#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gy9 n ARG 2 N 0.00 -2.84 -3.73 -0.52 5.12 -1.26 -5.08 116.66 108.35 2gy9 n ARG 2 Ca 0.00 -0.57 -0.13 0.00 -1.93 0.00 0.00 57.85 55.22 2gy9 n ARG 2 Cb 0.00 -0.69 -0.10 0.00 -1.16 0.00 0.00 32.46 30.51 2gy9 n ARG 2 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2gy9 s SER 3 N -2.45 -0.43 0.00 0.55 1.04 -1.26 -5.05 113.70 106.09 2gy9 s SER 3 Ca 0.25 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.52 2gy9 s SER 3 Cb -0.04 0.84 0.00 0.00 0.10 0.00 0.00 66.02 66.92 2gy9 s SER 3 CO 0.21 -0.14 0.00 -0.11 0.98 0.00 0.00 173.24 174.17 2gy9 n LEU 4 N 2.91 0.00 0.00 2.42 7.94 -1.26 -5.07 117.00 123.94 2gy9 n LEU 4 Ca -0.14 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.76 2gy9 n LEU 4 Cb 0.57 0.19 0.00 0.00 0.53 0.00 0.00 43.42 44.71 2gy9 n LEU 4 CO 0.13 -0.40 0.00 0.29 -1.11 0.00 0.00 177.39 176.30 2gy9 n LYS 5 N -2.29 0.00 -0.11 1.96 5.02 -1.26 -2.56 118.16 118.92 2gy9 n LYS 5 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2gy9 n LYS 5 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2gy9 n LYS 5 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2gy9 n LYS 6 N 0.00 0.00 -2.71 1.97 4.76 -1.26 -5.02 118.16 115.90 2gy9 n LYS 6 Ca 0.00 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.17 2gy9 n LYS 6 Cb 0.00 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.17 2gy9 n LYS 6 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2gy9 n GLY 7 N 0.00 5.77 3.59 0.72 0.00 -1.06 -5.08 105.19 109.13 2gy9 n GLY 7 Ca 0.00 -2.76 -0.45 0.00 0.00 0.00 0.00 46.02 42.81 2gy9 n GLY 7 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2gy9 n PRO 8 N -0.36 1.32 -3.67 1.61 -0.02 -1.26 -4.93 135.00 127.70 2gy9 n PRO 8 Ca 0.35 0.46 -0.37 0.00 -2.02 0.00 0.00 63.50 61.93 2gy9 n PRO 8 Cb 0.53 -1.84 -0.10 0.00 -0.02 0.00 0.00 33.50 32.07 2gy9 n PRO 8 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2gy9 s PHE 9 N -0.97 3.30 -0.28 6.00 2.19 -1.26 -5.04 117.98 121.92 2gy9 s PHE 9 Ca 0.60 0.20 -0.04 0.00 0.33 0.00 0.00 56.93 58.02 2gy9 s PHE 9 Cb -0.72 -2.27 0.09 0.00 -1.31 0.00 0.00 43.02 38.82 2gy9 s PHE 9 CO 0.59 0.04 0.12 0.42 1.83 0.00 0.00 175.22 178.23 2gy9 s ILE 10 N 1.10 0.02 -0.07 3.12 1.09 -1.26 -0.62 121.20 124.58 2gy9 s ILE 10 Ca 0.07 -0.74 -0.39 0.00 -1.10 0.00 0.00 60.65 58.50 2gy9 s ILE 10 Cb -0.14 -0.99 -0.17 0.00 -1.06 0.00 0.00 42.46 40.11 2gy9 s ILE 10 CO 0.05 -0.66 1.47 0.47 -0.10 0.00 0.00 174.94 176.17 2gy9 n ASP 11 N 5.22 1.77 0.29 3.58 9.92 -1.26 -4.81 116.55 131.26 2gy9 n ASP 11 Ca -0.06 1.11 0.20 0.00 -0.53 0.00 0.00 54.79 55.51 2gy9 n ASP 11 Cb 0.43 -1.14 1.01 0.00 -0.64 0.00 0.00 41.12 40.77 2gy9 n ASP 11 CO 0.00 0.00 0.00 0.17 0.13 0.00 0.00 177.20 177.50 2gy9 h LEU 12 N 5.39 0.00 -1.92 0.64 8.10 -1.99 -0.89 115.31 124.64 2gy9 h LEU 12 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.52 2gy9 h LEU 