#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gqi n SER 2 N 0.00 -0.95 -4.21 1.61 3.41 -1.26 -4.88 113.62 107.34 2gqi n SER 2 Ca 0.00 -0.99 -0.30 0.00 -0.26 0.00 0.00 58.87 57.32 2gqi n SER 2 Cb 0.00 -1.26 -0.17 0.00 -0.26 0.00 0.00 64.21 62.52 2gqi n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2gqi s SER 3 N -3.07 2.82 -0.02 4.04 1.04 -1.26 -5.13 113.70 112.12 2gqi s SER 3 Ca 0.52 -0.49 0.01 0.00 0.48 0.00 0.00 55.95 56.47 2gqi s SER 3 Cb -0.30 -1.03 0.01 0.00 0.10 0.00 0.00 66.02 64.81 2gqi s SER 3 CO 0.81 0.18 -0.04 -0.83 0.98 0.00 0.00 173.24 174.34 2gqi s GLY 4 N 0.14 0.33 -0.23 7.32 0.00 -1.26 -5.04 107.32 108.58 2gqi s GLY 4 Ca -0.11 -0.07 -0.10 0.00 0.00 0.00 0.00 44.72 44.45 2gqi s GLY 4 CO 0.06 0.22 -0.07 -1.26 0.00 0.00 0.00 173.10 172.04 2gqi n SER 5 N 3.62 1.98 -4.44 1.64 2.88 -1.26 -4.89 113.62 113.16 2gqi n SER 5 Ca -0.21 0.20 -0.36 0.00 -1.33 0.00 0.00 58.87 57.17 2gqi n SER 5 Cb 0.53 -0.75 -0.13 0.00 -0.75 0.00 0.00 64.21 63.12 2gqi n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2gqi s SER 6 N -7.02 5.10 -0.95 -3.46 0.01 -1.26 -5.04 113.70 101.08 2gqi s SER 6 Ca -0.33 -0.23 -0.07 0.00 1.31 0.00 0.00 55.95 56.63 2gqi s SER 6 Cb 0.10 -1.92 0.24 0.00 0.21 0.00 0.00 66.02 64.65 2gqi s SER 6 CO 0.59 -0.04 0.89 -0.83 0.41 0.00 0.00 173.24 174.26 2gqi s GLY 7 N 1.61 3.01 0.76 3.44 0.00 -1.26 -5.02 107.32 109.86 2gqi s GLY 7 Ca 0.06 -3.69 -0.17 0.00 0.00 0.00 0.00 44.72 40.92 2gqi s GLY 7 CO 0.03 1.26 -0.32 -2.13 0.00 0.00 0.00 173.10 171.94 2gqi n ARG 8 N 2.91 0.03 -4.78 2.90 0.63 -1.25 -4.69 116.66 112.41 2gqi n ARG 8 Ca 0.20 0.02 -0.29 0.00 -0.92 0.00 0.00 57.85 56.85 2gqi n ARG 8 Cb 0.40 -1.13 -0.14 0.00 0.45 0.00 0.00 32.46 32.04 2gqi n ARG 8 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2gqi s ARG 9 N -1.73 1.66 0.05 -0.14 1.81 -1.26 -2.15 118.95 117.19 2gqi s ARG 9 Ca 0.51 -1.11 -0.03 0.00 -1.72 0.00 0.00 55.73 53.38 2gqi s ARG 9 Cb -0.33 -1.86 -0.03 0.00 -0.45 0.00 0.00 34.95 32.28 2gqi s ARG 9 CO 0.72 0.48 0.03 0.14 -0.68 0.00 0.00 175.30 175.99 2gqi s VAL 10 N -0.84 0.18 0.01 3.52 -7.23 -1.25 -2.40 120.40 112.39 2gqi s VAL 10 Ca 0.11 -1.44 0.02 0.00 -1.81 0.00 0.00 61.98 58.86 2gqi s VAL 10 Cb -0.10 -1.19 -0.01 0.00 0.56 0.00 0.00 36.38 35.64 2gqi s VAL 10 CO 0.02 -0.80 -0.07 -0.60 -0.31 0.00 0.00 175.10 173.35 2gqi s ARG 11 N -3.30 0.52 -0.63 4.82 3.52 -1.13 -1.90 118.95 120.85 2gqi s ARG 11 Ca 0.01 -0.37 -0.25 0.00 -0.13 0.00 0.00 55.73 54.99 2gqi s ARG 11 Cb 0.03 -0.46 0.04 0.00 -1.56 0.00 0.00 34.95 33.00 2gqi s ARG 11 CO -0.08 0.12 1.09 0.00 -0.81 0.00 0.00 175.30 175.63 2gqi s ALA 12 N -0.46 3.00 0.29 6.12 0.00 -0.77 -2.22 121.76 127.72 2gqi s ALA 12 Ca -0.01 -1.31 0.34 0.00 0.00 0.00 0.00 51.96 50.98 2gqi s ALA 12 Cb -0.04 -3.97 1.59 0.00 0.00 0.00 0.00 23.12 20.69 2gqi s ALA 12 CO -0.00 -2.78 2.08 -0.84 0.00 0.00 0.00 175.76 174.22 2gqi h ILE 13 N 6.04 0.16 -3.91 0.00 3.07 -1.85 0.15 117.51 121.18 2gqi h ILE 13 Ca -0.27 -0.46 -0.11 0.00 1.55 0.00 0.00 64.86 65.56 2gqi h ILE 13 Cb 1.06 1.39 -0.16 0.00 -0.27 0.00 0.00 36.82 38.84 2gqi h ILE 13 CO 1.18 0.04 -0.52 -0.76 -1.05 0.00 0.00 178.15 177.04 2gqi s LEU 14 N -6.44 1.87 0.53 0.16 1.43 -1.25 -4.76 118.68 110.22 2gqi s LEU 14 Ca -0.01 -0.67 -0.20 0.00 -1.03 0.00 0.00 54.13 52.22 2gqi s LEU 14 Cb 0.11 0.61 -0.06 0.00 0.03 0.00 0.00 46.19 46.88 2gqi s LEU 14 CO 0.53 -0.58 1.14 -2.16 0.23 0.00 0.00 176.35 175.50 2gqi s PRO 15 N -3.22 3.44 0.08 1.29 0.04 -1.26 -4.45 135.00 130.92 2gqi s PRO 15 Ca 0.00 1.65 0.04 0.00 0.04 0.00 0.00 61.00 62.73 2gqi s PRO 15 Cb 0.02 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 2gqi s PRO 15 CO -0.07 -0.79 -0.11 -0.47 0.04 0.00 0.00 177.00 175.60 2gqi s TYR 16 N -1.72 1.07 -0.47 0.56 5.04 -1.16 -4.99 117.35 115.67 2gqi s TYR 16 Ca 0.71 -0.57 -0.01 0.00 -2.44 0.00 0.00 57.07 54.76 2gqi s TYR 16 Cb -0.25 -0.59 0.12 0.00 0.35 0.00 0.00 41.96 41.59 2gqi s TYR 16 CO 0.28 0.01 0.24 0.99 -1.34 0.00 0.00 175.55 175.74 2gqi s THR 17 N -1.94 3.11 0.81 4.34 2.01 -1.26 -3.98 115.64 118.72 2gqi s THR 17 Ca 0.01 -2.52 -0.17 0.00 0.31 0.00 0.00 61.69 59.32 2gqi s THR 17 Cb -0.06 -3.13 -0.11 0.00 0.01 0.00 0.00 72.50 69.21 2gqi s THR 17 CO 0.01 -0.74 -0.24 2.29 -0.69 0.00 0.00 174.62 175.26 2gqi n LYS 18 N 4.04 0.03 -3.49 4.92 2.85 -1.26 -4.93 118.16 120.31 2gqi n LYS 18 Ca 0.03 0.02 -0.38 0.00 -1.05 0.00 0.00 58.31 56.93 2gqi n LYS 18 Cb 0.39 -1.25 -0.06 0.00 -0.65 0.00 0.00 35.03 33.46 2gqi n LYS 18 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2gqi s VAL 19 N -2.03 5.05 0.31 0.58 1.01 -1.26 -4.99 120.40 