#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k93 s THR 2 N 0.00 1.97 0.00 0.44 -4.23 -1.26 -4.70 115.64 107.86 2k93 s THR 2 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 2k93 s THR 2 Cb 0.00 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 71.11 2k93 s THR 2 CO 0.00 0.00 0.77 -0.38 -0.54 0.00 0.00 174.62 174.47 2k93 n ILE 3 N -3.87 0.00 -0.15 2.99 2.08 -1.26 -0.51 119.36 118.64 2k93 n ILE 3 Ca 0.07 1.27 -0.04 0.00 0.56 0.00 0.00 62.75 64.61 2k93 n ILE 3 Cb 0.59 -1.94 0.02 0.00 -0.75 0.00 0.00 39.64 37.57 2k93 n ILE 3 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 2k93 h GLU 4 N 0.00 -0.06 -0.93 0.38 4.22 -1.94 0.49 114.58 116.74 2k93 h GLU 4 Ca 0.00 0.00 0.11 0.00 0.08 0.00 0.00 59.36 59.56 2k93 h GLU 4 Cb 0.00 0.01 -0.13 0.00 0.50 0.00 0.00 28.75 29.13 2k93 h GLU 4 CO 0.00 -0.04 -0.47 -1.91 -2.18 0.00 0.00 179.01 174.41 2k93 n GLU 5 N -5.38 -0.32 -0.14 1.92 2.13 -0.94 0.12 120.64 118.03 2k93 n GLU 5 Ca 0.04 1.42 -0.06 0.00 0.66 0.00 0.00 57.16 59.22 2k93 n GLU 5 Cb 0.29 -2.10 0.11 0.00 0.27 0.00 0.00 31.44 30.00 2k93 n GLU 5 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k93 h ARG 6 N 0.00 0.89 0.57 5.31 3.08 0.23 -2.10 114.38 122.36 2k93 h ARG 6 Ca 0.23 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 2k93 h ARG 6 Cb 0.46 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 2k93 h ARG 6 CO -0.90 0.89 -0.38 0.28 -1.07 0.00 0.00 179.97 178.79 2k93 h VAL 7 N 0.82 0.00 -0.77 2.04 2.07 0.32 0.99 116.25 121.72 2k93 h VAL 7 Ca 0.15 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.85 2k93 h VAL 7 Cb 0.51 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.15 2k93 h VAL 7 CO 0.03 0.00 0.10 0.11 0.02 0.00 0.00 177.57 177.83 2k93 h LYS 8 N -0.90 0.17 0.17 1.57 6.56 0.91 0.96 116.57 126.01 2k93 h LYS 8 Ca -0.08 -0.01 -0.00 0.00 -1.06 0.00 0.00 60.65 59.50 2k93 h LYS 8 Cb 0.73 -0.04 -0.02 0.00 -0.57 0.00 0.00 32.23 32.33 2k93 h LYS 8 CO 0.06 0.11 -0.29 -0.22 -2.06 0.00 0.00 179.45 177.05 2k93 h LYS 9 N 0.17 -0.47 -0.73 3.15 1.63 -0.94 0.87 116.57 120.25 2k93 h LYS 9 Ca 0.44 0.03 0.12 0.00 -0.85 0.00 0.00 60.65 60.39 2k93 h LYS 9 Cb 0.79 0.11 -0.13 0.00 -0.60 0.00 0.00 32.23 32.39 2k93 h LYS 9 CO -0.61 -0.32 -0.34 0.82 -3.45 0.00 0.00 179.45 175.56 2k93 h ILE 10 N -0.49 0.13 -0.76 2.00 1.08 0.44 1.43 117.51 121.34 2k93 h ILE 10 Ca -0.02 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.54 2k93 h ILE 10 Cb 0.46 0.13 -0.05 0.00 -3.07 0.00 0.00 36.82 34.28 2k93 h ILE 10 CO -0.10 0.00 0.50 0.40 -0.69 0.00 0.00 178.15 178.25 2k93 h ILE 11 N -0.10 0.96 0.00 -0.67 5.03 -0.33 