#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fmr s SER 2 N 0.00 6.26 -0.28 0.00 1.04 -1.26 -4.88 113.70 114.58 2fmr s SER 2 Ca 0.00 -0.73 0.09 0.00 0.48 0.00 0.00 55.95 55.79 2fmr s SER 2 Cb 0.00 -2.37 0.69 0.00 0.10 0.00 0.00 66.02 64.44 2fmr s SER 2 CO 0.00 -1.12 1.68 0.54 0.98 0.00 0.00 173.24 175.32 2fmr n ARG 3 N 6.93 3.71 -3.19 4.02 1.74 -1.26 -4.50 116.66 124.10 2fmr n ARG 3 Ca -0.03 -2.77 -0.23 0.00 -0.77 0.00 0.00 57.85 54.05 2fmr n ARG 3 Cb 0.46 -2.14 -0.07 0.00 -1.02 0.00 0.00 32.46 29.69 2fmr n ARG 3 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2fmr n PHE 4 N 0.05 -0.81 -4.43 -1.55 3.01 -0.98 -5.03 117.46 107.72 2fmr n PHE 4 Ca 0.34 -3.31 -0.25 0.00 1.01 0.00 0.00 57.45 55.23 2fmr n PHE 4 Cb 1.25 -0.02 -0.11 0.00 -0.01 0.00 0.00 39.48 40.59 2fmr n PHE 4 CO 0.00 0.00 0.00 -3.38 1.01 0.00 0.00 176.76 174.39 2fmr s HIS 5 N -0.70 2.33 0.03 1.38 -3.43 -1.26 -2.38 115.29 111.25 2fmr s HIS 5 Ca 0.34 -0.33 0.02 0.00 -0.80 0.00 0.00 55.06 54.29 2fmr s HIS 5 Cb 0.14 -1.08 -0.02 0.00 -1.43 0.00 0.00 32.58 30.19 2fmr s HIS 5 CO -0.14 0.60 -0.07 -2.00 -2.00 0.00 0.00 174.74 171.14 2fmr s GLU 6 N -3.10 0.49 0.16 -0.38 2.56 -1.17 -4.98 118.70 112.29 2fmr s GLU 6 Ca 0.26 -0.57 0.10 0.00 0.00 0.00 0.00 54.97 54.76 2fmr s GLU 6 Cb -0.07 -0.32 -0.04 0.00 2.00 0.00 0.00 34.13 35.71 2fmr s GLU 6 CO 0.13 0.07 -0.23 1.14 -0.56 0.00 0.00 175.26 175.80 2fmr s GLN 7 N -1.12 1.40 -0.29 4.30 -2.07 -1.26 -1.96 119.66 118.66 2fmr s GLN 7 Ca -0.06 -1.42 -0.29 0.00 -1.82 0.00 0.00 55.36 51.77 2fmr s GLN 7 Cb -0.07 -1.71 0.20 0.00 -1.09 0.00 0.00 33.01 30.33 2fmr s GLN 7 CO 0.00 0.38 1.38 -0.59 -1.32 0.00 0.00 175.29 175.14 2fmr s PHE 8 N -1.52 -0.02 0.31 9.60 -0.71 -0.62 -4.96 117.98 120.07 2fmr s PHE 8 Ca 0.16 0.03 -0.12 0.00 -1.04 0.00 0.00 56.93 55.96 2fmr s PHE 8 Cb -0.08 0.50 -0.08 0.00 -1.21 0.00 0.00 43.02 42.15 2fmr s PHE 8 CO 0.08 -0.02 0.69 0.96 -1.34 0.00 0.00 175.22 175.59 2fmr s ILE 9 N -1.03 4.77 -0.17 -4.49 -4.36 -1.26 0.16 121.20 114.82 2fmr s ILE 9 Ca 0.09 0.74 0.01 0.00 -0.26 0.00 0.00 60.65 61.23 2fmr s ILE 9 Cb -0.01 -3.64 0.03 0.00 1.25 0.00 0.00 42.46 40.09 2fmr s ILE 9 CO -0.08 -0.22 -0.14 0.68 0.24 0.00 0.00 174.94 175.42 2fmr s VAL 10 N -2.02 1.68 0.42 8.37 -7.23 -1.26 -4.88 120.40 115.47 2fmr s VAL 10 Ca 0.52 -0.82 -0.24 0.00 -1.81 0.00 0.00 61.98 59.62 2fmr s VAL 10 Cb -0.10 -1.63 -0.11 0.00 0.56 0.00 0.00 36.38 