#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jqt s THR 2 N 0.00 0.83 0.23 2.03 -4.23 -1.26 -5.12 115.64 108.12 2jqt s THR 2 Ca 0.00 -2.95 0.05 0.00 -1.18 0.00 0.00 61.69 57.61 2jqt s THR 2 Cb 0.00 -1.57 -0.03 0.00 1.34 0.00 0.00 72.50 72.24 2jqt s THR 2 CO 0.00 -1.19 0.29 0.68 -0.54 0.00 0.00 174.62 173.86 2jqt s VAL 3 N -0.22 4.97 0.89 2.29 -7.23 -1.26 -5.11 120.40 114.73 2jqt s VAL 3 Ca 0.31 -1.10 -0.12 0.00 -1.81 0.00 0.00 61.98 59.26 2jqt s VAL 3 Cb 0.02 -3.68 0.13 0.00 0.56 0.00 0.00 36.38 33.41 2jqt s VAL 3 CO -0.19 -0.31 1.13 0.00 -0.31 0.00 0.00 175.10 175.42 2jqt s GLN 4 N -3.84 1.30 -0.64 4.82 -2.07 -1.26 -5.01 119.66 112.96 2jqt s GLN 4 Ca 0.34 0.38 -0.12 0.00 -1.82 0.00 0.00 55.36 54.14 2jqt s GLN 4 Cb -0.09 -1.85 0.16 0.00 -1.09 0.00 0.00 33.01 30.15 2jqt s GLN 4 CO 0.27 -2.11 0.55 -0.51 -1.32 0.00 0.00 175.29 172.17 2jqt s ASP 5 N -3.96 6.13 0.52 12.60 1.01 -1.26 -4.91 116.67 126.80 2jqt s ASP 5 Ca 0.63 -2.30 0.17 0.00 0.71 0.00 0.00 52.55 51.76 2jqt s ASP 5 Cb -0.15 -2.11 1.28 0.00 1.01 0.00 0.00 42.92 42.95 2jqt s ASP 5 CO 0.54 -0.64 2.14 1.88 0.21 0.00 0.00 175.17 179.29 2jqt h TYR 6 N 8.11 0.00 -0.22 4.23 0.05 -2.02 -1.48 116.97 125.64 2jqt h TYR 6 Ca -0.09 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.72 2jqt h TYR 6 Cb 1.05 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.78 2jqt h TYR 6 CO 0.81 0.02 0.15 1.37 -1.05 0.00 0.00 178.16 179.47 2jqt h LEU 7 N 0.00 0.13 -0.83 3.88 8.10 -1.96 -1.55 115.31 123.08 2jqt h LEU 7 Ca -0.00 -0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.97 2jqt h LEU 7 Cb 0.04 -0.03 -0.04 0.00 -0.44 0.00 0.00 40.66 40.19 2jqt h LEU 7 CO 0.00 0.09 0.43 0.25 -4.11 0.00 0.00 178.44 175.10 2jqt h LEU 8 N 0.15 1.06 -0.68 0.17 5.85 -1.69 -1.18 115.31 118.99 2jqt h LEU 8 Ca 0.10 -0.12 -0.14 0.00 0.84 0.00 0.00 57.88 58.56 2jqt h LEU 8 Cb 0.20 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2jqt h LEU 8 CO -0.02 0.87 -0.56 0.11 -0.34 0.00 0.00 178.44 178.50 2jqt h LYS 9 N 1.16 0.28 -0.14 1.25 6.56 -1.41 -3.07 116.57 121.20 2jqt h LYS 9 Ca 0.29 -0.18 -0.03 0.00 -1.06 0.00 0.00 60.65 59.67 2jqt h LYS 9 Cb 0.07 0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 31.75 2jqt h LYS 9 CO -0.04 0.77 -0.03 0.35 -2.06 0.00 0.00 179.45 178.43 2jqt h PHE 10 N 0.21 0.30 -0.09 -1.35 3.04 -1.01 -2.88 116.94 115.16 2jqt h PHE 10 Ca -0.00 -0.06 0.03 0.00 3.98 0.00 0.00 57.97 61.91 2jqt h PHE 10 Cb 1.06 -0.07 -0.00 0.00 2.56 0.00 0.00 35.95 39.49 2jqt h PHE 10 CO 0.02 0.56 0.09 0.07 -2.02 0.00 0.00 178.31 177.02 2jqt h ARG 11 N -0.04 0.00 0.00 