#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 -0.18 0.24 1.12 -0.85 -1.26 -3.27 117.35 113.14 2k7i s TYR 2 Ca 0.00 0.07 -0.19 0.00 -0.52 0.00 0.00 57.07 56.43 2k7i s TYR 2 Cb 0.00 0.54 0.07 0.00 0.38 0.00 0.00 41.96 42.95 2k7i s TYR 2 CO 0.00 -0.39 0.93 0.36 -1.52 0.00 0.00 175.55 174.93 2k7i n LYS 3 N -0.24 0.77 -3.50 -3.49 -0.00 -1.26 -4.96 118.16 105.48 2k7i n LYS 3 Ca -0.04 -1.64 -0.41 0.00 -0.00 0.00 0.00 58.31 56.21 2k7i n LYS 3 Cb 0.60 2.16 -0.10 0.00 -0.00 0.00 0.00 35.03 37.69 2k7i n LYS 3 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 2k7i s PHE 4 N -2.29 3.23 -0.39 5.58 0.40 -1.26 -2.25 117.98 121.01 2k7i s PHE 4 Ca 0.20 -0.35 -0.18 0.00 -0.60 0.00 0.00 56.93 56.01 2k7i s PHE 4 Cb -0.03 -2.53 0.01 0.00 0.51 0.00 0.00 43.02 40.97 2k7i s PHE 4 CO 0.07 -0.45 0.50 -1.83 0.70 0.00 0.00 175.22 174.21 2k7i s GLU 5 N 1.72 3.39 -0.35 0.44 -1.05 -0.72 -4.93 118.70 117.20 2k7i s GLU 5 Ca 0.06 -0.42 -0.14 0.00 -0.15 0.00 0.00 54.97 54.33 2k7i s GLU 5 Cb -0.18 -3.89 -0.01 0.00 -0.44 0.00 0.00 34.13 29.62 2k7i s GLU 5 CO 0.10 -0.77 0.28 0.42 0.95 0.00 0.00 175.26 176.25 2k7i s ILE 6 N 2.36 5.26 0.24 1.83 1.01 -1.26 -1.60 121.20 129.03 2k7i s ILE 6 Ca 0.17 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.59 2k7i s ILE 6 Cb -0.16 -3.78 -0.05 0.00 0.01 0.00 0.00 42.46 38.48 2k7i s ILE 6 CO 0.14 -0.09 0.07 -0.72 0.00 0.00 0.00 174.94 174.35 2k7i s TYR 7 N 1.78 1.48 -0.02 3.97 1.13 -0.55 -5.00 117.35 120.14 2k7i s TYR 7 Ca 0.07 -1.13 0.03 0.00 -1.41 0.00 0.00 57.07 54.63 2k7i s TYR 7 Cb -0.17 -0.86 -0.03 0.00 -1.10 0.00 0.00 41.96 39.79 2k7i s TYR 7 CO 0.11 -0.29 -0.08 1.14 -2.51 0.00 0.00 175.55 173.92 2k7i s GLN 8 N -4.00 2.59 0.72 -3.49 -2.07 -1.26 -0.68 119.66 111.47 2k7i s GLN 8 Ca 0.35 -0.67 -0.11 0.00 -1.82 0.00 0.00 55.36 53.10 2k7i s GLN 8 Cb 0.07 -2.50 0.02 0.00 -1.09 0.00 0.00 33.01 29.52 2k7i s GLN 8 CO 0.11 0.62 1.09 0.34 -1.32 0.00 0.00 175.29 176.13 2k7i s ASP 9 N -1.15 5.23 0.47 12.60 2.15 0.01 -4.80 116.67 131.19 2k7i s ASP 9 Ca 0.15 1.27 0.28 0.00 0.43 0.00 0.00 52.55 54.68 2k7i s ASP 9 Cb -0.11 -2.08 1.35 0.00 -0.30 0.00 0.00 42.92 41.78 2k7i s ASP 9 CO 0.05 -1.49 1.78 0.07 -0.17 0.00 0.00 175.17 175.40 2k7i h LYS 10 N -0.76 0.17 0.00 4.34 5.09 -2.00 0.32 116.57 123.73 2k7i h LYS 10 Ca -0.45 -0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.28 2k7i h LYS 10 Cb 1.25 -0.04 0.00 0.00 0.10 0.00 0.00 32.23 33.54 2k7i h LYS 10 CO 0.61 0.11 0.00 0.00 -2.09 0.00 0.00 179.45 178.09 2k7i n ALA 11 N -2.63 2.20 -1.53 0.07 0.00 -1.26 -4.83 120.51 112.54 2k7i n ALA 11 Ca 0.26 -0.03 -0.10 0.00 0.00 0.00 0.00 53.44 53.57 2k7i n ALA 11 Cb 1.10 -1.09 -0.03 0.00 0.00 0.00 0.00 