#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 6.60 -2.72 6.12 7.64 -1.26 -4.45 113.62 125.56 2gqc n SER 2 Ca 0.00 -3.20 -0.04 0.00 1.01 0.00 0.00 58.87 56.64 2gqc n SER 2 Cb 0.00 -1.03 0.02 0.00 -1.01 0.00 0.00 64.21 62.20 2gqc n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gqc n ALA 3 N 0.06 -2.82 -2.48 -0.43 0.00 -1.25 -4.44 120.51 109.16 2gqc n ALA 3 Ca 0.37 -0.50 -0.32 0.00 0.00 0.00 0.00 53.44 52.99 2gqc n ALA 3 Cb 0.62 -2.38 -0.15 0.00 0.00 0.00 0.00 19.45 17.54 2gqc n ALA 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2gqc s VAL 4 N 0.90 2.52 -0.25 0.00 0.11 -1.26 -4.79 120.40 117.63 2gqc s VAL 4 Ca 0.27 -0.92 -0.28 0.00 -2.93 0.00 0.00 61.98 58.12 2gqc s VAL 4 Cb 0.07 -1.94 -0.04 0.00 -1.53 0.00 0.00 36.38 32.94 2gqc s VAL 4 CO -0.08 0.58 2.14 -1.58 -3.33 0.00 0.00 175.10 172.83 2gqc s GLN 5 N -0.55 3.15 0.00 1.54 -0.44 -1.26 -3.93 119.66 118.17 2gqc s GLN 5 Ca 0.08 1.90 0.00 0.00 -2.50 0.00 0.00 55.36 54.83 2gqc s GLN 5 Cb -0.11 -4.34 0.00 0.00 -1.64 0.00 0.00 33.01 26.92 2gqc s GLN 5 CO 0.01 -2.08 0.00 1.55 0.50 0.00 0.00 175.29 175.26 2gqc n VAL 6 N 7.70 0.00 -4.32 1.34 3.14 -1.23 -5.06 118.33 119.91 2gqc n VAL 6 Ca 0.29 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.38 2gqc n VAL 6 Cb 0.45 0.00 -0.11 0.00 -1.06 0.00 0.00 33.84 33.12 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 -0.37 2.71 -0.02 6.55 0.20 -0.55 -4.94 118.68 122.26 2gqc s LEU 7 Ca 0.00 -0.60 -0.18 0.00 0.69 0.00 0.00 54.13 54.04 2gqc s LEU 7 Cb 0.00 -1.51 0.03 0.00 -0.43 0.00 0.00 46.19 44.28 2gqc s LEU 7 CO 0.00 0.16 0.38 -1.59 -0.29 0.00 0.00 176.35 175.01 2gqc s LYS 8 N -2.33 0.75 -0.56 1.98 0.00 -1.26 0.47 119.74 118.79 2gqc s LYS 8 Ca 0.19 -0.13 0.04 0.00 0.00 0.00 0.00 55.97 56.07 2gqc s LYS 8 Cb -0.10 0.34 0.14 0.00 0.00 0.00 0.00 37.83 38.21 2gqc s LYS 8 CO 0.11 -0.22 0.31 -0.59 0.00 0.00 0.00 175.35 174.96 2gqc s PHE 9 N -1.40 3.25 -0.26 1.78 -0.12 0.25 -4.86 117.98 116.61 2gqc s PHE 9 Ca -0.12 -3.20 -0.06 0.00 -0.05 0.00 0.00 56.93 53.49 2gqc s PHE 9 Cb -0.04 -2.78 -0.07 0.00 -0.63 0.00 0.00 43.02 39.51 2gqc s PHE 9 CO 0.05 -0.70 0.65 -2.30 -0.05 0.00 0.00 175.22 172.87 2gqc n PRO 10 N 2.85 0.00 0.02 1.99 -0.02 -1.26 -3.25 135.00 135.33 2gqc n PRO 10 Ca 0.08 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.64 2gqc n PRO 10 Cb 0.33 -0.34 0.34 0.00 -0.02 0.00 0.00 33.50 33.80 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 2.27 0.09 -0.68 2.45 -0.00 -1.26 -1.30 117.00 118.57 2gqc n LEU 11 Ca 0.17 0.52 0.12 0.00 -0.00 0.00 0.00 56.01 56.83 2gqc n LEU 11 Cb 0.02 -0.51 0.14 0.00 -0.00 0.00 0.00 43.42 43.07 2gqc n LEU 11 CO 0.26 -0.29 0.55 -1.20 -0.00 0.00 0.00 177.39 176.71 2gqc n SER 12 N -1.60 2.30 -2.57 1.45 7.64 -1.26 -4.98 113.62 114.60 2gqc n SER 12 Ca 0.03 -1.67 -0.12 0.00 1.01 0.00 0.00 58.87 58.12 2gqc n SER 12 Cb 0.18 0.17 -0.04 0.00 -1.01 0.00 0.00 64.21 63.52 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 0.55 0.00 -1.06 0.44 0.24 -0.42 -5.01 118.33 113.06 2gqc n VAL 13 Ca 0.13 -1.26 -0.28 0.00 -2.04 0.00 0.00 64.34 60.89 2gqc n VAL 13 Cb 0.50 0.50 -0.05 0.00 -1.47 0.00 0.00 33.84 33.32 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 -1.94 6.87 0.03 -1.34 2.03 -1.26 -4.65 116.55 116.29 2gqc n ASP 14 Ca -0.01 -2.46 0.02 0.00 0.52 0.00 0.00 54.79 52.86 2gqc n ASP 14 Cb 0.32 -1.37 0.10 0.00 -0.72 0.00 0.00 41.12 39.45 2gqc n ASP 14 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2gqc n LEU 15 N 3.52 0.09 -0.01 -2.67 -0.00 -1.26 -2.77 117.00 113.91 2gqc n LEU 15 Ca 0.61 0.52 0.23 0.00 -0.00 0.00 0.00 56.01 57.38 2gqc n LEU 15 Cb 0.32 -0.53 0.70 0.00 -0.00 0.00 0.00 43.42 43.91 2gqc n LEU 15 CO 0.66 -0.56 1.21 0.00 -0.00 0.00 0.00 177.39 178.71 2gqc h ALA 16 N 1.92 2.38 -0.28 1.47 0.00 -1.93 0.82 119.26 123.64 2gqc h ALA 16 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 2gqc h ALA 16 Cb 0.05 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2gqc h ALA 16 CO 0.00 -0.92 -0.48 0.78 0.00 0.00 0.00 179.25 178.62 2gqc h GLY 17 N 0.00 0.89 0.02 0.00 0.00 -1.93 -2.84 103.07 99.22 2gqc h GLY 17 Ca 0.29 -1.03 -0.37 0.00 0.00 0.00 0.00 47.33 46.21 2gqc h GLY 17 CO -0.00 0.92 -2.06 0.33 0.00 0.00 0.00 176.54 175.73 2gqc n PHE 18 N -4.09 0.42 -0.02 5.60 -0.00 0.19 -2.53 117.46 117.04 2gqc n PHE 18 Ca -0.05 0.17 0.02 0.00 -0.00 0.00 0.00 57.45 57.59 2gqc n PHE 18 Cb 0.59 -1.04 0.35 0.00 -0.00 0.00 0.00 39.48 39.38 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 -0.91 1.15 -0.20 -2.13 3.04 0.14 0.33 116.25 117.68 2gqc h VAL 19 Ca -0.56 -0.48 -0.13 0.00 -1.01 0.00 0.00 66.70 64.52 2gqc h VAL 19 Cb 1.54 0.67 -0.01 0.00 -2.01 0.00 0.00 31.29 31.48 2gqc h VAL 19 CO -0.31 0.19 -0.44 1.23 -1.01 0.00 0.00 177.57 177.22 2gqc h GLY 20 N 0.72 0.54 0.78 3.17 0.00 -1.57 -1.83 103.07 104.87 2gqc h GLY 20 Ca 0.14 -0.55 0.03 0.00 0.00 0.00 0.00 47.33 46.95 2gqc h GLY 20 CO -0.01 0.50 0.22 -2.00 0.00 0.00 0.00 176.54 175.25 2gqc h LEU 21 N 0.40 0.32 0.00 3.11 6.46 -0.05 0.27 115.31 125.83 2gqc h LEU 21 Ca 0.03 0.02 -0.15 0.00 -0.12 0.00 0.00 57.88 57.66 2gqc h LEU 21 Cb 0.94 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.80 2gqc h LEU 21 CO 0.08 0.23 -1.54 0.00 -0.62 