#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gqc n SER 2 N 0.00 1.00 -3.32 3.17 3.41 -1.26 -4.89 113.62 111.72 2gqc n SER 2 Ca 0.00 -2.48 -0.11 0.00 -0.26 0.00 0.00 58.87 56.02 2gqc n SER 2 Cb 0.00 -0.33 -0.06 0.00 -0.26 0.00 0.00 64.21 63.56 2gqc n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gqc s ALA 3 N -0.95 -1.01 -0.13 7.33 0.00 -1.25 -4.39 121.76 121.36 2gqc s ALA 3 Ca 0.24 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.03 2gqc s ALA 3 Cb 0.25 -2.10 -0.01 0.00 0.00 0.00 0.00 23.12 21.26 2gqc s ALA 3 CO -0.07 -1.89 -0.15 0.08 0.00 0.00 0.00 175.76 173.73 2gqc s VAL 4 N 2.16 2.85 -0.25 0.00 1.01 -1.25 -4.91 120.40 120.02 2gqc s VAL 4 Ca 0.12 -0.73 -0.28 0.00 0.00 0.00 0.00 61.98 61.09 2gqc s VAL 4 Cb -0.13 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2gqc s VAL 4 CO -0.22 0.53 2.22 -1.58 0.00 0.00 0.00 175.10 176.05 2gqc s GLN 5 N 0.44 3.05 0.00 2.72 -0.44 -1.26 -3.96 119.66 120.20 2gqc s GLN 5 Ca -0.11 1.95 0.00 0.00 -2.50 0.00 0.00 55.36 54.69 2gqc s GLN 5 Cb -0.16 -4.38 0.00 0.00 -1.64 0.00 0.00 33.01 26.82 2gqc s GLN 5 CO 0.05 -2.20 0.00 1.55 0.50 0.00 0.00 175.29 175.19 2gqc n VAL 6 N 7.77 0.00 -4.32 1.34 3.14 -1.23 -5.06 118.33 119.97 2gqc n VAL 6 Ca 0.30 0.00 -0.27 0.00 -2.96 0.00 0.00 64.34 61.41 2gqc n VAL 6 Cb 0.46 0.00 -0.10 0.00 -1.06 0.00 0.00 33.84 33.14 2gqc n VAL 6 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 2gqc s LEU 7 N -0.98 2.83 -0.05 6.55 0.20 -0.49 -4.94 118.68 121.80 2gqc s LEU 7 Ca 0.00 -0.65 -0.21 0.00 0.69 0.00 0.00 54.13 53.96 2gqc s LEU 7 Cb 0.00 -1.53 0.04 0.00 -0.43 0.00 0.00 46.19 44.27 2gqc s LEU 7 CO 0.00 0.11 0.47 -1.59 -0.29 0.00 0.00 176.35 175.06 2gqc s LYS 8 N -2.75 0.80 -0.59 1.98 -2.85 -1.26 0.22 119.74 115.29 2gqc s LYS 8 Ca 0.23 0.10 0.04 0.00 -1.00 0.00 0.00 55.97 55.35 2gqc s LYS 8 Cb -0.09 0.37 0.15 0.00 -2.06 0.00 0.00 37.83 36.20 2gqc s LYS 8 CO 0.14 -0.22 0.35 -0.59 0.10 0.00 0.00 175.35 175.13 2gqc s PHE 9 N -1.05 3.23 -0.14 1.78 -0.12 0.21 -4.88 117.98 117.02 2gqc s PHE 9 Ca -0.11 -3.19 -0.03 0.00 -0.05 0.00 0.00 56.93 53.55 2gqc s PHE 9 Cb -0.03 -2.69 -0.04 0.00 -0.63 0.00 0.00 43.02 39.64 2gqc s PHE 9 CO 0.06 -0.67 0.35 -2.30 -0.05 0.00 0.00 175.22 172.61 2gqc n PRO 10 N 2.67 0.00 0.00 1.99 -0.02 -1.26 -3.41 135.00 134.96 2gqc n PRO 10 Ca 0.12 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.66 2gqc n PRO 10 Cb 0.34 -0.19 0.30 0.00 -0.02 0.00 0.00 33.50 33.93 2gqc n PRO 10 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 2gqc n LEU 11 N 1.22 0.00 -0.42 2.45 -0.00 -1.26 -1.24 117.00 117.75 2gqc n LEU 11 Ca 0.09 0.45 0.11 0.00 -0.00 0.00 0.00 56.01 56.67 2gqc n LEU 11 Cb 0.01 -0.45 0.09 