#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 0.00 0.00 0.44 -2.24 -1.26 -4.44 114.28 106.78 2k92 n THR 2 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2k92 n THR 2 Cb 0.00 -1.29 0.00 0.00 -2.10 0.00 0.00 70.33 66.94 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 -1.90 0.00 0.20 2.28 0.00 -1.26 -4.75 119.36 113.94 2k92 n ILE 3 Ca -0.14 0.00 0.08 0.00 0.00 0.00 0.00 62.75 62.69 2k92 n ILE 3 Cb 0.45 -0.42 0.38 0.00 0.00 0.00 0.00 39.64 40.04 2k92 n ILE 3 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 176.55 177.60 2k92 h GLU 4 N 0.00 0.00 0.00 9.51 -0.00 -1.95 0.76 114.58 122.90 2k92 h GLU 4 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 59.36 59.22 2k92 h GLU 4 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 28.73 2k92 h GLU 4 CO 0.00 0.30 -0.67 1.05 -0.00 0.00 0.00 179.01 179.70 2k92 h GLU 5 N 0.00 0.00 0.07 1.06 4.11 -1.90 -3.26 114.58 114.65 2k92 h GLU 5 Ca -0.00 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 59.07 2k92 h GLU 5 Cb 0.85 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.06 2k92 h GLU 5 CO 0.04 0.67 -2.06 0.54 0.07 0.00 0.00 179.01 178.26 2k92 n ARG 6 N -3.29 0.69 -0.29 1.06 1.74 -1.03 -4.30 116.66 111.24 2k92 n ARG 6 Ca 0.01 0.28 0.03 0.00 -0.77 0.00 0.00 57.85 57.40 2k92 n ARG 6 Cb 0.79 -1.65 0.11 0.00 -1.02 0.00 0.00 32.46 30.69 2k92 n ARG 6 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2k92 h VAL 7 N -0.18 0.17 -1.20 1.55 2.07 0.42 1.50 116.25 120.58 2k92 h VAL 7 Ca -0.47 -0.00 0.41 0.00 0.82 0.00 0.00 66.70 67.45 2k92 h VAL 7 Cb 1.87 0.17 -0.14 0.00 -1.52 0.00 0.00 31.29 31.67 2k92 h VAL 7 CO -0.04 0.00 0.75 0.11 0.02 0.00 0.00 177.57 178.41 2k92 h LYS 8 N 0.00 0.12 0.19 1.57 6.56 -1.74 0.84 116.57 124.11 2k92 h LYS 8 Ca 0.40 -0.01 -0.01 0.00 -1.06 0.00 0.00 60.65 59.97 2k92 h LYS 8 Cb 0.61 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.25 2k92 h LYS 8 CO -0.85 0.08 -0.09 -0.22 -2.06 0.00 0.00 179.45 176.31 2k92 h LYS 9 N 0.13 -0.24 -0.42 3.15 3.64 0.19 1.26 116.57 124.28 2k92 h LYS 9 Ca 0.80 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 60.32 2k92 h LYS 9 Cb 2.32 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 34.18 2k92 h LYS 9 CO -0.50 0.11 0.65 0.82 -2.27 0.00 0.00 179.45 178.26 2k92 h ILE 10 N -0.63 0.17 0.00 2.00 2.04 0.10 1.93 117.51 123.12 2k92 h ILE 10 Ca -0.03 0.00 -0.28 0.00 1.00 0.00 0.00 64.86 65.56 2k92 h ILE 10 Cb 0.46 0.44 -0.05 0.00 -0.74 0.00 0.00 36.82 36.93 2k92 h ILE 10 CO 0.04 0.00 -2.28 -0.38 