#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 2.55 0.00 6.66 -4.23 -1.26 -5.02 115.64 114.34 2k93 s THR 2 Ca 0.00 -1.42 0.00 0.00 -1.18 0.00 0.00 61.69 59.09 2k93 s THR 2 Cb 0.00 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.87 2k93 s THR 2 CO 0.00 0.00 0.89 -0.38 -0.54 0.00 0.00 174.62 174.59 2k93 n ILE 3 N -1.49 0.00 -0.35 2.99 2.08 -1.26 -1.78 119.36 119.55 2k93 n ILE 3 Ca 0.02 1.39 0.05 0.00 0.56 0.00 0.00 62.75 64.78 2k93 n ILE 3 Cb 0.62 -2.24 0.13 0.00 -0.75 0.00 0.00 39.64 37.40 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 -0.00 -0.86 0.38 4.22 -1.93 1.00 114.58 117.39 2k93 h GLU 4 Ca 0.00 0.00 0.22 0.00 0.08 0.00 0.00 59.36 59.66 2k93 h GLU 4 Cb 0.00 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.10 2k93 h GLU 4 CO 0.00 -0.00 0.07 1.49 -2.18 0.00 0.00 179.01 178.39 2k93 h GLU 5 N -0.00 0.10 -0.07 1.92 4.81 -1.89 0.52 114.58 119.97 2k93 h GLU 5 Ca 0.46 -0.01 -0.23 0.00 -0.13 0.00 0.00 59.36 59.46 2k93 h GLU 5 Cb 0.71 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.07 2k93 h GLU 5 CO -1.00 0.07 -0.87 0.00 -0.73 0.00 0.00 179.01 176.47 2k93 h ARG 6 N 0.10 0.63 0.34 1.92 3.08 0.17 -2.95 114.38 117.67 2k93 h ARG 6 Ca 0.50 -0.59 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 2k93 h ARG 6 Cb 0.97 0.14 -0.03 0.00 0.08 0.00 0.00 29.97 31.13 2k93 h ARG 6 CO -0.74 1.20 -0.52 0.28 -1.07 0.00 0.00 179.97 179.12 2k93 h VAL 7 N 0.40 0.00 -0.43 2.04 2.07 0.29 0.23 116.25 120.85 2k93 h VAL 7 Ca -0.07 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.53 2k93 h VAL 7 Cb 1.50 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 31.18 2k93 h VAL 7 CO 0.17 0.00 -0.25 0.11 0.02 0.00 0.00 177.57 177.61 2k93 h LYS 8 N -0.90 -0.17 -0.08 1.57 6.56 -0.58 0.21 116.57 123.18 2k93 h LYS 8 Ca -0.04 0.01 0.02 0.00 -1.06 0.00 0.00 60.65 59.58 2k93 h LYS 8 Cb 0.83 0.04 -0.04 0.00 -0.57 0.00 0.00 32.23 32.49 2k93 h LYS 8 CO -0.16 -0.11 -0.33 -0.22 -2.06 0.00 0.00 179.45 176.57 2k93 h LYS 9 N -0.17 -0.33 -0.59 3.15 1.63 -1.23 0.90 116.57 119.92 2k93 h LYS 9 Ca 0.20 0.02 0.08 0.00 -0.85 0.00 0.00 60.65 60.11 2k93 h LYS 9 Cb 0.49 0.08 -0.11 0.00 -0.60 0.00 0.00 32.23 32.09 2k93 h LYS 9 CO -0.53 -0.22 -0.46 0.82 -3.45 0.00 0.00 179.45 175.61 2k93 h ILE 10 N -0.35 0.07 -0.87 2.00 1.08 0.22 1.20 117.51 120.86 2k93 h ILE 10 Ca 0.02 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 64.68 2k93 h ILE 10 Cb 0.41 0.07 -0.06 0.00 -3.07 0.00 0.00 36.82 34.16 2k93 h ILE 10 CO -0.26 0.00 0.58 0.40 -0.69 0.00 0.00 178.15 178.17 2k93 h ILE 11 N -0.23 0.71 0.00 -0.67 2.04 0.22 1.48 117.51 121.06 2k93 h ILE 11 Ca 0.17 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.88 2k93 h ILE 11 Cb 0.56 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2k93 h ILE 11 CO -0.70 0.08 0.00 0.61 0.00 0.00 0.00 178.15 178.14 2k93 n GLY 12 N -1.51 -0.96 0.06 5.37 0.00 0.40 -2.60 105.19 105.96 2k93 n GLY 