#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fbr n PRO 11 N 0.00 0.68 -3.61 0.00 -0.04 -1.26 -4.70 135.00 126.07 2fbr n PRO 11 Ca 0.00 -0.23 -0.19 0.00 -0.04 0.00 0.00 63.50 63.04 2fbr n PRO 11 Cb 0.00 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.81 2fbr n PRO 11 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2fbr s LEU 12 N -2.48 0.00 0.07 1.53 2.96 -1.26 -0.77 118.68 118.74 2fbr s LEU 12 Ca 0.29 -0.01 0.05 0.00 -0.22 0.00 0.00 54.13 54.24 2fbr s LEU 12 Cb 0.20 0.19 -0.03 0.00 0.50 0.00 0.00 46.19 47.05 2fbr s LEU 12 CO 0.48 -0.29 -0.14 -0.32 -1.32 0.00 0.00 176.35 174.76 2fbr s MET 13 N 2.27 0.82 -0.05 1.98 -2.45 -0.35 -4.38 119.30 117.14 2fbr s MET 13 Ca 0.04 -0.94 0.03 0.00 -1.25 0.00 0.00 55.69 53.58 2fbr s MET 13 Cb -0.14 -0.83 0.00 0.00 1.25 0.00 0.00 34.83 35.11 2fbr s MET 13 CO -0.08 0.19 -0.14 0.08 1.05 0.00 0.00 175.02 176.11 2fbr s VAL 14 N -1.24 1.23 -0.04 10.11 1.01 -1.01 -0.75 120.40 129.71 2fbr s VAL 14 Ca -0.02 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.41 2fbr s VAL 14 Cb -0.10 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.21 2fbr s VAL 14 CO 0.02 0.37 -0.10 -1.59 0.00 0.00 0.00 175.10 173.79 2fbr s LYS 15 N 0.26 1.21 -0.02 2.72 -2.85 -0.29 -0.20 119.74 120.57 2fbr s LYS 15 Ca -0.07 -0.35 0.02 0.00 -1.00 0.00 0.00 55.97 54.56 2fbr s LYS 15 Cb -0.12 -1.09 0.01 0.00 -2.06 0.00 0.00 37.83 34.57 2fbr s LYS 15 CO 0.02 0.10 -0.06 0.08 0.10 0.00 0.00 175.35 175.59 2fbr s VAL 16 N 0.33 0.60 0.09 1.79 1.01 -0.21 -0.79 120.40 123.22 2fbr s VAL 16 Ca -0.06 -0.24 0.09 0.00 0.00 0.00 0.00 61.98 61.76 2fbr s VAL 16 Cb -0.11 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 2fbr s VAL 16 CO 0.01 0.20 -0.20 -0.76 0.00 0.00 0.00 175.10 174.35 2fbr s LEU 17 N 0.33 2.57 -0.28 3.92 1.43 -0.13 -1.19 118.68 125.33 2fbr s LEU 17 Ca -0.04 -0.55 -0.09 0.00 -1.03 0.00 0.00 54.13 52.42 2fbr s LEU 17 Cb -0.09 -1.46 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 2fbr s LEU 17 CO 0.00 0.21 0.12 -0.62 0.23 0.00 0.00 176.35 176.29 2fbr s ASP 18 N -1.85 5.39 0.01 2.29 -1.08 0.39 -1.09 116.67 120.73 2fbr s ASP 18 Ca 0.16 -0.36 0.28 0.00 -0.52 0.00 0.00 52.55 52.10 2fbr s ASP 18 Cb -0.10 -1.97 0.97 0.00 -1.46 0.00 0.00 42.92 40.35 2fbr s ASP 18 CO 0.07 -0.12 1.75 0.00 0.52 0.00 0.00 175.17 177.39 2fbr n ALA 19 N 4.96 2.73 -0.00 3.66 0.00 -0.26 -1.59 120.51 130.01 2fbr n ALA 19 Ca -0.15 -0.18 -0.21 0.00 0.00 0.00 0.00 53.44 52.90 2fbr n ALA 19 Cb 0.50 -1.35 -0.14 0.00 0.00 0.00 0.00 19.45 18.46 2fbr n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2fbr h VAL 20 N 0.00 1.04 0.00 0.00 2.07 -1.95 -3.38 116.25 114.03 2fbr h VAL 20 Ca 0.00 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.13 2fbr h VAL 20 Cb 0.51 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.99 2fbr h VAL 20 CO 0.00 0.68 -1.10 0.54 0.02 0.00 0.00 177.57 177.71 2fbr n ARG 21 N -3.96 0.45 -3.08 1.57 1.74 -1.24 -4.99 116.66 107.15 2fbr n ARG 21 Ca -0.25 0.03 -0.13 0.00 -0.77 0.00 0.00 57.85 56.72 2fbr n ARG 21 Cb 0.88 -1.68 0.07 0.00 -1.02 0.00 0.00 32.46 30.71 2fbr n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fbr n GLY 22 N 1.28 -0.40 3.31 -0.13 0.00 -0.62 -5.03 105.19 103.60 2fbr n GLY 22 Ca 0.01 0.14 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 2fbr n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fbr s SER 23 N -3.84 -0.01 0.54 1.61 1.04 -1.12 -5.02 113.70 106.89 2fbr s SER 23 Ca 0.12 -0.65 -0.21 0.00 0.48 0.00 0.00 55.95 55.69 2fbr s SER 23 Cb -0.02 0.42 -0.06 0.00 0.10 0.00 0.00 66.02 66.47 2fbr s SER 23 CO 0.59 -0.85 1.14 -0.81 0.98 0.00 0.00 173.24 174.30 2fbr n PRO 24 N -0.18 1.33 -2.87 4.02 -0.04 -1.26 -0.46 135.00 135.54 2fbr n PRO 24 Ca -0.12 0.49 -0.43 0.00 -0.04 0.00 0.00 63.50 63.41 2fbr n PRO 24 Cb 0.63 -2.32 -0.04 0.00 -0.04 0.00 0.00 33.50 31.73 2fbr n PRO 24 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fbr