0.00 -0.00 0.00 0.00 43.42 43.07 2gqc n LEU 11 CO 0.14 -0.24 0.38 -1.20 -0.00 0.00 0.00 177.39 176.47 2gqc n SER 12 N -1.45 1.75 -2.13 1.45 7.64 -1.26 -4.98 113.62 114.65 2gqc n SER 12 Ca 0.04 -1.35 -0.08 0.00 1.01 0.00 0.00 58.87 58.50 2gqc n SER 12 Cb 0.14 0.41 -0.02 0.00 -1.01 0.00 0.00 64.21 63.73 2gqc n SER 12 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2gqc n VAL 13 N -0.22 0.00 -1.13 0.44 0.24 -0.37 -5.01 118.33 112.28 2gqc n VAL 13 Ca 0.10 -0.77 -0.31 0.00 -2.04 0.00 0.00 64.34 61.31 2gqc n VAL 13 Cb 0.44 0.30 -0.05 0.00 -1.47 0.00 0.00 33.84 33.06 2gqc n VAL 13 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2gqc n ASP 14 N -2.04 7.35 0.20 -1.34 2.03 -1.26 -4.64 116.55 116.85 2gqc n ASP 14 Ca -0.01 -2.49 0.13 0.00 0.52 0.00 0.00 54.79 52.94 2gqc n ASP 14 Cb 0.20 -1.42 0.68 0.00 -0.72 0.00 0.00 41.12 39.86 2gqc n ASP 14 CO 0.00 0.00 0.00 0.17 -1.92 0.00 0.00 177.20 175.45 2gqc h LEU 15 N 6.91 0.00 -1.81 -2.67 8.10 -1.91 -2.94 115.31 121.00 2gqc h LEU 15 Ca 0.68 0.00 0.12 0.00 0.11 0.00 0.00 57.88 58.80 2gqc h LEU 15 Cb 0.45 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.65 2gqc h LEU 15 CO 1.45 0.00 0.55 0.00 -4.11 0.00 0.00 178.44 176.34 2gqc h ALA 16 N 1.89 2.12 -0.24 0.17 0.00 -1.92 0.80 119.26 122.08 2gqc h ALA 16 Ca 0.00 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.70 2gqc h ALA 16 Cb 0.09 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2gqc h ALA 16 CO 0.00 -0.77 -0.62 0.78 0.00 0.00 0.00 179.25 178.64 2gqc h GLY 17 N 0.00 0.90 0.02 0.00 0.00 -1.92 -2.77 103.07 99.30 2gqc h GLY 17 Ca 0.20 -1.12 -0.40 0.00 0.00 0.00 0.00 47.33 46.02 2gqc h GLY 17 CO -0.00 1.00 -2.18 0.33 0.00 0.00 0.00 176.54 175.69 2gqc n PHE 18 N -3.98 0.32 -0.01 5.60 -0.00 0.22 -2.49 117.46 117.13 2gqc n PHE 18 Ca -0.05 0.13 0.01 0.00 -0.00 0.00 0.00 57.45 57.54 2gqc n PHE 18 Cb 0.66 -1.03 0.33 0.00 -0.00 0.00 0.00 39.48 39.44 2gqc n PHE 18 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.76 176.52 2gqc h VAL 19 N -0.88 1.17 -0.44 -2.13 3.04 -0.05 0.27 116.25 117.23 2gqc h VAL 19 Ca -0.59 -0.60 -0.09 0.00 -1.01 0.00 0.00 66.70 64.40 2gqc h VAL 19 Cb 1.57 0.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.63 2gqc h VAL 19 CO -0.33 0.22 -0.08 1.23 -1.01 0.00 0.00 177.57 177.60 2gqc h GLY 20 N 0.76 0.91 0.42 3.17 0.00 -1.56 -2.38 103.07 104.39 2gqc h GLY 20 Ca 0.13 -0.73 0.05 0.00 0.00 0.00 0.00 47.33 46.78 2gqc h GLY 20 CO -0.00 0.67 -0.11 -2.00 0.00 0.00 0.00 176.54 175.10 2gqc h LEU 21 N 0.68 -0.36 0.00 3.11 6.46 -0.17 0.34 115.31 125.37 2gqc h LEU 21 Ca 0.12 0.09 -0.13 0.00 -0.12 0.00 0.00 57.88 57.84 2gqc h LEU 21 Cb 0.61 0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 