#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jx3 n THR 2 N 0.00 0.02 -0.04 4.37 -1.04 -1.26 -4.98 114.28 111.36 2jx3 n THR 2 Ca 0.00 -2.30 -0.22 0.00 -2.04 0.00 0.00 64.05 59.49 2jx3 n THR 2 Cb 0.00 0.97 -0.13 0.00 -1.82 0.00 0.00 70.33 69.35 2jx3 n THR 2 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 2jx3 h ILE 3 N 2.39 0.79 -1.35 12.58 2.04 -1.91 -3.47 117.51 128.58 2jx3 h ILE 3 Ca -0.08 -2.28 0.09 0.00 1.00 0.00 0.00 64.86 63.59 2jx3 h ILE 3 Cb 1.11 2.41 -0.21 0.00 -0.74 0.00 0.00 36.82 39.39 2jx3 h ILE 3 CO 0.21 0.62 -0.20 0.00 0.00 0.00 0.00 178.15 178.78 2jx3 s ALA 4 N -2.47 -2.22 -0.07 1.87 0.00 -1.26 -4.47 121.76 113.14 2jx3 s ALA 4 Ca -0.25 2.03 0.10 0.00 0.00 0.00 0.00 51.96 53.84 2jx3 s ALA 4 Cb 0.06 -2.03 0.15 0.00 0.00 0.00 0.00 23.12 21.30 2jx3 s ALA 4 CO 0.69 -1.18 1.05 0.00 0.00 0.00 0.00 175.76 176.32 2jx3 n GLN 5 N 5.43 1.74 -0.80 0.00 10.64 -1.26 -4.68 117.38 128.46 2jx3 n GLN 5 Ca -0.05 -1.97 -0.01 0.00 -1.83 0.00 0.00 57.00 53.14 2jx3 n GLN 5 Cb 0.50 -1.20 -0.01 0.00 -0.86 0.00 0.00 30.24 28.67 2jx3 n GLN 5 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2jx3 n GLY 6 N -0.92 0.76 3.60 2.61 0.00 -1.26 -5.08 105.19 104.89 2jx3 n GLY 6 Ca 0.08 -0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 2jx3 n GLY 6 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jx3 s LYS 7 N 0.00 4.01 0.33 1.61 2.47 -1.26 -4.94 119.74 121.95 2jx3 s LYS 7 Ca 0.06 -0.02 0.12 0.00 -1.56 0.00 0.00 55.97 54.57 2jx3 s LYS 7 Cb 0.07 -3.66 1.01 0.00 -1.46 0.00 0.00 37.83 33.79 2jx3 s LYS 7 CO -0.03 -0.26 1.66 0.78 0.16 0.00 0.00 175.35 177.66 2jx3 h GLY 8 N 8.55 1.93 -5.00 5.54 0.00 -1.98 -3.33 103.07 108.78 2jx3 h GLY 8 Ca -0.32 -0.20 -0.13 0.00 0.00 0.00 0.00 47.33 46.67 2jx3 h GLY 8 CO 0.63 -0.46 -0.43 0.61 0.00 0.00 0.00 176.54 176.89 2jx3 n GLN 9 N -5.08 0.50 0.00 4.80 10.64 -1.26 -4.98 117.38 122.00 2jx3 n GLN 9 Ca 0.30 -1.81 0.00 0.00 -1.83 0.00 0.00 57.00 53.66 2jx3 n GLN 9 Cb 0.92 -1.23 0.00 0.00 -0.86 0.00 0.00 30.24 29.07 2jx3 n GLN 9 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 2jx3 n LYS 10 N 2.72 1.79 0.23 2.61 2.85 -1.25 -4.31 118.16 122.80 2jx3 n LYS 10 Ca 0.16 0.00 0.12 0.00 -1.05 0.00 0.00 58.31 57.53 2jx3 n LYS 10 Cb 0.58 0.00 0.48 0.00 -0.65 0.00 0.00 35.03 35.44 2jx3 n LYS 10 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 2jx3 h LEU 11 N 0.00 0.00 0.11 -5.58 3.38 -1.89 -3.21 115.31 108.11 2jx3 h LEU 11 Ca 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 2jx3 h LEU 11 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2jx3 h LEU 11 CO 0.00 0.17 -1.65 0.00 0.09 0.00 0.00 178.44 177.04 2jx3 h GLU 13 N -0.21 -0.31 -5.24 0.00 4.39 -1.82 -3.34 114.58 108.05 2jx3 h GLU 13 Ca -0.36 0.02 -0.11 0.00 0.34 0.00 0.00 59.36 59.26 2jx3 h GLU 13 Cb 1.84 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 30.53 2jx3 h GLU 13 CO 0.05 -0.21 0.59 0.44 -1.16 0.00 0.00 179.01 178.72 2jx3 n ILE 14 N -3.45 -0.00 -0.13 3.13 -5.35 -1.21 -4.71 119.36 107.63 2jx3 n ILE 14 Ca -0.04 -0.50 0.23 0.00 -0.27 0.00 0.00 62.75 62.17 2jx3 n ILE 14 Cb 0.16 -1.42 0.65 0.00 -1.74 0.00 0.00 39.64 37.28 2jx3 n ILE 14 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2jx3 h GLU 15 N 12.22 0.12 0.00 6.28 3.07 -1.88 -3.11 114.58 131.30 2jx3 h GLU 15 Ca 0.01 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2jx3 h GLU 15 Cb 1.04 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.92 2jx3 h GLU 15 CO 1.18 0.08 0.00 -2.13 -1.40 0.00 0.00 179.01 176.74 2jx3 n ARG 16 N -4.37 0.00 -0.24 2.33 3.00 -1.26 0.56 116.66 116.67 2jx3 n ARG 16 Ca 0.15 0.93 -0.07 0.00 -0.00 0.00 0.00 57.85 58.86 2jx3 n ARG 16 Cb 0.75 -1.41 0.04 0.00 0.00 