#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gqi s SER 2 N 0.00 5.40 -0.15 1.61 0.01 -1.26 -4.93 113.70 114.38 2gqi s SER 2 Ca 0.00 -0.13 -0.00 0.00 1.31 0.00 0.00 55.95 57.13 2gqi s SER 2 Cb 0.00 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.72 2gqi s SER 2 CO 0.00 -2.37 -0.08 -0.94 0.41 0.00 0.00 173.24 170.26 2gqi s SER 3 N 7.41 2.64 0.00 2.44 1.04 -1.26 -4.95 113.70 121.03 2gqi s SER 3 Ca 0.63 -0.53 0.00 0.00 0.48 0.00 0.00 55.95 56.53 2gqi s SER 3 Cb -0.10 -0.97 0.00 0.00 0.10 0.00 0.00 66.02 65.05 2gqi s SER 3 CO 0.12 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.82 2gqi n GLY 4 N 4.86 -2.28 3.91 7.32 0.00 -1.26 -5.15 105.19 112.59 2gqi n GLY 4 Ca -0.13 0.74 -0.29 0.00 0.00 0.00 0.00 46.02 46.34 2gqi n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gqi s SER 5 N 0.73 6.43 -0.10 1.61 1.04 -1.26 -5.05 113.70 117.11 2gqi s SER 5 Ca 0.00 0.53 -0.08 0.00 0.48 0.00 0.00 55.95 56.88 2gqi s SER 5 Cb 0.00 -2.07 -0.03 0.00 0.10 0.00 0.00 66.02 64.03 2gqi s SER 5 CO 0.00 -0.05 -0.16 -1.20 0.98 0.00 0.00 173.24 172.80 2gqi n SER 6 N -0.52 1.15 0.00 7.02 7.64 -1.26 -5.11 113.62 122.54 2gqi n SER 6 Ca -0.03 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.19 2gqi n SER 6 Cb 0.53 -0.69 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 2gqi n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gqi n GLY 7 N 1.57 3.44 3.80 0.23 0.00 -1.26 -4.93 105.19 108.03 2gqi n GLY 7 Ca -0.07 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 2gqi n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2gqi s ARG 8 N -1.54 4.33 -0.17 1.61 3.52 -0.42 -4.83 118.95 121.45 2gqi s ARG 8 Ca 0.00 0.88 -0.09 0.00 -0.13 0.00 0.00 55.73 56.39 2gqi s ARG 8 Cb 0.00 -3.25 -0.05 0.00 -1.56 0.00 0.00 34.95 30.09 2gqi s ARG 8 CO 0.00 0.60 0.12 0.50 -0.81 0.00 0.00 175.30 175.71 2gqi s ARG 9 N -1.08 3.93 0.10 5.12 3.52 -1.26 0.84 118.95 130.12 2gqi s ARG 9 Ca 0.31 -0.22 0.04 0.00 -0.13 0.00 0.00 55.73 55.74 2gqi s ARG 9 Cb -0.21 -3.32 -0.04 0.00 -1.56 0.00 0.00 34.95 29.83 2gqi s ARG 9 CO 0.21 0.43 -0.11 0.14 -0.81 0.00 0.00 175.30 175.17 2gqi s VAL 10 N -0.04 1.02 -0.03 7.11 -7.23 -1.20 -3.18 120.40 116.86 2gqi s VAL 10 Ca 0.09 -1.60 0.07 0.00 -1.81 0.00 0.00 61.98 58.73 2gqi s VAL 10 Cb -0.11 -1.34 -0.02 0.00 0.56 0.00 0.00 36.38 35.47 2gqi s VAL 10 CO -0.00 -0.49 -0.24 -0.60 -0.31 0.00 0.00 175.10 173.46 2gqi s ARG 11 N -2.62 2.24 -1.05 4.82 3.52 -1.16 -1.51 118.95 123.19 2gqi s ARG 11 Ca 0.05 -0.89 -0.22 0.00 -0.13 0.00 0.00 55.73 54.54 2gqi s ARG 11 Cb -0.04 -2.12 0.03 0.00 -1.56 0.00 0.00 34.95 31.27 2gqi s ARG 11 CO 0.01 0.55 1.58 0.00 -0.81 0.00 0.00 175.30 176.63 2gqi s ALA 12 N -0.57 2.62 0.63 6.12 0.00 -0.35 -1.99 121.76 128.21 2gqi s ALA 12 Ca 0.08 -2.24 0.30 0.00 0.00 0.00 0.00 51.96 50.10 2gqi s ALA 12 Cb -0.11 -4.56 1.59 0.00 0.00 0.00 0.00 23.12 20.05 2gqi s ALA 12 CO -0.00 -3.80 1.94 -0.84 0.00 0.00 0.00 175.76 173.06 2gqi h ILE 13 N 6.66 0.19 -3.53 0.00 3.07 -1.89 -0.34 117.51 121.69 2gqi h ILE 13 Ca 0.22 0.00 -0.11 0.00 1.55 0.00 0.00 64.86 66.52 2gqi h ILE 13 Cb 0.99 0.68 -0.17 0.00 -0.27 0.00 0.00 36.82 38.04 2gqi h ILE 13 CO 1.40 0.00 -0.38 -0.76 -1.05 0.00 0.00 178.15 177.35 2gqi s LEU 14 N -6.61 1.33 0.68 0.16 1.43 -1.25 -4.76 118.68 109.66 2gqi s LEU 14 Ca -0.04 -0.33 -0.14 0.00 -1.03 0.00 0.00 54.13 52.58 2gqi s LEU 14 Cb 0.12 0.98 0.01 0.00 0.03 0.00 0.00 46.19 47.33 2gqi s LEU 14 CO 0.41 -0.55 1.11 -2.16 0.23 0.00 0.00 176.35 175.39 2gqi s PRO 15 N -2.47 2.71 -0.18 1.29 0.04 -1.26 -4.52 135.00 130.60 2gqi s PRO 15 Ca -0.06 1.35 -0.14 0.00 0.04 0.00 0.00 61.00 62.20 2gqi s PRO 15 Cb -0.01 -1.94 0.05 0.00 0.04 0.00 0.00 34.50 32.63 2gqi s PRO 15 CO -0.03 -1.31 0.45 -0.47 0.04 0.00 0.00 177.00 175.68 2gqi s TYR 16 N -2.43 -0.57 -0.16 0.56 5.04 -1.05 -4.98 117.35 113.76 2gqi s TYR 16 Ca 0.66 1.30 -0.15 0.00 -2.44 0.00 0.00 57.07 56.44 2gqi s TYR 16 Cb -0.20 0.23 -0.04 0.00 0.35 0.00 0.00 41.96 42.29 2gqi s TYR 16 CO 0.44 -0.29 0.33 0.99 -1.34 0.00 0.00 175.55 175.68 2gqi s THR 17 N 0.69 5.28 1.27 4.34 2.01 -1.26 -2.65 115.64 125.32 2gqi s THR 17 Ca -0.04 0.61 -0.21 0.00 0.31 0.00 0.00 61.69 62.37 2gqi s THR 17 Cb -0.05 -3.67 0.31 0.00 0.01 0.00 0.00 72.50 69.11 2gqi s THR 17 CO -0.05 0.36 1.08 -1.59 -0.69 0.00 0.00 174.62 173.73 2gqi s LYS 18 N 0.65 -1.76 -0.03 4.92 -2.85 -1.26 -4.92 119.74 114.50 2gqi s LYS 18 Ca 0.18 -0.11 0.07 0.00 -1.00 0.00 0.00 55.97 55.11 2gqi s LYS 18 Cb -0.13 -1.54 -0.02 0.00 -2.06 0.00 0.00 37.83 34.08 2gqi s LYS 18 CO 0.05 -4.06 -0.25 0.08 0.10 0.00 0.00 175.35 171.28 2gqi s VAL 19 N -2.88 1.98 0.31 1.79 1.01 -1.26 -4.97 120.40 116.38 2gqi s VAL 19 Ca 0.71 -1.