#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 5.97 -0.05 1.61 1.04 -1.26 -5.04 113.70 115.96 2gqi s SER 2 Ca 0.00 2.02 -0.04 0.00 0.48 0.00 0.00 55.95 58.41 2gqi s SER 2 Cb 0.00 -2.57 -0.04 0.00 0.10 0.00 0.00 66.02 63.52 2gqi s SER 2 CO 0.00 -1.04 0.14 -0.44 0.98 0.00 0.00 173.24 172.88 2gqi s SER 3 N -2.01 6.19 -0.01 7.02 0.01 -1.26 -5.08 113.70 118.56 2gqi s SER 3 Ca 0.69 0.34 -0.30 0.00 1.31 0.00 0.00 55.95 57.99 2gqi s SER 3 Cb -0.20 -1.93 -0.03 0.00 0.21 0.00 0.00 66.02 64.07 2gqi s SER 3 CO 0.26 0.32 0.99 -0.83 0.41 0.00 0.00 173.24 174.39 2gqi s GLY 4 N -1.53 2.82 -0.98 3.44 0.00 -1.26 -4.93 107.32 104.89 2gqi s GLY 4 Ca 0.21 0.53 -0.25 0.00 0.00 0.00 0.00 44.72 45.22 2gqi s GLY 4 CO 0.12 1.73 2.11 -1.35 0.00 0.00 0.00 173.10 175.72 2gqi s SER 5 N 1.03 4.36 -0.37 1.64 1.04 -1.26 -4.90 113.70 115.23 2gqi s SER 5 Ca 0.52 -0.76 -0.29 0.00 0.48 0.00 0.00 55.95 55.90 2gqi s SER 5 Cb -0.21 -2.57 0.02 0.00 0.10 0.00 0.00 66.02 63.36 2gqi s SER 5 CO 0.27 -3.62 1.11 -0.55 0.98 0.00 0.00 173.24 171.43 2gqi s SER 6 N 8.61 6.82 0.00 7.02 0.15 -1.26 -4.76 113.70 130.27 2gqi s SER 6 Ca 0.79 0.86 0.00 0.00 0.70 0.00 0.00 55.95 58.30 2gqi s SER 6 Cb -0.07 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 2gqi s SER 6 CO 0.09 -1.02 0.00 0.61 1.20 0.00 0.00 173.24 174.12 2gqi n GLY 7 N 4.23 -1.34 3.73 9.45 0.00 -1.26 -5.04 105.19 114.95 2gqi n GLY 7 Ca 0.12 0.57 -0.36 0.00 0.00 0.00 0.00 46.02 46.35 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 0.00 2.50 -0.12 1.61 3.52 -1.23 -4.78 118.95 120.45 2gqi s ARG 8 Ca 0.00 1.87 0.03 0.00 -0.13 0.00 0.00 55.73 57.50 2gqi s ARG 8 Cb 0.00 -1.86 0.00 0.00 -1.56 0.00 0.00 34.95 31.53 2gqi s ARG 8 CO 0.00 -1.59 -0.21 1.03 -0.81 0.00 0.00 175.30 173.72 2gqi s ARG 9 N -3.59 3.10 0.20 5.12 0.52 -1.26 -1.57 118.95 121.47 2gqi s ARG 9 Ca 0.78 -0.83 0.01 0.00 -0.52 0.00 0.00 55.73 55.17 2gqi s ARG 9 Cb -0.32 -2.42 -0.05 0.00 0.52 0.00 0.00 34.95 32.68 2gqi s ARG 9 CO 0.40 0.10 0.04 0.14 0.02 0.00 0.00 175.30 176.00 2gqi s VAL 10 N 0.56 0.60 0.01 3.52 -7.23 -1.20 -3.22 120.40 113.44 2gqi s VAL 10 Ca -0.13 -1.99 0.01 0.00 -1.81 0.00 0.00 61.98 58.07 2gqi s VAL 10 Cb -0.17 -2.32 -0.01 0.00 0.56 0.00 0.00 36.38 34.44 2gqi s VAL 10 CO 0.04 -0.28 -0.05 -0.60 -0.31 0.00 0.00 175.10 173.90 2gqi s ARG 11 N -3.97 0.40 -0.72 4.82 3.52 -0.67 -1.98 118.95 120.35 2gqi s ARG 11 Ca 0.30 -0.35 -0.25 0.00 -0.13 0.00 0.00 55.73 55.30 2gqi s ARG 11 Cb 0.07 -0.30 0.05 0.00 -1.56 0.00 0.00 34.95 33.21 2gqi s ARG 11 CO 0.08 0.07 1.13 0.00 -0.81 0.00 0.00 175.30 175.77 2gqi s ALA 12 N -0.54 2.94 0.65 6.12 0.00 -0.33 -0.91 121.76 129.70 2gqi s ALA 12 Ca -0.03 -1.67 0.45 0.00 0.00 0.00 0.00 51.96 50.71 2gqi s ALA 12 Cb -0.04 -4.07 2.42 0.00 0.00 0.00 0.00 23.12 21.42 2gqi s ALA 12 CO -0.00 -3.05 2.37 -0.84 0.00 0.00 0.00 175.76 174.24 2gqi h ILE 13 N 6.03 0.00 -3.87 0.00 3.07 -1.84 0.11 117.51 121.00 2gqi h ILE 13 Ca -0.25 -0.01 -0.12 0.00 1.55 0.00 0.00 64.86 66.03 2gqi h ILE 13 Cb 1.06 1.01 -0.17 0.00 -0.27 0.00 0.00 36.82 38.45 2gqi h ILE 13 CO 1.23 0.00 -0.52 -0.76 -1.05 0.00 0.00 178.15 177.05 2gqi s LEU 14 N -6.14 1.84 1.00 0.16 1.43 -1.25 -4.74 118.68 110.98 2gqi s LEU 14 Ca -0.05 -0.63 -0.12 0.00 -1.03 0.00 0.00 54.13 52.30 2gqi s LEU 14 Cb 0.13 0.62 0.19 0.00 0.03 0.00 0.00 46.19 47.15 2gqi s LEU 14 CO 0.41 -0.56 1.09 -2.16 0.23 0.00 0.00 176.35 175.36 2gqi s PRO 15 N -3.04 0.44 -0.24 1.29 0.04 -1.26 -4.44 135.00 127.78 2gqi s PRO 15 Ca -0.01 0.53 -0.23 0.00 0.04 0.00 0.00 61.00 61.33 2gqi s PRO 15 Cb 0.01 -1.74 0.06 0.00 0.04 0.00 0.00 34.50 32.88 2gqi s PRO 15 CO -0.07 -2.73 0.65 -0.47 0.04 0.00 0.00 177.00 174.43 2gqi s TYR 16 N -2.96 -0.71 -0.69 0.56 5.04 -1.17 -4.97 117.35 112.44 2gqi s TYR 16 Ca 0.65 1.72 -0.12 0.00 -2.44 0.00 0.00 57.07 56.89 2gqi s TYR 16 Cb -0.19 0.25 0.18 0.00 0.35 0.00 0.00 41.96 42.55 2gqi s TYR 16 CO 0.58 -0.36 0.61 0.99 -1.34 0.00 0.00 175.55 176.03 2gqi s THR 17 N 0.27 5.06 0.43 4.34 2.01 -1.26 -3.52 115.64 122.98 2gqi s THR 17 Ca -0.01 -2.26 -0.20 0.00 0.31 0.00 0.00 61.69 59.54 2gqi s THR 17 Cb -0.04 -4.20 -0.15 0.00 0.01 0.00 0.00 72.50 68.12 2gqi s THR 17 CO 0.01 -0.94 0.01 2.29 -0.69 0.00 0.00 174.62 175.30 2gqi n LYS 18 N 4.28 0.00 -3.07 4.92 2.85 -1.26 -4.89 118.16 120.99 2gqi n LYS 18 Ca 0.04 0.00 -0.39 0.00 -1.05 0.00 0.00 58.31 56.91 2gqi n LYS 18 Cb 0.43 -0.98 -0.06 0.00 -0.65 0.00 0.00 35.03 33.77 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 -1.77 4.56 0.51 0.58 1.01 -1.26 -4.96 120.40 