#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 7dfr s ILE 2 N 0.00 4.46 -0.01 3.17 1.01 -1.26 -2.37 121.20 126.20 7dfr s ILE 2 Ca 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.15 7dfr s ILE 2 Cb 0.00 -3.03 0.00 0.00 0.01 0.00 0.00 42.46 39.45 7dfr s ILE 2 CO 0.00 0.35 -0.04 -0.44 0.00 0.00 0.00 174.94 174.81 7dfr s SER 3 N -1.70 0.59 0.03 3.58 0.01 -0.44 -2.23 113.70 113.54 7dfr s SER 3 Ca 0.22 -0.08 -0.06 0.00 1.31 0.00 0.00 55.95 57.34 7dfr s SER 3 Cb -0.12 -0.13 -0.05 0.00 0.21 0.00 0.00 66.02 65.94 7dfr s SER 3 CO 0.13 0.03 0.28 -0.76 0.41 0.00 0.00 173.24 173.32 7dfr s LEU 4 N 0.15 4.36 -0.10 2.44 1.02 -0.95 -0.02 118.68 125.58 7dfr s LEU 4 Ca -0.01 0.54 -0.02 0.00 0.02 0.00 0.00 54.13 54.66 7dfr s LEU 4 Cb -0.05 -2.78 0.04 0.00 0.02 0.00 0.00 46.19 43.41 7dfr s LEU 4 CO -0.00 0.22 0.01 -0.51 0.02 0.00 0.00 176.35 176.09 7dfr s ILE 5 N -1.36 0.37 0.13 -0.59 2.07 -0.88 -1.71 121.20 119.23 7dfr s ILE 5 Ca 0.30 -0.02 -0.10 0.00 -1.41 0.00 0.00 60.65 59.42 7dfr s ILE 5 Cb -0.13 -0.63 0.00 0.00 0.13 0.00 0.00 42.46 41.84 7dfr s ILE 5 CO 0.18 0.14 0.28 0.00 -1.91 0.00 0.00 174.94 173.64 7dfr s ALA 6 N 1.96 -0.27 -0.28 1.50 0.00 -0.89 -4.51 121.76 119.28 7dfr s ALA 6 Ca 0.04 -0.64 0.02 0.00 0.00 0.00 0.00 51.96 51.38 7dfr s ALA 6 Cb -0.13 0.71 0.06 0.00 0.00 0.00 0.00 23.12 23.75 7dfr s ALA 6 CO -0.06 -0.61 -0.06 0.00 0.00 0.00 0.00 175.76 175.03 7dfr s ALA 7 N -3.90 2.67 -0.15 0.00 0.00 -1.26 -2.09 121.76 117.03 7dfr s ALA 7 Ca 0.10 -1.84 -0.05 0.00 0.00 0.00 0.00 51.96 50.17 7dfr s ALA 7 Cb 0.03 -1.73 -0.04 0.00 0.00 0.00 0.00 23.12 21.39 7dfr s ALA 7 CO -0.06 -1.27 0.03 -0.51 0.00 0.00 0.00 175.76 173.95 7dfr s LEU 8 N 1.13 3.64 0.00 0.00 1.02 0.60 -4.64 118.68 120.43 7dfr s LEU 8 Ca -0.06 0.06 0.00 0.00 0.02 0.00 0.00 54.13 54.15 7dfr s LEU 8 Cb -0.20 -1.89 0.00 0.00 0.02 0.00 0.00 46.19 44.12 7dfr s LEU 8 CO -0.04 0.24 0.00 0.00 0.02 0.00 0.00 176.35 176.56 7dfr n ALA 9 N 3.11 0.00 -2.60 4.21 0.00 -0.46 -0.55 120.51 124.22 7dfr n ALA 9 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 7dfr n ALA 9 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 7dfr n ALA 9 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 7dfr s VAL 10 N 0.24 4.58 0.00 0.00 1.01 -0.30 -3.11 120.40 122.82 7dfr s VAL 10 Ca 0.00 1.86 0.00 0.00 0.00 0.00 0.00 61.98 63.84 7dfr s VAL 10 Cb 0.00 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.19 7dfr s VAL 10 CO 0.00 0.15 0.00 -0.67 0.00 0.00 0.00 175.10 174.58 7dfr n ASP 11 N 3.86 -0.98 -1.60 3.32 4.64 -1.26 -4.00 116.55 120.53 7dfr n ASP 11 Ca 0.07 0.00 -0.17 0.00 -1.38 0.00 0.00 54.79 53.31 7dfr n ASP 11 Cb 0.49 -0.17 -0.05 0.00 -1.04 0.00 0.00 41.12 40.35 7dfr n ASP 11 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 7dfr n ARG 12 N -2.22 -1.27 -2.20 -0.67 1.74 -1.18 -4.82 116.66 106.02 7dfr n ARG 12 Ca 0.00 0.99 -0.43 0.00 -0.77 0.00 0.00 57.85 57.64 7dfr n ARG 12 Cb 0.02 -5.32 -0.02 0.00 -1.02 0.00 0.00 32.46 26.11 7dfr n ARG 12 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 7dfr s VAL 13 N -2.73 3.91 -0.85 1.55 1.01 -1.25 -0.12 120.40 121.92 7dfr s VAL 13 Ca 0.00 1.10 0.10 0.00 0.00 0.00 0.00 61.98 63.18 7dfr s VAL 13 Cb 0.00 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 7dfr s VAL 13 CO 0.00 -0.10 0.60 2.30 0.00 0.00 0.00 175.10 177.90 7dfr n ILE 14 N 5.46 0.00 0.00 2.22 -5.35 -0.01 -1.35 119.36 120.33 7dfr n ILE 14 Ca 0.16 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.25 7dfr n ILE 14 Cb 0.44 1.10 0.00 0.00 -1.74 0.00 0.00 39.64 39.44 7dfr n ILE 14 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 7dfr n GLY 15 N 0.91 1.12 3.24 3.28 0.00 -1.11 -4.74 105.19 107.90 7dfr n GLY 15 Ca 0.04 -0.96 -0.14 0.00 0.00 0.00 0.00 46.02 44.95 7dfr n GLY 15 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 7dfr s MET 16 N -2.00 1.34 0.00 1.61 1.75 -0.02 -0.25 119.30 121.73 7dfr s MET 16 Ca 0.00 -1.73 0.00 0.00 -1.25 0.00 0.00 55.69 52.71 7dfr s MET 16 Cb 0.00 0.15 0.00 0.00 2.84 0.00 0.00 34.83 37.82 7dfr s MET 16 CO 0.00 -0.41 0.00 0.39 -0.65 0.00 0.00 175.02 174.35 7dfr n GLU 17 N -0.38 0.00 -2.47 4.11 4.71 -1.26 0.29 120.64 125.65 7dfr n GLU 17 Ca 0.02 0.00 -0.25 0.00 -0.01 0.00 0.00 57.16 56.93 7dfr n GLU 17 Cb 0.65 0.00 0.01 0.00 -1.01 0.00 0.00 31.44 31.09 7dfr n GLU 17 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 7dfr n ASN 18 N 0.71 4.34 -4.32 1.62 4.05 -1.26 -4.96 115.26 115.44 7dfr n ASN 18 Ca 0.00 -3.60 -0.17 0.00 0.45 0.00 0.00 54.58 51.27 7dfr n ASN 18 Cb 0.00 -0.46 -0.10 0.00 1.23 0.00 0.00 39.78 40.45 7dfr n ASN 18 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 7dfr s ALA 19 N -3.50 1.73 -0.32 5.20 0.00 0.84 -4.71 121.76 121.01 7dfr s ALA 19 Ca 0.46 -1.83 -0.07 0.00 0.00 0.00 0.00 51.96 50.51 7dfr s ALA 19 Cb 0.41 0.87 0.02 0.00 0.00 0.00 0.00 23.12 24.42 7dfr s ALA 19 CO -0.15 -0.40 0.11 -1.64 0.00 0.00 0.00 175.76 173.68 7dfr s MET 20 N -3.98 2.88 0.00 0.00 -1.94 -1.26 -0.84 119.30 114.15 7dfr s MET 20 Ca 0.34 -1.01 0.00 0.00 -1.71 0.00 0.00 55.69 53.31 7dfr s MET 20 Cb 0.07 -3.46 0.00 0.00 2.01 0.00 0.00 34.83 33.46 7dfr s MET 20 CO 0.12 -0.56 0.03 -0.35 -0.01 0.00 0.00 175.02 174.24 7dfr n PRO 21 N 4.86 0.05 -3.92 2.03 -0.04 -1.26 -4.61 135.00 132.10 7dfr n PRO 21 Ca -0.13 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.24 7dfr n PRO 21 