0.00 0.00 178.44 176.59 2gqc n LEU 22 N -4.91 0.67 -0.14 2.25 -0.00 -0.98 -3.07 117.00 110.83 2gqc n LEU 22 Ca 0.03 0.29 0.17 0.00 -0.00 0.00 0.00 56.01 56.50 2gqc n LEU 22 Cb 0.11 0.09 0.55 0.00 -0.00 0.00 0.00 43.42 44.17 2gqc n LEU 22 CO 0.30 0.13 1.21 -0.09 -0.00 0.00 0.00 177.39 178.93 2gqc h ARG 23 N 0.00 0.31 -0.06 1.47 1.12 -1.05 -0.56 114.38 115.61 2gqc h ARG 23 Ca -0.17 -0.02 -0.16 0.00 -1.11 0.00 0.00 59.98 58.53 2gqc h ARG 23 Cb 1.52 -0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 31.40 2gqc h ARG 23 CO 0.03 0.20 -0.66 0.00 -3.11 0.00 0.00 179.97 176.44 2gqc h ARG 24 N 0.32 0.25 0.23 0.20 2.47 -0.39 -3.31 114.38 114.16 2gqc h ARG 24 Ca 0.36 -0.19 -0.01 0.00 -1.26 0.00 0.00 59.98 58.87 2gqc h ARG 24 Cb 0.93 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.29 2gqc h ARG 24 CO -0.10 0.82 -0.11 -0.07 0.56 0.00 0.00 179.97 181.08 2gqc h LEU 25 N 0.18 -0.26 0.00 3.04 4.07 -1.09 -3.46 115.31 117.79 2gqc h LEU 25 Ca -0.01 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.75 2gqc h LEU 25 Cb 1.19 0.07 0.00 0.00 1.08 0.00 0.00 40.66 43.00 2gqc h LEU 25 CO 0.10 0.07 0.00 -0.46 -1.08 0.00 0.00 178.44 177.07 2gqc n ASN 26 N -5.09 0.00 -3.64 -0.43 0.23 -1.07 -5.04 115.26 100.22 2gqc n ASN 26 Ca -0.09 0.00 -0.20 0.00 -0.53 0.00 0.00 54.58 53.75 2gqc n ASN 26 Cb 0.24 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 37.94 2gqc n ASN 26 CO 0.00 0.00 0.00 1.33 -0.93 0.00 0.00 177.26 177.66 2gqc n VAL 27 N 0.00 -1.47 -0.41 3.53 0.24 -1.06 -4.82 118.33 114.34 2gqc n VAL 27 Ca 0.00 -0.19 -0.06 0.00 -2.04 0.00 0.00 64.34 62.04 2gqc n VAL 27 Cb 0.00 -1.27 0.20 0.00 -1.47 0.00 0.00 33.84 31.29 2gqc n VAL 27 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2gqc n PRO 28 N -2.55 2.71 -4.58 7.34 -0.04 -1.26 -4.96 135.00 131.65 2gqc n PRO 28 Ca -0.10 -2.10 -0.27 0.00 -0.04 0.00 0.00 63.50 60.99 2gqc n PRO 28 Cb 0.32 -1.91 -0.09 0.00 -0.04 0.00 0.00 33.50 31.78 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 -2.23 1.93 -0.14 0.54 -3.43 -1.26 -4.93 115.29 105.77 2gqc s HIS 29 Ca 0.38 -1.05 -0.05 0.00 -0.80 0.00 0.00 55.06 53.54 2gqc s HIS 29 Cb 0.31 -1.38 -0.04 0.00 -1.43 0.00 0.00 32.58 30.04 2gqc s HIS 29 CO 0.09 -0.00 0.03 0.50 -2.00 0.00 0.00 174.74 173.36 2gqc s ARG 30 N -3.80 3.53 -0.16 -0.38 3.52 -1.05 -4.94 118.95 115.67 2gqc s ARG 30 Ca 0.23 -0.38 -0.05 0.00 -0.13 0.00 0.00 55.73 55.40 2gqc s ARG 30 Cb 0.04 -3.01 -0.03 0.00 -1.56 0.00 0.00 34.95 30.39 2gqc s ARG 30 CO 0.12 0.46 0.02 0.08 -0.81 0.00 0.00 175.30 175.17 2gqc s VAL 31 N -0.19 4.38 0.00 7.11 1.01 -1.26 -0.69 120.40 130.76 