#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 5.08 -0.33 1.61 0.15 -1.26 -4.98 113.70 113.96 1uhz s SER 2 Ca 0.00 -0.84 -0.08 0.00 0.70 0.00 0.00 55.95 55.73 1uhz s SER 2 Cb 0.00 -1.85 0.19 0.00 -1.71 0.00 0.00 66.02 62.65 1uhz s SER 2 CO 0.00 -0.22 1.02 -0.94 1.20 0.00 0.00 173.24 174.30 1uhz s SER 3 N 1.45 -0.42 -0.03 5.45 1.04 -1.26 -5.16 113.70 114.77 1uhz s SER 3 Ca 0.01 -0.23 0.01 0.00 0.48 0.00 0.00 55.95 56.23 1uhz s SER 3 Cb -0.18 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.50 1uhz s SER 3 CO 0.02 -0.04 -0.05 -0.83 0.98 0.00 0.00 173.24 173.31 1uhz s GLY 4 N 1.91 0.42 0.60 7.32 0.00 -1.26 -5.13 107.32 111.17 1uhz s GLY 4 Ca 0.15 -0.11 -0.19 0.00 0.00 0.00 0.00 44.72 44.58 1uhz s GLY 4 CO -0.14 0.26 1.01 1.44 0.00 0.00 0.00 173.10 175.67 1uhz n SER 5 N 3.75 0.99 -3.16 1.64 7.64 -1.26 -3.90 113.62 119.32 1uhz n SER 5 Ca -0.23 0.83 -0.05 0.00 1.01 0.00 0.00 58.87 60.43 1uhz n SER 5 Cb 0.52 -1.41 0.01 0.00 -1.01 0.00 0.00 64.21 62.32 1uhz n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1uhz n SER 6 N -0.81 -6.66 -4.24 6.43 2.88 -1.26 -5.00 113.62 104.95 1uhz n SER 6 Ca 0.13 0.47 -0.15 0.00 -1.33 0.00 0.00 58.87 58.00 1uhz n SER 6 Cb 0.47 -2.16 -0.10 0.00 -0.75 0.00 0.00 64.21 61.67 1uhz n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1uhz s GLY 7 N -1.17 1.05 0.17 0.46 0.00 -1.25 -5.05 107.32 101.53 1uhz s GLY 7 Ca 0.05 -1.43 0.01 0.00 0.00 0.00 0.00 44.72 43.36 1uhz s GLY 7 CO 0.23 -1.52 1.41 -0.56 0.00 0.00 0.00 173.10 172.65 1uhz h PRO 8 N 2.98 0.26 0.00 2.90 0.13 -1.94 -2.62 132.00 133.72 1uhz h PRO 8 Ca -0.37 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 1uhz h PRO 8 Cb 1.19 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1uhz h PRO 8 CO 0.60 0.94 0.00 -0.89 -0.23 0.00 0.00 178.00 178.42 1uhz n ILE 9 N -3.73 0.00 -0.34 -3.56 5.41 -1.26 -1.29 119.36 114.59 1uhz n ILE 9 Ca -0.04 0.90 0.16 0.00 1.00 0.00 0.00 62.75 64.78 1uhz n ILE 9 Cb 0.76 -1.76 0.32 0.00 -0.71 0.00 0.00 39.64 38.25 1uhz n ILE 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1uhz h SER 10 N 0.00 -0.41 -0.65 4.38 0.02 -1.95 1.76 113.55 116.71 1uhz h SER 10 Ca 0.00 0.28 0.04 0.00 -0.84 0.00 0.00 61.79 61.27 1uhz h SER 10 Cb 0.00 0.47 -0.05 0.00 0.14 0.00 0.00 62.40 62.96 1uhz h SER 10 CO 0.00 -0.36 0.38 -0.09 -1.14 0.00 0.00 176.83 175.62 1uhz h ARG 11 N 0.01 0.71 -0.05 3.45 2.43 -1.52 0.77 114.38 120.19 1uhz h ARG 11 Ca 0.62 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.73 1uhz h ARG 11 Cb 1.33 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1uhz h ARG 11 CO -0.91 0.47 -0.05 1.25 -1.51 0.00 0.00 179.97 179.22 1uhz h LEU 12 N 0.74 0.13 -0.50 3.80 6.46 0.36 -2.38 115.31 123.90 1uhz h LEU 12 Ca 0.27 -0.50 0.07 0.00 -0.12 0.00 0.00 57.88 57.60 1uhz h LEU 12 Cb 0.09 -0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 39.92 1uhz h LEU 12 CO -0.14 0.60 0.17 0.00 -0.62 0.00 0.00 