19.45 19.43 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 0.21 0.83 3.39 0.00 0.00 0.11 -4.98 105.19 104.75 2k7i n GLY 12 Ca 0.04 -0.55 -0.45 0.00 0.00 0.00 0.00 46.02 45.06 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 -3.29 3.33 0.17 1.61 2.02 -1.11 -4.76 118.70 116.68 2k7i s GLU 13 Ca 0.00 -1.69 -0.34 0.00 0.02 0.00 0.00 54.97 52.96 2k7i s GLU 13 Cb 0.00 -4.49 -0.14 0.00 0.10 0.00 0.00 34.13 29.60 2k7i s GLU 13 CO 0.00 -1.56 1.48 0.66 0.02 0.00 0.00 175.26 175.86 2k7i n TYR 14 N 5.90 2.08 -3.89 1.61 4.02 -1.26 -0.81 117.16 124.82 2k7i n TYR 14 Ca 0.06 0.38 -0.08 0.00 -0.01 0.00 0.00 57.90 58.26 2k7i n TYR 14 Cb 0.45 -2.48 -0.03 0.00 -0.02 0.00 0.00 39.34 37.27 2k7i n TYR 14 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 2k7i s ARG 15 N 0.47 1.76 -0.08 -0.72 1.70 0.15 -3.43 118.95 118.80 2k7i s ARG 15 Ca 0.77 -1.07 -0.07 0.00 -0.47 0.00 0.00 55.73 54.89 2k7i s ARG 15 Cb -0.72 0.58 0.02 0.00 -0.57 0.00 0.00 34.95 34.26 2k7i s ARG 15 CO 0.43 -0.79 0.21 -0.59 -1.08 0.00 0.00 175.30 173.47 2k7i s PHE 16 N -3.87 -0.23 0.34 5.89 -0.71 -1.26 -1.49 117.98 116.65 2k7i s PHE 16 Ca 0.14 0.57 0.08 0.00 -1.04 0.00 0.00 56.93 56.68 2k7i s PHE 16 Cb -0.05 0.07 -0.03 0.00 -1.21 0.00 0.00 43.02 41.80 2k7i s PHE 16 CO 0.08 -0.12 0.26 1.03 -1.34 0.00 0.00 175.22 175.13 2k7i s ARG 17 N 0.24 2.66 0.01 1.99 0.52 -0.63 -1.60 118.95 122.14 2k7i s ARG 17 Ca -0.01 -1.34 0.06 0.00 -0.52 0.00 0.00 55.73 53.91 2k7i s ARG 17 Cb -0.03 -2.42 -0.02 0.00 0.52 0.00 0.00 34.95 33.01 2k7i s ARG 17 CO -0.01 0.10 -0.17 0.12 0.02 0.00 0.00 175.30 175.36 2k7i s PHE 18 N -2.33 1.51 0.47 -0.53 5.36 -1.07 -1.75 117.98 119.64 2k7i s PHE 18 Ca 0.40 -0.32 0.06 0.00 -0.96 0.00 0.00 56.93 56.12 2k7i s PHE 18 Cb -0.05 -0.94 0.08 0.00 -0.34 0.00 0.00 43.02 41.77 2k7i s PHE 18 CO 0.26 0.01 0.64 1.63 -1.46 0.00 0.00 175.22 176.31 2k7i n LYS 19 N 2.33 0.60 -4.21 10.12 4.76 -0.95 -2.00 118.16 128.81 2k7i n LYS 19 Ca -0.16 -2.38 -0.12 0.00 -2.87 0.00 0.00 58.31 52.78 2k7i n LYS 19 Cb 0.54 -0.23 -0.10 0.00 -1.84 0.00 0.00 35.03 33.40 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 -2.62 1.20 0.55 7.82 0.00 0.33 -4.66 121.76 124.38 2k7i s ALA 20 Ca 0.48 -1.45 0.27 0.00 0.00 0.00 0.00 51.96 51.26 2k7i s ALA 20 Cb -0.04 0.22 1.46 0.00 0.00 0.00 0.00 23.12 24.77 2k7i s ALA 20 CO 0.31 -0.22 2.00 0.66 0.00 0.00 0.00 175.76 178.50 2k7i h SER 21 N 2.85 0.00 -0.19 0.00 4.64 -1.87 0.70 113.55 119.67 2k7i h SER 21 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2k7i h SER 21 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2k7i h SER 21 CO 0.64 0.00 0.00 -3.20 -0.87 0.00 0.00 176.83 173.40 2k7i n ASN 22 N -4.15 2.05 -3.13 4.97 