65 -0.12 0.00 0.02 0.00 0.00 54.97 54.26 2k7i s GLU 5 Cb -0.18 -3.96 -0.05 0.00 0.10 0.00 0.00 34.13 30.05 2k7i s GLU 5 CO 0.07 -0.89 0.20 0.42 0.02 0.00 0.00 175.26 175.08 2k7i s ILE 6 N 2.31 5.37 0.33 -1.63 1.09 -1.26 -1.55 121.20 125.86 2k7i s ILE 6 Ca 0.15 0.35 0.01 0.00 -1.10 0.00 0.00 60.65 60.06 2k7i s ILE 6 Cb -0.16 -3.54 -0.01 0.00 -1.06 0.00 0.00 42.46 37.69 2k7i s ILE 6 CO 0.15 0.43 0.39 -0.72 -0.10 0.00 0.00 174.94 175.09 2k7i s TYR 7 N 0.33 1.32 0.08 3.97 1.13 -0.49 -4.98 117.35 118.71 2k7i s TYR 7 Ca 0.12 -1.43 0.10 0.00 -1.41 0.00 0.00 57.07 54.44 2k7i s TYR 7 Cb -0.12 -0.33 -0.03 0.00 -1.10 0.00 0.00 41.96 40.38 2k7i s TYR 7 CO 0.01 -1.02 -0.25 1.14 -2.51 0.00 0.00 175.55 172.91 2k7i s GLN 8 N -3.23 1.55 0.38 -3.49 -2.07 -1.26 -0.90 119.66 110.64 2k7i s GLN 8 Ca 0.34 -1.17 0.06 0.00 -1.82 0.00 0.00 55.36 52.77 2k7i s GLN 8 Cb 0.01 -1.84 0.06 0.00 -1.09 0.00 0.00 33.01 30.15 2k7i s GLN 8 CO 0.23 0.46 0.49 -3.47 -1.32 0.00 0.00 175.29 171.67 2k7i n ASP 9 N 1.43 1.49 -0.39 12.60 2.03 -0.05 -4.78 116.55 128.89 2k7i n ASP 9 Ca -0.18 -2.04 0.33 0.00 0.52 0.00 0.00 54.79 53.42 2k7i n ASP 9 Cb 0.53 -0.24 0.60 0.00 -0.72 0.00 0.00 41.12 41.28 2k7i n ASP 9 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 2k7i h LYS 10 N 0.00 0.12 -0.62 -0.67 2.10 -2.02 0.22 116.57 115.70 2k7i h LYS 10 Ca -0.18 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.46 2k7i h LYS 10 Cb 0.82 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.12 2k7i h LYS 10 CO 0.27 0.08 0.00 0.00 -2.00 0.00 0.00 179.45 177.80 2k7i n ALA 11 N -2.41 3.66 -2.33 0.07 0.00 -1.26 -4.86 120.51 113.38 2k7i n ALA 11 Ca 0.36 -1.74 -0.15 0.00 0.00 0.00 0.00 53.44 51.91 2k7i n ALA 11 Cb 1.30 -1.10 -0.00 0.00 0.00 0.00 0.00 19.45 19.64 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 0.70 -0.22 3.55 0.00 0.00 0.77 -4.95 105.19 105.03 2k7i n GLY 12 Ca 0.26 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 -4.79 3.52 -0.39 1.61 2.02 -1.13 -4.64 118.70 114.91 2k7i s GLU 13 Ca 0.02 -1.03 -0.30 0.00 0.02 0.00 0.00 54.97 53.68 2k7i s GLU 13 Cb -0.01 -5.13 -0.09 0.00 0.10 0.00 0.00 34.13 29.00 2k7i s GLU 13 CO 0.03 -2.16 2.30 0.66 0.02 0.00 0.00 175.26 176.10 2k7i n TYR 14 N 8.77 1.59 -4.54 1.61 4.01 -1.26 -0.87 117.16 126.47 2k7i n TYR 14 Ca 0.27 0.12 -0.26 0.00 -0.16 0.00 0.00 57.90 57.88 2k7i n TYR 14 Cb 0.50 -2.61 -0.09 0.00 -0.31 0.00 0.00 39.34 36.84 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 6.97 1.88 0.17 -0.72 0.52 -0.08 -2.12 118.95 125.57 2k7i s ARG 15 Ca 1.06 -2.12 -0.24 0.00 -0.52 0.00 0.00 55.73 53.92 2k7i s ARG 15 Cb -0.56 -0.91 0.06 0.00 0.52 0.00 0.00 34.95 34.05 2k7i s ARG 15 CO 0.39 -0.33 0.80 -0.59 0.02 0.00 0.00 175.30 175.59 2k7i s PHE 16 N -3.16 -0.26 0.23 -0.53 -0.71 -1.26 -1.40 117.98 110.90 2k7i s PHE 16 Ca 0.26 -0.05 -0.04 0.00 -1.04 0.00 0.00 56.93 56.06 2k7i s PHE 16 Cb 0.05 0.63 -0.03 0.00 -1.21 0.00 0.00 43.02 42.47 2k7i s PHE 16 CO 0.13 -0.93 0.27 -0.98 -1.34 0.00 0.00 175.22 172.37 2k7i s ARG 17 N -3.56 1.39 -0.04 1.99 1.70 -0.59 -2.39 118.95 117.44 2k7i s ARG 17 Ca 0.09 -1.55 0.04 0.00 -0.47 0.00 0.00 55.73 53.83 2k7i s ARG 17 Cb -0.03 0.34 -0.00 0.00 -0.57 0.00 0.00 34.95 34.69 2k7i s ARG 17 CO -0.01 -0.51 -0.16 0.12 -1.08 0.00 0.00 175.30 173.66 2k7i s PHE 18 N -3.99 1.64 0.53 5.89 5.36 -1.02 -1.91 117.98 124.47 2k7i s PHE 18 Ca 0.34 -0.47 0.06 0.00 -0.96 0.00 0.00 56.93 55.90 2k7i s PHE 18 Cb 0.04 -1.11 0.09 0.00 -0.34 0.00 0.00 43.02 41.70 2k7i s PHE 18 CO 0.13 -0.16 0.73 1.63 -1.46 0.00 0.00 175.22 176.08 2k7i n LYS 19 N 3.17 0.50 -4.21 10.12 4.76 -0.77 -2.83 118.16 128.91 2k7i n LYS 19 Ca -0.18 -2.59 -0.12 0.00 -2.87 0.00 0.00 58.31 52.55 2k7i n LYS 19 Cb 0.53 -0.29 -0.10 0.00 -1.84 0.00 0.00 35.03 33.33 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 -2.72 1.19 0.53 7.82 0.00 0.59 -4.57 121.76 124.59 2k7i s ALA 20 Ca 0.53 -1.47 0.36 0.00 0.00 0.00 0.00 51.96 51.38 2k7i s ALA 20 Cb -0.04 0.33 1.54 0.00 0.00 0.00 0.00 23.12 24.95 2k7i s ALA 20 CO 0.34 -0.26 1.79 0.77 0.00 0.00 0.00 175.76 178.40 2k7i h SER 21 N 2.83 0.03 -0.08 0.00 0.02 -1.94 0.08 113.55 114.48 2k7i h SER 21 Ca -0.36 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2k7i h SER 21 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2k7i h SER 21 CO 0.64 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.92 2k7i n ASN 22 N -4.20 0.91 -1.06 3.07 3.02 -1.26 -4.89 115.26 110.85 2k7i n ASN 22 Ca 0.27 -1.54 -0.09 0.00 -0.03 0.00 0.00 54.58 53.19 2k7i n ASN 22 Cb 1.27 -0.05 -0.00 0.00 -0.61 0.00 0.00 39.78 40.38 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 0.99 -0.01 3.72 7.41 0.00 0.01 -5.05 105.19 112.26 2k7i n GLY 23 Ca 0.16 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 2k7i n GLY 23 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k7i s GLU 24 N -4.47 2.95 -0.08 1.61 -1.05 -1.24 -4.90 118.70 111.52 2k7i s GLU 24 Ca 0.00 -0.50 -0.08 0.00 -0.15 0.00 0.00 54.97 54.25 2k7i s GLU 24 Cb -0.00 -2.78 -0.04 0.00 -0.44 0.00 0.00 34.13 30.86 2k7i s GLU 24 CO 0.00 0.66 0.19 0.99 0.95 0.00 0.00 