#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jn9 n VAL 2 N 0.00 -3.70 0.00 2.03 0.31 -1.26 -4.62 118.33 111.09 2jn9 n VAL 2 Ca 0.00 1.28 0.00 0.00 -0.01 0.00 0.00 64.34 65.61 2jn9 n VAL 2 Cb 0.00 -2.32 0.00 0.00 -0.91 0.00 0.00 33.84 30.61 2jn9 n VAL 2 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2jn9 n LYS 3 N 0.08 0.00 -2.75 5.55 5.02 -1.26 -4.81 118.16 119.99 2jn9 n LYS 3 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2jn9 n LYS 3 Cb 0.00 -0.18 -0.02 0.00 -0.02 0.00 0.00 35.03 34.81 2jn9 n LYS 3 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2jn9 s THR 4 N 0.00 4.40 -0.45 -0.18 2.01 -1.26 -4.81 115.64 115.34 2jn9 s THR 4 Ca 0.00 -1.45 -0.21 0.00 0.31 0.00 0.00 61.69 60.34 2jn9 s THR 4 Cb 0.00 -4.95 0.03 0.00 0.01 0.00 0.00 72.50 67.59 2jn9 s THR 4 CO 0.00 -1.74 0.66 -0.22 -0.69 0.00 0.00 174.62 172.62 2jn9 s LEU 5 N 3.58 4.51 -0.45 4.42 2.96 -1.25 -4.68 118.68 127.77 2jn9 s LEU 5 Ca 0.41 -0.36 -0.11 0.00 -0.22 0.00 0.00 54.13 53.85 2jn9 s LEU 5 Cb -0.02 -2.73 0.09 0.00 0.50 0.00 0.00 46.19 44.04 2jn9 s LEU 5 CO -0.06 -0.80 0.32 -0.60 -1.32 0.00 0.00 176.35 173.88 2jn9 s ARG 6 N 2.86 2.66 -0.22 1.98 3.52 -0.90 -0.78 118.95 128.07 2jn9 s ARG 6 Ca 0.23 -1.53 -0.11 0.00 -0.13 0.00 0.00 55.73 54.19 2jn9 s ARG 6 Cb -0.14 -3.90 -0.05 0.00 -1.56 0.00 0.00 34.95 29.29 2jn9 s ARG 6 CO 0.19 -1.05 0.16 -0.51 -0.81 0.00 0.00 175.30 173.28 2jn9 s LEU 7 N 1.45 4.16 -1.75 -0.88 1.43 0.08 -1.08 118.68 122.08 2jn9 s LEU 7 Ca 0.04 0.18 -0.00 0.00 -1.03 0.00 0.00 54.13 53.31 2jn9 s LEU 7 Cb -0.24 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 43.86 2jn9 s LEU 7 CO 0.02 0.11 0.04 0.59 0.23 0.00 0.00 176.35 177.34 2jn9 n ASN 8 N 3.97 -5.87 -0.40 2.29 3.02 0.40 -0.80 115.26 117.87 2jn9 n ASN 8 Ca -0.15 -0.04 -0.05 0.00 -0.03 0.00 0.00 54.58 54.31 2jn9 n ASN 8 Cb 0.52 -4.87 -0.02 0.00 -0.61 0.00 0.00 39.78 34.80 2jn9 n ASN 8 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2jn9 n ASN 9 N -1.97 -4.25 -4.45 6.41 4.13 -1.26 -4.98 115.26 108.89 2jn9 n ASN 9 Ca -0.24 0.13 -0.34 0.00 1.68 0.00 0.00 54.58 55.81 2jn9 n ASN 9 Cb 0.68 -2.20 -0.13 0.00 -1.54 0.00 0.00 39.78 36.59 2jn9 n ASN 9 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2jn9 s VAL 10 N -1.98 3.83 0.18 2.41 1.01 0.02 -5.08 120.40 120.80 2jn9 s VAL 10 Ca 0.00 -0.37 -0.30 0.00 0.00 0.00 0.00 61.98 61.31 2jn9 s VAL 10 Cb 0.00 -2.71 -0.09 0.00 0.00 0.00 0.00 36.38 33.59 2jn9 s VAL 10 CO 0.00 0.46 1.32 0.28 0.00 0.00 0.00 175.10 177.16 2jn9 s THR 11 N 0.73 3.24 0.07 3.92 -1.32 -1.26 -0.75 115.64 120.27 2jn9 s THR 11 Ca -0.01 1.00 0.07 0.00 -1.21 0.00 0.00 61.69 61.54 2jn9 s THR 11 Cb -0.14 -3.64 -0.03 0.00 -1.51 0.00 0.00 72.50 67.18 2jn9 s THR 11 CO 0.02 0.14 -0.20 -0.22 -2.21 0.00 0.00 174.62 172.15 2jn9 s LEU 12 N 0.07 2.23 0.18 9.08 2.96 0.04 -4.92 118.68 128.31 2jn9 s LEU 12 Ca 0.58 -0.59 0.08 0.00 -0.22 0.00 0.00 54.13 53.98 2jn9 s LEU 12 Cb -0.36 -0.89 -0.04 0.00 0.50 0.00 0.00 46.19 45.39 2jn9 s LEU 12 CO 0.37 0.10 -0.06 -1.61 -1.32 0.00 0.00 176.35 173.83 2jn9 s GLU 13 N -1.50 2.20 0.12 1.98 2.02 -1.26 -3.76 118.70 118.49 2jn9 s GLU 13 Ca 0.06 -1.21 0.02 0.00 0.02 0.00 0.00 54.97 53.86 2jn9 s GLU 13 Cb -0.09 -2.23 -0.01 0.00 0.10 0.00 0.00 34.13 31.90 2jn9 s GLU 13 CO 0.03 0.44 0.05 -1.33 0.02 0.00 0.00 175.26 174.47 2jn9 n MET 14 N -0.04 0.65 0.09 1.61 2.81 -1.26 -4.69 117.12 116.29 2jn9 n MET 14 Ca -0.10 -1.03 0.00 0.00 -1.81 0.00 0.00 57.70 54.76 2jn9 n MET 14 Cb 0.55 0.63 0.00 0.00 -0.71 0.00 0.00 33.22 33.69 2jn9 n MET 14 