0.67 117.51 123.07 2k93 h ILE 11 Ca 0.28 -0.24 0.00 0.00 -0.12 0.00 0.00 64.86 64.78 2k93 h ILE 11 Cb 0.57 0.19 0.00 0.00 -3.03 0.00 0.00 36.82 34.55 2k93 h ILE 11 CO -0.78 0.13 0.00 0.61 -0.68 0.00 0.00 178.15 177.43 2k93 n GLY 12 N -1.45 -0.80 0.00 5.37 0.00 0.47 -2.01 105.19 106.78 2k93 n GLY 12 Ca 0.12 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.10 2k93 n GLY 12 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k93 n GLN 13 N -1.26 0.56 0.14 1.61 6.02 0.21 -2.05 117.38 122.61 2k93 n GLN 13 Ca 0.08 -0.07 0.12 0.00 -0.01 0.00 0.00 57.00 57.12 2k93 n GLN 13 Cb 0.12 -1.16 0.52 0.00 1.02 0.00 0.00 30.24 30.74 2k93 n GLN 13 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k93 n GLN 14 N -1.73 0.19 0.00 -1.09 -0.00 0.29 -4.13 117.38 110.90 2k93 n GLN 14 Ca -0.01 0.48 0.00 0.00 -0.00 0.00 0.00 57.00 57.47 2k93 n GLN 14 Cb 0.20 -1.91 0.00 0.00 -0.00 0.00 0.00 30.24 28.53 2k93 n GLN 14 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.06 178.53 2k93 n LEU 15 N -2.27 0.00 0.00 2.61 -0.00 -1.24 -4.50 117.00 111.61 2k93 n LEU 15 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.02 2k93 n LEU 15 Cb 0.18 0.03 0.00 0.00 -0.00 0.00 0.00 43.42 43.63 2k93 n LEU 15 CO 0.17 -0.23 0.00 0.61 -0.00 0.00 0.00 177.39 177.94 2k93 n GLY 16 N 1.15 0.78 2.73 1.47 0.00 -1.05 -5.12 105.19 105.14 2k93 n GLY 16 Ca 0.00 -0.62 -0.18 0.00 0.00 0.00 0.00 46.02 45.23 2k93 n GLY 16 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2k93 n VAL 17 N 0.00 0.00 -0.34 1.61 0.24 -0.87 -5.01 118.33 113.96 2k93 n VAL 17 Ca 0.00 -2.04 0.00 0.00 -2.04 0.00 0.00 64.34 60.26 2k93 n VAL 17 Cb 0.00 0.95 0.00 0.00 -1.47 0.00 0.00 33.84 33.32 2k93 n VAL 17 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2k93 n LYS 18 N -0.59 3.44 -0.10 7.34 4.81 -1.26 -4.81 118.16 126.98 2k93 n LYS 18 Ca 0.04 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.24 2k93 n LYS 18 Cb 0.51 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 35.45 2k93 n LYS 18 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2k93 n GLN 19 N 0.00 0.61 0.30 1.64 -0.06 -1.26 -3.67 117.38 114.93 2k93 n GLN 19 Ca 0.00 0.40 0.18 0.00 -2.00 0.00 0.00 57.00 55.57 2k93 n GLN 19 Cb 0.00 -1.64 0.92 0.00 -4.06 0.00 0.00 30.24 25.45 2k93 n GLN 19 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2k93 h GLU 20 N -0.76 0.00 0.00 3.69 5.08 -1.98 0.97 114.58 121.59 2k93 h GLU 20 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2k93 h GLU 20 Cb 1.