#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ue9 s SER 2 N 0.00 6.06 -0.30 1.61 1.04 -1.26 -4.96 113.70 115.90 1ue9 s SER 2 Ca 0.00 -1.99 0.06 0.00 0.48 0.00 0.00 55.95 54.50 1ue9 s SER 2 Cb 0.00 -2.13 0.20 0.00 0.10 0.00 0.00 66.02 64.19 1ue9 s SER 2 CO 0.00 -0.75 0.60 -0.44 0.98 0.00 0.00 173.24 173.63 1ue9 s SER 3 N 3.00 -1.62 0.00 7.02 0.01 -1.26 -5.14 113.70 115.71 1ue9 s SER 3 Ca 0.06 0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.41 1ue9 s SER 3 Cb -0.26 2.02 0.00 0.00 0.21 0.00 0.00 66.02 68.00 1ue9 s SER 3 CO -0.00 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 173.98 1ue9 n GLY 4 N 5.31 0.67 2.86 3.44 0.00 -1.26 -5.07 105.19 111.13 1ue9 n GLY 4 Ca 0.06 -2.15 -0.08 0.00 0.00 0.00 0.00 46.02 43.85 1ue9 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ue9 n SER 5 N 1.26 -7.90 0.00 1.61 2.88 -1.26 -4.83 113.62 105.39 1ue9 n SER 5 Ca 0.00 0.63 0.00 0.00 -1.33 0.00 0.00 58.87 58.17 1ue9 n SER 5 Cb 0.00 -5.27 0.00 0.00 -0.75 0.00 0.00 64.21 58.19 1ue9 n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ue9 n SER 6 N -0.17 0.00 -4.66 -3.46 2.88 -1.26 -4.44 113.62 102.51 1ue9 n SER 6 Ca 0.10 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.21 1ue9 n SER 6 Cb 0.41 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.85 1ue9 n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1ue9 s GLY 7 N 0.00 1.65 -0.10 0.46 0.00 -1.26 -4.96 107.32 103.10 1ue9 s GLY 7 Ca 0.00 0.67 -0.30 0.00 0.00 0.00 0.00 44.72 45.09 1ue9 s GLY 7 CO 0.00 2.67 1.30 -0.54 0.00 0.00 0.00 173.10 176.53 1ue9 s GLU 8 N 3.51 4.27 -0.06 2.90 2.02 -1.26 -4.81 118.70 125.27 1ue9 s GLU 8 Ca 0.62 1.76 -0.09 0.00 0.02 0.00 0.00 54.97 57.27 1ue9 s GLU 8 Cb -0.27 -3.70 -0.05 0.00 0.10 0.00 0.00 34.13 30.22 1ue9 s GLU 8 CO 0.21 -0.62 0.25 0.42 0.02 0.00 0.00 175.26 175.54 1ue9 s ILE 9 N 3.01 5.32 -0.03 -1.63 -1.09 -1.26 -0.43 121.20 125.09 1ue9 s ILE 9 Ca 0.58 0.41 0.05 0.00 -2.23 0.00 0.00 60.65 59.46 1ue9 s ILE 9 Cb -0.25 -3.53 -0.01 0.00 -1.58 0.00 0.00 42.46 37.09 1ue9 s ILE 9 CO 0.20 0.56 -0.19 0.00 -1.23 0.00 0.00 174.94 174.28 1ue9 s ALA 10 N -1.10 1.62 -0.40 9.38 0.00 -1.04 -2.07 121.76 128.16 1ue9 s ALA 10 Ca 0.20 -0.79 -0.16 0.00 0.00 0.00 0.00 51.96 51.21 1ue9 s ALA 10 Cb -0.14 -0.48 0.01 0.00 0.00 0.00 0.00 23.12 22.52 1ue9 s ALA 10 CO 0.09 0.34 0.37 -1.14 0.00 0.00 0.00 175.76 175.42 1ue9 s GLN 11 N -0.21 3.17 0.24 0.00 0.74 0.53 -3.07 119.66 121.07 1ue9 s GLN 11 Ca 0.01 -0.77 -0.31 0.00 0.05 0.00 0.00 55.36 54.34 1ue9 s GLN 11 Cb -0.10 -3.93 -0.13 0.00 1.10 0.00 0.00 33.01 29.95 1ue9 s GLN 11 CO 0.01 -0.73 1.45 0.28 -0.55 0.00 0.00 175.29 175.74 1ue9 n VAL 12 N 5.29 0.91 -0.02 1.34 0.31 -1.24 -1.03 118.33 123.89 1ue9 n VAL 12 Ca -0.09 -0.23 -0.01 0.00 -0.01 0.00 0.00 64.34 64.00 1ue9 n VAL 12 Cb 0.48 -1.55 -0.04 0.00 -0.91 0.00 0.00 33.84 31.81 1ue9 n VAL 12 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1ue9 n THR 13 N 2.03 0.25 -4.31 2.52 -2.24 0.10 -3.73 114.28 108.90 1ue9 n THR 13 Ca 0.11 -0.19 -0.18 0.00 -2.27 0.00 0.00 64.05 61.52 1ue9 n THR 13 Cb 0.32 -0.49 -0.15 0.00 -2.10 0.00 0.00 70.33 67.91 1ue9 n THR 13 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1ue9 s SER 14 N -3.34 0.97 0.37 3.42 0.01 -0.64 -4.84 113.70 109.65 1ue9 s SER 14 Ca -0.02 -0.15 -0.26 0.00 1.31 0.00 0.00 55.95 56.82 1ue9 s SER 14 Cb 0.02 -0.17 -0.09 0.00 0.21 0.00 0.00 66.02 65.99 1ue9 s SER 14 CO 0.22 0.08 1.19 0.00 0.41 0.00 0.00 173.24 175.14 1ue9 s ALA 15 N -0.03 3.25 -0.10 1.44 0.00 -1.26 -4.49 121.76 120.57 1ue9 s ALA 15 Ca 0.01 1.02 -0.04 0.00 0.00 0.00 0.00 51.96 52.94 1ue9 s ALA 15 Cb -0.05 -3.40 0.05 0.00 0.00 0.00 0.00 23.12 19.72 1ue9 s ALA 15 CO -0.00 -0.52 0.22 -0.47 0.00 0.00 0.00 175.76 174.99 1ue9 s TYR 16 N -1.33 -0.29 -0.49 0.00 5.04 0.87 -4.92 117.35 116.23 1ue9 s TYR 16 Ca 0.54 0.72 -0.00 0.00 -2.44 0.00 0.00 57.07 55.89 1ue9 s TYR 16 Cb -0.33 -0.01 0.13 0.00 0.35 0.00 0.00 41.96 42.10 1ue9 s TYR 16 CO 0.42 -0.23 0.27 0.54 -1.34 0.00 0.00 175.55 175.20 1ue9 s VAL 17 N 1.40 3.11 1.00 3.14 0.11 -1.26 0.21 120.40 128.11 1ue9 s VAL 17 Ca -0.08 -2.67 -0.17 0.00 -2.93 0.00 0.00 61.98 56.13 1ue9 s VAL 17 Cb -0.11 -3.12 -0.14 0.00 -1.53 0.00 0.00 36.38 31.49 1ue9 s VAL 17 CO -0.08 -0.76 -0.77 0.00 -3.33 0.00 0.00 175.10 170.17 1ue9 n ALA 18 N 3.86 -5.31 -2.68 1.54 0.00 -1.26 -4.95 120.51 111.71 1ue9 n ALA 18 Ca 0.04 -0.74 -0.05 0.00 0.00 0.00 0.00 53.44 52.69 1ue9 n ALA 18 Cb 0.38 -1.17 0.11 0.00 0.00 0.00 0.00 19.45 18.78 1ue9 n ALA 18 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ue9 n SER 19 N 3.10 -1.67 0.00 0.00 7.64 -1.26 -4.95 113.62 116.49 1ue9 n SER 19 Ca -0.01 -2.30 0.00 0.00 1.01 0.00 0.00 58.87 57.57 1ue9 n SER 19 Cb 0.57 0.88 0.00 0.00 -1.01 0.00 0.00 64.21 64.65 1ue9 n SER 19 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ue9 n GLY 20 N -0.92 3.07 1.77 0.23 0.00 -1.26 -5.12 105.19 102.96 1ue9 n GLY 20 Ca -0.09 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1ue9 n GLY 20 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ue9 n SER 21 N 0.00 0.06 -2.88 1.61 2.88 -1.26 -4.90 113.62 109.14 1ue9 n SER 21 Ca 0.00 0.22 -0.40 0.00 -1.33 0.00 0.00 58.87 57.36 1ue9 n SER 21 Cb 0.00 0.13 0.04 0.00 -0.75 