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2jn9 n ALA 15 N -2.39 3.00 -3.82 3.04 0.00 -0.90 -4.79 120.51 114.65 2jn9 n ALA 15 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.10 2jn9 n ALA 15 Cb 0.18 0.10 -0.13 0.00 0.00 0.00 0.00 19.45 19.61 2jn9 n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jn9 s ALA 16 N -2.00 2.82 -0.64 0.00 0.00 -1.26 -4.81 121.76 115.87 2jn9 s ALA 16 Ca 0.00 -3.04 -0.27 0.00 0.00 0.00 0.00 51.96 48.64 2jn9 s ALA 16 Cb 0.00 -2.02 0.02 0.00 0.00 0.00 0.00 23.12 21.12 2jn9 s ALA 16 CO 0.00 -2.05 1.37 -0.47 0.00 0.00 0.00 175.76 174.61 2jn9 s TYR 17 N -0.19 2.28 -0.18 0.00 5.04 -1.26 -2.56 117.35 120.48 2jn9 s TYR 17 Ca 0.19 0.29 0.01 0.00 -2.44 0.00 0.00 57.07 55.12 2jn9 s TYR 17 Cb -0.21 -4.48 0.02 0.00 0.35 0.00 0.00 41.96 37.64 2jn9 s TYR 17 CO -0.03 -1.98 -0.19 -1.14 -1.34 0.00 0.00 175.55 170.87 2jn9 s GLN 18 N 5.65 3.02 -0.01 4.97 -0.44 -0.84 -3.86 119.66 128.16 2jn9 s GLN 18 Ca 0.45 -0.82 0.08 0.00 -2.50 0.00 0.00 55.36 52.58 2jn9 s GLN 18 Cb -0.09 -2.60 -0.02 0.00 -1.64 0.00 0.00 33.01 28.66 2jn9 s GLN 18 CO 0.21 -0.19 -0.26 -2.00 0.50 0.00 0.00 175.29 173.55 2jn9 s GLU 19 N 1.27 2.00 -0.28 1.67 2.12 -1.26 -0.97 118.70 123.25 2jn9 s GLU 19 Ca 0.04 -0.95 -0.11 0.00 0.36 0.00 0.00 54.97 54.31 2jn9 s GLU 19 Cb -0.13 -1.98 -0.05 0.00 0.26 0.00 0.00 34.13 32.23 2jn9 s GLU 19 CO -0.11 0.54 0.20 -1.21 -0.54 0.00 0.00 175.26 174.13 2jn9 s GLU 20 N -0.73 3.93 0.00 4.30 0.41 0.14 -4.97 118.70 121.79 2jn9 s GLU 20 Ca 0.10 -0.32 0.16 0.00 -0.41 0.00 0.00 54.97 54.50 2jn9 s GLU 20 Cb -0.10 -3.67 -0.12 0.00 -1.78 0.00 0.00 34.13 28.46 2jn9 s GLU 20 CO -0.00 -0.20 0.72 0.43 -0.49 0.00 0.00 175.26 175.72 2jn9 n SER 21 N 5.07 0.99 -0.10 -0.19 7.64 -1.24 -0.60 113.62 125.19 2jn9 n SER 21 Ca -0.14 -1.00 -0.17 0.00 1.01 0.00 0.00 58.87 58.57 2jn9 n SER 21 Cb 0.52 0.85 -0.06 0.00 -1.01 0.00 0.00 64.21 64.51 2jn9 n SER 21 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2jn9 n GLU 22 N -1.00 0.52 0.27 1.43 -0.58 -1.26 -4.46 120.64 115.56 2jn9 n GLU 22 Ca 0.04 0.22 0.18 0.00 -0.42 0.00 0.00 57.16 57.17 2jn9 n GLU 22 Cb 0.27 -1.40 0.79 0.00 -0.57 0.00 0.00 31.44 30.53 2jn9 n GLU 22 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2jn9 h PRO 23 N -0.94 0.00 0.00 3.49 0.13 -2.01 -3.46 132.00 129.21 2jn9 h PRO 23 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2jn9 h PRO 23 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2jn9 h PRO 23 CO -0.18 0.00 0.00 1.17 -0.23 0.00 0.00 178.00 178.76 2jn9 n LYS 24 N -2.92 -1.46 -3.22 0.86 4.81 -1.26 -5.04 118.16 109.94 2jn9 n LYS 24 Ca -0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 58.31 56.98 2jn9 n LYS 24 Cb 0.22 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.26 2jn9 n LYS 24 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2jn9 s ARG 25 N -0.53 3.78 -0.33 1.64 0.52 -1.26 -3.65 118.95 119.12 2jn9 s ARG 25 Ca 0.00 -2.51 -0.05 0.00 -0.52 0.00 0.00 55.73 52.65 2jn9 s ARG 25 Cb 0.00 -4.61 0.04 0.00 0.52 0.00 0.00 34.95 30.90 2jn9 s ARG 25 CO 0.00 -1.42 0.08 0.21 0.02 0.00 0.00 175.30 174.20 2jn9 s LYS 26 N 0.47 2.56 -0.27 3.54 2.20 0.23 -0.99 119.74 127.47 2jn9 s LYS 26 Ca 0.26 -1.22 -0.09 0.00 -0.36 0.00 0.00 55.97 54.56 2jn9 s LYS 26 Cb -0.08 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.81 2jn9 s LYS 26 CO -0.08 -0.67 0.12 0.96 -0.36 0.00 0.00 175.35 175.32 2jn9 s ILE 27 N 1.36 4.65 -0.35 5.43 -4.36 0.65 0.28 121.20 128.86 2jn9 s ILE 27 Ca -0.02 -0.09 0.01 0.00 -0.26 0.00 0.00 60.65 60.29 2jn9 s ILE 27 Cb -0.20 -3.21 0.09 0.00 1.25 0.00 0.00 42.46 