#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhz s SER 2 N 0.00 4.85 -0.63 1.61 0.15 -1.26 -4.99 113.70 113.43 1uhz s SER 2 Ca 0.00 -2.93 0.05 0.00 0.70 0.00 0.00 55.95 53.77 1uhz s SER 2 Cb 0.00 -1.76 0.17 0.00 -1.71 0.00 0.00 66.02 62.72 1uhz s SER 2 CO 0.00 -0.31 0.45 -0.44 1.20 0.00 0.00 173.24 174.14 1uhz s SER 3 N 0.26 4.06 0.21 5.45 0.01 -1.26 -5.09 113.70 117.35 1uhz s SER 3 Ca 0.17 -3.65 0.00 0.00 1.31 0.00 0.00 55.95 53.78 1uhz s SER 3 Cb -0.23 -1.37 0.00 0.00 0.21 0.00 0.00 66.02 64.64 1uhz s SER 3 CO -0.02 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.13 1uhz n GLY 4 N 2.20 0.36 3.15 3.44 0.00 -1.26 -4.82 105.19 108.26 1uhz n GLY 4 Ca 0.22 -0.68 0.04 0.00 0.00 0.00 0.00 46.02 45.60 1uhz n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uhz s SER 5 N -4.00 -1.26 -0.37 1.61 0.01 -1.26 -5.04 113.70 103.39 1uhz s SER 5 Ca 0.00 0.13 -0.04 0.00 1.31 0.00 0.00 55.95 57.34 1uhz s SER 5 Cb 0.00 1.79 0.20 0.00 0.21 0.00 0.00 66.02 68.22 1uhz s SER 5 CO 0.00 -0.23 1.01 -0.55 0.41 0.00 0.00 173.24 173.88 1uhz s SER 6 N 2.84 -0.55 0.00 2.44 0.15 -1.26 -5.06 113.70 112.27 1uhz s SER 6 Ca 0.16 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 56.23 1uhz s SER 6 Cb -0.07 0.72 0.00 0.00 -1.71 0.00 0.00 66.02 64.95 1uhz s SER 6 CO -0.25 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 174.78 1uhz n GLY 7 N 2.92 -1.53 0.12 9.45 0.00 -1.26 -5.00 105.19 109.89 1uhz n GLY 7 Ca 0.12 -1.06 -0.05 0.00 0.00 0.00 0.00 46.02 45.03 1uhz n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uhz h PRO 8 N 0.00 0.07 0.00 1.61 0.13 -1.95 -2.89 132.00 128.97 1uhz h PRO 8 Ca 0.00 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 1uhz h PRO 8 Cb 0.00 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.15 1uhz h PRO 8 CO 0.00 0.80 0.00 -0.89 -0.23 0.00 0.00 178.00 177.68 1uhz n ILE 9 N -3.67 0.00 -0.32 -3.56 5.41 -1.26 -0.96 119.36 114.99 1uhz n ILE 9 Ca -0.02 0.96 0.13 0.00 1.00 0.00 0.00 62.75 64.83 1uhz n ILE 9 Cb 0.74 -1.83 0.26 0.00 -0.71 0.00 0.00 39.64 38.10 1uhz n ILE 9 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1uhz n SER 10 N -1.42 -0.13 -0.10 4.38 7.64 -1.26 0.19 113.62 122.92 1uhz n SER 10 Ca 0.00 1.59 -0.07 0.00 1.01 0.00 0.00 58.87 61.40 1uhz n SER 10 Cb 0.00 -0.57 0.01 0.00 -1.01 0.00 0.00 64.21 62.64 1uhz n SER 10 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1uhz h ARG 11 N 0.00 0.33 -0.01 1.43 2.43 -1.54 0.98 114.38 118.00 1uhz h ARG 11 Ca 0.56 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.71 1uhz h ARG 11 Cb 1.13 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.60 1uhz h ARG 11 CO -0.89 0.22 0.00 1.25 -1.51 0.00 0.00 179.97 179.04 1uhz h LEU 12 N 0.34 0.02 -0.59 3.80 6.46 0.39 -1.48 115.31 124.24 1uhz h LEU 12 Ca 0.15 -0.28 0.06 0.00 -0.12 0.00 0.00 57.88 57.69 1uhz h LEU 12 Cb 0.07 -0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 39.94 1uhz h LEU 12 CO -0.11 0.29 0.29 0.00 -0.62 0.00 0.00 178.44 178.29 1uhz h ALA 13 