#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 -0.71 0.10 1.61 0.01 -1.26 -5.18 113.70 108.27 1uhz s SER 2 Ca 0.00 1.37 -0.13 0.00 1.31 0.00 0.00 55.95 58.50 1uhz s SER 2 Cb 0.00 1.39 0.02 0.00 0.21 0.00 0.00 66.02 67.64 1uhz s SER 2 CO 0.00 -0.24 0.31 -0.55 0.41 0.00 0.00 173.24 173.17 1uhz s SER 3 N 0.35 -0.09 0.00 2.44 0.15 -1.26 -5.08 113.70 110.21 1uhz s SER 3 Ca 0.00 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.25 1uhz s SER 3 Cb -0.05 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 1uhz s SER 3 CO 0.00 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.29 1uhz n GLY 4 N -0.00 -1.98 3.07 9.45 0.00 -1.26 -4.92 105.19 109.56 1uhz n GLY 4 Ca -0.16 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 1uhz n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uhz n SER 5 N 0.00 5.15 -3.59 1.61 2.88 -1.26 -4.84 113.62 113.57 1uhz n SER 5 Ca 0.00 -3.07 -0.02 0.00 -1.33 0.00 0.00 58.87 54.46 1uhz n SER 5 Cb 0.00 -1.51 -0.06 0.00 -0.75 0.00 0.00 64.21 61.89 1uhz n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1uhz s SER 6 N 1.52 -0.57 0.00 -3.46 1.04 -1.26 -5.04 113.70 105.94 1uhz s SER 6 Ca 0.41 0.87 0.00 0.00 0.48 0.00 0.00 55.95 57.71 1uhz s SER 6 Cb 0.05 1.36 0.00 0.00 0.10 0.00 0.00 66.02 67.54 1uhz s SER 6 CO 0.00 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.70 1uhz n GLY 7 N 4.10 1.96 0.14 7.32 0.00 -1.26 -4.76 105.19 112.69 1uhz n GLY 7 Ca -0.16 -2.01 -0.08 0.00 0.00 0.00 0.00 46.02 43.76 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 0.24 0.00 1.61 0.13 -1.97 -2.42 132.00 129.59 1uhz h PRO 8 Ca 0.00 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1uhz h PRO 8 Cb 0.00 0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.19 1uhz h PRO 8 CO 0.00 0.93 0.00 -0.89 -0.23 0.00 0.00 178.00 177.81 1uhz n ILE 9 N -3.72 0.00 -0.21 -3.56 2.08 -1.26 -0.75 119.36 111.94 1uhz n ILE 9 Ca -0.04 1.37 -0.01 0.00 0.56 0.00 0.00 62.75 64.63 1uhz n ILE 9 Cb 0.76 -2.37 0.05 0.00 -0.75 0.00 0.00 39.64 37.33 1uhz n ILE 9 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1uhz h SER 10 N 0.00 -0.70 -0.49 4.38 0.02 -1.86 0.32 113.55 115.22 1uhz h SER 10 Ca 0.00 0.20 0.10 0.00 -0.84 0.00 0.00 61.79 61.25 1uhz h SER 10 Cb 0.00 0.43 -0.10 0.00 0.14 0.00 0.00 62.40 62.87 1uhz h SER 10 CO 0.00 -0.23 -0.17 -0.09 -1.14 0.00 0.00 176.83 175.20 1uhz h ARG 11 N -0.04 -0.05 -0.48 3.45 2.43 -1.44 0.68 114.38 118.93 1uhz h ARG 11 Ca 0.29 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.47 1uhz h ARG 11 Cb 0.49 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 1uhz h ARG 11 CO -0.66 -0.03 0.29 1.25 -1.51 0.00 0.00 179.97 179.31 1uhz h LEU 12 N -0.05 0.57 -0.85 3.80 6.46 0.14 -1.27 115.31 124.12 1uhz h LEU 12 Ca 0.24 -0.05 0.06 0.00 -0.12 0.00 0.00 57.88 58.01 1uhz h LEU 12 Cb 0.42 -0.14 -0.06 0.00 -0.73 0.00 0.00 40.66 40.14 1uhz h LEU 12 CO -0.54 0.45 0.52 0.00 -0.62 0.00 0.00 178.44 178.26 1uhz h ALA 13 N 