178.44 178.45 1uhz h ALA 13 N 0.53 0.60 -0.12 1.25 0.00 0.12 0.27 119.26 121.92 1uhz h ALA 13 Ca 0.01 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1uhz h ALA 13 Cb 0.56 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1uhz h ALA 13 CO 0.01 -0.23 0.09 1.96 0.00 0.00 0.00 179.25 181.08 1uhz h GLN 14 N 0.34 0.00 0.06 0.00 4.20 0.59 0.12 115.11 120.42 1uhz h GLN 14 Ca 0.24 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.69 1uhz h GLN 14 Cb 0.27 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.06 1uhz h GLN 14 CO -0.26 0.00 -1.10 0.82 -0.67 0.00 0.00 178.83 177.62 1uhz h ILE 15 N 0.00 1.38 -0.31 2.54 2.04 -0.07 0.32 117.51 123.41 1uhz h ILE 15 Ca 0.06 -2.56 -0.10 0.00 1.00 0.00 0.00 64.86 63.25 1uhz h ILE 15 Cb 0.23 2.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.90 1uhz h ILE 15 CO -0.00 0.77 -0.24 1.56 0.00 0.00 0.00 178.15 180.24 1uhz h GLN 16 N 0.22 0.61 0.11 2.37 1.08 0.12 0.14 115.11 119.75 1uhz h GLN 16 Ca -0.13 -0.24 -0.19 0.00 -1.45 0.00 0.00 58.65 56.65 1uhz h GLN 16 Cb 1.77 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 29.17 1uhz h GLN 16 CO 0.20 0.80 -0.90 -0.56 -0.95 0.00 0.00 178.83 177.41 1uhz h GLN 17 N 0.54 0.23 -0.17 1.46 3.07 -0.87 -2.11 115.11 117.26 1uhz h GLN 17 Ca 0.08 -0.39 -0.01 0.00 0.09 0.00 0.00 58.65 58.41 1uhz h GLN 17 Cb 0.70 0.15 -0.01 0.00 0.08 0.00 0.00 27.48 28.39 1uhz h GLN 17 CO 0.05 1.19 0.07 0.00 0.09 0.00 0.00 178.83 180.23 1uhz h ALA 18 N 0.00 1.80 0.00 0.06 0.00 -0.33 0.18 119.26 120.97 1uhz h ALA 18 Ca -0.18 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.68 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 0.09 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.50 1uhz h ARG 19 N 0.24 0.00 -2.40 0.00 3.08 -0.80 -3.47 114.38 111.03 1uhz h ARG 19 Ca 0.06 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.77 1uhz h ARG 19 Cb 0.05 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1uhz h ARG 19 CO -0.01 0.00 -0.44 1.63 -1.07 0.00 0.00 179.97 180.08 1uhz n LYS 20 N -2.34 -1.37 0.00 0.04 5.02 0.64 -4.91 118.16 115.23 1uhz n LYS 20 Ca 0.05 0.85 0.00 0.00 -2.02 0.00 0.00 58.31 57.19 1uhz n LYS 20 Cb 0.41 -5.30 0.00 0.00 -0.02 0.00 0.00 35.03 30.12 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 -2.65 0.00 0.00 1.97 -0.58 -0.82 -5.04 120.64 113.51 1uhz n GLU 21 Ca -0.20 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 1uhz n GLU 21 Cb 0.65 -0.53 0.00 0.00 -0.57 0.00 0.00 31.44 30.99 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 -2.25 0.00 -0.99 3.49 4.81 -1.05 -5.05 118.16 117.12 1uhz n LYS 22 Ca 0.00 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.08 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 -0.14 0.00 -2.46 1.64 1.02 -1.26 -4.69 120.64 114.74 1uhz n GLU 23 Ca 0.00 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.80 1uhz n GLU 23 Cb 0.00 -0.99 -0.03 0.00 -0.02 0.00 0.00 31.44 30.40 