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.81 2k93 h GLU 20 CO -0.23 0.04 -0.38 0.39 -1.00 0.00 0.00 179.01 177.84 2k93 n GLU 21 N -3.34 0.20 -2.17 2.33 4.71 -1.26 -3.72 120.64 117.38 2k93 n GLU 21 Ca -0.02 0.09 -0.14 0.00 -0.01 0.00 0.00 57.16 57.09 2k93 n GLU 21 Cb 0.18 -1.66 0.04 0.00 -1.01 0.00 0.00 31.44 28.99 2k93 n GLU 21 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2k93 n VAL 22 N -1.96 2.02 -0.94 2.62 0.31 0.23 -4.89 118.33 115.72 2k93 n VAL 22 Ca 0.05 -3.64 -0.37 0.00 -0.01 0.00 0.00 64.34 60.37 2k93 n VAL 22 Cb 0.41 -0.23 0.06 0.00 -0.91 0.00 0.00 33.84 33.16 2k93 n VAL 22 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2k93 n THR 23 N -0.66 0.00 -0.29 2.52 -2.24 -0.59 -4.78 114.28 108.24 2k93 n THR 23 Ca 0.29 -0.16 -0.06 0.00 -2.27 0.00 0.00 64.05 61.86 2k93 n THR 23 Cb 0.90 -0.12 0.06 0.00 -2.10 0.00 0.00 70.33 69.07 2k93 n THR 23 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2k93 h ASN 24 N -1.19 1.08 -1.99 3.42 7.08 -1.95 -2.90 115.58 119.12 2k93 h ASN 24 Ca -0.43 -0.16 -0.70 0.00 -3.08 0.00 0.00 56.30 51.93 2k93 h ASN 24 Cb 1.37 -0.28 -0.34 0.00 -2.08 0.00 0.00 38.32 36.99 2k93 h ASN 24 CO 0.25 0.95 0.28 -3.20 -2.08 0.00 0.00 177.43 173.62 2k93 n ASN 25 N -4.30 6.20 -4.95 6.14 2.85 -1.26 0.19 115.26 120.13 2k93 n ASN 25 Ca 0.07 -3.75 -0.23 0.00 -0.11 0.00 0.00 54.58 50.57 2k93 n ASN 25 Cb 0.17 -0.84 0.02 0.00 1.24 0.00 0.00 39.78 40.37 2k93 n ASN 25 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k93 s ALA 26 N -3.89 3.74 0.44 5.20 0.00 -1.09 -4.90 121.76 121.25 2k93 s ALA 26 Ca 0.47 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 51.40 2k93 s ALA 26 Cb 0.34 -2.17 -0.02 0.00 0.00 0.00 0.00 23.12 21.27 2k93 s ALA 26 CO -0.24 -0.47 0.08 -1.12 0.00 0.00 0.00 175.76 174.01 2k93 s SER 27 N -4.25 3.29 -0.05 0.00 0.01 -1.26 -2.35 113.70 109.09 2k93 s SER 27 Ca 0.50 -1.65 -0.01 0.00 1.31 0.00 0.00 55.95 56.11 2k93 s SER 27 Cb -0.10 0.46 -0.03 0.00 0.21 0.00 0.00 66.02 66.56 2k93 s SER 27 CO 0.39 -0.87 -0.05 0.49 0.41 0.00 0.00 173.24 173.60 2k93 n PHE 28 N -1.03 0.00 0.28 2.43 3.01 -1.24 -3.79 117.46 117.11 2k93 n PHE 28 Ca -0.11 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.49 2k93 n PHE 28 Cb 0.66 -0.18 0.32 0.00 -0.01 0.00 0.00 39.48 40.27 2k93 n PHE 28 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2k93 h VAL 29 N -0.07 0.00 0.00 -4.37 2.07 -1.85 1.87 116.25 113.89 2k93 h VAL 29 Ca -0.11 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.59 2k93 h VAL 29 Cb 1.14 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.72 2k93 h VAL 29 CO -0.04 0.00 -1.60 1.21 0.02 0.00 0.00 177.57 177.16 2k93 n GLU 30 N -3.00 0.68 -0.01 1.57 2.13 -1.26 -3.65 120.64 117.10 2k93 n GLU 