#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 1.18 -3.06 7.83 2.88 -1.24 -3.34 113.62 117.86 2gqc n SER 2 Ca 0.00 -2.01 -0.16 0.00 -1.33 0.00 0.00 58.87 55.37 2gqc n SER 2 Cb 0.00 -0.16 -0.01 0.00 -0.75 0.00 0.00 64.21 63.29 2gqc n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gqc n ALA 3 N 0.12 2.24 -2.61 -1.46 0.00 -1.26 -3.65 120.51 113.89 2gqc n ALA 3 Ca 0.07 -3.29 -0.33 0.00 0.00 0.00 0.00 53.44 49.89 2gqc n ALA 3 Cb 0.19 -0.94 -0.13 0.00 0.00 0.00 0.00 19.45 18.57 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 -2.51 3.13 -0.27 0.00 0.11 -1.24 -4.91 120.40 114.70 2gqc s VAL 4 Ca 0.37 -0.69 -0.28 0.00 -2.93 0.00 0.00 61.98 58.45 2gqc s VAL 4 Cb 0.37 -2.25 -0.03 0.00 -1.53 0.00 0.00 36.38 32.94 2gqc s VAL 4 CO -0.05 0.58 1.87 -1.58 -3.33 0.00 0.00 175.10 172.59 2gqc s GLN 5 N -0.51 3.41 0.00 1.54 -0.44 -1.26 -3.93 119.66 118.47 2gqc s GLN 5 Ca 0.07 1.66 0.00 0.00 -2.50 0.00 0.00 55.36 54.59 2gqc s GLN 5 Cb -0.12 -4.21 0.00 0.00 -1.64 0.00 0.00 33.01 27.04 2gqc s GLN 5 CO 0.02 -1.77 0.00 1.55 0.50 0.00 0.00 175.29 175.58 2gqc n VAL 6 N 7.25 0.00 -4.34 1.34 3.14 -1.24 -5.06 118.33 119.42 2gqc n VAL 6 Ca 0.24 0.00 -0.26 0.00 -2.96 0.00 0.00 64.34 61.35 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 -0.51 2.83 0.05 6.55 0.20 -0.71 -4.96 118.68 122.14 2gqc s LEU 7 Ca 0.00 -0.69 -0.20 0.00 0.69 0.00 0.00 54.13 53.93 2gqc s LEU 7 Cb 0.00 -1.50 0.04 0.00 -0.43 0.00 0.00 46.19 44.31 2gqc s LEU 7 CO 0.00 0.09 0.47 -1.59 -0.29 0.00 0.00 176.35 175.03 2gqc s LYS 8 N -2.93 0.99 -0.47 1.98 -2.85 -1.26 0.19 119.74 115.39 2gqc s LYS 8 Ca 0.25 -0.33 0.04 0.00 -1.00 0.00 0.00 55.97 54.92 2gqc s LYS 8 Cb -0.08 0.45 0.12 0.00 -2.06 0.00 0.00 37.83 36.26 2gqc s LYS 8 CO 0.14 -0.36 0.21 -0.59 0.10 0.00 0.00 175.35 174.86 2gqc s PHE 9 N -2.59 3.09 -0.30 1.78 -0.71 0.18 -4.86 117.98 114.56 2gqc s PHE 9 Ca -0.04 -3.00 -0.07 0.00 -1.04 0.00 0.00 56.93 52.78 2gqc s PHE 9 Cb -0.01 -2.68 -0.08 0.00 -1.21 0.00 0.00 43.02 39.04 2gqc s PHE 9 CO -0.03 -0.79 0.75 -2.30 -1.34 0.00 0.00 175.22 171.51 2gqc n PRO 10 N 3.44 0.00 0.12 1.99 -0.02 -1.26 -3.02 135.00 136.25 2gqc n PRO 10 Ca 0.05 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.64 2gqc n PRO 10 Cb 0.35 -0.39 0.48 0.00 -0.02 0.00 0.00 33.50 33.91 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 2.58 0.59 -0.80 2.45 -0.00 -1.26 -1.05 117.00 119.51 2gqc n LEU 11 Ca 0.20 0.66 0.12 0.00 -0.00 0.00 0.00 56.01 57.00 2gqc n LEU 11 Cb 0.02 -0.61 0.09 0.00 -0.00 0.00 0.00 43.42 42.93 2gqc n LEU 11 CO 0.30 -0.60 0.55 -0.24 -0.00 0.00 0.00 177.39 177.41 