#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 2.38 0.00 6.66 -4.23 -1.26 -4.67 115.64 114.52 2k93 s THR 2 Ca 0.00 0.12 0.00 0.00 -1.18 0.00 0.00 61.69 60.63 2k93 s THR 2 Cb 0.00 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.88 2k93 s THR 2 CO 0.00 -0.16 0.51 -0.38 -0.54 0.00 0.00 174.62 174.04 2k93 n ILE 3 N -3.50 0.00 -0.21 2.99 2.08 -1.26 -0.05 119.36 119.40 2k93 n ILE 3 Ca 0.07 1.01 -0.03 0.00 0.56 0.00 0.00 62.75 64.36 2k93 n ILE 3 Cb 0.59 -1.55 0.03 0.00 -0.75 0.00 0.00 39.64 37.97 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 -0.10 -0.62 0.38 4.81 -1.91 -1.21 114.58 115.93 2k93 h GLU 4 Ca 0.00 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2k93 h GLU 4 Cb 0.00 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.33 2k93 h GLU 4 CO 0.00 -0.06 -0.37 -1.91 -0.73 0.00 0.00 179.01 175.94 2k93 n GLU 5 N -5.44 -0.27 -0.18 1.92 2.13 -0.73 0.64 120.64 118.70 2k93 n GLU 5 Ca 0.06 1.20 -0.02 0.00 0.66 0.00 0.00 57.16 59.06 2k93 n GLU 5 Cb 0.35 -1.78 0.08 0.00 0.27 0.00 0.00 31.44 30.37 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 0.37 0.02 5.31 3.08 0.61 -1.39 114.38 122.38 2k93 h ARG 6 Ca 0.10 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2k93 h ARG 6 Cb 0.26 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2k93 h ARG 6 CO -0.59 0.25 -0.08 0.28 -1.07 0.00 0.00 179.97 178.76 2k93 h VAL 7 N 0.38 0.00 -0.99 2.04 2.07 0.13 0.61 116.25 120.49 2k93 h VAL 7 Ca 0.27 0.00 0.33 0.00 0.82 0.00 0.00 66.70 68.12 2k93 h VAL 7 Cb 0.30 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 29.89 2k93 h VAL 7 CO -0.27 0.00 0.24 0.11 0.02 0.00 0.00 177.57 177.67 2k93 h LYS 8 N -0.11 0.01 0.52 1.57 6.56 0.13 1.06 116.57 126.32 2k93 h LYS 8 Ca -0.00 -0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.56 2k93 h LYS 8 Cb 0.11 -0.00 0.01 0.00 -0.57 0.00 0.00 32.23 31.77 2k93 h LYS 8 CO -0.04 0.01 -0.25 -0.22 -2.06 0.00 0.00 179.45 176.89 2k93 h LYS 9 N 0.01 -0.68 -0.93 3.15 1.63 -0.08 -1.05 116.57 118.62 2k93 h LYS 9 Ca 0.70 0.05 0.23 0.00 -0.85 0.00 0.00 60.65 60.78 2k93 h LYS 9 Cb 1.64 0.15 -0.12 0.00 -0.60 0.00 0.00 32.23 33.30 2k93 h LYS 9 CO -0.86 -0.45 0.47 0.82 -3.45 0.00 0.00 179.45 175.98 2k93 h ILE 10 N -0.72 0.50 -0.75 2.00 1.08 0.33 0.69 117.51 120.63 2k93 h ILE 10 Ca -0.07 -0.16 0.10 0.00 -0.39 0.00 0.00 64.86 64.34 2k93 h ILE 10 Cb 0.54 -0.01 -0.07 0.00 -3.07 0.00 0.00 36.82 34.21 2k93 h ILE 10 CO 0.12 0.08 0.39 0.40 -0.69 0.00 0.00 178.15 178.45 2k93 h ILE 11 N 0.46 0.84 -0.90 -0.67 1.08 0.13 0.13 117.51 118.58 2k93 h ILE 11 Ca 0.59 -0.22 0.20 0.00 -0.39 0.00 0.00 64.86 65.04 2k93 h ILE 11 Cb 1.12 0.15 -0.07 0.00 -3.07 0.00 0.00 36.82 34.95 2k93 h ILE 11 CO -0.51 0.12 0.59 1.23 -0.69 0.00 0.00 178.15 178.89 2k93 h GLY 12 N 0.64 0.91 1.21 5.37 0.00 0.17 0.10 103.07 111.47 2k93 h GLY 12 Ca 0.37 -0.20 -0.25 0.00 0.00 0.00 