#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g91 n ASP 2 N 0.00 0.00 -4.71 7.83 8.00 -1.26 -4.66 116.55 121.76 1g91 n ASP 2 Ca 0.00 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.19 1g91 n ASP 2 Cb 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.24 1g91 n ASP 2 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1g91 s ARG 3 N 0.00 1.41 -0.09 -1.24 3.03 -1.26 -4.99 118.95 115.81 1g91 s ARG 3 Ca 0.00 1.22 -0.17 0.00 2.03 0.00 0.00 55.73 58.81 1g91 s ARG 3 Cb 0.00 -1.80 -0.05 0.00 -1.03 0.00 0.00 34.95 32.08 1g91 s ARG 3 CO 0.00 -2.25 0.44 0.12 -1.13 0.00 0.00 175.30 172.48 1g91 s PHE 4 N -2.79 3.56 -0.40 5.89 2.19 -1.26 -5.04 117.98 120.13 1g91 s PHE 4 Ca 0.64 0.89 0.03 0.00 0.33 0.00 0.00 56.93 58.82 1g91 s PHE 4 Cb -0.20 -2.47 0.11 0.00 -1.31 0.00 0.00 43.02 39.15 1g91 s PHE 4 CO 0.57 0.29 0.14 -1.58 1.83 0.00 0.00 175.22 176.48 1g91 s HIS 5 N 0.19 3.14 -0.06 10.12 2.46 -1.26 -5.07 115.29 124.80 1g91 s HIS 5 Ca 0.24 -2.85 -0.03 0.00 0.47 0.00 0.00 55.06 52.90 1g91 s HIS 5 Cb -0.15 -2.64 0.03 0.00 -0.13 0.00 0.00 32.58 29.69 1g91 s HIS 5 CO 0.10 -0.86 0.14 0.00 -2.47 0.00 0.00 174.74 171.66 1g91 s ALA 6 N 0.54 -0.27 -0.07 1.58 0.00 -1.26 -5.14 121.76 117.15 1g91 s ALA 6 Ca 0.13 0.59 0.01 0.00 0.00 0.00 0.00 51.96 52.69 1g91 s ALA 6 Cb -0.22 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.54 1g91 s ALA 6 CO -0.07 -0.13 -0.09 -0.08 0.00 0.00 0.00 175.76 175.40 1g91 s THR 7 N 0.87 0.92 -0.45 0.00 -1.32 -1.26 -5.10 115.64 109.30 1g91 s THR 7 Ca -0.07 -0.33 -0.16 0.00 -1.21 0.00 0.00 61.69 59.93 1g91 s THR 7 Cb -0.09 -0.88 0.05 0.00 -1.51 0.00 0.00 72.50 70.07 1g91 s THR 7 CO -0.04 0.32 0.39 -0.94 -2.21 0.00 0.00 174.62 172.13 1g91 s SER 8 N 0.93 6.15 0.08 8.08 1.04 -1.26 -5.05 113.70 123.66 1g91 s SER 8 Ca -0.10 -1.07 -0.30 0.00 0.48 0.00 0.00 55.95 54.95 1g91 s SER 8 Cb -0.15 -2.19 -0.05 0.00 0.10 0.00 0.00 66.02 63.73 1g91 s SER 8 CO 0.01 -0.59 0.99 0.00 0.98 0.00 0.00 173.24 174.63 1g91 s ALA 9 N 1.79 3.23 0.00 5.32 0.00 -1.26 -4.90 121.76 125.94 1g91 s ALA 9 Ca 0.06 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.62 1g91 s ALA 9 Cb -0.21 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1g91 s ALA 9 CO 0.09 -0.13 0.00 -0.25 0.00 0.00 0.00 175.76 175.47 1g91 n ASP 10 N 3.18 0.21 -4.80 0.00 8.00 -1.26 -5.05 116.55 116.83 1g91 n ASP 10 Ca 0.04 -0.36 -0.33 0.00 0.71 0.00 