Cb 0.46 -1.12 -0.05 0.00 -0.04 0.00 0.00 33.50 32.75 7dfr n PRO 21 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 7dfr s TRP 22 N -0.56 0.23 -0.23 0.54 -2.14 -1.26 -5.04 118.94 110.47 7dfr s TRP 22 Ca 0.00 -0.59 -0.04 0.00 2.66 0.00 0.00 56.10 58.14 7dfr s TRP 22 Cb 0.00 0.22 0.08 0.00 -3.10 0.00 0.00 33.47 30.66 7dfr s TRP 22 CO 0.00 -0.93 0.09 1.21 -2.66 0.00 0.00 176.95 174.66 7dfr s ASN 23 N -2.97 3.02 -0.45 -2.66 3.84 -1.26 -5.07 114.94 109.39 7dfr s ASN 23 Ca 0.18 -0.98 0.07 0.00 0.21 0.00 0.00 52.86 52.34 7dfr s ASN 23 Cb -0.00 -0.43 0.23 0.00 -0.55 0.00 0.00 41.25 40.50 7dfr s ASN 23 CO 0.04 -0.37 0.52 0.18 -2.79 0.00 0.00 177.10 174.68 7dfr n LEU 24 N 5.17 0.73 -0.55 3.21 4.77 -1.26 -4.33 117.00 124.73 7dfr n LEU 24 Ca -0.07 -4.77 0.44 0.00 -0.03 0.00 0.00 56.01 51.59 7dfr n LEU 24 Cb 0.46 0.35 0.73 0.00 -2.33 0.00 0.00 43.42 42.63 7dfr n LEU 24 CO 0.09 2.01 1.33 -0.65 -1.33 0.00 0.00 177.39 178.84 7dfr h PRO 25 N 4.43 0.02 0.00 3.23 0.10 -1.98 1.01 132.00 138.80 7dfr h PRO 25 Ca 0.13 -0.00 -0.05 0.00 0.10 0.00 0.00 66.00 66.18 7dfr h PRO 25 Cb 0.85 -0.00 -0.01 0.00 0.10 0.00 0.00 31.00 31.94 7dfr h PRO 25 CO 0.51 0.01 -0.24 0.00 0.10 0.00 0.00 178.00 178.38 7dfr h ALA 26 N 1.38 0.86 -0.12 -0.75 0.00 -1.94 -2.39 119.26 116.30 7dfr h ALA 26 Ca 0.89 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 55.51 7dfr h ALA 26 Cb 3.13 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 20.88 7dfr h ALA 26 CO -0.28 0.31 -0.16 0.22 0.00 0.00 0.00 179.25 179.33 7dfr h ASP 27 N 0.00 0.35 -0.51 0.00 3.58 0.63 -2.71 116.42 117.76 7dfr h ASP 27 Ca -0.00 -0.51 0.02 0.00 0.42 0.00 0.00 57.03 56.96 7dfr h ASP 27 Cb 1.13 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 42.05 7dfr h ASP 27 CO 0.03 0.79 0.34 -0.07 -2.88 0.00 0.00 179.24 177.45 7dfr h LEU 28 N -0.08 0.54 -0.74 2.28 3.38 -1.50 0.85 115.31 120.04 7dfr h LEU 28 Ca 0.01 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 7dfr h LEU 28 Cb 0.71 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 7dfr h LEU 28 CO 0.04 0.38 -0.21 0.00 0.09 0.00 0.00 178.44 178.74 7dfr h ALA 29 N 1.69 0.92 -0.06 1.53 0.00 -1.41 0.15 119.26 122.08 7dfr h ALA 29 Ca 0.20 -0.36 -0.21 0.00 0.00 0.00 0.00 54.91 54.55 7dfr h ALA 29 Cb 0.03 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.68 7dfr h ALA 29 CO -0.05 0.62 -0.77 2.35 0.00 0.00 0.00 179.25 181.40 7dfr h TRP 30 N 0.65 0.89 0.37 0.00 2.91 -0.60 -0.32 115.95 119.85 7dfr h TRP 30 Ca 0.09 -0.44 -0.01 0.00 1.13 0.00 0.00 58.89 59.66 7dfr h TRP 30 Cb 0.70 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.21 7dfr h TRP 30 CO 0.03 1.26 -0.38 0.35 -1.03 0.00 0.00 178.44 178.67 7dfr h PHE 31 N 0.27 -1.07 -0.86 2.65 3.57 0.88 -1.52 116.94 120.87 7dfr h PHE 31 Ca -0.08 0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.64 7dfr h PHE 31 Cb 1.42 0.42 -0.13 0.00 2.79 0.00 0.00 35.95 40.45 7dfr h PHE 31 CO 0.11 -0.51 0.31 -0.22 -2.23 0.00 0.00 178.31 175.77 7dfr h LYS 32 N -0.76 0.31 0.00 1.11 3.64 -0.75 0.50 116.57 120.62 7dfr h LYS 32 Ca -0.05 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.23 7dfr h LYS 32 Cb 0.66 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 7dfr h LYS 32 CO -0.05 0.21 -0.42 -0.09 -2.27 0.00 0.00 179.45 176.82 7dfr h ARG 33 N 0.32 0.00 0.00 1.90 2.43 -0.80 -1.59 114.38 116.64 7dfr h ARG 33 Ca 0.53 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.54 7dfr h ARG 33 Cb 1.01 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 7dfr h ARG 33 CO -0.56 0.42 -0.86 -0.91 -1.51 0.00 0.00 179.97 176.55 7dfr h ASN 34 N 0.00 0.00 0.03 -3.80 2.35 0.10 -3.39 115.58 110.87 7dfr h ASN 34 Ca -0.00 0.00 -0.39 0.00 -0.55 0.00 0.00 56.30 55.36 7dfr h ASN 34 Cb 0.75 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.06 7dfr h ASN 34 CO 0.05 0.72 -2.30 0.35 -1.65 0.00 0.00 177.43 174.61 7dfr n THR 35 N -3.22 1.57 -0.52 2.81 -2.24 -0.78 -5.00 114.28 106.90 7dfr n THR 35 Ca -0.01 -0.52 -0.20 0.00 -2.27 0.00 0.00 64.05 61.05 7dfr n THR 35 Cb 0.84 -1.62 -0.02 0.00 -2.10 0.00 0.00 70.33 67.43 7dfr n THR 35 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 7dfr n LEU 36 N -3.56 -0.16 -2.53 3.22 7.94 -0.61 -1.07 117.00 120.23 7dfr n LEU 36 Ca -0.43 0.41 -0.20 0.00 -1.11 0.00 0.00 56.01 54.68 7dfr n LEU 36 Cb 0.96 -0.33 0.02 0.00 0.53 0.00 0.00 43.42 44.60 7dfr n LEU 36 CO 0.25 -0.81 -0.08 0.47 -1.11 0.00 0.00 177.39 176.11 7dfr n ASP 37 N 0.59 -5.61 -3.92 1.96 8.00 0.32 -4.98 116.55 112.91 7dfr n ASP 37 Ca 0.07 -0.18 -0.10 0.00 0.71 0.00 0.00 54.79 55.30 7dfr n ASP 37 Cb 0.05 -4.52 -0.09 0.00 -0.02 0.00 0.00 41.12 36.54 7dfr n ASP 37 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 7dfr s LYS 38 N -5.36 0.55 0.23 -1.24 1.02 -0.23 -5.00 119.74 109.71 7dfr s LYS 38 Ca 0.18 -0.67 -0.30 0.00 0.02 0.00 0.00 55.97 55.20 7dfr s LYS 38 Cb -0.08 0.22 -0.09 0.00 -0.52 0.00 0.00 37.83 37.36 7dfr s LYS 38 CO 0.22 -0.14 1.22 -1.25 -0.92 0.00 0.00 175.35 174.49 7dfr s PRO 39 N -2.30 4.47 -0.13 -1.68 0.05 -1.26 -3.57 135.00 130.58 7dfr s PRO 39 Ca -0.08 1.97 0.02 0.00 0.05 0.00 0.00 61.00 62.96 7dfr s PRO 39 Cb -0.03 -3.19 0.02 0.00 0.05 0.00 0.00 34.50 31.35 7dfr s PRO 39 CO -0.03 -0.08 -0.17 0.14 0.05 0.00 0.00 177.00 176.91 7dfr s VAL 40 N -0.44 1.70 -0.19 -0.36 -7.23 -0.25 -1.07 120.40 112.56 7dfr s VAL 40 Ca 0.51 -0.75 -0.15 0.00 -1.81 0.00 0.00 