1.14 1.16 0.00 1.25 0.00 0.17 0.21 119.26 123.20 1uhz h ALA 13 Ca 0.17 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1uhz h ALA 13 Cb -0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1uhz h ALA 13 CO -0.03 0.26 -0.15 1.96 0.00 0.00 0.00 179.25 181.28 1uhz h GLN 14 N 0.95 0.00 0.08 0.00 4.20 0.10 0.47 115.11 120.92 1uhz h GLN 14 Ca 0.37 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.83 1uhz h GLN 14 Cb 0.17 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 1uhz h GLN 14 CO -0.17 0.15 -1.14 0.82 -0.67 0.00 0.00 178.83 177.82 1uhz h ILE 15 N 0.00 1.53 -0.02 2.54 2.04 0.40 0.19 117.51 124.19 1uhz h ILE 15 Ca -0.00 -3.04 -0.14 0.00 1.00 0.00 0.00 64.86 62.68 1uhz h ILE 15 Cb 0.32 2.84 -0.02 0.00 -0.74 0.00 0.00 36.82 39.23 1uhz h ILE 15 CO 0.02 0.88 -0.64 1.56 0.00 0.00 0.00 178.15 179.97 1uhz h GLN 16 N 0.08 0.09 0.13 2.37 1.08 0.22 -0.38 115.11 118.70 1uhz h GLN 16 Ca -0.10 -0.07 -0.29 0.00 -1.45 0.00 0.00 58.65 56.74 1uhz h GLN 16 Cb 1.86 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 29.30 1uhz h GLN 16 CO 0.18 0.70 -1.46 -0.56 -0.95 0.00 0.00 178.83 176.74 1uhz h GLN 17 N 0.07 0.28 -0.25 1.46 3.07 -0.95 -2.36 115.11 116.43 1uhz h GLN 17 Ca -0.01 -0.48 -0.05 0.00 0.09 0.00 0.00 58.65 58.20 1uhz h GLN 17 Cb 1.14 0.18 -0.01 0.00 0.08 0.00 0.00 27.48 28.87 1uhz h GLN 17 CO 0.09 1.23 -0.06 0.00 0.09 0.00 0.00 178.83 180.18 1uhz h ALA 18 N -0.00 1.44 0.00 0.06 0.00 -0.64 -0.68 119.26 119.44 1uhz h ALA 18 Ca -0.31 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1uhz h ALA 18 Cb 1.83 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1uhz h ALA 18 CO 0.09 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.73 1uhz h ARG 19 N 0.37 0.00 -1.55 0.00 3.08 -1.17 -3.47 114.38 111.64 1uhz h ARG 19 Ca 0.08 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.87 1uhz h ARG 19 Cb 0.34 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 1uhz h ARG 19 CO 0.02 0.00 -0.31 1.63 -1.07 0.00 0.00 179.97 180.24 1uhz n LYS 20 N -2.91 -0.99 0.00 0.04 5.02 -0.26 -4.93 118.16 114.12 1uhz n LYS 20 Ca 0.03 0.69 0.00 0.00 -2.02 0.00 0.00 58.31 57.01 1uhz n LYS 20 Cb 0.41 -4.87 0.00 0.00 -0.02 0.00 0.00 35.03 30.55 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 -2.32 0.00 0.00 1.97 -0.58 -0.92 -5.05 120.64 113.75 1uhz n GLU 21 Ca -0.15 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 1uhz n GLU 21 Cb 0.57 -0.35 0.00 0.00 -0.57 0.00 0.00 31.44 31.09 1uhz n GLU 21 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1uhz n LYS 22 N -1.74 0.00 -0.99 3.49 4.81 -1.05 -5.05 118.16 117.63 1uhz n LYS 22 Ca 0.00 0.00 -0.35 0.00 -0.87 0.00 0.00 58.31 57.09 1uhz n LYS 22 Cb 0.00 0.00 0.04 0.00 0.02 0.00 0.00 35.03 35.09 1uhz n LYS 22 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1uhz n GLU 23 N -0.19 0.00 -2.53 1.64 4.71 -1.26 -4.77 120.64 118.24 1uhz n GLU 23 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.16 56.78 