#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fh0 s GLU 37 N 0.00 0.17 0.15 1.61 -6.30 -1.26 -5.14 118.70 107.93 2fh0 s GLU 37 Ca 0.00 -0.26 -0.03 0.00 -2.50 0.00 0.00 54.97 52.19 2fh0 s GLU 37 Cb 0.00 -1.68 -0.03 0.00 0.00 0.00 0.00 34.13 32.41 2fh0 s GLU 37 CO 0.00 -0.77 0.12 1.21 0.02 0.00 0.00 175.26 175.84 2fh0 s ASN 38 N 2.09 0.22 -0.10 -1.70 3.84 -1.26 -5.08 114.94 112.96 2fh0 s ASN 38 Ca 0.04 -1.17 -0.05 0.00 0.21 0.00 0.00 52.86 51.89 2fh0 s ASN 38 Cb -0.16 0.34 -0.26 0.00 -0.55 0.00 0.00 41.25 40.62 2fh0 s ASN 38 CO -0.17 -0.79 0.44 0.28 -2.79 0.00 0.00 177.10 174.07 2fh0 h SER 39 N 2.75 0.39 -3.79 -4.21 0.02 -2.06 -3.47 113.55 103.18 2fh0 h SER 39 Ca -0.34 -0.85 -0.48 0.00 -0.84 0.00 0.00 61.79 59.27 2fh0 h SER 39 Cb 1.21 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.61 2fh0 h SER 39 CO 0.55 1.76 0.35 0.00 -1.14 0.00 0.00 176.83 178.36 2fh0 s ALA 40 N -2.57 3.30 -1.09 3.77 0.00 -1.26 -4.97 121.76 118.95 2fh0 s ALA 40 Ca -0.20 0.60 -0.22 0.00 0.00 0.00 0.00 51.96 52.14 2fh0 s ALA 40 Cb 0.07 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 19.97 2fh0 s ALA 40 CO 0.79 0.18 1.79 -1.25 0.00 0.00 0.00 175.76 177.26 2fh0 s PRO 41 N -1.46 3.07 -0.63 0.00 0.04 -1.26 -4.79 135.00 129.98 2fh0 s PRO 41 Ca 0.44 -1.07 -0.01 0.00 0.04 0.00 0.00 61.00 60.40 2fh0 s PRO 41 Cb -0.24 -5.28 0.48 0.00 0.04 0.00 0.00 34.50 29.50 2fh0 s PRO 41 CO 0.30 -3.05 2.00 1.33 0.04 0.00 0.00 177.00 177.62 2fh0 n VAL 42 N 7.33 3.54 0.00 -0.36 0.24 -1.26 -4.58 118.33 123.24 2fh0 n VAL 42 Ca 0.42 -2.82 0.00 0.00 -2.04 0.00 0.00 64.34 59.89 2fh0 n VAL 42 Cb 0.48 -1.06 0.00 0.00 -1.47 0.00 0.00 33.84 31.79 2fh0 n VAL 42 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fh0 n GLY 43 N -0.95 1.99 0.35 7.63 0.00 -1.26 -5.00 105.19 107.95 2fh0 n GLY 43 Ca 0.62 -0.18 -0.01 0.00 0.00 0.00 0.00 46.02 46.45 2fh0 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fh0 h ALA 44 N 0.00 1.21 -0.63 4.61 0.00 -1.92 0.36 119.26 122.89 2fh0 h ALA 44 Ca 0.00 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.92 2fh0 h ALA 44 Cb 0.00 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.43 2fh0 h ALA 44 CO 0.00 0.46 0.41 0.00 0.00 0.00 0.00 179.25 180.13 2fh0 h ALA 45 N 1.38 1.76 0.00 0.00 0.00 -1.95 -1.77 119.26 118.69 2fh0 h ALA 45 Ca 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2fh0 h ALA 45 Cb -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2fh0 h ALA 45 CO -0.12 0.15 -0.99 -0.89 0.00 0.00 0.00 179.25 177.40 2fh0 n ILE 46 N -4.47 0.08 0.29 0.00 2.08 -0.74 -4.21 119.36 112.38 2fh0 n ILE 46 Ca 0.09 -0.15 0.16 0.00 0.56 0.00 0.00 62.75 63.41 2fh0 n ILE 46 Cb 0.21 0.43 0.95 0.00 -0.75 0.00 0.00 39.64 40.48 2fh0 n ILE 46 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2fh0 h ALA 47 N 2.72 1.49 