#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 3.95 -0.26 1.61 0.01 -1.26 -5.09 113.70 112.67 2gqi s SER 2 Ca 0.00 -1.55 -0.29 0.00 1.31 0.00 0.00 55.95 55.42 2gqi s SER 2 Cb 0.00 -0.92 -0.06 0.00 0.21 0.00 0.00 66.02 65.24 2gqi s SER 2 CO 0.00 -0.39 2.23 -1.54 0.41 0.00 0.00 173.24 173.96 2gqi n SER 3 N 4.81 3.00 -1.79 2.44 3.41 -1.26 -4.43 113.62 119.80 2gqi n SER 3 Ca -0.03 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 2gqi n SER 3 Cb 0.43 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.87 2gqi n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gqi n GLY 4 N 5.93 -4.99 2.90 5.00 0.00 -1.26 -5.03 105.19 107.75 2gqi n GLY 4 Ca 0.33 -0.46 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 2gqi n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gqi s SER 5 N -1.98 0.67 -0.23 1.61 0.01 -1.26 -5.05 113.70 107.47 2gqi s SER 5 Ca 0.00 -0.09 -0.10 0.00 1.31 0.00 0.00 55.95 57.07 2gqi s SER 5 Cb 0.00 -0.24 -0.10 0.00 0.21 0.00 0.00 66.02 65.89 2gqi s SER 5 CO 0.00 -0.02 -0.28 -1.54 0.41 0.00 0.00 173.24 171.81 2gqi n SER 6 N 3.61 1.71 -0.13 2.44 3.41 -1.26 -5.11 113.62 118.29 2gqi n SER 6 Ca -0.21 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2gqi n SER 6 Cb 0.54 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 2gqi n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gqi n GLY 7 N 1.67 -0.19 3.78 5.00 0.00 -1.26 -5.07 105.19 109.11 2gqi n GLY 7 Ca -0.45 -0.76 -0.38 0.00 0.00 0.00 0.00 46.02 44.43 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 -0.06 4.61 -0.09 1.61 3.52 -1.24 -4.90 118.95 122.40 2gqi s ARG 8 Ca 0.00 1.26 -0.00 0.00 -0.13 0.00 0.00 55.73 56.86 2gqi s ARG 8 Cb 0.00 -3.05 -0.03 0.00 -1.56 0.00 0.00 34.95 30.31 2gqi s ARG 8 CO 0.00 0.43 -0.06 0.50 -0.81 0.00 0.00 175.30 175.36 2gqi s ARG 9 N -1.59 3.01 0.31 5.12 3.52 -1.26 -1.15 118.95 126.92 2gqi s ARG 9 Ca 0.43 -0.53 0.03 0.00 -0.13 0.00 0.00 55.73 55.53 2gqi s ARG 9 Cb -0.21 -2.68 -0.04 0.00 -1.56 0.00 0.00 34.95 30.45 2gqi s ARG 9 CO 0.26 0.55 0.16 0.14 -0.81 0.00 0.00 175.30 175.60 2gqi s VAL 10 N -0.49 0.36 -0.01 7.11 -7.23 -1.20 -3.64 120.40 115.30 2gqi s VAL 10 Ca 0.07 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.16 2gqi s VAL 10 Cb -0.12 -2.51 0.01 0.00 0.56 0.00 0.00 36.38 34.32 2gqi s VAL 10 CO 0.02 0.00 0.17 -0.60 -0.31 0.00 0.00 175.10 174.38 2gqi s ARG 11 N -3.80 0.47 -0.55 4.82 3.52 -0.67 -2.13 118.95 120.62 2gqi s ARG 11 Ca 0.35 -0.26 -0.28 0.00 -0.13 0.00 0.00 55.73 55.40 2gqi s ARG 11 Cb 0.05 0.20 0.03 0.00 -1.56 0.00 0.00 34.95 33.67 2gqi s ARG 11 CO 0.18 -0.11 1.20 0.00 -0.81 0.00 0.00 175.30 