1.11 0.11 -1.24 -0.14 114.38 114.18 2jqt h ARG 11 Ca 0.03 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.06 2jqt h ARG 11 Cb 0.46 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.53 2jqt h ARG 11 CO 0.01 0.00 -0.26 -0.22 0.10 0.00 0.00 179.97 179.61 2jqt h LYS 12 N 0.00 0.00 -6.79 0.08 3.64 -1.41 -3.43 116.57 108.66 2jqt h LYS 12 Ca 0.04 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.90 2jqt h LYS 12 Cb 0.21 0.00 0.05 0.00 -0.41 0.00 0.00 32.23 32.08 2jqt h LYS 12 CO -0.00 0.26 0.62 0.42 -2.27 0.00 0.00 179.45 178.48 2jqt s ILE 13 N -4.17 3.02 -0.09 2.00 1.01 -0.07 -4.94 121.20 117.97 2jqt s ILE 13 Ca -0.03 0.95 0.06 0.00 0.00 0.00 0.00 60.65 61.63 2jqt s ILE 13 Cb 0.14 -3.60 -0.09 0.00 0.01 0.00 0.00 42.46 38.91 2jqt s ILE 13 CO 0.67 0.20 0.00 -0.24 0.00 0.00 0.00 174.94 175.56 2jqt n SER 14 N 1.55 3.02 -4.77 3.58 2.88 -1.26 -5.00 113.62 113.62 2jqt n SER 14 Ca 0.02 -0.01 -0.39 0.00 -1.33 0.00 0.00 58.87 57.16 2jqt n SER 14 Cb 0.43 0.50 -0.06 0.00 -0.75 0.00 0.00 64.21 64.33 2jqt n SER 14 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2jqt s SER 15 N -4.25 7.18 0.42 -3.46 0.01 -1.26 -4.96 113.70 107.38 2jqt s SER 15 Ca -0.06 1.40 0.20 0.00 1.31 0.00 0.00 55.95 58.79 2jqt s SER 15 Cb 0.03 -2.43 0.94 0.00 0.21 0.00 0.00 66.02 64.76 2jqt s SER 15 CO 0.32 0.14 1.87 -0.07 0.41 0.00 0.00 173.24 175.90 2jqt h LEU 16 N 5.10 0.00 -0.83 2.44 4.07 -2.02 -3.01 115.31 121.06 2jqt h LEU 16 Ca -0.46 0.00 0.07 0.00 0.08 0.00 0.00 57.88 57.57 2jqt h LEU 16 Cb 1.21 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.88 2jqt h LEU 16 CO 0.68 0.29 0.49 -0.08 -1.08 0.00 0.00 178.44 178.74 2jqt h GLU 17 N 0.00 0.85 -0.06 1.13 4.81 -2.03 -0.15 114.58 119.14 2jqt h GLU 17 Ca -0.00 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.19 2jqt h GLU 17 Cb 0.64 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 2jqt h GLU 17 CO 0.04 0.56 0.06 1.03 -0.73 0.00 0.00 179.01 179.96 2jqt h SER 18 N 0.87 0.00 -0.05 1.04 0.87 -1.95 -2.51 113.55 111.83 2jqt h SER 18 Ca 0.38 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.97 2jqt h SER 18 Cb 0.25 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 2jqt h SER 18 CO -0.20 0.00 -0.14 0.25 -0.53 0.00 0.00 176.83 176.21 2jqt h LEU 19 N 0.00 -0.41 -1.37 2.23 6.46 -1.15 0.31 115.31 121.37 2jqt h LEU 19 Ca 0.03 0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 57.81 2jqt h LEU 19 Cb 0.14 0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.24 2jqt h LEU 19 CO -0.00 -0.19 -0.06 -0.33 -0.62 0.00 0.00 178.44 177.24 2jqt h GLU 20 N -0.21 0.34 0.05 