119.08 2gqi s VAL 19 Ca 0.57 1.54 -0.21 0.00 0.00 0.00 0.00 61.98 63.88 2gqi s VAL 19 Cb -0.58 -4.06 -0.06 0.00 0.00 0.00 0.00 36.38 31.68 2gqi s VAL 19 CO 0.63 0.49 1.14 -2.16 0.00 0.00 0.00 175.10 175.21 2gqi s PRO 20 N -0.87 3.51 -0.85 2.72 0.04 -1.26 -3.64 135.00 134.65 2gqi s PRO 20 Ca 0.34 1.67 -0.05 0.00 0.04 0.00 0.00 61.00 63.00 2gqi s PRO 20 Cb -0.21 -2.16 0.01 0.00 0.04 0.00 0.00 34.50 32.17 2gqi s PRO 20 CO 0.23 -0.74 0.74 -3.47 0.04 0.00 0.00 177.00 173.81 2gqi n ASP 21 N -0.99 -4.68 -3.17 6.66 2.03 -1.26 -5.01 116.55 110.13 2gqi n ASP 21 Ca 0.10 -0.34 -0.10 0.00 0.52 0.00 0.00 54.79 54.98 2gqi n ASP 21 Cb 0.50 -3.34 0.00 0.00 -0.72 0.00 0.00 41.12 37.56 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 -3.20 0.00 -1.06 5.18 -4.23 -1.24 -5.02 115.64 106.07 2gqi s THR 22 Ca 0.36 -1.12 0.08 0.00 -1.18 0.00 0.00 61.69 59.82 2gqi s THR 22 Cb -0.16 -2.68 0.37 0.00 1.34 0.00 0.00 72.50 71.38 2gqi s THR 22 CO 0.46 0.00 1.15 0.47 -0.54 0.00 0.00 174.62 176.16 2gqi n ASP 23 N -1.22 2.87 -4.77 3.99 8.00 -1.26 -4.93 116.55 119.23 2gqi n ASP 23 Ca -0.06 -2.31 -0.38 0.00 0.71 0.00 0.00 54.79 52.75 2gqi n ASP 23 Cb 0.60 -0.48 -0.01 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.75 3.88 -0.02 -1.24 0.41 -1.26 -3.63 118.70 115.08 2gqi s GLU 24 Ca 0.26 1.88 0.06 0.00 -0.41 0.00 0.00 54.97 56.76 2gqi s GLU 24 Cb 0.18 -2.56 -0.01 0.00 -1.78 0.00 0.00 34.13 29.95 2gqi s GLU 24 CO 0.10 -0.48 -0.21 0.96 -0.49 0.00 0.00 175.26 175.14 2gqi s ILE 25 N -1.43 1.68 0.06 -1.63 -4.36 -1.26 -4.70 121.20 109.56 2gqi s ILE 25 Ca 0.60 -0.90 -0.21 0.00 -0.26 0.00 0.00 60.65 59.89 2gqi s ILE 25 Cb -0.32 -1.40 -0.06 0.00 1.25 0.00 0.00 42.46 41.93 2gqi s ILE 25 CO 0.39 0.47 0.62 -0.94 0.24 0.00 0.00 174.94 175.72 2gqi s SER 26 N -0.41 7.09 0.18 4.36 1.04 -1.26 -4.37 113.70 120.33 2gqi s SER 26 Ca 0.06 1.30 -0.00 0.00 0.48 0.00 0.00 55.95 57.79 2gqi s SER 26 Cb -0.09 -2.39 -0.04 0.00 0.10 0.00 0.00 66.02 63.60 2gqi s SER 26 CO -0.00 0.20 0.08 0.72 0.98 0.00 0.00 173.24 175.22 2gqi s PHE 27 N -0.81 1.12 0.22 5.02 -0.71 -1.23 -4.99 117.98 116.60 2gqi s PHE 27 Ca 0.31 -1.24 0.10 0.00 -1.04 0.00 0.00 56.93 55.06 2gqi s PHE 27 Cb -0.20 -0.61 -0.04 0.00 -1.21 0.00 0.00 43.02 40.96 2gqi s PHE 27 CO 0.20 -0.48 -0.15 -0.51 -1.34 0.00 0.00 175.22 172.94 2gqi s LEU 28 N -3.15 2.76 -0.21 -1.99 1.43 -1.26 -3.03 118.68 113.23 2gqi s LEU 28 Ca 0.31 -0.77 -0.37 0.00 -1.03 0.00 0.00 54.13 52.28 2gqi s LEU 28 Cb 0.07 -1.40 -0.13 0.00 0.03 0.00 0.00 46.19 44.76 2gqi s LEU 28 CO 0.07 0.08 1.88 1.17 0.23 0.00 0.00 176.35 179.79 2gqi n LYS 29 N -0.16 1.58 0.00 1.70 4.81 -1.26 -0.53 118.16 124.31 2gqi n LYS 29 Ca -0.10 0.56 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 2gqi n LYS 29 Cb 0.57 -2.40 0.00 0.00 0.02 0.00 0.00 35.03 33.22 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 4.69 0.94 3.75 3.14 0.00 0.39 -4.99 105.19 113.10 2gqi n GLY 30 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.92 6.64 0.63 1.61 1.11 0.31 -4.70 116.67 120.36 2gqi s ASP 31 Ca 0.00 2.69 0.01 0.00 0.18 0.00 0.00 52.55 55.43 2gqi s ASP 31 Cb 0.00 -2.63 0.08 0.00 1.07 0.00 0.00 42.92 41.45 2gqi s ASP 31 CO 0.00 -0.70 0.88 -0.04 1.18 0.00 0.00 175.17 176.49 2gqi s MET 32 N -0.51 2.12 0.23 8.23 -1.94 -1.26 -1.18 119.30 124.98 2gqi s MET 32 Ca 0.59 -1.00 -0.22 0.00 -1.71 0.00 0.00 55.69 53.35 2gqi s MET 32 Cb -0.42 -2.42 0.04 0.00 2.01 0.00 0.00 34.83 34.04 2gqi s MET 32 CO 0.45 -1.07 0.68 -0.06 -0.01 0.00 0.00 175.02 175.00 2gqi s PHE 33 N -2.94 -0.33 -0.32 -0.03 0.40 -0.84 -3.56 117.98 110.38 2gqi s PHE 33 Ca 0.62 -0.02 0.02 0.00 -0.60 0.00 0.00 56.93 56.94 2gqi s PHE 33 Cb -0.08 0.65 0.10 0.00 0.51 0.00 0.00 43.02 44.20 2gqi s PHE 33 CO 0.41 -1.07 0.06 0.42 0.70 0.00 0.00 175.22 175.74 2gqi s ILE 34 N -3.83 1.62 -0.42 0.64 1.01 -1.22 -3.26 121.20 115.74 2gqi s ILE 34 Ca 0.07 -1.83 -0.27 0.00 0.00 0.00 0.00 60.65 58.62 2gqi s ILE 34 Cb -0.04 -2.17 -0.06 0.00 0.01 0.00 0.00 42.46 40.20 2gqi s ILE 34 CO -0.01 -0.57 2.33 -0.69 0.00 0.00 0.00 174.94 175.99 2gqi s VAL 35 N 1.25 3.03 -0.19 2.92 1.01 -0.61 -3.35 120.40 124.46 2gqi s VAL 35 Ca 0.08 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 61.89 2gqi s VAL 35 Cb -0.18 -3.06 -0.20 0.00 0.00 0.00 0.00 36.38 32.94 2gqi s VAL 35 CO -0.15 -0.05 0.25 0.45 0.00 0.00 0.00 175.10 175.60 2gqi h HIS 36 N 18.09 0.08 -4.00 5.22 3.86 -1.22 -3.27 115.15 133.91 2gqi h HIS 36 Ca -0.29 -0.06 -0.59 0.00 -1.16 0.00 0.00 60.37 58.27 2gqi h HIS 36 Cb 1.25 -0.00 -0.23 0.00 