0.00 47.33 47.26 2k93 h GLY 12 CO -0.28 -0.00 -0.94 -1.61 0.00 0.00 0.00 176.54 173.71 2k93 h GLN 13 N 0.43 0.74 -0.11 4.80 4.15 -0.63 0.22 115.11 124.71 2k93 h GLN 13 Ca 0.47 -0.71 0.03 0.00 0.77 0.00 0.00 58.65 59.21 2k93 h GLN 13 Cb 1.13 0.18 -0.00 0.00 0.21 0.00 0.00 27.48 29.00 2k93 h GLN 13 CO -0.18 1.30 0.26 1.96 -1.93 0.00 0.00 178.83 180.24 2k93 h GLN 14 N 0.45 0.00 0.00 1.69 4.20 0.15 -3.40 115.11 118.21 2k93 h GLN 14 Ca -0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.61 2k93 h GLN 14 Cb 1.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.37 2k93 h GLN 14 CO 0.19 0.00 0.00 1.47 -0.67 0.00 0.00 178.83 179.82 2k93 n LEU 15 N -3.26 0.00 0.00 1.46 -0.00 -0.94 -3.95 117.00 110.31 2k93 n LEU 15 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2k93 n LEU 15 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.77 2k93 n LEU 15 CO 0.20 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.20 2k93 n GLY 16 N 1.61 0.00 3.68 1.47 0.00 0.77 -5.03 105.19 107.69 2k93 n GLY 16 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2k93 n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k93 s VAL 17 N 0.00 1.29 0.00 1.61 1.01 -1.23 -5.07 120.40 118.02 2k93 s VAL 17 Ca 0.00 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 59.98 2k93 s VAL 17 Cb 0.00 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.96 2k93 s VAL 17 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.10 176.27 2k93 n LYS 18 N -1.11 3.54 -0.05 2.72 4.81 -1.26 -4.50 118.16 122.31 2k93 n LYS 18 Ca -0.13 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.24 2k93 n LYS 18 Cb 0.67 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.66 2k93 n LYS 18 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k93 n GLN 19 N 0.00 0.78 0.16 1.64 -0.00 -1.26 -4.25 117.38 114.44 2k93 n GLN 19 Ca 0.00 0.05 0.02 0.00 -0.00 0.00 0.00 57.00 57.07 2k93 n GLN 19 Cb 0.00 -1.22 0.25 0.00 -0.00 0.00 0.00 30.24 29.26 2k93 n GLN 19 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 2k93 h GLU 20 N 0.00 0.00 0.00 2.61 4.22 -1.97 0.79 114.58 120.23 2k93 h GLU 20 Ca -0.25 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.19 2k93 h GLU 20 Cb 1.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.67 2k93 h GLU 20 CO -0.03 0.50 -0.11 0.39 -2.18 0.00 0.00 179.01 177.59 2k93 n GLU 21 N -3.68 0.21 -2.58 1.92 1.02 -1.26 -3.60 120.64 112.68 2k93 n GLU 21 Ca -0.01 0.15 -0.08 0.00 -0.02 0.00 0.00 57.16 57.21 2k93 n GLU 21 Cb 0.57 -1.73 0.04 0.00 -0.02 0.00 0.00 31.44 30.30 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 -2.09 1.67 -0.97 2.62 0.31 -0.95 -4.95 118.33 113.96 2k93 n VAL 22 Ca 0.05 -3.34 -0.35 0.00 -0.01 0.00 0.00 64.34 60.70 2k93 n VAL 22 Cb 0.41 0.52 0.04 0.00 -0.91 0.00 0.00 33.84 33.90 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 -0.63 0.00 -1.56 2.52 -2.24 0.23 -4.53 114.28 