#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ue9 n SER 2 N 0.00 2.02 -4.15 1.61 2.88 -1.26 -4.88 113.62 109.84 1ue9 n SER 2 Ca 0.00 -0.81 -0.35 0.00 -1.33 0.00 0.00 58.87 56.38 1ue9 n SER 2 Cb 0.00 -1.57 -0.13 0.00 -0.75 0.00 0.00 64.21 61.75 1ue9 n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1ue9 s SER 3 N 11.53 4.95 -0.99 -3.46 0.01 -1.26 -5.01 113.70 119.49 1ue9 s SER 3 Ca 0.98 -1.50 -0.01 0.00 1.31 0.00 0.00 55.95 56.73 1ue9 s SER 3 Cb -0.21 -1.73 0.32 0.00 0.21 0.00 0.00 66.02 64.61 1ue9 s SER 3 CO 0.22 -0.33 1.62 0.61 0.41 0.00 0.00 173.24 175.77 1ue9 n GLY 4 N 4.59 5.81 3.46 3.44 0.00 -1.26 -4.95 105.19 116.27 1ue9 n GLY 4 Ca -0.10 -2.63 -0.11 0.00 0.00 0.00 0.00 46.02 43.19 1ue9 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ue9 s SER 5 N -1.71 -0.49 -0.28 1.61 1.04 -1.26 -5.17 113.70 107.44 1ue9 s SER 5 Ca 0.38 0.01 -0.20 0.00 0.48 0.00 0.00 55.95 56.62 1ue9 s SER 5 Cb 0.16 0.51 0.11 0.00 0.10 0.00 0.00 66.02 66.91 1ue9 s SER 5 CO -0.07 -0.82 0.90 -0.55 0.98 0.00 0.00 173.24 173.69 1ue9 s SER 6 N -2.62 -0.61 -0.05 7.02 0.15 -1.26 -5.18 113.70 111.15 1ue9 s SER 6 Ca 0.03 1.06 -0.31 0.00 0.70 0.00 0.00 55.95 57.42 1ue9 s SER 6 Cb -0.01 1.17 0.12 0.00 -1.71 0.00 0.00 66.02 65.60 1ue9 s SER 6 CO -0.11 -0.17 1.35 -0.83 1.20 0.00 0.00 173.24 174.67 1ue9 s GLY 7 N 0.92 -0.38 -0.28 9.45 0.00 -1.26 -5.12 107.32 110.64 1ue9 s GLY 7 Ca -0.04 0.63 -0.29 0.00 0.00 0.00 0.00 44.72 45.02 1ue9 s GLY 7 CO -0.11 1.65 1.35 -0.54 0.00 0.00 0.00 173.10 175.44 1ue9 s GLU 8 N -2.18 3.91 0.12 2.90 2.02 -1.26 -4.94 118.70 119.27 1ue9 s GLU 8 Ca 0.19 1.32 -0.05 0.00 0.02 0.00 0.00 54.97 56.45 1ue9 s GLU 8 Cb 0.05 -3.90 -0.05 0.00 0.10 0.00 0.00 34.13 30.32 1ue9 s GLU 8 CO -0.04 -1.14 0.35 0.42 0.02 0.00 0.00 175.26 174.87 1ue9 s ILE 9 N 4.47 5.20 -0.00 -1.63 -1.09 -1.26 -0.93 121.20 125.95 1ue9 s ILE 9 Ca 0.58 0.02 0.02 0.00 -2.23 0.00 0.00 60.65 59.04 1ue9 s ILE 9 Cb -0.18 -3.62 -0.01 0.00 -1.58 0.00 0.00 42.46 37.07 1ue9 s ILE 9 CO 0.24 0.09 -0.07 0.00 -1.23 0.00 0.00 174.94 173.97 1ue9 s ALA 10 N -1.60 0.58 -0.25 9.38 0.00 -1.06 -2.62 121.76 126.18 1ue9 s ALA 10 Ca 0.39 -0.31 -0.08 0.00 0.00 0.00 0.00 51.96 51.96 1ue9 s ALA 10 Cb -0.12 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 1ue9 s ALA 10 CO 0.24 0.14 0.11 -1.14 0.00 0.00 0.00 175.76 175.10 1ue9 s GLN 11 N -0.19 3.77 0.16 0.00 0.74 -0.04 -2.96 119.66 121.14 1ue9 s GLN 11 Ca 0.02 -0.42 -0.32 0.00 0.05 0.00 0.00 55.36 54.70 1ue9 s GLN 11 Cb -0.03 -3.42 -0.10 0.00 1.10 0.00 0.00 33.01 30.56 1ue9 s GLN 11 CO -0.00 -0.15 1.58 0.08 -0.55 0.00 0.00 175.29 176.24 1ue9 s VAL 12 N 1.57 2.61 -0.07 1.34 1.01 -1.21 -0.24 120.40 125.41 1ue9 s VAL 12 Ca 0.06 0.43 0.05 0.00 0.00 0.00 0.00 61.98 62.52 1ue9 s VAL 12 Cb -0.15 -3.28 -0.07 0.00 0.00 0.00 0.00 36.38 32.88 1ue9 s VAL 12 CO 0.06 0.03 0.14 0.35 0.00 0.00 0.00 175.10 175.68 1ue9 n THR 13 N 3.99 0.00 -3.74 3.92 -2.24 0.22 -3.56 114.28 112.86 1ue9 n THR 13 Ca 0.14 -0.19 -0.14 0.00 -2.27 0.00 0.00 64.05 61.59 1ue9 n THR 13 Cb 0.38 0.56 -0.15 0.00 -2.10 0.00 0.00 70.33 69.02 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 -2.28 -0.01 0.51 3.42 0.01 -0.07 -4.92 113.70 110.35 1ue9 s SER 14 Ca -0.01 0.27 -0.23 0.00 1.31 0.00 0.00 55.95 57.29 1ue9 s SER 14 Cb 0.03 0.16 -0.06 0.00 0.21 0.00 0.00 66.02 66.36 1ue9 s SER 14 CO 0.21 -0.15 1.31 0.00 0.41 0.00 0.00 173.24 175.02 1ue9 s ALA 15 N 1.26 2.92 0.07 1.44 0.00 -1.26 -4.65 121.76 121.53 1ue9 s ALA 15 Ca -0.08 1.24 0.02 0.00 0.00 0.00 0.00 51.96 53.14 1ue9 s ALA 15 Cb -0.12 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 1ue9 s ALA 15 CO -0.06 -1.15 -0.07 -0.47 0.00 0.00 0.00 175.76 174.01 1ue9 s TYR 16 N -1.35 0.79 -0.15 0.00 5.04 0.59 -4.97 117.35 117.31 1ue9 s TYR 16 Ca 0.68 -0.70 -0.01 0.00 -2.44 0.00 0.00 57.07 54.60 1ue9 s TYR 16 Cb -0.38 -0.46 0.04 0.00 0.35 0.00 0.00 41.96 41.51 1ue9 s TYR 16 CO 0.45 -0.11 -0.05 0.08 -1.34 0.00 0.00 175.55 174.58 1ue9 s VAL 17 N -2.49 1.05 0.98 3.14 1.01 -1.26 -3.12 120.40 119.71 1ue9 s VAL 17 Ca 0.01 -0.51 -0.14 0.00 0.00 0.00 0.00 61.98 61.34 1ue9 s VAL 17 Cb -0.02 -1.19 0.02 0.00 0.00 0.00 0.00 36.38 35.19 1ue9 s VAL 17 CO -0.02 0.19 0.20 0.00 0.00 0.00 0.00 175.10 175.47 1ue9 n ALA 18 N 4.91 -3.16 -2.20 5.51 0.00 -1.26 -4.95 120.51 119.36 1ue9 n ALA 18 Ca -0.12 -0.73 -0.03 0.00 0.00 0.00 0.00 53.44 52.56 1ue9 n ALA 18 Cb 0.48 -1.68 -0.03 0.00 0.00 0.00 0.00 19.45 18.22 1ue9 n ALA 18 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ue9 n SER 19 N -0.84 -0.37 0.00 0.00 2.88 -1.26 -5.07 113.62 108.96 1ue9 n SER 19 Ca 0.05 -2.01 0.00 0.00 -1.33 0.00 0.00 58.87 55.58 1ue9 n SER 19 Cb 0.55 0.12 0.00 0.00 -0.75 0.00 0.00 64.21 64.13 1ue9 n SER 19 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ue9 n GLY 20 N 0.07 4.19 0.02 0.46 0.00 -1.26 -5.08 105.19 103.59 1ue9 n GLY 20 Ca -0.17 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1ue9 n GLY 20 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ue9 n SER 21 N 0.00 3.43 -2.32 1.61 7.64 -1.26 -4.73 113.62 117.99 1ue9 n SER 21 Ca 0.00 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.54 