40.73 2gqc h LEU 21 CO 0.04 -0.14 -1.00 0.17 -0.62 0.00 0.00 178.44 176.89 2gqc h LEU 22 N -0.07 0.00 -2.08 2.25 -0.00 -1.47 -2.88 115.31 111.06 2gqc h LEU 22 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.01 2gqc h LEU 22 Cb 0.26 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.92 2gqc h LEU 22 CO -0.29 0.50 0.01 -0.09 -0.00 0.00 0.00 178.44 178.57 2gqc h ARG 23 N 0.00 0.00 0.00 0.17 1.12 -0.84 -0.27 114.38 114.56 2gqc h ARG 23 Ca -0.08 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.77 2gqc h ARG 23 Cb 1.45 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 31.41 2gqc h ARG 23 CO 0.05 0.00 -0.09 0.00 -3.11 0.00 0.00 179.97 176.82 2gqc h ARG 24 N 0.00 0.00 0.03 0.20 3.08 -0.12 -3.34 114.38 114.23 2gqc h ARG 24 Ca 0.01 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.93 2gqc h ARG 24 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2gqc h ARG 24 CO -0.00 0.09 -0.66 -0.07 -1.07 0.00 0.00 179.97 178.27 2gqc h LEU 25 N 0.00 0.09 0.00 3.04 3.38 -1.00 -3.47 115.31 117.35 2gqc h LEU 25 Ca -0.00 -0.82 0.00 0.00 0.09 0.00 0.00 57.88 57.15 2gqc h LEU 25 Cb 0.95 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.67 2gqc h LEU 25 CO 0.01 1.27 0.00 -0.46 0.09 0.00 0.00 178.44 179.35 2gqc n ASN 26 N -4.42 0.00 -3.48 -0.43 0.23 -1.05 -5.06 115.26 101.05 2gqc n ASN 26 Ca -0.19 0.00 -0.18 0.00 -0.53 0.00 0.00 54.58 53.67 2gqc n ASN 26 Cb 0.63 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.33 2gqc n ASN 26 CO 0.00 0.00 0.00 0.55 -0.93 0.00 0.00 177.26 176.88 2gqc n VAL 27 N 0.00 -1.66 -0.55 3.53 3.14 -0.99 -4.85 118.33 116.96 2gqc n VAL 27 Ca 0.00 -0.12 0.04 0.00 -2.96 0.00 0.00 64.34 61.30 2gqc n VAL 27 Cb 0.00 -1.45 0.32 0.00 -1.06 0.00 0.00 33.84 31.64 2gqc n VAL 27 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 2gqc n PRO 28 N -2.24 4.03 -4.49 1.45 -0.04 -1.26 -5.01 135.00 127.44 2gqc n PRO 28 Ca -0.14 -2.54 -0.27 0.00 -0.04 0.00 0.00 63.50 60.52 2gqc n PRO 28 Cb 0.36 -2.11 -0.10 0.00 -0.04 0.00 0.00 33.50 31.61 2gqc n PRO 28 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 2gqc s HIS 29 N -2.44 2.51 -0.15 0.54 -3.43 -1.26 -4.95 115.29 106.11 2gqc s HIS 29 Ca 0.44 -0.58 -0.18 0.00 -0.80 0.00 0.00 55.06 53.94 2gqc s HIS 29 Cb 0.34 -1.67 -0.04 0.00 -1.43 0.00 0.00 32.58 29.78 2gqc s HIS 29 CO 0.13 0.44 0.48 0.50 -2.00 0.00 0.00 174.74 174.29 2gqc s ARG 30 N -3.72 4.28 -0.22 -0.38 3.52 -1.09 -4.92 118.95 116.43 2gqc s ARG 30 Ca 0.35 0.41 -0.08 0.00 -0.13 0.00 0.00 55.73 56.28 2gqc s ARG 30 Cb 0.06 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 2gqc s ARG 30 CO 0.19 0.05 0.09 0.08 -0.81 0.00 0.00 175.30 174.90 2gqc s VAL 31 N 0.97 4.81 -0.19 