5.15 -1.26 -4.84 115.26 114.05 2k7i n ASN 22 Ca 0.08 -2.19 -0.15 0.00 -0.60 0.00 0.00 54.58 51.72 2k7i n ASN 22 Cb 0.57 -0.43 0.08 0.00 -0.53 0.00 0.00 39.78 39.47 2k7i n ASN 22 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k7i n GLY 23 N 0.41 -0.26 2.86 8.20 0.00 0.24 -5.04 105.19 111.60 2k7i n GLY 23 Ca 0.08 0.03 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 -5.19 -0.00 0.29 1.61 -1.05 -1.23 -4.92 118.70 108.20 2k7i s GLU 24 Ca 0.00 0.02 -0.28 0.00 -0.15 0.00 0.00 54.97 54.57 2k7i s GLU 24 Cb -0.00 -0.03 -0.09 0.00 -0.44 0.00 0.00 34.13 33.57 2k7i s GLU 24 CO 0.64 -0.02 0.98 0.99 0.95 0.00 0.00 175.26 178.80 2k7i s THR 25 N 0.12 3.96 0.00 1.83 2.01 -1.26 -0.51 115.64 121.79 2k7i s THR 25 Ca -0.01 1.82 0.00 0.00 0.31 0.00 0.00 61.69 63.81 2k7i s THR 25 Cb -0.01 -4.09 0.00 0.00 0.01 0.00 0.00 72.50 68.40 2k7i s THR 25 CO -0.00 0.31 0.00 1.15 -0.69 0.00 0.00 174.62 175.39 2k7i n MET 26 N 0.98 0.65 -3.74 4.92 0.00 -0.85 -4.95 117.12 114.13 2k7i n MET 26 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.60 2k7i n MET 26 Cb 0.48 -0.99 -0.05 0.00 0.00 0.00 0.00 33.22 32.65 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 -1.97 -0.04 0.01 3.17 -0.71 -1.25 -5.03 117.98 112.15 2k7i s PHE 27 Ca 0.00 -0.31 0.04 0.00 -1.04 0.00 0.00 56.93 55.62 2k7i s PHE 27 Cb 0.00 0.20 -0.01 0.00 -1.21 0.00 0.00 43.02 41.99 2k7i s PHE 27 CO 0.00 -0.73 -0.12 0.45 -1.34 0.00 0.00 175.22 173.48 2k7i s SER 28 N -2.85 1.43 0.51 1.98 0.15 -1.26 -2.60 113.70 111.05 2k7i s SER 28 Ca 0.07 -0.29 0.08 0.00 0.70 0.00 0.00 55.95 56.51 2k7i s SER 28 Cb 0.02 -0.13 0.04 0.00 -1.71 0.00 0.00 66.02 64.24 2k7i s SER 28 CO -0.08 0.10 0.61 -0.55 1.20 0.00 0.00 173.24 174.52 2k7i s SER 29 N -0.56 5.16 0.27 5.45 0.15 -0.63 -5.00 113.70 118.55 2k7i s SER 29 Ca 0.03 -0.79 0.25 0.00 0.70 0.00 0.00 55.95 56.15 2k7i s SER 29 Cb -0.06 -0.05 0.70 0.00 -1.71 0.00 0.00 66.02 64.90 2k7i s SER 29 CO 0.00 -1.05 1.74 1.05 1.20 0.00 0.00 173.24 176.17 2k7i h GLU 30 N 0.51 0.00 0.00 5.44 4.11 -1.89 -3.41 114.58 119.35 2k7i h GLU 30 Ca -0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.08 2k7i h GLU 30 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2k7i h GLU 30 CO 0.47 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.96 2k7i n GLY 31 N 1.23 1.03 4.30 1.06 0.00 -1.22 -4.53 105.19 107.05 2k7i n GLY 31 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2k7i n GLY 31 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2k7i n TYR 32 N -2.00 0.00 0.13 1.61 9.36 -1.26 -3.33 117.16 121.67 2k7i n TYR 32 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2k7i n TYR 32 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 2k7i