61.98 59.78 7dfr s VAL 40 Cb -0.35 -1.55 -0.04 0.00 0.56 0.00 0.00 36.38 35.00 7dfr s VAL 40 CO 0.41 0.48 0.36 -0.63 -0.31 0.00 0.00 175.10 175.41 7dfr s ILE 41 N 1.08 5.24 0.14 -0.62 1.01 0.50 -2.22 121.20 126.33 7dfr s ILE 41 Ca -0.03 0.63 0.01 0.00 0.00 0.00 0.00 60.65 61.27 7dfr s ILE 41 Cb -0.14 -3.69 -0.00 0.00 0.01 0.00 0.00 42.46 38.63 7dfr s ILE 41 CO -0.05 0.29 0.05 0.23 0.00 0.00 0.00 174.94 175.46 7dfr n MET 42 N 4.21 0.88 -4.22 2.79 2.81 -0.92 -0.29 117.12 122.38 7dfr n MET 42 Ca -0.10 -1.20 -0.16 0.00 -1.81 0.00 0.00 57.70 54.43 7dfr n MET 42 Cb 0.51 0.62 -0.11 0.00 -0.71 0.00 0.00 33.22 33.54 7dfr n MET 42 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 7dfr s GLY 43 N -1.88 1.00 0.26 3.03 0.00 -1.08 -2.86 107.32 105.80 7dfr s GLY 43 Ca 0.07 -1.31 -0.10 0.00 0.00 0.00 0.00 44.72 43.37 7dfr s GLY 43 CO 0.05 -1.38 1.57 -0.09 0.00 0.00 0.00 173.10 173.24 7dfr h ARG 44 N 3.34 -0.00 -0.41 2.90 2.43 -0.95 0.13 114.38 121.83 7dfr h ARG 44 Ca -0.38 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 58.72 7dfr h ARG 44 Cb 1.19 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 7dfr h ARG 44 CO 0.55 -0.00 -0.01 0.45 -1.51 0.00 0.00 179.97 179.44 7dfr h HIS 45 N -0.00 0.80 -0.03 2.20 -0.00 -1.97 -1.33 115.15 114.81 7dfr h HIS 45 Ca 0.43 -0.14 0.02 0.00 -0.00 0.00 0.00 60.37 60.68 7dfr h HIS 45 Cb 0.67 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 27.85 7dfr h HIS 45 CO -0.73 0.81 -0.09 1.15 -0.00 0.00 0.00 177.93 179.07 7dfr h THR 46 N 0.56 0.76 -0.78 2.45 2.02 -1.12 -1.78 112.91 115.02 7dfr h THR 46 Ca 0.11 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.46 7dfr h THR 46 Cb 0.50 0.76 -0.11 0.00 -1.74 0.00 0.00 68.15 67.56 7dfr h THR 46 CO 0.02 0.00 0.28 -0.25 0.37 0.00 0.00 175.52 175.94 7dfr h TRP 47 N -0.15 0.46 -0.55 3.16 2.91 -1.04 1.40 115.95 122.15 7dfr h TRP 47 Ca 0.04 0.04 -0.04 0.00 1.13 0.00 0.00 58.89 60.06 7dfr h TRP 47 Cb 0.21 -0.08 -0.03 0.00 -0.51 0.00 0.00 29.16 28.75 7dfr h TRP 47 CO -0.17 -0.01 0.16 0.93 -1.03 0.00 0.00 178.44 178.32 7dfr h GLU 48 N 0.38 0.83 -0.29 2.65 5.08 -0.75 -1.06 114.58 121.41 7dfr h GLU 48 Ca 0.45 -0.15 -0.10 0.00 -1.00 0.00 0.00 59.36 58.55 7dfr h GLU 48 Cb 0.75 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 7dfr h GLU 48 CO -0.47 0.72 -0.20 0.66 -1.00 0.00 0.00 179.01 178.72 7dfr h SER 49 N 0.80 0.69 0.74 1.42 4.64 0.27 -3.23 113.55 118.88 7dfr h SER 49 Ca 0.18 -0.44 -0.03 0.00 -0.47 0.00 0.00 61.79 61.03 7dfr h SER 49 Cb 0.25 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.15 7dfr h SER 49 CO -0.01 0.98 -0.45 0.40 -0.87 0.00 0.00 176.83 176.88 7dfr h ILE 50 N 0.40 0.09 0.00 0.95 2.04 -0.80 -3.47 117.51 116.73 7dfr h ILE 50 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 7dfr h ILE 50 Cb 0.75 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 7dfr h ILE 50 CO 0.06 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.82 7dfr n GLY 51 N -1.59 0.77 3.64 5.37 0.00 -0.43 -5.02 105.19 107.93 7dfr n GLY 51 Ca -0.14 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.86 7dfr n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 7dfr s ARG 52 N -0.65 0.05 1.01 1.61 3.03 -1.26 -5.10 118.95 117.64 7dfr s ARG 52 Ca 0.00 0.02 -0.14 0.00 2.03 0.00 0.00 55.73 57.64 7dfr s ARG 52 Cb 0.00 0.02 0.08 0.00 -1.03 0.00 0.00 34.95 34.03 7dfr s ARG 52 CO 0.00 -0.02 0.41 -0.35 -1.13 0.00 0.00 175.30 174.21 7dfr n PRO 53 N 0.63 -0.81 -3.59 3.89 -0.04 -1.26 -4.95 135.00 128.87 7dfr n PRO 53 Ca -0.01 -0.20 -0.40 0.00 -0.04 0.00 0.00 63.50 62.85 7dfr n PRO 53 Cb 0.59 -1.89 -0.11 0.00 -0.04 0.00 0.00 33.50 32.05 7dfr n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 7dfr s LEU 54 N -2.08 4.40 0.57 1.53 1.43 -1.26 -5.07 118.68 118.20 7dfr s LEU 54 Ca 0.58 -0.59 -0.19 0.00 -1.03 0.00 0.00 54.13 52.90 7dfr s LEU 54 Cb -0.19 -2.06 -0.07 0.00 0.03 0.00 0.00 46.19 43.90 7dfr s LEU 54 CO 0.66 -0.26 0.74 -2.65 0.23 0.00 0.00 176.35 175.07 7dfr n PRO 55 N 5.04 0.71 -1.29 1.29 -0.02 -1.26 -2.72 135.00 136.75 7dfr n PRO 55 Ca -0.13 0.28 -0.10 0.00 -2.02 0.00 0.00 63.50 61.53 7dfr n PRO 55 Cb 0.49 -1.91 -0.04 0.00 -0.02 0.00 0.00 33.50 32.02 7dfr n PRO 55 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 7dfr n GLY 56 N 1.54 1.03 3.20 -1.23 0.00 -1.26 -4.82 105.19 103.65 7dfr n GLY 56 Ca 0.12 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 7dfr n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 7dfr s ARG 57 N -2.67 0.68 -0.54 1.61 0.52 -1.10 0.12 118.95 117.57 7dfr s ARG 57 Ca 0.00 -0.45 -0.24 0.00 -0.52 0.00 0.00 55.73 54.52 7dfr s ARG 57 Cb 0.00 0.29 0.04 0.00 0.52 0.00 0.00 34.95 35.80 7dfr s ARG 57 CO 0.00 -0.20 0.90 0.21 0.02 0.00 0.00 175.30 176.23 7dfr s LYS 58 N -2.06 3.32 -0.38 3.54 2.20 -1.23 -4.71 119.74 120.42 7dfr s LYS 58 Ca -0.09 -0.31 -0.22 0.00 -0.36 0.00 0.00 55.97 54.99 7dfr s LYS 58 Cb -0.03 -4.05 0.01 0.00 -1.51 0.00 0.00 37.83 32.25 7dfr s LYS 58 CO -0.01 -1.43 0.71 -0.80 -0.36 0.00 0.00 175.35 173.47 7dfr s ASN 59 N 2.77 6.47 -0.16 1.43 0.02 -1.26 -1.09 114.94 123.12 7dfr s ASN 59 Ca 0.29 0.16 -0.01 0.00 -1.02 0.00 0.00 52.86 52.28 7dfr s ASN 59 Cb -0.13 -2.36 -0.01 0.00 0.02 0.00 0.00 41.25 38.77 7dfr s ASN 59 CO 0.19 -0.70 -0.11 -0.63 0.02 0.00 0.00 177.10 175.87 7dfr s ILE 60 N 2.94 3.03 0.14 0.60 1.01 -0.94 -2.37 121.20 125.62 7dfr s ILE 60 Ca 0.28 