7.11 1.01 -1.25 -1.05 120.40 131.82 2gqc s VAL 31 Ca 0.25 -0.02 -0.15 0.00 0.00 0.00 0.00 61.98 62.06 2gqc s VAL 31 Cb -0.15 -3.21 0.05 0.00 0.00 0.00 0.00 36.38 33.07 2gqc s VAL 31 CO 0.10 0.39 0.48 -0.44 0.00 0.00 0.00 175.10 175.64 2gqc s SER 32 N 0.90 -0.55 -0.84 3.32 0.01 0.14 -4.92 113.70 111.76 2gqc s SER 32 Ca 0.05 1.00 -0.25 0.00 1.31 0.00 0.00 55.95 58.06 2gqc s SER 32 Cb -0.14 0.97 0.04 0.00 0.21 0.00 0.00 66.02 67.11 2gqc s SER 32 CO 0.03 -0.18 1.32 -1.61 0.41 0.00 0.00 173.24 173.21 2gqc s GLU 33 N 0.68 3.33 -0.13 12.44 2.02 -1.26 0.24 118.70 136.02 2gqc s GLU 33 Ca -0.03 -0.60 0.01 0.00 0.02 0.00 0.00 54.97 54.37 2gqc s GLU 33 Cb -0.05 -4.61 -0.00 0.00 0.10 0.00 0.00 34.13 29.57 2gqc s GLU 33 CO -0.05 -2.15 -0.17 -2.00 0.02 0.00 0.00 175.26 170.91 2gqc s GLU 34 N 5.35 3.21 0.00 1.61 2.56 0.54 -4.60 118.70 127.37 2gqc s GLU 34 Ca 0.38 -0.77 0.00 0.00 0.00 0.00 0.00 54.97 54.58 2gqc s GLU 34 Cb -0.05 -2.53 0.00 0.00 2.00 0.00 0.00 34.13 33.55 2gqc s GLU 34 CO 0.06 0.11 0.00 0.45 -0.56 0.00 0.00 175.26 175.32 2gqc n SER 35 N 3.76 -4.04 0.00 -1.70 2.88 -1.26 -2.27 113.62 110.99 2gqc n SER 35 Ca -0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.35 2gqc n SER 35 Cb 0.52 -1.89 0.00 0.00 -0.75 0.00 0.00 64.21 62.09 2gqc n SER 35 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gqc n GLY 36 N -1.14 0.94 3.29 0.46 0.00 -1.26 -5.07 105.19 102.42 2gqc n GLY 36 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2gqc n GLY 36 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gqc s GLN 37 N -0.89 1.16 0.28 1.61 -0.21 -0.96 -4.56 119.66 116.09 2gqc s GLN 37 Ca 0.00 -1.36 -0.29 0.00 0.02 0.00 0.00 55.36 53.73 2gqc s GLN 37 Cb 0.00 -1.09 -0.10 0.00 1.00 0.00 0.00 33.01 32.83 2gqc s GLN 37 CO 0.00 0.21 1.30 -0.65 -2.12 0.00 0.00 175.29 174.03 2gqc s GLN 38 N -2.89 4.39 0.01 2.91 -0.21 -1.22 -0.34 119.66 122.31 2gqc s GLN 38 Ca 0.14 2.14 0.03 0.00 0.02 0.00 0.00 55.36 57.69 2gqc s GLN 38 Cb -0.04 -3.12 -0.01 0.00 1.00 0.00 0.00 33.01 30.83 2gqc s GLN 38 CO 0.05 -0.18 -0.10 0.08 -2.12 0.00 0.00 175.29 173.01 2gqc s VAL 39 N -0.69 0.80 -0.13 1.09 1.01 0.14 0.68 120.40 123.29 2gqc s VAL 39 Ca 0.52 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2gqc s VAL 39 Cb -0.38 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.30 2gqc s VAL 39 CO 0.47 0.12 -0.20 -0.22 0.00 0.00 0.00 175.10 175.26 2gqc s LEU 40 N -0.53 2.27 -0.28 3.92 0.20 0.13 0.25 118.68 124.64 2gqc s LEU 40 Ca 0.02 -0.53 0.01 0.00 0.69 0.00 0.00 54.13 54.32 2gqc s LEU 40 Cb -0.05 -1.48 0.08 0.00 -0.43 0.00 0.00 46.19 44.31 2gqc s LEU 40 CO 0.00 0.11 0.02 0.26 -0.29 0.00 0.00 176.35 176.46 2gqc s TRP 41 N 0.63 2.45 -0.01 5.38 