n TYR 32 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 2k7i n LYS 33 N 0.00 0.00 -2.13 2.98 3.00 -1.26 -5.07 118.16 115.68 2k7i n LYS 33 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.28 2k7i n LYS 33 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.02 2k7i n LYS 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k7i n ALA 34 N -3.10 -0.01 0.00 3.14 0.00 -1.25 -4.70 120.51 114.60 2k7i n ALA 34 Ca 0.00 -0.32 -0.12 0.00 0.00 0.00 0.00 53.44 53.00 2k7i n ALA 34 Cb 0.00 0.26 -0.08 0.00 0.00 0.00 0.00 19.45 19.62 2k7i n ALA 34 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2k7i h LYS 35 N 0.00 0.04 -0.97 0.00 3.64 -1.93 -0.10 116.57 117.24 2k7i h LYS 35 Ca -0.05 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.41 2k7i h LYS 35 Cb 0.22 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.97 2k7i h LYS 35 CO 0.07 0.29 0.62 0.00 -2.27 0.00 0.00 179.45 178.16 2k7i h ALA 36 N 0.75 1.49 -0.01 5.00 0.00 -1.98 -0.49 119.26 124.02 2k7i h ALA 36 Ca 0.01 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2k7i h ALA 36 Cb 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2k7i h ALA 36 CO 0.00 0.33 -0.63 0.77 0.00 0.00 0.00 179.25 179.73 2k7i h SER 37 N 1.06 0.03 0.31 0.00 0.02 -1.84 -2.27 113.55 110.86 2k7i h SER 37 Ca 0.44 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.35 2k7i h SER 37 Cb 0.29 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2k7i h SER 37 CO -0.19 0.65 -0.15 0.00 -1.14 0.00 0.00 176.83 176.00 2k7i h ALA 38 N 1.35 -0.42 -0.31 3.77 0.00 0.52 -1.39 119.26 122.78 2k7i h ALA 38 Ca -0.01 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.75 2k7i h ALA 38 Cb 1.11 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 2k7i h ALA 38 CO 0.08 -0.56 0.11 0.82 0.00 0.00 0.00 179.25 179.70 2k7i h ILE 39 N -0.77 0.92 -0.91 0.00 5.03 -1.29 -1.68 117.51 118.80 2k7i h ILE 39 Ca -0.04 -0.08 0.07 0.00 -0.12 0.00 0.00 64.86 64.68 2k7i h ILE 39 Cb 0.51 0.65 -0.06 0.00 -3.03 0.00 0.00 36.82 34.89 2k7i h ILE 39 CO 0.07 0.04 0.59 0.45 -0.68 0.00 0.00 178.15 178.62 2k7i h HIS 40 N 0.24 1.04 0.32 1.37 3.86 -1.44 0.19 115.15 120.73 2k7i h HIS 40 Ca 0.14 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 2k7i h HIS 40 Cb 0.11 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.24 2k7i h HIS 40 CO -0.14 0.53 -0.15 0.00 0.86 0.00 0.00 177.93 179.04 2k7i h ALA 41 N 1.51 -0.43 -0.11 2.45 0.00 -0.99 -2.71 119.26 118.99 2k7i h ALA 41 Ca 0.39 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.22 2k7i h ALA 41 Cb 0.23 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2k7i h ALA 41 CO -0.15 -0.70 0.10 0.82 0.00 0.00 0.00 179.25 179.31 2k7i h ILE 42 N -0.50 0.70 -0.80 0.00 