#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fmr n SER 2 N 0.00 1.88 0.00 0.00 3.41 -1.26 -4.99 113.62 112.65 2fmr n SER 2 Ca 0.00 0.45 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 2fmr n SER 2 Cb 0.00 -0.88 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 2fmr n SER 2 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2fmr n ARG 3 N -4.45 0.00 -3.93 4.33 3.00 -1.26 -4.39 116.66 109.97 2fmr n ARG 3 Ca -0.28 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.27 2fmr n ARG 3 Cb 0.59 -0.26 -0.14 0.00 0.00 0.00 0.00 32.46 32.66 2fmr n ARG 3 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2fmr s PHE 4 N -1.55 3.08 0.40 -0.14 0.40 -0.82 -5.05 117.98 114.29 2fmr s PHE 4 Ca 0.00 -3.11 0.04 0.00 -0.60 0.00 0.00 56.93 53.26 2fmr s PHE 4 Cb 0.00 -2.73 -0.06 0.00 0.51 0.00 0.00 43.02 40.74 2fmr s PHE 4 CO 0.00 -0.74 0.04 -3.38 0.70 0.00 0.00 175.22 171.84 2fmr s HIS 5 N -0.26 2.11 -0.20 0.36 -3.43 -1.26 -0.33 115.29 112.28 2fmr s HIS 5 Ca 0.17 -0.91 -0.18 0.00 -0.80 0.00 0.00 55.06 53.35 2fmr s HIS 5 Cb -0.25 -1.49 0.05 0.00 -1.43 0.00 0.00 32.58 29.46 2fmr s HIS 5 CO -0.00 0.15 0.52 -2.00 -2.00 0.00 0.00 174.74 171.41 2fmr s GLU 6 N -3.80 0.60 -0.02 -0.38 2.12 -0.76 -4.99 118.70 111.47 2fmr s GLU 6 Ca 0.29 0.74 0.08 0.00 0.36 0.00 0.00 54.97 56.44 2fmr s GLU 6 Cb 0.07 0.27 -0.02 0.00 0.26 0.00 0.00 34.13 34.72 2fmr s GLU 6 CO 0.14 -0.08 -0.26 -0.65 -0.54 0.00 0.00 175.26 173.88 2fmr s GLN 7 N 0.38 2.10 0.20 4.30 1.11 -1.26 -2.25 119.66 124.24 2fmr s GLN 7 Ca -0.01 -0.93 -0.23 0.00 0.01 0.00 0.00 55.36 54.20 2fmr s GLN 7 Cb -0.04 -2.05 0.05 0.00 -1.01 0.00 0.00 33.01 29.97 2fmr s GLN 7 CO -0.01 0.56 0.66 -0.59 0.01 0.00 0.00 175.29 175.92 2fmr s PHE 8 N -0.63 -0.41 0.06 0.91 -0.71 -0.99 -4.97 117.98 111.24 2fmr s PHE 8 Ca 0.10 0.11 0.01 0.00 -1.04 0.00 0.00 56.93 56.11 2fmr s PHE 8 Cb -0.10 0.61 -0.04 0.00 -1.21 0.00 0.00 43.02 42.28 2fmr s PHE 8 CO -0.01 -0.97 0.18 0.96 -1.34 0.00 0.00 175.22 174.04 2fmr s ILE 9 N -3.78 5.19 0.36 -4.49 -4.36 -1.26 -0.88 121.20 111.98 2fmr s ILE 9 Ca 0.05 -0.46 0.09 0.00 -0.26 0.00 0.00 60.65 60.07 2fmr s ILE 9 Cb -0.03 -3.52 -0.07 0.00 1.25 0.00 0.00 42.46 40.10 2fmr s ILE 9 CO -0.06 0.15 -0.07 0.68 0.24 0.00 0.00 174.94 175.88 2fmr s VAL 10 N -1.47 2.21 0.10 8.37 -7.23 -1.20 -5.00 120.40 116.19 2fmr s VAL 10 Ca 0.33 -2.15 0.01 0.00 -1.81 0.00 0.00 61.98 58.36 2fmr