12 Cb 1.34 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.56 2gy9 h LEU 12 CO 0.84 0.00 0.00 0.00 -4.11 0.00 0.00 178.44 175.17 2gy9 n HIS 13 N -2.90 0.83 -1.63 0.17 1.44 -1.26 -3.21 115.22 108.66 2gy9 n HIS 13 Ca -0.02 -0.32 0.00 0.00 -2.01 0.00 0.00 57.72 55.37 2gy9 n HIS 13 Cb 0.10 -0.19 0.00 0.00 0.12 0.00 0.00 29.99 30.02 2gy9 n HIS 13 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 2gy9 n LEU 14 N 0.42 0.00 0.00 2.39 -0.00 -0.38 -4.90 117.00 114.52 2gy9 n LEU 14 Ca 0.13 -0.42 0.00 0.00 -0.00 0.00 0.00 56.01 55.72 2gy9 n LEU 14 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.98 2gy9 n LEU 14 CO 0.13 0.35 -0.41 -0.11 -0.00 0.00 0.00 177.39 177.35 2gy9 n LEU 15 N 0.00 0.00 0.01 1.47 7.94 -0.92 -4.54 117.00 120.95 2gy9 n LEU 15 Ca 0.00 0.00 -0.19 0.00 -1.11 0.00 0.00 56.01 54.71 2gy9 n LEU 15 Cb 0.52 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 44.33 2gy9 n LEU 15 CO 0.00 0.00 0.00 0.11 -1.11 0.00 0.00 177.39 176.39 2gy9 h LYS 16 N 0.00 0.20 -0.18 1.96 1.57 -1.82 -3.24 116.57 115.06 2gy9 h LYS 16 Ca 0.00 -0.35 -0.16 0.00 -1.87 0.00 0.00 60.65 58.28 2gy9 h LYS 16 Cb 0.65 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 2gy9 h LYS 16 CO 0.00 1.17 -0.54 -0.22 -0.57 0.00 0.00 179.45 179.29 2gy9 h LYS 17 N -0.54 0.53 -0.01 3.15 3.64 -1.88 -2.11 116.57 119.36 2gy9 h LYS 17 Ca -0.15 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2gy9 h LYS 17 Cb 1.50 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 33.35 2gy9 h LYS 17 CO 0.08 0.93 0.01 -0.24 -2.27 0.00 0.00 179.45 177.96 2gy9 h VAL 18 N 0.41 0.43 0.00 2.00 3.04 -1.80 0.53 116.25 120.86 2gy9 h VAL 18 Ca 0.01 0.00 -0.19 0.00 -1.01 0.00 0.00 66.70 65.51 2gy9 h VAL 18 Cb 1.07 0.99 -0.03 0.00 -2.01 0.00 0.00 31.29 31.31 2gy9 h VAL 18 CO 0.10 0.00 -1.08 -0.33 -1.01 0.00 0.00 177.57 175.25 2gy9 h GLU 19 N 0.00 0.00 0.62 4.17 4.39 -1.45 -3.33 114.58 118.98 2gy9 h GLU 19 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2gy9 h GLU 19 Cb 0.02 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.68 2gy9 h GLU 19 CO -0.00 0.63 -0.30 0.87 -1.16 0.00 0.00 179.01 179.05 2gy9 h LYS 20 N 0.00 -0.80 0.00 2.33 1.57 0.67 -1.70 116.57 118.65 2gy9 h LYS 20 Ca -0.09 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2gy9 h LYS 20 Cb 1.67 0.18 0.00 0.00 0.08 0.00 0.00 32.23 34.16 2gy9 h LYS 20 CO 0.09 -0.52 0.41 0.00 -0.57 0.00 0.00 179.45 178.85 2gy9 h ALA 21 N -0.47 1.39 0.00 3.86 0.00 -1.47 0.47 119.26 123.04 2gy9 h ALA 21 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2gy9 h ALA 21 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2gy9 h ALA 21 CO 0.14 -0.39 0.00 0.28 0.00 0.00 0.00 179.25 179.28 2gy9 n VAL 22 N -2.74 0.00 -0.28 0.00 0.31 -0.64 -3.52 118.33 111.46 2gy9 n VAL 22 Ca -0.02 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.30 2gy9 n VAL 22 Cb 0.44 -0.48 0.11 0.00 -0.91 0.00 0.00 33.84 33.01 