1.06 0.00 0.00 27.41 29.49 2gqi h HIS 36 CO 0.96 1.53 -0.84 1.21 0.86 0.00 0.00 177.93 181.65 2gqi s ASN 37 N -6.88 2.70 -0.22 2.45 2.47 -1.06 -4.99 114.94 109.40 2gqi s ASN 37 Ca -0.28 -0.66 0.01 0.00 0.42 0.00 0.00 52.86 52.35 2gqi s ASN 37 Cb 0.06 -0.18 0.03 0.00 -1.45 0.00 0.00 41.25 39.71 2gqi s ASN 37 CO 0.62 0.11 -0.13 -1.61 -3.72 0.00 0.00 177.10 172.37 2gqi s GLU 38 N -1.74 2.77 0.77 0.43 2.02 -1.26 -1.28 118.70 120.42 2gqi s GLU 38 Ca 0.08 -0.99 -0.03 0.00 0.02 0.00 0.00 54.97 54.04 2gqi s GLU 38 Cb -0.10 -2.79 0.15 0.00 0.10 0.00 0.00 34.13 31.49 2gqi s GLU 38 CO 0.04 -0.36 1.06 -0.51 0.02 0.00 0.00 175.26 175.51 2gqi s LEU 39 N 1.26 2.92 -0.02 1.80 2.01 -1.09 -5.03 118.68 120.53 2gqi s LEU 39 Ca 0.00 -0.29 0.22 0.00 0.01 0.00 0.00 54.13 54.07 2gqi s LEU 39 Cb -0.16 -1.96 -0.33 0.00 0.01 0.00 0.00 46.19 43.75 2gqi s LEU 39 CO -0.08 -2.05 0.50 -0.62 1.01 0.00 0.00 176.35 175.10 2gqi n GLU 40 N -3.02 0.65 0.00 1.70 1.02 -1.26 -4.16 120.64 115.57 2gqi n GLU 40 Ca 0.16 -0.19 0.08 0.00 -0.02 0.00 0.00 57.16 57.19 2gqi n GLU 40 Cb 0.60 -1.53 0.48 0.00 -0.02 0.00 0.00 31.44 30.98 2gqi n GLU 40 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2gqi n ASP 41 N -2.26 0.00 0.00 1.62 8.00 -1.26 -4.80 116.55 117.85 2gqi n ASP 41 Ca -0.04 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.76 2gqi n ASP 41 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 2gqi n ASP 41 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gqi n GLY 42 N 0.19 1.05 3.92 0.44 0.00 -1.26 -5.06 105.19 104.47 2gqi n GLY 42 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.26 2.54 -0.19 1.61 0.52 -1.26 -3.90 118.94 116.00 2gqi s TRP 43 Ca 0.00 0.49 -0.07 0.00 0.02 0.00 0.00 56.10 56.53 2gqi s TRP 43 Cb 0.00 -3.51 0.08 0.00 -1.15 0.00 0.00 33.47 28.89 2gqi s TRP 43 CO 0.00 -1.86 0.41 -1.64 0.02 0.00 0.00 176.95 173.88 2gqi s MET 44 N -5.52 0.33 -0.72 4.98 -1.94 -1.10 -2.66 119.30 112.68 2gqi s MET 44 Ca 0.64 0.96 -0.26 0.00 -1.71 0.00 0.00 55.69 55.33 2gqi s MET 44 Cb -0.09 0.22 -0.03 0.00 2.01 0.00 0.00 34.83 36.95 2gqi s MET 44 CO 0.48 -0.23 1.86 -0.46 -0.01 0.00 0.00 175.02 176.66 2gqi s TRP 45 N 2.30 1.75 0.32 -0.03 -0.11 -0.40 -3.59 118.94 119.18 2gqi s TRP 45 Ca -0.03 0.67 0.03 0.00 1.22 0.00 0.00 