#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fta s SER 4 N 0.00 0.10 -0.20 0.00 1.04 -1.26 -1.09 113.70 112.28 2fta s SER 4 Ca 0.00 -1.11 -0.16 0.00 0.48 0.00 0.00 55.95 55.16 2fta s SER 4 Cb 0.00 0.55 0.06 0.00 0.10 0.00 0.00 66.02 66.73 2fta s SER 4 CO 0.00 -1.10 0.52 0.54 0.98 0.00 0.00 173.24 174.19 2fta s VAL 5 N -3.91 -0.01 -0.22 5.02 0.11 -0.01 -4.91 120.40 116.47 2fta s VAL 5 Ca 0.27 0.02 -0.10 0.00 -2.93 0.00 0.00 61.98 59.24 2fta s VAL 5 Cb 0.01 -0.74 -0.05 0.00 -1.53 0.00 0.00 36.38 34.07 2fta s VAL 5 CO 0.11 0.01 0.14 -1.81 -3.33 0.00 0.00 175.10 170.22 2fta s ASP 6 N 0.67 6.07 -0.01 3.54 1.01 -1.26 -1.06 116.67 125.63 2fta s ASP 6 Ca -0.03 0.13 0.07 0.00 0.71 0.00 0.00 52.55 53.43 2fta s ASP 6 Cb -0.05 -2.08 -0.02 0.00 1.01 0.00 0.00 42.92 41.78 2fta s ASP 6 CO -0.04 0.10 -0.22 -0.63 0.21 0.00 0.00 175.17 174.59 2fta s ILE 7 N 0.83 1.73 -0.04 0.77 1.01 0.09 -4.95 121.20 120.64 2fta s ILE 7 Ca 0.07 -0.99 0.07 0.00 0.00 0.00 0.00 60.65 59.80 2fta s ILE 7 Cb -0.13 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 2fta s ILE 7 CO 0.02 0.44 -0.25 -1.10 0.00 0.00 0.00 174.94 174.06 2fta s GLN 8 N -0.63 2.34 -0.21 2.79 -0.21 -1.26 -0.98 119.66 121.49 2fta s GLN 8 Ca 0.08 -0.90 0.02 0.00 0.02 0.00 0.00 55.36 54.58 2fta s GLN 8 Cb -0.09 -2.08 0.04 0.00 1.00 0.00 0.00 33.01 31.88 2fta s GLN 8 CO -0.00 0.45 -0.14 0.20 -2.12 0.00 0.00 175.29 173.67 2fta s GLY 9 N -0.34 1.42 0.27 3.09 0.00 -0.72 -1.44 107.32 109.61 2fta s GLY 9 Ca 0.02 -1.36 0.03 0.00 0.00 0.00 0.00 44.72 43.41 2fta s GLY 9 CO 0.02 0.51 0.37 1.16 0.00 0.00 0.00 173.10 175.16 2fta n ASN 10 N 4.59 0.85 0.25 1.64 0.23 -0.69 -3.64 115.26 118.49 2fta n ASN 10 Ca -0.17 -1.64 0.13 0.00 -0.53 0.00 0.00 54.58 52.37 2fta n ASN 10 Cb 0.47 -0.21 0.62 0.00 -2.08 0.00 0.00 39.78 38.58 2fta n ASN 10 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2fta h ASP 11 N -0.02 0.00 -0.22 0.53 3.45 -1.91 -2.55 116.42 115.70 2fta h ASP 11 Ca -0.12 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.34 2fta h ASP 11 Cb 0.55 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.32 2fta h ASP 11 CO 0.17 0.14 0.00 0.00 -1.57 0.00 0.00 179.24 177.98 2fta n GLN 12 N -3.40 1.97 -3.48 3.56 3.00 -1.26 -4.90 117.38 112.86 2fta n GLN 12 Ca -0.01 -0.98 -0.19 0.00 -0.01 0.00 0.00 57.00 55.81 2fta n GLN 12 Cb 0.33 -1.49 0.06 0.00 0.00 0.00 0.00 30.24 29.14 2fta n GLN 12 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 2fta n MET 13 N 0.22 -4.48 -4.08 -1.09 2.81 -0.96 -5.02 117.12 104.52 2fta n MET 13 Ca 0.09 0.75 -0.14 0.00 -1.81 0.00 0.00 57.70 56.59 2fta n MET 13 Cb 0.40 -5.50 -0.14 0.00 -0.71 0.00 0.00 33.22 27.27 2fta n MET 13 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2fta s GLN 14 N -5.34 0.33 0.11 0.03 -0.21 -1.26 -4.76 119.66 108.57 2fta s GLN 14 Ca 0.17 -0.21 -0.05 0.00 0.02 0.00 0.00 55.36 55.29 2fta s GLN 14 Cb -0.03 -0.29 -0.05 0.00 1.00 0.00 0.00 33.01 33.64 2fta s GLN 14 CO 0.77 0.07 0.34 -0.06 -2.12 0.00 0.00 175.29 174.29 2fta s PHE 15 N -0.26 3.50 -0.36 0.91 0.08 -1.26 -1.71 117.98 118.89 2fta s PHE 15 Ca -0.00 0.53 -0.01 0.00 0.12 0.00 0.00 56.93 57.57 2fta s PHE 15 Cb -0.03 -1.98 0.28 0.00 -0.57 0.00 0.00 43.02 40.73 2fta s PHE 15 CO -0.00 0.49 1.93 0.27 -0.10 0.00 0.00 175.22 177.80 2fta n ASN 16 N 0.30 6.09 -3.64 1.36 6.94 -0.52 -4.78 115.26 121.01 2fta n ASN 16 Ca -0.04 -3.15 -0.05 0.00 -0.02 0.00 0.00 54.58 51.32 2fta n ASN 16 Cb 0.52 -0.98 -0.07 0.00 -2.36 0.00 0.00 39.78 36.89 2fta n ASN 16 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2fta s THR 17 N -2.61 0.00 0.00 5.53 -1.32 -1.26 -4.88 115.64 111.10 2fta s THR 17 Ca 0.36 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.84 2fta s THR 17 Cb 0.29 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.28 2fta s THR 17 CO 0.01 0.00 0.94 -0.46 -2.21 0.00 0.00 174.62 172.90 2fta n ASN 18 N 1.66 1.75 -3.65 8.08 6.94 -1.26 -4.80 115.26 123.98 2fta n ASN 18 Ca -0.10 -1.88 -0.04 0.00 -0.02 0.00 0.00 54.58 52.54 2fta n ASN 18 Cb 0.57 