#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 2.98 0.28 1.12 -0.85 -1.26 -4.86 117.35 114.77 2k7i s TYR 2 Ca 0.00 1.52 -0.19 0.00 -0.52 0.00 0.00 57.07 57.87 2k7i s TYR 2 Cb 0.00 -3.02 0.06 0.00 0.38 0.00 0.00 41.96 39.38 2k7i s TYR 2 CO 0.00 -1.10 0.88 -1.59 -1.52 0.00 0.00 175.55 172.21 2k7i s LYS 3 N -3.99 1.78 -0.33 -3.49 0.00 -1.26 -4.97 119.74 107.47 2k7i s LYS 3 Ca 0.64 -1.11 -0.12 0.00 0.00 0.00 0.00 55.97 55.38 2k7i s LYS 3 Cb -0.16 0.52 -0.02 0.00 0.00 0.00 0.00 37.83 38.17 2k7i s LYS 3 CO 0.35 -0.83 0.22 -0.06 0.00 0.00 0.00 175.35 175.03 2k7i s PHE 4 N -2.58 3.22 -0.39 1.78 0.08 -1.26 -1.80 117.98 117.03 2k7i s PHE 4 Ca 0.16 -0.29 -0.19 0.00 0.12 0.00 0.00 56.93 56.74 2k7i s PHE 4 Cb -0.04 -2.45 0.01 0.00 -0.57 0.00 0.00 43.02 39.97 2k7i s PHE 4 CO 0.08 -0.38 0.55 -1.21 -0.10 0.00 0.00 175.22 174.16 2k7i s GLU 5 N 1.70 3.46 -0.41 0.44 2.02 -0.87 -4.92 118.70 120.12 2k7i s GLU 5 Ca 0.06 -0.28 -0.14 0.00 0.02 0.00 0.00 54.97 54.63 2k7i s GLU 5 Cb -0.17 -3.87 0.03 0.00 0.10 0.00 0.00 34.13 30.21 2k7i s GLU 5 CO 0.10 -0.79 0.29 0.42 0.02 0.00 0.00 175.26 175.30 2k7i s ILE 6 N 2.51 5.10 0.39 -1.63 1.01 -1.26 -1.81 121.20 125.51 2k7i s ILE 6 Ca 0.20 -0.74 0.05 0.00 0.00 0.00 0.00 60.65 60.15 2k7i s ILE 6 Cb -0.15 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 2k7i s ILE 6 CO 0.15 -0.32 0.18 0.00 0.00 0.00 0.00 174.94 174.95 2k7i n TYR 7 N 5.13 -0.08 -4.79 3.97 4.11 -0.53 -5.03 117.16 119.94 2k7i n TYR 7 Ca -0.11 -2.65 -0.27 0.00 -0.00 0.00 0.00 57.90 54.86 2k7i n TYR 7 Cb 0.46 0.06 -0.15 0.00 -0.00 0.00 0.00 39.34 39.72 2k7i n TYR 7 CO 0.00 0.00 0.00 1.14 -0.00 0.00 0.00 176.86 178.00 2k7i s GLN 8 N -3.51 1.56 0.62 -3.48 -2.07 -1.26 -1.15 119.66 110.37 2k7i s GLN 8 Ca 0.25 -0.95 -0.12 0.00 -1.82 0.00 0.00 55.36 52.73 2k7i s GLN 8 Cb 0.01 -1.65 -0.04 0.00 -1.09 0.00 0.00 33.01 30.24 2k7i s GLN 8 CO 0.18 0.43 1.03 0.34 -1.32 0.00 0.00 175.29 175.95 2k7i s ASP 9 N -1.06 6.14 0.48 12.60 2.15 0.25 -4.84 116.67 132.39 2k7i s ASP 9 Ca 0.09 1.47 0.31 0.00 0.43 0.00 0.00 52.55 54.85 2k7i s ASP 9 Cb -0.09 -2.48 1.41 0.00 -0.30 0.00 0.00 42.92 41.47 2k7i s ASP 9 CO 0.01 -0.93 1.74 0.07 -0.17 0.00 0.00 175.17 175.89 2k7i h LYS 10 N -0.23 0.13 0.00 4.34 5.09 -2.02 0.34 116.57 124.22 2k7i h LYS 10 Ca -0.44 -0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.29 2k7i h LYS 10 Cb 1.19 -0.03 0.00 0.00 0.10 0.00 0.00 32.23 33.49 2k7i h LYS 10 CO 0.61 0.09 0.00 0.00 -2.09 0.00 0.00 179.45 178.06 2k7i n ALA 11 N -2.65 2.33 -1.92 0.07 0.00 -1.26 -4.84 120.51 112.23 2k7i n ALA 11 Ca 0.30 -0.01 -0.12 0.00 0.00 0.00 0.00 53.44 