0.00 0.00 0.00 178.15 175.53 2k92 n ILE 11 N -3.30 1.05 -0.39 -0.67 2.08 -0.36 -2.79 119.36 114.98 2k92 n ILE 11 Ca 0.08 -0.76 0.07 0.00 0.56 0.00 0.00 62.75 62.70 2k92 n ILE 11 Cb 0.81 -0.36 0.32 0.00 -0.75 0.00 0.00 39.64 39.66 2k92 n ILE 11 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2k92 n GLY 12 N 1.66 2.47 1.02 7.39 0.00 0.43 -3.61 105.19 114.55 2k92 n GLY 12 Ca -0.26 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2k92 n GLY 12 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k92 n GLN 13 N 0.83 0.00 0.03 1.61 1.13 0.55 -4.17 117.38 117.37 2k92 n GLN 13 Ca 0.23 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.27 2k92 n GLN 13 Cb 0.87 -0.33 -0.01 0.00 0.11 0.00 0.00 30.24 30.88 2k92 n GLN 13 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 2k92 h GLN 14 N 0.00 -0.12 -0.08 -1.09 -0.00 -1.63 -3.38 115.11 108.80 2k92 h GLN 14 Ca 0.00 0.01 0.02 0.00 -0.00 0.00 0.00 58.65 58.67 2k92 h GLN 14 Cb 0.23 0.03 -0.03 0.00 0.00 0.00 0.00 27.48 27.71 2k92 h GLN 14 CO 0.00 -0.08 -0.26 -0.07 0.00 0.00 0.00 178.83 178.42 2k92 h LEU 15 N -0.45 -0.82 0.00 -2.39 3.38 -1.71 -3.48 115.31 109.85 2k92 h LEU 15 Ca -0.01 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2k92 h LEU 15 Cb 0.10 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2k92 h LEU 15 CO 0.02 -0.22 0.00 0.61 0.09 0.00 0.00 178.44 178.94 2k92 n GLY 16 N -1.20 0.49 3.38 0.83 0.00 -1.25 -4.93 105.19 102.51 2k92 n GLY 16 Ca -0.03 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.55 2k92 n GLY 16 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k92 s VAL 17 N 0.00 0.03 1.27 1.61 -7.23 -1.26 -4.93 120.40 109.89 2k92 s VAL 17 Ca 0.00 -0.23 -0.20 0.00 -1.81 0.00 0.00 61.98 59.74 2k92 s VAL 17 Cb 0.00 -1.07 0.31 0.00 0.56 0.00 0.00 36.38 36.18 2k92 s VAL 17 CO 0.00 -0.12 1.05 -0.54 -0.31 0.00 0.00 175.10 175.18 2k92 s LYS 18 N -3.77 -1.76 -0.09 4.82 3.01 -1.26 -4.35 119.74 116.34 2k92 s LYS 18 Ca 0.02 0.05 -0.09 0.00 -1.01 0.00 0.00 55.97 54.94 2k92 s LYS 18 Cb 0.00 -1.52 -0.28 0.00 -1.01 0.00 0.00 37.83 35.02 2k92 s LYS 18 CO -0.12 -4.09 0.50 1.96 0.51 0.00 0.00 175.35 174.11 2k92 h GLN 19 N -2.85 0.32 -0.27 1.68 7.50 -1.87 -3.09 115.11 116.52 2k92 h GLN 19 Ca -0.45 -0.55 -0.13 0.00 0.50 0.00 0.00 58.65 58.01 2k92 h GLN 19 Cb 1.31 0.21 -0.00 0.00 0.05 0.00 0.00 27.48 29.04 2k92 h GLN 19 CO 0.33 1.26 -0.34 1.49 -1.50 0.00 0.00 178.83 180.08 2k92 h GLU 20 N 0.09 0.71 -0.78 1.46 4.81 -2.00 -3.12 114.58 115.76 2k92 h GLU 20 Ca -0.39 -0.40 -0.04 0.00 -0.13 0.00 0.00 59.36 58.40 2k92 h GLU 20 Cb 2.07 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 31.44 2k92 h GLU 20 CO 0.13 1.02 0.32 0.93 -0.73 0.00 0.00 179.01 180.67 2k92 h GLU 21 N 0.45 1.16 -6.39 1.92 5.08 -1.96 -3.41 114.58 111.43 2k92 h GLU 21 Ca 0.04 -0.21 -0.54 0.00 -1.00 0.00 0.00 59.36 57.65 2k92 h GLU 21 Cb 0.92 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 2k92 h GLU 21 CO 0.08 0.94 0.35 0.54 -1.00 0.00 0.00 179.01 179.92 2k92 s VAL 22 N -5.57 4.87 0.00 3.13 0.11 -1.17 -4.95 120.40 116.83 2k92 s VAL 22 Ca -0.12 2.02 0.00 0.00 -2.93 0.00 0.00 61.98 60.95 2k92 s VAL 22 Cb 0.15 -4.30 0.00 0.00 -1.53 0.00 0.00 36.38 30.70 2k92 s VAL 22 CO 0.83 0.17 0.00 0.35 -3.33 0.00 0.00 175.10 173.12 2k92 n THR 23 N 3.86 0.00 -0.11 5.04 -2.24 -1.26 -4.82 114.28 114.75 2k92 n THR 23 Ca 0.05 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.64 2k92 n THR 23 Cb 0.51 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.65 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 1.93 -2.63 3.42 0.23 -1.26 -4.53 115.26 112.42 2k92 n ASN 24 Ca 0.00 0.10 -0.37 0.00 -0.53 0.00 0.00 54.58 53.78 2k92 n ASN 24 Cb 0.00 -0.51 0.06 0.00 -2.08 0.00 0.00 39.78 37.25 2k92 n ASN 24 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2k92 n ASN 25 N -3.60 7.59 -4.12 0.53 6.94 -1.26 -1.55 115.26 119.79 2k92 n ASN 25 Ca -0.41 -3.82 -0.33 0.00 -0.02 0.00 0.00 54.58 50.00 2k92 n ASN 25 Cb 0.85 -1.02 -0.14 0.00 -2.36 0.00 0.00 39.78 37.10 2k92 n ASN 25 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2k92 s ALA 26 N -3.96 2.68 -1.23 -2.53 0.00 -1.26 -5.04 121.76 110.43 2k92 s ALA 26 Ca 0.58 -1.74 -0.16 0.00 0.00 0.00 0.00 51.96 50.64 2k92 s ALA 26 Cb 0.47 -1.74 0.13 0.00 0.00 0.00 0.00 23.12 21.99 2k92 s ALA 26 CO -0.22 -1.20 1.54 -1.12 0.00 0.00 0.00 175.76 174.75 2k92 s SER 27 N 1.18 6.96 0.36 0.00 0.01 -1.26 -3.77 113.70 117.18 2k92 s SER 27 Ca -0.07 -2.72 0.24 0.00 1.31 0.00 0.00 55.95 54.71 2k92 s SER 27 Cb -0.20 -2.47 1.27 0.00 0.21 0.00 0.00 66.02 64.83 2k92 s SER 27 CO -0.03 -0.93 1.40 2.22 0.41 0.00 0.00 173.24 176.30 2k92 n PHE 28 N 6.77 0.81 0.00 2.43 1.16 -1.26 -1.13 117.46 126.25 2k92 n PHE 28 Ca 0.41 0.82 0.00 0.00 -1.87 0.00 0.00 57.45 56.81 2k92 n PHE 28 Cb 0.44 -1.24 0.00 0.00 -1.61 0.00 0.00 39.48 37.08 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 -4.72 0.00 0.26 1.97 0.24 -1.26 0.16 118.33 114.98 2k92 n VAL 29 Ca 0.35 0.67 -0.11 0.00 -2.04 0.00 0.00 64.34 63.21 2k92 n VAL 29 Cb 