0.00 -1.39 0.00 0.63 0.11 119.26 122.82 2fh0 h ALA 47 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2fh0 h ALA 47 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2fh0 h ALA 47 CO 0.00 -0.04 -0.01 -1.71 0.00 0.00 0.00 179.25 177.48 2fh0 n ASN 48 N -3.73 0.83 -1.94 0.00 2.85 -1.24 -3.40 115.26 108.63 2fh0 n ASN 48 Ca -0.02 0.57 -0.17 0.00 -0.11 0.00 0.00 54.58 54.84 2fh0 n ASN 48 Cb 0.11 -0.78 0.15 0.00 1.24 0.00 0.00 39.78 40.51 2fh0 n ASN 48 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 2fh0 n PHE 49 N -2.28 2.35 -4.37 1.20 3.72 0.38 -4.92 117.46 113.54 2fh0 n PHE 49 Ca 0.05 -1.48 -0.20 0.00 -0.05 0.00 0.00 57.45 55.77 2fh0 n PHE 49 Cb 0.43 -0.77 -0.09 0.00 -0.94 0.00 0.00 39.48 38.11 2fh0 n PHE 49 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2fh0 s LEU 50 N -2.55 1.77 0.03 4.37 1.43 -1.22 -3.63 118.68 118.89 2fh0 s LEU 50 Ca 0.44 -1.52 -0.08 0.00 -1.03 0.00 0.00 54.13 51.95 2fh0 s LEU 50 Cb 0.37 0.05 -0.05 0.00 0.03 0.00 0.00 46.19 46.59 2fh0 s LEU 50 CO 0.09 -0.83 0.31 -1.61 0.23 0.00 0.00 176.35 174.54 2fh0 s GLU 51 N -3.85 3.64 0.21 1.70 0.41 -1.14 -4.88 118.70 114.79 2fh0 s GLU 51 Ca 0.34 0.01 -0.10 0.00 -0.41 0.00 0.00 54.97 54.82 2fh0 s GLU 51 Cb 0.06 -3.06 0.27 0.00 -1.78 0.00 0.00 34.13 29.62 2fh0 s GLU 51 CO 0.16 0.62 1.74 -1.35 -0.49 0.00 0.00 175.26 175.94 2fh0 h PRO 52 N 3.92 0.36 -0.35 0.39 0.11 -1.95 0.20 132.00 134.68 2fh0 h PRO 52 Ca -0.50 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.48 2fh0 h PRO 52 Cb 1.20 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2fh0 h PRO 52 CO 0.66 0.24 -0.22 1.96 -0.21 0.00 0.00 178.00 180.43 2fh0 h GLN 53 N 0.38 0.77 -0.61 1.05 4.20 -1.96 -2.60 115.11 116.33 2fh0 h GLN 53 Ca 0.30 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2fh0 h GLN 53 Cb 0.38 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 2fh0 h GLN 53 CO -0.31 0.98 0.36 0.00 -0.67 0.00 0.00 178.83 179.19 2fh0 h ALA 54 N 0.77 0.78 -0.68 3.87 0.00 -1.68 -2.18 119.26 120.15 2fh0 h ALA 54 Ca 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fh0 h ALA 54 Cb 0.78 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2fh0 h ALA 54 CO 0.06 0.27 0.43 -0.07 0.00 0.00 0.00 179.25 179.94 2fh0 h LEU 55 N 0.83 0.79 -0.32 0.00 3.38 -0.57 -1.22 115.31 118.21 2fh0 h LEU 55 Ca 0.22 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2fh0 h LEU 55 Cb -0.00 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2fh0 h LEU 55 CO -0.04 0.60 0.21 -0.08 0.09 0.00 0.00 178.44 179.22 2fh0 h GLU 56 N 0.92 0.42 -0.67 1.13 4.81 -1.13 -2.02 114.58 118.04 2fh0 h GLU 56 Ca 0.25 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 2fh0 h GLU 56 Cb -0.07 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 2fh0 h GLU 56 CO -0.05 0.28 0.33 -0.09 -0.73 0.00 0.00 179.01 