#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 2.15 0.01 6.66 -4.23 -1.26 -4.99 115.64 113.98 2k93 s THR 2 Ca 0.00 -1.02 -0.04 0.00 -1.18 0.00 0.00 61.69 59.44 2k93 s THR 2 Cb 0.00 -2.18 -0.02 0.00 1.34 0.00 0.00 72.50 71.64 2k93 s THR 2 CO 0.00 0.00 0.97 0.40 -0.54 0.00 0.00 174.62 175.45 2k93 h ILE 3 N 0.22 0.00 -1.24 2.99 1.08 -1.98 -2.57 117.51 116.01 2k93 h ILE 3 Ca -0.30 -0.01 0.36 0.00 -0.39 0.00 0.00 64.86 64.51 2k93 h ILE 3 Cb 1.29 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.99 2k93 h ILE 3 CO 0.42 0.00 1.04 -0.08 -0.69 0.00 0.00 178.15 178.84 2k93 h GLU 4 N -0.17 0.00 0.00 2.37 4.22 -1.93 -1.97 114.58 117.09 2k93 h GLU 4 Ca -0.02 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.42 2k93 h GLU 4 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2k93 h GLU 4 CO 0.03 0.00 0.00 -1.91 -2.18 0.00 0.00 179.01 174.95 2k93 n GLU 5 N -3.80 0.00 -0.05 1.92 4.07 -0.98 0.20 120.64 121.99 2k93 n GLU 5 Ca 0.27 0.06 0.23 0.00 -0.06 0.00 0.00 57.16 57.66 2k93 n GLU 5 Cb 1.43 -0.96 0.53 0.00 -0.06 0.00 0.00 31.44 32.38 2k93 n GLU 5 CO 0.00 0.00 0.00 0.07 -0.06 0.00 0.00 177.13 177.14 2k93 h ARG 6 N 0.00 0.00 0.17 5.31 0.11 -1.24 0.47 114.38 119.20 2k93 h ARG 6 Ca 0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 2k93 h ARG 6 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2k93 h ARG 6 CO 0.00 0.00 -0.08 0.28 0.10 0.00 0.00 179.97 180.27 2k93 h VAL 7 N 0.00 0.43 0.00 0.08 2.07 -0.99 -2.03 116.25 115.81 2k93 h VAL 7 Ca 0.34 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.80 2k93 h VAL 7 Cb 2.15 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 2k93 h VAL 7 CO -0.00 0.13 0.04 0.50 0.02 0.00 0.00 177.57 178.25 2k93 h LYS 8 N -1.00 0.00 0.03 1.57 3.11 0.67 0.32 116.57 121.27 2k93 h LYS 8 Ca -0.02 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.82 2k93 h LYS 8 Cb 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.61 2k93 h LYS 8 CO 0.04 0.00 -0.01 -0.22 -2.81 0.00 0.00 179.45 176.44 2k93 h LYS 9 N 0.00 -0.04 -0.95 1.90 3.11 -0.66 -3.13 116.57 116.80 2k93 h LYS 9 Ca 0.00 0.00 0.07 0.00 -2.81 0.00 0.00 60.65 57.91 2k93 h LYS 9 Cb 0.08 0.01 -0.07 0.00 -1.00 0.00 0.00 32.23 31.26 2k93 h LYS 9 CO 0.00 -0.02 0.61 0.82 -2.81 0.00 0.00 179.45 178.04 2k93 h ILE 10 N -0.64 1.06 -0.28 2.00 2.04 -0.87 -2.46 117.51 118.36 2k93 h ILE 10 Ca -0.00 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.52 2k93 h ILE 10 Cb 0.03 -0.13 -0.07 0.00 -0.74 0.00 0.00 36.82 35.92 2k93 h ILE 10 CO 0.01 0.20 -0.50 0.40 0.00 0.00 0.00 178.15 178.26 2k93 h ILE 11 N 1.09 0.00 -1.12 -0.67 1.08 -0.52 0.49 117.51 117.87 2k93 h ILE 11 Ca 0.41 0.00 0.31 0.00 -0.39 0.00 0.00 64.86 65.20 2k93 h ILE 11 Cb 0.18 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 33.84 2k93 h ILE 11 CO -0.18 0.00 0.73 1.23 -0.69 0.00 0.00 178.15 179.24 2k93 h GLY 12 N -0.41 