#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gyo s ASP 2 N 0.00 3.87 -0.46 1.96 2.15 -1.26 -5.09 116.67 117.84 1gyo s ASP 2 Ca 0.00 -1.09 -0.24 0.00 0.43 0.00 0.00 52.55 51.66 1gyo s ASP 2 Cb 0.00 -1.46 0.03 0.00 -0.30 0.00 0.00 42.92 41.18 1gyo s ASP 2 CO 0.00 -0.13 0.82 -0.69 -0.17 0.00 0.00 175.17 175.00 1gyo s VAL 3 N 1.22 4.60 0.29 1.11 1.01 -1.26 -5.01 120.40 122.35 1gyo s VAL 3 Ca -0.04 0.45 -0.30 0.00 0.00 0.00 0.00 61.98 62.10 1gyo s VAL 3 Cb -0.17 -4.36 -0.11 0.00 0.00 0.00 0.00 36.38 31.74 1gyo s VAL 3 CO -0.08 -0.78 1.53 -2.16 0.00 0.00 0.00 175.10 173.62 1gyo s PRO 4 N 3.42 4.17 0.31 2.72 0.04 -1.26 -4.88 135.00 139.53 1gyo s PRO 4 Ca 0.31 2.49 0.07 0.00 0.04 0.00 0.00 61.00 63.91 1gyo s PRO 4 Cb -0.12 -3.05 0.52 0.00 0.04 0.00 0.00 34.50 31.90 1gyo s PRO 4 CO 0.23 -0.55 1.75 0.00 0.04 0.00 0.00 177.00 178.47 1gyo s LYS 6 N -4.27 0.80 0.07 0.00 1.02 -1.26 -0.76 119.74 115.34 1gyo s LYS 6 Ca -0.05 -0.27 0.09 0.00 0.02 0.00 0.00 55.97 55.77 1gyo s LYS 6 Cb 0.14 -0.76 -0.03 0.00 -0.52 0.00 0.00 37.83 36.65 1gyo s LYS 6 CO 0.76 0.11 -0.24 0.14 -0.92 0.00 0.00 175.35 175.21 1gyo s VAL 7 N 0.12 2.41 -0.24 3.17 -7.23 -0.25 -4.98 120.40 113.40 1gyo s VAL 7 Ca -0.02 -1.44 -0.05 0.00 -1.81 0.00 0.00 61.98 58.67 1gyo s VAL 7 Cb -0.07 -2.01 -0.01 0.00 0.56 0.00 0.00 36.38 34.85 1gyo s VAL 7 CO 0.00 0.27 -0.00 -0.69 -0.31 0.00 0.00 175.10 174.37 1gyo s VAL 8 N -0.93 3.64 -0.18 1.32 1.01 -1.26 -1.25 120.40 122.75 1gyo s VAL 8 Ca 0.14 -0.46 -0.12 0.00 0.00 0.00 0.00 61.98 61.54 1gyo s VAL 8 Cb -0.10 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 1gyo s VAL 8 CO 0.05 0.36 0.22 -0.63 0.00 0.00 0.00 175.10 175.09 1gyo s ILE 9 N 1.51 5.35 0.00 2.22 1.01 0.48 -4.94 121.20 126.83 1gyo s ILE 9 Ca 0.05 0.38 0.00 0.00 0.00 0.00 0.00 60.65 61.09 1gyo s ILE 9 Cb -0.15 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.76 1gyo s ILE 9 CO -0.01 0.41 0.00 1.07 0.00 0.00 0.00 174.94 176.41 1gyo n THR 10 N 3.60 0.00 -0.80 2.92 5.66 -1.26 -1.08 114.28 123.31 1gyo n THR 10 Ca -0.14 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.55 1gyo n THR 10 Cb 0.52 0.00 0.15 0.00 -1.55 0.00 0.00 70.33 69.45 1gyo n THR 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1gyo s ALA 11 N -1.85 1.62 0.55 1.79 0.00 -1.26 -4.92 121.76 117.69 1gyo s ALA 11 Ca 0.00 0.55 -0.20 0.00 0.00 0.00 0.00 51.96 52.31 1gyo s ALA 11 Cb 0.00 -3.42 -0.06 0.00 0.00 0.00 0.00 23.12 19.64 1gyo s ALA 11 CO 0.00 -2.58 1.04 -2.30 0.00 0.00 0.00 175.76 171.92 1gyo n PRO 12 N -4.09 1.13 -1.62 0.00 -0.02 -1.26 -4.80 135.00 124.35 1gyo n PRO 12 Ca 0.11 0.43 -0.55 0.00 -2.02 0.00 0.00 63.50 61.47 1gyo n PRO 12 Cb 0.52 -2.21 -0.07 0.00 -0.02 0.00 0.00 33.50 31.73 1gyo n PRO 12 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1gyo n GLU 13 N -0.75 0.98 0.00 -0.52 4.07 -1.26 -0.84 120.64 122.33 1gyo n GLU 13 Ca 0.12 0.36 0.00 0.00 -0.06 0.00 0.00 57.16 57.58 1gyo n GLU 13 Cb 0.45 -1.99 0.00 0.00 -0.06 0.00 0.00 31.44 29.84 1gyo n GLU 13 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1gyo n GLY 14 N 2.89 1.57 3.89 8.31 0.00 -1.26 -5.03 105.19 115.55 1gyo n GLY 14 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 1gyo