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 -1.98 3.73 -0.39 3.49 0.04 -1.26 -4.85 135.00 133.78 1uhz s PRO 24 Ca 0.39 1.32 -0.06 0.00 0.04 0.00 0.00 61.00 62.70 1uhz s PRO 24 Cb -0.16 -2.09 0.07 0.00 0.04 0.00 0.00 34.50 32.37 1uhz s PRO 24 CO 0.81 -0.49 0.18 -0.51 0.04 0.00 0.00 177.00 177.04 1uhz s ASP 25 N -2.14 5.40 0.02 6.66 1.11 0.90 -4.90 116.67 123.71 1uhz s ASP 25 Ca 0.66 -1.52 -0.21 0.00 0.18 0.00 0.00 52.55 51.66 1uhz s ASP 25 Cb -0.16 -1.89 -0.06 0.00 1.07 0.00 0.00 42.92 41.88 1uhz s ASP 25 CO 0.23 -0.46 0.61 -0.31 1.18 0.00 0.00 175.17 176.42 1uhz s TYR 26 N 1.34 3.72 -0.04 4.23 2.02 -1.26 0.43 117.35 127.79 1uhz s TYR 26 Ca 0.02 1.25 0.01 0.00 -0.37 0.00 0.00 57.07 57.98 1uhz s TYR 26 Cb -0.22 -2.61 0.02 0.00 -0.40 0.00 0.00 41.96 38.76 1uhz s TYR 26 CO 0.00 0.40 -0.03 0.42 -1.57 0.00 0.00 175.55 174.77 1uhz s ILE 27 N -0.40 0.42 -0.40 2.71 1.09 0.81 -4.97 121.20 120.47 1uhz s ILE 27 Ca 0.31 -0.05 -0.29 0.00 -1.10 0.00 0.00 60.65 59.52 1uhz s ILE 27 Cb -0.19 -0.47 0.01 0.00 -1.06 0.00 0.00 42.46 40.75 1uhz s ILE 27 CO 0.18 0.20 1.28 -0.22 -0.10 0.00 0.00 174.94 176.28 1uhz s LEU 28 N 0.99 3.70 0.01 2.97 1.98 -1.26 0.91 118.68 127.97 1uhz s LEU 28 Ca -0.10 0.83 -0.14 0.00 -2.89 0.00 0.00 54.13 51.82 1uhz s LEU 28 Cb -0.14 -3.54 -0.08 0.00 0.66 0.00 0.00 46.19 43.09 1uhz s LEU 28 CO -0.01 -1.25 0.94 -0.07 -1.89 0.00 0.00 176.35 174.07 1uhz h LEU 29 N 11.43 -0.44 0.00 -0.68 3.38 -1.36 -3.48 115.31 124.16 1uhz h LEU 29 Ca -0.25 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1uhz h LEU 29 Cb 1.09 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1uhz h LEU 29 CO 1.08 -0.24 0.00 -1.20 0.09 0.00 0.00 178.44 178.17 1uhz n SER 30 N -3.77 0.00 -3.80 -0.43 7.64 -1.15 -5.01 113.62 107.10 1uhz n SER 30 Ca -0.06 -0.87 -0.13 0.00 1.01 0.00 0.00 58.87 58.82 1uhz n SER 30 Cb 0.20 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.28 1uhz n SER 30 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1uhz s GLU 31 N -1.61 0.25 0.00 1.43 2.02 -1.26 -1.26 118.70 118.28 1uhz s GLU 31 Ca 0.00 0.26 0.00 0.00 0.02 0.00 0.00 54.97 55.25 1uhz s GLU 31 Cb 0.00 0.12 0.00 0.00 0.10 0.00 0.00 34.13 34.35 1uhz s GLU 31 CO 0.00 -0.03 0.00 0.54 0.02 0.00 0.00 175.26 175.79 1uhz n ARG 32 N 2.90 -3.02 0.00 1.61 1.74 0.94 -5.01 116.66 115.82 1uhz n ARG 32 Ca -0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1uhz n ARG 32 Cb 0.58 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.02 1uhz n ARG 32 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uhz n GLY 33 N -0.06 -0.35 3.26 -0.13 0.00 -1.26 0.21 105.19 106.85 1uhz n GLY 33 Ca 0.00 -2.25 -0.36 0.00 0.00 0.00 0.00 46.02 43.41 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 -0.24 0.02 0.17 1.61 2.81 -1.26 -4.59 117.12 115.64 1uhz n MET 34 Ca 0.00 0.03 0.05 0.00 -1.81 0.00 0.00 57.70 55.97 1uhz n MET 34 Cb 0.00 -1.41 0.24 0.00 -0.71 0.00 0.00 33.22 