#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 -0.07 0.16 1.61 0.15 -1.26 -5.18 113.70 109.10 2gqi s SER 2 Ca 0.00 -0.31 -0.03 0.00 0.70 0.00 0.00 55.95 56.31 2gqi s SER 2 Cb 0.00 0.36 -0.03 0.00 -1.71 0.00 0.00 66.02 64.64 2gqi s SER 2 CO 0.00 -0.65 0.14 -0.44 1.20 0.00 0.00 173.24 173.48 2gqi s SER 3 N -2.29 0.20 0.00 5.45 0.01 -1.26 -5.11 113.70 110.71 2gqi s SER 3 Ca -0.02 -1.17 0.00 0.00 1.31 0.00 0.00 55.95 56.07 2gqi s SER 3 Cb 0.00 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.59 2gqi s SER 3 CO -0.06 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.40 2gqi n GLY 4 N -0.17 0.27 3.22 3.44 0.00 -1.26 -5.05 105.19 105.64 2gqi n GLY 4 Ca -0.04 -1.36 -0.28 0.00 0.00 0.00 0.00 46.02 44.34 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 -4.00 2.48 0.00 1.61 1.04 -1.26 -5.14 113.70 108.44 2gqi s SER 5 Ca 0.00 -0.39 -0.04 0.00 0.48 0.00 0.00 55.95 56.00 2gqi s SER 5 Cb 0.00 -0.36 -0.04 0.00 0.10 0.00 0.00 66.02 65.71 2gqi s SER 5 CO 0.00 0.24 0.23 -0.44 0.98 0.00 0.00 173.24 174.25 2gqi s SER 6 N -0.40 6.42 0.00 7.02 0.01 -1.26 -4.47 113.70 121.03 2gqi s SER 6 Ca 0.06 0.44 0.00 0.00 1.31 0.00 0.00 55.95 57.76 2gqi s SER 6 Cb -0.09 -2.04 0.00 0.00 0.21 0.00 0.00 66.02 64.10 2gqi s SER 6 CO -0.00 0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.51 2gqi n GLY 7 N 0.97 0.88 3.74 3.44 0.00 -1.26 -5.02 105.19 107.95 2gqi n GLY 7 Ca -0.11 -0.69 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 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 -4.72 4.56 0.08 1.61 3.52 -1.25 -4.90 118.95 117.86 2gqi s ARG 8 Ca 0.00 1.79 0.02 0.00 -0.13 0.00 0.00 55.73 57.41 2gqi s ARG 8 Cb 0.00 -3.25 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2gqi s ARG 8 CO 0.00 0.04 0.12 1.03 -0.81 0.00 0.00 175.30 175.67 2gqi s ARG 9 N -0.50 3.03 0.05 5.12 0.52 -1.26 -1.15 118.95 124.76 2gqi s ARG 9 Ca 0.50 -0.63 -0.10 0.00 -0.52 0.00 0.00 55.73 54.98 2gqi s ARG 9 Cb -0.31 -2.81 0.00 0.00 0.52 0.00 0.00 34.95 32.36 2gqi s ARG 9 CO 0.37 0.57 0.20 0.14 0.02 0.00 0.00 175.30 176.60 2gqi s VAL 10 N -1.44 0.11 0.04 3.52 -7.23 -1.23 -2.27 120.40 111.89 2gqi s VAL 10 Ca 0.31 -0.91 0.07 0.00 -1.81 0.00 0.00 61.98 59.64 2gqi s VAL 10 Cb -0.12 -0.98 -0.02 0.00 0.56 0.00 0.00 36.38 35.82 2gqi s VAL 10 CO 0.24 -0.50 -0.20 -0.60 -0.31 0.00 0.00 175.10 173.72 2gqi s ARG 11 N -2.76 1.37 -0.64 4.82 6.06 -1.22 -1.58 118.95 125.00 2gqi s ARG 11 Ca -0.04 -0.92 -0.23 0.00 -2.50 0.00 0.00 55.73 52.05 2gqi s ARG 11 Cb -0.00 -1.47 0.07 0.00 0.06 0.00 0.00 34.95 33.61 2gqi s ARG 11 CO -0.05 0.38 0.95 0.00 -2.50 0.00 0.00 175.30 