35.10 2fmr s VAL 10 CO 0.21 0.36 1.04 -1.14 -0.31 0.00 0.00 175.10 175.26 2fmr n ARG 11 N 4.71 1.41 0.23 4.82 0.63 -1.26 -4.66 116.66 122.53 2fmr n ARG 11 Ca -0.17 0.50 -0.16 0.00 -0.92 0.00 0.00 57.85 57.10 2fmr n ARG 11 Cb 0.49 -2.07 -0.09 0.00 0.45 0.00 0.00 32.46 31.23 2fmr n ARG 11 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 2fmr h GLU 12 N 1.60 -0.84 -0.63 -0.14 4.22 -1.99 0.70 114.58 117.50 2fmr h GLU 12 Ca -0.45 0.06 0.18 0.00 0.08 0.00 0.00 59.36 59.23 2fmr h GLU 12 Cb 1.33 0.19 -0.03 0.00 0.50 0.00 0.00 28.75 30.75 2fmr h GLU 12 CO 0.57 -0.56 0.48 0.22 -2.18 0.00 0.00 179.01 177.55 2fmr h ASP 13 N -0.87 0.00 -0.70 1.04 1.82 -2.04 0.18 116.42 115.85 2fmr h ASP 13 Ca -0.04 0.00 -0.47 0.00 -0.39 0.00 0.00 57.03 56.13 2fmr h ASP 13 Cb 0.78 0.00 -0.29 0.00 0.68 0.00 0.00 39.33 40.50 2fmr h ASP 13 CO -0.11 0.00 -0.14 0.18 -1.61 0.00 0.00 179.24 177.55 2fmr n LEU 14 N -4.21 5.43 -0.02 2.28 4.32 -0.30 -4.36 117.00 120.13 2fmr n LEU 14 Ca 0.12 -4.33 -0.04 0.00 -0.02 0.00 0.00 56.01 51.74 2fmr n LEU 14 Cb 0.73 -0.60 -0.13 0.00 -1.62 0.00 0.00 43.42 41.80 2fmr n LEU 14 CO 0.36 1.68 -0.60 0.80 -1.22 0.00 0.00 177.39 178.40 2fmr n MET 15 N -0.90 0.64 0.12 3.23 1.56 0.23 -4.27 117.12 117.73 2fmr n MET 15 Ca 0.46 0.16 0.00 0.00 -0.27 0.00 0.00 57.70 58.05 2fmr n MET 15 Cb 0.92 -1.72 0.00 0.00 2.15 0.00 0.00 33.22 34.57 2fmr n MET 15 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2fmr n GLY 16 N 1.52 -0.26 2.54 -5.12 0.00 -1.26 -5.06 105.19 97.55 2fmr n GLY 16 Ca -0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 2fmr n GLY 16 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2fmr n LEU 17 N -3.30 -5.08 -4.36 0.99 7.94 -1.26 -4.88 117.00 107.05 2fmr n LEU 17 Ca 0.00 -0.09 -0.45 0.00 -1.11 0.00 0.00 56.01 54.36 2fmr n LEU 17 Cb 0.00 -2.50 -0.01 0.00 0.53 0.00 0.00 43.42 41.45 2fmr n LEU 17 CO 0.00 -0.66 0.78 0.00 -1.11 0.00 0.00 177.39 176.40 2fmr s ALA 18 N -3.02 4.33 0.23 1.96 0.00 -1.26 -4.82 121.76 119.18 2fmr s ALA 18 Ca 0.03 -3.54 0.11 0.00 0.00 0.00 0.00 51.96 48.56 2fmr s ALA 18 Cb -0.00 -3.67 0.28 0.00 0.00 0.00 0.00 23.12 19.72 2fmr s ALA 18 CO 0.49 -2.37 1.56 0.82 0.00 0.00 0.00 175.76 176.26 2fmr h ILE 19 N 4.32 1.43 0.00 0.00 1.08 -1.93 -3.48 117.51 118.93 2fmr h ILE 19 Ca 0.18 -2.30 0.00 0.00 -0.39 0.00 0.00 64.86 62.35 2fmr h ILE 19 Cb 0.94 2.25 0.00 0.00 -3.07 0.00 0.00 36.82 36.94 2fmr h ILE 19 CO 0.98 0.65 