#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jn9 s VAL 2 N 0.00 4.79 -0.26 3.17 1.01 -1.26 -4.99 120.40 122.86 2jn9 s VAL 2 Ca 0.00 1.31 -0.08 0.00 0.00 0.00 0.00 61.98 63.22 2jn9 s VAL 2 Cb 0.00 -3.96 -0.13 0.00 0.00 0.00 0.00 36.38 32.29 2jn9 s VAL 2 CO 0.00 0.47 -0.29 1.17 0.00 0.00 0.00 175.10 176.44 2jn9 n LYS 3 N 2.31 0.58 -3.21 2.72 4.81 -1.26 -4.84 118.16 119.26 2jn9 n LYS 3 Ca -0.07 0.21 -0.45 0.00 -0.87 0.00 0.00 58.31 57.12 2jn9 n LYS 3 Cb 0.51 -1.45 -0.04 0.00 0.02 0.00 0.00 35.03 34.06 2jn9 n LYS 3 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2jn9 s THR 4 N -2.48 5.06 0.10 3.15 2.01 -1.26 -4.83 115.64 117.38 2jn9 s THR 4 Ca -0.35 -1.38 0.07 0.00 0.31 0.00 0.00 61.69 60.34 2jn9 s THR 4 Cb 0.12 -4.43 -0.04 0.00 0.01 0.00 0.00 72.50 68.16 2jn9 s THR 4 CO 0.50 -1.02 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.07 2jn9 s LEU 5 N 1.97 2.97 -0.08 4.42 2.96 -1.23 -4.05 118.68 125.65 2jn9 s LEU 5 Ca 0.09 -0.41 -0.03 0.00 -0.22 0.00 0.00 54.13 53.56 2jn9 s LEU 5 Cb -0.25 -1.77 0.04 0.00 0.50 0.00 0.00 46.19 44.71 2jn9 s LEU 5 CO 0.03 0.18 0.16 -0.60 -1.32 0.00 0.00 176.35 174.80 2jn9 s ARG 6 N -2.14 0.09 -0.18 1.98 3.52 -0.43 0.13 118.95 121.92 2jn9 s ARG 6 Ca 0.20 0.45 0.00 0.00 -0.13 0.00 0.00 55.73 56.26 2jn9 s ARG 6 Cb -0.11 -0.19 0.04 0.00 -1.56 0.00 0.00 34.95 33.12 2jn9 s ARG 6 CO 0.13 -0.21 -0.10 -0.51 -0.81 0.00 0.00 175.30 173.80 2jn9 s LEU 7 N 1.52 1.97 -1.10 -0.88 1.43 0.12 -1.10 118.68 120.64 2jn9 s LEU 7 Ca -0.06 -0.73 -0.09 0.00 -1.03 0.00 0.00 54.13 52.22 2jn9 s LEU 7 Cb -0.12 -1.14 -0.05 0.00 0.03 0.00 0.00 46.19 44.92 2jn9 s LEU 7 CO -0.06 -0.13 0.88 0.59 0.23 0.00 0.00 176.35 177.85 2jn9 n ASN 8 N 4.75 -5.70 0.00 2.29 3.02 -0.91 -2.15 115.26 116.57 2jn9 n ASN 8 Ca -0.14 -0.79 0.00 0.00 -0.03 0.00 0.00 54.58 53.62 2jn9 n ASN 8 Cb 0.48 -4.69 0.00 0.00 -0.61 0.00 0.00 39.78 34.96 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 -3.07 0.00 -4.58 6.41 4.13 -1.26 -4.93 115.26 111.95 2jn9 n ASN 9 Ca -0.10 0.00 -0.38 0.00 1.68 0.00 0.00 54.58 55.78 2jn9 n ASN 9 Cb 0.62 -0.30 -0.11 0.00 -1.54 0.00 0.00 39.78 38.45 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 -1.14 5.27 0.44 2.41 1.01 -0.91 -5.06 120.40 122.42 2jn9 s VAL 10 Ca 0.00 0.13 -0.24 0.00 0.00 0.00 0.00 61.98 61.87 2jn9 s VAL 10 Cb 0.00 -3.53 -0.08 0.00 0.00 0.00 0.00 36.38 32.78 2jn9 s VAL 10 CO 0.00 0.23 1.18 0.28 0.00 0.00 0.00 175.10 176.79 2jn9 s THR 11 N 1.75 3.07 0.04 3.92 -1.32 -1.26 0.13 115.64 121.97 2jn9 s THR 11 Ca 0.07 0.84 0.03 0.00 -1.21 0.00 0.00 61.69 61.41 2jn9 s THR 11 Cb -0.16 -3.44 -0.02 0.00 -1.51 0.00 0.00 72.50 67.37 2jn9 s THR 11 CO 0.11 0.02 -0.09 -0.22 -2.21 0.00 0.00 174.62 172.23 2jn9 s LEU 12 N -2.86 2.22 0.14 9.08 2.96 0.12 -4.86 118.68 125.47 2jn9 s LEU 12 Ca 0.62 -0.48 0.11 0.00 -0.22 0.00 0.00 54.13 54.15 2jn9 s LEU 12 Cb -0.30 -0.26 -0.04 0.00 0.50 0.00 0.00 46.19 46.09 2jn9 s LEU 12 CO 0.37 -0.13 -0.25 -1.61 -1.32 0.00 0.00 176.35 173.41 2jn9 s GLU 13 N -1.35 1.49 0.09 1.98 2.02 -1.26 -3.47 118.70 118.21 2jn9 s GLU 13 Ca -0.06 -1.34 0.05 0.00 0.02 0.00 0.00 54.97 53.63 2jn9 s GLU 13 Cb -0.09 -1.93 -0.03 0.00 0.10 0.00 0.00 34.13 32.18 2jn9 s GLU 13 CO 0.01 0.45 -0.13 -1.64 0.02 0.00 0.00 175.26 173.97 2jn9 s MET 14 N -2.16 0.87 -0.23 1.61 -1.94 -1.26 -4.89 119.30 111.30 2jn9 s MET 14 Ca 0.16 -1.08 -0.12 0.00 -1.71 0.00 0.00 55.69 52.94 2jn9 s MET 14 Cb -0.10 -0.73 -0.18 0.00 2.01 0.00 0.00 34.83 35.83 2jn9 s MET 14 CO 0.07 0.14 -0.03 0.00 -0.01 0.00 0.00 175.02 175.19 2jn9 n