53.61 2k7i n ALA 11 Cb 1.25 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 19.66 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 0.34 0.37 3.27 0.00 0.00 0.12 -5.00 105.19 104.28 2k7i n GLY 12 Ca 0.01 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 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 -4.04 2.65 0.12 1.61 2.02 -1.12 -4.82 118.70 115.12 2k7i s GLU 13 Ca 0.00 -1.57 -0.34 0.00 0.02 0.00 0.00 54.97 53.07 2k7i s GLU 13 Cb 0.00 -3.93 -0.14 0.00 0.10 0.00 0.00 34.13 30.16 2k7i s GLU 13 CO 0.00 -1.08 1.57 0.66 0.02 0.00 0.00 175.26 176.43 2k7i n TYR 14 N 4.99 2.16 -4.03 1.61 4.02 -1.26 -0.59 117.16 124.06 2k7i n TYR 14 Ca -0.10 0.30 -0.15 0.00 -0.01 0.00 0.00 57.90 57.95 2k7i n TYR 14 Cb 0.42 -2.52 -0.15 0.00 -0.02 0.00 0.00 39.34 37.07 2k7i n TYR 14 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2k7i s ARG 15 N 1.17 0.27 -0.07 -0.72 1.81 -0.30 -3.31 118.95 117.80 2k7i s ARG 15 Ca 0.81 -0.09 0.04 0.00 -1.72 0.00 0.00 55.73 54.77 2k7i s ARG 15 Cb -0.73 -0.29 0.00 0.00 -0.45 0.00 0.00 34.95 33.48 2k7i s ARG 15 CO 0.41 0.04 -0.19 -0.59 -0.68 0.00 0.00 175.30 174.28 2k7i s PHE 16 N 0.09 2.05 0.40 -0.53 -0.71 -1.26 -1.46 117.98 116.57 2k7i s PHE 16 Ca -0.01 -0.75 0.08 0.00 -1.04 0.00 0.00 56.93 55.21 2k7i s PHE 16 Cb -0.03 -1.40 -0.06 0.00 -1.21 0.00 0.00 43.02 40.32 2k7i s PHE 16 CO -0.00 -0.30 0.13 -0.98 -1.34 0.00 0.00 175.22 172.73 2k7i s ARG 17 N 0.31 2.18 -0.06 1.99 1.70 -0.75 -1.80 118.95 122.51 2k7i s ARG 17 Ca -0.13 -1.85 0.04 0.00 -0.47 0.00 0.00 55.73 53.32 2k7i s ARG 17 Cb -0.16 -1.94 -0.00 0.00 -0.57 0.00 0.00 34.95 32.29 2k7i s ARG 17 CO 0.05 -0.06 -0.19 0.12 -1.08 0.00 0.00 175.30 174.14 2k7i s PHE 18 N -2.60 1.99 0.45 5.89 5.36 -1.07 -2.04 117.98 125.96 2k7i s PHE 18 Ca 0.39 -0.65 0.07 0.00 -0.96 0.00 0.00 56.93 55.78 2k7i s PHE 18 Cb 0.04 -1.34 0.07 0.00 -0.34 0.00 0.00 43.02 41.45 2k7i s PHE 18 CO 0.21 -0.24 0.57 1.63 -1.46 0.00 0.00 175.22 175.93 2k7i n LYS 19 N 3.26 0.72 -4.24 10.12 4.76 -0.74 -2.54 118.16 129.50 2k7i n LYS 19 Ca -0.19 -2.49 -0.14 0.00 -2.87 0.00 0.00 58.31 52.63 2k7i n LYS 19 Cb 0.53 -0.10 -0.10 0.00 -1.84 0.00 0.00 35.03 33.52 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 -2.56 1.38 0.50 7.82 0.00 0.83 -4.49 121.76 125.24 2k7i s ALA 20 Ca 0.43 -1.47 0.30 0.00 0.00 0.00 0.00 51.96 51.22 2k7i s ALA 20 Cb -0.03 0.06 1.40 0.00 0.00 0.00 0.00 23.12 24.55 2k7i s ALA 20 CO 0.27 -0.11 1.81 0.66 0.00 0.00 0.00 175.76 178.39 2k7i h SER 21 N 2.82 0.14 -0.25 0.00 4.64 -1.89 -0.13 113.55 118.88 2k7i h SER 21 Ca -0.36 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 