0.00 0.61 -0.69 0.00 0.00 178.15 179.69 2fmr n GLY 20 N 0.45 3.73 0.25 5.37 0.00 -1.26 -4.92 105.19 108.82 2fmr n GLY 20 Ca -0.01 -0.77 -0.11 0.00 0.00 0.00 0.00 46.02 45.13 2fmr n GLY 20 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2fmr h THR 21 N 0.00 1.29 -3.70 2.61 1.35 -1.97 -3.44 112.91 109.05 2fmr h THR 21 Ca 0.00 -1.61 -0.52 0.00 -0.55 0.00 0.00 66.41 63.73 2fmr h THR 21 Cb 0.00 1.50 0.06 0.00 -1.73 0.00 0.00 68.15 67.98 2fmr h THR 21 CO 0.00 0.52 0.66 -1.00 -0.25 0.00 0.00 175.52 175.46 2fmr s HIS 22 N -4.28 3.08 0.00 4.73 4.02 -1.26 -5.01 115.29 116.57 2fmr s HIS 22 Ca -0.09 1.31 0.00 0.00 1.02 0.00 0.00 55.06 57.29 2fmr s HIS 22 Cb 0.11 -3.69 0.00 0.00 -1.02 0.00 0.00 32.58 27.98 2fmr s HIS 22 CO 0.86 -2.02 0.00 0.41 1.02 0.00 0.00 174.74 175.01 2fmr n GLY 23 N 1.34 1.54 3.04 -2.22 0.00 -1.26 -4.82 105.19 102.81 2fmr n GLY 23 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 2fmr n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fmr s ALA 24 N -3.82 -0.38 -0.15 4.61 0.00 -1.26 -5.05 121.76 115.72 2fmr s ALA 24 Ca 0.00 0.36 -0.25 0.00 0.00 0.00 0.00 51.96 52.07 2fmr s ALA 24 Cb 0.00 -0.21 -0.22 0.00 0.00 0.00 0.00 23.12 22.69 2fmr s ALA 24 CO 0.00 -0.09 0.60 -0.91 0.00 0.00 0.00 175.76 175.36 2fmr h ASN 25 N 5.68 0.00 0.37 0.00 2.35 -1.90 -3.30 115.58 118.79 2fmr h ASN 25 Ca -0.26 -0.82 -0.01 0.00 -0.55 0.00 0.00 56.30 54.66 2fmr h ASN 25 Cb 1.20 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.56 2fmr h ASN 25 CO 0.41 1.04 -0.30 0.40 -1.65 0.00 0.00 177.43 177.33 2fmr h ILE 26 N -1.00 0.00 -1.07 2.81 2.04 -1.96 -1.35 117.51 116.98 2fmr h ILE 26 Ca -0.06 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.10 2fmr h ILE 26 Cb 0.97 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.93 2fmr h ILE 26 CO -0.04 0.00 0.67 1.56 0.00 0.00 0.00 178.15 180.34 2fmr h GLN 27 N -0.65 0.36 -0.29 2.37 1.08 -2.01 0.21 115.11 116.19 2fmr h GLN 27 Ca -0.05 -0.02 -0.08 0.00 -1.45 0.00 0.00 58.65 57.05 2fmr h GLN 27 Cb 0.54 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.89 2fmr h GLN 27 CO 0.00 0.24 -0.13 1.96 -0.95 0.00 0.00 178.83 179.95 2fmr h GLN 28 N 0.37 0.60 -0.82 1.46 1.08 -1.57 -1.92 115.11 114.32 2fmr h GLN 28 Ca 0.67 -0.26 0.07 0.00 -1.45 0.00 0.00 58.65 57.67 2fmr h GLN 28 Cb 1.65 -0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 29.00 2fmr h GLN 28 CO -0.41 0.83 0.54 0.00 -0.95 0.00 0.00 178.83 