#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k92 n THR 2 N 0.00 2.05 0.01 0.44 -2.24 -1.26 -4.54 114.28 108.74 2k92 n THR 2 Ca 0.00 -2.33 0.00 0.00 -2.27 0.00 0.00 64.05 59.45 2k92 n THR 2 Cb 0.00 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 67.98 2k92 n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k92 n ILE 3 N -1.19 0.21 0.13 2.28 0.00 -1.26 -4.13 119.36 115.40 2k92 n ILE 3 Ca 0.18 0.07 0.07 0.00 0.00 0.00 0.00 62.75 63.07 2k92 n ILE 3 Cb 0.72 -1.43 0.35 0.00 0.00 0.00 0.00 39.64 39.28 2k92 n ILE 3 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 2k92 n GLU 4 N -3.06 0.08 -0.12 9.51 0.28 -1.26 0.15 120.64 126.22 2k92 n GLU 4 Ca 0.00 0.56 -0.18 0.00 -0.16 0.00 0.00 57.16 57.38 2k92 n GLU 4 Cb 0.37 -1.77 -0.11 0.00 1.43 0.00 0.00 31.44 31.37 2k92 n GLU 4 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2k92 n GLU 5 N -1.94 0.60 0.10 3.44 0.28 -1.26 -4.33 120.64 117.53 2k92 n GLU 5 Ca -0.01 0.15 -0.05 0.00 -0.16 0.00 0.00 57.16 57.09 2k92 n GLU 5 Cb 0.04 -1.48 0.03 0.00 1.43 0.00 0.00 31.44 31.46 2k92 n GLU 5 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2k92 h ARG 6 N -0.08 0.06 -0.38 3.44 3.08 -1.48 -3.22 114.38 115.79 2k92 h ARG 6 Ca -0.55 -0.06 0.07 0.00 0.07 0.00 0.00 59.98 59.50 2k92 h ARG 6 Cb 1.82 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 31.82 2k92 h ARG 6 CO -0.11 0.82 0.01 0.28 -1.07 0.00 0.00 179.97 179.90 2k92 h VAL 7 N 0.03 0.73 -0.85 2.04 2.07 0.12 0.23 116.25 120.62 2k92 h VAL 7 Ca -0.02 -0.04 0.21 0.00 0.82 0.00 0.00 66.70 67.68 2k92 h VAL 7 Cb 1.40 0.60 -0.13 0.00 -1.52 0.00 0.00 31.29 31.65 2k92 h VAL 7 CO 0.11 0.02 0.28 0.11 0.02 0.00 0.00 177.57 178.11 2k92 h LYS 8 N 0.11 0.28 0.19 1.57 1.79 -1.75 0.23 116.57 119.00 2k92 h LYS 8 Ca 0.19 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.63 2k92 h LYS 8 Cb 0.26 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 2k92 h LYS 8 CO -0.30 0.19 -0.09 0.87 -1.08 0.00 0.00 179.45 179.03 2k92 h LYS 9 N 0.29 -0.24 -0.57 3.15 1.57 -1.13 1.62 116.57 121.26 2k92 h LYS 9 Ca 0.53 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 59.44 2k92 h LYS 9 Cb 1.01 0.06 -0.11 0.00 0.08 0.00 0.00 32.23 33.26 2k92 h LYS 9 CO -0.58 -0.04 -0.19 0.82 -0.57 0.00 0.00 179.45 178.89 2k92 h ILE 10 N -0.41 0.35 0.00 1.86 2.04 0.68 1.29 117.51 123.33 2k92 h ILE 10 Ca -0.03 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.71 2k92 h ILE 10 Cb 0.31 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 2k92 h ILE 10 CO 0.04 0.00 -0.59 0.40 0.00 0.00 0.00 178.15 178.00 2k92 h ILE 11 N -0.05 1.34 