#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 3.60 0.00 2.46 -4.23 -1.26 -4.75 115.64 111.46 2k93 s THR 2 Ca 0.00 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 2k93 s THR 2 Cb 0.00 -3.45 0.00 0.00 1.34 0.00 0.00 72.50 70.39 2k93 s THR 2 CO 0.00 -0.48 0.47 -0.38 -0.54 0.00 0.00 174.62 173.69 2k93 n ILE 3 N -2.66 0.00 -0.32 2.99 2.08 -1.26 0.31 119.36 120.51 2k93 n ILE 3 Ca 0.05 0.97 0.01 0.00 0.56 0.00 0.00 62.75 64.34 2k93 n ILE 3 Cb 0.58 -1.54 0.08 0.00 -0.75 0.00 0.00 39.64 38.00 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 -0.02 0.00 0.38 4.81 -1.92 0.16 114.58 117.98 2k93 h GLU 4 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2k93 h GLU 4 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.39 2k93 h GLU 4 CO 0.00 -0.02 0.00 -1.91 -0.73 0.00 0.00 179.01 176.35 2k93 n GLU 5 N -5.52 0.00 0.08 1.92 2.13 -0.69 0.10 120.64 118.65 2k93 n GLU 5 Ca 0.11 0.88 -0.15 0.00 0.66 0.00 0.00 57.16 58.66 2k93 n GLU 5 Cb 0.42 -1.46 -0.09 0.00 0.27 0.00 0.00 31.44 30.58 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 -0.66 -0.83 5.31 3.08 0.85 -0.10 114.38 122.04 2k93 h ARG 6 Ca 0.00 0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.17 2k93 h ARG 6 Cb 0.00 0.15 -0.10 0.00 0.08 0.00 0.00 29.97 30.10 2k93 h ARG 6 CO 0.00 -0.44 -0.49 0.28 -1.07 0.00 0.00 179.97 178.25 2k93 h VAL 7 N -0.68 0.00 -0.42 2.04 2.07 -0.23 0.35 116.25 119.37 2k93 h VAL 7 Ca 0.02 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.61 2k93 h VAL 7 Cb 0.72 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.40 2k93 h VAL 7 CO -0.33 0.00 -0.41 0.50 0.02 0.00 0.00 177.57 177.35 2k93 h LYS 8 N -0.01 -0.29 -0.35 1.57 1.63 0.12 0.14 116.57 119.39 2k93 h LYS 8 Ca 0.13 0.02 0.04 0.00 -0.85 0.00 0.00 60.65 59.99 2k93 h LYS 8 Cb 0.35 0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 31.99 2k93 h LYS 8 CO -0.78 -0.20 -0.36 -0.22 -3.45 0.00 0.00 179.45 174.44 2k93 h LYS 9 N -0.30 -0.19 -0.39 1.90 1.63 0.14 1.29 116.57 120.65 2k93 h LYS 9 Ca 0.15 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 60.01 2k93 h LYS 9 Cb 0.58 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 32.18 2k93 h LYS 9 CO -0.58 -0.13 -0.45 0.82 -3.45 0.00 0.00 179.45 175.66 2k93 h ILE 10 N -0.20 0.00 -0.62 2.00 1.08 0.39 0.19 117.51 120.35 2k93 h ILE 10 Ca 0.06 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.65 2k93 h ILE 10 Cb 0.36 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 33.99 2k93 h ILE 10 CO -0.43 0.00 -0.17 0.40 -0.69 0.00 0.00 178.15 177.26 2k93 h ILE 11 N -0.27 0.36 -0.90 -0.67 2.04 0.31 0.75 117.51 119.12 2k93 h ILE 11 Ca 0.07 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.14 2k93 h ILE 11 Cb 0.45 0.36 -0.06 0.00 -0.74 0.00 0.00 36.82 36.83 2k93 h ILE 11 CO -0.51 0.00 0.60 1.23 0.00 0.00 0.00 178.15 179.47 2k93 h GLY 12 N -0.01 0.80 2.00 5.37 0.00 0.43 0.96 103.07 