40.40 2jn9 s ILE 27 CO 0.02 0.28 0.07 0.00 0.24 0.00 0.00 174.94 175.55 2jn9 s ALA 28 N 1.66 2.92 0.07 2.27 0.00 -0.14 -0.80 121.76 127.75 2jn9 s ALA 28 Ca 0.06 -2.37 0.08 0.00 0.00 0.00 0.00 51.96 49.73 2jn9 s ALA 28 Cb -0.16 -2.04 -0.03 0.00 0.00 0.00 0.00 23.12 20.89 2jn9 s ALA 28 CO 0.06 -1.62 -0.22 -0.59 0.00 0.00 0.00 175.76 173.39 2jn9 s PHE 29 N 1.02 1.89 -0.32 0.00 -0.71 -0.83 -1.98 117.98 117.05 2jn9 s PHE 29 Ca 0.06 -0.39 -0.25 0.00 -1.04 0.00 0.00 56.93 55.31 2jn9 s PHE 29 Cb -0.20 -1.08 0.01 0.00 -1.21 0.00 0.00 43.02 40.53 2jn9 s PHE 29 CO -0.06 0.16 0.85 0.95 -1.34 0.00 0.00 175.22 175.79 2jn9 s THR 30 N -0.97 4.72 -0.71 -4.49 -4.23 -1.06 -2.47 115.64 106.43 2jn9 s THR 30 Ca 0.08 1.28 -0.23 0.00 -1.18 0.00 0.00 61.69 61.64 2jn9 s THR 30 Cb -0.09 -4.22 0.07 0.00 1.34 0.00 0.00 72.50 69.59 2jn9 s THR 30 CO 0.03 -0.32 1.07 -0.22 -0.54 0.00 0.00 174.62 174.64 2jn9 s LEU 31 N 3.13 4.13 0.05 4.79 0.20 -0.20 -2.11 118.68 128.67 2jn9 s LEU 31 Ca 0.35 -0.98 -0.30 0.00 0.69 0.00 0.00 54.13 53.89 2jn9 s LEU 31 Cb -0.14 -2.46 -0.09 0.00 -0.43 0.00 0.00 46.19 43.08 2jn9 s LEU 31 CO 0.14 -1.50 1.81 0.21 -0.29 0.00 0.00 176.35 176.71 2jn9 s ASN 32 N 3.75 6.51 -0.53 3.68 3.84 -1.26 0.37 114.94 131.29 2jn9 s ASN 32 Ca 0.27 2.59 -0.05 0.00 0.21 0.00 0.00 52.86 55.88 2jn9 s ASN 32 Cb -0.13 -2.55 0.14 0.00 -0.55 0.00 0.00 41.25 38.16 2jn9 s ASN 32 CO 0.09 -0.98 0.36 -0.69 -2.79 0.00 0.00 177.10 173.09 2jn9 s VAL 33 N 3.49 3.79 0.88 -5.21 1.01 0.11 -4.88 120.40 119.58 2jn9 s VAL 33 Ca 0.81 -2.39 -0.13 0.00 0.00 0.00 0.00 61.98 60.26 2jn9 s VAL 33 Cb -0.41 -3.50 0.14 0.00 0.00 0.00 0.00 36.38 32.60 2jn9 s VAL 33 CO 0.36 -0.80 1.24 0.42 0.00 0.00 0.00 175.10 176.32 2jn9 s THR 34 N 0.65 2.02 0.03 3.92 -4.23 -1.26 -0.06 115.64 116.70 2jn9 s THR 34 Ca 0.12 -0.03 0.32 0.00 -1.18 0.00 0.00 61.69 60.92 2jn9 s THR 34 Cb -0.22 -2.99 0.37 0.00 1.34 0.00 0.00 72.50 71.00 2jn9 s THR 34 CO -0.03 0.00 1.96 0.77 -0.54 0.00 0.00 174.62 176.77 2jn9 h SER 35 N -1.32 0.00 0.50 3.99 4.64 -1.98 -0.69 113.55 118.69 2jn9 h SER 35 Ca -0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.85 2jn9 h SER 35 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2jn9 h SER 35 CO 0.51 0.00 -0.24 -0.08 -0.87 0.00 0.00 176.83 176.14 2jn9 h GLU 36 N 0.00 -0.65 -0.52 4.77 4.57 -1.99 -3.31 114.58 117.45 2jn9 h GLU 36 Ca 0.00 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2jn9 h GLU 36 Cb 0.44 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2jn9 h GLU 36 CO 0.00 -0.34 0.00 -2.37 -1.18 0.00 0.00 179.01 175.12 2jn9 n THR 37 N -5.28 2.18 0.20 0.32 5.66 -1.16 -4.60 114.28 111.59 2jn9 n THR 37 Ca -0.11 -1.40 -0.15 0.00 -3.05 0.00 0.00 64.05 59.34 2jn9 n THR 37 Cb 0.32 -0.06 -0.07 0.00 -1.55 0.00 0.00 70.33 68.97 2jn9 n THR 37 CO 0.00 0.00 0.00 0.22 -3.05 0.00 0.00 175.07 172.24 2jn9 h TYR 38 N 3.40 -0.86 -0.38 1.09 3.20 -1.22 -2.34 116.97 119.86 2jn9 h TYR 38 Ca 0.00 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.96 2jn9 h TYR 38 Cb 1.57 0.34 -0.02 0.00 1.54 0.00 0.00 36.73 40.16 2jn9 h TYR 38 CO 0.77 -0.45 0.26 1.12 -1.64 0.00 0.00 178.16 178.22 2jn9 h HIS 39 N -0.66 0.15 0.04 -3.82 2.07 -1.84 0.83 115.15 111.92 2jn9 h HIS 39 Ca -0.01 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.51 2jn9 h HIS 39 Cb 0.61 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 30.54 2jn9 h HIS 39 CO -0.20 0.08 -0.02 0.22 -3.07 0.00 0.00 177.93 174.94 2jn9 h ASP 40 N 0.15 -0.04 1.41 3.10 1.82 -1.78 -3.24 116.42 117.83 2jn9 h ASP 40 Ca 0.18 -0.63 0.00 0.00 -0.39 0.00 0.00 