31.33 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 -0.79 0.00 0.00 0.03 0.13 -1.98 -0.30 132.00 129.10 1uhz h PRO 35 Ca -0.44 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.29 1uhz h PRO 35 Cb 1.33 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.40 1uhz h PRO 35 CO 0.34 0.41 -2.24 0.54 -0.23 0.00 0.00 178.00 176.82 1uhz n ARG 36 N -3.40 0.58 0.23 0.86 1.74 -1.26 -4.63 116.66 110.78 1uhz n ARG 36 Ca 0.01 0.31 -0.14 0.00 -0.77 0.00 0.00 57.85 57.25 1uhz n ARG 36 Cb 0.59 -1.53 -0.08 0.00 -1.02 0.00 0.00 32.46 30.42 1uhz n ARG 36 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1uhz h ARG 37 N -1.00 -0.58 -3.27 5.56 2.43 -1.94 -3.50 114.38 112.08 1uhz h ARG 37 Ca -0.60 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.61 1uhz h ARG 37 Cb 1.52 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 31.20 1uhz h ARG 37 CO -0.36 -0.28 -0.77 0.54 -1.51 0.00 0.00 179.97 177.58 1uhz n ARG 38 N -5.25 -4.13 -4.08 0.20 5.12 -0.12 -4.59 116.66 103.81 1uhz n ARG 38 Ca -0.11 3.01 -0.28 0.00 -1.93 0.00 0.00 57.85 58.54 1uhz n ARG 38 Cb 0.30 -3.33 -0.17 0.00 -1.16 0.00 0.00 32.46 28.10 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 -2.93 2.01 -0.17 5.56 2.12 0.56 -3.94 118.70 121.90 1uhz s GLU 39 Ca 0.00 -0.45 -0.03 0.00 0.36 0.00 0.00 54.97 54.85 1uhz s GLU 39 Cb 0.00 -1.87 -0.02 0.00 0.26 0.00 0.00 34.13 32.50 1uhz s GLU 39 CO 0.00 -0.20 -0.05 -0.06 -0.54 0.00 0.00 175.26 174.40 1uhz s PHE 40 N 1.44 2.96 -0.21 5.30 0.40 -1.17 -0.04 117.98 126.66 1uhz s PHE 40 Ca 0.02 -0.57 -0.18 0.00 -0.60 0.00 0.00 56.93 55.59 1uhz s PHE 40 Cb -0.13 -1.99 -0.03 0.00 0.51 0.00 0.00 43.02 41.38 1uhz s PHE 40 CO -0.08 -0.25 0.53 0.08 0.70 0.00 0.00 175.22 176.20 1uhz s VAL 41 N 0.76 5.09 0.08 -0.44 1.01 -0.39 -3.60 120.40 122.91 1uhz s VAL 41 Ca -0.02 0.96 0.10 0.00 0.00 0.00 0.00 61.98 63.01 1uhz s VAL 41 Cb -0.15 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 1uhz s VAL 41 CO 0.02 0.15 -0.26 -0.32 0.00 0.00 0.00 175.10 174.69 1uhz s MET 42 N 1.78 1.66 0.14 2.72 1.75 0.12 -0.96 119.30 126.51 1uhz s MET 42 Ca 0.24 -1.20 0.10 0.00 -1.25 0.00 0.00 55.69 53.58 1uhz s MET 42 Cb -0.15 -1.96 -0.04 0.00 2.84 0.00 0.00 34.83 35.51 1uhz s MET 42 CO 0.09 0.49 -0.24 -1.14 -0.65 0.00 0.00 175.02 173.57 1uhz s GLN 43 N -1.61 1.34 -0.02 4.11 0.74 0.26 0.20 119.66 124.68 1uhz s GLN 43 Ca 0.13 -1.35 0.00 0.00 0.05 0.00 0.00 55.36 54.20 1uhz s GLN 43 Cb -0.10 -1.71 0.03 0.00 1.10 0.00 0.00 33.01 32.33 1uhz s GLN 43 CO 0.04 0.39 0.02 0.54 -0.55 0.00 0.00 175.29 175.73 1uhz s VAL 44 N -1.30 0.04 -0.21 1.34 0.11 0.13 -0.13 120.40 120.39 1uhz s VAL 44 Ca 0.14 0.15 -0.00 0.00 -2.93 0.00 0.00 61.98 59.33 1uhz s VAL 44 Cb -0.09 -0.16 0.02 0.00 -1.53 0.00 0.00 36.38 34.62 1uhz s VAL 44 CO 0.06 0.11 -0.14 -0.75 -3.33 0.00 0.00 175.10 171.05 1uhz s LYS 45 N 0.97 2.99 -0.24 1.54 2.20 0.17 0.22 119.74 127.59 1uhz s LYS 45 Ca -0.09 -0.85 0.01 0.00 -0.36 0.00 0.00 55.97 54.68 1uhz s LYS 45 Cb -0.12 -2.75 0.06 0.00 -1.51 0.00 0.00 37.83 33.50 1uhz s LYS 45 CO -0.02 -0.26 -0.06 0.08 -0.36 0.00 0.00 175.35 174.72 1uhz s VAL 46 N 1.32 1.59 0.00 4.02 1.01 0.12 -0.07 120.40 128.39 1uhz s VAL 46 Ca 0.03 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 60.75 1uhz s VAL 46 Cb -0.14 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1uhz s VAL 46 CO -0.09 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.53 1uhz n GLY 47 N 4.65 1.07 0.89 4.51 0.00 -1.26 0.26 105.19 115.30 1uhz n GLY 47 Ca -0.12 0.49 0.02 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 10.38 2.75 -4.27 1.61 3.02 -1.26 -4.99 115.26 122.49 1uhz n ASN 48 Ca 0.00 -3.50 -0.17 0.00 -0.03 0.00 0.00 54.58 50.88 1uhz n ASN 48 Cb 0.00 -0.57 -0.10 0.00 -0.61 0.00 0.00 39.78 38.49 1uhz n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1uhz s GLU 49 N -3.09 1.12 0.02 3.52 8.01 0.14 -5.16 118.70 123.26 1uhz s GLU 49 Ca 0.42 -1.41 -0.05 0.00 0.01 0.00 0.00 54.97 53.94 1uhz s GLU 49 Cb 0.37 -0.87 -0.01 0.00 -4.31 0.00 0.00 34.13 29.31 1uhz s GLU 49 CO 0.02 0.14 0.08 0.54 0.01 0.00 0.00 175.26 176.05 1uhz s VAL 50 N -2.77 0.10 0.23 2.63 0.11 -1.26 0.13 120.40 119.57 1uhz s VAL 50 Ca 0.15 -0.86 -0.09 0.00 -2.93 0.00 0.00 61.98 58.25 1uhz s VAL 50 Cb -0.01 -0.51 -0.02 0.00 -1.53 0.00 0.00 36.38 34.32 1uhz s VAL 50 CO 0.03 -0.47 0.37 0.00 -3.33 0.00 0.00 175.10 171.70 1uhz s ALA 51 N -1.72 0.20 0.10 1.54 0.00 0.13 -4.96 121.76 117.06 1uhz s ALA 51 Ca -0.13 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.73 1uhz s ALA 51 Cb -0.07 1.17 -0.04 0.00 0.00 0.00 0.00 23.12 24.19 1uhz s ALA 51 CO -0.01 -0.77 -0.09 0.95 0.00 0.00 0.00 175.76 175.84 1uhz s THR 52 N -4.06 0.87 -0.06 0.00 -4.23 -1.26 0.22 115.64 107.13 1uhz s THR 52 Ca 0.28 -1.76 -0.06 0.00 -1.18 0.00 0.00 61.69 58.97 1uhz s THR 52 Cb 0.02 -1.48 0.02 0.00 1.34 0.00 0.00 72.50 72.39 1uhz s THR 52 CO 0.10 -0.67 0.17 -0.83 -0.54 0.00 0.00 174.62 172.85 1uhz s GLY 53 N -2.68 -0.12 0.17 3.99 0.00 0.13 -4.16 107.32 104.65 1uhz s GLY 53 Ca 0.08 0.44 0.05 0.00 0.00 0.00 0.00 44.72 45.29 1uhz s GLY 53 CO -0.01 0.36 -0.08 -0.51 0.00 0.00 0.00 173.10 172.86 1uhz s THR 54 N -0.05 1.19 0.00 0.90 -4.23 -1.24 0.16 115.64 112.38 1uhz s THR 54 Ca -0.01 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.43 1uhz s THR 54 Cb -0.02 -1.98 0.00 0.00 1.34 0.00 0.00 72.50 71.84 1uhz s THR 54 CO 0.00 -0.64 0.00 0.61 -0.54 0.00 0.00 174.62 174.06 1uhz n GLY 55 N -0.27 0.89 0.18 3.99 0.00 -1.24 -4.32 105.19 104.42 1uhz n GLY 55 Ca -0.09 -0.55 -0.14 0.00 0.00 0.00 0.00 46.02 45.24 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 0.52 -4.92 1.61 0.13 -1.81 -3.10 132.00 124.43 1uhz h PRO 56 Ca 0.00 -0.51 -0.46 0.00 -0.87 0.00 0.00 66.00 64.17 1uhz h PRO 56 Cb 0.00 0.13 -0.14 0.00 0.13 0.00 0.00 31.00 31.13 1uhz h PRO 56 CO 0.00 1.14 -0.53 0.54 -0.23 0.00 0.00 178.00 178.92 1uhz s ASN 57 N -7.10 1.83 0.08 1.44 4.22 -1.26 -4.09 114.94 110.06 1uhz s ASN 57 Ca -0.07 -1.63 -0.26 0.00 -2.14 0.00 0.00 52.86 48.77 1uhz s ASN 57 Cb 0.09 0.45 -0.16 0.00 1.28 0.00 0.00 41.25 42.90 1uhz s ASN 57 CO 0.88 -0.93 1.70 0.50 -2.04 0.00 0.00 177.10 177.20 1uhz h LYS 58 N 2.11 -0.25 0.00 3.55 3.64 -1.91 -0.60 116.57 123.11 1uhz h LYS 58 Ca -0.32 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1uhz h LYS 58 Cb 1.25 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 1uhz h LYS 58 CO 0.50 -0.16 0.00 1.63 -2.27 0.00 0.00 179.45 179.15 1uhz n LYS 59 N -5.20 0.00 -0.18 1.90 4.76 -1.26 0.11 118.16 118.29 1uhz n LYS 59 Ca -0.09 0.51 -0.06 0.00 -2.87 0.00 0.00 58.31 55.80 1uhz n LYS 59 Cb 0.13 -0.93 -0.00 0.00 -1.84 0.00 0.00 35.03 32.39 1uhz n LYS 59 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1uhz h ILE 60 N 0.00 0.19 -1.54 -0.18 2.04 -1.96 1.09 117.51 117.15 1uhz h ILE 60 Ca 0.00 0.00 0.47 0.00 1.00 0.00 0.00 64.86 66.33 1uhz h ILE 60 Cb 0.00 0.19 -0.09 0.00 -0.74 0.00 0.00 36.82 36.17 1uhz h ILE 60 CO 0.00 0.00 1.07 0.00 0.00 0.00 0.00 178.15 179.22 1uhz h ALA 61 N 0.91 3.23 -0.03 1.87 0.00 0.67 1.64 119.26 127.56 1uhz h ALA 61 Ca 0.21 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1uhz h ALA 61 Cb 0.55 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1uhz h ALA 61 CO -0.64 -1.78 -0.27 -0.22 0.00 0.00 0.00 179.25 176.35 1uhz h LYS 62 N 0.05 0.23 -0.76 0.00 3.11 0.85 -2.28 116.57 117.77 1uhz h LYS 62 Ca 0.81 -0.21 0.06 0.00 -2.81 0.00 0.00 60.65 58.50 1uhz h LYS 62 Cb 2.95 0.05 -0.06 0.00 -1.00 0.00 0.00 32.23 34.17 1uhz h LYS 62 CO -0.18 0.89 0.45 0.87 -2.81 0.00 0.00 179.45 178.68 1uhz h LYS 63 N -0.36 0.80 -0.14 1.90 1.57 0.31 0.12 116.57 120.78 1uhz h LYS 63 Ca -0.03 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 1uhz h LYS 63 Cb 0.97 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1uhz h LYS 63 CO 0.05 0.53 -0.11 -0.91 -0.57 0.00 0.00 179.45 178.44 1uhz h ASN 64 N 0.82 0.20 -0.15 0.86 2.35 -0.39 -0.92 115.58 118.36 1uhz h ASN 64 Ca 0.34 -0.04 0.01 0.00 -0.55 0.00 0.00 56.30 56.06 1uhz h ASN 64 Cb 0.19 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 1uhz h ASN 64 CO -0.18 0.34 0.06 0.00 -1.65 0.00 0.00 177.43 176.00 1uhz h ALA 65 N 1.68 0.17 -0.51 -0.83 0.00 -0.16 0.21 119.26 119.83 1uhz h ALA 65 Ca 0.04 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1uhz h ALA 65 Cb 0.33 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1uhz h ALA 65 CO 0.02 -0.38 0.07 0.00 0.00 0.00 0.00 179.25 178.96 1uhz h ALA 66 N 1.09 0.68 -0.14 0.00 0.00 -0.90 -1.65 119.26 118.34 1uhz h ALA 66 Ca 0.06 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.76 1uhz h ALA 66 Cb 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1uhz h ALA 66 CO -0.06 0.43 -0.12 1.49 0.00 0.00 0.00 179.25 181.00 1uhz h GLU 67 N 0.74 -0.13 -0.99 0.00 4.81 -0.65 0.37 