0.00 -0.67 1.08 -0.50 1.14 117.51 119.85 2k92 h ILE 11 Ca 0.27 -2.10 -0.05 0.00 -0.39 0.00 0.00 64.86 62.59 2k92 h ILE 11 Cb 0.47 2.16 -0.01 0.00 -3.07 0.00 0.00 36.82 36.37 2k92 h ILE 11 CO -0.61 0.58 -0.24 1.23 -0.69 0.00 0.00 178.15 178.42 2k92 h GLY 12 N 2.03 0.00 0.00 5.37 0.00 0.75 -2.91 103.07 108.31 2k92 h GLY 12 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2k92 h GLY 12 CO 0.08 0.00 -0.77 -1.06 0.00 0.00 0.00 176.54 174.78 2k92 n GLN 13 N -3.51 0.39 -0.23 4.80 1.13 0.39 -0.17 117.38 120.18 2k92 n GLN 13 Ca -0.01 0.15 -0.07 0.00 -1.94 0.00 0.00 57.00 55.14 2k92 n GLN 13 Cb 0.40 -1.18 -0.06 0.00 0.11 0.00 0.00 30.24 29.51 2k92 n GLN 13 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 2k92 h GLN 14 N -0.73 -0.03 -0.84 -1.09 1.08 0.12 0.30 115.11 113.92 2k92 h GLN 14 Ca -0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 2k92 h GLN 14 Cb 0.75 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.15 2k92 h GLN 14 CO -0.01 -0.02 0.50 -0.07 -0.95 0.00 0.00 178.83 178.28 2k92 h LEU 15 N -0.03 1.01 -0.28 1.46 3.38 -1.65 -3.47 115.31 115.74 2k92 h LEU 15 Ca 0.09 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2k92 h LEU 15 Cb 0.26 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2k92 h LEU 15 CO -0.54 0.79 0.00 0.61 0.09 0.00 0.00 178.44 179.39 2k92 n GLY 16 N -1.20 0.62 0.80 0.83 0.00 0.11 -4.95 105.19 101.40 2k92 n GLY 16 Ca 0.09 -0.62 -0.02 0.00 0.00 0.00 0.00 46.02 45.46 2k92 n GLY 16 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2k92 n VAL 17 N -0.06 0.00 -2.47 1.61 0.24 0.76 -4.98 118.33 113.43 2k92 n VAL 17 Ca 0.00 -0.27 -0.24 0.00 -2.04 0.00 0.00 64.34 61.79 2k92 n VAL 17 Cb 0.01 0.22 0.10 0.00 -1.47 0.00 0.00 33.84 32.70 2k92 n VAL 17 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2k92 s LYS 18 N -2.07 1.81 -0.24 7.34 3.01 -1.26 -4.46 119.74 123.87 2k92 s LYS 18 Ca 0.04 -0.85 -0.17 0.00 -1.01 0.00 0.00 55.97 53.98 2k92 s LYS 18 Cb -0.01 -2.28 -0.16 0.00 -1.01 0.00 0.00 37.83 34.37 2k92 s LYS 18 CO 0.03 -1.38 -0.06 0.94 0.51 0.00 0.00 175.35 175.39 2k92 n GLN 19 N -2.85 0.58 0.29 1.68 0.00 -1.26 -3.20 117.38 112.62 2k92 n GLN 19 Ca 0.13 0.42 0.16 0.00 -0.00 0.00 0.00 57.00 57.70 2k92 n GLN 19 Cb 0.60 -1.62 0.89 0.00 0.00 0.00 0.00 30.24 30.11 2k92 n GLN 19 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 2k92 h GLU 20 N -0.96 0.00 0.00 3.69 4.39 -2.00 -2.90 114.58 116.80 2k92 h GLU 20 Ca -0.52 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.18 2k92 h GLU 20 Cb 1.48 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.13 2k92 h GLU 