57.03 56.19 2jn9 h ASP 40 Cb 0.51 0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.53 2jn9 h ASP 40 CO -0.02 0.65 0.00 0.40 -1.61 0.00 0.00 179.24 178.65 2jn9 h ILE 41 N -0.77 0.00 0.00 2.25 2.04 -1.15 -2.06 117.51 117.81 2jn9 h ILE 41 Ca -0.01 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 2jn9 h ILE 41 Cb 0.67 1.61 -0.00 0.00 -0.74 0.00 0.00 36.82 38.35 2jn9 h ILE 41 CO 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 178.15 178.07 2jn9 h ALA 42 N 2.12 1.28 0.12 1.87 0.00 -0.87 -2.63 119.26 121.16 2jn9 h ALA 42 Ca 0.00 -0.08 -0.36 0.00 0.00 0.00 0.00 54.91 54.47 2jn9 h ALA 42 Cb 0.70 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2jn9 h ALA 42 CO 0.00 0.11 -1.97 0.28 0.00 0.00 0.00 179.25 177.66 2jn9 n VAL 43 N -3.60 1.78 -2.97 0.00 0.31 -0.81 -4.72 118.33 108.32 2jn9 n VAL 43 Ca -0.02 -0.67 -0.44 0.00 -0.01 0.00 0.00 64.34 63.21 2jn9 n VAL 43 Cb 0.21 -1.70 -0.03 0.00 -0.91 0.00 0.00 33.84 31.40 2jn9 n VAL 43 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2jn9 s LEU 44 N -7.00 4.99 -0.52 7.52 2.96 -0.99 -4.97 118.68 120.67 2jn9 s LEU 44 Ca -0.21 -1.56 0.02 0.00 -0.22 0.00 0.00 54.13 52.16 2jn9 s LEU 44 Cb 0.07 -2.37 0.13 0.00 0.50 0.00 0.00 46.19 44.52 2jn9 s LEU 44 CO 0.78 -1.19 0.28 -1.48 -1.32 0.00 0.00 176.35 173.42 2jn9 s LEU 45 N 3.04 4.70 -0.01 -0.68 2.34 -1.26 -4.73 118.68 122.08 2jn9 s LEU 45 Ca 0.23 -2.80 -0.01 0.00 0.06 0.00 0.00 54.13 51.61 2jn9 s LEU 45 Cb -0.14 -1.71 0.00 0.00 -0.56 0.00 0.00 46.19 43.78 2jn9 s LEU 45 CO 0.01 -0.31 0.02 0.00 -1.06 0.00 0.00 176.35 175.01 2jn9 n TYR 46 N 3.45 -0.36 -0.47 3.48 0.18 -1.26 -4.99 117.16 117.19 2jn9 n TYR 46 Ca 0.05 0.21 0.00 0.00 1.88 0.00 0.00 57.90 60.04 2jn9 n TYR 46 Cb 0.36 -1.24 0.00 0.00 -0.38 0.00 0.00 39.34 38.08 2jn9 n TYR 46 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2jn9 n GLU 47 N 2.47 -0.81 -0.04 -3.48 1.02 -1.26 -5.05 120.64 113.49 2jn9 n GLU 47 Ca -0.03 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.07 2jn9 n GLU 47 Cb 0.05 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.46 2jn9 n GLU 47 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2jn9 n LYS 48 N -1.36 0.25 -3.21 3.49 5.02 -1.26 -4.67 118.16 116.41 2jn9 n LYS 48 Ca 0.00 0.17 -0.40 0.00 -2.02 0.00 0.00 58.31 56.06 2jn9 n LYS 48 Cb 0.00 -1.01 -0.07 0.00 -0.02 0.00 0.00 35.03 33.93 2jn9 n LYS 48 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2jn9 s THR 49 N -1.84 5.06 -0.24 -0.18 -4.23 -1.26 -0.64 115.64 112.31 2jn9 s THR 49 Ca -0.12 0.95 0.00 0.00 -1.18 0.00 0.00 61.69 61.34 2jn9 s THR 49 Cb 0.02 -3.85 0.04 0.00 1.34 0.00 0.00 72.50 70.04 2jn9 s THR 49 CO 0.18 0.10 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.90 2jn9 s PHE 50 N 2.19 3.07 -0.77 3.99 0.08 -0.89 -4.94 117.98 120.71 2jn9 s PHE 50 Ca 0.23 -1.80 -0.26 0.00 0.12 0.00 0.00 56.93 55.22 2jn9 s PHE 50 Cb -0.16 -2.00 0.00 0.00 -0.57 0.00 0.00 43.02 40.30 2jn9 s PHE 50 CO 0.09 -0.79 1.61 1.21 -0.10 0.00 0.00 175.22 177.24 2jn9 s ASN 51 N 1.25 5.74 -0.42 1.36 2.47 -1.26 -0.45 114.94 123.64 2jn9 s ASN 51 Ca -0.02 -0.38 -0.27 0.00 0.42 0.00 0.00 52.86 52.62 2jn9 s ASN 51 Cb -0.17 -2.55 0.02 0.00 -1.45 0.00 0.00 41.25 37.10 2jn9 s ASN 51 CO -0.06 -2.12 1.00 -0.69 -3.72 0.00 0.00 177.10 171.51 2jn9 s VAL 52 N 7.47 4.44 -0.24 -5.21 1.01 0.76 -0.46 120.40 128.18 2jn9 s VAL 52 Ca 0.53 1.14 -0.00 0.00 0.00 0.00 0.00 61.98 63.65 2jn9 s VAL 52 Cb -0.08 -4.44 0.07 0.00 0.00 0.00 0.00 36.38 31.92 2jn9 s VAL 52 CO 0.10 -0.74 -0.01 -0.70 0.00 0.00 0.00 175.10 173.76 2jn9 s GLU 53 N 3.83 1.24 -0.22 