112.62 2k93 h GLY 12 Ca 0.30 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.45 2k93 h GLY 12 CO -0.64 -0.01 -0.05 -1.61 0.00 0.00 0.00 176.54 174.23 2k93 h GLN 13 N 0.37 0.00 -0.10 4.80 4.15 0.32 2.07 115.11 126.73 2k93 h GLN 13 Ca 0.47 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.89 2k93 h GLN 13 Cb 1.22 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.91 2k93 h GLN 13 CO -0.17 0.05 0.00 1.04 -1.93 0.00 0.00 178.83 177.82 2k93 n GLN 14 N -3.12 1.24 0.11 1.69 6.02 0.33 -4.47 117.38 119.18 2k93 n GLN 14 Ca 0.02 -0.37 0.00 0.00 -0.01 0.00 0.00 57.00 56.64 2k93 n GLN 14 Cb 0.46 -1.11 0.00 0.00 1.02 0.00 0.00 30.24 30.61 2k93 n GLN 14 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 2k93 n LEU 15 N -0.22 -1.61 0.00 1.08 -0.00 -1.04 -4.40 117.00 110.81 2k93 n LEU 15 Ca 0.05 0.41 0.00 0.00 -0.00 0.00 0.00 56.01 56.47 2k93 n LEU 15 Cb 0.09 1.70 0.00 0.00 -0.00 0.00 0.00 43.42 45.21 2k93 n LEU 15 CO 0.03 -0.24 0.00 0.61 -0.00 0.00 0.00 177.39 177.79 2k93 n GLY 16 N -0.63 -1.76 0.87 1.47 0.00 0.58 -5.10 105.19 100.62 2k93 n GLY 16 Ca 0.00 0.80 -0.16 0.00 0.00 0.00 0.00 46.02 46.66 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 -1.64 1.61 0.24 0.51 -4.85 118.33 114.19 2k93 n VAL 17 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2k93 n VAL 17 Cb 0.00 -0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.25 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 1.24 0.82 0.00 7.34 4.81 -1.26 -5.04 118.16 126.08 2k93 n LYS 18 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 2k93 n LYS 18 Cb -0.01 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.04 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 0.00 0.00 1.64 6.02 -1.26 -4.55 117.38 119.23 2k93 n GLN 19 Ca 0.00 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.10 2k93 n GLN 19 Cb 0.00 -0.68 -0.03 0.00 1.02 0.00 0.00 30.24 30.55 2k93 n GLN 19 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2k93 n GLU 20 N -2.21 1.05 -0.00 -1.09 2.13 -1.26 -3.69 120.64 115.57 2k93 n GLU 20 Ca 0.00 -0.81 0.07 0.00 0.66 0.00 0.00 57.16 57.08 2k93 n GLU 20 Cb 0.28 -1.47 -0.10 0.00 0.27 0.00 0.00 31.44 30.43 2k93 n GLU 20 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2k93 n GLU 21 N -0.29 1.51 -1.92 5.31 2.13 -1.26 -4.43 120.64 121.69 2k93 n GLU 21 Ca 0.08 -0.05 -0.11 0.00 0.66 0.00 0.00 57.16 57.75 2k93 n GLU 21 Cb 0.44 -1.26 0.06 0.00 0.27 0.00 0.00 31.44 30.95 2k93 n GLU 21 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2k93 n VAL 22 N -1.59 1.96 -0.73 6.31 0.31 -1.26 -4.90 118.33 118.43 2k93 n VAL 22 Ca 0.01 -3.47 -0.30 0.00 -0.01 0.00 0.00 64.34 60.57 2k93 n VAL 22 Cb 0.29 -0.22 0.27 0.00 -0.91 0.00 0.00 33.84 33.27 2k93 n VAL 22 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2k93 s THR 23 N -3.78 1.35 -0.01 2.52 -4.23 -1.24 -4.88 115.64 105.37 2k93 s THR 23 Ca 0.42 