n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gyo s GLU 15 N -0.59 3.18 0.19 1.61 2.02 -0.02 -5.09 118.70 120.00 1gyo s GLU 15 Ca 0.00 -0.84 -0.30 0.00 0.02 0.00 0.00 54.97 53.85 1gyo s GLU 15 Cb 0.00 -2.76 -0.08 0.00 0.10 0.00 0.00 34.13 31.40 1gyo s GLU 15 CO 0.00 0.45 1.06 -0.51 0.02 0.00 0.00 175.26 176.28 1gyo s ASP 16 N -3.65 7.35 0.64 -0.19 1.01 -1.26 -4.79 116.67 115.78 1gyo s ASP 16 Ca 0.33 2.05 -0.17 0.00 0.71 0.00 0.00 52.55 55.47 1gyo s ASP 16 Cb -0.09 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.22 1gyo s ASP 16 CO 0.27 -0.14 1.18 -2.16 0.21 0.00 0.00 175.17 174.53 1gyo s PRO 17 N -0.56 2.77 0.29 8.23 0.04 -1.26 -4.85 135.00 139.66 1gyo s PRO 17 Ca 0.47 1.70 -0.30 0.00 0.04 0.00 0.00 61.00 62.92 1gyo s PRO 17 Cb -0.28 -1.92 -0.13 0.00 0.04 0.00 0.00 34.50 32.21 1gyo s PRO 17 CO 0.35 -1.34 1.39 1.58 0.04 0.00 0.00 177.00 179.02 1gyo n HIS 18 N -2.01 2.31 0.37 0.56 -0.00 -1.26 -4.87 115.22 110.31 1gyo n HIS 18 Ca 0.13 0.45 0.13 0.00 0.46 0.00 0.00 57.72 58.89 1gyo n HIS 18 Cb 0.50 -2.46 0.54 0.00 -0.12 0.00 0.00 29.99 28.45 1gyo n HIS 18 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1gyo h PRO 19 N 3.67 0.00 0.00 1.57 0.13 -1.98 -3.16 132.00 132.23 1gyo h PRO 19 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1gyo h PRO 19 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1gyo h PRO 19 CO 0.71 0.00 -0.75 -2.13 -0.23 0.00 0.00 178.00 175.60 1gyo n ARG 20 N -2.42 2.04 -1.88 0.86 0.63 -1.26 -4.84 116.66 109.79 1gyo n ARG 20 Ca 0.02 0.00 -0.21 0.00 -0.92 0.00 0.00 57.85 56.74 1gyo n ARG 20 Cb 0.24 -0.88 0.04 0.00 0.45 0.00 0.00 32.46 32.32 1gyo n ARG 20 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1gyo n PHE 21 N -1.31 2.47 0.14 -0.14 3.01 -1.25 -4.91 117.46 115.47 1gyo n PHE 21 Ca 0.00 -2.15 0.10 0.00 1.01 0.00 0.00 57.45 56.41 1gyo n PHE 21 Cb 0.14 -0.33 0.06 0.00 -0.01 0.00 0.00 39.48 39.33 1gyo n PHE 21 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1gyo h GLY 22 N 2.06 0.00 -5.59 1.37 0.00 -1.87 -3.44 103.07 95.61 1gyo h GLY 22 Ca 0.33 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.44 1gyo h GLY 22 CO 0.68 0.00 -0.68 0.54 0.00 0.00 0.00 176.54 177.08 1gyo s LYS 23 N -3.24 0.03 -0.02 4.80 1.02 -1.26 -4.04 119.74 117.04 1gyo s LYS 23 Ca 0.02 0.06 0.01 0.00 0.02 0.00 0.00 55.97 56.08 1gyo s LYS 23 Cb 0.08 0.00 0.02 0.00 -0.52 0.00 0.00 37.83 37.40 1gyo s LYS 23 CO 0.75 -0.02 -0.01 0.08 -0.92 0.00 0.00 175.35 175.23 1gyo s VAL 24 N 0.09 0.23 0.10 3.17 1.01 -0.24 -4.79 120.40 119.97 1gyo s VAL 24 Ca -0.01 -0.01 -0.13 0.00 0.00 0.00 0.00 61.98 61.83 1gyo s VAL 24 Cb -0.01 -0.27 -0.06 0.00 0.00 0.00 0.00 36.38 36.04 1gyo s VAL 24 CO -0.00 0.12 0.49 -1.61 0.00 0.00 0.00 175.10 174.09 1gyo s GLU 25 N 0.59 3.91 -0.02 2.72 2.02 -1.26 -0.39 118.70 126.28 1gyo s GLU 25 Ca -0.06 0.39 0.02 0.00 0.02 0.00 0.00 54.97 55.34 1gyo s GLU 25 Cb -0.09 -3.00 0.01 0.00 0.10 0.00 0.00 34.13 31.14 1gyo s GLU 25 CO -0.01 0.54 -0.05 1.41 0.02 0.00 0.00 175.26 177.17 1gyo s MET 26 N -1.80 0.56 -0.30 1.61 1.75 -0.38 -4.92 119.30 115.81 1gyo s MET 26 Ca 0.34 -0.16 -0.12 0.00 -1.25 0.00 0.00 55.69 54.50 1gyo s MET 26 Cb -0.15 -0.56 -0.04 0.00 2.84 0.00 0.00 34.83 36.92 