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 0.63 0.03 0.00 0.59 -0.87 0.00 0.00 176.83 177.21 2k7i n ASN 22 N -4.33 1.48 -0.08 4.97 3.02 -1.26 -4.87 115.26 114.18 2k7i n ASN 22 Ca 0.24 -2.03 -0.01 0.00 -0.03 0.00 0.00 54.58 52.75 2k7i n ASN 22 Cb 1.08 -0.21 -0.00 0.00 -0.61 0.00 0.00 39.78 40.04 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 0.84 0.48 3.82 7.41 0.00 -0.06 -5.04 105.19 112.64 2k7i n GLY 23 Ca 0.09 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.91 3.28 0.14 1.61 0.41 -1.23 -4.79 118.70 117.20 2k7i s GLU 24 Ca 0.00 1.02 0.11 0.00 -0.41 0.00 0.00 54.97 55.69 2k7i s GLU 24 Cb 0.00 -2.03 -0.04 0.00 -1.78 0.00 0.00 34.13 30.28 2k7i s GLU 24 CO 0.00 -0.83 -0.25 0.99 -0.49 0.00 0.00 175.26 174.68 2k7i s THR 25 N -2.79 2.40 0.00 3.63 2.01 -1.26 -0.12 115.64 119.51 2k7i s THR 25 Ca 0.60 -1.75 0.00 0.00 0.31 0.00 0.00 61.69 60.85 2k7i s THR 25 Cb -0.14 -2.08 0.00 0.00 0.01 0.00 0.00 72.50 70.29 2k7i s THR 25 CO 0.45 0.06 0.00 1.15 -0.69 0.00 0.00 174.62 175.59 2k7i n MET 26 N 0.79 2.30 -3.99 4.92 0.00 -1.05 -4.97 117.12 115.11 2k7i n MET 26 Ca -0.17 0.00 -0.09 0.00 0.00 0.00 0.00 57.70 57.45 2k7i n MET 26 Cb 0.53 -0.79 -0.10 0.00 0.00 0.00 0.00 33.22 32.87 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 -1.57 0.31 -0.04 3.17 -0.12 -1.25 -5.04 117.98 113.45 2k7i s PHE 27 Ca 0.00 -0.67 0.03 0.00 -0.05 0.00 0.00 56.93 56.23 2k7i s PHE 27 Cb 0.00 -0.23 0.00 0.00 -0.63 0.00 0.00 43.02 42.16 2k7i s PHE 27 CO 0.00 -0.31 -0.11 0.45 -0.05 0.00 0.00 175.22 175.21 2k7i s SER 28 N -2.11 1.45 0.64 1.98 0.15 -1.26 -2.58 113.70 111.97 2k7i s SER 28 Ca -0.06 -0.23 0.03 0.00 0.70 0.00 0.00 55.95 56.40 2k7i s SER 28 Cb -0.02 -0.45 0.10 0.00 -1.71 0.00 0.00 66.02 63.94 2k7i s SER 28 CO -0.05 0.07 0.88 -0.55 1.20 0.00 0.00 173.24 174.79 2k7i s SER 29 N 0.28 4.78 0.00 5.45 0.15 -0.75 -5.00 113.70 118.60 2k7i s SER 29 Ca -0.05 -0.48 0.26 0.00 0.70 0.00 0.00 55.95 56.38 2k7i s SER 29 Cb -0.11 -0.06 0.99 0.00 -1.71 0.00 0.00 66.02 65.14 2k7i s SER 29 CO 0.01 -1.54 1.71 -1.84 1.20 0.00 0.00 173.24 172.78 2k7i n GLU 30 N -2.53 1.67 0.00 5.44 -0.00 -1.26 -4.57 120.64 119.39 2k7i n GLU 30 Ca 0.14 -0.98 0.00 0.00 -0.00 0.00 0.00 57.16 56.31 2k7i n GLU 30 Cb 0.61 -1.46 0.00 0.00 -0.00 0.00 0.00 31.44 30.58 2k7i n GLU 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2k7i n GLY 31 N 1.16 1.92 5.00 -1.84 0.00 -1.21 -4.65 105.19 105.57 2k7i n GLY 31 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 0.22 1.61 9.36 -1.26 -3.73 117.16 121.36 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 -2.06 2.98 3.00 -1.26 -5.08 