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 60.33 7dfr s ILE 60 Cb -0.14 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 7dfr s ILE 60 CO 0.17 0.49 0.13 -0.63 0.00 0.00 0.00 174.94 175.10 7dfr s ILE 61 N 0.82 4.52 -0.21 2.92 -1.09 -0.27 -2.15 121.20 125.74 7dfr s ILE 61 Ca -0.04 -0.99 0.00 0.00 -2.23 0.00 0.00 60.65 57.39 7dfr s ILE 61 Cb -0.15 -3.28 0.02 0.00 -1.58 0.00 0.00 42.46 37.48 7dfr s ILE 61 CO 0.01 -0.05 -0.14 -0.76 -1.23 0.00 0.00 174.94 172.77 7dfr s LEU 62 N -2.92 2.67 -0.09 2.97 2.01 -1.14 -0.87 118.68 121.31 7dfr s LEU 62 Ca 0.31 -0.79 -0.13 0.00 0.01 0.00 0.00 54.13 53.53 7dfr s LEU 62 Cb -0.11 -1.56 0.03 0.00 0.01 0.00 0.00 46.19 44.56 7dfr s LEU 62 CO 0.23 -0.06 0.33 -0.55 1.01 0.00 0.00 176.35 177.31 7dfr s SER 63 N 1.29 -0.31 0.08 2.29 0.15 -0.08 -0.18 113.70 116.94 7dfr s SER 63 Ca 0.02 0.51 0.08 0.00 0.70 0.00 0.00 55.95 57.26 7dfr s SER 63 Cb -0.15 0.59 -0.22 0.00 -1.71 0.00 0.00 66.02 64.53 7dfr s SER 63 CO -0.09 -0.22 1.13 0.77 1.20 0.00 0.00 173.24 176.03 7dfr h SER 64 N 5.08 0.01 -4.03 5.45 4.64 -1.87 -3.20 113.55 119.63 7dfr h SER 64 Ca -0.27 -0.01 -0.46 0.00 -0.47 0.00 0.00 61.79 60.57 7dfr h SER 64 Cb 1.18 -0.00 0.08 0.00 -0.31 0.00 0.00 62.40 63.35 7dfr h SER 64 CO 0.32 1.01 0.28 -1.10 -0.87 0.00 0.00 176.83 176.48 7dfr s GLN 65 N -2.68 2.15 0.28 4.77 -0.21 -1.26 -4.88 119.66 117.82 7dfr s GLN 65 Ca -0.01 -0.13 -0.29 0.00 0.02 0.00 0.00 55.36 54.95 7dfr s GLN 65 Cb 0.09 -2.10 -0.10 0.00 1.00 0.00 0.00 33.01 31.91 7dfr s GLN 65 CO 0.82 -1.34 1.13 -1.25 -2.12 0.00 0.00 175.29 172.54 7dfr s PRO 66 N -5.34 4.60 0.53 2.91 0.04 -1.26 -4.91 135.00 131.55 7dfr s PRO 66 Ca 0.61 1.86 -0.20 0.00 0.04 0.00 0.00 61.00 63.30 7dfr s PRO 66 Cb -0.11 -3.17 -0.06 0.00 0.04 0.00 0.00 34.50 31.20 7dfr s PRO 66 CO 0.46 0.15 1.17 0.20 0.04 0.00 0.00 177.00 179.02 7dfr s GLY 67 N -0.79 2.72 -0.27 0.56 0.00 -1.26 -4.98 107.32 103.31 7dfr s GLY 67 Ca 0.45 0.93 0.12 0.00 0.00 0.00 0.00 44.72 46.23 7dfr s GLY 67 CO 0.43 1.34 1.17 -1.30 0.00 0.00 0.00 173.10 174.73 7dfr n THR 68 N -1.10 2.08 -3.50 0.90 -2.24 -1.26 -4.97 114.28 104.18 7dfr n THR 68 Ca 0.11 -3.71 0.00 0.00 -2.27 0.00 0.00 64.05 58.18 7dfr n THR 68 Cb 0.49 -0.31 -0.04 0.00 -2.10 0.00 0.00 70.33 68.37 7dfr n THR 68 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 7dfr s ASP 69 N -3.61 -0.71 0.12 3.42 -1.08 -1.26 -5.04 116.67 108.50 7dfr s ASP 69 Ca 0.43 1.00 0.26 0.00 -0.52 0.00 0.00 52.55 53.72 7dfr s ASP 69 Cb 0.38 1.74 0.98 0.00 -1.46 0.00 0.00 42.92 44.56 7dfr s ASP 69 CO 0.01 -0.14 1.82 0.47 0.52 0.00 0.00 175.17 177.84 7dfr n ASP 70 N 4.90 0.43 0.19 -0.34 8.00 -1.26 -3.45 116.55 125.02 7dfr n ASP 70 Ca -0.11 0.55 0.04 0.00 0.71 0.00 0.00 54.79 55.97 7dfr n ASP 70 Cb 0.53 -0.66 0.39 0.00 -0.02 0.00 0.00 41.12 41.36 7dfr n ASP 70 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 7dfr h ARG 71 N 0.00 0.00 -6.37 -1.24 3.08 -1.99 -3.43 114.38 104.42 7dfr h ARG 71 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 7dfr h ARG 71 Cb 0.59 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.50 7dfr h ARG 71 CO 0.00 0.34 -0.73 0.14 -1.07 0.00 0.00 179.97 178.65 7dfr s VAL 72 N -4.20 2.98 -0.30 2.04 -7.23 -1.22 -4.96 120.40 107.51 7dfr s VAL 72 Ca -0.03 -1.91 -0.29 0.00 -1.81 0.00 0.00 61.98 57.94 7dfr s VAL 72 Cb 0.14 -2.51 0.01 0.00 0.56 0.00 0.00 36.38 34.57 7dfr s VAL 72 CO 0.71 -0.22 1.21 -0.89 -0.31 0.00 0.00 175.10 175.60 7dfr s THR 73 N -1.99 4.29 0.17 5.32 2.01 -1.00 -4.86 115.64 119.58 7dfr s THR 73 Ca 0.27 1.48 -0.05 0.00 0.31 0.00 0.00 61.69 63.70 7dfr s THR 73 Cb -0.07 -4.24 -0.06 0.00 0.01 0.00 0.00 72.50 68.14 7dfr s THR 73 CO 0.15 -0.45 0.41 0.26 -0.69 0.00 0.00 174.62 174.30 7dfr s TRP 74 N 4.02 3.47 -0.02 4.92 0.52 -1.26 -1.11 118.94 129.48 7dfr s TRP 74 Ca 0.52 0.57 -0.16 0.00 0.02 0.00 0.00 56.10 57.05 7dfr s TRP 74 Cb -0.15 -2.02 0.03 0.00 -1.15 0.00 0.00 33.47 30.17 7dfr s TRP 74 CO 0.19 0.39 0.35 0.14 0.02 0.00 0.00 176.95 178.04 7dfr s VAL 75 N -1.74 0.05 -0.83 4.03 -7.23 -0.05 -4.87 120.40 109.77 7dfr s VAL 75 Ca 0.42 -0.41 0.07 0.00 -1.81 0.00 0.00 61.98 60.24 7dfr s VAL 75 Cb -0.12 -0.65 0.04 0.00 0.56 0.00 0.00 36.38 36.22 7dfr s VAL 75 CO 0.25 -0.23 0.67 0.29 -0.31 0.00 0.00 175.10 175.78 7dfr n LYS 76 N 1.29 0.56 -3.63 4.82 5.02 -1.21 -0.91 118.16 124.10 7dfr n LYS 76 Ca -0.21 -0.82 -0.15 0.00 -2.02 0.00 0.00 58.31 55.11 7dfr n LYS 76 Cb 0.56 -1.10 -0.07 0.00 -0.02 0.00 0.00 35.03 34.41 7dfr n LYS 76 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 7dfr s SER 77 N -0.71 -0.41 0.20 4.39 1.04 -1.26 -4.81 113.70 112.14 7dfr s SER 77 Ca 0.08 0.29 -0.11 0.00 0.48 0.00 0.00 55.95 56.69 7dfr s SER 77 Cb 0.06 0.44 0.24 0.00 0.10 0.00 0.00 66.02 66.85 7dfr s SER 77 CO 0.11 -0.59 1.74 0.58 0.98 0.00 0.00 173.24 176.05 7dfr h VAL 78 N 3.22 0.77 -0.52 5.02 2.07 -1.98 0.23 116.25 125.05 7dfr h VAL 78 Ca -0.29 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.06 7dfr h VAL 78 Cb 1.18 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 7dfr h VAL 78 CO 0.41 0.06 0.14 0.44 0.02 0.00 0.00 177.57 178.63 7dfr h ASP 79 N 0.35 0.73 0.66 0.57 3.32 -1.98 0.43 116.42 120.51 7dfr h ASP 79 Ca 0.28 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 7dfr h ASP 79 Cb 0.34 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.71 7dfr h ASP 79 CO -0.30 0.71 -0.36 -0.33 -1.72 0.00 0.00 179.24 177.25 7dfr h GLU 80 N 0.76 -0.90 -0.80 3.56 5.08 -1.36 -0.16 114.58 120.76 7dfr h GLU 80 Ca 0.17 0.06 0.07 0.00 -1.00 0.00 0.00 59.36 58.67 7dfr h GLU 80 Cb 0.27 0.21 -0.10 0.00 0.50 0.00 0.00 28.75 29.63 7dfr h GLU 80 CO -0.00 -0.60 -0.46 0.00 -1.00 0.00 0.00 179.01 176.94 7dfr n ALA 81 N -2.52 -0.50 0.25 3.43 0.00 0.60 0.29 120.51 122.05 7dfr n ALA 81 Ca -0.12 0.68 0.08 0.00 0.00 0.00 0.00 53.44 54.09 7dfr n ALA 81 Cb 0.38 -0.12 0.63 0.00 0.00 0.00 0.00 19.45 20.33 7dfr n ALA 81 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 7dfr h ILE 82 N 0.00 0.93 0.03 0.00 2.04 -0.14 -2.47 117.51 117.90 7dfr h ILE 82 Ca 0.13 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 7dfr h ILE 82 Cb 0.33 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 7dfr h ILE 82 CO -0.75 0.11 -0.01 0.00 0.00 0.00 0.00 178.15 177.49 7dfr h ALA 83 N 1.89 -0.04 0.00 1.87 0.00 0.62 -3.31 119.26 120.28 7dfr h ALA 83 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 7dfr h ALA 83 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 7dfr h ALA 83 CO 0.01 -0.14 0.14 0.00 0.00 0.00 0.00 179.25 179.27 7dfr n ALA 84 N -2.52 0.71 -0.11 0.00 0.00 0.46 -1.80 120.51 117.26 7dfr n ALA 84 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 7dfr n ALA 84 Cb 0.34 -0.65 -0.11 0.00 0.00 0.00 0.00 19.45 19.03 7dfr n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 7dfr n GLY 86 N 1.42 0.41 3.40 0.00 0.00 -0.75 -4.75 105.19 104.93 7dfr n GLY 86 Ca -0.34 -1.70 -0.45 0.00 0.00 0.00 0.00 46.02 43.53 7dfr n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 7dfr s ASP 87 N -4.00 6.92 0.16 1.61 1.11 -1.26 -4.98 116.67 116.22 7dfr s ASP 87 Ca 0.00 -2.78 0.07 0.00 0.18 0.00 0.00 52.55 50.02 7dfr s ASP 87 Cb 0.00 -2.31 -0.04 0.00 1.07 0.00 0.00 42.92 41.64 7dfr s ASP 87 CO 0.00 -0.69 -0.15 0.68 1.18 0.00 0.00 175.17 176.19 7dfr s VAL 88 N 0.90 1.56 0.06 -1.27 -7.23 -1.26 -5.06 120.40 108.09 7dfr s VAL 88 Ca 0.31 -1.91 -0.23 0.00 -1.81 0.00 0.00 61.98 58.34 7dfr s VAL 88 Cb -0.07 -1.76 -0.15 0.00 0.56 0.00 0.00 36.38 34.96 7dfr s VAL 88 CO -0.07 -0.45 1.55 -0.65 -0.31 0.00 0.00 175.10 175.17 7dfr h PRO 89 N 3.17 0.11 -3.24 4.82 0.11 -1.94 -3.42 132.00 131.62 7dfr h PRO 89 Ca -0.40 -0.02 -0.28 0.00 0.11 0.00 0.00 66.00 65.41 7dfr h PRO 89 Cb 1.20 -0.01 -0.34 0.00 0.11 0.00 0.00 31.00 31.96 7dfr h PRO 89 CO 0.54 0.29 -0.64 -2.00 -0.21 0.00 0.00 178.00 175.98 7dfr s GLU 90 N -5.33 0.04 -0.17 1.05 2.12 -1.26 -0.26 118.70 114.89 7dfr s GLU 90 Ca -0.14 0.41 -0.07 0.00 0.36 0.00 0.00 54.97 55.53 7dfr s GLU 90 Cb 0.05 -0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.15 7dfr s GLU 90 CO 0.68 -0.23 0.08 0.42 -0.54 0.00 0.00 175.26 175.68 7dfr s ILE 91 N 1.63 5.01 -0.27 -3.70 1.09 -1.00 -4.47 121.20 119.49 7dfr s ILE 91 Ca -0.04 0.04 -0.09 0.00 -1.10 0.00 0.00 60.65 59.46 7dfr s ILE 91 Cb -0.12 -3.24 -0.03 0.00 -1.06 0.00 0.00 42.46 38.01 7dfr s ILE 91 CO -0.05 0.50 0.12 -0.04 -0.10 0.00 0.00 174.94 175.36 7dfr s MET 92 N -0.00 3.65 -0.29 2.79 -1.94 -0.23 -1.33 119.30 121.94 7dfr s MET 92 Ca 0.07 -0.50 -0.12 0.00 -1.71 0.00 0.00 55.69 53.43 7dfr s MET 92 Cb -0.12 -3.46 -0.04 0.00 2.01 0.00 0.00 34.83 33.22 7dfr s MET 92 CO 0.00 -0.24 0.25 0.08 -0.01 0.00 0.00 175.02 175.11 7dfr s VAL 93 N 1.65 5.26 -0.38 -6.03 1.01 0.97 -0.37 120.40 122.51 7dfr s VAL 93 Ca 0.06 0.19 0.06 0.00 0.00 0.00 0.00 61.98 62.30 7dfr s VAL 93 Cb -0.16 -3.62 0.59 0.00 0.00 0.00 0.00 36.38 33.19 7dfr s VAL 93 CO 0.06 0.16 1.70 2.30 0.00 0.00 0.00 175.10 179.33 7dfr n ILE 94 N 5.10 2.91 -4.34 2.22 -5.35 0.60 -2.07 119.36 118.43 7dfr n ILE 94 Ca -0.12 -2.37 0.00 0.00 -0.27 0.00 0.00 62.75 59.99 7dfr n ILE 94 Cb 0.51 -0.42 0.00 0.00 -1.74 0.00 0.00 39.64 37.99 7dfr n ILE 94 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 7dfr n GLY 95 N -1.13 -1.05 0.00 3.28 0.00 -1.26 -4.86 105.19 100.17 7dfr n GLY 95 Ca 0.48 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 45.30 7dfr n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 7dfr n GLY 96 N 0.00 -0.41 0.00 -0.02 0.00 -1.26 -2.64 105.19 100.85 7dfr n GLY 96 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 7dfr n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 7dfr n GLY 97 N 3.43 -3.12 0.32 -0.02 0.00 -1.26 -0.90 105.19 103.63 7dfr n GLY 97 Ca 0.00 0.27 0.12 0.00 0.00 0.00 0.00 46.02 46.41 7dfr n GLY 97 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 7dfr h ARG 98 N 0.00 0.06 -0.31 1.61 0.11 -1.96 0.23 114.38 114.12 7dfr h ARG 98 Ca 0.00 -0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.06 7dfr h ARG 98 Cb 0.00 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.05 7dfr h ARG 98 CO 0.00 0.04 0.14 0.28 0.10 0.00 0.00 179.97 180.52 7dfr h VAL 99 N 0.06 1.17 0.18 0.08 2.07 -1.83 -0.84 116.25 117.15 7dfr h VAL 99 Ca 0.54 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.56 7dfr h VAL 99 Cb 1.07 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 7dfr h VAL 99 CO -0.82 0.18 -0.30 1.88 0.02 0.00 0.00 177.57 178.52 7dfr h TYR 100 N 0.36 -0.81 -0.97 1.57 0.05 0.11 0.94 116.97 118.22 7dfr h TYR 100 Ca 0.11 0.01 0.31 0.00 0.05 0.00 0.00 58.73 59.21 7dfr h TYR 100 Cb 0.16 0.33 -0.16 0.00 1.01 0.00 0.00 36.73 38.07 7dfr h TYR 100 CO -0.01 -0.42 0.41 1.49 -1.05 0.00 0.00 178.16 178.59 7dfr h GLU 101 N -0.56 