ALA 15 N 0.88 1.06 -3.77 3.03 0.00 -0.58 -4.73 120.51 116.39 2jn9 n ALA 15 Ca -0.18 -0.83 -0.29 0.00 0.00 0.00 0.00 53.44 52.14 2jn9 n ALA 15 Cb 0.56 -0.26 -0.13 0.00 0.00 0.00 0.00 19.45 19.62 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 -2.48 2.64 -0.84 0.00 0.00 -1.00 -5.00 121.76 115.09 2jn9 s ALA 16 Ca -0.32 -2.96 -0.23 0.00 0.00 0.00 0.00 51.96 48.45 2jn9 s ALA 16 Cb 0.10 -1.97 0.07 0.00 0.00 0.00 0.00 23.12 21.31 2jn9 s ALA 16 CO 0.59 -2.05 1.22 -0.47 0.00 0.00 0.00 175.76 175.04 2jn9 s TYR 17 N -0.15 2.62 -0.60 0.00 5.04 -1.26 -0.32 117.35 122.68 2jn9 s TYR 17 Ca 0.20 -0.68 -0.11 0.00 -2.44 0.00 0.00 57.07 54.05 2jn9 s TYR 17 Cb -0.18 -4.49 0.15 0.00 0.35 0.00 0.00 41.96 37.79 2jn9 s TYR 17 CO -0.05 -1.81 0.50 -1.14 -1.34 0.00 0.00 175.55 171.72 2jn9 s GLN 18 N 4.47 2.90 -0.23 4.97 0.74 -0.16 -4.81 119.66 127.55 2jn9 s GLN 18 Ca 0.34 -2.04 -0.08 0.00 0.05 0.00 0.00 55.36 53.64 2jn9 s GLN 18 Cb -0.07 -4.12 -0.04 0.00 1.10 0.00 0.00 33.01 29.88 2jn9 s GLN 18 CO 0.02 -1.25 0.08 -2.00 -0.55 0.00 0.00 175.29 171.59 2jn9 s GLU 19 N 0.92 3.80 -0.27 1.67 -6.30 -1.26 -1.44 118.70 115.82 2jn9 s GLU 19 Ca 0.10 -0.41 0.02 0.00 -2.50 0.00 0.00 54.97 52.18 2jn9 s GLU 19 Cb -0.22 -3.31 0.06 0.00 0.00 0.00 0.00 34.13 30.66 2jn9 s GLU 19 CO -0.02 -0.01 -0.09 -1.21 0.02 0.00 0.00 175.26 173.95 2jn9 s GLU 20 N 1.14 2.27 -0.03 4.30 2.02 0.08 -4.97 118.70 123.52 2jn9 s GLU 20 Ca 0.05 -1.33 0.18 0.00 0.02 0.00 0.00 54.97 53.88 2jn9 s GLU 20 Cb -0.14 -2.94 0.58 0.00 0.10 0.00 0.00 34.13 31.73 2jn9 s GLU 20 CO 0.04 -0.58 1.48 0.43 0.02 0.00 0.00 175.26 176.65 2jn9 n SER 21 N 4.46 3.62 -0.06 -0.19 7.64 -1.23 -0.93 113.62 126.93 2jn9 n SER 21 Ca -0.14 -2.12 -0.04 0.00 1.01 0.00 0.00 58.87 57.58 2jn9 n SER 21 Cb 0.42 -0.46 -0.02 0.00 -1.01 0.00 0.00 64.21 63.14 2jn9 n SER 21 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2jn9 h GLU 22 N 3.64 0.00 0.00 1.43 5.08 -1.96 -3.34 114.58 119.43 2jn9 h GLU 22 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2jn9 h GLU 22 Cb 0.98 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 2jn9 h GLU 22 CO 0.06 0.12 -0.18 -1.35 -1.00 0.00 0.00 179.01 176.66 2jn9 h PRO 23 N -1.00 0.00 0.00 2.33 0.11 -2.03 -3.47 132.00 127.95 2jn9 h PRO 23 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2jn9 h PRO 23 Cb 0.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.49 2jn9 h PRO 23 CO -0.01 0.18 0.00 1.17 -0.21 0.00 0.00 178.00 179.13 2jn9 n LYS 24 N -3.44 -1.24 -2.66 1.05 4.81 -1.25 -5.09 118.16 110.34 2jn9 n LYS 24 Ca -0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.01 2jn9 n LYS 24 Cb 0.36 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.38 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 -2.00 3.47 -0.20 1.64 0.52 -1.26 -3.50 118.95 117.62 2jn9 s ARG 25 Ca 0.00 0.12 0.01 0.00 -0.52 0.00 0.00 55.73 55.34 2jn9 s ARG 25 Cb 0.00 -4.02 0.04 0.00 0.52 0.00 0.00 34.95 31.49 2jn9 s ARG 25 CO 0.00 -1.61 -0.14 0.21 0.02 0.00 0.00 175.30 173.78 2jn9 s LYS 26 N 4.63 2.42 -0.55 3.54 2.20 -0.10 -2.15 119.74 129.73 2jn9 s LYS 26 Ca 0.40 -0.93 -0.17 0.00 -0.36 0.00 0.00 55.97 54.90 2jn9 s LYS 26 Cb -0.09 -2.55 0.11 0.00 -1.51 0.00 0.00 37.83 33.79 2jn9 s LYS 26 CO 0.24 -0.37 0.59 0.42 -0.36 0.00 0.00 175.35 175.87 2jn9 s ILE 27 N 1.30 5.02 -0.53 5.43 1.01 0.67 -0.74 121.20 133.36 2jn9 s ILE 27 Ca -0.00 -1.18 -0.06 0.00 0.00 0.00 0.00 60.65 59.41 2jn9 s ILE 27 Cb -0.16 -4.39 0.14 0.00 0.01 0.00 0.00 42.46 38.07 2jn9 s ILE 27 CO -0.09 -0.95 0.37 0.00 0.00 0.00 0.00 174.94 174.26 2jn9 s ALA 