#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ft6 s SER 4 N 0.00 -0.09 -0.03 0.00 1.04 -1.26 -1.58 113.70 111.78 2ft6 s SER 4 Ca 0.00 -0.72 -0.11 0.00 0.48 0.00 0.00 55.95 55.59 2ft6 s SER 4 Cb 0.00 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.64 2ft6 s SER 4 CO 0.00 -0.98 0.24 0.54 0.98 0.00 0.00 173.24 174.02 2ft6 s VAL 5 N -3.94 0.05 -0.19 5.02 0.11 -0.41 -4.95 120.40 116.09 2ft6 s VAL 5 Ca 0.14 -0.45 -0.08 0.00 -2.93 0.00 0.00 61.98 58.67 2ft6 s VAL 5 Cb 0.01 -0.51 -0.04 0.00 -1.53 0.00 0.00 36.38 34.31 2ft6 s VAL 5 CO -0.00 -0.25 0.08 -1.81 -3.33 0.00 0.00 175.10 169.79 2ft6 s ASP 6 N -1.04 5.74 -0.01 3.54 1.01 -1.26 -1.00 116.67 123.65 2ft6 s ASP 6 Ca -0.11 0.09 0.05 0.00 0.71 0.00 0.00 52.55 53.29 2ft6 s ASP 6 Cb -0.05 -2.00 -0.01 0.00 1.01 0.00 0.00 42.92 41.87 2ft6 s ASP 6 CO 0.03 0.15 -0.16 -0.63 0.21 0.00 0.00 175.17 174.77 2ft6 s ILE 7 N 0.50 1.26 0.05 0.77 -1.09 -0.16 -4.95 121.20 117.58 2ft6 s ILE 7 Ca 0.04 -0.71 0.09 0.00 -2.23 0.00 0.00 60.65 57.84 2ft6 s ILE 7 Cb -0.12 -1.06 -0.03 0.00 -1.58 0.00 0.00 42.46 39.67 2ft6 s ILE 7 CO 0.00 0.34 -0.24 -1.10 -1.23 0.00 0.00 174.94 172.71 2ft6 s GLN 8 N -0.43 1.85 -0.06 2.79 -0.21 -1.26 -1.30 119.66 121.04 2ft6 s GLN 8 Ca 0.06 -1.09 0.04 0.00 0.02 0.00 0.00 55.36 54.39 2ft6 s GLN 8 Cb -0.06 -2.03 -0.00 0.00 1.00 0.00 0.00 33.01 31.92 2ft6 s GLN 8 CO -0.00 0.52 -0.19 0.20 -2.12 0.00 0.00 175.29 173.69 2ft6 s GLY 9 N -1.32 1.05 0.23 3.09 0.00 -0.58 -1.45 107.32 108.34 2ft6 s GLY 9 Ca 0.13 -0.77 0.02 0.00 0.00 0.00 0.00 44.72 44.09 2ft6 s GLY 9 CO 0.03 -0.33 0.14 1.16 0.00 0.00 0.00 173.10 174.10 2ft6 n ASN 10 N 3.28 1.92 0.00 1.64 0.23 -0.90 -3.77 115.26 117.67 2ft6 n ASN 10 Ca -0.19 -1.85 0.12 0.00 -0.53 0.00 0.00 54.58 52.13 2ft6 n ASN 10 Cb 0.53 0.02 0.58 0.00 -2.08 0.00 0.00 39.78 38.82 2ft6 n ASN 10 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2ft6 n ASP 11 N -1.78 0.00 -1.61 0.53 8.00 -1.25 -2.70 116.55 117.74 2ft6 n ASP 11 Ca -0.03 0.07 0.08 0.00 0.71 0.00 0.00 54.79 55.63 2ft6 n ASP 11 Cb 0.27 -0.34 0.36 0.00 -0.02 0.00 0.00 41.12 41.40 2ft6 n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ft6 n GLN 12 N -1.34 4.22 -3.57 -1.24 3.00 -1.26 -4.95 117.38 112.24 2ft6 n GLN 12 Ca 0.10 -3.01 -0.21 0.00 -0.01 0.00 0.00 57.00 53.86 2ft6 n GLN 12 Cb 0.21 -2.07 0.08 0.00 0.00 0.00 0.00 30.24 28.45 2ft6 n GLN 12 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 2ft6 n MET 13 N 0.57 -6.95 -5.00 -1.09 2.81 -1.10 -5.00 117.12 101.37 2ft6 n MET 13 Ca 0.26 0.80 -0.29 0.00 -1.81 0.00 0.00 57.70 56.65 2ft6 n MET 13 Cb 1.05 -5.78 -0.17 0.00 -0.71 0.00 0.00 33.22 27.61 2ft6 n MET 13 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2ft6 s GLN 14 N -5.92 2.56 0.43 0.03 -0.21 -1.26 -4.75 119.66 110.53 2ft6 s GLN 14 Ca 0.30 -0.72 -0.20 0.00 0.02 0.00 0.00 55.36 54.76 2ft6 s GLN 14 Cb -0.14 -1.98 -0.11 0.00 1.00 0.00 0.00 33.01 31.79 2ft6 s GLN 14 CO 0.75 0.13 0.94 -0.06 -2.12 0.00 0.00 175.29 174.93 2ft6 s PHE 15 N 0.43 3.32 -2.19 0.91 0.08 -1.26 -2.11 117.98 117.17 2ft6 s PHE 15 Ca -0.17 1.57 0.21 0.00 0.12 0.00 0.00 56.93 58.66 2ft6 s PHE 15 Cb -0.17 -2.82 0.93 0.00 -0.57 0.00 0.00 43.02 40.39 2ft6 s PHE 15 CO 0.07 -0.11 1.64 0.27 -0.10 0.00 0.00 175.22 176.98 2ft6 n ASN 16 N -0.69 1.02 -3.86 1.36 6.94 -0.53 -4.77 115.26 114.74 2ft6 n ASN 16 Ca 0.07 -1.57 -0.10 0.00 -0.02 0.00 0.00 54.58 52.95 2ft6 n ASN 16 Cb 0.54 -0.06 -0.08 0.00 -2.36 0.00 0.00 39.78 37.82 2ft6 n ASN 16 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2ft6 s THR 17 N -1.88 0.11 -0.77 5.53 -1.32 -1.26 -4.98 115.64 111.07 2ft6 s THR 17 Ca 0.32 -0.94 0.07 0.00 -1.21 0.00 0.00 61.69 59.93 2ft6 s THR 17 Cb 0.16 -0.94 0.14 0.00 -1.51 0.00 0.00 72.50 70.36 2ft6 s THR 17 CO 0.25 -0.52 0.99 -0.46 -2.21 0.00 0.00 174.62 172.67 2ft6 n ASN 18 N 0.65 2.20 -3.69 8.08 6.94 -1.26 -4.88 115.26 123.30 2ft6 n ASN 18 Ca -0.19 -1.70 -0.11 0.00 -0.02 0.00 0.00 54.58 52.56 2ft6 n ASN 18 Cb 0.59 -0.09 -0.11 0.00 -2.36 0.00 0.00 39.78 37.81 2ft6 n ASN 18 