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.78 2k93 s THR 23 Cb 0.38 -2.29 -0.08 0.00 1.34 0.00 0.00 72.50 71.85 2k93 s THR 23 CO -0.02 0.00 0.76 0.78 -0.54 0.00 0.00 174.62 175.60 2k93 h ASN 24 N -3.06 -0.45 -0.56 3.99 2.35 -1.98 -3.21 115.58 112.66 2k93 h ASN 24 Ca -0.43 0.02 -0.34 0.00 -0.55 0.00 0.00 56.30 55.00 2k93 h ASN 24 Cb 1.31 0.12 -0.17 0.00 0.05 0.00 0.00 38.32 39.63 2k93 h ASN 24 CO 0.29 -0.15 0.43 -3.20 -1.65 0.00 0.00 177.43 173.14 2k93 n ASN 25 N -4.38 5.12 -4.71 5.81 2.85 -1.26 0.04 115.26 118.73 2k93 n ASN 25 Ca -0.07 -3.04 -0.42 0.00 -0.11 0.00 0.00 54.58 50.94 2k93 n ASN 25 Cb 0.21 -0.88 -0.03 0.00 1.24 0.00 0.00 39.78 40.32 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 -1.99 3.78 1.00 5.20 0.00 -1.21 -4.80 121.76 123.74 2k93 s ALA 26 Ca 0.34 1.37 -0.00 0.00 0.00 0.00 0.00 51.96 53.67 2k93 s ALA 26 Cb 0.28 -3.64 0.01 0.00 0.00 0.00 0.00 23.12 19.76 2k93 s ALA 26 CO 0.03 -0.83 0.04 0.43 0.00 0.00 0.00 175.76 175.43 2k93 n SER 27 N 4.16 -0.02 0.00 0.00 7.64 -1.26 -0.52 113.62 123.63 2k93 n SER 27 Ca 0.14 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 59.02 2k93 n SER 27 Cb 0.38 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 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 -2.06 -0.04 -0.27 1.43 3.01 -1.26 -3.91 117.46 114.37 2k93 n PHE 28 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.49 2k93 n PHE 28 Cb 0.02 0.20 0.11 0.00 -0.01 0.00 0.00 39.48 39.79 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 0.25 0.00 -4.37 2.07 -1.91 1.64 116.25 113.93 2k93 h VAL 29 Ca 0.00 -0.01 -0.16 0.00 0.82 0.00 0.00 66.70 67.35 2k93 h VAL 29 Cb 0.00 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 2k93 h VAL 29 CO 0.00 0.00 -1.57 1.21 0.02 0.00 0.00 177.57 177.23 2k93 n GLU 30 N -5.48 0.23 -0.20 1.57 2.13 -1.26 -2.95 120.64 114.69 2k93 n GLU 30 Ca 0.11 0.08 -0.03 0.00 0.66 0.00 0.00 57.16 57.98 2k93 n GLU 30 Cb 0.41 -1.01 0.03 0.00 0.27 0.00 0.00 31.44 31.14 2k93 n GLU 30 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 2k93 h ASP 31 N -0.21 -0.92 -0.24 4.31 1.82 -1.77 -0.38 116.42 119.04 2k93 h ASP 31 Ca -0.24 0.21 -0.05 0.00 -0.39 0.00 0.00 57.03 56.55 2k93 h ASP 31 Cb 1.28 0.49 -0.03 0.00 0.68 0.00 0.00 39.33 41.75 2k93 h ASP 31 CO -0.10 -0.27 -0.03 0.18 -1.61 0.00 0.00 179.24 177.40 2k93 n LEU 32 N -5.44 3.67 -2.30 2.28 7.99 -0.52 -4.91 117.00 117.78 2k93 n LEU 32 Ca 0.05 -3.27 -0.02 0.00 -0.01 0.00 0.00 56.01 52.77 2k93 n LEU 32 Cb 0.35 -0.55 -0.00 0.00 -0.11 0.00 0.00 43.42 43.10 2k93 n LEU 32 CO 0.03 0.86 -0.01 0.61 -1.51 0.00 0.00 177.39 177.37 2k93 n GLY 33 N -0.86 -0.42 3.10 -0.72 0.00 0.70 -2.08 105.19 104.92 2k93 n GLY 33 Ca 0.24 0.00 -0.24 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 -2.04 -2.72 4.61 0.00 0.53 -4.88 120.51 113.81 2k93 n ALA 34 Ca 0.01 0.19 -0.37 0.00 0.00 0.00 0.00 53.44 53.27 2k93 n