0.00 54.79 54.85 1g91 n ASP 10 Cb 0.49 0.76 0.02 0.00 -0.02 0.00 0.00 41.12 42.37 1g91 n ASP 10 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1g91 n ILE 13 N 1.77 0.45 -3.91 0.00 5.41 -1.26 -4.74 119.36 117.08 1g91 n ILE 13 Ca -0.18 -0.17 -0.17 0.00 1.00 0.00 0.00 62.75 63.24 1g91 n ILE 13 Cb 0.54 -0.81 -0.16 0.00 -0.71 0.00 0.00 39.64 38.50 1g91 n ILE 13 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1g91 s SER 14 N -4.81 0.37 0.45 4.38 1.04 -1.26 -5.13 113.70 108.74 1g91 s SER 14 Ca -0.11 -0.02 -0.17 0.00 0.48 0.00 0.00 55.95 56.14 1g91 s SER 14 Cb 0.03 -0.20 -0.09 0.00 0.10 0.00 0.00 66.02 65.86 1g91 s SER 14 CO 0.18 -0.10 0.91 -0.31 0.98 0.00 0.00 173.24 174.90 1g91 s TYR 15 N 1.02 3.40 -0.06 5.02 1.51 -1.26 -4.54 117.35 122.43 1g91 s TYR 15 Ca -0.10 1.42 -0.30 0.00 -1.01 0.00 0.00 57.07 57.09 1g91 s TYR 15 Cb -0.13 -2.73 -0.05 0.00 -0.11 0.00 0.00 41.96 38.94 1g91 s TYR 15 CO -0.02 -0.19 1.50 -0.08 -1.11 0.00 0.00 175.55 175.65 1g91 s THR 16 N -2.36 3.75 -1.46 -0.71 -1.32 -1.04 -4.88 115.64 107.62 1g91 s THR 16 Ca 0.58 0.99 -0.10 0.00 -1.21 0.00 0.00 61.69 61.95 1g91 s THR 16 Cb -0.10 -3.64 -0.07 0.00 -1.51 0.00 0.00 72.50 67.19 1g91 s THR 16 CO 0.23 -0.06 2.70 -0.81 -2.21 0.00 0.00 174.62 174.48 1g91 n PRO 17 N 6.49 3.26 -3.51 7.08 -0.04 -1.26 -4.82 135.00 142.20 1g91 n PRO 17 Ca 0.15 -2.11 -0.14 0.00 -0.04 0.00 0.00 63.50 61.36 1g91 n PRO 17 Cb 0.43 -2.80 -0.04 0.00 -0.04 0.00 0.00 33.50 31.05 1g91 n PRO 17 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1g91 s ARG 18 N 2.59 1.13 -0.35 0.54 0.52 -1.26 -5.12 118.95 117.00 1g91 s ARG 18 Ca 0.62 -0.23 -0.29 0.00 -0.52 0.00 0.00 55.73 55.31 1g91 s ARG 18 Cb 0.16 0.52 0.02 0.00 0.52 0.00 0.00 34.95 36.17 1g91 s ARG 18 CO -0.05 -0.43 1.06 -1.54 0.02 0.00 0.00 175.30 174.36 1g91 s SER 19 N -2.11 6.86 -0.19 0.23 1.04 -1.26 -5.00 113.70 113.27 1g91 s SER 19 Ca -0.04 0.91 -0.19 0.00 0.48 0.00 0.00 55.95 57.11 1g91 s SER 19 Cb -0.00 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.55 1g91 s SER 19 CO -0.04 -0.93 0.54 -0.63 0.98 0.00 0.00 173.24 173.17 1g91 s ILE 20 N 3.74 5.09 0.24 -1.02 -1.09 -1.26 -5.04 121.20 121.85 1g91 s ILE 20 Ca 0.45 1.02 -0.30 0.00 -2.23 0.00 0.00 60.65 59.59 1g91 s ILE 20 Cb -0.11 -3.87 -0.09 0.00 -1.58 0.00 0.00 42.46 36.81 1g91 s ILE 20 CO 0.18 0.18 0.98 -2.16 -1.23 0.00 0.00 174.94 172.89 1g91 s PRO 21 N 1.56 