108.07 2k93 n THR 23 Ca 0.19 -0.48 -0.29 0.00 -2.27 0.00 0.00 64.05 61.20 2k93 n THR 23 Cb 0.85 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 69.00 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 3.28 2.24 0.00 3.42 0.23 -1.26 -1.20 115.26 121.96 2k93 n ASN 24 Ca -0.01 -2.61 0.00 0.00 -0.53 0.00 0.00 54.58 51.42 2k93 n ASN 24 Cb 0.53 -1.46 0.00 0.00 -2.08 0.00 0.00 39.78 36.77 2k93 n ASN 24 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2k93 n ASN 25 N 13.92 0.00 -3.91 0.53 0.23 -1.26 -4.49 115.26 120.29 2k93 n ASN 25 Ca 0.45 0.00 -0.35 0.00 -0.53 0.00 0.00 54.58 54.15 2k93 n ASN 25 Cb 0.45 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.18 2k93 n ASN 25 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2k93 n ALA 26 N 0.00 -4.38 -2.83 -2.53 0.00 -0.34 -4.52 120.51 105.90 2k93 n ALA 26 Ca 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 53.44 53.00 2k93 n ALA 26 Cb 0.00 -1.19 0.01 0.00 0.00 0.00 0.00 19.45 18.27 2k93 n ALA 26 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2k93 n SER 27 N 2.93 0.31 0.01 0.00 7.64 -1.26 -3.20 113.62 120.05 2k93 n SER 27 Ca 0.02 -1.23 0.00 0.00 1.01 0.00 0.00 58.87 58.67 2k93 n SER 27 Cb 0.50 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 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 -1.31 -0.05 0.24 1.43 3.01 -0.54 -4.19 117.46 116.05 2k93 n PHE 28 Ca 0.03 0.01 0.13 0.00 1.01 0.00 0.00 57.45 58.63 2k93 n PHE 28 Cb 0.10 0.16 0.41 0.00 -0.01 0.00 0.00 39.48 40.13 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 0.11 0.00 -4.37 2.07 -1.84 1.83 116.25 114.04 2k93 h VAL 29 Ca 0.00 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.63 2k93 h VAL 29 Cb 0.64 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2k93 h VAL 29 CO 0.00 0.05 -1.55 -0.62 0.02 0.00 0.00 177.57 175.47 2k93 n GLU 30 N -3.14 0.64 0.00 1.57 -0.58 -1.26 -3.67 120.64 114.21 2k93 n GLU 30 Ca 0.02 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 2k93 n GLU 30 Cb 0.44 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 2k93 n GLU 30 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2k93 n ASP 31 N -1.93 0.00 -1.62 1.62 2.03 -1.12 -4.67 116.55 110.87 2k93 n ASP 31 Ca -0.01 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.22 2k93 n ASP 31 Cb 0.44 -0.28 0.16 0.00 -0.72 0.00 0.00 41.12 40.71 2k93 n ASP 31 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2k93 n LEU 32 N -2.43 4.82 -2.24 -2.67 7.99 0.24 -4.85 117.00 117.86 2k93 n LEU 32 Ca 0.00 -2.52 0.00 0.00 -0.01 0.00 0.00 56.01 53.48 2k93 n LEU 32 Cb 0.00 -0.68 0.00 0.00 -0.11 0.00 0.00 43.42 42.63 2k93 n LEU 32 CO 0.00 0.72 0.00 0.61 -1.51 0.00 0.00 177.39 177.21 2k93 n GLY 33 N -0.21 -0.43 3.33 -0.72 0.00 0.50 -1.58 105.19 106.08 2k93 n GLY 33 Ca 0.30 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.52 -2.08 4.61 0.00 0.50 -4.72 120.51 