N 0.73 0.77 -0.01 1.25 0.00 0.10 0.22 119.26 122.33 1uhz h ALA 13 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1uhz h ALA 13 Cb 0.28 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1uhz h ALA 13 CO 0.00 -0.06 0.01 1.96 0.00 0.00 0.00 179.25 181.16 1uhz h GLN 14 N 0.55 0.00 0.07 0.00 4.20 0.12 0.11 115.11 120.16 1uhz h GLN 14 Ca 0.27 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.72 1uhz h GLN 14 Cb 0.21 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.00 1uhz h GLN 14 CO -0.20 0.00 -1.11 0.82 -0.67 0.00 0.00 178.83 177.67 1uhz h ILE 15 N 0.00 1.42 -0.22 2.54 2.04 0.32 0.38 117.51 123.99 1uhz h ILE 15 Ca 0.00 -2.68 -0.11 0.00 1.00 0.00 0.00 64.86 63.07 1uhz h ILE 15 Cb 0.01 2.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.75 1uhz h ILE 15 CO -0.00 0.80 -0.34 1.56 0.00 0.00 0.00 178.15 180.17 1uhz h GLN 16 N 0.17 0.46 0.09 2.37 1.08 0.90 0.53 115.11 120.71 1uhz h GLN 16 Ca -0.12 -0.20 -0.22 0.00 -1.45 0.00 0.00 58.65 56.66 1uhz h GLN 16 Cb 1.78 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 29.20 1uhz h GLN 16 CO 0.19 0.74 -1.09 -0.56 -0.95 0.00 0.00 178.83 177.17 1uhz h GLN 17 N 0.39 0.19 -0.19 1.46 3.07 -0.86 -2.07 115.11 117.11 1uhz h GLN 17 Ca 0.05 -0.33 0.00 0.00 0.09 0.00 0.00 58.65 58.46 1uhz h GLN 17 Cb 0.78 0.12 -0.01 0.00 0.08 0.00 0.00 27.48 28.45 1uhz h GLN 17 CO 0.06 1.16 0.12 0.00 0.09 0.00 0.00 178.83 180.26 1uhz h ALA 18 N -0.07 1.86 0.00 0.06 0.00 -0.24 0.18 119.26 121.05 1uhz h ALA 18 Ca -0.24 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1uhz h ALA 18 Cb 1.58 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1uhz h ALA 18 CO 0.04 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.42 1uhz h ARG 19 N 0.26 0.00 -3.18 0.00 3.08 -0.98 -3.47 114.38 110.08 1uhz h ARG 19 Ca 0.07 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.84 1uhz h ARG 19 Cb -0.02 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.07 1uhz h ARG 19 CO -0.01 0.00 -0.42 1.63 -1.07 0.00 0.00 179.97 180.10 1uhz n LYS 20 N -2.90 -3.29 0.00 0.04 5.02 0.65 -4.94 118.16 112.73 1uhz n LYS 20 Ca 0.04 0.64 0.00 0.00 -2.02 0.00 0.00 58.31 56.97 1uhz n LYS 20 Cb 0.48 -4.92 0.00 0.00 -0.02 0.00 0.00 35.03 30.57 1uhz n LYS 20 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1uhz n GLU 21 N -2.99 0.00 0.00 1.97 -0.58 -0.80 -5.05 120.64 113.19 1uhz n GLU 21 Ca -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 1uhz n GLU 21 Cb 0.59 -0.34 0.00 0.00 -0.57 0.00 0.00 31.44 31.12 1uhz n GLU 21 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1uhz n LYS 22 N -2.23 0.00 -0.97 3.49 5.02 -1.08 -5.05 118.16 117.34 1uhz n LYS 22 Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 1uhz n LYS 22 Cb 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.06 1uhz n LYS 22 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1uhz n GLU 23 N -0.21 -0.06 -2.35 1.97 1.02 -1.26 -4.75 120.64 114.99 1uhz n GLU 23 Ca 0.00 -0.01 -0.33 0.00 -0.02 0.00 0.00 57.16 56.79 1uhz