1.28 -1.16 -0.05 0.00 -1.47 0.00 0.00 33.84 32.44 2k92 n VAL 29 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2k92 h GLU 30 N 0.00 -0.69 -0.55 7.34 4.22 -1.81 -2.89 114.58 120.21 2k92 h GLU 30 Ca 0.00 0.05 0.05 0.00 0.08 0.00 0.00 59.36 59.54 2k92 h GLU 30 Cb 0.00 0.16 -0.07 0.00 0.50 0.00 0.00 28.75 29.34 2k92 h GLU 30 CO 0.00 -0.46 -0.32 -0.25 -2.18 0.00 0.00 179.01 175.80 2k92 n ASP 31 N -5.13 -0.58 0.00 1.04 8.00 -0.28 -4.47 116.55 115.12 2k92 n ASP 31 Ca -0.09 1.34 0.00 0.00 0.71 0.00 0.00 54.79 56.75 2k92 n ASP 31 Cb 0.28 -0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 2k92 n ASP 31 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2k92 n LEU 32 N -4.25 0.00 -2.75 0.64 4.77 0.26 -4.99 117.00 110.68 2k92 n LEU 32 Ca 0.01 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.01 2k92 n LEU 32 Cb 0.14 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.24 2k92 n LEU 32 CO -0.09 0.00 0.51 -0.83 -1.33 0.00 0.00 177.39 175.65 2k92 s GLY 33 N 0.00 -1.53 -0.88 -0.72 0.00 0.42 -4.80 107.32 99.81 2k92 s GLY 33 Ca 0.00 1.44 0.01 0.00 0.00 0.00 0.00 44.72 46.16 2k92 s GLY 33 CO 0.00 4.36 1.38 0.00 0.00 0.00 0.00 173.10 178.84 2k92 n ALA 34 N 3.71 5.24 -1.00 3.20 0.00 -1.24 -4.67 120.51 125.75 2k92 n ALA 34 Ca 0.05 -4.71 0.07 0.00 0.00 0.00 0.00 53.44 48.85 2k92 n ALA 34 Cb 0.64 -1.70 0.30 0.00 0.00 0.00 0.00 19.45 18.68 2k92 n ALA 34 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2k92 n ASP 35 N 0.37 4.36 -3.15 0.00 5.75 -1.26 -4.47 116.55 118.15 2k92 n ASP 35 Ca 0.36 -3.05 0.05 0.00 -0.01 0.00 0.00 54.79 52.13 2k92 n ASP 35 Cb 0.33 -0.60 -0.01 0.00 -1.03 0.00 0.00 41.12 39.81 2k92 n ASP 35 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2k92 s SER 36 N -1.62 -0.99 -0.61 -1.12 0.15 -1.26 -4.92 113.70 103.33 2k92 s SER 36 Ca 0.46 0.62 0.00 0.00 0.70 0.00 0.00 55.95 57.74 2k92 s SER 36 Cb 0.37 1.83 0.00 0.00 -1.71 0.00 0.00 66.02 66.51 2k92 s SER 36 CO 0.11 -0.18 0.00 0.18 1.20 0.00 0.00 173.24 174.54 2k92 n LEU 37 N 5.45 -1.26 0.00 3.45 4.77 -1.26 -4.87 117.00 123.28 2k92 n LEU 37 Ca -0.04 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2k92 n LEU 37 Cb 0.52 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.29 2k92 n LEU 37 CO -0.03 -0.10 0.00 -0.67 -1.33 0.00 0.00 177.39 175.27 2k92 n ASP 38 N 0.67 0.00 -0.31 -1.43 2.03 -1.26 -3.80 116.55 112.44 2k92 n ASP 38 Ca -0.08 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.19 2k92 n ASP 38 Cb 0.54 0.00 0.08 0.00 -0.72 0.00 0.00 41.12 