28 N 2.14 3.44 -0.16 9.38 0.00 -0.52 0.24 121.76 136.27 2jn9 s ALA 28 Ca 0.08 -2.83 -0.08 0.00 0.00 0.00 0.00 51.96 49.13 2jn9 s ALA 28 Cb -0.26 -2.71 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 2jn9 s ALA 28 CO 0.05 -1.97 0.10 -0.59 0.00 0.00 0.00 175.76 173.36 2jn9 s PHE 29 N 0.75 3.40 -0.35 0.00 -0.71 -0.97 -0.99 117.98 119.11 2jn9 s PHE 29 Ca 0.11 0.31 -0.14 0.00 -1.04 0.00 0.00 56.93 56.17 2jn9 s PHE 29 Cb -0.22 -2.05 -0.01 0.00 -1.21 0.00 0.00 43.02 39.53 2jn9 s PHE 29 CO -0.03 0.39 0.27 0.99 -1.34 0.00 0.00 175.22 175.50 2jn9 s THR 30 N -0.13 5.26 -0.25 -4.49 2.01 0.57 -2.53 115.64 116.08 2jn9 s THR 30 Ca 0.09 -0.23 -0.11 0.00 0.31 0.00 0.00 61.69 61.75 2jn9 s THR 30 Cb -0.12 -3.76 -0.05 0.00 0.01 0.00 0.00 72.50 68.58 2jn9 s THR 30 CO 0.01 -0.07 0.17 -0.22 -0.69 0.00 0.00 174.62 173.81 2jn9 s LEU 31 N 1.77 4.09 -0.51 4.42 0.20 -0.33 -1.53 118.68 126.79 2jn9 s LEU 31 Ca 0.07 0.08 -0.29 0.00 0.69 0.00 0.00 54.13 54.68 2jn9 s LEU 31 Cb -0.17 -2.11 0.03 0.00 -0.43 0.00 0.00 46.19 43.51 2jn9 s LEU 31 CO 0.11 0.04 1.18 0.21 -0.29 0.00 0.00 176.35 177.60 2jn9 s ASN 32 N 1.21 6.54 -0.34 3.68 3.84 -1.26 0.23 114.94 128.85 2jn9 s ASN 32 Ca 0.07 0.38 -0.29 0.00 0.21 0.00 0.00 52.86 53.23 2jn9 s ASN 32 Cb -0.14 -2.55 0.02 0.00 -0.55 0.00 0.00 41.25 38.02 2jn9 s ASN 32 CO 0.06 -1.35 1.13 -0.69 -2.79 0.00 0.00 177.10 173.46 2jn9 s VAL 33 N 4.73 4.39 0.40 -5.21 1.01 0.30 -4.89 120.40 121.13 2jn9 s VAL 33 Ca 0.48 1.58 0.08 0.00 0.00 0.00 0.00 61.98 64.11 2jn9 s VAL 33 Cb -0.08 -4.39 -0.05 0.00 0.00 0.00 0.00 36.38 31.86 2jn9 s VAL 33 CO 0.30 -0.55 0.15 0.42 0.00 0.00 0.00 175.10 175.41 2jn9 s THR 34 N 3.91 2.36 0.55 3.92 -4.23 -1.25 -0.50 115.64 120.39 2jn9 s THR 34 Ca 0.48 -1.75 0.23 0.00 -1.18 0.00 0.00 61.69 59.47 2jn9 s THR 34 Cb -0.12 -2.98 0.34 0.00 1.34 0.00 0.00 72.50 71.08 2jn9 s THR 34 CO 0.19 -0.03 2.10 -1.28 -0.54 0.00 0.00 174.62 175.06 2jn9 h SER 35 N 1.50 0.00 0.63 3.99 0.87 -1.65 0.34 113.55 119.23 2jn9 h SER 35 Ca -0.43 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.10 2jn9 h SER 35 Cb 1.25 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.22 2jn9 h SER 35 CO 0.70 0.00 -0.30 -0.08 -0.53 0.00 0.00 176.83 176.62 2jn9 h GLU 36 N 0.00 -0.82 0.00 2.24 4.81 -1.95 -3.30 114.58 115.56 2jn9 h GLU 36 Ca 0.10 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2jn9 h GLU 36 Cb 0.44 0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.01 2jn9 h GLU 36 CO -0.00 -0.55 0.00 1.79 -0.73 0.00 0.00 179.01 179.52 2jn9 h THR 37 N -1.12 0.00 -0.98 0.32 1.35 -1.82 -3.31 112.91 107.35 2jn9 h THR 37 Ca -0.09 -0.81 0.31 0.00 -0.55 0.00 0.00 66.41 65.27 2jn9 h THR 37 Cb 0.65 1.81 -0.15 0.00 -1.73 0.00 0.00 68.15 68.73 2jn9 h THR 37 CO 0.14 0.00 0.50 0.22 -0.25 0.00 0.00 175.52 176.14 2jn9 h TYR 38 N 0.00 0.82 -0.00 4.73 3.20 -0.40 0.27 116.97 125.59 2jn9 h TYR 38 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2jn9 h TYR 38 Cb 0.82 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.89 2jn9 h TYR 38 CO 0.00 -0.19 0.00 0.45 -1.64 0.00 0.00 178.16 176.78 2jn9 h HIS 39 N 0.29 0.00 0.00 -3.82 3.86 -1.75 -1.32 115.15 112.41 2jn9 h HIS 39 Ca 0.71 0.00 -0.37 0.00 -1.16 0.00 0.00 60.37 59.54 2jn9 h HIS 39 Cb 1.59 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.99 2jn9 h HIS 39 CO -0.06 0.00 -2.42 -3.47 0.86 0.00 0.00 177.93 172.84 2jn9 n ASP 40 N -4.22 1.80 0.26 2.45 -0.08 0.76 -4.42 116.55 113.10 2jn9 n ASP 40 Ca -0.03 -0.12 0.12 0.00 -1.51 0.00 0.00 54.79 53.25 2jn9 n ASP 40 Cb 0.09 -0.22 0.68 0.00 2.34 0.00 