56.10 57.99 2gqi s TRP 45 Cb -0.11 -4.10 0.03 0.00 -1.50 0.00 0.00 33.47 27.78 2gqi s TRP 45 CO -0.13 -2.11 0.24 1.33 -4.62 0.00 0.00 176.95 171.67 2gqi n VAL 46 N 7.40 0.00 -3.60 5.86 0.24 -1.12 -0.64 118.33 126.46 2gqi n VAL 46 Ca 0.27 -1.29 -0.21 0.00 -2.04 0.00 0.00 64.34 61.07 2gqi n VAL 46 Cb 0.50 -0.22 -0.16 0.00 -1.47 0.00 0.00 33.84 32.49 2gqi n VAL 46 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2gqi s THR 47 N -1.60 -0.18 0.21 3.34 2.01 -1.21 -1.81 115.64 116.39 2gqi s THR 47 Ca 0.18 0.05 -0.32 0.00 0.31 0.00 0.00 61.69 61.91 2gqi s THR 47 Cb -0.01 -0.47 -0.13 0.00 0.01 0.00 0.00 72.50 71.90 2gqi s THR 47 CO 0.12 -0.10 1.66 -3.20 -0.69 0.00 0.00 174.62 172.40 2gqi n ASN 48 N 5.30 3.69 0.19 3.53 2.85 0.08 -3.37 115.26 127.53 2gqi n ASN 48 Ca -0.05 1.08 0.07 0.00 -0.11 0.00 0.00 54.58 55.57 2gqi n ASN 48 Cb 0.49 -1.53 0.21 0.00 1.24 0.00 0.00 39.78 40.19 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 6.20 0.00 0.12 1.20 3.38 -1.89 0.45 115.31 124.77 2gqi h LEU 49 Ca -0.44 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 2gqi h LEU 49 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2gqi h LEU 49 CO 0.91 0.29 -0.06 -0.09 0.09 0.00 0.00 178.44 179.58 2gqi h ARG 50 N 0.00 -0.15 0.00 1.13 2.43 -1.90 -3.33 114.38 112.56 2gqi h ARG 50 Ca -0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2gqi h ARG 50 Cb 1.08 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2gqi h ARG 50 CO 0.04 0.30 -0.53 0.25 -1.51 0.00 0.00 179.97 178.52 2gqi n THR 51 N -4.86 0.21 -3.59 0.20 -2.24 -1.25 -4.95 114.28 97.80 2gqi n THR 51 Ca -0.07 -0.16 -0.26 0.00 -2.27 0.00 0.00 64.05 61.30 2gqi n THR 51 Cb 0.26 -0.03 0.05 0.00 -2.10 0.00 0.00 70.33 68.52 2gqi n THR 51 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2gqi n ASP 52 N -1.85 -5.79 -4.30 3.42 9.92 0.16 -4.99 116.55 113.12 2gqi n ASP 52 Ca 0.04 -0.56 -0.22 0.00 -0.53 0.00 0.00 54.79 53.52 2gqi n ASP 52 Cb 0.39 -4.59 -0.12 0.00 -0.64 0.00 0.00 41.12 36.16 2gqi n ASP 52 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2gqi s GLU 53 N -6.30 1.17 0.27 -1.24 0.41 -1.13 -4.92 118.70 106.96 2gqi s GLU 53 Ca 0.56 -1.28 0.01 0.00 -0.41 0.00 0.00 54.97 53.85 2gqi s GLU 53 Cb -0.26 -1.28 -0.04 0.00 -1.78 0.00 0.00 34.13 