#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j98 n ILE 4 N 0.00 0.00 -0.02 6.31 2.08 -1.26 -4.34 119.36 122.13 2j98 n ILE 4 Ca 0.00 -0.01 -0.09 0.00 0.56 0.00 0.00 62.75 63.21 2j98 n ILE 4 Cb 0.00 -0.41 -0.03 0.00 -0.75 0.00 0.00 39.64 38.45 2j98 n ILE 4 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 2j98 h MET 5 N 0.13 -0.27 0.00 0.38 2.86 -2.01 -0.96 114.93 115.06 2j98 h MET 5 Ca 0.00 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2j98 h MET 5 Cb 0.24 0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.96 2j98 h MET 5 CO 0.00 -0.18 0.00 -0.35 1.06 0.00 0.00 176.91 177.44 2j98 n PRO 6 N -5.37 0.12 0.01 -0.22 -0.04 -1.26 -1.71 135.00 126.53 2j98 n PRO 6 Ca -0.02 0.44 0.11 0.00 -0.04 0.00 0.00 63.50 63.99 2j98 n PRO 6 Cb 0.29 -1.77 0.03 0.00 -0.04 0.00 0.00 33.50 32.00 2j98 n PRO 6 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2j98 n GLY 7 N -0.42 -1.15 3.75 0.55 0.00 -0.44 -4.84 105.19 102.64 2j98 n GLY 7 Ca 0.01 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 2j98 n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2j98 s LYS 8 N -3.11 4.33 -0.11 1.61 2.20 -0.69 -4.89 119.74 119.08 2j98 s LYS 8 Ca 0.06 2.20 -0.13 0.00 -0.36 0.00 0.00 55.97 57.74 2j98 s LYS 8 Cb 0.16 -3.13 0.03 0.00 -1.51 0.00 0.00 37.83 33.38 2j98 s LYS 8 CO 0.80 -0.31 0.35 1.41 -0.36 0.00 0.00 175.35 177.24 2j98 s MET 9 N -0.57 0.46 0.26 4.03 1.75 -1.26 -4.50 119.30 119.46 2j98 s MET 9 Ca 0.56 0.38 0.07 0.00 -1.25 0.00 0.00 55.69 55.45 2j98 s MET 9 Cb -0.40 0.22 -0.05 0.00 2.84 0.00 0.00 34.83 37.44 2j98 s MET 9 CO 0.43 -0.07 -0.08 0.15 -0.65 0.00 0.00 175.02 174.80 2j98 s LYS 10 N -0.07 1.50 -0.01 4.11 1.02 0.33 -4.96 119.74 121.67 2j98 s LYS 10 Ca -0.02 -1.74 0.07 0.00 0.02 0.00 0.00 55.97 54.30 2j98 s LYS 10 Cb -0.03 -1.16 -0.02 0.00 -0.52 0.00 0.00 37.83 36.10 2j98 s LYS 10 CO 0.01 0.08 -0.21 0.08 -0.92 0.00 0.00 175.35 174.39 2j98 s VAL 11 N -2.99 1.70 -0.02 3.17 1.01 -1.26 -0.99 120.40 121.02 2j98 s VAL 11 Ca 0.28 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2j98 s VAL 11 Cb 0.02 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 35.01 2j98 s VAL 11 CO 0.11 0.46 0.01 -0.75 0.00 0.00 0.00 175.10 174.93 2j98 s LYS 12 N -0.56 0.11 0.21 2.72 2.20 -0.02 -4.98 119.74 119.42 2j98 s LYS 12 Ca 0.08 0.11 -0.31 0.00 -0.36 0.00 0.00 55.97 55.50 2j98 s LYS 12 Cb -0.08 -0.31 -0.10 0.00 -1.51 0.00 0.00 37.83 35.82 2j98 s LYS 12 CO -0.01 -0.13 1.51 0.00 -0.36 0.00 0.00 175.35 176.36 2j98 s ALA 13 N 0.90 3.70 0.38 3.13 0.00 -1.26 -0.06 121.76 128.54 2j98 s ALA 13 Ca -0.08 1.36 -0.10 0.00 0.00 0.00 0.00 51.96 53.14 2j98 s ALA 13 Cb -0.11 -3.59 0.04 0.00 0.00 0.00 0.00 23.12 19.45 2j98 s ALA 13 CO -0.02 -0.77 0.67 -2.37 0.00 0.00 0.00 175.76 173.27 2j98 n THR 14 N 3.12 0.00 -4.95 0.00 5.66 0.32 -4.84 114.28 113.59 2j98 n THR 14 Ca 0.10 -1.28 -0.27 0.00 -3.05 0.00 0.00 64.05 59.56 2j98 n THR 14 Cb 0.39 1.02 -0.16 0.00 -1.55 0.00 0.00 70.33 70.04 2j98 n THR 14 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2j98 s LYS 15 N -2.36 1.68 0.33 1.09 -0.14 -1.26 -0.98 119.74 118.10 2j98 s LYS 15 Ca 0.21 -0.69 0.09 0.00 -1.36 0.00 0.00 55.97 54.21 2j98 s LYS 15 Cb -0.03 -1.57 -0.05 0.00 -1.68 0.00 0.00 37.83 34.49 2j98 s LYS 15 CO 0.15 0.39 0.05 0.20 -0.76 0.00 0.00 175.35 175.38 2j98 s GLY 16 N -0.35 2.00 0.01 -3.33 0.00 -0.33 -1.31 107.32 104.01 2j98 s GLY 16 Ca 0.05 -1.90 -0.02 0.00 0.00 0.00 0.00 44.72 42.85 2j98 s GLY 16 CO 0.00 -1.85 0.02 -0.54 0.00 0.00 0.00 173.10 170.74 2j98 s GLU 17 N -3.75 0.34 0.49 2.90 2.02 -0.21 -1.37 118.70 119.11 2j98 s GLU 17 Ca 0.35 -0.50 0.02 0.00 0.02 0.00 0.00 54.97 54.86 2j98 s GLU 17 Cb -0.01 0.13 -0.02 0.00 0.10 0.00 0.00 34.13 34.33 2j98 s GLU 17 CO 0.20 -0.07 0.02 0.20 0.02 0.00 0.00 175.26 175.63 2j98 s GLY 18 N -1.34 2.92 0.19 -1.39 0.00 -0.55 0.20 107.32 107.35 2j98 s GLY 18 Ca -0.15 -0.68 -0.12 0.00 0.00 0.00 0.00 44.72 43.78 2j98 s GLY 18 CO -0.00 -2.15 1.80 -0.55 0.00 0.00 0.00 173.10 172.20 2j98 h ASP 19 N 1.45 0.47 -0.98 1.64 3.45 -1.87 -3.22 116.42 117.35 2j98 h ASP 19 Ca -0.43 0.02 -0.57 0.00 0.43 0.00 0.00 57.03 56.48 2j98 h ASP 19 Cb 1.30 -0.07 -0.30 0.00 -0.56 0.00 0.00 39.33 39.71 2j98 h ASP 19 CO 0.73 0.32 0.71 0.61 -1.57 0.00 0.00 179.24 180.04 2j98 n GLY 20 N -1.26 5.07 0.32 2.75 0.00 -1.26 -4.80 105.19 106.00 2j98 n GLY 20 Ca 0.06 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.49 2j98 n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j98 n GLY 21 N -1.05 0.61 3.50 -0.02 0.00 -1.21 -5.04 105.19 101.97 2j98 n GLY 21 Ca 0.60 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 46.15 2j98 n GLY 21 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2j98 n ILE 22 N -2.00 1.77 -3.93 -0.61 5.41 -1.25 -4.85 119.36 113.89 2j98 n ILE 22 Ca 0.00 -0.44 -0.10 0.00 1.00 0.00 0.00 62.75 63.21 2j98 n ILE 22 Cb 0.00 -0.49 -0.10 0.00 -0.71 0.00 0.00 39.64 38.34 2j98 n ILE 22 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2j98 s THR 23 N -0.88 0.12 0.18 1.39 2.01 -1.26 -1.49 115.64 115.71 2j98 s THR 23 Ca 0.64 -0.97 -0.19 0.00 0.31 0.00 0.00 61.69 61.48 2j98 s THR 23 Cb -0.85 -0.65 0.04 0.00 0.01 0.00 0.00 72.50 71.05 2j98 s THR 23 CO 0.57 -0.53 0.54 -0.94 -0.69 0.00 0.00 174.62 173.56 2j98 s SER 24 N -1.80 -0.34 0.12 3.53 1.04 -0.47 -4.92 113.70 110.85 2j98 s SER 24 Ca -0.10 -0.32 0.09 0.00 0.48 0.00 0.00 55.95 56.11 2j98 s SER 24 Cb -0.05 0.58 -0.04 0.00 0.10 0.00 0.00 66.02 66.61 2j98 s SER 24 CO -0.02 -1.01 -0.20 -1.61 0.98 0.00 0.00 173.24 171.38 2j98 s GLU 25 N -3.83 1.72 0.00 4.02 2.02 -1.26 -1.19 118.70 120.18 2j98 s GLU 25 Ca 0.06 -1.21 0.00 0.00 0.02 0.00 0.00 54.97 53.84 2j98 s GLU 25 Cb -0.01 -2.08 0.00 0.00 0.10 0.00 0.00 34.13 32.15 2j98 s GLU 25 CO -0.07 0.48 0.00 0.41 0.02 0.00 0.00 175.26 176.10 2j98 n GLY 26 N 0.83 -1.13 3.40 -1.39 0.00 -0.15 -4.49 105.19 102.25 2j98 n GLY 26 Ca -0.16 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.76 2j98 n GLY 26 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j98 s ASN 27 N -4.00 4.03 -0.01 1.61 0.01 0.00 -0.52 114.94 116.06 2j98 s ASN 27 Ca 0.00 -0.29 -0.20 0.00 -0.71 0.00 0.00 52.86 51.66 2j98 s ASN 27 Cb 0.00 -1.41 -0.05 0.00 0.41 0.00 0.00 41.25 40.20 2j98 s ASN 27 CO 0.00 0.21 0.58 0.00 -1.51 0.00 0.00 177.10 176.39 2j98 s ALA 28 N 0.06 3.49 -0.22 0.60 0.00 0.91 -0.75 121.76 125.85 2j98 s ALA 28 Ca -0.05 0.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.85 2j98 s ALA 28 Cb -0.14 -2.72 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 2j98 s ALA 28 CO 0.04 0.17 0.08 -0.51 0.00 0.00 0.00 175.76 175.54 2j98 s LEU 29 N -0.20 3.65 0.08 0.00 1.43 0.15 -0.84 118.68 122.95 2j98 s LEU 29 Ca 0.31 -0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 53.28 2j98 s LEU 29 Cb -0.18 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 2j98 s LEU 29 CO 0.17 0.06 0.13 -0.72 0.23 0.00 0.00 176.35 176.22 2j98 s TYR 30 N 1.08 0.27 -0.09 0.29 -0.85 -0.16 -0.22 117.35 117.67 2j98 s TYR 30 Ca 0.04 -0.73 0.04 0.00 -0.52 0.00 0.00 57.07 55.90 2j98 s TYR 30 Cb -0.14 -0.15 -0.01 0.00 0.38 0.00 0.00 41.96 42.04 2j98 s TYR 30 CO 0.03 -0.51 -0.22 1.21 -1.52 0.00 0.00 175.55 174.54 2j98 s ASN 31 N -2.88 3.29 -0.68 -0.18 3.04 0.11 -0.51 114.94 117.13 2j98 s ASN 31 Ca 0.06 -0.48 0.04 0.00 0.04 0.00 0.00 52.86 52.52 2j98 s ASN 31 Cb 0.06 -1.21 0.32 0.00 -1.54 0.00 0.00 41.25 38.88 2j98 s ASN 31 CO -0.10 0.20 1.05 -0.46 -3.04 0.00 0.00 177.10 174.75 2j98 n ASN 32 N 3.24 4.81 -0.28 -4.21 2.04 -1.26 -0.44 115.26 119.17 2j98 n ASN 32 Ca -0.18 -3.62 -0.03 0.00 -0.44 0.00 0.00 54.58 50.30 2j98 n ASN 32 Cb 0.53 -0.70 0.08 0.00 -2.53 0.00 0.00 39.78 37.16 2j98 n ASN 32 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 2j98 h GLU 33 N 3.52 0.96 0.00 -3.83 4.11 -1.91 -3.43 114.58 113.99 2j98 h GLU 33 Ca 0.20 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.57 2j98 h GLU 33 Cb 0.52 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2j98 h GLU 33 CO 0.90 0.63 0.00 0.41 0.07 0.00 0.00 179.01 181.02 2j98 n GLY 34 N -1.31 -1.48 0.00 1.06 0.00 -1.26 -5.04 105.19 97.16 2j98 n GLY 34 Ca 0.08 0.96 0.00 0.00 0.00 0.00 0.00 46.02 47.06 2j98 n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j98 n GLY 35 N 0.00 4.16 3.55 -0.02 0.00 -1.26 -5.11 105.19 106.51 2j98 n GLY 35 Ca 0.00 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 2j98 n GLY 35 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2j98 s ARG 36 N 0.00 1.43 0.02 1.61 6.06 -1.26 -5.15 118.95 121.66 2j98 s ARG 36 Ca 0.00 -0.66 -0.27 0.00 -2.50 0.00 0.00 55.73 52.31 2j98 s ARG 36 Cb 0.00 0.59 -0.04 0.00 0.06 0.00 0.00 34.95 35.55 2j98 s ARG 36 CO 0.00 -0.63 0.83 0.00 -2.50 0.00 0.00 175.30 173.00 2j98 s ALA 37 N -3.81 3.29 -0.27 6.12 0.00 -1.26 -4.20 121.76 121.62 2j98 s ALA 37 Ca 0.05 0.36 -0.01 0.00 0.00 0.00 0.00 51.96 52.35 2j98 s ALA 37 Cb -0.02 -3.12 0.09 0.00 0.00 0.00 0.00 23.12 20.07 2j98 s ALA 37 CO -0.06 -0.06 0.06 0.12 0.00 0.00 0.00 175.76 175.82 2j98 s PHE 38 N 0.41 1.64 0.15 0.00 2.19 0.42 -4.98 117.98 117.80 2j98 s PHE 38 Ca 0.43 -1.54 -0.30 0.00 0.33 0.00 0.00 56.93 55.85 2j98 s PHE 38 Cb -0.20 -1.54 -0.07 0.00 -1.31 0.00 0.00 43.02 39.89 2j98 s PHE 38 CO 0.24 -0.80 1.19 1.41 1.83 0.00 0.00 175.22 179.09 2j98 s MET 39 N 1.64 4.49 -0.21 10.12 -2.45 -1.26 -0.71 119.30 130.92 2j98 s MET 39 Ca 0.05 1.83 0.12 0.00 -1.25 0.00 0.00 55.69 56.44 2j98 s MET 39 Cb -0.17 -3.27 -0.21 0.00 1.25 0.00 0.00 34.83 32.42 2j98 s MET 39 CO -0.19 -0.12 -0.04 0.66 1.05 0.00 0.00 175.02 176.39 2j98 n TYR 40 N 2.87 0.00 -3.57 4.11 4.01 0.69 -4.84 117.16 120.44 2j98 n TYR 40 Ca 0.05 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.71 2j98 n TYR 40 Cb 0.45 -0.95 -0.02 0.00 -0.31 0.00 0.00 39.34 38.51 2j98 n TYR 40 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2j98 s ALA 41 N -2.48 -1.66 -0.03 -0.72 0.00 -1.10 -1.65 121.76 114.12 2j98 s ALA 41 Ca -0.18 0.55 0.01 0.00 0.00 0.00 0.00 51.96 52.34 2j98 s ALA 41 Cb 0.07 0.64 0.02 0.00 0.00 0.00 0.00 23.12 23.84 2j98 s ALA 41 CO 0.71 -0.82 -0.04 -0.47 0.00 0.00 0.00 175.76 175.14 2j98 s TYR 42 N -3.42 0.65 -0.12 0.00 5.04 -0.03 -0.68 117.35 118.79 2j98 s TYR 42 Ca 0.06 -0.16 0.02 0.00 -2.44 0.00 0.00 57.07 54.56 2j98 s TYR 42 Cb -0.02 -0.56 -0.00 0.00 0.35 0.00 0.00 41.96 41.73 2j98 s TYR 42 CO -0.06 -0.14 -0.20 0.08 -1.34 0.00 0.00 175.55 173.89 2j98 s VAL 43 N 0.69 2.37 0.28 3.14 1.01 0.07 -0.28 120.40 127.68 2j98 s VAL 43 Ca -0.09 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.01 2j98 s VAL 43 Cb -0.12 -1.95 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 