175.26 178.05 2k7i s THR 25 N -1.06 5.42 -0.02 1.83 2.01 -1.26 -0.30 115.64 122.26 2k7i s THR 25 Ca 0.19 0.26 0.07 0.00 0.31 0.00 0.00 61.69 62.51 2k7i s THR 25 Cb -0.12 -3.47 -0.10 0.00 0.01 0.00 0.00 72.50 68.83 2k7i s THR 25 CO 0.09 0.57 0.12 1.15 -0.69 0.00 0.00 174.62 175.85 2k7i n MET 26 N 1.79 0.84 -3.62 4.92 0.00 -1.13 -5.00 117.12 114.92 2k7i n MET 26 Ca -0.18 -0.05 -0.10 0.00 0.00 0.00 0.00 57.70 57.38 2k7i n MET 26 Cb 0.54 -1.16 -0.02 0.00 0.00 0.00 0.00 33.22 32.58 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 -2.40 -0.34 0.14 3.17 -0.12 -1.25 -5.06 117.98 112.12 2k7i s PHE 27 Ca -0.03 0.02 -0.25 0.00 -0.05 0.00 0.00 56.93 56.63 2k7i s PHE 27 Cb 0.04 0.56 0.08 0.00 -0.63 0.00 0.00 43.02 43.06 2k7i s PHE 27 CO 0.28 -0.97 1.04 0.45 -0.05 0.00 0.00 175.22 175.96 2k7i s SER 28 N -2.83 -0.09 -0.98 1.98 0.15 -1.26 -2.43 113.70 108.24 2k7i s SER 28 Ca 0.06 -0.47 -0.05 0.00 0.70 0.00 0.00 55.95 56.19 2k7i s SER 28 Cb -0.02 0.44 -0.05 0.00 -1.71 0.00 0.00 66.02 64.67 2k7i s SER 28 CO -0.05 -0.84 0.87 -1.20 1.20 0.00 0.00 173.24 173.22 2k7i n SER 29 N -0.77 -6.92 0.02 5.45 7.64 -1.01 -4.98 113.62 113.05 2k7i n SER 29 Ca -0.05 -0.56 -0.06 0.00 1.01 0.00 0.00 58.87 59.20 2k7i n SER 29 Cb 0.60 -5.24 -0.04 0.00 -1.01 0.00 0.00 64.21 58.52 2k7i n SER 29 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2k7i h GLU 30 N -0.73 -0.16 -2.56 1.43 4.57 -1.90 -3.50 114.58 111.72 2k7i h GLU 30 Ca -0.47 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 2k7i h GLU 30 Cb 1.24 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 2k7i h GLU 30 CO 0.41 0.11 0.00 0.41 -1.18 0.00 0.00 179.01 178.75 2k7i n GLY 31 N 1.20 0.75 0.23 1.92 0.00 -1.24 -5.04 105.19 103.01 2k7i n GLY 31 Ca -0.05 -0.36 -0.08 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 -0.46 0.00 1.61 3.20 -1.81 -3.48 116.97 116.03 2k7i h TYR 32 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2k7i h TYR 32 Cb 0.97 0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.39 2k7i h TYR 32 CO 0.00 -0.29 0.00 1.17 -1.64 0.00 0.00 178.16 177.40 2k7i n LYS 33 N -4.93 0.00 -4.28 1.82 3.00 -1.26 -5.10 118.16 107.42 2k7i n LYS 33 Ca -0.06 0.00 -0.16 0.00 -0.00 0.00 0.00 58.31 58.08 2k7i n LYS 33 Cb 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 35.03 35.13 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 -1.00 1.66 0.08 3.14 0.00 -1.26 -4.41 121.76 119.96 2k7i s ALA 34 Ca 0.00 -1.80 -0.20 0.00 0.00 0.00 0.00 51.96 49.96 2k7i s ALA 34 Cb 0.00 1.26 -0.09 0.00 0.00 0.00 0.00 23.12 