#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 1.37 0.00 2.46 -4.23 -1.26 -5.04 115.64 108.94 2k93 s THR 2 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2k93 s THR 2 Cb 0.00 -2.77 0.00 0.00 1.34 0.00 0.00 72.50 71.07 2k93 s THR 2 CO 0.00 0.00 0.49 -0.38 -0.54 0.00 0.00 174.62 174.19 2k93 n ILE 3 N -0.83 0.00 -0.34 2.99 2.08 -1.26 -2.20 119.36 119.79 2k93 n ILE 3 Ca -0.05 0.98 0.28 0.00 0.56 0.00 0.00 62.75 64.52 2k93 n ILE 3 Cb 0.67 -1.95 0.53 0.00 -0.75 0.00 0.00 39.64 38.13 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 0.21 0.00 0.38 4.81 -1.94 -1.72 114.58 116.33 2k93 h GLU 4 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2k93 h GLU 4 Cb 0.00 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.33 2k93 h GLU 4 CO 0.00 0.14 0.00 -1.91 -0.73 0.00 0.00 179.01 176.51 2k93 n GLU 5 N -5.04 0.00 -0.35 1.92 2.13 -1.18 -0.89 120.64 117.23 2k93 n GLU 5 Ca 0.34 0.71 0.02 0.00 0.66 0.00 0.00 57.16 58.89 2k93 n GLU 5 Cb 1.11 -1.34 0.08 0.00 0.27 0.00 0.00 31.44 31.56 2k93 n GLU 5 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2k93 n ARG 6 N -2.14 -0.15 -0.16 5.31 1.74 -0.66 0.57 116.66 121.16 2k93 n ARG 6 Ca 0.00 1.43 -0.10 0.00 -0.77 0.00 0.00 57.85 58.41 2k93 n ARG 6 Cb 0.00 -2.13 -0.06 0.00 -1.02 0.00 0.00 32.46 29.25 2k93 n ARG 6 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2k93 h VAL 7 N 0.00 0.07 -0.58 1.55 2.07 -1.13 0.27 116.25 118.50 2k93 h VAL 7 Ca 0.38 0.00 0.12 0.00 0.82 0.00 0.00 66.70 68.02 2k93 h VAL 7 Cb 0.61 0.07 -0.10 0.00 -1.52 0.00 0.00 31.29 30.35 2k93 h VAL 7 CO -0.94 0.00 -0.06 0.11 0.02 0.00 0.00 177.57 176.71 2k93 h LYS 8 N -0.31 0.06 0.08 1.57 1.79 0.21 1.48 116.57 121.46 2k93 h LYS 8 Ca 0.14 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.61 2k93 h LYS 8 Cb 0.58 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 2k93 h LYS 8 CO -0.63 0.04 -0.34 -0.22 -1.08 0.00 0.00 179.45 177.23 2k93 h LYS 9 N 0.07 -0.47 0.01 3.15 3.11 0.69 1.33 116.57 124.46 2k93 h LYS 9 Ca 0.29 0.03 0.03 0.00 -2.81 0.00 0.00 60.65 58.19 2k93 h LYS 9 Cb 0.46 0.11 -0.04 0.00 -1.00 0.00 0.00 32.23 31.76 2k93 h LYS 9 CO -0.54 -0.31 -0.22 0.82 -2.81 0.00 0.00 179.45 176.39 2k93 h ILE 10 N -0.49 0.49 -0.71 2.00 1.08 0.11 -1.19 117.51 118.81 2k93 h ILE 10 Ca -0.01 0.00 0.16 0.00 -0.39 0.00 0.00 64.86 64.62 2k93 h ILE 10 Cb 0.49 0.49 -0.12 0.00 -3.07 0.00 0.00 36.82 34.61 2k93 h ILE 10 CO -0.18 0.00 0.05 0.40 -0.69 0.00 0.00 178.15 177.73 2k93 h ILE 11 N -0.35 0.43 -0.67 -0.67 1.08 0.25 0.77 117.51 118.34 2k93 h ILE 11 Ca 0.06 -0.05 0.08 0.00 -0.39 0.00 0.00 64.86 64.56 2k93 h ILE 11 Cb 0.43 0.27 -0.04 0.00 -3.07 0.00 0.00 36.82 34.40 2k93 h ILE 11 CO -0.19 0.03 0.44 1.23 -0.69 0.00 0.00 178.15 178.97 2k93 h GLY 12 N 0.15 0.81 0.75 5.37 0.00 0.29 -1.92 103.07 108.52 2k93 h GLY 12 Ca 0.39 -0.25 -0.12 0.00 0.00 0.00 0.00 47.33 47.35 2k93 h GLY 12 CO -0.58 0.17 -0.41 -1.61 0.00 0.00 