2j98 s VAL 43 CO -0.00 0.54 0.34 1.07 0.00 0.00 0.00 175.10 177.05 2j98 n THR 44 N 3.70 0.00 1.15 3.92 5.66 -0.73 -0.82 114.28 127.16 2j98 n THR 44 Ca -0.19 -1.59 0.12 0.00 -3.05 0.00 0.00 64.05 59.34 2j98 n THR 44 Cb 0.52 0.91 0.21 0.00 -1.55 0.00 0.00 70.33 70.43 2j98 n THR 44 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2j98 n THR 45 N -0.48 0.00 -5.01 1.09 -2.24 -1.26 -0.18 114.28 106.20 2j98 n THR 45 Ca 0.02 -0.27 -0.30 0.00 -2.27 0.00 0.00 64.05 61.23 2j98 n THR 45 Cb 0.47 0.94 -0.15 0.00 -2.10 0.00 0.00 70.33 69.49 2j98 n THR 45 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2j98 s LYS 46 N -2.31 1.85 0.85 -0.78 1.02 -1.26 -4.82 119.74 114.30 2j98 s LYS 46 Ca 0.25 -1.03 -0.11 0.00 0.02 0.00 0.00 55.97 55.10 2j98 s LYS 46 Cb 0.19 -1.94 0.14 0.00 -0.52 0.00 0.00 37.83 35.70 2j98 s LYS 46 CO 0.46 0.51 1.19 -1.25 -0.92 0.00 0.00 175.35 175.35 2j98 s PRO 47 N -1.02 1.32 0.00 -1.68 0.04 -1.26 -4.53 135.00 127.87 2j98 s PRO 47 Ca 0.11 -0.39 0.00 0.00 0.04 0.00 0.00 61.00 60.75 2j98 s PRO 47 Cb -0.10 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.45 2j98 s PRO 47 CO 0.01 -1.91 0.00 0.41 0.04 0.00 0.00 177.00 175.55 2j98 n GLY 48 N -3.39 0.60 3.77 0.56 0.00 -1.26 -5.02 105.19 100.45 2j98 n GLY 48 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 2j98 n GLY 48 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2j98 s MET 49 N -0.10 4.02 0.00 1.61 -1.94 -1.26 -4.06 119.30 117.56 2j98 s MET 49 Ca 0.00 1.73 0.00 0.00 -1.71 0.00 0.00 55.69 55.71 2j98 s MET 49 Cb 0.00 -2.59 0.00 0.00 2.01 0.00 0.00 34.83 34.25 2j98 s MET 49 CO 0.00 -0.32 0.00 1.63 -0.01 0.00 0.00 175.02 176.32 2j98 n LYS 50 N -0.08 2.64 -4.06 2.03 4.76 0.13 -4.88 118.16 118.71 2j98 n LYS 50 Ca 0.05 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.40 2j98 n LYS 50 Cb 0.48 -0.86 -0.11 0.00 -1.84 0.00 0.00 35.03 32.70 2j98 n LYS 50 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2j98 s TYR 51 N -1.66 0.51 0.05 2.13 1.51 -0.49 -0.20 117.35 119.20 2j98 s TYR 51 Ca 0.00 -0.74 0.09 0.00 -1.01 0.00 0.00 57.07 55.41 2j98 s TYR 51 Cb 0.00 -0.34 -0.03 0.00 -0.11 0.00 0.00 41.96 41.48 2j98 s TYR 51 CO 0.00 -0.22 -0.24 0.08 -1.11 0.00 0.00 175.55 174.06 2j98 s VAL 52 N -2.49 1.97 -0.68 0.71 1.01 0.06 -1.05 120.40 119.92 2j98 s VAL 52 Ca -0.04 -1.33 -0.18 0.00 0.00 0.00 0.00 61.98 60.44 2j98 s VAL 52 Cb -0.02 -1.69 0.13 0.00 0.00 0.00 0.00 36.38 34.80 2j98 s VAL 52 CO -0.04 0.30 0.75 -0.54 0.00 0.00 0.00 175.10 175.58 2j98 s LYS 53 N -1.23 3.23 -0.31 2.72 -0.14 -0.43 -0.71 119.74 122.86 2j98 s LYS 53 Ca 0.10 -1.65 -0.13 0.00 -1.36 0.00 0.00 55.97 52.92 2j98 s LYS 53 Cb -0.10 -4.39 -0.03 0.00 -1.68 0.00 0.00 37.83 31.63 2j98 s LYS 53 CO 0.02 -1.50 0.29 -0.46 -0.76 0.00 0.00 175.35 172.94 2j98 s TRP 54 N 2.07 3.22 0.06 3.18 -0.00 0.15 -4.47 118.94 123.15 2j98 s TRP 54 Ca 0.15 0.04 -0.30 0.00 -0.00 0.00 0.00 56.10 55.98 2j98 s TRP 54 Cb -0.19 -2.53 -0.05 0.00 -0.00 0.00 0.00 33.47 30.69 2j98 s TRP 54 CO 0.01 -0.31 1.12 -2.00 -0.00 0.00 0.00 176.95 175.76 2j98 s GLU 55 N 1.89 4.49 0.00 5.86 2.12 -1.26 0.22 118.70 132.02 2j98 s GLU 55 Ca 0.10 1.65 0.00 0.00 0.36 0.00 0.00 54.97 57.08 2j98 s GLU 55 Cb -0.16 -3.37 0.00 0.00 0.26 0.00 0.00 34.13 30.85 2j98 s GLU 55 CO 0.11 -0.15 0.00 1.58 -0.54 0.00 0.00 175.26 176.26 2j98 n HIS 56 N 3.74 0.00 -0.29 5.30 -0.00 -0.53 -4.90 115.22 118.54 2j98 n HIS 56 Ca 0.07 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.25 2j98 n HIS 56 Cb 0.48 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.35 