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 2gqi s VAL 19 Cb -0.09 -1.65 -0.10 0.00 0.00 0.00 0.00 36.38 34.54 2gqi s VAL 19 CO 0.56 0.56 1.23 -2.16 0.00 0.00 0.00 175.10 175.29 2gqi s PRO 20 N -0.49 4.47 -0.45 2.72 0.04 -1.26 -3.31 135.00 136.71 2gqi s PRO 20 Ca 0.07 2.06 -0.01 0.00 0.04 0.00 0.00 61.00 63.15 2gqi s PRO 20 Cb -0.11 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.32 2gqi s PRO 20 CO 0.00 -0.04 0.11 -0.25 0.04 0.00 0.00 177.00 176.86 2gqi n ASP 21 N 0.99 -2.64 -3.94 6.66 8.00 -1.26 -5.03 116.55 119.32 2gqi n ASP 21 Ca -0.00 -0.05 -0.10 0.00 0.71 0.00 0.00 54.79 55.35 2gqi n ASP 21 Cb 0.43 -1.73 -0.06 0.00 -0.02 0.00 0.00 41.12 39.74 2gqi n ASP 21 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2gqi s THR 22 N -2.55 0.05 -0.63 -3.53 -4.23 -1.21 -5.03 115.64 98.51 2gqi s THR 22 Ca 0.05 -1.33 0.04 0.00 -1.18 0.00 0.00 61.69 59.27 2gqi s THR 22 Cb -0.02 -1.89 0.27 0.00 1.34 0.00 0.00 72.50 72.20 2gqi s THR 22 CO 0.07 -0.21 1.00 0.47 -0.54 0.00 0.00 174.62 175.40 2gqi n ASP 23 N -0.26 2.74 -4.85 3.99 8.00 -1.26 -4.90 116.55 120.02 2gqi n ASP 23 Ca -0.06 -2.36 -0.32 0.00 0.71 0.00 0.00 54.79 52.75 2gqi n ASP 23 Cb 0.63 -0.57 -0.06 0.00 -0.02 0.00 0.00 41.12 41.10 2gqi n ASP 23 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2gqi s GLU 24 N -1.51 4.02 0.08 -1.24 2.02 -1.26 -2.96 118.70 117.85 2gqi s GLU 24 Ca 0.19 0.77 0.07 0.00 0.02 0.00 0.00 54.97 56.01 2gqi s GLU 24 Cb 0.15 -2.34 -0.03 0.00 0.10 0.00 0.00 34.13 32.00 2gqi s GLU 24 CO 0.05 0.05 -0.19 0.96 0.02 0.00 0.00 175.26 176.16 2gqi s ILE 25 N -2.13 1.53 -0.19 -1.63 -4.36 -1.26 -4.57 121.20 108.59 2gqi s ILE 25 Ca 0.56 -1.41 -0.13 0.00 -0.26 0.00 0.00 60.65 59.41 2gqi s ILE 25 Cb -0.10 -1.40 -0.05 0.00 1.25 0.00 0.00 42.46 42.17 2gqi s ILE 25 CO 0.19 -0.06 0.26 -0.94 0.24 0.00 0.00 174.94 174.63 2gqi s SER 26 N -1.74 6.34 0.37 4.36 1.04 -1.26 -4.29 113.70 118.53 2gqi s SER 26 Ca 0.04 0.40 0.07 0.00 0.48 0.00 0.00 55.95 56.94 2gqi s SER 26 Cb -0.10 -2.16 -0.07 0.00 0.10 0.00 0.00 66.02 63.79 2gqi s SER 26 CO 0.03 0.07 -0.01 0.72 0.98 0.00 0.00 173.24 175.04 2gqi s PHE 27 N 0.71 2.33 0.41 5.02 -0.71 -1.08 -4.94 117.98 119.71 2gqi s PHE 27 Ca 0.14 -0.69 0.07 0.00 -1.04 0.00 0.00 56.93 55.41 2gqi s PHE 27 Cb -0.13 -1.53 -0.06 0.00 -1.21 0.00 0.00 43.02 40.09 2gqi s PHE 27 CO 0.04 0.37 0.15 -0.51 -1.34 0.00 0.00 175.22 173.93 2gqi s LEU 28 N -3.62 3.08 -0.09 -1.99 2.01 -1.26 -2.54 118.68 114.27 2gqi s LEU 28 Ca 0.34 -1.13 -0.29 0.00 0.01 0.00 0.00 54.13 53.06 2gqi s LEU 28 Cb 0.08 -1.34 -0.06 0.00 0.01 0.00 0.00 46.19 44.88 2gqi s LEU 28 CO 0.17 -0.53 1.80 -0.75 1.01 0.00 0.00 176.35 178.04 2gqi s LYS 29 N -3.87 3.94 0.00 1.70 2.20 -1.26 -1.98 119.74 120.47 2gqi s LYS 29 Ca 0.40 2.14 0.00 0.00 -0.36 0.00 0.00 55.97 58.15 2gqi s LYS 29 Cb 0.05 -4.09 0.00 0.00 -1.51 0.00 0.00 37.83 32.28 2gqi s LYS 29 CO 0.22 -1.15 0.00 0.41 -0.36 0.00 0.00 175.35 174.47 2gqi n GLY 30 N 4.58 2.37 3.67 5.54 0.00 -0.14 -5.00 105.19 116.21 2gqi n GLY 30 Ca 0.20 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.77 2gqi n GLY 30 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gqi n ASP 31 N 0.00 2.86 -4.97 1.61 9.92 -0.84 -4.55 116.55 120.58 2gqi n ASP 31 Ca 0.00 1.13 -0.21 0.00 -0.53 0.00 0.00 54.79 55.18 2gqi n ASP 31 Cb 0.00 -1.43 0.01 0.00 -0.64 0.00 0.00 41.12 39.06 2gqi n ASP 31 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 2gqi s MET 32 N -0.06 3.02 0.21 -1.24 -1.94 -1.26 -1.21 119.30 116.81 2gqi s MET 32 Ca 0.71 -0.77 -0.07 0.00 -1.71 0.00 0.00 55.69 53.84 2gqi s MET 32 Cb -0.66 -2.67 -0.02 0.00 2.01 0.00 0.00 34.83 33.50 2gqi s MET 32 CO 0.47 -0.19 0.30 -0.06 -0.01 0.00 0.00 175.02 175.53 2gqi s PHE 33 N -2.41 0.67 -0.53 -0.03 0.40 -0.57 -2.28 117.98 113.22 2gqi s PHE 33 Ca 0.48 -0.99 0.04 0.00 -0.60 0.00 0.00 56.93 55.87 2gqi s PHE 33 Cb -0.10 -0.15 0.14 0.00 0.51 0.00 0.00 43.02 43.42 2gqi s PHE 33 CO 0.35 -0.80 0.29 0.42 0.70 0.00 0.00 175.22 176.17 2gqi s ILE 34 N -4.06 2.46 -0.09 0.64 1.01 -1.21 -3.22 121.20 116.73 2gqi s ILE 34 Ca 0.28 -3.35 -0.30 0.00 0.00 0.00 0.00 60.65 57.28 2gqi s ILE 34 Cb 0.03 -2.70 -0.08 0.00 0.01 0.00 0.00 42.46 39.73 2gqi s ILE 34 CO 0.08 -0.84 2.08 0.52 0.00 0.00 0.00 174.94 176.78 2gqi n VAL 35 N 3.00 0.57 -0.09 2.92 0.31 0.25 -3.46 118.33 121.84 2gqi n VAL 35 Ca 0.08 -0.27 -0.11 0.00 -0.01 0.00 0.00 64.34 64.02 2gqi n VAL 35 Cb 0.33 -2.37 -0.09 0.00 -0.91 0.00 0.00 33.84 30.79 2gqi n VAL 35 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 2gqi n HIS 36 N 9.25 0.00 -4.17 3.52 8.25 -0.82 -1.30 115.22 129.95 2gqi n HIS 36 Ca 0.25 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.55 2gqi n HIS 36 Cb 0.41 -0.71 -0.14 0.00 1.12 0.00 0.00 29.99 30.66 2gqi n HIS 36 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2gqi s ASN 37 N -5.55 0.65 -0.36 0.41 2.47 -1.20 -4.93 114.94 106.43 2gqi s ASN 37 Ca -0.21 -0.11 -0.04 0.00 0.42 0.00 0.00 52.86 52.92 2gqi s ASN 37 Cb 0.06 -0.07 0.08 0.00 -1.45 0.00 0.00 41.25 39.87 2gqi s ASN 37 CO 0.47 0.06 0.13 -1.61 -3.72 0.00 0.00 177.10 172.42 2gqi s GLU 38 N -0.17 2.29 1.09 0.43 2.02 -1.26 -0.71 118.70 122.39 2gqi s GLU 38 Ca 0.02 -1.50 -0.17 0.00 0.02 0.00 0.00 54.97 53.33 2gqi s GLU 38 Cb -0.02 -3.45 0.24 0.00 0.10 0.00 0.00 34.13 31.00 2gqi s GLU 38 CO -0.00 -0.85 1.19 -0.51 0.02 0.00 0.00 175.26 175.11 2gqi s LEU 39 N 1.25 1.54 -0.27 1.80 2.01 0.81 -4.98 118.68 120.84 2gqi s LEU 39 Ca 0.02 0.53 -0.09 0.00 0.01 0.00 0.00 54.13 54.60 2gqi s LEU 39 Cb -0.21 -2.43 -0.14 0.00 0.01 0.00 0.00 46.19 43.42 2gqi s LEU 39 CO -0.01 -3.49 -0.28 -0.62 1.01 0.00 0.00 176.35 172.96 2gqi n GLU 40 N -4.32 0.61 -0.37 1.70 1.02 -1.26 -4.33 120.64 113.70 2gqi n GLU 40 Ca 0.13 0.24 0.37 0.00 -0.02 0.00 0.00 57.16 57.87 2gqi n GLU 40 Cb 0.59 -1.52 0.60 0.00 -0.02 0.00 0.00 31.44 31.10 2gqi n GLU 40 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2gqi h ASP 41 N -0.64 0.00 0.00 1.62 3.32 -2.04 -3.41 116.42 115.26 2gqi h ASP 41 Ca -0.65 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.40 2gqi h ASP 41 Cb 1.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.26 2gqi h ASP 41 CO -0.30 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.83 2gqi n GLY 42 N -1.78 0.88 3.50 2.75 0.00 -1.26 -5.14 105.19 104.14 2gqi n GLY 42 Ca 0.30 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.18 2gqi n GLY 42 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2gqi s TRP 43 N -1.43 0.89 -0.22 1.61 0.52 -1.26 -3.94 118.94 115.12 2gqi s TRP 43 Ca 0.00 -1.16 -0.08 0.00 0.02 0.00 0.00 56.10 54.87 2gqi s TRP 43 Cb 0.00 -0.03 0.09 0.00 -1.15 0.00 0.00 33.47 32.38 2gqi s TRP 43 CO 0.00 -1.08 0.49 -1.64 0.02 0.00 0.00 176.95 174.73 2gqi s MET 44 N -3.31 0.41 -0.65 4.98 -1.94 -0.62 -0.14 119.30 118.04 2gqi s MET 44 Ca 0.29 1.11 -0.26 0.00 -1.71 0.00 0.00 55.69 55.12 2gqi s MET 44 Cb -0.00 0.40 -0.10 0.00 2.01 0.00 0.00 34.83 37.14 2gqi s MET 44 CO 0.17 -0.22 2.37 -0.46 -0.01 0.00 0.00 175.02 176.87 2gqi s TRP 45 N 2.45 1.15 0.40 -0.03 -0.11 0.12 -3.69 118.94 