2gy9 n VAL 22 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2gy9 h GLU 23 N 0.00 0.86 -0.82 5.55 5.08 -0.17 -3.35 114.58 121.74 2gy9 h GLU 23 Ca 0.00 -0.05 -0.36 0.00 -1.00 0.00 0.00 59.36 57.95 2gy9 h GLU 23 Cb 0.00 -0.20 -0.24 0.00 0.50 0.00 0.00 28.75 28.81 2gy9 h GLU 23 CO 0.00 0.57 -0.74 0.43 -1.00 0.00 0.00 179.01 178.27 2gy9 n SER 24 N -4.66 -1.59 0.00 1.42 7.64 -1.23 -5.11 113.62 110.09 2gy9 n SER 24 Ca 0.10 -3.09 0.00 0.00 1.01 0.00 0.00 58.87 56.89 2gy9 n SER 24 Cb 0.14 0.83 0.00 0.00 -1.01 0.00 0.00 64.21 64.17 2gy9 n SER 24 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gy9 n GLY 25 N 1.44 0.93 3.61 0.23 0.00 -1.25 -4.98 105.19 105.18 2gy9 n GLY 25 Ca 0.14 -1.39 -0.28 0.00 0.00 0.00 0.00 46.02 44.48 2gy9 n GLY 25 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gy9 s ASP 26 N -4.00 3.33 0.20 1.61 1.01 -1.24 -3.51 116.67 114.07 2gy9 s ASP 26 Ca 0.00 -1.66 0.08 0.00 0.71 0.00 0.00 52.55 51.68 2gy9 s ASP 26 Cb 0.00 0.49 -0.05 0.00 1.01 0.00 0.00 42.92 44.37 2gy9 s ASP 26 CO 0.00 -0.89 -0.15 -0.75 0.21 0.00 0.00 175.17 173.59 2gy9 s LYS 27 N -3.77 1.32 1.09 8.23 2.20 -1.26 -4.96 119.74 122.58 2gy9 s LYS 27 Ca 0.17 -1.57 -0.16 0.00 -0.36 0.00 0.00 55.97 54.05 2gy9 s LYS 27 Cb 0.02 -1.14 0.12 0.00 -1.51 0.00 0.00 37.83 35.32 2gy9 s LYS 27 CO 0.10 0.19 0.25 1.63 -0.36 0.00 0.00 175.35 177.17 2gy9 n LYS 28 N -0.30 -1.44 -1.45 4.03 5.02 -1.26 -4.68 118.16 118.07 2gy9 n LYS 28 Ca -0.09 -0.40 -0.47 0.00 -2.02 0.00 0.00 58.31 55.34 2gy9 n LYS 28 Cb 0.60 -1.81 -0.02 0.00 -0.02 0.00 0.00 35.03 33.77 2gy9 n LYS 28 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2gy9 n PRO 29 N -2.46 0.38 -4.33 1.97 -0.04 -1.26 -4.85 135.00 124.41 2gy9 n PRO 29 Ca 0.02 0.13 -0.29 0.00 -0.04 0.00 0.00 63.50 63.33 2gy9 n PRO 29 Cb 0.59 -1.24 -0.05 0.00 -0.04 0.00 0.00 33.50 32.76 2gy9 n PRO 29 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2gy9 s LEU 30 N 2.29 2.63 -0.04 1.53 2.96 -0.66 -4.98 118.68 122.41 2gy9 s LEU 30 Ca 0.62 -1.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.13 2gy9 s LEU 30 Cb -0.86 -1.04 0.03 0.00 0.50 0.00 0.00 46.19 44.83 2gy9 s LEU 30 CO 0.57 -0.86 0.07 -0.13 -1.32 0.00 0.00 176.35 174.69 2gy9 s ARG 31 N -4.01 -0.06 0.11 1.98 0.52 -1.26 -0.04 118.95 116.19 2gy9 s ARG 31 Ca 0.24 0.38 0.10 0.00 -0.52 0.00 0.00 55.73 55.94 2gy9 s ARG 31 Cb 0.01 -0.46 -0.04 0.00 0.52 0.00 0.00 34.95 34.99 2gy9 s ARG 31 CO 0.14 -0.31 -0.26 -0.08 0.02 0.00 0.00 175.30 174.81 2gy9 s THR 32 N 2.07 2.16 -0.19 0.02 -1.32 -0.77 -4.95 115.64 112.67 2gy9 s THR 32 Ca 0.03 -1.66 -0.08 0.00 -1.21 0.00 0.00 61.69 58.77 2gy9 s THR 32 Cb -0.12 -1.91 -0.21 0.00 -1.51 0.00 0.00 72.50 68.75 2gy9 s THR 32 CO -0.03 0.12 0.10 0.79 -2.21 0.00 0.00 174.62 173.39 2gy9 n TRP 33 N 1.10 0.75 -2.51 9.09 8.01 -1.26 -3.59 117.44 129.03 2gy9 n TRP 33 Ca -0.18 0.20 -0.41 0.00 -1.31 0.00 0.00 57.50 55.80 