175.76 2gqi s ALA 12 N -1.14 3.03 -0.71 6.12 0.00 0.04 -0.45 121.76 128.65 2gqi s ALA 12 Ca -0.12 -0.70 0.23 0.00 0.00 0.00 0.00 51.96 51.37 2gqi s ALA 12 Cb -0.06 -4.00 0.90 0.00 0.00 0.00 0.00 23.12 19.96 2gqi s ALA 12 CO 0.02 -2.57 1.71 0.44 0.00 0.00 0.00 175.76 175.36 2gqi n ILE 13 N 6.75 0.69 -3.70 0.00 -5.35 -0.79 -0.14 119.36 116.81 2gqi n ILE 13 Ca 0.10 0.06 -0.12 0.00 -0.27 0.00 0.00 62.75 62.52 2gqi n ILE 13 Cb 0.49 -0.89 -0.07 0.00 -1.74 0.00 0.00 39.64 37.43 2gqi n ILE 13 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2gqi s LEU 14 N -4.04 0.62 0.33 7.28 1.43 -1.25 -4.84 118.68 118.21 2gqi s LEU 14 Ca 0.08 -0.11 -0.28 0.00 -1.03 0.00 0.00 54.13 52.79 2gqi s LEU 14 Cb 0.11 1.57 -0.10 0.00 0.03 0.00 0.00 46.19 47.81 2gqi s LEU 14 CO 0.44 -0.65 1.22 -2.16 0.23 0.00 0.00 176.35 175.43 2gqi s PRO 15 N -2.60 4.36 -0.01 1.29 0.04 -1.26 -4.41 135.00 132.41 2gqi s PRO 15 Ca -0.05 2.01 -0.00 0.00 0.04 0.00 0.00 61.00 63.01 2gqi s PRO 15 Cb -0.01 -3.01 0.01 0.00 0.04 0.00 0.00 34.50 31.54 2gqi s PRO 15 CO -0.03 -0.11 0.02 -0.47 0.04 0.00 0.00 177.00 176.45 2gqi s TYR 16 N -1.21 -0.01 -0.29 0.56 5.04 -1.04 -5.00 117.35 115.40 2gqi s TYR 16 Ca 0.50 0.08 -0.11 0.00 -2.44 0.00 0.00 57.07 55.10 2gqi s TYR 16 Cb -0.35 -0.07 -0.04 0.00 0.35 0.00 0.00 41.96 41.85 2gqi s TYR 16 CO 0.46 -0.04 0.17 0.99 -1.34 0.00 0.00 175.55 175.80 2gqi s THR 17 N 0.35 5.06 1.05 4.34 2.01 -1.26 -3.13 115.64 124.05 2gqi s THR 17 Ca -0.03 -0.03 -0.11 0.00 0.31 0.00 0.00 61.69 61.83 2gqi s THR 17 Cb -0.04 -3.46 0.22 0.00 0.01 0.00 0.00 72.50 69.23 2gqi s THR 17 CO -0.01 0.20 1.08 -1.59 -0.69 0.00 0.00 174.62 173.61 2gqi s LYS 18 N 1.71 -0.03 -0.11 4.92 -2.85 -1.26 -4.99 119.74 117.13 2gqi s LYS 18 Ca 0.06 1.19 -0.05 0.00 -1.00 0.00 0.00 55.97 56.18 2gqi s LYS 18 Cb -0.16 -1.63 -0.04 0.00 -2.06 0.00 0.00 37.83 33.94 2gqi s LYS 18 CO 0.09 -3.23 0.07 0.08 0.10 0.00 0.00 175.35 172.46 2gqi s VAL 19 N -2.54 4.92 0.29 1.79 1.01 -1.26 -5.00 120.40 119.61 2gqi s VAL 19 Ca 0.68 -0.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.35 2gqi s VAL 19 Cb -0.24 -3.12 -0.10 0.00 0.00 0.00 0.00 36.38 32.92 2gqi s VAL 19 CO 0.62 0.60 1.24 -2.16 0.00 0.00 0.00 175.10 175.40 2gqi s PRO 20 N -0.82 4.45 -0.49 2.72 0.04 -1.26 -3.15 135.00 136.50 2gqi s PRO 20 Ca 0.13 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.22 2gqi s PRO 20 Cb -0.12 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2gqi s PRO 20 CO 0.03 -0.08 0.00 -3.47 0.04 0.00 0.00 177.00 173.52 2gqi n ASP 21 N 1.33 -2.42 -4.16 6.66 2.03 -1.26 -5.03 116.55 113.69 2gqi n ASP 21 Ca 0.01 0.01 -0.10 0.00 0.52 