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.93 2fta n ASN 18 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2fta s ALA 19 N -0.88 -1.80 -0.08 -2.53 0.00 -1.26 -2.09 121.76 113.12 2fta s ALA 19 Ca 0.00 2.18 0.01 0.00 0.00 0.00 0.00 51.96 54.15 2fta s ALA 19 Cb 0.00 -1.57 -0.03 0.00 0.00 0.00 0.00 23.12 21.53 2fta s ALA 19 CO 0.00 -0.72 -0.10 0.42 0.00 0.00 0.00 175.76 175.36 2fta s ILE 20 N 2.44 3.45 -0.14 0.00 -1.09 0.18 -4.93 121.20 121.11 2fta s ILE 20 Ca -0.07 -0.56 0.01 0.00 -2.23 0.00 0.00 60.65 57.80 2fta s ILE 20 Cb -0.10 -2.41 -0.00 0.00 -1.58 0.00 0.00 42.46 38.36 2fta s ILE 20 CO -0.18 0.57 -0.16 -0.89 -1.23 0.00 0.00 174.94 173.06 2fta s THR 21 N -0.48 2.66 -0.21 2.92 2.01 -1.26 -1.03 115.64 120.25 2fta s THR 21 Ca 0.07 -0.78 -0.03 0.00 0.31 0.00 0.00 61.69 61.25 2fta s THR 21 Cb -0.12 -2.11 -0.01 0.00 0.01 0.00 0.00 72.50 70.27 2fta s THR 21 CO 0.02 0.52 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.72 2fta s VAL 22 N 0.66 3.28 -0.29 3.82 1.01 0.15 -4.95 120.40 124.08 2fta s VAL 22 Ca -0.08 -0.53 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 2fta s VAL 22 Cb -0.16 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 2fta s VAL 22 CO 0.02 0.44 1.61 -0.62 0.00 0.00 0.00 175.10 176.55 2fta s ASP 23 N 1.32 6.26 0.00 3.32 3.68 -1.26 -4.15 116.67 125.85 2fta s ASP 23 Ca 0.04 1.38 0.00 0.00 2.13 0.00 0.00 52.55 56.10 2fta s ASP 23 Cb -0.14 -2.53 0.00 0.00 -1.45 0.00 0.00 42.92 38.79 2fta s ASP 23 CO -0.03 -1.39 0.80 2.29 0.13 0.00 0.00 175.17 176.97 2fta n LYS 24 N 7.91 0.00 0.11 4.34 2.85 -1.26 0.44 118.16 132.54 2fta n LYS 24 Ca 0.19 0.32 -0.03 0.00 -1.05 0.00 0.00 58.31 57.74 2fta n LYS 24 Cb 0.46 -1.59 0.06 0.00 -0.65 0.00 0.00 35.03 33.32 2fta n LYS 24 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2fta h SER 25 N 0.00 0.00 -3.93 -5.58 0.87 -2.02 -3.45 113.55 99.45 2fta h SER 25 Ca 0.00 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.04 2fta h SER 25 Cb 0.17 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 62.20 2fta h SER 25 CO 0.00 0.74 0.58 0.00 -0.53 0.00 0.00 176.83 177.63 2fta n LYS 27 N 0.27 0.51 -3.85 0.00 5.02 -1.26 -4.64 118.16 114.21 2fta n LYS 27 Ca 0.03 -0.14 -0.12 0.00 -2.02 0.00 0.00 58.31 56.06 2fta n LYS 27 Cb 0.44 -1.53 -0.13 0.00 -0.02 0.00 0.00 35.03 33.79 2fta n LYS 27 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2fta s GLN 28 N -3.40 0.14 -0.02 1.97 -0.21 -1.26 -2.38 119.66 114.50 2fta s GLN 28 Ca -0.04 0.03 0.06 0.00 0.02 0.00 0.00 55.36 55.43 2fta s GLN 28 Cb 0.14 0.07 -0.01 0.00 1.00 0.00 0.00 33.01 34.20 2fta s GLN 28 CO 0.89 -0.02 -0.21 0.12 -2.12 0.00 0.00 175.29 173.96 2fta s PHE 29 N -0.16 1.88 -0.11 0.91 5.36 -0.67 -4.83 117.98 120.36 2fta s PHE 29 Ca -0.02 -0.40 0.03 0.00 -0.96 0.00 0.00 56.93 55.58 2fta s PHE 29 Cb -0.02 -1.22 0.01 0.00 -0.34 0.00 0.00 43.02 41.44 2fta s PHE 29 CO 0.00 -0.07 -0.22 0.99 -1.46 0.00 0.00 175.22 174.47 2fta s THR 30 N -0.39 1.92 -0.23 0.12 2.01 -0.25 -1.79 115.64 117.02 2fta s THR 30 Ca 0.05 -0.92 -0.06 0.00 0.31 0.00 0.00 61.69 61.08 2fta s THR 30 Cb -0.09 -1.68 -0.02 0.00 0.01 0.00 0.00 72.50 70.72 2fta s THR 30 CO -0.00 0.53 0.01 -0.69 -0.69 0.00 0.00 174.62 173.78 2fta s VAL 31 N 0.55 3.85 -0.47 3.82 1.01 -0.16 -0.83 120.40 128.17 2fta s VAL 31 Ca -0.15 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.40 2fta s VAL 31 Cb -0.17 -2.78 0.11 0.00 0.00 0.00 0.00 36.38 33.54 2fta s VAL 31 CO 0.05 0.38 0.36 0.20 0.00 0.00 0.00 175.10 176.09 2fta s ASN 32 N 1.52 5.81 -0.04 3.32 0.01 -0.23 -1.56 114.94 123.78 2fta s ASN 32 Ca 0.06 -1.76 -0.16 0.00 -0.71 0.00 0.00 52.86 50.29 2fta s ASN 32 Cb -0.15 -2.05 -0.05 0.00 0.41 0.00 0.00 41.25 39.41 2fta s ASN 32 CO 0.00 -0.69 0.42 -0.22 -1.51 0.00 0.00 177.10 175.11 2fta s LEU 33 N 1.44 4.40 0.15 0.60 2.96 -0.32 -0.73 118.68 127.19 2fta s LEU 33 Ca 0.05 0.90 0.02 0.00 -0.22 0.00 0.00 54.13 54.88 2fta s LEU 33 Cb -0.26 -2.