ALA 34 Cb 0.42 -1.46 -0.07 0.00 0.00 0.00 0.00 19.45 18.35 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 -1.14 6.53 0.41 0.00 1.11 -0.88 -4.95 116.67 117.74 2k93 s ASP 35 Ca 0.23 0.63 0.22 0.00 0.18 0.00 0.00 52.55 53.81 2k93 s ASP 35 Cb -0.02 -2.22 1.20 0.00 1.07 0.00 0.00 42.92 42.94 2k93 s ASP 35 CO 0.52 0.06 1.72 0.28 1.18 0.00 0.00 175.17 178.92 2k93 h SER 36 N 6.71 0.39 -0.44 0.27 0.02 -1.93 1.60 113.55 120.17 2k93 h SER 36 Ca -0.41 0.11 -0.08 0.00 -0.84 0.00 0.00 61.79 60.57 2k93 h SER 36 Cb 1.17 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.75 2k93 h SER 36 CO 0.76 -0.01 0.00 -0.07 -1.14 0.00 0.00 176.83 176.37 2k93 h LEU 37 N 0.29 0.81 -0.07 5.07 3.38 -1.93 0.63 115.31 123.49 2k93 h LEU 37 Ca 0.68 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.42 2k93 h LEU 37 Cb 1.85 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.38 2k93 h LEU 37 CO -0.36 0.88 -0.04 0.44 0.09 0.00 0.00 178.44 179.45 2k93 h ASP 38 N 0.79 0.16 -0.26 -0.43 3.45 0.20 1.59 116.42 121.92 2k93 h ASP 38 Ca 0.15 -0.43 -0.06 0.00 0.43 0.00 0.00 57.03 57.12 2k93 h ASP 38 Cb 0.47 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 39.18 2k93 h ASP 38 CO 0.02 0.55 -0.04 0.74 -1.57 0.00 0.00 179.24 178.94 2k93 h THR 39 N -0.23 1.22 0.16 0.35 2.02 -0.60 -1.22 112.91 114.61 2k93 h THR 39 Ca 0.02 -0.94 -0.31 0.00 0.77 0.00 0.00 66.41 65.94 2k93 h THR 39 Cb 0.49 0.99 0.03 0.00 -1.74 0.00 0.00 68.15 67.92 2k93 h THR 39 CO 0.01 0.32 -1.32 0.58 0.37 0.00 0.00 175.52 175.48 2k93 h VAL 40 N 0.57 1.28 0.00 3.16 2.07 0.37 -3.12 116.25 120.59 2k93 h VAL 40 Ca 0.11 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 65.10 2k93 h VAL 40 Cb 0.43 2.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.99 2k93 h VAL 40 CO 0.02 0.77 0.00 -0.33 0.02 0.00 0.00 177.57 178.05 2k93 h GLU 41 N 0.24 0.00 0.01 1.57 4.39 0.26 -0.55 114.58 120.50 2k93 h GLU 41 Ca -0.21 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.25 2k93 h GLU 41 Cb 2.00 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.65 2k93 h GLU 41 CO 0.25 0.00 -0.97 1.25 -1.16 0.00 0.00 179.01 178.38 2k93 h LEU 42 N 0.00 0.59 -0.45 1.33 6.46 -1.16 1.41 115.31 123.49 2k93 h LEU 42 Ca 0.00 -0.48 -0.10 0.00 -0.12 0.00 0.00 57.88 57.19 2k93 h LEU 42 Cb 0.15 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.89 2k93 h LEU 42 CO 0.00 1.28 -0.46 0.58 -0.62 0.00 0.00 178.44 179.22 2k93 h VAL 43 N 0.25 0.89 0.09 1.05 2.07 -1.16 -2.41 116.25 117.03 2k93 h VAL 43 Ca -0.09 -1.93 -0.35 0.00 0.82 0.00 0.00 66.70 65.15 2k93 h VAL 43 Cb 1.62 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 33.56 2k93 h VAL 43 CO 0.17 0.45 -1.96 0.23 0.02 0.00 0.00 177.57 176.48 2k93 n MET 44 N -3.36 0.72 0.04 1.57 2.81 -0.62 -2.91 117.12 115.37 2k93 n MET 44 Ca 0.01 0.29 -0.11 0.00 -1.81 0.00 0.00 57.70 56.08 2k93 n MET 44 Cb 0.63 -1.69 -0.06 0.00 -0.71 0.00 