2gy9 n TRP 33 Cb 0.53 -1.09 -0.03 0.00 -2.01 0.00 0.00 31.31 28.71 2gy9 n TRP 33 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 2gy9 s SER 34 N -6.93 6.10 0.00 -0.99 0.15 -1.26 -4.66 113.70 106.10 2gy9 s SER 34 Ca -0.29 -0.35 0.28 0.00 0.70 0.00 0.00 55.95 56.30 2gy9 s SER 34 Cb 0.08 -2.56 1.28 0.00 -1.71 0.00 0.00 66.02 63.12 2gy9 s SER 34 CO 0.66 -1.87 1.93 -2.11 1.20 0.00 0.00 173.24 173.05 2gy9 n ARG 35 N 9.31 0.14 -0.04 5.44 1.85 -1.26 -3.43 116.66 128.66 2gy9 n ARG 35 Ca 0.05 0.02 0.09 0.00 -1.00 0.00 0.00 57.85 57.00 2gy9 n ARG 35 Cb 0.49 -1.50 0.47 0.00 -1.05 0.00 0.00 32.46 30.88 2gy9 n ARG 35 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2gy9 h ARG 36 N 0.00 0.45 -6.78 2.89 2.47 -1.97 -3.18 114.38 108.25 2gy9 h ARG 36 Ca 0.00 -0.03 -0.57 0.00 -1.26 0.00 0.00 59.98 58.13 2gy9 h ARG 36 Cb 0.41 -0.10 0.17 0.00 -1.65 0.00 0.00 29.97 28.80 2gy9 h ARG 36 CO 0.00 0.29 -0.03 -1.13 0.56 0.00 0.00 179.97 179.67 2gy9 n SER 37 N -4.47 0.16 -4.85 7.04 3.41 -1.22 -4.88 113.62 108.80 2gy9 n SER 37 Ca 0.07 0.74 -0.30 0.00 -0.26 0.00 0.00 58.87 59.11 2gy9 n SER 37 Cb 0.24 -1.34 -0.05 0.00 -0.26 0.00 0.00 64.21 62.80 2gy9 n SER 37 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2gy9 s THR 38 N -1.66 4.97 0.21 6.66 2.01 0.21 -3.31 115.64 124.73 2gy9 s THR 38 Ca 0.73 -0.61 -0.28 0.00 0.31 0.00 0.00 61.69 61.84 2gy9 s THR 38 Cb -0.40 -3.43 -0.08 0.00 0.01 0.00 0.00 72.50 68.60 2gy9 s THR 38 CO 0.50 0.10 0.88 -0.63 -0.69 0.00 0.00 174.62 174.78 2gy9 s ILE 39 N -1.49 4.20 0.20 1.82 1.01 -0.84 -4.83 121.20 121.27 2gy9 s ILE 39 Ca 0.32 1.95 -0.02 0.00 0.00 0.00 0.00 60.65 62.90 2gy9 s ILE 39 Cb -0.12 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 38.05 2gy9 s ILE 39 CO 0.25 0.50 0.15 -0.36 0.00 0.00 0.00 174.94 175.48 2gy9 s PHE 40 N -1.11 1.09 0.00 3.97 0.40 -1.26 -1.48 117.98 119.58 2gy9 s PHE 40 Ca 0.39 -1.32 0.00 0.00 -0.60 0.00 0.00 56.93 55.40 2gy9 s PHE 40 Cb -0.25 -0.50 0.00 0.00 0.51 0.00 0.00 43.02 42.78 2gy9 s PHE 40 CO 0.30 -0.66 0.34 -2.30 0.70 0.00 0.00 175.22 173.60 2gy9 n PRO 41 N -0.27 0.00 -0.23 0.24 -0.02 -1.26 -1.53 135.00 131.93 2gy9 n PRO 41 Ca 0.01 0.34 0.17 0.00 -2.02 0.00 0.00 63.50 62.00 2gy9 n PRO 41 Cb 0.66 -0.62 0.31 0.00 -0.02 0.00 0.00 33.50 33.83 2gy9 n PRO 41 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2gy9 n ASN 42 N -1.22 0.09 0.00 2.55 6.94 -1.26 0.17 115.26 122.53 2gy9 n ASN 42 Ca 0.00 1.18 0.05 0.00 -0.02 0.00 0.00 54.58 55.79 2gy9 n ASN 42 Cb 0.00 -0.50 0.27 0.00 -2.36 0.00 0.00 39.78 37.18 2gy9 n ASN 42 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2gy9 n MET 43 N -4.76 0.13 -2.21 -3.83 2.81 -0.58 -4.78 117.12 103.89 2gy9 n MET 43 Ca 0.22 0.21 -0.38 0.00 -1.81 0.00 0.00 57.70 55.93 2gy9 n MET 43 Cb 0.73 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.73 2gy9 n MET 43 CO 0.00 0.00 0.00 -1.50 1.51 0.00 0.00 175.97 175.98 