178.84 2fmr h ALA 29 N 0.75 1.61 -0.30 3.87 0.00 0.54 -1.26 119.26 124.47 2fmr h ALA 29 Ca 0.07 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 2fmr h ALA 29 Cb 0.65 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2fmr h ALA 29 CO 0.04 0.27 -0.47 0.00 0.00 0.00 0.00 179.25 179.09 2fmr h ARG 30 N 0.90 0.80 -0.96 0.00 3.08 -1.16 -3.06 114.38 113.98 2fmr h ARG 30 Ca 0.35 -0.46 0.13 0.00 0.07 0.00 0.00 59.98 60.07 2fmr h ARG 30 Cb 0.23 0.03 -0.09 0.00 0.08 0.00 0.00 29.97 30.23 2fmr h ARG 30 CO -0.13 1.09 0.58 0.87 -1.07 0.00 0.00 179.97 181.32 2fmr h LYS 31 N 0.64 0.88 -6.55 0.04 1.57 -0.42 -3.43 116.57 109.30 2fmr h LYS 31 Ca 0.04 -0.05 -0.60 0.00 -1.87 0.00 0.00 60.65 58.17 2fmr h LYS 31 Cb 1.04 -0.20 0.11 0.00 0.08 0.00 0.00 32.23 33.26 2fmr h LYS 31 CO 0.10 0.58 0.29 0.28 -0.57 0.00 0.00 179.45 180.13 2fmr n VAL 32 N -4.68 1.84 -2.43 0.50 0.31 -1.01 -4.91 118.33 107.95 2fmr n VAL 32 Ca 0.18 -0.46 -0.41 0.00 -0.01 0.00 0.00 64.34 63.64 2fmr n VAL 32 Cb 0.37 -1.19 -0.03 0.00 -0.91 0.00 0.00 33.84 32.07 2fmr n VAL 32 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2fmr s PRO 33 N -1.47 4.51 0.00 5.55 0.04 -1.26 -3.71 135.00 138.65 2fmr s PRO 33 Ca 0.59 1.80 0.00 0.00 0.04 0.00 0.00 61.00 63.44 2fmr s PRO 33 Cb -0.67 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 30.60 2fmr s PRO 33 CO 0.59 -0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.97 2fmr n GLY 34 N 2.37 3.41 3.70 0.56 0.00 -1.26 -4.62 105.19 109.35 2fmr n GLY 34 Ca 0.05 -1.02 -0.44 0.00 0.00 0.00 0.00 46.02 44.61 2fmr n GLY 34 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2fmr n VAL 35 N 0.00 0.15 -0.04 1.61 0.31 -1.24 -2.03 118.33 117.09 2fmr n VAL 35 Ca 0.00 -0.04 -0.03 0.00 -0.01 0.00 0.00 64.34 64.26 2fmr n VAL 35 Cb 0.00 -1.77 -0.14 0.00 -0.91 0.00 0.00 33.84 31.02 2fmr n VAL 35 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2fmr n THR 36 N 3.46 1.09 -3.82 2.52 -2.24 0.54 -4.90 114.28 110.93 2fmr n THR 36 Ca 0.15 -0.74 0.04 0.00 -2.27 0.00 0.00 64.05 61.24 2fmr n THR 36 Cb 0.32 -0.50 0.01 0.00 -2.10 0.00 0.00 70.33 68.06 2fmr n THR 36 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fmr s ALA 37 N -2.81 -2.68 -0.06 6.98 0.00 0.42 -5.01 121.76 118.59 2fmr s ALA 37 Ca -0.07 0.52 0.06 0.00 0.00 0.00 0.00 51.96 52.47 2fmr s ALA 37 Cb 0.08 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.83 2fmr s ALA 37 CO 0.84 -1.13 -0.24 -1.50 0.00 