#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ja7 s ASN 3 N 0.00 3.23 0.40 4.04 0.01 -1.26 -4.86 114.94 116.50 2ja7 s ASN 3 Ca 0.00 -1.71 0.08 0.00 -0.71 0.00 0.00 52.86 50.52 2ja7 s ASN 3 Cb 0.00 0.59 -0.01 0.00 0.41 0.00 0.00 41.25 42.24 2ja7 s ASN 3 CO 0.00 -0.96 0.46 -0.89 -1.51 0.00 0.00 177.10 174.20 2ja7 s THR 4 N -3.10 3.04 0.00 1.60 2.01 -1.26 -4.20 115.64 113.72 2ja7 s THR 4 Ca 0.17 -1.17 0.00 0.00 0.31 0.00 0.00 61.69 61.00 2ja7 s THR 4 Cb 0.01 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.46 2ja7 s THR 4 CO 0.11 -0.03 0.25 0.18 -0.69 0.00 0.00 174.62 174.44 2ja7 n LEU 5 N -1.66 0.23 -3.65 4.42 4.77 -1.26 -4.77 117.00 115.08 2ja7 n LEU 5 Ca 0.04 -0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 55.76 2ja7 n LEU 5 Cb 0.60 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.62 2ja7 n LEU 5 CO 0.41 0.06 0.92 0.12 -1.33 0.00 0.00 177.39 177.57 2ja7 s PHE 6 N -0.06 -0.27 -0.01 -1.77 5.36 -1.26 -4.55 117.98 115.42 2ja7 s PHE 6 Ca 0.00 0.59 -0.00 0.00 -0.96 0.00 0.00 56.93 56.56 2ja7 s PHE 6 Cb 0.00 0.31 0.02 0.00 -0.34 0.00 0.00 43.02 43.01 2ja7 s PHE 6 CO 0.00 -0.13 0.02 0.34 -1.46 0.00 0.00 175.22 173.99 2ja7 s ASP 7 N 0.64 0.03 0.00 6.13 -1.08 -1.26 -3.23 116.67 117.91 2ja7 s ASP 7 Ca -0.01 0.04 0.00 0.00 -0.52 0.00 0.00 52.55 52.05 2ja7 s ASP 7 Cb -0.04 -0.03 0.00 0.00 -1.46 0.00 0.00 42.92 41.39 2ja7 s ASP 7 CO -0.12 -0.08 0.00 -0.67 0.52 0.00 0.00 175.17 174.82 2ja7 n ASP 8 N 3.74 0.00 -4.27 -0.34 2.03 -1.06 -5.04 116.55 111.62 2ja7 n ASP 8 Ca -0.22 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 54.80 2ja7 n ASP 8 Cb 0.54 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.78 2ja7 n ASP 8 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2ja7 s ILE 9 N -2.00 1.92 0.28 5.18 1.01 -1.26 -1.19 121.20 125.14 2ja7 s ILE 9 Ca 0.00 -1.02 0.05 0.00 0.00 0.00 0.00 60.65 59.68 2ja7 s ILE 9 Cb 0.00 -1.60 -0.06 0.00 0.01 0.00 0.00 42.46 40.81 2ja7 s ILE 9 CO 0.00 0.54 -0.02 -0.36 0.00 0.00 0.00 174.94 175.10 2ja7 s PHE 10 N -0.41 1.85 -0.09 3.97 0.40 0.93 -2.32 117.98 122.31 2ja7 s PHE 10 Ca 0.05 -0.82 0.01 0.00 -0.60 0.00 0.00 56.93 55.57 2ja7 s PHE 10 Cb -0.11 -1.10 0.02 0.00 0.51 0.00 0.00 43.02 42.34 2ja7 s PHE 10 CO 0.01 0.13 -0.11 -1.14 0.70 0.00 0.00 175.22 174.81 2ja7 s GLN 11 N -3.80 1.71 -0.28 0.44 0.74 -0.42 -1.59 119.66 116.46 2ja7 s GLN 11 Ca 0.31 -0.37 -0.28 0.00 0.05 0.00 0.00 55.36 55.06 2ja7 s GLN 11 Cb 0.05 -1.55 -0.03 0.00 1.10 0.00 0.00 33.01 32.59 2ja7 s GLN 11 CO 0.12 -0.10 1.92 0.08 -0.55 0.00 0.00 175.29 176.75 2ja7 s VAL 12 N 1.11 3.34 0.19 1.34 1.01 -1.23 -1.77 120.40 124.39 2ja7 s VAL 12 Ca -0.06 0.35 -0.03 0.00 0.00 0.00 0.00 61.98 62.25 2ja7 s VAL 12 Cb -0.14 -3.45 -0.07 0.00 0.00 0.00 0.00 36.38 32.72 2ja7 s VAL 12 CO -0.02 -0.27 1.48 0.77 0.00 0.00 0.00 175.10 177.05 2ja7 h SER 13 N 13.33 0.57 -3.13 3.32 4.64 -0.49 0.17 113.55 131.97 2ja7 h SER 13 Ca -0.36 -0.33 0.10 0.00 -0.47 0.00 0.00 61.79 60.73 2ja7 h SER 13 Cb 1.19 -0.16 -0.27 0.00 -0.31 0.00 0.00 62.40 62.84 2ja7 h SER 13 CO 1.00 1.05 0.58 -0.70 -0.87 0.00 0.00 176.83 177.89 2ja7 s GLU 14 N -3.85 0.41 -0.13 4.77 2.12 -1.16 -4.79 118.70 116.07 2ja7 s GLU 14 Ca -0.07 0.39 -0.04 0.00 0.36 0.00 0.00 54.97 55.61 2ja7 s GLU 14 Cb 0.11 0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.66 2ja7 s GLU 14 CO 0.84 -0.07 0.01 0.08 -0.54 0.00 0.00 175.26 175.58 2ja7 s VAL 15 N -0.09 4.34 -0.12 3.70 1.01 -1.26 -3.03 120.40 124.95 2ja7 s VAL 15 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.80 2ja7 s VAL 15 Cb -0.04 -2.88 0.02 0.00 0.00 0.00 0.00 36.38 33.48 2ja7 s VAL 15 CO -0.07 0.54 -0.11 -0.62 0.00 0.00 0.00 175.10 174.84 2ja7 s ASP 16 N -0.23 2.32 -0.78 3.32 2.15 -0.81 -5.00 116.67 117.63 2ja7 s ASP 16 Ca 0.06 -0.37 0.01 0.00 0.43 0.00 0.00 52.55 52.68 2ja7 s ASP 16 Cb -0.12 -0.97 0.19 0.00 -0.30 0.00 0.00 42.92 41.72 2ja7 s ASP 16 CO 0.02 -0.07 0.62 -2.16 -0.17 0.00 0.00 175.17 173.41 2ja7 s PRO 17 N 1.46 2.85 -1.32 4.34 0.04 -1.26 -1.70 135.00 139.41 2ja7 s PRO 17 Ca 0.02 -3.23 -0.14 0.00 0.04 0.00 0.00 61.00 57.69 2ja7 s PRO 17 Cb -0.13 -3.70 0.11 0.00 0.04 0.00 0.00 34.50 30.81 2ja7 s PRO 17 CO -0.07 -1.26 1.86 0.41 0.04 0.00 0.00 177.00 177.98 2ja7 n GLY 18 N 2.30 3.86 2.18 0.56 0.00 -1.26 -4.28 105.19 108.54 2ja7 n GLY 18 Ca 0.19 -1.78 -0.08 0.00 0.00 0.00 0.00 46.02 44.35 2ja7 n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ja7 n ARG 19 N 5.96 -1.58 -3.42 1.61 1.74 -1.26 -5.00 116.66 114.71 2ja7 n ARG 19 Ca 0.45 0.32 -0.26 0.00 -0.77 