2gqc s VAL 31 Ca 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2gqc s VAL 31 Cb -0.12 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.32 2gqc s VAL 31 CO 0.02 0.49 0.00 -0.24 0.00 0.00 0.00 175.10 175.37 2gqc n SER 32 N 3.34 0.00 -3.72 3.32 2.88 0.15 -4.95 113.62 114.64 2gqc n SER 32 Ca -0.17 -0.49 -0.28 0.00 -1.33 0.00 0.00 58.87 56.60 2gqc n SER 32 Cb 0.52 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.82 2gqc n SER 32 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2gqc s GLU 33 N -0.47 0.62 -0.19 -1.46 -1.05 -1.26 0.17 118.70 115.06 2gqc s GLU 33 Ca 0.00 -0.49 -0.03 0.00 -0.15 0.00 0.00 54.97 54.30 2gqc s GLU 33 Cb 0.00 -2.05 -0.01 0.00 -0.44 0.00 0.00 34.13 31.63 2gqc s GLU 33 CO 0.00 -0.70 -0.07 -1.21 0.95 0.00 0.00 175.26 174.23 2gqc s GLU 34 N 1.85 3.41 0.00 -4.83 0.41 -0.29 -4.77 118.70 114.48 2gqc s GLU 34 Ca 0.01 -0.63 0.00 0.00 -0.41 0.00 0.00 54.97 53.94 2gqc s GLU 34 Cb -0.17 -2.90 0.00 0.00 -1.78 0.00 0.00 34.13 29.28 2gqc s GLU 34 CO -0.11 -0.05 0.00 0.45 -0.49 0.00 0.00 175.26 175.06 2gqc n SER 35 N 4.34 0.00 0.00 -0.19 2.88 -1.26 -1.94 113.62 117.45 2gqc n SER 35 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 2gqc n SER 35 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 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 0.00 0.00 3.32 0.46 0.00 -1.26 -5.14 105.19 102.57 2gqc n GLY 36 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 0.00 1.23 0.35 1.61 -0.21 -0.82 -4.51 119.66 117.31 2gqc s GLN 37 Ca 0.00 -1.34 -0.28 0.00 0.02 0.00 0.00 55.36 53.77 2gqc s GLN 37 Cb 0.00 -1.34 -0.10 0.00 1.00 0.00 0.00 33.01 32.57 2gqc s GLN 37 CO 0.00 0.28 1.26 -0.65 -2.12 0.00 0.00 175.29 174.06 2gqc s GLN 38 N -2.55 4.27 0.05 2.91 -0.21 -1.20 -1.14 119.66 121.79 2gqc s GLN 38 Ca 0.13 2.09 0.03 0.00 0.02 0.00 0.00 55.36 57.62 2gqc s GLN 38 Cb -0.07 -2.96 -0.03 0.00 1.00 0.00 0.00 33.01 30.95 2gqc s GLN 38 CO 0.06 -0.21 -0.09 0.14 -2.12 0.00 0.00 175.29 173.07 2gqc s VAL 39 N -1.21 0.66 -0.09 1.09 -7.23 0.13 0.84 120.40 114.58 2gqc s VAL 39 Ca 0.51 -1.17 0.03 0.00 -1.81 0.00 0.00 61.98 59.55 2gqc s VAL 39 Cb -0.37 -0.75 0.00 0.00 0.56 0.00 0.00 36.38 35.82 2gqc s VAL 39 CO 0.48 -0.38 -0.20 -0.22 -0.31 0.00 0.00 175.10 174.47 2gqc s LEU 40 N -1.69 1.95 -0.30 1.32 0.20 0.18 0.32 118.68 120.66 2gqc s LEU 40 Ca -0.07 -0.48 0.01 0.00 0.69 0.00 0.00 54.13 54.28 2gqc s LEU 40 Cb -0.09 -1.23 0.09 0.00 -0.43 0.00 0.00 46.19 44.53 2gqc s LEU 40 CO 0.01 0.12 0.05 0.26 -0.29 0.00 0.00 176.35 176.49 2gqc s TRP 41 N 0.45 2.49 0.00 5.38 0.52 0.13 -1.48 118.94 126.44 2gqc s TRP 41 