114.10 2k93 n ALA 34 Ca 0.00 0.54 -0.28 0.00 0.00 0.00 0.00 53.44 53.70 2k93 n ALA 34 Cb 0.43 -2.60 0.01 0.00 0.00 0.00 0.00 19.45 17.29 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 -1.89 6.02 0.02 0.00 -1.08 -0.62 -4.92 116.67 114.21 2k93 s ASP 35 Ca 0.32 1.04 -0.23 0.00 -0.52 0.00 0.00 52.55 53.16 2k93 s ASP 35 Cb -0.05 -2.16 -0.16 0.00 -1.46 0.00 0.00 42.92 39.09 2k93 s ASP 35 CO 0.85 -0.84 1.36 0.28 0.52 0.00 0.00 175.17 177.34 2k93 h SER 36 N -0.10 0.18 -0.53 -0.34 0.02 -1.92 0.12 113.55 110.98 2k93 h SER 36 Ca -0.46 -0.42 0.04 0.00 -0.84 0.00 0.00 61.79 60.11 2k93 h SER 36 Cb 1.22 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.68 2k93 h SER 36 CO 0.62 0.56 0.35 -0.07 -1.14 0.00 0.00 176.83 177.15 2k93 h LEU 37 N -0.20 0.48 0.12 5.07 3.38 -1.94 1.53 115.31 123.75 2k93 h LEU 37 Ca 0.02 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2k93 h LEU 37 Cb 0.50 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2k93 h LEU 37 CO 0.01 0.33 -0.06 0.44 0.09 0.00 0.00 178.44 179.25 2k93 h ASP 38 N 0.56 -0.14 0.34 -0.43 3.45 -1.63 1.16 116.42 119.73 2k93 h ASP 38 Ca 0.22 -0.40 -0.04 0.00 0.43 0.00 0.00 57.03 57.24 2k93 h ASP 38 Cb 0.17 0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 38.97 2k93 h ASP 38 CO -0.06 0.38 -0.19 0.74 -1.57 0.00 0.00 179.24 178.55 2k93 h THR 39 N -0.72 0.84 0.19 0.35 2.02 -0.15 -1.69 112.91 113.75 2k93 h THR 39 Ca -0.02 -0.72 -0.33 0.00 0.77 0.00 0.00 66.41 66.12 2k93 h THR 39 Cb 0.53 1.42 0.02 0.00 -1.74 0.00 0.00 68.15 68.38 2k93 h THR 39 CO 0.03 0.18 -1.56 0.58 0.37 0.00 0.00 175.52 175.12 2k93 h VAL 40 N 0.00 1.09 0.00 3.16 2.07 0.22 -3.26 116.25 119.53 2k93 h VAL 40 Ca -0.00 -2.55 0.00 0.00 0.82 0.00 0.00 66.70 64.97 2k93 h VAL 40 Cb 0.41 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 2k93 h VAL 40 CO 0.02 0.81 0.00 -0.33 0.02 0.00 0.00 177.57 178.10 2k93 h GLU 41 N 0.02 0.00 0.00 1.57 4.39 0.18 0.92 114.58 121.66 2k93 h GLU 41 Ca -0.30 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.23 2k93 h GLU 41 Cb 2.04 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.67 2k93 h GLU 41 CO 0.19 0.00 -0.78 1.25 -1.16 0.00 0.00 179.01 178.51 2k93 h LEU 42 N 0.00 0.00 0.00 1.33 5.85 -1.36 1.13 115.31 122.27 2k93 h LEU 42 Ca 0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 2k93 h LEU 42 Cb 0.13 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2k93 h LEU 42 CO 0.00 0.78 -0.68 0.58 -0.34 0.00 0.00 178.44 178.78 2k93 h VAL 43 N 0.00 0.57 0.05 1.05 2.07 -0.92 -3.05 116.25 116.02 2k93 h VAL 43 Ca -0.01 -1.87 -0.38 0.00 0.82 0.00 0.00 66.70 65.26 2k93 h VAL 43 Cb 1.54 2.19 -0.05 0.00 -1.52 0.00 0.00 31.29 33.45 2k93 h VAL 43 CO 0.10 0.33 -2.26 0.23 0.02 0.00 0.00 177.57 175.99 2k93 n MET 44 N -3.08 0.69 -0.07 1.57 2.81 -0.61 -3.28 117.12 115.17 2k93 n MET 44 Ca -0.01 0.19 -0.09 0.00 -1.81 0.00 0.00 57.70 55.99 