s ALA 25 N -1.37 3.15 0.18 0.55 0.00 -0.33 -4.50 121.76 119.44 2fbr s ALA 25 Ca 0.71 -1.51 -0.10 0.00 0.00 0.00 0.00 51.96 51.06 2fbr s ALA 25 Cb -0.44 -3.76 -0.07 0.00 0.00 0.00 0.00 23.12 18.85 2fbr s ALA 25 CO 0.50 -2.52 0.51 0.96 0.00 0.00 0.00 175.76 175.21 2fbr s ILE 26 N 3.92 4.95 -1.47 0.00 -4.36 -1.26 -4.33 121.20 118.65 2fbr s ILE 26 Ca 0.26 0.52 -0.03 0.00 -0.26 0.00 0.00 60.65 61.15 2fbr s ILE 26 Cb -0.15 -3.65 0.00 0.00 1.25 0.00 0.00 42.46 39.92 2fbr s ILE 26 CO 0.15 0.06 0.34 0.59 0.24 0.00 0.00 174.94 176.32 2fbr n ASN 27 N 0.26 -5.55 -4.65 4.36 5.03 -0.43 -4.94 115.26 109.33 2fbr n ASN 27 Ca -0.02 -0.17 -0.42 0.00 0.87 0.00 0.00 54.58 54.84 2fbr n ASN 27 Cb 0.52 -4.46 -0.04 0.00 -1.02 0.00 0.00 39.78 34.78 2fbr n ASN 27 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2fbr s VAL 28 N -3.04 4.80 0.33 2.41 1.01 -1.26 -4.77 120.40 119.87 2fbr s VAL 28 Ca 0.17 1.70 -0.27 0.00 0.00 0.00 0.00 61.98 63.57 2fbr s VAL 28 Cb -0.07 -4.17 -0.09 0.00 0.00 0.00 0.00 36.38 32.04 2fbr s VAL 28 CO 0.21 -0.10 1.11 0.00 0.00 0.00 0.00 175.10 176.32 2fbr s ALA 29 N 2.90 3.29 -0.06 5.51 0.00 -1.26 -1.29 121.76 130.85 2fbr s ALA 29 Ca 0.38 0.88 0.01 0.00 0.00 0.00 0.00 51.96 53.22 2fbr s ALA 29 Cb -0.15 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.66 2fbr s ALA 29 CO 0.07 -0.25 -0.05 0.08 0.00 0.00 0.00 175.76 175.61 2fbr s VAL 30 N -1.32 0.64 -0.09 0.00 1.01 -0.02 -0.57 120.40 120.05 2fbr s VAL 30 Ca 0.50 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.37 2fbr s VAL 30 Cb -0.30 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.41 2fbr s VAL 30 CO 0.38 0.26 -0.23 -1.00 0.00 0.00 0.00 175.10 174.51 2fbr s HIS 31 N 1.11 2.54 -0.09 5.22 3.76 0.01 -1.69 115.29 126.14 2fbr s HIS 31 Ca -0.08 -0.88 -0.00 0.00 -0.15 0.00 0.00 55.06 53.95 2fbr s HIS 31 Cb -0.14 -1.68 -0.03 0.00 1.11 0.00 0.00 32.58 31.84 2fbr s HIS 31 CO -0.01 -0.32 -0.06 0.08 -0.85 0.00 0.00 174.74 173.58 2fbr s VAL 32 N 0.14 3.74 0.15 -0.90 1.01 0.12 -0.51 120.40 124.15 2fbr s VAL 32 Ca -0.12 -0.45 0.09 0.00 0.00 0.00 0.00 61.98 61.49 2fbr s VAL 32 Cb -0.16 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 2fbr s VAL 32 CO 0.07 0.57 -0.19 -0.36 0.00 0.00 0.00 175.10 175.18 2fbr s PHE 33 N -0.47 1.86 -0.06 5.22 0.40 0.64 -0.54 117.98 125.02 2fbr s PHE 33 Ca 0.07 -0.45 0.03 0.00 -0.60 0.00 0.00 56.93 55.98 2fbr s PHE 33 Cb -0.12 -0.95 0.01 0.00 0.51 0.00 0.00 43.02 42.47 2fbr s PHE 33 CO 0.02 0.31 -0.14 0.50 0.70 0.00 0.00 175.22 176.61 2fbr s ARG 34 N -2.56 1.79 -0.01 0.44 3.52 -0.34 -0.80 118.95 121.00 2fbr s ARG 34 Ca 0.14 -0.50 -0.30 0.00 -0.13 0.00 0.00 55.73 54.94 2fbr s ARG 34 Cb -0.07 -1.49 -0.07 0.00 -1.56 0.00 0.00 34.95 31.76 2fbr s ARG 34 CO 0.06 0.10 1.66 0.21 -0.81 0.00 0.00 175.30 176.52 2fbr s LYS 35 N 0.44 4.19 0.80 5.12 2.20 0.02 -1.57 119.74 130.94 2fbr s LYS 35 Ca -0.11 2.24 -0.09 0.00 -0.36 0.00 0.00 55.97 57.65 2fbr s LYS 35 Cb -0.14 -3.85 0.12 0.00 -1.51 0.00 0.00 37.83 32.45 2fbr s LYS 35 CO 0.04 -0.80 1.13 0.00 -0.36 0.00 0.00 175.35 175.35 2fbr s ALA 36 N 3.53 2.92 0.45 3.13 0.00 -0.41 -4.71 121.76 126.66 2fbr s ALA 36 Ca 0.74 -1.16 0.10 0.00 0.00 0.00 0.00 51.96 51.64 2fbr s ALA 36 Cb -0.36 -2.56 1.01 0.00 0.00 0.00 0.00 23.12 21.21 2fbr s ALA 36 CO 0.31 -1.74 2.09 0.00 0.00 0.00 0.00 175.76 176.42 2fbr h ALA 37 N -0.97 1.81 -0.07 0.00 0.00 -1.94 -0.32 119.26 117.77 2fbr h ALA 37 Ca -0.43 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2fbr h ALA 37 Cb 1.28 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2fbr h ALA 37 CO 0.49 0.17 0.00 -0.40 0.00 0.00 0.00 179.25 179.51 2fbr n ASP 38 N -4.50 0.49 -0.26 0.00 5.75 -1.26 -4.91 116.55 111.85 2fbr n ASP 38 Ca 0.01 -1.76 -0.03 0.00 -0.01 0.00 0.00 54.79 53.00 2fbr n ASP 38 Cb 0.07 -0.05 -0.01 0.00 -1.03 0.00 0.00 41.12 40.10 2fbr n ASP 38 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2fbr