#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhz n SER 2 N 0.00 -6.13 -4.58 1.61 2.88 -1.26 -4.89 113.62 101.24 1uhz n SER 2 Ca 0.00 0.38 -0.45 0.00 -1.33 0.00 0.00 58.87 57.47 1uhz n SER 2 Cb 0.00 -4.05 -0.02 0.00 -0.75 0.00 0.00 64.21 59.39 1uhz n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1uhz n SER 3 N -0.35 1.23 -4.15 -3.46 2.88 -1.26 -4.90 113.62 103.62 1uhz n SER 3 Ca 0.08 1.17 -0.32 0.00 -1.33 0.00 0.00 58.87 58.47 1uhz n SER 3 Cb 0.31 -1.27 0.15 0.00 -0.75 0.00 0.00 64.21 62.65 1uhz n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uhz n GLY 4 N 1.39 -2.59 1.45 0.46 0.00 -1.26 -4.71 105.19 99.92 1uhz n GLY 4 Ca 0.11 -0.67 0.18 0.00 0.00 0.00 0.00 46.02 45.64 1uhz n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uhz n SER 5 N -0.70 -8.20 -4.72 1.61 7.64 -1.26 -4.68 113.62 103.31 1uhz n SER 5 Ca 0.01 1.22 -0.42 0.00 1.01 0.00 0.00 58.87 60.68 1uhz n SER 5 Cb 0.62 -4.81 -0.03 0.00 -1.01 0.00 0.00 64.21 58.98 1uhz n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1uhz s SER 6 N -7.20 6.49 0.31 6.43 0.01 -1.26 -5.00 113.70 113.48 1uhz s SER 6 Ca 0.00 2.73 0.03 0.00 1.31 0.00 0.00 55.95 60.02 1uhz s SER 6 Cb 0.00 -2.60 -0.06 0.00 0.21 0.00 0.00 66.02 63.58 1uhz s SER 6 CO 0.00 -0.90 0.07 -0.83 0.41 0.00 0.00 173.24 172.00 1uhz s GLY 7 N 1.22 2.02 0.19 3.44 0.00 -1.26 -5.05 107.32 107.88 1uhz s GLY 7 Ca 0.73 -1.95 0.03 0.00 0.00 0.00 0.00 44.72 43.53 1uhz s GLY 7 CO 0.32 -1.76 1.43 -0.56 0.00 0.00 0.00 173.10 172.53 1uhz h PRO 8 N 2.16 0.19 0.18 2.90 0.13 -1.95 -2.11 132.00 133.50 1uhz h PRO 8 Ca -0.40 -0.18 -0.01 0.00 -0.87 0.00 0.00 66.00 64.54 1uhz h PRO 8 Cb 1.25 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1uhz h PRO 8 CO 0.66 0.89 -0.08 0.82 -0.23 0.00 0.00 178.00 180.06 1uhz h ILE 9 N 0.11 0.00 -0.36 -3.56 1.08 -1.88 -1.47 117.51 111.43 1uhz h ILE 9 Ca -0.03 -0.04 0.08 0.00 -0.39 0.00 0.00 64.86 64.47 1uhz h ILE 9 Cb 1.40 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 35.06 1uhz h ILE 9 CO 0.12 0.00 -0.26 -1.28 -0.69 0.00 0.00 178.15 176.05 1uhz h SER 10 N -0.28 -0.85 -1.06 1.72 0.87 -1.97 0.46 113.55 112.45 1uhz h SER 10 Ca -0.02 0.16 0.30 0.00 -1.23 0.00 0.00 61.79 61.00 1uhz h SER 10 Cb 0.18 0.42 -0.12 0.00 -0.44 0.00 0.00 62.40 62.44 1uhz h SER 10 CO 0.04 -0.28 0.65 -0.09 -0.53 0.00 0.00 176.83 176.62 1uhz h ARG 11 N -0.21 0.37 -0.01 2.24 2.43 -1.43 1.46 114.38 119.25 1uhz h ARG 11 Ca 0.17 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.26 1uhz h ARG 11 Cb 0.48 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1uhz h ARG 11 CO -0.48 0.25 -0.23 1.25 -1.51 0.00 0.00 179.97 179.24 1uhz h LEU 12 N 0.38 0.22 -0.75 3.80 6.46 0.60 -2.78 115.31 123.23 1uhz h LEU 12 Ca 0.68 -0.76 0.06 0.00 -0.12 0.00 0.00 57.88 57.74 1uhz h LEU 12 Cb 1.62 -0.07 -0.06 0.00 -0.73 0.00 0.00 40.66 41.43 1uhz h LEU 12 CO -0.44 0.95 0.45 0.00 -0.62 0.00 0.00 178.44 