1ue9 n SER 21 Cb 0.00 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.28 1ue9 n SER 21 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ue9 n GLU 22 N -2.39 2.63 -4.29 1.43 4.71 -1.26 -4.94 120.64 116.54 1ue9 n GLU 22 Ca 0.00 -3.18 -0.29 0.00 -0.01 0.00 0.00 57.16 53.68 1ue9 n GLU 22 Cb 0.44 -2.24 -0.11 0.00 -1.01 0.00 0.00 31.44 28.52 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 -3.70 1.86 -0.09 3.49 1.11 -1.26 -0.67 119.66 120.40 1ue9 s GLN 23 Ca 0.62 -1.17 0.04 0.00 0.01 0.00 0.00 55.36 54.86 1ue9 s GLN 23 Cb 0.49 -2.15 0.00 0.00 -1.01 0.00 0.00 33.01 30.34 1ue9 s GLN 23 CO -0.02 0.48 -0.23 -1.17 0.01 0.00 0.00 175.29 174.36 1ue9 s LEU 24 N -2.24 2.05 0.10 2.90 2.96 0.88 -4.51 118.68 120.82 1ue9 s LEU 24 Ca 0.19 -0.53 -0.30 0.00 -0.22 0.00 0.00 54.13 53.27 1ue9 s LEU 24 Cb -0.10 -1.36 -0.06 0.00 0.50 0.00 0.00 46.19 45.17 1ue9 s LEU 24 CO 0.11 0.16 1.16 -0.44 -1.32 0.00 0.00 176.35 176.02 1ue9 s SER 25 N 0.33 7.14 -0.02 3.68 0.01 -1.26 -4.63 113.70 118.95 1ue9 s SER 25 Ca -0.18 2.03 0.01 0.00 1.31 0.00 0.00 55.95 59.13 1ue9 s SER 25 Cb -0.18 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.43 1ue9 s SER 25 CO 0.08 -0.39 0.00 -0.76 0.41 0.00 0.00 173.24 172.58 1ue9 s LEU 26 N 0.61 3.54 0.02 2.44 1.43 -1.18 -4.97 118.68 120.57 1ue9 s LEU 26 Ca 0.56 0.03 0.05 0.00 -1.03 0.00 0.00 54.13 53.73 1ue9 s LEU 26 Cb -0.29 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 1ue9 s LEU 26 CO 0.31 0.30 -0.16 0.00 0.23 0.00 0.00 176.35 177.03 1ue9 s ALA 27 N -1.05 1.30 -0.33 4.21 0.00 -1.26 -0.30 121.76 124.34 1ue9 s ALA 27 Ca 0.18 -0.81 -0.29 0.00 0.00 0.00 0.00 51.96 51.04 1ue9 s ALA 27 Cb -0.11 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.75 1ue9 s ALA 27 CO 0.09 0.28 1.36 -1.25 0.00 0.00 0.00 175.76 176.24 1ue9 s PRO 28 N -0.90 3.80 0.00 0.00 0.04 -1.26 -2.91 135.00 133.77 1ue9 s PRO 28 Ca 0.04 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1ue9 s PRO 28 Cb -0.07 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.53 1ue9 s PRO 28 CO 0.01 -1.27 0.00 0.41 0.04 0.00 0.00 177.00 176.19 1ue9 n GLY 29 N 4.57 1.66 3.64 0.56 0.00 -1.23 -5.03 105.19 109.37 1ue9 n GLY 29 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1ue9 n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ue9 s GLN 30 N -0.25 2.00 -0.02 1.61 -0.21 -1.14 -5.04 119.66 116.61 1ue9 s GLN 30 Ca 0.00 -2.18 0.05 0.00 0.02 0.00 0.00 55.36 53.25 1ue9 s GLN 30 Cb 0.00 -1.48 -0.01 0.00 1.00 0.00 0.00 33.01 32.52 1ue9 s GLN 30 CO 0.00 -0.18 -0.18 -0.51 -2.12 0.00 0.00 175.29 172.30 1ue9 