119.07 2gqi s VAL 19 Ca 0.51 0.83 -0.29 0.00 0.00 0.00 0.00 61.98 63.04 2gqi s VAL 19 Cb -0.30 -3.71 -0.10 0.00 0.00 0.00 0.00 36.38 32.26 2gqi s VAL 19 CO 0.72 0.55 1.23 -2.16 0.00 0.00 0.00 175.10 175.44 2gqi s PRO 20 N -0.90 4.46 -0.65 2.72 0.04 -1.26 -3.42 135.00 135.99 2gqi s PRO 20 Ca 0.24 2.06 -0.04 0.00 0.04 0.00 0.00 61.00 63.29 2gqi s PRO 20 Cb -0.16 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.26 2gqi s PRO 20 CO 0.13 -0.04 0.56 -3.47 0.04 0.00 0.00 177.00 174.22 2gqi n ASP 21 N 1.00 -4.08 -3.20 6.66 -0.08 -1.26 -5.03 116.55 110.57 2gqi n ASP 21 Ca -0.00 -0.26 -0.13 0.00 -1.51 0.00 0.00 54.79 52.89 2gqi n ASP 21 Cb 0.43 -2.66 -0.02 0.00 2.34 0.00 0.00 41.12 41.21 2gqi n ASP 21 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2gqi s THR 22 N -3.15 0.00 -0.49 5.18 -4.23 -1.22 -5.04 115.64 106.68 2gqi s THR 22 Ca 0.28 -1.41 0.24 0.00 -1.18 0.00 0.00 61.69 59.62 2gqi s THR 22 Cb -0.12 -2.68 0.10 0.00 1.34 0.00 0.00 72.50 71.14 2gqi s THR 22 CO 0.35 0.00 1.33 0.44 -0.54 0.00 0.00 174.62 176.19 2gqi h ASP 23 N 2.08 0.00 -1.59 3.99 3.32 -1.96 -3.48 116.42 118.79 2gqi h ASP 23 Ca -0.29 -0.09 -0.65 0.00 0.02 0.00 0.00 57.03 56.01 2gqi h ASP 23 Cb 1.24 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.90 2gqi h ASP 23 CO 0.39 0.05 -0.19 -0.62 -1.72 0.00 0.00 179.24 177.15 2gqi n GLU 24 N -2.45 0.58 -4.26 3.56 1.02 -1.26 -4.29 120.64 113.54 2gqi n GLU 24 Ca 0.03 0.20 -0.28 0.00 -0.02 0.00 0.00 57.16 57.09 2gqi n GLU 24 Cb 0.49 -1.41 -0.10 0.00 -0.02 0.00 0.00 31.44 30.40 2gqi n GLU 24 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2gqi s ILE 25 N -0.87 3.23 -0.02 -3.67 -4.36 -1.26 -4.55 121.20 109.69 2gqi s ILE 25 Ca 0.65 -1.47 -0.10 0.00 -0.26 0.00 0.00 60.65 59.47 2gqi s ILE 25 Cb -0.87 -2.55 -0.05 0.00 1.25 0.00 0.00 42.46 40.25 2gqi s ILE 25 CO 0.57 0.01 0.30 -0.94 0.24 0.00 0.00 174.94 175.12 2gqi s SER 26 N -2.48 6.59 0.17 4.36 1.04 -1.26 -4.34 113.70 117.79 2gqi s SER 26 Ca 0.22 0.70 -0.04 0.00 0.48 0.00 0.00 55.95 57.32 2gqi s SER 26 Cb -0.10 -2.15 -0.03 0.00 0.10 0.00 0.00 66.02 63.84 2gqi s SER 26 CO 0.14 0.32 0.17 0.72 0.98 0.00 0.00 173.24 175.57 2gqi s PHE 27 N -1.15 0.82 0.33 5.02 -0.71 -1.26 -5.00 117.98 116.02 2gqi s PHE 27 Ca 0.23 -1.13 0.09 0.00 -1.04 0.00 0.00 56.93 55.08 2gqi s PHE 27 