4.79 0.37 2.79 0.04 -1.26 -4.95 135.00 138.34 1g91 s PRO 21 Ca 0.26 1.56 0.16 0.00 0.04 0.00 0.00 61.00 63.02 1g91 s PRO 21 Cb -0.16 -3.27 0.73 0.00 0.04 0.00 0.00 34.50 31.85 1g91 s PRO 21 CO 0.10 0.41 1.79 0.00 0.04 0.00 0.00 177.00 179.34 1g91 n SER 23 N -3.84 0.31 -1.45 0.00 2.88 -1.26 -2.20 113.62 108.05 1g91 n SER 23 Ca -0.01 0.58 -0.10 0.00 -1.33 0.00 0.00 58.87 58.01 1g91 n SER 23 Cb 0.45 -0.65 0.19 0.00 -0.75 0.00 0.00 64.21 63.45 1g91 n SER 23 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1g91 n LEU 24 N -1.85 4.81 -4.09 2.46 7.94 -0.78 -4.96 117.00 120.53 1g91 n LEU 24 Ca 0.03 -3.80 -0.22 0.00 -1.11 0.00 0.00 56.01 50.90 1g91 n LEU 24 Cb 0.19 -0.68 -0.15 0.00 0.53 0.00 0.00 43.42 43.30 1g91 n LEU 24 CO 0.16 1.26 -0.47 -0.76 -1.11 0.00 0.00 177.39 176.47 1g91 s LEU 25 N -3.29 1.97 -0.10 -1.96 1.43 -0.93 -4.08 118.68 111.71 1g91 s LEU 25 Ca 0.48 -0.25 0.18 0.00 -1.03 0.00 0.00 54.13 53.50 1g91 s LEU 25 Cb 0.43 -0.72 -0.26 0.00 0.03 0.00 0.00 46.19 45.66 1g91 s LEU 25 CO 0.02 0.15 0.25 1.21 0.23 0.00 0.00 176.35 178.21 1g91 n GLU 26 N 2.88 0.82 -3.79 1.70 0.00 0.11 -4.64 120.64 117.72 1g91 n GLU 26 Ca -0.15 -0.10 0.04 0.00 0.00 0.00 0.00 57.16 56.96 1g91 n GLU 26 Cb 0.55 -1.46 0.00 0.00 0.00 0.00 0.00 31.44 30.53 1g91 n GLU 26 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1g91 s SER 27 N -4.70 -0.00 0.13 4.31 0.15 -1.22 -5.00 113.70 107.38 1g91 s SER 27 Ca -0.08 -0.00 -0.20 0.00 0.70 0.00 0.00 55.95 56.37 1g91 s SER 27 Cb 0.09 0.00 0.05 0.00 -1.71 0.00 0.00 66.02 64.45 1g91 s SER 27 CO 0.77 -0.00 0.51 -0.72 1.20 0.00 0.00 173.24 174.99 1g91 s TYR 28 N -2.00 -0.39 0.26 3.44 1.13 -1.26 -0.71 117.35 117.82 1g91 s TYR 28 Ca 0.24 0.16 -0.04 0.00 -1.41 0.00 0.00 57.07 56.01 1g91 s TYR 28 Cb 0.04 0.41 -0.02 0.00 -1.10 0.00 0.00 41.96 41.29 1g91 s TYR 28 CO -0.05 -0.76 0.33 -0.59 -2.51 0.00 0.00 175.55 171.97 1g91 s PHE 29 N -3.63 0.94 -0.09 -3.49 -0.71 -0.89 -4.99 117.98 105.13 1g91 s PHE 29 Ca 0.01 -1.18 -0.11 0.00 -1.04 0.00 0.00 56.93 54.62 1g91 s PHE 29 Cb 0.00 -0.23 -0.05 0.00 -1.21 0.00 0.00 43.02 41.54 1g91 s PHE 29 CO -0.11 -0.89 0.25 -1.21 -1.34 0.00 0.00 175.22 171.92 1g91 s GLU 30 N -3.80 3.74 0.69 1.99 2.02 -1.26 -1.40 118.70 120.68 1g91 s GLU 30 Ca 0.32 0.09 -0.12 0.00 0.02 0.00 0.00 54.97 55.28 1g91 s GLU 30 Cb 0.02 -3.24 0.17 0.00 0.10 0.00 0.00 34.13 31.18 1g91 s GLU 30 CO 0.14 