0.18 0.04 4.88 4.81 -0.13 -0.27 114.58 123.53 7dfr h GLU 101 Ca 0.02 -0.01 -0.26 0.00 -0.13 0.00 0.00 59.36 58.98 7dfr h GLU 101 Cb 0.56 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 7dfr h GLU 101 CO -0.14 0.12 -1.31 1.96 -0.73 0.00 0.00 179.01 178.92 7dfr h GLN 102 N 0.19 0.09 0.00 1.92 4.20 -0.53 -3.37 115.11 117.61 7dfr h GLN 102 Ca 0.70 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 59.21 7dfr h GLN 102 Cb 1.60 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.43 7dfr h GLN 102 CO -0.69 0.95 -0.60 0.74 -0.67 0.00 0.00 178.83 178.56 7dfr h PHE 103 N 0.03 0.00 -0.62 2.96 0.04 0.73 -3.39 116.94 116.69 7dfr h PHE 103 Ca -0.14 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.71 7dfr h PHE 103 Cb 1.91 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.95 7dfr h PHE 103 CO 0.02 0.16 -0.47 1.25 -0.60 0.00 0.00 178.31 178.67 7dfr h LEU 104 N 0.00 -1.64 -1.55 1.54 5.85 -1.28 0.14 115.31 118.37 7dfr h LEU 104 Ca -0.02 0.26 0.32 0.00 0.84 0.00 0.00 57.88 59.28 7dfr h LEU 104 Cb 1.14 0.73 -0.09 0.00 0.37 0.00 0.00 40.66 42.81 7dfr h LEU 104 CO 0.02 -0.33 0.76 -0.65 -0.34 0.00 0.00 178.44 177.89 7dfr h PRO 105 N -0.22 0.23 0.00 5.25 0.11 -1.83 0.30 132.00 135.83 7dfr h PRO 105 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.26 7dfr h PRO 105 Cb 0.56 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.61 7dfr h PRO 105 CO -0.72 0.15 -0.59 1.63 -0.21 0.00 0.00 178.00 178.26 7dfr n LYS 106 N -4.50 0.28 -1.89 1.05 4.01 -0.05 -4.93 118.16 112.13 7dfr n LYS 106 Ca 0.27 0.09 -0.34 0.00 -0.51 0.00 0.00 58.31 57.83 7dfr n LYS 106 Cb 1.08 -1.69 0.04 0.00 -0.51 0.00 0.00 35.03 33.95 7dfr n LYS 106 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 7dfr s ALA 107 N -3.16 2.52 0.00 7.82 0.00 0.11 -4.59 121.76 124.45 7dfr s ALA 107 Ca 0.07 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.68 7dfr s ALA 107 Cb 0.13 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.91 7dfr s ALA 107 CO 0.71 -1.16 0.00 1.04 0.00 0.00 0.00 175.76 176.35 7dfr n GLN 108 N -2.10 4.21 -3.70 0.00 6.02 -0.95 -4.90 117.38 115.97 7dfr n GLN 108 Ca 0.11 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.96 7dfr n GLN 108 Cb 0.52 -0.52 -0.09 0.00 1.02 0.00 0.00 30.24 31.16 7dfr n GLN 108 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 7dfr s LYS 109 N -0.98 0.68 0.11 -1.09 2.20 -1.21 -1.88 119.74 117.56 7dfr s LYS 109 Ca 0.00 0.27 0.10 0.00 -0.36 0.00 0.00 55.97 55.98 7dfr s LYS 109 Cb 0.00 0.32 -0.04 0.00 -1.51 0.00 0.00 37.83 36.60 7dfr s LYS 109 CO 0.00 -0.15 -0.26 -0.51 -0.36 0.00 0.00 175.35 174.07 7dfr s LEU 110 N -0.58 2.28 -0.34 5.43 1.43 0.13 -2.25 118.68 124.79 7dfr s LEU 110 Ca -0.07 -0.71 0.02 0.00 -1.03 0.00 0.00 54.13 52.34 7dfr s LEU 110 Cb -0.03 -1.18 0.10 0.00 0.03 0.00 0.00 46.19 45.11 7dfr s LEU 110 CO 0.04 0.18 0.09 -0.31 0.23 0.00 0.00 176.35 176.57 7dfr s TYR 111 N -1.02 2.64 0.11 0.29 1.51 -0.70 -2.60 117.35 117.58 7dfr s TYR 111 Ca 0.12 -2.36 0.08 0.00 -1.01 0.00 0.00 57.07 53.91 7dfr s TYR 111 Cb -0.10 -2.27 -0.04 0.00 -0.11 0.00 0.00 41.96 39.44 7dfr s TYR 111 CO 0.05 -0.90 -0.17 -0.51 -1.11 0.00 0.00 175.55 172.91 7dfr s LEU 112 N 1.18 2.73 -0.43 -1.29 1.43 -0.25 -2.09 118.68 119.97 7dfr s LEU 112 Ca 0.11 -0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 52.57 7dfr s LEU 112 Cb -0.19 -1.58 0.07 0.00 0.03 0.00 0.00 46.19 44.53 7dfr s LEU 112 CO -0.16 0.19 0.30 -0.89 0.23 0.00 0.00 176.35 176.02 7dfr s THR 113 N -1.13 4.60 -0.55 5.49 2.01 -0.89 0.90 115.64 126.08 7dfr s THR 113 Ca 0.18 -1.21 -0.17 0.00 0.31 0.00 0.00 61.69 60.80 7dfr s THR 113 Cb -0.11 -3.76 0.11 0.00 0.01 0.00 0.00 72.50 68.75 7dfr s THR 113 CO 0.10 -0.49 0.57 -1.00 -0.69 0.00 0.00 174.62 173.11 7dfr s HIS 114 N 1.51 3.14 0.30 4.92 0.09 0.46 -0.29 115.29 125.42 7dfr s HIS 114 Ca 0.03 -1.07 -0.28 0.00 -0.00 0.00 0.00 55.06 53.74 7dfr s HIS 114 Cb -0.23 -3.79 -0.09 0.00 -0.00 0.00 0.00 32.58 28.47 7dfr s HIS 114 CO 0.04 -1.10 1.01 0.42 -0.00 0.00 0.00 174.74 175.12 7dfr s ILE 115 N 2.08 3.85 -1.15 0.60 1.09 0.29 -0.49 121.20 127.47 7dfr s ILE 115 Ca 0.07 1.70 -0.12 0.00 -1.10 0.00 0.00 60.65 61.20 7dfr s ILE 115 Cb -0.26 -4.02 0.21 0.00 -1.06 0.00 0.00 42.46 37.32 7dfr s ILE 115 CO 0.05 0.29 1.28 -0.62 -0.10 0.00 0.00 174.94 175.84 7dfr s ASP 116 N -1.25 7.13 -0.27 3.58 2.15 0.87 -4.21 116.67 124.67 7dfr s ASP 116 Ca 0.47 -3.16 -0.25 0.00 0.43 0.00 0.00 52.55 50.04 7dfr s ASP 116 Cb -0.26 -2.32 0.08 0.00 -0.30 0.00 0.00 42.92 40.12 7dfr s ASP 116 CO 0.32 -0.59 0.78 0.00 -0.17 0.00 0.00 175.17 175.51 7dfr s ALA 117 N 0.54 -1.82 -0.91 3.66 0.00 -1.26 -4.59 121.76 117.38 7dfr s ALA 117 Ca 0.37 2.02 -0.08 0.00 0.00 0.00 0.00 51.96 54.27 7dfr s ALA 117 Cb -0.06 -1.24 0.23 0.00 0.00 0.00 0.00 23.12 22.06 7dfr s ALA 117 CO -0.04 -0.32 0.84 -1.21 0.00 0.00 0.00 175.76 175.03 7dfr s GLU 118 N 0.39 3.58 0.11 0.00 2.02 -1.26 -1.15 118.70 122.39 7dfr s GLU 118 Ca 0.00 -2.94 0.08 0.00 0.02 0.00 0.00 54.97 52.13 7dfr s GLU 118 Cb -0.05 -4.25 -0.04 0.00 0.10 0.00 0.00 34.13 29.89 7dfr s GLU 118 CO -0.01 -1.25 -0.13 0.14 0.02 0.00 0.00 175.26 174.03 7dfr s VAL 119 N -0.75 3.18 0.16 2.63 -7.23 -1.26 -5.04 120.40 112.08 7dfr s VAL 119 Ca 0.25 -1.35 -0.23 0.00 -1.81 0.00 0.00 61.98 58.83 7dfr s VAL 119 Cb -0.11 -2.48 -0.08 0.00 0.56 0.00 0.00 36.38 34.28 7dfr s VAL 119 CO -0.09 0.11 0.73 -0.70 -0.31 0.00 0.00 175.10 174.84 7dfr s GLU 120 N -2.18 4.45 0.20 4.82 2.12 -1.26 -4.82 118.70 122.02 7dfr s GLU 120 Ca 0.20 1.03 -0.09 0.00 0.36 0.00 0.00 54.97 56.48 7dfr s GLU 120 Cb -0.11 -3.20 -0.01 0.00 0.26 0.00 0.00 34.13 31.07 7dfr s GLU 120 CO 0.12 0.56 0.31 0.20 -0.54 0.00 0.00 175.26 175.92 7dfr s GLY 121 N -1.22 0.69 0.00 -1.50 0.00 -1.26 -4.75 107.32 99.28 7dfr s GLY 121 Ca 0.35 -1.05 0.12 0.00 0.00 0.00 0.00 44.72 44.15 7dfr s GLY 121 CO 0.24 -0.89 0.55 2.09 0.00 0.00 0.00 173.10 175.10 7dfr n ASP 122 N -0.28 0.69 -4.10 1.64 3.85 0.65 -4.93 116.55 114.08 7dfr n ASP 122 Ca -0.04 -0.85 -0.26 0.00 -0.71 0.00 0.00 54.79 52.94 7dfr n ASP 122 Cb 0.63 0.93 -0.16 0.00 -1.35 0.00 0.00 41.12 41.17 7dfr n ASP 122 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 7dfr s THR 123 N -2.09 1.39 0.20 2.12 2.01 -1.05 -5.03 115.64 113.19 7dfr s THR 123 Ca 0.05 -0.66 0.10 0.00 0.31 0.00 0.00 61.69 61.50 7dfr s THR 123 Cb 0.09 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.34 7dfr s THR 123 CO 0.48 0.41 -0.21 -1.00 -0.69 0.00 0.00 174.62 173.61 7dfr s HIS 124 N 0.31 2.09 0.17 4.92 3.76 -1.26 -0.83 115.29 124.45 7dfr s HIS 124 Ca -0.10 -0.41 -0.22 0.00 -0.15 0.00 0.00 55.06 54.18 7dfr s HIS 124 Cb -0.14 -1.01 -0.08 0.00 1.11 0.00 0.00 32.58 32.46 7dfr s HIS 124 CO 0.04 0.47 0.73 0.12 -0.85 0.00 0.00 174.74 175.24 7dfr s PHE 125 N -2.03 3.81 0.43 1.40 5.36 0.83 -4.81 117.98 122.96 7dfr s PHE 125 Ca 0.21 1.50 -0.21 0.00 -0.96 0.00 0.00 56.93 57.46 7dfr s PHE 125 Cb -0.06 -2.67 -0.14 0.00 -0.34 0.00 0.00 43.02 39.81 7dfr s PHE 125 CO 0.09 0.47 0.31 -0.35 -1.46 0.00 0.00 175.22 174.28 7dfr n PRO 126 N 1.32 0.27 -2.03 10.12 -0.04 -1.26 -4.75 135.00 138.63 7dfr n PRO 126 Ca -0.05 0.10 -0.36 0.00 -0.04 0.00 0.00 63.50 63.15 7dfr n PRO 126 Cb 0.50 -1.26 -0.04 0.00 -0.04 0.00 0.00 33.50 32.66 7dfr n PRO 126 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 7dfr n ASP 127 N 1.76 3.56 -3.81 3.54 -0.08 -1.26 -4.97 116.55 115.29 7dfr n ASP 127 Ca 0.11 -2.77 -0.27 0.00 -1.51 0.00 0.00 54.79 50.35 7dfr n ASP 127 Cb 0.41 -1.64 0.24 0.00 2.34 0.00 0.00 41.12 42.47 7dfr n ASP 127 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 7dfr n TYR 128 N 10.98 -2.48 -3.69 -0.67 4.11 -1.26 -4.99 117.16 119.16 7dfr n TYR 128 Ca 0.47 -0.32 -0.29 0.00 -0.00 0.00 0.00 57.90 57.77 7dfr n TYR 128 Cb 0.45 -1.47 -0.16 0.00 -0.00 0.00 0.00 39.34 38.16 7dfr n TYR 128 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.86 174.86 7dfr s GLU 129 N -4.26 0.55 0.08 -3.48 2.12 -1.26 -5.05 118.70 107.39 7dfr s GLU 129 Ca 0.59 -0.67 -0.06 0.00 0.36 0.00 0.00 54.97 55.18 7dfr s GLU 129 Cb -0.14 -1.84 0.08 0.00 0.26 0.00 0.00 34.13 32.48 7dfr s GLU 129 CO 0.56 -0.86 0.54 -2.30 -0.54 0.00 0.00 175.26 172.66 7dfr n PRO 130 N 5.03 -0.09 0.34 4.30 -0.01 -1.26 0.16 135.00 143.47 7dfr n PRO 130 Ca -0.06 0.53 0.22 0.00 -0.01 0.00 0.00 63.50 64.18 7dfr n PRO 130 Cb 0.44 -0.79 1.17 0.00 -0.01 0.00 0.00 33.50 34.31 7dfr n PRO 130 CO 0.00 0.00 0.00 0.38 -0.01 0.00 0.00 175.50 175.87 7dfr h ASP 131 N 0.00 0.00 1.00 2.55 2.03 -2.03 -2.59 116.42 117.38 7dfr h ASP 131 Ca 0.12 0.00 -0.20 0.00 -0.73 0.00 0.00 57.03 56.21 7dfr h ASP 131 Cb 0.20 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.67 7dfr h ASP 131 CO -0.34 0.00 -1.03 0.44 -1.03 0.00 0.00 179.24 177.28 7dfr h ASP 132 N 0.00 0.00 -3.14 4.15 3.32 -0.65 -3.46 116.42 116.65 7dfr h ASP 132 Ca 0.00 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.42 7dfr h ASP 132 Cb 0.10 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.54 7dfr h ASP 132 CO -0.00 0.92 -0.63 0.26 -1.72 0.00 0.00 179.24 178.07 7dfr s TRP 133 N -2.74 3.03 -0.28 4.55 0.52 -0.98 0.39 118.94 123.44 7dfr s TRP 133 Ca 0.01 -0.02 0.02 0.00 0.02 0.00 0.00 56.10 56.13 7dfr s TRP 133 Cb 0.09 -1.53 0.07 0.00 -1.15 0.00 0.00 33.47 30.96 7dfr s TRP 133 CO 0.81 0.50 -0.05 -2.00 0.02 0.00 0.00 176.95 176.23 7dfr s GLU 134 N -2.55 1.82 -0.13 4.98 2.12 0.51 -4.78 118.70 120.67 7dfr s GLU 134 Ca 0.28 -1.37 -0.29 0.00 0.36 0.00 0.00 54.97 53.94 7dfr s GLU 134 Cb -0.11 -2.85 -0.05 0.00 0.26 0.00 0.00 34.13 31.38 7dfr s GLU 134 CO 0.20 -0.69 1.86 0.45 -0.54 0.00 0.00 175.26 176.55 7dfr s SER 135 N 1.15 6.22 -0.14 -1.70 0.15 -1.26 -0.12 113.70 118.00 7dfr s SER 135 Ca -0.02 2.06 0.17 0.00 0.70 0.00 0.00 55.95 58.86 7dfr s SER 135 Cb -0.19 -2.53 0.31 0.00 -1.71 0.00 0.00 66.02 61.90 7dfr s SER 135 CO -0.07 -1.32 1.16 1.33 1.20 0.00 0.00 173.24 175.54 7dfr n VAL 136 N 6.36 1.90 0.00 4.45 0.24 0.82 -4.92 118.33 127.17 7dfr n VAL 136 Ca 0.21 -2.39 0.00 0.00 -2.04 0.00 0.00 64.34 60.13 7dfr n VAL 136 Cb 0.44 -0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.59 7dfr n VAL 136 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 7dfr n PHE 137 N -1.34 0.00 -3.64 6.34 7.35 -1.00 -4.87 117.46 120.29 7dfr n PHE 137 Ca 0.16 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.70 7dfr n PHE 137 Cb 0.65 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.41 7dfr n PHE 137 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 7dfr s SER 138 N 0.00 -0.58 -0.24 -2.13 0.01 -1.26 -0.37 113.70 109.13 7dfr s SER 138 Ca 0.00 0.93 -0.11 0.00 1.31 0.00 0.00 55.95 58.08 7dfr s SER 138 Cb 0.00 0.92 0.09 0.00 0.21 0.00 0.00 66.02 67.24 7dfr s SER 138 CO 0.00 -0.35 0.56 -0.70 0.41 0.00 0.00 