#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k94 n THR 2 N 0.00 0.00 0.18 6.66 -2.24 -1.26 -4.77 114.28 112.85 2k94 n THR 2 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 2k94 n THR 2 Cb 0.00 -0.25 -0.07 0.00 -2.10 0.00 0.00 70.33 67.90 2k94 n THR 2 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2k94 h ILE 3 N -2.21 0.51 0.00 2.28 1.08 -1.90 -2.92 117.51 114.35 2k94 h ILE 3 Ca -0.10 -0.63 0.00 0.00 -0.39 0.00 0.00 64.86 63.73 2k94 h ILE 3 Cb 0.34 0.77 0.00 0.00 -3.07 0.00 0.00 36.82 34.86 2k94 h ILE 3 CO 0.06 0.10 0.00 1.05 -0.69 0.00 0.00 178.15 178.67 2k94 h GLU 4 N -0.91 0.00 -0.85 2.37 9.09 -1.90 -1.98 114.58 120.40 2k94 h GLU 4 Ca -0.05 0.00 0.09 0.00 0.05 0.00 0.00 59.36 59.45 2k94 h GLU 4 Cb 0.54 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 27.58 2k94 h GLU 4 CO 0.08 0.00 0.55 1.49 0.05 0.00 0.00 179.01 181.18 2k94 h GLU 5 N 0.00 0.82 0.02 1.06 4.57 -1.81 1.29 114.58 120.53 2k94 h GLU 5 Ca 0.00 -0.05 -0.24 0.00 -1.18 0.00 0.00 59.36 57.89 2k94 h GLU 5 Cb 0.12 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 2k94 h GLU 5 CO 0.00 0.54 -1.23 0.00 -1.18 0.00 0.00 179.01 177.14 2k94 h ARG 6 N 0.84 0.04 -0.01 1.92 3.08 -1.43 -3.26 114.38 115.56 2k94 h ARG 6 Ca 0.38 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.35 2k94 h ARG 6 Cb 0.38 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2k94 h ARG 6 CO -0.15 0.91 -0.03 0.28 -1.07 0.00 0.00 179.97 179.91 2k94 h VAL 7 N 0.01 1.52 -0.68 2.04 2.07 -1.11 -3.27 116.25 116.83 2k94 h VAL 7 Ca -0.10 -1.57 0.14 0.00 0.82 0.00 0.00 66.70 65.99 2k94 h VAL 7 Cb 1.86 2.57 -0.12 0.00 -1.52 0.00 0.00 31.29 34.08 2k94 h VAL 7 CO 0.13 0.41 -0.11 0.11 0.02 0.00 0.00 177.57 178.13 2k94 h LYS 8 N -0.62 0.03 0.00 1.57 6.56 0.15 0.43 116.57 124.68 2k94 h LYS 8 Ca -0.00 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2k94 h LYS 8 Cb 0.69 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.34 2k94 h LYS 8 CO 0.01 0.02 0.00 1.63 -2.06 0.00 0.00 179.45 179.05 2k94 n LYS 9 N -5.41 0.00 -0.29 3.15 5.02 -1.23 -0.23 118.16 119.16 2k94 n LYS 9 Ca 0.09 0.24 0.11 0.00 -2.02 0.00 0.00 58.31 56.73 2k94 n LYS 9 Cb 0.37 -0.83 0.25 0.00 -0.02 0.00 0.00 35.03 34.80 2k94 n LYS 9 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2k94 h ILE 10 N 0.00 0.26 0.00 -0.18 5.03 -1.60 0.47 117.51 121.49 2k94 h ILE 10 Ca 0.00 -0.04 0.00 0.00 -0.12 0.00 0.00 64.86 64.70 2k94 h ILE 10 Cb 0.00 0.12 0.00 0.00 -3.03 0.00 0.00 36.82 33.91 2k94 h ILE 10 CO 0.00 0.02 0.00 -0.38 -0.68 0.00 0.00 178.15 177.11 2k94 n ILE 11 N -5.32 0.00 -0.25 -0.67 2.08 