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2ft6 s ALA 19 N -0.84 -0.93 -0.06 -2.53 0.00 -1.26 -1.25 121.76 114.89 2ft6 s ALA 19 Ca 0.13 1.37 0.05 0.00 0.00 0.00 0.00 51.96 53.50 2ft6 s ALA 19 Cb 0.07 -0.97 -0.02 0.00 0.00 0.00 0.00 23.12 22.21 2ft6 s ALA 19 CO 0.10 -0.39 -0.20 0.42 0.00 0.00 0.00 175.76 175.69 2ft6 s ILE 20 N 1.73 2.56 0.01 0.00 1.01 -0.03 -4.97 121.20 121.51 2ft6 s ILE 20 Ca -0.07 -0.89 0.08 0.00 0.00 0.00 0.00 60.65 59.77 2ft6 s ILE 20 Cb -0.10 -1.98 -0.02 0.00 0.01 0.00 0.00 42.46 40.37 2ft6 s ILE 20 CO -0.12 0.57 -0.25 0.42 0.00 0.00 0.00 174.94 175.57 2ft6 s THR 21 N -0.35 1.96 -0.18 2.92 -4.23 -1.26 -1.41 115.64 113.09 2ft6 s THR 21 Ca 0.03 -1.16 -0.00 0.00 -1.18 0.00 0.00 61.69 59.37 2ft6 s THR 21 Cb -0.12 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.07 2ft6 s THR 21 CO 0.02 0.46 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.73 2ft6 s VAL 22 N -0.66 2.63 0.25 2.29 1.01 -0.19 -4.91 120.40 120.82 2ft6 s VAL 22 Ca 0.10 -0.76 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2ft6 s VAL 22 Cb -0.10 -2.13 -0.10 0.00 0.00 0.00 0.00 36.38 34.05 2ft6 s VAL 22 CO 0.00 0.50 1.42 -0.62 0.00 0.00 0.00 175.10 176.40 2ft6 s ASP 23 N 1.11 6.69 0.21 3.32 -1.08 -1.26 -0.17 116.67 125.49 2ft6 s ASP 23 Ca 0.00 2.63 0.20 0.00 -0.52 0.00 0.00 52.55 54.86 2ft6 s ASP 23 Cb -0.14 -2.62 0.89 0.00 -1.46 0.00 0.00 42.92 39.59 2ft6 s ASP 23 CO -0.05 -0.67 1.60 0.29 0.52 0.00 0.00 175.17 176.87 2ft6 n LYS 24 N 2.31 0.14 0.13 4.34 5.02 -1.26 -1.30 118.16 127.54 2ft6 n LYS 24 Ca 0.06 0.45 0.13 0.00 -2.02 0.00 0.00 58.31 56.93 2ft6 n LYS 24 Cb 0.41 -1.80 0.47 0.00 -0.02 0.00 0.00 35.03 34.08 2ft6 n LYS 24 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2ft6 h SER 25 N 0.00 0.00 -3.15 4.39 4.64 -1.97 -3.44 113.55 114.02 2ft6 h SER 25 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 2ft6 h SER 25 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 2ft6 h SER 25 CO 0.00 0.00 0.62 0.00 -0.87 0.00 0.00 176.83 176.58 2ft6 h LYS 27 N 7.17 0.26 -5.38 0.00 1.79 -1.88 -3.43 116.57 115.10 2ft6 h LYS 27 Ca -0.38 -0.45 -0.40 0.00 -2.18 0.00 0.00 60.65 57.24 2ft6 h LYS 27 Cb 1.19 0.17 -0.15 0.00 -1.58 0.00 0.00 32.23 31.86 2ft6 h LYS 27 CO 0.84 1.13 -0.73 1.14 -1.08 0.00 0.00 179.45 180.76 2ft6 s GLN 28 N -2.61 1.21 0.00 3.15 -2.07 -1.26 -1.41 119.66 116.66 2ft6 s GLN 28 Ca -0.09 -1.51 0.01 0.00 -1.82 0.00 0.00 55.36 51.95 2ft6 s GLN 28 Cb 0.07 -0.93 -0.00 0.00 -1.09 0.00 0.00 33.01 31.05 2ft6 s GLN 28 CO 0.85 0.15 -0.03 0.12 -1.32 0.00 0.00 175.29 175.06 2ft6 s PHE 29 N -3.02 0.24 -0.08 9.60 5.36 -0.31 -4.85 117.98 124.92 2ft6 s PHE 29 Ca 0.19 -0.10 0.04 0.00 -0.96 0.00 0.00 56.93 56.11 2ft6 s PHE 29 Cb 0.00 -0.16 0.00 0.00 -0.34 0.00 0.00 43.02 42.52 2ft6 s PHE 29 CO 0.04 -0.02 -0.21 0.99 -1.46 0.00 0.00 175.22 174.57 2ft6 s THR 30 N -0.21 1.77 -0.19 0.12 2.01 -0.62 -1.05 115.64 117.47 2ft6 s THR 30 Ca -0.01 -0.86 -0.05 0.00 0.31 0.00 0.00 61.69 61.08 2ft6 s THR 30 Cb -0.02 -1.54 -0.03 0.00 0.01 0.00 0.00 72.50 70.93 2ft6 s THR 30 CO -0.00 0.50 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.73 2ft6 s VAL 31 N 0.33 3.95 -0.43 3.82 1.01 0.26 -1.29 120.40 128.05 2ft6 s VAL 31 Ca -0.15 -0.32 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 2ft6 s VAL 31 Cb -0.16 -2.78 0.08 0.00 0.00 0.00 0.00 36.38 33.52 2ft6 s VAL 31 CO 0.06 0.44 0.30 0.20 0.00 0.00 0.00 175.10 176.10 2ft6 s ASN 32 N 0.86 5.78 -0.05 3.32 0.01 -0.17 -1.33 114.94 123.37 2ft6 s ASN 32 Ca 0.01 -1.44 -0.14 0.00 -0.71 0.00 0.00 52.86 50.58 2ft6 s ASN 32 Cb -0.14 -2.04 -0.05 0.00 0.41 0.00 0.00 41.25 39.42 2ft6 s ASN 32 CO 0.02 -0.56 0.35 -0.22 -1.51 0.00 0.00 177.10 175.18 2ft6 s LEU 33 N 1.49 4.42 0.30 0.60 2.96 0.03 -0.99 118.68 127.49 2ft6 s LEU 33 Ca 0.03 0.82 0.04 0.00 -0.22 0.00 0.00 54.13 54.80 2ft6 s LEU 33 Cb -0.23 -2.48 -0.03 0.00 0.50 0.00 0.00 46.19 43.94 2ft6 s LEU 33 CO 0.03 0.29 0.20 -0.94 -1.32 0.00 0.00 176.35 174.62 2ft6 s SER 34 N -0.79 1.42 -0.42 3.68 1.04 -0.42 -1.78 113.70 116.44 