0.00 176.54 174.10 2k93 h GLN 13 N 0.61 0.40 -0.88 4.80 4.15 0.15 0.23 115.11 124.57 2k93 h GLN 13 Ca 0.30 -0.34 0.26 0.00 0.77 0.00 0.00 58.65 59.64 2k93 h GLN 13 Cb 0.37 0.07 -0.16 0.00 0.21 0.00 0.00 27.48 27.98 2k93 h GLN 13 CO -0.10 0.98 0.08 1.04 -1.93 0.00 0.00 178.83 178.90 2k93 n GLN 14 N -4.34 -0.07 0.00 1.69 6.02 0.97 -4.13 117.38 117.52 2k93 n GLN 14 Ca -0.08 1.30 0.00 0.00 -0.01 0.00 0.00 57.00 58.21 2k93 n GLN 14 Cb 0.55 -2.10 0.00 0.00 1.02 0.00 0.00 30.24 29.71 2k93 n GLN 14 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2k93 n LEU 15 N -5.24 0.00 0.00 1.08 4.77 -1.18 -4.78 117.00 111.64 2k93 n LEU 15 Ca 0.22 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2k93 n LEU 15 Cb 0.74 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.83 2k93 n LEU 15 CO -0.06 -0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.46 2k93 n GLY 16 N 3.64 0.00 3.58 -0.72 0.00 0.81 -5.06 105.19 107.43 2k93 n GLY 16 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2k93 n GLY 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2k93 n VAL 17 N 0.00 0.00 -0.40 1.61 0.31 -1.21 -5.05 118.33 113.59 2k93 n VAL 17 Ca 0.00 -1.53 0.00 0.00 -0.01 0.00 0.00 64.34 62.80 2k93 n VAL 17 Cb 0.00 -0.84 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 2k93 n VAL 17 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2k93 n LYS 18 N -2.57 3.53 -0.00 5.55 3.00 -1.26 -4.79 118.16 121.62 2k93 n LYS 18 Ca 0.15 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.49 2k93 n LYS 18 Cb 0.55 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 35.53 2k93 n LYS 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k93 n GLN 19 N 0.00 2.15 -0.04 1.64 10.64 -1.26 -4.32 117.38 126.20 2k93 n GLN 19 Ca 0.00 -0.03 -0.04 0.00 -1.83 0.00 0.00 57.00 55.10 2k93 n GLN 19 Cb 0.00 -1.00 -0.14 0.00 -0.86 0.00 0.00 30.24 28.25 2k93 n GLN 19 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 2k93 n GLU 20 N -1.48 0.66 0.06 2.61 2.13 -1.26 -2.87 120.64 120.48 2k93 n GLU 20 Ca -0.00 0.09 0.13 0.00 0.66 0.00 0.00 57.16 58.03 2k93 n GLU 20 Cb 0.13 -1.65 0.39 0.00 0.27 0.00 0.00 31.44 30.58 2k93 n GLU 20 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2k93 n GLU 21 N -2.78 0.18 -2.70 5.31 4.71 -1.26 -3.79 120.64 120.31 2k93 n GLU 21 Ca -0.19 0.11 -0.07 0.00 -0.01 0.00 0.00 57.16 57.00 2k93 n GLU 21 Cb 0.97 -1.67 0.04 0.00 -1.01 0.00 0.00 31.44 29.76 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 1.24 -0.49 2.62 0.31 -1.26 -4.93 118.33 113.85 2k93 n VAL 22 Ca 0.05 -3.15 -0.13 0.00 -0.01 0.00 0.00 64.34 61.10 2k93 n VAL 22 Cb 0.40 0.75 0.13 0.00 -0.91 0.00 0.00 33.84 34.20 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 -0.32 0.00 -1.09 2.52 -2.24 -1.14 -4.70 114.28 107.31 2k93 n THR 23 Ca 0.11 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.74 2k93 n THR 23 Cb 0.81 -0.43 -0.13 0.00 -2.10 0.00 0.00 70.33 68.48 2k93 n THR 23 