0.00 0.00 64.21 63.63 1ue9 n SER 21 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1ue9 n GLU 22 N -3.01 2.75 -4.42 -1.46 4.71 -1.26 -4.95 120.64 113.00 1ue9 n GLU 22 Ca 0.00 -3.51 -0.30 0.00 -0.01 0.00 0.00 57.16 53.34 1ue9 n GLU 22 Cb 0.00 -2.27 -0.12 0.00 -1.01 0.00 0.00 31.44 28.04 1ue9 n GLU 22 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 1ue9 s GLN 23 N -4.06 1.89 -0.08 3.49 -0.21 -1.26 -0.64 119.66 118.79 1ue9 s GLN 23 Ca 0.53 -1.11 0.05 0.00 0.02 0.00 0.00 55.36 54.85 1ue9 s GLN 23 Cb 0.44 -2.14 -0.01 0.00 1.00 0.00 0.00 33.01 32.30 1ue9 s GLN 23 CO -0.39 0.50 -0.24 -1.17 -2.12 0.00 0.00 175.29 171.87 1ue9 s LEU 24 N -1.91 2.13 0.42 2.90 2.96 -1.05 -4.58 118.68 119.54 1ue9 s LEU 24 Ca 0.17 -0.52 -0.23 0.00 -0.22 0.00 0.00 54.13 53.33 1ue9 s LEU 24 Cb -0.11 -1.41 -0.09 0.00 0.50 0.00 0.00 46.19 45.08 1ue9 s LEU 24 CO 0.09 0.20 1.02 -0.94 -1.32 0.00 0.00 176.35 175.39 1ue9 s SER 25 N 0.09 6.74 0.23 3.68 1.04 -1.26 -4.47 113.70 119.76 1ue9 s SER 25 Ca -0.11 1.92 0.11 0.00 0.48 0.00 0.00 55.95 58.35 1ue9 s SER 25 Cb -0.16 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.35 1ue9 s SER 25 CO 0.06 -0.50 -0.18 -0.76 0.98 0.00 0.00 173.24 172.84 1ue9 s LEU 26 N -2.90 2.64 0.00 2.42 1.43 0.57 -4.93 118.68 117.91 1ue9 s LEU 26 Ca 0.60 -0.86 -0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1ue9 s LEU 26 Cb -0.18 -1.27 -0.00 0.00 0.03 0.00 0.00 46.19 44.77 1ue9 s LEU 26 CO 0.22 0.08 -0.00 0.00 0.23 0.00 0.00 176.35 176.88 1ue9 s ALA 27 N -2.03 0.01 -0.34 4.21 0.00 -1.26 -0.09 121.76 122.25 1ue9 s ALA 27 Ca 0.26 -0.06 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 1ue9 s ALA 27 Cb -0.07 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.07 1ue9 s ALA 27 CO 0.13 -0.02 1.37 -1.25 0.00 0.00 0.00 175.76 176.00 1ue9 s PRO 28 N -0.17 3.77 0.00 0.00 0.04 -1.26 -2.91 135.00 134.47 1ue9 s PRO 28 Ca -0.02 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1ue9 s PRO 28 Cb -0.01 -3.95 0.00 0.00 0.04 0.00 0.00 34.50 30.58 1ue9 s PRO 28 CO -0.00 -1.31 0.00 0.41 0.04 0.00 0.00 177.00 176.14 1ue9 n GLY 29 N 4.64 1.66 3.78 0.56 0.00 -1.24 -5.03 105.19 109.56 1ue9 n GLY 29 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1ue9 n GLY 29 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ue9 n GLN 30 N -0.80 0.72 -4.14 1.61 6.02 -1.15 -5.04 117.38 114.61 1ue9 n GLN 30 Ca 0.00 -3.83 -0.17 0.00 -0.01 0.00 0.00 57.00 52.98 1ue9 n GLN 30 Cb 0.00 1.00 -0.15 0.00 1.02 0.00 0.00 30.24 32.11 1ue9 n GLN 30 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1ue9 s LEU 31 N 0.00 1.70 0.13 1.08 1.43 -1.26 -3.60 