Cb -0.14 -0.35 -0.05 0.00 -1.21 0.00 0.00 43.02 41.27 2gqi s PHE 27 CO 0.12 -0.65 0.01 -0.51 -1.34 0.00 0.00 175.22 172.84 2gqi s LEU 28 N -3.07 3.00 0.07 -1.99 2.01 -1.26 -2.99 118.68 114.45 2gqi s LEU 28 Ca 0.28 -0.94 -0.32 0.00 0.01 0.00 0.00 54.13 53.16 2gqi s LEU 28 Cb 0.06 -1.40 -0.11 0.00 0.01 0.00 0.00 46.19 44.75 2gqi s LEU 28 CO 0.06 -0.20 1.87 1.17 1.01 0.00 0.00 176.35 180.26 2gqi n LYS 29 N -0.94 2.68 0.00 1.70 4.81 -1.26 -1.47 118.16 123.69 2gqi n LYS 29 Ca -0.04 0.98 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 2gqi n LYS 29 Cb 0.62 -2.88 0.00 0.00 0.02 0.00 0.00 35.03 32.79 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 4.30 2.82 3.69 3.14 0.00 0.53 -5.01 105.19 114.67 2gqi n GLY 30 Ca 0.19 0.00 -0.44 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 3.03 -4.87 1.61 9.92 -0.54 -4.67 116.55 121.03 2gqi n ASP 31 Ca 0.00 1.15 -0.27 0.00 -0.53 0.00 0.00 54.79 55.14 2gqi n ASP 31 Cb 0.00 -1.47 -0.04 0.00 -0.64 0.00 0.00 41.12 38.96 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 -0.56 3.18 0.24 -1.24 -1.94 -1.26 -1.85 119.30 115.87 2gqi s MET 32 Ca 0.66 -0.70 0.04 0.00 -1.71 0.00 0.00 55.69 53.98 2gqi s MET 32 Cb -0.60 -2.82 -0.02 0.00 2.01 0.00 0.00 34.83 33.40 2gqi s MET 32 CO 0.50 0.52 0.15 1.19 -0.01 0.00 0.00 175.02 177.37 2gqi n PHE 33 N -0.32 -0.26 -3.67 -0.03 3.01 -0.80 -1.56 117.46 113.83 2gqi n PHE 33 Ca -0.07 -1.82 -0.30 0.00 1.01 0.00 0.00 57.45 56.27 2gqi n PHE 33 Cb 0.54 0.11 -0.15 0.00 -0.01 0.00 0.00 39.48 39.97 2gqi n PHE 33 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2gqi s ILE 34 N -2.76 0.67 -0.24 4.37 1.01 -1.13 -3.85 121.20 119.26 2gqi s ILE 34 Ca 0.21 -1.37 -0.28 0.00 0.00 0.00 0.00 60.65 59.21 2gqi s ILE 34 Cb 0.01 -1.51 -0.05 0.00 0.01 0.00 0.00 42.46 40.92 2gqi s ILE 34 CO 0.15 -0.73 2.23 -0.69 0.00 0.00 0.00 174.94 175.90 2gqi s VAL 35 N 1.58 3.01 -0.25 2.92 1.01 -0.91 -3.49 120.40 124.28 2gqi s VAL 35 Ca 0.11 0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.08 2gqi s VAL 35 Cb -0.18 -3.02 -0.15 0.00 0.00 0.00 0.00 36.38 33.03 2gqi s VAL 35 CO -0.24 -0.01 -0.25 1.41 0.00 0.00 0.00 175.10 176.01 2gqi n HIS 36 N 12.03 0.00 -4.39 5.22 8.25 -0.85 -3.83 115.22 131.65 2gqi n HIS 36 Ca 0.30 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.53 2gqi