s VAL 10 Cb -0.13 -2.72 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 2fmr s VAL 10 CO 0.26 -0.16 0.25 -0.13 -0.31 0.00 0.00 175.10 175.01 2fmr s ARG 11 N -3.63 3.45 0.45 4.82 0.52 -1.26 -4.93 118.95 118.36 2fmr s ARG 11 Ca 0.33 -0.50 0.18 0.00 -0.52 0.00 0.00 55.73 55.22 2fmr s ARG 11 Cb 0.04 -3.00 1.14 0.00 0.52 0.00 0.00 34.95 33.65 2fmr s ARG 11 CO 0.17 0.56 1.94 0.93 0.02 0.00 0.00 175.30 178.92 2fmr h GLU 12 N 2.64 0.31 0.35 3.54 5.08 -2.01 0.66 114.58 125.14 2fmr h GLU 12 Ca -0.47 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 57.86 2fmr h GLU 12 Cb 1.18 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2fmr h GLU 12 CO 0.72 0.20 -0.17 0.22 -1.00 0.00 0.00 179.01 178.99 2fmr h ASP 13 N 0.32 -0.40 -0.89 1.42 3.58 -2.04 -3.13 116.42 115.28 2fmr h ASP 13 Ca 0.34 -0.09 -0.56 0.00 0.42 0.00 0.00 57.03 57.15 2fmr h ASP 13 Cb 0.89 0.10 -0.29 0.00 1.72 0.00 0.00 39.33 41.76 2fmr h ASP 13 CO -0.09 -0.14 0.50 0.18 -2.88 0.00 0.00 179.24 176.80 2fmr n LEU 14 N -5.22 6.66 0.22 2.28 4.32 -0.71 -4.56 117.00 119.99 2fmr n LEU 14 Ca -0.10 -4.08 0.08 0.00 -0.02 0.00 0.00 56.01 51.88 2fmr n LEU 14 Cb 0.25 -0.82 0.49 0.00 -1.62 0.00 0.00 43.42 41.72 2fmr n LEU 14 CO 0.33 1.40 0.81 -0.03 -1.22 0.00 0.00 177.39 178.68 2fmr h MET 15 N 1.60 0.00 0.00 3.23 4.05 0.35 -3.41 114.93 120.75 2fmr h MET 15 Ca 0.54 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.96 2fmr h MET 15 Cb 1.60 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.40 2fmr h MET 15 CO 1.21 0.26 0.00 0.41 0.23 0.00 0.00 176.91 179.02 2fmr n GLY 16 N -0.24 0.92 1.25 1.39 0.00 -1.26 -4.98 105.19 102.26 2fmr n GLY 16 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 0.00 0.00 0.99 7.94 -1.26 -4.90 117.00 119.77 2fmr n LEU 17 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2fmr n LEU 17 Cb 0.00 0.14 0.00 0.00 0.53 0.00 0.00 43.42 44.09 2fmr n LEU 17 CO 0.00 -0.31 0.00 0.00 -1.11 0.00 0.00 177.39 175.97 2fmr n ALA 18 N -1.93 0.00 0.00 1.96 0.00 -1.26 -1.38 120.51 117.90 2fmr n ALA 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2fmr n ALA 18 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2fmr n ALA 18 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2fmr n ILE 19 N 0.00 0.00 -0.27 0.00 2.08 -1.26 -5.08 119.36 114.83 2fmr n ILE 19 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 2fmr n ILE 19 Cb 0.00 -0.62 0.00 0.00 -0.75 0.00 