0.15 -0.27 119.36 115.08 2k94 n ILE 11 Ca 0.19 0.91 0.05 0.00 0.56 0.00 0.00 62.75 64.46 2k94 n ILE 11 Cb 0.63 -1.54 0.18 0.00 -0.75 0.00 0.00 39.64 38.16 2k94 n ILE 11 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2k94 h GLY 12 N 0.00 1.07 -0.14 7.39 0.00 -0.30 -2.59 103.07 108.50 2k94 h GLY 12 Ca 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.25 2k94 h GLY 12 CO 0.00 -0.13 -0.10 1.46 0.00 0.00 0.00 176.54 177.76 2k94 h GLN 13 N 0.36 -0.02 -0.77 4.80 7.50 0.35 1.20 115.11 128.54 2k94 h GLN 13 Ca 0.40 0.00 0.07 0.00 0.50 0.00 0.00 58.65 59.62 2k94 h GLN 13 Cb 0.64 0.00 -0.09 0.00 0.05 0.00 0.00 27.48 28.08 2k94 h GLN 13 CO -0.44 -0.01 -0.45 1.04 -1.50 0.00 0.00 178.83 177.46 2k94 n GLN 14 N -3.33 -0.34 0.16 1.46 6.02 0.63 -1.48 117.38 120.49 2k94 n GLN 14 Ca 0.00 1.27 -0.08 0.00 -0.01 0.00 0.00 57.00 58.18 2k94 n GLN 14 Cb 0.05 -1.87 -0.04 0.00 1.02 0.00 0.00 30.24 29.39 2k94 n GLN 14 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2k94 h LEU 15 N 0.00 -0.56 0.00 1.08 -0.00 -1.15 -3.48 115.31 111.20 2k94 h LEU 15 Ca 0.12 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 2k94 h LEU 15 Cb 0.32 0.17 0.00 0.00 -0.00 0.00 0.00 40.66 41.15 2k94 h LEU 15 CO -0.72 -0.31 0.00 0.61 -0.00 0.00 0.00 178.44 178.02 2k94 n GLY 16 N -1.26 0.11 3.24 0.83 0.00 0.40 -5.11 105.19 103.40 2k94 n GLY 16 Ca -0.06 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.43 2k94 n GLY 16 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k94 s VAL 17 N 0.00 0.01 0.66 1.61 -7.23 -1.07 -5.01 120.40 109.37 2k94 s VAL 17 Ca 0.00 -0.11 -0.17 0.00 -1.81 0.00 0.00 61.98 59.89 2k94 s VAL 17 Cb 0.00 -0.52 -0.03 0.00 0.56 0.00 0.00 36.38 36.39 2k94 s VAL 17 CO 0.00 -0.06 0.83 2.29 -0.31 0.00 0.00 175.10 177.85 2k94 n LYS 18 N 2.52 0.61 0.13 4.82 2.85 -1.26 -4.09 118.16 123.74 2k94 n LYS 18 Ca -0.15 0.25 0.18 0.00 -1.05 0.00 0.00 58.31 57.54 2k94 n LYS 18 Cb 0.57 -2.06 0.76 0.00 -0.65 0.00 0.00 35.03 33.65 2k94 n LYS 18 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 177.40 176.79 2k94 h GLN 19 N 0.06 0.00 -0.40 -1.58 -0.00 -1.92 0.16 115.11 111.43 2k94 h GLN 19 Ca -0.47 0.00 -0.11 0.00 -0.00 0.00 0.00 58.65 58.07 2k94 h GLN 19 Cb 1.36 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.82 2k94 h GLN 19 CO 0.48 0.00 -0.21 1.49 -0.00 0.00 0.00 178.83 180.59 2k94 h GLU 20 N 0.00 0.78 0.82 0.06 4.81 -1.98 -3.21 114.58 115.86 2k94 h GLU 20 Ca 0.15 -0.30 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 2k94 h GLU 20 Cb 0.72 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.06 2k94 h GLU 20 CO -0.00 0.92 -0.39 1.49 -0.73 0.00 0.00 179.01 180.29 2k94 h GLU 21 N 0.68 -1.06 -6.02 1.92 4.22 -1.00 -3.42 114.58 109.90 2k94 h GLU 21 Ca 0.10 0.07 -0.81 0.00 0.08 0.00 0.00 59.36 58.80 2k94 h GLU 21 Cb 0.71 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 2k94 h GLU 21 CO 0.05 -0.70 0.97 0.28 -2.18 0.00 0.00 179.01 177.43 2k94 n VAL 22 N -5.55 0.05 -2.24 0.32 0.31 -1.14 -4.92 118.33 105.16 2k94 n VAL 22 Ca -0.15 -0.02 -0.04 0.00 -0.01 0.00 0.00 64.34 64.12 2k94 n VAL 22 Cb 0.44 -0.67 0.02 0.00 -0.91 0.00 0.00 33.84 32.73 2k94 n VAL 22 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2k94 n THR 23 N 5.09 0.00 0.14 2.52 -1.04 -1.26 -5.00 114.28 114.74 2k94 n THR 23 Ca 0.39 -0.27 0.05 0.00 -2.04 0.00 0.00 64.05 62.18 2k94 n THR 23 Cb -0.01 -1.33 -0.08 0.00 -1.82 0.00 0.00 70.33 67.09 2k94 n THR 23 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2k94 n ASN 24 N -2.99 1.90 -3.49 8.00 4.13 -1.26 -3.52 115.26 118.02 2k94 n ASN 24 Ca 0.03 -0.22 -0.27 0.00 1.68 0.00 0.00 54.58 55.80 2k94 n ASN 24 Cb 0.10 1.36 -0.09 0.00 -1.54 0.00 0.00 39.78 39.61 2k94 n ASN 24 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2k94 n ASN 25 N -1.70 2.15 0.00 6.41 5.15 -1.26 -3.91 115.26 122.10 2k94 n ASN 25 Ca -0.01 -3.06 0.00 0.00 -0.60 0.00 0.00 54.58 50.91 2k94 n ASN 25 Cb 0.25 -0.67 0.00 0.00 -0.53 0.00 0.00 39.78 38.83 2k94 n ASN 25 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k94 n ALA 26 N 1.56 0.00 -3.52 5.20 0.00 -1.26 -5.09 120.51 117.40 2k94 n ALA 26 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2k94 n ALA 26 Cb 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.85 2k94 n ALA 26 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k94 s SER 27 N 1.00 -1.18 0.00 0.00 0.15 -1.26 -4.65 113.70 107.76 2k94 s SER 27 Ca 0.00 1.38 0.11 0.00 0.70 0.00 0.00 55.95 58.14 2k94 s SER 27 Cb 0.00 2.25 0.62 0.00 -1.71 0.00 0.00 66.02 67.18 2k94 s SER 27 CO 0.00 -0.22 1.40 0.49 1.20 0.00 0.00 173.24 176.11 2k94 n PHE 28 N 5.43 0.03 -0.07 3.44 3.01 -0.80 -0.74 117.46 127.76 2k94 n PHE 28 Ca -0.09 -0.02 -0.16 0.00 1.01 0.00 0.00 57.45 58.20 2k94 n PHE 28 Cb 0.50 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.83 2k94 n PHE 28 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2k94 n VAL 29 N -0.56 1.56 0.08 -4.37 0.31 -1.25 -1.02 118.33 113.09 2k94 n VAL 29 Ca 0.08 -0.69 0.00 0.00 -0.01 0.00 0.00 64.34 63.72 2k94 n VAL 29 Cb 0.06 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 2k94 n VAL 29 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2k94 n GLU 30 N -3.17 0.00 0.00 5.55 1.02 -1.19 -4.07 120.64 118.78 2k94 n GLU 30 Ca -0.35 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.79 2k94 n GLU 30 Cb 1.05 -0.24 0.00 0.00 -0.02 0.00 0.00 31.44 32.23 2k94 n GLU 30 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2k94 n ASP 31 N -3.36 0.00 0.19 1.62 2.03 -0.33 -1.01 116.55 115.70 2k94 n ASP 31 Ca 0.00 0.98 0.12 0.00 0.52 0.00 0.00 54.79 56.41 2k94 n ASP 31 Cb 0.05 -0.49 0.19 0.00 -0.72 0.00 0.00 41.12 40.15 2k94 n ASP 31 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2k94 h LEU 32 N 0.00 0.00 -2.06 -2.67 4.07 -1.22 -3.49 115.31 109.94 2k94 h LEU 32 Ca 0.00 -0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.96 2k94 h LEU 32 Cb 0.00 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 41.65 2k94 h LEU 32 CO 0.00 0.00 -1.40 0.61 -1.08 0.00 0.00 178.44 176.57 2k94 n GLY 33 N 1.14 -4.98 2.88 0.83 0.00 -0.18 -4.99 105.19 99.90 2k94 n GLY 33 Ca 0.04 1.37 -0.30 0.00 0.00 0.00 0.00 46.02 47.13 2k94 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k94 s ALA 34 N -0.99 2.03 1.01 4.61 0.00 -0.19 -4.96 121.76 123.27 2k94 s ALA 34 Ca -0.19 -1.78 -0.16 0.00 0.00 0.00 0.00 51.96 49.83 2k94 s ALA 34 Cb 0.01 -1.64 0.09 0.00 0.00 0.00 0.00 23.12 21.58 2k94 s ALA 34 CO 0.79 -1.50 -0.08 -0.40 0.00 0.00 0.00 175.76 174.57 2k94 n ASP 35 N 4.63 -2.74 0.01 0.00 5.68 -1.26 -3.95 116.55 118.91 2k94 n ASP 35 Ca -0.04 -0.23 0.06 0.00 -0.50 0.00 0.00 54.79 54.08 2k94 n ASP 35 Cb 0.43 -0.76 0.25 0.00 -1.14 0.00 0.00 41.12 39.89 2k94 n ASP 35 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2k94 n SER 36 N -0.40 0.03 0.00 -1.12 3.41 -1.26 -0.25 113.62 114.02 2k94 n SER 36 Ca 0.03 0.51 0.05 0.00 -0.26 0.00 0.00 58.87 59.19 2k94 n SER 36 Cb 0.47 -0.51 -0.12 0.00 -0.26 0.00 0.00 64.21 63.79 2k94 n SER 36 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2k94 n LEU 37 N -1.53 0.33 -0.05 1.04 4.32 -1.26 -3.42 117.00 116.43 2k94 n LEU 37 Ca 0.03 0.14 -0.11 0.00 -0.02 0.00 0.00 56.01 56.04 2k94 n LEU 37 Cb 0.13 0.10 -0.15 0.00 -1.62 0.00 0.00 43.42 41.89 2k94 n LEU 37 CO 0.11 0.10 -0.82 -0.67 -1.22 0.00 0.00 177.39 174.88 2k94 n ASP 38 N -2.56 0.82 -0.01 -1.43 -0.08 -0.54 -4.00 116.55 108.75 2k94 n ASP 38 Ca -0.10 0.22 -0.13 0.00 -1.51 0.00 0.00 54.79 53.27 2k94 n ASP 38 Cb 0.74 0.16 -0.10 0.00 2.34 0.00 0.00 41.12 44.26 2k94 n ASP 38 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 2k94 h THR 39 N 0.01 1.37 0.00 5.18 2.02 -0.74 -3.03 112.91 117.72 2k94 h THR 39 Ca -0.41 -1.35 0.00 0.00 0.77 0.00 0.00 66.41 65.42 2k94 h THR 39 Cb 2.08 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 