#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g91 s ASP 2 N 0.00 5.61 1.43 3.17 1.01 -1.26 -5.08 116.67 121.55 1g91 s ASP 2 Ca 0.00 0.05 -0.23 0.00 0.71 0.00 0.00 52.55 53.08 1g91 s ASP 2 Cb 0.00 -1.16 0.35 0.00 1.01 0.00 0.00 42.92 43.13 1g91 s ASP 2 CO 0.00 -0.85 0.86 -1.14 0.21 0.00 0.00 175.17 174.24 1g91 n ARG 3 N -2.11 -4.50 -4.00 8.23 3.00 -1.26 -5.00 116.66 111.01 1g91 n ARG 3 Ca 0.04 -1.42 -0.33 0.00 -0.00 0.00 0.00 57.85 56.14 1g91 n ARG 3 Cb 0.59 -1.76 -0.06 0.00 0.00 0.00 0.00 32.46 31.23 1g91 n ARG 3 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 1g91 s PHE 4 N -2.17 3.40 -0.02 -0.14 5.36 -1.26 -5.11 117.98 118.05 1g91 s PHE 4 Ca 0.64 0.27 -0.01 0.00 -0.96 0.00 0.00 56.93 56.86 1g91 s PHE 4 Cb -0.10 -1.77 0.01 0.00 -0.34 0.00 0.00 43.02 40.82 1g91 s PHE 4 CO 0.53 0.59 0.05 -1.58 -1.46 0.00 0.00 175.22 173.35 1g91 s HIS 5 N -1.28 -0.04 0.02 10.12 2.46 -1.26 -5.16 115.29 120.15 1g91 s HIS 5 Ca 0.26 0.14 0.00 0.00 0.47 0.00 0.00 55.06 55.93 1g91 s HIS 5 Cb -0.12 -0.04 0.00 0.00 -0.13 0.00 0.00 32.58 32.29 1g91 s HIS 5 CO 0.17 -0.05 0.02 0.00 -2.47 0.00 0.00 174.74 172.42 1g91 n ALA 6 N 3.37 0.04 -1.05 1.58 0.00 -1.26 -5.03 120.51 118.16 1g91 n ALA 6 Ca -0.16 -0.08 0.05 0.00 0.00 0.00 0.00 53.44 53.25 1g91 n ALA 6 Cb 0.57 0.03 0.27 0.00 0.00 0.00 0.00 19.45 20.32 1g91 n ALA 6 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1g91 n THR 7 N -0.79 2.44 -1.67 0.00 5.66 -1.26 -5.01 114.28 113.64 1g91 n THR 7 Ca 0.00 -1.92 -0.47 0.00 -3.05 0.00 0.00 64.05 58.62 1g91 n THR 7 Cb 0.02 -0.28 -0.04 0.00 -1.55 0.00 0.00 70.33 68.48 1g91 n THR 7 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1g91 n SER 8 N -0.45 3.21 -4.62 1.09 7.64 -1.26 -4.85 113.62 114.38 1g91 n SER 8 Ca 0.25 1.05 -0.45 0.00 1.01 0.00 0.00 58.87 60.74 1g91 n SER 8 Cb 0.99 -1.41 -0.02 0.00 -1.01 0.00 0.00 64.21 62.76 1g91 n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1g91 n ALA 9 N 4.35 0.22 -2.45 -0.43 0.00 -1.26 -4.85 120.51 116.10 1g91 n ALA 9 Ca 0.19 0.40 -0.01 0.00 0.00 0.00 0.00 53.44 54.02 1g91 n ALA 9 Cb 0.29 -2.11 0.03 0.00 0.00 0.00 0.00 19.45 17.66 1g91 n ALA 9 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1g91 n ASP 10 N 1.43 -0.37 -3.53 0.00 2.03 -1.26 -5.14 116.55 109.71 1g91 n ASP 10 Ca 0.10 -1.24 -0.18 0.00 0.52 0.00 0.00 54.79 53.99 