174.07 2gqi s ALA 12 N -0.79 3.13 -0.95 6.12 0.00 0.20 -0.63 121.76 128.85 2gqi s ALA 12 Ca 0.07 -1.79 0.19 0.00 0.00 0.00 0.00 51.96 50.43 2gqi s ALA 12 Cb -0.09 -3.82 0.82 0.00 0.00 0.00 0.00 23.12 20.03 2gqi s ALA 12 CO 0.02 -2.71 1.62 0.44 0.00 0.00 0.00 175.76 175.13 2gqi n ILE 13 N 5.93 0.71 -3.76 0.00 -5.35 -1.15 0.01 119.36 115.75 2gqi n ILE 13 Ca -0.04 0.16 -0.13 0.00 -0.27 0.00 0.00 62.75 62.48 2gqi n ILE 13 Cb 0.45 -0.87 -0.09 0.00 -1.74 0.00 0.00 39.64 37.40 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 -3.18 0.86 0.51 7.28 1.43 -1.25 -4.84 118.68 119.49 2gqi s LEU 14 Ca 0.09 0.13 -0.21 0.00 -1.03 0.00 0.00 54.13 53.11 2gqi s LEU 14 Cb 0.12 1.24 -0.06 0.00 0.03 0.00 0.00 46.19 47.52 2gqi s LEU 14 CO 0.36 -0.42 1.14 -2.16 0.23 0.00 0.00 176.35 175.50 2gqi s PRO 15 N -1.19 3.49 0.00 1.29 0.04 -1.26 -4.53 135.00 132.85 2gqi s PRO 15 Ca -0.12 1.66 0.04 0.00 0.04 0.00 0.00 61.00 62.62 2gqi s PRO 15 Cb -0.05 -2.14 -0.01 0.00 0.04 0.00 0.00 34.50 32.34 2gqi s PRO 15 CO 0.04 -0.74 -0.12 -0.47 0.04 0.00 0.00 177.00 175.75 2gqi s TYR 16 N -1.70 1.04 -0.70 0.56 5.04 -1.15 -5.00 117.35 115.45 2gqi s TYR 16 Ca 0.70 -0.23 -0.08 0.00 -2.44 0.00 0.00 57.07 55.02 2gqi s TYR 16 Cb -0.25 -0.66 0.18 0.00 0.35 0.00 0.00 41.96 41.58 2gqi s TYR 16 CO 0.29 -0.01 0.57 0.99 -1.34 0.00 0.00 175.55 176.05 2gqi s THR 17 N -0.42 4.52 0.31 4.34 2.01 -1.26 -3.36 115.64 121.77 2gqi s THR 17 Ca 0.03 -2.69 -0.16 0.00 0.31 0.00 0.00 61.69 59.18 2gqi s THR 17 Cb -0.05 -3.87 -0.12 0.00 0.01 0.00 0.00 72.50 68.47 2gqi s THR 17 CO -0.00 -0.93 0.07 2.29 -0.69 0.00 0.00 174.62 175.35 2gqi n LYS 18 N 3.77 0.00 -2.92 4.92 2.85 -1.26 -4.87 118.16 120.66 2gqi n LYS 18 Ca 0.09 0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 56.95 2gqi n LYS 18 Cb 0.42 -0.76 -0.06 0.00 -0.65 0.00 0.00 35.03 33.98 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 -1.27 4.37 0.22 0.58 1.01 -1.26 -4.96 120.40 119.08 2gqi s VAL 19 Ca 0.45 1.80 -0.30 0.00 0.00 0.00 0.00 61.98 63.93 2gqi s VAL 19 Cb -0.48 -4.19 -0.09 0.00 0.00 0.00 0.00 36.38 31.62 2gqi s VAL 19 CO 0.48 0.48 1.29 -2.16 0.00 0.00 0.00 175.10 175.19 2gqi s PRO 20 N -0.92 4.40 -0.41 2.72 0.04 -1.26 -3.37 135.00 136.20 2gqi s PRO 20 Ca 0.38 2.05 -0.03 0.00 0.04 0.00 0.00 61.00 63.45 2gqi s PRO 20 Cb -0.23 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.13 2gqi s PRO 20 CO 0.27 -0.21 0.35 -0.25 0.04 0.00 0.00 177.00 177.21 2gqi n ASP 21 N 2.31 -3.23 -3.73 6.66 8.00 -1.26 -5.04 116.55 120.26 2gqi n ASP 21 Ca 0.05 -0.16 -0.08 0.00 0.71 0.00 0.00 54.79 55.30 2gqi n ASP 21 Cb 0.43 -1.87 -0.02 0.00 -0.02 0.00 0.00 41.12 39.64 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 -3.10 0.00 -0.18 -3.53 -4.23 -1.22 -5.03 115.64 98.35 2gqi s THR 22 Ca 0.16 -1.10 0.23 0.00 -1.18 0.00 0.00 61.69 59.81 2gqi s THR 22 Cb -0.07 -2.19 0.27 0.00 1.34 0.00 0.00 72.50 71.84 2gqi s THR 22 CO 0.22 0.00 1.68 0.44 -0.54 0.00 0.00 174.62 176.42 2gqi h ASP 23 N 2.05 0.00 -0.73 3.99 3.32 -1.96 -3.47 116.42 119.62 2gqi h ASP 23 Ca -0.23 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.33 2gqi h ASP 23 Cb 1.25 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.88 2gqi h ASP 23 CO 0.29 0.15 -0.36 -0.62 -1.72 0.00 0.00 179.24 176.98 2gqi n GLU 24 N -3.18 0.00 -4.33 3.56 4.71 -1.26 -4.42 120.64 115.72 2gqi n GLU 24 Ca 0.02 0.00 -0.28 0.00 -0.01 0.00 0.00 57.16 56.90 2gqi n GLU 24 Cb 0.52 -0.75 -0.11 0.00 -1.01 0.00 0.00 31.44 30.09 2gqi n GLU 24 CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 2gqi s ILE 25 N -0.69 2.82 -0.16 -3.67 -4.36 -1.26 -4.51 121.20 109.38 2gqi s ILE 25 Ca 0.48 -1.72 -0.06 0.00 -0.26 0.00 0.00 60.65 59.09 2gqi s ILE 25 Cb -0.70 -2.35 -0.04 0.00 1.25 0.00 0.00 42.46 40.63 2gqi s ILE 25 CO 0.41 -0.04 0.05 -0.94 0.24 0.00 0.00 174.94 174.66 2gqi s SER 26 N -2.54 5.54 0.38 4.36 1.04 -1.26 -4.03 113.70 117.19 2gqi s SER 26 Ca 0.21 0.10 0.04 0.00 0.48 0.00 0.00 55.95 56.78 2gqi s SER 26 Cb -0.09 -1.88 -0.05 0.00 0.10 0.00 0.00 66.02 64.09 2gqi s SER 26 CO 0.12 0.22 0.05 0.72 0.98 0.00 0.00 173.24 175.33 2gqi s PHE 27 N 0.07 2.03 0.18 5.02 -0.71 -1.21 -4.96 117.98 118.40 2gqi s PHE 27 Ca 0.05 -0.96 0.10 0.00 -1.04 0.00 0.00 56.93 55.08 2gqi s PHE 27 Cb -0.12 -1.40 -0.04 0.00 -1.21 0.00 0.00 43.02 40.24 2gqi s PHE 27 CO 0.01 0.07 -0.19 -0.51 -1.34 0.00 0.00 175.22 173.26 2gqi s LEU 28 N -3.60 2.62 -0.19 -1.99 1.43 -1.26 -2.94 118.68 112.74 2gqi s LEU 28 Ca 0.30 -0.74 -0.33 0.00 -1.03 0.00 0.00 54.13 52.33 2gqi s LEU 28 Cb 0.07 -1.36 -0.10 0.00 0.03 0.00 0.00 46.19 44.82 2gqi s LEU 28 CO 0.14 0.13 2.04 1.17 0.23 0.00 0.00 176.35 180.06 2gqi n LYS 29 N 0.31 1.84 0.00 1.70 4.81 -1.26 -1.45 118.16 124.12 2gqi n LYS 29 Ca -0.13 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 57.92 2gqi n LYS 29 Cb 0.55 -2.72 0.00 0.00 0.02 0.00 0.00 35.03 32.88 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 5.27 1.21 3.82 3.14 0.00 0.10 -5.00 105.19 113.72 2gqi n GLY 30 Ca 0.29 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.00 6.60 0.63 1.61 1.11 -0.53 -4.84 116.67 119.26 2gqi s ASP 31 Ca 0.00 0.71 0.00 0.00 0.18 0.00 0.00 52.55 53.44 2gqi s ASP 31 Cb 0.00 -2.19 0.07 0.00 1.07 0.00 0.00 42.92 41.88 