n ASP 39 N -0.35 -4.05 -4.93 -1.12 2.03 -0.13 -5.05 116.55 102.96 2fbr n ASP 39 Ca 0.09 0.08 -0.25 0.00 0.52 0.00 0.00 54.79 55.23 2fbr n ASP 39 Cb 0.11 -1.85 -0.01 0.00 -0.72 0.00 0.00 41.12 38.65 2fbr n ASP 39 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2fbr s THR 40 N -1.91 5.05 -0.49 5.18 -4.23 -1.26 -4.85 115.64 113.13 2fbr s THR 40 Ca 0.00 -0.24 -0.25 0.00 -1.18 0.00 0.00 61.69 60.02 2fbr s THR 40 Cb 0.00 -3.84 0.03 0.00 1.34 0.00 0.00 72.50 70.03 2fbr s THR 40 CO 0.00 -0.57 0.95 0.26 -0.54 0.00 0.00 174.62 174.72 2fbr s TRP 41 N -2.35 2.86 -0.02 3.99 0.52 -1.26 -1.29 118.94 121.39 2fbr s TRP 41 Ca 0.42 0.29 -0.19 0.00 0.02 0.00 0.00 56.10 56.64 2fbr s TRP 41 Cb -0.10 -4.05 -0.05 0.00 -1.15 0.00 0.00 33.47 28.12 2fbr s TRP 41 CO 0.37 -1.20 0.55 -2.00 0.02 0.00 0.00 176.95 174.68 2fbr s GLU 42 N 3.91 4.27 0.26 4.98 2.12 -0.61 -4.87 118.70 128.75 2fbr s GLU 42 Ca 0.36 0.64 -0.31 0.00 0.36 0.00 0.00 54.97 56.02 2fbr s GLU 42 Cb -0.10 -3.34 -0.12 0.00 0.26 0.00 0.00 34.13 30.83 2fbr s GLU 42 CO 0.25 0.38 1.65 -2.14 -0.54 0.00 0.00 175.26 174.85 2fbr s PRO 43 N -0.18 4.12 -0.06 4.30 0.02 -1.26 -1.20 135.00 140.75 2fbr s PRO 43 Ca 0.29 2.59 -0.02 0.00 0.02 0.00 0.00 61.00 63.88 2fbr s PRO 43 Cb -0.17 -3.05 -0.03 0.00 0.02 0.00 0.00 34.50 31.27 2fbr s PRO 43 CO 0.15 -0.68 -0.06 0.34 -0.33 0.00 0.00 177.00 176.42 2fbr n PHE 44 N 2.93 0.00 -3.51 6.54 7.35 0.30 -4.81 117.46 126.26 2fbr n PHE 44 Ca 0.11 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.71 2fbr n PHE 44 Cb 0.36 -0.21 -0.03 0.00 0.35 0.00 0.00 39.48 39.96 2fbr n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2fbr s ALA 45 N -2.11 -1.82 0.14 3.13 0.00 -1.01 -5.01 121.76 115.08 2fbr s ALA 45 Ca -0.08 1.08 -0.13 0.00 0.00 0.00 0.00 51.96 52.84 2fbr s ALA 45 Cb 0.03 0.25 0.02 0.00 0.00 0.00 0.00 23.12 23.41 2fbr s ALA 45 CO 0.11 -0.62 0.36 -1.54 0.00 0.00 0.00 175.76 174.07 2fbr s SER 46 N -2.21 -0.10 -0.01 0.00 1.04 -1.26 0.10 113.70 111.26 2fbr s SER 46 Ca 0.03 -0.54 -0.09 0.00 0.48 0.00 0.00 55.95 55.83 2fbr s SER 46 Cb -0.01 0.46 0.03 0.00 0.10 0.00 0.00 66.02 66.60 2fbr s SER 46 CO -0.07 -0.88 0.40 0.61 0.98 0.00 0.00 173.24 174.29 2fbr n GLY 47 N -0.21 0.51 3.03 7.32 0.00 -0.68 -4.93 105.19 110.22 2fbr n GLY 47 Ca -0.13 -0.90 -0.11 0.00 0.00 0.00 0.00 46.02 44.88 2fbr n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fbr s LYS 48 N -2.00 0.43 0.52 1.61 -2.85 -1.26 -0.84 119.74 115.35 2fbr s LYS 48 Ca 0.10 -0.71 -0.21 0.00 -1.00 0.00 0.00 55.97 54.14 2fbr s LYS 48 Cb -0.00 -0.09 -0.06 0.00 -2.06 0.00 0.00 37.83 35.62 2fbr s LYS 48 CO -0.00 -0.00 1.20 0.95 0.10 0.00 0.00 175.35 177.60 2fbr s THR 49 N -1.54 2.82 0.43 3.79 -4.23 -0.41 -4.70 115.64 111.81 2fbr s THR 49 Ca -0.12 0.57 -0.06 0.00 -1.18 0.00 0.00 61.69 60.91 2fbr s THR 49 Cb -0.09 -3.27 0.10 0.00 1.34 0.00 0.00 72.50 70.58 2fbr s THR 49 CO -0.01 -0.05 0.59 -1.54 -0.54 0.00 0.00 174.62 173.07 2fbr n SER 50 N -0.99 0.22 0.29 3.99 3.41 -0.16 -1.31 113.62 119.07 2fbr n SER 50 Ca 0.10 -1.32 0.15 0.00 -0.26 0.00 0.00 58.87 57.54 2fbr n SER 50 Cb 0.48 -0.44 0.89 0.00 -0.26 0.00 0.00 64.21 64.89 2fbr n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2fbr h GLU 51 N 0.00 0.00 -0.01 4.33 4.39 -1.94 -0.41 114.58 120.94 2fbr h GLU 51 Ca -0.19 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.51 2fbr h GLU 51 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 2fbr h GLU 51 CO 0.15 0.02 0.00 -1.13 -1.16 0.00 0.00 179.01 176.89 2fbr n SER 52 N -3.81 0.69 0.00 1.42 3.41 -1.26 -4.80 113.62 109.27 2fbr n SER 52 Ca -0.03 -1.25 0.00 0.00 -0.26 0.00 0.00 58.87 57.34 2fbr n SER 52 Cb 0.11 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2fbr n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fbr n GLY 53 N 1.07 0.41 3.80 5.00 0.00 -0.16 -4.78 105.19 110.54 2fbr n GLY 53 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 