n HIS 36 Cb 0.46 -0.94 -0.13 0.00 1.12 0.00 0.00 29.99 30.50 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 -6.61 2.29 -0.35 0.41 2.47 -1.19 -4.99 114.94 106.97 2gqi s ASN 37 Ca -0.34 -0.59 -0.02 0.00 0.42 0.00 0.00 52.86 52.33 2gqi s ASN 37 Cb 0.10 -0.14 0.08 0.00 -1.45 0.00 0.00 41.25 39.83 2gqi s ASN 37 CO 0.54 0.07 0.10 -1.61 -3.72 0.00 0.00 177.10 172.47 2gqi s GLU 38 N -1.54 2.20 0.68 0.43 2.02 -1.26 -2.04 118.70 119.19 2gqi s GLU 38 Ca 0.05 -1.53 -0.11 0.00 0.02 0.00 0.00 54.97 53.40 2gqi s GLU 38 Cb -0.09 -3.37 0.16 0.00 0.10 0.00 0.00 34.13 30.93 2gqi s GLU 38 CO 0.03 -0.83 0.73 1.28 0.02 0.00 0.00 175.26 176.49 2gqi n LEU 39 N 4.60 0.00 -0.03 1.80 7.99 -0.49 -5.01 117.00 125.87 2gqi n LEU 39 Ca -0.07 -0.79 -0.03 0.00 -0.01 0.00 0.00 56.01 55.11 2gqi n LEU 39 Cb 0.42 -0.62 -0.04 0.00 -0.11 0.00 0.00 43.42 43.08 2gqi n LEU 39 CO 0.29 -1.43 -0.68 -1.84 -1.51 0.00 0.00 177.39 172.23 2gqi n GLU 40 N -3.17 2.75 0.00 3.23 0.00 -1.26 -4.53 120.64 117.66 2gqi n GLU 40 Ca 0.10 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.29 2gqi n GLU 40 Cb 0.36 -1.14 0.12 0.00 0.00 0.00 0.00 31.44 30.78 2gqi n GLU 40 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2gqi n ASP 41 N -2.26 0.00 0.00 -1.84 -0.08 -1.26 -4.75 116.55 106.36 2gqi n ASP 41 Ca -0.09 0.43 0.00 0.00 -1.51 0.00 0.00 54.79 53.62 2gqi n ASP 41 Cb 0.67 -0.45 0.00 0.00 2.34 0.00 0.00 41.12 43.68 2gqi n ASP 41 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2gqi n GLY 42 N -0.91 1.83 3.44 0.27 0.00 -1.26 -5.08 105.19 103.48 2gqi n GLY 42 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 1.75 -0.26 1.61 0.52 -1.26 -2.76 118.94 116.54 2gqi s TRP 43 Ca 0.00 -1.30 -0.06 0.00 0.02 0.00 0.00 56.10 54.75 2gqi s TRP 43 Cb 0.00 -1.06 0.13 0.00 -1.15 0.00 0.00 33.47 31.39 2gqi s TRP 43 CO 0.00 -0.37 0.54 -1.64 0.02 0.00 0.00 176.95 175.50 2gqi s MET 44 N -3.74 0.48 -0.75 4.98 -1.94 -1.03 -1.39 119.30 115.91 2gqi s MET 44 Ca 0.29 1.14 -0.26 0.00 -1.71 0.00 0.00 55.69 55.16 2gqi s MET 44 Cb 0.04 0.50 -0.14 0.00 2.01 0.00 0.00 34.83 37.24 2gqi s MET 44 CO 0.16 -0.35 2.41 1.87 -0.01 0.00 0.00 175.02 179.11 2gqi n TRP 45 N 5.42 1.17 -3.70 -0.03 -0.00 -0.87 -3.88 117.44 115.55 2gqi n TRP 45 Ca -0.08 0.00 -0.24 0.00 -0.00 0.00 0.00 57.50 57.18 2gqi n TRP 45 Cb 