0.00 0.00 54.79 55.22 2gqi n ASP 21 Cb 0.43 -1.68 -0.10 0.00 -0.72 0.00 0.00 41.12 39.05 2gqi n ASP 21 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2gqi s THR 22 N -2.27 0.28 -0.28 5.18 -4.23 -1.19 -5.03 115.64 108.10 2gqi s THR 22 Ca 0.00 -1.91 0.02 0.00 -1.18 0.00 0.00 61.69 58.62 2gqi s THR 22 Cb 0.00 -1.98 0.30 0.00 1.34 0.00 0.00 72.50 72.16 2gqi s THR 22 CO 0.00 -0.55 1.33 0.47 -0.54 0.00 0.00 174.62 175.32 2gqi n ASP 23 N -0.10 3.27 -4.90 3.99 8.00 -1.26 -4.89 116.55 120.66 2gqi n ASP 23 Ca -0.07 -2.63 -0.34 0.00 0.71 0.00 0.00 54.79 52.46 2gqi n ASP 23 Cb 0.63 -0.63 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 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 -1.47 3.51 0.30 -1.24 2.02 -1.26 -1.83 118.70 118.73 2gqi s GLU 24 Ca 0.24 -0.21 0.10 0.00 0.02 0.00 0.00 54.97 55.12 2gqi s GLU 24 Cb 0.20 -3.07 -0.05 0.00 0.10 0.00 0.00 34.13 31.32 2gqi s GLU 24 CO 0.05 0.64 -0.00 0.96 0.02 0.00 0.00 175.26 176.93 2gqi s ILE 25 N -1.35 3.04 0.16 -1.63 -4.36 -1.25 -4.56 121.20 111.24 2gqi s ILE 25 Ca 0.29 -1.96 0.04 0.00 -0.26 0.00 0.00 60.65 58.75 2gqi s ILE 25 Cb -0.13 -2.78 -0.04 0.00 1.25 0.00 0.00 42.46 40.76 2gqi s ILE 25 CO 0.19 -0.30 0.23 -0.55 0.24 0.00 0.00 174.94 174.75 2gqi s SER 26 N -3.69 6.03 0.14 4.36 0.15 -1.26 -4.31 113.70 115.11 2gqi s SER 26 Ca 0.33 0.05 -0.14 0.00 0.70 0.00 0.00 55.95 56.89 2gqi s SER 26 Cb -0.04 -1.73 0.02 0.00 -1.71 0.00 0.00 66.02 62.56 2gqi s SER 26 CO 0.20 0.05 0.38 0.72 1.20 0.00 0.00 173.24 175.78 2gqi s PHE 27 N -1.76 -0.07 0.35 3.44 -0.12 -1.18 -4.99 117.98 113.65 2gqi s PHE 27 Ca 0.33 -0.27 0.09 0.00 -0.05 0.00 0.00 56.93 57.02 2gqi s PHE 27 Cb -0.11 0.20 -0.05 0.00 -0.63 0.00 0.00 43.02 42.43 2gqi s PHE 27 CO 0.27 -0.72 0.03 -0.51 -0.05 0.00 0.00 175.22 174.24 2gqi s LEU 28 N -2.84 3.00 -0.12 -1.99 2.01 -1.26 -2.48 118.68 114.99 2gqi s LEU 28 Ca 0.06 -1.01 -0.31 0.00 0.01 0.00 0.00 54.13 52.88 2gqi s LEU 28 Cb 0.02 -1.35 -0.09 0.00 0.01 0.00 0.00 46.19 44.78 2gqi s LEU 28 CO -0.09 -0.28 2.06 1.17 1.01 0.00 0.00 176.35 180.22 2gqi n LYS 29 N -0.99 2.21 0.00 1.70 4.81 -1.26 -0.90 118.16 123.73 2gqi n LYS 29 Ca -0.04 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 2gqi n LYS 29 Cb 0.63 -2.95 0.00 0.00 0.02 0.00 0.00 35.03 32.73 2gqi n LYS 29 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2gqi n GLY 30 N 5.15 0.67 3.74 3.14 0.00 0.80 -5.00 105.19 113.68 2gqi n GLY 30 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 2gqi n GLY 30 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gqi s ASP 31 N -1.99 6.65 0.50 1.61 1.11 -0.08 -4.72 116.67 119.76 2gqi