178.75 2fh0 h ARG 57 N 0.43 0.95 -0.31 1.92 1.12 -1.13 -2.37 114.38 114.99 2fh0 h ARG 57 Ca 0.12 -0.13 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 2fh0 h ARG 57 Cb -0.05 -0.17 -0.02 0.00 -0.01 0.00 0.00 29.97 29.72 2fh0 h ARG 57 CO -0.03 0.75 0.20 1.25 -3.11 0.00 0.00 179.97 179.04 2fh0 h LEU 58 N 0.92 0.36 -0.49 3.80 5.85 -0.93 -2.17 115.31 122.65 2fh0 h LEU 58 Ca 0.23 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 2fh0 h LEU 58 Cb 0.10 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2fh0 h LEU 58 CO -0.03 0.26 0.07 0.28 -0.34 0.00 0.00 178.44 178.68 2fh0 h SER 59 N 0.42 0.80 -0.33 1.25 0.02 -0.84 -1.01 113.55 113.86 2fh0 h SER 59 Ca 0.11 -0.27 -0.03 0.00 -0.84 0.00 0.00 61.79 60.76 2fh0 h SER 59 Cb -0.04 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 2fh0 h SER 59 CO -0.02 0.86 0.08 -0.09 -1.14 0.00 0.00 176.83 176.53 2fh0 h ARG 60 N 0.70 0.52 -0.66 3.45 9.65 -1.25 -3.05 114.38 123.74 2fh0 h ARG 60 Ca 0.15 -0.12 -0.09 0.00 -1.10 0.00 0.00 59.98 58.82 2fh0 h ARG 60 Cb 0.42 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.90 2fh0 h ARG 60 CO 0.01 0.58 0.08 -0.24 2.80 0.00 0.00 179.97 183.20 2fh0 h VAL 61 N 0.37 1.27 -0.45 0.20 3.04 -1.39 -2.79 116.25 116.50 2fh0 h VAL 61 Ca 0.10 -1.08 0.13 0.00 -1.01 0.00 0.00 66.70 64.84 2fh0 h VAL 61 Cb 0.29 0.67 -0.02 0.00 -2.01 0.00 0.00 31.29 30.22 2fh0 h VAL 61 CO 0.00 0.40 0.37 0.00 -1.01 0.00 0.00 177.57 177.33 2fh0 h ALA 62 N 1.04 2.30 0.00 3.17 0.00 -1.07 0.57 119.26 125.26 2fh0 h ALA 62 Ca 0.20 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 2fh0 h ALA 62 Cb 0.48 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2fh0 h ALA 62 CO 0.02 -0.60 -0.60 -0.07 0.00 0.00 0.00 179.25 177.99 2fh0 h LEU 63 N 0.00 0.00 0.01 0.00 4.07 -1.44 -2.92 115.31 115.02 2fh0 h LEU 63 Ca 0.21 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 57.82 2fh0 h LEU 63 Cb 0.95 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.64 2fh0 h LEU 63 CO -0.00 0.60 -1.94 0.52 -1.08 0.00 0.00 178.44 176.54 2fh0 n VAL 64 N -3.61 1.55 -3.49 1.22 0.31 0.24 -4.83 118.33 109.72 2fh0 n VAL 64 Ca -0.00 -0.26 -0.28 0.00 -0.01 0.00 0.00 64.34 63.78 2fh0 n VAL 64 Cb 0.65 -1.91 -0.12 0.00 -0.91 0.00 0.00 33.84 31.55 2fh0 n VAL 64 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2fh0 s ARG 65 N -2.45 0.80 0.48 5.55 1.81 0.17 -4.98 118.95 120.33 2fh0 s ARG 65 Ca -0.33 -1.70 0.14 0.00 -1.72 0.00 0.00 55.73 52.13 2fh0 s ARG 65 Cb 0.10 -1.53 1.13 0.00 -0.45 0.00 0.00 34.95 34.20 2fh0 s ARG 65 CO 0.56 -1.26 2.07 0.07 -0.68 0.00 0.00 175.30 176.06 2fh0 h ARG 66 N 6.53 0.22 -0.86 3.54 0.11 -1.67 -2.41 114.38 119.85 2fh0 h ARG 66 Ca 0.11 -0.01 0.10 0.00 0.10 0.00 0.00 59.98 60.28 2fh0 h ARG 66 Cb 0.94 -0.05 -0.08 0.00 1.11 0.00 0.00 29.97 31.89 2fh0 h ARG 66 CO 