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.77 2fta s LEU 33 CO 0.01 0.22 -0.03 -0.94 -1.32 0.00 0.00 176.35 174.28 2fta s SER 34 N -0.49 1.33 -0.33 3.68 1.04 -0.15 -1.40 113.70 117.38 2fta s SER 34 Ca 0.24 -1.11 -0.01 0.00 0.48 0.00 0.00 55.95 55.56 2fta s SER 34 Cb -0.16 0.08 0.11 0.00 0.10 0.00 0.00 66.02 66.15 2fta s SER 34 CO 0.12 -0.50 0.13 -2.28 0.98 0.00 0.00 173.24 171.69 2fta s HIS 35 N -3.58 1.55 0.43 5.02 2.46 -1.13 -1.75 115.29 118.29 2fta s HIS 35 Ca 0.20 -1.76 -0.18 0.00 0.47 0.00 0.00 55.06 53.78 2fta s HIS 35 Cb 0.05 -1.61 -0.09 0.00 -0.13 0.00 0.00 32.58 30.80 2fta s HIS 35 CO 0.02 -0.85 0.91 -1.25 -2.47 0.00 0.00 174.74 171.09 2fta s PRO 36 N 1.41 4.08 0.00 2.88 0.04 -1.24 -0.65 135.00 141.52 2fta s PRO 36 Ca 0.12 0.95 0.00 0.00 0.04 0.00 0.00 61.00 62.11 2fta s PRO 36 Cb -0.19 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.13 2fta s PRO 36 CO -0.20 -0.06 0.00 0.41 0.04 0.00 0.00 177.00 177.19 2fta n GLY 37 N -0.90 0.69 0.00 0.56 0.00 -1.26 -3.56 105.19 100.72 2fta n GLY 37 Ca 0.06 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2fta n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2fta n ASN 38 N 0.92 4.42 -4.71 1.61 4.13 -1.26 -4.52 115.26 115.85 2fta n ASN 38 Ca 0.00 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.83 2fta n ASN 38 Cb 0.00 0.46 -0.02 0.00 -1.54 0.00 0.00 39.78 38.68 2fta n ASN 38 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2fta n LEU 39 N -1.80 3.80 -4.82 3.41 4.77 -1.26 -4.77 117.00 116.33 2fta n LEU 39 Ca 0.00 1.13 -0.31 0.00 -0.03 0.00 0.00 56.01 56.80 2fta n LEU 39 Cb 0.42 -1.52 0.04 0.00 -2.33 0.00 0.00 43.42 40.03 2fta n LEU 39 CO 0.00 -0.10 0.71 -2.16 -1.33 0.00 0.00 177.39 174.52 2fta s PRO 40 N -0.18 3.06 0.51 3.23 0.04 -1.26 -2.09 135.00 138.31 2fta s PRO 40 Ca 0.68 1.02 0.32 0.00 0.04 0.00 0.00 61.00 63.07 2fta s PRO 40 Cb -0.56 -2.00 1.45 0.00 0.04 0.00 0.00 34.50 33.42 2fta s PRO 40 CO 0.46 -1.01 1.80 -0.22 0.04 0.00 0.00 177.00 178.07 2fta h LYS 41 N -0.37 0.09 0.00 4.56 3.64 -1.85 0.24 116.57 122.88 2fta h LYS 41 Ca -0.45 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 2fta h LYS 41 Cb 1.21 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2fta h LYS 41 CO 0.57 0.06 0.00 -2.95 -2.27 0.00 0.00 179.45 174.86 2fta h ASN 42 N 0.09 0.00 0.00 4.20 -1.07 -1.96 -2.53 115.58 114.32 2fta h ASN 42 Ca 0.57 0.00 -0.18 0.00 0.07 0.00 0.00 56.30 56.76 2fta h ASN 42 Cb 2.08 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 38.30 2fta h ASN 42 CO -0.08 0.00 -1.67 0.52 0.07 0.00 0.00 177.43 176.26 2fta n VAL 43 N -2.35 0.67 -2.60 6.14 0.31 0.60 -4.84 118.33 116.28 2fta n VAL 43 Ca 0.04 -0.24 -0.15 0.00 -0.01 0.00 0.00 64.34 63.98 2fta n VAL 43 Cb 0.35 -1.10 0.02 0.00 -0.91 0.00 0.00 33.84 32.20 2fta n VAL 43 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2fta n MET 44 N -3.02 1.96 -2.51 5.55 0.00 0.18 -5.01 117.12 114.28 2fta n MET 44 Ca -0.22 -3.69 -0.41 0.00 -0.00 0.00 0.00 57.70 53.38 2fta n MET 44 Cb 0.71 -1.60 -0.04 0.00 0.00 0.00 0.00 33.22 32.28 2fta n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2fta s GLY 45 N -3.29 2.90 0.08 -5.12 0.00 -0.95 -4.71 107.32 96.23 2fta s GLY 45 Ca 0.34 0.83 0.07 0.00 0.00 0.00 0.00 44.72 45.96 2fta s GLY 45 CO -0.04 1.61 -0.18 0.30 0.00 0.00 0.00 173.10 174.79 2fta s HIS 46 N -0.48 1.53 0.22 1.90 3.76 -0.63 -4.81 115.29 116.78 2fta s HIS 46 Ca 0.48 -0.42 0.01 0.00 -0.15 0.00 0.00 55.06 54.98 2fta s HIS 46 Cb -0.30 -0.86 -0.05 0.00 1.11 0.00 0.00 32.58 32.48 2fta s HIS 46 CO 0.36 0.12 0.07 0.54 -0.85 0.00 0.00 174.74 174.98 2fta s ASN 47 N -1.67 0.99 -0.20 1.40 2.20 -1.26 -0.28 114.94 116.12 2fta s ASN 47 Ca 0.03 -1.31 0.01 0.00 -0.94 0.00 0.00 52.86 50.65 2fta s ASN 47 Cb -0.10 0.19 0.04 0.00 -2.00 0.00 0.00 41.25 39.38 2fta s ASN 47 CO 0.03 -0.70 -0.12 0.86 -2.94 0.00 0.00 177.10 174.23 2fta s TRP 48 N -3.80 2.56 -0.04 1.54 -0.00 -1.26 -4.01 118.94 113.94 2fta s TRP 48 Ca 0.33 -1.67 0.06 0.00 -0.00 0.00 0.00 56.10 54.82 2fta s TRP 48 Cb 0.07 -1.71 -0.01 0.00 -0.00 0.00 0.00 33.47 31.82 2fta s TRP 48 CO 0.10 -0.77 -0.22 0.08 -0.00 0.00 0.00 176.95 176.14 2fta s VAL 49 N 1.35 1.78 -0.11 5.86 1.01 