0.00 0.00 57.85 57.59 2ja7 n ARG 19 Cb 0.41 -3.98 -0.08 0.00 -1.02 0.00 0.00 32.46 27.78 2ja7 n ARG 19 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2ja7 n TYR 20 N -3.71 2.22 -0.52 -1.55 0.53 -1.26 -4.97 117.16 107.90 2ja7 n TYR 20 Ca -0.04 -3.96 0.39 0.00 -1.02 0.00 0.00 57.90 53.26 2ja7 n TYR 20 Cb 0.54 -0.46 0.60 0.00 -1.03 0.00 0.00 39.34 39.00 2ja7 n TYR 20 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 2ja7 n ASN 21 N 1.28 0.01 -0.13 7.72 3.02 -1.26 -0.63 115.26 125.25 2ja7 n ASN 21 Ca 0.26 0.74 0.02 0.00 -0.03 0.00 0.00 54.58 55.57 2ja7 n ASN 21 Cb 0.44 -0.37 0.02 0.00 -0.61 0.00 0.00 39.78 39.26 2ja7 n ASN 21 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ja7 n LYS 22 N -3.44 0.12 -3.77 3.52 5.02 -1.26 -4.98 118.16 113.37 2ja7 n LYS 22 Ca 0.33 -0.87 -0.13 0.00 -2.02 0.00 0.00 58.31 55.61 2ja7 n LYS 22 Cb 1.47 -1.06 -0.11 0.00 -0.02 0.00 0.00 35.03 35.31 2ja7 n LYS 22 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2ja7 s VAL 23 N -0.40 0.00 0.06 -0.18 1.01 0.19 -2.69 120.40 118.39 2ja7 s VAL 23 Ca 0.04 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.06 2ja7 s VAL 23 Cb 0.03 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.96 2ja7 s VAL 23 CO 0.04 -0.00 -0.14 0.00 0.00 0.00 0.00 175.10 175.00 2ja7 s ARG 25 N -1.49 4.08 0.16 0.00 3.52 -0.69 -0.14 118.95 124.39 2ja7 s ARG 25 Ca -0.01 0.28 0.10 0.00 -0.13 0.00 0.00 55.73 55.96 2ja7 s ARG 25 Cb -0.09 -3.33 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 2ja7 s ARG 25 CO 0.02 0.44 -0.17 0.42 -0.81 0.00 0.00 175.30 175.20 2ja7 s ILE 26 N -0.22 2.79 -0.05 4.11 1.01 0.14 -1.93 121.20 127.06 2ja7 s ILE 26 Ca 0.21 -1.73 -0.02 0.00 0.00 0.00 0.00 60.65 59.11 2ja7 s ILE 26 Cb -0.15 -2.34 0.03 0.00 0.01 0.00 0.00 42.46 40.02 2ja7 s ILE 26 CO 0.09 -0.04 0.05 -1.61 0.00 0.00 0.00 174.94 173.42 2ja7 s GLU 27 N -2.54 0.08 0.37 2.79 2.02 -1.17 0.34 118.70 120.59 2ja7 s GLU 27 Ca 0.21 0.31 0.05 0.00 0.02 0.00 0.00 54.97 55.56 2ja7 s GLU 27 Cb -0.09 -0.61 -0.03 0.00 0.10 0.00 0.00 34.13 33.50 2ja7 s GLU 27 CO 0.12 -0.32 0.19 0.00 0.02 0.00 0.00 175.26 175.27 2ja7 s ALA 28 N 2.10 2.44 0.33 5.21 0.00 -0.68 0.30 121.76 131.46 2ja7 s ALA 28 Ca 0.05 -1.58 0.05 0.00 0.00 0.00 0.00 51.96 50.48 2ja7 s ALA 28 Cb -0.12 1.07 -0.07 0.00 0.00 0.00 0.00 23.12 24.00 2ja7 s ALA 28 CO -0.04 -0.48 0.02 0.00 0.00 0.00 0.00 175.76 175.26 2ja7 s ALA 29 N -3.34 2.51 -0.07 0.00 0.00 -0.73 -1.44 121.76 118.69 2ja7 s ALA 29 Ca 0.31 -2.07 -0.12 0.00 0.00 0.00 0.00 51.96 50.09 2ja7 s ALA 29 Cb 0.03 0.43 -0.05 0.00 0.00 0.00 0.00 23.12 23.53 2ja7 s ALA 29 CO 0.20 -0.21 0.29 0.45 0.00 0.00 0.00 175.76 176.49 2ja7 s SER 30 N -3.52 6.59 -1.05 0.00 0.15 -0.86 -1.29 113.70 113.73 2ja7 s SER 30 Ca 0.34 0.70 -0.05 0.00 0.70 0.00 0.00 55.95 57.65 2ja7 s SER 30 Cb 0.08 -2.17 0.12 0.00 -1.71 0.00 0.00 66.02 62.33 2ja7 s SER 30 CO 0.15 0.32 2.46 0.41 1.20 0.00 0.00 173.24 177.78 2ja7 n THR 31 N 2.19 4.72 0.00 6.45 -1.04 -0.98 -4.52 114.28 121.09 2ja7 n THR 31 Ca -0.16 -4.03 0.00 0.00 -2.04 0.00 0.00 64.05 57.82 2ja7 n THR 31 Cb 0.53 -1.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.15 2ja7 n THR 31 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2ja7 n THR 32 N 1.35 0.00 -2.22 12.58 -1.04 -1.26 -4.94 114.28 118.74 2ja7 n THR 32 Ca 0.58 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 62.18 2ja7 n THR 32 Cb 0.34 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.82 2ja7 n THR 32 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2ja7 s GLN 33 N 1.57 4.43 -0.02 -2.82 1.11 -1.26 -4.87 119.66 117.81 2ja7 s GLN 33 Ca 0.00 2.08 0.01 0.00 0.01 0.00 0.00 55.36 57.46 2ja7 s GLN 33 Cb 0.00 -3.13 0.07 0.00 -1.01 0.00 0.00 33.01 28.94 2ja7 s GLN 33 CO 0.00 -0.11 0.70 -0.25 0.01 0.00 0.00 175.29 175.64 2ja7 n ASP 34 N 1.36 1.18 -0.10 5.90 8.00 -1.26 -3.48 116.55 128.15 2ja7 n ASP 34 Ca 0.01 -2.06 -0.17 0.00 0.71 0.00 0.00 54.79 53.28 2ja7 n ASP 34 Cb 0.43 -0.42 -0.09 0.00 -0.02 0.00 0.00 41.12 41.02 2ja7 n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ja7 n GLN 35 N -0.02 0.49 -1.81 -1.24 6.02 -1.26 -4.93 117.38 114.62 2ja7 n GLN 35 Ca 0.02 0.15 -0.34 0.00 -0.01 0.00 0.00 57.00 56.82 2ja7 n GLN 35 Cb 0.27 -1.36 -0.04 0.00 1.02 0.00 0.00 30.24 30.14 2ja7 n GLN 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ja7 s LYS 37 N 7.69 2.99 0.01 0.00 1.02 -1.01 -2.02 119.74 128.43 2ja7 s LYS 37 Ca 0.81 -1.01 -0.00 0.00 0.02 0.00 0.00 55.97 55.79 2ja7 s LYS 37 Cb -0.14 -2.61 -0.01 0.00 -0.52 0.00 0.00 37.83 34.56 