0.33 0.15 0.50 0.22 0.10 0.00 0.00 179.97 181.27 2fh0 h ASP 67 N 0.23 0.71 -0.08 0.08 1.82 -1.93 0.51 116.42 117.76 2fh0 h ASP 67 Ca 0.13 0.05 -0.01 0.00 -0.39 0.00 0.00 57.03 56.81 2fh0 h ASP 67 Cb 0.23 -0.09 -0.00 0.00 0.68 0.00 0.00 39.33 40.15 2fh0 h ASP 67 CO -0.02 0.39 0.01 0.03 -1.61 0.00 0.00 179.24 178.04 2fh0 h ARG 68 N 0.82 0.14 -0.40 0.28 3.08 -1.81 -2.08 114.38 114.41 2fh0 h ARG 68 Ca 0.42 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.35 2fh0 h ARG 68 Cb 0.40 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 2fh0 h ARG 68 CO -0.26 0.37 -0.08 0.00 -1.07 0.00 0.00 179.97 178.94 2fh0 h ALA 69 N 0.76 1.12 -0.75 0.04 0.00 -1.44 -2.64 119.26 116.34 2fh0 h ALA 69 Ca 0.02 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2fh0 h ALA 69 Cb 0.31 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2fh0 h ALA 69 CO 0.00 0.55 0.29 1.96 0.00 0.00 0.00 179.25 182.06 2fh0 h GLN 70 N 0.63 1.12 -0.02 0.00 4.20 0.11 -2.48 115.11 118.66 2fh0 h GLN 70 Ca 0.11 -0.20 -0.12 0.00 0.06 0.00 0.00 58.65 58.51 2fh0 h GLN 70 Cb 0.51 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 2fh0 h GLN 70 CO 0.03 0.91 -0.54 0.00 -0.67 0.00 0.00 178.83 178.56 2fh0 h ALA 71 N 1.23 1.06 -0.18 3.87 0.00 -1.15 -2.63 119.26 121.46 2fh0 h ALA 71 Ca 0.25 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2fh0 h ALA 71 Cb 0.21 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2fh0 h ALA 71 CO -0.02 0.68 0.03 0.28 0.00 0.00 0.00 179.25 180.21 2fh0 h VAL 72 N 0.05 1.23 -0.53 0.00 2.07 -1.10 0.94 116.25 118.92 2fh0 h VAL 72 Ca -0.00 -0.74 -0.06 0.00 0.82 0.00 0.00 66.70 66.72 2fh0 h VAL 72 Cb 0.97 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 2fh0 h VAL 72 CO 0.07 0.23 0.09 1.05 0.02 0.00 0.00 177.57 179.03 2fh0 h GLU 73 N 0.09 0.83 -0.06 1.57 4.11 -1.45 -1.89 114.58 117.77 2fh0 h GLU 73 Ca 0.05 -0.19 -0.16 0.00 0.07 0.00 0.00 59.36 59.14 2fh0 h GLU 73 Cb 0.32 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2fh0 h GLU 73 CO 0.00 0.77 -0.65 1.79 0.07 0.00 0.00 179.01 181.00 2fh0 h THR 74 N 0.79 1.40 -0.10 -1.06 1.35 -1.33 -2.12 112.91 111.83 2fh0 h THR 74 Ca 0.17 -2.07 -0.02 0.00 -0.55 0.00 0.00 66.41 63.94 2fh0 h THR 74 Cb 0.34 2.06 -0.00 0.00 -1.73 0.00 0.00 68.15 68.82 2fh0 h THR 74 CO 0.00 0.61 -0.01 0.22 -0.25 0.00 0.00 175.52 176.10 2fh0 h TYR 75 N 0.18 0.20 -0.25 4.73 5.03 -0.43 -1.45 116.97 124.98 2fh0 h TYR 75 Ca -0.01 -0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.23 2fh0 h TYR 75 Cb 1.17 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 39.39 2fh0 h TYR 75 CO 0.03 0.45 0.05 1.25 -1.32 0.00 0.00 178.16 178.61 2fh0 h LEU 76 N -0.11 0.40 -1.39 2.82 5.85 -1.37 -2.78 115.31 118.73 2fh0 h LEU 76 Ca 0.03 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 2fh0 h LEU 76 Cb 0.37 