70.76 2k94 h THR 39 CO 0.05 0.34 0.00 0.52 0.37 0.00 0.00 175.52 176.80 2k94 n VAL 40 N -4.83 0.00 -0.65 3.16 0.31 -1.22 -0.46 118.33 114.64 2k94 n VAL 40 Ca -0.09 1.21 0.49 0.00 -0.01 0.00 0.00 64.34 65.94 2k94 n VAL 40 Cb 0.29 -1.92 0.76 0.00 -0.91 0.00 0.00 33.84 32.06 2k94 n VAL 40 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2k94 n GLU 41 N -1.54 -0.00 0.50 5.55 1.02 -1.26 0.66 120.64 125.57 2k94 n GLU 41 Ca 0.00 1.01 -0.20 0.00 -0.02 0.00 0.00 57.16 57.96 2k94 n GLU 41 Cb 0.00 -2.32 -0.09 0.00 -0.02 0.00 0.00 31.44 29.01 2k94 n GLU 41 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2k94 h LEU 42 N 0.00 -1.09 -0.50 -4.62 7.12 -0.63 0.18 115.31 115.77 2k94 h LEU 42 Ca 0.87 0.04 -0.11 0.00 0.13 0.00 0.00 57.88 58.81 2k94 h LEU 42 Cb 3.47 0.28 -0.02 0.00 -0.53 0.00 0.00 40.66 43.87 2k94 h LEU 42 CO -0.03 -0.75 -0.13 0.58 -0.13 0.00 0.00 178.44 177.98 2k94 h VAL 43 N -1.34 1.27 0.29 1.05 2.07 0.11 -2.77 116.25 116.93 2k94 h VAL 43 Ca -0.13 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.12 2k94 h VAL 43 Cb 0.98 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.77 2k94 h VAL 43 CO 0.22 0.44 -0.43 0.24 0.02 0.00 0.00 177.57 178.06 2k94 h MET 44 N 0.83 -0.75 -0.07 1.57 2.86 -0.64 -1.27 114.93 117.46 2k94 h MET 44 Ca 0.13 0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.84 2k94 h MET 44 Cb 0.69 0.17 -0.05 0.00 0.06 0.00 0.00 31.60 32.47 2k94 h MET 44 CO 0.05 -0.50 -0.44 0.00 1.06 0.00 0.00 176.91 177.08 2k94 h ALA 45 N -0.40 -0.83 -0.91 6.32 0.00 -0.63 -2.21 119.26 120.60 2k94 h ALA 45 Ca -0.02 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.92 2k94 h ALA 45 Cb 0.73 0.91 -0.11 0.00 0.00 0.00 0.00 17.79 19.32 2k94 h ALA 45 CO -0.14 -0.98 -0.55 -0.07 0.00 0.00 0.00 179.25 177.50 2k94 h LEU 46 N -0.50 -2.03 -0.93 0.00 4.07 -1.31 0.87 115.31 115.48 2k94 h LEU 46 Ca 0.02 0.31 0.08 0.00 0.08 0.00 0.00 57.88 58.37 2k94 h LEU 46 Cb 0.57 0.89 -0.11 0.00 1.08 0.00 0.00 40.66 43.09 2k94 h LEU 46 CO -0.34 -0.23 -0.55 -0.62 -1.08 0.00 0.00 178.44 175.63 2k94 n GLU 47 N -5.13 -0.41 -0.08 1.13 4.71 -0.50 0.15 120.64 120.51 2k94 n GLU 47 Ca 0.02 1.40 -0.01 0.00 -0.01 0.00 0.00 57.16 58.56 2k94 n GLU 47 Cb 0.25 -2.05 0.26 0.00 -1.01 0.00 0.00 31.44 28.88 2k94 n GLU 47 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 2k94 h GLU 48 N 0.00 0.72 -0.85 3.49 4.81 -0.41 0.56 114.58 122.90 2k94 h GLU 48 Ca 0.15 -0.12 0.20 0.00 -0.13 0.00 0.00 59.36 59.45 2k94 h GLU 48 Cb 0.38 -0.12 -0.15 0.00 0.63 0.00 0.00 28.75 29.48 2k94 h GLU 48 CO -0.87 0.63 -0.05 1.49 -0.73 0.00 0.00 