20 CO -0.30 0.04 -0.00 0.93 -1.16 0.00 0.00 179.01 178.52 2k92 h GLU 21 N 0.00 0.00 -7.11 2.33 5.08 -1.99 -3.46 114.58 109.43 2k92 h GLU 21 Ca -0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 2k92 h GLU 21 Cb 0.14 0.00 0.17 0.00 0.50 0.00 0.00 28.75 29.56 2k92 h GLU 21 CO 0.01 0.33 0.43 1.55 -1.00 0.00 0.00 179.01 180.33 2k92 n VAL 22 N -4.72 4.09 0.00 3.13 3.14 -1.10 -4.99 118.33 117.88 2k92 n VAL 22 Ca -0.03 -0.42 0.00 0.00 -2.96 0.00 0.00 64.34 60.93 2k92 n VAL 22 Cb 0.16 -1.39 0.00 0.00 -1.06 0.00 0.00 33.84 31.55 2k92 n VAL 22 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2k92 n THR 23 N -2.30 0.00 -0.05 1.55 -2.24 -1.26 -4.87 114.28 105.11 2k92 n THR 23 Ca 0.15 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.83 2k92 n THR 23 Cb 0.49 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 2k92 n THR 23 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2k92 n ASN 24 N 0.00 1.08 0.05 3.42 6.94 -1.26 -4.55 115.26 120.94 2k92 n ASN 24 Ca 0.00 0.18 0.10 0.00 -0.02 0.00 0.00 54.58 54.84 2k92 n ASN 24 Cb 0.00 -0.42 0.42 0.00 -2.36 0.00 0.00 39.78 37.42 2k92 n ASN 24 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2k92 n ASN 25 N -3.68 0.26 -4.67 0.53 5.15 -1.26 -3.35 115.26 108.24 2k92 n ASN 25 Ca -0.18 0.55 -0.42 0.00 -0.60 0.00 0.00 54.58 53.93 2k92 n ASN 25 Cb 0.52 -0.61 -0.03 0.00 -0.53 0.00 0.00 39.78 39.13 2k92 n ASN 25 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k92 s ALA 26 N -3.10 3.63 -1.06 5.20 0.00 -1.26 -4.94 121.76 120.23 2k92 s ALA 26 Ca 0.08 0.85 -0.11 0.00 0.00 0.00 0.00 51.96 52.78 2k92 s ALA 26 Cb 0.11 -3.70 0.26 0.00 0.00 0.00 0.00 23.12 19.79 2k92 s ALA 26 CO 0.37 -1.27 1.07 -1.12 0.00 0.00 0.00 175.76 174.80 2k92 s SER 27 N 2.83 7.19 0.43 0.00 0.01 -1.26 -3.93 113.70 118.97 2k92 s SER 27 Ca 0.68 -3.36 0.31 0.00 1.31 0.00 0.00 55.95 54.89 2k92 s SER 27 Cb -0.31 -2.23 1.46 0.00 0.21 0.00 0.00 66.02 65.16 2k92 s SER 27 CO 0.26 -0.38 1.56 2.22 0.41 0.00 0.00 173.24 177.30 2k92 n PHE 28 N 3.20 0.77 0.00 2.43 1.16 -1.26 0.11 117.46 123.87 2k92 n PHE 28 Ca 0.23 0.78 0.00 0.00 -1.87 0.00 0.00 57.45 56.58 2k92 n PHE 28 Cb 0.41 -1.21 0.00 0.00 -1.61 0.00 0.00 39.48 37.07 2k92 n PHE 28 CO 0.00 0.00 0.00 1.33 -1.87 0.00 0.00 176.76 176.22 2k92 n VAL 29 N -4.79 0.00 -0.13 1.97 0.24 -1.26 0.18 118.33 114.55 2k92 n VAL 29 Ca 0.40 0.92 -0.18 0.00 -2.04 0.00 0.00 64.34 63.43 2k92 n VAL 29 Cb 1.52 -1.39 -0.12 0.00 -1.47 0.00 0.00 33.84 32.39 2k92 n VAL 29 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2k92 n GLU 30 N -0.92 0.63 -0.33 7.34 0.00 -0.82 -0.76 120.64 125.78 2k92 n GLU 30 Ca 0.00 0.15 0.24 0.00 0.00 0.00 0.00 57.16 57.56 2k92 n GLU 30 Cb 0.00 -1.50 0.46 0.00 0.00 0.00 0.00 31.44 30.39 2k92 n GLU 30 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2k92 n ASP 31 N -3.30 0.14 0.00 4.31 2.03 0.30 -3.95 116.55 116.08 2k92 n ASP 31 Ca -0.45 1.67 0.00 0.00 0.52 0.00 0.00 54.79 56.53 2k92 n ASP 31 Cb 0.97 -0.72 0.00 0.00 -0.72 0.00 0.00 41.12 40.65 2k92 n ASP 31 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2k92 n LEU 32 N -5.36 0.00 0.00 -2.67 4.32 -1.08 -4.94 117.00 107.27 2k92 n LEU 32 Ca 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.30 2k92 n LEU 32 Cb 1.05 -0.04 0.00 0.00 -1.62 0.00 0.00 43.42 42.82 2k92 n LEU 32 CO -0.03 -0.26 0.00 0.61 -1.22 0.00 0.00 177.39 176.49 2k92 n GLY 33 N 3.48 0.46 3.06 -0.72 0.00 0.49 -4.99 105.19 106.97 2k92 n GLY 33 Ca 0.00 0.50 0.02 0.00 0.00 0.00 0.00 46.02 46.54 2k92 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k92 s ALA 34 N 0.00 -3.23 -0.10 4.61 0.00 0.06 -4.87 121.76 118.22 2k92 s ALA 34 Ca 0.00 0.82 0.14 0.00 0.00 0.00 0.00 51.96 52.92 2k92 s ALA 34 Cb 0.00 -2.81 0.25 0.00 0.00 0.00 0.00 23.12 20.56 2k92 s ALA 34 CO 0.00 -2.23 1.13 -3.47 0.00 0.00 0.00 175.76 171.19 2k92 n ASP 35 N 4.44 1.64 0.00 0.00 -0.08 -1.26 -4.17 116.55 117.13 2k92 n ASP 35 Ca 0.08 -2.89 0.00 0.00 -1.51 0.00 0.00 54.79 50.47 2k92 n ASP 35 Cb 0.59 -0.38 0.00 0.00 2.34 0.00 0.00 41.12 43.66 2k92 n ASP 35 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2k92 n SER 36 N -0.96 0.00 -1.51 1.67 7.64 -1.26 -4.86 113.62 114.34 2k92 n SER 36 Ca 0.12 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.98 2k92 n SER 36 Cb 0.69 0.00 0.21 0.00 -1.01 0.00 0.00 64.21 64.09 2k92 n SER 36 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2k92 n LEU 37 N -2.34 4.46 0.05 -3.43 4.77 -1.26 -4.05 117.00 115.20 2k92 n LEU 37 Ca 0.00 -2.30 -0.03 0.00 -0.03 0.00 0.00 56.01 53.65 2k92 n LEU 37 Cb 0.00 -0.65 -0.01 0.00 -2.33 0.00 0.00 43.42 40.43 2k92 n LEU 37 CO 0.00 0.61 0.11 -2.24 -1.33 0.00 0.00 177.39 174.54 2k92 h ASP 38 N 1.85 -0.15 0.00 -1.43 2.03 -1.89 -3.31 116.42 113.51 2k92 h ASP 38 Ca 0.14 0.01 -0.04 0.00 -0.73 0.00 0.00 57.03 56.40 2k92 h ASP 38 Cb 1.69 0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 40.23 2k92 h ASP 38 CO 0.44 0.16 -0.40 0.74 -1.03 0.00 0.00 179.24 179.15 2k92 h THR 39 N -0.71 0.41 0.00 1.15 2.02 -1.86 -3.17 112.91 110.75 2k92 h THR 39 Ca -0.02 -1.40 0.00 0.00 0.77 0.00 0.00 66.41 65.76 2k92 h THR 39 Cb 0.14 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2k92 