0.00 0.00 175.76 173.73 2fmr s ILE 38 N -2.01 2.14 -0.03 0.00 1.10 -1.26 -1.11 121.20 120.02 2fmr s ILE 38 Ca 0.25 -1.04 0.04 0.00 -0.51 0.00 0.00 60.65 59.39 2fmr s ILE 38 Cb 0.04 -1.78 -0.00 0.00 0.15 0.00 0.00 42.46 40.86 2fmr s ILE 38 CO -0.05 0.57 -0.13 -1.81 -2.11 0.00 0.00 174.94 171.41 2fmr s ASP 39 N -0.14 1.67 0.09 4.50 1.11 -0.37 -4.93 116.67 118.60 2fmr s ASP 39 Ca -0.04 -0.26 0.07 0.00 0.18 0.00 0.00 52.55 52.49 2fmr s ASP 39 Cb -0.14 -0.38 -0.03 0.00 1.07 0.00 0.00 42.92 43.44 2fmr s ASP 39 CO 0.04 0.13 -0.17 -0.22 1.18 0.00 0.00 175.17 176.12 2fmr s LEU 40 N -0.01 2.31 -0.18 1.23 2.96 -1.26 0.06 118.68 123.78 2fmr s LEU 40 Ca -0.01 -0.68 0.01 0.00 -0.22 0.00 0.00 54.13 53.23 2fmr s LEU 40 Cb -0.09 -0.70 0.02 0.00 0.50 0.00 0.00 46.19 45.93 2fmr s LEU 40 CO 0.01 -0.02 -0.19 -1.81 -1.32 0.00 0.00 176.35 173.01 2fmr s ASP 41 N -1.92 3.20 0.00 3.68 1.11 -1.20 -4.95 116.67 116.59 2fmr s ASP 41 Ca 0.04 -0.68 0.00 0.00 0.18 0.00 0.00 52.55 52.09 2fmr s ASP 41 Cb -0.09 -1.49 0.00 0.00 1.07 0.00 0.00 42.92 42.41 2fmr s ASP 41 CO 0.03 -0.01 0.64 -0.62 1.18 0.00 0.00 175.17 176.39 2fmr n GLU 42 N 4.61 0.00 0.00 8.23 1.02 -1.26 -3.77 120.64 129.47 2fmr n GLU 42 Ca -0.21 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2fmr n GLU 42 Cb 0.50 -1.15 0.00 0.00 -0.02 0.00 0.00 31.44 30.77 2fmr n GLU 42 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2fmr n ASP 43 N -1.05 0.00 -4.58 1.62 9.92 -1.26 -3.33 116.55 117.88 2fmr n ASP 43 Ca 0.00 0.72 -0.18 0.00 -0.53 0.00 0.00 54.79 54.79 2fmr n ASP 43 Cb 0.00 -0.22 -0.10 0.00 -0.64 0.00 0.00 41.12 40.17 2fmr n ASP 43 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2fmr s THR 44 N -1.87 3.17 -0.91 -3.53 -4.23 -1.26 -4.80 115.64 102.21 2fmr s THR 44 Ca 0.00 -0.28 -0.17 0.00 -1.18 0.00 0.00 61.69 60.07 2fmr s THR 44 Cb 0.00 -4.10 -0.25 0.00 1.34 0.00 0.00 72.50 69.49 2fmr s THR 44 CO 0.00 -0.31 2.27 0.00 -0.54 0.00 0.00 174.62 176.04 2fmr s THR 46 N 6.62 0.00 -0.06 0.00 -1.32 -1.25 -4.64 115.64 115.00 2fmr s THR 46 Ca 1.15 -1.10 0.05 0.00 -1.21 0.00 0.00 61.69 60.58 2fmr s THR 46 Cb -0.53 -2.45 -0.01 0.00 -1.51 0.00 0.00 72.50 68.00 2fmr s THR 46 CO 0.35 0.00 -0.24 0.12 -2.21 0.00 0.00 174.62 172.65 2fmr s PHE 47 N -3.19 2.48 -0.03 9.09 2.19 0.43 -3.24 117.98 125.70 2fmr s PHE 47 Ca 0.16 -0.71 0.07 0.00 0.33 0.00 0.00 56.93 56.79 2fmr s PHE 47 Cb -0.04 -1.62 -0.02 0.00 -1.31 0.00 0.00 