118.16 115.74 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 -0.00 0.00 0.00 0.00 0.00 35.03 35.03 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 -3.42 -0.18 -0.04 3.14 0.00 -1.24 -4.92 120.51 113.86 2k7i n ALA 34 Ca 0.00 -0.39 -0.13 0.00 0.00 0.00 0.00 53.44 52.92 2k7i n ALA 34 Cb 0.00 0.31 -0.08 0.00 0.00 0.00 0.00 19.45 19.68 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 0.19 -0.85 0.00 3.64 -1.96 -0.04 116.57 117.56 2k7i h LYS 35 Ca -0.07 -0.10 0.07 0.00 -1.27 0.00 0.00 60.65 59.28 2k7i h LYS 35 Cb 0.30 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.06 2k7i h LYS 35 CO 0.10 0.62 0.52 0.00 -2.27 0.00 0.00 179.45 178.41 2k7i h ALA 36 N 0.57 1.19 0.00 5.00 0.00 -1.98 0.10 119.26 124.14 2k7i h ALA 36 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2k7i h ALA 36 Cb 0.58 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2k7i h ALA 36 CO 0.02 0.23 -0.37 0.77 0.00 0.00 0.00 179.25 179.90 2k7i h SER 37 N 0.92 0.00 -0.13 0.00 0.02 -1.89 -2.59 113.55 109.89 2k7i h SER 37 Ca 0.38 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.27 2k7i h SER 37 Cb 0.23 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 2k7i h SER 37 CO -0.19 0.37 -0.18 0.00 -1.14 0.00 0.00 176.83 175.69 2k7i h ALA 38 N 1.63 0.20 -0.10 3.77 0.00 0.88 -1.21 119.26 124.43 2k7i h ALA 38 Ca -0.00 -0.35 0.03 0.00 0.00 0.00 0.00 54.91 54.59 2k7i h ALA 38 Cb 0.69 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 2k7i h ALA 38 CO 0.05 0.11 -0.12 0.82 0.00 0.00 0.00 179.25 180.11 2k7i h ILE 39 N -0.05 0.67 -0.71 0.00 5.03 -1.13 -1.12 117.51 120.20 2k7i h ILE 39 Ca 0.02 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.77 2k7i h ILE 39 Cb 0.73 0.67 -0.04 0.00 -3.03 0.00 0.00 36.82 35.15 2k7i h ILE 39 CO 0.04 0.00 0.47 0.45 -0.68 0.00 0.00 178.15 178.43 2k7i h HIS 40 N -0.16 0.86 0.59 1.37 3.86 -1.47 0.15 115.15 120.36 2k7i h HIS 40 Ca 0.08 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.28 2k7i h HIS 40 Cb 0.27 -0.29 0.01 0.00 1.06 0.00 0.00 27.41 28.45 2k7i h HIS 40 CO -0.23 0.52 -0.28 0.00 0.86 0.00 0.00 177.93 178.80 2k7i h ALA 41 N 1.57 -0.79 -0.22 2.45 0.00 -1.01 -2.66 119.26 118.60 2k7i h ALA 41 Ca 0.27 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2k7i h ALA 41 Cb -0.03 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2k7i h ALA 41 CO -0.07 -0.94 0.20 0.82 0.00 0.00 0.00 179.25 179.27 2k7i h ILE 42 N -0.81 0.60 -0.05 0.00 2.04 -0.27 -0.04 117.51 118.97 2k7i h ILE 42 Ca -0.08 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.72 2k7i h ILE 42 Cb 0.62 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 