0.50 -2.57 0.00 0.00 -0.00 0.00 0.00 31.31 29.24 2gqi n TRP 45 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 177.69 177.83 2gqi s VAL 46 N 14.08 1.88 -0.06 5.87 -7.23 -1.10 -2.00 120.40 131.83 2gqi s VAL 46 Ca 0.95 -1.39 -0.02 0.00 -1.81 0.00 0.00 61.98 59.72 2gqi s VAL 46 Cb -0.16 -2.27 0.03 0.00 0.56 0.00 0.00 36.38 34.54 2gqi s VAL 46 CO 0.12 0.00 0.02 -0.89 -0.31 0.00 0.00 175.10 174.04 2gqi s THR 47 N -2.71 0.25 0.28 5.32 2.01 -1.23 -2.21 115.64 117.34 2gqi s THR 47 Ca 0.41 0.20 -0.30 0.00 0.31 0.00 0.00 61.69 62.31 2gqi s THR 47 Cb -0.03 -0.44 -0.11 0.00 0.01 0.00 0.00 72.50 71.94 2gqi s THR 47 CO 0.25 0.23 1.54 0.21 -0.69 0.00 0.00 174.62 176.16 2gqi s ASN 48 N 2.02 6.47 0.35 3.53 3.84 -0.57 -2.85 114.94 127.74 2gqi s ASN 48 Ca 0.05 2.85 0.25 0.00 0.21 0.00 0.00 52.86 56.22 2gqi s ASN 48 Cb -0.12 -2.63 0.63 0.00 -0.55 0.00 0.00 41.25 38.58 2gqi s ASN 48 CO -0.05 -0.84 1.71 -0.07 -2.79 0.00 0.00 177.10 175.06 2gqi h LEU 49 N 4.92 0.00 0.00 3.21 3.38 -1.64 0.27 115.31 125.45 2gqi h LEU 49 Ca -0.47 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.36 2gqi h LEU 49 Cb 1.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 2gqi h LEU 49 CO 0.79 0.00 -0.88 -0.09 0.09 0.00 0.00 178.44 178.35 2gqi h ARG 50 N 0.00 0.00 0.00 1.13 2.43 -1.90 -3.38 114.38 112.65 2gqi h ARG 50 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2gqi h ARG 50 Cb 0.83 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 2gqi h ARG 50 CO 0.00 0.75 -0.44 1.79 -1.51 0.00 0.00 179.97 180.56 2gqi h THR 51 N -1.00 0.00 -3.90 0.20 1.35 -1.95 -3.47 112.91 104.13 2gqi h THR 51 Ca -0.21 -0.97 -0.41 0.00 -0.55 0.00 0.00 66.41 64.27 2gqi h THR 51 Cb 1.04 1.74 0.03 0.00 -1.73 0.00 0.00 68.15 69.23 2gqi h THR 51 CO -0.13 0.00 -0.58 0.47 -0.25 0.00 0.00 175.52 175.03 2gqi n ASP 52 N -2.87 -6.09 -4.51 5.36 8.00 0.95 -4.99 116.55 112.40 2gqi n ASP 52 Ca 0.02 -0.19 -0.24 0.00 0.71 0.00 0.00 54.79 55.10 2gqi n ASP 52 Cb 0.53 -4.98 -0.10 0.00 -0.02 0.00 0.00 41.12 36.56 2gqi n ASP 52 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2gqi s GLU 53 N -5.45 1.79 0.14 -1.24 2.02 -1.23 -4.89 118.70 109.84 2gqi s GLU 53 Ca 0.19 -1.75 0.03 0.00 0.02 0.00 0.00 54.97 53.46 2gqi s GLU 53 Cb -0.08 -1.82 -0.04 0.00 0.10 0.00 0.00 34.13 32.29 2gqi s GLU 53 CO 0.23 