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 2fh0 h LEU 76 CO 0.01 0.55 0.08 0.07 -0.34 0.00 0.00 178.44 178.80 2fh0 h LYS 77 N 0.23 0.49 -0.50 1.25 5.09 -1.41 -1.80 116.57 119.91 2fh0 h LYS 77 Ca 0.08 -0.08 -0.03 0.00 0.09 0.00 0.00 60.65 60.71 2fh0 h LYS 77 Cb 0.32 -0.09 -0.02 0.00 0.10 0.00 0.00 32.23 32.54 2fh0 h LYS 77 CO 0.00 0.45 0.18 -0.22 -2.09 0.00 0.00 179.45 177.77 2fh0 h LYS 78 N 0.48 0.76 -0.24 0.07 3.64 -1.09 0.31 116.57 120.51 2fh0 h LYS 78 Ca 0.11 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 2fh0 h LYS 78 Cb 0.19 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2fh0 h LYS 78 CO -0.00 0.70 0.01 -0.07 -2.27 0.00 0.00 179.45 177.82 2fh0 h LEU 79 N 0.67 0.40 -0.39 5.20 3.38 -1.19 -1.68 115.31 121.71 2fh0 h LEU 79 Ca 0.16 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 2fh0 h LEU 79 Cb 0.24 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2fh0 h LEU 79 CO -0.01 0.60 -0.02 0.40 0.09 0.00 0.00 178.44 179.51 2fh0 h ILE 80 N 0.19 1.26 0.00 1.22 2.04 -1.23 0.27 117.51 121.27 2fh0 h ILE 80 Ca 0.07 -1.04 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 2fh0 h ILE 80 Cb 0.39 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.62 2fh0 h ILE 80 CO 0.01 0.35 -0.16 0.00 0.00 0.00 0.00 178.15 178.35 2fh0 h ALA 81 N 0.87 1.49 0.00 1.87 0.00 -0.35 -3.29 119.26 119.85 2fh0 h ALA 81 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2fh0 h ALA 81 Cb 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2fh0 h ALA 81 CO 0.02 0.20 -0.26 1.15 0.00 0.00 0.00 179.25 180.36 2fh0 h THR 82 N 0.00 0.00 0.00 0.00 2.02 -1.06 -3.50 112.91 110.37 2fh0 h THR 82 Ca -0.00 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.51 2fh0 h THR 82 Cb 0.33 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 2fh0 h THR 82 CO 0.02 0.00 0.00 -0.46 0.37 0.00 0.00 175.52 175.45 2fh0 n ASN 83 N -3.84 0.00 -4.55 4.18 6.94 0.60 -5.10 115.26 113.50 2fh0 n ASN 83 Ca -0.04 0.00 -0.32 0.00 -0.02 0.00 0.00 54.58 54.20 2fh0 n ASN 83 Cb 0.14 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.50 2fh0 n ASN 83 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2fh0 n ASN 84 N 0.00 1.97 -3.24 0.53 3.02 0.64 -4.82 115.26 113.36 2fh0 n ASN 84 Ca 0.00 -0.63 -0.18 0.00 -0.03 0.00 0.00 54.58 53.74 2fh0 n ASN 84 Cb 0.00 -1.52 -0.07 0.00 -0.61 0.00 0.00 39.78 37.58 2fh0 n ASN 84 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2fh0 s VAL 85 N 12.20 -0.22 0.00 2.41 1.01 -1.26 -3.18 120.40 131.36 2fh0 s VAL 85 Ca 1.01 -1.66 0.00 0.00 0.00 0.00 0.00 61.98 61.34 2fh0 s VAL 85 Cb -0.27 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 35.36 2fh0 s VAL 85 CO 0.26 -0.72 0.88 0.35 0.00 0.00 0.00 175.10 175.87 2fh0 n THR 86 N 3.39 0.00 -3.94 3.92 -2.24 -1.26 -5.12 114.28 109.03 2fh0 n THR 86 Ca 0.20 