h THR 39 CO 0.03 0.14 0.00 0.52 0.37 0.00 0.00 175.52 176.58 2k92 n VAL 40 N -4.64 0.00 -0.38 3.16 0.31 -1.26 -0.55 118.33 114.98 2k92 n VAL 40 Ca -0.10 0.84 -0.01 0.00 -0.01 0.00 0.00 64.34 65.07 2k92 n VAL 40 Cb 0.28 -1.37 0.04 0.00 -0.91 0.00 0.00 33.84 31.88 2k92 n VAL 40 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2k92 n GLU 41 N -0.66 -0.23 -0.31 5.55 1.02 -1.25 0.20 120.64 124.96 2k92 n GLU 41 Ca 0.00 1.51 0.30 0.00 -0.02 0.00 0.00 57.16 58.95 2k92 n GLU 41 Cb 0.00 -2.24 0.56 0.00 -0.02 0.00 0.00 31.44 29.74 2k92 n GLU 41 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2k92 n LEU 42 N -5.45 0.33 0.00 -4.62 -0.00 -0.69 -0.62 117.00 105.95 2k92 n LEU 42 Ca 0.10 1.59 0.00 0.00 -0.00 0.00 0.00 56.01 57.70 2k92 n LEU 42 Cb 0.39 -0.77 0.00 0.00 -0.00 0.00 0.00 43.42 43.04 2k92 n LEU 42 CO -0.13 -1.78 0.44 0.52 -0.00 0.00 0.00 177.39 176.44 2k92 n VAL 43 N -5.17 0.00 -0.29 1.96 0.31 0.52 0.15 118.33 115.81 2k92 n VAL 43 Ca 0.36 1.37 0.01 0.00 -0.01 0.00 0.00 64.34 66.07 2k92 n VAL 43 Cb 1.22 -2.22 0.05 0.00 -0.91 0.00 0.00 33.84 31.98 2k92 n VAL 43 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 2k92 n MET 44 N -1.87 -0.15 0.00 5.55 2.81 0.21 0.24 117.12 123.90 2k92 n MET 44 Ca 0.00 1.20 0.00 0.00 -1.81 0.00 0.00 57.70 57.09 2k92 n MET 44 Cb 0.00 -1.79 0.00 0.00 -0.71 0.00 0.00 33.22 30.72 2k92 n MET 44 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2k92 n ALA 45 N -3.62 -0.33 -0.01 3.04 0.00 -0.86 0.13 120.51 118.86 2k92 n ALA 45 Ca 0.09 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.76 2k92 n ALA 45 Cb 0.33 0.07 0.59 0.00 0.00 0.00 0.00 19.45 20.44 2k92 n ALA 45 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2k92 h LEU 46 N 0.00 0.00 0.08 0.00 3.38 0.13 0.60 115.31 119.50 2k92 h LEU 46 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k92 h LEU 46 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2k92 h LEU 46 CO 0.00 0.00 -0.04 -0.33 0.09 0.00 0.00 178.44 178.16 2k92 h GLU 47 N 0.00 -0.11 -0.38 1.13 4.39 0.40 -3.29 114.58 116.73 2k92 h GLU 47 Ca 0.29 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.96 2k92 h GLU 47 Cb 1.87 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 30.53 2k92 h GLU 47 CO -0.00 0.43 0.05 0.93 -1.16 0.00 0.00 179.01 179.25 2k92 h GLU 48 N -0.88 0.57 -0.11 2.33 4.39 0.56 -2.41 114.58 119.02 2k92 h GLU 48 Ca -0.01 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.59 2k92 h GLU 48 Cb 0.58 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 2k92 h GLU 48 CO 0.02 0.56 -0.10 1.49 -1.16 0.00 0.00 179.01 179.82 