1g91 n ASP 10 Cb 0.31 0.17 0.11 0.00 -0.72 0.00 0.00 41.12 41.00 1g91 n ASP 10 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1g91 n ILE 13 N 0.95 0.00 -4.14 0.00 5.41 -1.26 -5.05 119.36 115.27 1g91 n ILE 13 Ca -0.11 0.00 -0.15 0.00 1.00 0.00 0.00 62.75 63.49 1g91 n ILE 13 Cb 0.53 -0.75 -0.14 0.00 -0.71 0.00 0.00 39.64 38.57 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 -4.27 0.59 -0.29 4.38 1.04 -1.26 -5.12 113.70 108.77 1g91 s SER 14 Ca 0.00 -0.11 -0.10 0.00 0.48 0.00 0.00 55.95 56.22 1g91 s SER 14 Cb 0.00 -0.06 -0.03 0.00 0.10 0.00 0.00 66.02 66.03 1g91 s SER 14 CO 0.00 0.05 0.16 -0.31 0.98 0.00 0.00 173.24 174.12 1g91 s TYR 15 N -0.18 3.18 -0.69 5.02 1.51 -1.26 -3.66 117.35 121.26 1g91 s TYR 15 Ca 0.01 -0.27 -0.34 0.00 -1.01 0.00 0.00 57.07 55.47 1g91 s TYR 15 Cb -0.02 -2.36 -0.17 0.00 -0.11 0.00 0.00 41.96 39.29 1g91 s TYR 15 CO -0.00 -0.33 2.44 -2.37 -1.11 0.00 0.00 175.55 174.18 1g91 n THR 16 N 5.02 0.02 -1.17 -0.71 5.66 -0.75 -4.73 114.28 117.61 1g91 n THR 16 Ca -0.14 -0.16 -0.35 0.00 -3.05 0.00 0.00 64.05 60.35 1g91 n THR 16 Cb 0.51 -1.04 -0.03 0.00 -1.55 0.00 0.00 70.33 68.22 1g91 n THR 16 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1g91 n PRO 17 N 8.29 3.31 -3.74 1.09 -0.04 -1.26 -4.82 135.00 137.84 1g91 n PRO 17 Ca 0.55 -2.02 -0.10 0.00 -0.04 0.00 0.00 63.50 61.88 1g91 n PRO 17 Cb 0.12 -2.72 0.01 0.00 -0.04 0.00 0.00 33.50 30.87 1g91 n PRO 17 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1g91 n ARG 18 N 3.75 0.95 -2.80 0.54 1.74 -1.26 -5.11 116.66 114.47 1g91 n ARG 18 Ca 0.70 -2.33 -0.43 0.00 -0.77 0.00 0.00 57.85 55.03 1g91 n ARG 18 Cb 0.21 2.64 -0.04 0.00 -1.02 0.00 0.00 32.46 34.26 1g91 n ARG 18 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1g91 s SER 19 N -3.02 6.66 -0.44 0.55 0.15 -1.26 -5.00 113.70 111.34 1g91 s SER 19 Ca 0.20 0.53 -0.12 0.00 0.70 0.00 0.00 55.95 57.26 1g91 s SER 19 Cb -0.03 -2.47 0.07 0.00 -1.71 0.00 0.00 66.02 61.89 1g91 s SER 19 CO 0.14 -0.89 0.31 -0.63 1.20 0.00 0.00 173.24 173.38 1g91 s ILE 20 N 3.53 4.62 -0.09 6.45 -1.09 -1.26 -5.05 121.20 128.31 1g91 s ILE 20 Ca 0.38 -1.25 -0.30 0.00 -2.23 0.00 0.00 60.65 57.25 1g91 s ILE 20 Cb -0.12 -3.79 -0.02 0.00 -1.58 0.00 0.00 42.46 36.95 1g91 s ILE 20 CO 0.20 -0.53 1.12 -2.16 -1.23 0.00 0.00 174.94 172.35 1g91 s PRO 21 N 1.51 4.37 0.60 