2ja7 s LYS 37 CO 0.19 0.41 -0.00 -1.17 -0.92 0.00 0.00 175.35 173.86 2ja7 s LEU 38 N -3.83 2.06 -0.15 3.17 2.96 -0.52 -2.33 118.68 120.03 2ja7 s LEU 38 Ca 0.33 -0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 54.00 2ja7 s LEU 38 Cb -0.08 0.09 0.06 0.00 0.50 0.00 0.00 46.19 46.75 2ja7 s LEU 38 CO 0.25 -0.14 0.08 -0.89 -1.32 0.00 0.00 176.35 174.34 2ja7 s THR 39 N -0.64 -0.04 -0.09 3.68 2.01 -0.37 -1.68 115.64 118.51 2ja7 s THR 39 Ca -0.07 -0.11 -0.04 0.00 0.31 0.00 0.00 61.69 61.77 2ja7 s THR 39 Cb -0.04 -0.55 0.04 0.00 0.01 0.00 0.00 72.50 71.96 2ja7 s THR 39 CO -0.00 -0.21 0.20 -0.22 -0.69 0.00 0.00 174.62 173.70 2ja7 s LEU 40 N 2.12 0.59 0.57 4.42 2.96 0.15 0.12 118.68 129.62 2ja7 s LEU 40 Ca 0.02 0.42 -0.18 0.00 -0.22 0.00 0.00 54.13 54.18 2ja7 s LEU 40 Cb -0.16 0.58 -0.04 0.00 0.50 0.00 0.00 46.19 47.07 2ja7 s LEU 40 CO -0.08 -0.15 1.09 -1.81 -1.32 0.00 0.00 176.35 174.08 2ja7 s ASP 41 N 1.15 5.69 -0.24 3.68 1.01 -0.77 0.28 116.67 127.46 2ja7 s ASP 41 Ca -0.09 2.01 -0.15 0.00 0.71 0.00 0.00 52.55 55.04 2ja7 s ASP 41 Cb -0.10 -2.56 0.07 0.00 1.01 0.00 0.00 42.92 41.34 2ja7 s ASP 41 CO -0.07 -1.23 0.60 -0.63 0.21 0.00 0.00 175.17 174.05 2ja7 s ILE 42 N -2.09 -0.01 -0.60 0.77 1.01 0.80 -4.83 121.20 116.24 2ja7 s ILE 42 Ca 0.68 0.03 -0.26 0.00 0.00 0.00 0.00 60.65 61.10 2ja7 s ILE 42 Cb -0.20 -0.87 -0.07 0.00 0.01 0.00 0.00 42.46 41.32 2ja7 s ILE 42 CO 0.31 0.01 2.28 0.21 0.00 0.00 0.00 174.94 177.76 2ja7 s ASN 43 N 1.40 4.51 -0.05 3.58 3.84 -1.26 -2.28 114.94 124.68 2ja7 s ASN 43 Ca -0.09 0.61 -0.01 0.00 0.21 0.00 0.00 52.86 53.59 2ja7 s ASN 43 Cb -0.06 -2.52 0.01 0.00 -0.55 0.00 0.00 41.25 38.13 2ja7 s ASN 43 CO -0.15 -3.00 2.16 0.52 -2.79 0.00 0.00 177.10 173.83 2ja7 n VAL 44 N 8.02 2.22 0.00 -5.21 0.31 -1.10 -2.79 118.33 119.78 2ja7 n VAL 44 Ca 0.36 -0.79 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2ja7 n VAL 44 Cb 0.51 -1.52 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 2ja7 n VAL 44 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2ja7 n GLU 45 N 1.41 0.87 0.00 5.55 2.13 -1.26 -4.54 120.64 124.80 2ja7 n GLU 45 Ca 0.09 0.00 0.11 0.00 0.66 0.00 0.00 57.16 58.01 2ja7 n GLU 45 Cb 0.55 -0.66 -0.11 0.00 0.27 0.00 0.00 31.44 31.49 2ja7 n GLU 45 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2ja7 n LEU 46 N -1.24 0.45 -2.97 4.31 4.77 -1.20 -4.67 117.00 116.45 2ja7 n LEU 46 Ca 0.00 -0.15 -0.12 0.00 -0.03 0.00 0.00 56.01 55.70 2ja7 n LEU 46 Cb 0.16 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 2ja7 n LEU 46 CO 0.00 0.08 -0.03 0.33 -1.33 0.00 0.00 177.39 176.45 2ja7 n PHE 47 N -1.98 -2.72 -0.97 -1.77 7.35 -1.12 -5.04 117.46 111.21 2ja7 n PHE 47 Ca -0.00 -2.11 -0.34 0.00 -0.76 0.00 0.00 57.45 54.24 2ja7 n PHE 47 Cb 0.47 1.03 0.12 0.00 0.35 0.00 0.00 39.48 41.44 2ja7 n PHE 47 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2ja7 n PRO 48 N 2.66 -0.06 -3.67 -7.13 -0.02 -1.26 -4.45 135.00 121.08 2ja7 n PRO 48 Ca 0.21 0.04 -0.08 0.00 -2.02 0.00 0.00 63.50 61.64 2ja7 n PRO 48 Cb 0.54 -2.04 -0.09 0.00 -0.02 0.00 0.00 33.50 31.89 2ja7 n PRO 48 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ja7 s VAL 49 N -2.24 -0.27 0.23 -1.45 1.01 -1.26 -5.03 120.40 111.39 2ja7 s VAL 49 Ca 0.64 0.09 0.10 0.00 0.00 0.00 0.00 61.98 62.80 2ja7 s VAL 49 Cb -0.27 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2ja7 s VAL 49 CO 0.60 0.04 -0.07 0.00 0.00 0.00 0.00 175.10 175.67 2ja7 s ALA 50 N 1.90 3.02 0.23 5.51 0.00 -1.26 -4.98 121.76 126.18 2ja7 s ALA 50 Ca -0.07 -1.61 -0.30 0.00 0.00 0.00 0.00 51.96 49.98 2ja7 s ALA 50 Cb -0.09 -0.69 -0.15 0.00 0.00 0.00 0.00 23.12 22.19 2ja7 s ALA 50 CO -0.15 0.35 0.94 0.00 0.00 0.00 0.00 175.76 176.89 2ja7 n ALA 51 N -0.49 -1.10 -2.69 0.00 0.00 -1.26 -4.28 120.51 110.69 2ja7 n ALA 51 Ca -0.08 0.43 -0.02 0.00 0.00 0.00 0.00 53.44 53.77 2ja7 n ALA 51 Cb 0.58 -1.92 -0.01 0.00 0.00 0.00 0.00 19.45 18.10 2ja7 n ALA 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2ja7 n GLN 52 N 1.08 -3.83 -4.09 0.00 6.02 0.61 -4.96 117.38 112.20 2ja7 n GLN 52 Ca 0.13 3.00 -0.11 0.00 -0.01 0.00 0.00 57.00 60.01 2ja7 n GLN 52 Cb 0.28 -5.28 -0.07 0.00 1.02 0.00 0.00 30.24 26.19 2ja7 n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2ja7 s ASP 53 N -1.35 0.13 -0.98 1.08 1.01 -1.26 -4.85 116.67 110.45 2ja7 s ASP 53 Ca -0.09 -1.17 -0.04 0.00 0.71 0.00 0.00 52.55 51.96 2ja7 s ASP 53 Cb 0.01 0.52 0.25 0.00 1.01 0.00 0.00 42.92 44.70 2ja7 s ASP 53 CO 0.79 -1.04 0.93 -1.54 0.21 0.00 0.00 175.17 174.51 2ja7 n SER 54 N -0.46 4.75 -4.78 0.27 3.41 -1.26 -3.52 113.62 112.03 2ja7 n SER 54 Ca 0.00 -3.11 -0.39 0.00 -0.26 0.00 0.00 58.87 55.11 2ja7 n SER 54 Cb 0.63 -1.17 -0.06 0.00 -0.26 0.00 0.00 64.21 63.35 2ja7 n SER 54 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ja7 s LEU 55 N -1.42 4.54 -0.35 1.04 1.43 -0.62 -4.66 118.68 118.65 2ja7 s LEU 55 Ca 0.29 1.46 -0.06 0.00 -1.03 0.00 0.00 54.13 54.79 2ja7 s LEU 55 Cb -0.07 -3.13 0.05 0.00 0.03 0.00 0.00 46.19 43.07 2ja7 s LEU 55 CO -0.10 0.20 0.11 -0.89 0.23 0.00 0.00 176.35 175.90 2ja7 s THR 56 N -0.93 3.73 -0.07 5.49 2.01 -1.04 -0.05 115.64 124.78 2ja7 s THR 56 Ca 0.33 -1.22 -0.13 0.00 0.31 0.00 0.00 61.69 60.98 2ja7 s THR 56 Cb -0.21 -3.15 -0.05 0.00 0.01 0.00 0.00 72.50 69.10 2ja7 s THR 56 CO 0.23 -0.22 0.33 -0.69 -0.69 0.00 0.00 174.62 173.58 2ja7 s VAL 57 N 1.38 5.20 0.36 3.82 1.01 -0.33 -2.79 120.40 129.05 2ja7 s VAL 57 Ca -0.01 0.65 0.06 0.00 0.00 0.00 0.00 61.98 62.68 2ja7 s VAL 57 Cb -0.20 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2ja7 s VAL 57 CO 0.02 0.52 0.21 -0.89 0.00 0.00 0.00 175.10 174.96 2ja7 s THR 58 N -0.52 0.23 0.00 3.92 2.01 -1.14 -2.55 115.64 117.59 2ja7 s THR 58 Ca 0.20 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.20 2ja7 s THR 58 Cb -0.15 -2.43 0.00 0.00 0.01 0.00 0.00 72.50 69.93 2ja7 s THR 58 CO 0.09 0.00 0.00 -0.38 -0.69 0.00 0.00 174.62 173.64 2ja7 n ILE 59 N -0.72 0.00 -0.85 1.82 5.41 -1.20 -3.27 119.36 120.55 2ja7 n ILE 59 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 2ja7 n ILE 59 Cb 0.63 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.56 2ja7 n ILE 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ja7 n ALA 60 N -3.00 -1.34 -3.46 -1.39 0.00 -1.26 -4.49 120.51 105.57 2ja7 n ALA 60 Ca 0.00 0.26 -0.34 0.00 0.00 0.00 0.00 53.44 53.36 2ja7 n ALA 60 Cb 0.00 -1.02 -0.06 0.00 0.00 0.00 0.00 19.45 18.37 2ja7 n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2ja7 n SER 61 N -1.96 4.47 0.00 0.00 3.41 -1.26 -2.32 113.62 115.96 2ja7 n SER 61 Ca 0.00 -3.29 0.00 0.00 -0.26 0.00 0.00 58.87 55.32 2ja7 n SER 61 Cb 0.23 -0.97 0.00 0.00 -0.26 0.00 0.00 64.21 63.21 2ja7 n SER 61 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ja7 n SER 62 N 1.65 0.00 -1.73 4.04 3.41 -1.26 -4.56 113.62 115.17 2ja7 n SER 62 Ca 0.25 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.81 2ja7 n SER 62 Cb 0.37 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.26 2ja7 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2ja7 n LEU 63 N 0.00 5.00 -0.06 1.04 4.77 -1.26 -4.14 117.00 122.36 2ja7 n LEU 63 Ca 0.00 -2.58 -0.06 0.00 -0.03 0.00 0.00 56.01 53.35 2ja7 n LEU 63 Cb 0.00 -1.18 -0.02 0.00 -2.33 0.00 0.00 43.42 39.90 2ja7 n LEU 63 CO 0.00 1.20 -0.42 0.59 -1.33 0.00 0.00 177.39 177.43 2ja7 n ASN 64 N 1.93 1.21 -0.14 -1.43 3.02 -1.26 -4.27 115.26 114.33 2ja7 n ASN 64 Ca 0.16 0.21 -0.02 0.00 -0.03 0.00 0.00 54.58 54.90 2ja7 n ASN 64 Cb 0.63 -0.64 -0.01 0.00 -0.61 0.00 0.00 39.78 39.15 2ja7 n ASN 64 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2ja7 n LEU 65 N -3.72 0.15 0.00 3.41 4.77 -1.26 -4.75 117.00 115.59 2ja7 n LEU 65 Ca -0.09 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 2ja7 n LEU 65 Cb 0.32 -1.25 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 2ja7 n LEU 65 CO 0.13 -0.37 0.00 0.41 -1.33 0.00 0.00 177.39 176.23 2ja7 n THR 76 N -2.67 0.00 -1.70 -5.08 -1.04 -1.26 -5.04 114.28 97.49 2ja7 n THR 76 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2ja7 n THR 76 Cb 0.19 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.70 2ja7 n THR 76 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2ja7 n ARG 77 N 0.00 -4.43 -1.23 -2.82 1.74 -1.26 -4.84 116.66 103.81 2ja7 n ARG 77 Ca 0.00 3.28 -0.38 0.00 -0.77 0.00 0.00 57.85 59.98 2ja7 n ARG 77 Cb 0.00 -3.74 0.03 0.00 -1.02 0.00 0.00 32.46 27.73 2ja7 n ARG 77 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2ja7 n SER 78 N -0.60 -3.32 -4.66 0.55 3.41 -1.26 -4.91 113.62 102.83 2ja7 n SER 78 Ca 0.00 0.57 -0.39 0.00 -0.26 0.00 0.00 58.87 58.79 2ja7 n SER 78 Cb 0.00 -0.94 -0.07 0.00 -0.26 0.00 0.00 64.21 62.94 2ja7 n SER 78 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2ja7 s TRP 79 N -1.95 3.37 0.04 7.33 -0.00 -1.26 -5.08 118.94 121.39 2ja7 s TRP 79 Ca 0.57 0.77 -0.14 0.00 -0.00 0.00 0.00 56.10 57.30 2ja7 s TRP 79 Cb -0.41 -2.67 -0.06 0.00 -0.00 0.00 0.00 33.47 30.33 2ja7 s TRP 79 CO 0.66 -0.10 0.43 1.03 -0.00 0.00 0.00 176.95 178.97 2ja7 s ARG 80 N 1.64 3.90 0.00 5.86 0.52 -1.26 -5.11 118.95 124.50 2ja7 s ARG 80 Ca 0.24 0.38 