2gqi s ASP 31 CO 0.00 0.28 0.88 -0.04 1.18 0.00 0.00 175.17 177.47 2gqi s MET 32 N -0.62 2.17 0.32 8.23 -1.94 -1.26 -0.63 119.30 125.56 2gqi s MET 32 Ca 0.20 -0.90 -0.14 0.00 -1.71 0.00 0.00 55.69 53.14 2gqi s MET 32 Cb -0.14 -2.41 0.02 0.00 2.01 0.00 0.00 34.83 34.31 2gqi s MET 32 CO 0.08 -1.05 0.64 -0.06 -0.01 0.00 0.00 175.02 174.63 2gqi s PHE 33 N -2.95 0.27 -0.44 -0.03 0.40 -0.61 -3.18 117.98 111.44 2gqi s PHE 33 Ca 0.61 -0.74 0.02 0.00 -0.60 0.00 0.00 56.93 56.22 2gqi s PHE 33 Cb -0.08 0.48 0.14 0.00 0.51 0.00 0.00 43.02 44.07 2gqi s PHE 33 CO 0.41 -1.27 0.27 0.42 0.70 0.00 0.00 175.22 175.75 2gqi s ILE 34 N -3.25 1.16 -0.17 0.64 1.01 -1.24 -3.56 121.20 115.79 2gqi s ILE 34 Ca 0.19 -2.56 -0.35 0.00 0.00 0.00 0.00 60.65 57.92 2gqi s ILE 34 Cb -0.03 -1.81 -0.12 0.00 0.01 0.00 0.00 42.46 40.50 2gqi s ILE 34 CO 0.11 -0.97 1.91 0.52 0.00 0.00 0.00 174.94 176.51 2gqi n VAL 35 N 3.41 0.47 -0.08 2.92 0.31 -0.30 -3.69 118.33 121.37 2gqi n VAL 35 Ca 0.13 -0.13 -0.15 0.00 -0.01 0.00 0.00 64.34 64.18 2gqi n VAL 35 Cb 0.37 -1.74 -0.06 0.00 -0.91 0.00 0.00 33.84 31.50 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 6.97 0.00 -4.35 3.52 8.25 -0.40 -3.80 115.22 125.41 2gqi n HIS 36 Ca 0.26 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.45 2gqi n HIS 36 Cb 0.26 -0.57 -0.13 0.00 1.12 0.00 0.00 29.99 30.67 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 -6.16 3.04 -0.30 0.41 3.04 -1.17 -4.96 114.94 108.84 2gqi s ASN 37 Ca -0.22 -0.74 0.02 0.00 0.04 0.00 0.00 52.86 51.97 2gqi s ASN 37 Cb 0.08 -0.19 0.07 0.00 -1.54 0.00 0.00 41.25 39.67 2gqi s ASN 37 CO 0.30 0.13 -0.03 -1.61 -3.04 0.00 0.00 177.10 172.85 2gqi s GLU 38 N -2.05 2.00 0.95 0.43 2.02 -1.26 -1.86 118.70 118.93 2gqi s GLU 38 Ca 0.12 -1.54 -0.14 0.00 0.02 0.00 0.00 54.97 53.43 2gqi s GLU 38 Cb -0.10 -3.07 0.16 0.00 0.10 0.00 0.00 34.13 31.23 2gqi s GLU 38 CO 0.06 -0.72 1.17 -0.51 0.02 0.00 0.00 175.26 175.27 2gqi s LEU 39 N 1.06 1.98 -0.15 1.80 2.01 0.06 -5.01 118.68 120.42 2gqi s LEU 39 Ca -0.01 0.79 -0.19 0.00 0.01 0.00 0.00 54.13 54.73 2gqi s LEU 39 Cb -0.20 -3.00 -0.16 0.00 0.01 0.00 0.00 46.19 42.84 2gqi s LEU 39 CO -0.05 -2.76 0.36 1.05 1.01 0.00 0.00 176.35 175.95 2gqi h GLU 40 N -1.64 0.00 -1.04 1.70 4.11 -2.00 -3.35 114.58 112.36 2gqi h GLU 40 Ca -0.48 0.00 0.36 0.00 0.07 0.00 0.00 59.36 59.31 2gqi h GLU 40 Cb 1.31 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.41 2gqi h GLU 40 CO 0.54 0.67 0.60 0.22 0.07 0.00 0.00 179.01 181.12 2gqi h ASP 41 N -1.00 0.43 0.00 3.06 1.82 -2.04 -3.43 116.42 115.26 2gqi h ASP 41 Ca -0.09 0.20 0.00 0.00 -0.39 0.00 0.00 57.03 56.75 2gqi h ASP 41 Cb 0.81 0.17 0.00 0.00 0.68 0.00 0.00 39.33 40.99 2gqi h ASP 41 CO -0.05 -0.22 0.00 0.61 -1.61 0.00 0.00 179.24 177.97 2gqi n GLY 42 N -1.31 0.29 3.89 -0.78 0.00 -1.26 -5.11 105.19 100.90 2gqi n GLY 42 Ca 0.34 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 3.29 -0.15 1.61 0.52 -1.26 -3.71 118.94 119.24 2gqi s TRP 43 Ca 0.00 0.97 -0.05 0.00 0.02 0.00 0.00 56.10 57.04 2gqi s TRP 43 Cb 0.00 -3.06 0.07 0.00 -1.15 0.00 0.00 33.47 29.33 2gqi s TRP 43 CO 0.00 -1.18 0.30 -1.64 0.02 0.00 0.00 176.95 174.44 2gqi s MET 44 N -5.33 0.19 -0.52 4.98 -1.94 -1.11 -0.77 119.30 114.80 2gqi s MET 44 Ca 0.58 0.80 -0.26 0.00 -1.71 0.00 0.00 55.69 55.10 2gqi s MET 44 Cb -0.11 0.02 -0.08 0.00 2.01 0.00 0.00 34.83 36.67 2gqi s MET 44 CO 0.51 -0.29 2.42 1.87 -0.01 0.00 0.00 175.02 179.52 2gqi n TRP 45 N 5.36 1.40 -4.36 -0.03 -0.00 -0.78 -3.93 117.44 115.10 2gqi n TRP 45 Ca -0.07 0.11 -0.25 0.00 -0.00 0.00 0.00 57.50 57.29 2gqi n TRP 45 Cb 0.50 -2.64 -0.09 0.00 -0.00 0.00 0.00 31.31 29.08 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 12.53 2.54 -0.28 5.87 -7.23 -1.23 -1.27 120.40 131.33 2gqi s VAL 46 Ca 0.98 -1.98 0.02 0.00 -1.81 0.00 0.00 61.98 59.19 2gqi s VAL 46 Cb -0.17 -2.80 0.08 0.00 0.56 0.00 0.00 36.38 34.04 2gqi s VAL 46 CO 0.24 -0.18 -0.01 -0.89 -0.31 0.00 0.00 175.10 173.96 2gqi s THR 47 N -2.54 1.72 0.29 5.32 2.01 -1.24 -2.57 115.64 118.62 2gqi s THR 47 Ca 0.35 -1.63 -0.28 0.00 0.31 0.00 0.00 61.69 60.44 2gqi s THR 47 Cb 0.01 -2.09 -0.14 0.00 0.01 0.00 0.00 72.50 70.29 2gqi s THR 47 CO 0.19 -0.33 1.03 -3.20 -0.69 0.00 0.00 174.62 171.62 2gqi n ASN 48 N 4.55 1.36 0.14 3.53 2.85 -0.74 -3.60 115.26 123.35 2gqi n ASN 48 Ca -0.06 1.18 0.12 0.00 -0.11 0.00 0.00 54.58 55.71 2gqi n ASN 48 Cb 0.43 -1.29 0.11 0.00 1.24 0.00 0.00 39.78 40.27 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 2.08 0.00 0.00 1.20 3.38 -1.90 -1.74 115.31 118.33 2gqi h LEU 49 Ca -0.40 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 2gqi h LEU 49 Cb 1.34 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.09 2gqi h LEU 49 CO 0.61 0.01 -0.40 -0.09 0.09 0.00 0.00 178.44 178.66 2gqi h ARG 50 N 0.00 0.00 0.00 1.13 1.12 -1.90 -3.38 114.38 111.35 2gqi h ARG 50 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 2gqi h ARG 50 Cb 0.95 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.91 2gqi h ARG 50 CO 0.00 0.09 0.00 1.79 -3.11 0.00 0.00 179.97 178.74 2gqi h THR 51 N -1.00 0.00 -5.84 0.20 1.35 -1.95 -3.47 112.91 102.20 2gqi h THR 51 Ca -0.02 -0.86 -0.38 0.00 -0.55 0.00 0.00 66.41 64.60 2gqi h THR 