30.77 2gqi s GLU 53 CO 0.69 0.28 0.45 -0.65 -0.49 0.00 0.00 175.26 175.54 2gqi s GLN 54 N -2.40 3.49 0.00 1.61 1.11 -1.26 -0.74 119.66 121.48 2gqi s GLN 54 Ca 0.11 -0.41 0.00 0.00 0.01 0.00 0.00 55.36 55.07 2gqi s GLN 54 Cb -0.07 -2.77 0.00 0.00 -1.01 0.00 0.00 33.01 29.15 2gqi s GLN 54 CO 0.05 0.30 0.00 0.41 0.01 0.00 0.00 175.29 176.06 2gqi n GLY 55 N -1.27 0.89 3.47 3.09 0.00 -0.75 -4.87 105.19 105.75 2gqi n GLY 55 Ca -0.05 -0.66 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 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 2.66 0.31 0.99 1.43 -1.24 -2.81 118.68 120.03 2gqi s LEU 56 Ca 0.00 -0.42 -0.05 0.00 -1.03 0.00 0.00 54.13 52.63 2gqi s LEU 56 Cb 0.00 -1.55 -0.00 0.00 0.03 0.00 0.00 46.19 44.67 2gqi s LEU 56 CO 0.00 0.25 0.44 0.27 0.23 0.00 0.00 176.35 177.54 2gqi s ILE 57 N -0.96 0.00 -0.06 -0.59 -4.36 -1.24 -4.44 121.20 109.56 2gqi s ILE 57 Ca 0.15 -1.59 0.05 0.00 -0.26 0.00 0.00 60.65 59.00 2gqi s ILE 57 Cb -0.11 -2.54 -0.00 0.00 1.25 0.00 0.00 42.46 41.06 2gqi s ILE 57 CO 0.06 0.00 -0.20 0.54 0.24 0.00 0.00 174.94 175.58 2gqi s VAL 58 N -3.36 1.69 0.59 8.37 0.11 -1.26 -2.69 120.40 123.86 2gqi s VAL 58 Ca 0.30 -0.85 0.29 0.00 -2.93 0.00 0.00 61.98 58.78 2gqi s VAL 58 Cb 0.00 -1.45 0.36 0.00 -1.53 0.00 0.00 36.38 33.76 2gqi s VAL 58 CO 0.17 0.48 2.12 1.05 -3.33 0.00 0.00 175.10 175.59 2gqi h GLU 59 N 6.29 0.00 0.00 1.54 4.11 -1.87 0.18 114.58 124.84 2gqi h GLU 59 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 2gqi h GLU 59 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2gqi h GLU 59 CO 0.47 0.00 0.00 -3.47 0.07 0.00 0.00 179.01 176.08 2gqi n ASP 60 N -3.77 0.29 -0.08 3.06 2.03 -1.26 -2.34 116.55 114.48 2gqi n ASP 60 Ca 0.01 0.59 -0.09 0.00 0.52 0.00 0.00 54.79 55.82 2gqi n ASP 60 Cb 0.29 -0.64 -0.12 0.00 -0.72 0.00 0.00 41.12 39.93 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 -1.84 0.42 -4.90 -2.67 4.77 0.62 -5.02 117.00 108.38 2gqi n LEU 61 Ca 0.02 -0.02 -0.25 0.00 -0.03 0.00 0.00 56.01 55.74 2gqi n LEU 61 Cb 0.13 0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 2gqi n LEU 61 CO 0.12 0.45 0.06 0.68 -1.33 0.00 0.00 177.39 177.37 2gqi s VAL 62 N -2.38 1.92 0.23 4.08 -7.23 -0.99 -2.70 120.40 113.33 2gqi s VAL 62 Ca -0.10 -1.43 -0.10 0.00 -1.81 0.00 0.00 61.98 58.54 2gqi s VAL 62 Cb 0.05 -2.35 -0.01 0.00 0.56 0.00 0.00 36.38 34.63 2gqi s VAL 62 CO 0.61 0.00 0.39 -1.83 -0.31 0.00 0.00 175.10 173.96 2gqi s GLU 63 N -4.27 1.43 0.34 4.82 -1.05 -0.08 -4.79 118.70 115.10 2gqi s GLU 63 Ca 0.40 -1.31 -0.27 0.00 -0.15 0.00 0.00 54.97 53.64 2gqi s GLU 63 Cb -0.02 0.42 -0.09 0.00 -0.44 0.00 0.00 34.13 33.99 2gqi s GLU 63 CO 0.24 -0.57 1.06 -1.83 0.95 0.00 0.00 175.26 175.11 2gqi s GLU 64 N -4.04 4.41 0.11 -4.83 -1.05 -1.26 -1.67 118.70 110.37 2gqi s GLU 64 Ca 0.25 1.62 0.00 0.00 -0.15 0.00 0.00 54.97 56.69 2gqi s GLU 64 Cb 0.01 -2.85 0.00 0.00 -0.44 0.00 0.00 34.13 30.85 2gqi s GLU 64 CO 0.08 0.05 0.00 0.28 0.95 0.00 0.00 175.26 176.63 2gqi n VAL 65 N 0.54 0.99 -3.98 1.83 0.31 -1.20 -4.85 118.33 111.98 2gqi n VAL 65 Ca 0.02 0.33 -0.29 0.00 -0.01 0.00 0.00 64.34 64.39 2gqi n VAL 65 Cb 0.48 -1.40 -0.00 0.00 -0.91 0.00 0.00 33.84 32.00 2gqi n VAL 65 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2gqi n SER 66 N -3.41 -2.52 -0.11 4.52 7.64 -1.26 -4.94 113.62 113.54 2gqi n SER 66 Ca 0.00 -0.92 0.00 0.00 1.01 0.00 0.00 58.87 58.96 2gqi n SER 66 Cb 0.00 -3.36 0.00 0.00 -1.01 0.00 0.00 64.21 59.84 2gqi n SER 66 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gqi n GLY 67 N -1.68 5.69 3.60 0.23 0.00 -1.26 -5.16 105.19 106.60 2gqi n GLY 67 Ca -0.11 -1.59 -0.30 0.00 0.00 0.00 0.00 46.02 44.02 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 0.73 -1.10 0.15 1.61 0.04 -1.26 -5.05 135.00 130.12 2gqi s PRO 68 Ca 0.00 -0.02 -0.05 0.00 0.04 0.00 0.00 61.00 60.98 2gqi s PRO 68 Cb 0.00 -1.61 -0.06 0.00 0.04 0.00 0.00 34.50 32.88 2gqi s PRO 68 CO 0.00 -3.64 0.38 -1.54 0.04 0.00 0.00 177.00 172.24 2gqi s SER 69 N -3.85 6.49 -0.08 6.66 1.04 -1.26 -5.10 113.70 117.60 2gqi s SER 69 Ca 0.70 0.59 0.02 0.00 0.48 0.00 0.00 55.95 57.74 2gqi s SER 69 Cb -0.11 -2.09 -0.02 0.00 0.10 0.00 0.00 66.02 63.90 2gqi s SER 69 CO 0.56 0.04 -0.12 -0.55 0.98 0.00 0.00 173.24 174.15 2gqi s SER 70 N -2.46 4.17 0.00 7.02 0.15 -1.26 -5.26 113.70 116.06 2gqi s SER 70 Ca 0.41 -0.19 0.00 0.00 0.70 0.00 0.00 55.95 56.87 2gqi s SER 70 Cb -0.12 -1.13 0.00 0.00 -1.71 0.00 0.00 66.02 63.06 2gqi s SER 70 CO 0.25 0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.59