30 Ca 0.03 -0.13 -0.02 0.00 0.66 0.00 0.00 57.16 57.71 2k93 n GLU 30 Cb 0.46 -1.42 -0.01 0.00 0.27 0.00 0.00 31.44 30.74 2k93 n GLU 30 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2k93 n ASP 31 N -1.97 0.50 -1.44 4.31 4.64 -1.17 -4.65 116.55 116.78 2k93 n ASP 31 Ca -0.02 0.08 -0.01 0.00 -1.38 0.00 0.00 54.79 53.46 2k93 n ASP 31 Cb 0.44 -0.37 0.21 0.00 -1.04 0.00 0.00 41.12 40.36 2k93 n ASP 31 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 2k93 n LEU 32 N -2.99 4.20 -2.06 -2.67 7.99 0.26 -4.86 117.00 116.87 2k93 n LEU 32 Ca -0.02 -2.16 -0.00 0.00 -0.01 0.00 0.00 56.01 53.82 2k93 n LEU 32 Cb 0.09 -0.64 -0.00 0.00 -0.11 0.00 0.00 43.42 42.77 2k93 n LEU 32 CO 0.04 0.57 -0.00 0.61 -1.51 0.00 0.00 177.39 177.09 2k93 n GLY 33 N 0.15 -0.35 2.00 -0.72 0.00 0.52 -3.59 105.19 103.19 2k93 n GLY 33 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2k93 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k93 n ALA 34 N -2.05 -2.10 -2.45 4.61 0.00 0.49 -4.73 120.51 114.29 2k93 n ALA 34 Ca -0.00 0.45 -0.14 0.00 0.00 0.00 0.00 53.44 53.75 2k93 n ALA 34 Cb 0.35 -1.40 -0.11 0.00 0.00 0.00 0.00 19.45 18.30 2k93 n ALA 34 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k93 s ASP 35 N -0.49 1.49 0.05 0.00 -0.00 -1.24 -4.95 116.67 111.53 2k93 s ASP 35 Ca 0.00 -0.84 -0.33 0.00 -0.00 0.00 0.00 52.55 51.38 2k93 s ASP 35 Cb 0.00 0.01 -0.19 0.00 -0.00 0.00 0.00 42.92 42.74 2k93 s ASP 35 CO 0.00 -0.27 1.48 0.28 -0.00 0.00 0.00 175.17 176.66 2k93 h SER 36 N 3.46 -0.91 -0.72 0.27 0.02 -1.97 0.23 113.55 113.94 2k93 h SER 36 Ca -0.37 0.02 0.21 0.00 -0.84 0.00 0.00 61.79 60.81 2k93 h SER 36 Cb 1.19 0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.93 2k93 h SER 36 CO 0.54 -0.60 0.52 -0.07 -1.14 0.00 0.00 176.83 176.08 2k93 h LEU 37 N -1.15 0.00 0.23 5.07 3.38 -1.96 1.49 115.31 122.37 2k93 h LEU 37 Ca -0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2k93 h LEU 37 Cb 0.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.58 2k93 h LEU 37 CO 0.18 0.00 -0.11 0.44 0.09 0.00 0.00 178.44 179.04 2k93 h ASP 38 N 0.00 -0.26 0.58 -0.43 5.19 -1.63 1.61 116.42 121.48 2k93 h ASP 38 Ca 0.34 -0.27 0.00 0.00 -0.62 0.00 0.00 57.03 56.48 2k93 h ASP 38 Cb 1.39 0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.96 2k93 h ASP 38 CO -0.00 0.23 0.00 0.41 -3.12 0.00 0.00 179.24 176.76 2k93 n THR 39 N -5.00 0.74 -0.12 0.35 -1.04 0.74 -1.52 114.28 108.43 2k93 n THR 39 Ca -0.08 0.18 -0.22 0.00 -2.04 0.00 0.00 64.05 61.89 2k93 n THR 39 Cb 0.26 -0.88 -0.12 0.00 -1.82 0.00 0.00 70.33 67.78 2k93 n THR 39 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2k93 