2k7i h ILE 42 CO 0.13 0.00 -0.23 -0.33 0.00 0.00 0.00 178.15 177.73 2k7i h GLU 43 N 0.00 0.09 -0.92 2.37 5.08 -0.38 -0.07 114.58 120.75 2k7i h GLU 43 Ca 0.10 -0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.56 2k7i h GLU 43 Cb 0.51 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.66 2k7i h GLU 43 CO -0.00 0.32 0.55 0.77 -1.00 0.00 0.00 179.01 179.64 2k7i h SER 44 N 0.08 0.78 -0.26 1.42 0.02 -0.87 -2.76 113.55 111.95 2k7i h SER 44 Ca 0.01 0.06 -0.10 0.00 -0.84 0.00 0.00 61.79 60.92 2k7i h SER 44 Cb 0.45 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.89 2k7i h SER 44 CO 0.03 0.40 -0.22 0.40 -1.14 0.00 0.00 176.83 176.31 2k7i h ILE 45 N 0.86 1.31 0.00 3.27 1.08 -1.10 -3.05 117.51 119.87 2k7i h ILE 45 Ca 0.46 -1.36 -0.01 0.00 -0.39 0.00 0.00 64.86 63.57 2k7i h ILE 45 Cb 0.50 1.61 -0.00 0.00 -3.07 0.00 0.00 36.82 35.85 2k7i h ILE 45 CO -0.28 0.43 -0.02 0.11 -0.69 0.00 0.00 178.15 177.69 2k7i h LYS 46 N 0.34 0.00 0.27 2.37 1.79 -1.19 -2.67 116.57 117.47 2k7i h LYS 46 Ca 0.05 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.50 2k7i h LYS 46 Cb 0.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 2k7i h LYS 46 CO 0.06 0.02 -0.13 0.00 -1.08 0.00 0.00 179.45 178.32 2k7i h ARG 47 N 0.00 -0.35 0.00 3.15 2.47 -1.38 -3.45 114.38 114.82 2k7i h ARG 47 Ca -0.00 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2k7i h ARG 47 Cb 0.07 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2k7i h ARG 47 CO 0.00 -0.23 0.00 -1.71 0.56 0.00 0.00 179.97 178.59 2k7i n ASN 48 N -3.03 0.00 0.12 7.04 2.85 -1.22 -5.00 115.26 116.03 2k7i n ASN 48 Ca -0.04 -0.75 0.03 0.00 -0.11 0.00 0.00 54.58 53.71 2k7i n ASN 48 Cb 0.14 0.00 0.42 0.00 1.24 0.00 0.00 39.78 41.58 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 0.22 -0.06 1.20 0.87 -1.66 0.11 113.55 114.24 2k7i h SER 49 Ca 0.00 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2k7i h SER 49 Cb 0.75 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.65 2k7i h SER 49 CO 0.00 0.34 0.03 0.00 -0.53 0.00 0.00 176.83 176.67 2k7i h ALA 50 N 1.69 1.91 -0.06 6.23 0.00 -1.95 -2.49 119.26 124.60 2k7i h ALA 50 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2k7i h ALA 50 Cb 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2k7i h ALA 50 CO 0.01 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.75 2k7i n GLY 51 N -1.48 0.68 3.65 0.00 0.00 -0.05 -5.00 105.19 102.99 2k7i n GLY 51 Ca -0.02 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.61 1.09 0.47 4.61 0.00 0.19 -5.05 121.76 121.46 2k7i s ALA 52 Ca 0.24 0.28 -0.07 0.00 0.00 0.00 0.00 51.96 52.41 2k7i s ALA 52 Cb 0.17 