2j98 n HIS 56 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2j98 n ASP 57 N 0.00 -0.20 -4.79 0.26 10.43 -1.26 -3.71 116.55 117.29 2j98 n ASP 57 Ca 0.00 0.00 -0.38 0.00 2.57 0.00 0.00 54.79 56.98 2j98 n ASP 57 Cb 0.00 0.00 -0.06 0.00 1.84 0.00 0.00 41.12 42.90 2j98 n ASP 57 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2j98 s SER 58 N -4.00 6.74 0.28 -2.24 1.04 -1.26 -4.88 113.70 109.38 2j98 s SER 58 Ca 0.00 0.88 -0.20 0.00 0.48 0.00 0.00 55.95 57.10 2j98 s SER 58 Cb 0.00 -2.26 0.04 0.00 0.10 0.00 0.00 66.02 63.90 2j98 s SER 58 CO 0.00 0.20 0.79 -0.83 0.98 0.00 0.00 173.24 174.38 2j98 s GLY 59 N -0.38 0.01 -0.12 7.32 0.00 -1.24 -5.15 107.32 107.76 2j98 s GLY 59 Ca 0.24 -0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.61 2j98 s GLY 59 CO 0.12 0.00 -0.12 0.14 0.00 0.00 0.00 173.10 173.23 2j98 s VAL 60 N -3.35 1.35 -0.11 1.40 1.01 -1.26 -1.46 120.40 117.99 2j98 s VAL 60 Ca 0.13 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.56 2j98 s VAL 60 Cb -0.05 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 2j98 s VAL 60 CO 0.07 0.42 0.04 -0.69 0.00 0.00 0.00 175.10 174.94 2j98 s VAL 61 N 1.39 4.59 -0.36 2.92 1.01 0.58 -4.91 120.40 125.63 2j98 s VAL 61 Ca 0.01 -0.13 -0.18 0.00 0.00 0.00 0.00 61.98 61.68 2j98 s VAL 61 Cb -0.13 -2.97 -0.00 0.00 0.00 0.00 0.00 36.38 33.27 2j98 s VAL 61 CO -0.07 0.58 0.49 -0.89 0.00 0.00 0.00 175.10 175.21 2j98 s THR 62 N -0.64 5.03 -0.23 3.92 2.01 -1.26 0.32 115.64 124.79 2j98 s THR 62 Ca 0.11 0.23 -0.08 0.00 0.31 0.00 0.00 61.69 62.25 2j98 s THR 62 Cb -0.12 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 2j98 s THR 62 CO 0.02 -0.24 0.09 -0.69 -0.69 0.00 0.00 174.62 173.12 2j98 s VAL 63 N 2.34 4.72 0.24 3.82 1.01 0.11 -4.92 120.40 127.71 2j98 s VAL 63 Ca 0.17 -0.04 -0.21 0.00 0.00 0.00 0.00 61.98 61.89 2j98 s VAL 63 Cb -0.16 -3.18 -0.09 0.00 0.00 0.00 0.00 36.38 32.96 2j98 s VAL 63 CO 0.13 0.37 0.77 -0.70 0.00 0.00 0.00 175.10 175.68 2j98 s GLU 64 N 1.13 4.35 0.15 2.72 2.12 -1.26 -0.76 118.70 127.14 2j98 s GLU 64 Ca 0.05 0.99 0.09 0.00 0.36 0.00 0.00 54.97 56.45 2j98 s GLU 64 Cb -0.14 -2.90 -0.04 0.00 0.26 0.00 0.00 34.13 31.31 2j98 s GLU 64 CO 0.04 0.39 -0.13 -0.51 -0.54 0.00 0.00 175.26 174.51 2j98 s LEU 65 N -1.91 2.89 0.59 2.70 1.43 0.72 -0.99 118.68 124.11 2j98 s LEU 65 Ca 0.44 -0.54 -0.09 0.00 -1.03 0.00 0.00 54.13 52.91 2j98 s LEU 65 Cb -0.18 -1.65 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 2j98 s LEU 65 CO 0.22 0.14 0.96 -1.61 0.23 0.00 0.00 176.35 176.30 2j98 s GLU 66 N -2.49 3.43 0.40 1.70 0.41 0.70 -4.71 118.70 118.15 2j98 s GLU 66 Ca 0.22 0.51 -0.26 0.00 -0.41 0.00 0.00 54.97 55.02 2j98 s GLU 66 Cb -0.10 -2.16 -0.10 0.00 -1.78 0.00 0.00 34.13 29.98 2j98 s GLU 66 CO 0.13 -0.55 1.32 -2.30 -0.49 0.00 0.00 175.26 173.37 2j98 n PRO 67 N -2.64 2.09 -2.16 0.39 -0.02 -1.26 -4.45 135.00 126.94 2j98 n PRO 67 Ca 0.05 0.74 -0.32 0.00 -2.02 0.00 0.00 63.50 61.94 2j98 n PRO 67 Cb 0.55 -2.43 -0.01 0.00 -0.02 0.00 0.00 33.50 31.59 2j98 n PRO 67 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2j98 s PRO 68 N -2.15 3.64 -0.13 0.52 0.04 -1.26 -4.73 135.00 130.93 2j98 s PRO 68 Ca 0.59 1.00 -0.07 0.00 0.04 0.00 0.00 61.00 62.56 2j98 s PRO 68 Cb -0.51 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.90 2j98 s PRO 68 CO 0.59 -0.53 0.12 0.00 0.04 0.00 0.00 177.00 177.23 2j98 s ALA 69 N -2.68 3.80 -0.01 8.56 0.00 -0.33 -4.89 121.76 126.21 2j98 s ALA 69 Ca 0.60 -0.66 -0.14 0.00 0.00 0.00 0.00 51.96 51.76 2j98 