1.25 4.39 -1.53 -1.80 114.58 117.06 2jqt h GLU 20 Ca 0.06 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2jqt h GLU 20 Cb 0.29 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 2jqt h GLU 20 CO -0.17 0.42 -0.02 0.87 -1.16 0.00 0.00 179.01 178.95 2jqt h LYS 21 N 0.33 -0.06 -0.05 2.33 6.56 -1.25 -1.80 116.57 122.62 2jqt h LYS 21 Ca 0.07 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.63 2jqt h LYS 21 Cb 0.32 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 31.99 2jqt h LYS 21 CO 0.01 0.24 -0.14 1.25 -2.06 0.00 0.00 179.45 178.76 2jqt h LEU 22 N -0.36 0.07 0.38 2.94 6.46 -0.80 -1.26 115.31 122.75 2jqt h LEU 22 Ca -0.01 -0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.72 2jqt h LEU 22 Cb 0.33 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.24 2jqt h LEU 22 CO 0.01 0.22 -0.18 0.22 -0.62 0.00 0.00 178.44 178.09 2jqt h TYR 23 N 0.07 -0.48 -0.84 1.25 3.20 -1.17 -1.68 116.97 117.32 2jqt h TYR 23 Ca 0.02 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.89 2jqt h TYR 23 Cb 0.30 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 2jqt h TYR 23 CO 0.00 -0.15 0.56 -0.44 -1.64 0.00 0.00 178.16 176.49 2jqt h ASP 24 N -0.92 0.95 0.37 -2.11 3.32 -1.23 -0.13 116.42 116.67 2jqt h ASP 24 Ca -0.05 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 2jqt h ASP 24 Cb 0.54 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.86 2jqt h ASP 24 CO 0.09 0.68 -0.19 -0.74 -1.72 0.00 0.00 179.24 177.36 2jqt h HIS 25 N 1.12 -0.48 -0.29 4.55 2.76 -1.27 0.47 115.15 122.01 2jqt h HIS 25 Ca 0.32 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.46 2jqt h HIS 25 Cb -0.10 0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 2jqt h HIS 25 CO -0.02 -0.30 0.09 -0.07 -1.30 0.00 0.00 177.93 176.34 2jqt h LEU 26 N -0.51 0.37 -0.29 0.26 3.38 -1.11 -2.05 115.31 115.36 2jqt h LEU 26 Ca -0.05 -0.04 -0.20 0.00 0.09 0.00 0.00 57.88 57.69 2jqt h LEU 26 Cb 0.40 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2jqt h LEU 26 CO 0.08 0.36 -0.86 -1.13 0.09 0.00 0.00 178.44 176.98 2jqt h ASN 27 N 0.41 0.33 -0.92 -0.43 -1.24 -0.63 -3.18 115.58 109.92 2jqt h ASN 27 Ca 0.10 -0.25 -0.50 0.00 0.71 0.00 0.00 56.30 56.36 2jqt h ASN 27 Cb 0.13 -0.10 -0.28 0.00 0.73 0.00 0.00 38.32 38.79 2jqt h ASN 27 CO -0.01 1.04 0.64 -1.22 -1.29 0.00 0.00 177.43 176.59 2jqt n TYR 28 N -3.70 2.85 0.03 0.67 4.01 0.16 -3.62 117.16 117.57 2jqt n TYR 28 Ca -0.04 -1.90 0.00 0.00 -0.16 0.00 0.00 57.90 55.80 2jqt n TYR 28 Cb 0.79 -0.96 0.00 0.00 -0.31 0.00 0.00 39.34 38.86 2jqt n TYR 28 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2jqt