0.66 0.67 0.25 0.02 0.00 0.00 175.26 177.01 1g91 n THR 31 N 2.19 0.00 -2.19 3.63 -2.24 -0.11 -4.89 114.28 110.67 1g91 n THR 31 Ca -0.17 -0.35 -0.43 0.00 -2.27 0.00 0.00 64.05 60.83 1g91 n THR 31 Cb 0.54 -1.27 -0.02 0.00 -2.10 0.00 0.00 70.33 67.47 1g91 n THR 31 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1g91 s ASN 32 N -3.38 6.18 0.02 3.42 3.04 -1.26 -4.83 114.94 118.13 1g91 s ASN 32 Ca 0.42 1.12 0.12 0.00 0.04 0.00 0.00 52.86 54.56 1g91 s ASN 32 Cb -0.03 -2.53 0.50 0.00 -1.54 0.00 0.00 41.25 37.65 1g91 s ASN 32 CO 0.32 -1.51 1.37 -0.24 -3.04 0.00 0.00 177.10 174.00 1g91 n SER 33 N 9.30 0.04 0.22 -4.21 2.88 -1.26 -2.01 113.62 118.59 1g91 n SER 33 Ca 0.19 0.51 0.09 0.00 -1.33 0.00 0.00 58.87 58.34 1g91 n SER 33 Cb 0.47 -0.52 0.48 0.00 -0.75 0.00 0.00 64.21 63.89 1g91 n SER 33 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1g91 h GLU 34 N 0.00 0.00 -7.37 -1.46 3.07 -2.00 -3.44 114.58 103.38 1g91 h GLU 34 Ca 0.00 0.00 -0.47 0.00 -0.50 0.00 0.00 59.36 58.39 1g91 h GLU 34 Cb 0.19 0.00 0.15 0.00 -0.84 0.00 0.00 28.75 28.25 1g91 h GLU 34 CO 0.00 0.24 0.24 0.00 -1.40 0.00 0.00 179.01 178.09 1g91 h SER 36 N -1.65 0.00 -3.96 0.00 0.02 -1.89 -3.38 113.55 102.70 1g91 h SER 36 Ca -0.51 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 59.80 1g91 h SER 36 Cb 1.31 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 63.43 1g91 h SER 36 CO 0.57 0.47 -0.62 -0.54 -1.14 0.00 0.00 176.83 175.57 1g91 s LYS 37 N -2.98 2.11 0.83 3.45 -0.14 -1.26 -5.09 119.74 116.66 1g91 s LYS 37 Ca 0.04 -2.84 -0.12 0.00 -1.36 0.00 0.00 55.97 51.69 1g91 s LYS 37 Cb 0.07 -3.32 0.09 0.00 -1.68 0.00 0.00 37.83 32.99 1g91 s LYS 37 CO 0.74 -1.17 1.15 -1.25 -0.76 0.00 0.00 175.35 174.06 1g91 s PRO 38 N -0.64 1.81 0.00 -1.68 0.04 -1.26 -3.76 135.00 129.51 1g91 s PRO 38 Ca 0.20 0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.49 1g91 s PRO 38 Cb -0.19 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1g91 s PRO 38 CO -0.05 -1.73 0.00 0.41 0.04 0.00 0.00 177.00 175.67 1g91 n GLY 39 N -2.82 -0.05 3.62 0.56 0.00 -1.26 -4.89 105.19 100.34 1g91 n GLY 39 Ca 0.07 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 1g91 n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g91 s VAL 40 N -2.00 4.01 -0.22 1.61 1.01 -0.98 -0.94 120.40 122.88 1g91 s VAL 40 Ca 0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 61.98 61.53 1g91 s