2.04 -0.33 -0.94 117.51 117.67 2k7i h ILE 42 Ca -0.04 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 2k7i h ILE 42 Cb 0.38 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 2k7i h ILE 42 CO 0.07 0.00 0.36 -0.33 0.00 0.00 0.00 178.15 178.25 2k7i h GLU 43 N 0.00 1.17 -0.95 2.37 4.39 -0.34 -0.80 114.58 120.41 2k7i h GLU 43 Ca 0.05 -0.18 0.13 0.00 0.34 0.00 0.00 59.36 59.70 2k7i h GLU 43 Cb 0.24 -0.20 -0.08 0.00 -0.10 0.00 0.00 28.75 28.61 2k7i h GLU 43 CO -0.00 0.92 0.60 0.77 -1.16 0.00 0.00 179.01 180.14 2k7i h SER 44 N 1.15 0.81 -0.39 1.42 0.02 -1.03 -2.51 113.55 113.02 2k7i h SER 44 Ca 0.27 0.04 -0.14 0.00 -0.84 0.00 0.00 61.79 61.12 2k7i h SER 44 Cb 0.15 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 2k7i h SER 44 CO -0.03 0.42 -0.32 0.40 -1.14 0.00 0.00 176.83 176.16 2k7i h ILE 45 N 0.86 1.28 0.00 3.27 1.08 -1.18 -3.05 117.51 119.76 2k7i h ILE 45 Ca 0.47 -1.48 -0.01 0.00 -0.39 0.00 0.00 64.86 63.46 2k7i h ILE 45 Cb 0.59 1.34 -0.00 0.00 -3.07 0.00 0.00 36.82 35.68 2k7i h ILE 45 CO -0.24 0.50 -0.02 0.11 -0.69 0.00 0.00 178.15 177.80 2k7i h LYS 46 N 0.73 0.00 0.38 2.37 1.79 -0.96 -2.78 116.57 118.10 2k7i h LYS 46 Ca 0.07 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.52 2k7i h LYS 46 Cb 0.90 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 2k7i h LYS 46 CO 0.08 0.02 -0.18 0.00 -1.08 0.00 0.00 179.45 178.29 2k7i h ARG 47 N 0.00 -0.49 0.00 3.15 2.47 -1.44 -3.45 114.38 114.62 2k7i h ARG 47 Ca -0.00 0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 2k7i h ARG 47 Cb 0.16 0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.59 2k7i h ARG 47 CO 0.00 -0.33 0.00 -1.71 0.56 0.00 0.00 179.97 178.49 2k7i n ASN 48 N -5.04 0.00 0.11 7.04 2.85 -1.24 -4.98 115.26 114.00 2k7i n ASN 48 Ca -0.06 -0.82 0.02 0.00 -0.11 0.00 0.00 54.58 53.61 2k7i n ASN 48 Cb 0.20 0.00 0.38 0.00 1.24 0.00 0.00 39.78 41.60 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 0.23 0.29 1.20 0.87 -1.68 0.33 113.55 114.80 2k7i h SER 49 Ca 0.00 -0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 2k7i h SER 49 Cb 0.82 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.71 2k7i h SER 49 CO 0.00 0.40 -0.05 0.00 -0.53 0.00 0.00 176.83 176.65 2k7i h ALA 50 N 1.63 1.22 -0.00 6.23 0.00 -1.94 -2.48 119.26 123.91 2k7i h ALA 50 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k7i h ALA 50 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2k7i h ALA 50 CO 0.02 0.06 -0.59 0.41 0.00 0.00 0.00 179.25 179.16 2k7i n GLY 51 N -0.81 -0.31 3.73 0.00 0.00 0.13 -5.04 105.19 102.90 2k7i n GLY 51 Ca -0.02 -0.45 -0.36 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 -2.27 2.32 0.66 4.61 0.00 0.95 -5.01 121.76 