2gqc n SER 12 N -2.17 2.63 -3.22 1.45 2.88 -1.26 -4.94 113.62 108.99 2gqc n SER 12 Ca 0.02 -1.83 -0.19 0.00 -1.33 0.00 0.00 58.87 55.54 2gqc n SER 12 Cb 0.19 0.14 -0.06 0.00 -0.75 0.00 0.00 64.21 63.72 2gqc n SER 12 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2gqc n VAL 13 N 0.88 0.00 -1.13 2.46 0.24 -0.21 -5.03 118.33 115.55 2gqc n VAL 13 Ca 0.13 -2.08 -0.34 0.00 -2.04 0.00 0.00 64.34 60.01 2gqc n VAL 13 Cb 0.55 0.90 -0.03 0.00 -1.47 0.00 0.00 33.84 33.79 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 -1.74 5.37 0.00 -1.34 2.03 -1.26 -4.65 116.55 114.96 2gqc n ASP 14 Ca 0.01 -2.54 0.03 0.00 0.52 0.00 0.00 54.79 52.81 2gqc n ASP 14 Cb 0.52 -1.32 0.17 0.00 -0.72 0.00 0.00 41.12 39.78 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 4.94 0.00 0.24 -2.67 -0.00 -1.26 -2.71 117.00 115.55 2gqc n LEU 15 Ca 0.56 0.28 0.18 0.00 -0.00 0.00 0.00 56.01 57.03 2gqc n LEU 15 Cb 0.25 -0.28 0.85 0.00 -0.00 0.00 0.00 43.42 44.25 2gqc n LEU 15 CO 0.84 -0.22 1.15 0.00 -0.00 0.00 0.00 177.39 179.17 2gqc h ALA 16 N 2.32 1.62 -0.21 1.47 0.00 -1.93 0.90 119.26 123.43 2gqc h ALA 16 Ca 0.00 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 2gqc h ALA 16 Cb 0.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2gqc h ALA 16 CO 0.00 -0.35 -0.59 0.78 0.00 0.00 0.00 179.25 179.08 2gqc h GLY 17 N 0.00 0.85 0.02 0.00 0.00 -1.91 -2.66 103.07 99.37 2gqc h GLY 17 Ca 0.07 -1.08 -0.36 0.00 0.00 0.00 0.00 47.33 45.97 2gqc h GLY 17 CO -0.00 0.96 -1.95 0.33 0.00 0.00 0.00 176.54 175.88 2gqc n PHE 18 N -4.05 0.51 -0.16 5.60 -0.00 0.11 -2.19 117.46 117.28 2gqc n PHE 18 Ca -0.06 0.21 0.05 0.00 -0.00 0.00 0.00 57.45 57.65 2gqc n PHE 18 Cb 0.65 -1.05 0.35 0.00 -0.00 0.00 0.00 39.48 39.42 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 -0.93 1.06 -0.09 -2.13 3.04 0.39 0.29 116.25 117.89 2gqc h VAL 19 Ca -0.53 -0.26 -0.11 0.00 -1.01 0.00 0.00 66.70 64.79 2gqc h VAL 19 Cb 1.50 0.23 -0.01 0.00 -2.01 0.00 0.00 31.29 31.00 2gqc h VAL 19 CO -0.30 0.14 -0.43 1.23 -1.01 0.00 0.00 177.57 177.20 2gqc h GLY 20 N 0.77 0.23 1.00 3.17 0.00 -1.51 0.28 103.07 107.00 2gqc h GLY 20 Ca 0.28 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 2gqc h GLY 20 CO -0.09 0.20 0.36 -2.00 0.00 0.00 0.00 176.54 175.01 2gqc h LEU 21 N 0.17 0.75 0.00 3.11 6.46 0.06 0.14 115.31 126.00 2gqc h LEU 21 Ca 0.01 -0.07 -0.14 0.00 -0.12 0.00 0.00 57.88 57.56 2gqc h LEU 21 Cb 0.83 -0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 40.55 2gqc h LEU 21 CO 0.06 0.60 -1.67 0.00 -0.62 0.00 0.00 178.44 176.82 2gqc n LEU 22 N -4.59 0.51 0.04 2.25 -0.00 -0.88 -2.96 117.00 111.36 2gqc n LEU 22 Ca 0.04 0.22 0.09 0.00 -0.00 0.00 0.00 56.01 56.36 2gqc n LEU 22 Cb 0.07 0.12 0.53 0.00 -0.00 0.00 0.00 43.42 44.13 2gqc n LEU 22 CO 0.37 0.13 1.15 -0.09 -0.00 0.00 0.00 177.39 178.95 2gqc h ARG 23 N 0.00 0.31 0.00 1.47 1.12 -0.21 -0.49 114.38 116.57 2gqc h ARG 23 Ca -0.17 -0.02 -0.05 0.00 -1.11 0.00 0.00 59.98 58.63 2gqc h ARG 23 Cb 1.49 -0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 31.38 2gqc h ARG 23 CO 0.03 0.20 -0.23 0.00 -3.11 0.00 0.00 179.97 176.85 2gqc h ARG 24 N 0.31 0.00 0.15 0.20 2.47 -0.61 -3.29 114.38 113.62 2gqc h ARG 24 Ca 0.16 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.88 2gqc h ARG 24 Cb 0.25 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.57 2gqc h ARG 24 CO -0.04 0.23 -0.07 1.25 0.56 0.00 0.00 179.97 181.91 2gqc h LEU 25 N 0.00 -0.17 0.00 3.04 5.85 -1.09 -3.47 115.31 119.46 2gqc h LEU 25 Ca -0.00 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2gqc h LEU 25 Cb 0.85 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.92 2gqc h LEU 25 CO 0.03 0.36 0.00 -0.46 -0.34 0.00 0.00 178.44 178.03 2gqc n ASN 26 N -4.90 0.00 -3.66 1.25 6.94 -0.92 -5.04 115.26 108.92 2gqc n ASN 26 Ca -0.04 0.00 -0.24 0.00 -0.02 0.00 0.00 54.58 54.28 2gqc n ASN 26 Cb 0.15 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.58 2gqc n ASN 26 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 2gqc n VAL 27 N 0.00 -1.87 -1.42 3.53 0.31 -1.03 -4.87 118.33 112.98 2gqc n VAL 27 Ca 0.00 -0.20 -0.27 0.00 -0.01 0.00 0.00 64.34 63.86 2gqc n VAL 27 Cb 0.00 -1.63 0.11 0.00 -0.91 0.00 0.00 33.84 31.40 2gqc n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2gqc n PRO 28 N -2.78 2.62 -4.41 5.55 -0.04 -1.26 -5.04 135.00 129.64 2gqc n PRO 28 Ca -0.14 -3.34 -0.22 0.00 -0.04 0.00 0.00 63.50 59.76 2gqc n PRO 28 Cb 0.41 -2.21 -0.09 0.00 -0.04 0.00 0.00 33.50 31.57 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 -3.61 1.72 -0.03 0.54 -3.43 -1.26 -4.94 115.29 104.28 2gqc s HIS 29 Ca 0.59 -1.32 -0.14 0.00 -0.80 0.00 0.00 55.06 53.39 2gqc s HIS 29 Cb 0.48 -1.00 -0.05 0.00 -1.43 0.00 0.00 32.58 30.57 2gqc s HIS 29 CO 0.03 -0.41 0.37 0.50 -2.00 0.00 0.00 174.74 173.22 2gqc s ARG 30 N -3.75 3.90 -0.12 -0.38 3.52 -1.09 -4.93 118.95 116.11 2gqc s ARG 30 Ca 0.31 0.32 0.02 0.00 -0.13 0.00 0.00 55.73 56.26 2gqc s ARG 30 Cb 0.04 -3.24 -0.01 0.00 -1.56 0.00 0.00 34.95 30.18 2gqc s ARG 30 CO 0.17 0.64 -0.18 0.08 -0.81 0.00 0.00 175.30 175.20 2gqc s VAL 31 N -0.87 2.58 0.00 7.11 1.01 -1.25 -0.86 120.40 128.12 2gqc s VAL 31 Ca 0.22 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2gqc