s LEU 31 N -3.73 2.01 0.07 2.90 1.43 -1.26 -3.34 118.68 116.76 1ue9 s LEU 31 Ca 0.26 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1ue9 s LEU 31 Cb 0.07 -0.93 -0.03 0.00 0.03 0.00 0.00 46.19 45.33 1ue9 s LEU 31 CO 0.13 0.21 -0.12 -0.63 0.23 0.00 0.00 176.35 176.17 1ue9 s ILE 32 N -0.35 0.92 -0.30 -0.59 1.01 -1.16 0.15 121.20 120.90 1ue9 s ILE 32 Ca 0.05 -1.31 -0.08 0.00 0.00 0.00 0.00 60.65 59.31 1ue9 s ILE 32 Cb -0.08 -1.00 0.00 0.00 0.01 0.00 0.00 42.46 41.39 1ue9 s ILE 32 CO -0.00 -0.34 0.10 -0.22 0.00 0.00 0.00 174.94 174.48 1ue9 s LEU 33 N -1.84 3.89 -0.05 2.97 0.20 0.11 -2.55 118.68 121.42 1ue9 s LEU 33 Ca -0.03 -0.60 -0.30 0.00 0.69 0.00 0.00 54.13 53.89 1ue9 s LEU 33 Cb -0.09 -1.92 -0.05 0.00 -0.43 0.00 0.00 46.19 43.70 1ue9 s LEU 33 CO 0.01 -0.18 1.56 -0.63 -0.29 0.00 0.00 176.35 176.82 1ue9 s ILE 34 N 1.55 3.64 -0.12 6.68 -1.09 -0.11 -0.14 121.20 131.60 1ue9 s ILE 34 Ca 0.04 0.86 -0.00 0.00 -2.23 0.00 0.00 60.65 59.31 1ue9 s ILE 34 Cb -0.17 -3.55 -0.08 0.00 -1.58 0.00 0.00 42.46 37.08 1ue9 s ILE 34 CO 0.04 -0.06 -0.12 0.18 -1.23 0.00 0.00 174.94 173.75 1ue9 n LEU 35 N 6.59 2.63 -4.07 2.97 4.77 0.35 -4.38 117.00 125.85 1ue9 n LEU 35 Ca 0.16 -0.03 -0.09 0.00 -0.03 0.00 0.00 56.01 56.02 1ue9 n LEU 35 Cb 0.43 -0.42 -0.10 0.00 -2.33 0.00 0.00 43.42 41.00 1ue9 n LEU 35 CO 0.61 0.63 -0.37 -0.75 -1.33 0.00 0.00 177.39 176.18 1ue9 s LYS 36 N -2.24 0.55 0.21 3.23 2.47 0.22 -4.97 119.74 119.21 1ue9 s LYS 36 Ca -0.17 -1.01 0.03 0.00 -1.56 0.00 0.00 55.97 53.27 1ue9 s LYS 36 Cb 0.05 0.05 -0.05 0.00 -1.46 0.00 0.00 37.83 36.42 1ue9 s LYS 36 CO 0.27 -0.06 -0.02 0.15 0.16 0.00 0.00 175.35 175.85 1ue9 s LYS 37 N -2.92 1.24 0.02 4.03 1.02 -1.26 0.79 119.74 122.66 1ue9 s LYS 37 Ca -0.01 -1.61 -0.00 0.00 0.02 0.00 0.00 55.97 54.37 1ue9 s LYS 37 Cb 0.00 -0.54 -0.02 0.00 -0.52 0.00 0.00 37.83 36.75 1ue9 s LYS 37 CO -0.05 -0.08 -0.02 1.21 -0.92 0.00 0.00 175.35 175.49 1ue9 s ASN 38 N -3.26 0.24 0.24 2.83 2.47 -0.59 -4.91 114.94 111.97 1ue9 s ASN 38 Ca 0.26 -0.50 -0.07 0.00 0.42 0.00 0.00 52.86 52.97 1ue9 s ASN 38 Cb 0.05 0.11 0.24 0.00 -1.45 0.00 0.00 41.25 40.20 1ue9 s ASN 38 CO 0.06 -0.32 1.90 0.71 -3.72 0.00 0.00 177.10 175.74 1ue9 h THR 39 N 4.57 1.26 -0.49 -5.21 1.35 -2.02 -2.33 112.91 110.03 1ue9 h THR 39 Ca -0.32 -0.52 0.06 0.00 -0.55 0.00 0.00 66.41 65.08 1ue9 h THR 39 Cb 1.21 -0.12 -0.05 0.00 -1.73 0.00 0.00 68.15 67.45 1ue9 h THR 39 CO 0.42 0.26 0.18 -1.28 -0.25 0.00 0.00 175.52 174.85 1ue9 h SER 40 N 1.31 0.20 0.00 5.36 0.87 -2.04 -3.46 113.55 115.79 1ue9 h SER 40 Ca 0.35 