s ASP 31 Ca 0.00 2.63 0.02 0.00 0.18 0.00 0.00 52.55 55.38 2gqi s ASP 31 Cb 0.00 -2.61 0.02 0.00 1.07 0.00 0.00 42.92 41.40 2gqi s ASP 31 CO 0.00 -0.73 0.72 -0.04 1.18 0.00 0.00 175.17 176.30 2gqi s MET 32 N 0.10 2.74 0.12 8.23 -1.94 -1.26 -0.78 119.30 126.51 2gqi s MET 32 Ca 0.62 -0.74 -0.20 0.00 -1.71 0.00 0.00 55.69 53.66 2gqi s MET 32 Cb -0.42 -2.54 0.05 0.00 2.01 0.00 0.00 34.83 33.93 2gqi s MET 32 CO 0.39 -0.52 0.51 -0.06 -0.01 0.00 0.00 175.02 175.34 2gqi s PHE 33 N -2.65 -0.39 -0.60 -0.03 0.08 -0.90 -3.54 117.98 109.94 2gqi s PHE 33 Ca 0.54 0.20 -0.00 0.00 0.12 0.00 0.00 56.93 57.78 2gqi s PHE 33 Cb -0.10 0.40 0.15 0.00 -0.57 0.00 0.00 43.02 42.90 2gqi s PHE 33 CO 0.38 -0.75 0.40 0.42 -0.10 0.00 0.00 175.22 175.56 2gqi s ILE 34 N -3.49 3.36 -0.66 0.64 1.09 -1.26 -3.22 121.20 117.68 2gqi s ILE 34 Ca 0.00 -3.15 -0.28 0.00 -1.10 0.00 0.00 60.65 56.13 2gqi s ILE 34 Cb 0.00 -3.22 -0.12 0.00 -1.06 0.00 0.00 42.46 38.06 2gqi s ILE 34 CO -0.10 -0.86 2.51 0.52 -0.10 0.00 0.00 174.94 176.90 2gqi n VAL 35 N 3.28 -0.05 -0.09 2.92 0.31 -0.30 -3.83 118.33 120.56 2gqi n VAL 35 Ca 0.08 -0.52 -0.22 0.00 -0.01 0.00 0.00 64.34 63.67 2gqi n VAL 35 Cb 0.36 -2.00 -0.12 0.00 -0.91 0.00 0.00 33.84 31.17 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 13.94 0.97 -5.11 3.52 8.25 -0.83 -3.59 115.22 132.38 2gqi n HIS 36 Ca 0.47 0.39 -0.31 0.00 -0.26 0.00 0.00 57.72 58.01 2gqi n HIS 36 Cb 0.36 -1.10 -0.15 0.00 1.12 0.00 0.00 29.99 30.22 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 -6.92 3.28 -0.39 0.41 2.47 -1.15 -4.99 114.94 107.66 2gqi s ASN 37 Ca -0.29 -0.45 -0.02 0.00 0.42 0.00 0.00 52.86 52.51 2gqi s ASN 37 Cb 0.07 -0.42 0.10 0.00 -1.45 0.00 0.00 41.25 39.54 2gqi s ASN 37 CO 0.60 0.31 0.16 -1.61 -3.72 0.00 0.00 177.10 172.84 2gqi s GLU 38 N -0.83 2.06 0.93 0.43 2.02 -1.26 -1.63 118.70 120.42 2gqi s GLU 38 Ca 0.11 -1.72 -0.13 0.00 0.02 0.00 0.00 54.97 53.25 2gqi s GLU 38 Cb -0.10 -3.50 0.15 0.00 0.10 0.00 0.00 34.13 30.78 2gqi s GLU 38 CO 0.00 -0.98 1.17 -0.51 0.02 0.00 0.00 175.26 174.96 2gqi s LEU 39 N 1.15 2.09 -0.24 1.80 2.01 -0.15 -5.02 118.68 120.32 2gqi s LEU 39 Ca 0.06 0.79 -0.01 0.00 0.01 0.00 0.00 54.13 54.98 2gqi s LEU 39 Cb -0.22 -3.04 -0.18 0.00 0.01 0.00 0.00 46.19 42.76 2gqi s LEU 39 CO -0.04 -2.61 -0.15 -0.62 1.01 0.00 0.00 176.35 173.93 2gqi n GLU 40 N -3.78 0.66 -0.18 1.70 4.71 -1.26 -4.30 120.64 118.19 2gqi n GLU 40 Ca 0.09 0.18 0.30 0.00 -0.01 0.00 0.00 57.16 57.71 2gqi n GLU 40 Cb 0.60 -1.55 0.69 0.00 -1.01 0.00 0.00 31.44 30.17 2gqi n GLU 40 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 2gqi h ASP 41 