0.84 -1.37 120.40 129.75 2fta s VAL 49 Ca -0.01 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.05 2fta s VAL 49 Cb -0.16 -1.50 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 2fta s VAL 49 CO -0.09 0.50 -0.15 -0.22 0.00 0.00 0.00 175.10 175.14 2fta s LEU 50 N -0.23 2.60 0.31 3.92 2.96 -0.09 -0.71 118.68 127.43 2fta s LEU 50 Ca 0.01 -0.36 -0.15 0.00 -0.22 0.00 0.00 54.13 53.41 2fta s LEU 50 Cb -0.11 -1.57 0.02 0.00 0.50 0.00 0.00 46.19 45.03 2fta s LEU 50 CO 0.02 0.19 0.65 -0.94 -1.32 0.00 0.00 176.35 174.94 2fta s SER 51 N 0.22 -0.00 0.73 3.68 1.04 -0.87 -0.55 113.70 117.95 2fta s SER 51 Ca -0.10 -0.95 -0.11 0.00 0.48 0.00 0.00 55.95 55.27 2fta s SER 51 Cb -0.16 0.72 0.03 0.00 0.10 0.00 0.00 66.02 66.72 2fta s SER 51 CO 0.06 -1.39 1.08 0.42 0.98 0.00 0.00 173.24 174.39 2fta s THR 52 N -3.38 3.58 0.29 2.02 -4.23 -1.26 -0.98 115.64 111.66 2fta s THR 52 Ca 0.17 0.54 -0.02 0.00 -1.18 0.00 0.00 61.69 61.20 2fta s THR 52 Cb -0.04 -3.11 0.27 0.00 1.34 0.00 0.00 72.50 70.96 2fta s THR 52 CO 0.10 -0.64 1.94 0.00 -0.54 0.00 0.00 174.62 175.48 2fta h ALA 53 N -0.83 1.40 -0.26 3.99 0.00 -1.62 -2.27 119.26 119.67 2fta h ALA 53 Ca -0.44 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 2fta h ALA 53 Cb 1.22 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2fta h ALA 53 CO 0.54 0.52 -0.15 0.00 0.00 0.00 0.00 179.25 180.16 2fta h ALA 54 N 1.46 1.26 0.00 0.00 0.00 -1.91 -2.93 119.26 117.14 2fta h ALA 54 Ca 0.35 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2fta h ALA 54 Cb -0.04 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2fta h ALA 54 CO -0.10 0.49 -0.20 -0.25 0.00 0.00 0.00 179.25 179.20 2fta n ASP 55 N -4.19 0.30 -0.02 0.00 10.43 -0.89 -4.42 116.55 117.76 2fta n ASP 55 Ca 0.00 0.26 -0.10 0.00 2.57 0.00 0.00 54.79 57.53 2fta n ASP 55 Cb 0.33 -0.27 -0.03 0.00 1.84 0.00 0.00 41.12 42.99 2fta n ASP 55 CO 0.00 0.00 0.00 -0.03 -1.07 0.00 0.00 177.20 176.10 2fta h MET 56 N 0.00 -0.34 -0.87 -1.24 4.05 -1.26 -1.90 114.93 113.37 2fta h MET 56 Ca 0.00 0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.47 2fta h MET 56 Cb 0.55 0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 31.38 2fta h MET 56 CO 0.00 -0.22 0.57 0.37 0.23 0.00 0.00 176.91 177.85 2fta h GLN 57 N -0.35 1.09 -0.37 0.39 4.15 -1.80 -0.19 115.11 118.02 2fta h GLN 57 Ca 0.11 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.47 2fta h GLN 57 Cb 0.52 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 2fta h GLN 57 CO -0.37 0.72 0.25 0.78 -1.93 0.00 0.00 178.83 178.27 2fta h GLY 58 N 1.12 0.53 0.99 2.39 0.00 -1.75 -0.53 103.07 105.82 2fta h GLY 58 Ca 0.34 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.47 2fta h GLY 58 CO -0.10 0.20 0.31 -2.08 0.00 0.00 0.00 176.54 174.87 2fta h VAL 59 N 0.50 1.15 -0.16 4.60 2.07 -0.80 -1.48 116.25 122.13 2fta h VAL 59 Ca 0.14 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2fta h VAL 59 Cb -0.05 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 2fta h VAL 59 CO -0.03 0.15 0.04 0.58 0.02 0.00 0.00 177.57 178.33 2fta h VAL 60 N 0.68 1.19 0.16 2.57 2.07 -0.70 0.69 116.25 122.92 2fta h VAL 60 Ca 0.18 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 2fta h VAL 60 Cb -0.03 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2fta h VAL 60 CO -0.04 0.19 -0.08 0.71 0.02 0.00 0.00 177.57 178.37 2fta h THR 61 N 0.07 0.96 0.00 2.57 1.35 -1.04 -0.94 112.91 115.88 2fta h THR 61 Ca 0.05 -0.58 -0.02 0.00 -0.55 0.00 0.00 66.41 65.32 2fta h THR 61 Cb 0.25 1.31 -0.00 0.00 -1.73 0.00 0.00 68.15 67.98 2fta h THR 61 CO -0.00 0.13 -0.08 0.44 -0.25 0.00 0.00 175.52 175.76 2fta h ASP 62 N -0.49 0.00 -0.02 5.36 3.32 -1.32 -2.65 116.42 120.62 2fta h ASP 62 Ca -0.02 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 2fta h ASP 62 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2fta h ASP 62 CO 0.04 0.08 -0.05 1.23 -1.72 0.00 0.00 179.24 178.81 2fta h GLY 63 N 0.68 0.08 1.25 2.75 0.00 -0.49 -2.82 103.07 104.53 2fta h GLY 63 Ca -0.00 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.24 