2gy9 s ILE 44 N -2.66 2.97 0.00 2.02 2.07 0.46 -2.98 121.20 123.08 2gy9 s ILE 44 Ca 0.09 0.82 0.00 0.00 -1.41 0.00 0.00 60.65 60.15 2gy9 s ILE 44 Cb 0.07 -3.46 0.00 0.00 0.13 0.00 0.00 42.46 39.20 2gy9 s ILE 44 CO 0.17 0.08 0.00 0.61 -1.91 0.00 0.00 174.94 173.89 2gy9 n GLY 45 N 0.64 2.93 3.91 1.50 0.00 -0.91 -5.01 105.19 108.26 2gy9 n GLY 45 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 2gy9 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gy9 s LEU 46 N 0.00 3.13 -0.35 0.99 1.02 -1.16 -4.88 118.68 117.42 2gy9 s LEU 46 Ca 0.00 0.74 0.02 0.00 0.02 0.00 0.00 54.13 54.92 2gy9 s LEU 46 Cb 0.00 -3.54 0.10 0.00 0.02 0.00 0.00 46.19 42.77 2gy9 s LEU 46 CO 0.00 -1.18 0.08 -0.89 0.02 0.00 0.00 176.35 174.39 2gy9 s THR 47 N -3.08 2.53 -0.10 5.49 2.01 -1.26 -2.02 115.64 119.21 2gy9 s THR 47 Ca 0.55 -2.25 -0.10 0.00 0.31 0.00 0.00 61.69 60.21 2gy9 s THR 47 Cb -0.11 -2.82 -0.05 0.00 0.01 0.00 0.00 72.50 69.54 2gy9 s THR 47 CO 0.46 -0.60 0.22 -0.63 -0.69 0.00 0.00 174.62 173.37 2gy9 s ILE 48 N 0.97 5.37 -0.32 1.82 -1.09 -1.08 -1.65 121.20 125.21 2gy9 s ILE 48 Ca 0.10 0.39 -0.12 0.00 -2.23 0.00 0.00 60.65 58.79 2gy9 s ILE 48 Cb -0.20 -3.50 -0.02 0.00 -1.58 0.00 0.00 42.46 37.16 2gy9 s ILE 48 CO -0.07 0.58 0.21 0.00 -1.23 0.00 0.00 174.94 174.43 2gy9 s ALA 49 N -0.86 3.45 0.15 9.38 0.00 0.95 0.32 121.76 135.14 2gy9 s ALA 49 Ca 0.17 -1.33 -0.09 0.00 0.00 0.00 0.00 51.96 50.71 2gy9 s ALA 49 Cb -0.13 -2.56 -0.06 0.00 0.00 0.00 0.00 23.12 20.37 2gy9 s ALA 49 CO 0.06 -0.87 0.46 0.08 0.00 0.00 0.00 175.76 175.49 2gy9 s VAL 50 N 1.70 5.03 -0.31 0.00 1.01 -0.50 -1.84 120.40 125.48 2gy9 s VAL 50 Ca 0.06 0.41 -0.19 0.00 0.00 0.00 0.00 61.98 62.26 2gy9 s VAL 50 Cb -0.17 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 2gy9 s VAL 50 CO 0.09 0.12 0.57 -2.28 0.00 0.00 0.00 175.10 173.60 2gy9 s HIS 51 N -1.59 3.21 -0.79 5.22 2.46 -1.24 -0.33 115.29 122.22 2gy9 s HIS 51 Ca 0.40 0.47 0.26 0.00 0.47 0.00 0.00 55.06 56.65 2gy9 s HIS 51 Cb -0.13 -2.92 0.94 0.00 -0.13 0.00 0.00 32.58 30.34 2gy9 s HIS 51 CO 0.21 -0.46 1.79 0.09 -2.47 0.00 0.00 174.74 173.90 2gy9 n ASN 52 N 5.78 0.51 0.00 9.88 5.03 -0.26 -4.84 115.26 131.36 2gy9 n ASN 52 Ca -0.03 0.56 0.00 0.00 0.87 0.00 0.00 54.58 55.98 2gy9 n ASN 52 Cb 0.49 -0.69 0.00 0.00 -1.02 0.00 0.00 39.78 38.56 2gy9 n ASN 52 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2gy9 n GLY 53 N 1.11 2.08 0.45 7.41 0.00 -1.26 -4.76 105.19 110.22 2gy9 n GLY 53 Ca 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.03 2gy9 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gy9 n ARG 54 N -0.03 0.11 -4.09 1.61 1.74 -1.26 -5.11 116.66 109.63 2gy9 n ARG 54 Ca 0.00 0.04 -0.14 0.00 -0.77 0.00 0.00 57.85 56.98 2gy9 n ARG 54 Cb 0.00 -0.88 -0.04 0.00 -1.02 0.00 0.00 32.46 30.52 2gy9 n ARG 54 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2gy9 s GLN 55 N -2.09 1.86 -0.26 