41.02 2k92 n ASP 38 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k92 h THR 39 N 0.00 1.22 0.00 5.18 1.03 -1.90 -0.08 112.91 118.36 2k92 h THR 39 Ca 0.00 -0.43 0.00 0.00 -0.01 0.00 0.00 66.41 65.97 2k92 h THR 39 Cb 0.00 -0.01 0.00 0.00 -1.07 0.00 0.00 68.15 67.07 2k92 h THR 39 CO 0.00 0.22 0.00 0.52 -0.01 0.00 0.00 175.52 176.25 2k92 n VAL 40 N -4.47 0.00 -0.32 0.00 0.31 -1.26 -2.32 118.33 110.27 2k92 n VAL 40 Ca 0.09 0.48 0.13 0.00 -0.01 0.00 0.00 64.34 65.03 2k92 n VAL 40 Cb 0.03 -1.30 0.26 0.00 -0.91 0.00 0.00 33.84 31.91 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 0.00 -0.07 -0.34 5.55 -0.58 -1.25 0.19 120.64 124.13 2k92 n GLU 41 Ca 0.00 1.39 0.31 0.00 -0.42 0.00 0.00 57.16 58.44 2k92 n GLU 41 Cb 0.00 -2.20 0.54 0.00 -0.57 0.00 0.00 31.44 29.22 2k92 n GLU 41 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 2k92 n LEU 42 N -5.37 0.24 0.08 -4.62 -0.00 -0.04 0.20 117.00 107.48 2k92 n LEU 42 Ca 0.21 1.30 -0.03 0.00 -0.00 0.00 0.00 56.01 57.50 2k92 n LEU 42 Cb 0.69 -0.64 -0.01 0.00 -0.00 0.00 0.00 43.42 43.46 2k92 n LEU 42 CO -0.07 -1.44 0.43 0.58 -0.00 0.00 0.00 177.39 176.89 2k92 h VAL 43 N 0.00 0.00 -0.74 1.96 2.07 0.25 -1.38 116.25 118.40 2k92 h VAL 43 Ca 0.74 -0.03 0.11 0.00 0.82 0.00 0.00 66.70 68.35 2k92 h VAL 43 Cb 2.19 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 31.84 2k92 h VAL 43 CO -0.53 0.00 -0.31 0.23 0.02 0.00 0.00 177.57 176.99 2k92 n MET 44 N -2.60 -0.19 0.00 1.57 2.81 0.13 0.22 117.12 119.07 2k92 n MET 44 Ca -0.02 1.14 0.00 0.00 -1.81 0.00 0.00 57.70 57.01 2k92 n MET 44 Cb 0.08 -1.69 0.00 0.00 -0.71 0.00 0.00 33.22 30.89 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 -3.59 -0.18 -0.24 3.04 0.00 -0.70 0.18 120.51 119.01 2k92 n ALA 45 Ca 0.07 0.00 0.32 0.00 0.00 0.00 0.00 53.44 53.83 2k92 n ALA 45 Cb 0.29 0.09 0.62 0.00 0.00 0.00 0.00 19.45 20.45 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 -0.04 0.89 115.31 119.62 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 -0.32 1.13 4.39 0.39 -3.23 114.58 116.83 2k92 h GLU 47 Ca 0.51 0.01 -0.06 0.00 0.34 0.00 0.00 59.36 60.15 2k92 h GLU 47 Cb 2.55 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 31.20 2k92 h GLU 47 CO -0.01 0.44 -0.08 0.93 -1.16 0.00 0.00 179.01 179.14 2k92 h GLU 48 N -0.83 0.53 -0.31 2.33 4.39 0.83 -2.07 114.58 119.45 2k92 h GLU 48 Ca -0.01 -0.14 0.04 0.00 0.34 0.00 0.00 59.36 59.59 2k92 h GLU 48 Cb 0.60 -0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 29.11 2k92 h GLU 48 CO 0.02 