2fta h GLY 63 CO 0.01 0.09 0.49 -0.33 0.00 0.00 0.00 176.54 176.81 2fta h MET 64 N -0.49 0.96 -0.04 4.80 2.86 -0.88 -1.56 114.93 120.59 2fta h MET 64 Ca -0.00 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 2fta h MET 64 Cb 0.65 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 2fta h MET 64 CO 0.01 0.64 -0.27 0.00 1.06 0.00 0.00 176.91 178.35 2fta h ALA 65 N 1.54 1.48 0.00 6.32 0.00 -1.51 -2.25 119.26 124.84 2fta h ALA 65 Ca 0.28 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2fta h ALA 65 Cb -0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2fta h ALA 65 CO -0.06 0.38 -0.12 0.77 0.00 0.00 0.00 179.25 180.22 2fta h SER 66 N 0.06 0.00 -4.29 0.00 0.02 -1.01 -3.49 113.55 104.84 2fta h SER 66 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2fta h SER 66 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 2fta h SER 66 CO 0.04 0.12 0.00 0.61 -1.14 0.00 0.00 176.83 176.46 2fta n GLY 67 N -0.34 -1.03 0.26 -3.77 0.00 -0.85 -4.31 105.19 95.15 2fta n GLY 67 Ca -0.01 -1.63 -0.00 0.00 0.00 0.00 0.00 46.02 44.38 2fta n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2fta h LEU 68 N 0.00 0.47 -0.53 0.99 5.85 -1.90 -0.31 115.31 119.88 2fta h LEU 68 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2fta h LEU 68 Cb 0.00 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.99 2fta h LEU 68 CO 0.00 0.29 0.00 0.47 -0.34 0.00 0.00 178.44 178.86 2fta n ASP 69 N -4.85 0.34 -0.92 1.25 8.00 -1.26 -1.21 116.55 117.90 2fta n ASP 69 Ca 0.09 0.61 0.02 0.00 0.71 0.00 0.00 54.79 56.23 2fta n ASP 69 Cb 0.23 -0.67 0.21 0.00 -0.02 0.00 0.00 41.12 40.87 2fta n ASP 69 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2fta n LYS 70 N -1.90 2.16 -2.21 -1.24 5.02 -0.78 -4.94 118.16 114.26 2fta n LYS 70 Ca 0.01 -3.00 -0.15 0.00 -2.02 0.00 0.00 58.31 53.16 2fta n LYS 70 Cb 0.13 -1.79 -0.02 0.00 -0.02 0.00 0.00 35.03 33.34 2fta n LYS 70 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2fta n ASP 71 N -0.94 -4.36 -3.80 4.39 8.00 -0.35 -1.86 116.55 117.63 2fta n ASP 71 Ca 0.26 0.18 -0.26 0.00 0.71 0.00 0.00 54.79 55.69 2fta n ASP 71 Cb 0.93 -3.74 0.03 0.00 -0.02 0.00 0.00 41.12 38.32 2fta n ASP 71 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2fta n TYR 72 N -3.22 -2.15 -3.86 1.24 4.01 -0.20 -4.67 117.16 108.31 2fta n TYR 72 Ca -0.17 0.88 -0.12 0.00 -0.16 0.00 0.00 57.90 58.33 2fta n TYR 72 Cb 0.60 -4.22 -0.13 0.00 -0.31 0.00 0.00 39.34 35.28 2fta n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2fta s LEU 73 N -7.01 1.79 -0.05 7.72 1.43 -0.78 -4.12 118.68 117.67 2fta s LEU 73 Ca 0.36 0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 53.23 2fta s LEU 73 Cb -0.18 0.21 -0.04 0.00 0.03 0.00 0.00 46.19 46.22 2fta s LEU 73 CO 0.82 -0.05 1.28 -0.75 0.23 0.00 0.00 176.35 177.88 2fta s LYS 74 N -0.10 4.31 0.11 1.70 2.20 -1.26 -4.80 119.74 121.91 2fta s LYS 74 Ca -0.01 1.78 -0.36 0.00 -0.36 0.00 0.00 55.97 57.02 2fta s LYS 74 Cb -0.01 -3.60 -0.16 0.00 -1.51 0.00 0.00 37.83 32.55 2fta s LYS 74 CO 0.00 -0.53 1.39 -2.30 -0.36 0.00 0.00 175.35 173.56 2fta n PRO 75 N 5.47 1.43 -2.60 4.03 -0.02 -1.26 -1.68 135.00 140.36 2fta n PRO 75 Ca 0.12 0.51 -0.19 0.00 -2.02 0.00 0.00 63.50 61.93 2fta n PRO 75 Cb 0.45 -2.18 -0.00 0.00 -0.02 0.00 0.00 33.50 31.75 2fta n PRO 75 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2fta n ASP 76 N 2.71 -5.12 -4.63 2.55 10.43 -1.26 -4.87 116.55 116.36 2fta n ASP 76 Ca 0.18 -0.02 -0.43 0.00 2.57 0.00 0.00 54.79 57.09 2fta n ASP 76 Cb 0.22 -4.26 -0.03 0.00 1.84 0.00 0.00 41.12 38.89 2fta n ASP 76 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2fta s ASP 77 N -2.21 5.88 0.31 -2.24 -1.08 -0.68 -4.83 116.67 111.82 2fta s ASP 77 Ca 0.09 2.24 0.25 0.00 -0.52 0.00 0.00 52.55 54.60 2fta s ASP 77 Cb -0.04 -2.52 1.09 0.00 -1.46 0.00 0.00 42.92 39.99 2fta s ASP 77 CO 0.11 -1.57 1.75 0.77 0.52 0.00 0.00 175.17 176.74 2fta h SER 78 N 13.15 0.00 1.89 -0.34 4.64 -1.90 -2.32 113.55 128.66 2fta h SER 78 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2fta h SER 