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 62.02 2fh0 n THR 86 Cb 0.48 0.54 0.01 0.00 -2.10 0.00 0.00 70.33 69.26 2fh0 n THR 86 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2fh0 s HIS 87 N 0.00 0.01 0.28 4.78 -3.43 -1.26 -5.19 115.29 110.48 2fh0 s HIS 87 Ca 0.00 -0.06 0.06 0.00 -0.80 0.00 0.00 55.06 54.26 2fh0 s HIS 87 Cb 0.00 0.53 -0.06 0.00 -1.43 0.00 0.00 32.58 31.62 2fh0 s HIS 87 CO 0.00 -0.13 -0.04 0.15 -2.00 0.00 0.00 174.74 172.71 2fh0 s LYS 88 N -2.04 1.56 -0.82 -0.38 3.01 -1.26 -5.02 119.74 114.79 2fh0 s LYS 88 Ca 0.28 -1.80 -0.23 0.00 -1.01 0.00 0.00 55.97 53.21 2fh0 s LYS 88 Cb 0.01 -1.11 0.06 0.00 -1.01 0.00 0.00 37.83 35.78 2fh0 s LYS 88 CO -0.03 0.01 1.21 0.42 0.51 0.00 0.00 175.35 177.47 2fh0 s ILE 89 N -3.05 4.12 1.01 2.17 1.01 -1.24 -4.95 121.20 120.27 2fh0 s ILE 89 Ca 0.30 -0.45 -0.16 0.00 0.00 0.00 0.00 60.65 60.34 2fh0 s ILE 89 Cb 0.04 -4.86 0.20 0.00 0.01 0.00 0.00 42.46 37.85 2fh0 s ILE 89 CO 0.12 -1.70 1.21 0.42 0.00 0.00 0.00 174.94 174.99 2fh0 s THR 90 N 4.53 1.89 0.27 2.92 -4.23 -1.26 -2.89 115.64 116.87 2fh0 s THR 90 Ca 0.34 0.00 -0.00 0.00 -1.18 0.00 0.00 61.69 60.84 2fh0 s THR 90 Cb -0.08 -2.79 0.27 0.00 1.34 0.00 0.00 72.50 71.24 2fh0 s THR 90 CO 0.03 0.00 1.84 1.05 -0.54 0.00 0.00 174.62 177.00 2fh0 h GLU 91 N -1.83 0.95 -0.21 3.99 -0.00 -1.92 0.40 114.58 115.96 2fh0 h GLU 91 Ca -0.46 -0.06 -0.09 0.00 -0.00 0.00 0.00 59.36 58.75 2fh0 h GLU 91 Cb 1.28 -0.21 -0.00 0.00 -0.00 0.00 0.00 28.75 29.82 2fh0 h GLU 91 CO 0.45 0.63 -0.24 0.00 -0.00 0.00 0.00 179.01 179.85 2fh0 h ALA 92 N 1.51 0.31 -0.51 1.06 0.00 -2.00 -2.81 119.26 116.83 2fh0 h ALA 92 Ca 0.47 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2fh0 h ALA 92 Cb 0.43 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2fh0 h ALA 92 CO -0.25 0.27 -0.00 1.49 0.00 0.00 0.00 179.25 180.76 2fh0 h GLU 93 N 0.20 0.90 -0.80 0.00 4.81 -1.70 -2.55 114.58 115.45 2fh0 h GLU 93 Ca 0.03 -0.29 -0.05 0.00 -0.13 0.00 0.00 59.36 58.92 2fh0 h GLU 93 Cb 0.79 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.06 2fh0 h GLU 93 CO 0.06 0.93 0.31 0.97 -0.73 0.00 0.00 179.01 180.54 2fh0 h ILE 94 N 0.76 1.26 -0.54 2.32 2.10 -0.27 -2.01 117.51 121.13 2fh0 h ILE 94 Ca 0.14 -0.84 -0.06 0.00 1.08 0.00 0.00 64.86 65.18 2fh0 h ILE 94 Cb 0.53 0.32 -0.02 0.00 -1.09 0.00 0.00 36.82 36.55 2fh0 h ILE 94 CO 0.03 0.34 0.09 0.58 -1.08 0.00 0.00 178.15 178.11 2fh0 h VAL 95 N 1.16 1.25 -0.63 2.19 2.07 -1.42 -1.16 116.25 119.72 2fh0 h VAL 95 Ca 0.26 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.80 2fh0 h VAL 95 Cb 0.23 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2fh0 h VAL 95 CO -0.02 0.34 0.27 0.77 0.02 0.00 0.00 177.57 178.96 2fh0 h SER 96 N 0.79 0.85 -0.23 0.57 4.64 -1.24 -0.02 113.55 118.91 2fh0 h SER 96 Ca 0.17 -0.16 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 2fh0 h SER 96 Cb 0.40 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2fh0 h SER 96 CO 0.01 0.77 0.04 0.40 -0.87 0.00 0.00 176.83 177.18 2fh0 h ILE 97 N 0.87 1.22 -0.90 0.95 2.04 -1.22 -1.76 117.51 118.71 2fh0 h ILE 97 Ca 0.21 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 65.34 2fh0 h ILE 97 Cb 0.17 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 2fh0 h ILE 97 CO -0.02 0.23 0.60 -0.07 0.00 0.00 0.00 178.15 178.89 2fh0 h LEU 98 N 0.19 1.04 -1.01 1.44 3.38 -1.04 -0.27 115.31 119.05 2fh0 h LEU 98 Ca 0.07 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 2fh0 h LEU 98 Cb 0.31 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2fh0 h LEU 98 CO 0.00 0.75 0.05 0.78 0.09 0.00 0.00 178.44 180.12 2fh0 h ASN 99 N 1.23 0.73 0.09 -0.43 2.35 -0.83 -2.16 115.58 116.56 2fh0 h ASN 99 Ca 0.33 -0.15 -0.19 0.00 -0.55 0.00 0.00 56.30 55.74 2fh0 h ASN 99 Cb -0.14 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.04 2fh0 h ASN 99 CO -0.07 0.76 -0.70 1.23 -1.65 0.00 0.00 177.43 177.00 2fh0 h GLY 100 N 0.95 0.60 1.37 2.83 0.00 -0.73 -2.74 103.07 105.36 2fh0 h GLY 100 Ca 0.15 -0.82 -0.01 0.00 0.00 0.00 0.00 47.33 46.65 2fh0 h GLY 100 CO 0.01 0.73 0.32 -2.22 0.00 0.00 0.00 176.54 175.38 2fh0 h ILE 101 N 0.39 1.19 0.00 2.60 2.04 -0.76 -1.93 117.51 121.03 2fh0 h ILE 101 Ca -0.03 -0.47 -0.12 0.00 1.00 0.00 0.00 64.86 65.24 2fh0 h ILE 101 Cb 1.28 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 2fh0 h ILE 101 CO 0.13 0.21 -0.58 0.00 0.00 0.00 0.00 178.15 177.90 2fh0 h ALA 102 N 1.52 0.82 -0.25 1.87 0.00 -1.32 -2.92 119.26 118.98 2fh0 h ALA 102 Ca 0.21 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 2fh0 h ALA 102 Cb 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2fh0 h ALA 102 CO -0.03 0.73 -0.02 -0.22 0.00 0.00 0.00 179.25 179.70 2fh0 h LYS 103 N 0.00 0.46 -0.03 0.00 3.11 -1.05 -3.10 116.57 115.96 2fh0 h LYS 103 Ca -0.01 -0.16 -0.12 0.00 -2.81 0.00 0.00 60.65 57.56 2fh0 h LYS 103 Cb 1.20 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 32.38 2fh0 h LYS 103 CO 0.08 0.65 -0.52 -0.56 -2.81 0.00 0.00 179.45 176.29 2fh0 h GLN 104 N 0.22 0.09 -6.02 1.90 -0.00 -1.53 -3.33 115.11 106.45 2fh0 h GLN 104 Ca 0.07 -0.05 -0.47 0.00 -0.00 0.00 0.00 58.65 58.19 2fh0 h GLN 104 Cb 0.46 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 27.88 2fh0 h GLN 104 CO 0.02 0.59 1.15 -1.14 -0.00 0.00 0.00 178.83 179.44 2fh0 s GLN 105 N -3.88 2.92 0.00 0.06 -0.44 -1.10 -4.59 119.66 112.63 2fh0 s GLN 105 Ca -0.03 -0.16 0.00 0.00 -2.50 0.00 0.00 55.36 52.67 2fh0 s GLN 105 Cb 0.13 -4.72 0.00 0.00 -1.64 0.00 0.00 33.01 26.79 2fh0 s GLN 105 CO 0.76 -2.68 0.00 0.09 0.50 0.00 0.00 175.29 173.96 2fh0 n ASN 106 N 11.59 0.00 -3.59 6.67 3.02 -1.26 -4.64 