n GLU 23 Cb 0.00 -1.14 -0.02 0.00 -0.02 0.00 0.00 31.44 30.27 1uhz n GLU 23 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1uhz s PRO 24 N -2.26 3.63 -0.36 3.49 0.04 -1.26 -4.88 135.00 133.40 1uhz s PRO 24 Ca 0.42 1.28 -0.03 0.00 0.04 0.00 0.00 61.00 62.71 1uhz s PRO 24 Cb -0.16 -2.07 0.08 0.00 0.04 0.00 0.00 34.50 32.38 1uhz s PRO 24 CO 0.79 -0.56 0.13 0.34 0.04 0.00 0.00 177.00 177.74 1uhz s ASP 25 N -2.34 5.16 0.06 6.66 -1.08 0.84 -4.92 116.67 121.06 1uhz s ASP 25 Ca 0.65 -1.63 -0.21 0.00 -0.52 0.00 0.00 52.55 50.84 1uhz s ASP 25 Cb -0.16 -1.80 -0.06 0.00 -1.46 0.00 0.00 42.92 39.43 1uhz s ASP 25 CO 0.27 -0.42 0.63 -0.31 0.52 0.00 0.00 175.17 175.85 1uhz s TYR 26 N 1.23 3.78 -0.06 -5.34 2.02 -1.26 0.51 117.35 118.22 1uhz s TYR 26 Ca 0.02 1.32 0.01 0.00 -0.37 0.00 0.00 57.07 58.05 1uhz s TYR 26 Cb -0.21 -2.60 0.02 0.00 -0.40 0.00 0.00 41.96 38.77 1uhz s TYR 26 CO -0.02 0.47 -0.05 0.42 -1.57 0.00 0.00 175.55 174.81 1uhz s ILE 27 N -0.72 0.61 -0.35 2.71 1.09 0.95 -4.96 121.20 120.54 1uhz s ILE 27 Ca 0.31 -0.12 -0.29 0.00 -1.10 0.00 0.00 60.65 59.45 1uhz s ILE 27 Cb -0.20 -0.65 0.01 0.00 -1.06 0.00 0.00 42.46 40.56 1uhz s ILE 27 CO 0.20 0.26 1.25 -0.22 -0.10 0.00 0.00 174.94 176.32 1uhz s LEU 28 N 1.18 3.81 -0.02 2.97 1.98 -1.26 0.88 118.68 128.21 1uhz s LEU 28 Ca -0.07 1.00 -0.15 0.00 -2.89 0.00 0.00 54.13 52.02 1uhz s LEU 28 Cb -0.14 -3.54 -0.09 0.00 0.66 0.00 0.00 46.19 43.08 1uhz s LEU 28 CO -0.01 -1.12 0.69 -0.07 -1.89 0.00 0.00 176.35 173.94 1uhz h LEU 29 N 10.97 -0.47 0.00 -0.68 3.38 -1.24 -3.48 115.31 123.79 1uhz h LEU 29 Ca -0.25 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1uhz h LEU 29 Cb 1.08 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1uhz h LEU 29 CO 1.06 -0.09 0.00 -0.24 0.09 0.00 0.00 178.44 179.25 1uhz n SER 30 N -4.86 0.00 -3.36 -0.43 2.88 -1.07 -5.00 113.62 101.78 1uhz n SER 30 Ca -0.07 -0.51 0.02 0.00 -1.33 0.00 0.00 58.87 56.98 1uhz n SER 30 Cb 0.22 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.65 1uhz n SER 30 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 1uhz s GLU 31 N -0.54 0.48 0.26 -1.46 -1.05 -1.26 -0.71 118.70 114.41 1uhz s GLU 31 Ca 0.00 1.04 -0.05 0.00 -0.15 0.00 0.00 54.97 55.81 1uhz s GLU 31 Cb 0.00 0.60 0.02 0.00 -0.44 0.00 0.00 34.13 34.31 1uhz s GLU 31 CO 0.00 -0.34 0.42 0.54 0.95 0.00 0.00 175.26 176.83 1uhz n ARG 32 N 5.37 0.61 0.00 -4.83 3.00 0.13 -4.96 116.66 115.98 1uhz n ARG 32 Ca -0.07 -1.80 0.00 0.00 -0.01 0.00 0.00 57.85 55.98 1uhz n ARG 32 Cb 0.51 1.90 0.00 0.00 0.00 0.00 0.00 32.46 34.87 1uhz n ARG 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1uhz n GLY 33 N -0.39 1.74 3.39 -0.13 0.00 -1.26 0.82 105.19 109.37 1uhz n GLY 33 Ca -0.02 -2.13 -0.33 0.00 0.00 0.00 0.00 46.02 43.54 1uhz n GLY 33 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1uhz n MET 34 N -0.06 -0.54 0.02 1.61 0.00 -1.26 -4.68 117.12 112.21 1uhz n MET 34 Ca 0.00 -0.12 -0.19 0.00 0.00 0.00 0.00 57.70 57.39 1uhz n MET 34 Cb 