2k92 h GLU 49 N 0.55 -0.05 0.00 2.33 4.57 -0.13 -3.42 114.58 118.43 2k92 h GLU 49 Ca 0.12 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2k92 h GLU 49 Cb 0.28 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 2k92 h GLU 49 CO 0.00 -0.03 0.00 0.34 -1.18 0.00 0.00 179.01 178.14 2k92 n PHE 50 N -3.26 -0.53 0.00 0.92 -0.00 -1.20 -5.11 117.46 108.28 2k92 n PHE 50 Ca -0.00 0.09 0.00 0.00 -0.00 0.00 0.00 57.45 57.54 2k92 n PHE 50 Cb 0.06 0.15 0.00 0.00 -0.00 0.00 0.00 39.48 39.69 2k92 n PHE 50 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 2k92 n ASP 51 N -3.24 0.00 -3.15 -2.13 9.92 -0.91 -5.04 116.55 112.00 2k92 n ASP 51 Ca 0.00 0.00 0.06 0.00 -0.53 0.00 0.00 54.79 54.32 2k92 n ASP 51 Cb 0.00 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2k92 n ASP 51 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2k92 s THR 52 N 0.00 -0.24 -0.58 -3.53 -1.32 -1.26 -5.02 115.64 103.70 2k92 s THR 52 Ca 0.00 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.39 2k92 s THR 52 Cb 0.00 -0.25 -0.08 0.00 -1.51 0.00 0.00 72.50 70.67 2k92 s THR 52 CO 0.00 0.00 1.74 -1.84 -2.21 0.00 0.00 174.62 172.31 2k92 n GLU 53 N 5.10 1.27 -1.41 7.08 0.28 -1.26 -4.06 120.64 127.64 2k92 n GLU 53 Ca 0.09 -1.22 -0.48 0.00 -0.16 0.00 0.00 57.16 55.39 2k92 n GLU 53 Cb 0.58 -2.41 -0.12 0.00 1.43 0.00 0.00 31.44 30.92 2k92 n GLU 53 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 2k92 n ILE 54 N 4.91 0.02 -2.54 3.84 0.13 -1.26 -4.85 119.36 119.62 2k92 n ILE 54 Ca 0.33 -0.11 -0.36 0.00 -1.10 0.00 0.00 62.75 61.52 2k92 n ILE 54 Cb 0.16 -0.86 -0.04 0.00 -0.84 0.00 0.00 39.64 38.06 2k92 n ILE 54 CO 0.00 0.00 0.00 -2.16 2.80 0.00 0.00 176.55 177.19 2k92 s PRO 55 N 7.55 4.05 0.19 9.51 0.04 -1.26 -4.66 135.00 150.43 2k92 s PRO 55 Ca 1.24 1.47 -0.11 0.00 0.04 0.00 0.00 61.00 63.64 2k92 s PRO 55 Cb -1.19 -2.41 0.21 0.00 0.04 0.00 0.00 34.50 31.15 2k92 s PRO 55 CO 0.53 -0.23 1.75 0.38 0.04 0.00 0.00 177.00 179.46 2k92 h ASP 56 N 2.22 0.20 -1.79 6.66 3.04 -1.91 0.89 116.42 125.73 2k92 h ASP 56 Ca -0.49 0.07 0.52 0.00 -3.24 0.00 0.00 57.03 53.89 2k92 h ASP 56 Cb 1.22 0.05 -0.07 0.00 -1.04 0.00 0.00 39.33 39.48 2k92 h ASP 56 CO 0.61 0.13 1.39 -1.84 -2.04 0.00 0.00 179.24 177.50 2k92 n GLU 57 N -5.00 0.00 -0.01 4.15 0.28 -1.26 0.27 120.64 119.07 2k92 n GLU 57 Ca 0.07 1.07 0.03 0.00 -0.16 0.00 0.00 57.16 58.16 2k92 n GLU 57 Cb 0.23 -2.52 -0.06 0.00 1.43 0.00 0.00 31.44 30.52 2k92 n GLU 57 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2k92 n GLU 58 N -3.78 0.67 0.00 3.44 1.02 0.20 -4.19 120.64 118.00 2k92 n GLU 