0.00 41.12 44.01 2jn9 n ASP 40 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2jn9 h ILE 41 N 0.00 0.60 0.00 5.18 1.08 -0.76 -0.27 117.51 123.34 2jn9 h ILE 41 Ca -0.56 -0.62 0.00 0.00 -0.39 0.00 0.00 64.86 63.29 2jn9 h ILE 41 Cb 1.91 1.40 0.00 0.00 -3.07 0.00 0.00 36.82 37.06 2jn9 h ILE 41 CO -0.07 0.14 0.00 0.00 -0.69 0.00 0.00 178.15 177.53 2jn9 n ALA 42 N -2.29 1.72 -0.08 1.87 0.00 -0.52 -1.85 120.51 119.36 2jn9 n ALA 42 Ca -0.02 0.01 -0.11 0.00 0.00 0.00 0.00 53.44 53.32 2jn9 n ALA 42 Cb 0.26 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.24 2jn9 n ALA 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2jn9 n VAL 43 N -1.84 1.45 -3.03 0.00 0.31 -0.16 -4.68 118.33 110.38 2jn9 n VAL 43 Ca 0.03 -0.82 -0.44 0.00 -0.01 0.00 0.00 64.34 63.10 2jn9 n VAL 43 Cb 0.21 -0.68 0.00 0.00 -0.91 0.00 0.00 33.84 32.46 2jn9 n VAL 43 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2jn9 n LEU 44 N -2.87 5.48 -3.76 7.52 7.94 -0.77 -4.90 117.00 125.65 2jn9 n LEU 44 Ca -0.31 -4.69 -0.30 0.00 -1.11 0.00 0.00 56.01 49.61 2jn9 n LEU 44 Cb 1.12 -1.55 -0.13 0.00 0.53 0.00 0.00 43.42 43.39 2jn9 n LEU 44 CO 0.42 1.02 -0.25 -1.48 -1.11 0.00 0.00 177.39 175.99 2jn9 s LEU 45 N 0.34 2.95 -0.40 -1.96 0.05 -1.25 -4.84 118.68 113.57 2jn9 s LEU 45 Ca 0.38 -2.55 -0.14 0.00 0.05 0.00 0.00 54.13 51.87 2jn9 s LEU 45 Cb -0.04 -1.13 0.02 0.00 -2.05 0.00 0.00 46.19 42.99 2jn9 s LEU 45 CO -0.02 -0.28 0.46 -1.22 -0.55 0.00 0.00 176.35 174.74 2jn9 n TYR 46 N 3.65 -3.52 -1.30 3.48 4.02 -1.26 -5.03 117.16 117.20 2jn9 n TYR 46 Ca 0.07 1.46 0.00 0.00 -0.01 0.00 0.00 57.90 59.41 2jn9 n TYR 46 Cb 0.35 -3.91 0.00 0.00 -0.02 0.00 0.00 39.34 35.76 2jn9 n TYR 46 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2jn9 n GLU 47 N -0.05 0.32 -0.06 -0.72 -0.58 -1.26 -5.06 120.64 113.22 2jn9 n GLU 47 Ca 0.08 0.00 -0.07 0.00 -0.42 0.00 0.00 57.16 56.75 2jn9 n GLU 47 Cb 0.37 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.22 2jn9 n GLU 47 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2jn9 n LYS 48 N -0.90 0.43 -4.10 3.49 4.01 -1.26 -4.36 118.16 115.47 2jn9 n LYS 48 Ca 0.00 0.17 -0.33 0.00 -0.51 0.00 0.00 58.31 57.64 2jn9 n LYS 48 Cb 0.00 -1.25 -0.16 0.00 -0.51 0.00 0.00 35.03 33.11 2jn9 n LYS 48 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 2jn9 s THR 49 N -2.72 2.18 -0.35 -0.18 -4.23 -1.26 0.03 115.64 109.11 2jn9 s THR 49 Ca -0.24 -0.91 -0.09 0.00 -1.18 0.00 0.00 61.69 59.27 2jn9 s THR 49 Cb 0.03 -1.93 0.03 0.00 1.34 0.00 0.00 72.50 71.97 2jn9 s THR 49 CO 0.35 0.52 0.16 -0.36 -0.54 0.00 0.00 174.62 174.75 2jn9 s PHE 50 N 1.30 3.24 -0.74 3.99 0.08 -0.36 -4.93 117.98 120.57 2jn9 s PHE 50 Ca 0.05 -1.10 -0.26 0.00 0.12 0.00 0.00 56.93 55.74 2jn9 s PHE 50 Cb -0.13 -2.37 -0.01 0.00 -0.57 0.00 0.00 43.02 39.94 2jn9 s PHE 50 CO -0.12 -0.66 1.73 -0.80 -0.10 0.00 0.00 175.22 175.27 2jn9 s ASN 51 N 1.50 5.52 -0.10 1.36 0.01 -1.26 -0.51 114.94 121.46 2jn9 s ASN 51 Ca 0.01 -0.19 -0.29 0.00 -0.71 0.00 0.00 52.86 51.68 2jn9 s ASN 51 Cb -0.19 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 38.91 2jn9 s ASN 51 CO 0.05 -2.28 0.96 -0.69 -1.51 0.00 0.00 177.10 173.63 2jn9 s VAL 52 N 8.32 4.83 -0.04 1.60 1.01 0.70 -2.14 120.40 134.67 2jn9 s VAL 52 Ca 0.60 1.95 0.00 0.00 0.00 0.00 0.00 61.98 64.53 2jn9 s VAL 52 Cb -0.09 -4.27 0.03 0.00 0.00 0.00 0.00 36.38 32.04 2jn9 s VAL 52 CO 0.12 0.05 0.00 -0.70 0.00 0.00 0.00 175.10 174.57 2jn9 s GLU 53 N 1.80 0.36 -0.11 2.72 2.12 -0.26 -1.84 118.70 123.50 2jn9 s GLU 53 Ca 0.47 0.08 -0.04 0.00 0.36 0.00 0.00 54.97 