2.79 0.04 -1.26 -4.90 135.00 138.15 1g91 s PRO 21 Ca 0.03 1.55 0.29 0.00 0.04 0.00 0.00 61.00 62.91 1g91 s PRO 21 Cb -0.23 -3.57 1.47 0.00 0.04 0.00 0.00 34.50 32.21 1g91 s PRO 21 CO 0.04 -0.42 1.88 0.00 0.04 0.00 0.00 177.00 178.53 1g91 h SER 23 N 0.00 0.00 -0.45 0.00 0.87 -2.03 0.26 113.55 112.20 1g91 h SER 23 Ca 0.19 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.56 1g91 h SER 23 Cb 1.16 0.00 -0.11 0.00 -0.44 0.00 0.00 62.40 63.01 1g91 h SER 23 CO -0.00 0.00 0.06 0.18 -0.53 0.00 0.00 176.83 176.54 1g91 n LEU 24 N -3.02 4.57 -4.06 2.23 4.32 0.10 -4.94 117.00 116.20 1g91 n LEU 24 Ca -0.02 -3.55 -0.28 0.00 -0.02 0.00 0.00 56.01 52.14 1g91 n LEU 24 Cb 0.25 -0.65 -0.17 0.00 -1.62 0.00 0.00 43.42 41.24 1g91 n LEU 24 CO 0.17 1.07 -0.49 -0.76 -1.22 0.00 0.00 177.39 176.16 1g91 s LEU 25 N -3.15 1.72 0.08 2.23 1.43 0.93 -3.69 118.68 118.24 1g91 s LEU 25 Ca 0.47 -0.40 0.18 0.00 -1.03 0.00 0.00 54.13 53.35 1g91 s LEU 25 Cb 0.41 -1.04 -0.11 0.00 0.03 0.00 0.00 46.19 45.47 1g91 s LEU 25 CO 0.04 0.03 0.84 1.21 0.23 0.00 0.00 176.35 178.70 1g91 n GLU 26 N 4.03 0.62 -3.67 1.70 2.13 0.11 -4.83 120.64 120.73 1g91 n GLU 26 Ca -0.20 0.17 0.01 0.00 0.66 0.00 0.00 57.16 57.80 1g91 n GLU 26 Cb 0.52 -1.79 -0.00 0.00 0.27 0.00 0.00 31.44 30.43 1g91 n GLU 26 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1g91 s SER 27 N -5.61 -0.06 0.19 4.31 0.15 -1.16 -4.45 113.70 107.07 1g91 s SER 27 Ca -0.03 -0.18 -0.17 0.00 0.70 0.00 0.00 55.95 56.27 1g91 s SER 27 Cb 0.09 0.20 0.03 0.00 -1.71 0.00 0.00 66.02 64.63 1g91 s SER 27 CO 0.81 -0.38 0.50 -0.72 1.20 0.00 0.00 173.24 174.65 1g91 s TYR 28 N -2.48 -0.11 0.29 3.44 1.13 -1.26 -0.18 117.35 118.18 1g91 s TYR 28 Ca 0.15 -0.23 -0.19 0.00 -1.41 0.00 0.00 57.07 55.39 1g91 s TYR 28 Cb 0.04 0.36 0.05 0.00 -1.10 0.00 0.00 41.96 41.31 1g91 s TYR 28 CO -0.03 -0.89 0.85 -0.59 -2.51 0.00 0.00 175.55 172.38 1g91 s PHE 29 N -3.87 0.01 0.31 -3.49 -0.71 -0.70 -4.96 117.98 104.57 1g91 s PHE 29 Ca 0.09 -0.53 0.03 0.00 -1.04 0.00 0.00 56.93 55.48 1g91 s PHE 29 Cb -0.01 0.76 -0.03 0.00 -1.21 0.00 0.00 43.02 42.54 1g91 s PHE 29 CO -0.04 -1.27 0.47 -1.21 -1.34 0.00 0.00 175.22 171.83 1g91 s GLU 30 N -2.77 3.37 0.37 1.99 8.01 -1.26 0.20 118.70 128.61 1g91 s GLU 30 Ca 0.15 -0.62 -0.03 0.00 0.01 0.00 0.00 54.97 54.48 1g91 s GLU 30 Cb -0.04 -2.77 0.08 