2.72 -6.30 -0.24 -1.02 118.70 118.71 2jn9 s GLU 53 Ca 0.41 -0.87 -0.03 0.00 -2.50 0.00 0.00 54.97 51.98 2jn9 s GLU 53 Cb -0.10 -2.41 0.10 0.00 0.00 0.00 0.00 34.13 31.72 2jn9 s GLU 53 CO 0.24 -0.67 0.24 0.54 0.02 0.00 0.00 175.26 175.63 2jn9 s VAL 54 N 1.53 -0.35 0.42 3.70 0.11 0.77 -2.11 120.40 124.48 2jn9 s VAL 54 Ca -0.02 -0.17 0.30 0.00 -2.93 0.00 0.00 61.98 59.16 2jn9 s VAL 54 Cb -0.18 -0.73 0.33 0.00 -1.53 0.00 0.00 36.38 34.26 2jn9 s VAL 54 CO -0.09 -0.25 2.11 1.55 -3.33 0.00 0.00 175.10 175.10 2jn9 h PRO 55 N 8.30 0.00 0.00 1.54 0.13 -1.84 0.19 132.00 140.32 2jn9 h PRO 55 Ca -0.17 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.87 2jn9 h PRO 55 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2jn9 h PRO 55 CO 0.29 0.08 -0.44 1.49 -0.23 0.00 0.00 178.00 179.20 2jn9 h GLU 56 N 0.00 0.00 -0.38 0.86 4.81 -1.94 -2.38 114.58 115.54 2jn9 h GLU 56 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2jn9 h GLU 56 Cb 0.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2jn9 h GLU 56 CO 0.01 0.44 0.00 0.54 -0.73 0.00 0.00 179.01 179.27 2jn9 n ARG 57 N -3.52 2.43 -3.11 1.92 5.12 -0.88 -4.95 116.66 113.67 2jn9 n ARG 57 Ca -0.00 -2.09 -0.22 0.00 -1.93 0.00 0.00 57.85 53.61 2jn9 n ARG 57 Cb 0.56 -1.37 0.01 0.00 -1.16 0.00 0.00 32.46 30.50 2jn9 n ARG 57 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2jn9 n ASP 58 N 0.95 -4.61 -4.45 0.55 8.00 -0.53 -4.93 116.55 111.54 2jn9 n ASP 58 Ca 0.15 -0.27 -0.37 0.00 0.71 0.00 0.00 54.79 55.01 2jn9 n ASP 58 Cb 0.48 -3.78 -0.12 0.00 -0.02 0.00 0.00 41.12 37.67 2jn9 n ASP 58 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2jn9 s LEU 59 N -6.44 3.59 -0.52 0.64 1.43 0.56 -4.97 118.68 112.97 2jn9 s LEU 59 Ca 0.31 -0.27 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 2jn9 s LEU 59 Cb -0.15 -1.94 0.16 0.00 0.03 0.00 0.00 46.19 44.29 2jn9 s LEU 59 CO 0.38 -0.07 0.37 0.00 0.23 0.00 0.00 176.35 177.27 2jn9 s ALA 60 N 1.62 2.37 -0.08 4.21 0.00 -1.24 -0.16 121.76 128.47 2jn9 s ALA 60 Ca 0.06 -2.95 -0.14 0.00 0.00 0.00 0.00 51.96 48.93 2jn9 s ALA 60 Cb -0.16 -1.85 0.03 0.00 0.00 0.00 0.00 23.12 21.15 2jn9 s ALA 60 CO 0.04 -2.04 0.35 0.12 0.00 0.00 0.00 175.76 174.24 2jn9 s PHE 61 N -0.39 -0.31 -0.68 0.00 5.36 -0.19 -5.02 117.98 116.75 2jn9 s PHE 61 Ca 0.27 0.66 -0.20 0.00 -0.96 0.00 0.00 56.93 56.70 2jn9 s PHE 61 Cb -0.05 0.13 0.10 0.00 -0.34 0.00 0.00 43.02 42.86 2jn9 s PHE 61 CO -0.14 -0.30 0.89 0.50 -1.46 0.00 0.00 175.22 174.70 2jn9 s ARG 62 N -0.56 3.18 -0.46 10.12 3.52 -1.26 -0.17 118.95 133.32 2jn9 s ARG 62 Ca -0.07 -1.21 -0.18 0.00 -0.13 0.00 0.00 55.73 54.13 2jn9 s ARG 62 Cb -0.04 -4.36 0.04 0.00 -1.56 0.00 0.00 34.95 29.03 2jn9 s ARG 62 CO 0.03 -1.69 0.54 0.20 -0.81 0.00 0.00 175.30 173.56 2jn9 s GLY 63 N 3.61 1.83 -0.07 8.12 0.00 0.40 -4.65 107.32 116.57 2jn9 s GLY 63 Ca 0.20 -1.59 -0.05 0.00 0.00 0.00 0.00 44.72 43.28 2jn9 s GLY 63 CO 0.05 1.33 0.15 -1.83 0.00 0.00 0.00 173.10 172.80 2jn9 s GLU 64 N 2.40 3.39 0.04 2.90 -1.05 -1.26 -2.09 118.70 123.03 2jn9 s GLU 64 Ca 0.14 -0.24 -0.31 0.00 -0.15 0.00 0.00 54.97 54.42 2jn9 s GLU 64 Cb -0.18 -3.11 -0.10 0.00 -0.44 0.00 0.00 34.13 30.30 2jn9 s GLU 64 CO 0.13 0.73 1.93 -1.33 0.95 0.00 0.00 175.26 177.67 2jn9 n MET 65 N 1.53 2.77 -0.08 -4.83 2.81 0.19 -4.46 117.12 115.05 2jn9 n MET 65 Ca -0.16 1.02 0.10 0.00 -1.81 0.00 0.00 57.70 56.85 2jn9 n MET 65 Cb 0.54 -2.95 0.13 0.00 -0.71 0.00 0.00 33.22 30.24 2jn9 n MET 65 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2jn9 n THR 66 N 5.30 0.23 -2.30 2.03 -2.24 -1.26 -4.97 114.28 