2ft6 s SER 34 Ca 0.22 -1.62 0.04 0.00 0.48 0.00 0.00 55.95 55.07 2ft6 s SER 34 Cb -0.15 0.47 0.17 0.00 0.10 0.00 0.00 66.02 66.60 2ft6 s SER 34 CO 0.11 -0.95 0.43 -2.28 0.98 0.00 0.00 173.24 171.52 2ft6 s HIS 35 N -3.62 0.09 0.86 5.02 2.46 -1.23 -1.52 115.29 117.35 2ft6 s HIS 35 Ca 0.37 -1.50 -0.13 0.00 0.47 0.00 0.00 55.06 54.28 2ft6 s HIS 35 Cb 0.04 -0.50 0.07 0.00 -0.13 0.00 0.00 32.58 32.06 2ft6 s HIS 35 CO 0.20 -0.97 0.86 -2.30 -2.47 0.00 0.00 174.74 170.07 2ft6 n PRO 36 N 3.30 -0.07 0.00 2.88 -0.02 -1.25 -1.59 135.00 138.26 2ft6 n PRO 36 Ca 0.21 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2ft6 n PRO 36 Cb 0.48 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2ft6 n PRO 36 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ft6 n GLY 37 N 0.93 0.41 0.00 -1.23 0.00 -1.26 -3.80 105.19 100.24 2ft6 n GLY 37 Ca 0.11 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.89 2ft6 n GLY 37 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ft6 n ASN 38 N 0.56 0.51 -4.85 1.61 0.23 -1.26 -4.62 115.26 107.44 2ft6 n ASN 38 Ca 0.00 -0.80 -0.36 0.00 -0.53 0.00 0.00 54.58 52.89 2ft6 n ASN 38 Cb 0.00 0.23 -0.06 0.00 -2.08 0.00 0.00 39.78 37.87 2ft6 n ASN 38 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2ft6 s LEU 39 N -0.46 4.37 0.81 -4.53 1.43 -1.26 -4.87 118.68 114.17 2ft6 s LEU 39 Ca 0.00 0.94 -0.11 0.00 -1.03 0.00 0.00 54.13 53.93 2ft6 s LEU 39 Cb 0.00 -3.03 0.10 0.00 0.03 0.00 0.00 46.19 43.29 2ft6 s LEU 39 CO 0.00 0.17 1.16 -2.16 0.23 0.00 0.00 176.35 175.76 2ft6 s PRO 40 N -1.77 1.74 0.42 1.29 0.04 -1.26 -1.27 135.00 134.19 2ft6 s PRO 40 Ca 0.33 -0.13 0.10 0.00 0.04 0.00 0.00 61.00 61.34 2ft6 s PRO 40 Cb -0.15 -2.00 0.89 0.00 0.04 0.00 0.00 34.50 33.28 2ft6 s PRO 40 CO 0.18 -1.67 2.00 -0.22 0.04 0.00 0.00 177.00 177.33 2ft6 h LYS 41 N -1.05 0.30 0.00 4.56 3.64 -1.84 0.19 116.57 122.37 2ft6 h LYS 41 Ca -0.45 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2ft6 h LYS 41 Cb 1.30 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2ft6 h LYS 41 CO 0.58 0.31 0.00 -2.95 -2.27 0.00 0.00 179.45 175.12 2ft6 h ASN 42 N 0.30 0.00 0.00 4.20 -1.07 -1.96 -1.95 115.58 115.11 2ft6 h ASN 42 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.44 2ft6 h ASN 42 Cb 0.17 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.42 2ft6 h ASN 42 CO 0.00 0.00 -0.40 1.33 0.07 0.00 0.00 177.43 178.43 2ft6 n VAL 43 N -2.66 0.00 -2.70 6.14 0.24 -1.00 -4.83 118.33 113.52 2ft6 n VAL 43 Ca 0.03 -0.32 -0.06 0.00 -2.04 0.00 0.00 64.34 61.94 2ft6 n VAL 43 Cb 0.36 0.82 0.08 0.00 -1.47 0.00 0.00 33.84 33.63 2ft6 n VAL 43 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 2ft6 n MET 44 N -1.20 1.25 -2.54 7.34 0.00 0.02 -5.00 117.12 116.99 2ft6 n MET 44 Ca 0.00 -2.41 -0.40 0.00 -0.00 0.00 0.00 57.70 54.89 2ft6 n MET 44 Cb 0.02 -0.55 -0.05 0.00 0.00 0.00 0.00 33.22 32.64 2ft6 n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2ft6 s GLY 45 N -2.12 3.04 0.08 -5.12 0.00 -0.73 -4.68 107.32 97.79 2ft6 s GLY 45 Ca 0.23 0.82 0.09 0.00 0.00 0.00 0.00 44.72 45.85 2ft6 s GLY 45 CO -0.04 1.46 -0.22 0.30 0.00 0.00 0.00 173.10 174.59 2ft6 s HIS 46 N -0.99 1.94 0.39 1.90 3.76 -0.41 -4.86 115.29 117.03 2ft6 s HIS 46 Ca 0.45 -0.40 0.04 0.00 -0.15 0.00 0.00 55.06 55.00 2ft6 s HIS 46 Cb -0.30 -1.10 -0.05 0.00 1.11 0.00 0.00 32.58 32.24 2ft6 s HIS 46 CO 0.38 0.19 0.05 0.54 -0.85 0.00 0.00 174.74 175.05 2ft6 s ASN 47 N -1.66 3.09 -0.12 1.40 2.20 -1.26 -0.65 114.94 117.93 2ft6 s ASN 47 Ca 0.09 -1.49 -0.01 0.00 -0.94 0.00 0.00 52.86 50.51 2ft6 s ASN 47 Cb -0.10 0.09 0.03 0.00 -2.00 0.00 0.00 41.25 39.27 2ft6 s ASN 47 CO 0.04 -0.69 -0.06 0.86 -2.94 0.00 0.00 177.10 174.30 2ft6 s TRP 48 N -3.08 1.47 -0.03 1.54 -0.00 -1.26 -3.89 118.94 113.69 2ft6 s TRP 48 Ca 0.28 -0.78 0.03 0.00 -0.00 0.00 0.00 56.10 55.63 2ft6 s TRP 48 Cb 0.06 -1.22 0.00 0.00 -0.00 0.00 0.00 33.47 32.31 2ft6 s TRP 48 CO 0.14 -0.53 -0.11 0.08 -0.00 0.00 0.00 176.95 176.53 2ft6 s VAL 49 N 1.71 0.93 -0.13 5.86 1.01 -0.00 -1.03 120.40 128.75 2ft6 s VAL 