s VAL 31 Cb -0.16 -2.05 0.00 0.00 0.00 0.00 0.00 36.38 34.18 2gqc s VAL 31 CO 0.11 0.54 0.00 -1.20 0.00 0.00 0.00 175.10 174.55 2gqc n SER 32 N 3.54 0.19 -3.52 3.32 7.64 0.18 -4.92 113.62 120.06 2gqc n SER 32 Ca -0.19 -0.50 -0.28 0.00 1.01 0.00 0.00 58.87 58.92 2gqc n SER 32 Cb 0.53 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.59 2gqc n SER 32 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2gqc s GLU 33 N -0.50 0.26 -0.14 1.43 -1.05 -1.26 0.04 118.70 117.48 2gqc s GLU 33 Ca 0.00 -0.62 -0.00 0.00 -0.15 0.00 0.00 54.97 54.19 2gqc s GLU 33 Cb 0.00 -1.14 -0.01 0.00 -0.44 0.00 0.00 34.13 32.54 2gqc s GLU 33 CO 0.00 -1.05 -0.13 -1.21 0.95 0.00 0.00 175.26 173.82 2gqc s GLU 34 N 1.96 3.36 0.00 -4.83 0.41 0.54 -4.65 118.70 115.49 2gqc s GLU 34 Ca 0.10 -0.69 0.00 0.00 -0.41 0.00 0.00 54.97 53.98 2gqc s GLU 34 Cb -0.17 -2.66 0.00 0.00 -1.78 0.00 0.00 34.13 29.52 2gqc s GLU 34 CO -0.31 0.16 0.00 0.43 -0.49 0.00 0.00 175.26 175.05 2gqc n SER 35 N 3.69 -4.18 0.00 -0.19 7.64 -1.26 -2.06 113.62 117.26 2gqc n SER 35 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 2gqc n SER 35 Cb 0.52 -2.42 0.00 0.00 -1.01 0.00 0.00 64.21 61.30 2gqc n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gqc n GLY 36 N -0.55 1.18 3.08 0.23 0.00 -1.26 -5.09 105.19 102.78 2gqc n GLY 36 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2gqc n GLY 36 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2gqc s GLN 37 N -0.46 0.57 0.38 1.61 -2.07 -0.88 -4.30 119.66 114.52 2gqc s GLN 37 Ca 0.00 -0.83 -0.27 0.00 -1.82 0.00 0.00 55.36 52.44 2gqc s GLN 37 Cb 0.00 -0.31 -0.09 0.00 -1.09 0.00 0.00 33.01 31.52 2gqc s GLN 37 CO 0.00 0.05 1.25 -0.65 -1.32 0.00 0.00 175.29 174.62 2gqc s GLN 38 N -1.82 4.13 0.06 9.60 -0.21 -1.17 -0.34 119.66 129.90 2gqc s GLN 38 Ca -0.07 2.06 0.05 0.00 0.02 0.00 0.00 55.36 57.42 2gqc s GLN 38 Cb -0.08 -2.84 -0.03 0.00 1.00 0.00 0.00 33.01 31.06 2gqc s GLN 38 CO -0.00 -0.33 -0.15 0.08 -2.12 0.00 0.00 175.29 172.77 2gqc s VAL 39 N -1.26 1.19 -0.09 1.09 1.01 0.11 0.49 120.40 122.92 2gqc s VAL 39 Ca 0.54 -1.17 0.02 0.00 0.00 0.00 0.00 61.98 61.37 2gqc s VAL 39 Cb -0.36 -1.10 0.01 0.00 0.00 0.00 0.00 36.38 34.93 2gqc s VAL 39 CO 0.47 -0.08 -0.16 -0.22 0.00 0.00 0.00 175.10 175.11 2gqc s LEU 40 N -1.43 1.77 -0.37 3.92 0.20 0.13 0.49 118.68 123.39 2gqc s LEU 40 Ca 0.01 -0.41 0.02 0.00 0.69 0.00 0.00 54.13 54.44 2gqc s LEU 40 Cb -0.09 -1.07 0.11 0.00 -0.43 0.00 0.00 46.19 44.71 2gqc s LEU 40 CO 0.02 0.05 0.12 0.26 -0.29 0.00 0.00 176.35 176.50 2gqc s TRP 41 N 0.76 2.92 0.00 5.38 0.52 -0.04 -1.73 118.94 126.75 2gqc s TRP 41 Ca -0.11 -2.62 0.02 0.00 0.02 0.00 0.00 56.10 53.40 2gqc s TRP 41 Cb -0.16 -2.47 0.03 0.00 -1.15 0.00 0.00 33.47 29.73 2gqc s TRP 41 CO 0.02 -0.88 0.97 1.33 0.02 0.00 0.00 176.95 178.41 2gqc n VAL 42 N 4.16 0.00 0.00 4.03 0.24 -1.24 -2.66 118.33 122.87 2gqc n VAL 42 Ca 0.03 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 2gqc n VAL 42 Cb 0.40 0.49 0.00 0.00 -1.47 0.00 0.00 33.84 33.26 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 0.04 0.00 0.00 7.34 -0.04 -1.26 -4.81 135.00 136.26 2gqc n PRO 43 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2gqc n PRO 43 Cb 0.72 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.18 2gqc n PRO 43 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2gqc n ASP 44 N 0.00 0.00 0.16 3.54 -0.08 -1.21 -3.65 116.55 115.31 2gqc n ASP 44 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2gqc n ASP 44 Cb 0.00 0.38 0.00 0.00 2.34 0.00 0.00 41.12 43.84 2gqc n ASP 44 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2gqc n GLU 45 N -2.48 0.00 0.09 -0.67 2.13 -1.26 -4.80 120.64 113.65 2gqc n GLU 45 Ca 0.00 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.78 2gqc n GLU 45 Cb 0.00 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.66 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 0.00 -0.04 5.31 -0.00 -2.01 -3.19 114.38 114.45 2gqc h ARG 46 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 59.98 59.85 2gqc h ARG 46 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 29.96 2gqc h ARG 46 CO 0.00 0.84 -0.57 1.25 -0.00 0.00 0.00 179.97 181.48 2gqc h LEU 47 N 0.00 0.15 -0.97 0.08 6.46 -1.92 -3.19 115.31 115.91 2gqc h LEU 47 Ca -0.01 -0.08 0.32 0.00 -0.12 0.00 0.00 57.88 57.99 2gqc h LEU 47 Cb 1.60 -0.04 -0.16 0.00 -0.73 0.00 0.00 40.66 41.33 2gqc h LEU 47 CO 0.11 0.69 0.41 0.00 -0.62 0.00 0.00 178.44 179.03 2gqc h ALA 48 N 1.31 1.75 0.20 1.25 0.00 -1.86 0.44 119.26 122.35 2gqc h ALA 48 Ca -0.00 0.24 -0.32 0.00 0.00 0.00 0.00 54.91 54.83 2gqc h ALA 48 Cb 1.04 0.29 0.02 0.00 0.00 0.00 0.00 17.79 19.14 2gqc h ALA 48 CO 0.08 -0.64 -1.42 0.93 0.00 0.00 0.00 179.25 178.20 2gqc h GLU 49 N 0.18 0.42 -0.18 0.00 5.08 -1.75 -2.88 114.58 115.45 2gqc h GLU 49 Ca 0.70 -0.72 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 2gqc h GLU 49 Cb 1.62 0.27 -0.01 0.00 0.50 0.00 0.00 28.75 31.13 2gqc h GLU 49 CO -0.70 1.34 -0.06 0.37 -1.00 0.00 0.00 179.01 178.96 2gqc h GLN 50 N 0.12 0.27 0.08 2.33 5.75 -0.98 -1.88 115.11 120.80 2gqc h GLN 50 Ca -0.22 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.23 2gqc h GLN 50 Cb 2.09 