n THR 29 N -0.98 0.49 -0.05 -0.72 -2.24 -0.84 -4.96 114.28 104.99 2jqt n THR 29 Ca 0.56 0.16 -0.05 0.00 -2.27 0.00 0.00 64.05 62.44 2jqt n THR 29 Cb 1.45 -1.10 -0.07 0.00 -2.10 0.00 0.00 70.33 68.52 2jqt n THR 29 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2jqt n LEU 30 N -2.98 0.66 -2.85 3.22 4.32 -1.23 -5.08 117.00 113.06 2jqt n LEU 30 Ca 0.00 -0.01 -0.07 0.00 -0.02 0.00 0.00 56.01 55.90 2jqt n LEU 30 Cb 0.00 0.09 0.01 0.00 -1.62 0.00 0.00 43.42 41.89 2jqt n LEU 30 CO 0.00 0.33 0.07 0.41 -1.22 0.00 0.00 177.39 176.98 2jqt n THR 31 N -2.45-11.00 -3.97 -5.08 -1.04 -1.24 -5.06 114.28 84.44 2jqt n THR 31 Ca -0.16 0.82 -0.09 0.00 -2.04 0.00 0.00 64.05 62.57 2jqt n THR 31 Cb 0.78 -7.27 -0.04 0.00 -1.82 0.00 0.00 70.33 61.98 2jqt n THR 31 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2jqt s ASP 32 N -2.62 -0.10 0.37 8.00 1.11 -1.26 -5.04 116.67 117.14 2jqt s ASP 32 Ca 0.23 -0.89 0.12 0.00 0.18 0.00 0.00 52.55 52.20 2jqt s ASP 32 Cb -0.06 0.62 0.73 0.00 1.07 0.00 0.00 42.92 45.28 2jqt s ASP 32 CO 0.76 -1.20 1.84 0.44 1.18 0.00 0.00 175.17 178.19 2jqt h ASP 33 N 2.19 0.04 -0.79 0.27 5.19 -1.99 -2.77 116.42 118.57 2jqt h ASP 33 Ca -0.25 -0.01 0.04 0.00 -0.62 0.00 0.00 57.03 56.19 2jqt h ASP 33 Cb 1.25 -0.01 -0.05 0.00 0.18 0.00 0.00 39.33 40.70 2jqt h ASP 33 CO 0.33 0.37 0.52 -0.61 -3.12 0.00 0.00 179.24 176.73 2jqt h GLN 34 N 0.03 0.92 -0.04 3.56 5.75 -1.98 0.55 115.11 123.90 2jqt h GLN 34 Ca 0.00 -0.06 -0.18 0.00 -0.15 0.00 0.00 58.65 58.27 2jqt h GLN 34 Cb 0.62 -0.21 0.01 0.00 1.07 0.00 0.00 27.48 28.97 2jqt h GLN 34 CO 0.05 0.61 -0.66 0.93 -2.65 0.00 0.00 178.83 177.10 2jqt h GLU 35 N 0.95 0.53 -0.26 1.69 4.39 -1.85 -2.24 114.58 117.78 2jqt h GLU 35 Ca 0.32 -0.51 -0.05 0.00 0.34 0.00 0.00 59.36 59.46 2jqt h GLU 35 Cb 0.07 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2jqt h GLU 35 CO -0.09 1.14 -0.02 1.25 -1.16 0.00 0.00 179.01 180.12 2jqt h LEU 36 N 0.10 0.47 -0.57 1.33 6.46 -1.25 -0.42 115.31 121.43 2jqt h LEU 36 Ca -0.07 -0.33 -0.06 0.00 -0.12 0.00 0.00 57.88 57.30 2jqt h LEU 36 Cb 1.34 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 41.12 2jqt h LEU 36 CO 0.13 0.69 0.12 -0.29 -0.62 0.00 0.00 178.44 178.47 2jqt h ILE 37 N 0.24 1.25 -0.23 4.05 2.10 0.00 -0.36 117.51 124.56 2jqt h ILE 37 Ca 0.07 -0.92 -0.05 0.00 1.08 0.00 0.00 64.86 65.04 2jqt h ILE 37 Cb 0.46 0.75 -0.01 0.00 -1.09 0.00 0.00 36.82 36.93 2jqt h ILE 37 CO 0.02 0.34 -0.04 0.78 -1.08 0.00 0.00 178.15 178.16 2jqt h ASN 38 N 0.83 0.44 -0.48 2.19 4.21 -1.36 -1.29 115.58 120.11 2jqt h ASN 38 Ca 0.18 -0.35 -0.03 0.00 1.21 0.00 0.00 56.30 57.31 2jqt h ASN 38 Cb 0.37 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.43 2jqt h ASN 38 CO 0.00 0.69 0.19 -0.03 -1.29 0.00 0.00 177.43 177.00 2jqt h MET 39 N 0.18 0.72 -0.47 0.81 4.05 -1.00 -1.61 114.93 117.61 2jqt h MET 39 Ca 0.06 -0.13 -0.03 0.00 -0.28 0.00 0.00 59.70 59.32 2jqt h MET 39 Cb 0.49 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 31.15 2jqt h MET 39 CO 0.02 0.64 0.19 1.88 0.23 0.00 0.00 176.91 179.87 2jqt h TYR 40 N 0.64 0.72 -0.06 1.39 0.05 -1.03 0.82 116.97 119.50 2jqt h TYR 40 Ca 0.16 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.89 2jqt h TYR 40 Cb 0.19 -0.22 -0.00 0.00 1.01 0.00 0.00 36.73 37.71 2jqt h TYR 40 CO 0.00 0.61 0.04 0.00 -1.05 0.00 0.00 178.16 177.76 2jqt h ARG 41 N 0.62 0.08 -0.14 4.88 3.08 -1.07 0.29 114.38 122.12 2jqt h ARG 41 Ca 0.16 -0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.08 2jqt h ARG 41 Cb 0.20 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2jqt h ARG 41 CO -0.01 0.06 -0.38 0.00 -1.07 0.00 0.00 179.97 178.56 2jqt h ALA 42 N 1.01 0.23 0.07 0.04 0.00 -1.19 -2.23 119.26 117.19 2jqt h ALA 42 Ca 0.02 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2jqt h ALA 42 Cb -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2jqt h ALA 42 CO -0.00 0.32 -0.04 0.00 0.00 0.00 0.00 179.25 179.53 2jqt h ALA 43 N 0.52 -0.10 -0.30 0.00 0.00 0.75 0.13 119.26 120.26 2jqt h ALA 43 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2jqt h ALA 43 Cb 1.00 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2jqt h ALA 43 CO 0.08 -0.56 0.20 -0.44 0.00 0.00 0.00 179.25 178.53 2jqt h ASP 44 N -0.11 0.35 -0.26 0.00 3.32 -0.50 0.34 116.42 119.56 2jqt h ASP 44 Ca -0.01 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 2jqt h ASP 44 Cb 0.09 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2jqt h ASP 44 CO 0.01 0.26 0.16 0.45 -1.72 0.00 0.00 179.24 178.41 2jqt h HIS 45 N 0.41 0.34 -0.03 4.55 3.86 -1.24 0.25 115.15 123.29 2jqt h HIS 45 Ca 0.11 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.32 2jqt h HIS 45 Cb -0.04 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.32 2jqt h HIS 45 CO -0.05 0.25 0.01 -0.09 0.86 0.00 0.00 177.93 178.90 2jqt h ARG 46 N 0.34 0.06 -0.78 2.45 9.65 -0.52 -2.07 114.38 123.50 2jqt h ARG 46 Ca 0.10 -0.01 0.01 0.00 -1.10 0.00 0.00 59.98 58.97 2jqt h ARG 46 Cb -0.00 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.53 2jqt h ARG 46 CO -0.02 0.29 0.52 0.00 2.80 0.00 0.00 179.97 183.56 2jqt h ARG 47 N -0.19 1.03 -0.90 0.20 2.47 -0.23 0.19 114.38 116.95 2jqt h