119.23 2gqi s TRP 45 Ca -0.04 1.69 0.08 0.00 1.22 0.00 0.00 56.10 59.05 2gqi s TRP 45 Cb -0.11 -3.55 -0.04 0.00 -1.50 0.00 0.00 33.47 28.26 2gqi s TRP 45 CO -0.15 -2.05 0.22 0.14 -4.62 0.00 0.00 176.95 170.49 2gqi s VAL 46 N 13.18 2.54 -0.31 5.86 -7.23 -1.03 -1.94 120.40 131.46 2gqi s VAL 46 Ca 0.93 -1.61 -0.01 0.00 -1.81 0.00 0.00 61.98 59.47 2gqi s VAL 46 Cb -0.14 -2.99 0.10 0.00 0.56 0.00 0.00 36.38 33.90 2gqi s VAL 46 CO 0.16 -0.04 0.11 -0.89 -0.31 0.00 0.00 175.10 174.14 2gqi s THR 47 N -2.53 0.71 0.46 5.32 2.01 -1.22 -1.45 115.64 118.93 2gqi s THR 47 Ca 0.42 -1.35 -0.20 0.00 0.31 0.00 0.00 61.69 60.87 2gqi s THR 47 Cb 0.01 -1.54 -0.14 0.00 0.01 0.00 0.00 72.50 70.84 2gqi s THR 47 CO 0.24 -0.71 0.15 -3.20 -0.69 0.00 0.00 174.62 170.41 2gqi n ASN 48 N 4.83 -2.57 -0.01 3.53 2.85 -1.02 -3.34 115.26 119.52 2gqi n ASN 48 Ca -0.02 0.76 -0.10 0.00 -0.11 0.00 0.00 54.58 55.12 2gqi n ASN 48 Cb 0.41 -0.95 -0.14 0.00 1.24 0.00 0.00 39.78 40.35 2gqi n ASN 48 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 2gqi h LEU 49 N 0.28 0.04 0.12 1.20 3.38 -1.81 -2.61 115.31 115.89 2gqi h LEU 49 Ca -0.40 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.48 2gqi h LEU 49 Cb 1.43 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.17 2gqi h LEU 49 CO 0.46 1.08 -0.06 -0.09 0.09 0.00 0.00 178.44 179.92 2gqi h ARG 50 N 0.01 -0.15 0.00 1.13 2.43 -1.91 -3.32 114.38 112.57 2gqi h ARG 50 Ca -0.28 0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 58.82 2gqi h ARG 50 Cb 2.01 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.58 2gqi h ARG 50 CO 0.08 -0.10 -0.37 1.79 -1.51 0.00 0.00 179.97 179.86 2gqi h THR 51 N -0.25 0.89 -4.41 0.20 1.35 -1.97 -3.47 112.91 105.26 2gqi h THR 51 Ca -0.02 -1.50 -0.27 0.00 -0.55 0.00 0.00 66.41 64.07 2gqi h THR 51 Cb 0.12 1.92 0.10 0.00 -1.73 0.00 0.00 68.15 68.55 2gqi h THR 51 CO 0.03 0.37 -0.48 -0.67 -0.25 0.00 0.00 175.52 174.51 2gqi n ASP 52 N -3.55 -4.58 -4.16 5.36 2.03 -0.98 -5.03 116.55 105.64 2gqi n ASP 52 Ca -0.00 -0.39 -0.22 0.00 0.52 0.00 0.00 54.79 54.70 2gqi n ASP 52 Cb 0.50 -3.67 -0.14 0.00 -0.72 0.00 0.00 41.12 37.09 2gqi n ASP 52 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2gqi s GLU 53 N -5.76 1.16 0.62 -0.67 2.02 -1.24 -4.93 118.70 109.89 2gqi s GLU 53 Ca 0.34 -0.69 -0.13 0.00 0.02 0.00 0.00 54.97 54.51 2gqi s GLU 53 