0.30 0.25 -0.65 0.02 0.00 0.00 175.26 175.41 2gqi s GLN 54 N -3.55 3.35 0.02 1.61 -0.21 -1.26 -1.50 119.66 118.12 2gqi s GLN 54 Ca 0.31 -0.62 -0.16 0.00 0.02 0.00 0.00 55.36 54.91 2gqi s GLN 54 Cb -0.04 -2.92 0.05 0.00 1.00 0.00 0.00 33.01 31.10 2gqi s GLN 54 CO 0.16 0.53 0.72 0.41 -2.12 0.00 0.00 175.29 174.99 2gqi n GLY 55 N -0.42 0.53 3.28 3.09 0.00 -0.94 -4.75 105.19 105.99 2gqi n GLY 55 Ca -0.07 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.61 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 3.14 0.30 0.99 1.43 -1.26 -2.73 118.68 120.55 2gqi s LEU 56 Ca 0.17 -0.59 0.10 0.00 -1.03 0.00 0.00 54.13 52.78 2gqi s LEU 56 Cb -0.01 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.42 2gqi s LEU 56 CO 0.01 -0.08 -0.06 0.27 0.23 0.00 0.00 176.35 176.72 2gqi s ILE 57 N 1.44 2.82 0.03 -0.59 -4.36 -1.25 -4.48 121.20 114.81 2gqi s ILE 57 Ca 0.04 -2.09 -0.06 0.00 -0.26 0.00 0.00 60.65 58.28 2gqi s ILE 57 Cb -0.15 -2.67 -0.05 0.00 1.25 0.00 0.00 42.46 40.84 2gqi s ILE 57 CO -0.03 -0.31 0.29 0.54 0.24 0.00 0.00 174.94 175.67 2gqi s VAL 58 N -2.46 5.27 -1.63 8.37 0.11 -1.26 -2.46 120.40 126.33 2gqi s VAL 58 Ca 0.32 0.16 0.24 0.00 -2.93 0.00 0.00 61.98 59.77 2gqi s VAL 58 Cb -0.03 -3.58 0.51 0.00 -1.53 0.00 0.00 36.38 31.74 2gqi s VAL 58 CO 0.18 0.32 1.79 -1.84 -3.33 0.00 0.00 175.10 172.22 2gqi n GLU 59 N 0.96 0.49 0.00 1.54 0.28 -1.11 -2.40 120.64 120.40 2gqi n GLU 59 Ca -0.10 0.04 0.13 0.00 -0.16 0.00 0.00 57.16 57.08 2gqi n GLU 59 Cb 0.53 -1.50 0.36 0.00 1.43 0.00 0.00 31.44 32.26 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 -1.18 1.98 -0.00 -1.84 9.92 -1.26 -3.90 116.55 120.26 2gqi n ASP 60 Ca 0.14 -1.63 0.03 0.00 -0.53 0.00 0.00 54.79 52.79 2gqi n ASP 60 Cb 0.15 0.02 -0.04 0.00 -0.64 0.00 0.00 41.12 40.61 2gqi n ASP 60 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2gqi n LEU 61 N 0.51 0.23 0.00 0.64 4.77 -1.01 -5.05 117.00 117.09 2gqi n LEU 61 Ca 0.17 -0.39 -0.27 0.00 -0.03 0.00 0.00 56.01 55.48 2gqi n LEU 61 Cb 0.44 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.46 2gqi n LEU 61 CO 0.17 0.06 -0.19 1.33 -1.33 0.00 0.00 177.39 177.43 2gqi n VAL 62 N -1.26 0.00 -3.70 4.08 0.24 -1.23 -2.69 118.33 113.77 2gqi n VAL 62 Ca 0.01 -2.24 -0.14 0.00 -2.04 0.00 0.00 64.34 59.93 2gqi n VAL 62 Cb 0.11 