0.00 0.00 32.46 31.84 2jx3 n ARG 16 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.63 176.79 2jx3 h ILE 17 N 0.00 1.24 -0.85 5.15 3.07 -1.86 -2.44 117.51 121.82 2jx3 h ILE 17 Ca 0.00 -0.78 0.18 0.00 1.55 0.00 0.00 64.86 65.81 2jx3 h ILE 17 Cb 0.00 0.49 -0.06 0.00 -0.27 0.00 0.00 36.82 36.98 2jx3 h ILE 17 CO 0.00 0.31 0.57 -0.74 -1.05 0.00 0.00 178.15 177.23 2jx3 h HIS 18 N 0.97 0.52 0.20 0.16 2.76 -1.14 -2.60 115.15 116.01 2jx3 h HIS 18 Ca 0.22 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.40 2jx3 h HIS 18 Cb 0.23 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 29.03 2jx3 h HIS 18 CO 0.02 0.16 -0.09 0.35 -1.30 0.00 0.00 177.93 177.06 2jx3 h PHE 19 N 0.41 -0.25 -1.10 5.26 3.57 0.59 0.55 116.94 125.97 2jx3 h PHE 19 Ca 0.43 -0.01 0.32 0.00 3.53 0.00 0.00 57.97 62.25 2jx3 h PHE 19 Cb 1.06 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.83 2jx3 h PHE 19 CO -0.00 -0.15 1.19 0.35 -2.23 0.00 0.00 178.31 177.46 2jx3 h PHE 20 N -0.83 0.00 0.00 0.41 3.04 -1.28 0.63 116.94 118.91 2jx3 h PHE 20 Ca -0.03 0.00 -0.36 0.00 3.98 0.00 0.00 57.97 61.57 2jx3 h PHE 20 Cb 0.20 0.00 -0.07 0.00 2.56 0.00 0.00 35.95 38.65 2jx3 h PHE 20 CO 0.01 0.00 -2.34 1.28 -2.02 0.00 0.00 178.31 175.25 2jx3 n LEU 21 N -3.37 0.09 -0.59 0.59 4.77 -1.00 -4.34 117.00 113.15 2jx3 n LEU 21 Ca 0.25 -0.00 0.47 0.00 -0.03 0.00 0.00 56.01 56.69 2jx3 n LEU 21 Cb 1.52 0.44 0.79 0.00 -2.33 0.00 0.00 43.42 43.84 2jx3 n LEU 21 CO 0.26 0.49 1.42 -1.28 -1.33 0.00 0.00 177.39 176.96 2jx3 h SER 22 N 0.00 0.03 -0.03 -1.43 0.87 0.27 0.91 113.55 114.16 2jx3 h SER 22 Ca -0.53 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.05 2jx3 h SER 22 Cb 2.19 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 64.16 2jx3 h SER 22 CO 0.03 -0.02 0.34 0.11 -0.53 0.00 0.00 176.83 176.75 2jx3 h LYS 23 N 0.01 0.00 -4.55 2.24 1.57 -1.75 -3.47 116.57 110.62 2jx3 h LYS 23 Ca 0.84 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 59.62 2jx3 h LYS 23 Cb 3.27 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 35.49 2jx3 h LYS 23 CO -0.06 0.00 -1.22 1.17 -0.57 0.00 0.00 179.45 178.77 2jx3 n LYS 24 N -2.94 -3.95 -0.82 3.15 4.81 0.31 -5.05 118.16 113.67 2jx3 n LYS 24 Ca -0.01 3.03 0.00 0.00 -0.87 0.00 0.00 58.31 60.46 2jx3 n LYS 24 Cb 0.39 -4.30 0.00 0.00 0.02 0.00 0.00 35.03 31.14 2jx3 n LYS 24 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2jx3 n LYS 25 N 1.44 1.66 0.06 1.64 4.01 -1.26 -5.07 118.16 120.63 2jx3 n LYS 25 Ca -0.28 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.52 2jx3 n LYS 25 Cb 0.43 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.95 2jx3 n LYS 25 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 2jx3 n THR 26 N -0.64 0.73 0.05 -0.18 -1.04 -1.26 -4.48 114.28 107.45 2jx3 n THR 26 Ca 0.00 0.24 -0.13 0.00 -2.04 0.00 0.00 64.05 62.12 2jx3 n THR 26 Cb 0.00 -1.31 -0.09 0.00 -1.82 0.00 0.00 70.33 67.11 2jx3 n THR 26 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 2jx3 h ASP 27 N 0.00 -0.09 0.68 8.00 3.58 -1.99 -1.40 116.42 125.20 2jx3 h ASP 27 Ca 0.00 -0.27 -0.03 0.00 0.42 0.00 0.00 57.03 57.15 2jx3 h ASP 27 Cb 0.17 0.02 0.01 0.00 1.72 0.00 0.00 39.33 41.25 2jx3 h ASP 27 CO 0.00 0.23 -0.33 -0.33 -2.88 0.00 0.00 179.24 175.93 2jx3 h GLU 28 N -0.41 -0.88 -1.01 0.28 3.07 -1.90 -2.22 114.58 111.51 2jx3 h GLU 28 Ca -0.01 0.06 0.29 0.00 -0.50 0.00 0.00 59.36 59.20 2jx3 h GLU 28 Cb 0.35 0.20 -0.04 0.00 -0.84 0.00 0.00 28.75 28.42 2jx3 h GLU 28 CO 0.02 -0.56 0.74 1.25 -1.40 0.00 0.00 179.01 179.05 2jx3 h LEU 29 N -1.00 0.00 0.00 1.33 7.12 -1.78 -0.44 115.31 120.54 2jx3 h LEU 29 Ca -0.09 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.92 2jx3 h LEU 29 Cb 0.72 