ARG 47 Ca 0.01 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.67 2jqt h ARG 47 Cb 0.26 -0.23 -0.04 0.00 -1.65 0.00 0.00 29.97 28.31 2jqt h ARG 47 CO 0.00 0.68 0.59 0.00 0.56 0.00 0.00 179.97 181.80 2jqt h ALA 48 N 1.29 1.15 -0.01 0.04 0.00 -0.41 0.60 119.26 121.91 2jqt h ALA 48 Ca 0.29 -0.07 -0.20 0.00 0.00 0.00 0.00 54.91 54.92 2jqt h ALA 48 Cb -0.12 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.30 2jqt h ALA 48 CO -0.06 0.56 -0.87 0.93 0.00 0.00 0.00 179.25 179.81 2jqt h GLU 49 N 1.23 0.29 -0.08 0.00 5.08 -0.84 -1.45 114.58 118.80 2jqt h GLU 49 Ca 0.33 -0.30 -0.16 0.00 -1.00 0.00 0.00 59.36 58.24 2jqt h GLU 49 Cb -0.12 0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.22 2jqt h GLU 49 CO -0.07 0.99 -0.56 -0.07 -1.00 0.00 0.00 179.01 178.31 2jqt h LEU 50 N 0.17 0.63 -0.73 1.33 3.38 -0.15 -3.09 115.31 116.85 2jqt h LEU 50 Ca -0.05 -0.67 -0.14 0.00 0.09 0.00 0.00 57.88 57.12 2jqt h LEU 50 Cb 1.48 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2jqt h LEU 50 CO 0.14 1.20 -0.59 1.62 0.09 0.00 0.00 178.44 180.90 2jqt h VAL 51 N 0.11 1.40 -0.15 1.22 3.04 0.13 -3.01 116.25 118.99 2jqt h VAL 51 Ca -0.05 -1.98 -0.04 0.00 -1.01 0.00 0.00 66.70 63.62 2jqt h VAL 51 Cb 1.21 2.03 -0.01 0.00 -2.01 0.00 0.00 31.29 32.51 2jqt h VAL 51 CO 0.11 0.58 -0.10 0.28 -1.01 0.00 0.00 177.57 177.43 2jqt h SER 52 N 0.11 0.22 -3.95 3.17 0.02 -1.29 -3.49 113.55 108.33 2jqt h SER 52 Ca -0.01 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2jqt h SER 52 Cb 1.07 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2jqt h SER 52 CO 0.09 0.35 0.00 0.61 -1.14 0.00 0.00 176.83 176.74 2jqt n GLY 53 N -0.95 -1.92 0.00 -3.77 0.00 -1.14 -4.98 105.19 92.43 2jqt n GLY 53 Ca -0.01 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.36 2jqt n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jqt n GLY 54 N 0.00 -1.87 3.45 -0.02 0.00 -1.26 -4.89 105.19 100.61 2jqt n GLY 54 Ca 0.00 0.84 -0.44 0.00 0.00 0.00 0.00 46.02 46.42 2jqt n GLY 54 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2jqt s ARG 55 N 0.00 3.86 0.09 1.61 1.70 -1.26 -4.40 118.95 120.55 2jqt s ARG 55 Ca 0.00 -2.21 0.00 0.00 -0.47 0.00 0.00 55.73 53.05 2jqt s ARG 55 Cb 0.00 -4.98 0.00 0.00 -0.57 0.00 0.00 34.95 29.40 2jqt s ARG 55 CO 0.00 -1.75 0.00 -0.11 -1.08 0.00 0.00 175.30 172.36 2jqt n LEU 56 N 5.99 -0.47 0.00 -1.89 0.00 -1.26 -5.36 117.00 114.01 2jqt n LEU 56 Ca 0.30 0.17 0.00 0.00 0.00 0.00 0.00 56.01 56.48 2jqt n LEU 56 Cb 0.46 0.63 0.00 0.00 0.00 0.00 0.00 43.42 44.50 2jqt n LEU 56 CO 0.56 -0.46 0.00 0.49 0.00 0.00 0.00 177.39 177.98