0.52 -0.21 -1.39 118.94 126.31 2gqc s TRP 41 Ca -0.10 -2.01 0.02 0.00 0.02 0.00 0.00 56.10 54.02 2gqc s TRP 41 Cb -0.16 -1.92 0.02 0.00 -1.15 0.00 0.00 33.47 30.26 2gqc s TRP 41 CO 0.03 -0.84 0.77 1.33 0.02 0.00 0.00 176.95 178.25 2gqc n VAL 42 N 4.64 0.29 -1.92 4.03 0.24 -1.25 -2.67 118.33 121.69 2gqc n VAL 42 Ca -0.05 -0.32 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 2gqc n VAL 42 Cb 0.43 0.68 0.00 0.00 -1.47 0.00 0.00 33.84 33.48 2gqc n VAL 42 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2gqc n PRO 43 N -0.19 3.25 0.03 7.34 -0.04 -1.26 -4.77 135.00 139.36 2gqc n PRO 43 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2gqc n PRO 43 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 2gqc n PRO 43 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2gqc n ASP 44 N 0.00 0.28 0.00 3.54 9.92 -1.26 -3.77 116.55 125.26 2gqc n ASP 44 Ca 0.00 0.08 0.00 0.00 -0.53 0.00 0.00 54.79 54.34 2gqc n ASP 44 Cb 0.00 -0.05 0.00 0.00 -0.64 0.00 0.00 41.12 40.43 2gqc n ASP 44 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2gqc n GLU 45 N -2.85 0.00 -0.31 -1.24 2.13 -1.26 -4.83 120.64 112.28 2gqc n GLU 45 Ca 0.00 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.77 2gqc n GLU 45 Cb 0.00 0.00 0.08 0.00 0.27 0.00 0.00 31.44 31.79 2gqc n GLU 45 CO 0.00 0.00 0.00 0.07 -0.41 0.00 0.00 177.13 176.79 2gqc h ARG 46 N 0.00 1.20 0.00 5.31 -0.00 -2.03 -1.98 114.38 116.88 2gqc h ARG 46 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 59.98 59.83 2gqc h ARG 46 Cb 0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 29.97 29.74 2gqc h ARG 46 CO 0.00 0.90 -0.05 1.47 -0.00 0.00 0.00 179.97 182.29 2gqc n LEU 47 N -4.35 0.33 -0.24 0.08 -0.00 -1.26 -3.32 117.00 108.24 2gqc n LEU 47 Ca 0.08 0.49 0.03 0.00 -0.00 0.00 0.00 56.01 56.61 2gqc n LEU 47 Cb 0.11 -0.41 0.12 0.00 -0.00 0.00 0.00 43.42 43.24 2gqc n LEU 47 CO 0.39 -0.06 0.78 0.00 -0.00 0.00 0.00 177.39 178.51 2gqc h ALA 48 N 2.82 0.62 -0.46 1.47 0.00 -1.67 0.46 119.26 122.50 2gqc h ALA 48 Ca 0.00 0.25 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 2gqc h ALA 48 Cb 0.59 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2gqc h ALA 48 CO 0.00 -0.42 0.03 0.93 0.00 0.00 0.00 179.25 179.79 2gqc h GLU 49 N 0.06 0.80 0.00 0.00 4.39 -1.68 -2.74 114.58 115.41 2gqc h GLU 49 Ca 0.37 -0.24 -0.05 0.00 0.34 0.00 0.00 59.36 59.78 2gqc h GLU 49 Cb 0.61 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2gqc h GLU 49 CO -0.67 0.83 -0.25 -0.56 -1.16 0.00 0.00 179.01 177.21 2gqc h GLN 50 N 0.65 0.00 -0.02 2.33 -0.00 -1.25 0.53 115.11 117.36 2gqc h GLN 50 Ca 0.14 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.74 2gqc h GLN 50 