0.00 -1.83 -0.09 0.00 0.00 0.00 0.00 33.22 31.30 1uhz n MET 34 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 1uhz h PRO 35 N -1.66 0.72 -0.88 3.17 0.13 -1.97 -1.94 132.00 129.56 1uhz h PRO 35 Ca -0.45 -0.70 0.12 0.00 -0.87 0.00 0.00 66.00 64.10 1uhz h PRO 35 Cb 1.30 0.18 -0.14 0.00 0.13 0.00 0.00 31.00 32.47 1uhz h PRO 35 CO 0.35 1.29 -0.44 0.00 -0.23 0.00 0.00 178.00 178.97 1uhz h ARG 36 N 0.44 -0.06 -2.08 0.86 2.47 -2.03 -3.24 114.38 110.74 1uhz h ARG 36 Ca -0.10 0.00 -0.56 0.00 -1.26 0.00 0.00 59.98 58.07 1uhz h ARG 36 Cb 1.59 0.01 -0.37 0.00 -1.65 0.00 0.00 29.97 29.55 1uhz h ARG 36 CO 0.19 -0.04 -1.02 0.54 0.56 0.00 0.00 179.97 180.20 1uhz n ARG 37 N -5.41 0.48 -0.98 0.04 3.00 -1.24 -5.13 116.66 107.41 1uhz n ARG 37 Ca 0.06 -3.14 -0.36 0.00 -0.01 0.00 0.00 57.85 54.41 1uhz n ARG 37 Cb 0.36 -1.42 0.05 0.00 0.00 0.00 0.00 32.46 31.44 1uhz n ARG 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1uhz n ARG 38 N 2.07 -0.04 -3.95 5.56 5.12 -0.73 -4.65 116.66 120.05 1uhz n ARG 38 Ca 0.25 -0.01 -0.29 0.00 -1.93 0.00 0.00 57.85 55.86 1uhz n ARG 38 Cb 0.51 -1.07 -0.16 0.00 -1.16 0.00 0.00 32.46 30.58 1uhz n ARG 38 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 1uhz s GLU 39 N -2.13 1.76 -0.20 5.56 2.12 0.24 -3.83 118.70 122.23 1uhz s GLU 39 Ca 0.41 -0.69 -0.07 0.00 0.36 0.00 0.00 54.97 54.98 1uhz s GLU 39 Cb -0.15 -2.23 -0.04 0.00 0.26 0.00 0.00 34.13 31.98 1uhz s GLU 39 CO 0.80 -0.43 0.05 -0.06 -0.54 0.00 0.00 175.26 175.07 1uhz s PHE 40 N 1.50 3.16 -0.24 5.30 0.40 -0.93 0.17 117.98 127.35 1uhz s PHE 40 Ca -0.00 -0.13 -0.17 0.00 -0.60 0.00 0.00 56.93 56.03 1uhz s PHE 40 Cb -0.16 -2.10 -0.03 0.00 0.51 0.00 0.00 43.02 41.24 1uhz s PHE 40 CO -0.08 -0.03 0.47 0.08 0.70 0.00 0.00 175.22 176.36 1uhz s VAL 41 N 0.73 5.12 0.07 -0.44 1.01 0.11 -3.33 120.40 123.66 1uhz s VAL 41 Ca 0.02 0.80 0.09 0.00 0.00 0.00 0.00 61.98 62.90 1uhz s VAL 41 Cb -0.14 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 1uhz s VAL 41 CO 0.02 0.14 -0.25 -0.32 0.00 0.00 0.00 175.10 174.69 1uhz s MET 42 N 1.99 1.73 0.18 2.72 1.75 0.12 -0.71 119.30 127.07 1uhz s MET 42 Ca 0.20 -1.16 0.10 0.00 -1.25 0.00 0.00 55.69 53.58 1uhz s MET 42 Cb -0.15 -2.00 -0.04 0.00 2.84 0.00 0.00 34.83 35.48 1uhz s MET 42 CO 0.09 0.50 -0.22 -1.14 -0.65 0.00 0.00 175.02 173.59 1uhz s GLN 43 N -1.54 1.42 -0.02 4.11 0.74 0.25 0.20 119.66 124.82 1uhz s GLN 43 Ca 0.13 -1.46 0.00 0.00 0.05 0.00 0.00 55.36 54.08 1uhz s GLN 43 Cb -0.10 -1.68 0.02 0.00 1.10 0.00 0.00 33.01 32.35 1uhz s GLN 43 CO 0.04 0.36 0.02 0.54 -0.55 0.00 0.00 175.29 175.70 1uhz s VAL 44 N -1.70 0.00 -0.17 1.34 0.11 0.13 -0.03 120.40 120.09 1uhz s VAL 44 Ca 0.18 0.13 0.01 0.00 -2.93 0.00 0.00 61.98 59.38 1uhz s VAL 44 Cb -0.08 -0.10 0.02 0.00 -1.53 0.00 0.00 36.38 34.69 1uhz s VAL 44 CO 0.08 0.08 -0.20 -0.75 -3.33 0.00 0.00 175.10 170.98 1uhz s LYS 45 N 0.76 2.94 -0.22 1.54 2.20 0.18 0.35 119.74 127.51 1uhz s LYS 45 Ca -0.07 -0.82 -0.01 0.00 -0.36 0.00 0.00 55.97 