0.00 -4.31 0.00 0.00 34.13 27.09 1g91 s GLU 30 CO 0.08 0.21 0.50 0.25 0.01 0.00 0.00 175.26 176.31 1g91 n THR 31 N -1.64 0.00 -2.36 3.63 -2.24 -0.85 -4.80 114.28 106.02 1g91 n THR 31 Ca -0.05 -0.61 -0.42 0.00 -2.27 0.00 0.00 64.05 60.69 1g91 n THR 31 Cb 0.57 -1.38 -0.03 0.00 -2.10 0.00 0.00 70.33 67.39 1g91 n THR 31 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1g91 s ASN 32 N -2.96 6.96 0.03 3.42 0.02 -1.26 -4.86 114.94 116.29 1g91 s ASN 32 Ca 0.31 1.95 0.11 0.00 -1.02 0.00 0.00 52.86 54.20 1g91 s ASN 32 Cb -0.01 -2.56 0.46 0.00 0.02 0.00 0.00 41.25 39.16 1g91 s ASN 32 CO 0.21 -0.64 1.34 -1.20 0.02 0.00 0.00 177.10 176.82 1g91 n SER 33 N 5.27 0.08 0.25 -1.22 7.64 -1.26 -2.10 113.62 122.28 1g91 n SER 33 Ca 0.12 0.52 0.11 0.00 1.01 0.00 0.00 58.87 60.63 1g91 n SER 33 Cb 0.45 -0.54 0.66 0.00 -1.01 0.00 0.00 64.21 63.77 1g91 n SER 33 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1g91 h GLU 34 N 0.00 0.00 -7.34 1.43 3.07 -2.01 -3.43 114.58 106.30 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 0.16 0.00 0.15 0.00 -0.84 0.00 0.00 28.75 28.22 1g91 h GLU 34 CO 0.00 0.15 0.23 0.00 -1.40 0.00 0.00 179.01 177.99 1g91 h SER 36 N -1.65 0.86 -3.58 0.00 4.64 -1.90 -3.41 113.55 108.52 1g91 h SER 36 Ca -0.51 -0.71 -0.63 0.00 -0.47 0.00 0.00 61.79 59.47 1g91 h SER 36 Cb 1.30 -0.27 -0.39 0.00 -0.31 0.00 0.00 62.40 62.73 1g91 h SER 36 CO 0.55 1.51 -0.76 -0.54 -0.87 0.00 0.00 176.83 176.73 1g91 s LYS 37 N -3.26 1.44 1.04 4.77 1.02 -1.26 -5.11 119.74 118.38 1g91 s LYS 37 Ca -0.09 -1.38 -0.18 0.00 0.02 0.00 0.00 55.97 54.35 1g91 s LYS 37 Cb 0.07 -2.73 0.24 0.00 -0.52 0.00 0.00 37.83 34.90 1g91 s LYS 37 CO 0.92 -0.80 1.26 -0.35 -0.92 0.00 0.00 175.35 175.45 1g91 n PRO 38 N 4.53 -1.79 -2.23 -1.68 -0.04 -1.26 -4.63 135.00 127.90 1g91 n PRO 38 Ca -0.04 -1.96 0.00 0.00 -0.04 0.00 0.00 63.50 61.47 1g91 n PRO 38 Cb 0.43 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 1g91 n PRO 38 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1g91 n GLY 39 N -3.91 0.69 3.45 0.55 0.00 -1.26 -4.96 105.19 99.74 1g91 n GLY 39 Ca 0.16 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.20 3.20 -0.37 1.61 1.01 -1.00 -2.01 120.40 120.64 1g91 s VAL 40 Ca 0.06 -0.64 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 1g91 s VAL 40 Cb -0.00 -2.30 0.03 0.00 0.00 0.00 0.00 