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.93 2gqc h GLN 50 CO 0.02 0.25 -0.16 -0.24 -0.00 0.00 0.00 178.83 178.69 2gqc h VAL 51 N 0.00 1.52 0.24 1.86 3.04 0.15 0.12 116.25 123.18 2gqc h VAL 51 Ca -0.00 -1.77 -0.34 0.00 -1.01 0.00 0.00 66.70 63.58 2gqc h VAL 51 Cb 0.79 2.63 0.03 0.00 -2.01 0.00 0.00 31.29 32.73 2gqc h VAL 51 CO 0.03 0.48 -1.50 0.08 -1.01 0.00 0.00 177.57 175.65 2gqc h ARG 52 N -0.50 0.51 0.55 4.17 0.11 -1.46 -2.85 114.38 114.90 2gqc h ARG 52 Ca -0.02 -0.86 -0.03 0.00 0.10 0.00 0.00 59.98 59.17 2gqc h ARG 52 Cb 0.87 0.32 0.01 0.00 1.11 0.00 0.00 29.97 32.28 2gqc h ARG 52 CO 0.03 1.41 -0.26 0.93 0.10 0.00 0.00 179.97 182.18 2gqc h GLU 53 N 0.14 -0.71 -0.08 0.08 4.39 -0.96 -2.74 114.58 114.70 2gqc h GLU 53 Ca -0.26 0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.40 2gqc h GLU 53 Cb 2.15 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 30.95 2gqc h GLU 53 CO 0.26 -0.47 -0.34 -0.07 -1.16 0.00 0.00 179.01 177.23 2gqc h LEU 54 N -1.02 0.15 -0.65 1.33 4.07 -1.13 0.49 115.31 118.56 2gqc h LEU 54 Ca -0.07 -0.05 0.08 0.00 0.08 0.00 0.00 57.88 57.92 2gqc h LEU 54 Cb 0.56 -0.04 -0.07 0.00 1.08 0.00 0.00 40.66 42.19 2gqc h LEU 54 CO 0.12 0.49 0.30 1.88 -1.08 0.00 0.00 178.44 180.16 2gqc h TYR 55 N 0.13 0.54 -0.00 1.13 -1.99 -1.55 0.97 116.97 116.20 2gqc h TYR 55 Ca 0.02 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.77 2gqc h TYR 55 Cb 0.67 -0.15 0.00 0.00 2.00 0.00 0.00 36.73 39.26 2gqc h TYR 55 CO 0.01 0.20 -0.08 2.89 -0.00 0.00 0.00 178.16 181.18 2gqc n ARG 56 N -4.90 0.59 0.00 4.88 1.85 0.05 -1.80 116.66 117.32 2gqc n ARG 56 Ca 0.09 -0.14 0.00 0.00 -1.00 0.00 0.00 57.85 56.80 2gqc n ARG 56 Cb 0.24 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.16 2gqc n ARG 56 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2gqc n ARG 57 N -1.08 3.81 0.00 2.89 1.85 -0.50 -4.46 116.66 119.17 2gqc n ARG 57 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.99 2gqc n ARG 57 Cb 0.26 -0.40 0.00 0.00 -1.05 0.00 0.00 32.46 31.27 2gqc n ARG 57 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2gqc n TYR 58 N -0.10 0.00 -0.25 2.89 4.02 0.32 -3.26 117.16 120.78 2gqc n TYR 58 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.97 2gqc n TYR 58 Cb 0.00 0.00 0.16 0.00 -0.02 0.00 0.00 39.34 39.48 2gqc n TYR 58 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 2gqc n PRO 59 N -1.57 -0.06 -0.04 -0.72 -0.02 -0.45 0.12 135.00 132.26 2gqc n PRO 59 Ca 0.00 1.07 -0.08 0.00 -2.02 0.00 0.00 63.50 62.47 2gqc n PRO 59 Cb 0.00 -1.66 -0.14 0.00 -0.02 0.00 0.00 33.50 31.68 2gqc n PRO 59 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2gqc n GLU 60 N -5.03 0.65 0.00 -0.52 -0.58 -0.75 -3.64 120.64 110.77 2gqc n GLU 60 Ca 0.14 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 57.05 2gqc n GLU 60 Cb 0.46 -1.69 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 2gqc n GLU 60 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gqc n GLY 61 N 1.60 1.19 3.79 0.62 0.00 -0.46 0.09 105.19 112.02 2gqc n GLY 61 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 2gqc n GLY 61 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gqc s ASP 62 N -0.11 4.74 0.06 1.61 -1.08 0.31 -4.30 116.67 117.90 2gqc s ASP 62 Ca 0.00 1.68 0.01 0.00 -0.52 0.00 0.00 52.55 53.72 2gqc s ASP 62 Cb 0.00 -2.45 0.08 0.00 -1.46 0.00 0.00 42.92 39.09 2gqc s ASP 62 CO 0.00 -1.86 0.75 -0.81 0.52 0.00 0.00 175.17 173.77 2gqc n PRO 63 N -3.40 0.01 0.24 4.34 -0.04 -1.26 -1.72 135.00 133.18 2gqc n PRO 63 Ca 0.08 0.24 -0.10 0.00 -0.04 0.00 0.00 63.50 63.69 2gqc n PRO 63 Cb 0.54 -1.88 -0.05 0.00 -0.04 0.00 0.00 33.50 32.07 2gqc n PRO 63 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2gqc h GLN 64 N 0.00 -0.60 0.00 0.54 4.20 -1.89 -3.50 115.11 113.86 2gqc h GLN 64 Ca 0.00 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2gqc h GLN 64 Cb 0.70 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.61 2gqc h GLN 64 CO 0.00 -0.40 0.00 0.00 -0.67 0.00 0.00 178.83 177.76 2gqc n ALA 65 N -2.38 0.23 -0.09 3.87 0.00 -0.70 -5.08 120.51 116.35 2gqc n ALA 65 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2gqc n ALA 65 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.70 2gqc n ALA 65 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2gqc n THR 66 N 0.00 0.00 0.00 0.00 -1.04 0.11 -4.81 114.28 108.54 2gqc n THR 66 Ca 0.00 1.45 0.00 0.00 -2.04 0.00 0.00 64.05 63.46 2gqc n THR 66 Cb 0.00 -2.22 0.00 0.00 -1.82 0.00 0.00 70.33 66.29 2gqc n THR 66 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2gqc n LEU 67 N -2.29 0.00 -0.61 -4.42 -0.00 -1.17 -0.84 117.00 107.67 2gqc n LEU 67 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 56.01 56.10 2gqc n LEU 67 Cb 0.00 0.00 0.31 0.00 -0.00 0.00 0.00 43.42 43.73 2gqc n LEU 67 CO 0.00 0.00 0.73 -1.84 -0.00 0.00 0.00 177.39 176.28 2gqc n GLU 68 N 0.00 1.78 0.00 1.96 0.00 -1.26 -2.95 120.64 120.17 2gqc n GLU 68 Ca 0.00 -1.19 0.13 0.00 0.00 0.00 0.00 57.16 56.10 2gqc n GLU 68 Cb 0.00 -1.37 0.36 0.00 0.00 0.00 0.00 31.44 30.44 2gqc n GLU 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2gqc n ALA 69 N 0.43 2.84 0.00 -1.84 0.00 -0.02 -5.22 120.51 116.69 2gqc n ALA 69 Ca 0.15 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2gqc n ALA 69 Cb 0.33 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.71 2gqc n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50