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.85 2jx3 h LEU 29 CO 0.15 0.00 0.00 0.54 -0.13 0.00 0.00 178.44 179.00 2jx3 n ARG 30 N -4.20 0.00 -0.21 1.25 1.74 -0.53 -0.81 116.66 113.90 2jx3 n ARG 30 Ca 0.21 0.40 0.19 0.00 -0.77 0.00 0.00 57.85 57.88 2jx3 n ARG 30 Cb 1.08 -1.23 0.53 0.00 -1.02 0.00 0.00 32.46 31.83 2jx3 n ARG 30 CO 0.00 0.00 0.00 -2.95 -1.52 0.00 0.00 177.63 173.16 2jx3 h ASN 31 N 0.00 0.36 0.00 0.55 -1.07 -1.24 0.37 115.58 114.55 2jx3 h ASN 31 Ca 0.00 0.03 0.00 0.00 0.07 0.00 0.00 56.30 56.40 2jx3 h ASN 31 Cb 0.00 -0.04 0.00 0.00 -2.07 0.00 0.00 38.32 36.21 2jx3 h ASN 31 CO 0.00 0.16 0.00 0.18 0.07 0.00 0.00 177.43 177.84 2jx3 n LEU 32 N -4.48 0.04 0.26 6.14 4.77 -0.20 -0.23 117.00 123.30 2jx3 n LEU 32 Ca 0.17 0.72 0.18 0.00 -0.03 0.00 0.00 56.01 57.06 2jx3 n LEU 32 Cb 0.66 -0.49 0.91 0.00 -2.33 0.00 0.00 43.42 42.18 2jx3 n LEU 32 CO 0.32 -0.49 1.15 -0.74 -1.33 0.00 0.00 177.39 176.30 2jx3 h HIS 33 N 0.00 0.00 0.00 -1.77 2.76 -0.87 0.53 115.15 115.80 2jx3 h HIS 33 Ca 0.00 0.00 -0.28 0.00 -2.20 0.00 0.00 60.37 57.89 2jx3 h HIS 33 Cb 0.00 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 28.91 2jx3 h HIS 33 CO 0.10 0.00 -1.62 -0.22 -1.30 0.00 0.00 177.93 174.89 2jx3 h LYS 34 N 0.00 0.00 0.00 5.26 3.11 -0.29 0.29 116.57 124.94 2jx3 h LYS 34 Ca 0.05 0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 57.81 2jx3 h LYS 34 Cb 0.44 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.66 2jx3 h LYS 34 CO -0.00 0.54 -1.03 -0.11 -2.81 0.00 0.00 179.45 176.04 2jx3 n LEU 35 N -3.08 1.65 0.24 5.20 7.94 0.68 -3.21 117.00 126.42 2jx3 n LEU 35 Ca -0.15 0.27 -0.16 0.00 -1.11 0.00 0.00 56.01 54.87 2jx3 n LEU 35 Cb 1.04 -0.62 -0.08 0.00 0.53 0.00 0.00 43.42 44.29 2jx3 n LEU 35 CO 0.45 -0.22 0.68 0.25 -1.11 0.00 0.00 177.39 177.44 2jx3 h LEU 36 N -0.72 -0.72 -0.38 -1.96 5.85 -0.08 -2.99 115.31 114.31 2jx3 h LEU 36 Ca -0.11 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2jx3 h LEU 36 Cb 0.88 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.14 2jx3 h LEU 36 CO -0.07 -0.43 -0.48 -1.22 -0.34 0.00 0.00 178.44 175.90 2jx3 n TYR 37 N -5.41 0.00 -4.34 1.25 4.01 -1.00 -4.95 117.16 106.72 2jx3 n TYR 37 Ca -0.10 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.29 2jx3 n TYR 37 Cb 0.31 -0.12 -0.08 0.00 -0.31 0.00 0.00 39.34 39.15 2jx3 n TYR 37 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2jx3 n ASN 38 N -0.90 -0.49 -4.22 7.72 5.15 -0.85 -4.90 115.26 116.78 2jx3 n ASN 38 Ca 0.09 -1.21 -0.13 0.00 -0.60 0.00 0.00 54.58 52.73 2jx3 n ASN 38 Cb 0.36 -1.87 -0.10 0.00 -0.53 0.00 0.00 39.78 37.64 2jx3 n ASN 38 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2jx3 s ARG 39 N -7.21 1.19 -0.36 1.20 3.00 0.97 -4.96 118.95 112.77 2jx3 s ARG 39 Ca 0.34 -1.62 -0.29 0.00 0.00 0.00 0.00 55.73 54.16 2jx3 s ARG 39 Cb -0.20 0.13 0.00 0.00 0.00 0.00 0.00 34.95 34.89 2jx3 s ARG 39 CO 0.99 -0.33 1.43 -1.25 0.00 0.00 0.00 175.30 176.13 2jx3 s PRO 40 N -4.10 3.66 -0.59 3.54 0.04 -1.26 -4.09 135.00 132.19 2jx3 s PRO 40 Ca 0.35 1.10 -0.36 0.00 0.04 0.00 0.00 61.00 62.13 2jx3 s PRO 40 Cb 0.07 -4.00 -0.16 0.00 0.04 0.00 0.00 34.50 30.44 2jx3 s PRO 40 CO 0.10 -1.46 2.34 0.41 0.04 0.00 0.00 177.00 178.43 2jx3 n GLY 41 N 4.89 -0.02 3.29 0.56 0.00 -1.26 -4.80 105.19 107.84 2jx3 n GLY 41 Ca 0.17 1.03 -0.31 0.00 0.00 0.00 0.00 46.02 46.91 2jx3 n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jx3 s THR 42 N 7.83 2.01 0.28 2.61 -4.23 -1.26 -4.82 115.64 118.07 2jx3 s THR 42 Ca 1.19 -1.08 0.07 0.00 -1.18 0.00 0.00 61.69 60.70 2jx3 s THR 42 Cb -1.12 -1.68 0.34 0.00 1.34 0.00 0.00 72.50 71.38 2jx3 s THR 42 CO 0.52 0.57 1.35 1.33 -0.54 0.00 0.00 174.62 