2fbr n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fbr s GLU 54 N -0.48 2.99 -0.22 1.61 2.02 -1.26 -1.04 118.70 122.32 2fbr s GLU 54 Ca 0.00 -0.64 0.00 0.00 0.02 0.00 0.00 54.97 54.35 2fbr s GLU 54 Cb 0.00 -2.79 0.06 0.00 0.10 0.00 0.00 34.13 31.50 2fbr s GLU 54 CO 0.00 0.57 -0.05 -1.17 0.02 0.00 0.00 175.26 174.63 2fbr s LEU 55 N -2.42 2.33 0.26 1.80 2.96 0.72 -0.99 118.68 123.34 2fbr s LEU 55 Ca 0.30 -1.07 0.09 0.00 -0.22 0.00 0.00 54.13 53.24 2fbr s LEU 55 Cb -0.12 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.42 2fbr s LEU 55 CO 0.23 -0.23 -0.01 -1.00 -1.32 0.00 0.00 176.35 174.03 2fbr s HIS 56 N 1.46 2.71 0.00 5.38 3.76 -1.26 -2.41 115.29 124.92 2fbr s HIS 56 Ca -0.04 -0.22 0.00 0.00 -0.15 0.00 0.00 55.06 54.65 2fbr s HIS 56 Cb -0.18 -1.21 0.00 0.00 1.11 0.00 0.00 32.58 32.30 2fbr s HIS 56 CO -0.07 0.61 0.00 0.41 -0.85 0.00 0.00 174.74 174.84 2fbr n GLY 57 N -0.81 0.49 0.34 -2.22 0.00 -1.26 -4.94 105.19 96.79 2fbr n GLY 57 Ca -0.07 -0.56 -0.05 0.00 0.00 0.00 0.00 46.02 45.35 2fbr n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fbr h LEU 58 N 0.00 1.03 0.00 0.99 3.38 -1.87 -3.47 115.31 115.37 2fbr h LEU 58 Ca 0.00 -0.16 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 2fbr h LEU 58 Cb 0.00 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2fbr h LEU 58 CO 0.00 0.91 0.06 1.07 0.09 0.00 0.00 178.44 180.57 2fbr n THR 59 N -4.28 0.00 -4.46 0.22 5.66 -1.26 -4.73 114.28 105.42 2fbr n THR 59 Ca 0.07 -1.29 -0.23 0.00 -3.05 0.00 0.00 64.05 59.55 2fbr n THR 59 Cb 0.18 0.97 -0.10 0.00 -1.55 0.00 0.00 70.33 69.83 2fbr n THR 59 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2fbr s THR 60 N -2.48 2.19 0.25 1.09 -4.23 -1.26 -4.63 115.64 106.56 2fbr s THR 60 Ca 0.21 -2.29 -0.04 0.00 -1.18 0.00 0.00 61.69 58.39 2fbr s THR 60 Cb -0.03 -2.36 0.21 0.00 1.34 0.00 0.00 72.50 71.66 2fbr s THR 60 CO 0.15 -0.37 1.80 -0.33 -0.54 0.00 0.00 174.62 175.33 2fbr h GLU 61 N 2.26 0.71 -0.56 3.99 5.08 -1.99 -0.18 114.58 123.89 2fbr h GLU 61 Ca -0.40 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 57.81 2fbr h GLU 61 Cb 1.25 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 2fbr h GLU 61 CO 0.64 0.47 -0.05 0.93 -1.00 0.00 0.00 179.01 180.00 2fbr h GLU 62 N 0.73 1.02 0.00 2.33 5.08 -2.04 -3.16 114.58 118.55 2fbr h GLU 62 Ca 0.40 -0.35 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 2fbr h GLU 62 Cb 0.42 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2fbr h GLU 62 CO -0.27 1.04 -0.59 0.93 -1.00 0.00 0.00 179.01 179.11 2fbr h GLU 63 N 0.90 0.00 -4.33 2.33 5.08 -1.86 -3.39 114.58 113.32 2fbr h GLU 63 Ca 0.15 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.79 2fbr h GLU 63 Cb 0.61 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.74 2fbr h GLU 63 CO 0.04 0.34 2.21 0.34 -1.00 0.00 0.00 179.01 180.95 2fbr n PHE 64 N -3.11 3.85 -2.05 4.33 7.35 -0.12 -4.94 117.46 122.76 2fbr n PHE 64 Ca 0.00 -2.97 -0.28 0.00 -0.76 0.00 0.00 57.45 53.44 2fbr n PHE 64 Cb 0.70 -2.29 0.15 0.00 0.35 0.00 0.00 39.48 38.39 2fbr n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 2fbr s VAL 65 N 2.08 2.05 0.44 -2.13 -7.23 -1.26 -4.92 120.40 109.42 2fbr s VAL 65 Ca 0.45 -0.12 -0.24 0.00 -1.81 0.00 0.00 61.98 60.27 2fbr s VAL 65 Cb 0.07 -2.93 -0.10 0.00 0.56 0.00 0.00 36.38 33.98 2fbr s VAL 65 CO -0.01 0.00 1.04 1.21 -0.31 0.00 0.00 175.10 177.03 2fbr n GLU 66 N -3.47 1.37 0.00 4.82 0.00 -1.26 -4.79 120.64 117.30 2fbr n GLU 66 Ca 0.13 0.49 0.00 0.00 0.00 0.00 0.00 57.16 57.79 2fbr n GLU 66 Cb 0.60 -2.10 0.00 0.00 0.00 0.00 0.00 31.44 29.94 2fbr n GLU 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2fbr n GLY 67 N 1.15 -0.57 3.63 8.31 0.00 -1.09 -5.00 105.19 111.62 2fbr n GLY 67 Ca 0.09 -1.15 -0.37 0.00 0.00 0.00 0.00 46.02 44.59 2fbr n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fbr s ILE 68 N -2.00 5.31 0.04 -0.61 1.01 -1.26 -0.76 121.20 122.93 2fbr s ILE 68 Ca 0.00 0.27 0.05 0.00 0.00 0.00 0.00 60.65 60.97 2fbr s ILE 68 Cb 0.00 -3.55 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 2fbr s ILE 68 CO 0.00 0.28 -0.10 -0.31 0.00 0.00 0.00 174.94 174.81 2fbr s TYR 69 N 1.43 2.76 -0.19 3.97 1.51 -0.05 -0.80 117.35 125.98 2fbr s TYR 69 Ca 0.09 -0.13 -0.01 0.00 -1.01 0.00 0.00 57.07 56.02 2fbr s TYR 69 Cb -0.15 -1.52 0.01 0.00 -0.11 0.00 0.00 41.96 40.19 2fbr s TYR 69 CO 0.08 0.35 -0.15 0.21 -1.11 0.00 0.00 175.55 174.93 2fbr s LYS 70 N -1.63 3.13 -0.36 -0.62 2.20 0.02 -1.27 119.74 121.21 2fbr s LYS 70 Ca 0.18 -0.76 -0.12 0.00 -0.36 0.00 0.00 55.97 54.91 2fbr s LYS 70 Cb -0.11 -2.72 0.01 0.00 -1.51 0.00 0.00 37.83 33.50 2fbr s LYS 70 CO 0.09 -0.19 0.22 0.08 -0.36 0.00 0.00 175.35 175.18 2fbr s VAL 71 N 1.33 4.83 -0.27 4.02 1.01 0.71 -0.26 120.40 131.76 2fbr s VAL 71 Ca 0.05 -0.63 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 2fbr s VAL 71 Cb -0.14 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 2fbr s VAL 71 CO -0.09 -0.15 0.18 -0.70 0.00 0.00 0.00 175.10 174.33 2fbr s GLU 72 N 1.62 3.96 -0.23 2.72 2.12 0.34 -0.26 118.70 128.96 2fbr s GLU 72 Ca 0.04 -0.32 -0.07 0.00 0.36 0.00 0.00 54.97 54.98 2fbr s GLU 72 Cb -0.18 -3.62 -0.03 0.00 0.26 0.00 0.00 34.13 30.56 2fbr s GLU 72 CO 0.08 -0.13 0.06 0.42 -0.54 0.00 0.00 175.26 175.15 2fbr s ILE 73 N 1.61 4.37 -1.29 -3.70 1.01 0.10 -0.81 121.20 122.49 2fbr s ILE 73 Ca 0.07 -0.16 -0.12 0.00 0.00 0.00 0.00 60.65 60.45 2fbr s ILE 73 Cb -0.15 -3.03 0.14 0.00 0.01 0.00 0.00 42.46 39.43 2fbr s ILE 73 CO 0.09 0.36 1.81 0.47 0.00 0.00 0.00 174.94 177.68 2fbr n ASP 74 N 4.64 4.92 0.04 3.58 10.43 0.27 -1.23 116.55 139.21 2fbr n ASP 74 Ca -0.16 -3.02 -0.06 0.00 2.57 0.00 0.00 54.79 54.11 2fbr n ASP 74 Cb 0.52 -1.55 0.12 0.00 1.84 0.00 0.00 41.12 42.04 2fbr n ASP 74 CO 0.00 0.00 0.00 0.71 -1.07 0.00 0.00 177.20 176.84 2fbr h THR 75 N 4.15 1.33 -0.40 -3.53 1.35 -1.86 -2.07 112.91 111.89 2fbr h THR 75 Ca 0.41 -1.75 -0.04 0.00 -0.55 0.00 0.00 66.41 64.49 2fbr h THR 75 Cb 0.71 1.77 -0.02 0.00 -1.73 0.00 0.00 68.15 68.89 2fbr h THR 75 CO 1.56 0.53 0.11 0.50 -0.25 0.00 0.00 175.52 177.97 2fbr h LYS 76 N 0.32 0.63 -0.62 4.72 3.64 -1.69 -1.45 116.57 122.12 2fbr h LYS 76 Ca 0.01 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.21 2fbr h LYS 76 Cb 1.00 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.70 2fbr h LYS 76 CO 0.09 0.64 0.24 0.77 -2.27 0.00 0.00 179.45 178.92 2fbr h SER 77 N 0.50 0.83 0.48 4.20 0.02 -1.77 0.45 113.55 118.26 2fbr h SER 77 Ca 0.13 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 2fbr h SER 77 Cb 0.29 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.62 2fbr h SER 77 CO -0.00 0.75 -0.23 0.22 -1.14 0.00 0.00 176.83 176.43 2fbr h TYR 78 N 0.89 -0.60 -0.68 3.45 3.20 -1.05 -0.55 116.97 121.64 2fbr h TYR 78 Ca 0.21 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 2fbr h TYR 78 Cb 0.19 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.63 2fbr h TYR 78 CO 0.01 -0.34 0.29 -1.49 -1.64 0.00 0.00 178.16 175.00 2fbr h TRP 79 N -0.71 0.98 -0.04 -3.82 4.06 -1.09 -2.86 115.95 112.48 2fbr h TRP 79 Ca -0.07 -0.05 -0.13 0.00 2.06 0.00 0.00 58.89 60.71 2fbr h TRP 79 Cb 0.53 -0.30 -0.01 0.00 -1.00 0.00 0.00 29.16 28.37 2fbr h TRP 79 CO -0.03 0.74 -0.56 0.87 -3.56 0.00 0.00 178.44 175.90 2fbr h LYS 80 N 0.97 0.11 0.00 0.49 1.57 -0.81 0.44 116.57 119.34 2fbr h LYS 80 Ca 0.23 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 2fbr h LYS 80 Cb 0.15 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 2fbr h LYS 80 CO -0.02 0.64 -0.12 0.00 -0.57 0.00 0.00 179.45 179.38 2fbr h ALA 81 N 1.35 1.07 -0.10 3.86 0.00 -0.89 0.01 119.26 124.55 2fbr h ALA 81 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2fbr h ALA 81 Cb 1.