49 Ca 0.04 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.59 2ft6 s VAL 49 Cb -0.13 -0.81 -0.00 0.00 0.00 0.00 0.00 36.38 35.43 2ft6 s VAL 49 CO -0.08 0.28 -0.19 -0.22 0.00 0.00 0.00 175.10 174.89 2ft6 s LEU 50 N 0.11 2.35 0.28 3.92 2.96 -0.28 -0.89 118.68 127.14 2ft6 s LEU 50 Ca -0.02 -0.49 -0.10 0.00 -0.22 0.00 0.00 54.13 53.30 2ft6 s LEU 50 Cb -0.09 -1.50 0.00 0.00 0.50 0.00 0.00 46.19 45.10 2ft6 s LEU 50 CO 0.01 0.13 0.49 -0.94 -1.32 0.00 0.00 176.35 174.72 2ft6 s SER 51 N 0.55 0.18 0.81 3.68 1.04 -0.85 -0.75 113.70 118.36 2ft6 s SER 51 Ca -0.11 -1.11 -0.12 0.00 0.48 0.00 0.00 55.95 55.09 2ft6 s SER 51 Cb -0.16 0.62 0.08 0.00 0.10 0.00 0.00 66.02 66.66 2ft6 s SER 51 CO 0.04 -1.22 1.16 0.42 0.98 0.00 0.00 173.24 174.62 2ft6 s THR 52 N -3.62 2.39 0.25 2.02 -4.23 -1.26 -1.06 115.64 110.13 2ft6 s THR 52 Ca 0.24 0.15 -0.04 0.00 -1.18 0.00 0.00 61.69 60.87 2ft6 s THR 52 Cb -0.01 -2.50 0.25 0.00 1.34 0.00 0.00 72.50 71.59 2ft6 s THR 52 CO 0.12 -0.14 1.89 0.00 -0.54 0.00 0.00 174.62 175.96 2ft6 h ALA 53 N -1.02 1.31 -0.23 3.99 0.00 -1.25 -2.23 119.26 119.82 2ft6 h ALA 53 Ca -0.45 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 2ft6 h ALA 53 Cb 1.27 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2ft6 h ALA 53 CO 0.47 0.49 -0.13 0.00 0.00 0.00 0.00 179.25 180.08 2ft6 h ALA 54 N 1.41 1.35 0.00 0.00 0.00 -1.92 -2.83 119.26 117.28 2ft6 h ALA 54 Ca 0.40 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2ft6 h ALA 54 Cb 0.05 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2ft6 h ALA 54 CO -0.14 0.44 -0.27 -0.25 0.00 0.00 0.00 179.25 179.03 2ft6 n ASP 55 N -4.23 0.52 -0.08 0.00 8.00 -0.88 -4.38 116.55 115.50 2ft6 n ASP 55 Ca 0.00 0.27 -0.07 0.00 0.71 0.00 0.00 54.79 55.70 2ft6 n ASP 55 Cb 0.30 -0.25 -0.00 0.00 -0.02 0.00 0.00 41.12 41.15 2ft6 n ASP 55 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 2ft6 h MET 56 N 0.00 0.06 -0.45 -1.24 1.85 -1.19 -1.92 114.93 112.04 2ft6 h MET 56 Ca 0.00 -0.00 0.03 0.00 -0.61 0.00 0.00 59.70 59.12 2ft6 h MET 56 Cb 0.63 -0.01 -0.04 0.00 0.43 0.00 0.00 31.60 32.62 2ft6 h MET 56 CO 0.00 0.04 0.24 0.37 -0.40 0.00 0.00 176.91 177.16 2ft6 h GLN 57 N 0.06 0.46 -0.60 0.39 4.15 -1.78 -0.59 115.11 117.20 2ft6 h GLN 57 Ca 0.14 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.45 2ft6 h GLN 57 Cb 0.20 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 2ft6 h GLN 57 CO -0.26 0.31 0.05 0.78 -1.93 0.00 0.00 178.83 177.77 2ft6 h GLY 58 N 0.48 1.09 0.98 2.39 0.00 -1.76 -0.29 103.07 105.96 2ft6 h GLY 58 Ca 0.19 -0.75 0.01 0.00 0.00 0.00 0.00 47.33 46.78 2ft6 h GLY 58 CO -0.12 0.69 0.27 -2.08 0.00 0.00 0.00 176.54 175.30 2ft6 h VAL 59 N 0.94 1.09 -0.06 4.60 2.07 -0.88 -0.88 116.25 123.13 2ft6 h VAL 59 Ca 0.18 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2ft6 h VAL 59 Cb 0.48 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 2ft6 h VAL 59 CO 0.02 0.10 0.01 0.58 0.02 0.00 0.00 177.57 178.30 2ft6 h VAL 60 N 0.54 1.19 -0.11 2.57 2.07 -0.95 0.30 116.25 121.87 2ft6 h VAL 60 Ca 0.16 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2ft6 h VAL 60 Cb -0.04 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2ft6 h VAL 60 CO -0.04 0.16 0.07 0.74 0.02 0.00 0.00 177.57 178.52 2ft6 h THR 61 N -0.12 1.04 -0.18 2.57 2.02 -0.95 -0.10 112.91 117.19 2ft6 h THR 61 Ca 0.02 -0.09 -0.12 0.00 0.77 0.00 0.00 66.41 66.99 2ft6 h THR 61 Cb 0.24 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 2ft6 h THR 61 CO 0.00 0.04 -0.39 0.44 0.37 0.00 0.00 175.52 175.98 2ft6 h ASP 62 N 0.13 0.41 -0.54 4.18 3.32 -1.17 -2.17 116.42 120.59 2ft6 h ASP 62 Ca 0.04 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 2ft6 h ASP 62 Cb 0.00 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2ft6 h ASP 62 CO -0.01 0.77 0.20 1.23 -1.72 0.00 0.00 179.24 179.71 2ft6 h GLY 63 N 1.14 0.88 1.61 2.75 0.00 -0.51 -2.14 103.07 106.79 2ft6 h GLY 63 Ca 0.03 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 2ft6 h GLY 63 CO 0.07 0.46 -0.18 -0.33 0.00 0.00 0.00 176.54 176.56 2ft6 