s ALA 69 Cb -0.12 -1.94 -0.06 0.00 0.00 0.00 0.00 23.12 21.00 2j98 s ALA 69 CO 0.38 0.56 0.38 1.03 0.00 0.00 0.00 175.76 178.11 2j98 s ARG 70 N -0.85 3.87 0.22 0.00 0.52 -1.26 -0.47 118.95 120.97 2j98 s ARG 70 Ca 0.14 0.36 -0.04 0.00 -0.52 0.00 0.00 55.73 55.66 2j98 s ARG 70 Cb -0.12 -3.21 -0.03 0.00 0.52 0.00 0.00 34.95 32.11 2j98 s ARG 70 CO 0.03 0.70 0.23 -0.59 0.02 0.00 0.00 175.30 175.69 2j98 s PHE 71 N -1.08 0.95 -0.01 -0.53 -0.12 0.00 -4.97 117.98 112.21 2j98 s PHE 71 Ca 0.23 -1.21 0.03 0.00 -0.05 0.00 0.00 56.93 55.93 2j98 s PHE 71 Cb -0.16 -0.35 -0.00 0.00 -0.63 0.00 0.00 43.02 41.87 2j98 s PHE 71 CO 0.13 -0.75 -0.08 0.08 -0.05 0.00 0.00 175.22 174.54 2j98 s VAL 72 N -4.10 0.70 0.16 -2.49 1.01 -1.26 -0.07 120.40 114.35 2j98 s VAL 72 Ca 0.34 -0.35 0.11 0.00 0.00 0.00 0.00 61.98 62.08 2j98 s VAL 72 Cb 0.05 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 2j98 s VAL 72 CO 0.12 0.21 -0.25 0.27 0.00 0.00 0.00 175.10 175.44 2j98 s ILE 73 N -0.05 2.33 0.29 2.22 -4.36 -0.23 -4.47 121.20 116.94 2j98 s ILE 73 Ca 0.01 -1.89 -0.29 0.00 -0.26 0.00 0.00 60.65 58.22 2j98 s ILE 73 Cb -0.05 -2.08 -0.09 0.00 1.25 0.00 0.00 42.46 41.49 2j98 s ILE 73 CO -0.00 -0.01 1.09 -0.62 0.24 0.00 0.00 174.94 175.63 2j98 s ASP 74 N -2.37 7.24 0.26 4.36 2.15 0.06 -0.26 116.67 128.12 2j98 s ASP 74 Ca 0.18 2.23 0.01 0.00 0.43 0.00 0.00 52.55 55.40 2j98 s ASP 74 Cb -0.09 -2.62 -0.04 0.00 -0.30 0.00 0.00 42.92 39.86 2j98 s ASP 74 CO 0.08 -0.16 0.12 0.42 -0.17 0.00 0.00 175.17 175.46 2j98 s THR 75 N -1.21 0.38 0.56 1.71 -4.23 -0.63 -4.82 115.64 107.41 2j98 s THR 75 Ca 0.46 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.23 2j98 s THR 75 Cb -0.31 -2.57 0.37 0.00 1.34 0.00 0.00 72.50 71.33 2j98 s THR 75 CO 0.39 0.00 2.04 -0.65 -0.54 0.00 0.00 174.62 175.87 2j98 h PRO 76 N 2.37 0.00 -0.40 3.99 0.11 -2.01 -1.83 132.00 134.23 2j98 h PRO 76 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2j98 h PRO 76 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2j98 h PRO 76 CO 0.56 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.60 2j98 n THR 77 N -4.03 1.28 0.00 -1.15 -2.24 -1.26 -5.08 114.28 101.80 2j98 n THR 77 Ca 0.05 -1.16 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 2j98 n THR 77 Cb 0.44 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 2j98 n THR 77 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j98 n GLY 78 N 0.51 -0.15 3.76 3.38 0.00 -0.69 -5.03 105.19 106.97 2j98 n GLY 78 Ca 0.16 -2.26 -0.39 0.00 0.00 0.00 0.00 46.02 43.53 2j98 n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j98 s PRO 79 N -0.03 3.69 -0.07 1.61 0.04 -1.26 -1.60 135.00 137.37 2j98 s PRO 79 Ca 0.00 2.12 0.02 0.00 0.04 0.00 0.00 61.00 63.18 2j98 s PRO 79 Cb 0.00 -2.55 0.02 0.00 0.04 0.00 0.00 34.50 32.01 2j98 s PRO 79 CO 0.00 -0.71 -0.11 -1.14 0.04 0.00 0.00 177.00 175.07 2j98 s GLN 80 N -2.53 1.68 0.11 4.56 0.74 0.65 -4.89 119.66 119.97 2j98 s GLN 80 Ca 0.62 -0.39 -0.31 0.00 0.05 0.00 0.00 55.36 55.34 2j98 s GLN 80 Cb -0.37 -1.45 -0.07 0.00 1.10 0.00 0.00 33.01 32.23 2j98 s GLN 80 CO 0.46 -0.03 1.25 0.42 -0.55 0.00 0.00 175.29 176.84 2j98 s ILE 81 N 0.85 3.73 0.25 -2.34 1.01 -1.26 -1.06 121.20 122.39 2j98 s ILE 81 Ca -0.11 1.29 0.11 0.00 0.00 0.00 0.00 60.65 61.95 2j98 s ILE 81 Cb -0.15 -3.83 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 2j98 s ILE 81 CO 0.01 0.13 -0.18 -0.54 0.00 0.00 0.00 174.94 174.36 2j98 s LYS 82 N 0.73 1.73 -0.12 2.79 -0.14 0.90 -4.72 119.74 120.91 2j98 s LYS 82 Ca 0.59 -1.64 0.02 0.00 -1.36 0.00 0.00 55.97 53.57 2j98 s LYS 82 Cb -0.32 -1.85 0.01 0.00 -1.68 0.00 0.00 37.83 33.99 2j98 s LYS 82 CO 0.31 0.36 -0.19 0.71 -0.76 0.00 0.00 175.35 175.78 2j98 s TYR 83 N -2.24 2.31 -0.27 3.18 1.51 0.75 -0.82 117.35 121.77 2j98 s TYR 83 Ca 0.28 -1.12 -0.06 0.00 -1.01 0.00 0.00 57.07 55.16 2j98 s TYR 83 Cb -0.06 -1.61 -0.00 0.00 -0.11 0.00 0.00 41.96 40.18 2j98 s TYR 83 CO 0.14 -0.53 0.06 -1.17 -1.11 0.00 0.00 175.55 172.94 2j98 s LEU 84 N 0.87 3.59 -0.27 -1.29 2.96 0.37 -1.78 118.68 123.13 2j98 s LEU 84 Ca -0.08 -0.54 -0.05 0.00 -0.22 0.00 0.00 54.13 53.24 2j98 s LEU 84 Cb -0.15 -1.86 0.02 0.00 0.50 0.00 0.00 46.19 44.69 2j98 s LEU 84 CO -0.01 -0.13 0.02 -0.31 -1.32 0.00 0.00 176.35 174.60 2j98 s TYR 85 N 1.52 3.11 0.49 5.38 1.51 0.62 -1.18 117.35 128.80 2j98 s TYR 85 Ca 0.04 -1.22 -0.20 0.00 -1.01 0.00 0.00 57.07 54.68 2j98 s TYR 85 Cb -0.16 -2.17 -0.08 0.00 -0.11 0.00 0.00 41.96 39.44 2j98 s TYR 85 CO 0.02 -0.64 1.04 -0.06 -1.11 0.00 0.00 175.55 174.80 2j98 s PHE 86 N 1.43 2.99 0.60 2.71 0.40 -1.26 -0.85 117.98 123.99 2j98 s PHE 86 Ca 0.02 1.57 -0.17 0.00 -0.60 0.00 0.00 56.93 57.75 2j98 s PHE 86 Cb -0.17 -3.06 -0.03 0.00 0.51 0.00 0.00 43.02 40.27 2j98 s PHE 86 CO -0.01 -0.86 1.11 0.14 0.70 0.00 0.00 175.22 176.31 2j98 s VAL 87 N -2.01 3.27 0.08 -0.44 -7.23 -0.66 -0.22 120.40 113.19 2j98 s VAL 87 Ca 0.67 0.68 -0.34 0.00 -1.81 0.00 0.00 61.98 61.19 2j98 s VAL 87 Cb -0.16 -3.22 -0.13 0.00 0.56 0.00 0.00 36.38 33.43 2j98 s VAL 87 CO 0.21 -0.28 1.71 1.17 -0.31 0.00 0.00 175.10 177.60 2j98 n LYS 88 N -1.85 2.25 -1.69 4.82 4.81 -0.17 -1.93 118.16 124.41 2j98 n LYS 88 Ca 0.11 0.81 -0.11 0.00 -0.87 0.00 0.00 58.31 58.25 2j98 n LYS 88 Cb 0.52 -2.62 -0.03 0.00 0.02 0.00 0.00 35.03 32.91 2j98 n LYS 88 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2j98 n ASN 89 N 4.70 -4.01 -4.76 3.14 3.02 -1.26 -4.97 115.26 111.11 2j98 n ASN 89 Ca 0.19 0.15 -0.41 0.00 -0.03 0.00 0.00 54.58 54.48 2j98 n ASN 89 Cb 0.30 -2.80 -0.01 0.00 -0.61 0.00 0.00 39.78 36.66 2j98 n ASN 89 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2j98 s LEU 90 N -2.77 4.35 0.81 3.41 2.96 -0.81 -4.96 118.68 121.67 2j98 s LEU 90 Ca 0.00 2.93 -0.12 0.00 -0.22 0.00 0.00 54.13 56.72 2j98 s LEU 90 Cb 0.00 -3.65 0.08 0.00 0.50 0.00 0.00 46.19 43.12 2j98 s LEU 90 CO 0.00 -0.82 1.10 0.54 -1.32 0.00 0.00 176.35 175.84 2j98 s ASN 91 N 0.09 4.41 0.28 3.68 2.20 -1.26 -4.78 114.94 119.55 2j98 s ASN 91 Ca 0.57 1.30 -0.00 0.00 -0.94 0.00 0.00 52.86 53.78 2j98 s ASN 91 Cb -0.45 -2.02 0.41 0.00 -2.00 0.00 0.00 41.25 37.19 2j98 s ASN 91 CO 0.54 -2.02 1.79 0.78 -2.94 0.00 0.00 177.10 175.25 2j98 h ASN 92 N -1.13 0.68 -0.46 3.54 2.35 -1.99 -0.95 115.58 117.62 2j98 h ASN 92 Ca -0.47 -0.15 0.02 0.00 -0.55 0.00 0.00 56.30 55.15 2j98 h ASN 92 Cb 1.27 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 39.43 2j98 h ASN 92 CO 0.59 0.75 0.27 0.25 -1.65 0.00 0.00 177.43 177.64 2j98 h LEU 93 N 0.67 0.44 -0.46 1.61 5.85 -1.99 -0.78 115.31 120.65 2j98 h LEU 93 Ca 0.13 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.68 2j98 h LEU 93 Cb 0.41 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2j98 h LEU 93 CO 0.02 0.31 -0.66 0.03 -0.34 0.00 0.00 178.44 177.80 2j98 h ARG 94 N 0.54 0.45 -0.65 1.25 3.08 -1.80 -0.94 114.38 116.32 2j98 h ARG 94 Ca 0.18 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2j98 h ARG 94 Cb 0.01 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 2j98 h ARG 94 CO -0.08 0.96 0.41 0.00 -1.07 0.00 0.00 179.97 180.19 2j98 h