177.85 2jx3 n VAL 43 N 2.62 -0.36 -0.05 2.29 0.24 -1.26 0.27 118.33 122.08 2jx3 n VAL 43 Ca -0.16 1.83 -0.14 0.00 -2.04 0.00 0.00 64.34 63.83 2jx3 n VAL 43 Cb 0.51 -2.78 -0.07 0.00 -1.47 0.00 0.00 33.84 30.03 2jx3 n VAL 43 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2jx3 h SER 44 N 0.00 0.53 0.29 -1.34 0.87 -1.97 -2.98 113.55 108.94 2jx3 h SER 44 Ca 0.59 -0.57 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 2jx3 h SER 44 Cb 1.37 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2jx3 h SER 44 CO -0.76 1.00 -0.14 -1.28 -0.53 0.00 0.00 176.83 175.12 2jx3 h SER 45 N 0.08 -0.33 -0.48 6.23 0.87 0.36 -2.31 113.55 117.96 2jx3 h SER 45 Ca -0.00 -0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.56 2jx3 h SER 45 Cb 0.92 0.09 -0.06 0.00 -0.44 0.00 0.00 62.40 62.91 2jx3 h SER 45 CO 0.07 0.13 -0.28 0.18 -0.53 0.00 0.00 176.83 176.40 2jx3 n LEU 46 N -5.04 -0.51 0.00 2.23 4.77 0.77 0.15 117.00 119.37 2jx3 n LEU 46 Ca -0.06 0.97 0.00 0.00 -0.03 0.00 0.00 56.01 56.90 2jx3 n LEU 46 Cb 0.18 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2jx3 n LEU 46 CO 0.14 -0.76 0.22 0.29 -1.33 0.00 0.00 177.39 175.96 2jx3 n LYS 47 N -4.33 0.00 0.04 3.23 5.02 -1.13 -2.64 118.16 118.35 2jx3 n LYS 47 Ca 0.01 0.33 -0.06 0.00 -2.02 0.00 0.00 58.31 56.58 2jx3 n LYS 47 Cb 0.13 -1.10 -0.04 0.00 -0.02 0.00 0.00 35.03 34.00 2jx3 n LYS 47 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2jx3 h LYS 48 N 0.00 -0.26 -0.89 1.97 1.63 -1.10 -2.54 116.57 115.38 2jx3 h LYS 48 Ca 0.00 0.02 0.08 0.00 -0.85 0.00 0.00 60.65 59.90 2jx3 h LYS 48 Cb 0.00 0.06 -0.11 0.00 -0.60 0.00 0.00 32.23 31.58 2jx3 h LYS 48 CO 0.00 -0.17 -0.54 -0.97 -3.45 0.00 0.00 179.45 174.32 2jx3 h ASN 49 N -0.27 -1.97 -1.31 4.20 -1.24 0.12 1.49 115.58 116.61 2jx3 h ASN 49 Ca -0.00 0.30 0.39 0.00 0.71 0.00 0.00 56.30 57.70 2jx3 h ASN 49 Cb 0.27 0.87 -0.10 0.00 0.73 0.00 0.00 38.32 40.09 2jx3 h ASN 49 CO -0.10 -0.22 0.88 0.58 -1.29 0.00 0.00 177.43 177.28 2jx3 h VAL 50 N -0.01 0.27 -0.36 2.57 2.07 -1.33 1.64 116.25 121.09 2jx3 h VAL 50 Ca 0.14 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.62 2jx3 h VAL 50 Cb 0.38 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2jx3 h VAL 50 CO -0.84 0.02 0.00 0.61 0.02 0.00 0.00 177.57 177.38 2jx3 n GLY 51 N -1.62 3.64 2.67 2.17 0.00 0.44 -4.70 105.19 107.80 2jx3 n GLY 51 Ca 0.33 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 2jx3 n GLY 51 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jx3 n GLN 52 N -0.09 0.70 -0.09 1.61 1.13 0.56 0.26 117.38 121.47 2jx3 n GLN 52 Ca 0.22 -2.02 -0.09 0.00 -1.94 0.00 0.00 57.00 53.18 2jx3 n GLN 52 Cb 0.92 -1.45 -0.03 0.00 0.11 0.00 0.00 30.24 29.80 2jx3 n GLN 52 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2jx3 n PHE 53 N 1.91 0.28 0.00 1.08 7.35 -1.16 -4.47 117.46 122.46 2jx3 n PHE 53 Ca 0.13 0.12 0.00 0.00 -0.76 0.00 0.00 57.45 56.94 2jx3 n PHE 53 Cb 0.60 -0.60 0.00 0.00 0.35 0.00 0.00 39.48 39.83 2jx3 n PHE 53 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2jx3 n SER 54 N -4.50 0.00 -2.70 -2.13 2.88 -1.26 -4.84 113.62 101.07 2jx3 n SER 54 Ca -0.13 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.32 2jx3 n SER 54 Cb 0.46 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.00 2jx3 n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jx3 n GLY 55 N 0.00 1.43 0.37 0.46 0.00 -1.26 -4.46 105.19 101.72 2jx3 n GLY 55 Ca 0.00 -0.59 0.01 0.00 0.00 0.00 0.00 46.02 45.45 2jx3 n GLY 55 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jx3 n PHE 56 N -0.34 0.14 -0.73 1.61 3.01 -1.26 -0.56 117.46 119.33 2jx3 n PHE 56 Ca 0.02 1.20 -0.09 0.00 1.01 0.00 0.00 57.45 59.60 2jx3 n PHE 56 Cb 0.83 -0.93 -0.12 0.00 -0.01 0.00 0.00 39.48 39.24 2jx3 n PHE 56 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2jx3 n PRO 57 N -5.49 1.46 0.00 -1.08 -0.04 -1.26 -3.52 135.00 125.08 2jx3 n PRO 57 Ca 0.12 -0.71 0.00 0.00 -0.04 0.00 0.00 63.50 62.87 2jx3 n PRO 57 Cb 0.42 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 2jx3 n PRO 57 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2jx3 n PHE 58 N 2.58 0.00 -4.24 0.54 -1.74 0.28 -4.88 117.46 110.00 2jx3 n PHE 58 Ca 0.31 0.00 -0.29 0.00 -0.56 0.00 0.00 57.45 56.90 2jx3 n PHE 58 Cb 0.67 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.64 2jx3 n PHE 58 CO 0.00 0.00 0.00 -1.21 -0.56 0.00 0.00 176.76 174.99 2jx3 s GLU 59 N 3.21 2.23 0.00 3.97 2.02 -1.26 -4.80 118.70 124.08 2jx3 s GLU 59 Ca 0.00 -2.20 0.00 0.00 0.02 0.00 0.00 54.97 52.79 2jx3 s GLU 59 Cb 0.00 -1.87 0.00 0.00 0.10 0.00 0.00 34.13 32.36 2jx3 s GLU 59 CO 0.00 -0.55 0.00 0.36 0.02 0.00 0.00 175.26 175.09 2jx3 n LYS 60 N -1.59 1.00 -1.15 1.61 2.85 -1.26 -4.83 118.16 114.78 2jx3 n LYS 60 Ca -0.09 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.10 2jx3 n LYS 60 Cb 0.65 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 35.00 2jx3 n LYS 60 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2jx3 n GLY 61 N 1.38 0.68 3.67 2.58 0.00 -1.26 -4.92 105.19 107.32 2jx3 n GLY 61 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2jx3 n GLY 61 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jx3 s SER 62 N -2.13 4.77 0.29 1.61 0.15 -1.26 -4.97 113.70 112.16 2jx3 s SER 62 Ca 0.00 -0.45 0.01 0.00 0.70 0.00 0.00 55.95 56.21 2jx3 s SER 62 Cb 0.00 -1.00 0.69 0.00 -1.71 0.00 0.00 66.02 63.99 2jx3 s SER 62 CO 0.00 0.06 1.62 -0.37 1.20 0.00 0.00 173.24 175.75 2jx3 h VAL 63 N 2.25 0.23 -0.67 4.45 -1.51 -2.01 0.72 116.25 119.71 2jx3 h VAL 63 Ca -0.46 -0.04 -0.03 0.00 -1.23 0.00 0.00 66.70 64.93 2jx3 h VAL 63 Cb 1.22 0.09 -0.03 0.00 -2.13 0.00 0.00 31.29 30.44 2jx3 h VAL 63 CO 0.59 0.02 0.30 0.06 -1.23 0.00 0.00 177.57 177.31 2jx3 h GLN 64 N 0.13 0.97 0.68 5.19 3.07 -1.98 -2.66 115.11 120.51 2jx3 h GLN 64 Ca 0.55 -0.14 -0.03 0.00 0.09 0.00 0.00 58.65 59.11 2jx3 h GLN 64 Cb 1.10 -0.17 0.00 0.00 0.08 0.00 0.00 27.48 28.49 2jx3 h GLN 64 CO -0.73 0.77 -0.37 -0.92 0.09 0.00 0.00 178.83 177.66 2jx3 h TYR 65 N 0.96 -0.98 -0.67 0.06 3.20 0.12 -2.16 116.97 117.50 2jx3 h TYR 65 Ca 0.23 -0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.23 2jx3 h TYR 65 Cb 0.14 0.34 -0.11 0.00 1.54 0.00 0.00 36.73 38.64 2jx3 h TYR 65 CO 0.01 -0.58 0.03 0.87 -1.64 0.00 0.00 178.16 176.84 2jx3 h LYS 66 N -0.98 0.13 -0.15 1.82 1.57 -1.30 -1.01 116.57 116.65 2jx3 h LYS 66 Ca -0.09 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2jx3 h LYS 66 Cb 0.77 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.99 2jx3 h LYS 66 CO 0.12 0.09 -0.52 0.87 -0.57 0.00 0.00 179.45 179.43 2jx3 h LYS 67 N 0.13 -0.52 -0.69 3.15 6.56 -1.11 -1.51 116.57 122.58 2jx3 h LYS 67 Ca 0.36 0.04 0.11 0.00 -1.06 0.00 0.00 60.65 60.10 2jx3 h LYS 67 Cb 0.60 0.12 -0.12 0.00 -0.57 0.00 0.00 32.23 32.26 2jx3 h LYS 67 CO -0.56 -0.35 -0.39 0.87 -2.06 0.00 0.00 179.45 176.95 2jx3 h LYS 68 N -0.54 -0.14 -0.96 3.15 1.57 -0.56 0.21 116.57 119.30 2jx3 h LYS 68 Ca 0.03 0.01 0.33 0.00 -1.87 0.00 0.00 60.65 59.15 2jx3 h LYS 68 Cb 0.64 0.03 -0.18 0.00 0.08 0.00 0.00 32.23 32.81 2jx3 h LYS 68 CO -0.43 -0.09 0.27 -1.91 -0.57 0.00 0.00 179.45 176.72 2jx3 n GLU 69 N -5.43 -0.07 0.05 3.15 2.13 -0.58 0.78 120.64 120.67 2jx3 n GLU 69 Ca 0.04 1.38 -0.03 0.00 0.66 0.00 0.00 57.16 59.21 2jx3 n GLU 69 Cb 0.36 -2.32 -0.01 0.00 0.27 0.00 0.00 31.44 29.73 2jx3 n GLU 69 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2jx3 h