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.96 1ue9 h SER 40 Cb -0.09 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1ue9 h SER 40 CO -0.07 0.14 0.00 0.61 -0.53 0.00 0.00 176.83 176.98 1ue9 n GLY 41 N -1.26 0.76 3.69 5.77 0.00 -0.88 -5.05 105.19 108.22 1ue9 n GLY 41 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 2.57 -0.02 1.61 0.52 -1.26 -2.27 118.94 120.10 1ue9 s TRP 42 Ca 0.00 0.48 0.05 0.00 0.02 0.00 0.00 56.10 56.65 1ue9 s TRP 42 Cb 0.00 -3.87 -0.03 0.00 -1.15 0.00 0.00 33.47 28.43 1ue9 s TRP 42 CO 0.00 -3.40 -0.15 -1.58 0.02 0.00 0.00 176.95 171.84 1ue9 s TRP 43 N 2.56 2.66 -0.51 -1.98 0.52 0.42 -1.54 118.94 121.07 1ue9 s TRP 43 Ca 0.71 -0.19 -0.06 0.00 0.02 0.00 0.00 56.10 56.57 1ue9 s TRP 43 Cb -0.37 -1.57 0.13 0.00 -1.15 0.00 0.00 33.47 30.51 1ue9 s TRP 43 CO 0.30 0.21 0.34 -1.14 0.02 0.00 0.00 176.95 176.69 1ue9 s GLN 44 N -0.99 2.40 0.16 4.98 0.74 0.24 -0.04 119.66 127.14 1ue9 s GLN 44 Ca 0.13 -2.00 0.01 0.00 0.05 0.00 0.00 55.36 53.55 1ue9 s GLN 44 Cb -0.11 -3.80 -0.00 0.00 1.10 0.00 0.00 33.01 30.20 1ue9 s GLN 44 CO 0.02 -1.16 0.03 0.41 -0.55 0.00 0.00 175.29 174.05 1ue9 n GLY 45 N 4.43 3.89 3.12 2.59 0.00 -1.11 0.71 105.19 118.82 1ue9 n GLY 45 Ca -0.01 -2.12 -0.28 0.00 0.00 0.00 0.00 46.02 43.61 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 -2.59 2.26 -0.12 1.61 2.12 0.80 -2.77 118.70 120.00 1ue9 s GLU 46 Ca 0.04 -0.63 -0.29 0.00 0.36 0.00 0.00 54.97 54.45 1ue9 s GLU 46 Cb 0.00 -1.79 -0.06 0.00 0.26 0.00 0.00 34.13 32.55 1ue9 s GLU 46 CO 0.03 0.12 1.95 -1.17 -0.54 0.00 0.00 175.26 175.64 1ue9 s LEU 47 N 0.44 3.96 -0.26 2.70 0.20 0.82 0.09 118.68 126.63 1ue9 s LEU 47 Ca -0.15 2.11 0.02 0.00 0.69 0.00 0.00 54.13 56.80 1ue9 s LEU 47 Cb -0.16 -3.52 0.35 0.00 -0.43 0.00 0.00 46.19 42.43 1ue9 s LEU 47 CO 0.06 -1.41 1.57 0.00 -0.29 0.00 0.00 176.35 176.28 1ue9 n GLN 48 N 7.97 1.72 -3.12 1.98 1.13 0.41 -4.24 117.38 123.23 1ue9 n GLN 48 Ca 0.23 -1.67 -0.19 0.00 -1.94 0.00 0.00 57.00 53.42 1ue9 n GLN 48 Cb 0.44 -1.66 -0.03 0.00 0.11 0.00 0.00 30.24 29.10 1ue9 n GLN 48 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ue9 n ALA 49 N -0.34 2.55 -3.65 -1.58 0.00 -1.24 -4.70 120.51 111.56 1ue9 n ALA 49 Ca 0.33 -3.62 0.01 0.00 0.00 0.00 0.00 53.44 50.16 1ue9 n ALA 49 Cb 1.08 -0.89 -0.06 0.00 0.00 0.00 0.00 19.45 19.57 1ue9 n ALA 49 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1ue9 s ARG 50 N -2.65 0.03 0.04 0.00 6.06 -1.26 -5.03 118.95 116.14 1ue9 s ARG 50 Ca 0.41 0.04 0.00 0.00 -2.50 0.00 0.00 55.73 53.68 1ue9 s ARG 50 Cb 0.34 0.01 -0.04 