36.38 34.11 1g91 s VAL 40 CO 0.00 0.56 0.18 -0.63 0.00 0.00 0.00 175.10 175.21 1g91 s ILE 41 N -0.24 4.30 -0.17 2.22 1.01 0.13 0.47 121.20 128.93 1g91 s ILE 41 Ca 0.02 -0.98 -0.14 0.00 0.00 0.00 0.00 60.65 59.54 1g91 s ILE 41 Cb -0.13 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1g91 s ILE 41 CO 0.03 -0.23 0.32 -0.36 0.00 0.00 0.00 174.94 174.69 1g91 s PHE 42 N 1.50 3.44 -0.26 3.97 0.40 -0.64 -1.73 117.98 124.66 1g91 s PHE 42 Ca 0.01 0.60 -0.11 0.00 -0.60 0.00 0.00 56.93 56.83 1g91 s PHE 42 Cb -0.19 -2.38 -0.05 0.00 0.51 0.00 0.00 43.02 40.90 1g91 s PHE 42 CO 0.05 0.18 0.18 -1.17 0.70 0.00 0.00 175.22 175.16 1g91 s LEU 43 N 0.65 4.06 0.72 -0.37 0.20 0.75 -1.86 118.68 122.83 1g91 s LEU 43 Ca 0.17 0.04 -0.11 0.00 0.69 0.00 0.00 54.13 54.92 1g91 s LEU 43 Cb -0.13 -2.12 0.03 0.00 -0.43 0.00 0.00 46.19 43.54 1g91 s LEU 43 CO 0.05 -0.00 1.10 0.42 -0.29 0.00 0.00 176.35 177.62 1g91 s THR 44 N 1.47 3.17 -2.00 3.68 -4.23 0.29 0.04 115.64 118.07 1g91 s THR 44 Ca 0.07 0.33 0.16 0.00 -1.18 0.00 0.00 61.69 61.08 1g91 s THR 44 Cb -0.15 -3.37 0.45 0.00 1.34 0.00 0.00 72.50 70.78 1g91 s THR 44 CO 0.08 -0.48 1.59 1.17 -0.54 0.00 0.00 174.62 176.45 1g91 n LYS 45 N -3.04 0.97 -0.92 3.99 4.81 -1.24 -3.15 118.16 119.58 1g91 n LYS 45 Ca 0.07 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.53 1g91 n LYS 45 Cb 0.58 -1.26 0.35 0.00 0.02 0.00 0.00 35.03 34.73 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 -0.76 4.23 -2.00 1.64 5.02 -1.26 -4.88 118.16 120.16 1g91 n LYS 46 Ca 0.12 -3.12 -0.11 0.00 -2.02 0.00 0.00 58.31 53.18 1g91 n LYS 46 Cb 0.05 -2.21 -0.02 0.00 -0.02 0.00 0.00 35.03 32.84 1g91 n LYS 46 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1g91 n GLY 47 N 0.18 0.24 3.38 0.72 0.00 -1.19 -5.01 105.19 103.51 1g91 n GLY 47 Ca 0.33 -0.43 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 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 -4.17 1.43 -0.20 1.61 3.00 -1.25 -4.98 118.95 114.37 1g91 s ARG 48 Ca 0.00 -1.69 -0.18 0.00 0.00 0.00 0.00 55.73 53.86 1g91 s ARG 48 Cb 0.00 -1.05 0.05 0.00 0.00 0.00 0.00 34.95 33.96 1g91 s ARG 48 CO 0.00 0.07 0.54 -0.98 0.00 0.00 0.00 175.30 174.93 1g91 s ARG 49 N -3.72 0.62 0.13 3.54 1.70 -1.26 0.11 118.95 120.07 1g91 s ARG 49 Ca 0.26 0.77 0.04 0.00 -0.47 0.00 0.00 55.73 56.33 1g91 s ARG 49 Cb 0.02 