n VAL 40 N -1.47 1.53 0.28 12.58 0.31 0.49 -4.00 118.33 128.04 2k93 n VAL 40 Ca 0.05 -0.50 0.16 0.00 -0.01 0.00 0.00 64.34 64.04 2k93 n VAL 40 Cb 0.20 -1.61 0.73 0.00 -0.91 0.00 0.00 33.84 32.25 2k93 n VAL 40 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2k93 h GLU 41 N -0.32 0.00 0.00 5.55 5.08 0.25 -0.74 114.58 124.40 2k93 h GLU 41 Ca -0.59 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 57.61 2k93 h GLU 41 Cb 1.81 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.04 2k93 h GLU 41 CO -0.17 0.06 -0.76 1.25 -1.00 0.00 0.00 179.01 178.39 2k93 h LEU 42 N 0.00 0.00 0.00 1.33 5.85 -1.45 1.41 115.31 122.45 2k93 h LEU 42 Ca -0.00 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 2k93 h LEU 42 Cb 0.45 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2k93 h LEU 42 CO 0.01 0.76 -0.93 0.58 -0.34 0.00 0.00 178.44 178.52 2k93 h VAL 43 N 0.00 0.51 0.00 1.05 2.07 -1.46 -3.11 116.25 115.32 2k93 h VAL 43 Ca -0.01 -1.85 -0.31 0.00 0.82 0.00 0.00 66.70 65.35 2k93 h VAL 43 Cb 1.37 2.08 -0.06 0.00 -1.52 0.00 0.00 31.29 33.16 2k93 h VAL 43 CO 0.10 0.29 -1.96 0.23 0.02 0.00 0.00 177.57 176.25 2k93 n MET 44 N -2.99 0.65 -0.04 1.57 2.81 -0.37 -3.13 117.12 115.62 2k93 n MET 44 Ca -0.03 0.17 -0.12 0.00 -1.81 0.00 0.00 57.70 55.91 2k93 n MET 44 Cb 0.74 -1.69 -0.07 0.00 -0.71 0.00 0.00 33.22 31.49 2k93 n MET 44 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2k93 h ALA 45 N 1.03 0.17 -0.04 3.04 0.00 0.18 0.47 119.26 124.11 2k93 h ALA 45 Ca -0.38 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.22 2k93 h ALA 45 Cb 2.07 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.81 2k93 h ALA 45 CO 0.06 -0.11 -0.45 -0.07 0.00 0.00 0.00 179.25 178.68 2k93 h LEU 46 N -0.07 0.09 -0.00 0.00 3.38 -1.72 -1.80 115.31 115.18 2k93 h LEU 46 Ca 0.03 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2k93 h LEU 46 Cb 0.42 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 2k93 h LEU 46 CO 0.01 0.53 -0.00 -0.33 0.09 0.00 0.00 178.44 178.74 2k93 h GLU 47 N 0.07 0.00 0.00 1.13 4.39 -1.45 -0.25 114.58 118.48 2k93 h GLU 47 Ca 0.00 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2k93 h GLU 47 Cb 0.82 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 2k93 h GLU 47 CO 0.06 0.54 0.00 -1.91 -1.16 0.00 0.00 179.01 176.54 2k93 n GLU 48 N -4.83 0.11 -0.01 2.33 2.13 0.16 0.20 120.64 120.73 2k93 n GLU 48 Ca -0.09 0.44 -0.01 0.00 0.66 0.00 0.00 57.16 58.17 2k93 n GLU 48 Cb 0.27 -1.75 -0.00 0.00 0.27 0.00 0.00 31.44 30.23 2k93 n GLU 48 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2k93 h GLU 