114.58 118.73 1uhz h GLU 67 Ca 0.15 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.44 1uhz h GLU 67 Cb 0.43 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.78 1uhz h GLU 67 CO 0.01 -0.09 0.64 0.00 -0.73 0.00 0.00 179.01 178.85 1uhz h ALA 68 N 0.96 1.33 0.26 2.92 0.00 -0.45 0.20 119.26 124.49 1uhz h ALA 68 Ca 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1uhz h ALA 68 Cb 0.27 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1uhz h ALA 68 CO -0.22 0.51 -0.13 1.98 0.00 0.00 0.00 179.25 181.39 1uhz h MET 69 N 1.22 -0.34 -0.84 0.00 1.85 -0.22 0.62 114.93 117.23 1uhz h MET 69 Ca 0.40 0.02 0.04 0.00 -0.61 0.00 0.00 59.70 59.55 1uhz h MET 69 Cb 0.05 0.08 -0.05 0.00 0.43 0.00 0.00 31.60 32.11 1uhz h MET 69 CO -0.14 -0.15 0.55 -0.07 -0.40 0.00 0.00 176.91 176.70 1uhz h LEU 70 N -0.47 0.89 -0.46 3.39 3.38 0.11 0.77 115.31 122.93 1uhz h LEU 70 Ca -0.04 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.78 1uhz h LEU 70 Cb 0.35 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1uhz h LEU 70 CO 0.06 0.61 -0.28 -0.07 0.09 0.00 0.00 178.44 178.85 1uhz h LEU 71 N 1.03 1.02 -0.92 1.67 3.38 -0.28 0.38 115.31 121.59 1uhz h LEU 71 Ca 0.33 -0.42 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 1uhz h LEU 71 Cb 0.05 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1uhz h LEU 71 CO -0.10 1.22 -0.47 0.06 0.09 0.00 0.00 178.44 179.24 1uhz h GLN 72 N 0.83 0.00 0.00 1.13 3.07 0.16 -2.64 115.11 117.66 1uhz h GLN 72 Ca 0.09 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.71 1uhz h GLN 72 Cb 0.87 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.41 1uhz h GLN 72 CO 0.08 0.47 -0.60 -0.07 0.09 0.00 0.00 178.83 178.79 1uhz h LEU 73 N 0.00 0.00 -0.05 0.06 3.38 0.81 -3.47 115.31 116.03 1uhz h LEU 73 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1uhz h LEU 73 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1uhz h LEU 73 CO 0.06 0.60 0.00 0.61 0.09 0.00 0.00 178.44 179.81 1uhz n GLY 74 N 0.82 1.38 0.00 0.83 0.00 -0.30 -5.00 105.19 102.93 1uhz n GLY 74 Ca 0.00 -0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.73 0.00 -2.24 1.61 4.02 0.12 -4.48 117.16 115.46 1uhz n TYR 75 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.91 1uhz n TYR 75 Cb 0.05 -0.11 0.02 0.00 -0.02 0.00 0.00 39.34 39.28 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 -1.56 0.05 -0.07 -0.72 5.02 -1.21 -4.86 118.16 114.81 1uhz n LYS 76 Ca 0.01 -1.59 -0.12 0.00 -2.02 0.00 0.00 58.31 54.59 1uhz n LYS 76 Cb 0.28 -0.27 -0.11 0.00 -0.02 0.00 0.00 35.03 34.91 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 0.54 0.00 -0.64 7.82 0.00 -1.79 -2.47 119.26 122.73 1uhz h ALA 77 Ca -0.12 -0.44 0.10 0.00 0.00 0.00 0.00 54.91 54.45 1uhz h ALA 77 Cb 1.65 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 19.33 1uhz h ALA 77 CO 0.05 0.01 -0.41 1.03 0.00 0.00 0.00 179.25 179.93 1uhz h SER 78 N -1.00 -1.43 0.56 0.00 