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 34.65 1g91 s ARG 49 CO 0.09 -0.08 -0.10 -0.59 -1.08 0.00 0.00 175.30 173.54 1g91 s PHE 50 N 0.38 1.19 0.13 5.89 -0.12 -0.78 -4.95 117.98 119.73 1g91 s PHE 50 Ca -0.01 -0.75 -0.25 0.00 -0.05 0.00 0.00 56.93 55.87 1g91 s PHE 50 Cb -0.04 -0.62 -0.07 0.00 -0.63 0.00 0.00 43.02 41.66 1g91 s PHE 50 CO -0.01 0.04 0.77 0.00 -0.05 0.00 0.00 175.22 175.97 1g91 s ALA 52 N -0.88 2.70 0.06 0.00 0.00 0.18 -1.80 121.76 122.01 1g91 s ALA 52 Ca 0.36 -1.88 -0.24 0.00 0.00 0.00 0.00 51.96 50.20 1g91 s ALA 52 Cb -0.22 -0.22 -0.06 0.00 0.00 0.00 0.00 23.12 22.62 1g91 s ALA 52 CO 0.25 0.24 0.71 1.21 0.00 0.00 0.00 175.76 178.18 1g91 s ASN 53 N -3.50 7.18 0.16 0.00 3.84 -1.26 -2.37 114.94 118.98 1g91 s ASN 53 Ca 0.30 1.40 0.24 0.00 0.21 0.00 0.00 52.86 55.01 1g91 s ASN 53 Cb -0.04 -2.44 0.91 0.00 -0.55 0.00 0.00 41.25 39.13 1g91 s ASN 53 CO 0.14 0.09 1.74 -0.81 -2.79 0.00 0.00 177.10 175.47 1g91 n PRO 54 N 2.51 0.16 -0.12 0.43 -0.04 -1.26 -2.53 135.00 134.15 1g91 n PRO 54 Ca -0.05 0.24 0.12 0.00 -0.04 0.00 0.00 63.50 63.78 1g91 n PRO 54 Cb 0.50 -1.73 0.25 0.00 -0.04 0.00 0.00 33.50 32.48 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 -2.01 2.84 -4.66 3.54 7.64 -1.26 -4.70 113.62 115.01 1g91 n SER 55 Ca 0.04 -1.90 -0.42 0.00 1.01 0.00 0.00 58.87 57.61 1g91 n SER 55 Cb 0.32 -0.16 -0.04 0.00 -1.01 0.00 0.00 64.21 63.33 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 -1.63 6.94 0.33 6.43 -1.08 -1.05 -4.91 116.67 121.70 1g91 s ASP 56 Ca 0.35 1.17 0.11 0.00 -0.52 0.00 0.00 52.55 53.67 1g91 s ASP 56 Cb 0.21 -2.47 0.95 0.00 -1.46 0.00 0.00 42.92 40.15 1g91 s ASP 56 CO 0.30 -0.52 1.71 0.50 0.52 0.00 0.00 175.17 177.69 1g91 h LYS 57 N 7.51 0.50 -0.23 4.34 3.64 -1.90 1.05 116.57 131.48 1g91 h LYS 57 Ca -0.24 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.14 1g91 h LYS 57 Cb 1.10 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.79 1g91 h LYS 57 CO 0.89 0.33 0.16 1.96 -2.27 0.00 0.00 179.45 180.51 1g91 h GLN 58 N 0.51 0.15 0.00 1.90 4.20 -1.94 0.39 115.11 120.32 1g91 h GLN 58 Ca 0.67 -0.01 -0.27 0.00 0.06 0.00 0.00 58.65 59.10 1g91 h GLN 58 Cb 1.36 -0.03 0.02 0.00 0.30 0.00 0.00 27.48 29.12 1g91 h GLN 58 CO -0.50 0.10 -1.04 0.28 -0.67 0.00 0.00 178.83 177.00 1g91 h VAL 59 N 0.16 1.28 -0.14 -0.54 2.07 0.87 -1.30 116.25 