h MET 64 N 0.74 0.46 0.00 4.80 2.86 -0.85 -1.45 114.93 121.49 2ft6 h MET 64 Ca 0.18 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 2ft6 h MET 64 Cb 0.23 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.84 2ft6 h MET 64 CO -0.01 0.63 -0.06 0.00 1.06 0.00 0.00 176.91 178.54 2ft6 h ALA 65 N 1.39 1.07 0.02 6.32 0.00 -1.17 -3.15 119.26 123.73 2ft6 h ALA 65 Ca 0.07 -0.05 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 2ft6 h ALA 65 Cb 0.56 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2ft6 h ALA 65 CO 0.04 0.07 -1.38 0.77 0.00 0.00 0.00 179.25 178.75 2ft6 h SER 66 N 0.00 0.07 -4.43 0.00 0.02 -0.61 -3.50 113.55 105.11 2ft6 h SER 66 Ca -0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 2ft6 h SER 66 Cb 0.40 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.91 2ft6 h SER 66 CO 0.01 1.08 0.00 0.61 -1.14 0.00 0.00 176.83 177.39 2ft6 n GLY 67 N 1.49 -0.55 0.13 -3.77 0.00 -0.94 -4.46 105.19 97.08 2ft6 n GLY 67 Ca -0.10 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.04 2ft6 n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ft6 h LEU 68 N 0.00 0.32 0.00 0.99 5.85 -1.90 -0.44 115.31 120.13 2ft6 h LEU 68 Ca 0.00 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.60 2ft6 h LEU 68 Cb 0.00 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2ft6 h LEU 68 CO 0.00 0.35 0.00 -0.67 -0.34 0.00 0.00 178.44 177.78 2ft6 n ASP 69 N -4.83 0.00 -1.49 1.25 2.03 -1.26 -0.91 116.55 111.34 2ft6 n ASP 69 Ca -0.03 0.23 0.08 0.00 0.52 0.00 0.00 54.79 55.60 2ft6 n ASP 69 Cb 0.09 -0.38 0.34 0.00 -0.72 0.00 0.00 41.12 40.46 2ft6 n ASP 69 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2ft6 n LYS 70 N -1.38 4.01 -1.92 -0.67 4.01 -0.81 -4.95 118.16 116.46 2ft6 n LYS 70 Ca 0.07 -2.97 -0.17 0.00 -0.51 0.00 0.00 58.31 54.73 2ft6 n LYS 70 Cb 0.18 -2.02 -0.04 0.00 -0.51 0.00 0.00 35.03 32.63 2ft6 n LYS 70 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 2ft6 n ASP 71 N 0.42 -5.12 -3.93 4.39 8.00 -0.09 -2.00 116.55 118.22 2ft6 n ASP 71 Ca 0.25 0.21 -0.30 0.00 0.71 0.00 0.00 54.79 55.66 2ft6 n ASP 71 Cb 1.01 -4.18 0.02 0.00 -0.02 0.00 0.00 41.12 37.95 2ft6 n ASP 71 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2ft6 n TYR 72 N -3.26 -2.18 -4.02 1.24 4.01 -0.24 -4.62 117.16 108.10 2ft6 n TYR 72 Ca -0.19 0.88 -0.15 0.00 -0.16 0.00 0.00 57.90 58.28 2ft6 n TYR 72 Cb 0.62 -3.91 -0.15 0.00 -0.31 0.00 0.00 39.34 35.59 2ft6 n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2ft6 s LEU 73 N -7.21 1.82 0.07 7.72 1.43 -0.85 -4.12 118.68 117.55 2ft6 s LEU 73 Ca 0.58 -0.05 -0.31 0.00 -1.03 0.00 0.00 54.13 53.32 2ft6 s LEU 73 Cb -0.29 -0.17 -0.07 0.00 0.03 0.00 0.00 46.19 45.68 2ft6 s LEU 73 CO 0.84 0.01 1.43 -0.75 0.23 0.00 0.00 176.35 178.10 2ft6 s LYS 74 N 0.17 4.29 0.31 1.70 2.20 -1.26 -4.83 119.74 122.33 2ft6 s LYS 74 Ca -0.01 2.07 -0.29 0.00 -0.36 0.00 0.00 55.97 57.38 2ft6 s LYS 74 Cb -0.04 -3.39 -0.12 0.00 -1.51 0.00 0.00 37.83 32.77 2ft6 s LYS 74 CO -0.00 -0.52 1.38 -2.30 -0.36 0.00 0.00 175.35 173.55 2ft6 n PRO 75 N 4.59 2.24 -2.55 4.03 -0.02 -1.26 -2.38 135.00 139.66 2ft6 n PRO 75 Ca 0.13 0.79 -0.21 0.00 -2.02 0.00 0.00 63.50 62.19 2ft6 n PRO 75 Cb 0.42 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 2ft6 n PRO 75 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2ft6 n ASP 76 N 1.28 -5.87 -4.63 2.55 8.00 -1.26 -4.90 116.55 111.71 2ft6 n ASP 76 Ca 0.07 -0.07 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 2ft6 n ASP 76 Cb 0.35 -4.86 -0.03 0.00 -0.02 0.00 0.00 41.12 36.57 2ft6 n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2ft6 s ASP 77 N -2.20 6.42 0.00 -2.24 -1.08 -1.00 -4.85 116.67 111.72 2ft6 s ASP 77 Ca 0.07 1.73 0.19 0.00 -0.52 0.00 0.00 52.55 54.02 2ft6 s ASP 77 Cb -0.03 -2.53 0.86 0.00 -1.46 0.00 0.00 42.92 39.76 2ft6 s ASP 77 CO 0.09 -1.20 1.60 -1.54 0.52 0.00 0.00 175.17 174.63 2ft6 n SER 78 N 8.25 0.00 0.12 -0.34 3.41 -1.26 -2.09 113.62 121.70 2ft6 n SER 78 Ca 0.19 0.32 0.13 0.00 -0.26 0.00 0.00 58.87 59.24 2ft6 n SER 78 Cb 0.45 -0.42 0.31 0.00 -0.26 0.00 0.00 64.21 64.29 2ft6 n SER 78 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2ft6 h ARG 79 N 0.00 0.00 -5.82 4.33 3.08 -1.97 -3.44 114.38 110.56 2ft6 h ARG 79 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 2ft6 h ARG 79 Cb 0.27 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.19 2ft6 h ARG 79 CO 0.00 0.00 0.38 0.08 -1.07 0.00 0.00 179.97 179.36 2ft6 s VAL 80 N -3.14 4.64 0.17 2.04 1.01 -0.89 -4.51 120.40 119.72 2ft6 s VAL 80 Ca 0.09 0.50 -0.06 0.00 0.00 0.00 0.00 61.98 62.51 2ft6 s VAL 80 Cb 0.11 -4.