#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 1.94 0.69 2.03 -4.23 -1.26 -5.11 115.64 109.70 2jqt s THR 2 Ca 0.00 -1.10 -0.11 0.00 -1.18 0.00 0.00 61.69 59.30 2jqt s THR 2 Cb 0.00 -2.04 0.00 0.00 1.34 0.00 0.00 72.50 71.80 2jqt s THR 2 CO 0.00 0.00 1.06 0.68 -0.54 0.00 0.00 174.62 175.82 2jqt s VAL 3 N -2.72 4.04 0.00 2.29 -7.23 -1.26 -4.88 120.40 110.63 2jqt s VAL 3 Ca 0.56 0.68 0.00 0.00 -1.81 0.00 0.00 61.98 61.41 2jqt s VAL 3 Cb -0.05 -3.41 0.00 0.00 0.56 0.00 0.00 36.38 33.48 2jqt s VAL 3 CO 0.36 -0.85 0.00 0.00 -0.31 0.00 0.00 175.10 174.30 2jqt n GLN 4 N -3.06 0.00 -3.56 4.82 6.02 -1.26 -5.06 117.38 115.28 2jqt n GLN 4 Ca 0.08 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.66 2jqt n GLN 4 Cb 0.53 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.73 2jqt n GLN 4 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2jqt s ASP 5 N -1.04 5.94 0.57 1.08 1.11 -1.26 -4.90 116.67 118.17 2jqt s ASP 5 Ca 0.00 -2.97 0.26 0.00 0.18 0.00 0.00 52.55 50.02 2jqt s ASP 5 Cb 0.00 -2.00 1.66 0.00 1.07 0.00 0.00 42.92 43.65 2jqt s ASP 5 CO 0.00 -0.40 2.22 1.88 1.18 0.00 0.00 175.17 180.04 2jqt h TYR 6 N 7.10 0.00 -0.48 4.23 0.05 -2.02 -1.59 116.97 124.27 2jqt h TYR 6 Ca 0.06 0.00 0.11 0.00 0.05 0.00 0.00 58.73 58.95 2jqt h TYR 6 Cb 0.96 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.67 2jqt h TYR 6 CO 0.83 0.00 0.33 1.37 -1.05 0.00 0.00 178.16 179.64 2jqt h LEU 7 N 0.00 0.12 -0.80 3.88 8.10 -1.93 -0.88 115.31 123.81 2jqt h LEU 7 Ca 0.01 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.99 2jqt h LEU 7 Cb 0.04 -0.02 -0.04 0.00 -0.44 0.00 0.00 40.66 40.20 2jqt h LEU 7 CO -0.00 0.07 0.47 0.25 -4.11 0.00 0.00 178.44 175.13 2jqt h LEU 8 N 0.14 0.97 -0.51 0.17 5.85 -1.71 -0.52 115.31 119.69 2jqt h LEU 8 Ca 0.22 -0.07 -0.16 0.00 0.84 0.00 0.00 57.88 58.71 2jqt h LEU 8 Cb 0.71 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 2jqt h LEU 8 CO -0.03 0.76 -0.57 0.50 -0.34 0.00 0.00 178.44 178.76 2jqt h LYS 9 N 1.10 0.53 0.50 1.25 3.11 -1.33 -2.70 116.57 119.03 2jqt h LYS 9 Ca 0.29 -0.35 -0.02 0.00 -2.81 0.00 0.00 60.65 57.76 2jqt h LYS 9 Cb -0.02 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.25 2jqt h LYS 9 CO -0.05 0.95 -0.24 0.35 -2.81 0.00 0.00 179.45 177.65 2jqt h PHE 10 N 0.41 -0.62 -0.36 1.91 3.04 -1.01 -2.96 116.94 117.34 2jqt h PHE 10 Ca 0.00 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.04 2jqt h PHE 10 Cb 1.11 0.21 -0.01 0.00 2.56 0.00 0.00 35.95 39.81 2jqt h PHE 10 CO 0.04 -0.30 0.28 0.07 -2.02 0.00 0.00 178.31 176.39 2jqt h ARG 11 N -0.94 0.00 0.00 1.11 -0.00 -1.18 0.13 114.38 113.50 2jqt h ARG 11 Ca -0.07 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.89 2jqt h ARG 11 Cb 0.60 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 30.57 2jqt h ARG 11 CO 0.11 0.00 -0.10 -0.22 -0.00 0.00 0.00 179.97 179.76 2jqt h LYS 12 N 0.00 0.00 -6.94 0.08 1.63 -1.31 -3.43 116.57 106.60 2jqt h LYS 12 Ca 0.17 0.00 -0.55 0.00 -0.85 0.00 0.00 60.65 59.42 2jqt h LYS 12 Cb 0.73 0.00 0.12 0.00 -0.60 0.00 0.00 32.23 32.47 2jqt h LYS 12 CO -0.00 0.10 0.71 -0.89 -3.45 0.00 0.00 179.45 175.92 2jqt n ILE 13 N -3.69 2.37 -0.04 2.00 5.41 0.44 -4.93 119.36 120.92 2jqt n ILE 13 Ca -0.02 -0.50 -0.04 0.00 1.00 0.00 0.00 62.75 63.19 2jqt n ILE 13 Cb 0.21 -1.87 -0.07 0.00 -0.71 0.00 0.00 39.64 37.20 2jqt n ILE 13 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2jqt n SER 14 N 0.19 2.82 -4.80 4.38 3.41 -1.26 -4.99 113.62 113.36 2jqt n SER 14 Ca 0.03 -0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.26 2jqt n SER 14 Cb 0.40 0.69 -0.06 0.00 -0.26 0.00 0.00 64.21 64.98 2jqt n SER 14 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2jqt s SER 15 N -4.12 6.80 0.42 4.04 0.15 -1.26 -4.97 113.70 114.75 2jqt s SER 15 Ca -0.05 0.95 0.20 0.00 0.70 0.00 0.00 55.95 57.75 2jqt s SER 15 Cb 0.03 -2.27 0.94 0.00 -1.71 0.00 0.00 66.02 63.01 2jqt s SER 15 CO 0.36 0.23 1.87 -0.07 1.20 0.00 0.00 173.24 176.83 2jqt h LEU 16 N 5.26 0.00 -1.65 3.45 3.38 -2.02 -2.86 115.31 120.88 2jqt h LEU 16 Ca -0.48 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.58 2jqt h LEU 16 Cb 1.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 2jqt h LEU 16 CO 0.66 0.28 0.39 -0.08 0.09 0.00 0.00 178.44 179.79 2jqt h GLU 17 N 0.00 0.39 0.00 1.13 4.57 -2.02 0.79 114.58 119.44 2jqt h GLU 17 Ca -0.00 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.12 2jqt h GLU 17 Cb 0.65 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 2jqt h GLU 17 CO 0.04 0.26 -0.14 0.77 -1.18 0.00 0.00 179.01 178.75 2jqt h SER 18 N 0.40 0.00 0.24 1.04 0.02 -1.93 -2.62 113.55 110.70 2jqt h SER 18 Ca 0.27 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.21 2jqt h SER 18 Cb 0.53 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 2jqt h SER 18 CO -0.07 0.14 -0.17 0.25 -1.14 0.00 0.00 176.83 175.84 2jqt h LEU 19 N 0.00 -0.44 -1.90 5.07 5.85 -0.99 0.28 115.31 123.18 2jqt h LEU 19 Ca -0.00 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.76 2jqt h LEU 19 Cb 0.31 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2jqt h LEU 19 CO 0.02 -0.25 0.09 1.05 -0.34 0.00 0.00 178.44 179.01 2jqt h GLU 20 N -0.39 0.13 -0.00 1.25 4.11 -1.65 0.17 114.58 118.19 2jqt h GLU 20 Ca -0.03 -0.01 -0.00 0.00 0.07 0.00 0.00 59.36 59.39 2jqt h GLU 20 Cb 0.32 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2jqt h GLU 20 CO 0.02 0.08 0.00 -0.22 0.07 0.00 0.00 179.01 178.96 2jqt h LYS 21 N 0.13 0.01 -0.25 1.06 1.63 -1.20 -1.27 116.57 116.68 2jqt h LYS 21 Ca 0.05 -0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.72 2jqt h LYS 21 Cb 0.05 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.67 2jqt h LYS 21 CO -0.01 0.29 -0.39 1.25 -3.45 0.00 0.00 179.45 177.15 2jqt h LEU 22 N -0.28 0.59 0.69 5.20 6.46 0.00 -1.59 115.31 126.39 2jqt h LEU 22 Ca 0.00 -0.26 -0.03 0.00 -0.12 0.00 0.00 57.88 57.47 2jqt h LEU 22 Cb 0.29 -0.17 0.01 0.00 -0.73 0.00 0.00 40.66 40.06 2jqt h LEU 22 CO 0.00 0.92 -0.33 0.22 -0.62 0.00 0.00 178.44 178.63 2jqt h TYR 23 N 0.47 -0.86 -0.12 1.25 3.20 -0.92 0.62 116.97 120.60 2jqt h TYR 23 Ca 0.04 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 2jqt h TYR 23 Cb 0.88 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.43 2jqt h TYR 23 CO 0.04 -0.51 -0.03 -0.44 -1.64 0.00 0.00 178.16 175.57 2jqt h ASP 24 N -1.06 0.15 0.11 -2.11 5.19 -1.28 0.60 116.42 118.02 2jqt h ASP 24 Ca -0.10 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.29 2jqt h ASP 24 Cb 0.74 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.22 2jqt h ASP 24 CO 0.16 0.21 -0.05 -0.74 -3.12 0.00 0.00 179.24 175.70 2jqt h HIS 25 N 0.16 -0.13 -0.32 4.55 2.76 -1.11 -1.90 115.15 119.16 2jqt h HIS 25 Ca 0.04 -0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.10 2jqt h HIS 25 Cb 0.17 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.16 2jqt h HIS 25 CO 0.00 0.37 -0.23 1.25 -1.30 0.00 0.00 177.93 178.02 2jqt h LEU 26 N -0.87 0.61 -0.96 0.26 5.85 0.38 0.99 115.31 121.57 2jqt h LEU 26 Ca -0.01 -0.21 -0.11 0.00 0.84 0.00 0.00 57.88 58.39 2jqt h LEU 26 Cb 0.56 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2jqt h LEU 26 CO 0.02 0.83 -0.49 -1.13 -0.34 0.00 0.00 178.44 177.34 2jqt h ASN 27 N 0.54 0.08 0.40 1.25 -1.24 0.12 0.88 115.58 117.61 2jqt h ASN 27 Ca 0.08 -0.04 -0.31 0.00 0.71 0.00 0.00 56.30 56.74 2jqt h ASN 27 Cb 0.68 -0.02 -0.00 0.00 0.73 0.00 0.00 38.32 39.71 2jqt h ASN 27 CO 0.05 0.55 -1.55 1.88 -1.29 0.00 0.00 177.43 177.07 2jqt h TYR 28 N 0.06 0.54 0.13 0.67 -1.99 -1.04 -1.09 116.97 114.24 2jqt h TYR 28 Ca -0.00 -0.39 -0.01 0.00 2.00 0.00 0.00 58.73 60.33 2jqt h TYR 28 Cb 0.88 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 39.59 2jqt h TYR 28 CO 0.00 1.44 -0.06 1.79 -0.00 0.00 0.00 178.16 181.34 2jqt