173.24 173.16 7dfr s GLU 139 N -0.31 0.53 0.10 12.44 2.12 -0.80 -4.99 118.70 127.79 7dfr s GLU 139 Ca -0.05 1.15 0.03 0.00 0.36 0.00 0.00 54.97 56.47 7dfr s GLU 139 Cb -0.03 0.33 -0.04 0.00 0.26 0.00 0.00 34.13 34.65 7dfr s GLU 139 CO 0.04 -0.19 0.12 0.12 -0.54 0.00 0.00 175.26 174.81 7dfr s PHE 140 N 2.11 3.23 -0.27 5.30 5.36 -1.26 -0.93 117.98 131.51 7dfr s PHE 140 Ca -0.07 0.07 -0.19 0.00 -0.96 0.00 0.00 56.93 55.77 7dfr s PHE 140 Cb -0.09 -1.61 0.07 0.00 -0.34 0.00 0.00 43.02 41.06 7dfr s PHE 140 CO -0.17 0.53 0.69 -1.01 -1.46 0.00 0.00 175.22 173.80 7dfr s HIS 141 N -1.52 -0.93 0.30 10.12 3.76 -0.62 -5.00 115.29 121.39 7dfr s HIS 141 Ca 0.31 2.01 -0.11 0.00 -0.15 0.00 0.00 55.06 57.11 7dfr s HIS 141 Cb -0.12 0.47 -0.08 0.00 1.11 0.00 0.00 32.58 33.97 7dfr s HIS 141 CO 0.23 -0.46 0.66 0.34 -0.85 0.00 0.00 174.74 174.66 7dfr s ASP 142 N 1.10 6.65 1.10 1.40 2.15 -1.26 -0.77 116.67 127.04 7dfr s ASP 142 Ca -0.06 1.08 -0.20 0.00 0.43 0.00 0.00 52.55 53.80 7dfr s ASP 142 Cb -0.05 -2.29 0.06 0.00 -0.30 0.00 0.00 42.92 40.34 7dfr s ASP 142 CO -0.11 -0.19 -0.22 0.00 -0.17 0.00 0.00 175.17 174.48 7dfr n ALA 143 N -0.49 -4.40 -3.00 3.66 0.00 -1.24 -4.68 120.51 110.35 7dfr n ALA 143 Ca 0.02 -1.30 0.00 0.00 0.00 0.00 0.00 53.44 52.15 7dfr n ALA 143 Cb 0.53 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.57 7dfr n ALA 143 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 7dfr n ASP 144 N -0.93 0.00 -0.09 0.00 5.68 0.53 -4.90 116.55 116.83 7dfr n ASP 144 Ca 0.00 -0.82 -0.06 0.00 -0.50 0.00 0.00 54.79 53.41 7dfr n ASP 144 Cb 0.64 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.62 7dfr n ASP 144 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 7dfr h ALA 145 N 2.00 0.23 -0.10 2.12 0.00 -2.01 -3.21 119.26 118.30 7dfr h ALA 145 Ca 0.00 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 7dfr h ALA 145 Cb 0.00 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.03 7dfr h ALA 145 CO 0.00 -0.45 -0.36 1.96 0.00 0.00 0.00 179.25 180.40 7dfr h GLN 146 N 0.01 0.41 -3.52 0.00 1.08 -1.97 -3.42 115.11 107.70 7dfr h GLN 146 Ca 0.16 -0.32 -0.70 0.00 -1.45 0.00 0.00 58.65 56.34 7dfr h GLN 146 Cb 0.24 0.06 -0.35 0.00 -0.05 0.00 0.00 27.48 27.38 7dfr h GLN 146 CO -0.33 0.94 -0.31 -0.80 -0.95 0.00 0.00 178.83 177.38 7dfr s ASN 147 N -6.46 5.38 0.31 1.46 0.01 -1.21 -4.56 114.94 109.86 7dfr s ASN 147 Ca -0.14 -3.01 0.06 0.00 -0.71 0.00 0.00 52.86 49.06 7dfr s ASN 147 Cb 0.05 -1.87 0.33 0.00 0.41 0.00 0.00 41.25 40.16 7dfr s ASN 147 CO 0.79 -0.34 0.99 -0.24 -1.51 0.00 0.00 177.10 176.79 7dfr n SER 148 N 3.28 0.16 -3.99 -1.22 2.88 -1.26 -0.35 113.62 113.12 7dfr n SER 148 Ca 0.10 0.38 -0.08 0.00 -1.33 0.00 0.00 58.87 57.94 7dfr n SER 148 Cb 0.38 -0.24 -0.10 0.00 -0.75 0.00 0.00 64.21 63.50 7dfr n SER 148 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 7dfr s HIS 149 N -3.10 0.32 0.69 0.66 3.76 -1.26 -4.80 115.29 111.56 7dfr s HIS 149 Ca -0.01 -0.71 -0.06 0.00 -0.15 0.00 0.00 55.06 54.14 7dfr s HIS 149 Cb 0.02 -0.23 0.07 0.00 1.11 0.00 0.00 32.58 33.54 7dfr s HIS 149 CO 0.05 -0.34 0.99 -1.54 -0.85 0.00 0.00 174.74 173.05 7dfr s SER 150 N -2.30 4.80 -0.11 1.40 1.04 -1.26 -3.70 113.70 113.56 7dfr s SER 150 Ca -0.03 0.34 -0.31 0.00 0.48 0.00 0.00 55.95 56.44 7dfr s SER 150 Cb 0.01 -0.99 0.12 0.00 0.10 0.00 0.00 66.02 65.26 7dfr s SER 150 CO -0.06 -1.59 1.02 -0.72 0.98 0.00 0.00 173.24 172.88 7dfr s TYR 151 N -3.20 -0.28 -0.12 5.02 1.13 0.05 -0.09 117.35 119.85 7dfr s TYR 151 Ca 0.61 0.28 0.00 0.00 -1.41 0.00 0.00 57.07 56.54 7dfr s TYR 151 Cb -0.10 0.51 0.02 0.00 -1.10 0.00 0.00 41.96 41.29 7dfr s TYR 151 CO 0.44 -0.38 -0.10 0.00 -2.51 0.00 0.00 175.55 173.00 7dfr s PHE 153 N 1.54 3.44 0.10 0.00 0.08 -0.10 0.17 117.98 123.21 7dfr s PHE 153 Ca 0.03 1.70 -0.08 0.00 0.12 0.00 0.00 56.93 58.70 7dfr s PHE 153 Cb -0.13 -3.05 -0.00 0.00 -0.57 0.00 0.00 43.02 39.27 7dfr s PHE 153 CO -0.08 -0.29 0.19 -2.00 -0.10 0.00 0.00 175.22 172.94 7dfr s GLU 154 N -2.31 0.87 -0.04 0.44 2.12 0.26 -1.91 118.70 118.12 7dfr s GLU 154 Ca 0.54 -1.00 -0.02 0.00 0.36 0.00 0.00 54.97 54.86 7dfr s GLU 154 Cb -0.21 0.34 0.03 0.00 0.26 0.00 0.00 34.13 34.56 7dfr s GLU 154 CO 0.26 -0.28 0.08 0.42 -0.54 0.00 0.00 175.26 175.21 7dfr s ILE 155 N -3.88 -0.10 -0.02 -3.70 1.01 0.50 -1.09 121.20 113.93 7dfr s ILE 155 Ca 0.07 0.28 0.07 0.00 0.00 0.00 0.00 60.65 61.06 7dfr s ILE 155 Cb 0.05 -0.16 -0.02 0.00 0.01 0.00 0.00 42.46 42.34 7dfr s ILE 155 CO -0.10 0.11 -0.24 -0.76 0.00 0.00 0.00 174.94 173.96 7dfr s LEU 156 N 1.51 2.04 -0.18 2.97 1.02 -1.07 0.29 118.68 125.26 7dfr s LEU 156 Ca -0.04 -0.43 -0.01 0.00 0.02 0.00 0.00 54.13 53.67 7dfr s LEU 156 Cb -0.12 -1.23 0.00 0.00 0.02 0.00 0.00 46.19 44.86 7dfr s LEU 156 CO -0.04 0.28 -0.13 -1.61 0.02 0.00 0.00 176.35 174.87 7dfr s GLU 157 N -0.51 3.21 -0.26 1.70 2.02 0.83 -0.69 118.70 125.01 7dfr s GLU 157 Ca 0.08 -0.73 -0.35 0.00 0.02 0.00 0.00 54.97 53.98 7dfr s GLU 157 Cb -0.10 -2.72 -0.11 0.00 0.10 0.00 0.00 34.13 31.30 7dfr s GLU 157 CO -0.00 -0.10 2.05 -2.13 0.02 0.00 0.00 175.26 175.10 7dfr n ARG 158 N 4.40 1.48 0.00 1.61 3.00 -0.79 -0.37 116.66 126.00 7dfr n ARG 158 Ca -0.19 0.47 0.09 0.00 -0.00 0.00 0.00 57.85 58.22 7dfr n ARG 158 Cb 0.51 -2.55 0.54 0.00 0.00 0.00 0.00 32.46 30.96 7dfr n ARG 158 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50