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.12 2ft6 s VAL 80 CO 0.64 -0.70 1.49 0.40 0.00 0.00 0.00 175.10 176.93 2ft6 h ILE 81 N 5.97 1.30 -2.01 2.22 2.04 -1.24 -3.47 117.51 122.32 2ft6 h ILE 81 Ca -0.25 -1.70 -0.06 0.00 1.00 0.00 0.00 64.86 63.86 2ft6 h ILE 81 Cb 1.09 1.62 -0.19 0.00 -0.74 0.00 0.00 36.82 38.59 2ft6 h ILE 81 CO 0.96 0.54 0.17 0.00 0.00 0.00 0.00 178.15 179.83 2ft6 s ALA 82 N -4.15 -1.77 0.01 1.87 0.00 -1.23 -4.97 121.76 111.54 2ft6 s ALA 82 Ca -0.09 1.48 -0.22 0.00 0.00 0.00 0.00 51.96 53.12 2ft6 s ALA 82 Cb 0.11 -0.27 0.05 0.00 0.00 0.00 0.00 23.12 23.01 2ft6 s ALA 82 CO 0.86 -0.36 0.50 -3.38 0.00 0.00 0.00 175.76 173.38 2ft6 s HIS 83 N -0.83 -0.41 0.75 0.00 -3.43 -1.26 -1.12 115.29 108.99 2ft6 s HIS 83 Ca -0.08 0.55 -0.05 0.00 -0.80 0.00 0.00 55.06 54.68 2ft6 s HIS 83 Cb -0.01 0.29 0.11 0.00 -1.43 0.00 0.00 32.58 31.54 2ft6 s HIS 83 CO 0.08 -0.58 1.04 0.95 -2.00 0.00 0.00 174.74 174.24 2ft6 s THR 84 N -1.93 2.21 0.84 -5.38 -4.23 -0.20 -4.80 115.64 102.14 2ft6 s THR 84 Ca -0.08 -0.39 -0.13 0.00 -1.18 0.00 0.00 61.69 59.91 2ft6 s THR 84 Cb -0.01 -2.82 0.11 0.00 1.34 0.00 0.00 72.50 71.11 2ft6 s THR 84 CO 0.02 0.00 1.21 -1.59 -0.54 0.00 0.00 174.62 173.72 2ft6 s LYS 85 N -5.28 1.67 0.08 3.99 0.00 -1.26 -4.59 119.74 114.34 2ft6 s LYS 85 Ca 0.65 0.02 -0.30 0.00 0.00 0.00 0.00 55.97 56.34 2ft6 s LYS 85 Cb -0.07 -1.92 -0.05 0.00 0.00 0.00 0.00 37.83 35.78 2ft6 s LYS 85 CO 0.46 -1.79 0.99 -1.17 0.00 0.00 0.00 175.35 173.84 2ft6 s LEU 86 N -5.66 4.45 0.03 2.77 2.96 -1.26 -4.43 118.68 117.55 2ft6 s LEU 86 Ca 0.64 1.79 0.07 0.00 -0.22 0.00 0.00 54.13 56.41 2ft6 s LEU 86 Cb -0.10 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.99 2ft6 s LEU 86 CO 0.50 -0.15 -0.20 0.27 -1.32 0.00 0.00 176.35 175.45 2ft6 s ILE 87 N 0.33 1.61 0.33 6.68 -4.36 0.18 -4.89 121.20 121.08 2ft6 s ILE 87 Ca 0.49 -1.13 0.04 0.00 -0.26 0.00 0.00 60.65 59.79 2ft6 s ILE 87 Cb -0.23 -1.40 0.06 0.00 1.25 0.00 0.00 42.46 42.14 2ft6 s ILE 87 CO 0.30 0.23 0.46 0.61 0.24 0.00 0.00 174.94 176.77 2ft6 n GLY 88 N 1.96 1.73 3.76 6.27 0.00 -1.26 -1.28 105.19 116.38 2ft6 n GLY 88 Ca -0.17 -2.15 -0.39 0.00 0.00 0.00 0.00 46.02 43.31 2ft6 n GLY 88 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ft6 s SER 89 N -3.03 5.89 0.00 1.61 1.04 -0.39 -1.76 113.70 117.05 2ft6 s SER 89 Ca 0.34 2.82 0.00 0.00 0.48 0.00 0.00 55.95 59.59 2ft6 s SER 89 Cb -0.03 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.45 2ft6 s SER 89 CO 0.22 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.89 2ft6 n GLY 90 N 0.62 2.97 3.91 7.32 0.00 -0.62 -4.94 105.19 114.45 2ft6 n GLY 90 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 2ft6 n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ft6 s GLU 91 N -0.09 2.95 0.01 1.61 2.02 -0.72 -4.91 118.70 119.56 2ft6 s GLU 91 Ca 0.00 0.05 -0.02 0.00 0.02 0.00 0.00 54.97 55.02 2ft6 s GLU 91 Cb 0.00 -2.25 -0.01 0.00 0.10 0.00 0.00 34.13 31.96 2ft6 s GLU 91 CO 0.00 -0.71 0.01 0.15 0.02 0.00 0.00 175.26 174.73 2ft6 s LYS 92 N -5.01 0.31 -0.09 1.61 1.02 -1.26 -3.55 119.74 112.77 2ft6 s LYS 92 Ca 0.54 -0.50 -0.15 0.00 0.02 0.00 0.00 55.97 55.88 2ft6 s LYS 92 Cb -0.11 0.12 0.03 0.00 -0.52 0.00 0.00 37.83 37.36 2ft6 s LYS 92 CO 0.46 -0.06 0.38 0.34 -0.92 0.00 0.00 175.35 175.55 2ft6 s ASP 93 N -1.29 -0.34 0.06 2.83 2.15 -0.73 -5.02 116.67 114.33 2ft6 s ASP 93 Ca -0.14 0.51 0.07 0.00 0.43 0.00 0.00 52.55 53.42 2ft6 s ASP 93 Cb -0.08 0.59 -0.03 0.00 -0.30 