0.87 -1.89 0.18 113.55 110.84 1uhz h SER 78 Ca -0.00 0.25 -0.03 0.00 -1.23 0.00 0.00 61.79 60.78 1uhz h SER 78 Cb 0.86 0.67 0.01 0.00 -0.44 0.00 0.00 62.40 63.50 1uhz h SER 78 CO -0.00 -0.32 -0.27 0.74 -0.53 0.00 0.00 176.83 176.45 1uhz h THR 79 N -0.18 0.45 -0.92 2.23 2.02 -1.93 -1.96 112.91 112.63 1uhz h THR 79 Ca 0.21 -0.05 0.08 0.00 0.77 0.00 0.00 66.41 67.42 1uhz h THR 79 Cb 0.56 0.47 -0.11 0.00 -1.74 0.00 0.00 68.15 67.33 1uhz h THR 79 CO -0.73 0.01 -0.56 -1.28 0.37 0.00 0.00 175.52 173.33 1uhz h SER 80 N -0.78 -2.06 -0.02 4.18 0.87 -0.76 0.33 113.55 115.32 1uhz h SER 80 Ca -0.08 0.31 0.01 0.00 -1.23 0.00 0.00 61.79 60.80 1uhz h SER 80 Cb 0.59 0.91 -0.03 0.00 -0.44 0.00 0.00 62.40 63.42 1uhz h SER 80 CO 0.13 -0.23 -0.26 -0.07 -0.53 0.00 0.00 176.83 175.86 1uhz h LEU 81 N -0.03 -0.82 -0.56 2.23 4.07 -0.61 -0.70 115.31 118.89 1uhz h LEU 81 Ca 0.15 0.09 0.05 0.00 0.08 0.00 0.00 57.88 58.25 1uhz h LEU 81 Cb 0.41 0.31 -0.07 0.00 1.08 0.00 0.00 40.66 42.39 1uhz h LEU 81 CO -0.88 -0.25 -0.33 0.00 -1.08 0.00 0.00 178.44 175.90 1uhz n GLN 82 N -3.95 -0.25 -0.37 1.13 6.02 -0.38 0.18 117.38 119.77 1uhz n GLN 82 Ca -0.03 1.24 -0.02 0.00 -0.01 0.00 0.00 57.00 58.17 1uhz n GLN 82 Cb 0.19 -1.83 0.03 0.00 1.02 0.00 0.00 30.24 29.65 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 -1.45 -0.38 1.08 1.82 -0.05 0.75 116.42 118.19 1uhz h ASP 83 Ca 0.09 0.31 0.07 0.00 -0.39 0.00 0.00 57.03 57.11 1uhz h ASP 83 Cb 0.23 0.75 -0.06 0.00 0.68 0.00 0.00 39.33 40.93 1uhz h ASP 83 CO -0.52 -0.29 -0.03 0.28 -1.61 0.00 0.00 179.24 177.07 1uhz h SER 84 N -0.02 -0.22 -3.68 2.28 0.02 0.13 -3.32 113.55 108.75 1uhz h SER 84 Ca 0.33 0.10 -0.69 0.00 -0.84 0.00 0.00 61.79 60.68 1uhz h SER 84 Cb 0.59 0.18 -0.35 0.00 0.14 0.00 0.00 62.40 62.96 1uhz h SER 84 CO -0.96 -0.07 -0.51 -0.83 -1.14 0.00 0.00 176.83 173.32 1uhz s GLY 85 N -2.92 2.13 0.34 -3.77 0.00 0.26 -5.08 107.32 98.28 1uhz s GLY 85 Ca -0.14 -2.74 -0.27 0.00 0.00 0.00 0.00 44.72 41.58 1uhz s GLY 85 CO 0.71 1.05 1.07 2.56 0.00 0.00 0.00 173.10 178.48 1uhz s PRO 86 N 0.79 4.39 0.25 2.90 0.04 -1.03 -4.47 135.00 137.87 1uhz s PRO 86 Ca 0.11 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.78 1uhz s PRO 86 Cb -0.22 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1uhz s PRO 86 CO -0.04 0.03 0.00 0.43 0.04 0.00 0.00 177.00 177.47 1uhz n SER 87 N 0.53 -2.26 -4.53 6.66 7.64 -1.26 -5.12 113.62 115.28 1uhz n SER 87 Ca 0.02 0.68 -0.29 0.00 1.01 0.00 0.00 58.87 60.28 1uhz n SER 87 Cb 0.47 2.31 0.22 0.00 -1.01 0.00 0.00 64.21 66.21 1uhz n SER 87 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1uhz n SER 88 N -3.17 -1.11 0.00 6.43 2.88 -1.26 -5.27 113.62 112.12 1uhz n SER 88 Ca 0.00 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1uhz n SER 88 Cb 0.00 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 62.14 1uhz n SER 88 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42