179.01 179.48 2k94 h GLU 49 N 0.70 0.05 -0.06 1.92 4.57 0.84 0.30 114.58 122.90 2k94 h GLU 49 Ca 0.16 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.33 2k94 h GLU 49 Cb 0.21 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 2k94 h GLU 49 CO -0.01 0.03 -0.10 0.34 -1.18 0.00 0.00 179.01 178.09 2k94 n PHE 50 N -5.44 0.21 -3.24 0.92 7.35 -0.79 -5.03 117.46 111.43 2k94 n PHE 50 Ca 0.16 -1.12 -0.15 0.00 -0.76 0.00 0.00 57.45 55.58 2k94 n PHE 50 Cb 0.53 -0.22 0.01 0.00 0.35 0.00 0.00 39.48 40.16 2k94 n PHE 50 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 2k94 n ASP 51 N -1.22 -6.40 -3.66 -2.13 9.92 0.17 -5.01 116.55 108.21 2k94 n ASP 51 Ca 0.18 0.30 -0.12 0.00 -0.53 0.00 0.00 54.79 54.63 2k94 n ASP 51 Cb 0.71 -2.18 -0.06 0.00 -0.64 0.00 0.00 41.12 38.95 2k94 n ASP 51 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2k94 s THR 52 N -1.33 0.07 -0.89 -3.53 -1.32 0.47 -4.96 115.64 104.15 2k94 s THR 52 Ca 0.16 -0.55 -0.01 0.00 -1.21 0.00 0.00 61.69 60.08 2k94 s THR 52 Cb -0.02 -1.05 0.24 0.00 -1.51 0.00 0.00 72.50 70.16 2k94 s THR 52 CO 0.44 -0.30 0.89 -0.62 -2.21 0.00 0.00 174.62 172.82 2k94 n GLU 53 N 0.19 2.91 -1.41 7.08 1.02 -1.26 -4.49 120.64 124.68 2k94 n GLU 53 Ca -0.17 -4.52 -0.53 0.00 -0.02 0.00 0.00 57.16 51.92 2k94 n GLU 53 Cb 0.61 -2.41 -0.08 0.00 -0.02 0.00 0.00 31.44 29.55 2k94 n GLU 53 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 2k94 n ILE 54 N 1.94 0.15 -1.39 -3.67 0.00 -1.26 -4.90 119.36 110.23 2k94 n ILE 54 Ca 0.24 -0.20 -0.30 0.00 0.00 0.00 0.00 62.75 62.49 2k94 n ILE 54 Cb 0.37 -1.38 0.11 0.00 0.00 0.00 0.00 39.64 38.74 2k94 n ILE 54 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2k94 s PRO 55 N 6.10 1.75 0.00 9.51 0.04 -1.26 -4.85 135.00 146.29 2k94 s PRO 55 Ca 1.12 0.75 0.20 0.00 0.04 0.00 0.00 61.00 63.11 2k94 s PRO 55 Cb -1.00 -1.87 1.00 0.00 0.04 0.00 0.00 34.50 32.67 2k94 s PRO 55 CO 0.53 -1.88 1.62 -0.25 0.04 0.00 0.00 177.00 177.06 2k94 n ASP 56 N -3.63 0.00 0.05 6.66 8.00 -1.26 -1.95 116.55 124.42 2k94 n ASP 56 Ca 0.07 -0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.61 2k94 n ASP 56 Cb 0.56 -0.28 -0.06 0.00 -0.02 0.00 0.00 41.12 41.32 2k94 n ASP 56 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2k94 n GLU 57 N -1.28 0.62 -0.05 -1.24 1.02 -1.26 -4.12 120.64 114.32 2k94 n GLU 57 Ca 0.09 0.18 -0.12 0.00 -0.02 0.00 0.00 57.16 57.30 2k94 n GLU 57 Cb 0.16 -1.81 -0.14 0.00 -0.02 0.00 0.00 31.44 29.62 2k94 n GLU 57 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2k94 n GLU 58 N -2.81 0.67 -0.11 3.49 2.13 -0.91 -4.08 120.64 