12 Ca 0.18 -0.06 -0.07 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.42 1.71 -0.49 1.61 1.13 0.47 -2.41 117.38 117.98 2k93 n GLN 13 Ca 0.05 0.01 0.41 0.00 -1.94 0.00 0.00 57.00 55.54 2k93 n GLN 13 Cb 0.16 -1.30 0.74 0.00 0.11 0.00 0.00 30.24 29.94 2k93 n GLN 13 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 2k93 h GLN 14 N 0.00 0.05 0.00 -1.09 4.20 -0.26 -3.23 115.11 114.78 2k93 h GLN 14 Ca -0.33 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.38 2k93 h GLN 14 Cb 1.69 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.46 2k93 h GLN 14 CO 0.00 0.03 -0.42 1.47 -0.67 0.00 0.00 178.83 179.25 2k93 n LEU 15 N -4.25 0.37 0.00 1.46 -0.00 -1.25 -4.34 117.00 108.99 2k93 n LEU 15 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.36 2k93 n LEU 15 Cb 1.54 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.96 2k93 n LEU 15 CO 0.36 -0.14 0.00 0.61 -0.00 0.00 0.00 177.39 178.22 2k93 n GLY 16 N 2.19 0.78 1.91 1.47 0.00 -1.06 -5.12 105.19 105.36 2k93 n GLY 16 Ca 0.00 -0.61 -0.12 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.12 1.61 0.24 -1.01 -5.02 118.33 114.03 2k93 n VAL 17 Ca 0.00 -1.44 0.00 0.00 -2.04 0.00 0.00 64.34 60.86 2k93 n VAL 17 Cb 0.00 0.70 0.00 0.00 -1.47 0.00 0.00 33.84 33.07 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 -0.39 3.43 -0.08 7.34 4.81 -1.26 -4.85 118.16 127.16 2k93 n LYS 18 Ca 0.04 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.33 2k93 n LYS 18 Cb 0.36 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.35 2k93 n LYS 18 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2k93 n GLN 19 N 0.00 0.36 0.33 1.64 6.02 -1.26 -4.33 117.38 120.13 2k93 n GLN 19 Ca 0.00 0.13 0.19 0.00 -0.01 0.00 0.00 57.00 57.32 2k93 n GLN 19 Cb 0.00 -1.16 1.03 0.00 1.02 0.00 0.00 30.24 31.14 2k93 n GLN 19 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 2k93 h GLU 20 N -0.39 0.00 0.00 -1.09 4.81 -1.97 0.91 114.58 116.84 2k93 h GLU 20 Ca -0.39 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 2k93 h GLU 20 Cb 1.42 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.80 2k93 h GLU 20 CO -0.19 0.00 -0.44 0.39 -0.73 0.00 0.00 179.01 178.04 2k93 n GLU 21 N -3.09 0.18 -2.65 1.92 4.71 -1.26 -3.94 120.64 116.51 2k93 n GLU 21 Ca -0.02 0.07 -0.08 0.00 -0.01 0.00 0.00 57.16 57.12 2k93 n GLU 21 Cb 0.21 -1.63 0.04 0.00 -1.01 0.00 0.00 31.44 29.04 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 -1.91 1.42 -0.33 2.62 0.31 0.29 -4.71 118.33 116.03 2k93 n VAL 22 Ca 0.05 -3.30 -0.11 0.00 -0.01 0.00 0.00 64.34 60.97 2k93 n VAL 22 Cb 0.40 0.57 0.10 0.00 -0.91 0.00 0.00 33.84 34.01 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 -0.42 0.00 0.35 2.52 -2.24 0.05 -4.78 114.28 109.76 2k93 n THR 23 Ca 0.15 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.78 2k93 n THR 23 Cb 0.81 -0.35 -0.07 0.00 -2.10 0.00 0.00 70.33 68.62 2k93 n THR 23 