51 Cb 0.43 1.86 0.12 0.00 -1.73 0.00 0.00 68.15 68.83 2gqi h THR 51 CO -0.01 0.00 -0.75 0.47 -0.25 0.00 0.00 175.52 174.98 2gqi n ASP 52 N -3.10 -3.56 -4.22 5.36 8.00 -0.66 -5.01 116.55 113.37 2gqi n ASP 52 Ca 0.03 -0.64 -0.13 0.00 0.71 0.00 0.00 54.79 54.76 2gqi n ASP 52 Cb 0.46 -4.82 -0.10 0.00 -0.02 0.00 0.00 41.12 36.65 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 -5.88 0.98 0.01 -1.24 2.02 -1.24 -4.94 118.70 108.41 2gqi s GLU 53 Ca 0.25 -1.39 -0.01 0.00 0.02 0.00 0.00 54.97 53.84 2gqi s GLU 53 Cb -0.12 -0.50 -0.04 0.00 0.10 0.00 0.00 34.13 33.58 2gqi s GLU 53 CO 0.75 0.05 0.14 -0.65 0.02 0.00 0.00 175.26 175.57 2gqi s GLN 54 N -3.67 3.25 0.00 1.61 -0.21 -1.26 -1.79 119.66 117.59 2gqi s GLN 54 Ca 0.14 -0.43 0.00 0.00 0.02 0.00 0.00 55.36 55.09 2gqi s GLN 54 Cb 0.03 -2.97 0.00 0.00 1.00 0.00 0.00 33.01 31.07 2gqi s GLN 54 CO -0.01 0.65 0.00 0.41 -2.12 0.00 0.00 175.29 174.22 2gqi n GLY 55 N 0.92 2.34 2.87 3.09 0.00 -1.06 -4.88 105.19 108.47 2gqi n GLY 55 Ca -0.11 -0.28 -0.17 0.00 0.00 0.00 0.00 46.02 45.47 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 1.48 0.21 0.99 1.43 -1.26 -3.57 118.68 117.95 2gqi s LEU 56 Ca 0.00 -0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.07 2gqi s LEU 56 Cb 0.00 -0.24 -0.05 0.00 0.03 0.00 0.00 46.19 45.93 2gqi s LEU 56 CO 0.00 -0.04 0.01 0.27 0.23 0.00 0.00 176.35 176.82 2gqi s ILE 57 N 0.63 0.82 -0.15 -0.59 -4.36 -1.25 -4.13 121.20 112.16 2gqi s ILE 57 Ca -0.07 -2.01 -0.06 0.00 -0.26 0.00 0.00 60.65 58.26 2gqi s ILE 57 Cb -0.10 -2.28 -0.04 0.00 1.25 0.00 0.00 42.46 41.30 2gqi s ILE 57 CO -0.01 -0.35 0.05 0.54 0.24 0.00 0.00 174.94 175.41 2gqi s VAL 58 N -3.57 4.69 -0.29 8.37 0.11 -1.26 -2.73 120.40 125.71 2gqi s VAL 58 Ca 0.28 -0.08 0.21 0.00 -2.93 0.00 0.00 61.98 59.45 2gqi s VAL 58 Cb 0.06 -3.07 0.21 0.00 -1.53 0.00 0.00 36.38 32.05 2gqi s VAL 58 CO 0.07 0.51 1.64 -1.84 -3.33 0.00 0.00 175.10 172.15 2gqi n GLU 59 N 3.04 0.14 0.00 1.54 0.28 -1.24 -0.65 120.64 123.75 2gqi n GLU 59 Ca -0.17 0.59 0.15 0.00 -0.16 0.00 0.00 57.16 57.56 2gqi n GLU 59 Cb 0.53 -1.92 0.72 0.00 1.43 0.00 0.00 31.44 32.20 2gqi n GLU 59 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2gqi n ASP 60 N -2.21 0.09 -0.05 -1.84 2.03 -1.26 -3.45 116.55 109.86 2gqi n ASP 60 Ca -0.01 -0.20 -0.04 0.00 0.52 0.00 0.00 54.79 55.06 2gqi n ASP 60 Cb 0.07 -0.24 -0.10 0.00 -0.72 0.00 0.00 41.12 40.12 2gqi n ASP 60 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2gqi n LEU 61 N -1.24 0.00 -4.90 -2.67 4.77 0.18 -5.03 117.00 108.11 2gqi n LEU 61 Ca 0.14 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.90 