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 30.60 2gqc h GLN 50 CO 0.24 0.35 -0.04 -0.24 -2.65 0.00 0.00 178.83 176.49 2gqc h VAL 51 N 0.26 0.00 0.18 2.39 3.04 -0.07 -2.62 116.25 119.43 2gqc h VAL 51 Ca 0.06 -0.82 -0.31 0.00 -1.01 0.00 0.00 66.70 64.61 2gqc h VAL 51 Cb 0.28 0.00 0.01 0.00 -2.01 0.00 0.00 31.29 29.58 2gqc h VAL 51 CO 0.01 0.00 -1.47 0.08 -1.01 0.00 0.00 177.57 175.19 2gqc h ARG 52 N -0.93 0.37 0.00 4.17 0.11 -1.63 -2.45 114.38 114.02 2gqc h ARG 52 Ca -0.01 -0.63 -0.01 0.00 0.10 0.00 0.00 59.98 59.43 2gqc h ARG 52 Cb 0.08 0.24 -0.00 0.00 1.11 0.00 0.00 29.97 31.40 2gqc h ARG 52 CO 0.02 1.28 -0.47 0.93 0.10 0.00 0.00 179.97 181.83 2gqc h GLU 53 N 0.10 0.00 0.00 0.08 5.08 -1.50 -2.59 114.58 115.75 2gqc h GLU 53 Ca -0.23 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 57.91 2gqc h GLU 53 Cb 2.07 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 31.28 2gqc h GLU 53 CO 0.21 0.03 -2.08 1.28 -1.00 0.00 0.00 179.01 177.45 2gqc n LEU 54 N -2.93 0.00 0.20 1.33 4.32 -0.99 -4.31 117.00 114.62 2gqc n LEU 54 Ca 0.02 0.00 0.04 0.00 -0.02 0.00 0.00 56.01 56.05 2gqc n LEU 54 Cb 0.56 0.30 0.45 0.00 -1.62 0.00 0.00 43.42 43.10 2gqc n LEU 54 CO 0.37 0.30 0.85 1.88 -1.22 0.00 0.00 177.39 179.57 2gqc h TYR 55 N 0.00 0.04 0.00 -1.77 0.05 -1.44 0.76 116.97 114.60 2gqc h TYR 55 Ca -0.33 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.45 2gqc h TYR 55 Cb 1.70 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 39.43 2gqc h TYR 55 CO 0.00 0.26 0.00 2.89 -1.05 0.00 0.00 178.16 180.26 2gqc n ARG 56 N -4.26 0.22 0.00 4.88 1.85 -0.98 -2.26 116.66 116.11 2gqc n ARG 56 Ca -0.02 0.09 0.00 0.00 -1.00 0.00 0.00 57.85 56.92 2gqc n ARG 56 Cb 0.29 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.20 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 -1.35 1.70 0.00 2.89 1.85 -0.44 -4.39 116.66 116.92 2gqc n ARG 57 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.94 2gqc n ARG 57 Cb 0.20 -0.18 0.00 0.00 -1.05 0.00 0.00 32.46 31.44 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 -0.36 2.89 4.02 0.25 -3.16 117.16 120.71 2gqc n TYR 58 Ca 0.00 0.00 0.26 0.00 -0.01 0.00 0.00 57.90 58.15 2gqc n TYR 58 Cb 0.00 0.00 0.52 0.00 -0.02 0.00 0.00 39.34 39.84 2gqc n TYR 58 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 2gqc h PRO 59 N 0.00 0.29 -0.01 -0.72 0.11 -1.74 -0.48 132.00 129.45 2gqc h PRO 59 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2gqc h PRO 59 Cb 0.00 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.05 2gqc h PRO 59 CO 0.00 0.19 -0.02 -1.91 -0.21 0.00 0.00 178.00 