55.85 2jn9 s GLU 53 Cb -0.18 -0.58 0.05 0.00 0.26 0.00 0.00 34.13 33.68 2jn9 s GLU 53 CO 0.19 -0.16 0.16 0.54 -0.54 0.00 0.00 175.26 175.44 2jn9 s VAL 54 N 1.21 -0.25 0.03 3.70 0.11 -0.43 -1.31 120.40 123.47 2jn9 s VAL 54 Ca -0.07 0.25 -0.25 0.00 -2.93 0.00 0.00 61.98 58.98 2jn9 s VAL 54 Cb -0.13 -0.37 -0.17 0.00 -1.53 0.00 0.00 36.38 34.18 2jn9 s VAL 54 CO -0.02 0.07 1.47 -0.65 -3.33 0.00 0.00 175.10 172.64 2jn9 h PRO 55 N 8.36 -0.11 -0.90 1.54 0.11 -1.87 -0.25 132.00 138.89 2jn9 h PRO 55 Ca -0.14 0.01 0.20 0.00 0.11 0.00 0.00 66.00 66.18 2jn9 h PRO 55 Cb 1.12 0.03 -0.12 0.00 0.11 0.00 0.00 31.00 32.14 2jn9 h PRO 55 CO 0.17 0.13 0.43 1.05 -0.21 0.00 0.00 178.00 179.58 2jn9 h GLU 56 N -0.36 0.47 -0.06 1.05 9.09 -1.97 0.64 114.58 123.43 2jn9 h GLU 56 Ca -0.01 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.37 2jn9 h GLU 56 Cb 0.30 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 27.30 2jn9 h GLU 56 CO 0.02 0.31 0.00 0.54 0.05 0.00 0.00 179.01 179.93 2jn9 n ARG 57 N -4.98 1.73 -3.77 1.06 1.74 -1.24 -5.00 116.66 106.20 2jn9 n ARG 57 Ca 0.21 -1.69 -0.31 0.00 -0.77 0.00 0.00 57.85 55.29 2jn9 n ARG 57 Cb 0.61 -1.37 0.02 0.00 -1.02 0.00 0.00 32.46 30.70 2jn9 n ARG 57 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2jn9 n ASP 58 N 1.09 -5.09 -4.21 0.55 2.03 0.21 -4.98 116.55 106.15 2jn9 n ASP 58 Ca 0.12 -1.00 -0.31 0.00 0.52 0.00 0.00 54.79 54.12 2jn9 n ASP 58 Cb 0.48 -2.59 -0.17 0.00 -0.72 0.00 0.00 41.12 38.13 2jn9 n ASP 58 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2jn9 s LEU 59 N -6.12 2.04 -0.17 -2.67 0.20 -0.40 -4.99 118.68 106.57 2jn9 s LEU 59 Ca 0.31 -0.52 -0.04 0.00 0.69 0.00 0.00 54.13 54.56 2jn9 s LEU 59 Cb -0.14 -1.34 0.08 0.00 -0.43 0.00 0.00 46.19 44.36 2jn9 s LEU 59 CO 0.89 0.16 0.19 0.00 -0.29 0.00 0.00 176.35 177.30 2jn9 s ALA 60 N 0.30 -0.15 0.00 5.97 0.00 -1.25 -1.31 121.76 125.31 2jn9 s ALA 60 Ca -0.16 0.26 -0.25 0.00 0.00 0.00 0.00 51.96 51.81 2jn9 s ALA 60 Cb -0.17 -1.15 0.06 0.00 0.00 0.00 0.00 23.12 21.85 2jn9 s ALA 60 CO 0.08 -1.04 0.57 -0.59 0.00 0.00 0.00 175.76 174.78 2jn9 s PHE 61 N 2.29 -0.51 -0.96 0.00 -0.71 -0.77 -5.01 117.98 112.33 2jn9 s PHE 61 Ca 0.05 0.73 -0.18 0.00 -1.04 0.00 0.00 56.93 56.49 2jn9 s PHE 61 Cb -0.15 0.36 0.14 0.00 -1.21 0.00 0.00 43.02 42.16 2jn9 s PHE 61 CO -0.10 -0.61 1.15 0.50 -1.34 0.00 0.00 175.22 174.82 2jn9 s ARG 62 N -1.83 3.65 -0.26 1.99 3.52 -1.26 -0.22 118.95 124.54 2jn9 s ARG 62 Ca -0.08 -1.87 -0.28 0.00 -0.13 0.00 0.00 55.73 53.37 2jn9 s ARG 62 Cb -0.01 -4.92 0.01 0.00 -1.56 0.00 0.00 34.95 28.47 2jn9 s ARG 62 CO 0.03 -1.76 1.00 0.20 -0.81 0.00 0.00 175.30 173.96 2jn9 s GLY 63 N 3.51 1.67 0.37 8.12 0.00 0.34 -4.79 107.32 116.53 2jn9 s GLY 63 Ca 0.33 0.02 -0.17 0.00 0.00 0.00 0.00 44.72 44.91 2jn9 s GLY 63 CO -0.09 2.12 0.82 -1.83 0.00 0.00 0.00 173.10 174.12 2jn9 s GLU 64 N 3.24 4.06 -0.22 2.90 -1.05 -1.26 -1.22 118.70 125.15 2jn9 s GLU 64 Ca 0.42 0.81 -0.04 0.00 -0.15 0.00 0.00 54.97 56.01 2jn9 s GLU 64 Cb -0.14 -2.34 -0.01 0.00 -0.44 0.00 0.00 34.13 31.20 2jn9 s GLU 64 CO 0.09 0.07 -0.03 1.41 0.95 0.00 0.00 175.26 177.75 2jn9 s MET 65 N -3.14 3.42 -0.01 -4.83 -2.45 0.10 -4.30 119.30 108.10 2jn9 s MET 65 Ca 0.57 -0.60 0.10 0.00 -1.25 0.00 0.00 55.69 54.51 2jn9 s MET 65 Cb -0.10 -3.05 0.17 0.00 1.25 0.00 0.00 34.83 33.10 2jn9 s MET 65 CO 0.17 -0.19 1.07 -2.37 1.05 0.00 0.00 175.02 174.76 2jn9 n THR 66 N 4.78 0.08 -4.17 10.11 5.66 -1.26 -4.52 114.28 124.96 2jn9 n THR 66 Ca -0.18 -0.47 -0.24 0.00 -3.05 0.00 0.00 64.05 60.10 2jn9 n THR 66 Cb 0.51 