Cb -0.15 -1.16 -0.03 0.00 0.10 0.00 0.00 34.13 32.88 2gqi s GLU 53 CO 0.51 0.30 1.04 -0.65 0.02 0.00 0.00 175.26 176.48 2gqi s GLN 54 N -0.78 3.38 -0.03 1.61 -0.21 -1.26 -2.45 119.66 119.92 2gqi s GLN 54 Ca 0.05 0.97 -0.15 0.00 0.02 0.00 0.00 55.36 56.25 2gqi s GLN 54 Cb -0.07 -2.05 0.05 0.00 1.00 0.00 0.00 33.01 31.94 2gqi s GLN 54 CO 0.00 -0.75 0.67 0.41 -2.12 0.00 0.00 175.29 173.50 2gqi n GLY 55 N -1.83 0.35 3.37 3.09 0.00 -0.53 -4.75 105.19 104.89 2gqi n GLY 55 Ca 0.07 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 2gqi n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gqi s LEU 56 N 0.00 2.74 0.08 0.99 1.43 -1.16 -2.47 118.68 120.29 2gqi s LEU 56 Ca 0.16 -0.33 0.03 0.00 -1.03 0.00 0.00 54.13 52.96 2gqi s LEU 56 Cb -0.00 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.56 2gqi s LEU 56 CO -0.01 0.16 -0.09 0.27 0.23 0.00 0.00 176.35 176.90 2gqi s ILE 57 N 0.41 0.80 0.15 -0.59 -4.36 -1.24 -4.43 121.20 111.94 2gqi s ILE 57 Ca -0.10 -1.47 -0.12 0.00 -0.26 0.00 0.00 60.65 58.70 2gqi s ILE 57 Cb -0.16 -1.14 -0.07 0.00 1.25 0.00 0.00 42.46 42.34 2gqi s ILE 57 CO 0.05 -0.51 0.52 0.54 0.24 0.00 0.00 174.94 175.78 2gqi s VAL 58 N -2.15 4.92 -2.00 8.37 0.11 -1.26 -1.58 120.40 126.80 2gqi s VAL 58 Ca 0.01 0.68 0.10 0.00 -2.93 0.00 0.00 61.98 59.83 2gqi s VAL 58 Cb -0.05 -3.69 0.27 0.00 -1.53 0.00 0.00 36.38 31.38 2gqi s VAL 58 CO -0.00 0.18 1.36 -1.84 -3.33 0.00 0.00 175.10 171.47 2gqi n GLU 59 N 0.62 0.99 -0.00 1.54 0.28 -1.25 -2.84 120.64 119.98 2gqi n GLU 59 Ca -0.05 0.00 0.10 0.00 -0.16 0.00 0.00 57.16 57.06 2gqi n GLU 59 Cb 0.52 -1.15 -0.13 0.00 1.43 0.00 0.00 31.44 32.11 2gqi n GLU 59 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2gqi n ASP 60 N -0.65 0.77 -0.14 -1.84 8.00 -1.26 -4.21 116.55 117.22 2gqi n ASP 60 Ca 0.07 -0.76 0.07 0.00 0.71 0.00 0.00 54.79 54.88 2gqi n ASP 60 Cb 0.03 1.21 -0.04 0.00 -0.02 0.00 0.00 41.12 42.30 2gqi n ASP 60 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2gqi n LEU 61 N -1.68 1.01 -4.54 0.64 4.77 -1.13 -5.01 117.00 111.06 2gqi n LEU 61 Ca 0.02 -0.62 -0.25 0.00 -0.03 0.00 0.00 56.01 55.13 2gqi n LEU 61 Cb 0.39 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.37 2gqi n LEU 61 CO 0.44 0.22 -0.29 0.68 -1.33 0.00 0.00 177.39 177.10 2gqi s VAL 62 N -2.01 1.68 0.45 4.08 -7.23 -1.24 -3.28 120.40 112.85 2gqi