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2k93 n ASN 24 N -0.99 5.55 0.00 3.42 6.94 -1.26 -3.04 115.26 125.89 2k93 n ASN 24 Ca 0.06 -2.66 0.00 0.00 -0.02 0.00 0.00 54.58 51.96 2k93 n ASN 24 Cb 0.26 -1.36 0.00 0.00 -2.36 0.00 0.00 39.78 36.32 2k93 n ASN 24 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2k93 n ASN 25 N 2.04 0.00 -4.86 0.53 5.15 -1.26 -4.40 115.26 112.47 2k93 n ASN 25 Ca 0.42 0.00 -0.23 0.00 -0.60 0.00 0.00 54.58 54.18 2k93 n ASN 25 Cb 0.81 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 40.02 2k93 n ASN 25 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k93 s ALA 26 N 0.00 3.67 0.63 5.20 0.00 -1.17 -4.96 121.76 125.13 2k93 s ALA 26 Ca 0.00 -1.33 -0.01 0.00 0.00 0.00 0.00 51.96 50.61 2k93 s ALA 26 Cb 0.00 -1.42 0.06 0.00 0.00 0.00 0.00 23.12 21.76 2k93 s ALA 26 CO 0.00 0.30 0.39 0.43 0.00 0.00 0.00 175.76 176.88 2k93 n SER 27 N -1.07 0.38 0.00 0.00 7.64 -1.26 -2.27 113.62 117.04 2k93 n SER 27 Ca -0.08 -1.35 0.00 0.00 1.01 0.00 0.00 58.87 58.45 2k93 n SER 27 Cb 0.57 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 2k93 n SER 27 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2k93 n PHE 28 N -2.09 0.00 -0.14 1.43 3.01 -1.26 -3.84 117.46 114.56 2k93 n PHE 28 Ca 0.06 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.48 2k93 n PHE 28 Cb 0.21 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.65 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 0.00 0.00 0.02 -4.37 2.07 -1.90 1.81 116.25 113.88 2k93 h VAL 29 Ca 0.00 0.00 -0.40 0.00 0.82 0.00 0.00 66.70 67.12 2k93 h VAL 29 Cb 0.56 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 2k93 h VAL 29 CO 0.00 0.00 -2.39 -0.62 0.02 0.00 0.00 177.57 174.58 2k93 n GLU 30 N -3.76 0.65 -0.15 1.57 1.02 -1.26 -0.24 120.64 118.47 2k93 n GLU 30 Ca 0.01 0.20 -0.04 0.00 -0.02 0.00 0.00 57.16 57.31 2k93 n GLU 30 Cb 0.09 -1.55 0.02 0.00 -0.02 0.00 0.00 31.44 29.98 2k93 n GLU 30 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2k93 h ASP 31 N -0.24 -0.69 -0.31 1.62 3.32 -1.75 -0.64 116.42 117.73 2k93 h ASP 31 Ca -0.58 0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2k93 h ASP 31 Cb 1.84 0.39 0.00 0.00 0.22 0.00 0.00 39.33 41.77 2k93 h ASP 31 CO -0.14 -0.23 0.00 0.18 -1.72 0.00 0.00 179.24 177.33 2k93 n LEU 32 N -5.39 3.93 -1.18 1.55 4.77 0.57 -4.92 117.00 116.33 2k93 n LEU 32 Ca 0.04 -2.86 -0.09 0.00 -0.03 0.00 0.00 56.01 53.06 2k93 n LEU 32 Cb 0.30 -0.52 -0.04 0.00 -2.33 0.00 0.00 43.42 40.84 2k93 n LEU 32 CO 0.09 0.68 -0.09 0.61 -1.33 0.00 0.00 177.39 177.35 2k93 n GLY 33 N -0.24 0.85 2.96 -0.72 0.00 0.73 -3.03 105.19 105.74 2k93 n GLY 33 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 0.14 -2.00 -2.89 4.61 0.00 0.58 -4.84 120.51 116.12 2k93 n ALA 34 Ca -0.09 0.24 -0.24 0.00 0.00 0.00 0.00 53.44 53.35 2k93 n ALA 34 Cb 0.31 -1.69 -0.02 0.00 0.00 0.00 0.00 19.45 18.05 2k93 n ALA 34 