2k93 n MET 44 Cb 0.71 -1.60 -0.02 0.00 -0.71 0.00 0.00 33.22 31.60 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 0.13 0.31 -0.18 3.04 0.00 0.12 0.82 119.26 123.50 2k93 h ALA 45 Ca -0.51 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 2k93 h ALA 45 Cb 1.98 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 2k93 h ALA 45 CO -0.01 -0.27 -0.34 -0.07 0.00 0.00 0.00 179.25 178.56 2k93 h LEU 46 N 0.26 0.37 0.01 0.00 3.38 -1.72 -1.44 115.31 116.18 2k93 h LEU 46 Ca 0.11 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2k93 h LEU 46 Cb 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2k93 h LEU 46 CO -0.08 0.69 -0.00 -0.33 0.09 0.00 0.00 178.44 178.81 2k93 h GLU 47 N 0.31 -0.01 0.00 1.13 5.08 -1.28 0.69 114.58 120.50 2k93 h GLU 47 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2k93 h GLU 47 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 2k93 h GLU 47 CO 0.06 0.33 0.00 -1.91 -1.00 0.00 0.00 179.01 176.48 2k93 n GLU 48 N -4.93 0.13 -0.02 2.33 2.13 0.27 0.20 120.64 120.74 2k93 n GLU 48 Ca -0.08 0.42 -0.01 0.00 0.66 0.00 0.00 57.16 58.15 2k93 n GLU 48 Cb 0.18 -1.77 -0.00 0.00 0.27 0.00 0.00 31.44 30.12 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 4.81 -0.79 -3.44 114.58 120.47 2k93 h GLU 49 Ca 0.00 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2k93 h GLU 49 Cb 0.26 0.00 -0.21 0.00 0.63 0.00 0.00 28.75 29.42 2k93 h GLU 49 CO 0.00 0.00 -0.77 1.19 -0.73 0.00 0.00 179.01 178.70 2k93 n PHE 50 N -3.10 0.00 -3.95 0.92 3.72 0.19 -5.01 117.46 110.24 2k93 n PHE 50 Ca -0.02 -0.79 -0.37 0.00 -0.05 0.00 0.00 57.45 56.23 2k93 n PHE 50 Cb 0.06 -0.17 0.01 0.00 -0.94 0.00 0.00 39.48 38.45 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 -0.15 -3.91 -0.01 4.37 2.03 0.53 -4.84 116.55 114.58 2k93 n ASP 51 Ca 0.10 -1.10 0.08 0.00 0.52 0.00 0.00 54.79 54.38 2k93 n ASP 51 Cb 0.94 -1.44 -0.12 0.00 -0.72 0.00 0.00 41.12 39.79 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 -4.01 0.00 -3.15 5.18 5.66 -1.21 -4.93 114.28 111.83 2k93 n THR 52 Ca -0.16 -0.32 -0.00 0.00 -3.05 0.00 0.00 64.05 60.51 2k93 n THR 52 Cb 0.55 0.28 -0.00 0.00 -1.55 0.00 0.00 70.33 69.60 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 -1.94 -0.62 -2.79 1.09 0.28 -1.26 -4.87 120.64 110.54 2k93 n GLU 53 Ca -0.02 0.96 -0.40 0.00 -0.16 0.00 0.00 57.16 57.53 2k93 n GLU 53 Cb 0.38 -1.16 -0.05 0.00 1.43 0.00 0.00 31.44 32.04 2k93 n GLU 53 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2k93 s ILE 54 N -0.83 4.35 0.00 3.84 -1.09 -1.25 -5.02 121.20 121.19 2k93 s ILE 54 Ca -0.00 1.99 0.00 0.00 -2.23 0.00 0.00 60.65 60.41 2k93 s ILE 54 Cb 0.00 -4.28 0.00 0.00 -1.58 0.00 0.00 42.46 36.60 2k93 s ILE 54 CO 0.04 0.41 0.00 -0.81 -1.23 0.00 0.00 174.94 173.35 2k93 n PRO 55 N 2.19 0.19 0.00 2.79 -0.04 -1.26 -4.51 135.00 134.37 2k93 n PRO 55 Ca -0.01 