N -0.08 0.00 0.00 1.62 5.19 -2.04 -3.42 116.42 117.68 2gqi h ASP 41 Ca -0.57 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.84 2gqi h ASP 41 Cb 1.89 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.40 2gqi h ASP 41 CO -0.10 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.63 2gqi n GLY 42 N -1.67 1.45 3.32 2.75 0.00 -1.26 -5.13 105.19 104.65 2gqi n GLY 42 Ca 0.20 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.67 1.56 -0.17 1.61 0.52 -1.26 -3.61 118.94 115.93 2gqi s TRP 43 Ca 0.00 -1.17 -0.06 0.00 0.02 0.00 0.00 56.10 54.89 2gqi s TRP 43 Cb 0.00 -0.92 0.08 0.00 -1.15 0.00 0.00 33.47 31.48 2gqi s TRP 43 CO 0.00 -0.32 0.34 -1.64 0.02 0.00 0.00 176.95 175.36 2gqi s MET 44 N -4.03 0.24 -0.69 4.98 -1.94 -1.04 -0.98 119.30 115.85 2gqi s MET 44 Ca 0.38 0.90 -0.26 0.00 -1.71 0.00 0.00 55.69 55.00 2gqi s MET 44 Cb 0.08 0.16 -0.05 0.00 2.01 0.00 0.00 34.83 37.03 2gqi s MET 44 CO 0.14 -0.27 2.03 -0.46 -0.01 0.00 0.00 175.02 176.45 2gqi s TRP 45 N 2.52 1.55 0.46 -0.03 -0.11 -0.64 -3.81 118.94 118.88 2gqi s TRP 45 Ca -0.00 0.99 0.07 0.00 1.22 0.00 0.00 56.10 58.38 2gqi s TRP 45 Cb -0.12 -3.93 -0.01 0.00 -1.50 0.00 0.00 33.47 27.91 2gqi s TRP 45 CO -0.11 -2.12 0.36 0.14 -4.62 0.00 0.00 176.95 170.61 2gqi s VAL 46 N 10.42 2.29 -0.35 5.86 -7.23 -1.23 -1.96 120.40 128.20 2gqi s VAL 46 Ca 0.75 -1.44 0.01 0.00 -1.81 0.00 0.00 61.98 59.49 2gqi s VAL 46 Cb -0.12 -2.73 0.11 0.00 0.56 0.00 0.00 36.38 34.21 2gqi s VAL 46 CO 0.14 0.00 0.12 -0.89 -0.31 0.00 0.00 175.10 174.17 2gqi s THR 47 N -2.59 1.26 0.05 5.32 2.01 -1.25 -2.70 115.64 117.75 2gqi s THR 47 Ca 0.43 -1.86 -0.38 0.00 0.31 0.00 0.00 61.69 60.20 2gqi s THR 47 Cb -0.02 -1.93 -0.17 0.00 0.01 0.00 0.00 72.50 70.39 2gqi s THR 47 CO 0.25 -0.72 1.29 -3.20 -0.69 0.00 0.00 174.62 171.56 2gqi n ASN 48 N 4.41 1.27 0.09 3.53 2.85 -0.27 -3.98 115.26 123.16 2gqi n ASN 48 Ca 0.02 1.13 -0.06 0.00 -0.11 0.00 0.00 54.58 55.56 2gqi n ASN 48 Cb 0.40 -1.12 0.06 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 4.27 0.18 0.41 1.20 3.38 -1.89 0.38 115.31 123.23 2gqi h LEU 49 Ca -0.48 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.34 2gqi h LEU 49 Cb 1.36 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.06 2gqi h LEU 49 CO 0.75 0.87 -0.20 -0.09 0.09 0.00 0.00 178.44 179.87 2gqi h ARG 50 N 0.09 -0.53 0.00 1.13 2.43 -1.89 -3.30 114.38 112.32 2gqi h ARG 50 Ca -0.02 0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2gqi h ARG 50 Cb 1.33 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 31.00 2gqi h ARG 50 CO 0.11 -0.35 -0.01 1.79 -1.51 0.00 0.00 179.97 180.00 2gqi h THR 51 