58 Ca 0.40 -0.06 0.14 0.00 -0.02 0.00 0.00 57.16 57.63 2k92 n GLU 58 Cb 1.93 -1.18 0.62 0.00 -0.02 0.00 0.00 31.44 32.78 2k92 n GLU 58 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k92 n ALA 59 N -1.85 2.65 -0.08 0.62 0.00 0.43 -3.59 120.51 118.69 2k92 n ALA 59 Ca -0.03 -0.37 -0.10 0.00 0.00 0.00 0.00 53.44 52.94 2k92 n ALA 59 Cb 0.29 -1.26 -0.11 0.00 0.00 0.00 0.00 19.45 18.37 2k92 n ALA 59 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2k92 n GLU 60 N -0.24 1.17 0.00 0.00 4.07 0.75 -4.27 120.64 122.12 2k92 n GLU 60 Ca 0.19 0.03 0.13 0.00 -0.06 0.00 0.00 57.16 57.45 2k92 n GLU 60 Cb 0.29 -1.40 0.71 0.00 -0.06 0.00 0.00 31.44 30.98 2k92 n GLU 60 CO 0.00 0.00 0.00 0.36 -0.06 0.00 0.00 177.13 177.43 2k92 n LYS 61 N -2.73 0.59 -0.06 5.31 2.85 -1.24 -3.33 118.16 119.55 2k92 n LYS 61 Ca -0.28 0.02 -0.05 0.00 -1.05 0.00 0.00 58.31 56.95 2k92 n LYS 61 Cb 0.97 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.80 2k92 n LYS 61 CO 0.00 0.00 0.00 -0.84 -0.05 0.00 0.00 177.40 176.51 2k92 h ILE 62 N 0.00 0.56 0.00 0.58 3.07 -1.74 -3.47 117.51 116.51 2k92 h ILE 62 Ca 0.00 -1.44 0.00 0.00 1.55 0.00 0.00 64.86 64.97 2k92 h ILE 62 Cb 0.12 1.07 0.00 0.00 -0.27 0.00 0.00 36.82 37.74 2k92 h ILE 62 CO 0.00 0.19 0.00 0.35 -1.05 0.00 0.00 178.15 177.64 2k92 n THR 63 N -4.70 0.00 -3.83 0.16 -2.24 -1.21 -4.74 114.28 97.72 2k92 n THR 63 Ca -0.05 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.64 2k92 n THR 63 Cb 0.19 -0.78 0.02 0.00 -2.10 0.00 0.00 70.33 67.66 2k92 n THR 63 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2k92 s THR 64 N -1.19 0.00 -0.04 4.28 -4.23 -1.26 -4.37 115.64 108.82 2k92 s THR 64 Ca 0.00 -1.06 -0.12 0.00 -1.18 0.00 0.00 61.69 59.33 2k92 s THR 64 Cb 0.00 -2.88 -0.31 0.00 1.34 0.00 0.00 72.50 70.65 2k92 s THR 64 CO 0.00 0.00 0.69 0.58 -0.54 0.00 0.00 174.62 175.35 2k92 h VAL 65 N 2.01 0.97 -0.33 2.29 2.07 -1.68 -3.32 116.25 118.26 2k92 h VAL 65 Ca -0.32 -2.52 0.07 0.00 0.82 0.00 0.00 66.70 64.75 2k92 h VAL 65 Cb 1.25 2.79 -0.08 0.00 -1.52 0.00 0.00 31.29 33.73 2k92 h VAL 65 CO 0.41 0.85 -0.28 -0.61 0.02 0.00 0.00 177.57 177.96 2k92 h GLN 66 N 0.10 -0.24 0.00 1.57 5.75 -1.82 1.21 115.11 121.68 2k92 h GLN 66 Ca -0.34 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.18 2k92 h GLN 66 Cb 2.10 0.06 0.00 0.00 1.07 0.00 0.00 27.48 30.71 2k92 h GLN 66 CO 0.18 -0.16 0.05 0.00 -2.65 0.00 0.00 178.83 176.25 2k92 h ALA 67 N 0.79 1.04 0.00 3.38 0.00 -1.85 0.71 119.26 123.32 2k92 h ALA 67 Ca 0.16 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 2k92 h ALA 67 