ARG 95 N 0.33 0.87 -0.59 0.04 3.08 -1.02 -1.56 114.38 115.53 2j98 h ARG 95 Ca -0.02 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 2j98 h ARG 95 Cb 1.22 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 31.05 2j98 h ARG 95 CO 0.12 0.60 0.36 0.78 -1.07 0.00 0.00 179.97 180.76 2j98 h GLY 96 N 0.88 0.85 0.89 0.04 0.00 -0.86 -1.50 103.07 103.37 2j98 h GLY 96 Ca 0.24 -0.35 0.03 0.00 0.00 0.00 0.00 47.33 47.24 2j98 h GLY 96 CO -0.05 0.34 0.46 0.00 0.00 0.00 0.00 176.54 177.29 2j98 h ALA 97 N 1.18 0.94 -0.11 3.60 0.00 -0.81 0.12 119.26 124.18 2j98 h ALA 97 Ca 0.21 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.12 2j98 h ALA 97 Cb -0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2j98 h ALA 97 CO -0.04 0.26 -0.03 0.28 0.00 0.00 0.00 179.25 179.71 2j98 h VAL 98 N 0.90 0.87 -0.79 0.00 2.07 -0.75 -0.24 116.25 118.32 2j98 h VAL 98 Ca 0.29 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.83 2j98 h VAL 98 Cb -0.00 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 2j98 h VAL 98 CO -0.10 0.00 0.51 -0.07 0.02 0.00 0.00 177.57 177.93 2j98 h LEU 99 N -0.01 0.86 -0.67 2.57 3.38 -0.61 -0.54 115.31 120.30 2j98 h LEU 99 Ca 0.06 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2j98 h LEU 99 Cb 0.09 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2j98 h LEU 99 CO -0.12 0.60 0.22 1.23 0.09 0.00 0.00 178.44 180.47 2j98 h GLY 100 N 1.01 1.11 0.92 0.83 0.00 -0.76 0.15 103.07 106.32 2j98 h GLY 100 Ca 0.30 -0.64 -0.08 0.00 0.00 0.00 0.00 47.33 46.92 2j98 h GLY 100 CO -0.09 0.60 -0.10 -1.82 0.00 0.00 0.00 176.54 175.13 2j98 h TYR 101 N 0.97 0.73 -0.26 5.60 3.20 -0.65 -1.31 116.97 125.25 2j98 h TYR 101 Ca 0.22 -0.16 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2j98 h TYR 101 Cb 0.27 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 2j98 h TYR 101 CO 0.02 0.83 0.12 0.82 -1.64 0.00 0.00 178.16 178.31 2j98 h ILE 102 N 0.42 1.15 -0.95 1.81 2.04 -0.94 -2.16 117.51 118.88 2j98 h ILE 102 Ca 0.08 -0.44 0.10 0.00 1.00 0.00 0.00 64.86 65.61 2j98 h ILE 102 Cb 0.61 0.96 -0.08 0.00 -0.74 0.00 0.00 36.82 37.57 2j98 h ILE 102 CO 0.04 0.15 0.58 1.23 0.00 0.00 0.00 178.15 180.15 2j98 h GLY 103 N 0.28 1.51 2.00 5.37 0.00 -0.86 0.22 103.07 111.60 2j98 h GLY 103 Ca 0.09 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 46.97 2j98 h GLY 103 CO -0.01 0.17 -0.24 0.00 0.00 0.00 0.00 176.54 176.47 2j98 h ALA 104 N 1.50 0.97 0.00 3.60 0.00 -0.85 -3.36 119.26 121.12 2j98 h ALA 104 Ca 0.46 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 2j98 h ALA 104 Cb 0.40 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2j98 h ALA 104 CO -0.25 0.30 -1.16 0.25 0.00 0.00 0.00 179.25 178.39 2j98 n THR 105 N -3.34 0.10 -3.94 0.00 -2.24 -0.80 -5.02 114.28 99.04 2j98 n THR 105 Ca 0.01 -0.09 -0.32 0.00 -2.27 0.00 0.00 64.05 61.37 2j98 n THR 105 Cb 0.47 -0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.38 2j98 n THR 105 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2j98 s VAL 106 N -2.13 5.26 -0.83 2.28 1.01 0.72 -5.05 120.40 121.66 2j98 s VAL 106 Ca -0.01 -0.34 -0.22 0.00 0.00 0.00 0.00 61.98 61.41 2j98 s VAL 106 Cb 0.01 -3.51 0.09 0.00 0.00 0.00 0.00 36.38 32.97 2j98 s VAL 106 CO 0.12 0.23 1.14 0.00 0.00 0.00 0.00 175.10 176.58 2j98 s ARG 107 N -2.22 3.38 0.00 2.72 1.04 -1.26 -4.77 118.95 117.84 2j98 s ARG 107 Ca 0.31 -1.17 0.27 0.00 -1.04 0.00 0.00 55.73 54.09 2j98 s ARG 107 Cb -0.13 -4.68 1.59 0.00 -2.04 0.00 0.00 34.95 29.70 2j98 s ARG 107 CO 0.23 -1.90 1.94 1.28 -0.04 0.00 0.00 175.30 176.81