178.77 1uhz h ALA 13 N 0.28 1.02 0.00 1.25 0.00 0.31 0.21 119.26 122.32 1uhz h ALA 13 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1uhz h ALA 13 Cb 0.98 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1uhz h ALA 13 CO 0.05 0.17 -0.06 1.96 0.00 0.00 0.00 179.25 181.36 1uhz h GLN 14 N 0.83 0.00 0.12 0.00 4.20 0.18 0.85 115.11 121.29 1uhz h GLN 14 Ca 0.33 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.76 1uhz h GLN 14 Cb 0.16 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.95 1uhz h GLN 14 CO -0.17 0.06 -1.22 0.82 -0.67 0.00 0.00 178.83 177.65 1uhz h ILE 15 N 0.00 1.45 -0.16 2.54 2.04 -0.50 0.13 117.51 123.01 1uhz h ILE 15 Ca -0.00 -2.89 -0.11 0.00 1.00 0.00 0.00 64.86 62.86 1uhz h ILE 15 Cb 0.12 2.86 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 1uhz h ILE 15 CO 0.01 0.85 -0.37 1.56 0.00 0.00 0.00 178.15 180.20 1uhz h GLN 16 N 0.12 0.35 0.15 2.37 1.08 0.52 0.14 115.11 119.83 1uhz h GLN 16 Ca -0.14 -0.16 -0.28 0.00 -1.45 0.00 0.00 58.65 56.62 1uhz h GLN 16 Cb 1.93 -0.01 0.01 0.00 -0.05 0.00 0.00 27.48 29.36 1uhz h GLN 16 CO 0.21 0.68 -1.35 -0.56 -0.95 0.00 0.00 178.83 176.85 1uhz h GLN 17 N 0.30 0.33 -0.07 1.46 3.07 -0.91 -2.48 115.11 116.80 1uhz h GLN 17 Ca 0.03 -0.56 -0.05 0.00 0.09 0.00 0.00 58.65 58.16 1uhz h GLN 17 Cb 0.80 0.21 -0.01 0.00 0.08 0.00 0.00 27.48 28.56 1uhz h GLN 17 CO 0.06 1.27 -0.17 0.00 0.09 0.00 0.00 178.83 180.08 1uhz h ALA 18 N 0.04 1.58 0.00 0.06 0.00 -0.69 -0.56 119.26 119.68 1uhz h ALA 18 Ca -0.27 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1uhz h ALA 18 Cb 1.86 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1uhz h ALA 18 CO 0.13 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.69 1uhz h ARG 19 N 0.11 0.00 -2.28 0.00 3.08 -0.81 -3.47 114.38 111.02 1uhz h ARG 19 Ca 0.02 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.78 1uhz h ARG 19 Cb 0.38 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 1uhz h ARG 19 CO 0.02 0.00 -0.38 1.63 -1.07 0.00 0.00 179.97 180.17 1uhz n LYS 20 N -2.90 -1.53 0.00 0.04 5.02 -0.22 -4.93 118.16 113.64 1uhz n LYS 20 Ca 0.03 0.70 0.00 0.00 -2.02 0.00 0.00 58.31 57.02 1uhz n LYS 20 Cb 0.45 -5.01 0.00 0.00 -0.02 0.00 0.00 35.03 30.45 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 -2.51 0.00 0.00 1.97 -0.58 -0.95 -5.05 120.64 113.52 1uhz n GLU 21 Ca -0.16 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1uhz n GLU 21 Cb 0.62 -0.32 0.00 0.00 -0.57 0.00 0.00 31.44 31.17 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 -2.08 0.00 -0.97 3.49 5.02 -1.11 -5.06 118.16 117.45 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 -0.31 -0.06 -2.50 1.97 1.02 -1.26 -4.72 120.64 114.78 1uhz n GLU 23 Ca 0.00 -0.01 -0.34 0.00 -0.02 0.00 0.00 57.16 56.79 1uhz n GLU 23 Cb 0.00 -1.14 -0.03 0.00 -0.02 0.00 0.00 31.44 30.25 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 -2.27 3.76 -0.40 3.49 