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2k92 h ALA 67 CO -0.47 -0.04 -1.38 0.00 0.00 0.00 0.00 179.25 177.37 2k92 h ALA 68 N 1.89 0.67 0.00 0.00 0.00 0.12 -3.16 119.26 118.78 2k92 h ALA 68 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 53.94 2k92 h ALA 68 Cb 0.09 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2k92 h ALA 68 CO 0.00 1.08 -0.32 0.82 0.00 0.00 0.00 179.25 180.83 2k92 h ILE 69 N 0.00 0.00 -0.25 0.00 2.04 0.33 -2.98 117.51 116.64 2k92 h ILE 69 Ca -0.17 -0.81 0.07 0.00 1.00 0.00 0.00 64.86 64.95 2k92 h ILE 69 Cb 1.69 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 2k92 h ILE 69 CO 0.06 0.00 0.54 0.44 0.00 0.00 0.00 178.15 179.19 2k92 h ASP 70 N -0.81 0.00 0.07 1.72 5.19 -0.17 0.58 116.42 123.01 2k92 h ASP 70 Ca 0.00 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.30 2k92 h ASP 70 Cb 0.32 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.84 2k92 h ASP 70 CO 0.00 0.00 -0.46 0.22 -3.12 0.00 0.00 179.24 175.88 2k92 h TYR 71 N 0.00 0.33 0.00 4.55 3.20 -1.67 0.29 116.97 123.67 2k92 h TYR 71 Ca 0.12 -0.23 0.00 0.00 3.14 0.00 0.00 58.73 61.76 2k92 h TYR 71 Cb 1.19 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.44 2k92 h TYR 71 CO 0.00 1.16 0.00 -0.89 -1.64 0.00 0.00 178.16 176.79 2k92 n ILE 72 N -4.34 0.66 -0.09 1.81 2.08 0.11 -1.69 119.36 117.90 2k92 n ILE 72 Ca -0.12 0.07 -0.12 0.00 0.56 0.00 0.00 62.75 63.14 2k92 n ILE 72 Cb 0.66 -0.86 -0.15 0.00 -0.75 0.00 0.00 39.64 38.55 2k92 n ILE 72 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 2k92 n ASN 73 N -1.92 0.61 -0.33 4.38 3.02 0.16 -3.45 115.26 117.74 2k92 n ASN 73 Ca 0.04 0.03 0.11 0.00 -0.03 0.00 0.00 54.58 54.74 2k92 n ASN 73 Cb 0.28 0.49 0.52 0.00 -0.61 0.00 0.00 39.78 40.47 2k92 n ASN 73 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k92 n GLY 74 N 1.84 -0.27 0.40 7.41 0.00 0.10 -4.20 105.19 110.47 2k92 n GLY 74 Ca -0.34 -0.32 -0.03 0.00 0.00 0.00 0.00 46.02 45.34 2k92 n GLY 74 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2k92 n HIS 75 N -0.16 0.00 -1.66 1.61 -0.00 -0.68 -4.96 115.22 109.36 2k92 n HIS 75 Ca 0.17 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.46 2k92 n HIS 75 Cb 0.24 -0.15 -0.03 0.00 -0.00 0.00 0.00 29.99 30.05 2k92 n HIS 75 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.34 177.28 2k92 n GLN 76 N -3.24 2.77 0.00 1.57 7.27 -1.22 -5.11 117.38 119.43 2k92 n GLN 76 Ca -0.04 1.02 0.00 0.00 0.07 0.00 0.00 57.00 58.05 2k92 n GLN 76 Cb 0.15 -2.96 0.00 0.00 2.41 0.00 0.00 30.24 29.85 2k92 n GLN 76 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13