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2k93 h ASN 24 N -2.43 -0.79 -0.66 3.42 4.21 -1.96 -3.05 115.58 114.32 2k93 h ASN 24 Ca -0.14 0.01 -0.41 0.00 1.21 0.00 0.00 56.30 56.97 2k93 h ASN 24 Cb 0.47 0.20 -0.20 0.00 -1.12 0.00 0.00 38.32 37.67 2k93 h ASN 24 CO 0.08 -0.42 0.53 -3.20 -1.29 0.00 0.00 177.43 173.14 2k93 n ASN 25 N -5.40 5.67 -4.80 5.81 5.15 -1.26 -0.58 115.26 119.84 2k93 n ASN 25 Ca -0.12 -3.23 -0.34 0.00 -0.60 0.00 0.00 54.58 50.29 2k93 n ASN 25 Cb 0.38 -0.92 -0.04 0.00 -0.53 0.00 0.00 39.78 38.66 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 -2.41 2.93 0.15 5.20 0.00 -1.15 -4.92 121.76 121.55 2k93 s ALA 26 Ca 0.41 0.56 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2k93 s ALA 26 Cb 0.33 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 20.22 2k93 s ALA 26 CO 0.02 -0.19 0.00 0.43 0.00 0.00 0.00 175.76 176.02 2k93 n SER 27 N -0.83 0.00 0.00 0.00 7.64 -1.26 -2.53 113.62 116.64 2k93 n SER 27 Ca 0.08 -0.77 0.00 0.00 1.01 0.00 0.00 58.87 59.19 2k93 n SER 27 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 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 -0.89 0.00 0.25 1.43 3.01 -1.26 -4.13 117.46 115.87 2k93 n PHE 28 Ca 0.00 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.63 2k93 n PHE 28 Cb 0.00 0.00 0.82 0.00 -0.01 0.00 0.00 39.48 40.29 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 0.17 0.00 -4.37 2.07 -1.84 2.38 116.25 114.65 2k93 h VAL 29 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2k93 h VAL 29 Cb 0.00 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2k93 h VAL 29 CO 0.00 0.00 -1.67 -0.62 0.02 0.00 0.00 177.57 175.30 2k93 n GLU 30 N -3.25 0.60 0.00 1.57 1.02 -1.26 -3.81 120.64 115.51 2k93 n GLU 30 Ca 0.01 -0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 2k93 n GLU 30 Cb 0.43 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 2k93 n GLU 30 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2k93 n ASP 31 N -2.32 0.00 -1.62 1.62 -0.08 0.33 -4.73 116.55 109.75 2k93 n ASP 31 Ca -0.02 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.14 2k93 n ASP 31 Cb 0.55 0.00 0.08 0.00 2.34 0.00 0.00 41.12 44.09 2k93 n ASP 31 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2k93 n LEU 32 N -1.24 4.97 -2.03 -2.67 4.77 0.38 -4.82 117.00 116.36 2k93 n LEU 32 Ca 0.00 -2.59 0.00 0.00 -0.03 0.00 0.00 56.01 53.39 2k93 n LEU 32 Cb 0.00 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 2k93 n LEU 32 CO 0.00 0.81 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 2k93 n GLY 33 N -0.23 -0.36 2.65 -0.72 0.00 0.71 -2.42 105.19 104.82 2k93 n GLY 33 Ca 0.29 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.99 -1.83 -1.62 4.61 0.00 -0.57 -4.51 120.51 114.59 2k93 n ALA 34 Ca 0.00 0.13 -0.33 0.00 0.00 0.00 0.00 53.44 53.24 2k93 n ALA 34 Cb 0.36 -1.03 0.02 0.00 0.00 0.00 0.00 19.45 18.81 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 -0.90 