Ca -0.17 -2.12 0.07 0.00 0.02 0.00 0.00 56.10 53.89 2gqc s TRP 41 Cb -0.17 -2.05 0.11 0.00 -1.15 0.00 0.00 33.47 30.21 2gqc s TRP 41 CO 0.07 -0.87 0.93 1.55 0.02 0.00 0.00 176.95 178.65 2gqc n VAL 42 N 4.63 0.00 -0.69 4.03 3.14 -1.25 -2.53 118.33 125.65 2gqc n VAL 42 Ca -0.02 -0.27 0.00 0.00 -2.96 0.00 0.00 64.34 61.09 2gqc n VAL 42 Cb 0.43 0.52 0.00 0.00 -1.06 0.00 0.00 33.84 33.72 2gqc n VAL 42 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 2gqc n PRO 43 N 0.13 3.49 0.00 1.45 -0.04 -1.26 -4.72 135.00 134.05 2gqc n PRO 43 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 2gqc n PRO 43 Cb 0.77 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.23 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 0.00 0.00 3.54 8.00 -1.26 -3.79 116.55 123.04 2gqc n ASP 44 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2gqc n ASP 44 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2gqc n ASP 44 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2gqc n GLU 45 N -0.77 0.00 0.12 -1.24 2.13 -1.26 -4.61 120.64 115.02 2gqc n GLU 45 Ca 0.00 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.83 2gqc n GLU 45 Cb 0.00 0.00 0.32 0.00 0.27 0.00 0.00 31.44 32.03 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 0.18 -0.11 5.31 -0.00 -2.02 -2.60 114.38 115.15 2gqc h ARG 46 Ca 0.00 -0.06 -0.11 0.00 -0.00 0.00 0.00 59.98 59.80 2gqc h ARG 46 Cb 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.97 29.94 2gqc h ARG 46 CO 0.00 0.47 -0.42 1.25 -0.00 0.00 0.00 179.97 181.27 2gqc h LEU 47 N 0.16 0.26 -0.83 0.08 6.46 -1.96 -2.96 115.31 116.53 2gqc h LEU 47 Ca 0.02 -0.11 0.18 0.00 -0.12 0.00 0.00 57.88 57.86 2gqc h LEU 47 Cb 0.61 -0.07 -0.15 0.00 -0.73 0.00 0.00 40.66 40.32 2gqc h LEU 47 CO 0.04 0.66 -0.10 0.00 -0.62 0.00 0.00 178.44 178.43 2gqc h ALA 48 N 1.35 0.72 -0.11 1.25 0.00 -1.71 0.64 119.26 121.41 2gqc h ALA 48 Ca 0.02 0.30 -0.20 0.00 0.00 0.00 0.00 54.91 55.02 2gqc h ALA 48 Cb 0.84 0.55 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2gqc h ALA 48 CO 0.07 -0.43 -0.75 0.93 0.00 0.00 0.00 179.25 179.06 2gqc h GLU 49 N 0.04 0.58 -0.09 0.00 4.39 -1.64 -2.66 114.58 115.20 2gqc h GLU 49 Ca 0.43 -0.47 -0.06 0.00 0.34 0.00 0.00 59.36 59.60 2gqc h GLU 49 Cb 0.74 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.48 2gqc h GLU 49 CO -0.80 1.10 -0.21 0.37 -1.16 0.00 0.00 179.01 178.31 2gqc h GLN 50 N 0.39 0.15 0.00 2.33 5.75 -0.72 -2.28 115.11 120.74 2gqc h GLN 50 Ca -0.04 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.41 2gqc h GLN 50 Cb 1.35 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.88 