78 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2fta h SER 78 CO 0.95 0.00 -0.11 0.03 -0.87 0.00 0.00 176.83 176.84 2fta h ARG 79 N 0.00 0.00 -6.25 4.77 3.08 -1.97 -3.42 114.38 110.59 2fta h ARG 79 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 2fta h ARG 79 Cb 0.30 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.25 2fta h ARG 79 CO 0.00 0.00 0.69 0.08 -1.07 0.00 0.00 179.97 179.67 2fta s VAL 80 N -3.23 4.35 0.24 2.04 1.01 -0.88 -4.46 120.40 119.48 2fta s VAL 80 Ca 0.06 0.76 -0.00 0.00 0.00 0.00 0.00 61.98 62.80 2fta s VAL 80 Cb 0.06 -4.52 0.01 0.00 0.00 0.00 0.00 36.38 31.93 2fta s VAL 80 CO 0.68 -0.98 1.62 0.40 0.00 0.00 0.00 175.10 176.82 2fta h ILE 81 N 6.11 1.29 -2.17 2.22 2.04 -1.08 -3.47 117.51 122.45 2fta h ILE 81 Ca -0.24 -1.51 0.07 0.00 1.00 0.00 0.00 64.86 64.17 2fta h ILE 81 Cb 1.07 1.52 -0.17 0.00 -0.74 0.00 0.00 36.82 38.50 2fta h ILE 81 CO 1.08 0.48 0.43 0.00 0.00 0.00 0.00 178.15 180.14 2fta s ALA 82 N -4.29 -1.81 -0.05 1.87 0.00 -1.23 -4.99 121.76 111.26 2fta s ALA 82 Ca -0.07 1.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.71 2fta s ALA 82 Cb 0.13 0.16 0.10 0.00 0.00 0.00 0.00 23.12 23.52 2fta s ALA 82 CO 0.81 -0.57 0.87 -3.38 0.00 0.00 0.00 175.76 173.50 2fta s HIS 83 N -2.50 -0.42 0.41 0.00 -3.43 -1.26 -0.91 115.29 107.19 2fta s HIS 83 Ca 0.01 0.51 0.06 0.00 -0.80 0.00 0.00 55.06 54.84 2fta s HIS 83 Cb -0.01 0.49 0.07 0.00 -1.43 0.00 0.00 32.58 31.70 2fta s HIS 83 CO -0.05 -0.51 0.57 0.25 -2.00 0.00 0.00 174.74 173.01 2fta n THR 84 N 0.27 0.00 -2.71 -5.38 -2.24 -0.47 -4.82 114.28 98.93 2fta n THR 84 Ca -0.11 -1.35 -0.22 0.00 -2.27 0.00 0.00 64.05 60.10 2fta n THR 84 Cb 0.60 -0.68 0.03 0.00 -2.10 0.00 0.00 70.33 68.18 2fta n THR 84 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2fta s LYS 85 N -3.88 2.70 0.09 -0.78 1.02 -1.26 -4.60 119.74 113.03 2fta s LYS 85 Ca 0.43 -0.63 -0.30 0.00 0.02 0.00 0.00 55.97 55.49 2fta s LYS 85 Cb -0.03 -2.48 -0.05 0.00 -0.52 0.00 0.00 37.83 34.74 2fta s LYS 85 CO 0.27 -0.61 1.03 -1.17 -0.92 0.00 0.00 175.35 173.96 2fta s LEU 86 N -4.74 4.44 0.04 3.17 2.96 -1.26 -4.47 118.68 118.82 2fta s LEU 86 Ca 0.55 1.85 0.05 0.00 -0.22 0.00 0.00 54.13 56.36 2fta s LEU 86 Cb -0.10 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 42.98 2fta s LEU 86 CO 0.39 -0.21 -0.15 0.27 -1.32 0.00 0.00 176.35 175.33 2fta s ILE 87 N 0.37 1.19 0.56 6.68 -4.36 0.61 -4.90 121.20 121.35 2fta s ILE 87 Ca 0.51 -1.01 0.08 0.00 -0.26 0.00 0.00 60.65 59.96 2fta s ILE 87 Cb -0.25 -1.07 0.07 0.00 1.25 0.00 0.00 42.46 42.47 2fta s ILE 87 CO 0.30 0.04 0.77 -0.83 0.24 0.00 0.00 174.94 175.46 2fta s GLY 88 N -1.12 1.78 0.31 6.27 0.00 -1.26 -1.61 107.32 111.69 2fta s GLY 88 Ca 0.03 -1.99 -0.29 0.00 0.00 0.00 0.00 44.72 42.46 2fta s GLY 88 CO 0.01 -1.58 1.40 -1.14 0.00 0.00 0.00 173.10 171.80 2fta n SER 89 N -2.23 3.09 0.00 1.64 3.41 -0.89 -1.74 113.62 116.90 2fta n SER 89 Ca 0.14 1.18 0.00 0.00 -0.26 0.00 0.00 58.87 59.93 2fta n SER 89 Cb 0.61 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 2fta n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fta n GLY 90 N 1.39 3.18 3.92 5.00 0.00 0.17 -4.92 105.19 113.92 2fta n GLY 90 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2fta n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fta s GLU 91 N -0.44 0.97 -0.15 1.61 2.02 -0.71 -4.89 118.70 117.11 2fta s GLU 91 Ca 0.00 -0.26 -0.28 0.00 0.02 0.00 0.00 54.97 54.45 2fta s GLU 91 Cb 0.00 -1.87 0.07 0.00 0.10 0.00 0.00 34.13 32.43 2fta s GLU 91 CO 0.00 -2.22 0.70 -1.59 0.02 0.00 0.00 175.26 172.18 2fta s LYS 92 N -5.79 0.96 -0.20 1.61 -2.85 -1.26 -2.84 119.74 109.35 2fta s LYS 92 Ca 0.71 0.58 -0.20 0.00 -1.00 0.00 0.00 55.97 56.06 2fta s LYS 92 Cb -0.06 0.46 0.05 0.00 -2.06 0.00 0.00 37.83 36.22 2fta s LYS 92 CO 0.52 -0.23 0.57 0.34 0.10 0.00 0.00 175.35 176.65 2fta s ASP 93 N -0.49 -0.58 0.17 0.03 2.15 -0.49 -5.02 116.67 112.42 2fta s ASP 93 Ca -0.06 1.11 0.11 0.00 0.43 0.00 0.00 52.55 54.14 2fta s ASP 93 Cb -0.02 1.12 -0.04 0.00 -0.30 0.00 0.00 