43.02 40.03 2fmr s PHE 47 CO 0.10 -0.21 -0.25 -1.01 1.83 0.00 0.00 175.22 175.68 2fmr s HIS 48 N -0.14 2.37 -0.04 10.12 3.76 0.11 -1.59 115.29 129.88 2fmr s HIS 48 Ca -0.04 -0.51 0.06 0.00 -0.15 0.00 0.00 55.06 54.42 2fmr s HIS 48 Cb -0.14 -1.53 -0.02 0.00 1.11 0.00 0.00 32.58 32.00 2fmr s HIS 48 CO 0.04 -0.09 -0.24 0.42 -0.85 0.00 0.00 174.74 174.02 2fmr s ILE 49 N -0.49 2.18 -0.50 0.60 -1.09 -0.83 -1.24 121.20 119.83 2fmr s ILE 49 Ca 0.06 -1.04 0.01 0.00 -2.23 0.00 0.00 60.65 57.45 2fmr s ILE 49 Cb -0.11 -1.78 0.13 0.00 -1.58 0.00 0.00 42.46 39.12 2fmr s ILE 49 CO 0.00 0.57 0.27 -0.31 -1.23 0.00 0.00 174.94 174.25 2fmr s TYR 50 N -0.37 3.43 0.27 3.97 1.51 -0.27 -3.02 117.35 122.87 2fmr s TYR 50 Ca 0.03 -2.87 0.09 0.00 -1.01 0.00 0.00 57.07 53.30 2fmr s TYR 50 Cb -0.12 -3.03 -0.05 0.00 -0.11 0.00 0.00 41.96 38.64 2fmr s TYR 50 CO 0.02 -0.85 -0.12 0.20 -1.11 0.00 0.00 175.55 173.69 2fmr s GLY 51 N 0.59 1.77 -0.08 0.71 0.00 -1.00 0.20 107.32 109.51 2fmr s GLY 51 Ca 0.14 -1.85 0.17 0.00 0.00 0.00 0.00 44.72 43.19 2fmr s GLY 51 CO -0.03 -1.87 0.27 -1.84 0.00 0.00 0.00 173.10 169.63 2fmr n GLU 52 N -0.56 0.81 -2.87 2.90 0.28 -0.86 -2.33 120.64 118.01 2fmr n GLU 52 Ca -0.06 -0.11 -0.19 0.00 -0.16 0.00 0.00 57.16 56.65 2fmr n GLU 52 Cb 0.62 -1.45 0.02 0.00 1.43 0.00 0.00 31.44 32.06 2fmr n GLU 52 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2fmr s ASP 53 N -4.55 5.51 -0.13 -1.84 2.15 -1.26 -4.61 116.67 111.94 2fmr s ASP 53 Ca -0.08 -0.27 -0.10 0.00 0.43 0.00 0.00 52.55 52.53 2fmr s ASP 53 Cb 0.09 -0.72 -0.07 0.00 -0.30 0.00 0.00 42.92 41.92 2fmr s ASP 53 CO 0.75 -0.91 0.10 1.56 -0.17 0.00 0.00 175.17 176.50 2fmr h GLN 54 N 0.42 0.00 0.00 4.34 7.50 -1.94 -3.33 115.11 122.10 2fmr h GLN 54 Ca -0.41 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 58.72 2fmr h GLN 54 Cb 1.29 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.81 2fmr h GLN 54 CO 0.48 0.27 -0.09 -0.44 -1.50 0.00 0.00 178.83 177.54 2fmr h ASP 55 N -1.00 0.00 0.21 1.46 5.19 -1.97 -2.80 116.42 117.50 2fmr h ASP 55 Ca -0.04 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.38 2fmr h ASP 55 Cb 0.44 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.92 2fmr h ASP 55 CO -0.02 0.09 -0.29 0.00 -3.12 0.00 0.00 179.24 175.91 2fmr h ALA 56 N 1.91 -0.55 -0.49 3.45 0.00 -1.82 0.23 119.26 121.99 2fmr h ALA 56 Ca -0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2fmr h ALA 