5.61 0.05 0.00 -1.08 -1.02 -4.83 116.67 114.50 2k93 s ASP 35 Ca 0.15 1.83 -0.29 0.00 -0.52 0.00 0.00 52.55 53.72 2k93 s ASP 35 Cb -0.02 -2.53 -0.16 0.00 -1.46 0.00 0.00 42.92 38.76 2k93 s ASP 35 CO 0.34 -1.29 1.44 0.28 0.52 0.00 0.00 175.17 176.46 2k93 h SER 36 N 0.23 -0.94 -1.35 -0.34 0.02 -1.94 -0.82 113.55 108.41 2k93 h SER 36 Ca -0.46 0.04 0.39 0.00 -0.84 0.00 0.00 61.79 60.92 2k93 h SER 36 Cb 1.22 0.26 -0.05 0.00 0.14 0.00 0.00 62.40 63.97 2k93 h SER 36 CO 0.57 -0.61 1.00 0.17 -1.14 0.00 0.00 176.83 176.81 2k93 h LEU 37 N -1.00 0.00 0.48 5.07 -0.00 -1.94 0.43 115.31 118.35 2k93 h LEU 37 Ca -0.10 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.76 2k93 h LEU 37 Cb 0.78 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 2k93 h LEU 37 CO 0.13 0.00 -0.23 -0.78 -0.00 0.00 0.00 178.44 177.56 2k93 h ASP 38 N 0.00 -0.54 -0.78 0.17 1.82 -1.50 1.75 116.42 117.34 2k93 h ASP 38 Ca 0.64 -0.07 0.10 0.00 -0.39 0.00 0.00 57.03 57.31 2k93 h ASP 38 Cb 2.64 0.14 -0.05 0.00 0.68 0.00 0.00 39.33 42.73 2k93 h ASP 38 CO -0.01 -0.14 0.51 0.74 -1.61 0.00 0.00 179.24 178.74 2k93 h THR 39 N -1.05 0.94 0.04 2.25 2.02 0.10 0.32 112.91 117.54 2k93 h THR 39 Ca -0.07 -0.24 -0.16 0.00 0.77 0.00 0.00 66.41 66.71 2k93 h THR 39 Cb 0.58 0.17 0.02 0.00 -1.74 0.00 0.00 68.15 67.17 2k93 h THR 39 CO 0.11 0.13 -0.66 0.58 0.37 0.00 0.00 175.52 176.04 2k93 h VAL 40 N 0.70 1.46 0.00 3.16 2.07 -0.54 -3.14 116.25 119.96 2k93 h VAL 40 Ca 0.36 -2.22 -0.00 0.00 0.82 0.00 0.00 66.70 65.66 2k93 h VAL 40 Cb 0.47 2.79 -0.00 0.00 -1.52 0.00 0.00 31.29 33.03 2k93 h VAL 40 CO -0.14 0.64 -0.01 -0.33 0.02 0.00 0.00 177.57 177.75 2k93 h GLU 41 N -0.19 0.00 -0.21 1.57 4.39 0.37 0.19 114.58 120.70 2k93 h GLU 41 Ca -0.10 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.44 2k93 h GLU 41 Cb 1.41 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.06 2k93 h GLU 41 CO 0.13 0.01 -0.55 1.25 -1.16 0.00 0.00 179.01 178.69 2k93 h LEU 42 N 0.00 0.69 -0.83 1.33 5.85 -0.36 1.67 115.31 123.66 2k93 h LEU 42 Ca -0.00 -0.37 -0.09 0.00 0.84 0.00 0.00 57.88 58.26 2k93 h LEU 42 Cb 0.03 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2k93 h LEU 42 CO 0.00 1.10 -0.45 0.58 -0.34 0.00 0.00 178.44 179.33 2k93 h VAL 43 N 0.48 1.03 0.05 1.05 2.07 -0.96 -1.57 116.25 118.41 2k93 h VAL 43 Ca 0.01 -1.73 -0.27 0.00 0.82 0.00 0.00 66.70 65.53 2k93 h VAL 43 Cb 1.10 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.87 2k93 h VAL 43 CO 0.11 0.44 -1.44 0.24 0.02 0.00 0.00 177.57 176.94 2k93 h MET 44 N 0.00 0.11 -0.33 1.57 2.86 -1.03 -3.00 114.93 115.12 2k93 h MET 44 Ca -0.00 -0.19 0.04 0.00 -2.06 0.00 0.00 59.70 57.48 2k93 h MET 44 Cb 0.98 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.68 2k93 h MET 44 CO 0.06 1.09 0.11 0.00 1.06 0.00 0.00 176.91 179.23 2k93 h ALA 45 N -0.25 0.37 0.00 6.32 0.00 0.24 1.14 119.26 127.09 2k93 h ALA 45 Ca -0.35 