0.00 33.22 31.40 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 -0.04 -0.05 -0.10 3.04 0.00 0.19 0.93 119.26 123.23 2k93 h ALA 45 Ca -0.44 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 2k93 h ALA 45 Cb 1.91 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 2k93 h ALA 45 CO 0.01 -0.55 -0.27 -0.07 0.00 0.00 0.00 179.25 178.38 2k93 h LEU 46 N -0.09 0.18 -0.13 0.00 3.38 -1.61 -0.15 115.31 116.88 2k93 h LEU 46 Ca 0.03 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2k93 h LEU 46 Cb 0.13 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2k93 h LEU 46 CO -0.06 0.45 -0.08 -0.33 0.09 0.00 0.00 178.44 178.51 2k93 h GLU 47 N 0.16 0.29 0.00 1.13 5.08 -1.15 0.67 114.58 120.76 2k93 h GLU 47 Ca 0.03 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2k93 h GLU 47 Cb 0.57 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2k93 h GLU 47 CO 0.04 0.64 0.00 -1.91 -1.00 0.00 0.00 179.01 176.78 2k93 n GLU 48 N -4.65 0.16 -0.01 2.33 2.13 0.31 0.59 120.64 121.51 2k93 n GLU 48 Ca -0.06 0.34 -0.00 0.00 0.66 0.00 0.00 57.16 58.09 2k93 n GLU 48 Cb 0.31 -1.78 -0.00 0.00 0.27 0.00 0.00 31.44 30.24 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 -0.10 5.31 4.81 -0.70 -3.44 114.58 120.46 2k93 h GLU 49 Ca 0.00 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 2k93 h GLU 49 Cb 0.42 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 29.55 2k93 h GLU 49 CO 0.00 0.00 -0.83 1.19 -0.73 0.00 0.00 179.01 178.64 2k93 n PHE 50 N -2.45 0.34 -3.66 0.92 3.72 0.19 -4.96 117.46 111.56 2k93 n PHE 50 Ca -0.01 -1.17 -0.25 0.00 -0.05 0.00 0.00 57.45 55.97 2k93 n PHE 50 Cb 0.02 -0.21 -0.05 0.00 -0.94 0.00 0.00 39.48 38.30 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 -0.31 -1.46 0.21 4.37 -0.08 0.20 -4.72 116.55 114.76 2k93 n ASP 51 Ca 0.14 -0.52 0.10 0.00 -1.51 0.00 0.00 54.79 53.00 2k93 n ASP 51 Cb 0.93 -1.33 0.33 0.00 2.34 0.00 0.00 41.12 43.39 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 -0.50 0.37 -6.29 5.18 1.35 -1.68 -3.46 112.91 107.87 2k93 h THR 52 Ca -0.35 -1.22 0.00 0.00 -0.55 0.00 0.00 66.41 64.30 2k93 h THR 52 Cb 1.20 1.93 -0.00 0.00 -1.73 0.00 0.00 68.15 69.55 2k93 h THR 52 CO 0.52 0.18 -0.77 -1.84 -0.25 0.00 0.00 175.52 173.36 2k93 n GLU 53 N -3.22 -0.57 -3.39 4.72 0.28 -1.26 -4.90 120.64 112.30 2k93 n GLU 53 Ca 0.02 0.92 -0.38 0.00 -0.16 0.00 0.00 57.16 57.55 2k93 n GLU 53 Cb 0.50 -1.03 -0.06 0.00 1.43 0.00 0.00 31.44 32.28 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 -0.78 4.98 0.00 3.84 2.07 -1.26 -5.00 121.20 125.05 2k93 s ILE 54 Ca -0.00 0.98 0.00 0.00 -1.41 0.00 0.00 60.65 60.22 2k93 s ILE 54 Cb 0.00 -3.79 0.00 0.00 0.13 0.00 0.00 42.46 38.80 2k93 s ILE 54 CO 0.02 0.51 0.00 -0.81 -1.91 0.00 0.00 174.94 172.75 2k93 n PRO 55 N 2.22 -0.39 -0.00 3.50 -0.04 -1.26 -4.15 135.00 134.88 2k93 n PRO 55 Ca -0.11 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.45 