#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jqp s THR 2 N 0.00 4.07 0.02 1.96 2.01 -1.26 -1.32 115.64 121.12 2jqp s THR 2 Ca 0.00 -0.30 -0.01 0.00 0.31 0.00 0.00 61.69 61.69 2jqp s THR 2 Cb 0.00 -2.78 -0.02 0.00 0.01 0.00 0.00 72.50 69.71 2jqp s THR 2 CO 0.00 0.51 -0.01 0.00 -0.69 0.00 0.00 174.62 174.43 2jqp s LEU 4 N -1.37 4.30 0.03 0.00 2.01 -0.99 0.24 118.68 122.89 2jqp s LEU 4 Ca -0.15 1.14 0.02 0.00 0.01 0.00 0.00 54.13 55.16 2jqp s LEU 4 Cb -0.09 -3.06 -0.02 0.00 0.01 0.00 0.00 46.19 43.03 2jqp s LEU 4 CO -0.01 -0.13 -0.07 0.27 1.01 0.00 0.00 176.35 177.42 2jqp s ILE 5 N 0.93 0.53 0.00 -0.59 -0.00 0.80 -4.46 121.20 118.40 2jqp s ILE 5 Ca 0.36 -0.84 0.00 0.00 -0.00 0.00 0.00 60.65 60.18 2jqp s ILE 5 Cb -0.17 -0.55 0.00 0.00 -0.00 0.00 0.00 42.46 41.73 2jqp s ILE 5 CO 0.17 -0.22 0.00 0.00 -0.00 0.00 0.00 174.94 174.88 2jqp n PRO 7 N 0.00 1.57 -3.52 0.00 -0.04 -1.26 -4.79 135.00 126.96 2jqp n PRO 7 Ca 0.00 -2.34 -0.11 0.00 -0.04 0.00 0.00 63.50 61.01 2jqp n PRO 7 Cb 0.00 -3.57 -0.04 0.00 -0.04 0.00 0.00 33.50 29.85 2jqp n PRO 7 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2jqp s GLU 8 N 6.20 0.86 0.01 0.54 2.02 -1.26 -4.93 118.70 122.13 2jqp s GLU 8 Ca 0.66 -0.08 -0.03 0.00 0.02 0.00 0.00 54.97 55.54 2jqp s GLU 8 Cb 0.02 0.40 -0.01 0.00 0.10 0.00 0.00 34.13 34.64 2jqp s GLU 8 CO 0.14 -0.33 1.05 0.87 0.02 0.00 0.00 175.26 177.01 2jqp h LYS 9 N 2.36 -0.07 -3.86 1.61 1.79 -2.03 -3.36 116.57 113.01 2jqp h LYS 9 Ca -0.23 0.01 -0.70 0.00 -2.18 0.00 0.00 60.65 57.54 2jqp h LYS 9 Cb 1.21 0.02 -0.35 0.00 -1.58 0.00 0.00 32.23 31.53 2jqp h LYS 9 CO 0.33 -0.05 -0.40 0.16 -1.08 0.00 0.00 179.45 178.42 2jqp s ASP 10 N -2.60 5.31 0.00 0.86 -4.77 -1.26 -5.01 116.67 109.19 2jqp s ASP 10 Ca -0.02 -2.60 0.00 0.00 -3.30 0.00 0.00 52.55 46.64 2jqp s ASP 10 Cb 0.01 -1.87 0.00 0.00 -1.09 0.00 0.00 42.92 39.97 2jqp s ASP 10 CO 0.06 -0.43 0.00 0.00 0.70 0.00 0.00 175.17 175.49 2jqp s GLN 12 N -0.86 0.38 -0.12 0.00 -2.07 -1.26 -4.52 119.66 111.21 2jqp s GLN 12 Ca 0.00 1.13 0.01 0.00 -1.82 0.00 0.00 55.36 54.68 2jqp s GLN 12 Cb 0.00 0.46 -0.01 0.00 -1.09 0.00 0.00 33.01 32.36 2jqp s GLN 12 CO 0.00 -0.24 -0.14 0.21 -1.32 0.00 0.00 175.29 173.80 2jqp s LYS 13 N 2.66 3.26 0.38 9.60 2.20 -0.45 -4.86 119.74 132.54 2jqp s LYS 13 Ca -0.03 -0.71 -0.28 0.00 -0.36 0.00 0.00 55.97 54.59 2jqp s LYS 13 Cb -0.12 -2.57 -0.11 0.00 -1.51 0.00 0.00 37.83 