1gyo s MET 26 CO 0.18 0.05 0.22 0.45 -0.65 0.00 0.00 175.02 175.28 1gyo s SER 27 N 0.24 6.05 0.36 1.11 0.15 -1.26 -1.09 113.70 119.26 1gyo s SER 27 Ca -0.03 -0.11 0.07 0.00 0.70 0.00 0.00 55.95 56.58 1gyo s SER 27 Cb -0.07 -2.13 0.67 0.00 -1.71 0.00 0.00 66.02 62.78 1gyo s SER 27 CO -0.00 -0.12 1.88 0.45 1.20 0.00 0.00 173.24 176.64 1gyo h HIS 28 N 8.39 0.38 -0.39 3.44 3.86 -1.12 -2.79 115.15 126.92 1gyo h HIS 28 Ca -0.34 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 58.83 1gyo h HIS 28 Cb 1.18 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.52 1gyo h HIS 28 CO 0.73 0.46 0.26 0.00 0.86 0.00 0.00 177.93 180.24 1gyo h ALA 29 N 1.56 0.49 0.00 2.45 0.00 -1.86 -2.30 119.26 119.60 1gyo h ALA 29 Ca 0.07 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1gyo h ALA 29 Cb 0.40 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1gyo h ALA 29 CO 0.02 -0.05 -0.25 0.87 0.00 0.00 0.00 179.25 179.83 1gyo h LYS 30 N 0.52 0.00 -0.77 0.00 1.79 -1.85 -2.28 116.57 113.98 1gyo h LYS 30 Ca 0.14 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.52 1gyo h LYS 30 Cb -0.06 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.54 1gyo h LYS 30 CO -0.03 0.25 0.11 0.72 -1.08 0.00 0.00 179.45 179.42 1gyo n HIS 31 N -3.79 1.70 0.31 -1.35 8.25 -0.91 -4.62 115.22 114.82 1gyo n HIS 31 Ca -0.01 -0.75 0.19 0.00 -0.26 0.00 0.00 57.72 56.88 1gyo n HIS 31 Cb 0.35 -0.49 0.93 0.00 1.12 0.00 0.00 29.99 31.90 1gyo n HIS 31 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1gyo h ARG 32 N 2.42 0.00 -0.42 -0.41 0.11 -0.95 -1.02 114.38 114.10 1gyo h ARG 32 Ca 0.11 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.19 1gyo h ARG 32 Cb 1.77 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.85 1gyo h ARG 32 CO 0.47 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.63 1gyo n ASN 33 N -2.98 2.73 -4.52 0.08 3.02 -1.26 -4.83 115.26 107.50 1gyo n ASN 33 Ca -0.01 -1.94 -0.35 0.00 -0.03 0.00 0.00 54.58 52.25 1gyo n ASN 33 Cb 0.17 -0.28 -0.12 0.00 -0.61 0.00 0.00 39.78 38.94 1gyo n ASN 33 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1gyo s VAL 34 N -1.44 4.31 0.60 2.41 1.01 -0.39 -5.08 120.40 121.82 1gyo s VAL 34 Ca 0.36 -0.19 -0.20 0.00 0.00 0.00 0.00 61.98 61.95 1gyo s VAL 34 Cb 0.19 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 1gyo s VAL 34 CO 0.26 0.43 1.30 -0.94 0.00 0.00 0.00 175.10 176.15 1gyo s SER 35 N 0.83 4.98 0.22 3.32 1.04 -1.26 -4.90 113.70 117.92 1gyo s SER 35 Ca 0.02 2.64 -0.08 0.00 0.48 0.00 0.00 55.95 59.01 1gyo s SER 35 Cb -0.14 -2.62 0.31 0.00 0.10 0.00 0.00 66.02 63.67 1gyo s SER 35 CO 0.02 -1.76 1.77 0.00 0.98 0.00 0.00 173.24 174.25 1gyo h VAL 37 N 0.53 0.00 -0.04 0.00 3.04 -1.91 0.47 116.25 118.35 1gyo h VAL 37 Ca 0.33 -0.34 -0.01 0.00 -1.01 0.00 0.00 66.70 65.67 1gyo h VAL 37 Cb 0.36 1.19 -0.00 0.00 -2.01 0.00 0.00 31.29 30.82 1gyo h VAL 37 CO -0.28 0.00 -0.01 0.28 -1.01 0.00 0.00 177.57 176.56 1gyo h SER 38 N 0.00 0.05 0.00 3.17 0.02 -1.57 -3.08 113.55 112.14 1gyo h SER 38 Ca 0.00 -0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.75 1gyo h SER 38 Cb 0.42 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1gyo h SER 38 CO 0.00 0.07 -1.56 0.00 -1.14 0.00 0.00 176.83 