1.10 1.27 5.37 0.00 -1.38 0.72 103.07 109.73 2k93 h GLY 12 Ca 0.05 -0.16 -0.17 0.00 0.00 0.00 0.00 47.33 47.05 2k93 h GLY 12 CO -0.49 -0.18 -0.53 1.46 0.00 0.00 0.00 176.54 176.81 2k93 h GLN 13 N 0.28 0.78 -0.62 4.80 7.50 -0.04 1.76 115.11 129.57 2k93 h GLN 13 Ca 0.64 -0.48 0.18 0.00 0.50 0.00 0.00 58.65 59.49 2k93 h GLN 13 Cb 1.82 0.05 -0.02 0.00 0.05 0.00 0.00 27.48 29.38 2k93 h GLN 13 CO -0.29 1.11 0.51 -0.56 -1.50 0.00 0.00 178.83 178.09 2k93 h GLN 14 N 0.60 0.00 0.00 1.46 3.07 0.42 -3.38 115.11 117.27 2k93 h GLN 14 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.76 2k93 h GLN 14 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.67 2k93 h GLN 14 CO 0.11 0.00 0.00 1.47 0.09 0.00 0.00 178.83 180.50 2k93 n LEU 15 N -4.06 0.00 -0.55 0.06 -0.00 -1.08 -3.93 117.00 107.45 2k93 n LEU 15 Ca 0.12 0.00 -0.00 0.00 -0.00 0.00 0.00 56.01 56.13 2k93 n LEU 15 Cb 0.75 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 44.17 2k93 n LEU 15 CO 0.34 0.00 0.25 0.61 -0.00 0.00 0.00 177.39 178.59 2k93 n GLY 16 N 4.73 0.88 2.15 1.47 0.00 -0.33 -5.06 105.19 109.04 2k93 n GLY 16 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.01-11.99 -2.34 1.61 0.24 0.59 -4.96 118.33 101.48 2k93 n VAL 17 Ca -0.02 2.97 0.00 0.00 -2.04 0.00 0.00 64.34 65.25 2k93 n VAL 17 Cb 0.56 -5.19 0.00 0.00 -1.47 0.00 0.00 33.84 27.74 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 1.91 0.78 -0.00 7.34 0.00 -1.26 -5.07 118.16 121.86 2k93 n LYS 18 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 58.31 58.31 2k93 n LYS 18 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.03 2k93 n LYS 18 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2k93 n GLN 19 N 0.00 0.01 -0.03 1.64 1.13 -1.26 -4.54 117.38 114.33 2k93 n GLN 19 Ca 0.00 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.19 2k93 n GLN 19 Cb 0.00 -0.83 0.36 0.00 0.11 0.00 0.00 30.24 29.88 2k93 n GLN 19 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 2k93 n GLU 20 N -2.69 1.92 -0.00 -1.09 0.28 -1.26 -3.69 120.64 114.11 2k93 n GLU 20 Ca -0.01 -1.35 0.09 0.00 -0.16 0.00 0.00 57.16 55.73 2k93 n GLU 20 Cb 0.51 -1.46 -0.12 0.00 1.43 0.00 0.00 31.44 31.79 2k93 n GLU 20 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2k93 n GLU 21 N 0.63 0.76 -1.56 3.44 1.02 -1.26 -4.31 120.64 119.35 2k93 n GLU 21 Ca 0.17 -0.04 -0.10 0.00 -0.02 0.00 0.00 57.16 57.17 2k93 n GLU 21 Cb 0.44 -1.40 0.09 0.00 -0.02 0.00 0.00 31.44 30.55 2k93 n GLU 21 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2k93 n VAL 22 N -1.60 2.17 0.00 2.62 0.31 -1.24 -4.88 118.33 115.71 2k93 n VAL 22 Ca 0.02 -3.59 0.00 0.00 -0.01 0.00 0.00 64.34 60.76 2k93 n VAL 22 Cb 0.34 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.77 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 -0.78 0.00 -2.30 2.52 -2.24 -1.25 -5.00 114.28 105.23 2k93 n THR 23 Ca 0.30 