111.08 2jn9 n THR 66 Ca 0.20 -0.62 -0.25 0.00 -2.27 0.00 0.00 64.05 61.11 2jn9 n THR 66 Cb 0.39 1.22 0.10 0.00 -2.10 0.00 0.00 70.33 69.93 2jn9 n THR 66 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2jn9 s ASN 67 N -1.56 4.43 -0.14 3.42 4.22 -1.26 -5.01 114.94 119.04 2jn9 s ASN 67 Ca 0.29 0.15 0.16 0.00 -2.14 0.00 0.00 52.86 51.32 2jn9 s ASN 67 Cb 0.19 -0.65 0.41 0.00 1.28 0.00 0.00 41.25 42.48 2jn9 s ASN 67 CO 0.27 -1.83 1.31 -1.22 -2.04 0.00 0.00 177.10 173.59 2jn9 n TYR 68 N -2.99 0.58 -2.34 1.54 4.01 -1.26 -5.02 117.16 111.68 2jn9 n TYR 68 Ca 0.11 -0.85 -0.01 0.00 -0.16 0.00 0.00 57.90 56.99 2jn9 n TYR 68 Cb 0.60 -0.23 -0.01 0.00 -0.31 0.00 0.00 39.34 39.40 2jn9 n TYR 68 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2jn9 n SER 69 N -0.66 -5.29 -0.05 7.72 2.88 -1.26 -4.95 113.62 112.02 2jn9 n SER 69 Ca 0.18 1.01 -0.10 0.00 -1.33 0.00 0.00 58.87 58.63 2jn9 n SER 69 Cb 0.74 -4.07 0.04 0.00 -0.75 0.00 0.00 64.21 60.18 2jn9 n SER 69 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2jn9 h THR 70 N 2.29 1.29 -4.15 2.46 2.02 -1.96 -3.47 112.91 111.39 2jn9 h THR 70 Ca -0.07 -1.62 -0.32 0.00 0.77 0.00 0.00 66.41 65.17 2jn9 h THR 70 Cb 0.17 1.54 -0.08 0.00 -1.74 0.00 0.00 68.15 68.03 2jn9 h THR 70 CO 0.06 0.52 -0.21 -1.20 0.37 0.00 0.00 175.52 175.06 2jn9 n SER 71 N -4.02 -1.19 0.00 4.18 7.64 -1.26 -5.14 113.62 113.83 2jn9 n SER 71 Ca -0.02 -2.91 0.00 0.00 1.01 0.00 0.00 58.87 56.94 2jn9 n SER 71 Cb 0.55 2.30 0.00 0.00 -1.01 0.00 0.00 64.21 66.04 2jn9 n SER 71 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jn9 n LEU 72 N 0.00 0.00 -1.93 -3.43 -0.00 -1.26 -4.80 117.00 105.57 2jn9 n LEU 72 Ca 0.02 0.00 -0.08 0.00 -0.00 0.00 0.00 56.01 55.96 2jn9 n LEU 72 Cb 0.58 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.89 2jn9 n LEU 72 CO 0.29 0.00 1.30 0.41 -0.00 0.00 0.00 177.39 179.39 2jn9 n THR 73 N 0.00 2.35 -3.59 1.47 -1.04 -1.26 -3.10 114.28 109.11 2jn9 n THR 73 Ca 0.00 -1.06 -0.28 0.00 -2.04 0.00 0.00 64.05 60.67 2jn9 n THR 73 Cb 0.00 -1.80 -0.16 0.00 -1.82 0.00 0.00 70.33 66.56 2jn9 n THR 73 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2jn9 s ASN 74 N 2.10 3.11 -0.02 8.00 0.02 -1.17 -4.05 114.94 122.92 2jn9 s ASN 74 Ca 0.42 -1.04 0.00 0.00 -1.02 0.00 0.00 52.86 51.22 2jn9 s ASN 74 Cb 0.20 -0.36 -0.02 0.00 0.02 0.00 0.00 41.25 41.09 2jn9 s ASN 74 CO 0.00 -0.40 -0.02 -0.11 0.02 0.00 0.00 177.10 176.60 2jn9 n LEU 75 N 5.22 2.46 0.00 0.60 7.94 -1.26 -4.62 117.00 127.34 2jn9 n LEU 75 Ca -0.06 -0.01 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 2jn9 n LEU 75 Cb 0.45 -0.06 0.00 0.00 0.53 0.00 0.00 43.42 44.34 2jn9 n LEU 75 CO 0.07 0.45 0.00 0.00 -1.11 0.00 0.00 177.39 176.81 2jn9 n TYR 76 N -2.48 0.00 -3.27 1.96 9.36 -1.26 -5.09 117.16 116.38 2jn9 n TYR 76 Ca -0.04 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.21 2jn9 n TYR 76 Cb 0.55 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.23 2jn9 n TYR 76 CO 0.00 0.00 0.00 -1.83 0.22 0.00 0.00 176.86 175.25 2jn9 s GLU 77 N 0.00 0.26 0.63 2.98 -1.05 -1.26 -5.18 118.70 115.08 2jn9 s GLU 77 Ca 0.00 0.57 -0.10 0.00 -0.15 0.00 0.00 54.97 55.29 2jn9 s GLU 77 Cb 0.00 0.33 -0.01 0.00 -0.44 0.00 0.00 34.13 34.01 2jn9 s GLU 77 CO 0.00 -0.18 1.01 -1.25 0.95 0.00 0.00 175.26 175.79 2jn9 s PRO 78 N 2.66 3.20 0.00 -4.83 0.05 -1.26 -5.02 135.00 129.79 2jn9 s PRO 78 Ca 0.00 0.45 0.00 0.00 0.05 0.00 0.00 61.00 61.50 2jn9 s PRO 78 Cb -0.08 -2.12 0.00 0.00 0.05 0.00 0.00 34.50 32.35 2jn9 s PRO 78 CO -0.15 -0.73 0.00 0.41 0.05 0.00 0.00 177.00 176.58 2jn9 n GLY 79 N -2.77 3.24 0.00 0.56 0.00 -1.26 -4.92 105.19 100.05 2jn9 n GLY 79 Ca 0.05 -0.43 0.11 0.00 0.00 0.00 0.00 46.02 45.76 2jn9 n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jn9 n ALA 80 N -3.00 2.16 -2.75 4.61 0.00 -1.26 -4.67 120.51 115.60 2jn9 n ALA 80 Ca 0.00 -0.11 -0.16 0.00 0.00 0.00 0.00 53.44 53.17 2jn9 n ALA 80 Cb 0.00 -1.37 -0.13 0.00 0.00 0.00 0.00 19.45 17.95 2jn9 n ALA 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jn9 s VAL 81 N -2.58 0.65 0.48 0.00 0.11 -1.26 -4.69 120.40 113.11 2jn9 s VAL 81 Ca 0.21 -0.66 0.09 0.00 -2.93 0.00 0.00 61.98 58.69 2jn9 s VAL 81 Cb 0.15 -0.61 0.04 0.00 -1.53 0.00 0.00 36.38 34.43 2jn9 s VAL 81 CO 0.35 -0.03 0.65 -0.44 -3.33 0.00 0.00 175.10 172.30 2jn9 s SER 82 N -0.76 5.44 -0.23 3.54 0.01 0.92 -4.56 113.70 118.07 2jn9 s SER 82 Ca -0.01 -0.59 -0.04 0.00 1.31 0.00 0.00 55.95 56.62 2jn9 s SER 82 Cb -0.06 -0.30 0.12 0.00 0.21 0.00 0.00 66.02 65.99 2jn9 s SER 82 CO 0.00 -0.98 0.40 -1.83 0.41 0.00 0.00 173.24 171.24 2jn9 s GLU 83 N -4.46 0.34 -0.14 12.44 -1.05 -1.26 0.04 118.70 124.60 2jn9 s GLU 83 Ca 0.57 0.74 -0.29 0.00 -0.15 0.00 0.00 54.97 55.84 2jn9 s GLU 83 Cb -0.08 -0.13 -0.01 0.00 -0.44 0.00 0.00 34.13 33.46 2jn9 s GLU 83 CO 0.35 -0.49 1.14 -0.06 0.95 0.00 0.00 175.26 177.15 2jn9 s PHE 84 N 2.58 3.19 -0.66 4.83 0.40 0.16 -3.05 117.98 125.42 2jn9 s PHE 84 Ca 0.08 1.29 -0.27 0.00 -0.60 0.00 0.00 56.93 57.43 2jn9 s PHE 84 Cb -0.14 -3.36 0.00 0.00 0.51 0.00 0.00 43.02 40.03 2jn9 s PHE 84 CO -0.15 -1.01 1.57 -0.47 0.70 0.00 0.00 175.22 175.86 2jn9 s TYR 85 N 2.80 1.99 -0.44 0.36 5.04 -1.18 -1.03 117.35 124.89 2jn9 s TYR 85 Ca 0.51 0.39 -0.08 0.00 -2.44 0.00 0.00 57.07 55.45 2jn9 s TYR 85 Cb -0.20 -4.35 0.10 0.00 0.35 0.00 0.00 41.96 37.86 2jn9 s TYR 85 CO 0.15 -2.19 0.28 0.42 -1.34 0.00 0.00 175.55 172.87 2jn9 s ILE 86 N 7.33 4.03 -0.44 3.14 -1.09 -1.03 -4.96 121.20 128.17 2jn9 s ILE 86 Ca 0.52 -1.67 -0.08 0.00 -2.23 0.00 0.00 60.65 57.19 2jn9 s ILE 86 Cb -0.11 -3.59 0.11 0.00 -1.58 0.00 0.00 42.46 37.29 2jn9 s ILE 86 CO 0.19 -0.64 0.29 -0.70 -1.23 0.00 0.00 174.94 172.86 2jn9 s GLU 87 N 1.35 2.43 -0.38 2.79 2.12 -1.26 -1.97 118.70 123.79 2jn9 s GLU 87 Ca 0.05 -1.69 -0.06 0.00 0.36 0.00 0.00 54.97 53.63 2jn9 s GLU 87 Cb -0.24 -3.82 0.07 0.00 0.26 0.00 0.00 34.13 30.40 2jn9 s GLU 87 CO -0.00 -1.10 0.17 0.42 -0.54 0.00 0.00 175.26 174.20 2jn9 s ILE 88 N 1.34 3.73 -0.09 -3.70 1.01 0.02 -4.60 121.20 118.91 2jn9 s ILE 88 Ca 0.05 -1.46 -0.10 0.00 0.00 0.00 0.00 60.65 59.14 2jn9 s ILE 88 Cb -0.25 -3.27 -0.05 0.00 0.01 0.00 0.00 42.46 38.91 2jn9 s ILE 88 CO -0.01 -0.40 0.23 -0.89 0.00 0.00 0.00 174.94 173.87 2jn9 s THR 89 N 1.33 5.35 -0.06 2.92 2.01 -1.26 -0.26 115.64 125.68 2jn9 s THR 89 Ca 0.02 0.41 -0.38 0.00 0.31 0.00 0.00 61.69 62.05 2jn9 s THR 89 Cb -0.22 -3.51 -0.16 0.00 0.01 0.00 0.00 72.50 68.63 2jn9 s THR 89 CO 0.01 0.58 1.53 1.21 -0.69 0.00 0.00 174.62 177.25 2jn9 n GLU 90 N 2.15 1.23 -1.93 4.92 2.13 -0.16 -4.35 120.64 124.63 2jn9 n GLU 90 Ca -0.17 0.45 -0.34 0.00 0.66 0.00 0.00 57.16 57.75 2jn9 n GLU 90 Cb 0.54 -2.12 0.03 0.00 0.27 0.00 0.00 31.44 30.16 2jn9 n GLU 90 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 2jn9 s ILE 91 N 1.82 3.11 0.79 6.31 2.07 -1.26 -4.88 121.20 129.16 2jn9 s ILE 91 Ca 0.90 0.59 -0.12 0.00 -1.41 0.00 0.00 60.65 60.61 2jn9 s ILE 91 Cb -0.98 -3.15 0.07 0.00 0.13 0.00 0.00 42.46 38.54 2jn9 s ILE 91 CO 0.54 -0.25 1.14 -1.81 -1.91 0.00 0.00 174.94 172.65 2jn9 s ASP 92 N -2.19 4.03 -0.20 4.50 1.11 -1.26 -4.94 116.67 117.71 2jn9 s ASP 92 Ca 0.70 2.09 0.15 