h THR 29 N 0.08 0.87 0.00 -2.88 1.35 -0.76 -3.39 112.91 108.18 2jqt h THR 29 Ca -0.26 -1.26 -0.05 0.00 -0.55 0.00 0.00 66.41 64.30 2jqt h THR 29 Cb 2.04 1.51 -0.01 0.00 -1.73 0.00 0.00 68.15 69.97 2jqt h THR 29 CO 0.17 0.24 -0.37 -0.07 -0.25 0.00 0.00 175.52 175.25 2jqt h LEU 30 N -0.89 0.00 -1.07 3.87 4.07 -1.00 -3.49 115.31 116.80 2jqt h LEU 30 Ca -0.02 -0.41 -0.36 0.00 0.08 0.00 0.00 57.88 57.17 2jqt h LEU 30 Cb 0.53 0.00 0.14 0.00 1.08 0.00 0.00 40.66 42.41 2jqt h LEU 30 CO 0.03 0.91 -0.67 0.41 -1.08 0.00 0.00 178.44 178.04 2jqt n THR 31 N -4.62 -3.60 -4.43 0.22 -1.04 -0.41 -5.01 114.28 95.39 2jqt n THR 31 Ca -0.11 -0.12 -0.21 0.00 -2.04 0.00 0.00 64.05 61.56 2jqt n THR 31 Cb 0.34 -4.14 -0.10 0.00 -1.82 0.00 0.00 70.33 64.61 2jqt n THR 31 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2jqt s ASP 32 N -3.56 2.13 0.39 8.00 -1.08 -1.26 -5.04 116.67 116.24 2jqt s ASP 32 Ca 0.42 -1.43 0.14 0.00 -0.52 0.00 0.00 52.55 51.16 2jqt s ASP 32 Cb -0.18 0.09 0.80 0.00 -1.46 0.00 0.00 42.92 42.16 2jqt s ASP 32 CO 0.70 -0.70 1.85 0.44 0.52 0.00 0.00 175.17 177.98 2jqt h ASP 33 N 2.13 0.00 0.72 -0.34 5.19 -1.99 -2.80 116.42 119.34 2jqt h ASP 33 Ca -0.39 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 55.99 2jqt h ASP 33 Cb 1.25 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.76 2jqt h ASP 33 CO 0.65 0.34 -0.43 1.56 -3.12 0.00 0.00 179.24 178.24 2jqt h GLN 34 N 0.00 -1.04 -0.05 3.56 4.20 -1.99 0.97 115.11 120.76 2jqt h GLN 34 Ca -0.00 0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2jqt h GLN 34 Cb 0.62 0.24 -0.00 0.00 0.30 0.00 0.00 27.48 28.63 2jqt h GLN 34 CO 0.04 -0.69 -0.06 1.05 -0.67 0.00 0.00 178.83 178.51 2jqt h GLU 35 N -1.08 0.07 -0.31 1.46 -0.00 -1.91 0.24 114.58 113.05 2jqt h GLU 35 Ca -0.09 -0.01 -0.09 0.00 -0.00 0.00 0.00 59.36 59.17 2jqt h GLU 35 Cb 0.86 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 29.59 2jqt h GLU 35 CO 0.11 0.14 -0.16 -0.07 -0.00 0.00 0.00 179.01 179.03 2jqt h LEU 36 N 0.07 0.67 -0.48 3.06 3.38 -1.18 -1.48 115.31 119.36 2jqt h LEU 36 Ca 0.02 -0.41 -0.16 0.00 0.09 0.00 0.00 57.88 57.42 2jqt h LEU 36 Cb 0.15 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2jqt h LEU 36 CO 0.01 0.94 -0.76 -0.29 0.09 0.00 0.00 178.44 178.42 2jqt h ILE 37 N 0.41 1.54 -0.03 1.22 2.10 -0.32 -1.30 117.51 121.14 2jqt h ILE 37 Ca 0.07 -2.59 -0.15 0.00 1.08 0.00 0.00 64.86 63.27 2jqt h ILE 37 Cb 0.69 2.40 -0.01 0.00 -1.09 0.00 0.00 36.82 38.80 2jqt h ILE 37 CO 0.05 0.74 -0.64 -1.13 -1.08 0.00 0.00 178.15 176.09 2jqt h ASN 38 N 0.01 0.15 0.20 2.19 -0.73 -0.90 -2.44 115.58 114.06 2jqt h ASN 38 Ca -0.01 -0.09 -0.34 0.00 1.87 0.00 0.00 56.30 57.73 2jqt h ASN 38 Cb 1.34 -0.04 0.02 0.00 0.27 0.00 0.00 38.32 39.91 2jqt h ASN 38 CO 0.10 0.75 -1.65 -0.03 -0.37 0.00 0.00 177.43 176.23 2jqt h MET 39 N 0.09 0.43 -0.44 6.67 4.05 -1.23 -3.20 114.93 121.30 2jqt h MET 39 Ca -0.01 -0.73 -0.00 0.00 -0.28 0.00 0.00 59.70 58.68 2jqt h MET 39 Cb 1.15 0.27 -0.02 0.00 -0.80 0.00 0.00 31.60 32.20 2jqt h MET 39 CO 0.09 1.35 0.26 1.88 0.23 0.00 0.00 176.91 180.72 2jqt h TYR 40 N 0.09 0.59 -0.07 1.39 -1.99 -1.27 0.82 116.97 116.53 2jqt h TYR 40 Ca -0.32 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.41 2jqt h TYR 40 Cb 2.09 -0.19 -0.00 0.00 2.00 0.00 0.00 36.73 40.63 2jqt h TYR 40 CO 0.11 0.43 0.04 0.00 -0.00 0.00 0.00 178.16 178.75 2jqt h ARG 41 N 0.58 0.08 -0.06 4.88 3.08 -1.58 0.13 114.38 121.50 2jqt h ARG 41 Ca 0.16 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 60.06 2jqt h ARG 41 Cb 0.02 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2jqt h ARG 41 CO -0.03 0.06 -0.61 0.00 -1.07 0.00 0.00 179.97 178.32 2jqt h ALA 42 N 1.03 0.86 0.26 0.04 0.00 -1.51 -2.26 119.26 117.67 2jqt h ALA 42 Ca 0.03 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 2jqt h ALA 42 Cb -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2jqt h ALA 42 CO -0.01 0.74 -0.12 0.00 0.00 0.00 0.00 179.25 179.85 2jqt h ALA 43 N 1.21 -0.35 -0.42 0.00 0.00 0.97 0.92 119.26 121.59 2jqt h ALA 43 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2jqt h ALA 43 Cb 1.11 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2jqt h ALA 43 CO 0.09 -0.52 0.27 0.22 0.00 0.00 0.00 179.25 179.31 2jqt h ASP 44 N -0.70 0.50 -0.20 0.00 3.58 -0.81 0.78 116.42 119.57 2jqt h ASP 44 Ca -0.04 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.37 2jqt h ASP 44 Cb 0.48 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 2jqt h ASP 44 CO 0.06 0.39 0.08 0.45 -2.88 0.00 0.00 179.24 177.33 2jqt h HIS 45 N 0.56 0.30 -0.74 0.28 3.86 -1.44 0.19 115.15 118.17 2jqt h HIS 45 Ca 0.15 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 2jqt h HIS 45 Cb -0.03 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.31 2jqt h HIS 45 CO -0.04 0.35 0.43 -0.09 0.86 0.00 0.00 177.93 179.44 2jqt h ARG 46 N 0.17 1.01 -0.00 2.45 1.12 -0.62 0.14 114.38 118.66 2jqt h ARG 46 Ca 0.07 -0.10 -0.00 0.00 -1.11 0.00 0.00 59.98 58.83 2jqt h ARG 46 Cb 0.18 -0.21 -0.00 0.00 -0.01 0.00 0.00 29.97 29.93 2jqt h ARG 46 CO -0.01 0.73 -0.00 0.00 -3.11 0.00 0.00 179.97 177.59 2jqt h ARG 47 N 1.01 0.00 -0.31 0.20 2.47 -0.67 -1.44 114.38 