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2k93 s ASP 35 N -1.17 6.34 0.03 0.00 -1.08 -1.17 -4.98 116.67 114.64 2k93 s ASP 35 Ca 0.29 0.21 -0.25 0.00 -0.52 0.00 0.00 52.55 52.28 2k93 s ASP 35 Cb -0.03 -1.92 -0.17 0.00 -1.46 0.00 0.00 42.92 39.33 2k93 s ASP 35 CO 0.68 -0.06 1.44 0.28 0.52 0.00 0.00 175.17 178.03 2k93 h SER 36 N 1.56 -0.16 -0.58 -0.34 0.02 -1.95 -2.20 113.55 109.90 2k93 h SER 36 Ca -0.50 -0.20 0.17 0.00 -0.84 0.00 0.00 61.79 60.42 2k93 h SER 36 Cb 1.21 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.77 2k93 h SER 36 CO 0.65 0.11 0.51 0.17 -1.14 0.00 0.00 176.83 177.12 2k93 h LEU 37 N -0.44 0.00 0.46 5.07 -0.00 -1.95 0.24 115.31 118.68 2k93 h LEU 37 Ca -0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.84 2k93 h LEU 37 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.02 2k93 h LEU 37 CO 0.03 0.00 -0.22 -0.78 -0.00 0.00 0.00 178.44 177.47 2k93 h ASP 38 N 0.00 -0.52 -0.55 0.17 1.82 -1.72 1.50 116.42 117.12 2k93 h ASP 38 Ca 0.28 -0.08 0.05 0.00 -0.39 0.00 0.00 57.03 56.89 2k93 h ASP 38 Cb 1.29 0.13 -0.03 0.00 0.68 0.00 0.00 39.33 41.40 2k93 h ASP 38 CO -0.00 -0.12 0.36 0.74 -1.61 0.00 0.00 179.24 178.62 2k93 h THR 39 N -1.04 1.01 0.06 2.25 2.02 -0.58 0.10 112.91 116.73 2k93 h THR 39 Ca -0.06 -0.19 -0.20 0.00 0.77 0.00 0.00 66.41 66.73 2k93 h THR 39 Cb 0.57 0.42 0.02 0.00 -1.74 0.00 0.00 68.15 67.41 2k93 h THR 39 CO 0.10 0.10 -0.83 0.58 0.37 0.00 0.00 175.52 175.84 2k93 h VAL 40 N 0.54 1.40 0.00 3.16 2.07 -0.56 -3.06 116.25 119.81 2k93 h VAL 40 Ca 0.23 -2.28 -0.00 0.00 0.82 0.00 0.00 66.70 65.47 2k93 h VAL 40 Cb 0.24 2.74 -0.00 0.00 -1.52 0.00 0.00 31.29 32.74 2k93 h VAL 40 CO -0.06 0.67 -0.02 -0.33 0.02 0.00 0.00 177.57 177.85 2k93 h GLU 41 N -0.04 0.00 0.00 1.57 4.39 0.30 0.17 114.58 120.97 2k93 h GLU 41 Ca -0.12 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.42 2k93 h GLU 41 Cb 1.55 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.18 2k93 h GLU 41 CO 0.16 0.02 -0.78 1.25 -1.16 0.00 0.00 179.01 178.50 2k93 h LEU 42 N 0.00 0.00 0.00 1.33 5.85 -0.79 1.43 115.31 123.13 2k93 h LEU 42 Ca -0.00 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 2k93 h LEU 42 Cb 0.06 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2k93 h LEU 42 CO 0.00 0.78 -0.76 0.58 -0.34 0.00 0.00 178.44 178.70 2k93 h VAL 43 N 0.00 0.74 0.06 1.05 2.07 -0.68 -3.04 116.25 116.44 2k93 h VAL 43 Ca -0.01 -2.12 -0.36 0.00 0.82 0.00 0.00 66.70 65.03 2k93 h VAL 43 Cb 1.44 2.29 -0.04 0.00 -1.52 0.00 0.00 31.29 33.46 2k93 h VAL 43 CO 0.10 0.42 -2.15 0.23 0.02 0.00 0.00 177.57 176.19 2k93 n MET 44 N -3.12 0.70 0.24 1.57 2.81 0.14 -3.28 117.12 116.19 2k93 n MET 44 Ca -0.01 0.20 -0.15 0.00 -1.81 0.00 0.00 57.70 55.93 2k93 n MET 44 Cb 0.76 -1.64 -0.08 0.00 -0.71 0.00 0.00 33.22 31.55 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 0.27 -0.58 0.00 3.04 0.00 0.19 0.99 119.26 123.16 2k93 h ALA 45 Ca -0.47 