24.29 2k7i s ALA 34 CO 0.00 -0.55 1.58 -0.22 0.00 0.00 0.00 175.76 176.57 2k7i h LYS 35 N 2.36 0.33 -0.84 0.00 3.11 -1.94 0.57 116.57 120.15 2k7i h LYS 35 Ca -0.34 -0.08 0.03 0.00 -2.81 0.00 0.00 60.65 57.46 2k7i h LYS 35 Cb 1.25 -0.04 -0.05 0.00 -1.00 0.00 0.00 32.23 32.38 2k7i h LYS 35 CO 0.51 0.45 0.54 0.00 -2.81 0.00 0.00 179.45 178.14 2k7i h ALA 36 N 0.87 1.11 -0.05 5.00 0.00 -2.00 -1.30 119.26 122.88 2k7i h ALA 36 Ca 0.06 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2k7i h ALA 36 Cb 0.27 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2k7i h ALA 36 CO 0.00 0.39 -0.36 0.77 0.00 0.00 0.00 179.25 180.05 2k7i h SER 37 N 1.07 0.10 -0.02 0.00 0.02 -1.93 -2.25 113.55 110.53 2k7i h SER 37 Ca 0.33 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.24 2k7i h SER 37 Cb -0.01 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 2k7i h SER 37 CO -0.11 0.46 -0.01 0.00 -1.14 0.00 0.00 176.83 176.04 2k7i h ALA 38 N 1.54 0.03 -0.49 3.77 0.00 0.15 -1.31 119.26 122.96 2k7i h ALA 38 Ca 0.01 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.76 2k7i h ALA 38 Cb 0.69 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2k7i h ALA 38 CO 0.05 -0.27 0.27 0.82 0.00 0.00 0.00 179.25 180.12 2k7i h ILE 39 N -0.31 1.01 -0.97 0.00 5.03 -1.16 -1.49 117.51 119.62 2k7i h ILE 39 Ca 0.01 -0.18 0.01 0.00 -0.12 0.00 0.00 64.86 64.57 2k7i h ILE 39 Cb 0.39 0.43 -0.05 0.00 -3.03 0.00 0.00 36.82 34.56 2k7i h ILE 39 CO 0.00 0.10 0.63 0.45 -0.68 0.00 0.00 178.15 178.65 2k7i h HIS 40 N 0.54 1.24 0.23 1.37 3.86 -1.38 0.12 115.15 121.14 2k7i h HIS 40 Ca 0.20 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 2k7i h HIS 40 Cb 0.06 -0.42 -0.02 0.00 1.06 0.00 0.00 27.41 28.10 2k7i h HIS 40 CO -0.08 0.79 -0.23 0.00 0.86 0.00 0.00 177.93 179.27 2k7i h ALA 41 N 1.35 -0.48 -0.18 2.45 0.00 -0.97 -2.34 119.26 119.09 2k7i h ALA 41 Ca 0.35 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.25 2k7i h ALA 41 Cb -0.13 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2k7i h ALA 41 CO -0.07 -0.80 0.16 0.82 0.00 0.00 0.00 179.25 179.36 2k7i h ILE 42 N -0.50 0.68 -0.05 0.00 2.04 -0.56 -0.64 117.51 118.48 2k7i h ILE 42 Ca -0.00 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 2k7i h ILE 42 Cb 0.47 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2k7i h ILE 42 CO -0.06 0.00 -0.10 -0.33 0.00 0.00 0.00 178.15 177.66 2k7i h GLU 43 N 0.00 0.07 -0.98 2.37 5.08 -0.21 0.03 114.58 120.95 2k7i h GLU 43 Ca 0.09 -0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.55 2k7i h GLU 43 