33.52 2jqp s LYS 13 CO -0.14 0.25 1.48 0.14 -0.36 0.00 0.00 175.35 176.72 2jqp s VAL 14 N 0.24 2.06 0.06 4.02 -7.23 -1.26 -0.14 120.40 118.14 2jqp s VAL 14 Ca -0.10 0.06 -0.00 0.00 -1.81 0.00 0.00 61.98 60.13 2jqp s VAL 14 Cb -0.16 -3.04 -0.04 0.00 0.56 0.00 0.00 36.38 33.71 2jqp s VAL 14 CO 0.06 0.01 -0.04 -2.28 -0.31 0.00 0.00 175.10 172.54 2jqp s HIS 15 N -1.12 0.59 -0.25 2.82 2.46 0.14 -4.84 115.29 115.08 2jqp s HIS 15 Ca 0.53 -1.03 0.02 0.00 0.47 0.00 0.00 55.06 55.05 2jqp s HIS 15 Cb -0.46 -0.41 0.05 0.00 -0.13 0.00 0.00 32.58 31.63 2jqp s HIS 15 CO 0.63 -0.33 -0.12 0.99 -2.47 0.00 0.00 174.74 173.44 2jqp s THR 16 N -3.82 2.20 -0.65 0.89 2.01 -1.26 -1.10 115.64 113.90 2jqp s THR 16 Ca 0.08 -1.51 -0.05 0.00 0.31 0.00 0.00 61.69 60.51 2jqp s THR 16 Cb 0.07 -2.24 -0.00 0.00 0.01 0.00 0.00 72.50 70.34 2jqp s THR 16 CO -0.09 0.06 2.87 0.00 -0.69 0.00 0.00 174.62 176.77 2jqp s ARG 18 N -0.75 3.17 0.00 0.00 1.70 -1.26 -4.31 118.95 117.50 2jqp s ARG 18 Ca 0.60 0.88 0.00 0.00 -0.47 0.00 0.00 55.73 56.74 2jqp s ARG 18 Cb 0.31 -4.20 0.00 0.00 -0.57 0.00 0.00 34.95 30.49 2jqp s ARG 18 CO -0.14 -2.07 0.00 -1.71 -1.08 0.00 0.00 175.30 170.30 2jqp n ASN 19 N 10.54 0.00 0.23 -2.89 4.05 -1.26 -4.97 115.26 120.97 2jqp n ASN 19 Ca 0.18 0.00 0.18 0.00 0.45 0.00 0.00 54.58 55.39 2jqp n ASN 19 Cb 0.49 0.00 0.87 0.00 1.23 0.00 0.00 39.78 42.37 2jqp n ASN 19 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 177.26 175.26 2jqp h GLU 20 N 0.00 0.00 0.00 1.20 4.11 -2.00 -3.42 114.58 114.47 2jqp h GLU 20 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.29 2jqp h GLU 20 Cb 0.00 0.00 0.07 0.00 0.50 0.00 0.00 28.75 29.32 2jqp h GLU 20 CO 0.00 0.00 0.07 0.39 0.07 0.00 0.00 179.01 179.54 2jqp n GLU 21 N -3.58 -1.47 0.00 1.06 4.71 -1.26 -4.91 120.64 115.19 2jqp n GLU 21 Ca 0.01 -0.65 0.00 0.00 -0.01 0.00 0.00 57.16 56.51 2jqp n GLU 21 Cb 0.32 -0.56 0.00 0.00 -1.01 0.00 0.00 31.44 30.19 2jqp n GLU 21 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2jqp n LYS 22 N -2.53 0.00 -3.32 3.49 5.02 -0.28 -4.94 118.16 115.60 2jqp n LYS 22 Ca 0.06 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.16 2jqp n LYS 22 Cb 0.21 -0.09 -0.00 0.00 -0.02 0.00 0.00 35.03 35.12 2jqp n LYS 22 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2jqp s ILE 23 N -1.33 3.58 -0.13 -0.18 -4.36 0.84 -4.52 121.20 115.10 2jqp s ILE 23 Ca 0.00 -1.04 0.01 0.00 -0.26 0.00 0.00 60.65 