N -1.10 0.01 -5.13 0.20 1.35 -1.95 -3.47 112.91 102.83 2gqi h THR 51 Ca -0.06 -0.80 -0.40 0.00 -0.55 0.00 0.00 66.41 64.60 2gqi h THR 51 Cb 0.42 1.79 0.10 0.00 -1.73 0.00 0.00 68.15 68.73 2gqi h THR 51 CO 0.09 0.01 -0.64 -0.67 -0.25 0.00 0.00 175.52 174.06 2gqi n ASP 52 N -3.10 -6.27 -4.42 5.36 2.03 0.13 -5.00 116.55 105.29 2gqi n ASP 52 Ca 0.02 -0.41 -0.21 0.00 0.52 0.00 0.00 54.79 54.72 2gqi n ASP 52 Cb 0.43 -4.99 -0.10 0.00 -0.72 0.00 0.00 41.12 35.74 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 -6.00 1.53 0.22 -0.67 2.02 -1.17 -4.92 118.70 109.71 2gqi s GLU 53 Ca 0.44 -1.78 0.08 0.00 0.02 0.00 0.00 54.97 53.73 2gqi s GLU 53 Cb -0.20 -1.04 -0.04 0.00 0.10 0.00 0.00 34.13 32.95 2gqi s GLU 53 CO 0.55 -0.01 0.05 -0.65 0.02 0.00 0.00 175.26 175.22 2gqi s GLN 54 N -3.77 2.51 0.00 1.61 1.11 -1.26 -1.12 119.66 118.74 2gqi s GLN 54 Ca 0.30 -1.19 0.00 0.00 0.01 0.00 0.00 55.36 54.48 2gqi s GLN 54 Cb 0.05 -2.35 0.00 0.00 -1.01 0.00 0.00 33.01 29.70 2gqi s GLN 54 CO 0.12 0.42 0.00 0.41 0.01 0.00 0.00 175.29 176.24 2gqi n GLY 55 N -0.62 -0.77 3.22 3.09 0.00 -1.10 -4.77 105.19 104.24 2gqi n GLY 55 Ca -0.08 -0.32 -0.27 0.00 0.00 0.00 0.00 46.02 45.35 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 2.04 0.03 0.99 1.43 -0.76 -3.54 118.68 118.87 2gqi s LEU 56 Ca 0.00 -0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 52.68 2gqi s LEU 56 Cb 0.00 -1.05 -0.01 0.00 0.03 0.00 0.00 46.19 45.15 2gqi s LEU 56 CO 0.00 0.25 0.08 0.27 0.23 0.00 0.00 176.35 177.18 2gqi s ILE 57 N -0.49 0.12 0.12 -0.59 -4.36 -1.25 -3.85 121.20 110.91 2gqi s ILE 57 Ca 0.08 -1.02 -0.13 0.00 -0.26 0.00 0.00 60.65 59.32 2gqi s ILE 57 Cb -0.08 -0.74 -0.07 0.00 1.25 0.00 0.00 42.46 42.83 2gqi s ILE 57 CO -0.01 -0.56 0.51 0.54 0.24 0.00 0.00 174.94 175.66 2gqi s VAL 58 N -2.25 4.91 -1.04 8.37 0.11 -1.26 -2.48 120.40 126.75 2gqi s VAL 58 Ca -0.08 0.76 0.23 0.00 -2.93 0.00 0.00 61.98 59.96 2gqi s VAL 58 Cb -0.03 -3.72 0.22 0.00 -1.53 0.00 0.00 36.38 31.31 2gqi s VAL 58 CO -0.03 0.28 1.75 -1.84 -3.33 0.00 0.00 175.10 171.93 2gqi n GLU 59 N 0.89 0.03 0.00 1.54 0.28 -1.24 -2.59 120.64 119.56 2gqi n GLU 59 Ca -0.06 0.10 0.14 0.00 -0.16 0.00 0.00 57.16 57.17 2gqi n GLU 59 Cb 0.52 -1.50 0.60 0.00 1.43 0.00 0.00 31.44 32.48 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 -1.48 0.28 -0.00 -1.84 8.00 -1.26 -3.50 116.55 116.75 2gqi n ASP 60 Ca 0.06 -0.21 0.05 0.00 0.71 0.00 0.00 54.79 55.40 2gqi n ASP 60 Cb 0.26 -0.17 -0.08 0.00 -0.02 0.00 0.00 41.12 41.12 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 -1.21 0.04 -4.70 0.64 4.77 -1.07 -5.01 117.00 110.46 2gqi