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.56 2k93 n PRO 55 Cb 0.48 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.83 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 -1.62 0.51 0.09 3.54 2.03 -1.26 -3.55 116.55 116.29 2k93 n ASP 56 Ca 0.00 -0.44 -0.20 0.00 0.52 0.00 0.00 54.79 54.67 2k93 n ASP 56 Cb 0.00 1.39 -0.15 0.00 -0.72 0.00 0.00 41.12 41.64 2k93 n ASP 56 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2k93 h GLU 57 N 0.00 0.36 0.00 -0.67 4.11 -2.02 -3.28 114.58 113.08 2k93 h GLU 57 Ca 0.00 -0.61 0.00 0.00 0.07 0.00 0.00 59.36 58.82 2k93 h GLU 57 Cb 0.75 0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.23 2k93 h GLU 57 CO 0.00 1.25 -0.09 0.39 0.07 0.00 0.00 179.01 180.63 2k93 n GLU 58 N -3.56 0.27 -0.07 1.06 -0.58 -1.26 -3.46 120.64 113.04 2k93 n GLU 58 Ca -0.19 0.20 -0.13 0.00 -0.42 0.00 0.00 57.16 56.62 2k93 n GLU 58 Cb 1.07 -1.79 -0.06 0.00 -0.57 0.00 0.00 31.44 30.09 2k93 n GLU 58 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k93 h ALA 59 N 2.52 0.32 -0.85 0.62 0.00 -1.62 -2.80 119.26 117.45 2k93 h ALA 59 Ca 0.00 -0.38 0.12 0.00 0.00 0.00 0.00 54.91 54.65 2k93 h ALA 59 Cb 0.74 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.38 2k93 h ALA 59 CO 0.00 0.29 0.46 1.49 0.00 0.00 0.00 179.25 181.50 2k93 h GLU 60 N 0.23 0.70 0.00 0.00 4.81 -1.62 1.10 114.58 119.81 2k93 h GLU 60 Ca 0.03 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2k93 h GLU 60 Cb 0.81 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.03 2k93 h GLU 60 CO 0.06 0.46 0.00 0.36 -0.73 0.00 0.00 179.01 179.16 2k93 n LYS 61 N -4.80 0.90 -1.28 1.92 2.85 -1.16 -2.56 118.16 114.03 2k93 n LYS 61 Ca 0.15 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.44 2k93 n LYS 61 Cb 0.36 -1.36 0.10 0.00 -0.65 0.00 0.00 35.03 33.48 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 -0.86 1.13 1.09 0.58 5.41 0.37 -4.79 119.36 122.29 2k93 n ILE 62 Ca 0.15 -2.24 0.00 0.00 1.00 0.00 0.00 62.75 61.67 2k93 n ILE 62 Cb 0.07 0.40 0.00 0.00 -0.71 0.00 0.00 39.64 39.40 2k93 n ILE 62 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2k93 n THR 63 N -0.30 0.00 -2.77 1.39 -2.24 -0.28 -4.76 114.28 105.33 2k93 n THR 63 Ca 0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 2k93 n THR 63 Cb 0.93 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 2k93 n THR 63 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2k93 n THR 64 N -0.05 0.00 -0.05 4.28 -2.24 -1.26 -1.47 114.28 113.49 2k93 n THR 64 Ca 0.00 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 2k93 n THR 64 Cb 0.22 -0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.41 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 0.00 0.71 0.18 2.28 0.31 -1.19 -4.53 118.33 116.09 2k93 n VAL 65 Ca 0.00 -0.11 0.09 0.00 -0.01 0.00 0.00 64.34 64.31 2k93 n VAL 65 Cb 0.00 -1.68 0.44 0.00 -0.91 0.00 0.00 33.84 31.69 2k93 n VAL 65 