115.64 2jqt h ARG 47 Ca 0.26 -0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.99 2jqt h ARG 47 Cb -0.00 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.30 2jqt h ARG 47 CO -0.05 0.40 0.19 0.00 0.56 0.00 0.00 179.97 181.07 2jqt h ALA 48 N 0.60 0.38 -0.29 0.04 0.00 -0.49 -2.09 119.26 117.42 2jqt h ALA 48 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2jqt h ALA 48 Cb 0.40 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2jqt h ALA 48 CO 0.00 -0.18 0.05 0.93 0.00 0.00 0.00 179.25 180.05 2jqt h GLU 49 N 0.38 0.42 -0.19 0.00 5.08 -0.74 -0.80 114.58 118.73 2jqt h GLU 49 Ca 0.12 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2jqt h GLU 49 Cb -0.02 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2jqt h GLU 49 CO -0.05 0.41 0.07 1.25 -1.00 0.00 0.00 179.01 179.70 2jqt h LEU 50 N 0.41 0.26 -0.85 1.33 5.85 -0.61 -1.18 115.31 120.53 2jqt h LEU 50 Ca 0.10 -0.17 -0.12 0.00 0.84 0.00 0.00 57.88 58.53 2jqt h LEU 50 Cb 0.20 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2jqt h LEU 50 CO -0.00 0.36 -0.54 0.58 -0.34 0.00 0.00 178.44 178.50 2jqt h VAL 51 N 0.15 1.38 -0.89 1.05 2.07 -1.11 -2.93 116.25 115.97 2jqt h VAL 51 Ca 0.06 -1.85 -0.44 0.00 0.82 0.00 0.00 66.70 65.29 2jqt h VAL 51 Cb 0.18 1.96 -0.26 0.00 -1.52 0.00 0.00 31.29 31.65 2jqt h VAL 51 CO -0.00 0.54 0.56 -1.20 0.02 0.00 0.00 177.57 177.48 2jqt n SER 52 N -3.90 3.82 0.00 0.57 7.64 -0.33 -4.88 113.62 116.53 2jqt n SER 52 Ca -0.02 -3.43 0.00 0.00 1.01 0.00 0.00 58.87 56.44 2jqt n SER 52 Cb 0.56 -0.80 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 2jqt n SER 52 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jqt n GLY 53 N -0.89 0.69 0.00 0.23 0.00 -0.47 -4.93 105.19 99.82 2jqt n GLY 53 Ca 0.53 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.46 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 5.00 0.00 3.15 -0.02 0.00 -1.26 -5.10 105.19 106.96 2jqt n GLY 54 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2jqt n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jqt s ARG 55 N 0.00 0.17 -0.50 1.61 3.00 -1.26 -5.12 118.95 116.85 2jqt s ARG 55 Ca 0.00 0.19 -0.14 0.00 -1.00 0.00 0.00 55.73 54.78 2jqt s ARG 55 Cb 0.00 0.09 0.11 0.00 0.00 0.00 0.00 34.95 35.15 2jqt s ARG 55 CO 0.00 -0.30 0.42 -1.17 0.00 0.00 0.00 175.30 174.26 2jqt s LEU 56 N 2.95 5.86 0.00 -0.88 2.96 -1.26 -5.21 118.68 123.10 2jqt s LEU 56 Ca 0.22 -1.67 0.00 0.00 -0.22 0.00 0.00 54.13 52.46 2jqt s LEU 56 Cb -0.03 -2.14 0.00 0.00 0.50 0.00 0.00 46.19 44.51 2jqt s LEU 56 CO -0.21 -0.75 0.00 0.33 -1.32 0.00 0.00 176.35 174.40