GLU 70 N 0.00 -0.17 -0.91 5.31 4.39 -0.44 -2.15 114.58 120.61 2jx3 h GLU 70 Ca 0.70 0.01 0.15 0.00 0.34 0.00 0.00 59.36 60.56 2jx3 h GLU 70 Cb 1.67 0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 30.27 2jx3 h GLU 70 CO -0.82 -0.12 0.51 0.52 -1.16 0.00 0.00 179.01 177.95 2jx3 h MET 71 N -0.66 0.71 0.00 2.33 2.86 -0.90 0.52 114.93 119.78 2jx3 h MET 71 Ca -0.02 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 2jx3 h MET 71 Cb 0.14 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 2jx3 h MET 71 CO 0.03 0.47 -0.12 -0.07 1.06 0.00 0.00 176.91 178.28 2jx3 h LEU 72 N 0.73 0.00 0.64 1.22 3.38 0.25 -2.83 115.31 118.70 2jx3 h LEU 72 Ca 0.49 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.43 2jx3 h LEU 72 Cb 0.66 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.41 2jx3 h LEU 72 CO -0.34 0.12 -0.31 0.50 0.09 0.00 0.00 178.44 178.50 2jx3 h LYS 73 N 0.00 -0.83 -0.48 1.13 3.64 0.75 2.49 116.57 123.27 2jx3 h LYS 73 Ca -0.00 0.06 0.09 0.00 -1.27 0.00 0.00 60.65 59.53 2jx3 h LYS 73 Cb 0.53 0.19 -0.08 0.00 -0.41 0.00 0.00 32.23 32.45 2jx3 h LYS 73 CO 0.02 -0.55 -0.06 0.87 -2.27 0.00 0.00 179.45 177.45 2jx3 h LYS 74 N -0.94 0.05 0.00 1.90 1.79 -1.52 0.90 116.57 118.75 2jx3 h LYS 74 Ca -0.09 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 2jx3 h LYS 74 Cb 0.66 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.30 2jx3 h LYS 74 CO 0.14 0.03 0.00 0.74 -1.08 0.00 0.00 179.45 179.29 2jx3 h PHE 75 N 0.05 0.00 -0.33 -1.35 0.04 -1.38 -2.85 116.94 111.12 2jx3 h PHE 75 Ca 0.24 0.00 0.05 0.00 2.80 0.00 0.00 57.97 61.06 2jx3 h PHE 75 Cb 0.36 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.46 2jx3 h PHE 75 CO -0.36 0.00 0.06 0.07 -0.60 0.00 0.00 178.31 177.48 2jx3 h ARG 76 N 0.00 0.16 0.00 1.51 0.11 1.20 2.11 114.38 119.47 2jx3 h ARG 76 Ca 0.00 -0.01 -0.00 0.00 0.10 0.00 0.00 59.98 60.07 2jx3 h ARG 76 Cb 0.38 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.42 2jx3 h ARG 76 CO 0.00 0.11 -0.00 -0.91 0.10 0.00 0.00 179.97 179.27 2jx3 h ASN 77 N 0.17 -0.00 0.01 0.08 -0.26 -1.36 -2.87 115.58 111.34 2jx3 h ASN 77 Ca 0.16 -0.54 -0.00 0.00 -0.56 0.00 0.00 56.30 55.36 2jx3 h ASN 77 Cb 0.18 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.44 2jx3 h ASN 77 CO -0.21 0.54 -0.00 0.00 -1.06 0.00 0.00 177.43 176.69 2jx3 h ALA 78 N 0.46 -0.14 -0.83 -0.83 0.00 -1.37 -3.02 119.26 113.53 2jx3 h ALA 78 Ca -0.00 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.01 2jx3 h ALA 78 Cb 0.54 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.21 2jx3 h ALA 78 CO 0.00 -0.14 -0.48 1.98 0.00 0.00 0.00 179.25 180.61 2jx3 h MET 79 N -0.04 -0.09 -0.82 0.00 1.85 0.32 0.47 114.93 116.62 2jx3 h MET 79 Ca -0.00 0.01 0.14 0.00 -0.61 0.00 0.00 59.70 59.24 2jx3 h MET 79 Cb 0.01 0.02 -0.09 0.00 0.43 0.00 0.00 31.60 31.96 2jx3 h MET 79 CO 0.00 -0.06 0.39 -0.07 -0.40 0.00 0.00 176.91 176.77 2jx3 h LEU 80 N -0.09 0.45 -0.77 3.39 3.38 -1.07 1.12 115.31 121.72 2jx3 h LEU 80 Ca 0.21 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.35 2jx3 h LEU 80 Cb 0.52 0.03 -0.11 0.00 0.09 0.00 0.00 40.66 41.20 2jx3 h LEU 80 CO -0.86 0.18 -0.58 0.50 0.09 0.00 0.00 178.44 177.78 2jx3 h LYS 81 N 0.57 -0.15 0.07 1.13 1.63 0.09 0.96 116.57 120.85 2jx3 h LYS 81 Ca 0.45 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.25 2jx3 h LYS 81 Cb 0.64 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.31 2jx3 h LYS 81 CO -0.37 -0.10 -0.03 0.77 -3.45 0.00 0.00 179.45 176.26 2jx3 h SER 82 N -0.16 -0.08 -0.07 4.20 0.02 -1.06 -2.93 113.55 113.47 2jx3 h SER 82 Ca 0.13 -0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2jx3 h SER 82 Cb 0.48 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 