s VAL 62 Ca 0.08 -2.01 0.03 0.00 -1.81 0.00 0.00 61.98 58.27 2gqi s VAL 62 Cb 0.11 -2.88 -0.01 0.00 0.56 0.00 0.00 36.38 34.15 2gqi s VAL 62 CO 0.46 -0.02 0.11 -1.83 -0.31 0.00 0.00 175.10 173.50 2gqi s GLU 63 N -3.78 2.05 -0.15 4.82 4.04 -0.84 -4.89 118.70 119.95 2gqi s GLU 63 Ca 0.35 -2.28 -0.03 0.00 0.04 0.00 0.00 54.97 53.05 2gqi s GLU 63 Cb 0.09 -0.81 -0.03 0.00 0.02 0.00 0.00 34.13 33.40 2gqi s GLU 63 CO 0.17 -0.50 -0.05 -1.83 -1.84 0.00 0.00 175.26 171.21 2gqi s GLU 64 N -3.72 3.59 -0.37 -4.83 -1.05 -1.26 -2.99 118.70 108.06 2gqi s GLU 64 Ca 0.17 -0.54 0.03 0.00 -0.15 0.00 0.00 54.97 54.47 2gqi s GLU 64 Cb 0.01 -2.86 0.51 0.00 -0.44 0.00 0.00 34.13 31.35 2gqi s GLU 64 CO 0.11 0.27 1.75 1.33 0.95 0.00 0.00 175.26 179.67 2gqi n VAL 65 N 3.44 2.79 -2.50 1.83 0.24 -1.19 -4.96 118.33 117.98 2gqi n VAL 65 Ca -0.17 -1.60 -0.29 0.00 -2.04 0.00 0.00 64.34 60.23 2gqi n VAL 65 Cb 0.53 -0.66 -0.01 0.00 -1.47 0.00 0.00 33.84 32.23 2gqi n VAL 65 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2gqi s SER 66 N -0.82 6.35 0.00 -1.34 0.15 -1.26 -5.04 113.70 111.73 2gqi s SER 66 Ca 0.45 1.13 0.00 0.00 0.70 0.00 0.00 55.95 58.24 2gqi s SER 66 Cb 0.38 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 62.35 2gqi s SER 66 CO 0.08 -0.60 0.00 0.61 1.20 0.00 0.00 173.24 174.53 2gqi n GLY 67 N -2.08 -0.68 3.77 9.45 0.00 -1.26 -5.14 105.19 109.25 2gqi n GLY 67 Ca 0.03 -0.86 -0.39 0.00 0.00 0.00 0.00 46.02 44.80 2gqi n GLY 67 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gqi s PRO 68 N -0.89 4.20 -0.20 1.61 0.04 -1.26 -4.98 135.00 133.52 2gqi s PRO 68 Ca 0.00 1.95 -0.29 0.00 0.04 0.00 0.00 61.00 62.70 2gqi s PRO 68 Cb 0.00 -2.85 -0.00 0.00 0.04 0.00 0.00 34.50 31.69 2gqi s PRO 68 CO 0.00 -0.23 1.16 0.45 0.04 0.00 0.00 177.00 178.42 2gqi s SER 69 N -0.91 7.02 -0.20 6.66 0.15 -1.26 -4.92 113.70 120.23 2gqi s SER 69 Ca 0.53 1.54 -0.22 0.00 0.70 0.00 0.00 55.95 58.51 2gqi s SER 69 Cb -0.34 -2.54 -0.20 0.00 -1.71 0.00 0.00 66.02 61.24 2gqi s SER 69 CO 0.43 -0.72 0.26 -1.28 1.20 0.00 0.00 173.24 173.14 2gqi h SER 70 N 7.85 0.01 0.00 5.45 0.87 -2.06 -3.58 113.55 122.09 2gqi h SER 70 Ca -0.23 -0.55 0.00 0.00 -1.23 0.00 0.00 61.79 59.78 2gqi h SER 70 Cb 1.08 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 2gqi h SER 70 CO 0.98 1.46 0.00 0.61 -0.53 0.00 0.00 176.83 179.34