118.68 118.16 1ue9 s LEU 31 Ca 0.01 -0.10 0.06 0.00 -1.03 0.00 0.00 54.13 53.08 1ue9 s LEU 31 Cb -0.00 -0.32 -0.04 0.00 0.03 0.00 0.00 46.19 45.86 1ue9 s LEU 31 CO 0.01 0.01 -0.15 -0.63 0.23 0.00 0.00 176.35 175.82 1ue9 s ILE 32 N 0.32 1.40 -0.28 -0.59 1.01 -1.18 0.96 121.20 122.85 1ue9 s ILE 32 Ca -0.04 -1.76 -0.06 0.00 0.00 0.00 0.00 60.65 58.80 1ue9 s ILE 32 Cb -0.07 -1.59 0.01 0.00 0.01 0.00 0.00 42.46 40.81 1ue9 s ILE 32 CO -0.00 -0.41 0.06 -0.22 0.00 0.00 0.00 174.94 174.36 1ue9 s LEU 33 N -2.50 3.66 -0.30 2.97 2.96 0.32 -2.50 118.68 123.30 1ue9 s LEU 33 Ca 0.10 -0.64 -0.29 0.00 -0.22 0.00 0.00 54.13 53.08 1ue9 s LEU 33 Cb -0.05 -1.85 -0.02 0.00 0.50 0.00 0.00 46.19 44.77 1ue9 s LEU 33 CO 0.03 -0.15 1.65 -0.63 -1.32 0.00 0.00 176.35 175.93 1ue9 s ILE 34 N 1.49 3.65 -0.27 6.68 -1.09 0.43 -0.58 121.20 131.52 1ue9 s ILE 34 Ca 0.03 0.70 -0.10 0.00 -2.23 0.00 0.00 60.65 59.04 1ue9 s ILE 34 Cb -0.17 -3.77 -0.14 0.00 -1.58 0.00 0.00 42.46 36.80 1ue9 s ILE 34 CO 0.01 -0.42 -0.27 0.18 -1.23 0.00 0.00 174.94 173.22 1ue9 n LEU 35 N 9.20 2.22 -4.14 2.97 4.77 0.18 -4.18 117.00 128.02 1ue9 n LEU 35 Ca 0.20 0.23 -0.16 0.00 -0.03 0.00 0.00 56.01 56.24 1ue9 n LEU 35 Cb 0.46 -0.86 -0.12 0.00 -2.33 0.00 0.00 43.42 40.58 1ue9 n LEU 35 CO 0.67 0.65 -0.44 -0.75 -1.33 0.00 0.00 177.39 176.20 1ue9 s LYS 36 N -2.50 0.74 0.32 3.23 2.20 0.32 -4.98 119.74 119.07 1ue9 s LYS 36 Ca -0.37 -0.92 0.05 0.00 -0.36 0.00 0.00 55.97 54.37 1ue9 s LYS 36 Cb 0.13 -0.65 -0.06 0.00 -1.51 0.00 0.00 37.83 35.74 1ue9 s LYS 36 CO 0.53 0.13 0.03 0.15 -0.36 0.00 0.00 175.35 175.83 1ue9 s LYS 37 N -1.81 1.66 0.24 4.03 1.02 -1.26 0.12 119.74 123.74 1ue9 s LYS 37 Ca -0.03 -1.90 0.01 0.00 0.02 0.00 0.00 55.97 54.06 1ue9 s LYS 37 Cb -0.09 -1.02 -0.04 0.00 -0.52 0.00 0.00 37.83 36.16 1ue9 s LYS 37 CO 0.02 -0.12 0.14 1.21 -0.92 0.00 0.00 175.35 175.67 1ue9 s ASN 38 N -3.50 0.73 -0.28 2.83 2.47 -1.06 -4.89 114.94 111.24 1ue9 s ASN 38 Ca 0.35 -1.44 0.12 0.00 0.42 0.00 0.00 52.86 52.30 1ue9 s ASN 38 Cb 0.08 0.34 0.80 0.00 -1.45 0.00 0.00 41.25 41.02 1ue9 s ASN 38 CO 0.15 -0.84 1.78 1.07 -3.72 0.00 0.00 177.10 175.54 1ue9 n THR 39 N -0.39 2.86 -0.01 -5.21 5.66 -1.26 -4.19 114.28 111.74 1ue9 n THR 39 Ca 0.02 -1.50 -0.01 0.00 -3.05 0.00 0.00 64.05 59.51 1ue9 n THR 39 Cb 0.66 -0.32 -0.01 0.00 -1.55 0.00 0.00 70.33 69.11 1ue9 n THR 39 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1ue9 n SER 40 N 0.31 3.85 0.00 1.09 2.88 -1.26 -5.03 113.62 115.45 1ue9 n SER 40 Ca 0.34 -0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 1ue9 n SER 40 Cb 1.29 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 