56 Cb 0.18 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2fmr h ALA 56 CO 0.01 -0.85 0.28 0.28 0.00 0.00 0.00 179.25 178.97 2fmr h VAL 57 N -0.55 1.16 -0.63 0.00 2.07 -1.61 -1.24 116.25 115.45 2fmr h VAL 57 Ca 0.01 -0.39 0.09 0.00 0.82 0.00 0.00 66.70 67.23 2fmr h VAL 57 Cb 0.54 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 2fmr h VAL 57 CO -0.11 0.17 0.27 0.11 0.02 0.00 0.00 177.57 178.03 2fmr h LYS 58 N 0.65 0.46 0.17 1.57 1.79 -1.23 0.13 116.57 120.11 2fmr h LYS 58 Ca 0.17 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.61 2fmr h LYS 58 Cb 0.02 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.57 2fmr h LYS 58 CO -0.03 0.31 -0.08 0.87 -1.08 0.00 0.00 179.45 179.43 2fmr h LYS 59 N 0.48 -0.22 -1.00 3.15 1.79 -0.62 -2.33 116.57 117.81 2fmr h LYS 59 Ca 0.31 0.01 0.15 0.00 -2.18 0.00 0.00 60.65 58.95 2fmr h LYS 59 Cb 0.36 0.05 -0.09 0.00 -1.58 0.00 0.00 32.23 30.96 2fmr h LYS 59 CO -0.28 0.05 0.62 0.00 -1.08 0.00 0.00 179.45 178.76 2fmr h ALA 60 N 0.29 1.57 -0.17 3.86 0.00 -0.77 0.17 119.26 124.21 2fmr h ALA 60 Ca -0.02 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2fmr h ALA 60 Cb 0.38 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2fmr h ALA 60 CO 0.04 0.12 -0.16 -0.09 0.00 0.00 0.00 179.25 179.15 2fmr h ARG 61 N 0.90 0.28 -0.26 0.00 2.43 -0.61 -1.55 114.38 115.57 2fmr h ARG 61 Ca 0.53 -0.07 -0.15 0.00 -0.81 0.00 0.00 59.98 59.47 2fmr h ARG 61 Cb 0.65 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 2fmr h ARG 61 CO -0.31 0.45 -0.46 1.03 -1.51 0.00 0.00 179.97 179.17 2fmr h SER 62 N 0.26 0.73 0.66 -3.80 0.87 -0.14 1.02 113.55 113.15 2fmr h SER 62 Ca 0.05 -0.35 -0.13 0.00 -1.23 0.00 0.00 61.79 60.13 2fmr h SER 62 Cb 0.45 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2fmr h SER 62 CO 0.03 1.08 -0.61 -0.26 -0.53 0.00 0.00 176.83 176.53 2fmr h PHE 63 N 0.54 0.00 0.06 2.24 0.04 -0.91 -3.20 116.94 115.71 2fmr h PHE 63 Ca 0.03 0.00 -0.32 0.00 2.80 0.00 0.00 57.97 60.48 2fmr h PHE 63 Cb 1.00 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.12 2fmr h PHE 63 CO 0.05 0.61 -1.82 1.28 -0.60 0.00 0.00 178.31 177.83 2fmr n LEU 64 N -3.75 1.64 0.00 1.54 4.77 -0.62 -4.69 117.00 115.88 2fmr n LEU 64 Ca -0.01 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 2fmr n LEU 64 Cb 0.62 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 2fmr n LEU 64 CO 0.42 0.59 0.22 -0.62 -1.33 0.00 0.00 177.39 176.67