0.00 0.18 0.00 0.00 52.55 55.67 2jn9 s ASP 92 Cb -0.23 -2.56 0.53 0.00 1.07 0.00 0.00 42.92 41.74 2jn9 s ASP 92 CO 0.36 -2.36 1.44 0.29 1.18 0.00 0.00 175.17 176.08 2jn9 n LYS 93 N -3.39 2.77 -1.14 8.23 5.02 -1.26 -4.83 118.16 123.56 2jn9 n LYS 93 Ca 0.11 -2.90 -0.34 0.00 -2.02 0.00 0.00 58.31 53.16 2jn9 n LYS 93 Cb 0.52 -1.86 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 2jn9 n LYS 93 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2jn9 n ASN 94 N -0.61 7.62 -0.25 4.39 5.15 -1.26 -4.91 115.26 125.39 2jn9 n ASN 94 Ca 0.24 -2.49 0.00 0.00 -0.60 0.00 0.00 54.58 51.73 2jn9 n ASN 94 Cb 0.94 -1.42 0.00 0.00 -0.53 0.00 0.00 39.78 38.77 2jn9 n ASN 94 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jn9 n ALA 95 N 3.74 0.00 -2.44 5.20 0.00 -1.26 -4.84 120.51 120.91 2jn9 n ALA 95 Ca 0.68 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.89 2jn9 n ALA 95 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 2jn9 n ALA 95 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jn9 s ASP 96 N -4.00 6.00 0.00 0.00 2.15 -1.26 -5.02 116.67 114.54 2jn9 s ASP 96 Ca 0.00 0.31 0.02 0.00 0.43 0.00 0.00 52.55 53.32 2jn9 s ASP 96 Cb 0.00 -1.68 0.04 0.00 -0.30 0.00 0.00 42.92 40.98 2jn9 s ASP 96 CO 0.00 -0.55 0.83 -0.24 -0.17 0.00 0.00 175.17 175.04 2jn9 n SER 97 N -1.95 -0.36 -4.49 -0.34 2.88 -1.26 -5.11 113.62 102.99 2jn9 n SER 97 Ca -0.01 -1.62 -0.37 0.00 -1.33 0.00 0.00 58.87 55.54 2jn9 n SER 97 Cb 0.57 0.09 -0.12 0.00 -0.75 0.00 0.00 64.21 64.00 2jn9 n SER 97 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2jn9 s LEU 98 N 0.00 3.61 0.27 2.46 2.01 -1.26 -5.05 118.68 120.72 2jn9 s LEU 98 Ca 0.03 -0.15 -0.08 0.00 0.01 0.00 0.00 54.13 53.95 2jn9 s LEU 98 Cb 0.04 -1.98 -0.01 0.00 0.01 0.00 0.00 46.19 44.25 2jn9 s LEU 98 CO -0.02 -0.03 0.42 -1.61 1.01 0.00 0.00 176.35 176.12 2jn9 s GLU 99 N 1.63 1.61 0.00 1.70 2.02 -1.26 -4.95 118.70 119.44 2jn9 s GLU 99 Ca 0.06 -1.46 0.00 0.00 0.02 0.00 0.00 54.97 53.59 2jn9 s GLU 99 Cb -0.15 0.43 0.00 0.00 0.10 0.00 0.00 34.13 34.51 2jn9 s GLU 99 CO 0.06 -0.65 0.00 0.72 0.02 0.00 0.00 175.26 175.41 2jn9 n HIS 100 N -0.42 0.00 -4.30 1.61 8.25 -1.26 -4.78 115.22 114.32 2jn9 n HIS 100 Ca -0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.30 2jn9 n HIS 100 Cb 0.62 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.63 2jn9 n HIS 100 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2jn9 s HIS 101 N 0.00 1.50 0.00 4.41 -3.43 -1.26 -5.14 115.29 111.36 2jn9 s HIS 101 Ca 0.00 -1.19 0.00 0.00 -0.80 0.00 0.00 55.06 53.07 2jn9 s HIS 101 Cb 0.00 -0.86 0.00 0.00 -1.43 0.00 0.00 32.58 30.29 2jn9 s HIS 101 CO 0.00 -0.36 0.00 0.72 -2.00 0.00 0.00 174.74 173.10 2jn9 n HIS 102 N -0.44 0.00 -2.64 0.38 -0.00 -1.23 -4.97 115.22 106.32 2jn9 n HIS 102 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.30 2jn9 n HIS 102 Cb 0.66 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.62 2jn9 n HIS 102 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2jn9 s HIS 103 N 2.43 3.62 0.00 4.41 3.76 -1.26 -4.10 115.29 124.15 2jn9 s HIS 103 Ca 0.00 1.61 0.00 0.00 -0.15 0.00 0.00 55.06 56.52 2jn9 s HIS 103 Cb 0.00 -3.19 0.00 0.00 1.11 0.00 0.00 32.58 30.50 2jn9 s HIS 103 CO 0.00 -0.31 0.00 -2.39 -0.85 0.00 0.00 174.74 171.19 2jn9 n HIS 104 N 3.74 0.00 -1.59 1.40 1.44 -1.26 -5.25 115.22 113.70 2jn9 n HIS 104 Ca 0.06 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.77 2jn9 n HIS 104 Cb 0.50 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.61 2jn9 n HIS 104 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11