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 2k93 h ALA 45 Cb 2.01 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 20.06 2k93 h ALA 45 CO 0.02 -0.83 -0.16 -0.07 0.00 0.00 0.00 179.25 178.21 2k93 h LEU 46 N -0.58 0.00 -0.12 0.00 3.38 -1.71 0.21 115.31 116.48 2k93 h LEU 46 Ca -0.05 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.76 2k93 h LEU 46 Cb 0.47 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.22 2k93 h LEU 46 CO 0.06 0.16 -0.56 -0.33 0.09 0.00 0.00 178.44 177.87 2k93 h GLU 47 N 0.00 0.58 0.00 1.13 4.39 -1.29 -0.75 114.58 118.65 2k93 h GLU 47 Ca -0.00 -0.47 0.00 0.00 0.34 0.00 0.00 59.36 59.23 2k93 h GLU 47 Cb 0.35 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2k93 h GLU 47 CO 0.02 1.10 0.00 -1.91 -1.16 0.00 0.00 179.01 177.06 2k93 n GLU 48 N -4.17 0.21 -0.01 2.33 0.00 0.33 -0.54 120.64 118.80 2k93 n GLU 48 Ca -0.08 0.21 -0.00 0.00 0.00 0.00 0.00 57.16 57.29 2k93 n GLU 48 Cb 0.63 -1.77 -0.00 0.00 0.00 0.00 0.00 31.44 30.30 2k93 n GLU 48 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2k93 h GLU 49 N 0.00 0.00 -0.14 5.31 4.57 -0.49 -3.44 114.58 120.39 2k93 h GLU 49 Ca 0.00 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 58.00 2k93 h GLU 49 Cb 0.64 0.00 -0.30 0.00 -0.16 0.00 0.00 28.75 28.93 2k93 h GLU 49 CO 0.00 0.00 -0.91 1.19 -1.18 0.00 0.00 179.01 178.11 2k93 n PHE 50 N -2.59 0.44 -4.27 0.92 3.72 -0.38 -4.99 117.46 110.32 2k93 n PHE 50 Ca -0.01 -1.16 -0.35 0.00 -0.05 0.00 0.00 57.45 55.89 2k93 n PHE 50 Cb 0.02 -0.20 -0.07 0.00 -0.94 0.00 0.00 39.48 38.29 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 -0.17 -0.18 0.04 4.37 2.03 0.30 -4.81 116.55 118.13 2k93 n ASP 51 Ca 0.12 -1.29 0.05 0.00 0.52 0.00 0.00 54.79 54.19 2k93 n ASP 51 Cb 0.97 -1.58 -0.07 0.00 -0.72 0.00 0.00 41.12 39.71 2k93 n ASP 51 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2k93 n THR 52 N -4.70 0.85 -3.17 5.18 -1.04 -0.62 -4.89 114.28 105.88 2k93 n THR 52 Ca -0.28 -0.63 -0.00 0.00 -2.04 0.00 0.00 64.05 61.10 2k93 n THR 52 Cb 0.67 -0.48 -0.00 0.00 -1.82 0.00 0.00 70.33 68.69 2k93 n THR 52 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2k93 n GLU 53 N -2.72 -0.42 -2.62 -2.82 0.28 -1.26 -4.86 120.64 106.23 2k93 n GLU 53 Ca -0.07 0.86 -0.40 0.00 -0.16 0.00 0.00 57.16 57.38 2k93 n GLU 53 Cb 0.73 -1.13 -0.05 0.00 1.43 0.00 0.00 31.44 32.42 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 -0.98 3.89 0.00 3.84 2.07 -1.26 -5.00 121.20 123.75 2k93 s ILE 54 Ca -0.00 1.81 0.00 0.00 -1.41 0.00 0.00 60.65 61.05 2k93 s ILE 54 Cb 0.00 -4.16 0.00 0.00 0.13 0.00 0.00 42.46 38.43 2k93 s ILE 54 CO 0.03 0.40 0.00 -0.81 -1.91 0.00 0.00 174.94 172.65 2k93 n PRO 55 N 1.67 -0.09 -0.00 3.50 -0.04 -1.26 -4.47 135.00 134.31 2k93 n PRO 55 Ca -0.01 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.54 2k93 n PRO 55 Cb 0.46 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.81 2k93 n PRO 55 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2k93 