49 N 0.00 0.00 0.00 5.31 4.57 -1.09 -3.44 114.58 119.94 2k93 h GLU 49 Ca 0.00 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 2k93 h GLU 49 Cb 0.20 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 28.65 2k93 h GLU 49 CO 0.00 0.00 -0.65 1.19 -1.18 0.00 0.00 179.01 178.37 2k93 n PHE 50 N -2.66 0.00 -3.18 0.92 3.72 -0.13 -4.96 117.46 111.17 2k93 n PHE 50 Ca -0.01 -0.99 -0.18 0.00 -0.05 0.00 0.00 57.45 56.22 2k93 n PHE 50 Cb 0.04 -0.19 -0.03 0.00 -0.94 0.00 0.00 39.48 38.36 2k93 n PHE 50 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2k93 n ASP 51 N -0.49 -1.24 0.07 4.37 -0.08 0.55 -4.71 116.55 115.02 2k93 n ASP 51 Ca 0.13 -0.27 -0.08 0.00 -1.51 0.00 0.00 54.79 53.05 2k93 n ASP 51 Cb 0.85 -1.14 -0.12 0.00 2.34 0.00 0.00 41.12 43.05 2k93 n ASP 51 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 2k93 h THR 52 N -0.36 1.68 -3.44 5.18 1.35 -1.72 -3.47 112.91 112.13 2k93 h THR 52 Ca -0.25 -3.35 0.00 0.00 -0.55 0.00 0.00 66.41 62.27 2k93 h THR 52 Cb 1.06 2.85 0.00 0.00 -1.73 0.00 0.00 68.15 70.33 2k93 h THR 52 CO 0.37 0.96 -0.77 -1.84 -0.25 0.00 0.00 175.52 173.99 2k93 n GLU 53 N -3.39 -3.32 -4.20 4.72 0.28 -1.26 -4.95 120.64 108.52 2k93 n GLU 53 Ca -0.01 2.57 -0.20 0.00 -0.16 0.00 0.00 57.16 59.36 2k93 n GLU 53 Cb 0.95 -3.29 -0.16 0.00 1.43 0.00 0.00 31.44 30.37 2k93 n GLU 53 CO 0.00 0.00 0.00 -1.50 -0.16 0.00 0.00 177.13 175.47 2k93 s ILE 54 N -4.93 0.56 1.12 3.84 2.07 -1.26 -4.94 121.20 117.66 2k93 s ILE 54 Ca 0.00 -0.16 -0.19 0.00 -1.41 0.00 0.00 60.65 58.89 2k93 s ILE 54 Cb 0.00 -0.57 0.27 0.00 0.13 0.00 0.00 42.46 42.29 2k93 s ILE 54 CO 0.00 0.22 1.23 -0.81 -1.91 0.00 0.00 174.94 173.67 2k93 n PRO 55 N 3.87 -2.23 0.11 3.50 -0.04 -1.26 -4.70 135.00 134.25 2k93 n PRO 55 Ca -0.24 -1.93 0.13 0.00 -0.04 0.00 0.00 63.50 61.42 2k93 n PRO 55 Cb 0.52 -1.52 0.38 0.00 -0.04 0.00 0.00 33.50 32.84 2k93 n PRO 55 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2k93 h ASP 56 N -2.25 0.00 0.00 3.54 3.58 -1.99 -2.78 116.42 116.52 2k93 h ASP 56 Ca -0.43 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.02 2k93 h ASP 56 Cb 1.23 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.28 2k93 h ASP 56 CO 0.29 0.00 -0.13 -0.08 -2.88 0.00 0.00 179.24 176.44 2k93 h GLU 57 N 0.00 0.00 0.00 0.28 4.81 -2.02 -3.33 114.58 114.32 2k93 h GLU 57 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2k93 h GLU 57 Cb 0.