5.56 -1.52 -1.26 -5.15 119.66 116.80 2gy9 s GLN 55 Ca -0.07 -1.72 -0.08 0.00 -1.95 0.00 0.00 55.36 51.54 2gy9 s GLN 55 Cb 0.02 0.44 -0.04 0.00 -0.22 0.00 0.00 33.01 33.22 2gy9 s GLN 55 CO 0.10 -0.77 0.11 -1.01 -0.25 0.00 0.00 175.29 173.47 2gy9 s HIS 56 N -3.16 3.13 -0.17 0.91 3.76 -1.26 -1.10 115.29 117.40 2gy9 s HIS 56 Ca 0.30 -0.24 -0.09 0.00 -0.15 0.00 0.00 55.06 54.88 2gy9 s HIS 56 Cb -0.00 -2.27 -0.05 0.00 1.11 0.00 0.00 32.58 31.37 2gy9 s HIS 56 CO 0.19 -0.28 0.12 0.14 -0.85 0.00 0.00 174.74 174.06 2gy9 s VAL 57 N 1.61 5.35 -0.22 -0.90 -7.23 0.54 -4.80 120.40 114.76 2gy9 s VAL 57 Ca 0.06 0.16 -0.29 0.00 -1.81 0.00 0.00 61.98 60.11 2gy9 s VAL 57 Cb -0.15 -3.40 -0.03 0.00 0.56 0.00 0.00 36.38 33.36 2gy9 s VAL 57 CO 0.06 0.51 1.61 -2.16 -0.31 0.00 0.00 175.10 174.80 2gy9 s PRO 58 N -0.14 3.81 -0.41 4.82 0.04 -1.26 -1.41 135.00 140.45 2gy9 s PRO 58 Ca 0.10 1.67 -0.01 0.00 0.04 0.00 0.00 61.00 62.80 2gy9 s PRO 58 Cb -0.11 -4.03 0.11 0.00 0.04 0.00 0.00 34.50 30.51 2gy9 s PRO 58 CO 0.00 -1.27 0.19 0.08 0.04 0.00 0.00 177.00 176.04 2gy9 s VAL 59 N 5.13 3.09 -0.53 -0.36 1.01 0.15 -4.97 120.40 123.92 2gy9 s VAL 59 Ca 0.71 -2.21 -0.27 0.00 0.00 0.00 0.00 61.98 60.21 2gy9 s VAL 59 Cb -0.25 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 2gy9 s VAL 59 CO 0.29 -0.69 1.88 0.12 0.00 0.00 0.00 175.10 176.70 2gy9 s PHE 60 N 0.97 1.66 0.27 5.22 2.19 -1.26 -2.63 117.98 124.41 2gy9 s PHE 60 Ca 0.10 0.81 -0.29 0.00 0.33 0.00 0.00 56.93 57.87 2gy9 s PHE 60 Cb -0.22 -4.06 -0.10 0.00 -1.31 0.00 0.00 43.02 37.33 2gy9 s PHE 60 CO -0.05 -2.47 1.28 0.08 1.83 0.00 0.00 175.22 175.89 2gy9 s VAL 61 N 8.73 3.01 0.15 3.12 1.01 -0.86 -4.99 120.40 130.57 2gy9 s VAL 61 Ca 0.73 0.93 0.05 0.00 0.00 0.00 0.00 61.98 63.69 2gy9 s VAL 61 Cb -0.15 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 2gy9 s VAL 61 CO 0.24 0.19 -0.11 -0.89 0.00 0.00 0.00 175.10 174.54 2gy9 s THR 62 N -0.60 1.23 0.34 3.92 2.01 -1.26 -2.13 115.64 119.14 2gy9 s THR 62 Ca 0.52 -2.07 0.07 0.00 0.31 0.00 0.00 61.69 60.52 2gy9 s THR 62 Cb -0.37 -1.86 0.31 0.00 0.01 0.00 0.00 72.50 70.59 2gy9 s THR 62 CO 0.45 -0.73 1.85 -2.24 -0.69 0.00 0.00 174.62 173.25 2gy9 h ASP 63 N 2.76 0.72 0.60 3.53 2.03 -1.96 0.41 116.42 124.52 2gy9 h ASP 63 Ca -0.37 0.05 -0.04 0.00 -0.73 0.00 0.00 57.03 55.95 2gy9 h ASP 63 Cb 1.19 -0.09 -0.01 0.00 -0.83 0.00 0.00 39.33 39.60 2gy9 h ASP 63 CO 0.63 0.35 -0.19 -0.08 -1.03 0.00 0.00 179.24 178.92 2gy9 h GLU 64 N 0.75 0.00 0.00 4.15 4.81 -2.01 -2.46 114.58 119.82 2gy9 h GLU 64 Ca 0.48 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.70 2gy9 h GLU 64 Cb 0.73 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.11 2gy9 h GLU 64 CO -0.24 0.19 -0.31 0.52 -0.73 0.00 0.00 179.01 178.44 2gy9 h MET 65 N 0.00 0.00 -6.39 1.92 2.86 -0.60 -3.47 114.93 109.25 2gy9 h MET 65 Ca -0.00 0.00 -0.63 0.00 -2.06 0.00 0.00 59.70 57.01 