0.04 -1.26 -4.86 135.00 133.50 1uhz s PRO 24 Ca 0.43 1.34 -0.06 0.00 0.04 0.00 0.00 61.00 62.74 1uhz s PRO 24 Cb -0.17 -2.09 0.08 0.00 0.04 0.00 0.00 34.50 32.37 1uhz s PRO 24 CO 0.80 -0.46 0.21 0.34 0.04 0.00 0.00 177.00 177.92 1uhz s ASP 25 N -2.07 5.43 -0.01 6.66 2.15 0.89 -4.91 116.67 124.80 1uhz s ASP 25 Ca 0.67 -1.63 -0.21 0.00 0.43 0.00 0.00 52.55 51.80 1uhz s ASP 25 Cb -0.16 -1.90 -0.05 0.00 -0.30 0.00 0.00 42.92 40.50 1uhz s ASP 25 CO 0.22 -0.51 0.63 -0.31 -0.17 0.00 0.00 175.17 175.03 1uhz s TYR 26 N 1.32 3.67 -0.04 -5.34 2.02 -1.26 0.42 117.35 118.14 1uhz s TYR 26 Ca 0.03 1.23 0.02 0.00 -0.37 0.00 0.00 57.07 57.98 1uhz s TYR 26 Cb -0.23 -2.66 0.01 0.00 -0.40 0.00 0.00 41.96 38.69 1uhz s TYR 26 CO -0.00 0.30 -0.07 0.42 -1.57 0.00 0.00 175.55 174.62 1uhz s ILE 27 N 0.01 0.70 -0.32 2.71 1.09 0.88 -4.96 121.20 121.30 1uhz s ILE 27 Ca 0.33 -0.25 -0.29 0.00 -1.10 0.00 0.00 60.65 59.34 1uhz s ILE 27 Cb -0.18 -0.67 0.02 0.00 -1.06 0.00 0.00 42.46 40.56 1uhz s ILE 27 CO 0.18 0.25 1.06 -0.22 -0.10 0.00 0.00 174.94 176.10 1uhz s LEU 28 N 0.63 3.94 -0.03 2.97 1.98 -1.26 0.10 118.68 127.01 1uhz s LEU 28 Ca -0.10 1.01 -0.08 0.00 -2.89 0.00 0.00 54.13 52.07 1uhz s LEU 28 Cb -0.13 -3.51 -0.04 0.00 0.66 0.00 0.00 46.19 43.17 1uhz s LEU 28 CO 0.01 -0.87 0.45 -0.07 -1.89 0.00 0.00 176.35 173.97 1uhz h LEU 29 N 10.07 -0.23 0.00 -0.68 3.38 -1.18 -3.48 115.31 123.20 1uhz h LEU 29 Ca -0.21 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1uhz h LEU 29 Cb 1.06 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1uhz h LEU 29 CO 1.02 0.03 0.03 -0.24 0.09 0.00 0.00 178.44 179.38 1uhz n SER 30 N -3.82 -0.17 -3.23 -0.43 2.88 -1.10 -4.99 113.62 102.76 1uhz n SER 30 Ca -0.03 -1.11 -0.02 0.00 -1.33 0.00 0.00 58.87 56.39 1uhz n SER 30 Cb 0.11 0.28 -0.03 0.00 -0.75 0.00 0.00 64.21 63.81 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 -2.01 0.49 0.24 -1.46 1.03 -1.26 -0.65 118.70 115.07 1uhz s GLU 31 Ca 0.02 0.62 -0.11 0.00 0.03 0.00 0.00 54.97 55.52 1uhz s GLU 31 Cb -0.00 0.08 -0.01 0.00 -0.80 0.00 0.00 34.13 33.40 1uhz s GLU 31 CO 0.01 -0.81 0.42 1.03 -1.33 0.00 0.00 175.26 174.58 1uhz s ARG 32 N 2.72 1.49 0.00 -4.83 3.00 0.13 -4.94 118.95 116.51 1uhz s ARG 32 Ca 0.14 -1.30 0.00 0.00 0.00 0.00 0.00 55.73 54.57 1uhz s ARG 32 Cb -0.13 0.44 0.00 0.00 0.00 0.00 0.00 34.95 35.26 1uhz s ARG 32 CO -0.23 -0.60 0.00 0.41 0.00 0.00 0.00 175.30 174.88 1uhz n GLY 33 N -0.36 0.56 3.30 -3.53 0.00 -1.26 0.14 105.19 104.04 1uhz n GLY 33 Ca -0.01 -2.16 -0.35 0.00 0.00 0.00 0.00 46.02 43.49 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 -0.14 0.01 0.03 1.61 2.81 -1.26 -4.67 117.12 115.50 1uhz n MET 34 Ca 0.00 0.03 -0.18 0.00 -1.81 0.00 0.00 57.70 55.74 1uhz n MET 34 Cb 0.00 -1.52 -0.08 0.00 -0.71 0.00 0.00 33.22 30.92 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 -0.86 0.68 0.71 0.03 0.13 -1.98 -1.41 132.00 129.30 