0.00 0.06 0.00 0.00 34.95 35.32 1ue9 s ARG 50 CO -0.09 -0.00 0.17 0.20 -2.50 0.00 0.00 175.30 173.08 1ue9 s GLY 51 N 0.69 2.14 0.00 8.12 0.00 -1.26 -4.60 107.32 112.40 1ue9 s GLY 51 Ca -0.03 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 43.83 1ue9 s GLY 51 CO -0.12 -0.82 0.00 1.17 0.00 0.00 0.00 173.10 173.34 1ue9 n LYS 52 N 0.53 0.00 -2.85 2.90 3.00 -1.26 -4.70 118.16 115.78 1ue9 n LYS 52 Ca -0.08 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.80 1ue9 n LYS 52 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.51 1ue9 n LYS 52 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1ue9 s LYS 53 N 0.00 3.38 -0.46 1.64 2.20 -1.26 -4.98 119.74 120.25 1ue9 s LYS 53 Ca 0.00 -1.27 -0.25 0.00 -0.36 0.00 0.00 55.97 54.09 1ue9 s LYS 53 Cb 0.00 -4.65 0.03 0.00 -1.51 0.00 0.00 37.83 31.70 1ue9 s LYS 53 CO 0.00 -1.84 0.90 1.03 -0.36 0.00 0.00 175.35 175.08 1ue9 s ARG 54 N 3.56 3.50 0.20 4.03 1.81 -1.26 -4.75 118.95 126.03 1ue9 s ARG 54 Ca 0.29 0.10 -0.30 0.00 -1.72 0.00 0.00 55.73 54.10 1ue9 s ARG 54 Cb -0.10 -3.93 -0.09 0.00 -0.45 0.00 0.00 34.95 30.38 1ue9 s ARG 54 CO -0.01 -1.22 1.28 -0.65 -0.68 0.00 0.00 175.30 174.02 1ue9 s GLN 55 N 3.69 4.42 -0.18 3.54 1.11 -1.26 -4.90 119.66 126.08 1ue9 s GLN 55 Ca 0.36 2.01 -0.09 0.00 0.01 0.00 0.00 55.36 57.64 1ue9 s GLN 55 Cb -0.10 -3.20 0.06 0.00 -1.01 0.00 0.00 33.01 28.75 1ue9 s GLN 55 CO 0.26 -0.21 0.43 0.21 0.01 0.00 0.00 175.29 175.99 1ue9 s LYS 56 N -0.18 0.41 0.00 2.91 2.36 -1.26 -0.12 119.74 123.85 1ue9 s LYS 56 Ca 0.55 0.83 0.00 0.00 -2.55 0.00 0.00 55.97 54.81 1ue9 s LYS 56 Cb -0.35 0.01 0.00 0.00 -1.05 0.00 0.00 37.83 36.44 1ue9 s LYS 56 CO 0.38 -0.16 0.00 0.41 1.55 0.00 0.00 175.35 177.53 1ue9 n GLY 57 N 4.35 -1.22 3.86 5.54 0.00 -1.12 -4.78 105.19 111.84 1ue9 n GLY 57 Ca -0.22 -0.98 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.25 3.61 0.13 1.61 0.52 0.15 -2.76 118.94 119.97 1ue9 s TRP 58 Ca 0.00 0.83 -0.18 0.00 0.02 0.00 0.00 56.10 56.77 1ue9 s TRP 58 Cb 0.00 -2.18 0.04 0.00 -1.15 0.00 0.00 33.47 30.18 1ue9 s TRP 58 CO 0.00 0.55 0.44 -0.59 0.02 0.00 0.00 176.95 177.37 1ue9 s PHE 59 N -1.33 -0.27 0.08 -1.98 -0.12 0.94 -0.08 117.98 115.22 1ue9 s PHE 59 Ca 0.31 -0.02 -0.30 0.00 -0.05 0.00 0.00 56.93 56.86 1ue9 s PHE 59 Cb -0.14 0.32 -0.06 0.00 -0.63 0.00 0.00 43.02 42.51 1ue9 s PHE 59 CO 0.17 -0.74 1.16 -1.25 -0.05 0.00 0.00 175.22 174.51 1ue9 s PRO 60 N -3.79 4.48 0.39 1.99 0.04 -1.26 0.16 135.00 137.01 1ue9 s PRO 60 Ca 0.03 1.73 0.28 0.00 0.04 0.00 0.00 61.00 63.07 1ue9 s PRO 60 Cb 0.01 -3.34 1.04 0.00 0.04 0.00 