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 62.09 2k93 n THR 23 Cb 0.87 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 69.09 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 0.00 0.38 0.00 3.42 0.23 -1.26 -4.83 115.26 113.20 2k93 n ASN 24 Ca 0.00 -1.95 0.00 0.00 -0.53 0.00 0.00 54.58 52.10 2k93 n ASN 24 Cb 0.00 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 37.56 2k93 n ASN 24 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2k93 n ASN 25 N 0.30 0.00 -4.94 0.53 2.85 -1.26 -4.35 115.26 108.39 2k93 n ASN 25 Ca -0.03 0.00 -0.24 0.00 -0.11 0.00 0.00 54.58 54.20 2k93 n ASN 25 Cb 0.96 0.00 0.02 0.00 1.24 0.00 0.00 39.78 42.00 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 0.00 3.60 0.35 5.20 0.00 -1.26 -4.87 121.76 124.78 2k93 s ALA 26 Ca 0.00 -0.93 0.06 0.00 0.00 0.00 0.00 51.96 51.09 2k93 s ALA 26 Cb 0.00 -2.30 0.06 0.00 0.00 0.00 0.00 23.12 20.88 2k93 s ALA 26 CO 0.00 -0.52 0.47 0.43 0.00 0.00 0.00 175.76 176.14 2k93 n SER 27 N -2.25 1.29 0.08 0.00 7.64 -1.26 -2.10 113.62 117.02 2k93 n SER 27 Ca 0.02 -1.93 0.00 0.00 1.01 0.00 0.00 58.87 57.97 2k93 n SER 27 Cb 0.58 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 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 -1.74 -0.89 0.31 1.43 3.01 -0.84 -3.99 117.46 114.74 2k93 n PHE 28 Ca 0.09 0.16 0.16 0.00 1.01 0.00 0.00 57.45 58.88 2k93 n PHE 28 Cb 0.36 0.21 0.73 0.00 -0.01 0.00 0.00 39.48 40.77 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 0.00 -4.37 2.07 -1.85 1.86 116.25 113.96 2k93 h VAL 29 Ca 0.00 -0.29 -0.21 0.00 0.82 0.00 0.00 66.70 67.02 2k93 h VAL 29 Cb 0.00 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 2k93 h VAL 29 CO 0.00 0.00 -1.80 -0.62 0.02 0.00 0.00 177.57 175.17 2k93 n GLU 30 N -2.79 1.96 -0.02 1.57 -0.58 -1.26 -3.76 120.64 115.76 2k93 n GLU 30 Ca 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.73 2k93 n GLU 30 Cb 0.21 -1.30 -0.00 0.00 -0.57 0.00 0.00 31.44 29.78 2k93 n GLU 30 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2k93 h ASP 31 N 0.00 0.00 -0.80 1.62 1.82 -1.63 -3.39 116.42 114.05 2k93 h ASP 31 Ca -0.32 0.00 -0.36 0.00 -0.39 0.00 0.00 57.03 55.96 2k93 h ASP 31 Cb 1.70 0.00 -0.22 0.00 0.68 0.00 0.00 39.33 41.50 2k93 h ASP 31 CO 0.01 0.21 0.46 0.18 -1.61 0.00 0.00 179.24 178.49 2k93 n LEU 32 N -2.94 6.05 -2.24 2.28 4.77 0.23 -4.87 117.00 120.27 2k93 n LEU 32 Ca -0.02 -3.20 0.00 0.00 -0.03 0.00 0.00 56.01 52.77 2k93 n LEU 32 Cb 0.06 -0.77 0.00 0.00 -2.33 0.00 0.00 43.42 40.38 2k93 n LEU 32 CO 0.03 0.90 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 2k93 n GLY 33 N -0.63 -0.43 3.08 -0.72 0.00 0.52 -2.42 105.19 104.58 2k93 n GLY 33 Ca 0.47 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.48 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 -2.20 -2.21 -2.75 4.61 0.00 0.44 -4.73 120.51 113.68 2k93 n ALA 34 