n ASP 56 N -2.18 0.95 -0.05 3.54 4.64 -1.26 -3.75 116.55 118.44 2k93 n ASP 56 Ca 0.00 -0.47 -0.01 0.00 -1.38 0.00 0.00 54.79 52.92 2k93 n ASP 56 Cb 0.00 1.36 -0.00 0.00 -1.04 0.00 0.00 41.12 41.43 2k93 n ASP 56 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 2k93 h GLU 57 N 0.00 0.00 0.00 -0.67 3.07 -2.00 -3.18 114.58 111.80 2k93 h GLU 57 Ca 0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 2k93 h GLU 57 Cb 0.56 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.47 2k93 h GLU 57 CO 0.00 0.00 -0.11 0.93 -1.40 0.00 0.00 179.01 178.43 2k93 h GLU 58 N -0.90 0.00 -0.47 2.33 3.07 -1.97 -2.26 114.58 114.38 2k93 h GLU 58 Ca 0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 2k93 h GLU 58 Cb 0.12 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.01 2k93 h GLU 58 CO 0.00 0.11 0.08 0.00 -1.40 0.00 0.00 179.01 177.80 2k93 h ALA 59 N 1.89 0.62 -0.75 3.43 0.00 -1.70 0.33 119.26 123.08 2k93 h ALA 59 Ca -0.00 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.69 2k93 h ALA 59 Cb 0.36 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2k93 h ALA 59 CO 0.01 0.34 0.49 0.93 0.00 0.00 0.00 179.25 181.03 2k93 h GLU 60 N 0.64 0.98 -0.17 0.00 5.08 -1.38 0.67 114.58 120.39 2k93 h GLU 60 Ca 0.14 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2k93 h GLU 60 Cb 0.38 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2k93 h GLU 60 CO 0.01 0.65 0.00 1.17 -1.00 0.00 0.00 179.01 179.83 2k93 n LYS 61 N -4.57 1.46 -0.43 2.33 4.81 -1.06 -3.06 118.16 117.64 2k93 n LYS 61 Ca 0.07 -0.71 0.03 0.00 -0.87 0.00 0.00 58.31 56.83 2k93 n LYS 61 Cb 0.02 -1.22 0.04 0.00 0.02 0.00 0.00 35.03 33.90 2k93 n LYS 61 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2k93 n ILE 62 N 0.03 0.49 0.09 3.15 5.41 0.38 -4.89 119.36 124.01 2k93 n ILE 62 Ca 0.09 -0.62 -0.15 0.00 1.00 0.00 0.00 62.75 63.07 2k93 n ILE 62 Cb 0.19 0.33 -0.09 0.00 -0.71 0.00 0.00 39.64 39.35 2k93 n ILE 62 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 2k93 h THR 63 N 5.22 0.00 -1.81 1.39 1.35 0.27 -3.37 112.91 115.96 2k93 h THR 63 Ca -0.01 0.00 -0.51 0.00 -0.55 0.00 0.00 66.41 65.34 2k93 h THR 63 Cb 1.31 0.00 0.20 0.00 -1.73 0.00 0.00 68.15 67.94 2k93 h THR 63 CO 0.00 0.00 -1.51 0.35 -0.25 0.00 0.00 175.52 174.11 2k93 n THR 64 N -5.23 0.00 0.07 6.82 -2.24 -1.26 -4.74 114.28 107.70 2k93 n THR 64 Ca -0.08 -0.45 -0.10 0.00 -2.27 0.00 0.00 64.05 61.15 2k93 n THR 64 Cb 0.38 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 2k93 n THR 64 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2k93 h VAL 65 N -0.65 1.41 -0.37 2.28 2.07 -1.73 -3.11 116.25 116.15 2k93 h VAL 65 Ca -0.39 -2.34 -0.09 0.00 0.82 0.00 0.00 66.70 64.69 2k93 h VAL 65 Cb 1.22 2.29 -0.02 0.00 -1.52 0.00 0.00 31.29 33.26 2k93 h VAL 65 CO 0.26 0.70 -0.15 -0.61 0.02 0.00 0.00 177.57 177.78 2k93 h GLN 66 N 0.22 0.68 0.00 1.57 5.75 -1.81 -1.33 115.11 120.20 2k93 h