174.20 1gyo n HIS 40 N -4.08 3.28 0.34 0.00 8.25 0.12 -4.76 115.22 118.37 1gyo n HIS 40 Ca -0.28 -2.99 0.13 0.00 -0.26 0.00 0.00 57.72 54.32 1gyo n HIS 40 Cb 0.62 -2.49 0.55 0.00 1.12 0.00 0.00 29.99 29.79 1gyo n HIS 40 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 1gyo h HIS 41 N 5.77 0.00 -0.01 4.41 2.07 -1.79 -0.94 115.15 124.66 1gyo h HIS 41 Ca 0.62 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.14 1gyo h HIS 41 Cb 0.57 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.55 1gyo h HIS 41 CO 1.53 0.00 -0.32 -1.33 -3.07 0.00 0.00 177.93 174.74 1gyo n MET 42 N -2.36 0.76 -2.60 5.12 2.81 -1.26 -4.90 117.12 114.69 1gyo n MET 42 Ca 0.01 -0.47 -0.42 0.00 -1.81 0.00 0.00 57.70 55.01 1gyo n MET 42 Cb 0.20 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.18 1gyo n MET 42 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 1gyo s PHE 43 N -2.56 3.61 -0.32 2.03 5.36 -0.36 -5.00 117.98 120.73 1gyo s PHE 43 Ca 0.22 1.58 -0.02 0.00 -0.96 0.00 0.00 56.93 57.76 1gyo s PHE 43 Cb 0.19 -3.22 0.12 0.00 -0.34 0.00 0.00 43.02 39.77 1gyo s PHE 43 CO 0.55 -0.43 0.16 0.16 -1.46 0.00 0.00 175.22 174.20 1gyo s ASP 44 N 0.74 3.41 0.00 6.13 -4.77 -1.26 -4.90 116.67 116.02 1gyo s ASP 44 Ca 0.53 -1.73 0.00 0.00 -3.30 0.00 0.00 52.55 48.05 1gyo s ASP 44 Cb -0.25 -0.47 0.00 0.00 -1.09 0.00 0.00 42.92 41.11 1gyo s ASP 44 CO 0.29 -0.38 0.00 0.61 0.70 0.00 0.00 175.17 176.39 1gyo n GLY 45 N 4.67 1.82 3.58 2.12 0.00 -1.26 -4.80 105.19 111.33 1gyo n GLY 45 Ca 0.02 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 1gyo n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gyo n GLY 47 N -0.36 0.21 3.58 0.00 0.00 -1.26 -5.04 105.19 102.32 1gyo n GLY 47 Ca -0.04 -2.07 -0.33 0.00 0.00 0.00 0.00 46.02 43.59 1gyo n GLY 47 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gyo s ASP 48 N -4.00 4.59 -0.93 1.61 1.01 -1.26 -5.06 116.67 112.62 1gyo s ASP 48 Ca 0.00 -0.11 -0.17 0.00 0.71 0.00 0.00 52.55 52.97 1gyo s ASP 48 Cb 0.00 -1.09 0.15 0.00 1.01 0.00 0.00 42.92 43.00 1gyo s ASP 48 CO 0.00 0.31 1.08 -0.36 0.21 0.00 0.00 175.17 176.41 1gyo s PHE 49 N -0.92 3.27 0.45 4.23 0.40 -1.26 -4.84 117.98 119.32 1gyo s PHE 49 Ca 0.15 -1.56 -0.21 0.00 -0.60 0.00 0.00 56.93 54.70 1gyo s PHE 49 Cb -0.11 -4.20 -0.09 0.00 0.51 0.00 0.00 43.02 39.13 1gyo s PHE 49 CO 0.05 -1.39 1.03 -0.65 0.70 0.00 0.00 175.22 174.97 1gyo s GLN 50 N 2.12 3.95 0.40 0.44 -0.21 -1.26 -5.00 119.66 120.10 1gyo s GLN 50 Ca 0.31 1.39 -0.27 0.00 0.02 0.00 0.00 55.36 56.81 1gyo s GLN 50 Cb -0.06 -2.24 -0.10 0.00 1.00 0.00 0.00 33.01 31.61 1gyo s GLN 50 CO -0.09 -0.31 1.43 0.15 -2.12 0.00 0.00 175.29 174.36 1gyo s LYS 51 N -2.99 3.96 0.22 2.91 1.02 -1.26 -4.89 119.74 118.72 1gyo s LYS 51 Ca 0.64 2.45 -0.09 0.00 0.02 0.00 0.00 55.97 58.99 1gyo s LYS 51 Cb -0.18 -2.84 0.22 0.00 -0.52 0.00 0.00 37.83 34.51 1gyo s LYS 51 CO 0.22 -0.60 1.86 0.00 -0.92 0.00 0.00 175.35 175.91 1gyo n ALA 53 N -2.33 2.22 0.27 0.00 0.00 -1.26 -0.72 120.51 118.69 1gyo n ALA 53 Ca 0.09 -0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.52 1gyo n ALA 53 Cb 0.08 -1.29 0.71 0.00 0.00 0.00 0.00 19.45 18.95 1gyo n ALA 53 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1gyo