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.13 2k93 h GLU 57 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 179.01 179.21 2k93 h GLU 58 N -0.87 0.00 -0.59 1.92 5.08 -1.95 -0.94 114.58 117.23 2k93 h GLU 58 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2k93 h GLU 58 Cb 0.13 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 2k93 h GLU 58 CO 0.00 0.00 0.19 0.00 -1.00 0.00 0.00 179.01 178.20 2k93 h ALA 59 N 2.01 0.77 -0.55 3.43 0.00 -1.60 -1.69 119.26 121.62 2k93 h ALA 59 Ca 0.00 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.77 2k93 h ALA 59 Cb 0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 2k93 h ALA 59 CO 0.00 0.43 0.28 1.49 0.00 0.00 0.00 179.25 181.44 2k93 h GLU 60 N 0.83 0.51 0.00 0.00 4.81 -1.28 0.54 114.58 119.99 2k93 h GLU 60 Ca 0.19 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2k93 h GLU 60 Cb 0.27 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.54 2k93 h GLU 60 CO -0.01 0.34 0.00 0.36 -0.73 0.00 0.00 179.01 178.97 2k93 n LYS 61 N -4.88 0.62 -1.42 1.92 2.85 -1.02 -2.38 118.16 113.85 2k93 n LYS 61 Ca 0.06 0.02 0.01 0.00 -1.05 0.00 0.00 58.31 57.35 2k93 n LYS 61 Cb 0.16 -1.50 0.09 0.00 -0.65 0.00 0.00 35.03 33.13 2k93 n LYS 61 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 2k93 n ILE 62 N -1.09 1.19 -0.28 0.58 5.41 0.15 -4.83 119.36 120.48 2k93 n ILE 62 Ca 0.16 -2.36 -0.10 0.00 1.00 0.00 0.00 62.75 61.44 2k93 n ILE 62 Cb 0.12 0.39 0.04 0.00 -0.71 0.00 0.00 39.64 39.48 2k93 n ILE 62 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 2k93 n THR 63 N -0.33 2.17 -4.04 1.39 5.66 0.11 -4.72 114.28 114.52 2k93 n THR 63 Ca 0.15 -1.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.08 2k93 n THR 63 Cb 0.93 -1.10 -0.02 0.00 -1.55 0.00 0.00 70.33 68.58 2k93 n THR 63 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2k93 n THR 64 N 0.30 0.00 -0.02 1.09 -2.24 -1.26 -3.65 114.28 108.49 2k93 n THR 64 Ca 0.21 -0.80 -0.02 0.00 -2.27 0.00 0.00 64.05 61.18 2k93 n THR 64 Cb 0.73 0.41 -0.01 0.00 -2.10 0.00 0.00 70.33 69.37 2k93 n THR 64 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2k93 n VAL 65 N -0.21 0.46 -0.12 2.28 0.31 -0.99 -3.75 118.33 116.30 2k93 n VAL 65 Ca 0.02 0.41 0.27 0.00 -0.01 0.00 0.00 64.34 65.03 2k93 n VAL 65 Cb 0.21 -1.79 0.71 0.00 -0.91 0.00 0.00 33.84 32.06 2k93 n VAL 65 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2k93 h GLN 66 N -0.32 0.00 -0.05 5.55 5.75 0.19 1.47 115.11 127.70 2k93 h GLN 66 Ca 0.00 0.00 -0.08 0.00 -0.15 0.00 0.00 58.65 58.42 2k93 h GLN 66 Cb 0.17 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.71 2k93 h GLN 66 CO 0.00 0.00 -0.36 0.00 -2.65 0.00 0.00 178.83 175.82 2k93 h ALA 67 N 1.40 1.31 -0.10 3.38 0.00 -1.80 0.59 119.26 124.03 2k93 h ALA 67 Ca 0.38 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2k93 