2gy9 h MET 65 Cb 0.54 0.00 0.06 0.00 0.06 0.00 0.00 31.60 32.25 2gy9 h MET 65 CO 0.02 0.04 0.63 0.28 1.06 0.00 0.00 176.91 178.95 2gy9 n VAL 66 N -3.00 0.01 0.00 -2.22 0.31 -0.74 -2.30 118.33 110.39 2gy9 n VAL 66 Ca 0.03 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2gy9 n VAL 66 Cb 0.56 -1.19 0.00 0.00 -0.91 0.00 0.00 33.84 32.30 2gy9 n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gy9 n GLY 67 N 3.00 3.09 3.85 2.92 0.00 -0.55 -4.99 105.19 112.51 2gy9 n GLY 67 Ca 0.18 -1.07 -0.32 0.00 0.00 0.00 0.00 46.02 44.81 2gy9 n GLY 67 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2gy9 s HIS 68 N -0.23 3.49 0.61 1.61 4.02 -0.97 -4.49 115.29 119.32 2gy9 s HIS 68 Ca 0.00 1.35 -0.13 0.00 1.02 0.00 0.00 55.06 57.30 2gy9 s HIS 68 Cb 0.00 -2.71 -0.03 0.00 -1.02 0.00 0.00 32.58 28.82 2gy9 s HIS 68 CO 0.00 -0.37 1.03 0.15 1.02 0.00 0.00 174.74 176.57 2gy9 s LYS 69 N -4.23 3.42 0.44 1.40 3.01 -1.26 -1.98 119.74 120.54 2gy9 s LYS 69 Ca 0.57 0.96 0.17 0.00 -1.01 0.00 0.00 55.97 56.66 2gy9 s LYS 69 Cb -0.10 -2.06 1.00 0.00 -1.01 0.00 0.00 37.83 35.66 2gy9 s LYS 69 CO 0.35 -0.71 1.94 -0.07 0.51 0.00 0.00 175.35 177.38 2gy9 h LEU 70 N 0.02 0.00 -1.46 3.17 3.38 -1.58 -2.50 115.31 116.33 2gy9 h LEU 70 Ca -0.45 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 2gy9 h LEU 70 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2gy9 h LEU 70 CO 0.59 0.24 -0.21 1.23 0.09 0.00 0.00 178.44 180.38 2gy9 h GLY 71 N 0.88 0.00 2.00 0.83 0.00 -1.84 -2.74 103.07 102.19 2gy9 h GLY 71 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2gy9 h GLY 71 CO 0.03 0.00 -0.10 0.83 0.00 0.00 0.00 176.54 177.30 2gy9 h GLU 72 N 0.00 0.00 -0.33 4.80 5.08 -1.77 -2.09 114.58 120.27 2gy9 h GLU 72 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2gy9 h GLU 72 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2gy9 h GLU 72 CO 0.03 0.10 0.00 1.19 -1.00 0.00 0.00 179.01 179.33 2gy9 n PHE 73 N -3.38 0.42 -3.94 4.33 3.01 -1.04 -4.71 117.46 112.15 2gy9 n PHE 73 Ca -0.01 -0.23 -0.30 0.00 1.01 0.00 0.00 57.45 57.92 2gy9 n PHE 73 Cb 0.28 -0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.61 2gy9 n PHE 73 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2gy9 s ALA 74 N -1.44 3.41 0.24 4.37 0.00 -0.79 -4.98 121.76 122.57 2gy9 s ALA 74 Ca 0.35 -3.38 -0.31 0.00 0.00 0.00 0.00 51.96 48.61 2gy9 s ALA 74 Cb 0.21 -2.17 -0.12 0.00 0.00 0.00 0.00 23.12 21.04 2gy9 s ALA 74 CO 0.29 -2.03 1.68 -1.25 0.00 0.00 0.00 175.76 174.44 2gy9 s PRO 75 N -0.50 4.12 -0.04 0.00 0.04 -1.26 -4.86 135.00 132.49 2gy9 s PRO 75 Ca 0.18 2.60 -0.05 0.00 0.04 0.00 0.00 61.00 63.78 2gy9 s PRO 75 Cb -0.22 -3.