1uhz h PRO 35 Ca -0.44 -0.65 -0.03 0.00 -0.87 0.00 0.00 66.00 64.00 1uhz h PRO 35 Cb 1.33 0.17 0.01 0.00 0.13 0.00 0.00 31.00 32.63 1uhz h PRO 35 CO 0.35 1.25 -0.34 0.00 -0.23 0.00 0.00 178.00 179.03 1uhz h ARG 36 N 0.41 -0.92 -2.70 0.86 -0.00 -2.01 -3.37 114.38 106.67 1uhz h ARG 36 Ca -0.09 0.06 -0.61 0.00 -0.50 0.00 0.00 59.98 58.84 1uhz h ARG 36 Cb 1.57 0.21 -0.41 0.00 0.00 0.00 0.00 29.97 31.33 1uhz h ARG 36 CO 0.18 -0.59 -0.69 0.54 0.00 0.00 0.00 179.97 179.41 1uhz n ARG 37 N -5.45 1.56 -1.70 0.04 3.00 -1.25 -5.10 116.66 107.76 1uhz n ARG 37 Ca -0.13 -4.18 -0.38 0.00 -0.01 0.00 0.00 57.85 53.15 1uhz n ARG 37 Cb 0.39 -2.09 0.05 0.00 0.00 0.00 0.00 32.46 30.82 1uhz n ARG 37 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1uhz n ARG 38 N 1.88 1.32 -3.45 5.56 0.63 -0.53 -4.21 116.66 117.86 1uhz n ARG 38 Ca 0.24 0.50 -0.39 0.00 -0.92 0.00 0.00 57.85 57.27 1uhz n ARG 38 Cb 0.40 -2.44 -0.10 0.00 0.45 0.00 0.00 32.46 30.78 1uhz n ARG 38 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 1uhz s GLU 39 N -2.94 3.81 -0.19 -0.14 2.12 0.38 -3.93 118.70 117.81 1uhz s GLU 39 Ca 0.75 -0.26 -0.08 0.00 0.36 0.00 0.00 54.97 55.75 1uhz s GLU 39 Cb -0.41 -3.72 -0.04 0.00 0.26 0.00 0.00 34.13 30.21 1uhz s GLU 39 CO 0.47 -0.35 0.08 -0.06 -0.54 0.00 0.00 175.26 174.85 1uhz s PHE 40 N 1.95 3.27 -0.26 5.30 0.40 -0.88 0.20 117.98 127.96 1uhz s PHE 40 Ca 0.11 0.09 -0.16 0.00 -0.60 0.00 0.00 56.93 56.37 1uhz s PHE 40 Cb -0.16 -2.12 -0.03 0.00 0.51 0.00 0.00 43.02 41.22 1uhz s PHE 40 CO 0.11 0.13 0.45 0.08 0.70 0.00 0.00 175.22 176.69 1uhz s VAL 41 N 0.50 5.13 0.09 -0.44 1.01 0.17 -3.22 120.40 123.64 1uhz s VAL 41 Ca 0.04 0.74 0.08 0.00 0.00 0.00 0.00 61.98 62.85 1uhz s VAL 41 Cb -0.12 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 1uhz s VAL 41 CO 0.01 0.13 -0.19 -0.32 0.00 0.00 0.00 175.10 174.73 1uhz s MET 42 N 2.09 1.86 0.11 2.72 1.75 0.13 -0.61 119.30 127.36 1uhz s MET 42 Ca 0.18 -1.12 0.09 0.00 -1.25 0.00 0.00 55.69 53.60 1uhz s MET 42 Cb -0.16 -2.12 -0.04 0.00 2.84 0.00 0.00 34.83 35.36 1uhz s MET 42 CO 0.09 0.50 -0.22 -1.14 -0.65 0.00 0.00 175.02 173.60 1uhz s GLN 43 N -1.83 1.21 -0.03 4.11 0.74 0.28 0.22 119.66 124.35 1uhz s GLN 43 Ca 0.16 -1.23 0.00 0.00 0.05 0.00 0.00 55.36 54.35 1uhz s GLN 43 Cb -0.10 -1.52 0.03 0.00 1.10 0.00 0.00 33.01 32.51 1uhz s GLN 43 CO 0.08 0.35 -0.00 0.54 -0.55 0.00 0.00 175.29 175.70 1uhz s VAL 44 N -1.20 0.22 -0.22 1.34 0.11 0.13 -0.09 120.40 120.70 1uhz s VAL 44 Ca 0.09 0.06 -0.00 0.00 -2.93 0.00 0.00 61.98 59.20 1uhz s VAL 44 Cb -0.10 -0.31 0.02 0.00 -1.53 0.00 0.00 36.38 34.47 1uhz s VAL 44 CO 0.05 0.15 -0.12 -0.75 -3.33 0.00 0.00 175.10 171.10 1uhz s LYS 45 N 1.01 2.88 -0.23 1.54 2.20 0.17 0.30 119.74 127.60 1uhz s LYS 45 Ca -0.10 -0.93 0.01 0.00 -0.36 0.00 0.00 55.97 54.59 1uhz s LYS 45 Cb -0.14 -2.81 0.06 0.00 -1.51 0.00 0.00 37.83 33.43 1uhz s LYS 45 CO -0.01 -0.33 -0.06 0.08 -0.36 0.00 0.00 175.35 174.67 1uhz s VAL 46 N 1.30 1.55 0.00 4.02 1.01 0.11 -0.08 120.40 128.31 1uhz s VAL 46 Ca 0.01 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 60.79 1uhz s VAL 46 Cb -0.15 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.43 1uhz s VAL 46 CO -0.08 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.56 1uhz n GLY 47 N 4.67 1.25 0.96 4.51 0.00 -1.26 0.21 105.19 115.53 1uhz n GLY 47 Ca -0.12 0.45 0.02 0.00 0.00 0.00 0.00 46.02 46.36 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 10.99 2.93 -4.26 1.61 2.85 -1.26 -4.99 115.26 123.12 1uhz n ASN 48 Ca 0.00 -3.46 -0.17 0.00 -0.11 0.00 0.00 54.58 50.84 1uhz n ASN 48 Cb 0.00 -0.58 -0.11 0.00 1.24 0.00 0.00 39.78 40.33 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 -3.07 1.09 0.03 1.20 8.01 0.13 -5.16 118.70 120.93 1uhz s GLU 49 Ca 0.43 -1.36 -0.02 0.00 0.01 0.00 0.00 54.97 54.03 1uhz s GLU 49 Cb 0.37 -0.88 -0.02 0.00 -4.31 0.00 0.00 34.13 29.29 1uhz s GLU 49 CO 0.03 0.15 -0.00 0.54 0.01 0.00 0.00 175.26 175.99 1uhz s VAL 50 N -2.60 0.14 0.22 2.63 0.11 -1.26 0.09 120.40 119.73 1uhz s VAL 50 Ca 0.14 -1.16 -0.09 0.00 -2.93 0.00 0.00 61.98 57.93 1uhz s VAL 50 Cb -0.02 -0.70 -0.01 0.00 -1.53 0.00 0.00 36.38 34.11 1uhz s VAL 50 CO 0.03 -0.64 0.36 0.00 -3.33 0.00 0.00 175.10 171.52 1uhz s ALA 51 N -2.29 0.16 0.12 1.54 0.00 0.15 -4.94 121.76 116.50 1uhz s ALA 51 Ca -0.08 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 50.83 1uhz s ALA 51 Cb -0.04 1.12 -0.04 0.00 0.00 0.00 0.00 23.12 24.17 1uhz s ALA 51 CO -0.04 -0.76 -0.10 0.95 0.00 0.00 0.00 175.76 175.81 1uhz s THR 52 N -4.05 1.07 -0.07 0.00 -4.23 -1.26 0.19 115.64 107.30 1uhz s THR 52 Ca 0.26 -1.83 -0.03 0.00 -1.18 0.00 0.00 61.69 58.91 1uhz s THR 52 Cb 0.02 -1.59 0.04 0.00 1.34 0.00 0.00 72.50 72.31 1uhz s THR 52 CO 0.08 -0.63 0.15 -0.83 -0.54 0.00 0.00 174.62 172.86 1uhz s GLY 53 N -2.76 -0.05 -0.03 3.99 0.00 0.13 -4.01 107.32 104.59 1uhz s GLY 53 Ca 0.11 0.68 0.06 0.00 0.00 0.00 0.00 44.72 45.56 1uhz s GLY 53 CO 0.00 0.95 -0.20 -0.51 0.00 0.00 0.00 173.10 173.34 1uhz s THR 54 N 1.06 1.63 0.19 0.90 -4.23 -1.25 0.21 115.64 114.15 1uhz s THR 54 Ca -0.08 -0.86 -0.05 0.00 -1.18 0.00 0.00 61.69 59.52 1uhz s THR 54 Cb -0.10 -1.37 0.02 0.00 1.34 0.00 0.00 72.50 72.39 1uhz s THR 54 CO -0.06 0.46 0.34 0.61 -0.54 0.00 0.00 174.62 175.44 1uhz n GLY 55 N 2.81 1.85 0.14 3.99 0.00 -1.20 -4.59 105.19 108.19 1uhz n GLY 55 Ca -0.16 -1.24 0.13 0.00 0.00 0.00 0.00 46.02 44.74 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 -3.52 1.61 0.13 -1.88 -2.34 132.00 126.00 1uhz h PRO 56 Ca -0.15 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.88 1uhz h PRO 56 Cb 0.59 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 31.56 1uhz h PRO 56 CO 0.20 0.00 -0.34 0.54 -0.23 0.00 0.00 178.00 178.17 1uhz s ASN 57 N -4.64 -0.01 0.19 1.44 4.22 -1.25 -3.78 114.94 111.12 