h ASP 54 N 0.00 0.00 0.00 0.00 5.19 -1.46 -3.34 116.42 116.81 1gyo h ASP 54 Ca 0.00 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.36 1gyo h ASP 54 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1gyo h ASP 54 CO 0.00 0.01 -1.17 0.00 -3.12 0.00 0.00 179.24 174.97 1gyo n HIS 56 N -2.72 3.91 -0.10 0.00 8.25 0.10 -4.64 115.22 120.03 1gyo n HIS 56 Ca -0.05 -2.97 -0.12 0.00 -0.26 0.00 0.00 57.72 54.31 1gyo n HIS 56 Cb 0.55 -2.33 -0.12 0.00 1.12 0.00 0.00 29.99 29.21 1gyo n HIS 56 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1gyo n ILE 57 N 4.78 1.23 -2.06 1.59 -5.35 -1.26 -3.63 119.36 114.67 1gyo n ILE 57 Ca 0.45 -0.61 -0.42 0.00 -0.27 0.00 0.00 62.75 61.90 1gyo n ILE 57 Cb 0.41 -0.91 -0.03 0.00 -1.74 0.00 0.00 39.64 37.37 1gyo n ILE 57 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1gyo s ASP 58 N -5.64 6.71 -0.06 7.28 2.15 -1.26 -4.60 116.67 121.26 1gyo s ASP 58 Ca -0.19 2.53 0.08 0.00 0.43 0.00 0.00 52.55 55.40 1gyo s ASP 58 Cb 0.06 -2.60 0.13 0.00 -0.30 0.00 0.00 42.92 40.21 1gyo s ASP 58 CO 0.61 -0.70 1.04 0.54 -0.17 0.00 0.00 175.17 176.50 1gyo n ARG 59 N 3.23 2.00 0.21 4.34 1.74 -1.26 -1.11 116.66 125.81 1gyo n ARG 59 Ca 0.10 -1.91 0.07 0.00 -0.77 0.00 0.00 57.85 55.34 1gyo n ARG 59 Cb 0.41 -1.18 0.43 0.00 -1.02 0.00 0.00 32.46 31.10 1gyo n ARG 59 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1gyo h ASP 60 N 0.00 0.00 -4.47 0.55 3.32 -2.03 -3.45 116.42 110.33 1gyo h ASP 60 Ca 0.00 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.66 1gyo h ASP 60 Cb 0.78 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.23 1gyo h ASP 60 CO 0.00 0.31 -0.33 -0.90 -1.72 0.00 0.00 179.24 176.60 1gyo n ASP 61 N -3.62 -0.99 -0.59 6.45 5.68 -1.26 -5.06 116.55 117.15 1gyo n ASP 61 Ca -0.01 -3.05 0.06 0.00 -0.50 0.00 0.00 54.79 51.29 1gyo n ASP 61 Cb 0.43 2.05 0.20 0.00 -1.14 0.00 0.00 41.12 42.65 1gyo n ASP 61 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1gyo n ARG 62 N -0.61 1.86 -0.02 0.11 1.74 -1.26 -4.68 116.66 113.81 1gyo n ARG 62 Ca 0.05 -2.90 -0.02 0.00 -0.77 0.00 0.00 57.85 54.20 1gyo n ARG 62 Cb 0.59 -1.67 -0.02 0.00 -1.02 0.00 0.00 32.46 30.34 1gyo n ARG 62 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1gyo n SER 63 N -1.08 3.88 -4.69 0.55 7.64 -1.26 -4.61 113.62 114.06 1gyo n SER 63 Ca 0.21 -0.01 -0.42 0.00 1.01 0.00 0.00 58.87 59.66 1gyo n SER 63 Cb 0.79 0.16 -0.03 0.00 -1.01 0.00 0.00 64.21 64.12 1gyo n SER 63 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1gyo s TYR 64 N -2.08 2.10 0.46 1.43 5.04 -1.26 -4.86 117.35 118.19 1gyo s TYR 64 Ca -0.04 0.03 0.30 0.00 -2.44 0.00 0.00 57.07 54.92 1gyo s TYR 64 Cb 0.01 -4.11 1.62 0.00 0.35 0.00 0.00 41.96 39.83 1gyo s TYR 64 CO 0.10 -4.63 2.14 0.93 -1.34 0.00 0.00 175.55 172.76 1gyo h GLU 65 N 8.82 0.00 -0.26 4.97 3.07 -1.98 -0.86 114.58 128.34 1gyo h GLU 65 Ca -0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 1gyo h GLU 65 Cb 1.