64.72 1ue9 n SER 40 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ue9 n GLY 41 N 3.40 0.71 3.69 0.46 0.00 -1.26 -5.07 105.19 107.12 1ue9 n GLY 41 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1ue9 n GLY 41 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ue9 s TRP 42 N 0.00 3.41 -0.01 1.61 0.52 -1.26 -1.19 118.94 122.02 1ue9 s TRP 42 Ca 0.00 1.45 0.06 0.00 0.02 0.00 0.00 56.10 57.63 1ue9 s TRP 42 Cb 0.00 -3.28 -0.03 0.00 -1.15 0.00 0.00 33.47 29.01 1ue9 s TRP 42 CO 0.00 -0.66 -0.20 -1.58 0.02 0.00 0.00 176.95 174.53 1ue9 s TRP 43 N 1.88 2.53 -0.55 -1.98 0.51 0.12 -2.57 118.94 118.87 1ue9 s TRP 43 Ca 0.52 -0.28 -0.07 0.00 -2.12 0.00 0.00 56.10 54.15 1ue9 s TRP 43 Cb -0.22 -1.53 0.14 0.00 -0.81 0.00 0.00 33.47 31.05 1ue9 s TRP 43 CO 0.22 0.13 0.40 -1.14 -0.51 0.00 0.00 176.95 176.05 1ue9 s GLN 44 N -0.91 2.57 0.33 4.98 0.74 0.33 -1.25 119.66 126.45 1ue9 s GLN 44 Ca 0.12 -2.08 0.02 0.00 0.05 0.00 0.00 55.36 53.47 1ue9 s GLN 44 Cb -0.10 -3.88 -0.01 0.00 1.10 0.00 0.00 33.01 30.12 1ue9 s GLN 44 CO 0.01 -1.18 0.06 0.41 -0.55 0.00 0.00 175.29 174.04 1ue9 n GLY 45 N 4.34 3.58 3.13 2.59 0.00 -1.19 0.12 105.19 117.75 1ue9 n GLY 45 Ca 0.00 -2.17 -0.28 0.00 0.00 0.00 0.00 46.02 43.57 1ue9 n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ue9 s GLU 46 N -3.23 2.27 0.15 1.61 2.12 0.26 -3.11 118.70 118.77 1ue9 s GLU 46 Ca 0.09 -0.64 -0.31 0.00 0.36 0.00 0.00 54.97 54.46 1ue9 s GLU 46 Cb 0.00 -1.80 -0.11 0.00 0.26 0.00 0.00 34.13 32.48 1ue9 s GLU 46 CO 0.06 0.13 1.78 -1.17 -0.54 0.00 0.00 175.26 175.53 1ue9 s LEU 47 N 0.41 4.39 -0.22 2.70 0.20 -0.89 -0.52 118.68 124.75 1ue9 s LEU 47 Ca -0.14 2.78 0.03 0.00 0.69 0.00 0.00 54.13 57.49 1ue9 s LEU 47 Cb -0.16 -3.58 0.36 0.00 -0.43 0.00 0.00 46.19 42.38 1ue9 s LEU 47 CO 0.06 -0.99 1.42 0.00 -0.29 0.00 0.00 176.35 176.55 1ue9 n GLN 48 N 5.08 1.85 -3.76 1.98 1.13 0.27 -4.62 117.38 119.32 1ue9 n GLN 48 Ca 0.17 -1.56 -0.26 0.00 -1.94 0.00 0.00 57.00 53.41 1ue9 n GLN 48 Cb 0.37 -1.65 -0.17 0.00 0.11 0.00 0.00 30.24 28.90 1ue9 n GLN 48 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ue9 s ALA 49 N -1.73 0.88 1.06 -1.58 0.00 -1.26 -4.83 121.76 114.30 1ue9 s ALA 49 Ca 0.29 -0.44 -0.24 0.00 0.00 0.00 0.00 51.96 51.58 1ue9 s ALA 49 Cb 0.24 -0.98 -0.06 0.00 0.00 0.00 0.00 23.12 22.33 1ue9 s ALA 49 CO 0.06 -0.83 -0.85 0.54 0.00 0.00 0.00 175.76 174.68 1ue9 n ARG 50 N 5.09 -0.75 -0.15 0.00 1.74 -1.26 -4.89 116.66 116.44 1ue9 n ARG 50 Ca -0.08 -0.21 0.00 0.00 -0.77 0.00 0.00 57.85 56.78 1ue9 n ARG 50 Cb 0.49 -1.32 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 