0.00 39.64 38.27 2fmr n ILE 19 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2fmr n GLY 20 N 3.12 0.68 1.52 7.39 0.00 -0.48 -5.05 105.19 112.37 2fmr n GLY 20 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2fmr n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fmr n THR 21 N -0.19 0.06 -3.14 2.61 -2.24 -1.26 -4.95 114.28 105.17 2fmr n THR 21 Ca 0.00 0.02 -0.19 0.00 -2.27 0.00 0.00 64.05 61.61 2fmr n THR 21 Cb 0.08 -0.99 -0.03 0.00 -2.10 0.00 0.00 70.33 67.29 2fmr n THR 21 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2fmr n HIS 22 N -2.81 0.74 -3.42 4.78 -0.00 -1.26 -5.02 115.22 108.22 2fmr n HIS 22 Ca 0.00 -3.82 -0.20 0.00 -0.00 0.00 0.00 57.72 53.70 2fmr n HIS 22 Cb 0.22 -0.43 -0.11 0.00 -0.00 0.00 0.00 29.99 29.68 2fmr n HIS 22 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 2fmr s GLY 23 N -2.59 0.02 -0.28 1.57 0.00 -1.26 -5.00 107.32 99.79 2fmr s GLY 23 Ca 0.41 -0.58 0.08 0.00 0.00 0.00 0.00 44.72 44.63 2fmr s GLY 23 CO -0.09 2.53 1.28 0.00 0.00 0.00 0.00 173.10 176.83 2fmr n ALA 24 N 5.15 4.48 -0.33 3.20 0.00 -1.26 -4.77 120.51 126.98 2fmr n ALA 24 Ca -0.01 -3.50 0.07 0.00 0.00 0.00 0.00 53.44 49.99 2fmr n ALA 24 Cb 0.45 -0.46 0.23 0.00 0.00 0.00 0.00 19.45 19.66 2fmr n ALA 24 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2fmr h ASN 25 N 1.55 0.76 -0.01 0.00 4.21 -1.90 1.12 115.58 121.31 2fmr h ASN 25 Ca 0.22 0.06 -0.16 0.00 1.21 0.00 0.00 56.30 57.64 2fmr h ASN 25 Cb 1.32 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 38.43 2fmr h ASN 25 CO 0.46 0.38 -0.52 0.40 -1.29 0.00 0.00 177.43 176.87 2fmr h ILE 26 N 0.84 1.31 -0.15 2.81 1.08 -1.90 -2.88 117.51 118.62 2fmr h ILE 26 Ca 0.47 -1.74 -0.19 0.00 -0.39 0.00 0.00 64.86 63.00 2fmr h ILE 26 Cb 0.53 1.71 0.00 0.00 -3.07 0.00 0.00 36.82 36.00 2fmr h ILE 26 CO -0.29 0.55 -0.70 -0.61 -0.69 0.00 0.00 178.15 176.41 2fmr h GLN 27 N 0.46 0.63 -0.26 2.37 4.15 -1.34 -2.91 115.11 118.20 2fmr h GLN 27 Ca 0.02 -0.48 0.04 0.00 0.77 0.00 0.00 58.65 59.00 2fmr h GLN 27 Cb 1.06 0.09 -0.04 0.00 0.21 0.00 0.00 27.48 28.80 2fmr h GLN 27 CO 0.10 1.10 0.04 1.96 -1.93 0.00 0.00 178.83 180.09 2fmr h GLN 28 N 0.44 0.13 0.00 1.69 4.20 0.13 1.25 115.11 122.95 2fmr h GLN 28 Ca -0.03 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 2fmr h GLN 28 Cb 1.29 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 29.03 2fmr h GLN 28 CO 0.13 0.09 -0.13 0.00 -0.67 0.00 0.00 178.83 178.25 2fmr h ALA 29 N 1.20 1.56 0.14 3.87 0.00 -1.52 -2.67 119.26 121.83 2fmr h ALA 29 Ca 0.12 -0.12 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 2fmr h ALA 29 Cb 0.13 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.91 2fmr h ALA 29 CO -0.17 0.16 -1.10 -0.09 0.00 0.00 0.00 179.25 178.05 2fmr h ARG 30 N 0.00 0.30 -0.78 0.00 2.43 -0.90 -3.30 114.38 112.13 2fmr h ARG 30 Ca -0.00 -0.51 0.22 0.00 -0.81 0.00 0.00 59.98 58.87 2fmr h ARG 30 Cb 0.27 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.98 2fmr h ARG 30 CO 0.02 1.25 0.55 0.87 -1.51 0.00 0.00 179.97 181.15 2fmr h LYS 31 N -0.30 0.08 -6.48 0.20 1.79 0.18 -3.42 116.57 108.62 2fmr h LYS 31 Ca -0.21 -0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.66 2fmr h LYS 31 Cb 1.74 -0.02 0.06 0.00 -1.58 0.00 0.00 32.23 32.42 2fmr h LYS 31 CO 0.13 0.05 0.79 0.28 -1.08 0.00 0.00 179.45 179.62 2fmr n VAL 32 N -4.35 0.03 -1.43 0.50 0.31 -1.05 -4.84 118.33 107.50 2fmr n VAL 32 Ca 0.16 -0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 64.09 2fmr n VAL 32 Cb 0.80 -1.51 -0.02 0.00 -0.91 0.00 0.00 33.84 32.20 2fmr n VAL 32 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2fmr n PRO 33 N 3.50 2.85 0.00 5.55 -0.04 -1.26 -3.44 135.00 142.16 2fmr n PRO 33 Ca 0.17 -2.27 0.00 0.00 -0.04 0.00 0.00 63.50 61.36 2fmr n PRO 33 Cb 0.28 -3.01 0.00 0.00 -0.04 0.00 0.00 33.50 30.73 2fmr n PRO 33 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2fmr n GLY 34 N 3.97 -0.14 3.55 0.55 0.00 -1.26 -5.06 105.19 106.80 2fmr n GLY 34 Ca 0.59 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.88 -0.08 -0.00 1.61 0.31 -1.22 -3.08 118.33 113.98 2fmr n VAL 35 Ca 0.00 -0.75 -0.09 0.00 -0.01 0.00 0.00 64.34 63.48 2fmr n VAL 35 Cb 0.00 -2.66 0.06 0.00 -0.91 0.00 0.00 33.84 30.33 2fmr n VAL 35 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2fmr h THR 36 N 7.72 1.31 -2.95 2.52 1.35 -1.21 -3.46 112.91 118.20 2fmr h THR 36 Ca -0.23 -1.75 -0.11 0.00 -0.55 0.00 0.00 66.41 63.77 2fmr h THR 36 Cb 1.27 1.71 -0.20 0.00 -1.73 0.00 0.00 68.15 69.21 2fmr h THR 36 CO 1.17 0.55 -0.24 0.00 -0.25 0.00 0.00 175.52 176.75 2fmr s ALA 37 N -4.06 -0.86 -0.01 6.62 0.00 0.01 -5.05 121.76 118.42 2fmr s ALA 37 Ca -0.08 0.41 -0.00 0.00 0.00 0.00 0.00 51.96 52.30 2fmr s ALA 37 Cb 0.11 0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.30 2fmr s ALA 37 CO 0.84 -0.27 0.02 -1.50 0.00 0.00 0.00 175.76 174.85 2fmr s ILE 38 N -1.28 -0.02 0.08 0.00 2.07 -1.26 -0.06 121.20 120.73 2fmr s ILE 38 Ca -0.13 0.08 0.04 0.00 -1.41 0.00 0.00 60.65 59.23 2fmr s ILE 38 Cb -0.05 -0.04 -0.03 0.00 0.13 0.00 0.00 42.46 42.47 2fmr s ILE 38 CO 0.05 0.03 -0.12 -1.81 -1.91 0.00 0.00 174.94 171.18 2fmr s ASP 39 N 0.41 1.48 0.12 4.50 1.11 -0.46 -5.01 116.67 118.82 2fmr s ASP 39 Ca -0.03 -0.67 0.11 0.00 0.18 0.00 0.00 52.55 52.14 2fmr s ASP 39 Cb -0.05 -0.02 -0.04 0.00 1.07 0.00 0.00 42.92 43.88 2fmr s ASP 39 CO -0.01 -0.15 -0.26 -0.22 1.18 0.00 0.00 175.17 175.70 2fmr s LEU 40 N -1.93 2.31 -0.16 1.23 2.96 -1.26 -2.11 118.68 119.72 2fmr s LEU 40 Ca -0.01 -0.74 0.02 0.00 -0.22 0.00 0.00 54.13 53.18 2fmr s LEU 40 Cb -0.08 -1.19 0.02 0.00 0.50 0.00 0.00 46.19 45.44 2fmr s LEU 40 CO 0.01 0.17 -0.20 -0.62 -1.32 0.00 0.00 176.35 174.40 2fmr s ASP 41 N -2.01 3.03 -0.61 3.68 2.15 -1.02 -4.97 116.67 116.91 2fmr s ASP 41 Ca 0.13 -0.60 0.01 0.00 0.43 0.00 0.00 52.55 52.52 2fmr s ASP 41 Cb -0.10 -1.41 0.42 0.00 -0.30 0.00 0.00 42.92 41.53 2fmr s ASP 41 CO 0.06 0.03 1.73 -0.62 -0.17 0.00 0.00 175.17 176.19 2fmr n GLU 42 N 4.38 3.00 0.12 4.34 4.71 -1.26 -3.75 120.64 132.17 2fmr n GLU 42 Ca -0.20 -3.71 0.00 0.00 -0.01 0.00 0.00 57.16 53.24 2fmr n GLU 42 Cb 0.51 -2.28 0.00 0.00 -1.01 0.00 0.00 31.44 28.66 2fmr n GLU 42 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2fmr n ASP 43 N -0.71 -0.10 -2.01 1.62 -0.08 -1.26 -4.88 116.55 109.14 2fmr n ASP 43 Ca 0.53 0.39 -0.03 0.00 -1.51 0.00 0.00 54.79 54.17 2fmr n ASP 43 Cb 0.60 0.31 0.34 0.00 2.34 0.00 0.00 41.12 44.71 2fmr n ASP 43 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2fmr n THR 44 N -3.29 2.91 -3.61 5.18 -1.04 -1.26 -4.90 114.28 108.27 2fmr n THR 44 Ca 0.00 -1.57 -0.26 0.00 -2.04 0.00 0.00 64.05 60.18 2fmr n THR 44 Cb 0.00 -0.34 -0.02 0.00 -1.82 0.00 0.00 70.33 68.15 2fmr n THR 44 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2fmr s THR 46 N -2.95 4.21 -0.02 0.00 2.01 -1.25 -3.25 115.64 114.39 2fmr s THR 46 Ca 0.49 -0.62 -0.00 0.00 0.31 0.00 0.00 61.69 61.87 2fmr s THR 46 Cb -0.27 -3.53 0.03 0.00 0.01 0.00 0.00 72.50 68.74 2fmr s THR 46 CO 0.60 -0.32 0.03 0.12 -0.69 0.00 0.00 174.62 174.35 2fmr s PHE 47 N -2.42 0.07 -0.12 4.92 2.19 -0.06 -2.45 117.98 120.12 2fmr s PHE 47 Ca 0.46 0.12 0.03 0.00 0.33 0.00 0.00 56.93 57.87 2fmr s PHE 47 Cb -0.10 -0.28 0.00 0.00 -1.31 0.00 0.00 43.02 41.34 2fmr s PHE 47 CO 0.36 -0.10 -0.22 -1.01 1.83 0.00 0.00 175.22 176.07 2fmr s HIS 48 N 1.15 2.62 -0.12 10.12 3.76 -0.90 -2.35 115.29 129.57 2fmr s HIS 48 Ca -0.08 -1.15 0.03 0.00 -0.15 0.00 0.00 55.06 53.70 2fmr s HIS 48 Cb -0.13 -1.76 0.01 0.00 1.11 0.00 0.00 32.58 31.80 2fmr s HIS 48 CO -0.03 -0.49 -0.22 0.42 -0.85 0.00 0.00 174.74 173.57 2fmr s ILE 49 N 0.55 2.00 -0.36 0.60 -1.09 -0.95 -1.36 121.20 120.58 2fmr s ILE 49 Ca -0.13 -0.96 0.01 0.00 -2.23 0.00 0.00 60.65 57.34 2fmr s ILE 49 Cb -0.17 -1.76 0.10 0.00 -1.58 0.00 0.00 42.46 39.05 2fmr s ILE 49 CO 0.04 0.54 0.10 -0.31 -1.23 0.00 0.00 174.94 174.08 2fmr s TYR 50 N 0.68 3.63 0.40 3.97 2.02 0.92 -1.83 117.35 127.15 2fmr s TYR 50 Ca -0.11 -2.65 0.07 0.00 -0.37 0.00 0.00 57.07 54.01 2fmr s TYR 50 Cb -0.16 -2.93 -0.05 0.00 -0.40 0.00 0.00 41.96 38.41 2fmr s TYR 50 CO 0.02 -0.94 0.15 0.20 -1.57 0.00 0.00 175.55 173.40 2fmr s GLY 51 N 1.30 2.30 -0.01 0.71 0.00 0.56 -0.66 107.32 111.53 2fmr s GLY 51 Ca 0.08 -2.10 0.22 0.00 0.00 0.00 0.00 44.72 42.91 2fmr s GLY 51 CO -0.06 -1.92 0.54 1.18 0.00 0.00 0.00 173.10 172.84 2fmr n GLU 52 N -1.18 0.65 -4.68 2.90 1.02 -1.18 -1.94 120.64 116.24 2fmr n GLU 52 Ca -0.02 -0.13 -0.27 0.00 -0.02 0.00 0.00 57.16 56.72 2fmr n GLU 52 Cb 0.64 -1.57 -0.17 0.00 -0.02 0.00 0.00 31.44 30.33 2fmr n GLU 52 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2fmr s ASP 53 N -4.74 2.28 0.27 1.62 1.01 -1.26 -4.67 116.67 111.18 2fmr s ASP 53 Ca -0.07 -0.40 0.00 0.00 0.71 0.00 0.00 52.55 52.80 2fmr s ASP 53 Cb 0.13 -1.04 0.57 0.00 1.01 0.00 0.00 42.92 43.59 2fmr s ASP 53 CO 0.89 0.05 1.78 -0.61 0.21 0.00 0.00 175.17 177.49 2fmr h GLN 54 N 7.07 0.69 -0.79 8.23 4.15 -1.90 0.20 115.11 132.77 2fmr h GLN 54 Ca -0.28 -0.04 0.14 0.00 0.77 0.00 0.00 58.65 59.23 2fmr h GLN 54 Cb 1.19 -0.16 -0.06 0.00 0.21 0.00 0.00 27.48 28.67 2fmr h GLN 54 CO 0.48 0.45 0.52 -0.44 -1.93 0.00 0.00 178.83 177.91 2fmr h ASP 55 N 0.71 0.50 0.42 -0.69 5.19 -1.99 0.22 116.42 120.78 2fmr h ASP 55 Ca 0.49 0.03 -0.31 0.00 -0.62 0.00 0.00 57.03 56.61 2fmr h ASP 55 Cb 0.67 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 40.11 2fmr h ASP 55 CO -0.35 0.27 -1.46 0.00 -3.12 0.00 0.00 179.24 174.58 2fmr h ALA 56 N 1.63 0.09 -0.60 3.45 0.00 -1.11 -2.66 119.26 120.06 2fmr h ALA 56 Ca 0.38 -0.98 -0.06 0.00 0.00 0.00 0.00 54.91 54.25 2fmr h ALA 56 Cb 0.73 