123.02 2k7i s ALA 52 Ca 0.09 1.02 -0.11 0.00 0.00 0.00 0.00 51.96 52.96 2k7i s ALA 52 Cb 0.12 -3.49 -0.01 0.00 0.00 0.00 0.00 23.12 19.74 2k7i s ALA 52 CO 0.55 -1.59 1.05 0.34 0.00 0.00 0.00 175.76 176.11 2k7i s ASP 53 N -1.71 5.67 -0.36 0.00 2.15 -1.26 -5.00 116.67 116.17 2k7i s ASP 53 Ca 0.78 1.58 0.04 0.00 0.43 0.00 0.00 52.55 55.38 2k7i s ASP 53 Cb -0.32 -2.49 0.10 0.00 -0.30 0.00 0.00 42.92 39.91 2k7i s ASP 53 CO 0.40 -1.24 0.07 -0.89 -0.17 0.00 0.00 175.17 173.34 2k7i s THR 54 N -3.01 2.35 -0.23 1.71 2.01 -1.26 -5.10 115.64 112.11 2k7i s THR 54 Ca 0.58 -2.40 -0.11 0.00 0.31 0.00 0.00 61.69 60.07 2k7i s THR 54 Cb -0.13 -2.73 -0.05 0.00 0.01 0.00 0.00 72.50 69.60 2k7i s THR 54 CO 0.52 -0.62 0.19 -0.69 -0.69 0.00 0.00 174.62 173.33 2k7i s VAL 55 N 0.84 5.35 -0.40 3.82 1.01 -1.26 -5.08 120.40 124.67 2k7i s VAL 55 Ca 0.11 0.26 -0.15 0.00 0.00 0.00 0.00 61.98 62.20 2k7i s VAL 55 Cb -0.20 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.67 2k7i s VAL 55 CO -0.07 0.35 0.32 -0.62 0.00 0.00 0.00 175.10 175.08 2k7i s ASP 56 N 0.92 6.12 0.14 3.32 -1.08 -1.26 -4.96 116.67 119.87 2k7i s ASP 56 Ca 0.09 -0.74 0.06 0.00 -0.52 0.00 0.00 52.55 51.44 2k7i s ASP 56 Cb -0.13 -2.17 -0.14 0.00 -1.46 0.00 0.00 42.92 39.02 2k7i s ASP 56 CO 0.04 -0.44 1.31 -0.07 0.52 0.00 0.00 175.17 176.53 2k7i h LEU 57 N 8.70 0.07 -0.50 -1.34 3.38 -2.07 -3.38 115.31 120.17 2k7i h LEU 57 Ca -0.28 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2k7i h LEU 57 Cb 1.13 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2k7i h LEU 57 CO 0.73 0.99 0.00 1.07 0.09 0.00 0.00 178.44 181.32 2k7i n THR 58 N -3.45 0.13 -1.58 0.22 5.66 -1.26 -4.42 114.28 109.58 2k7i n THR 58 Ca -0.01 -0.10 -0.42 0.00 -3.05 0.00 0.00 64.05 60.47 2k7i n THR 58 Cb 0.90 -0.09 -0.02 0.00 -1.55 0.00 0.00 70.33 69.57 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 -0.21 2.91 -4.71 1.09 -2.24 -1.26 -4.91 114.28 104.94 2k7i n THR 59 Ca 0.02 -2.57 -0.27 0.00 -2.27 0.00 0.00 64.05 58.96 2k7i n THR 59 Cb 0.13 -2.50 -0.17 0.00 -2.10 0.00 0.00 70.33 65.69 2k7i n THR 59 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2k7i s MET 60 N 3.88 2.17 -0.13 -0.78 -1.94 -1.26 -5.11 119.30 116.14 2k7i s MET 60 Ca 0.51 -0.57 -0.29 0.00 -1.71 0.00 0.00 55.69 53.63 2k7i s MET 60 Cb 0.14 -1.76 -0.04 0.00 2.01 0.00 0.00 34.83 35.18 2k7i s MET 60 CO -0.01 0.04 1.60 0.95 -0.01 0.00 0.00 175.02 177.59 2k7i s THR 61 N 0.67 3.70 0.00 2.05 -4.23 -1.26 -5.27 115.64 111.29 2k7i s THR 61 Ca -0.14 0.83 0.00 0.00 -1.18 0.00 0.00 61.69 61.20 2k7i s THR 61 Cb -0.16 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.07 2k7i s THR 61 CO 0.04 -0.15 0.00 0.00 -0.54 0.00 0.00 174.62 173.97