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1gyo h GLU 65 CO 0.94 0.08 0.00 0.54 -1.40 0.00 0.00 179.01 179.17 1gyo n ARG 66 N -3.61 2.08 -2.44 2.33 1.74 -1.26 -4.70 116.66 110.80 1gyo n ARG 66 Ca -0.02 -1.63 -0.21 0.00 -0.77 0.00 0.00 57.85 55.22 1gyo n ARG 66 Cb 0.19 -1.44 0.11 0.00 -1.02 0.00 0.00 32.46 30.29 1gyo n ARG 66 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gyo n GLY 67 N 1.30 0.75 0.15 -0.13 0.00 -0.33 -3.92 105.19 103.00 1gyo n GLY 67 Ca 0.17 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 1gyo n GLY 67 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1gyo h PHE 68 N -0.54 -0.25 -0.84 1.61 3.57 -1.18 -3.22 116.94 116.09 1gyo h PHE 68 Ca -0.30 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.22 1gyo h PHE 68 Cb 1.13 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.90 1gyo h PHE 68 CO 0.00 0.11 0.55 -0.92 -2.23 0.00 0.00 178.31 175.81 1gyo h TYR 69 N -0.65 1.03 0.00 0.41 3.20 -1.84 -2.13 116.97 117.00 1gyo h TYR 69 Ca -0.03 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1gyo h TYR 69 Cb 0.47 -0.35 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 1gyo h TYR 69 CO 0.04 0.62 -0.05 0.87 -1.64 0.00 0.00 178.16 178.01 1gyo h LYS 70 N 1.09 0.00 -0.37 1.82 1.79 -1.79 -1.90 116.57 117.21 1gyo h LYS 70 Ca 0.32 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.80 1gyo h LYS 70 Cb -0.06 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.57 1gyo h LYS 70 CO -0.09 0.05 0.25 0.00 -1.08 0.00 0.00 179.45 178.57 1gyo h ALA 71 N 1.95 1.74 0.00 3.86 0.00 -1.39 -2.98 119.26 122.44 1gyo h ALA 71 Ca -0.00 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1gyo h ALA 71 Cb 0.42 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1gyo h ALA 71 CO 0.01 0.24 -1.83 0.91 0.00 0.00 0.00 179.25 178.58 1gyo n TRP 72 N -4.48 0.00 -0.24 0.00 7.02 -0.94 -4.07 117.44 114.73 1gyo n TRP 72 Ca 0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.51 1gyo n TRP 72 Cb 0.06 -0.48 0.00 0.00 -2.42 0.00 0.00 31.31 28.48 1gyo n TRP 72 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 1gyo n HIS 73 N -2.21 0.00 -0.62 -5.99 8.25 -0.76 -1.51 115.22 112.38 1gyo n HIS 73 Ca -0.09 -0.05 -0.28 0.00 -0.26 0.00 0.00 57.72 57.03 1gyo n HIS 73 Cb 0.59 -0.01 0.25 0.00 1.12 0.00 0.00 29.99 31.94 1gyo n HIS 73 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1gyo s SER 74 N -0.10 1.07 0.55 0.41 0.15 -1.13 -4.53 113.70 110.12 1gyo s SER 74 Ca 0.00 1.45 0.25 0.00 0.70 0.00 0.00 55.95 58.35 1gyo s SER 74 Cb 0.00 -2.23 1.59 0.00 -1.71 0.00 0.00 66.02 63.67 1gyo s SER 74 CO 0.00 -4.13 2.19 -0.08 1.20 0.00 0.00 173.24 172.41 1gyo h GLU 75 N -2.58 0.00 -6.57 5.44 4.57 -1.94 -3.03 114.58 110.47 1gyo h GLU 75 Ca -0.61 0.00 -0.59 0.00 -1.18 0.00 0.00 59.36 56.98 1gyo h GLU 75 Cb 1.34 0.00 0.09 0.00 -0.16 0.00 0.00 28.75 30.01 1gyo h GLU 75 CO 0.52 0.04 0.55 0.45 -1.18 0.00 0.00 179.01 179.38 1gyo n SER 76 N -3.99 2.54 0.00 1.04 2.88 -1.26 -4.77 113.62 110.07 1gyo n SER 76 Ca -0.03 1.15 0.11 0.00 -1.33 0.00 0.00 58.87 58.77 1gyo n SER 76 Cb 0.12 -1.40 0.66 0.00 -0.75 0.00 0.00 64.21 62.84 1gyo n SER 76 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1gyo n GLU 77 N 1.84 0.76 0.16 -1.46 1.02 -1.26 -1.74 120.64 119.96 1gyo n GLU 77 Ca 0.11 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.29 1gyo n GLU 77 Cb 0.31 -1.46 0.20 0.00 -0.02 0.00 0.00 31.44 30.47 1gyo n GLU 77 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1gyo h ILE 78 N 0.00 0.92 -3.97 -3.67 2.04 -1.89 -3.34 117.51 107.60 1gyo h ILE 78 Ca 0.00 -1.89 -0.49 0.00 1.00 0.00 0.00 64.86 63.49 1gyo h ILE 78 Cb 0.00 2.16 0.02 0.00 -0.74 0.00 0.00 36.82 38.26 1gyo h ILE 78 CO 0.00 0.45 0.26 -0.94 0.00 0.00 0.00 178.15 177.92 1gyo s SER 79 N -6.46 6.49 0.13 1.72 1.04 -0.71 -4.69 113.70 111.22 1gyo s SER 79 Ca 0.02 1.32 -0.28 0.00 0.48 0.00 0.00 55.95 57.48 1gyo s SER 79 Cb 0.10 -2.41 -0.06 0.00 0.10 0.00 0.00 66.02 63.75 1gyo s SER 79 CO 0.71 -0.56 1.61 0.00 0.98 0.00 0.00 173.24 175.98 1gyo h ARG 81 N -0.49 0.28 -0.47 0.00 2.43 -1.57 -2.60 114.38 111.96 1gyo h ARG 81 Ca 0.06 -0.28 -0.06 0.00 -0.81 0.00 0.00 59.98 58.89 1gyo h ARG 81 Cb 0.59 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 1gyo h ARG 81 CO -0.29 0.97 0.05 0.78 -1.51 0.00 0.00 179.97 179.97 1gyo h GLY 82 N 1.58 0.85 0.84 2.80 0.00 -1.38 0.18 103.07 107.95 1gyo h GLY 82 Ca -0.05 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.67 1gyo h GLY 82 CO 0.14 0.55 0.04 0.00 0.00 0.00 0.00 176.54 177.26 1gyo h HIS 84 N 0.13 0.97 -0.72 0.00 -0.00 -1.35 0.07 115.15 114.24 1gyo h HIS 84 Ca 0.06 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.40 1gyo h HIS 84 Cb 0.30 -0.32 -0.03 0.00 -0.00 0.00 0.00 27.41 27.35 1gyo h HIS 84 CO 0.02 0.62 0.26 0.87 -0.00 0.00 0.00 177.93 179.70 1gyo h LYS 85 N 1.03 1.09 -0.65 2.45 1.57 -0.91 -0.47 116.57 120.69 1gyo h LYS 85 Ca 0.28 -0.21 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1gyo h LYS 85 Cb -0.10 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.02 1gyo h LYS 85 CO -0.06 0.91 0.07 0.00 -0.57 0.00 0.00 179.45 179.81 1gyo h ALA 86 N 1.13 0.90 -0.35 3.86 0.00 -0.68 -1.45 119.26 122.68 1gyo h ALA 86 Ca 0.24 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1gyo h ALA 86 Cb 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1gyo h ALA 86 CO -0.01 0.67 -0.14 0.52 0.00 0.00 0.00 179.25 180.28 1gyo h MET 87 N 1.01 0.71 -0.84 0.00 2.86 -0.78 -2.78 114.93 115.10 1gyo h MET 87 Ca 0.19 -0.30 0.03 0.00 -2.06 0.00 0.00 59.70 57.56 1gyo h MET 87 Cb 0.48 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.07 1gyo h MET 87 CO 0.02 0.89 0.55 -0.22 1.06 0.00 0.00 176.91 179.22 1gyo h LYS 88 N 0.49 1.04 0.00 1.72 3.64 -0.91 -1.13 116.57 121.42 1gyo h LYS 88 Ca 0.08 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 1gyo h LYS 88 Cb 0.66 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1gyo h LYS 88 CO 0.04 0.69 -0.13 0.00 -2.27 0.00 0.00 179.45 177.78 1gyo h ALA 89 N 1.50 1.44 -0.38 5.00 0.00 -1.05 -0.93 119.26 124.84 1gyo h ALA 89 Ca 0.33 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1gyo h ALA 89 Cb -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1gyo h ALA 89 CO -0.09 0.16 0.00 1.63 0.00 0.00 0.00 179.25 180.95 1gyo n LYS 90 N -3.88 2.13 -3.51 0.00 5.02 -0.53 -4.94 118.16 112.44 1gyo n LYS 90 Ca -0.02 -1.73 -0.24 0.00 -2.02 0.00 0.00 58.31 54.29 1gyo n LYS 90 Cb 0.23 -1.43 0.07 0.00 -0.02 0.00 0.00 35.03 33.88 1gyo n LYS 90 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1gyo n ASN 91 N 0.92 -6.22 -4.68 4.39 5.03 -0.35 -5.00 115.26 109.35 1gyo n ASN 91 Ca 0.17 -0.51 -0.35 0.00 0.87 0.00 0.00 54.58 54.76 1gyo n ASN 91 Cb 0.45 -4.92 -0.09 0.00 -1.02 0.00 0.00 39.78 34.19 1gyo n ASN 91 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1gyo s GLU 92 N -6.23 3.16 0.10 3.52 2.02 -0.57 -5.02 118.70 115.68 1gyo s GLU 92 Ca 0.54 -0.38 -0.35 0.00 0.02 0.00 0.00 54.97 54.80 1gyo s GLU 92 Cb -0.24 -2.87 -0.15 0.00 0.10 0.00 0.00 34.13 30.96 1gyo s GLU 92 CO 0.67 0.64 1.51 0.94 0.02 0.00 0.00 175.26 179.04 1gyo n GLN 93 N 2.34 1.74 -1.74 1.61 7.27 -1.26 -4.18 117.38 123.17 1gyo n GLN 93 Ca -0.18 0.63 -0.02 0.00 0.07 0.00 0.00 57.00 57.49 1gyo n GLN 93 Cb 0.54 -2.35 0.01 0.00 2.41 0.00 0.00 30.24 30.84 1gyo n GLN 93 CO 0.00 0.00 0.00 -2.37 0.07 0.00 0.00 177.06 174.76 1gyo n THR 94 N 3.21 0.00 -2.44 1.69 5.66 -1.26 -4.99 114.28 116.16 1gyo n THR 94 Ca 0.18 -0.26 -0.22 0.00 -3.05 0.00 0.00 64.05 60.70 1gyo n THR 94 Cb 0.25 0.26 0.12 0.00 -1.55 0.00 0.00 70.33 69.41 1gyo n THR 94 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1gyo n GLY 95 N -0.14 0.26 3.81 1.09 0.00 -1.26 -5.07 105.19 103.88 1gyo n GLY 95 Ca -0.02 -1.96 -0.32 0.00 0.00 0.00 0.00 46.02 43.71 1gyo n GLY 95 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gyo s PRO 96 N -5.00 3.31 0.00 1.61 0.04 -1.26 -4.85 135.00 128.85 1gyo s PRO 96 Ca 0.62 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.76 1gyo s PRO 96 Cb -0.03 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1gyo s PRO 96 CO 0.41 -0.81 0.00 -0.89 0.04 0.00 0.00 177.00 175.75 1gyo n ILE 97 N -2.25 0.00 -1.89 0.56 5.41 -1.26 -4.83 119.36 115.09 1gyo n ILE 97 Ca 0.08 0.00 -0.36 0.00 1.00 0.00 0.00 62.75 63.47 1gyo n ILE 97 Cb 0.53 -0.48 0.05 0.00 -0.71 0.00 0.00 39.64 39.03 1gyo n ILE 97 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1gyo s GLY 98 N -3.62 2.71 0.47 7.39 0.00 -1.26 -4.89 107.32 108.12 1gyo s GLY 98 Ca 0.00 1.03 0.17 0.00 0.00 0.00 0.00 44.72 45.92 1gyo s GLY 98 CO 0.00 1.43 2.03 0.00 0.00 0.00 0.00 173.10 176.56 1gyo n LEU 100 N -4.22 3.52 -4.58 0.00 4.77 -1.26 -4.31 117.00 110.92 1gyo n LEU 100 Ca -0.02 -2.48 -0.39 0.00 -0.03 0.00 0.00 56.01 53.09 1gyo n LEU 100 Cb 0.22 -0.40 -0.10 0.00 -2.33 0.00 0.00 43.42 40.81 1gyo n LEU 100 CO 0.35 0.71 -0.11 -1.10 -1.33 0.00 0.00 177.39 175.91 1gyo s GLN 101 N -1.87 3.85 0.00 3.23 -0.21 -0.67 -4.29 119.66 119.70 1gyo s GLN 101 Ca 0.34 -0.33 0.00 0.00 0.02 0.00 0.00 55.36 55.39 1gyo s GLN 101 Cb 0.24 -3.70 0.00 0.00 1.00 0.00 0.00 33.01 30.55 1gyo s GLN 101 CO 0.14 -0.27 0.00 0.41 -2.12 0.00 0.00 175.29 173.45 1gyo n GLY 102 N 5.00 2.29 0.16 3.09 0.00 -1.26 -4.36 105.19 110.11 1gyo n GLY 102 Ca -0.13 0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.79 1gyo n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gyo n HIS 104 N -5.20 3.09 -4.17 0.00 8.25 -1.26 -4.44 115.22 111.48 1gyo n HIS 104 Ca -0.09 -2.61 -0.13 0.00 -0.26 0.00 0.00 57.72 54.63 1gyo n HIS 104 Cb 0.18 -1.17 -0.10 0.00 1.12 0.00 0.00 29.99 30.01 1gyo n HIS 104 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 1gyo s GLU 105 N -3.94 0.85 0.00 -0.41 2.12 -1.10 -4.70 118.70 111.51 1gyo s GLU 105 Ca 0.56 -1.22 0.02 0.00 0.36 0.00 0.00 54.97 54.69 1gyo s GLU 105 Cb 0.46 -0.43 0.10 0.00 0.26 0.00 0.00 34.13 34.52 1gyo s GLU 105 CO -0.25 0.05 0.59 0.00 -0.54 0.00 0.00 175.26 175.10