1uhz n GLU 23 Cb 0.00 -0.96 -0.04 0.00 -1.01 0.00 0.00 31.44 29.43 1uhz n GLU 23 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1uhz s PRO 24 N -1.81 4.20 -0.50 3.49 0.04 -1.26 -4.90 135.00 134.26 1uhz s PRO 24 Ca 0.40 1.55 -0.16 0.00 0.04 0.00 0.00 61.00 62.83 1uhz s PRO 24 Cb -0.21 -2.60 0.09 0.00 0.04 0.00 0.00 34.50 31.82 1uhz s PRO 24 CO 0.78 -0.12 0.45 0.34 0.04 0.00 0.00 177.00 178.49 1uhz s ASP 25 N -1.49 6.17 -0.01 6.66 2.15 0.85 -4.89 116.67 126.11 1uhz s ASP 25 Ca 0.57 -1.41 -0.20 0.00 0.43 0.00 0.00 52.55 51.93 1uhz s ASP 25 Cb -0.23 -2.20 -0.05 0.00 -0.30 0.00 0.00 42.92 40.13 1uhz s ASP 25 CO 0.29 -0.73 0.57 -0.31 -0.17 0.00 0.00 175.17 174.82 1uhz s TYR 26 N 1.74 3.68 0.23 -5.34 2.02 -1.26 0.33 117.35 118.76 1uhz s TYR 26 Ca 0.05 1.17 0.02 0.00 -0.37 0.00 0.00 57.07 57.93 1uhz s TYR 26 Cb -0.25 -2.57 -0.05 0.00 -0.40 0.00 0.00 41.96 38.69 1uhz s TYR 26 CO 0.06 0.38 0.05 0.42 -1.57 0.00 0.00 175.55 174.89 1uhz s ILE 27 N -0.28 0.70 -0.32 2.71 1.09 0.86 -4.97 121.20 120.99 1uhz s ILE 27 Ca 0.30 -2.00 -0.07 0.00 -1.10 0.00 0.00 60.65 57.78 1uhz s ILE 27 Cb -0.18 -2.44 0.03 0.00 -1.06 0.00 0.00 42.46 38.81 1uhz s ILE 27 CO 0.16 -0.20 0.09 -0.22 -0.10 0.00 0.00 174.94 174.68 1uhz s LEU 28 N -3.28 4.13 -0.00 2.97 1.98 -1.26 -0.31 118.68 122.90 1uhz s LEU 28 Ca 0.32 -0.97 -0.15 0.00 -2.89 0.00 0.00 54.13 50.44 1uhz s LEU 28 Cb 0.07 -1.87 -0.08 0.00 0.66 0.00 0.00 46.19 44.96 1uhz s LEU 28 CO 0.10 -0.27 0.81 -0.07 -1.89 0.00 0.00 176.35 175.03 1uhz h LEU 29 N 8.23 -0.46 0.00 -0.68 3.38 -1.07 -3.48 115.31 121.22 1uhz h LEU 29 Ca -0.27 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1uhz h LEU 29 Cb 1.10 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1uhz h LEU 29 CO 0.60 -0.19 0.00 -1.20 0.09 0.00 0.00 178.44 177.74 1uhz n SER 30 N -4.24 0.00 -3.62 -0.43 7.64 -1.17 -5.00 113.62 106.80 1uhz n SER 30 Ca -0.07 -0.99 -0.16 0.00 1.01 0.00 0.00 58.87 58.66 1uhz n SER 30 Cb 0.22 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.28 1uhz n SER 30 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1uhz s GLU 31 N -1.98 0.12 -0.24 1.43 -6.30 -1.26 -0.66 118.70 109.82 1uhz s GLU 31 Ca 0.00 0.54 -0.27 0.00 -2.50 0.00 0.00 54.97 52.73 1uhz s GLU 31 Cb 0.00 -0.44 0.14 0.00 0.00 0.00 0.00 34.13 33.83 1uhz s GLU 31 CO 0.00 -0.40 1.11 -0.98 0.02 0.00 0.00 175.26 175.01 1uhz s ARG 32 N 2.35 0.44 0.00 4.30 1.70 0.99 -4.96 118.95 123.77 1uhz s ARG 32 Ca 0.03 0.29 0.00 0.00 -0.47 0.00 0.00 55.73 55.58 1uhz s ARG 32 Cb -0.13 0.21 0.00 0.00 -0.57 0.00 0.00 34.95 34.46 1uhz s ARG 32 CO -0.09 -0.10 0.00 0.41 -1.08 0.00 0.00 175.30 174.45 1uhz n GLY 33 N 1.36 -0.53 1.27 3.88 0.00 -1.26 -2.67 105.19 107.24 1uhz n GLY 33 Ca -0.10 0.13 0.09 0.00 0.00 0.00 0.00 46.02 46.14 1uhz n GLY 33 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1uhz n MET 34 N 0.00 -3.10 0.14 1.61 2.81 -1.26 -3.24 117.12 114.08 1uhz n MET 34 Ca 0.00 2.48 0.00 0.00 -1.81 0.00 0.00 57.70 58.38 1uhz n MET 34 Cb 0.00 -3.35 0.14 0.00 -0.71 0.00 0.00 33.22 29.30 1uhz n MET 34 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1uhz h PRO 35 N -0.68 0.00 -0.67 0.03 0.13 -2.00 -1.07 132.00 127.74 1uhz h PRO 35 Ca -0.11 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.10 1uhz h PRO 35 Cb 1.04 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.11 1uhz h PRO 35 CO 0.04 0.60 0.35 0.00 -0.23 0.00 0.00 178.00 178.76 1uhz h ARG 36 N 0.00 0.61 -1.11 0.86 2.47 -2.06 -3.35 114.38 111.80 1uhz h ARG 36 Ca -0.01 -0.04 -0.33 0.00 -1.26 0.00 0.00 59.98 58.34 1uhz h ARG 36 Cb 1.21 -0.14 -0.24 0.00 -1.65 0.00 0.00 29.97 29.15 1uhz h ARG 36 CO 0.08 0.41 -0.70 0.54 0.56 0.00 0.00 179.97 180.85 1uhz n ARG 37 N -4.83 0.59 -1.70 0.04 1.74 -1.21 -5.11 116.66 106.18 1uhz n ARG 37 Ca 0.09 -2.37 -0.57 0.00 -0.77 0.00 0.00 57.85 54.23 1uhz n ARG 37 Cb 0.22 -1.45 -0.07 0.00 -1.02 0.00 0.00 32.46 30.13 1uhz n ARG 37 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1uhz n ARG 38 N 2.20 1.24 -3.31 5.56 5.12 -0.41 -4.59 116.66 122.47 1uhz n ARG 38 Ca 0.18 0.45 -0.39 0.00 -1.93 0.00 0.00 57.85 56.16 1uhz n ARG 38 Cb 0.56 -2.17 -0.08 0.00 -1.16 0.00 0.00 32.46 29.62 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 3.75 4.09 0.39 5.56 2.12 -1.09 -4.34 118.70 129.17 1uhz s GLU 39 Ca 0.99 0.23 -0.03 0.00 0.36 0.00 0.00 54.97 56.51 1uhz s GLU 39 Cb -1.03 -3.62 -0.04 0.00 0.26 0.00 0.00 34.13 29.70 1uhz s GLU 39 CO 0.64 -0.25 0.65 -0.06 -0.54 0.00 0.00 175.26 175.70 1uhz s PHE 40 N 1.99 3.52 -0.14 5.30 0.40 -0.58 -0.01 117.98 128.46 1uhz s PHE 40 Ca 0.19 0.62 0.01 0.00 -0.60 0.00 0.00 56.93 57.14 1uhz s PHE 40 Cb -0.15 -2.11 0.02 0.00 0.51 0.00 0.00 43.02 41.28 1uhz s PHE 40 CO 0.09 -0.03 -0.14 0.08 0.70 0.00 0.00 175.22 175.92 1uhz s VAL 41 N -2.43 1.54 0.07 -0.44 1.01 0.17 -3.04 120.40 117.28 1uhz s VAL 41 Ca 0.44 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.88 1uhz s VAL 41 Cb -0.10 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1uhz s VAL 41 CO 0.38 0.45 -0.17 -0.04 0.00 0.00 0.00 175.10 175.72 1uhz s MET 42 N 1.41 2.00 0.18 2.72 -1.94 0.85 -0.45 119.30 124.08 1uhz s MET 42 Ca 0.03 -1.04 0.10 0.00 -1.71 0.00 0.00 55.69 53.07 1uhz s MET 42 Cb -0.13 -2.19 -0.04 0.00 2.01 0.00 0.00 34.83 34.48 1uhz s MET 42 CO -0.09 0.52 -0.21 -1.14 -0.01 0.00 0.00 175.02 174.09 1uhz s GLN 43 N -1.74 1.42 -0.02 2.03 0.74 0.57 0.24 119.66 122.89 1uhz s GLN 43 Ca 0.16 -1.48 -0.00 0.00 0.05 0.00 0.00 55.36 54.09 1uhz s GLN 43 Cb -0.11 -1.61 0.03 0.00 1.10 0.00 0.00 33.01 32.42 1uhz s GLN 43 CO 0.08 0.34 0.04 0.54 -0.55 0.00 0.00 175.29 175.74 1uhz s VAL 44 N -1.87 -0.06 -0.17 1.34 0.11 0.13 -0.10 120.40 119.79 1uhz s VAL 44 Ca 0.19 0.21 0.01 0.00 -2.93 0.00 0.00 61.98 59.46 1uhz s VAL 44 Cb -0.07 -0.09 0.01 0.00 -1.53 0.00 0.00 36.38 34.70 1uhz s VAL 44 CO 0.09 0.08 -0.19 -0.75 -3.33 0.00 0.00 175.10 171.00 1uhz s LYS 45 N 1.04 