2k93 n PRO 55 Cb 0.52 0.00 -0.14 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 -2.79 0.60 -0.06 3.54 -0.08 -1.26 -3.53 116.55 112.97 2k93 n ASP 56 Ca 0.00 -0.51 -0.05 0.00 -1.51 0.00 0.00 54.79 52.73 2k93 n ASP 56 Cb 0.00 1.46 -0.04 0.00 2.34 0.00 0.00 41.12 44.88 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 5.08 -2.01 -3.19 114.58 113.79 2k93 h GLU 57 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2k93 h GLU 57 Cb 0.71 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 2k93 h GLU 57 CO 0.00 0.31 -0.04 0.93 -1.00 0.00 0.00 179.01 179.22 2k93 h GLU 58 N -1.00 0.00 -0.11 2.33 4.39 -1.98 -2.30 114.58 115.92 2k93 h GLU 58 Ca -0.01 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.60 2k93 h GLU 58 Cb 0.33 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2k93 h GLU 58 CO -0.00 0.04 -0.37 0.00 -1.16 0.00 0.00 179.01 177.51 2k93 h ALA 59 N 1.96 1.18 -0.91 3.43 0.00 -1.67 -2.71 119.26 120.56 2k93 h ALA 59 Ca -0.00 -0.38 0.07 0.00 0.00 0.00 0.00 54.91 54.60 2k93 h ALA 59 Cb 0.51 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 2k93 h ALA 59 CO 0.00 0.55 0.56 0.93 0.00 0.00 0.00 179.25 181.30 2k93 h GLU 60 N 0.19 0.98 -0.11 0.00 5.08 -1.39 0.64 114.58 119.96 2k93 h GLU 60 Ca 0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2k93 h GLU 60 Cb 0.74 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2k93 h GLU 60 CO 0.06 0.65 0.00 0.36 -1.00 0.00 0.00 179.01 179.07 2k93 n LYS 61 N -4.60 1.33 -0.55 2.33 2.85 -1.04 -2.96 118.16 115.52 2k93 n LYS 61 Ca 0.14 -0.51 0.03 0.00 -1.05 0.00 0.00 58.31 56.92 2k93 n LYS 61 Cb 0.21 -1.22 0.05 0.00 -0.65 0.00 0.00 35.03 33.41 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 -0.18 0.57 0.36 0.58 5.41 0.18 -4.88 119.36 121.39 2k93 n ILE 62 Ca 0.10 -0.86 -0.16 0.00 1.00 0.00 0.00 62.75 62.83 2k93 n ILE 62 Cb 0.15 0.36 -0.08 0.00 -0.71 0.00 0.00 39.64 39.36 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 5.03 0.00 -1.92 1.39 1.35 -0.07 -3.38 112.91 115.32 2k93 h THR 63 Ca -0.03 0.00 -0.53 0.00 -0.55 0.00 0.00 66.41 65.30 2k93 h THR 63 Cb 1.36 0.00 0.23 0.00 -1.73 0.00 0.00 68.15 68.00 2k93 h THR 63 CO 0.01 0.00 -1.78 0.35 -0.25 0.00 0.00 175.52 173.86 2k93 n THR 64 N -4.94 0.00 0.22 6.82 -2.24 -1.26 -4.73 114.28 108.14 2k93 n THR 64 Ca -0.12 -0.48 -0.09 0.00 -2.27 0.00 0.00 64.05 61.09 2k93 n THR 64 Cb 0.41 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.60 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 -0.94 0.00 -0.23 2.28 2.07 -0.95 -2.97 116.25 115.51 2k93 h VAL 65 Ca -0.42 -0.43 0.07 0.00 0.82 0.00 0.00 66.70 66.73 2k93 h VAL 65 Cb 1.25 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2k93 h VAL 65 CO 0.22 0.00 0.60 -0.61 0.02 0.00 0.00 177.57 177.80 2k93 h GLN 66 N -1.04 0.00 0.00 1.57 5.75 -0.64 1.79 115.11 122.54 2k93 h GLN 66 Ca -0.06 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.34 2k93 h GLN 66 Cb 0.47 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 2k93 h GLN 66 CO 0.10 0.00 -0.45 0.00 -2.65 0.00 0.00 178.83 175.83 2k93 h ALA 67 N 1.02 1.25 -0.03 3.38 0.00 -1.79 -0.86 119.26 122.22 2k93 h ALA 67 Ca 0.11 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2k93 h ALA 67 Cb 1.