0.64 -0.09 0.00 -1.47 0.00 0.00 33.84 33.03 2gqi n VAL 62 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 2gqi s GLU 63 N -3.58 0.63 0.21 7.34 -1.05 -0.94 -4.89 118.70 116.42 2gqi s GLU 63 Ca 0.11 0.53 -0.32 0.00 -0.15 0.00 0.00 54.97 55.13 2gqi s GLU 63 Cb 0.01 0.30 -0.14 0.00 -0.44 0.00 0.00 34.13 33.86 2gqi s GLU 63 CO 0.08 -0.11 1.44 -0.85 0.95 0.00 0.00 175.26 176.77 2gqi n GLU 64 N 2.43 1.99 -3.64 -4.83 0.28 -1.26 -2.85 120.64 112.76 2gqi n GLU 64 Ca -0.15 0.71 -0.09 0.00 -0.16 0.00 0.00 57.16 57.47 2gqi n GLU 64 Cb 0.57 -2.39 -0.07 0.00 1.43 0.00 0.00 31.44 30.98 2gqi n GLU 64 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2gqi s VAL 65 N 0.21 0.00 -0.13 3.84 0.11 -1.01 -4.93 120.40 118.49 2gqi s VAL 65 Ca 0.72 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.64 2gqi s VAL 65 Cb -0.68 -1.00 -0.06 0.00 -1.53 0.00 0.00 36.38 33.12 2gqi s VAL 65 CO 0.47 0.00 -0.26 -0.24 -3.33 0.00 0.00 175.10 171.73 2gqi n SER 66 N 2.77 1.67 -4.49 3.54 2.88 -1.26 -4.02 113.62 114.71 2gqi n SER 66 Ca -0.14 0.27 -0.27 0.00 -1.33 0.00 0.00 58.87 57.40 2gqi n SER 66 Cb 0.56 -0.63 -0.11 0.00 -0.75 0.00 0.00 64.21 63.28 2gqi n SER 66 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2gqi s GLY 67 N -4.84 1.73 0.00 0.46 0.00 -1.26 -5.00 107.32 98.40 2gqi s GLY 67 Ca -0.23 -1.59 0.15 0.00 0.00 0.00 0.00 44.72 43.05 2gqi s GLY 67 CO 0.33 -1.62 1.33 -1.55 0.00 0.00 0.00 173.10 171.59 2gqi n PRO 68 N 0.09 0.49 -3.41 2.90 -0.04 -1.26 -4.38 135.00 129.39 2gqi n PRO 68 Ca -0.11 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 62.90 2gqi n PRO 68 Cb 0.56 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.49 2gqi n PRO 68 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2gqi s SER 69 N -1.99 6.35 -0.20 3.54 1.04 -1.26 -5.04 113.70 116.14 2gqi s SER 69 Ca 0.23 -2.55 -0.29 0.00 0.48 0.00 0.00 55.95 53.82 2gqi s SER 69 Cb 0.11 -2.13 -0.01 0.00 0.10 0.00 0.00 66.02 64.08 2gqi s SER 69 CO 0.18 -0.58 1.31 -0.94 0.98 0.00 0.00 173.24 174.19 2gqi s SER 70 N 2.12 6.83 0.00 7.02 1.04 -1.26 -5.09 113.70 124.36 2gqi s SER 70 Ca 0.15 1.59 0.00 0.00 0.48 0.00 0.00 55.95 58.17 2gqi s SER 70 Cb -0.16 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.43 2gqi s SER 70 CO -0.06 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 173.90