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2fbr h ALA 81 CO 0.08 0.15 0.00 1.28 0.00 0.00 0.00 179.25 180.75 2fbr n LEU 82 N -3.33 1.84 -0.93 0.00 4.77 -0.65 -4.93 117.00 113.77 2fbr n LEU 82 Ca -0.00 -0.69 -0.09 0.00 -0.03 0.00 0.00 56.01 55.20 2fbr n LEU 82 Cb 0.33 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.35 2fbr n LEU 82 CO 0.30 0.35 -0.11 0.61 -1.33 0.00 0.00 177.39 177.21 2fbr n GLY 83 N 1.20 0.15 3.48 -0.72 0.00 -0.01 -5.04 105.19 104.26 2fbr n GLY 83 Ca 0.17 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 2fbr n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fbr s ILE 84 N -2.41 3.08 -0.54 -0.61 -1.09 0.05 -4.98 121.20 114.69 2fbr s ILE 84 Ca 0.00 -0.80 -0.21 0.00 -2.23 0.00 0.00 60.65 57.41 2fbr s ILE 84 Cb 0.00 -2.23 0.06 0.00 -1.58 0.00 0.00 42.46 38.71 2fbr s ILE 84 CO 0.00 0.53 0.75 -0.55 -1.23 0.00 0.00 174.94 174.45 2fbr s SER 85 N -0.90 6.24 0.60 3.58 0.15 -1.26 -3.26 113.70 118.85 2fbr s SER 85 Ca 0.12 -0.84 0.06 0.00 0.70 0.00 0.00 55.95 55.99 2fbr s SER 85 Cb -0.11 -2.34 0.09 0.00 -1.71 0.00 0.00 66.02 61.95 2fbr s SER 85 CO 0.02 -1.06 0.83 -2.16 1.20 0.00 0.00 173.24 172.06 2fbr s PRO 86 N 3.13 2.19 -0.15 5.44 0.04 -1.26 -4.99 135.00 139.39 2fbr s PRO 86 Ca 0.19 -1.39 -0.26 0.00 0.04 0.00 0.00 61.00 59.58 2fbr s PRO 86 Cb -0.18 -2.56 -0.24 0.00 0.04 0.00 0.00 34.50 31.56 2fbr s PRO 86 CO 0.13 -0.96 0.62 0.35 0.04 0.00 0.00 177.00 177.17 2fbr h PHE 87 N 0.01 0.04 -3.45 0.56 3.04 -1.65 -3.48 116.94 112.01 2fbr h PHE 87 Ca -0.34 -0.03 -0.52 0.00 3.98 0.00 0.00 57.97 61.07 2fbr h PHE 87 Cb 1.28 -0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.77 2fbr h PHE 87 CO 0.23 1.16 -0.06 -1.01 -2.02 0.00 0.00 178.31 176.62 2fbr s HIS 88 N -2.28 3.44 0.06 0.41 3.76 -1.26 -4.99 115.29 114.42 2fbr s HIS 88 Ca -0.22 0.88 -0.16 0.00 -0.15 0.00 0.00 55.06 55.42 2fbr s HIS 88 Cb -0.00 -2.28 -0.21 0.00 1.11 0.00 0.00 32.58 31.20 2fbr s HIS 88 CO 0.67 0.17 1.20 0.93 -0.85 0.00 0.00 174.74 176.86 2fbr h GLU 89 N 2.11 0.62 -2.30 1.40 4.39 -1.98 -3.36 114.58 115.46 2fbr h GLU 89 Ca -0.47 -0.59 0.19 0.00 0.34 0.00 0.00 59.36 58.83 2fbr h GLU 89 Cb 1.18 0.15 -0.08 0.00 -0.10 0.00 0.00 28.75 29.90 2fbr h GLU 89 CO 0.67 1.20 0.52 -3.38 -1.16 0.00 0.00 179.01 176.87 2fbr s HIS 90 N -3.47 -0.09 -0.15 4.33 -3.43 -1.26 -3.03 115.29 108.19 2fbr s HIS 90 Ca -0.11 -0.22 -0.05 0.00 -0.80 0.00 0.00 55.06 53.88 2fbr s HIS 90 Cb 0.06 0.64 -0.04 0.00 -1.43 0.00 0.00 32.58 31.82 2fbr s HIS 90 CO 0.87 -0.81 0.03 0.00 -2.00 0.00 0.00 174.74 172.84 2fbr s ALA 91 N -3.05 3.32 -0.20 -1.38 0.00 -0.36 -4.89 121.76 115.19 2fbr s ALA 91 Ca 0.14 -0.77 -0.02 0.00 0.00 0.00 0.00 51.96 51.31 2fbr s ALA 91 Cb -0.01 -1.72 0.00 0.00 0.00 0.00 0.00 23.12 21.39 2fbr s ALA 91 CO 0.02 0.33 -0.11 -1.21 0.00 0.00 0.00 175.76 174.79 2fbr s GLU 92 N -0.07 3.23 -0.28 0.00 2.02 -1.26 -0.72 118.70 121.62 2fbr s GLU 92 Ca 0.05 -0.71 -0.01 0.00 0.02 0.00 0.00 54.97 54.32 2fbr s GLU 92 Cb -0.12 -2.80 0.04 0.00 0.10 0.00 0.00 34.13 31.34 2fbr s GLU 92 CO 0.02 -0.16 -0.03 0.08 0.02 0.00 0.00 175.26 175.18 2fbr s VAL 93 N 1.29 2.89 -0.15 2.63 1.01 0.64 -4.94 120.40 123.78 2fbr s VAL 93 Ca 0.04 -1.27 0.01 0.00 0.00 0.00 0.00 61.98 60.75 2fbr s VAL 93 Cb -0.14 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 33.65 2fbr s VAL 93 CO -0.06 0.01 -0.17 -0.69 0.00 0.00 0.00 175.10 174.19 2fbr s VAL 94 N 1.27 2.53 -0.05 2.92 1.01 -1.26 -0.21 120.40 126.61 2fbr s VAL 94 Ca -0.04 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 60.89 2fbr s VAL 94 Cb -0.19 -2.05 0.05 0.00 0.00 0.00 0.00 36.38 34.19 2fbr s VAL 94 CO -0.03 0.52 0.52 0.72 0.00 0.00 0.00 175.10 176.84 2fbr s PHE 95 N 0.78 -0.46 0.07 5.22 -0.71 -0.40 -4.99 117.98 117.49 2fbr s PHE 95 Ca -0.06 0.80 -0.30 0.00 -1.04 0.00 0.00 56.93 56.33 2fbr s PHE 95 Cb -0.15 0.26 -0.05 0.00 -1.21 0.00 0.00 43.02 41.87 2fbr s PHE 95 CO 0.00 -0.49 1.01 0.99 -1.34 0.00 0.00 175.22 175.39 2fbr s THR 96 N -1.12 4.53 0.10 -4.49 2.01 -1.26 -0.87 115.64 114.53 2fbr s THR 96 Ca -0.11 1.96 0.10 0.00 0.31 0.00 0.00 61.69 63.94 2fbr s THR 96 Cb -0.02 -4.25 -0.03 0.00 0.01 0.00 0.00 72.50 68.20 2fbr s THR 96 CO 0.07 0.23 -0.25 0.00 -0.69 0.00 0.00 174.62 173.98 2fbr s ALA 97 N 0.48 2.18 -1.90 7.40 0.00 0.06 -4.81 121.76 125.18 2fbr s ALA 97 Ca 0.50 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 51.13 2fbr s ALA 97 Cb -0.24 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.51 2fbr s ALA 97 CO 0.30 0.49 0.00 0.09 0.00 0.00 0.00 175.76 176.64 2fbr n ASN 98 N 1.25 -5.24 0.04 0.00 3.02 -1.26 -2.67 115.26 110.40 2fbr n ASN 98 Ca -0.18 0.38 0.13 0.00 -0.03 0.00 0.00 54.58 54.88 2fbr n ASN 98 Cb 0.53 -4.36 0.52 0.00 -0.61 0.00 0.00 39.78 35.86 2fbr n ASN 98 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2fbr n ASP 99 N -1.07 0.27 -1.26 6.41 4.64 -1.26 -2.71 116.55 121.57 2fbr n ASP 99 Ca -0.19 0.53 -0.08 0.00 -1.38 0.00 0.00 54.79 53.67 2fbr n ASP 99 Cb 0.62 -0.60 0.15 0.00 -1.04 0.00 0.00 41.12 40.25 2fbr n ASP 99 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 2fbr n SER 100 N -1.76 3.12 0.00 1.67 7.64 -1.26 -5.09 113.62 117.94 2fbr n SER 100 Ca 0.06 -3.82 0.00 0.00 1.01 0.00 0.00 58.87 56.12 2fbr n SER 100 Cb 0.34 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 2fbr n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fbr n GLY 101 N -1.01 1.67 3.74 0.23 0.00 -1.10 -4.99 105.19 103.73 2fbr n GLY 101 Ca 0.33 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 2fbr n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fbr s PRO 102 N -2.28 4.17 0.31 1.61 0.04 -1.26 -4.30 135.00 133.29 2fbr s PRO 102 Ca 0.00 2.48 0.03 0.00 0.04 0.00 0.00 61.00 63.56 2fbr s PRO 102 Cb 0.00 -3.06 -0.06 0.00 0.04 0.00 0.00 34.50 31.42 2fbr s PRO 102 CO 0.00 -0.57 0.06 1.03 0.04 0.00 0.00 177.00 177.55 2fbr s ARG 103 N -0.25 1.59 -0.16 4.56 1.81 -1.26 -4.88 118.95 120.36 2fbr s ARG 103 Ca 0.63 -1.87 -0.03 0.00 -1.72 0.00 0.00 55.73 52.74 2fbr s ARG 103 Cb -0.46 -0.76 -0.02 0.00 -0.45 0.00 0.00 34.95 33.26 2fbr s ARG 103 CO 0.44 -0.20 -0.06 1.03 -0.68 0.00 0.00 175.30 175.84 2fbr s ARG 104 N -3.91 3.56 -0.13 3.54 0.52 -0.26 -4.83 118.95 117.44 2fbr s ARG 104 Ca 0.36 -0.57 0.01 0.00 -0.52 0.00 0.00 55.73 55.01 2fbr s ARG 104 Cb 0.08 -2.88 -0.01 0.00 0.52 0.00 0.00 34.95 32.67 2fbr s ARG 104 CO 0.15 0.15 -0.18 0.71 0.02 0.00 0.00 175.30 176.15 2fbr s TYR 105 N 0.58 2.72 -0.13 -0.53 2.02 0.05 -1.03 117.35 121.03 2fbr s TYR 105 Ca -0.04 -0.91 0.01 0.00 -0.37 0.00 0.00 57.07 55.75 2fbr s TYR 105 Cb -0.15 -1.81 -0.01 0.00 -0.40 0.00 0.00 41.96 39.59 2fbr s TYR 105 CO 0.03 -0.37 -0.15 0.99 -1.57 0.00 0.00 175.55 174.48 2fbr s THR 106 N 0.50 2.79 -0.30 -0.71 2.01 0.25 -1.21 115.64 118.98 2fbr s THR 106 Ca -0.12 -0.75 -0.09 0.00 0.31 0.00 0.00 61.69 61.05 2fbr s THR 106 Cb -0.16 -2.16 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 2fbr s THR 106 CO 0.05 0.53 0.13 -0.63 -0.69 0.00 0.00 174.62 174.01 2fbr s ILE 107 N 0.49 4.55 -0.14 1.82 -1.09 0.07 -1.08 121.20 125.82 2fbr s ILE 107 Ca -0.11 -0.35 -0.04 0.00 -2.23 0.00 0.00 60.65 57.92 2fbr s ILE 107 Cb -0.16 -3.28 -0.03 0.00 -1.58 0.00 0.00 42.46 37.41 2fbr s ILE 107 CO 0.05 0.13 0.01 0.00 -1.23 0.00 0.00 174.94 173.89 2fbr s ALA 108 N 1.62 3.22 0.02 9.38 0.00 -0.04 -1.13 121.76 134.82 2fbr s ALA 108 Ca 0.05 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.25 2fbr s ALA 108 Cb -0.17 -1.65 -0.02 0.00 0.00 0.00 0.00 23.12 21.29 2fbr s ALA 108 CO 0.06 0.32 -0.10 0.00 0.00 0.00 0.00 175.76 176.03 2fbr s ALA 109 N -0.01 0.81 -0.11 0.00 0.00 0.03 -0.66 121.76 121.82 2fbr s ALA 109 Ca 0.03 -0.61 0.03 0.00 0.00 0.00 0.00 51.96 51.41 2fbr s ALA 109 Cb -0.13 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.88 2fbr s ALA 109 CO 0.02 0.14 -0.20 -1.17 0.00 0.00 0.00 175.76 174.54 2fbr s LEU 110 N -0.87 1.97 -0.07 0.00 2.96 -0.14 -0.95 