3.04 -0.21 1.54 2.20 0.15 0.24 119.74 127.74 1uhz s LYS 45 Ca -0.09 -0.82 -0.01 0.00 -0.36 0.00 0.00 55.97 54.70 1uhz s LYS 45 Cb -0.12 -2.57 0.06 0.00 -1.51 0.00 0.00 37.83 33.69 1uhz s LYS 45 CO -0.03 -0.14 -0.00 0.08 -0.36 0.00 0.00 175.35 174.89 1uhz s VAL 46 N 1.14 1.00 0.00 4.02 1.01 1.00 -0.11 120.40 128.46 1uhz s VAL 46 Ca 0.01 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1uhz s VAL 46 Cb -0.14 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.84 1uhz s VAL 46 CO -0.08 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.46 1uhz n GLY 47 N 4.87 0.96 0.77 4.51 0.00 -1.26 0.24 105.19 115.28 1uhz n GLY 47 Ca -0.10 0.51 0.04 0.00 0.00 0.00 0.00 46.02 46.46 1uhz n GLY 47 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1uhz n ASN 48 N 10.21 2.72 -4.30 1.61 2.85 -1.26 -5.00 115.26 122.09 1uhz n ASN 48 Ca 0.00 -3.44 -0.20 0.00 -0.11 0.00 0.00 54.58 50.82 1uhz n ASN 48 Cb 0.00 -0.55 -0.11 0.00 1.24 0.00 0.00 39.78 40.36 1uhz n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 1uhz s GLU 49 N -3.06 1.20 0.00 1.20 8.01 0.14 -5.15 118.70 121.04 1uhz s GLU 49 Ca 0.40 -1.38 -0.07 0.00 0.01 0.00 0.00 54.97 53.94 1uhz s GLU 49 Cb 0.36 -1.16 0.00 0.00 -4.31 0.00 0.00 34.13 29.02 1uhz s GLU 49 CO 0.02 0.23 0.12 0.54 0.01 0.00 0.00 175.26 176.18 1uhz s VAL 50 N -2.21 0.08 0.21 2.63 0.11 -1.26 -0.00 120.40 119.96 1uhz s VAL 50 Ca 0.14 -0.68 -0.07 0.00 -2.93 0.00 0.00 61.98 58.44 1uhz s VAL 50 Cb -0.05 -0.41 -0.02 0.00 -1.53 0.00 0.00 36.38 34.38 1uhz s VAL 50 CO 0.05 -0.37 0.30 0.00 -3.33 0.00 0.00 175.10 171.76 1uhz s ALA 51 N -1.32 0.35 0.05 1.54 0.00 0.14 -4.85 121.76 117.67 1uhz s ALA 51 Ca -0.14 -1.19 -0.03 0.00 0.00 0.00 0.00 51.96 50.60 1uhz s ALA 51 Cb -0.07 1.14 -0.03 0.00 0.00 0.00 0.00 23.12 24.15 1uhz s ALA 51 CO 0.01 -0.71 0.02 0.95 0.00 0.00 0.00 175.76 176.03 1uhz s THR 52 N -4.06 0.20 0.06 0.00 -4.23 -1.26 0.21 115.64 106.56 1uhz s THR 52 Ca 0.27 -1.61 -0.11 0.00 -1.18 0.00 0.00 61.69 59.07 1uhz s THR 52 Cb 0.03 -1.38 0.01 0.00 1.34 0.00 0.00 72.50 72.49 1uhz s THR 52 CO 0.08 -0.89 0.23 -0.83 -0.54 0.00 0.00 174.62 172.67 1uhz s GLY 53 N -2.78 -0.00 0.10 3.99 0.00 0.14 -4.02 107.32 104.74 1uhz s GLY 53 Ca 0.05 -0.29 0.02 0.00 0.00 0.00 0.00 44.72 44.49 1uhz s GLY 53 CO -0.09 -0.48 -0.07 -0.51 0.00 0.00 0.00 173.10 171.95 1uhz s THR 54 N -2.97 0.69 -0.01 0.90 -4.23 -1.25 -0.10 115.64 108.67 1uhz s THR 54 Ca -0.02 -1.91 -0.07 0.00 -1.18 0.00 0.00 61.69 58.51 1uhz s THR 54 Cb 0.01 -1.65 0.02 0.00 1.34 0.00 0.00 72.50 72.22 1uhz s THR 54 CO -0.06 -0.86 0.32 0.61 -0.54 0.00 0.00 174.62 174.09 1uhz n GLY 55 N -0.00 0.52 0.22 3.99 0.00 -1.17 -4.23 105.19 104.53 1uhz n GLY 55 Ca -0.12 -0.88 0.11 0.00 0.00 0.00 0.00 46.02 45.13 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 -4.12 1.61 0.13 -1.91 -1.54 132.00 126.17 1uhz h PRO 56 Ca -0.05 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.95 1uhz h PRO 56 Cb 0.29 