2jx3 h SER 82 CO -0.81 0.43 -0.15 0.40 -1.14 0.00 0.00 176.83 175.56 2jx3 h ILE 83 N -1.02 0.00 -0.94 3.27 5.03 0.14 0.64 117.51 124.62 2jx3 h ILE 83 Ca -0.01 0.00 0.29 0.00 -0.12 0.00 0.00 64.86 65.02 2jx3 h ILE 83 Cb 0.10 0.00 -0.16 0.00 -3.03 0.00 0.00 36.82 33.73 2jx3 h ILE 83 CO 0.02 0.00 0.31 0.00 -0.68 0.00 0.00 178.15 177.80 2jx3 h GLU 85 N 0.16 0.00 -0.83 0.00 4.22 -0.68 -3.12 114.58 114.33 2jx3 h GLU 85 Ca 0.65 0.00 -0.35 0.00 0.08 0.00 0.00 59.36 59.74 2jx3 h GLU 85 Cb 1.43 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.43 2jx3 h GLU 85 CO -0.71 0.00 -0.75 0.28 -2.18 0.00 0.00 179.01 175.64 2jx3 n VAL 86 N -3.83 -0.13 -2.68 0.32 0.31 0.71 -4.96 118.33 108.06 2jx3 n VAL 86 Ca 0.13 -2.73 -0.08 0.00 -0.01 0.00 0.00 64.34 61.66 2jx3 n VAL 86 Cb 0.86 0.59 0.07 0.00 -0.91 0.00 0.00 33.84 34.45 2jx3 n VAL 86 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2jx3 n LEU 87 N 0.63 0.16 -2.51 7.52 7.94 -0.04 -4.47 117.00 126.22 2jx3 n LEU 87 Ca 0.14 -3.59 -0.19 0.00 -1.11 0.00 0.00 56.01 51.25 2jx3 n LEU 87 Cb 0.66 0.27 0.02 0.00 0.53 0.00 0.00 43.42 44.90 2jx3 n LEU 87 CO 0.11 1.67 -0.08 -0.67 -1.11 0.00 0.00 177.39 177.31 2jx3 n ASP 88 N -0.30 -5.57 -3.07 1.96 2.03 -1.26 -4.88 116.55 105.46 2jx3 n ASP 88 Ca 0.04 -0.18 -0.16 0.00 0.52 0.00 0.00 54.79 55.02 2jx3 n ASP 88 Cb 0.83 -4.47 -0.04 0.00 -0.72 0.00 0.00 41.12 36.72 2jx3 n ASP 88 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2jx3 n LEU 89 N -3.30 0.00 -0.28 -2.67 4.77 -1.26 -4.99 117.00 109.26 2jx3 n LEU 89 Ca -0.14 -2.96 0.00 0.00 -0.03 0.00 0.00 56.01 52.88 2jx3 n LEU 89 Cb 0.63 2.40 0.01 0.00 -2.33 0.00 0.00 43.42 44.12 2jx3 n LEU 89 CO 0.37 -0.64 0.27 1.21 -1.33 0.00 0.00 177.39 177.27 2jx3 n GLU 90 N -0.60 0.14 -1.99 3.23 2.13 -1.26 -4.78 120.64 117.51 2jx3 n GLU 90 Ca 0.02 -0.90 -0.01 0.00 0.66 0.00 0.00 57.16 56.93 2jx3 n GLU 90 Cb 0.60 -0.56 -0.01 0.00 0.27 0.00 0.00 31.44 31.74 2jx3 n GLU 90 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2jx3 n ARG 91 N -0.08 -3.42 -3.41 5.31 0.00 -1.26 -5.01 116.66 108.79 2jx3 n ARG 91 Ca 0.01 2.66 0.02 0.00 -0.00 0.00 0.00 57.85 60.54 2jx3 n ARG 91 Cb 0.61 -3.46 -0.05 0.00 0.00 0.00 0.00 32.46 29.56 2jx3 n ARG 91 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2jx3 s SER 92 N -0.42 -0.21 0.00 6.15 0.01 -1.26 -5.16 113.70 112.81 2jx3 s SER 92 Ca -0.05 0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.52 2jx3 s SER 92 Cb 0.00 1.18 0.00 0.00 0.21 0.00 0.00 66.02 67.42 2jx3 s SER 92 CO 0.14 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.35 2jx3 n GLY 93 N 4.10 1.46 3.88 3.44 0.00 -1.26 -4.95 105.19 111.85 2jx3 n GLY 93 Ca -0.11 -1.96 -0.21 0.00 0.00 0.00 0.00 46.02 43.74 2jx3 n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jx3 s VAL 94 N -1.21 2.83 0.09 1.61 1.01 -1.26 -4.88 120.40 118.59 2jx3 s VAL 94 Ca 0.00 -1.33 -0.20 0.00 0.00 0.00 0.00 61.98 60.45 2jx3 s VAL 94 Cb 0.00 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.30 2jx3 s VAL 94 CO 0.00 -0.03 1.33 0.78 0.00 0.00 0.00 175.10 177.18 2jx3 h ASN 95 N 1.05 -1.28 -1.02 3.32 4.21 -2.00 0.88 115.58 120.75 2jx3 h ASN 95 Ca -0.42 0.19 0.26 0.00 1.21 0.00 0.00 56.30 57.53 2jx3 h ASN 95 Cb 1.26 0.55 -0.08 0.00 -1.12 0.00 0.00 38.32 38.93 2jx3 h ASN 95 CO 0.57 -0.18 0.66 0.28 -1.29 0.00 0.00 177.43 177.48 2jx3 h SER 96 N -0.08 0.41 0.93 5.81 0.02 -2.01 0.71 113.55 119.33 2jx3 h SER 96 Ca 0.08 0.07 -0.09 0.00 -0.84 0.00 0.00 61.79 61.01 2jx3 h SER 96 Cb 0.29 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2jx3 h SER 96 CO -0.51 0.10 -0.43 -0.08 -1.14 0.00 0.00 176.83 174.77 2jx3 h GLU 97 N 0.37 0.00 0.41 3.45 4.81 0.17 -2.84 114.58 120.95 2jx3 h GLU 97 Ca 0.56 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.77 2jx3 h GLU 97 Cb 1.