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2k93 h ALA 45 Cb 1.57 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 2k93 h ALA 45 CO -0.08 -0.29 -0.18 -0.07 0.00 0.00 0.00 179.25 178.63 2k93 h LEU 46 N 0.25 0.00 0.00 0.00 3.38 -1.46 -0.71 115.31 116.77 2k93 h LEU 46 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2k93 h LEU 46 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2k93 h LEU 46 CO -0.15 0.18 -0.05 -0.33 0.09 0.00 0.00 178.44 178.18 2k93 h GLU 47 N 0.00 0.03 0.00 1.13 5.08 -0.72 -2.90 114.58 117.20 2k93 h GLU 47 Ca -0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2k93 h GLU 47 Cb 0.54 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2k93 h GLU 47 CO 0.02 0.89 0.00 1.49 -1.00 0.00 0.00 179.01 180.41 2k93 h GLU 48 N -0.82 0.00 0.00 2.33 4.81 0.14 0.49 114.58 121.53 2k93 h GLU 48 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2k93 h GLU 48 Cb 0.91 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2k93 h GLU 48 CO 0.01 0.00 0.00 -1.91 -0.73 0.00 0.00 179.01 176.38 2k93 n GLU 49 N -2.33 0.00 -0.19 1.92 4.07 -0.29 -4.74 120.64 119.09 2k93 n GLU 49 Ca 0.01 0.32 0.02 0.00 -0.06 0.00 0.00 57.16 57.45 2k93 n GLU 49 Cb 0.20 -0.93 0.03 0.00 -0.06 0.00 0.00 31.44 30.68 2k93 n GLU 49 CO 0.00 0.00 0.00 1.97 -0.06 0.00 0.00 177.13 179.04 2k93 n PHE 50 N -1.47 0.00 -2.97 4.31 -1.74 -1.13 -5.05 117.46 109.42 2k93 n PHE 50 Ca 0.00 -0.27 -0.14 0.00 -0.56 0.00 0.00 57.45 56.49 2k93 n PHE 50 Cb 0.00 -0.05 0.02 0.00 1.52 0.00 0.00 39.48 40.96 2k93 n PHE 50 CO 0.00 0.00 0.00 -3.47 -0.56 0.00 0.00 176.76 172.73 2k93 n ASP 51 N -0.35 -7.52 0.00 5.98 2.03 0.17 -4.96 116.55 111.91 2k93 n ASP 51 Ca 0.03 0.43 0.00 0.00 0.52 0.00 0.00 54.79 55.77 2k93 n ASP 51 Cb 0.55 -4.71 0.00 0.00 -0.72 0.00 0.00 41.12 36.24 2k93 n ASP 51 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2k93 n THR 52 N -0.25 0.00 -2.67 5.18 5.66 -1.16 -4.96 114.28 116.07 2k93 n THR 52 Ca 0.08 -0.40 -0.03 0.00 -3.05 0.00 0.00 64.05 60.65 2k93 n THR 52 Cb 0.49 1.02 0.00 0.00 -1.55 0.00 0.00 70.33 70.30 2k93 n THR 52 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2k93 n GLU 53 N -0.72 -0.34 -2.31 1.09 0.28 -1.26 -4.77 120.64 112.62 2k93 n GLU 53 Ca 0.00 0.66 -0.42 0.00 -0.16 0.00 0.00 57.16 57.24 2k93 n GLU 53 Cb 0.00 -0.86 -0.03 0.00 1.43 0.00 0.00 31.44 31.99 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 -0.83 3.89 0.00 3.84 -1.16 -1.26 -5.02 121.20 120.67 2k93 s ILE 54 Ca 0.03 1.26 0.00 0.00 -0.51 0.00 0.00 60.65 61.44 2k93 s ILE 54 Cb -0.00 -3.81 0.00 0.00 0.61 0.00 0.00 42.46 39.25 2k93 s ILE 54 CO 0.07 0.00 0.00 -0.81 -2.81 0.00 0.00 174.94 171.40 2k93 n PRO 55 N 5.27 0.15 0.02 3.50 -0.04 -1.26 -4.63 135.00 138.00 2k93 n PRO 55 Ca 0.12 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.69 2k93 n PRO 55 Cb 0.45 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.84 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 -1.70 0.54 -0.04 3.54 -0.08 -1.26 -3.57 116.55 113.97 2k93 n ASP 56 Ca 0.00 -0.29 -0.01 0.00 -1.51 0.00 0.00 54.79 52.98 2k93 n ASP 56 Cb 0.00 1.15 -0.00 0.00 2.34 0.00 0.00 41.12 44.60 2k93 n ASP 56 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2k93 h GLU 57 N 0.00 0.00 -0.19 -0.67 5.08 -2.02 -3.35 114.58 113.43 2k93 h GLU 57 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2k93 h GLU 57 Cb 0.77 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 2k93 h GLU 57 CO 0.00 0.00 0.16 0.93 -1.00 0.00 0.00 179.01 179.10 2k93 h GLU 58 N -0.77 0.00 -0.96 2.33 4.39 -1.97 -0.19 114.58 117.41 2k93 h GLU 58 Ca 0.00 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.87 2k93 h GLU 58 Cb 0.12 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.68 2k93 h GLU 58 CO 0.00 0.00 0.61 0.00 -1.16 0.00 0.00 179.01 178.46 2k93 h ALA 59 N 1.86 1.81 0.00 3.43 0.00 -1.70 1.01 119.26 125.68 2k93 h ALA 59 Ca 0.09 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2k93 h ALA 59 Cb 0.41 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2k93 h ALA 59 CO -0.00 -0.12 0.04 1.05 0.00 0.00 0.00 179.25 180.23 2k93 h GLU 60 N 0.70 0.00 0.00 0.00 4.11 -1.15 0.75 114.58 118.99 2k93 h GLU 60 Ca 0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.94 2k93 h GLU 60 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2k93 h GLU 60 CO -0.27 0.00 -1.51 1.17 0.07 0.00 0.00 179.01 178.47 2k93 n LYS 61 N -2.40 0.35 -0.43 1.06 4.81 0.34 -4.06 118.16 117.84 2k93 n LYS 61 Ca -0.02 -0.10 0.08 0.00 -0.87 0.00 0.00 58.31 57.40 2k93 n LYS 61 Cb 0.08 -1.52 0.25 0.00 0.02 0.00 0.00 35.03 33.87 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 -1.92 2.02 0.08 3.15 2.08 0.23 -4.70 119.36 120.30 2k93 n ILE 62 Ca -0.00 -1.62 -0.15 0.00 0.56 0.00 0.00 62.75 61.55 2k93 n ILE 62 Cb 0.46 -0.07 -0.09 0.00 -0.75 0.00 0.00 39.64 39.19 2k93 n ILE 62 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 2k93 h THR 63 N 2.14 0.00 -0.00 1.39 1.35 -0.87 -3.42 112.91 113.50 2k93 h THR 63 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2k93 h THR 63 Cb 1.33 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 2k93 h THR 63 CO 0.20 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.82 2k93 n THR 64 N -5.17 0.00 -0.07 6.82 -2.24 -1.26 -4.50 114.28 107.86 2k93 n THR 64 Ca -0.07 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.59 2k93 n THR 64 Cb 0.37 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.56 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 -0.91 1.29 0.29 2.28 0.31 -1.05 -4.46 118.33 116.09 2k93 n VAL 65 Ca 0.00 0.03 0.15 0.00 -0.01 0.00 0.00 64.34 64.51 2k93 n VAL 65 Cb 0.00 -1.99 0.71 0.00 -0.91 0.00 0.00 33.84 31.66 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 -0.70 0.00 0.00 5.55 5.75 -1.09 1.33 115.11 125.95 2k93 h GLN 66 Ca -0.19 0.00 -0.08 0.00 -0.15 0.00 0.00 58.65 58.23 2k93 h