118.68 121.59 2fbr s LEU 110 Ca -0.01 -0.52 0.04 0.00 -0.22 0.00 0.00 54.13 53.42 2fbr s LEU 110 Cb -0.06 -1.29 -0.02 0.00 0.50 0.00 0.00 46.19 45.32 2fbr s LEU 110 CO 0.00 0.09 -0.18 -0.76 -1.32 0.00 0.00 176.35 174.19 2fbr s LEU 111 N 0.64 2.47 0.17 -0.68 1.43 -0.25 -1.64 118.68 120.81 2fbr s LEU 111 Ca -0.13 -0.35 0.03 0.00 -1.03 0.00 0.00 54.13 52.66 2fbr s LEU 111 Cb -0.16 -1.49 -0.05 0.00 0.03 0.00 0.00 46.19 44.52 2fbr s LEU 111 CO 0.03 0.27 -0.03 -0.44 0.23 0.00 0.00 176.35 176.41 2fbr s SER 112 N -0.29 1.48 0.50 2.29 0.01 -0.14 -1.10 113.70 116.45 2fbr s SER 112 Ca 0.01 -1.13 0.20 0.00 1.31 0.00 0.00 55.95 56.34 2fbr s SER 112 Cb -0.13 0.06 1.25 0.00 0.21 0.00 0.00 66.02 67.41 2fbr s SER 112 CO 0.03 -0.49 2.02 -0.65 0.41 0.00 0.00 173.24 174.56 2fbr h PRO 113 N 2.70 0.13 -0.09 12.44 0.11 -2.00 -2.71 132.00 142.58 2fbr h PRO 113 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2fbr h PRO 113 Cb 1.20 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2fbr h PRO 113 CO 0.63 0.09 0.00 0.66 -0.21 0.00 0.00 178.00 179.17 2fbr n TYR 114 N -4.44 0.12 -3.97 0.65 4.02 -1.26 -1.54 117.16 110.73 2fbr n TYR 114 Ca 0.07 -0.23 -0.09 0.00 -0.01 0.00 0.00 57.90 57.65 2fbr n TYR 114 Cb 0.43 -0.02 -0.10 0.00 -0.02 0.00 0.00 39.34 39.64 2fbr n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2fbr s SER 115 N -0.74 0.27 0.14 7.72 0.15 -1.02 -4.97 113.70 115.25 2fbr s SER 115 Ca 0.10 -0.66 -0.14 0.00 0.70 0.00 0.00 55.95 55.95 2fbr s SER 115 Cb 0.06 0.21 0.02 0.00 -1.71 0.00 0.00 66.02 64.60 2fbr s SER 115 CO 0.08 -0.52 0.38 -0.72 1.20 0.00 0.00 173.24 173.66 2fbr s TYR 116 N -2.88 -0.01 -0.05 3.44 -0.85 -1.26 -0.97 117.35 114.76 2fbr s TYR 116 Ca -0.03 -0.34 -0.04 0.00 -0.52 0.00 0.00 57.07 56.15 2fbr s TYR 116 Cb 0.00 0.18 0.02 0.00 0.38 0.00 0.00 41.96 42.55 2fbr s TYR 116 CO -0.06 -0.74 0.12 -1.12 -1.52 0.00 0.00 175.55 172.23 2fbr s SER 117 N -2.86 -0.12 0.01 -0.18 0.01 -0.65 -4.98 113.70 104.92 2fbr s SER 117 Ca 0.08 0.24 0.03 0.00 1.31 0.00 0.00 55.95 57.61 2fbr s SER 117 Cb 0.02 0.23 -0.01 0.00 0.21 0.00 0.00 66.02 66.46 2fbr s SER 117 CO -0.07 -0.06 -0.10 0.28 0.41 0.00 0.00 173.24 173.70 2fbr s THR 118 N 0.24 0.79 0.05 1.44 -1.32 -1.26 -0.96 115.64 114.62 2fbr s THR 118 Ca -0.01 -0.58 0.03 0.00 -1.21 0.00 0.00 61.69 59.92 2fbr s THR 118 Cb -0.03 -0.69 -0.03 0.00 -1.51 0.00 0.00 72.50 70.25 2fbr s THR 118 CO -0.01 0.11 -0.11 -0.89 -2.21 0.00 0.00 174.62 171.52 2fbr s THR 119 N -0.45 0.79 -0.14 5.08 2.01 0.16 -4.99 115.64 118.10 2fbr s THR 119 Ca 0.02 -1.13 -0.03 0.00 0.31 0.00 0.00 61.69 60.86 2fbr s THR 119 Cb -0.05 -0.80 -0.03 0.00 0.01 0.00 0.00 72.50 71.63 2fbr s THR 119 CO 0.00 -0.28 -0.04 0.00 -0.69 0.00 0.00 174.62 173.61 2fbr s ALA 120 N -1.26 3.02 -0.25 7.40 0.00 -1.26 -0.87 121.76 128.54 2fbr s ALA 120 Ca -0.06 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 51.04 2fbr s ALA 120 Cb -0.10 -1.52 0.01 0.00 0.00 0.00 0.00 23.12 21.51 2fbr s ALA 120 CO 0.01 0.28 -0.02 0.08 0.00 0.00 0.00 175.76 176.11 2fbr s VAL 121 N 0.16 3.32 -0.18 0.00 1.01 -0.24 -4.98 120.40 119.49 2fbr s VAL 121 Ca -0.01 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.20 2fbr s VAL 121 Cb -0.14 -2.63 0.01 0.00 0.00 0.00 0.00 36.38 33.62 2fbr s VAL 121 CO 0.03 0.24 -0.16 -0.69 0.00 0.00 0.00 175.10 174.52 2fbr s VAL 122 N 1.42 2.44 0.24 2.92 1.01 -1.26 -0.58 120.40 126.60 2fbr s VAL 122 Ca 0.03 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.27 2fbr s VAL 122 Cb -0.16 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 2fbr s VAL 122 CO -0.02 0.51 -0.13 0.42 0.00 0.00 0.00 175.10 175.88 2fbr s THR 123 N 1.23 1.85 0.00 3.92 -4.23 -0.20 -4.97 115.64 113.25 2fbr s THR 123 Ca 0.03 -2.22 0.00 0.00 -1.18 0.00 0.00 61.69 58.32 2fbr s THR 123 Cb -0.14 -2.23 0.00 0.00 1.34 0.00 0.00 72.50 71.48 2fbr s THR 123 CO -0.08 -0.46 0.49 -3.20 -0.54 0.00 0.00 174.62 170.82