1ue9 n ARG 50 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ue9 n GLY 51 N 2.84 -0.58 0.37 -0.13 0.00 -1.26 -4.99 105.19 101.44 1ue9 n GLY 51 Ca -0.01 -0.65 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 1ue9 n GLY 51 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ue9 h LYS 52 N 0.00 -0.06 -2.82 1.61 3.11 -2.06 -3.45 116.57 112.91 1ue9 h LYS 52 Ca 0.00 0.00 0.07 0.00 -2.81 0.00 0.00 60.65 57.91 1ue9 h LYS 52 Cb 0.00 0.01 -0.09 0.00 -1.00 0.00 0.00 32.23 31.16 1ue9 h LYS 52 CO 0.00 -0.04 0.29 0.15 -2.81 0.00 0.00 179.45 177.04 1ue9 s LYS 53 N -5.17 1.44 -0.55 1.90 1.02 -1.26 -5.09 119.74 112.03 1ue9 s LYS 53 Ca -0.11 -0.71 -0.43 0.00 0.02 0.00 0.00 55.97 54.75 1ue9 s LYS 53 Cb 0.09 0.55 -0.19 0.00 -0.52 0.00 0.00 37.83 37.75 1ue9 s LYS 53 CO 0.53 -0.65 2.19 0.54 -0.92 0.00 0.00 175.35 177.04 1ue9 n ARG 54 N -0.42 0.00 -2.74 1.68 5.12 -1.26 -4.84 116.66 114.21 1ue9 n ARG 54 Ca -0.09 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.42 1ue9 n ARG 54 Cb 0.61 -1.50 -0.04 0.00 -1.16 0.00 0.00 32.46 30.38 1ue9 n ARG 54 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1ue9 s GLN 55 N 6.28 4.59 -0.30 5.56 1.11 -1.26 -5.01 119.66 130.63 1ue9 s GLN 55 Ca 1.21 1.39 -0.15 0.00 0.01 0.00 0.00 55.36 57.82 1ue9 s GLN 55 Cb -1.48 -3.43 0.16 0.00 -1.01 0.00 0.00 33.01 27.24 1ue9 s GLN 55 CO 0.64 0.04 0.98 0.21 0.01 0.00 0.00 175.29 177.17 1ue9 s LYS 56 N 0.70 0.33 0.00 2.91 2.36 -1.26 -2.09 119.74 122.69 1ue9 s LYS 56 Ca 0.49 0.71 0.00 0.00 -2.55 0.00 0.00 55.97 54.62 1ue9 s LYS 56 Cb -0.21 0.28 0.00 0.00 -1.05 0.00 0.00 37.83 36.85 1ue9 s LYS 56 CO 0.28 -0.09 0.00 0.41 1.55 0.00 0.00 175.35 177.50 1ue9 n GLY 57 N 4.40 0.92 3.47 5.54 0.00 -1.18 -4.80 105.19 113.53 1ue9 n GLY 57 Ca -0.13 -0.81 -0.37 0.00 0.00 0.00 0.00 46.02 44.70 1ue9 n GLY 57 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ue9 s TRP 58 N -3.57 3.12 0.17 1.61 0.52 0.19 -3.18 118.94 117.80 1ue9 s TRP 58 Ca 0.00 -0.36 0.04 0.00 0.02 0.00 0.00 56.10 55.80 1ue9 s TRP 58 Cb 0.00 -2.28 -0.05 0.00 -1.15 0.00 0.00 33.47 29.99 1ue9 s TRP 58 CO 0.00 -0.34 -0.08 -0.59 0.02 0.00 0.00 176.95 175.96 1ue9 s PHE 59 N 1.64 1.37 0.04 -1.98 -0.12 -0.38 -2.53 117.98 116.02 1ue9 s PHE 59 Ca 0.06 -0.79 -0.30 0.00 -0.05 0.00 0.00 56.93 55.84 1ue9 s PHE 59 Cb -0.16 -0.73 -0.05 0.00 -0.63 0.00 0.00 43.02 41.46 1ue9 s PHE 59 CO 0.05 0.06 1.18 -1.25 -0.05 0.00 0.00 175.22 175.21 1ue9 s PRO 60 N -3.77 4.43 0.51 1.99 0.04 -1.26 0.10 135.00 137.04 1ue9 s PRO 60 Ca 0.20 1.72 0.32 0.00 0.04 0.00 0.00 61.00 63.28 1ue9 s PRO 60 Cb 0.03 -3.40 1.26 0.00 0.04 0.00 