0.66 -0.06 0.00 -1.55 0.00 0.00 70.33 69.89 2jn9 n THR 66 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2jn9 s ASN 67 N -1.45 5.13 -0.40 1.09 0.01 -1.26 -5.09 114.94 112.97 2jn9 s ASN 67 Ca 0.14 -0.34 0.03 0.00 -0.71 0.00 0.00 52.86 51.98 2jn9 s ASN 67 Cb 0.16 -1.20 0.11 0.00 0.41 0.00 0.00 41.25 40.73 2jn9 s ASN 67 CO -0.06 0.02 0.15 -0.47 -1.51 0.00 0.00 177.10 175.23 2jn9 s TYR 68 N -1.99 2.92 -0.16 2.20 5.04 -1.26 -4.93 117.35 119.17 2jn9 s TYR 68 Ca 0.31 -2.73 0.17 0.00 -2.44 0.00 0.00 57.07 52.38 2jn9 s TYR 68 Cb -0.08 -2.50 0.37 0.00 0.35 0.00 0.00 41.96 40.10 2jn9 s TYR 68 CO 0.22 -0.85 1.24 0.43 -1.34 0.00 0.00 175.55 175.25 2jn9 n SER 69 N 3.92 2.61 -4.60 4.32 7.64 -1.26 -5.04 113.62 121.21 2jn9 n SER 69 Ca 0.04 -3.21 -0.60 0.00 1.01 0.00 0.00 58.87 56.10 2jn9 n SER 69 Cb 0.38 -0.48 -0.09 0.00 -1.01 0.00 0.00 64.21 63.01 2jn9 n SER 69 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2jn9 n THR 70 N -1.18 0.14 0.00 0.44 -1.04 -1.26 -4.76 114.28 106.62 2jn9 n THR 70 Ca 0.19 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 2jn9 n THR 70 Cb 0.72 -0.91 0.00 0.00 -1.82 0.00 0.00 70.33 68.32 2jn9 n THR 70 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2jn9 n SER 71 N 5.97 0.00 0.00 8.00 3.41 -1.26 -4.94 113.62 124.80 2jn9 n SER 71 Ca 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 2jn9 n SER 71 Cb 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2jn9 n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jn9 n LEU 72 N -0.10 0.14 0.04 1.04 -0.00 -1.26 -4.70 117.00 112.16 2jn9 n LEU 72 Ca 0.00 -0.50 -0.10 0.00 -0.00 0.00 0.00 56.01 55.41 2jn9 n LEU 72 Cb 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 43.42 43.45 2jn9 n LEU 72 CO 0.00 0.03 0.38 0.71 -0.00 0.00 0.00 177.39 178.51 2jn9 h THR 73 N 0.02 1.36 0.00 1.47 1.35 -1.93 -3.47 112.91 111.72 2jn9 h THR 73 Ca 0.00 -2.06 0.00 0.00 -0.55 0.00 0.00 66.41 63.80 2jn9 h THR 73 Cb 0.01 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 2jn9 h THR 73 CO 0.00 0.62 0.00 0.59 -0.25 0.00 0.00 175.52 176.48 2jn9 n ASN 74 N -3.87 0.00 -0.69 5.36 3.02 -1.26 -4.41 115.26 113.42 2jn9 n ASN 74 Ca -0.04 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.53 2jn9 n ASN 74 Cb 0.69 -0.33 -0.01 0.00 -0.61 0.00 0.00 39.78 39.51 2jn9 n ASN 74 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2jn9 n LEU 75 N 0.00 -0.67 -1.59 3.41 4.32 -1.26 -4.79 117.00 116.42 2jn9 n LEU 75 Ca 0.00 1.22 -0.08 0.00 -0.02 0.00 0.00 56.01 57.14 2jn9 n LEU 75 Cb 0.00 -1.01 -0.02 0.00 -1.62 0.00 0.00 43.42 40.76 2jn9 n LEU 75 CO 0.00 -0.55 -0.08 0.00 -1.22 0.00 0.00 177.39 175.54 2jn9 n TYR 76 N -2.32 -0.94 -4.00 -1.77 0.18 -1.26 -4.93 117.16 102.12 2jn9 n TYR 76 Ca -0.01 0.00 -0.35 0.00 1.88 0.00 0.00 57.90 59.42 2jn9 n TYR 76 Cb 0.25 -1.95 -0.10 0.00 -0.38 0.00 0.00 39.34 37.15 2jn9 n TYR 76 CO 0.00 0.00 0.00 -1.21 -2.08 0.00 0.00 176.86 173.57 2jn9 s GLU 77 N -3.35 3.92 -0.51 -3.48 0.41 -1.26 -5.06 118.70 109.37 2jn9 s GLU 77 Ca 0.00 -0.37 -0.28 0.00 -0.41 0.00 0.00 54.97 53.91 2jn9 s GLU 77 Cb 0.00 -3.21 0.00 0.00 -1.78 0.00 0.00 34.13 29.14 2jn9 s GLU 77 CO 0.00 0.21 1.56 -1.25 -0.49 0.00 0.00 175.26 175.29 2jn9 s PRO 78 N 0.53 3.22 0.23 0.39 0.04 -1.26 -4.98 135.00 133.17 2jn9 s PRO 78 Ca 0.03 0.71 0.06 0.00 0.04 0.00 0.00 61.00 61.84 2jn9 s PRO 78 Cb -0.13 -4.17 -0.05 0.00 0.04 0.00 0.00 34.50 30.19 2jn9 s PRO 78 CO 0.01 -2.02 -0.07 0.20 0.04 0.00 0.00 177.00 175.16 2jn9 s GLY 79 N 5.30 1.58 -0.23 0.56 0.00 -1.26 -5.05 107.32 108.21 2jn9 s GLY 79 Ca 0.61 -1.76 