Cb 0.40 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.56 2k7i h GLU 43 CO -0.00 0.18 0.62 0.77 -1.00 0.00 0.00 179.01 179.58 2k7i h SER 44 N 0.07 0.90 -0.16 1.42 0.02 -1.02 -3.01 113.55 111.76 2k7i h SER 44 Ca 0.02 0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 2k7i h SER 44 Cb 0.22 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 2k7i h SER 44 CO 0.01 0.49 -0.10 0.40 -1.14 0.00 0.00 176.83 176.50 2k7i h ILE 45 N 0.97 1.32 -0.08 3.27 1.08 -1.10 -3.16 117.51 119.81 2k7i h ILE 45 Ca 0.47 -1.18 0.02 0.00 -0.39 0.00 0.00 64.86 63.78 2k7i h ILE 45 Cb 0.46 1.76 -0.00 0.00 -3.07 0.00 0.00 36.82 35.97 2k7i h ILE 45 CO -0.23 0.35 0.08 0.11 -0.69 0.00 0.00 178.15 177.76 2k7i h LYS 46 N 0.01 0.00 0.82 2.37 1.79 -1.36 -2.02 116.57 118.18 2k7i h LYS 46 Ca 0.03 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.46 2k7i h LYS 46 Cb 0.59 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.25 2k7i h LYS 46 CO 0.03 0.00 -0.39 0.00 -1.08 0.00 0.00 179.45 178.00 2k7i h ARG 47 N 0.00 -1.06 0.00 3.15 3.08 -1.50 -3.45 114.38 114.60 2k7i h ARG 47 Ca 0.04 0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2k7i h ARG 47 Cb 0.19 0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2k7i h ARG 47 CO -0.00 -0.70 0.00 -1.71 -1.07 0.00 0.00 179.97 176.49 2k7i n ASN 48 N -5.54 0.00 0.05 7.04 2.85 -1.11 -5.00 115.26 113.54 2k7i n ASN 48 Ca -0.15 -0.30 -0.00 0.00 -0.11 0.00 0.00 54.58 54.03 2k7i n ASN 48 Cb 0.44 0.00 0.30 0.00 1.24 0.00 0.00 39.78 41.76 2k7i n ASN 48 CO 0.00 0.00 0.00 -1.28 -2.11 0.00 0.00 177.26 173.87 2k7i h SER 49 N 0.00 0.39 -0.49 1.20 0.87 -1.56 0.19 113.55 114.15 2k7i h SER 49 Ca 0.00 -0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.50 2k7i h SER 49 Cb 0.30 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 2k7i h SER 49 CO 0.00 0.55 0.33 0.00 -0.53 0.00 0.00 176.83 177.17 2k7i h ALA 50 N 1.50 1.79 -0.02 6.23 0.00 -1.95 -2.50 119.26 124.30 2k7i h ALA 50 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2k7i h ALA 50 Cb 0.45 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2k7i h ALA 50 CO 0.03 0.15 -0.09 0.41 0.00 0.00 0.00 179.25 179.75 2k7i n GLY 51 N -1.48 0.41 3.69 0.00 0.00 -0.17 -4.99 105.19 102.65 2k7i n GLY 51 Ca 0.06 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.11 1.43 0.42 4.61 0.00 0.49 -5.05 121.76 121.54 2k7i s ALA 52 Ca 0.29 0.08 -0.05 0.00 0.00 0.00 0.00 51.96 52.28 2k7i s ALA 52 Cb 0.20 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 2k7i s ALA 52 CO 0.37 -2.49 0.71 0.34 0.00 0.00 