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 2k7i s ALA 52 CO 0.25 -2.86 0.79 0.34 0.00 0.00 0.00 175.76 174.28 2k7i s ASP 53 N -2.83 6.32 -0.31 0.00 2.15 -1.26 -5.03 116.67 115.71 2k7i s ASP 53 Ca 0.66 1.00 0.03 0.00 0.43 0.00 0.00 52.55 54.67 2k7i s ASP 53 Cb -0.22 -2.27 0.09 0.00 -0.30 0.00 0.00 42.92 40.21 2k7i s ASP 53 CO 0.59 -0.55 -0.00 -0.89 -0.17 0.00 0.00 175.17 174.16 2k7i s THR 54 N -2.67 2.28 -0.16 1.71 2.01 -1.26 -5.11 115.64 112.44 2k7i s THR 54 Ca 0.49 -2.09 -0.10 0.00 0.31 0.00 0.00 61.69 60.29 2k7i s THR 54 Cb -0.10 -2.57 -0.05 0.00 0.01 0.00 0.00 72.50 69.79 2k7i s THR 54 CO 0.42 -0.40 0.19 -0.69 -0.69 0.00 0.00 174.62 173.45 2k7i s VAL 55 N 0.98 5.39 -0.44 3.82 1.01 -1.26 -5.08 120.40 124.81 2k7i s VAL 55 Ca 0.04 0.33 -0.13 0.00 0.00 0.00 0.00 61.98 62.22 2k7i s VAL 55 Cb -0.19 -3.51 0.07 0.00 0.00 0.00 0.00 36.38 32.75 2k7i s VAL 55 CO -0.07 0.49 0.32 1.51 0.00 0.00 0.00 175.10 177.35 2k7i s ASP 56 N -0.08 5.91 0.10 3.32 -4.77 -1.26 -4.96 116.67 114.93 2k7i s ASP 56 Ca 0.13 -1.35 0.02 0.00 -3.30 0.00 0.00 52.55 48.04 2k7i s ASP 56 Cb -0.12 -2.09 -0.24 0.00 -1.09 0.00 0.00 42.92 39.37 2k7i s ASP 56 CO 0.02 -0.58 1.22 -0.07 0.70 0.00 0.00 175.17 176.46 2k7i h LEU 57 N 8.59 0.20 0.00 2.11 4.07 -1.98 -3.34 115.31 124.95 2k7i h LEU 57 Ca -0.26 -0.21 0.00 0.00 0.08 0.00 0.00 57.88 57.49 2k7i h LEU 57 Cb 1.10 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.78 2k7i h LEU 57 CO 0.81 1.16 -0.46 1.07 -1.08 0.00 0.00 178.44 179.94 2k7i n THR 58 N -3.44 0.19 -1.46 0.22 5.66 -1.26 -3.07 114.28 111.13 2k7i n THR 58 Ca -0.04 -0.14 0.06 0.00 -3.05 0.00 0.00 64.05 60.88 2k7i n THR 58 Cb 0.98 -0.06 0.08 0.00 -1.55 0.00 0.00 70.33 69.77 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 -1.81 1.09 0.02 1.09 -2.24 -1.26 -4.83 114.28 106.34 2k7i n THR 59 Ca 0.05 -1.31 0.00 0.00 -2.27 0.00 0.00 64.05 60.52 2k7i n THR 59 Cb 0.39 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 2k7i n THR 59 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 2k7i n MET 60 N -0.83 0.00 -3.50 -0.78 0.00 -1.25 -5.06 117.12 105.70 2k7i n MET 60 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 57.70 57.38 2k7i n MET 60 Cb 0.66 -0.02 -0.10 0.00 0.00 0.00 0.00 33.22 33.76 2k7i n MET 60 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2k7i s THR 61 N -1.19 5.27 0.00 1.12 -4.23 -1.17 -5.12 115.64 110.33 2k7i s THR 61 Ca 0.00 -0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.13 2k7i s THR 61 Cb 0.00 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 70.04 2k7i s THR 61 CO 0.00 -0.12 0.00 0.00 -0.54 0.00 0.00 174.62 173.96