0.05 0.00 0.00 0.00 0.00 44.72 43.61 2jn9 s GLY 79 CO 0.27 -1.75 -0.16 0.00 0.00 0.00 0.00 173.10 171.46 2jn9 n ALA 80 N -0.45 1.49 -3.65 3.20 0.00 -1.26 -4.54 120.51 115.29 2jn9 n ALA 80 Ca -0.06 -1.08 -0.23 0.00 0.00 0.00 0.00 53.44 52.06 2jn9 n ALA 80 Cb 0.62 -0.08 -0.17 0.00 0.00 0.00 0.00 19.45 19.82 2jn9 n ALA 80 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jn9 s VAL 81 N -2.48 -0.04 0.27 0.00 1.01 -1.21 -2.07 120.40 115.88 2jn9 s VAL 81 Ca -0.28 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 2jn9 s VAL 81 Cb 0.08 -0.40 -0.01 0.00 0.00 0.00 0.00 36.38 36.05 2jn9 s VAL 81 CO 0.60 -0.03 0.40 -0.44 0.00 0.00 0.00 175.10 175.64 2jn9 s SER 82 N 2.13 0.35 -0.25 3.32 0.01 0.35 -4.94 113.70 114.66 2jn9 s SER 82 Ca 0.03 -1.24 0.03 0.00 1.31 0.00 0.00 55.95 56.08 2jn9 s SER 82 Cb -0.14 0.57 0.06 0.00 0.21 0.00 0.00 66.02 66.72 2jn9 s SER 82 CO -0.06 -1.14 -0.12 -1.61 0.41 0.00 0.00 173.24 170.73 2jn9 s GLU 83 N -3.68 2.32 -0.40 12.44 8.01 -1.26 0.11 118.70 136.24 2jn9 s GLU 83 Ca 0.29 -1.30 -0.28 0.00 0.01 0.00 0.00 54.97 53.69 2jn9 s GLU 83 Cb 0.01 -2.86 0.02 0.00 -4.31 0.00 0.00 34.13 26.99 2jn9 s GLU 83 CO 0.14 -0.53 1.07 -0.06 0.01 0.00 0.00 175.26 175.89 2jn9 s PHE 84 N 1.12 3.00 -0.70 1.61 0.40 0.14 -3.92 117.98 119.62 2jn9 s PHE 84 Ca -0.08 0.91 -0.17 0.00 -0.60 0.00 0.00 56.93 56.99 2jn9 s PHE 84 Cb -0.19 -3.99 0.15 0.00 0.51 0.00 0.00 43.02 39.50 2jn9 s PHE 84 CO -0.06 -0.99 0.74 -0.47 0.70 0.00 0.00 175.22 175.14 2jn9 s TYR 85 N 3.95 3.32 -0.37 0.36 6.14 -1.26 -1.19 117.35 128.30 2jn9 s TYR 85 Ca 0.45 -1.43 -0.03 0.00 0.64 0.00 0.00 57.07 56.70 2jn9 s TYR 85 Cb -0.10 -3.94 0.08 0.00 0.42 0.00 0.00 41.96 38.42 2jn9 s TYR 85 CO 0.23 -1.16 0.13 0.42 0.64 0.00 0.00 175.55 175.81 2jn9 s ILE 86 N 1.62 3.25 -0.32 3.14 1.01 -1.05 -4.41 121.20 124.44 2jn9 s ILE 86 Ca 0.15 -1.75 -0.11 0.00 0.00 0.00 0.00 60.65 58.94 2jn9 s ILE 86 Cb -0.18 -3.08 -0.01 0.00 0.01 0.00 0.00 42.46 39.19 2jn9 s ILE 86 CO -0.02 -0.45 0.19 -0.70 0.00 0.00 0.00 174.94 173.96 2jn9 s GLU 87 N 1.20 3.45 -0.21 2.79 2.12 -1.26 -2.28 118.70 124.51 2jn9 s GLU 87 Ca 0.03 -0.66 -0.05 0.00 0.36 0.00 0.00 54.97 54.65 2jn9 s GLU 87 Cb -0.21 -3.67 -0.02 0.00 0.26 0.00 0.00 34.13 30.49 2jn9 s GLU 87 CO -0.02 -0.41 -0.00 0.42 -0.54 0.00 0.00 175.26 174.71 2jn9 s ILE 88 N 1.67 3.89 -0.17 -3.70 1.01 0.14 -4.50 121.20 119.53 2jn9 s ILE 88 Ca 0.05 -0.33 -0.13 0.00 0.00 0.00 0.00 60.65 60.24 2jn9 s ILE 88 Cb -0.17 -2.77 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 2jn9 s ILE 88 CO 0.08 0.42 0.26 0.42 0.00 0.00 0.00 174.94 176.12 2jn9 s THR 89 N 1.12 5.32 0.32 2.92 -4.23 -1.26 -0.24 115.64 119.60 2jn9 s THR 89 Ca 0.03 0.47 -0.29 0.00 -1.18 0.00 0.00 61.69 60.71 2jn9 s THR 89 Cb -0.14 -3.60 -0.12 0.00 1.34 0.00 0.00 72.50 69.98 2jn9 s THR 89 CO 0.01 0.39 1.44 1.21 -0.54 0.00 0.00 174.62 177.13 2jn9 n GLU 90 N 3.65 2.40 -2.15 3.99 2.13 -0.91 -4.49 120.64 125.26 2jn9 n GLU 90 Ca -0.13 0.85 -0.31 0.00 0.66 0.00 0.00 57.16 58.23 2jn9 n GLU 90 Cb 0.52 -2.53 -0.01 0.00 0.27 0.00 0.00 31.44 29.69 2jn9 n GLU 90 CO 0.00 0.00 0.00 0.96 -0.41 0.00 0.00 177.13 177.68 2jn9 s ILE 91 N -0.62 4.69 0.19 6.31 -5.25 -1.26 -4.97 121.20 120.29 2jn9 s ILE 91 Ca 0.59 0.88 0.02 0.00 -0.99 0.00 0.00 60.65 61.16 2jn9 s ILE 91 Cb -0.54 -3.82 0.03 0.00 2.95 0.00 0.00 42.46 41.08 2jn9 s ILE 91 CO 0.57 -0.95 0.26 0.47 -1.79 0.00 0.00 174.94 173.49 2jn9 n ASP 92 N -2.29 0.57 -0.70 4.36 9.92 -1.26 -4.98 116.55 122.18 2jn9 n ASP 92 Ca 0.05 -1.43 0.05 0.00 -0.53 0.00 0.00 54.79 52.93 