118.65 1g91 h VAL 59 Ca 0.10 -2.26 -0.17 0.00 0.82 0.00 0.00 66.70 65.19 1g91 h VAL 59 Cb 0.20 2.38 -0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1g91 h VAL 59 CO -0.02 0.70 -0.64 1.56 0.02 0.00 0.00 177.57 179.19 1g91 h GLN 60 N 0.39 0.50 0.00 1.57 4.20 -0.64 -2.54 115.11 118.59 1g91 h GLN 60 Ca -0.13 -0.36 -0.04 0.00 0.06 0.00 0.00 58.65 58.18 1g91 h GLN 60 Cb 1.69 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.53 1g91 h GLN 60 CO 0.20 0.97 -0.20 0.28 -0.67 0.00 0.00 178.83 179.41 1g91 h VAL 61 N 0.36 0.42 0.03 -0.54 2.07 -0.29 -3.15 116.25 115.15 1g91 h VAL 61 Ca -0.01 -1.26 -0.26 0.00 0.82 0.00 0.00 66.70 65.99 1g91 h VAL 61 Cb 1.20 1.93 0.02 0.00 -1.52 0.00 0.00 31.29 32.92 1g91 h VAL 61 CO 0.12 0.20 -1.07 0.00 0.02 0.00 0.00 177.57 176.83 1g91 h MET 63 N 0.31 0.00 0.23 0.00 3.00 -1.41 0.19 114.93 117.24 1g91 h MET 63 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 59.70 59.25 1g91 h MET 63 Cb 1.73 0.00 0.03 0.00 0.00 0.00 0.00 31.60 33.36 1g91 h MET 63 CO 0.20 0.00 -1.48 -0.09 0.00 0.00 0.00 176.91 175.54 1g91 h ARG 64 N 0.00 0.48 0.88 -0.10 2.43 -1.66 -3.37 114.38 113.03 1g91 h ARG 64 Ca 0.32 -0.82 -0.04 0.00 -0.81 0.00 0.00 59.98 58.64 1g91 h ARG 64 Cb 1.51 0.30 0.01 0.00 -0.42 0.00 0.00 29.97 31.37 1g91 h ARG 64 CO -0.00 1.39 -0.42 1.98 -1.51 0.00 0.00 179.97 181.40 1g91 h MET 65 N 0.07 -1.14 -4.34 0.20 4.05 -0.65 -3.25 114.93 109.87 1g91 h MET 65 Ca -0.27 0.08 -0.67 0.00 -0.28 0.00 0.00 59.70 58.56 1g91 h MET 65 Cb 2.09 0.26 0.01 0.00 -0.80 0.00 0.00 31.60 33.16 1g91 h MET 65 CO 0.23 -0.76 2.59 1.28 0.23 0.00 0.00 176.91 180.48 1g91 n LEU 66 N -5.54 5.11 0.00 3.39 4.77 -0.44 -4.83 117.00 119.45 1g91 n LEU 66 Ca -0.15 -3.37 0.00 0.00 -0.03 0.00 0.00 56.01 52.46 1g91 n LEU 66 Cb 0.47 -1.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 1g91 n LEU 66 CO 0.35 0.16 0.00 2.29 -1.33 0.00 0.00 177.39 178.86 1g91 n LYS 67 N 6.71 0.00 -0.49 3.23 0.00 -1.23 -4.32 118.16 122.07 1g91 n LYS 67 Ca 0.50 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.89 1g91 n LYS 67 Cb 0.40 0.00 0.28 0.00 -0.00 0.00 0.00 35.03 35.71 1g91 n LYS 67 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1g91 n LEU 68 N 0.00 3.84 0.00 -5.58 4.77 -1.26 -4.23 117.00 114.53 1g91 n LEU 68 Ca 0.00 -1.94 0.04 0.00 -0.03 0.00 0.00 56.01 54.08 1g91 n LEU 68 