Ca 0.00 0.16 -0.22 0.00 0.00 0.00 0.00 53.44 53.38 2k93 n ALA 34 Cb 0.43 -0.71 -0.01 0.00 0.00 0.00 0.00 19.45 19.16 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 -1.00 6.22 0.02 0.00 2.15 -1.02 -4.93 116.67 118.12 2k93 s ASP 35 Ca -0.01 0.17 -0.25 0.00 0.43 0.00 0.00 52.55 52.90 2k93 s ASP 35 Cb 0.00 -1.80 -0.14 0.00 -0.30 0.00 0.00 42.92 40.68 2k93 s ASP 35 CO 0.16 -0.24 1.11 0.28 -0.17 0.00 0.00 175.17 176.31 2k93 h SER 36 N 0.94 -0.76 -0.99 -0.34 0.02 -1.93 0.34 113.55 110.83 2k93 h SER 36 Ca -0.50 0.03 0.27 0.00 -0.84 0.00 0.00 61.79 60.74 2k93 h SER 36 Cb 1.23 0.20 -0.06 0.00 0.14 0.00 0.00 62.40 63.91 2k93 h SER 36 CO 0.60 -0.42 0.68 -0.07 -1.14 0.00 0.00 176.83 176.48 2k93 h LEU 37 N -1.13 0.20 0.24 5.07 3.38 -1.96 1.53 115.31 122.64 2k93 h LEU 37 Ca -0.09 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2k93 h LEU 37 Cb 0.68 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2k93 h LEU 37 CO 0.15 0.06 -0.12 0.44 0.09 0.00 0.00 178.44 179.06 2k93 h ASP 38 N 0.19 -0.27 0.43 -0.43 5.19 -1.62 1.46 116.42 121.37 2k93 h ASP 38 Ca 0.51 -0.25 -0.00 0.00 -0.62 0.00 0.00 57.03 56.67 2k93 h ASP 38 Cb 1.66 0.07 -0.00 0.00 0.18 0.00 0.00 39.33 41.24 2k93 h ASP 38 CO -0.12 0.22 -0.01 0.74 -3.12 0.00 0.00 179.24 176.94 2k93 h THR 39 N -0.89 0.07 0.07 0.35 2.02 0.18 0.62 112.91 115.33 2k93 h THR 39 Ca -0.03 -0.26 -0.29 0.00 0.77 0.00 0.00 66.41 66.60 2k93 h THR 39 Cb 0.51 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 2k93 h THR 39 CO 0.05 0.01 -1.59 0.58 0.37 0.00 0.00 175.52 174.95 2k93 h VAL 40 N 0.00 0.81 0.00 3.16 2.07 0.22 -3.28 116.25 119.22 2k93 h VAL 40 Ca -0.00 -2.27 -0.01 0.00 0.82 0.00 0.00 66.70 65.23 2k93 h VAL 40 Cb 0.23 2.40 -0.00 0.00 -1.52 0.00 0.00 31.29 32.41 2k93 h VAL 40 CO 0.00 0.61 -0.05 -0.33 0.02 0.00 0.00 177.57 177.82 2k93 h GLU 41 N -0.46 0.00 -0.01 1.57 5.08 0.25 -0.68 114.58 120.32 2k93 h GLU 41 Ca -0.37 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 57.80 2k93 h GLU 41 Cb 1.67 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.91 2k93 h GLU 41 CO -0.05 0.05 -0.82 1.25 -1.00 0.00 0.00 179.01 178.44 2k93 h LEU 42 N 0.00 0.23 -0.14 1.33 6.46 -1.01 1.15 115.31 123.33 2k93 h LEU 42 Ca -0.00 -0.18 -0.10 0.00 -0.12 0.00 0.00 57.88 57.48 2k93 h LEU 42 Cb 0.25 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.10 2k93 h LEU 42 CO 0.01 0.95 -0.48 0.58 -0.62 0.00 0.00 178.44 178.87 2k93 h VAL 43 N 0.11 0.86 0.11 1.05 2.07 -1.23 -3.00 116.25 116.21 2k93 h VAL 43 Ca -0.03 -2.11 -0.36 0.00 0.82 0.00 0.00 66.70 65.01 2k93 h VAL 43 Cb 1.42 2.35 -0.02 0.00 -1.52 0.00 0.00 31.29 33.52 2k93 h VAL 43 CO 0.12 0.47 -2.02 0.23 0.02 0.00 0.00 177.57 176.39 2k93 n MET 44 N -3.26 0.74 -0.08 1.57 2.81 -0.58 -3.14 117.12 115.18 2k93 n MET 44 Ca 0.02 0.26 -0.07 0.00 -1.81 0.00 0.00 57.70 56.11 2k93 n MET 44 Cb 0.70 -1.69 -0.00 