0.00 0.00 42.92 43.09 2ft6 s ASP 93 CO -0.00 -0.29 -0.17 -0.44 -0.17 0.00 0.00 175.17 174.09 2ft6 s SER 94 N -0.51 3.90 -0.00 -0.34 0.01 -1.26 -0.79 113.70 114.71 2ft6 s SER 94 Ca -0.06 -0.43 0.03 0.00 1.31 0.00 0.00 55.95 56.80 2ft6 s SER 94 Cb -0.04 -0.64 -0.01 0.00 0.21 0.00 0.00 66.02 65.54 2ft6 s SER 94 CO 0.03 0.24 -0.11 0.54 0.41 0.00 0.00 173.24 174.35 2ft6 s VAL 95 N -0.98 0.87 -0.02 3.43 0.11 -0.44 -4.90 120.40 118.46 2ft6 s VAL 95 Ca 0.16 -0.52 0.08 0.00 -2.93 0.00 0.00 61.98 58.77 2ft6 s VAL 95 Cb -0.11 -0.74 -0.02 0.00 -1.53 0.00 0.00 36.38 33.99 2ft6 s VAL 95 CO 0.07 0.21 -0.26 -0.89 -3.33 0.00 0.00 175.10 170.90 2ft6 s THR 96 N -0.33 2.03 0.08 5.04 2.01 -1.26 -0.57 115.64 122.64 2ft6 s THR 96 Ca 0.04 -1.10 0.00 0.00 0.31 0.00 0.00 61.69 60.94 2ft6 s THR 96 Cb -0.05 -1.69 -0.04 0.00 0.01 0.00 0.00 72.50 70.74 2ft6 s THR 96 CO -0.00 0.57 -0.03 0.72 -0.69 0.00 0.00 174.62 175.19 2ft6 s PHE 97 N -0.60 0.71 -0.26 4.92 -0.71 -0.22 -4.96 117.98 116.86 2ft6 s PHE 97 Ca 0.10 -1.03 -0.29 0.00 -1.04 0.00 0.00 56.93 54.67 2ft6 s PHE 97 Cb -0.10 -0.45 0.01 0.00 -1.21 0.00 0.00 43.02 41.27 2ft6 s PHE 97 CO -0.01 -0.31 1.03 0.34 -1.34 0.00 0.00 175.22 174.93 2ft6 s ASP 98 N -2.98 7.03 0.57 1.98 -1.08 -1.26 -1.17 116.67 119.76 2ft6 s ASP 98 Ca 0.11 1.25 0.34 0.00 -0.52 0.00 0.00 52.55 53.73 2ft6 s ASP 98 Cb 0.07 -2.53 1.74 0.00 -1.46 0.00 0.00 42.92 40.74 2ft6 s ASP 98 CO -0.07 -0.71 2.15 0.58 0.52 0.00 0.00 175.17 177.65 2ft6 h VAL 99 N 5.52 0.30 0.00 1.11 2.07 -1.50 -1.43 116.25 122.32 2ft6 h VAL 99 Ca -0.20 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2ft6 h VAL 99 Cb 1.06 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 2ft6 h VAL 99 CO 0.98 0.05 0.00 -1.54 0.02 0.00 0.00 177.57 177.09 2ft6 n SER 100 N -3.39 0.05 0.18 0.57 3.41 -1.26 -1.71 113.62 111.47 2ft6 n SER 100 Ca -0.02 0.52 0.14 0.00 -0.26 0.00 0.00 58.87 59.25 2ft6 n SER 100 Cb 0.19 -0.53 0.58 0.00 -0.26 0.00 0.00 64.21 64.19 2ft6 n SER 100 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2ft6 h LYS 101 N 0.00 0.00 -5.39 4.33 6.56 -1.65 -3.42 116.57 117.00 2ft6 h LYS 101 Ca 0.00 0.00 -0.63 0.00 -1.06 0.00 0.00 60.65 58.96 2ft6 h LYS 101 Cb 0.19 0.00 -0.14 0.00 -0.57 0.00 0.00 32.23 31.71 2ft6 h LYS 101 CO 0.00 0.00 0.06 -0.51 -2.06 0.00 0.00 179.45 176.94 2ft6 s LEU 102 N -5.02 4.26 0.02 2.94 1.43 -0.69 -5.03 118.68 116.59 2ft6 s LEU 102 Ca 0.03 0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 53.26 2ft6 s LEU 102 Cb 0.09 -2.71 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 2ft6 s LEU 102 CO 0.42 -0.52 0.18 -0.54 0.23 0.00 0.00 176.35 176.12 2ft6 s LYS 103 N 2.55 3.36 0.23 1.70 -0.14 -1.26 -5.06 119.74 121.12 2ft6 s LYS 103 Ca 0.22 -0.41 -0.32 0.00 -1.36 0.00 0.00 55.97 54.11 2ft6 s LYS 103 Cb -0.15 -3.03 -0.13 0.00 -1.68 0.00 0.00 37.83 32.84 2ft6 s LYS 103 CO 0.13 0.64 1.44 0.39 -0.76 0.00 0.00 175.35 177.20 2ft6 n GLU 104 N 0.69 2.08 -0.33 1.68 -0.58 -1.26 -2.35 120.64 120.57 2ft6 n GLU 104 Ca -0.09 0.74 0.00 0.00 -0.42 0.00 0.00 57.16 57.39 2ft6 n GLU 104 Cb 0.52 -2.42 0.00 0.00 -0.57 0.00 0.00 31.44 28.97 2ft6 n GLU 104 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ft6 n GLY 105 N 2.37 1.69 3.90 0.62 0.00 -1.26 -5.03 105.19 107.49 2ft6 n GLY 105 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 2ft6 n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ft6 s GLU 106 N -0.23 3.63 -0.27 1.61 2.56 -0.99 -5.08 118.70 119.92 2ft6 s GLU 106 Ca 0.00 0.02 -0.06 0.00 0.00 0.00 0.00 54.97 54.93 2ft6 s GLU 106 Cb 0.00 -2.63 0.01 0.00 2.00 0.00 0.00 34.13 33.50 2ft6 s GLU 106 CO 0.00 0.19 0.04 -1.14 -0.56 0.00 0.00 175.26 173.80 2ft6 s GLN 107 N -3.60 3.13 -0.09 4.30 0.74 -1.26 -4.95 119.66 117.92 2ft6 s GLN 107 Ca 0.44 -0.82 -0.03 0.00 0.05 0.00 0.00 55.36 55.00 2ft6 s GLN 107 Cb -0.11 -3.26 -0.03 0.00 1.10 0.00 0.00 33.01 30.71 2ft6 s GLN 107 CO 0.30 -0.39 0.02 0.71 -0.55 0.00 0.00 175.29 175.39 2ft6 s TYR 108 N 1.48 3.22 0.06 1.67 2.02 -1.26 -0.73 117.35 123.82 2ft6 s TYR 108 Ca 0.03 0.23 