Cb 0.00 -0.51 0.17 0.00 -2.33 0.00 0.00 43.42 40.75 1g91 n LEU 68 CO 0.00 0.65 0.63 -0.67 -1.33 0.00 0.00 177.39 176.67 1g91 n ASP 69 N 0.83 0.00 -4.55 -1.43 2.03 -1.26 -4.21 116.55 107.97 1g91 n ASP 69 Ca 0.20 0.50 -0.43 0.00 0.52 0.00 0.00 54.79 55.59 1g91 n ASP 69 Cb 0.73 -0.50 -0.01 0.00 -0.72 0.00 0.00 41.12 40.61 1g91 n ASP 69 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1g91 s THR 70 N -3.00 4.21 0.27 5.18 -4.23 -1.26 -4.76 115.64 112.05 1g91 s THR 70 Ca 0.04 -1.58 0.01 0.00 -1.18 0.00 0.00 61.69 58.97 1g91 s THR 70 Cb 0.05 -5.08 0.01 0.00 1.34 0.00 0.00 72.50 68.82 1g91 s THR 70 CO 0.15 -1.90 0.05 -1.14 -0.54 0.00 0.00 174.62 171.23 1g91 n ARG 71 N 8.07 1.30 -2.82 3.99 0.00 -1.26 -4.96 116.66 120.99 1g91 n ARG 71 Ca 0.40 -1.88 -0.03 0.00 -0.00 0.00 0.00 57.85 56.34 1g91 n ARG 71 Cb 0.48 0.44 -0.02 0.00 0.00 0.00 0.00 32.46 33.35 1g91 n ARG 71 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1g91 n ILE 72 N -0.77 -8.50 0.73 5.15 5.41 -1.26 -4.92 119.36 115.20 1g91 n ILE 72 Ca -0.09 1.65 0.07 0.00 1.00 0.00 0.00 62.75 65.39 1g91 n ILE 72 Cb 0.33 -5.20 -0.08 0.00 -0.71 0.00 0.00 39.64 33.99 1g91 n ILE 72 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1g91 n LYS 73 N 1.70 1.84 -4.53 0.38 4.81 -1.26 -4.99 118.16 116.11 1g91 n LYS 73 Ca -0.19 -0.11 -0.25 0.00 -0.87 0.00 0.00 58.31 56.90 1g91 n LYS 73 Cb 0.35 -1.24 -0.11 0.00 0.02 0.00 0.00 35.03 34.06 1g91 n LYS 73 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1g91 s THR 74 N -2.40 1.66 0.00 3.15 -4.23 -1.26 -5.09 115.64 107.47 1g91 s THR 74 Ca 0.07 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 1g91 s THR 74 Cb 0.12 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 71.12 1g91 s THR 74 CO 0.61 -0.04 0.65 0.54 -0.54 0.00 0.00 174.62 175.83 1g91 n ARG 75 N -0.81 0.00 0.00 3.99 3.00 -1.26 -4.96 116.66 116.63 1g91 n ARG 75 Ca -0.04 0.35 0.00 0.00 -0.01 0.00 0.00 57.85 58.15 1g91 n ARG 75 Cb 0.66 -1.23 0.00 0.00 0.00 0.00 0.00 32.46 31.89 1g91 n ARG 75 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1g91 n LYS 76 N -1.54 0.00 0.00 5.56 4.81 -1.26 -5.15 118.16 120.58 1g91 n LYS 76 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1g91 n LYS 76 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 1g91 n LYS 76 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86