1uhz s ASN 57 Ca 0.07 -0.36 -0.19 0.00 -2.14 0.00 0.00 52.86 50.24 1uhz s ASN 57 Cb 0.10 0.32 0.16 0.00 1.28 0.00 0.00 41.25 43.11 1uhz s ASN 57 CO 0.51 -0.61 1.59 0.50 -2.04 0.00 0.00 177.10 177.06 1uhz h LYS 58 N 3.26 -0.12 0.00 3.55 3.64 -1.89 0.19 116.57 125.20 1uhz h LYS 58 Ca -0.32 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 1uhz h LYS 58 Cb 1.20 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 1uhz h LYS 58 CO 0.49 -0.08 0.00 1.63 -2.27 0.00 0.00 179.45 179.22 1uhz n LYS 59 N -5.44 0.00 -0.25 1.90 4.01 -1.26 -0.01 118.16 117.11 1uhz n LYS 59 Ca 0.05 0.83 0.04 0.00 -0.51 0.00 0.00 58.31 58.72 1uhz n LYS 59 Cb 0.35 -1.34 0.13 0.00 -0.51 0.00 0.00 35.03 33.67 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 0.32 -1.20 -0.18 2.04 -1.80 1.47 117.51 118.16 1uhz h ILE 60 Ca 0.00 -0.02 0.34 0.00 1.00 0.00 0.00 64.86 66.18 1uhz h ILE 60 Cb 0.00 0.25 -0.07 0.00 -0.74 0.00 0.00 36.82 36.26 1uhz h ILE 60 CO 0.00 0.01 0.83 0.00 0.00 0.00 0.00 178.15 178.99 1uhz h ALA 61 N 1.71 2.85 0.09 1.87 0.00 0.24 1.34 119.26 127.36 1uhz h ALA 61 Ca 0.39 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.15 1uhz h ALA 61 Cb 0.66 0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.55 1uhz h ALA 61 CO -0.69 -1.26 -0.64 -0.22 0.00 0.00 0.00 179.25 176.44 1uhz h LYS 62 N 0.13 0.28 -0.83 0.00 3.11 0.58 -2.18 116.57 117.65 1uhz h LYS 62 Ca 0.62 -0.42 -0.00 0.00 -2.81 0.00 0.00 60.65 58.05 1uhz h LYS 62 Cb 2.16 0.15 -0.04 0.00 -1.00 0.00 0.00 32.23 33.49 1uhz h LYS 62 CO -0.14 1.16 0.51 0.87 -2.81 0.00 0.00 179.45 179.05 1uhz h LYS 63 N -0.40 1.11 0.00 1.90 1.57 0.18 0.39 116.57 121.33 1uhz h LYS 63 Ca -0.10 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 1uhz h LYS 63 Cb 1.46 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 1uhz h LYS 63 CO 0.12 0.77 -0.29 -0.91 -0.57 0.00 0.00 179.45 178.57 1uhz h ASN 64 N 1.14 0.00 0.53 0.86 2.35 0.14 -2.18 115.58 118.41 1uhz h ASN 64 Ca 0.30 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 56.02 1uhz h ASN 64 Cb -0.07 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.30 1uhz h ASN 64 CO -0.06 0.29 -0.26 0.00 -1.65 0.00 0.00 177.43 175.75 1uhz h ALA 65 N 1.71 -0.72 -0.40 -0.83 0.00 -0.27 -2.33 119.26 116.43 1uhz h ALA 65 Ca -0.00 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.75 1uhz h ALA 65 Cb 0.82 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 1uhz h ALA 65 CO 0.04 -0.78 0.18 0.00 0.00 0.00 0.00 179.25 178.69 1uhz h ALA 66 N -0.67 0.49 -0.73 0.00 0.00 -1.35 -0.71 119.26 116.29 1uhz h ALA 66 Ca -0.07 0.02 0.13 0.00 0.00 0.00 0.00 54.91 54.99 1uhz h ALA 66 Cb 0.62 -0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.25 1uhz h ALA 66 CO 0.12 -0.19 -0.30 1.49 0.00 0.00 0.00 179.25 180.38 1uhz h GLU 67 N 0.37 -0.08 -0.60 0.00 4.81 -1.35 1.11 114.58 118.85 1uhz h GLU 67 Ca 0.17 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 