59.37 2jqp s ILE 23 Cb 0.00 -3.22 0.02 0.00 1.25 0.00 0.00 42.46 40.50 2jqp s ILE 23 CO 0.00 -0.09 -0.16 0.00 0.24 0.00 0.00 174.94 174.92 2jqp s VAL 25 N 1.18 3.66 -0.00 0.00 1.01 -0.43 -0.86 120.40 124.95 2jqp s VAL 25 Ca -0.01 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.15 2jqp s VAL 25 Cb -0.14 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.60 2jqp s VAL 25 CO -0.06 0.32 -0.16 -0.75 0.00 0.00 0.00 175.10 174.45 2jqp s LYS 26 N -1.65 1.25 -0.03 2.72 2.47 0.14 -0.51 119.74 124.12 2jqp s LYS 26 Ca 0.19 -0.61 -0.00 0.00 -1.56 0.00 0.00 55.97 53.99 2jqp s LYS 26 Cb -0.11 -1.22 0.03 0.00 -1.46 0.00 0.00 37.83 35.06 2jqp s LYS 26 CO 0.10 0.33 0.02 1.03 0.16 0.00 0.00 175.35 176.99 2jqp s ARG 27 N -0.50 0.11 0.04 4.03 0.52 0.92 -1.05 118.95 123.03 2jqp s ARG 27 Ca 0.06 0.19 -0.01 0.00 -0.52 0.00 0.00 55.73 55.45 2jqp s ARG 27 Cb -0.06 -0.44 -0.03 0.00 0.52 0.00 0.00 34.95 34.94 2jqp s ARG 27 CO -0.00 -0.20 -0.03 -0.59 0.02 0.00 0.00 175.30 174.50 2jqp s PHE 28 N 1.37 0.41 -0.03 -0.53 -0.71 -0.61 -0.42 117.98 117.47 2jqp s PHE 28 Ca -0.05 -0.85 0.07 0.00 -1.04 0.00 0.00 56.93 55.06 2jqp s PHE 28 Cb -0.13 -0.31 -0.02 0.00 -1.21 0.00 0.00 43.02 41.36 2jqp s PHE 28 CO -0.03 -0.31 -0.23 -0.47 -1.34 0.00 0.00 175.22 172.84 2jqp s TYR 29 N -2.95 2.16 -0.12 3.49 6.14 0.12 -1.55 117.35 124.64 2jqp s TYR 29 Ca -0.02 -0.48 -0.04 0.00 0.64 0.00 0.00 57.07 57.17 2jqp s TYR 29 Cb 0.01 -1.40 0.05 0.00 0.42 0.00 0.00 41.96 41.03 2jqp s TYR 29 CO -0.06 -0.09 0.08 0.16 0.64 0.00 0.00 175.55 176.27 2jqp s ASP 30 N -0.42 1.85 0.34 4.32 -4.77 -1.26 -1.68 116.67 115.06 2jqp s ASP 30 Ca 0.05 -0.33 0.04 0.00 -3.30 0.00 0.00 52.55 49.02 2jqp s ASP 30 Cb -0.10 -0.21 -0.02 0.00 -1.09 0.00 0.00 42.92 41.50 2jqp s ASP 30 CO 0.00 -0.31 0.36 -0.75 0.70 0.00 0.00 175.17 175.17 2jqp s LYS 31 N 2.15 1.85 0.02 2.11 2.20 -0.97 -5.01 119.74 122.09 2jqp s LYS 31 Ca 0.03 -1.95 -0.00 0.00 -0.36 0.00 0.00 55.97 53.68 2jqp s LYS 31 Cb -0.14 0.37 0.01 0.00 -1.51 0.00 0.00 37.83 36.55 2jqp s LYS 31 CO -0.07 -0.72 0.02 0.09 -0.36 0.00 0.00 175.35 174.31 2jqp n ASN 32 N -1.58 -1.55 -3.18 1.43 4.13 -1.26 -2.63 115.26 110.61 2jqp n ASN 32 Ca 0.05 -0.25 -0.23 0.00 1.68 0.00 0.00 54.58 55.83 2jqp n ASN 32 Cb 0.62 -0.02 0.03 0.00 -1.54 0.00 0.00 39.78 38.87 2jqp n ASN 32 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2jqp n GLN 33 N -1.83 -4.71 -3.47 3.52 6.02 -1.26 -2.90 117.38 112.76 2jqp n GLN 33 Ca 0.00 0.78 -0.16 0.00 -0.01 0.00 0.00 57.00 57.61 2jqp n GLN 33 Cb 0.01 -5.61 0.01 0.00 1.02 0.00 0.00 30.24 25.67 2jqp n GLN 33 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 2jqp n LEU 34 N -4.04 -4.10 -4.07 1.08 -0.00 -1.26 -4.99 117.00 99.62 2jqp n LEU 34 Ca -0.07 -0.61 -0.30 0.00 -0.00 0.00 0.00 56.01 55.03 2jqp n LEU 34 Cb 0.59 -2.47 -0.17 0.00 -0.00 0.00 0.00 43.42 41.37 2jqp n LEU 34 CO 0.50 -0.21 -0.50 -0.83 -0.00 0.00 0.00 177.39 176.35 2jqp s GLY 35 N -3.09 1.12 -0.30 -3.96 0.00 -1.08 -5.05 107.32 94.96 2jqp s GLY 35 Ca 0.10 -0.84 -0.06 0.00 0.00 0.00 0.00 44.72 43.92 2jqp s GLY 35 CO 0.83 0.26 0.63 0.86 0.00 0.00 0.00 173.10 175.68 2jqp s TRP 36 N 1.08 -1.46 -0.04 1.90 -0.11 -1.25 -2.29 118.94 116.77 2jqp s TRP 36 Ca -0.04 2.01 -0.03 0.00 1.22 0.00 0.00 56.10 59.27 2jqp s TRP 36 Cb -0.14 0.68 0.02 0.00 -1.50 0.00 0.00 33.47 32.53 2jqp s TRP 36 CO -0.04 -0.77 0.10 1.03 -4.62 0.00 0.00 176.95 172.65 2jqp s ARG 37 N 2.88 0.09 0.15 5.86 1.81 -0.67 -4.99 118.95 124.08 2jqp s ARG 37 Ca 0.07 0.17 0.08 0.00 -1.72 0.00 0.00 55.73 54.34 2jqp s ARG 37 Cb -0.13 -0.01 -0.04 0.00 -0.45 0.00 0.00 34.95 34.31 2jqp s ARG 37 CO -0.20 -0.05 -0.18 0.00 -0.68 0.00 0.00 175.30 174.19 2jqp s ALA 38 N 0.32 1.91 -0.29 2.13 0.00 -1.26 0.12 121.76 124.69 2jqp s ALA 38 Ca -0.02 -1.43 -0.15 0.00 0.00 0.00 0.00 51.96 50.35 2jqp s ALA 38 Cb -0.03 -0.18 0.11 0.00 0.00 0.00 0.00 23.12 23.02 2jqp s ALA 38 CO -0.01 0.23 0.77 -0.65 0.00 0.00 0.00 175.76 176.10 2jqp s GLN 39 N -2.68 0.57 0.36 0.00 -0.21 0.44 -4.88 119.66 113.27 2jqp s GLN 39 Ca 0.14 1.10 0.08 0.00 0.02 0.00 0.00 55.36 56.69 2jqp s GLN 39 Cb -0.06 0.29 -0.04 0.00 1.00 0.00 0.00 33.01 34.20 2jqp s GLN 39 CO 0.06 -0.14 0.20 0.50 -2.12 0.00 0.00 175.29 173.79 2jqp s ARG 40 N 1.87 2.41 -0.24 2.91 3.52 -1.26 -0.05 118.95 128.10 2jqp s ARG 40 Ca -0.08 -1.56 -0.27 0.00 -0.13 0.00 0.00 55.73 53.69 2jqp s ARG 40 Cb -0.06 -2.21 0.12 0.00 -1.56 0.00 0.00 34.95 31.24 2jqp s ARG 40 CO -0.18 0.03 1.01 0.20 -0.81 0.00 0.00 175.30 175.55 2jqp s GLY 41 N -3.91 -0.20 0.35 8.12 0.00 0.33 -4.98 107.32 107.03 2jqp s GLY 41 Ca 0.40 2.46 -0.23 0.00 0.00 0.00 0.00 44.72 47.35 2jqp s GLY 41 CO 0.24 1.59 0.91 0.00 0.00 0.00 0.00 173.10 175.83 2jqp n ALA 43 N 0.09 -0.12 -1.31 0.00 0.00 -0.32 -4.92 120.51 113.93 2jqp n ALA 43 Ca 0.03 -0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.46 