0.00 -0.71 0.00 0.00 33.22 31.52 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 0.03 0.24 -0.15 3.04 0.00 0.13 1.23 119.26 123.78 2k93 h ALA 45 Ca -0.44 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 2k93 h ALA 45 Cb 1.98 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.95 2k93 h ALA 45 CO 0.05 -0.44 -0.27 -0.07 0.00 0.00 0.00 179.25 178.52 2k93 h LEU 46 N 0.04 0.27 0.21 0.00 3.38 -1.70 -1.85 115.31 115.66 2k93 h LEU 46 Ca 0.15 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2k93 h LEU 46 Cb 0.21 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2k93 h LEU 46 CO -0.28 0.54 -0.10 -0.08 0.09 0.00 0.00 178.44 178.62 2k93 h GLU 47 N 0.24 -0.27 0.00 1.13 4.22 -0.91 -0.25 114.58 118.74 2k93 h GLU 47 Ca 0.04 0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.49 2k93 h GLU 47 Cb 0.61 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2k93 h GLU 47 CO 0.04 0.08 0.00 -1.91 -2.18 0.00 0.00 179.01 175.05 2k93 n GLU 48 N -5.04 0.09 0.00 1.92 2.13 0.40 0.23 120.64 120.36 2k93 n GLU 48 Ca -0.09 0.51 0.00 0.00 0.66 0.00 0.00 57.16 58.24 2k93 n GLU 48 Cb 0.25 -1.74 0.00 0.00 0.27 0.00 0.00 31.44 30.22 2k93 n GLU 48 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2k93 n GLU 49 N -1.92 0.00 -0.30 5.31 2.13 -0.70 -4.74 120.64 120.41 2k93 n GLU 49 Ca 0.00 0.20 0.08 0.00 0.66 0.00 0.00 57.16 58.10 2k93 n GLU 49 Cb 0.07 -0.64 0.15 0.00 0.27 0.00 0.00 31.44 31.29 2k93 n GLU 49 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2k93 n PHE 50 N -1.80 0.00 -3.86 4.31 3.72 -0.14 -5.01 117.46 114.68 2k93 n PHE 50 Ca 0.00 -1.05 -0.31 0.00 -0.05 0.00 0.00 57.45 56.04 2k93 n PHE 50 Cb 0.00 -0.17 0.01 0.00 -0.94 0.00 0.00 39.48 38.37 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 -1.17 -4.46 -0.00 4.37 2.03 0.62 -4.86 116.55 113.07 2k93 n ASP 51 Ca 0.15 -1.05 0.03 0.00 0.52 0.00 0.00 54.79 54.44 2k93 n ASP 51 Cb 0.68 -1.54 -0.05 0.00 -0.72 0.00 0.00 41.12 39.49 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 -3.27 0.00 -3.40 5.18 5.66 -1.23 -4.94 114.28 112.28 2k93 n THR 52 Ca -0.26 -0.27 -0.26 0.00 -3.05 0.00 0.00 64.05 60.21 2k93 n THR 52 Cb 0.64 0.74 0.03 0.00 -1.55 0.00 0.00 70.33 70.19 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 -1.39 -1.43 -1.70 1.09 0.28 -1.26 -4.75 120.64 111.48 2k93 n GLU 53 Ca 0.00 1.24 -0.44 0.00 -0.16 0.00 0.00 57.16 57.81 2k93 n GLU 53 Cb 0.14 -1.77 -0.03 0.00 1.43 0.00 0.00 31.44 31.21 2k93 n GLU 53 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2k93 n ILE 54 N 0.29 0.60 -0.61 3.84 2.08 -1.25 -4.98 119.36 119.32 2k93 n ILE 54 Ca -0.06 -0.15 0.00 0.00 0.56 0.00 0.00 62.75 63.10 2k93 n ILE 54 Cb 0.62 -1.73 0.00 0.00 -0.75 0.00 0.00 39.64 37.78 2k93 n ILE 54 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 2k93 n PRO 55 N 2.71 -0.22 0.07 0.38 -0.04 -1.26 -4.73 135.00 131.90 2k93 n PRO 55 Ca 