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.28 1uhz h PRO 56 CO 0.08 0.14 -0.54 0.54 -0.23 0.00 0.00 178.00 177.98 1uhz s ASN 57 N -6.11 0.29 0.18 1.44 4.22 -1.26 -4.57 114.94 109.13 1uhz s ASN 57 Ca 0.03 -0.94 -0.15 0.00 -2.14 0.00 0.00 52.86 49.66 1uhz s ASN 57 Cb 0.08 0.29 0.14 0.00 1.28 0.00 0.00 41.25 43.04 1uhz s ASN 57 CO 0.64 -0.70 1.68 0.50 -2.04 0.00 0.00 177.10 177.18 1uhz h LYS 58 N 2.90 0.07 0.00 3.55 3.64 -1.92 0.62 116.57 125.42 1uhz h LYS 58 Ca -0.34 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 1uhz h LYS 58 Cb 1.18 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1uhz h LYS 58 CO 0.60 0.04 0.00 1.63 -2.27 0.00 0.00 179.45 179.45 1uhz n LYS 59 N -5.25 0.00 -0.24 1.90 4.01 -1.26 0.89 118.16 118.21 1uhz n LYS 59 Ca 0.04 0.66 -0.00 0.00 -0.51 0.00 0.00 58.31 58.49 1uhz n LYS 59 Cb 0.24 -1.18 0.07 0.00 -0.51 0.00 0.00 35.03 33.64 1uhz n LYS 59 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 1uhz h ILE 60 N 0.00 0.28 -1.20 -0.18 2.04 -1.90 1.46 117.51 118.02 1uhz h ILE 60 Ca 0.00 0.00 0.34 0.00 1.00 0.00 0.00 64.86 66.20 1uhz h ILE 60 Cb 0.00 0.28 -0.08 0.00 -0.74 0.00 0.00 36.82 36.29 1uhz h ILE 60 CO 0.00 0.00 0.82 0.00 0.00 0.00 0.00 178.15 178.97 1uhz h ALA 61 N 1.62 2.81 -0.03 1.87 0.00 0.91 0.70 119.26 127.13 1uhz h ALA 61 Ca 0.32 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1uhz h ALA 61 Cb 0.52 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1uhz h ALA 61 CO -0.72 -1.22 -0.08 -0.22 0.00 0.00 0.00 179.25 177.01 1uhz h LYS 62 N 0.15 0.10 -0.90 0.00 3.64 0.86 -2.25 116.57 118.17 1uhz h LYS 62 Ca 0.63 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 60.00 1uhz h LYS 62 Cb 2.13 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 33.90 1uhz h LYS 62 CO -0.16 0.69 0.57 0.87 -2.27 0.00 0.00 179.45 179.15 1uhz h LYS 63 N -0.46 1.01 -0.47 1.90 1.57 0.11 0.79 116.57 121.01 1uhz h LYS 63 Ca -0.00 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1uhz h LYS 63 Cb 0.69 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 1uhz h LYS 63 CO 0.02 0.67 0.22 -0.91 -0.57 0.00 0.00 179.45 178.87 1uhz h ASN 64 N 1.04 0.59 -0.02 0.86 2.35 -0.16 -1.13 115.58 119.10 1uhz h ASN 64 Ca 0.39 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 56.09 1uhz h ASN 64 Cb 0.16 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 1uhz h ASN 64 CO -0.17 0.52 0.01 0.00 -1.65 0.00 0.00 177.43 176.14 1uhz h ALA 65 N 1.58 0.03 -0.62 -0.83 0.00 -0.24 -1.93 119.26 117.25 1uhz h ALA 65 Ca 0.17 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.09 1uhz h ALA 65 Cb 0.09 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1uhz h ALA 65 CO -0.02 -0.46 0.37 0.00 0.00 0.00 0.00 179.25 179.14 1uhz h ALA 66 N 0.98 0.81 -0.02 0.00 0.00 -0.77 -2.11 119.26 118.15 1uhz h ALA 66 Ca 0.01 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1uhz h ALA 66 Cb 0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1uhz h ALA 