0.61 -0.55 1.49 -1.16 0.00 0.00 179.01 179.42 2k92 h GLU 49 N 0.50 -0.45 0.00 2.33 4.57 0.28 -3.43 114.58 118.38 2k92 h GLU 49 Ca 0.10 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2k92 h GLU 49 Cb 0.44 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 2k92 h GLU 49 CO 0.02 -0.30 0.00 1.19 -1.18 0.00 0.00 179.01 178.74 2k92 n PHE 50 N -5.40 -0.45 0.00 0.92 3.72 -1.17 -5.10 117.46 109.97 2k92 n PHE 50 Ca -0.04 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 2k92 n PHE 50 Cb 0.36 0.29 0.00 0.00 -0.94 0.00 0.00 39.48 39.19 2k92 n PHE 50 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2k92 n ASP 51 N -2.81 0.00 -3.13 4.37 9.92 -0.79 -5.02 116.55 119.10 2k92 n ASP 51 Ca 0.00 0.00 0.05 0.00 -0.53 0.00 0.00 54.79 54.31 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 -0.43 -3.53 -1.32 -1.26 -5.01 115.64 103.85 2k92 s THR 52 Ca 0.00 0.00 -0.18 0.00 -1.21 0.00 0.00 61.69 60.30 2k92 s THR 52 Cb 0.00 -0.22 -0.18 0.00 -1.51 0.00 0.00 72.50 70.59 2k92 s THR 52 CO 0.00 0.00 1.69 -1.84 -2.21 0.00 0.00 174.62 172.26 2k92 n GLU 53 N 5.01 0.89 -1.46 7.08 0.28 -1.26 -4.14 120.64 127.04 2k92 n GLU 53 Ca 0.09 -1.28 -0.46 0.00 -0.16 0.00 0.00 57.16 55.35 2k92 n GLU 53 Cb 0.58 -2.55 -0.08 0.00 1.43 0.00 0.00 31.44 30.82 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 5.79 0.07 -2.54 3.84 0.13 -1.26 -4.88 119.36 120.52 2k92 n ILE 54 Ca 0.39 -0.29 -0.34 0.00 -1.10 0.00 0.00 62.75 61.41 2k92 n ILE 54 Cb 0.29 -1.52 -0.04 0.00 -0.84 0.00 0.00 39.64 37.53 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 7.24 3.84 0.14 9.51 0.04 -1.26 -4.64 135.00 149.87 2k92 s PRO 55 Ca 1.14 1.38 -0.17 0.00 0.04 0.00 0.00 61.00 63.39 2k92 s PRO 55 Cb -0.87 -2.15 0.01 0.00 0.04 0.00 0.00 34.50 31.53 2k92 s PRO 55 CO 0.46 -0.40 1.77 0.38 0.04 0.00 0.00 177.00 179.26 2k92 h ASP 56 N 1.67 0.24 -1.34 6.66 3.04 -1.90 0.97 116.42 125.77 2k92 h ASP 56 Ca -0.49 0.01 0.39 0.00 -3.24 0.00 0.00 57.03 53.70 2k92 h ASP 56 Cb 1.22 -0.04 -0.08 0.00 -1.04 0.00 0.00 39.33 39.39 2k92 h ASP 56 CO 0.59 0.18 0.93 -0.08 -2.04 0.00 0.00 179.24 178.82 2k92 h GLU 57 N 0.34 0.09 0.00 4.15 4.57 -1.99 2.06 114.58 123.80 2k92 h GLU 57 Ca 0.13 -0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.24 2k92 h GLU 57 Cb 0.04 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.59 2k92 h GLU 57 CO -0.08 0.06 -2.06 0.39 -1.18 0.00 0.00 179.01 176.13 2k92 n GLU 58 N -4.34 0.67 -0.75 1.92 1.02 -0.36 -4.12 120.64 114.67 2k92 n GLU 58 Ca 0.32 -0.16 0.07 0.00 -0.02 0.00 0.00 57.16 57.37 2k92 n GLU 58 Cb 1.37 -1.52 0.37 0.00 -0.02 0.00 0.00 31.44 31.64 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 -2.34 3.54 -0.10 0.62 0.00 0.34 -4.08 120.51 118.49 2k92 n ALA 59 Ca -0.09 -1.69 -0.12 0.00 0.00 0.00 0.00 53.44 51.54 2k92 n ALA 59 Cb 0.67 -1.09 -0.11 0.00 0.00 0.00 0.00 19.45 18.93 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 0.77 0.78 0.00 0.00 2.13 0.61 -4.28 120.64 120.65 2k92 n GLU 60 Ca 0.26 0.08 0.13 0.00 0.66 0.00 0.00 57.16 58.29 2k92 n GLU 60 Cb 1.04 -1.41 0.77 0.00 0.27 0.00 0.00 31.44 32.11 2k92 n GLU 60 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 2k92 n LYS 61 N -2.95 0.76 -0.06 5.31 2.85 -1.26 -3.30 118.16 119.52 2k92 n LYS 61 Ca -0.33 0.01 -0.07 0.00 -1.05 0.00 0.00 58.31 56.87 2k92 n LYS 61 Cb 0.93 -1.50 -0.06 0.00 -0.65 0.00 0.00 35.03 33.75 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 0.84 -1.53 0.58 3.07 -1.75 -3.46 117.51 115.26 2k92 h ILE 62 Ca 0.00 -1.62 -0.23 0.00 1.55 0.00 0.00 64.86 64.57 2k92 h ILE 62 Cb 0.04 1.58 -0.09 0.00 -0.27 0.00 0.00 36.82 38.08 2k92 h ILE 62 CO 0.00 0.28 -0.21 1.07 -1.05 0.00 0.00 178.15 178.24 2k92 n THR 63 N -4.71 -0.01 -3.31 0.16 5.66 -1.21 -4.78 114.28 106.08 2k92 n THR 63 Ca -0.05 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 60.92 2k92 n THR 63 Cb 0.23 -1.07 0.01 0.00 -1.55 0.00 0.00 70.33 67.94 2k92 n THR 63 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2k92 n THR 64 N -1.77 0.00 -0.09 1.09 -2.24 -1.26 -4.52 114.28 105.48 2k92 n THR 64 Ca -0.11 -0.33 -0.13 0.00 -2.27 0.00 0.00 64.05 61.21 2k92 n THR 64 Cb 0.37 0.34 -0.05 0.00 -2.10 0.00 0.00 70.33 68.88 2k92 n THR 64 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2k92 n VAL 65 N -0.19 1.48 -0.37 2.28 0.31 -1.25 -4.16 118.33 116.44 2k92 n VAL 65 Ca -0.03 0.06 0.01 0.00 -0.01 0.00 0.00 64.34 64.37 2k92 n VAL 65 Cb 0.21 -2.23 0.07 0.00 -0.91 0.00 0.00 33.84 30.97 2k92 n VAL 65 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2k92 n GLN 66 N -4.48 -0.18 -0.23 5.55 7.27 -0.60 0.14 117.38 124.84 2k92 n GLN 66 Ca -0.21 1.50 0.01 0.00 0.07 0.00 0.00 57.00 58.37 2k92 n GLN 66 Cb 0.51 -2.23 0.09 0.00 2.41 0.00 0.00 30.24 31.02 2k92 n GLN 66 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2k92 h ALA 67 N 1.53 0.50 -0.23 1.69 0.00 -1.82 1.97 119.26 122.91 2k92 h ALA 67 Ca 0.38 0.26 0.07 0.00 0.00 0.00 0.00 54.91 55.61 2k92 h ALA 67 Cb 0.62 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2k92 h ALA 67 CO -0.97 -0.42 0.17 0.00 0.00 0.00 0.00 179.25 178.03 2k92 h ALA 68 N 1.68 2.16 0.00 0.00 0.00 0.10 0.11 119.26 123.32 2k92 h ALA 68 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2k92 h ALA 68 Cb 0.53 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2k92 h ALA 68 CO -0.69 -0.29 -0.01 0.82 0.00 0.00 0.00 179.25 179.08 2k92 h ILE 69 N 0.00 0.00 -1.53 0.00 2.04 0.37 -2.04 117.51 116.35 2k92 h ILE 69 Ca 0.11 -0.38 0.44 0.00 1.00 0.00 0.00 64.86 66.03 2k92 h ILE 69 Cb 0.45 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.47 2k92 h ILE 69 CO -0.00 0.00 1.22 -0.78 0.00 0.00 0.00 178.15 178.59 2k92 h ASP 70 N -0.38 0.00 0.13 1.72 3.58 0.11 1.63 116.42 123.22 2k92 h ASP 70 Ca 0.00 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.25 2k92 h ASP 70 Cb 0.01 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.08 2k92 h ASP 70 CO 0.00 0.00 -0.85 0.22 -2.88 0.00 0.00 179.24 175.73 2k92 h TYR 71 N 0.00 0.59 0.00 0.28 3.20 -0.86 -2.12 116.97 118.06 2k92 h TYR 71 Ca 0.72 -0.42 -0.02 0.00 3.14 0.00 0.00 58.73 62.15 2k92 h TYR 71 Cb 3.16 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 41.40 2k92 h TYR 71 CO 0.00 1.31 -0.11 0.82 -1.64 0.00 0.00 178.16 178.55 2k92 h ILE 72 N -0.29 0.78 0.14 1.81 1.08 0.30 -1.86 117.51 119.47 2k92 h ILE 72 Ca -0.14 -0.41 -0.26 0.00 -0.39 0.00 0.00 64.86 63.66 2k92 h ILE 72 Cb 1.65 1.24 0.03 0.00 -3.07 0.00 0.00 36.82 36.67 2k92 h ILE 72 CO 0.16 0.10 -1.10 0.78 -0.69 0.00 0.00 178.15 177.41 2k92 h ASN 73 N 0.00 0.71 0.00 1.72 2.35 -0.64 -3.16 115.58 116.56 2k92 h ASN 73 Ca -0.00 -0.88 0.00 0.00 -0.55 0.00 0.00 56.30 54.87 2k92 h ASN 73 Cb 0.23 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.38 2k92 h ASN 73 CO 0.01 1.53 0.06 1.23 -1.65 0.00 0.00 177.43 178.61 2k92 h GLY 74 N 0.01 0.00 0.46 2.83 0.00 -0.63 -2.54 103.07 103.19 2k92 h GLY 74 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 2k92 h GLY 74 CO 0.21 0.00 -0.22 0.84 0.00 0.00 0.00 176.54 177.37 2k92 h HIS 75 N 0.00 -0.57 -2.33 5.60 6.17 -1.42 -3.41 115.15 119.19 2k92 h HIS 75 Ca 0.00 -0.01 -0.58 0.00 0.71 0.00 0.00 60.37 60.49 2k92 h HIS 75 Cb 0.11 0.19 -0.01 0.00 2.52 0.00 0.00 27.41 30.22 2k92 h HIS 75 CO 0.00 -0.36 1.36 -0.65 0.71 0.00 0.00 177.93 179.00 2k92 s GLN 76 N -3.68 3.36 0.00 5.26 -0.21 -0.96 -5.15 119.66 118.29 2k92 s GLN 76 Ca -0.09 1.86 0.00 0.00 0.02 0.00 0.00 55.36 57.15 2k92 s GLN 76 Cb 0.01 -4.26 0.00 0.00 1.00 0.00 0.00 33.01 29.76 2k92 s GLN 76 CO 0.27 -1.83 0.00 0.00 -2.12 0.00 0.00 175.29 171.61