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 2gy9 s PRO 75 CO -0.03 -0.71 0.26 1.79 0.04 0.00 0.00 177.00 178.35 2gy9 h THR 76 N 3.66 0.00 -4.06 1.26 1.35 -1.91 -3.46 112.91 109.76 2gy9 h THR 76 Ca -0.44 -0.51 -0.46 0.00 -0.55 0.00 0.00 66.41 64.45 2gy9 h THR 76 Cb 1.21 0.00 0.14 0.00 -1.73 0.00 0.00 68.15 67.77 2gy9 h THR 76 CO 0.90 0.00 0.25 0.00 -0.25 0.00 0.00 175.52 176.42 2gy9 s ARG 77 N -2.02 0.87 -0.22 4.72 1.70 -1.26 -4.99 118.95 117.76 2gy9 s ARG 77 Ca -0.02 0.46 -0.03 0.00 -0.47 0.00 0.00 55.73 55.67 2gy9 s ARG 77 Cb 0.00 -1.79 0.07 0.00 -0.57 0.00 0.00 34.95 32.66 2gy9 s ARG 77 CO 0.07 -2.42 0.05 0.99 -1.08 0.00 0.00 175.30 172.92 2gy9 s THR 78 N -3.10 0.52 -0.25 4.99 2.01 -1.26 -5.11 115.64 113.44 2gy9 s THR 78 Ca 0.64 -0.69 -0.08 0.00 0.31 0.00 0.00 61.69 61.87 2gy9 s THR 78 Cb -0.17 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.19 2gy9 s THR 78 CO 0.56 -0.32 0.10 -0.47 -0.69 0.00 0.00 174.62 173.80 2gy9 s TYR 79 N 1.84 3.13 0.09 4.92 5.04 -1.26 -5.00 117.35 126.11 2gy9 s TYR 79 Ca 0.01 -0.26 -0.23 0.00 -2.44 0.00 0.00 57.07 54.15 2gy9 s TYR 79 Cb -0.17 -2.26 -0.15 0.00 0.35 0.00 0.00 41.96 39.73 2gy9 s TYR 79 CO -0.13 -0.28 1.73 0.00 -1.34 0.00 0.00 175.55 175.53 2gy9 h ARG 80 N 8.16 -0.03 0.00 4.97 2.47 -2.05 -3.47 114.38 124.44 2gy9 h ARG 80 Ca -0.37 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.35 2gy9 h ARG 80 Cb 1.18 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 2gy9 h ARG 80 CO 0.58 -0.01 0.00 0.41 0.56 0.00 0.00 179.97 181.51 2gy9 n GLY 81 N -1.07 1.58 0.49 0.04 0.00 -1.26 -4.91 105.19 100.06 2gy9 n GLY 81 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 2gy9 n GLY 81 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2gy9 n HIS 82 N -0.52 0.00 -1.48 1.61 -0.00 -1.26 -4.11 115.22 109.45 2gy9 n HIS 82 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2gy9 n HIS 82 Cb 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 29.99 29.91 2gy9 n HIS 82 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2gy9 n ALA 83 N 0.75 0.00 0.99 -1.41 0.00 -1.26 -4.93 120.51 114.66 2gy9 n ALA 83 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.62 2gy9 n ALA 83 Cb 0.05 0.00 0.59 0.00 0.00 0.00 0.00 19.45 20.09 2gy9 n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gy9 n ALA 84 N 0.00 2.24 -3.74 0.00 0.00 -1.26 -4.91 120.51 112.83 2gy9 n ALA 84 Ca 0.00 -0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.12 2gy9 n ALA 84 Cb 0.00 -1.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.00 2gy9 n ALA 84 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2gy9 n ASP 85 N -1.45 -0.93 -4.87 0.00 5.75 -1.26 -4.89 116.55 108.90 2gy9 n ASP 85 Ca 0.08 -0.73 -0.34 0.00 -0.01 0.00 0.00 54.79 53.79 2gy9 n ASP 85 Cb 0.28 -0.89 -0.05 0.00 -1.03 0.00 0.00 41.12 39.43 2gy9 n ASP 85 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2gy9 s LYS 86 N -5.96 3.76 0.00 0.11 0.00 -1.26 -5.14 119.74 111.25 2gy9 s LYS 86 Ca 0.15 0.17 0.00 0.00 0.00 0.00 0.00 55.97 56.28 2gy9 s LYS 86 Cb -0.08 -2.90 0.00 0.00 0.00 0.00 0.00 37.83 34.85 2gy9 s LYS 86 CO 0.56 0.49 0.00 1.63 0.00 0.00 0.00 175.35 178.03