0.00 0.00 -0.52 0.00 0.00 55.73 55.83 2ja7 s ARG 80 Cb -0.15 -3.14 0.00 0.00 0.52 0.00 0.00 34.95 32.18 2ja7 s ARG 80 CO 0.10 0.63 0.00 -2.30 0.02 0.00 0.00 175.30 173.75 2ja7 n PRO 81 N 1.48 0.36 0.00 3.54 -0.02 -1.26 -5.04 135.00 134.07 2ja7 n PRO 81 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 2ja7 n PRO 81 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2ja7 n PRO 81 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2ja7 n PRO 82 N 0.00 0.00 0.00 0.52 -0.04 -1.26 -4.72 135.00 129.50 2ja7 n PRO 82 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2ja7 n PRO 82 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2ja7 n PRO 82 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2ja7 n GLN 83 N 0.00 0.00 0.00 0.54 6.02 -1.26 -4.58 117.38 118.10 2ja7 n GLN 83 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2ja7 n GLN 83 Cb 0.00 -0.17 0.00 0.00 1.02 0.00 0.00 30.24 31.09 2ja7 n GLN 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ja7 n ALA 84 N 0.00 1.15 0.23 -1.58 0.00 -1.26 -3.26 120.51 115.80 2ja7 n ALA 84 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 2ja7 n ALA 84 Cb 0.00 -1.00 0.87 0.00 0.00 0.00 0.00 19.45 19.32 2ja7 n ALA 84 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2ja7 h GLY 85 N 1.18 0.00 -0.06 0.00 0.00 -1.93 -0.54 103.07 101.72 2ja7 h GLY 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ja7 h GLY 85 CO 0.00 0.00 -0.03 1.34 0.00 0.00 0.00 176.54 177.85 2ja7 n ASP 86 N -3.54 1.13 -4.08 0.19 -0.08 -1.20 -5.07 116.55 103.89 2ja7 n ASP 86 Ca 0.01 -1.68 -0.14 0.00 -1.51 0.00 0.00 54.79 51.47 2ja7 n ASP 86 Cb 0.33 -0.04 0.05 0.00 2.34 0.00 0.00 41.12 43.80 2ja7 n ASP 86 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2ja7 n ARG 87 N -0.34 0.70 -1.25 -0.67 1.74 -0.21 -5.07 116.66 111.55 2ja7 n ARG 87 Ca 0.01 -2.21 -0.36 0.00 -0.77 0.00 0.00 57.85 54.51 2ja7 n ARG 87 Cb 0.40 -0.18 0.06 0.00 -1.02 0.00 0.00 32.46 31.72 2ja7 n ARG 87 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2ja7 n SER 88 N -2.54 -1.60 -2.75 0.55 3.41 -1.26 -4.91 113.62 104.52 2ja7 n SER 88 Ca 0.12 0.58 -0.04 0.00 -0.26 0.00 0.00 58.87 59.27 2ja7 n SER 88 Cb 0.43 -1.17 0.01 0.00 -0.26 0.00 0.00 64.21 63.22 2ja7 n SER 88 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2ja7 n LEU 89 N 0.13 -3.29 -0.65 1.04 4.77 -1.26 -4.94 117.00 112.80 2ja7 n LEU 89 Ca 0.09 -2.75 0.00 0.00 -0.03 0.00 0.00 56.01 53.33 2ja7 n LEU 89 Cb 0.50 0.74 0.00 0.00 -2.33 0.00 0.00 43.42 42.33 2ja7 n LEU 89 CO 0.51 1.87 0.19 0.00 -1.33 0.00 0.00 177.39 178.63 2ja7 n ALA 90 N 2.90 1.93 -0.73 -1.18 0.00 -1.26 -4.00 120.51 118.16 2ja7 n ALA 90 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.42 2ja7 n ALA 90 Cb 0.57 -1.00 0.10 0.00 0.00 0.00 0.00 19.45 19.11 2ja7 n ALA 90 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2ja7 n ASP 91 N 0.36 4.87 -0.91 0.00 5.75 -1.26 -4.65 116.55 120.70 2ja7 n ASP 91 Ca 0.00 -3.19 0.00 0.00 -0.01 0.00 0.00 54.79 51.59 2ja7 n ASP 91 Cb 0.19 -0.85 0.00 0.00 -1.03 0.00 0.00 41.12 39.43 2ja7 n ASP 91 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2ja7 n ASP 92 N -0.43 1.17 0.00 -1.12 8.00 -1.26 -4.66 116.55 118.26 2ja7 n ASP 92 Ca 0.42 -0.88 0.00 0.00 0.71 0.00 0.00 54.79 55.03 2ja7 n ASP 92 Cb 1.03 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.91 2ja7 n ASP 92 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2ja7 n TYR 93 N 0.69 0.00 -0.24 1.24 4.02 -1.26 -4.98 117.16 116.63 2ja7 n TYR 93 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2ja7 n TYR 93 Cb 0.20 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.52 2ja7 n TYR 93 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2ja7 n ASP 94 N 0.00 0.42 -3.56 7.72 8.00 0.99 -4.98 116.55 125.15 2ja7 n ASP 94 Ca 0.00 -0.77 -0.08 0.00 0.71 0.00 0.00 54.79 54.65 2ja7 n ASP 94 Cb 0.00 0.22 -0.09 0.00 -0.02 0.00 0.00 41.12 41.23 2ja7 n ASP 94 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2ja7 s TYR 95 N -0.22 -0.85 -0.17 1.24 6.04 -1.08 -4.90 117.35 117.41 2ja7 s TYR 95 Ca 0.00 1.37 -0.01 0.00 0.04 0.00 0.00 57.07 58.47 2ja7 s TYR 95 Cb 0.00 0.25 0.05 0.00 -1.04 0.00 0.00 41.96 41.22 2ja7 s TYR 95 CO 0.00 -0.56 -0.02 0.08 -1.54 0.00 0.00 175.55 173.51 2ja7 s VAL 96 N 2.61 0.88 0.55 3.14 1.01 -1.26 -1.29 120.40 126.04 2ja7 s VAL 96 Ca 0.03 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 61.47 2ja7 s VAL 96 Cb -0.13 -1.18 0.04 0.00 0.00 0.00 0.00 36.38 35.11 2ja7 s VAL 96 CO -0.14 -0.01 0.45 -0.04 0.00 0.00 0.00 175.10 175.36 2ja7 s MET 97 N 