GLN 66 Cb 0.98 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.52 2k93 h GLN 66 CO -0.11 0.00 -0.39 0.00 -2.65 0.00 0.00 178.83 175.68 2k93 h ALA 67 N 1.20 1.15 -0.18 3.38 0.00 -1.84 -1.21 119.26 121.76 2k93 h ALA 67 Ca 0.03 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2k93 h ALA 67 Cb 0.90 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2k93 h ALA 67 CO -0.00 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.74 2k93 n ALA 68 N -2.37 2.49 -0.05 0.00 0.00 0.45 -2.27 120.51 118.76 2k93 n ALA 68 Ca -0.01 -0.36 -0.06 0.00 0.00 0.00 0.00 53.44 53.00 2k93 n ALA 68 Cb 0.46 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 18.83 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 0.05 0.58 0.10 0.00 -0.00 -0.52 -3.95 119.36 115.62 2k93 n ILE 69 Ca 0.09 -0.27 -0.20 0.00 -0.00 0.00 0.00 62.75 62.37 2k93 n ILE 69 Cb 0.19 -0.84 -0.12 0.00 -0.00 0.00 0.00 39.64 38.87 2k93 n ILE 69 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.55 176.99 2k93 h ASP 70 N 0.00 0.73 1.27 4.38 3.32 -1.41 0.80 116.42 125.51 2k93 h ASP 70 Ca -0.23 -0.68 -0.08 0.00 0.02 0.00 0.00 57.03 56.06 2k93 h ASP 70 Cb 1.41 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.72 2k93 h ASP 70 CO -0.02 1.50 -0.38 0.22 -1.72 0.00 0.00 179.24 178.84 2k93 h TYR 71 N 0.22 0.00 0.07 4.55 3.20 -1.71 -3.18 116.97 120.12 2k93 h TYR 71 Ca -0.16 0.00 -0.30 0.00 3.14 0.00 0.00 58.73 61.40 2k93 h TYR 71 Cb 1.89 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 40.13 2k93 h TYR 71 CO 0.10 0.38 -1.62 0.82 -1.64 0.00 0.00 178.16 176.20 2k93 h ILE 72 N 0.00 1.01 -0.71 1.81 5.03 -1.68 -3.29 117.51 119.68 2k93 h ILE 72 Ca -0.00 -2.75 0.21 0.00 -0.12 0.00 0.00 64.86 62.20 2k93 h ILE 72 Cb 1.12 2.61 -0.03 0.00 -3.03 0.00 0.00 36.82 37.50 2k93 h ILE 72 CO 0.05 0.74 0.59 -1.13 -0.68 0.00 0.00 178.15 177.72 2k93 h ASN 73 N 0.04 0.00 -0.83 1.72 -0.73 -0.81 0.81 115.58 115.79 2k93 h ASN 73 Ca -0.27 0.00 0.24 0.00 1.87 0.00 0.00 56.30 58.14 2k93 h ASN 73 Cb 2.00 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 40.55 2k93 h ASN 73 CO 0.12 0.00 0.98 1.23 -0.37 0.00 0.00 177.43 179.39 2k93 h GLY 74 N 0.00 0.00 -0.09 1.57 0.00 -1.63 0.16 103.07 103.08 2k93 h GLY 74 Ca 0.34 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.73 2k93 h GLY 74 CO -0.00 0.00 -0.34 0.84 0.00 0.00 0.00 176.54 177.03 2k93 h HIS 75 N 0.00 -0.97 0.00 5.60 -0.00 -1.11 0.13 115.15 118.81 2k93 h HIS 75 Ca 0.39 0.05 -0.12 0.00 -0.00 0.00 0.00 60.37 60.69 2k93 h HIS 75 Cb 2.36 0.47 -0.02 0.00 -0.00 0.00 0.00 27.41 30.22 2k93 h HIS 75 CO 0.00 -0.40 -0.59 -0.56 -0.00 0.00 0.00 177.93 176.37 2k93 h GLN 76 N -0.32 0.00 0.00 5.26 3.07 -0.94 -3.54 115.11 118.64 2k93 h GLN 76 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.88 2k93 h GLN 76 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.11 2k93 h GLN 76 CO -0.48 0.59 0.00 0.00 0.09 0.00 0.00 178.83 179.03