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.86 2jx3 h GLU 97 CO -0.25 0.43 -0.20 -0.07 -0.73 0.00 0.00 179.01 178.19 2jx3 h LEU 98 N 0.00 -0.47 0.66 1.64 3.38 0.46 -0.92 115.31 120.07 2jx3 h LEU 98 Ca -0.00 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2jx3 h LEU 98 Cb 1.01 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2jx3 h LEU 98 CO 0.06 -0.17 -0.46 0.58 0.09 0.00 0.00 178.44 178.53 2jx3 h VAL 99 N -0.78 0.00 -1.12 1.22 2.07 -1.53 0.02 116.25 116.13 2jx3 h VAL 99 Ca -0.06 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.79 2jx3 h VAL 99 Cb 0.53 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 2jx3 h VAL 99 CO 0.09 0.00 0.94 0.50 0.02 0.00 0.00 177.57 179.12 2jx3 h LYS 100 N -1.07 0.00 -0.68 1.57 3.64 -1.54 0.73 116.57 119.22 2jx3 h LYS 100 Ca -0.09 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 2jx3 h LYS 100 Cb 0.88 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.67 2jx3 h LYS 100 CO 0.05 0.00 0.30 -0.09 -2.27 0.00 0.00 179.45 177.43 2jx3 h ARG 101 N 0.00 1.00 -0.04 1.90 9.65 0.48 -1.32 114.38 126.06 2jx3 h ARG 101 Ca 0.53 -0.17 -0.12 0.00 -1.10 0.00 0.00 59.98 59.12 2jx3 h ARG 101 Cb 2.40 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 30.80 2jx3 h ARG 101 CO -0.01 0.81 -0.54 -0.84 2.80 0.00 0.00 179.97 182.20 2jx3 h ILE 102 N 0.95 1.38 0.00 1.20 -0.00 0.68 0.61 117.51 122.34 2jx3 h ILE 102 Ca 0.23 -1.85 -0.05 0.00 -0.00 0.00 0.00 64.86 63.19 2jx3 h ILE 102 Cb 0.17 1.96 -0.01 0.00 -0.00 0.00 0.00 36.82 38.94 2jx3 h ILE 102 CO -0.02 0.54 -0.22 -0.07 -0.00 0.00 0.00 178.15 178.37 2jx3 h LEU 103 N 0.08 0.00 0.00 0.16 3.38 -1.07 0.63 115.31 118.49 2jx3 h LEU 103 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2jx3 h LEU 103 Cb 0.98 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 2jx3 h LEU 103 CO 0.08 0.22 -1.88 0.59 0.09 0.00 0.00 178.44 177.54 2jx3 n ASN 104 N -3.38 0.63 -0.00 -0.43 3.02 -0.55 -4.23 115.26 110.32 2jx3 n ASN 104 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.54 2jx3 n ASN 104 Cb 0.43 1.85 -0.00 0.00 -0.61 0.00 0.00 39.78 41.45 2jx3 n ASN 104 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2jx3 n PHE 105 N -2.18 0.00 -0.26 3.10 -0.00 0.21 -3.88 117.46 114.46 2jx3 n PHE 105 Ca -0.04 0.00 0.16 0.00 -0.00 0.00 0.00 57.45 57.57 2jx3 n PHE 105 Cb 0.51 -0.07 0.44 0.00 -0.00 0.00 0.00 39.48 40.37 2jx3 n PHE 105 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 2jx3 h LEU 106 N -0.14 0.53 0.00 -2.13 -0.00 -0.90 0.96 115.31 113.63 2jx3 h LEU 106 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 2jx3 h LEU 106 Cb 0.14 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 40.75 2jx3 h LEU 106 CO 0.00 0.23 -0.23 0.80 -0.00 0.00 0.00 178.44 179.24 2jx3 n MET 107 N -4.56 0.25 -2.73 1.13 1.56 0.19 -4.05 117.12 108.92 2jx3 n MET 107 Ca 0.19 0.15 -0.01 0.00 -0.27 0.00 0.00 57.70 57.76 2jx3 n MET 107 Cb 0.60 -1.74 0.02 0.00 2.15 0.00 0.00 33.22 34.25 2jx3 n MET 107 CO 0.00 0.00 0.00 -1.01 -0.73 0.00 0.00 175.97 174.23 2jx3 s HIS 108 N -3.11 -0.42 0.00 1.12 3.76 0.27 -2.87 115.29 114.03 2jx3 s HIS 108 Ca 0.09 -0.05 0.00 0.00 -0.15 0.00 0.00 55.06 54.95 2jx3 s HIS 108 Cb 0.13 0.08 0.00 0.00 1.11 0.00 0.00 32.58 33.90 2jx3 s HIS 108 CO 0.64 -0.31 0.00 -0.35 -0.85 0.00 0.00 174.74 173.87 2jx3 n PRO 109 N 3.12 0.00 -0.58 8.40 -0.04 0.22 -3.94 135.00 142.17 2jx3 n PRO 109 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 2jx3 n PRO 109 Cb 0.64 -0.17 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 2jx3 n PRO 109 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09