119.03 2k94 n GLU 58 Ca -0.07 0.19 0.27 0.00 0.66 0.00 0.00 57.16 58.21 2k94 n GLU 58 Cb 0.74 -1.68 0.64 0.00 0.27 0.00 0.00 31.44 31.41 2k94 n GLU 58 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k94 h ALA 59 N 0.76 2.63 -1.11 4.31 0.00 -1.55 0.24 119.26 124.54 2k94 h ALA 59 Ca -0.41 -0.03 0.32 0.00 0.00 0.00 0.00 54.91 54.79 2k94 h ALA 59 Cb 2.07 0.06 -0.11 0.00 0.00 0.00 0.00 17.79 19.81 2k94 h ALA 59 CO 0.05 -1.23 0.71 0.93 0.00 0.00 0.00 179.25 179.71 2k94 h GLU 60 N 0.00 0.30 -2.22 0.00 5.08 -1.76 -0.14 114.58 115.83 2k94 h GLU 60 Ca 0.38 -0.02 -0.67 0.00 -1.00 0.00 0.00 59.36 58.06 2k94 h GLU 60 Cb 2.01 -0.07 -0.37 0.00 0.50 0.00 0.00 28.75 30.83 2k94 h GLU 60 CO -0.00 0.20 -0.06 1.63 -1.00 0.00 0.00 179.01 179.77 2k94 n LYS 61 N -4.69 3.95 -2.69 2.33 5.02 0.84 -4.68 118.16 118.23 2k94 n LYS 61 Ca 0.29 -4.74 -0.08 0.00 -2.02 0.00 0.00 58.31 51.76 2k94 n LYS 61 Cb 1.04 -2.31 0.09 0.00 -0.02 0.00 0.00 35.03 33.83 2k94 n LYS 61 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2k94 n ILE 62 N -0.21 0.29 -1.49 -0.18 5.41 -0.07 -4.02 119.36 119.08 2k94 n ILE 62 Ca 0.37 -1.97 0.05 0.00 1.00 0.00 0.00 62.75 62.21 2k94 n ILE 62 Cb 0.36 0.90 0.08 0.00 -0.71 0.00 0.00 39.64 40.27 2k94 n ILE 62 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2k94 n THR 63 N -0.43 1.04 -0.29 1.39 -2.24 -1.26 -4.89 114.28 107.59 2k94 n THR 63 Ca 0.01 -1.25 0.00 0.00 -2.27 0.00 0.00 64.05 60.54 2k94 n THR 63 Cb 0.84 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 2k94 n THR 63 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2k94 n THR 64 N -0.79 0.00 0.00 4.28 -2.24 -1.26 -1.91 114.28 112.37 2k94 n THR 64 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2k94 n THR 64 Cb 0.67 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 2k94 n THR 64 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2k94 n VAL 65 N 0.00 0.00 -0.11 2.28 0.24 -1.26 -4.26 118.33 115.22 2k94 n VAL 65 Ca 0.00 0.25 0.27 0.00 -2.04 0.00 0.00 64.34 62.82 2k94 n VAL 65 Cb 0.00 -1.21 0.67 0.00 -1.47 0.00 0.00 33.84 31.83 2k94 n VAL 65 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 2k94 h GLN 66 N 0.00 0.00 0.42 7.34 -0.00 -1.67 0.13 115.11 121.33 2k94 h GLN 66 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.63 2k94 h GLN 66 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.48 2k94 h GLN 66 CO 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 178.83 178.63 2k94 h ALA 67 N 1.23 -0.57 -0.80 3.38 0.00 -1.82 0.71 119.26 121.40 2k94 h ALA 67 Ca 0.38 -0.17 0.16 0.00 0.00 0.00 0.00 54.91 55.28 2k94 h ALA 67 Cb 