0.13 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.70 2k93 n PRO 55 Cb 0.33 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.80 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 -2.45 0.69 -0.05 3.54 -0.08 -1.26 -3.56 116.55 113.37 2k93 n ASP 56 Ca 0.00 0.15 -0.02 0.00 -1.51 0.00 0.00 54.79 53.41 2k93 n ASP 56 Cb 0.00 0.64 -0.01 0.00 2.34 0.00 0.00 41.12 44.09 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 0.00 -0.67 3.07 -2.02 -3.30 114.58 111.66 2k93 h GLU 57 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2k93 h GLU 57 Cb 0.90 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.81 2k93 h GLU 57 CO 0.00 0.09 0.10 0.93 -1.40 0.00 0.00 179.01 178.72 2k93 h GLU 58 N -1.00 0.00 -0.71 2.33 5.08 -1.96 -0.25 114.58 118.07 2k93 h GLU 58 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2k93 h GLU 58 Cb 0.13 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2k93 h GLU 58 CO -0.00 0.00 0.44 0.00 -1.00 0.00 0.00 179.01 178.45 2k93 h ALA 59 N 1.78 0.91 -0.67 3.43 0.00 -1.63 0.85 119.26 123.93 2k93 h ALA 59 Ca 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2k93 h ALA 59 Cb 0.20 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2k93 h ALA 59 CO 0.00 0.38 0.44 1.49 0.00 0.00 0.00 179.25 181.56 2k93 h GLU 60 N 0.97 0.88 0.00 0.00 4.81 -1.17 0.30 114.58 120.38 2k93 h GLU 60 Ca 0.26 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2k93 h GLU 60 Cb -0.04 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.14 2k93 h GLU 60 CO -0.05 0.58 0.00 1.17 -0.73 0.00 0.00 179.01 179.98 2k93 n LYS 61 N -4.62 0.32 -0.46 1.92 4.81 -0.85 -2.38 118.16 116.91 2k93 n LYS 61 Ca 0.06 0.05 0.07 0.00 -0.87 0.00 0.00 58.31 57.62 2k93 n LYS 61 Cb 0.02 -1.50 0.17 0.00 0.02 0.00 0.00 35.03 33.74 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 -1.30 1.88 1.79 3.15 5.41 0.40 -4.67 119.36 126.01 2k93 n ILE 62 Ca 0.11 -2.64 0.09 0.00 1.00 0.00 0.00 62.75 61.32 2k93 n ILE 62 Cb 0.21 -0.14 0.56 0.00 -0.71 0.00 0.00 39.64 39.56 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 -1.10 0.00 -3.26 1.39 5.66 0.78 -4.78 114.28 112.97 2k93 n THR 63 Ca 0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.16 2k93 n THR 63 Cb 0.70 -0.39 0.00 0.00 -1.55 0.00 0.00 70.33 69.09 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 -0.83 0.00 -0.08 1.09 -2.24 -1.26 -1.99 114.28 108.96 2k93 n THR 64 Ca 0.14 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.82 2k93 n THR 64 Cb 0.07 -0.53 -0.04 0.00 -2.10 0.00 0.00 70.33 67.73 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 -0.42 1.47 0.18 2.28 0.31 -0.89 -4.37 118.33 116.90 2k93 n VAL 65 Ca 0.00 0.10 0.11 0.00 -0.01 0.00 0.00 64.34 64.54 2k93 n VAL 65 Cb 0.00 -2.23 0.61 0.00 -0.91 0.00 0.00 33.84 31.31 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 -0.92 0.00 0.00 5.55 5.75 -1.85 0.30 115.11 