VAL 40 Cb 0.00 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 1g91 s VAL 40 CO 0.00 0.60 0.11 -0.63 0.00 0.00 0.00 175.10 175.17 1g91 s ILE 41 N -0.77 4.90 -0.19 2.22 1.01 -0.49 0.16 121.20 128.04 1g91 s ILE 41 Ca 0.12 0.02 -0.09 0.00 0.00 0.00 0.00 60.65 60.69 1g91 s ILE 41 Cb -0.11 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.05 1g91 s ILE 41 CO 0.02 0.38 0.11 -0.36 0.00 0.00 0.00 174.94 175.09 1g91 s PHE 42 N 0.99 3.36 0.01 3.97 0.40 -0.61 -2.09 117.98 124.02 1g91 s PHE 42 Ca 0.05 0.25 -0.00 0.00 -0.60 0.00 0.00 56.93 56.64 1g91 s PHE 42 Cb -0.14 -2.14 -0.04 0.00 0.51 0.00 0.00 43.02 41.22 1g91 s PHE 42 CO 0.03 0.25 0.10 -1.17 0.70 0.00 0.00 175.22 175.13 1g91 s LEU 43 N 0.37 3.96 0.47 -0.37 2.96 0.11 -2.21 118.68 123.97 1g91 s LEU 43 Ca 0.07 0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 1g91 s LEU 43 Cb -0.11 -2.39 0.01 0.00 0.50 0.00 0.00 46.19 44.20 1g91 s LEU 43 CO -0.01 0.25 0.68 0.42 -1.32 0.00 0.00 176.35 176.36 1g91 s THR 44 N -1.26 3.51 -1.40 3.68 -4.23 -0.31 -0.71 115.64 114.93 1g91 s THR 44 Ca 0.25 -0.63 0.25 0.00 -1.18 0.00 0.00 61.69 60.39 1g91 s THR 44 Cb -0.12 -3.29 0.42 0.00 1.34 0.00 0.00 72.50 70.85 1g91 s THR 44 CO 0.17 -0.19 1.84 1.17 -0.54 0.00 0.00 174.62 177.06 1g91 n LYS 45 N -2.11 0.33 -0.00 3.99 4.81 -1.26 -4.01 118.16 119.91 1g91 n LYS 45 Ca 0.04 0.05 -0.00 0.00 -0.87 0.00 0.00 58.31 57.53 1g91 n LYS 45 Cb 0.58 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 34.13 1g91 n LYS 45 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1g91 n LYS 46 N -1.30 0.01 0.00 1.64 4.76 -1.26 -5.01 118.16 117.01 1g91 n LYS 46 Ca 0.11 0.20 0.00 0.00 -2.87 0.00 0.00 58.31 55.76 1g91 n LYS 46 Cb 0.21 -0.72 0.00 0.00 -1.84 0.00 0.00 35.03 32.67 1g91 n LYS 46 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1g91 n GLY 47 N 1.69 0.00 3.30 0.72 0.00 -1.26 -5.17 105.19 104.47 1g91 n GLY 47 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1g91 n GLY 47 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g91 s ARG 48 N 0.00 1.28 -0.01 1.61 0.52 -1.26 -4.98 118.95 116.11 1g91 s ARG 48 Ca 0.00 -1.65 -0.22 0.00 -0.52 0.00 0.00 55.73 53.34 1g91 s ARG 48 Cb 0.00 -0.39 0.05 0.00 0.52 0.00 0.00 34.95 35.12 1g91 s ARG 48 CO 0.00 -0.17 0.48 -0.98 0.02 0.00 0.00 175.30 174.66 1g91 s ARG 49 N -3.93 0.89 -0.01 3.54 1.70 -1.26 -1.16 118.95 118.73 1g91 s ARG 49 Ca 0.30 -0.06 -0.19 0.00 -0.47 0.00 0.00 55.73 55.30 1g91 s ARG 49 Cb 0.06 0.41 0.04 0.00 -0.57 0.00 0.00 34.95 34.89 1g91 s ARG 49 CO 0.08 -0.28 0.41 -0.59 -1.08 0.00 0.00 175.30 173.85 1g91 s PHE 50 N -1.60 -0.30 0.38 5.89 -0.12 -0.94 -4.97 117.98 116.32 1g91 s PHE 50 Ca -0.10 0.43 -0.26 0.00 -0.05 0.00 0.00 56.93 56.95 1g91 s PHE 50 Cb -0.02 0.19 -0.09 0.00 -0.63 0.00 0.00 43.02 42.47 1g91 s PHE 50 CO 0.04 -0.48 1.17 0.00 -0.05 0.00 0.00 175.22 175.91 1g91 s ALA 52 N -1.37 1.85 0.03 0.00 0.00 0.43 -2.48 121.76 120.22 1g91 s ALA 52 Ca 0.55 -1.22 -0.23 0.00 0.00 0.00 0.00 51.96 51.06 1g91 s ALA 52 Cb -0.32 -0.28 -0.06 0.00 0.00 0.00 0.00 23.12 22.47 1g91 s ALA 52 CO 0.40 0.39 0.67 1.21 0.00 0.00 0.00 175.76 178.43 1g91 s ASN 53 N -1.74 7.10 0.00 0.00 2.47 -1.26 -2.33 114.94 119.18 1g91 s ASN 53 Ca 0.07 1.31 0.24 0.00 0.42 0.00 0.00 52.86 54.91 1g91 s ASN 53 Cb -0.10 -2.41 1.23 0.00 -1.45 0.00 0.00 41.25 38.52 1g91 s ASN 53 CO 0.04 0.08 1.81 -0.81 -3.72 0.00 0.00 177.10 174.50 1g91 n PRO 54 N 2.66 0.34 0.00 0.43 -0.04 -1.26 -2.53 135.00 134.59 1g91 n PRO 54 Ca -0.05 0.06 0.11 0.00 -0.04 0.00 0.00 63.50 63.58 1g91 n PRO 54 Cb 0.51 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.50 1g91 n PRO 54 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1g91 n SER 55 N -1.29 2.25 -4.60 3.54 7.64 -1.26 -4.80 113.62 115.10 1g91 n SER 55 Ca 0.11 -1.63 -0.43 0.00 1.01 0.00 0.00 58.87 57.94 1g91 n SER 55 Cb 0.20 0.34 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 1g91 n SER 55 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1g91 s ASP 56 N -2.35 6.65 0.38 6.43 2.15 -1.05 -4.88 116.67 123.99 1g91 s ASP 56 Ca 0.21 0.50 0.18 0.00 0.43 0.00 0.00 52.55 53.87 1g91 s ASP 56 Cb 0.19 -2.53 1.12 0.00 -0.30 0.00 0.00 42.92 41.39 1g91 s ASP 56 CO 0.50 -1.16 1.71 0.07 -0.17 0.00 0.00 175.17 176.12 1g91 h LYS 57 N 9.03 0.35 0.00 4.34 2.10 -1.89 1.17 116.57 131.66 1g91 h LYS 57 Ca -0.23 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.38 1g91 h LYS 57 Cb 1.06 -0.08 -0.00 0.00 -0.90 0.00 0.00 32.23 32.31 1g91 h LYS 57 CO 1.09 0.23 -0.10 1.96 -2.00 0.00 0.00 179.45 180.63 1g91 h GLN 58 N 0.36 0.00 -0.04 0.07 4.20 -1.95 -1.10 115.11 116.65 1g91 h GLN 58 Ca 0.68 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 59.26 1g91 h GLN 58 Cb 1.69 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.48 1g91 h GLN 58 CO -0.43 0.10 -0.48 