2gqc h GLN 50 CO 0.14 0.36 -0.03 -0.24 -2.65 0.00 0.00 178.83 176.41 2gqc h VAL 51 N 0.14 1.38 0.12 2.39 3.04 0.51 -2.13 116.25 121.69 2gqc h VAL 51 Ca 0.02 -2.04 -0.21 0.00 -1.01 0.00 0.00 66.70 63.46 2gqc h VAL 51 Cb 0.46 2.61 0.01 0.00 -2.01 0.00 0.00 31.29 32.36 2gqc h VAL 51 CO 0.03 0.47 -1.00 0.08 -1.01 0.00 0.00 177.57 176.14 2gqc h ARG 52 N -1.00 0.25 0.24 4.17 0.11 -1.61 -2.81 114.38 113.74 2gqc h ARG 52 Ca -0.01 -0.43 -0.01 0.00 0.10 0.00 0.00 59.98 59.63 2gqc h ARG 52 Cb 0.78 0.16 0.00 0.00 1.11 0.00 0.00 29.97 32.03 2gqc h ARG 52 CO -0.00 1.21 -0.12 0.93 0.10 0.00 0.00 179.97 182.09 2gqc h GLU 53 N -0.41 -0.31 0.00 0.08 4.39 -1.57 -2.77 114.58 113.99 2gqc h GLU 53 Ca -0.20 0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.42 2gqc h GLU 53 Cb 1.64 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 30.35 2gqc h GLU 53 CO 0.10 0.04 -0.48 -0.07 -1.16 0.00 0.00 179.01 177.44 2gqc h LEU 54 N -0.92 0.00 -1.40 1.33 4.07 -1.38 -0.41 115.31 116.60 2gqc h LEU 54 Ca -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.92 2gqc h LEU 54 Cb 0.50 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.21 2gqc h LEU 54 CO 0.05 0.48 0.30 1.88 -1.08 0.00 0.00 178.44 180.07 2gqc h TYR 55 N 0.00 0.68 0.00 1.13 -1.99 -1.43 0.87 116.97 116.23 2gqc h TYR 55 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2gqc h TYR 55 Cb 1.01 -0.23 0.00 0.00 2.00 0.00 0.00 36.73 39.52 2gqc h TYR 55 CO 0.00 0.47 0.00 2.89 -0.00 0.00 0.00 178.16 181.52 2gqc n ARG 56 N -4.42 0.92 0.00 4.88 1.85 -0.18 -2.03 116.66 117.69 2gqc n ARG 56 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.90 2gqc n ARG 56 Cb 0.08 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 29.99 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 -1.03 0.90 0.00 2.89 1.85 -0.78 -4.25 116.66 116.24 2gqc n ARG 57 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.08 2gqc n ARG 57 Cb 0.12 -0.23 0.00 0.00 -1.05 0.00 0.00 32.46 31.30 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 -0.34 0.00 -0.30 2.89 4.02 0.29 -3.62 117.16 120.10 2gqc n TYR 58 Ca 0.00 0.00 0.28 0.00 -0.01 0.00 0.00 57.90 58.17 2gqc n TYR 58 Cb 0.00 0.00 0.51 0.00 -0.02 0.00 0.00 39.34 39.83 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 -1.19 -0.06 -0.01 -0.72 -0.02 -0.92 -0.33 135.00 131.74 2gqc n PRO 59 Ca 0.00 1.30 0.01 0.00 -2.02 0.00 0.00 63.50 62.80 2gqc n PRO 59 Cb 0.00 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.12 2gqc n PRO 59 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2gqc n GLU 60 N -5.15 1.10 -0.46 -0.52 4.07 -0.86 -4.04 120.64 114.78 