h ALA 67 Cb 1.72 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2k93 h ALA 67 CO -0.00 0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.74 2k93 n ALA 68 N -2.47 2.56 -0.04 0.00 0.00 0.50 -2.92 120.51 118.14 2k93 n ALA 68 Ca -0.02 -0.35 -0.03 0.00 0.00 0.00 0.00 53.44 53.04 2k93 n ALA 68 Cb 0.42 -1.17 -0.07 0.00 0.00 0.00 0.00 19.45 18.63 2k93 n ALA 68 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2k93 n ILE 69 N -0.14 0.49 0.06 0.00 -0.00 -0.30 -3.99 119.36 115.48 2k93 n ILE 69 Ca 0.15 -0.33 -0.13 0.00 -0.00 0.00 0.00 62.75 62.44 2k93 n ILE 69 Cb 0.22 -0.62 -0.04 0.00 -0.00 0.00 0.00 39.64 39.20 2k93 n ILE 69 CO 0.00 0.00 0.00 -0.78 -0.00 0.00 0.00 176.55 175.77 2k93 h ASP 70 N 0.00 0.53 0.27 4.38 1.82 -0.95 0.47 116.42 122.95 2k93 h ASP 70 Ca -0.19 -0.41 -0.23 0.00 -0.39 0.00 0.00 57.03 55.81 2k93 h ASP 70 Cb 1.36 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 41.21 2k93 h ASP 70 CO 0.01 1.20 -0.94 0.22 -1.61 0.00 0.00 179.24 178.12 2k93 h TYR 71 N 0.24 0.68 -0.01 0.28 3.20 -1.77 -3.21 116.97 116.37 2k93 h TYR 71 Ca -0.07 -0.36 -0.20 0.00 3.14 0.00 0.00 58.73 61.23 2k93 h TYR 71 Cb 1.54 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 39.72 2k93 h TYR 71 CO 0.06 1.18 -0.86 0.82 -1.64 0.00 0.00 178.16 177.71 2k93 h ILE 72 N 0.26 1.43 -0.83 1.81 1.08 -1.69 -3.01 117.51 116.58 2k93 h ILE 72 Ca -0.08 -2.44 0.24 0.00 -0.39 0.00 0.00 64.86 62.18 2k93 h ILE 72 Cb 1.57 2.37 -0.03 0.00 -3.07 0.00 0.00 36.82 37.66 2k93 h ILE 72 CO 0.17 0.72 0.70 -1.13 -0.69 0.00 0.00 178.15 177.92 2k93 h ASN 73 N 0.18 0.00 0.00 1.72 -0.73 -0.90 0.73 115.58 116.58 2k93 h ASN 73 Ca -0.05 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.12 2k93 h ASN 73 Cb 1.48 0.00 0.00 0.00 0.27 0.00 0.00 38.32 40.07 2k93 h ASN 73 CO 0.14 0.00 0.25 1.23 -0.37 0.00 0.00 177.43 178.68 2k93 h GLY 74 N 0.00 0.00 1.29 1.57 0.00 -1.61 0.14 103.07 104.45 2k93 h GLY 74 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 2k93 h GLY 74 CO -0.00 0.00 0.46 0.84 0.00 0.00 0.00 176.54 177.83 2k93 h HIS 75 N 0.00 0.92 -2.25 5.60 -0.00 0.25 -3.32 115.15 116.35 2k93 h HIS 75 Ca 0.00 0.01 -0.57 0.00 -0.00 0.00 0.00 60.37 59.81 2k93 h HIS 75 Cb 0.49 -0.31 -0.37 0.00 -0.00 0.00 0.00 27.41 27.22 2k93 h HIS 75 CO 0.00 0.59 -0.98 0.00 -0.00 0.00 0.00 177.93 177.54 2k93 n GLN 76 N -4.41 0.27 0.00 5.26 -0.00 0.47 -5.21 117.38 113.76 2k93 n GLN 76 Ca 0.08 -3.13 0.00 0.00 -0.00 0.00 0.00 57.00 53.94 2k93 n GLN 76 Cb 0.05 -1.60 0.00 0.00 -0.00 0.00 0.00 30.24 28.69 2k93 n GLN 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06