2jqp n ALA 43 Cb 0.52 0.02 0.04 0.00 0.00 0.00 0.00 19.45 20.03 2jqp n ALA 43 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2jqp n VAL 44 N -0.03 0.61 -3.87 0.00 0.24 -1.26 -0.11 118.33 113.90 2jqp n VAL 44 Ca -0.00 -0.70 -0.11 0.00 -2.04 0.00 0.00 64.34 61.49 2jqp n VAL 44 Cb 0.03 0.41 -0.10 0.00 -1.47 0.00 0.00 33.84 32.71 2jqp n VAL 44 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2jqp s SER 45 N -1.28 0.05 -0.75 -1.34 0.15 -1.26 -4.93 113.70 104.34 2jqp s SER 45 Ca 0.08 -0.27 0.02 0.00 0.70 0.00 0.00 55.95 56.47 2jqp s SER 45 Cb 0.07 0.22 0.18 0.00 -1.71 0.00 0.00 66.02 64.78 2jqp s SER 45 CO 0.01 -0.42 0.57 0.00 1.20 0.00 0.00 173.24 174.60 2jqp n PRO 47 N 2.36 -0.26 -3.44 0.00 -0.04 -1.26 -5.10 135.00 127.25 2jqp n PRO 47 Ca 0.18 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.46 2jqp n PRO 47 Cb 0.36 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.78 2jqp n PRO 47 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2jqp n LYS 48 N -0.94 1.31 -3.82 0.54 -0.00 -1.26 -5.03 118.16 108.95 2jqp n LYS 48 Ca 0.00 -2.00 -0.09 0.00 -0.00 0.00 0.00 58.31 56.22 2jqp n LYS 48 Cb 0.00 0.56 0.02 0.00 -0.00 0.00 0.00 35.03 35.61 2jqp n LYS 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2jqp s ALA 49 N -2.48 -0.70 0.79 0.58 0.00 -1.26 -5.09 121.76 113.61 2jqp s ALA 49 Ca 0.01 -0.76 -0.14 0.00 0.00 0.00 0.00 51.96 51.07 2jqp s ALA 49 Cb 0.00 0.71 0.07 0.00 0.00 0.00 0.00 23.12 23.90 2jqp s ALA 49 CO 0.00 -0.98 1.22 0.15 0.00 0.00 0.00 175.76 176.15 2jqp s LYS 50 N -2.44 1.71 0.00 0.00 -0.14 -1.26 -4.88 119.74 112.73 2jqp s LYS 50 Ca 0.16 1.79 0.14 0.00 -1.36 0.00 0.00 55.97 56.71 2jqp s LYS 50 Cb -0.05 -1.78 0.69 0.00 -1.68 0.00 0.00 37.83 35.01 2jqp s LYS 50 CO 0.12 -2.17 1.42 -0.35 -0.76 0.00 0.00 175.35 173.61 2jqp n PRO 51 N -3.17 0.13 -0.08 -1.68 -0.04 -1.26 -3.02 135.00 125.88 2jqp n PRO 51 Ca 0.14 0.19 -0.23 0.00 -0.04 0.00 0.00 63.50 63.56 2jqp n PRO 51 Cb 0.50 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.34 2jqp n PRO 51 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2jqp n ASN 52 N -1.37 1.95 -4.41 3.54 3.02 -1.26 -4.97 115.26 111.77 2jqp n ASN 52 Ca 0.06 0.32 -0.29 0.00 -0.03 0.00 0.00 54.58 54.64 2jqp n ASN 52 Cb 0.14 -0.89 0.17 0.00 -0.61 0.00 0.00 39.78 38.59 2jqp n ASN 52 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2jqp s GLU 53 N -2.44 0.48 -0.07 3.52 -1.05 -1.17 -4.74 118.70 113.23 2jqp s GLU 53 Ca -0.29 0.05 0.03 0.00 -0.15 0.00 0.00 54.97 54.60 2jqp s GLU 53 Cb 0.08 -1.78 0.01 0.00 -0.44 0.00 0.00 34.13 31.99 2jqp s GLU 53 CO 0.62 -2.60 -0.15 0.99 0.95 0.00 0.00 175.26 175.08 2jqp s THR 54 N -3.36 1.31 0.02 1.83 2.01 -0.60 -4.81 115.64 112.05 2jqp s THR 54 Ca 0.68 -0.59 0.04 0.00 0.31 0.00 0.00 61.69 62.13 2jqp s THR 54 Cb -0.11 -1.17 -0.02 0.00 0.01 0.00 0.00 72.50 71.21 2jqp s THR 54 CO 0.54 0.39 -0.12 -0.69 -0.69 0.00 0.00 174.62 174.05 2jqp s VAL 55 N 0.56 0.91 -0.28 3.82 1.01 -1.26 -1.57 120.40 123.59 2jqp s VAL 55 Ca -0.15 -0.81 -0.16 0.00 0.00 0.00 0.00 61.98 60.86 2jqp s VAL 55 Cb -0.16 -0.83 0.09 0.00 0.00 0.00 0.00 36.38 35.48 2jqp s VAL 55 CO 0.05 0.02 0.72 0.00 0.00 0.00 0.00 175.10 175.89 2jqp s GLN 56 N -0.88 0.68 0.23 2.72 0.00 -0.21 -4.99 119.66 117.20 2jqp s GLN 56 Ca 0.01 1.17 0.08 0.00 -0.00 0.00 0.00 55.36 56.62 2jqp s GLN 56 Cb -0.07 0.14 -0.05 0.00 0.00 0.00 0.00 33.01 33.04 2jqp s GLN 56 CO 0.01 -0.14 -0.14 0.00 0.00 0.00 0.00 175.29 175.01 2jqp n SER 59 N 2.46 2.22 -4.24 0.00 3.41 -1.26 -1.77 113.62 114.44 2jqp n SER 59 Ca -0.16 -3.53 -0.16 0.00 -0.26 0.00 0.00 58.87 54.75 2jqp n SER 59 Cb 0.57 -0.51 -0.11 0.00 -0.26 0.00 0.00 64.21 63.90 2jqp n SER 59 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2jqp s THR 60 N -3.08 1.24 0.12 6.66 -4.23 -1.26 -5.00 115.64 110.10 2jqp s THR 60 Ca 0.37 -1.82 -0.31 0.00 -1.18 0.00 0.00 61.69 58.75 2jqp s THR 60 Cb 0.34 -1.60 -0.08 0.00 1.34 0.00 0.00 72.50 72.49 2jqp s THR 60 CO -0.01 -0.53 1.42 1.51 -0.54 0.00 0.00 174.62 176.46 2jqp s ASP 61 N -2.68 6.78 -1.66 3.99 -4.77 -1.26 -2.18 116.67 114.89 2jqp s ASP 61 Ca 0.11 2.37 0.00 0.00 -3.30 0.00 0.00 52.55 51.73 2jqp s ASP 61 Cb -0.02 -2.59 0.00 0.00 -1.09 0.00 0.00 42.92 39.22 2jqp s ASP 61 CO 0.02 -0.68 0.00 0.29 0.70 0.00 0.00 175.17 175.50 2jqp n LYS 62 N 3.96 -1.36 -0.07 2.11 4.01 -0.30 -4.87 118.16 121.65 2jqp n LYS 62 Ca 0.12 1.04 -0.08 0.00 -0.51 0.00 0.00 58.31 58.88 2jqp n LYS 62 Cb 0.42 -5.33 -0.05 0.00 -0.51 0.00 0.00 35.03 29.55 2jqp n LYS 62 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2jqp n ASN 64 N -4.64 2.01 0.00 0.00 5.15 -1.26 -4.95 115.26 111.58 2jqp n ASN 64 Ca -0.10 0.27 0.00 0.00 -0.60 0.00 0.00 54.58 54.15 2jqp n ASN 64 Cb 0.29 -1.28 0.00 0.00 -0.53 0.00 0.00 39.78 38.27 2jqp n ASN 64 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95