66 CO -0.00 0.09 -0.19 1.49 0.00 0.00 0.00 179.25 180.64 1uhz h GLU 67 N 0.71 -0.22 -0.54 0.00 4.81 -0.76 -0.15 114.58 118.44 1uhz h GLU 67 Ca 0.26 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.56 1uhz h GLU 67 Cb 0.07 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 29.42 1uhz h GLU 67 CO -0.13 -0.14 -0.49 0.00 -0.73 0.00 0.00 179.01 177.52 1uhz h ALA 68 N -1.09 -0.63 -0.95 2.92 0.00 -1.21 0.68 119.26 118.98 1uhz h ALA 68 Ca 0.01 0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.12 1uhz h ALA 68 Cb 0.25 1.17 -0.17 0.00 0.00 0.00 0.00 17.79 19.04 1uhz h ALA 68 CO -0.14 -0.90 -0.31 -0.12 0.00 0.00 0.00 179.25 177.78 1uhz n MET 69 N -4.97 -0.16 0.13 0.00 0.00 -0.81 0.15 117.12 111.46 1uhz n MET 69 Ca -0.01 1.47 -0.14 0.00 -0.00 0.00 0.00 57.70 59.03 1uhz n MET 69 Cb 0.27 -2.19 -0.08 0.00 0.00 0.00 0.00 33.22 31.21 1uhz n MET 69 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 1uhz h LEU 70 N 0.00 -0.26 -0.75 -0.89 3.38 0.11 0.61 115.31 117.51 1uhz h LEU 70 Ca 0.39 -0.14 0.17 0.00 0.09 0.00 0.00 57.88 58.38 1uhz h LEU 70 Cb 0.63 0.07 -0.11 0.00 0.09 0.00 0.00 40.66 41.33 1uhz h LEU 70 CO -0.96 -0.00 0.18 -0.07 0.09 0.00 0.00 178.44 177.68 1uhz h LEU 71 N -0.52 0.00 -0.10 1.67 -0.00 0.43 0.77 115.31 117.56 1uhz h LEU 71 Ca -0.03 0.15 -0.03 0.00 -0.00 0.00 0.00 57.88 57.97 1uhz h LEU 71 Cb 0.39 0.21 -0.00 0.00 -0.00 0.00 0.00 40.66 41.25 1uhz h LEU 71 CO 0.05 -0.05 -0.07 0.06 -0.00 0.00 0.00 178.44 178.43 1uhz h GLN 72 N 0.26 0.23 -0.54 1.13 3.07 0.16 -3.23 115.11 116.19 1uhz h GLN 72 Ca 0.43 -0.11 0.08 0.00 0.09 0.00 0.00 58.65 59.14 1uhz h GLN 72 Cb 0.75 -0.00 -0.10 0.00 0.08 0.00 0.00 27.48 28.20 1uhz h GLN 72 CO -0.53 0.60 -0.44 -0.07 0.09 0.00 0.00 178.83 178.48 1uhz h LEU 73 N -0.15 -1.50 0.00 0.06 4.07 0.21 -3.46 115.31 114.53 1uhz h LEU 73 Ca 0.02 0.24 0.00 0.00 0.08 0.00 0.00 57.88 58.22 1uhz h LEU 73 Cb 0.55 0.67 0.00 0.00 1.08 0.00 0.00 40.66 42.96 1uhz h LEU 73 CO 0.02 -0.34 0.00 0.61 -1.08 0.00 0.00 178.44 177.64 1uhz n GLY 74 N -1.40 0.96 0.02 0.83 0.00 0.08 -5.04 105.19 100.63 1uhz n GLY 74 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 0.00 -2.23 1.61 4.01 -1.11 -4.63 117.16 114.81 1uhz n TYR 75 Ca 0.00 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.75 1uhz n TYR 75 Cb 0.00 -0.40 -0.00 0.00 -0.31 0.00 0.00 39.34 38.63 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 -2.11 0.00 -0.07 -0.72 4.76 -1.26 -4.89 118.16 113.88 1uhz n LYS 76 Ca -0.07 -1.35 -0.16 0.00 -2.87 0.00 0.00 58.31 53.86 1uhz n LYS 76 Cb 0.50 -0.07 -0.13 0.00 -1.84 0.00 0.00 35.03 33.49 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 0.45 0.04 0.58 7.82 0.00 -1.82 -2.78 119.26 123.55 1uhz h ALA 77 Ca -0.19 -0.64 -0.03 0.00 0.00 0.00 0.00 54.91 54.05 1uhz h ALA 77 Cb 1.59 0.14 0.01 0.00 0.00 0.00 0.00 17.79 19.52 1uhz h ALA 77 CO 0.00 0.15 -0.28 0.77 0.00 0.00 0.00 179.25 179.90 1uhz h SER 78 N -0.96 -0.66 -0.67 0.00 