1uhz h GLU 67 Cb 0.10 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 1uhz h GLU 67 CO -0.14 -0.05 0.22 0.00 -0.73 0.00 0.00 179.01 178.32 1uhz h ALA 68 N 1.33 0.78 -0.84 2.92 0.00 -0.85 0.67 119.26 123.27 1uhz h ALA 68 Ca 0.30 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1uhz h ALA 68 Cb 0.57 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1uhz h ALA 68 CO -0.78 0.40 0.55 1.98 0.00 0.00 0.00 179.25 181.41 1uhz h MET 69 N 0.83 1.04 -0.18 0.00 1.85 0.13 1.48 114.93 120.09 1uhz h MET 69 Ca 0.20 -0.06 -0.21 0.00 -0.61 0.00 0.00 59.70 59.02 1uhz h MET 69 Cb 0.22 -0.23 0.01 0.00 0.43 0.00 0.00 31.60 32.03 1uhz h MET 69 CO -0.01 0.69 -0.71 -0.07 -0.40 0.00 0.00 176.91 176.41 1uhz h LEU 70 N 1.07 0.87 -0.08 3.39 3.38 0.15 -1.61 115.31 122.48 1uhz h LEU 70 Ca 0.33 -0.54 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1uhz h LEU 70 Cb -0.02 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 1uhz h LEU 70 CO -0.09 1.33 -0.09 -0.07 0.09 0.00 0.00 178.44 179.61 1uhz h LEU 71 N 0.53 0.22 -1.68 1.67 3.38 0.02 0.15 115.31 119.61 1uhz h LEU 71 Ca -0.03 -0.49 0.06 0.00 0.09 0.00 0.00 57.88 57.50 1uhz h LEU 71 Cb 1.32 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 1uhz h LEU 71 CO 0.14 0.67 0.31 0.06 0.09 0.00 0.00 178.44 179.71 1uhz h GLN 72 N -0.22 0.39 -0.20 1.13 3.07 0.20 -0.34 115.11 119.14 1uhz h GLN 72 Ca 0.01 -0.02 -0.19 0.00 0.09 0.00 0.00 58.65 58.54 1uhz h GLN 72 Cb 0.61 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 28.08 1uhz h GLN 72 CO 0.02 0.26 -0.63 -0.07 0.09 0.00 0.00 178.83 178.50 1uhz h LEU 73 N 0.40 0.82 0.00 0.06 4.07 -1.13 -3.48 115.31 116.05 1uhz h LEU 73 Ca 0.20 -0.48 0.00 0.00 0.08 0.00 0.00 57.88 57.69 1uhz h LEU 73 Cb 0.28 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.79 1uhz h LEU 73 CO -0.05 1.25 0.00 0.61 -1.08 0.00 0.00 178.44 179.17 1uhz n GLY 74 N 0.45 1.30 0.00 0.83 0.00 -0.14 -5.02 105.19 102.61 1uhz n GLY 74 Ca -0.05 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.16 0.00 -2.33 1.61 4.02 0.43 -4.45 117.16 116.28 1uhz n TYR 75 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.93 1uhz n TYR 75 Cb 0.00 -0.13 0.04 0.00 -0.02 0.00 0.00 39.34 39.23 1uhz n TYR 75 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1uhz n LYS 76 N -1.63 0.21 -0.05 -0.72 5.02 -1.24 -4.83 118.16 114.92 1uhz n LYS 76 Ca 0.01 -2.08 -0.19 0.00 -2.02 0.00 0.00 58.31 54.02 1uhz n LYS 76 Cb 0.32 -0.26 -0.13 0.00 -0.02 0.00 0.00 35.03 34.94 1uhz n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uhz h ALA 77 N 0.91 0.14 -0.26 7.82 0.00 -1.82 -3.03 119.26 123.01 1uhz h ALA 77 Ca -0.18 -0.95 0.04 0.00 0.00 0.00 0.00 54.91 53.83 1uhz h ALA 77 Cb 1.74 0.41 -0.07 0.00 0.00 0.00 0.00 17.79 19.86 1uhz h ALA 77 CO 0.08 0.54 -0.51 1.03 0.00 0.00 0.00 179.25 180.38 1uhz h SER 78 N -0.71 -1.67 -0.11 0.00 0.87 -1.88 0.10 113.55 110.14 1uhz h SER 78 Ca -0.23 