54.72 1uhz s LYS 45 Cb -0.10 -2.50 0.06 0.00 -1.51 0.00 0.00 37.83 33.79 1uhz s LYS 45 CO -0.02 -0.16 -0.01 0.08 -0.36 0.00 0.00 175.35 174.88 1uhz s VAL 46 N 1.18 1.01 0.00 4.02 1.01 0.98 -0.11 120.40 128.49 1uhz s VAL 46 Ca 0.02 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1uhz s VAL 46 Cb -0.14 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.83 1uhz s VAL 46 CO -0.10 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.44 1uhz n GLY 47 N 4.86 1.12 0.94 4.51 0.00 -1.26 0.28 105.19 115.63 1uhz n GLY 47 Ca -0.10 0.48 0.01 0.00 0.00 0.00 0.00 46.02 46.41 1uhz n GLY 47 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1uhz n ASN 48 N 10.36 2.68 -4.26 1.61 4.13 -1.26 -4.99 115.26 123.52 1uhz n ASN 48 Ca 0.00 -3.56 -0.17 0.00 1.68 0.00 0.00 54.58 52.53 1uhz n ASN 48 Cb 0.00 -0.59 -0.11 0.00 -1.54 0.00 0.00 39.78 37.55 1uhz n ASN 48 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1uhz s GLU 49 N -3.12 1.09 0.04 3.52 8.01 0.14 -5.16 118.70 123.21 1uhz s GLU 49 Ca 0.42 -1.37 -0.03 0.00 0.01 0.00 0.00 54.97 54.00 1uhz s GLU 49 Cb 0.38 -0.84 -0.02 0.00 -4.31 0.00 0.00 34.13 29.34 1uhz s GLU 49 CO 0.01 0.14 0.02 0.54 0.01 0.00 0.00 175.26 175.98 1uhz s VAL 50 N -2.70 0.15 0.27 2.63 0.11 -1.26 -0.01 120.40 119.59 1uhz s VAL 50 Ca 0.14 -1.23 -0.09 0.00 -2.93 0.00 0.00 61.98 57.87 1uhz s VAL 50 Cb -0.02 -0.86 -0.00 0.00 -1.53 0.00 0.00 36.38 33.97 1uhz s VAL 50 CO 0.03 -0.68 0.46 0.00 -3.33 0.00 0.00 175.10 171.58 1uhz s ALA 51 N -2.59 0.10 0.05 1.54 0.00 0.16 -4.87 121.76 116.14 1uhz s ALA 51 Ca -0.05 -1.10 -0.02 0.00 0.00 0.00 0.00 51.96 50.79 1uhz s ALA 51 Cb -0.01 1.10 -0.03 0.00 0.00 0.00 0.00 23.12 24.17 1uhz s ALA 51 CO -0.05 -0.82 -0.01 0.95 0.00 0.00 0.00 175.76 175.83 1uhz s THR 52 N -3.71 0.19 -0.04 0.00 -4.23 -1.26 0.21 115.64 106.81 1uhz s THR 52 Ca 0.26 -1.60 -0.09 0.00 -1.18 0.00 0.00 61.69 59.07 1uhz s THR 52 Cb -0.00 -1.29 0.02 0.00 1.34 0.00 0.00 72.50 72.56 1uhz s THR 52 CO 0.12 -0.88 0.22 -0.83 -0.54 0.00 0.00 174.62 172.71 1uhz s GLY 53 N -2.66 -0.09 0.09 3.99 0.00 0.13 -3.99 107.32 104.79 1uhz s GLY 53 Ca 0.03 0.30 0.04 0.00 0.00 0.00 0.00 44.72 45.09 1uhz s GLY 53 CO -0.08 0.17 -0.11 -0.51 0.00 0.00 0.00 173.10 172.56 1uhz s THR 54 N -0.75 1.00 0.00 0.90 -4.23 -1.24 0.11 115.64 111.42 1uhz s THR 54 Ca -0.08 -1.50 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 1uhz s THR 54 Cb -0.05 -1.22 0.00 0.00 1.34 0.00 0.00 72.50 72.57 1uhz s THR 54 CO 0.02 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 174.28 1uhz n GLY 55 N 0.85 1.21 0.17 3.99 0.00 -1.21 -4.37 105.19 105.82 1uhz n GLY 55 Ca -0.18 -0.85 0.04 0.00 0.00 0.00 0.00 46.02 45.04 1uhz n GLY 55 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uhz h PRO 56 N 0.00 0.00 -4.55 1.61 0.13 -1.88 -2.47 132.00 124.85 1uhz h PRO 56 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.91 1uhz h PRO 56 Cb 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 30.98 1uhz h PRO 56 CO 0.00 0.43 -0.63 0.54 -0.23 0.00 0.00 178.00 178.11 1uhz s ASN 57 N -6.44 0.23 0.11 1.44 2.20 -1.26 -4.11 114.94 107.11 1uhz s ASN 57 Ca 0.01 -1.33 -0.23 0.00 -0.94 0.00 0.00 52.86 50.38 1uhz s ASN 57 Cb 0.10 0.35 -0.08 0.00 -2.00 0.00 0.00 41.25 39.62 1uhz s ASN 57 CO 0.71 -0.80 1.70 0.50 -2.94 0.00 0.00 177.10 176.26 1uhz h LYS 58 N 2.69 -0.13 0.00 3.55 3.64 -1.89 -0.46 116.57 123.97 1uhz h LYS 58 Ca -0.36 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1uhz h LYS 58 Cb 1.23 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 1uhz h LYS 58 CO 0.55 -0.09 0.00 1.63 -2.27 0.00 0.00 179.45 179.27 1uhz n LYS 59 N -5.22 0.00 -0.25 1.90 5.02 -1.26 0.46 118.16 118.81 1uhz n LYS 59 Ca -0.05 0.70 -0.06 0.00 -2.02 0.00 0.00 58.31 56.89 1uhz n LYS 59 Cb 0.15 -1.20 -0.00 0.00 -0.02 0.00 0.00 35.03 33.95 1uhz n LYS 59 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1uhz h ILE 60 N 0.00 0.10 -1.45 -0.18 2.04 -1.95 1.54 117.51 117.62 1uhz h ILE 60 Ca 0.00 0.00 0.44 0.00 1.00 0.00 0.00 64.86 66.30 1uhz h ILE 60 Cb 0.00 0.10 -0.10 0.00 -0.74 0.00 0.00 36.82 36.08 1uhz h ILE 60 CO 0.00 0.00 0.99 0.00 0.00 0.00 0.00 178.15 179.14 1uhz h ALA 61 N 0.93 3.06 -0.09 1.87 0.00 0.53 1.57 119.26 127.13 1uhz h ALA 61 Ca 0.24 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1uhz h ALA 61 Cb 0.56 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1uhz h ALA 61 CO -0.76 -1.60 -0.15 -0.22 0.00 0.00 0.00 179.25 176.52 1uhz h LYS 62 N 0.08 0.26 -0.55 0.00 3.11 0.73 -1.92 116.57 118.27 1uhz h LYS 62 Ca 0.79 -0.16 0.03 0.00 -2.81 0.00 0.00 60.65 58.50 1uhz h LYS 62 Cb 2.74 0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 33.95 1uhz h LYS 62 CO -0.23 0.74 0.32 0.87 -2.81 0.00 0.00 179.45 178.34 1uhz h LYS 63 N -0.19 0.61 0.00 1.90 1.57 0.29 0.67 116.57 121.42 1uhz h LYS 63 Ca 0.01 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1uhz h LYS 63 Cb 0.72 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.89 1uhz h LYS 63 CO 0.03 0.40 -0.06 -0.91 -0.57 0.00 0.00 179.45 178.35 1uhz h ASN 64 N 0.63 0.00 0.38 0.86 2.35 -0.47 -0.89 115.58 118.44 1uhz h ASN 64 Ca 0.23 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.96 1uhz h ASN 64 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1uhz h ASN 64 CO -0.12 0.06 -0.18 0.00 -1.65 0.00 0.00 177.43 175.54 1uhz h ALA 65 N 1.94 -0.51 -0.89 -0.83 0.00 -0.06 -1.90 119.26 117.01 1uhz h ALA 65 Ca -0.00 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1uhz h ALA 65 Cb 0.11 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 1uhz h ALA 65 CO 0.01 -0.69 0.55 0.00 0.00 0.00 0.00 179.25 179.12 1uhz h ALA 66 N -0.19 1.22 0.13 0.00 0.00 -0.83 -1.75 119.26 117.84 1uhz h ALA 66 Ca -0.05 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1uhz h ALA 66 Cb 0.50 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1uhz h ALA 66 CO 0.09 0.30 -0.53 1.49 0.00 0.00 0.00 179.25 180.59 1uhz h GLU 67 N 1.00 -0.74 -0.46 0.00 4.81 -0.97 0.22 114.58 118.44 1uhz h GLU 67 Ca 0.39 