123.95 2k93 h GLN 66 Ca -0.08 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.30 2k93 h GLN 66 Cb 1.00 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.53 2k93 h GLN 66 CO -0.05 0.00 -0.57 0.00 -2.65 0.00 0.00 178.83 175.57 2k93 h ALA 67 N 1.89 0.95 -0.15 3.38 0.00 -1.90 0.53 119.26 123.96 2k93 h ALA 67 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2k93 h ALA 67 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2k93 h ALA 67 CO 0.00 0.71 0.00 0.00 0.00 0.00 0.00 179.25 179.96 2k93 n ALA 68 N -2.38 2.53 -0.03 0.00 0.00 0.11 -2.62 120.51 118.11 2k93 n ALA 68 Ca -0.01 -0.43 -0.04 0.00 0.00 0.00 0.00 53.44 52.96 2k93 n ALA 68 Cb 0.60 -1.11 -0.04 0.00 0.00 0.00 0.00 19.45 18.90 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 0.09 0.41 0.08 0.00 -0.00 -0.82 -4.06 119.36 115.06 2k93 n ILE 69 Ca 0.14 -0.21 -0.08 0.00 -0.00 0.00 0.00 62.75 62.60 2k93 n ILE 69 Cb 0.26 -0.81 0.02 0.00 -0.00 0.00 0.00 39.64 39.11 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 0.28 0.67 4.38 3.58 -0.97 0.94 116.42 125.30 2k93 h ASP 70 Ca -0.16 -0.21 -0.22 0.00 0.42 0.00 0.00 57.03 56.86 2k93 h ASP 70 Cb 1.32 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 42.27 2k93 h ASP 70 CO -0.01 0.98 -1.01 0.22 -2.88 0.00 0.00 179.24 176.54 2k93 h TYR 71 N 0.13 0.31 0.08 0.28 5.03 -1.75 -3.25 116.97 117.81 2k93 h TYR 71 Ca -0.04 -0.20 -0.25 0.00 2.58 0.00 0.00 58.73 60.82 2k93 h TYR 71 Cb 1.41 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 39.67 2k93 h TYR 71 CO 0.03 1.08 -1.13 0.82 -1.32 0.00 0.00 178.16 177.64 2k93 h ILE 72 N 0.08 1.49 -0.46 1.81 1.08 -1.69 -3.12 117.51 116.70 2k93 h ILE 72 Ca -0.07 -2.91 0.13 0.00 -0.39 0.00 0.00 64.86 61.62 2k93 h ILE 72 Cb 1.70 2.79 -0.02 0.00 -3.07 0.00 0.00 36.82 38.22 2k93 h ILE 72 CO 0.16 0.85 0.48 -1.13 -0.69 0.00 0.00 178.15 177.82 2k93 h ASN 73 N 0.10 0.00 0.00 1.72 -0.73 -0.84 0.29 115.58 116.12 2k93 h ASN 73 Ca -0.11 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.06 2k93 h ASN 73 Cb 1.83 0.00 0.00 0.00 0.27 0.00 0.00 38.32 40.42 2k93 h ASN 73 CO 0.18 0.00 0.39 1.23 -0.37 0.00 0.00 177.43 178.86 2k93 h GLY 74 N 0.00 0.00 0.59 1.57 0.00 -1.62 -0.81 103.07 102.81 2k93 h GLY 74 Ca 0.22 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.57 2k93 h GLY 74 CO -0.00 0.00 -0.24 0.84 0.00 0.00 0.00 176.54 177.14 2k93 h HIS 75 N 0.00 -0.63 -2.29 5.60 -0.00 -0.66 -3.43 115.15 113.73 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 0.77 0.26 -0.14 0.00 -0.00 0.00 0.00 27.41 28.31 2k93 h HIS 75 CO 0.00 -0.34 -0.71 1.14 -0.00 0.00 0.00 177.93 178.02 2k93 s GLN 76 N -6.08 1.66 0.00 5.26 1.03 -0.31 -5.21 119.66 116.01 2k93 s GLN 76 Ca -0.15 -1.81 0.13 0.00 0.04 0.00 0.00 55.36 53.57 2k93 s GLN 76 Cb 0.08 -1.54 0.10 0.00 0.03 0.00 0.00 33.01 31.68 2k93 s GLN 76 CO 0.65 0.19 0.91 0.00 -2.54 0.00 0.00 175.29 174.50