1.72 2.26 -0.24 2.72 -1.94 -0.67 -4.93 119.30 118.22 2ja7 s MET 97 Ca -0.00 -1.98 -0.09 0.00 -1.71 0.00 0.00 55.69 51.90 2ja7 s MET 97 Cb -0.16 -2.15 0.10 0.00 2.01 0.00 0.00 34.83 34.62 2ja7 s MET 97 CO -0.07 -0.65 0.53 -0.47 -0.01 0.00 0.00 175.02 174.35 2ja7 s TYR 98 N -2.76 -1.00 0.00 -0.03 5.04 -1.26 -1.35 117.35 115.98 2ja7 s TYR 98 Ca 0.37 1.86 0.00 0.00 -2.44 0.00 0.00 57.07 56.85 2ja7 s TYR 98 Cb -0.03 0.52 0.00 0.00 0.35 0.00 0.00 41.96 42.80 2ja7 s TYR 98 CO 0.23 -0.54 0.00 0.41 -1.34 0.00 0.00 175.55 174.31 2ja7 n GLY 99 N 5.14 4.40 3.30 8.97 0.00 -1.25 -4.54 105.19 121.20 2ja7 n GLY 99 Ca -0.13 -1.03 -0.16 0.00 0.00 0.00 0.00 46.02 44.70 2ja7 n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ja7 s THR 100 N -1.02 1.32 -0.10 2.61 2.01 0.19 -4.14 115.64 116.51 2ja7 s THR 100 Ca 0.00 -2.10 -0.01 0.00 0.31 0.00 0.00 61.69 59.89 2ja7 s THR 100 Cb 0.00 -2.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 2ja7 s THR 100 CO 0.00 -0.62 -0.06 0.00 -0.69 0.00 0.00 174.62 173.25 2ja7 s ALA 101 N -3.23 2.98 -0.24 7.40 0.00 -1.26 0.68 121.76 128.09 2ja7 s ALA 101 Ca 0.21 -0.86 -0.14 0.00 0.00 0.00 0.00 51.96 51.17 2ja7 s ALA 101 Cb 0.02 -1.35 -0.10 0.00 0.00 0.00 0.00 23.12 21.69 2ja7 s ALA 101 CO 0.04 0.44 -0.34 2.48 0.00 0.00 0.00 175.76 178.39 2ja7 n TYR 102 N 2.71 0.00 -4.37 0.00 -0.00 -1.10 -4.88 117.16 109.53 2ja7 n TYR 102 Ca -0.18 0.00 -0.26 0.00 -0.00 0.00 0.00 57.90 57.46 2ja7 n TYR 102 Cb 0.53 -0.85 -0.12 0.00 -0.00 0.00 0.00 39.34 38.89 2ja7 n TYR 102 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 2ja7 s LYS 103 N -2.55 1.34 -0.74 -3.48 2.20 -1.26 -5.02 119.74 110.24 2ja7 s LYS 103 Ca -0.35 -1.35 0.04 0.00 -0.36 0.00 0.00 55.97 53.95 2ja7 s LYS 103 Cb 0.12 -1.69 0.19 0.00 -1.51 0.00 0.00 37.83 34.95 2ja7 s LYS 103 CO 0.45 0.38 0.60 1.19 -0.36 0.00 0.00 175.35 177.62 2ja7 n PHE 104 N 0.72 3.48 -2.24 4.03 3.01 -1.26 -2.06 117.46 123.15 2ja7 n PHE 104 Ca -0.16 -4.23 -0.34 0.00 1.01 0.00 0.00 57.45 53.72 2ja7 n PHE 104 Cb 0.54 -0.71 -0.00 0.00 -0.01 0.00 0.00 39.48 39.30 2ja7 n PHE 104 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2ja7 s GLU 105 N -1.65 3.40 -0.67 -1.08 2.12 -0.39 -4.88 118.70 115.55 2ja7 s GLU 105 Ca 0.28 1.43 -0.04 0.00 0.36 0.00 0.00 54.97 57.00 2ja7 s GLU 105 Cb -0.01 -2.03 0.17 0.00 0.26 0.00 0.00 34.13 32.52 2ja7 s GLU 105 CO -0.13 -0.77 0.50 -1.21 -0.54 0.00 0.00 175.26 173.11 2ja7 s GLU 106 N -3.52 2.75 -0.89 4.30 2.02 -1.26 -1.58 118.70 120.52 2ja7 s GLU 106 Ca 0.69 -2.57 -0.09 0.00 0.02 0.00 0.00 54.97 53.02 2ja7 s GLU 106 Cb -0.20 -3.84 -0.07 0.00 0.10 0.00 0.00 34.13 30.12 2ja7 s GLU 106 CO 0.29 -1.20 2.06 0.28 0.02 0.00 0.00 175.26 176.72 2ja7 n VAL 107 N 3.48 2.31 -1.09 2.63 0.31 0.94 -4.88 118.33 122.02 2ja7 n VAL 107 Ca 0.09 -1.48 0.12 0.00 -0.01 0.00 0.00 64.34 63.06 2ja7 n VAL 107 Cb 0.39 -2.17 -0.04 0.00 -0.91 0.00 0.00 33.84 31.11 2ja7 n VAL 107 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2ja7 n SER 108 N 4.86 -5.59 0.00 4.52 3.41 -1.26 -4.40 113.62 115.16 2ja7 n SER 108 Ca 0.45 0.63 0.00 0.00 -0.26 0.00 0.00 58.87 59.69 2ja7 n SER 108 Cb 0.18 -3.50 0.00 0.00 -0.26 0.00 0.00 64.21 60.63 2ja7 n SER 108 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2ja7 n LYS 109 N -3.41 0.00 -2.68 4.33 5.02 -1.26 -1.49 118.16 118.66 2ja7 n LYS 109 Ca -0.02 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.95 2ja7 n LYS 109 Cb 0.62 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.62 2ja7 n LYS 109 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2ja7 n ASP 110 N 1.02 5.49 -3.92 4.39 5.75 -1.26 -4.97 116.55 123.05 2ja7 n ASP 110 Ca 0.00 -3.71 -0.30 0.00 -0.01 0.00 0.00 54.79 50.77 2ja7 n ASP 110 Cb 0.00 -0.73 -0.16 0.00 -1.03 0.00 0.00 41.12 39.21 2ja7 n ASP 110 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2ja7 s LEU 111 N -3.75 2.59 -0.16 -2.12 1.43 -0.56 -4.65 118.68 111.46 2ja7 s LEU 111 Ca 0.47 -1.22 -0.04 0.00 -1.03 0.00 0.00 54.13 52.30 2ja7 s LEU 111 Cb 0.30 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 45.33 2ja7 s LEU 111 CO -0.18 -0.25 -0.02 -0.63 0.23 0.00 0.00 176.35 175.50 2ja7 s ILE 112 N 1.40 4.01 -0.02 -0.59 1.01 -1.15 -0.04 121.20 125.82 2ja7 s ILE 112 Ca -0.04 -0.32 0.05 0.00 0.00 0.00 0.00 60.65 60.34 2ja7 s ILE 112 Cb -0.19 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 2ja7 s ILE 112 CO -0.07 0.49 -0.18 0.00 0.00 0.00 0.00 174.94 175.18 2ja7 s ALA 113 N 0.38 1.52 0.00 9.38 0.00 -0.61 -3.29 121.76 129.13 2ja7 s ALA 113 Ca -0.03 -0.75 0.08 0.00 0.00 