0.07 0.00 -0.37 0.00 0.00 57.07 57.03 2ft6 s TYR 108 Cb -0.17 -1.82 -0.03 0.00 -0.40 0.00 0.00 41.96 39.55 2ft6 s TYR 108 CO 0.01 0.49 -0.19 -1.64 -1.57 0.00 0.00 175.55 172.65 2ft6 s MET 109 N -0.85 1.16 0.14 -0.62 -1.94 -0.22 -2.16 119.30 114.80 2ft6 s MET 109 Ca 0.13 -0.97 0.07 0.00 -1.71 0.00 0.00 55.69 53.21 2ft6 s MET 109 Cb -0.11 -1.28 -0.04 0.00 2.01 0.00 0.00 34.83 35.40 2ft6 s MET 109 CO 0.02 0.31 -0.03 -0.59 -0.01 0.00 0.00 175.02 174.73 2ft6 s PHE 110 N -0.96 2.85 0.06 -0.03 -0.12 -0.22 -2.01 117.98 117.54 2ft6 s PHE 110 Ca 0.05 -0.12 -0.27 0.00 -0.05 0.00 0.00 56.93 56.54 2ft6 s PHE 110 Cb -0.09 -1.42 0.09 0.00 -0.63 0.00 0.00 43.02 40.97 2ft6 s PHE 110 CO 0.02 0.49 0.83 -0.59 -0.05 0.00 0.00 175.22 175.93 2ft6 s PHE 111 N -1.52 -0.35 -0.18 3.49 -0.71 -0.07 -0.50 117.98 118.13 2ft6 s PHE 111 Ca 0.26 0.17 -0.10 0.00 -1.04 0.00 0.00 56.93 56.22 2ft6 s PHE 111 Cb -0.10 0.56 -0.05 0.00 -1.21 0.00 0.00 43.02 42.22 2ft6 s PHE 111 CO 0.17 -0.66 0.16 0.00 -1.34 0.00 0.00 175.22 173.55 2ft6 h THR 113 N 4.58 1.30 0.00 0.00 1.35 -1.87 -3.24 112.91 115.03 2ft6 h THR 113 Ca -0.43 -1.64 0.00 0.00 -0.55 0.00 0.00 66.41 63.80 2ft6 h THR 113 Cb 1.16 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 69.28 2ft6 h THR 113 CO 0.74 0.52 0.00 -0.81 -0.25 0.00 0.00 175.52 175.72 2ft6 n PRO 114 N -4.14 0.17 -4.37 4.72 -0.04 -1.26 -4.88 135.00 125.20 2ft6 n PRO 114 Ca -0.05 0.30 -0.19 0.00 -0.04 0.00 0.00 63.50 63.52 2ft6 n PRO 114 Cb 0.56 -1.77 -0.10 0.00 -0.04 0.00 0.00 33.50 32.15 2ft6 n PRO 114 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2ft6 s HIS 115 N -3.18 1.78 -1.35 0.54 3.76 -1.22 -5.04 115.29 110.58 2ft6 s HIS 115 Ca 0.07 -0.60 -0.16 0.00 -0.15 0.00 0.00 55.06 54.23 2ft6 s HIS 115 Cb 0.11 -0.87 0.02 0.00 1.11 0.00 0.00 32.58 32.94 2ft6 s HIS 115 CO 0.45 0.35 2.11 -0.35 -0.85 0.00 0.00 174.74 176.45 2ft6 n PRO 116 N -0.44 2.72 -3.85 8.40 -0.04 -1.26 -4.58 135.00 135.95 2ft6 n PRO 116 Ca -0.07 -2.61 -0.22 0.00 -0.04 0.00 0.00 63.50 60.56 2ft6 n PRO 116 Cb 0.61 -3.29 -0.17 0.00 -0.04 0.00 0.00 33.50 30.61 2ft6 n PRO 116 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2ft6 s MET 117 N 3.64 0.63 0.17 0.54 -1.94 -1.26 -4.98 119.30 116.09 2ft6 s MET 117 Ca 0.50 0.07 -0.19 0.00 -1.71 0.00 0.00 55.69 54.36 2ft6 s MET 117 Cb 0.12 -0.92 0.04 0.00 2.01 0.00 0.00 34.83 36.09 2ft6 s MET 117 CO -0.03 -0.25 0.52 -1.59 -0.01 0.00 0.00 175.02 173.65 2ft6 s LYS 118 N 1.73 1.28 0.26 2.03 -2.85 -1.26 -2.11 119.74 118.82 2ft6 s LYS 118 Ca 0.01 -0.72 -0.14 0.00 -1.00 0.00 0.00 55.97 54.13 2ft6 s LYS 118 Cb -0.13 0.53 0.05 0.00 -2.06 0.00 0.00 37.83 36.22 2ft6 s LYS 118 CO -0.04 -0.54 0.70 0.41 0.10 0.00 0.00 175.35 175.97 2ft6 n GLY 119 N -0.32 1.03 3.74 0.59 0.00 0.34 -4.82 105.19 105.75 2ft6 n GLY 119 Ca -0.13 -1.17 -0.31 0.00 0.00 0.00 0.00 46.02 44.40 2ft6 n GLY 119 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ft6 s THR 120 N -2.24 4.39 -0.09 2.61 -4.23 -0.38 -1.05 115.64 114.64 2ft6 s THR 120 Ca 0.15 -0.70 0.02 0.00 -1.18 0.00 0.00 61.69 59.98 2ft6 s THR 120 Cb -0.03 -3.05 0.01 0.00 1.34 0.00 0.00 72.50 70.76 2ft6 s THR 120 CO 0.08 0.22 -0.15 -0.22 -0.54 0.00 0.00 174.62 174.01 2ft6 s LEU 121 N -2.06 1.74 0.02 4.79 0.20 -0.92 -0.85 118.68 121.60 2ft6 s LEU 121 Ca 0.25 -0.40 0.02 0.00 0.69 0.00 0.00 54.13 54.69 2ft6 s LEU 121 Cb -0.12 -1.04 -0.02 0.00 -0.43 0.00 0.00 46.19 44.58 2ft6 s LEU 121 CO 0.17 0.04 -0.06 0.42 -0.29 0.00 0.00 176.35 176.63 2ft6 s THR 122 N 0.79 0.42 0.09 3.68 -4.23 -0.50 -4.14 115.64 111.75 2ft6 s THR 122 Ca -0.11 -0.71 -0.30 0.00 -1.18 0.00 0.00 61.69 59.39 2ft6 s THR 122 Cb -0.16 -0.45 -0.06 0.00 1.34 0.00 0.00 72.50 73.18 2ft6 s THR 122 CO 0.02 -0.20 1.09 -0.76 -0.54 0.00 0.00 174.62 174.23 2ft6 s LEU 123 N -0.98 4.43 0.00 4.79 1.43 -1.26 -1.02 118.68 126.07 2ft6 s LEU 123 Ca -0.06 1.94 0.03 0.00 -1.03 0.00 0.00 54.13 55.01 2ft6 s LEU 123 Cb -0.07 -3.59 0.17 0.00 0.03 0.00 0.00 46.19 42.74 2ft6 s LEU 123 CO 0.00 -0.29 0.66 0.29 0.23 0.00 0.00 176.35 177.23