42.92 43.68 2fta s ASP 93 CO 0.06 -0.21 -0.24 -0.44 -0.17 0.00 0.00 175.17 174.16 2fta s SER 94 N 0.22 3.29 -0.01 -0.34 0.01 -1.26 -1.17 113.70 114.44 2fta s SER 94 Ca -0.01 -0.82 -0.00 0.00 1.31 0.00 0.00 55.95 56.43 2fta s SER 94 Cb -0.04 -0.23 0.02 0.00 0.21 0.00 0.00 66.02 65.98 2fta s SER 94 CO 0.01 0.12 0.02 0.54 0.41 0.00 0.00 173.24 174.35 2fta s VAL 95 N -1.49 -0.03 -0.04 3.43 0.11 -0.60 -4.93 120.40 116.85 2fta s VAL 95 Ca 0.18 0.12 0.07 0.00 -2.93 0.00 0.00 61.98 59.41 2fta s VAL 95 Cb -0.08 -0.06 -0.02 0.00 -1.53 0.00 0.00 36.38 34.69 2fta s VAL 95 CO 0.08 0.05 -0.25 -0.89 -3.33 0.00 0.00 175.10 170.76 2fta s THR 96 N 0.59 2.00 0.09 5.04 2.01 -1.26 -0.98 115.64 123.13 2fta s THR 96 Ca -0.05 -1.06 0.00 0.00 0.31 0.00 0.00 61.69 60.89 2fta s THR 96 Cb -0.07 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.72 2fta s THR 96 CO -0.02 0.56 -0.04 0.72 -0.69 0.00 0.00 174.62 175.16 2fta s PHE 97 N -0.38 0.76 -0.21 4.92 -0.12 -0.74 -4.96 117.98 117.26 2fta s PHE 97 Ca 0.03 -1.01 -0.29 0.00 -0.05 0.00 0.00 56.93 55.61 2fta s PHE 97 Cb -0.12 -0.48 -0.01 0.00 -0.63 0.00 0.00 43.02 41.79 2fta s PHE 97 CO 0.01 -0.28 1.23 0.34 -0.05 0.00 0.00 175.22 176.47 2fta s ASP 98 N -3.00 6.92 0.62 1.98 -1.08 -1.26 -1.68 116.67 119.16 2fta s ASP 98 Ca 0.12 1.53 0.30 0.00 -0.52 0.00 0.00 52.55 53.98 2fta s ASP 98 Cb 0.07 -2.54 1.62 0.00 -1.46 0.00 0.00 42.92 40.61 2fta s ASP 98 CO -0.06 -0.81 1.98 0.58 0.52 0.00 0.00 175.17 177.39 2fta h VAL 99 N 5.58 0.27 0.00 1.11 2.07 -1.73 0.18 116.25 123.72 2fta h VAL 99 Ca -0.25 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2fta h VAL 99 Cb 1.09 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2fta h VAL 99 CO 0.99 0.00 0.00 -1.20 0.02 0.00 0.00 177.57 177.38 2fta n SER 100 N -3.45 0.00 0.02 0.57 7.64 -1.26 -1.50 113.62 115.63 2fta n SER 100 Ca 0.03 -0.52 0.13 0.00 1.01 0.00 0.00 58.87 59.52 2fta n SER 100 Cb 0.45 -0.09 0.50 0.00 -1.01 0.00 0.00 64.21 64.06 2fta n SER 100 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2fta n LYS 101 N -1.09 0.06 -4.04 1.43 4.76 0.63 -4.78 118.16 115.14 2fta n LYS 101 Ca 0.16 0.04 -0.31 0.00 -2.87 0.00 0.00 58.31 55.32 2fta n LYS 101 Cb 0.11 -1.56 -0.06 0.00 -1.84 0.00 0.00 35.03 31.68 2fta n LYS 101 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2fta s LEU 102 N -3.31 3.92 0.02 -0.35 1.43 -0.56 -5.08 118.68 114.75 2fta s LEU 102 Ca 0.13 0.07 0.06 0.00 -1.03 0.00 0.00 54.13 53.36 2fta s LEU 102 Cb 0.17 -2.52 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 2fta s LEU 102 CO 0.58 0.19 -0.17 -0.75 0.23 0.00 0.00 176.35 176.44 2fta s LYS 103 N -2.26 2.20 0.20 1.70 2.20 -1.26 -5.04 119.74 117.48 2fta s LYS 103 Ca 0.29 -0.90 -0.30 0.00 -0.36 0.00 0.00 55.97 54.70 2fta s LYS 103 Cb -0.12 -2.25 -0.08 0.00 -1.51 0.00 0.00 37.83 33.87 2fta s LYS 103 CO 0.21 0.56 1.18 -1.21 -0.36 0.00 0.00 175.35 175.73 2fta s GLU 104 N -1.26 4.51 0.00 4.03 2.02 -1.26 -3.21 118.70 123.54 2fta s GLU 104 Ca 0.14 1.86 0.00 0.00 0.02 0.00 0.00 54.97 56.99 2fta s GLU 104 Cb -0.11 -3.24 0.00 0.00 0.10 0.00 0.00 34.13 30.89 2fta s GLU 104 CO 0.04 -0.04 0.00 0.41 0.02 0.00 0.00 175.26 175.69 2fta n GLY 105 N 2.04 2.55 3.86 -1.39 0.00 -1.26 -5.04 105.19 105.96 2fta n GLY 105 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 2fta n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fta s GLU 106 N -0.45 3.89 -0.32 1.61 2.12 -1.20 -5.04 118.70 119.31 2fta s GLU 106 Ca 0.00 0.68 -0.17 0.00 0.36 0.00 0.00 54.97 55.84 2fta s GLU 106 Cb 0.00 -2.31 -0.02 0.00 0.26 0.00 0.00 34.13 32.07 2fta s GLU 106 CO 0.00 -0.08 0.47 -0.65 -0.54 0.00 0.00 175.26 174.46 2fta s GLN 107 N -3.74 3.77 0.05 4.30 -0.21 -1.26 -4.91 119.66 117.67 2fta s GLN 107 Ca 0.55 -0.06 0.05 0.00 0.02 0.00 0.00 55.36 55.92 2fta s GLN 107 Cb -0.10 -3.75 -0.04 0.00 1.00 0.00 0.00 33.01 30.12 2fta s GLN 107 CO 0.28 -0.50 -0.10 0.71 -2.12 0.00 0.00 175.29 173.55 2fta s TYR 108 N 2.27 2.76 -0.02 0.91 2.02 -1.23 -1.67 117.35 122.38 2fta s TYR 108 Ca 0.18 -0.13 0.07 0.00 -0.37 0.00 0.00 57.07 