0.28 -0.67 0.00 0.00 178.83 177.63 1g91 h VAL 59 N 0.00 1.42 -0.15 -0.54 2.07 0.11 -2.15 116.25 117.02 1g91 h VAL 59 Ca -0.00 -1.92 -0.05 0.00 0.82 0.00 0.00 66.70 65.55 1g91 h VAL 59 Cb 0.18 2.46 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 1g91 h VAL 59 CO 0.01 0.56 -0.11 1.56 0.02 0.00 0.00 177.57 179.61 1g91 h GLN 60 N -0.10 0.23 -0.00 1.57 4.20 -1.02 -0.28 115.11 119.71 1g91 h GLN 60 Ca -0.05 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.45 1g91 h GLN 60 Cb 1.16 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.89 1g91 h GLN 60 CO 0.10 0.36 -0.76 0.28 -0.67 0.00 0.00 178.83 178.13 1g91 h VAL 61 N 0.22 1.54 0.20 -0.54 2.07 -1.18 -3.05 116.25 115.51 1g91 h VAL 61 Ca 0.05 -2.59 -0.32 0.00 0.82 0.00 0.00 66.70 64.65 1g91 h VAL 61 Cb 0.35 2.40 0.03 0.00 -1.52 0.00 0.00 31.29 32.55 1g91 h VAL 61 CO 0.02 0.74 -1.39 0.00 0.02 0.00 0.00 177.57 176.96 1g91 h MET 63 N 0.19 0.93 0.00 0.00 3.00 -1.11 0.24 114.93 118.18 1g91 h MET 63 Ca -0.23 -0.07 -0.10 0.00 0.00 0.00 0.00 59.70 59.31 1g91 h MET 63 Cb 2.07 -0.21 -0.01 0.00 0.00 0.00 0.00 31.60 33.45 1g91 h MET 63 CO 0.26 0.63 -0.48 0.00 0.00 0.00 0.00 176.91 177.32 1g91 h ARG 64 N 0.96 0.00 0.12 -0.10 3.08 -1.59 -3.26 114.38 113.59 1g91 h ARG 64 Ca 0.26 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.13 1g91 h ARG 64 Cb -0.08 0.00 0.02 0.00 0.08 0.00 0.00 29.97 29.98 1g91 h ARG 64 CO -0.05 0.48 -0.79 1.98 -1.07 0.00 0.00 179.97 180.52 1g91 h MET 65 N 0.00 0.25 -3.29 0.04 4.05 -1.01 -3.35 114.93 111.63 1g91 h MET 65 Ca -0.00 -0.43 -0.47 0.00 -0.28 0.00 0.00 59.70 58.51 1g91 h MET 65 Cb 1.09 0.16 0.02 0.00 -0.80 0.00 0.00 31.60 32.08 1g91 h MET 65 CO 0.06 1.21 2.98 1.28 0.23 0.00 0.00 176.91 182.67 1g91 n LEU 66 N -4.17 6.14 -4.60 3.39 4.77 0.70 -4.92 117.00 118.31 1g91 n LEU 66 Ca -0.15 -3.35 -0.42 0.00 -0.03 0.00 0.00 56.01 52.06 1g91 n LEU 66 Cb 0.79 -1.24 0.01 0.00 -2.33 0.00 0.00 43.42 40.65 1g91 n LEU 66 CO 0.46 1.09 0.56 2.29 -1.33 0.00 0.00 177.39 180.45 1g91 n LYS 67 N 3.99 1.32 -1.62 3.23 2.85 -1.26 -4.83 118.16 121.85 1g91 n LYS 67 Ca 0.55 0.47 -0.31 0.00 -1.05 0.00 0.00 58.31 57.98 1g91 n LYS 67 Cb 0.17 -2.00 -0.05 0.00 -0.65 0.00 0.00 35.03 32.50 1g91 n LYS 67 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1g91 n LEU 68 N 0.62 6.98 -3.76 -5.58 7.94 -1.26 -4.80 117.00 117.14 1g91 n LEU 68 Ca 0.09 -4.29 -0.42 0.00 -1.11 