115.26 127.04 2fh0 n ASN 106 Ca 0.24 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.72 2fh0 n ASN 106 Cb 0.50 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.63 2fh0 n ASN 106 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2fh0 s SER 107 N -1.84 -0.26 0.28 6.41 0.15 -1.25 -5.09 113.70 112.11 2fh0 s SER 107 Ca 0.00 0.23 -0.10 0.00 0.70 0.00 0.00 55.95 56.78 2fh0 s SER 107 Cb 0.00 0.22 -0.07 0.00 -1.71 0.00 0.00 66.02 64.46 2fh0 s SER 107 CO 0.00 -0.28 0.61 -1.58 1.20 0.00 0.00 173.24 173.20 2fh0 s GLN 108 N -1.43 3.80 0.22 5.44 0.74 -1.25 -4.73 119.66 122.45 2fh0 s GLN 108 Ca 0.03 0.32 0.06 0.00 0.05 0.00 0.00 55.36 55.82 2fh0 s GLN 108 Cb -0.01 -2.57 -0.04 0.00 1.10 0.00 0.00 33.01 31.49 2fh0 s GLN 108 CO -0.02 0.22 0.19 1.21 -0.55 0.00 0.00 175.29 176.34 2fh0 s ASN 109 N -2.60 5.60 -0.47 6.67 3.04 -1.26 -5.05 114.94 120.87 2fh0 s ASN 109 Ca 0.48 -0.17 -0.09 0.00 0.04 0.00 0.00 52.86 53.12 2fh0 s ASN 109 Cb -0.11 -1.46 0.12 0.00 -1.54 0.00 0.00 41.25 38.26 2fh0 s ASN 109 CO 0.23 -0.00 0.35 0.20 -3.04 0.00 0.00 177.10 174.84 2fh0 s ASN 110 N -3.58 5.73 -0.09 -4.21 0.01 -1.26 -5.04 114.94 106.49 2fh0 s ASN 110 Ca 0.32 -1.90 -0.13 0.00 -0.71 0.00 0.00 52.86 50.45 2fh0 s ASN 110 Cb -0.09 -2.02 0.03 0.00 0.41 0.00 0.00 41.25 39.58 2fh0 s ASN 110 CO 0.25 -0.70 0.34 -0.55 -1.51 0.00 0.00 177.10 174.93 2fh0 s SER 111 N 2.70 -0.31 -1.55 -1.22 0.15 -1.26 -4.88 113.70 107.33 2fh0 s SER 111 Ca 0.06 0.51 0.00 0.00 0.70 0.00 0.00 55.95 57.22 2fh0 s SER 111 Cb -0.26 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.63 2fh0 s SER 111 CO -0.00 -0.22 0.00 1.17 1.20 0.00 0.00 173.24 175.39 2fh0 n LYS 112 N 2.40 -1.28 0.00 5.44 4.81 -1.26 -4.81 118.16 123.46 2fh0 n LYS 112 Ca -0.16 0.90 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 2fh0 n LYS 112 Cb 0.57 -5.27 0.00 0.00 0.02 0.00 0.00 35.03 30.36 2fh0 n LYS 112 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2fh0 n ILE 113 N -3.53 0.00 0.04 3.15 5.41 -1.26 -4.77 119.36 118.40 2fh0 n ILE 113 Ca -0.19 0.00 0.22 0.00 1.00 0.00 0.00 62.75 63.78 2fh0 n ILE 113 Cb 0.62 -0.54 0.73 0.00 -0.71 0.00 0.00 39.64 39.74 2fh0 n ILE 113 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 176.55 176.71 2fh0 h ILE 114 N 0.00 0.42 0.09 1.39 3.07 -1.91 -1.96 117.51 118.60 2fh0 h ILE 114 Ca 0.00 0.00 0.01 0.00 1.55 0.00 0.00 64.86 66.42 2fh0 h ILE 114 Cb 0.58 0.63 -0.02 0.00 -0.27 0.00 0.00 36.82 37.74 2fh0 h ILE 114 CO 0.00 0.00 -0.15 0.15 -1.05 0.00 0.00 178.15 177.10 2fh0 h PHE 115 N 0.00 -0.39 -0.03 0.16 3.04 -1.98 -3.54 116.94 114.20 2fh0 h PHE 115 Ca 0.24 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.19 2fh0 h PHE 115 Cb 1.19 0.16 0.00 0.00 2.56 0.00 0.00 35.95 39.86 2fh0 h PHE 115 CO 0.00 -0.22 0.00 0.39 -2.02 0.00 0.00 178.31 176.46