2gqc n GLU 60 Ca 0.34 -0.05 0.00 0.00 -0.06 0.00 0.00 57.16 57.39 2gqc n GLU 60 Cb 1.14 -1.19 0.00 0.00 -0.06 0.00 0.00 31.44 31.33 2gqc n GLU 60 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2gqc n GLY 61 N 2.22 2.43 3.96 8.31 0.00 -1.03 -2.06 105.19 119.03 2gqc n GLY 61 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 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 1.93 4.93 0.00 1.61 2.15 0.55 -4.19 116.67 123.66 2gqc s ASP 62 Ca 0.00 -0.98 -0.05 0.00 0.43 0.00 0.00 52.55 51.95 2gqc s ASP 62 Cb 0.00 0.21 -0.07 0.00 -0.30 0.00 0.00 42.92 42.76 2gqc s ASP 62 CO 0.00 -1.14 0.98 -0.81 -0.17 0.00 0.00 175.17 174.03 2gqc n PRO 63 N -1.96 0.00 0.05 4.34 -0.04 -1.26 -3.49 135.00 132.64 2gqc n PRO 63 Ca 0.07 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 63.01 2gqc n PRO 63 Cb 0.63 -1.96 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2gqc n PRO 63 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2gqc n GLN 64 N 5.22 0.00 0.00 0.54 1.13 -1.26 -5.13 117.38 117.88 2gqc n GLN 64 Ca 0.08 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.14 2gqc n GLN 64 Cb 0.08 -0.04 0.00 0.00 0.11 0.00 0.00 30.24 30.39 2gqc n GLN 64 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2gqc n ALA 65 N -2.90 0.20 -1.25 -1.58 0.00 -1.14 -5.11 120.51 108.73 2gqc n ALA 65 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 2gqc n ALA 65 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 2gqc n ALA 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2gqc s THR 66 N 0.00 3.22 0.00 0.00 2.01 -0.87 -4.95 115.64 115.05 2gqc s THR 66 Ca 0.00 0.40 0.00 0.00 0.31 0.00 0.00 61.69 62.40 2gqc s THR 66 Cb 0.00 -2.88 0.00 0.00 0.01 0.00 0.00 72.50 69.63 2gqc s THR 66 CO 0.00 -0.52 0.00 0.18 -0.69 0.00 0.00 174.62 173.59 2gqc n LEU 67 N -3.58 0.00 -1.39 4.42 7.99 -1.26 -3.06 117.00 120.11 2gqc n LEU 67 Ca 0.09 0.00 0.12 0.00 -0.01 0.00 0.00 56.01 56.20 2gqc n LEU 67 Cb 0.53 0.00 0.33 0.00 -0.11 0.00 0.00 43.42 44.17 2gqc n LEU 67 CO 0.54 0.00 0.78 -0.62 -1.51 0.00 0.00 177.39 176.58 2gqc n GLU 68 N 0.00 2.85 -0.58 3.23 1.02 -1.26 -4.19 120.64 121.71 2gqc n GLU 68 Ca 0.00 -2.70 0.09 0.00 -0.02 0.00 0.00 57.16 54.53 2gqc n GLU 68 Cb 0.00 -1.61 0.34 0.00 -0.02 0.00 0.00 31.44 30.15 2gqc n GLU 68 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gqc n ALA 69 N 1.60 3.02 0.00 0.62 0.00 -1.26 -5.14 120.51 119.36 2gqc n ALA 69 Ca 0.25 -1.49 0.00 0.00 0.00 0.00 0.00 53.44 52.19 2gqc n ALA 69 Cb 0.66 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.08 2gqc n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50