0.00 0.00 56.01 50.29 1g91 n LEU 68 Cb 0.38 -1.30 0.00 0.00 0.53 0.00 0.00 43.42 43.03 1g91 n LEU 68 CO 0.57 1.85 2.31 -0.67 -1.11 0.00 0.00 177.39 180.34 1g91 n ASP 69 N 1.36 5.12 -0.12 1.96 2.03 -1.26 -4.71 116.55 120.92 1g91 n ASP 69 Ca 0.54 -3.00 -0.10 0.00 0.52 0.00 0.00 54.79 52.76 1g91 n ASP 69 Cb 0.47 -1.53 -0.01 0.00 -0.72 0.00 0.00 41.12 39.32 1g91 n ASP 69 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1g91 h THR 70 N 3.69 1.21 -4.68 5.18 1.35 -2.02 -3.49 112.91 114.15 1g91 h THR 70 Ca 0.50 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 1g91 h THR 70 Cb 0.59 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 1g91 h THR 70 CO 1.71 0.23 -0.99 0.54 -0.25 0.00 0.00 175.52 176.77 1g91 n ARG 71 N -4.64 -5.34 -3.31 4.72 5.12 -1.26 -4.86 116.66 107.09 1g91 n ARG 71 Ca -0.01 3.84 -0.39 0.00 -1.93 0.00 0.00 57.85 59.37 1g91 n ARG 71 Cb 0.17 -4.67 -0.03 0.00 -1.16 0.00 0.00 32.46 26.77 1g91 n ARG 71 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 1g91 n ILE 72 N 1.89 4.07 0.39 0.55 5.41 -1.26 -4.88 119.36 125.53 1g91 n ILE 72 Ca 0.00 -5.50 -0.16 0.00 1.00 0.00 0.00 62.75 58.09 1g91 n ILE 72 Cb 0.00 -2.25 -0.08 0.00 -0.71 0.00 0.00 39.64 36.60 1g91 n ILE 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1g91 h LYS 73 N 5.56 -0.98 0.00 0.38 3.64 -2.03 -3.48 116.57 119.66 1g91 h LYS 73 Ca 0.19 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1g91 h LYS 73 Cb 0.72 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1g91 h LYS 73 CO 1.07 -0.65 0.00 0.25 -2.27 0.00 0.00 179.45 177.85 1g91 n THR 74 N -5.45 0.00 -4.72 1.00 -2.24 -1.26 -5.15 114.28 96.46 1g91 n THR 74 Ca -0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1g91 n THR 74 Cb 0.40 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 1g91 n THR 74 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1g91 n ARG 75 N -0.44 0.00 -2.94 -0.78 5.12 -1.26 -4.86 116.66 111.50 1g91 n ARG 75 Ca 0.00 0.00 0.04 0.00 -1.93 0.00 0.00 57.85 55.96 1g91 n ARG 75 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1g91 n ARG 75 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1g91 s LYS 76 N 0.00 0.11 0.00 5.56 2.20 -1.26 -5.27 119.74 121.08 1g91 s LYS 76 Ca 0.00 0.02 0.30 0.00 -0.36 0.00 0.00 55.97 55.94 1g91 s LYS 76 Cb 0.00 0.03 1.56 0.00 -1.51 0.00 0.00 37.83 37.90 1g91 s LYS 76 CO 0.00 -0.17 2.03 0.27 -0.36 0.00 0.00 175.35 177.12