GLN 66 Ca -0.05 -0.23 0.00 0.00 -0.15 0.00 0.00 58.65 58.22 2k93 h GLN 66 Cb 1.43 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.93 2k93 h GLN 66 CO 0.14 0.80 0.00 0.00 -2.65 0.00 0.00 178.83 177.12 2k93 n ALA 67 N -2.49 1.49 1.28 3.38 0.00 -1.18 -0.43 120.51 122.57 2k93 n ALA 67 Ca 0.01 0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.65 2k93 n ALA 67 Cb 0.37 -1.31 0.35 0.00 0.00 0.00 0.00 19.45 18.87 2k93 n ALA 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k93 n ALA 68 N -1.70 2.53 -0.10 0.00 0.00 -0.51 -3.69 120.51 117.04 2k93 n ALA 68 Ca 0.02 -0.55 -0.14 0.00 0.00 0.00 0.00 53.44 52.77 2k93 n ALA 68 Cb 0.16 -1.02 -0.11 0.00 0.00 0.00 0.00 19.45 18.48 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 0.65 1.21 -0.25 0.00 2.08 0.43 -3.62 119.36 119.86 2k93 n ILE 69 Ca 0.17 -0.52 -0.04 0.00 0.56 0.00 0.00 62.75 62.92 2k93 n ILE 69 Cb 0.45 -1.12 0.11 0.00 -0.75 0.00 0.00 39.64 38.33 2k93 n ILE 69 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 2k93 h ASP 70 N 0.00 1.01 0.91 4.38 5.19 -1.58 1.70 116.42 128.03 2k93 h ASP 70 Ca -0.47 -0.15 -0.15 0.00 -0.62 0.00 0.00 57.03 55.64 2k93 h ASP 70 Cb 1.80 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 41.02 2k93 h ASP 70 CO -0.05 0.90 -0.72 0.22 -3.12 0.00 0.00 179.24 176.47 2k93 h TYR 71 N 1.08 0.00 0.08 4.55 3.20 -1.77 -3.18 116.97 120.92 2k93 h TYR 71 Ca 0.25 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.85 2k93 h TYR 71 Cb 0.20 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 2k93 h TYR 71 CO 0.02 0.72 -1.36 0.82 -1.64 0.00 0.00 178.16 176.71 2k93 h ILE 72 N 0.00 1.33 0.00 1.81 1.08 -1.46 -3.19 117.51 117.08 2k93 h ILE 72 Ca -0.01 -2.99 0.00 0.00 -0.39 0.00 0.00 64.86 61.47 2k93 h ILE 72 Cb 1.37 2.78 0.00 0.00 -3.07 0.00 0.00 36.82 37.90 2k93 h ILE 72 CO 0.09 0.83 0.02 0.78 -0.69 0.00 0.00 178.15 179.19 2k93 h ASN 73 N 0.05 0.00 1.00 1.72 2.35 0.25 0.58 115.58 121.53 2k93 h ASN 73 Ca -0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2k93 h ASN 73 Cb 1.95 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.32 2k93 h ASN 73 CO 0.15 0.00 -0.23 0.61 -1.65 0.00 0.00 177.43 176.32 2k93 n GLY 74 N -1.23 -1.49 0.14 2.83 0.00 -1.20 -3.85 105.19 100.39 2k93 n GLY 74 Ca -0.02 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 2k93 n GLY 74 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 2k93 h HIS 75 N 0.00 -0.22 -2.54 1.61 2.07 0.03 -3.45 115.15 112.65 2k93 h HIS 75 Ca 0.00 -0.01 -0.23 0.00 -2.85 0.00 0.00 60.37 57.28 2k93 h HIS 75 Cb 0.61 0.07 0.12 0.00 2.57 0.00 0.00 27.41 30.78 2k93 h HIS 75 CO 0.00 0.21 0.05 0.00 -3.07 0.00 0.00 177.93 175.12 2k93 n GLN 76 N -4.96 -2.45 0.00 5.12 10.64 -1.24 -5.17 117.38 119.32 2k93 n GLN 76 Ca -0.08 -1.01 0.00 0.00 -1.83 0.00 0.00 57.00 54.08 2k93 n GLN 76 Cb 0.26 -0.98 0.00 0.00 -0.86 0.00 0.00 30.24 28.66 2k93 n GLN 76 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23