1.89 0.22 -0.06 0.00 0.00 0.00 0.00 17.79 19.85 2k94 h ALA 67 CO -0.00 -0.74 0.53 0.00 0.00 0.00 0.00 179.25 179.04 2k94 h ALA 68 N -0.22 2.12 0.11 0.00 0.00 -0.89 -0.53 119.26 119.84 2k94 h ALA 68 Ca -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2k94 h ALA 68 Cb 0.52 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2k94 h ALA 68 CO 0.10 -0.34 -0.05 0.82 0.00 0.00 0.00 179.25 179.77 2k94 h ILE 69 N 0.43 0.82 -0.69 0.00 2.04 -1.16 -2.86 117.51 116.10 2k94 h ILE 69 Ca 0.40 -1.33 0.20 0.00 1.00 0.00 0.00 64.86 65.13 2k94 h ILE 69 Cb 0.91 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.42 2k94 h ILE 69 CO -0.14 0.24 0.71 -0.78 0.00 0.00 0.00 178.15 178.19 2k94 h ASP 70 N -0.93 0.00 0.21 1.72 1.82 0.11 1.32 116.42 120.67 2k94 h ASP 70 Ca -0.01 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 2k94 h ASP 70 Cb 0.51 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.52 2k94 h ASP 70 CO 0.02 0.00 -0.10 0.22 -1.61 0.00 0.00 179.24 177.77 2k94 h TYR 71 N 0.00 -0.26 0.00 0.28 3.20 -1.10 -3.26 116.97 115.83 2k94 h TYR 71 Ca 0.33 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.19 2k94 h TYR 71 Cb 1.75 0.09 0.00 0.00 1.54 0.00 0.00 36.73 40.10 2k94 h TYR 71 CO 0.00 -0.06 0.00 0.82 -1.64 0.00 0.00 178.16 177.28 2k94 h ILE 72 N -1.04 0.00 0.13 1.81 1.08 -0.83 -2.67 117.51 115.99 2k94 h ILE 72 Ca -0.03 -0.30 -0.00 0.00 -0.39 0.00 0.00 64.86 64.14 2k94 h ILE 72 Cb 0.32 1.13 -0.01 0.00 -3.07 0.00 0.00 36.82 35.18 2k94 h ILE 72 CO 0.05 0.00 -0.21 -1.13 -0.69 0.00 0.00 178.15 176.17 2k94 h ASN 73 N 0.00 -0.59 0.00 1.72 -0.73 0.16 -3.44 115.58 112.70 2k94 h ASN 73 Ca 0.00 0.05 -0.03 0.00 1.87 0.00 0.00 56.30 58.20 2k94 h ASN 73 Cb 0.36 0.21 -0.03 0.00 0.27 0.00 0.00 38.32 39.13 2k94 h ASN 73 CO 0.00 -0.25 -0.06 0.61 -0.37 0.00 0.00 177.43 177.36 2k94 n GLY 74 N -1.21 -0.31 0.00 1.57 0.00 -1.22 -4.85 105.19 99.16 2k94 n GLY 74 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2k94 n GLY 74 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2k94 n HIS 75 N -0.05 0.00 -1.22 1.61 -0.00 -1.01 -4.89 115.22 109.67 2k94 n HIS 75 Ca -0.05 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.16 2k94 n HIS 75 Cb 0.38 -0.41 -0.01 0.00 -0.12 0.00 0.00 29.99 29.83 2k94 n HIS 75 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2k94 n GLN 76 N -2.31 -0.51 0.00 1.57 1.13 -1.26 -5.14 117.38 110.86 2k94 n GLN 76 Ca 0.00 0.34 0.03 0.00 -1.94 0.00 0.00 57.00 55.42 2k94 n GLN 76 Cb 0.00 -0.62 0.02 0.00 0.11 0.00 0.00 30.24 29.75 2k94 n GLN 76 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62