0.00 0.00 51.96 51.25 2ja7 s ALA 113 Cb -0.14 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.53 2ja7 s ALA 113 CO 0.03 0.34 -0.24 0.14 0.00 0.00 0.00 175.76 176.03 2ja7 s VAL 114 N -0.28 2.29 -0.02 0.00 -7.23 -0.96 -1.26 120.40 112.94 2ja7 s VAL 114 Ca 0.04 -1.15 -0.03 0.00 -1.81 0.00 0.00 61.98 59.02 2ja7 s VAL 114 Cb -0.08 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 2ja7 s VAL 114 CO 0.00 0.49 0.17 -0.31 -0.31 0.00 0.00 175.10 175.14 2ja7 s TYR 115 N -0.72 3.52 0.19 2.82 1.51 -0.87 -1.84 117.35 121.96 2ja7 s TYR 115 Ca 0.11 0.35 0.07 0.00 -1.01 0.00 0.00 57.07 56.59 2ja7 s TYR 115 Cb -0.10 -1.83 -0.05 0.00 -0.11 0.00 0.00 41.96 39.88 2ja7 s TYR 115 CO 0.01 0.64 -0.13 0.71 -1.11 0.00 0.00 175.55 175.67 2ja7 s TYR 116 N -1.29 1.60 -0.13 2.71 1.51 0.45 -2.70 117.35 119.49 2ja7 s TYR 116 Ca 0.26 -0.61 -0.05 0.00 -1.01 0.00 0.00 57.07 55.65 2ja7 s TYR 116 Cb -0.12 -0.76 0.06 0.00 -0.11 0.00 0.00 41.96 41.03 2ja7 s TYR 116 CO 0.17 0.29 0.29 0.45 -1.11 0.00 0.00 175.55 175.63 2ja7 s SER 117 N -3.24 0.07 -0.94 2.29 0.15 0.21 0.15 113.70 112.39 2ja7 s SER 117 Ca 0.20 0.65 -0.04 0.00 0.70 0.00 0.00 55.95 57.46 2ja7 s SER 117 Cb -0.00 0.71 0.23 0.00 -1.71 0.00 0.00 66.02 65.25 2ja7 s SER 117 CO 0.05 -0.22 0.86 -0.36 1.20 0.00 0.00 173.24 174.77 2ja7 s PHE 118 N 2.09 3.98 -1.54 3.44 0.40 0.28 0.56 117.98 127.20 2ja7 s PHE 118 Ca -0.02 -2.93 -0.05 0.00 -0.60 0.00 0.00 56.93 53.33 2ja7 s PHE 118 Cb -0.11 -3.40 0.04 0.00 0.51 0.00 0.00 43.02 40.06 2ja7 s PHE 118 CO -0.09 -0.80 0.34 0.41 0.70 0.00 0.00 175.22 175.78 2ja7 n GLY 119 N 2.47 -0.23 0.00 4.36 0.00 -1.26 -1.90 105.19 108.63 2ja7 n GLY 119 Ca 0.22 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.39 2ja7 n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ja7 n GLY 120 N -2.04 2.09 3.38 -0.02 0.00 -1.26 -5.07 105.19 102.27 2ja7 n GLY 120 Ca -0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 2ja7 n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ja7 s LEU 121 N 0.00 4.14 0.71 0.99 1.43 -0.80 -5.09 118.68 120.06 2ja7 s LEU 121 Ca 0.00 -0.73 -0.05 0.00 -1.03 0.00 0.00 54.13 52.32 2ja7 s LEU 121 Cb 0.00 -1.95 0.08 0.00 0.03 0.00 0.00 46.19 44.35 2ja7 s LEU 121 CO 0.00 -0.24 1.00 -0.76 0.23 0.00 0.00 176.35 176.58 2ja7 s LEU 122 N 1.54 2.92 0.00 1.79 1.43 -1.26 0.10 118.68 125.21 2ja7 s LEU 122 Ca 0.03 0.19 -0.29 0.00 -1.03 0.00 0.00 54.13 53.03 2ja7 s LEU 122 Cb -0.18 -2.76 0.08 0.00 0.03 0.00 0.00 46.19 43.36 2ja7 s LEU 122 CO 0.05 -1.69 0.69 -0.32 0.23 0.00 0.00 176.35 175.31 2ja7 s MET 123 N -5.21 1.07 -0.02 1.70 -2.45 0.12 -1.84 119.30 112.67 2ja7 s MET 123 Ca 0.62 0.01 -0.01 0.00 -1.25 0.00 0.00 55.69 55.07 2ja7 s MET 123 Cb -0.09 0.50 0.02 0.00 1.25 0.00 0.00 34.83 36.52 2ja7 s MET 123 CO 0.44 -0.39 0.05 0.50 1.05 0.00 0.00 175.02 176.68 2ja7 s ARG 124 N -2.02 0.00 -0.00 4.11 3.52 0.33 -0.41 118.95 124.47 2ja7 s ARG 124 Ca -0.06 0.18 0.06 0.00 -0.13 0.00 0.00 55.73 55.78 2ja7 s ARG 124 Cb -0.00 -0.17 -0.02 0.00 -1.56 0.00 0.00 34.95 33.20 2ja7 s ARG 124 CO 0.02 -0.13 -0.18 -1.17 -0.81 0.00 0.00 175.30 173.03 2ja7 s LEU 125 N 0.82 2.06 -0.03 -0.88 2.96 -0.77 -1.23 118.68 121.62 2ja7 s LEU 125 Ca -0.07 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.49 2ja7 s LEU 125 Cb -0.09 -0.92 0.02 0.00 0.50 0.00 0.00 46.19 45.69 2ja7 s LEU 125 CO -0.03 0.20 -0.03 -0.70 -1.32 0.00 0.00 176.35 174.48 2ja7 s GLU 126 N -0.59 0.48 0.00 1.98 2.12 -0.98 -2.26 118.70 119.45 2ja7 s GLU 126 Ca 0.07 -0.06 0.00 0.00 0.36 0.00 0.00 54.97 55.34 2ja7 s GLU 126 Cb -0.07 -0.55 0.00 0.00 0.26 0.00 0.00 34.13 33.77 2ja7 s GLU 126 CO -0.00 -0.04 0.00 0.41 -0.54 0.00 0.00 175.26 175.09 2ja7 n GLY 127 N 3.73 -0.24 0.00 -1.50 0.00 -1.21 -2.40 105.19 103.58 2ja7 n GLY 127 Ca -0.22 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2ja7 n GLY 127 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ja7 n ASN 128 N 0.00 0.00 -0.85 1.61 2.85 -1.26 -2.93 115.26 114.68 2ja7 n ASN 128 Ca 0.00 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 54.54 2ja7 n ASN 128 Cb 0.00 0.00 0.21 0.00 1.24 0.00 0.00 39.78 41.23 2ja7 n ASN 128 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ja7 n TYR 129 N 0.00 0.64 -1.34 1.20 0.18 -1.26 -4.57 117.16 112.00 2ja7 n TYR 129 Ca 0.00 -0.51 -0.31 0.00 1.88 0.00 0.00 57.90 58.95 2ja7 n TYR 129 Cb 0.00 -0.03 0.05 0.00 -0.38 0.00 0.00 39.34 38.98 2ja7 n TYR 129 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2ja7 n ARG 130 N 0.79 2.49 -0.35 -3.48 3.00 -1.26 -4.59 116.66 113.26 2ja7 n