0.00 34.50 32.44 1ue9 s PRO 60 CO 0.03 -0.27 1.93 0.00 0.04 0.00 0.00 177.00 178.74 1ue9 h ALA 61 N 6.92 1.00 0.00 8.56 0.00 -1.50 -2.22 119.26 132.02 1ue9 h ALA 61 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1ue9 h ALA 61 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1ue9 h ALA 61 CO 0.82 0.00 0.00 0.43 0.00 0.00 0.00 179.25 180.50 1ue9 n SER 62 N -3.00 0.08 -0.66 0.00 7.64 -1.26 -0.14 113.62 116.28 1ue9 n SER 62 Ca 0.01 0.53 0.12 0.00 1.01 0.00 0.00 58.87 60.54 1ue9 n SER 62 Cb 0.31 -0.54 0.18 0.00 -1.01 0.00 0.00 64.21 63.15 1ue9 n SER 62 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1ue9 n HIS 63 N -1.60 0.00 -4.31 1.43 -0.00 -0.83 -4.79 115.22 105.12 1ue9 n HIS 63 Ca 0.02 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.55 1ue9 n HIS 63 Cb 0.10 -0.01 -0.09 0.00 -0.00 0.00 0.00 29.99 29.99 1ue9 n HIS 63 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 1ue9 s VAL 64 N -2.19 0.15 -0.04 1.59 -7.23 0.80 0.02 120.40 113.50 1ue9 s VAL 64 Ca 0.27 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.43 1ue9 s VAL 64 Cb 0.20 -2.49 0.03 0.00 0.56 0.00 0.00 36.38 34.68 1ue9 s VAL 64 CO 0.41 0.00 0.07 -1.59 -0.31 0.00 0.00 175.10 173.68 1ue9 s LYS 65 N -3.70 0.00 0.29 4.82 -2.85 -0.20 -4.76 119.74 113.34 1ue9 s LYS 65 Ca 0.37 0.26 -0.30 0.00 -1.00 0.00 0.00 55.97 55.31 1ue9 s LYS 65 Cb 0.04 -0.24 -0.11 0.00 -2.06 0.00 0.00 37.83 35.46 1ue9 s LYS 65 CO 0.21 -0.18 1.56 -0.51 0.10 0.00 0.00 175.35 176.53 1ue9 s LEU 66 N 1.18 4.35 -0.05 2.77 1.43 -1.26 -0.34 118.68 126.75 1ue9 s LEU 66 Ca -0.08 2.90 0.11 0.00 -1.03 0.00 0.00 54.13 56.03 1ue9 s LEU 66 Cb -0.13 -3.63 0.41 0.00 0.03 0.00 0.00 46.19 42.87 1ue9 s LEU 66 CO -0.04 -0.87 1.27 0.18 0.23 0.00 0.00 176.35 177.12 1ue9 n LEU 67 N 2.14 2.84 0.00 1.79 4.77 -0.88 -4.87 117.00 122.79 1ue9 n LEU 67 Ca 0.08 -1.43 0.00 0.00 -0.03 0.00 0.00 56.01 54.63 1ue9 n LEU 67 Cb 0.38 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1ue9 n LEU 67 CO 0.63 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.83 1ue9 n GLY 68 N 0.85 0.92 3.62 -0.72 0.00 -1.26 -4.38 105.19 104.22 1ue9 n GLY 68 Ca 0.15 -0.71 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 1ue9 n GLY 68 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ue9 s PRO 69 N 0.00 3.84 0.23 1.61 0.04 -1.26 -4.68 135.00 134.78 1ue9 s PRO 69 Ca 0.00 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1ue9 s PRO 69 Cb 0.00 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.62 1ue9 s PRO 69 CO 0.00 -1.22 0.00 0.45 0.04 0.00 0.00 177.00 176.27 1ue9 n SER 70 N 7.93 -0.69 -4.66 6.66 2.88 -1.26 -5.08 