0.22 0.03 0.00 -1.23 0.00 0.00 61.79 60.58 1uhz h SER 78 Cb 1.41 0.68 -0.04 0.00 -0.44 0.00 0.00 62.40 64.01 1uhz h SER 78 CO -0.04 -0.44 -0.10 0.74 -0.53 0.00 0.00 176.83 176.47 1uhz h THR 79 N -0.48 0.71 -0.31 2.23 2.02 -1.92 -0.42 112.91 114.74 1uhz h THR 79 Ca 0.07 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.28 1uhz h THR 79 Cb 0.64 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.71 1uhz h THR 79 CO -0.51 0.00 -0.26 0.28 0.37 0.00 0.00 175.52 175.40 1uhz h SER 80 N -0.12 -0.91 -0.21 4.18 0.02 -1.16 0.40 113.55 115.74 1uhz h SER 80 Ca 0.08 0.13 0.06 0.00 -0.84 0.00 0.00 61.79 61.21 1uhz h SER 80 Cb 0.23 0.39 -0.07 0.00 0.14 0.00 0.00 62.40 63.09 1uhz h SER 80 CO -0.19 -0.14 -0.33 -0.07 -1.14 0.00 0.00 176.83 174.96 1uhz h LEU 81 N -0.09 -1.04 -0.88 5.07 3.38 -0.84 0.60 115.31 121.51 1uhz h LEU 81 Ca 0.05 0.16 0.17 0.00 0.09 0.00 0.00 57.88 58.36 1uhz h LEU 81 Cb 0.23 0.45 -0.17 0.00 0.09 0.00 0.00 40.66 41.27 1uhz h LEU 81 CO -0.35 -0.35 -0.22 1.56 0.09 0.00 0.00 178.44 179.17 1uhz h GLN 82 N -0.35 -0.00 0.27 1.13 4.20 0.45 0.91 115.11 121.71 1uhz h GLN 82 Ca 0.12 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 1uhz h GLN 82 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1uhz h GLN 82 CO -0.41 -0.00 -0.13 0.22 -0.67 0.00 0.00 178.83 177.84 1uhz h ASP 83 N -0.00 -0.30 -0.93 1.46 3.58 0.13 -2.19 116.42 118.17 1uhz h ASP 83 Ca 0.42 -0.01 0.17 0.00 0.42 0.00 0.00 57.03 58.03 1uhz h ASP 83 Cb 0.64 0.08 -0.08 0.00 1.72 0.00 0.00 39.33 41.69 1uhz h ASP 83 CO -0.90 -0.19 0.59 -1.28 -2.88 0.00 0.00 179.24 174.58 1uhz h SER 84 N -0.39 0.65 -4.03 2.28 0.87 0.17 -3.44 113.55 109.66 1uhz h SER 84 Ca -0.04 0.05 0.22 0.00 -1.23 0.00 0.00 61.79 60.80 1uhz h SER 84 Cb 0.30 -0.07 -0.21 0.00 -0.44 0.00 0.00 62.40 61.98 1uhz h SER 84 CO 0.06 0.29 0.79 -0.83 -0.53 0.00 0.00 176.83 176.62 1uhz s GLY 85 N -3.71 -0.23 -0.04 5.77 0.00 0.28 -5.08 107.32 104.31 1uhz s GLY 85 Ca -0.10 1.86 -0.07 0.00 0.00 0.00 0.00 44.72 46.41 1uhz s GLY 85 CO 0.79 0.69 0.36 -0.56 0.00 0.00 0.00 173.10 174.38 1uhz h PRO 86 N 2.08 -0.24 -6.36 2.90 0.13 -1.81 -3.21 132.00 125.49 1uhz h PRO 86 Ca -0.10 0.02 -0.28 0.00 -0.87 0.00 0.00 66.00 64.76 1uhz h PRO 86 Cb 1.17 0.06 0.01 0.00 0.13 0.00 0.00 31.00 32.37 1uhz h PRO 86 CO 0.24 -0.16 -1.10 0.43 -0.23 0.00 0.00 178.00 177.17 1uhz n SER 87 N -4.21 -5.99 -4.50 1.44 7.64 -1.26 -4.80 113.62 101.94 1uhz n SER 87 Ca -0.03 0.04 -0.42 0.00 1.01 0.00 0.00 58.87 59.47 1uhz n SER 87 Cb 0.10 -2.13 -0.03 0.00 -1.01 0.00 0.00 64.21 61.13 1uhz n SER 87 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1uhz s SER 88 N -1.52 6.24 0.00 6.43 1.04 -1.26 -5.10 113.70 119.53 1uhz s SER 88 Ca 0.30 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 55.78 1uhz s SER 88 Cb -0.04 -2.48 0.00 0.00 0.10 0.00 0.00 66.02 63.60 1uhz s SER 88 CO 0.73 -1.55 0.00 0.61 0.98 0.00 0.00 173.24 174.01