0.02 -1.90 -2.76 113.55 106.63 1uhz h SER 78 Ca -0.07 0.02 0.12 0.00 -0.84 0.00 0.00 61.79 61.02 1uhz h SER 78 Cb 1.10 0.17 -0.09 0.00 0.14 0.00 0.00 62.40 63.72 1uhz h SER 78 CO -0.03 -0.47 0.23 0.74 -1.14 0.00 0.00 176.83 176.16 1uhz h THR 79 N -0.78 0.68 -0.32 -2.27 2.02 -1.91 -2.16 112.91 108.16 1uhz h THR 79 Ca -0.08 -0.13 0.03 0.00 0.77 0.00 0.00 66.41 67.00 1uhz h THR 79 Cb 0.60 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.23 1uhz h THR 79 CO 0.13 0.07 -0.24 -1.28 0.37 0.00 0.00 175.52 174.57 1uhz h SER 80 N 0.38 -0.85 -0.04 4.18 0.87 -1.20 0.52 113.55 117.41 1uhz h SER 80 Ca 0.36 0.12 0.02 0.00 -1.23 0.00 0.00 61.79 61.06 1uhz h SER 80 Cb 0.52 0.37 -0.05 0.00 -0.44 0.00 0.00 62.40 62.79 1uhz h SER 80 CO -0.38 -0.12 -0.46 -0.07 -0.53 0.00 0.00 176.83 175.27 1uhz h LEU 81 N -0.06 -1.44 -0.70 2.23 4.07 -1.29 -1.86 115.31 116.26 1uhz h LEU 81 Ca 0.05 0.16 0.06 0.00 0.08 0.00 0.00 57.88 58.24 1uhz h LEU 81 Cb 0.20 0.55 -0.08 0.00 1.08 0.00 0.00 40.66 42.40 1uhz h LEU 81 CO -0.33 -0.44 -0.41 0.00 -1.08 0.00 0.00 178.44 176.17 1uhz n GLN 82 N -5.01 -0.31 -0.38 1.13 6.02 -0.64 0.15 117.38 118.34 1uhz n GLN 82 Ca -0.06 1.31 -0.04 0.00 -0.01 0.00 0.00 57.00 58.20 1uhz n GLN 82 Cb 0.33 -1.93 -0.00 0.00 1.02 0.00 0.00 30.24 29.66 1uhz n GLN 82 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1uhz h ASP 83 N 0.00 -1.62 -0.32 1.08 3.58 0.54 0.61 116.42 120.28 1uhz h ASP 83 Ca 0.11 0.31 0.06 0.00 0.42 0.00 0.00 57.03 57.94 1uhz h ASP 83 Cb 0.29 0.80 -0.06 0.00 1.72 0.00 0.00 39.33 42.08 1uhz h ASP 83 CO -0.66 -0.28 -0.08 -1.28 -2.88 0.00 0.00 179.24 174.06 1uhz h SER 84 N -0.02 -0.30 0.00 2.28 0.87 0.50 -3.43 113.55 113.45 1uhz h SER 84 Ca 0.29 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.94 1uhz h SER 84 Cb 0.55 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 1uhz h SER 84 CO -0.95 -0.11 0.00 0.61 -0.53 0.00 0.00 176.83 175.85 1uhz n GLY 85 N -1.27 1.80 3.76 5.77 0.00 0.21 -5.11 105.19 110.36 1uhz n GLY 85 Ca 0.00 -1.81 -0.30 0.00 0.00 0.00 0.00 46.02 43.91 1uhz n GLY 85 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uhz s PRO 86 N 3.81 -0.61 0.18 1.61 0.04 -1.20 -4.83 135.00 134.01 1uhz s PRO 86 Ca 0.00 -0.37 0.00 0.00 0.04 0.00 0.00 61.00 60.67 1uhz s PRO 86 Cb 0.00 -1.70 0.00 0.00 0.04 0.00 0.00 34.50 32.84 1uhz s PRO 86 CO 0.00 -3.25 0.00 0.45 0.04 0.00 0.00 177.00 174.24 1uhz n SER 87 N -4.37 0.19 0.40 6.66 2.88 -1.26 -4.35 113.62 113.78 1uhz n SER 87 Ca 0.16 0.30 -0.16 0.00 -1.33 0.00 0.00 58.87 57.84 1uhz n SER 87 Cb 0.59 0.13 -0.08 0.00 -0.75 0.00 0.00 64.21 64.11 1uhz n SER 87 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1uhz h SER 88 N 0.00 -0.89 0.00 -3.46 0.02 -1.98 -3.52 113.55 103.72 1uhz h SER 88 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1uhz h SER 88 Cb 0.08 0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1uhz h SER 88 CO 0.00 -0.54 0.00 0.61 -1.14 0.00 0.00 176.83 175.76