0.00 175.76 174.70 2k7i s ASP 53 N -3.20 6.34 -0.30 0.00 2.15 -1.26 -5.03 116.67 115.37 2k7i s ASP 53 Ca 0.64 0.86 0.03 0.00 0.43 0.00 0.00 52.55 54.52 2k7i s ASP 53 Cb -0.19 -2.21 0.08 0.00 -0.30 0.00 0.00 42.92 40.29 2k7i s ASP 53 CO 0.58 -0.45 -0.03 -0.89 -0.17 0.00 0.00 175.17 174.21 2k7i s THR 54 N -2.51 2.22 -0.18 1.71 2.01 -1.26 -5.11 115.64 112.51 2k7i s THR 54 Ca 0.46 -1.98 -0.04 0.00 0.31 0.00 0.00 61.69 60.45 2k7i s THR 54 Cb -0.10 -2.47 -0.02 0.00 0.01 0.00 0.00 72.50 69.91 2k7i s THR 54 CO 0.39 -0.31 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.28 2k7i s VAL 55 N 1.01 3.68 -0.22 3.82 1.01 -1.26 -5.11 120.40 123.32 2k7i s VAL 55 Ca 0.01 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.49 2k7i s VAL 55 Cb -0.20 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 2k7i s VAL 55 CO -0.07 0.46 0.09 -0.62 0.00 0.00 0.00 175.10 174.96 2k7i s ASP 56 N 0.83 5.55 -0.08 3.32 -1.08 -1.26 -4.99 116.67 118.96 2k7i s ASP 56 Ca -0.01 -0.02 0.20 0.00 -0.52 0.00 0.00 52.55 52.20 2k7i s ASP 56 Cb -0.15 -1.98 -0.30 0.00 -1.46 0.00 0.00 42.92 39.03 2k7i s ASP 56 CO 0.02 0.07 0.34 0.18 0.52 0.00 0.00 175.17 176.30 2k7i n LEU 57 N 4.23 0.00 0.10 -1.34 4.77 -1.26 -4.73 117.00 118.77 2k7i n LEU 57 Ca -0.16 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.81 2k7i n LEU 57 Cb 0.52 0.15 -0.04 0.00 -2.33 0.00 0.00 43.42 41.72 2k7i n LEU 57 CO 0.34 0.15 0.29 0.00 -1.33 0.00 0.00 177.39 176.83 2k7i h THR 58 N 0.00 1.15 0.00 -5.08 1.03 -1.94 -3.11 112.91 104.95 2k7i h THR 58 Ca -0.16 -2.65 -0.16 0.00 -0.01 0.00 0.00 66.41 63.43 2k7i h THR 58 Cb 1.34 2.55 -0.02 0.00 -1.07 0.00 0.00 68.15 70.95 2k7i h THR 58 CO 0.01 0.65 -0.76 0.71 -0.01 0.00 0.00 175.52 176.12 2k7i h THR 59 N 0.00 1.37 0.19 0.00 1.35 -2.03 -3.27 112.91 110.52 2k7i h THR 59 Ca -0.02 -2.79 -0.31 0.00 -0.55 0.00 0.00 66.41 62.74 2k7i h THR 59 Cb 1.55 2.59 0.02 0.00 -1.73 0.00 0.00 68.15 70.58 2k7i h THR 59 CO 0.09 0.75 -1.37 -0.03 -0.25 0.00 0.00 175.52 174.71 2k7i h MET 60 N 0.00 0.43 -6.26 4.72 -1.53 -1.86 -3.43 114.93 106.99 2k7i h MET 60 Ca -0.01 -0.72 -0.57 0.00 -3.44 0.00 0.00 59.70 54.96 2k7i h MET 60 Cb 1.52 0.27 -0.03 0.00 -0.55 0.00 0.00 31.60 32.81 2k7i h MET 60 CO 0.10 1.34 1.27 0.95 0.14 0.00 0.00 176.91 180.72 2k7i s THR 61 N -2.64 3.48 0.00 -0.77 -4.23 -1.18 -5.18 115.64 105.12 2k7i s THR 61 Ca -0.07 0.48 0.00 0.00 -1.18 0.00 0.00 61.69 60.92 2k7i s THR 61 Cb 0.05 -3.67 0.00 0.00 1.34 0.00 0.00 72.50 70.23 2k7i s THR 61 CO 0.92 -0.44 0.00 0.00 -0.54 0.00 0.00 174.62 174.56