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.76 1uhz h GLU 67 Cb 0.18 0.17 -0.09 0.00 0.63 0.00 0.00 28.75 29.64 1uhz h GLU 67 CO -0.18 -0.49 -0.13 0.00 -0.73 0.00 0.00 179.01 177.48 1uhz h ALA 68 N -0.55 0.28 -0.50 2.92 0.00 -0.93 0.38 119.26 120.86 1uhz h ALA 68 Ca -0.01 0.18 0.10 0.00 0.00 0.00 0.00 54.91 55.18 1uhz h ALA 68 Cb 0.77 0.38 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 1uhz h ALA 68 CO -0.28 -0.46 -0.05 1.98 0.00 0.00 0.00 179.25 180.43 1uhz h MET 69 N -0.02 0.06 -0.69 0.00 1.85 -0.48 0.79 114.93 116.45 1uhz h MET 69 Ca 0.22 -0.00 -0.05 0.00 -0.61 0.00 0.00 59.70 59.26 1uhz h MET 69 Cb 0.36 -0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.35 1uhz h MET 69 CO -0.49 0.04 0.23 -0.07 -0.40 0.00 0.00 176.91 176.23 1uhz h LEU 70 N 0.06 0.97 -0.70 3.39 3.38 0.11 0.80 115.31 123.33 1uhz h LEU 70 Ca 0.25 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1uhz h LEU 70 Cb 0.38 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1uhz h LEU 70 CO -0.46 0.89 0.22 -0.07 0.09 0.00 0.00 178.44 179.11 1uhz h LEU 71 N 1.01 1.01 -0.16 1.67 3.38 0.21 0.20 115.31 122.63 1uhz h LEU 71 Ca 0.23 -0.21 -0.23 0.00 0.09 0.00 0.00 57.88 57.77 1uhz h LEU 71 Cb 0.26 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.75 1uhz h LEU 71 CO -0.01 0.95 -0.80 0.06 0.09 0.00 0.00 178.44 178.72 1uhz h GLN 72 N 1.02 0.76 -0.44 1.13 3.07 0.11 -3.21 115.11 117.55 1uhz h GLN 72 Ca 0.23 -0.64 0.02 0.00 0.09 0.00 0.00 58.65 58.34 1uhz h GLN 72 Cb 0.29 0.14 -0.03 0.00 0.08 0.00 0.00 27.48 27.96 1uhz h GLN 72 CO -0.01 1.24 0.27 -0.07 0.09 0.00 0.00 178.83 180.35 1uhz h LEU 73 N 0.51 0.45 0.00 0.06 4.07 0.89 -3.47 115.31 117.82 1uhz h LEU 73 Ca -0.06 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.90 1uhz h LEU 73 Cb 1.43 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 43.07 1uhz h LEU 73 CO 0.16 0.32 0.00 0.61 -1.08 0.00 0.00 178.44 178.45 1uhz n GLY 74 N -1.22 1.55 0.06 0.83 0.00 0.08 -5.04 105.19 101.45 1uhz n GLY 74 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 1uhz n GLY 74 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1uhz n TYR 75 N -0.02 0.00 -1.28 1.61 4.01 0.48 -4.52 117.16 117.45 1uhz n TYR 75 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.82 1uhz n TYR 75 Cb 0.00 -0.62 0.15 0.00 -0.31 0.00 0.00 39.34 38.57 1uhz n TYR 75 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1uhz n LYS 76 N -2.43 1.31 -0.06 -0.72 4.76 -1.18 -4.73 118.16 115.12 1uhz n LYS 76 Ca -0.19 -2.74 -0.03 0.00 -2.87 0.00 0.00 58.31 52.48 1uhz n LYS 76 Cb 0.86 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 32.55 1uhz n LYS 76 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1uhz h ALA 77 N 0.31 0.01 -0.99 7.82 0.00 -1.79 -2.88 119.26 121.74 1uhz h ALA 77 Ca -0.00 -0.25 0.12 0.00 0.00 0.00 0.00 54.91 54.77 1uhz h ALA 77 Cb 1.03 0.21 -0.14 0.00 0.00 0.00 0.00 17.79 18.89 1uhz h ALA 77 CO 0.00 0.21 -0.49 1.03 0.00 0.00 0.00 179.25 180.00 1uhz h SER 78 N -1.00 -1.81 0.20 0.00 0.87 -1.86 0.23 113.55 110.17 1uhz h SER 78 Ca -0.01 0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 1uhz h SER 78 Cb 0.28 0.86 -0.02 0.00 -0.44 0.00 0.00 62.40 63.08 1uhz h SER 78 CO -0.01 -0.26 -0.21 0.74 -0.53 0.00 0.00 176.83 176.57 1uhz h THR 79 N -0.01 0.55 -0.35 2.23 2.02 -1.88 -1.63 112.91 113.84 1uhz h THR 79 Ca 0.25 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.46 1uhz h THR 79 Cb 0.50 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 1uhz h THR 79 CO -0.96 0.00 -0.30 -1.28 0.37 0.00 0.00 175.52 173.35 1uhz h SER 80 N -0.44 -1.06 -0.25 4.18 0.87 -0.47 0.28 113.55 116.67 1uhz h SER 80 Ca 0.00 0.15 0.03 0.00 -1.23 0.00 0.00 61.79 60.74 1uhz h SER 80 Cb 0.42 0.45 -0.05 0.00 -0.44 0.00 0.00 62.40 62.78 1uhz h SER 80 CO -0.05 -0.17 -0.31 0.25 -0.53 0.00 0.00 176.83 176.01 1uhz h LEU 81 N -0.12 -1.06 -0.83 2.23 5.85 -0.64 -1.26 115.31 119.49 1uhz h LEU 81 Ca 0.06 0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.99 1uhz h LEU 81 Cb 0.27 0.43 -0.10 0.00 0.37 0.00 0.00 40.66 41.64 1uhz h LEU 81 CO -0.39 -0.22 -0.49 1.67 -0.34 0.00 0.00 178.44 178.67 1uhz n GLN 82 N -4.20 -0.36 -0.38 1.25 7.27 -0.62 0.52 117.38 120.85 1uhz n GLN 82 Ca -0.02 1.37 -0.06 0.00 0.07 0.00 0.00 57.00 58.36 1uhz n GLN 82 Cb 0.19 -2.02 -0.03 0.00 2.41 0.00 0.00 30.24 30.79 1uhz n GLN 82 CO 0.00 0.00 0.00 0.22 0.07 0.00 0.00 177.06 177.35 1uhz h ASP 83 N 0.00 -1.79 -0.16 1.69 1.82 0.48 0.48 116.42 118.94 1uhz h ASP 83 Ca 0.13 0.31 0.03 0.00 -0.39 0.00 0.00 57.03 57.12 1uhz h ASP 83 Cb 0.34 0.85 -0.03 0.00 0.68 0.00 0.00 39.33 41.16 1uhz h ASP 83 CO -0.78 -0.27 -0.04 -1.28 -1.61 0.00 0.00 179.24 175.27 1uhz h SER 84 N -0.03 -0.15 -2.21 2.28 0.87 0.74 -3.41 113.55 111.66 1uhz h SER 84 Ca 0.24 0.05 -0.24 0.00 -1.23 0.00 0.00 61.79 60.61 1uhz h SER 84 Cb 0.51 0.10 -0.33 0.00 -0.44 0.00 0.00 62.40 62.24 1uhz h SER 84 CO -0.94 -0.05 -0.56 -0.83 -0.53 0.00 0.00 176.83 173.92 1uhz s GLY 85 N -2.52 -0.20 -0.07 5.77 0.00 0.18 -4.91 107.32 105.58 1uhz s GLY 85 Ca -0.13 0.50 -0.20 0.00 0.00 0.00 0.00 44.72 44.89 1uhz s GLY 85 CO 0.68 2.42 0.76 -0.56 0.00 0.00 0.00 173.10 176.40 1uhz h PRO 86 N 8.25 -0.14 0.00 2.90 0.13 -1.19 -3.32 132.00 138.64 1uhz h PRO 86 Ca -0.18 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1uhz h PRO 86 Cb 1.15 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1uhz h PRO 86 CO 0.28 0.35 -0.67 0.45 -0.23 0.00 0.00 178.00 178.18 1uhz n SER 87 N -4.85 1.60 -3.72 1.44 2.88 -1.26 -4.94 113.62 104.78 1uhz n SER 87 Ca -0.07 0.26 -0.14 0.00 -1.33 0.00 0.00 58.87 57.59 1uhz n SER 87 Cb 0.27 -0.61 -0.09 0.00 -0.75 0.00 0.00 64.21 63.03 1uhz n SER 87 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1uhz s SER 88 N -5.84 -0.36 0.00 -3.46 0.01 -1.26 -5.20 113.70 97.59 1uhz s SER 88 Ca -0.19 0.51 0.28 0.00 1.31 0.00 0.00 55.95 57.85 1uhz s SER 88 Cb 0.03 0.59 1.09 0.00 0.21 0.00 0.00 66.02 67.93 1uhz s SER 88 CO 0.29 -0.33 1.77 0.61 0.41 0.00 0.00 173.24 175.99