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 2fmr h ALA 56 CO -0.14 0.96 0.13 0.28 0.00 0.00 0.00 179.25 180.48 2fmr h VAL 57 N 0.10 1.24 -0.05 0.00 2.07 0.26 -0.79 116.25 119.08 2fmr h VAL 57 Ca -0.23 -0.90 -0.08 0.00 0.82 0.00 0.00 66.70 66.31 2fmr h VAL 57 Cb 2.06 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.48 2fmr h VAL 57 CO 0.21 0.34 -0.27 0.11 0.02 0.00 0.00 177.57 177.97 2fmr h LYS 58 N 0.89 0.26 -0.44 1.57 1.79 -0.72 -1.81 116.57 118.11 2fmr h LYS 58 Ca 0.19 -0.22 0.04 0.00 -2.18 0.00 0.00 60.65 58.48 2fmr h LYS 58 Cb 0.35 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.02 2fmr h LYS 58 CO 0.00 0.88 0.30 0.87 -1.08 0.00 0.00 179.45 180.42 2fmr h LYS 59 N -0.28 0.41 0.00 3.15 1.57 -1.36 -0.12 116.57 119.95 2fmr h LYS 59 Ca -0.02 -0.02 -0.16 0.00 -1.87 0.00 0.00 60.65 58.58 2fmr h LYS 59 Cb 0.94 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.13 2fmr h LYS 59 CO 0.06 0.27 -0.74 0.00 -0.57 0.00 0.00 179.45 178.47 2fmr h ALA 60 N 1.75 0.56 -0.06 3.86 0.00 -1.12 -2.78 119.26 121.48 2fmr h ALA 60 Ca 0.19 -0.68 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 2fmr h ALA 60 Cb 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2fmr h ALA 60 CO -0.05 0.93 -0.52 -0.09 0.00 0.00 0.00 179.25 179.52 2fmr h ARG 61 N 0.00 0.16 0.07 0.00 2.43 -0.15 -2.58 114.38 114.30 2fmr h ARG 61 Ca -0.01 -0.09 -0.21 0.00 -0.81 0.00 0.00 59.98 58.86 2fmr h ARG 61 Cb 1.51 0.01 0.02 0.00 -0.42 0.00 0.00 29.97 31.09 2fmr h ARG 61 CO 0.10 0.64 -0.86 1.03 -1.51 0.00 0.00 179.97 179.37 2fmr h SER 62 N 0.12 0.64 -0.11 -3.80 0.87 -1.30 -3.22 113.55 106.75 2fmr h SER 62 Ca 0.00 -0.82 0.03 0.00 -1.23 0.00 0.00 61.79 59.77 2fmr h SER 62 Cb 0.96 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.68 2fmr h SER 62 CO 0.08 1.39 -0.10 -0.26 -0.53 0.00 0.00 176.83 177.41 2fmr h PHE 63 N -0.04 -0.25 0.00 2.24 0.04 -1.45 -3.27 116.94 114.21 2fmr h PHE 63 Ca -0.13 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.66 2fmr h PHE 63 Cb 1.59 0.13 0.00 0.00 2.20 0.00 0.00 35.95 39.87 2fmr h PHE 63 CO 0.15 -0.16 0.00 1.28 -0.60 0.00 0.00 178.31 178.98 2fmr n LEU 64 N -5.24 0.00 0.00 1.54 4.77 -0.98 -4.83 117.00 112.26 2fmr n LEU 64 Ca -0.04 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 2fmr n LEU 64 Cb 0.16 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2fmr n LEU 64 CO 0.25 -0.00 0.16 -1.84 -1.33 0.00 0.00 177.39 174.62