176.05 2gqc n GLU 60 N -4.86 0.32 -0.36 1.05 4.07 -0.96 -3.83 120.64 116.08 2gqc n GLU 60 Ca 0.31 -0.68 0.00 0.00 -0.06 0.00 0.00 57.16 56.74 2gqc n GLU 60 Cb 1.06 -1.04 0.13 0.00 -0.06 0.00 0.00 31.44 31.53 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 0.35 2.21 3.83 8.31 0.00 -0.77 -0.26 105.19 118.87 2gqc n GLY 61 Ca 0.02 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.20 4.25 0.00 1.61 2.15 -0.26 -4.59 116.67 119.63 2gqc s ASP 62 Ca 0.20 1.05 0.00 0.00 0.43 0.00 0.00 52.55 54.23 2gqc s ASP 62 Cb 0.16 -1.68 0.00 0.00 -0.30 0.00 0.00 42.92 41.09 2gqc s ASP 62 CO 0.06 -2.09 0.24 -2.65 -0.17 0.00 0.00 175.17 170.55 2gqc n PRO 63 N -3.48 0.00 0.06 4.34 -0.02 -1.26 -2.79 135.00 131.86 2gqc n PRO 63 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 2gqc n PRO 63 Cb 0.58 -1.12 0.00 0.00 -0.02 0.00 0.00 33.50 32.95 2gqc n PRO 63 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2gqc n GLN 64 N 2.25 0.00 0.00 -0.52 7.27 -1.26 -5.12 117.38 120.00 2gqc n GLN 64 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2gqc n GLN 64 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 2gqc n GLN 64 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2gqc n ALA 65 N -2.90 1.23 -3.15 1.69 0.00 -1.12 -5.13 120.51 111.14 2gqc n ALA 65 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 2gqc n ALA 65 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 2gqc n ALA 65 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2gqc n THR 66 N -0.23 0.00 0.00 0.00 5.66 0.64 -4.94 114.28 115.41 2gqc n THR 66 Ca 0.00 -1.43 0.00 0.00 -3.05 0.00 0.00 64.05 59.57 2gqc n THR 66 Cb 0.00 -0.57 0.00 0.00 -1.55 0.00 0.00 70.33 68.21 2gqc n THR 66 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 2gqc n LEU 67 N 0.00 0.00 -2.28 1.09 7.94 -1.26 -3.85 117.00 118.63 2gqc n LEU 67 Ca 0.10 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.81 2gqc n LEU 67 Cb 0.44 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.37 2gqc n LEU 67 CO 0.28 0.00 -0.23 -0.62 -1.11 0.00 0.00 177.39 175.71 2gqc n GLU 68 N 0.00 -1.78 0.00 1.96 4.71 -1.26 -4.78 120.64 119.49 2gqc n GLU 68 Ca 0.00 0.92 0.00 0.00 -0.01 0.00 0.00 57.16 58.07 2gqc n GLU 68 Cb 0.00 -5.53 0.00 0.00 -1.01 0.00 0.00 31.44 24.90 2gqc n GLU 68 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2gqc n ALA 69 N -1.61 1.11 0.00 0.62 0.00 -1.26 -5.22 120.51 114.15 2gqc n ALA 69 Ca -0.21 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.69 2gqc n ALA 69 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 2gqc n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50