113.62 119.40 1ue9 n SER 70 Ca 0.15 0.40 -0.58 0.00 -1.33 0.00 0.00 58.87 57.52 1ue9 n SER 70 Cb 0.47 0.81 -0.07 0.00 -0.75 0.00 0.00 64.21 64.66 1ue9 n SER 70 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1ue9 n SER 71 N -3.17 1.70 -4.65 -3.46 3.41 -1.26 -4.77 113.62 101.42 1ue9 n SER 71 Ca 0.00 1.12 -0.43 0.00 -0.26 0.00 0.00 58.87 59.30 1ue9 n SER 71 Cb 0.00 -1.09 -0.03 0.00 -0.26 0.00 0.00 64.21 62.83 1ue9 n SER 71 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1ue9 n GLU 72 N 3.85 2.63 -2.67 4.33 0.28 -1.26 -4.91 120.64 122.89 1ue9 n GLU 72 Ca 0.24 0.93 -0.43 0.00 -0.16 0.00 0.00 57.16 57.74 1ue9 n GLU 72 Cb 0.11 -3.03 -0.02 0.00 1.43 0.00 0.00 31.44 29.93 1ue9 n GLU 72 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1ue9 s ARG 73 N 4.85 4.08 -0.01 3.44 0.52 -1.26 -4.96 118.95 125.61 1ue9 s ARG 73 Ca 0.92 1.07 -0.00 0.00 -0.52 0.00 0.00 55.73 57.19 1ue9 s ARG 73 Cb -0.44 -3.72 0.01 0.00 0.52 0.00 0.00 34.95 31.32 1ue9 s ARG 73 CO 0.41 -0.85 0.02 0.00 0.02 0.00 0.00 175.30 174.90 1ue9 s ALA 74 N 3.53 0.03 -0.01 2.13 0.00 -1.26 -5.11 121.76 121.07 1ue9 s ALA 74 Ca 0.44 0.14 -0.39 0.00 0.00 0.00 0.00 51.96 52.15 1ue9 s ALA 74 Cb -0.13 -0.11 -0.18 0.00 0.00 0.00 0.00 23.12 22.71 1ue9 s ALA 74 CO 0.14 -0.05 1.32 0.43 0.00 0.00 0.00 175.76 177.60 1ue9 n SER 75 N 3.55 1.21 -2.42 0.00 7.64 -1.26 -4.87 113.62 117.46 1ue9 n SER 75 Ca -0.19 1.13 -0.03 0.00 1.01 0.00 0.00 58.87 60.79 1ue9 n SER 75 Cb 0.56 -1.09 0.01 0.00 -1.01 0.00 0.00 64.21 62.68 1ue9 n SER 75 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ue9 n GLY 76 N 2.48 2.06 3.75 0.23 0.00 -1.26 -5.08 105.19 107.38 1ue9 n GLY 76 Ca 0.20 -2.15 -0.40 0.00 0.00 0.00 0.00 46.02 43.67 1ue9 n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ue9 s PRO 77 N -2.37 4.65 0.22 1.61 0.04 -1.26 -5.00 135.00 132.89 1ue9 s PRO 77 Ca 0.08 1.76 -0.30 0.00 0.04 0.00 0.00 61.00 62.59 1ue9 s PRO 77 Cb -0.01 -3.21 -0.09 0.00 0.04 0.00 0.00 34.50 31.24 1ue9 s PRO 77 CO 0.05 0.22 1.13 -1.54 0.04 0.00 0.00 177.00 176.91 1ue9 s SER 78 N -0.80 7.20 -0.05 6.66 1.04 -1.26 -4.97 113.70 121.53 1ue9 s SER 78 Ca 0.45 2.22 -0.15 0.00 0.48 0.00 0.00 55.95 58.94 1ue9 s SER 78 Cb -0.31 -2.62 -0.10 0.00 0.10 0.00 0.00 66.02 63.10 1ue9 s SER 78 CO 0.39 -0.24 0.63 -1.28 0.98 0.00 0.00 173.24 173.73 1ue9 h SER 79 N 4.58 -0.35 0.00 7.02 0.87 -2.00 -3.56 113.55 120.11 1ue9 h SER 79 Ca -0.45 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.02 1ue9 h SER 79 Cb 1.21 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 1ue9 h SER 79 CO 0.71 0.13 0.00 0.61 -0.53 0.00 0.00 176.83 177.74