ARG 130 Ca 0.16 -2.88 -0.01 0.00 -0.01 0.00 0.00 57.85 55.10 2ja7 n ARG 130 Cb 0.50 -2.13 0.12 0.00 0.00 0.00 0.00 32.46 30.96 2ja7 n ARG 130 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 2ja7 h ASN 131 N 2.12 1.02 -0.20 0.55 2.35 -1.93 -2.50 115.58 116.98 2ja7 h ASN 131 Ca 0.52 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.26 2ja7 h ASN 131 Cb 0.70 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.84 2ja7 h ASN 131 CO 1.34 0.70 0.00 0.18 -1.65 0.00 0.00 177.43 178.00 2ja7 n LEU 132 N -4.49 2.99 -0.03 1.61 4.77 -1.26 -4.74 117.00 115.86 2ja7 n LEU 132 Ca 0.12 -2.54 -0.07 0.00 -0.03 0.00 0.00 56.01 53.49 2ja7 n LEU 132 Cb 0.09 -0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 40.82 2ja7 n LEU 132 CO 0.34 0.67 -0.57 0.59 -1.33 0.00 0.00 177.39 177.09 2ja7 n ASN 133 N -0.36 1.03 -4.55 -1.43 3.02 -1.09 -4.94 115.26 106.93 2ja7 n ASN 133 Ca 0.14 0.16 -0.39 0.00 -0.03 0.00 0.00 54.58 54.46 2ja7 n ASN 133 Cb 0.59 -0.38 -0.03 0.00 -0.61 0.00 0.00 39.78 39.35 2ja7 n ASN 133 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2ja7 s ASN 134 N -5.93 5.89 1.24 6.41 3.84 -0.96 -4.89 114.94 120.54 2ja7 s ASN 134 Ca -0.12 -0.45 -0.12 0.00 0.21 0.00 0.00 52.86 52.37 2ja7 s ASN 134 Cb 0.04 -2.55 0.19 0.00 -0.55 0.00 0.00 41.25 38.37 2ja7 s ASN 134 CO 0.17 -2.01 0.43 0.18 -2.79 0.00 0.00 177.10 173.08 2ja7 n LEU 135 N 10.62 0.00 -0.00 3.21 4.77 -1.26 -4.96 117.00 129.38 2ja7 n LEU 135 Ca 0.17 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 2ja7 n LEU 135 Cb 0.50 -0.49 -0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2ja7 n LEU 135 CO 0.69 -2.16 0.11 0.29 -1.33 0.00 0.00 177.39 174.98 2ja7 n LYS 136 N -3.89 3.63 -1.00 3.23 5.02 -1.26 -5.06 118.16 118.83 2ja7 n LYS 136 Ca 0.07 -0.21 -0.30 0.00 -2.02 0.00 0.00 58.31 55.85 2ja7 n LYS 136 Cb 0.30 -0.72 0.23 0.00 -0.02 0.00 0.00 35.03 34.82 2ja7 n LYS 136 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2ja7 s GLN 137 N -0.60 -1.05 -0.01 1.97 -0.21 -1.26 -4.83 119.66 113.67 2ja7 s GLN 137 Ca 0.00 0.12 -0.20 0.00 0.02 0.00 0.00 55.36 55.30 2ja7 s GLN 137 Cb 0.00 -1.60 -0.11 0.00 1.00 0.00 0.00 33.01 32.30 2ja7 s GLN 137 CO 0.01 -3.63 0.89 1.49 -2.12 0.00 0.00 175.29 171.92 2ja7 h GLU 138 N -2.53 -0.71 -4.50 2.91 4.81 -1.89 -3.39 114.58 109.28 2ja7 h GLU 138 Ca -0.48 0.05 -0.59 0.00 -0.13 0.00 0.00 59.36 58.21 2ja7 h GLU 138 Cb 1.31 0.16 0.04 0.00 0.63 0.00 0.00 28.75 30.89 2ja7 h GLU 138 CO 0.40 -0.47 0.01 0.09 -0.73 0.00 0.00 179.01 178.31 2ja7 n ASN 139 N -5.01 -0.08 0.00 1.04 3.02 -1.26 -4.25 115.26 108.71 2ja7 n ASN 139 Ca -0.09 0.87 0.00 0.00 -0.03 0.00 0.00 54.58 55.33 2ja7 n ASN 139 Cb 0.29 -0.69 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 2ja7 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ja7 n ALA 140 N 1.04 0.00 -1.77 5.41 0.00 -1.26 -4.81 120.51 119.13 2ja7 n ALA 140 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.19 2ja7 n ALA 140 Cb 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.49 2ja7 n ALA 140 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2ja7 s TYR 141 N 0.00 3.30 0.08 0.00 1.51 -0.98 -3.82 117.35 117.44 2ja7 s TYR 141 Ca 0.00 1.59 0.06 0.00 -1.01 0.00 0.00 57.07 57.71 2ja7 s TYR 141 Cb 0.00 -3.40 -0.04 0.00 -0.11 0.00 0.00 41.96 38.41 2ja7 s TYR 141 CO 0.00 -1.07 -0.09 -1.17 -1.11 0.00 0.00 175.55 172.11 2ja7 s LEU 142 N -1.86 3.06 0.07 -1.29 2.96 -0.46 -4.02 118.68 117.14 2ja7 s LEU 142 Ca 0.49 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 54.08 2ja7 s LEU 142 Cb -0.33 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.49 2ja7 s LEU 142 CO 0.43 0.20 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.84 2ja7 s LEU 143 N -2.04 2.43 -0.11 -0.68 1.02 -1.20 -1.67 118.68 116.43 2ja7 s LEU 143 Ca 0.21 -0.87 -0.12 0.00 0.02 0.00 0.00 54.13 53.36 2ja7 s LEU 143 Cb -0.11 -0.02 0.03 0.00 0.02 0.00 0.00 46.19 46.11 2ja7 s LEU 143 CO 0.13 -0.43 0.33 -0.63 0.02 0.00 0.00 176.35 175.76 2ja7 s ILE 144 N -3.06 0.01 0.02 -0.59 1.01 -0.41 -2.89 121.20 115.28 2ja7 s ILE 144 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.63 2ja7 s ILE 144 Cb 0.02 -0.49 -0.02 0.00 0.01 0.00 0.00 42.46 41.98 2ja7 s ILE 144 CO -0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 174.94 174.82 2ja7 s ARG 145 N -0.03 0.34 0.00 2.79 1.70 -1.12 -0.00 118.95 122.62 2ja7 s ARG 145 Ca -0.02 -0.62 0.00 0.00 -0.47 0.00 0.00 55.73 54.62 2ja7 s ARG 145 Cb -0.03 0.06 0.00 0.00 -0.57 0.00 0.00 34.95 34.41 2ja7 s ARG 145 CO 0.01 -0.04 0.00 0.54 -1.08 0.00 0.00 175.30 174.73