56.81 2fta s TYR 108 Cb -0.16 -1.51 -0.02 0.00 -0.40 0.00 0.00 41.96 39.87 2fta s TYR 108 CO 0.12 0.36 -0.23 -1.64 -1.57 0.00 0.00 175.55 172.59 2fta s MET 109 N -1.70 1.94 0.07 -0.62 -1.94 -0.15 -1.56 119.30 115.33 2fta s MET 109 Ca 0.18 -0.81 0.06 0.00 -1.71 0.00 0.00 55.69 53.42 2fta s MET 109 Cb -0.11 -1.82 -0.04 0.00 2.01 0.00 0.00 34.83 34.88 2fta s MET 109 CO 0.09 0.46 -0.12 -0.59 -0.01 0.00 0.00 175.02 174.84 2fta s PHE 110 N -0.44 2.70 0.21 -0.03 -0.12 -0.20 -2.05 117.98 118.05 2fta s PHE 110 Ca 0.06 -0.17 -0.23 0.00 -0.05 0.00 0.00 56.93 56.54 2fta s PHE 110 Cb -0.10 -1.47 0.05 0.00 -0.63 0.00 0.00 43.02 40.87 2fta s PHE 110 CO -0.00 0.36 0.89 -0.59 -0.05 0.00 0.00 175.22 175.83 2fta s PHE 111 N -1.08 -0.11 -0.19 3.49 -0.71 0.11 -1.28 117.98 118.21 2fta s PHE 111 Ca 0.18 -0.27 -0.05 0.00 -1.04 0.00 0.00 56.93 55.76 2fta s PHE 111 Cb -0.11 0.68 -0.03 0.00 -1.21 0.00 0.00 43.02 42.35 2fta s PHE 111 CO 0.10 -1.00 -0.00 0.00 -1.34 0.00 0.00 175.22 172.98 2fta h THR 113 N 5.30 1.26 -0.00 0.00 1.35 -1.87 -0.62 112.91 118.34 2fta h THR 113 Ca -0.35 -1.21 0.00 0.00 -0.55 0.00 0.00 66.41 64.30 2fta h THR 113 Cb 1.18 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 2fta h THR 113 CO 0.62 0.42 -0.00 -0.81 -0.25 0.00 0.00 175.52 175.50 2fta n PRO 114 N -4.15 0.23 -3.16 4.72 -0.04 -1.26 -3.86 135.00 127.47 2fta n PRO 114 Ca 0.02 -0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.26 2fta n PRO 114 Cb 0.38 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.29 2fta n PRO 114 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2fta n HIS 115 N -1.39 -0.37 0.03 0.54 8.25 -1.02 -4.99 115.22 116.28 2fta n HIS 115 Ca 0.11 -3.54 0.02 0.00 -0.26 0.00 0.00 57.72 54.05 2fta n HIS 115 Cb 0.29 -0.25 0.09 0.00 1.12 0.00 0.00 29.99 31.24 2fta n HIS 115 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2fta n PRO 116 N 1.03 0.02 0.04 -0.41 -0.04 -0.27 -0.21 135.00 135.16 2fta n PRO 116 Ca 0.21 0.47 0.14 0.00 -0.04 0.00 0.00 63.50 64.28 2fta n PRO 116 Cb 0.58 -1.64 0.52 0.00 -0.04 0.00 0.00 33.50 32.92 2fta n PRO 116 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2fta n PHE 117 N -1.57 0.35 -2.85 0.54 1.16 -1.26 -4.24 117.46 109.59 2fta n PHE 117 Ca -0.00 0.10 -0.43 0.00 -1.87 0.00 0.00 57.45 55.25 2fta n PHE 117 Cb 0.07 -0.66 -0.03 0.00 -1.61 0.00 0.00 39.48 37.25 2fta n PHE 117 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 2fta s MET 118 N -3.04 3.27 0.27 3.97 -1.94 0.70 -4.94 119.30 117.59 2fta s MET 118 Ca 0.13 -1.08 -0.10 0.00 -1.71 0.00 0.00 55.69 52.93 2fta s MET 118 Cb 0.16 -4.48 -0.00 0.00 2.01 0.00 0.00 34.83 32.52 2fta s MET 118 CO 0.56 -1.84 0.47 -1.59 -0.01 0.00 0.00 175.02 172.62 2fta s LYS 119 N 3.82 1.65 0.08 2.03 -2.85 -1.26 -2.09 119.74 121.12 2fta s LYS 119 Ca 0.27 -1.40 -0.23 0.00 -1.00 0.00 0.00 55.97 53.61 2fta s LYS 119 Cb -0.12 0.46 0.08 0.00 -2.06 0.00 0.00 37.83 36.19 2fta s LYS 119 CO 0.04 -0.68 1.09 0.41 0.10 0.00 0.00 175.35 176.30 2fta n GLY 120 N -0.42 0.44 3.89 0.59 0.00 -0.40 -4.68 105.19 104.61 2fta n GLY 120 Ca -0.01 -1.09 -0.25 0.00 0.00 0.00 0.00 46.02 44.66 2fta n GLY 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fta s THR 121 N -2.05 4.96 -0.09 2.61 -4.23 -0.89 -1.03 115.64 114.91 2fta s THR 121 Ca 0.25 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.86 2fta s THR 121 Cb -0.02 -3.57 0.02 0.00 1.34 0.00 0.00 72.50 70.27 2fta s THR 121 CO 0.02 -0.14 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.66 2fta s LEU 122 N -3.30 1.35 0.01 4.79 1.98 -0.60 0.49 118.68 123.40 2fta s LEU 122 Ca 0.33 -0.28 0.02 0.00 -2.89 0.00 0.00 54.13 51.32 2fta s LEU 122 Cb -0.10 -0.78 -0.01 0.00 0.66 0.00 0.00 46.19 45.95 2fta s LEU 122 CO 0.26 -0.06 -0.07 -0.89 -1.89 0.00 0.00 176.35 173.70 2fta s THR 123 N 1.25 0.54 -2.27 3.68 2.01 -0.20 -3.57 115.64 117.08 2fta s THR 123 Ca -0.04 -0.59 0.30 0.00 0.31 0.00 0.00 61.69 61.67 2fta s THR 123 Cb -0.14 -0.52 0.71 0.00 0.01 0.00 0.00 72.50 72.57 2fta s THR 123 CO -0.03 -0.05 1.97 0.18 -0.69 0.00 0.00 174.62 176.00