n LEU 61 Ca 0.12 -0.04 -0.26 0.00 -0.03 0.00 0.00 56.01 55.80 2gqi n LEU 61 Cb 0.29 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.31 2gqi n LEU 61 CO 0.26 0.01 -0.30 0.68 -1.33 0.00 0.00 177.39 176.71 2gqi s VAL 62 N -2.64 3.90 0.02 4.08 -7.23 -1.21 -1.88 120.40 115.44 2gqi s VAL 62 Ca -0.03 -1.41 0.02 0.00 -1.81 0.00 0.00 61.98 58.75 2gqi s VAL 62 Cb 0.07 -2.99 -0.02 0.00 0.56 0.00 0.00 36.38 34.00 2gqi s VAL 62 CO 0.42 -0.16 -0.06 -1.83 -0.31 0.00 0.00 175.10 173.17 2gqi s GLU 63 N -3.12 0.42 0.16 4.82 -1.05 0.41 -4.85 118.70 115.48 2gqi s GLU 63 Ca 0.29 -0.51 -0.33 0.00 -0.15 0.00 0.00 54.97 54.27 2gqi s GLU 63 Cb -0.09 -0.25 -0.13 0.00 -0.44 0.00 0.00 34.13 33.23 2gqi s GLU 63 CO 0.20 0.05 1.69 0.39 0.95 0.00 0.00 175.26 178.54 2gqi n GLU 64 N 2.05 2.47 -4.99 -4.83 4.71 -1.26 -1.68 120.64 117.11 2gqi n GLU 64 Ca -0.19 0.89 -0.32 0.00 -0.01 0.00 0.00 57.16 57.53 2gqi n GLU 64 Cb 0.56 -2.71 -0.16 0.00 -1.01 0.00 0.00 31.44 28.12 2gqi n GLU 64 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2gqi s VAL 65 N 1.45 2.43 -1.38 2.62 0.11 -1.24 -4.67 120.40 119.73 2gqi s VAL 65 Ca 0.79 -0.88 -0.12 0.00 -2.93 0.00 0.00 61.98 58.84 2gqi s VAL 65 Cb -0.59 -1.97 0.10 0.00 -1.53 0.00 0.00 36.38 32.38 2gqi s VAL 65 CO 0.37 0.54 0.58 -0.24 -3.33 0.00 0.00 175.10 173.02 2gqi n SER 66 N 3.59 -3.57 -2.99 3.54 2.88 -1.26 -4.84 113.62 110.97 2gqi n SER 66 Ca -0.19 -0.56 0.00 0.00 -1.33 0.00 0.00 58.87 56.79 2gqi n SER 66 Cb 0.53 -2.95 0.00 0.00 -0.75 0.00 0.00 64.21 61.04 2gqi n SER 66 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gqi n GLY 67 N -1.23 -0.58 0.00 0.46 0.00 -1.26 -4.88 105.19 97.70 2gqi n GLY 67 Ca 0.02 -1.62 0.07 0.00 0.00 0.00 0.00 46.02 44.49 2gqi n GLY 67 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2gqi n PRO 68 N 0.00 0.49 -3.78 1.61 -0.04 -1.26 -4.06 135.00 127.96 2gqi n PRO 68 Ca 0.00 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.18 2gqi n PRO 68 Cb 0.00 -1.44 -0.12 0.00 -0.04 0.00 0.00 33.50 31.90 2gqi n PRO 68 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2gqi s SER 69 N -1.94 3.89 -0.48 3.54 0.15 -1.26 -5.06 113.70 112.53 2gqi s SER 69 Ca 0.21 -3.31 -0.33 0.00 0.70 0.00 0.00 55.95 53.22 2gqi s SER 69 Cb 0.10 -1.29 -0.16 0.00 -1.71 0.00 0.00 66.02 62.96 2gqi s SER 69 CO 0.16 -0.16 1.80 -1.20 1.20 0.00 0.00 173.24 175.04 2gqi n SER 70 N 2.65 0.52 -0.27 5.45 7.64 -1.26 -4.89 113.62 123.47 2gqi n SER 70 Ca 0.17 0.46 0.15 0.00 1.01 0.00 0.00 58.87 60.65 2gqi n SER 70 Cb 0.37 -0.72 0.71 0.00 -1.01 0.00 0.00 64.21 63.56 2gqi n SER 70 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64