2gqi n LEU 61 Cb 0.25 0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 2gqi n LEU 61 CO 0.24 0.26 0.05 0.68 -1.33 0.00 0.00 177.39 177.28 2gqi s VAL 62 N -2.40 2.33 0.41 4.08 -7.23 -1.16 -2.95 120.40 113.48 2gqi s VAL 62 Ca -0.06 -1.35 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 2gqi s VAL 62 Cb 0.04 -2.68 -0.00 0.00 0.56 0.00 0.00 36.38 34.30 2gqi s VAL 62 CO 0.52 0.00 0.00 -1.84 -0.31 0.00 0.00 175.10 173.47 2gqi n GLU 63 N -1.67 1.01 -3.73 4.82 0.28 0.20 -4.86 120.64 116.69 2gqi n GLU 63 Ca 0.03 -2.99 -0.37 0.00 -0.16 0.00 0.00 57.16 53.68 2gqi n GLU 63 Cb 0.62 0.80 -0.11 0.00 1.43 0.00 0.00 31.44 34.18 2gqi n GLU 63 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2gqi s GLU 64 N -3.48 3.82 -0.63 3.44 2.02 -1.26 -3.40 118.70 119.21 2gqi s GLU 64 Ca 0.00 -0.40 0.03 0.00 0.02 0.00 0.00 54.97 54.63 2gqi s GLU 64 Cb 0.00 -3.43 0.15 0.00 0.10 0.00 0.00 34.13 30.95 2gqi s GLU 64 CO 0.00 -0.11 0.40 0.08 0.02 0.00 0.00 175.26 175.65 2gqi s VAL 65 N 1.47 2.96 -0.10 2.63 1.01 -0.96 -4.94 120.40 122.47 2gqi s VAL 65 Ca 0.06 -3.67 -0.07 0.00 0.00 0.00 0.00 61.98 58.30 2gqi s VAL 65 Cb -0.15 -2.98 -0.06 0.00 0.00 0.00 0.00 36.38 33.20 2gqi s VAL 65 CO 0.06 -0.90 0.24 -1.28 0.00 0.00 0.00 175.10 173.21 2gqi h SER 66 N 6.13 -0.06 -4.17 3.32 0.87 -1.97 -3.37 113.55 114.30 2gqi h SER 66 Ca 0.02 -0.18 -0.50 0.00 -1.23 0.00 0.00 61.79 59.90 2gqi h SER 66 Cb 0.84 0.01 0.09 0.00 -0.44 0.00 0.00 62.40 62.91 2gqi h SER 66 CO 0.71 0.52 0.39 -0.83 -0.53 0.00 0.00 176.83 177.09 2gqi s GLY 67 N -3.58 2.26 0.64 5.77 0.00 -1.26 -5.00 107.32 106.16 2gqi s GLY 67 Ca -0.05 0.60 -0.16 0.00 0.00 0.00 0.00 44.72 45.11 2gqi s GLY 67 CO 0.16 0.95 1.11 2.56 0.00 0.00 0.00 173.10 177.88 2gqi s PRO 68 N -3.90 2.88 -0.04 2.90 0.04 -1.26 -5.06 135.00 130.56 2gqi s PRO 68 Ca 0.68 1.42 0.02 0.00 0.04 0.00 0.00 61.00 63.16 2gqi s PRO 68 Cb -0.21 -1.96 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2gqi s PRO 68 CO 0.38 -1.19 -0.07 -1.54 0.04 0.00 0.00 177.00 174.61 2gqi s SER 69 N -2.47 1.16 0.10 6.66 1.04 -1.26 -5.15 113.70 113.77 2gqi s SER 69 Ca 0.68 -0.18 0.02 0.00 0.48 0.00 0.00 55.95 56.95 2gqi s SER 69 Cb -0.21 -0.46 -0.04 0.00 0.10 0.00 0.00 66.02 65.41 2gqi s SER 69 CO 0.39 0.01 0.17 -0.94 0.98 0.00 0.00 173.24 173.85 2gqi s SER 70 N 0.58 5.95 0.00 7.02 1.04 -1.26 -5.29 113.70 121.73 2gqi s SER 70 Ca -0.09 0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.44 2gqi s SER 70 Cb -0.12 -1.71 0.00 0.00 0.10 0.00 0.00 66.02 64.28 2gqi s SER 70 CO 0.01 0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.98