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2k93 n GLN 66 N -3.56 0.11 0.10 5.55 -0.06 -1.26 -0.64 117.38 117.62 2k93 n GLN 66 Ca -0.21 0.56 -0.05 0.00 -2.00 0.00 0.00 57.00 55.30 2k93 n GLN 66 Cb 0.61 -1.83 0.08 0.00 -4.06 0.00 0.00 30.24 25.03 2k93 n GLN 66 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2k93 h ALA 67 N 2.06 0.75 -0.07 1.69 0.00 -1.91 0.13 119.26 121.90 2k93 h ALA 67 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2k93 h ALA 67 Cb 0.06 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2k93 h ALA 67 CO 0.00 0.83 0.00 0.00 0.00 0.00 0.00 179.25 180.08 2k93 n ALA 68 N -2.45 2.57 -0.02 0.00 0.00 0.19 -2.36 120.51 118.44 2k93 n ALA 68 Ca -0.02 -0.42 0.01 0.00 0.00 0.00 0.00 53.44 53.00 2k93 n ALA 68 Cb 0.70 -1.18 -0.06 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 0.04 0.21 0.05 0.00 -0.00 -0.96 -3.96 119.36 114.74 2k93 n ILE 69 Ca 0.18 -0.25 0.00 0.00 -0.00 0.00 0.00 62.75 62.68 2k93 n ILE 69 Cb 0.30 -0.12 -0.07 0.00 -0.00 0.00 0.00 39.64 39.74 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 0.00 0.14 4.38 1.82 -0.78 -2.90 116.42 119.08 2k93 h ASP 70 Ca -0.08 0.00 -0.23 0.00 -0.39 0.00 0.00 57.03 56.32 2k93 h ASP 70 Cb 0.82 0.00 0.02 0.00 0.68 0.00 0.00 39.33 40.84 2k93 h ASP 70 CO 0.00 0.56 -1.08 0.22 -1.61 0.00 0.00 179.24 177.33 2k93 h TYR 71 N 0.00 0.56 -0.19 0.28 3.20 -1.70 -3.33 116.97 115.79 2k93 h TYR 71 Ca -0.14 -0.41 -0.11 0.00 3.14 0.00 0.00 58.73 61.21 2k93 h TYR 71 Cb 1.55 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.79 2k93 h TYR 71 CO 0.00 1.42 -0.37 0.82 -1.64 0.00 0.00 178.16 178.39 2k93 h ILE 72 N -0.30 1.30 -0.00 1.81 1.08 -1.72 -2.13 117.51 117.55 2k93 h ILE 72 Ca -0.21 -1.48 0.00 0.00 -0.39 0.00 0.00 64.86 62.78 2k93 h ILE 72 Cb 1.74 1.56 -0.00 0.00 -3.07 0.00 0.00 36.82 37.04 2k93 h ILE 72 CO 0.13 0.46 0.30 -1.13 -0.69 0.00 0.00 178.15 177.22 2k93 h ASN 73 N 0.35 0.00 0.27 1.72 -0.73 -1.61 1.02 115.58 116.60 2k93 h ASN 73 Ca 0.04 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.21 2k93 h ASN 73 Cb 0.81 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.40 2k93 h ASN 73 CO 0.07 0.00 0.00 0.61 -0.37 0.00 0.00 177.43 177.74 2k93 n GLY 74 N -1.20 -0.92 0.05 1.57 0.00 -0.80 -3.54 105.19 100.35 2k93 n GLY 74 Ca -0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 0.00 1.61 2.07 0.92 -3.50 115.15 116.25 2k93 h HIS 75 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2k93 h HIS 75 Cb 0.14 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.12 2k93 h HIS 75 CO 0.00 0.00 0.00 1.04 -3.07 0.00 0.00 177.93 175.90 2k93 n GLN 76 N -4.00 0.00 0.00 5.12 3.00 -1.23 -5.18 117.38 115.08 2k93 n GLN 76 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.94 2k93 n GLN 76 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.43 2k93 n GLN 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06