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2k93 h ALA 67 CO -0.00 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.81 2k93 n ALA 68 N -2.45 2.59 -0.07 0.00 0.00 0.61 -2.54 120.51 118.65 2k93 n ALA 68 Ca -0.02 -0.20 -0.10 0.00 0.00 0.00 0.00 53.44 53.13 2k93 n ALA 68 Cb 0.47 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.61 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 -0.56 0.76 0.17 0.00 -0.00 -0.45 -3.82 119.36 115.47 2k93 n ILE 69 Ca 0.14 -0.28 0.01 0.00 -0.00 0.00 0.00 62.75 62.62 2k93 n ILE 69 Cb 0.12 -1.02 0.32 0.00 -0.00 0.00 0.00 39.64 39.06 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 -0.04 0.04 0.25 4.38 3.58 -1.23 0.41 116.42 123.82 2k93 h ASP 70 Ca -0.30 -0.01 -0.33 0.00 0.42 0.00 0.00 57.03 56.80 2k93 h ASP 70 Cb 1.45 -0.01 0.04 0.00 1.72 0.00 0.00 39.33 42.53 2k93 h ASP 70 CO -0.06 0.43 -1.47 0.22 -2.88 0.00 0.00 179.24 175.48 2k93 h TYR 71 N 0.03 0.98 -0.10 0.28 3.20 -1.73 -3.30 116.97 116.33 2k93 h TYR 71 Ca -0.00 -0.71 -0.16 0.00 3.14 0.00 0.00 58.73 61.00 2k93 h TYR 71 Cb 0.72 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 2k93 h TYR 71 CO 0.00 1.56 -0.62 0.82 -1.64 0.00 0.00 178.16 178.29 2k93 h ILE 72 N 0.13 1.37 -0.37 1.81 1.08 -1.62 -2.71 117.51 117.20 2k93 h ILE 72 Ca -0.26 -1.97 0.11 0.00 -0.39 0.00 0.00 64.86 62.35 2k93 h ILE 72 Cb 2.16 1.97 -0.01 0.00 -3.07 0.00 0.00 36.82 37.86 2k93 h ILE 72 CO 0.27 0.59 0.52 -1.13 -0.69 0.00 0.00 178.15 177.71 2k93 h ASN 73 N 0.26 0.00 0.00 1.72 -0.73 -0.25 0.60 115.58 117.19 2k93 h ASN 73 Ca -0.01 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.16 2k93 h ASN 73 Cb 1.15 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.74 2k93 h ASN 73 CO 0.10 0.00 0.08 1.23 -0.37 0.00 0.00 177.43 178.48 2k93 h GLY 74 N 0.00 0.00 0.00 1.57 0.00 -1.60 -2.48 103.07 100.56 2k93 h GLY 74 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2k93 h GLY 74 CO -0.00 0.00 -0.04 0.84 0.00 0.00 0.00 176.54 177.34 2k93 h HIS 75 N 0.00 0.00 -1.87 5.60 -0.00 0.00 -3.42 115.15 115.47 2k93 h HIS 75 Ca 0.00 0.00 -0.48 0.00 -0.00 0.00 0.00 60.37 59.89 2k93 h HIS 75 Cb 0.17 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.55 2k93 h HIS 75 CO 0.00 0.00 1.36 -0.65 -0.00 0.00 0.00 177.93 178.64 2k93 s GLN 76 N -1.48 2.54 0.00 5.26 -0.21 -0.93 -5.20 119.66 119.64 2k93 s GLN 76 Ca -0.01 0.68 0.00 0.00 0.02 0.00 0.00 55.36 56.05 2k93 s GLN 76 Cb 0.00 -4.44 0.00 0.00 1.00 0.00 0.00 33.01 29.57 2k93 s GLN 76 CO 0.02 -2.85 0.17 0.00 -2.12 0.00 0.00 175.29 170.51