0.00 34.50 32.25 1ue9 s PRO 60 CO -0.12 -0.16 1.82 0.00 0.04 0.00 0.00 177.00 178.58 1ue9 h ALA 61 N 6.39 1.00 0.00 8.56 0.00 -1.79 -2.41 119.26 131.01 1ue9 h ALA 61 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 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 0.78 0.00 0.00 0.45 0.00 0.00 0.00 179.25 180.48 1ue9 n SER 62 N -2.68 0.16 0.02 0.00 2.88 -1.26 -1.12 113.62 111.62 1ue9 n SER 62 Ca 0.02 0.55 0.04 0.00 -1.33 0.00 0.00 58.87 58.15 1ue9 n SER 62 Cb 0.32 -0.58 -0.10 0.00 -0.75 0.00 0.00 64.21 63.10 1ue9 n SER 62 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1ue9 n HIS 63 N -1.69 0.58 -4.33 0.66 -0.00 -0.91 -4.82 115.22 104.73 1ue9 n HIS 63 Ca 0.02 0.18 -0.28 0.00 -0.00 0.00 0.00 57.72 57.65 1ue9 n HIS 63 Cb 0.13 -0.89 -0.06 0.00 -0.00 0.00 0.00 29.99 29.17 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 -3.12 1.79 -0.03 1.59 -7.23 -0.27 0.68 120.40 113.81 1ue9 s VAL 64 Ca -0.05 -1.78 0.00 0.00 -1.81 0.00 0.00 61.98 58.34 1ue9 s VAL 64 Cb 0.10 -2.57 0.03 0.00 0.56 0.00 0.00 36.38 34.49 1ue9 s VAL 64 CO 0.84 0.00 0.01 -1.59 -0.31 0.00 0.00 175.10 174.04 1ue9 s LYS 65 N -3.95 0.25 0.23 4.82 -2.85 0.67 -4.79 119.74 114.13 1ue9 s LYS 65 Ca 0.28 0.11 -0.31 0.00 -1.00 0.00 0.00 55.97 55.05 1ue9 s LYS 65 Cb 0.03 -0.47 -0.11 0.00 -2.06 0.00 0.00 37.83 35.22 1ue9 s LYS 65 CO 0.16 -0.15 1.58 -0.51 0.10 0.00 0.00 175.35 176.52 1ue9 s LEU 66 N 1.11 4.37 -0.06 2.77 1.43 -1.26 -0.86 118.68 126.17 1ue9 s LEU 66 Ca -0.09 2.79 0.09 0.00 -1.03 0.00 0.00 54.13 55.89 1ue9 s LEU 66 Cb -0.13 -3.61 0.37 0.00 0.03 0.00 0.00 46.19 42.84 1ue9 s LEU 66 CO -0.02 -0.86 1.20 0.18 0.23 0.00 0.00 176.35 177.08 1ue9 n LEU 67 N 3.03 2.66 0.00 1.79 4.77 -1.08 -4.90 117.00 123.27 1ue9 n LEU 67 Ca 0.11 -1.34 0.00 0.00 -0.03 0.00 0.00 56.01 54.75 1ue9 n LEU 67 Cb 0.38 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1ue9 n LEU 67 CO 0.62 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.76 1ue9 n GLY 68 N 0.71 1.85 0.20 -0.72 0.00 -1.26 -4.72 105.19 101.25 1ue9 n GLY 68 Ca 0.13 -2.01 -0.19 0.00 0.00 0.00 0.00 46.02 43.96 1ue9 n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ue9 h PRO 69 N 0.00 0.72 0.00 1.61 0.13 -1.96 -3.44 132.00 129.06 1ue9 h PRO 69 Ca 0.00 -0.70 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 1ue9 h PRO 69 Cb 0.00 0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.31 1ue9 h PRO 69 CO 0.00 1.29 -0.05 -1.13 -0.23 0.00 0.00 178.00 177.88 1ue9 n SER 70 N -3.88 0.04 -2.65 1.44 3.41 -1.26 -4.87 113.62 105.86 1ue9 n SER 70 Ca -0.09 0.31 -0.05 0.00 -0.26 0.00 0.00 58.87 58.78 1ue9 n SER 70 Cb 0.83 0.20 -0.04 0.00 -0.26 0.00 0.00 64.21 64.94 1ue9 n SER 70 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ue9 n SER 71 N -3.24 -1.91 -4.71 4.04 7.64 -1.26 -4.94 113.62 109.23 1ue9 n SER 71 Ca 0.00 1.35 -0.38 0.00 1.01 0.00 0.00 58.87 60.85 1ue9 n SER 71 Cb 0.03 -5.15 -0.06 0.00 -1.01 0.00 0.00 64.21 58.02 1ue9 n SER 71 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1ue9 s GLU 72 N -0.82 4.33 0.53 1.43 2.56 -1.26 -5.06 118.70 120.41 1ue9 s GLU 72 Ca -0.23 0.52 -0.11 0.00 0.00 0.00 0.00 54.97 55.15 1ue9 s GLU 72 Cb 0.02 -3.47 -0.05 0.00 2.00 0.00 0.00 34.13 32.63 1ue9 s GLU 72 CO 0.77 0.07 0.93 -0.98 -0.56 0.00 0.00 175.26 175.48 1ue9 s ARG 73 N 0.88 3.69 -0.46 4.30 1.70 -1.26 -5.05 118.95 122.76 1ue9 s ARG 73 Ca 0.28 0.63 0.04 0.00 -0.47 0.00 0.00 55.73 56.21 1ue9 s ARG 73 Cb -0.16 -2.21 0.19 0.00 -0.57 0.00 0.00 34.95 32.21 1ue9 s ARG 73 CO 0.11 -0.34 0.78 0.00 -1.08 0.00 0.00 175.30 174.78 1ue9 s ALA 74 N -2.83 -2.64 0.22 7.88 0.00 -1.26 -5.14 121.76 118.00 1ue9 s ALA 74 Ca 0.54 -0.07 -0.31 0.00 0.00 0.00 0.00 51.96 52.11 1ue9 s ALA 74 Cb -0.10 -2.78 -0.14 0.00 0.00 0.00 0.00 23.12 20.09 1ue9 s ALA 74 CO 0.43 -2.29 1.24 0.43 0.00 0.00 0.00 175.76 175.57 1ue9 n SER 75 N 3.19 1.97 -4.74 0.00 7.64 -1.26 -4.97 113.62 115.44 1ue9 n SER 75 Ca 0.15 1.15 -0.32 0.00 1.01 0.00 0.00 58.87 60.87 1ue9 n SER 75 Cb 0.58 -1.32 -0.07 0.00 -1.01 0.00 0.00 64.21 62.38 1ue9 n SER 75 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1ue9 s GLY 76 N 0.02 1.97 0.78 0.23 0.00 -1.26 -5.11 107.32 103.95 1ue9 s GLY 76 Ca 0.68 -0.97 -0.11 0.00 0.00 0.00 0.00 44.72 44.31 1ue9 s GLY 76 CO 0.53 -0.90 1.09 2.56 0.00 0.00 0.00 173.10 176.38 1ue9 s PRO 77 N -2.00 2.25 -0.29 2.90 0.04 -1.26 -5.08 135.00 131.55 1ue9 s PRO 77 Ca 0.25 0.70 -0.21 0.00 0.04 0.00 0.00 61.00 61.78 1ue9 s PRO 77 Cb -0.12 -1.93 0.16 0.00 0.04 0.00 0.00 34.50 32.65 1ue9 s PRO 77 CO 0.17 -1.52 1.16 -1.54 0.04 0.00 0.00 177.00 175.31 1ue9 s SER 78 N -3.88 -0.29 0.09 6.66 1.04 -1.26 -5.09 113.70 110.97 1ue9 s SER 78 Ca 0.60 0.51 0.00 0.00 0.48 0.00 0.00 55.95 57.54 1ue9 s SER 78 Cb -0.14 0.81 0.00 0.00 0.10 0.00 0.00 66.02 66.79 1ue9 s SER 78 CO 0.54 -0.08 0.00 -0.24 0.98 0.00 0.00 173.24 174.44 1ue9 n SER 79 N 2.67 0.89 0.00 7.02 2.88 -1.26 -5.36 113.62 120.47 1ue9 n SER 79 Ca -0.15 0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1ue9 n SER 79 Cb 0.57 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 1ue9 n SER 79 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42