2jn9 n ASP 92 Cb 0.54 -0.15 0.16 0.00 -0.64 0.00 0.00 41.12 41.03 2jn9 n ASP 92 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2jn9 n LYS 93 N -1.44 1.91 0.19 -1.24 3.00 -1.26 -4.12 118.16 115.21 2jn9 n LYS 93 Ca 0.05 -1.29 0.04 0.00 -0.00 0.00 0.00 58.31 57.11 2jn9 n LYS 93 Cb 0.18 -1.33 0.39 0.00 0.00 0.00 0.00 35.03 34.27 2jn9 n LYS 93 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.40 174.45 2jn9 h ASN 94 N 2.04 0.00 0.01 3.14 -1.07 -2.04 -3.25 115.58 114.41 2jn9 h ASN 94 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 56.30 56.37 2jn9 h ASN 94 Cb 0.54 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.79 2jn9 h ASN 94 CO 0.02 0.36 -0.01 0.00 0.07 0.00 0.00 177.43 177.88 2jn9 h ALA 95 N 1.64 -0.15 -1.91 4.14 0.00 -2.00 -3.50 119.26 117.48 2jn9 h ALA 95 Ca -0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 2jn9 h ALA 95 Cb 0.69 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2jn9 h ALA 95 CO 0.05 -0.15 -0.04 -3.47 0.00 0.00 0.00 179.25 175.63 2jn9 n ASP 96 N -2.21 -5.64 -0.70 0.00 -0.08 -1.23 -4.70 116.55 101.98 2jn9 n ASP 96 Ca -0.00 0.13 0.01 0.00 -1.51 0.00 0.00 54.79 53.42 2jn9 n ASP 96 Cb 0.01 -0.36 0.00 0.00 2.34 0.00 0.00 41.12 43.11 2jn9 n ASP 96 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2jn9 n SER 97 N -2.74 0.19 -4.77 1.67 3.41 -1.26 -5.10 113.62 105.03 2jn9 n SER 97 Ca 0.00 -1.98 -0.40 0.00 -0.26 0.00 0.00 58.87 56.23 2jn9 n SER 97 Cb 0.05 -0.21 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 2jn9 n SER 97 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2jn9 s LEU 98 N 0.00 4.34 0.38 1.04 2.96 -1.26 -4.95 118.68 121.19 2jn9 s LEU 98 Ca 0.07 2.60 -0.28 0.00 -0.22 0.00 0.00 54.13 56.30 2jn9 s LEU 98 Cb 0.08 -3.78 -0.10 0.00 0.50 0.00 0.00 46.19 42.89 2jn9 s LEU 98 CO -0.03 -0.62 1.39 -0.70 -1.32 0.00 0.00 176.35 175.07 2jn9 s GLU 99 N -1.98 4.11 -0.30 1.98 2.56 -1.26 -5.02 118.70 118.79 2jn9 s GLU 99 Ca 0.52 2.38 -0.12 0.00 0.00 0.00 0.00 54.97 57.75 2jn9 s GLU 99 Cb -0.37 -2.93 0.15 0.00 2.00 0.00 0.00 34.13 32.99 2jn9 s GLU 99 CO 0.49 -0.46 0.84 -3.38 -0.56 0.00 0.00 175.26 172.19 2jn9 s HIS 100 N -1.16 -0.99 0.05 5.30 -3.43 -1.26 -5.18 115.29 108.62 2jn9 s HIS 100 Ca 0.53 1.61 0.00 0.00 -0.80 0.00 0.00 55.06 56.40 2jn9 s HIS 100 Cb -0.43 0.55 -0.00 0.00 -1.43 0.00 0.00 32.58 31.28 2jn9 s HIS 100 CO 0.57 -0.50 0.01 0.72 -2.00 0.00 0.00 174.74 173.54 2jn9 n HIS 101 N 5.22 0.08 0.00 0.38 8.25 -1.26 -4.98 115.22 122.90 2jn9 n HIS 101 Ca -0.09 -0.29 0.00 0.00 -0.26 0.00 0.00 57.72 57.08 2jn9 n HIS 101 Cb 0.51 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.60 2jn9 n HIS 101 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2jn9 n HIS 102 N -0.13 0.00 -4.14 4.41 8.25 -1.26 -4.66 115.22 117.69 2jn9 n HIS 102 Ca -0.02 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.29 2jn9 n HIS 102 Cb 0.07 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.04 2jn9 n HIS 102 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2jn9 s HIS 103 N 0.00 0.48 -0.54 4.41 5.65 -1.26 -5.09 115.29 118.94 2jn9 s HIS 103 Ca 0.00 -0.14 -0.28 0.00 0.25 0.00 0.00 55.06 54.89 2jn9 s HIS 103 Cb 0.00 -0.31 0.02 0.00 -1.18 0.00 0.00 32.58 31.11 2jn9 s HIS 103 CO 0.00 -0.02 1.35 -1.01 -0.65 0.00 0.00 174.74 174.41 2jn9 s HIS 104 N -0.29 2.40 0.00 3.88 0.09 -1.26 -5.14 115.29 114.96 2jn9 s HIS 104 Ca 0.00 0.49 0.00 0.00 -0.00 0.00 0.00 55.06 55.55 2jn9 s HIS 104 Cb -0.03 -4.42 0.00 0.00 -0.00 0.00 0.00 32.58 28.13 2jn9 s HIS 104 CO -0.00 -1.86 0.00 0.72 -0.00 0.00 0.00 174.74 173.60