#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 4.13 -0.33 1.61 2.02 -1.26 -4.98 118.70 119.89 2fh0 s GLU 37 Ca 0.00 0.68 0.05 0.00 0.02 0.00 0.00 54.97 55.72 2fh0 s GLU 37 Cb 0.00 -2.97 0.20 0.00 0.10 0.00 0.00 34.13 31.46 2fh0 s GLU 37 CO 0.00 0.48 1.17 -1.71 0.02 0.00 0.00 175.26 175.21 2fh0 n ASN 38 N 0.94 -1.38 0.03 -0.19 5.15 -1.26 -5.03 115.26 113.52 2fh0 n ASN 38 Ca -0.05 -1.95 -0.00 0.00 -0.60 0.00 0.00 54.58 51.98 2fh0 n ASN 38 Cb 0.51 0.94 -0.00 0.00 -0.53 0.00 0.00 39.78 40.70 2fh0 n ASN 38 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2fh0 n SER 39 N -0.58 0.74 -3.98 1.20 3.41 -1.26 -4.98 113.62 108.18 2fh0 n SER 39 Ca -0.16 0.09 -0.30 0.00 -0.26 0.00 0.00 58.87 58.24 2fh0 n SER 39 Cb 0.73 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 64.30 2fh0 n SER 39 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fh0 s ALA 40 N -2.02 3.11 0.56 7.33 0.00 -1.26 -4.97 121.76 124.52 2fh0 s ALA 40 Ca -0.01 -2.93 0.30 0.00 0.00 0.00 0.00 51.96 49.33 2fh0 s ALA 40 Cb 0.00 -2.07 1.46 0.00 0.00 0.00 0.00 23.12 22.51 2fh0 s ALA 40 CO 0.01 -1.87 1.86 -1.35 0.00 0.00 0.00 175.76 174.42 2fh0 h PRO 41 N 7.02 0.00 -5.90 0.00 0.11 -1.99 -3.40 132.00 127.83 2fh0 h PRO 41 Ca -0.06 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.47 2fh0 h PRO 41 Cb 0.95 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 2fh0 h PRO 41 CO 0.61 0.00 1.51 1.33 -0.21 0.00 0.00 178.00 181.24 2fh0 n VAL 42 N -3.99 0.24 0.00 3.15 0.24 -1.26 -0.86 118.33 115.85 2fh0 n VAL 42 Ca 0.15 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 2fh0 n VAL 42 Cb 0.88 -2.41 0.00 0.00 -1.47 0.00 0.00 33.84 30.84 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 5.97 2.92 0.25 7.63 0.00 -1.26 -4.82 105.19 115.88 2fh0 n GLY 43 Ca 0.34 -0.80 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 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 0.80 -0.38 4.61 0.00 -1.69 0.13 119.26 122.74 2fh0 h ALA 44 Ca 0.00 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.34 2fh0 h ALA 44 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2fh0 h ALA 44 CO 0.00 0.65 -0.39 0.00 0.00 0.00 0.00 179.25 179.51 2fh0 h ALA 45 N 1.02 0.59 0.00 0.00 0.00 -1.32 -3.14 119.26 116.42 2fh0 h ALA 45 Ca 0.07 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.40 2fh0 h ALA 45 Cb 0.85 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2fh0 h ALA 45 CO 0.07 0.68 -0.64 -0.84 0.00 0.00 0.00 179.25 178.52 2fh0 h ILE 46 N 0.75 0.91 0.00 0.00 -0.00 -1.74 -3.25 117.51 114.17 2fh0 h ILE 46 Ca 0.06 -2.31 -0.03 0.00 -0.00 0.00 0.00 64.86 62.58 2fh0 h ILE 46 Cb 0.98 2.42 -0.00 0.00 -0.00 0.00 0.00 36.82 40.22 2fh0 h ILE 46 CO 0.09 0.52 -0.16 0.00 -0.00 0.00 0.00 178.15 178.60 2fh0 h ALA 47 N 1.44 1.40 -0.00 0.16 0.00 -0.70 -1.55 119.26 120.01 2fh0 h ALA 47 Ca -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2fh0 h ALA 47 Cb 1.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2fh0 h ALA 47 CO 0.07 0.20 -0.07 0.09 0.00 0.00 0.00 179.25 179.54 2fh0 n ASN 48 N -3.86 0.23 -1.48 0.00 3.02 -1.20 -3.49 115.26 108.49 2fh0 n ASN 48 Ca -0.02 -0.34 0.04 0.00 -0.03 0.00 0.00 54.58 54.24 2fh0 n ASN 48 Cb 0.26 -0.17 0.28 0.00 -0.61 0.00 0.00 39.78 39.53 2fh0 n ASN 48 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2fh0 n PHE 49 N -1.14 1.47 -0.67 3.10 7.35 -0.58 -4.01 117.46 122.97 2fh0 n PHE 49 Ca 0.14 -0.53 0.07 0.00 -0.76 0.00 0.00 57.45 56.37 2fh0 n PHE 49 Cb 0.26 -0.40 0.19 0.00 0.35 0.00 0.00 39.48 39.88 2fh0 n PHE 49 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2fh0 n LEU 50 N 0.40 3.21 -1.59 -2.13 4.32 -1.23 -2.61 117.00 117.37 2fh0 n LEU 50 Ca 0.20 -2.63 0.00 0.00 -0.02 0.00 0.00 56.01 53.56 2fh0 n LEU 50 Cb 0.92 -0.38 0.00 0.00 -1.62 0.00 0.00 43.42 42.34 2fh0 n LEU 50 CO 0.23 0.68 -0.43 -0.62 -1.22 0.00 0.00 177.39 176.03 2fh0 n GLU 51 N -0.34 -4.51 -0.28 3.23 -0.58 -1.24 -3.12 120.64 113.81 2fh0 n GLU 51 Ca 0.16 3.31 0.10 0.00 -0.42 0.00 0.00 57.16 60.31 2fh0 n GLU 51 Cb 0.66 -3.68 0.35 0.00 -0.57 0.00 0.00 31.44 28.20 2fh0 n GLU 51 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 2fh0 h PRO 52 N 2.14 0.73 -0.09 3.49 0.11 -1.91 0.24 132.00 136.71 2fh0 h PRO 52 Ca 0.00 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 2fh0 h PRO 52 Cb 0.00 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 30.94 2fh0 h PRO 52 CO 0.00 0.49 -0.10 1.96 -0.21 0.00 0.00 178.00 180.14 2fh0 h GLN 53 N 0.76 0.23 -0.05 1.05 4.20 -1.94 -3.06 115.11 116.29 2fh0 h GLN 53 Ca 0.44 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.93 2fh0 h GLN 53 Cb 0.62 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 2fh0 h GLN 53 CO -0.20 0.66 -0.40 0.00 -0.67 0.00 0.00 178.83 178.22 2fh0 h ALA 54 N 0.57 1.25 -0.48 3.87 0.00 -1.52 -3.02 119.26 119.92 2fh0 h ALA 54 Ca 0.01 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.56 2fh0 h ALA 54 Cb 0.62 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2fh0 h ALA 54 CO 0.02 0.54 0.30 1.25 0.00 0.00 0.00 179.25 181.36 2fh0 h LEU 55 N 0.09 0.49 -0.63 0.00 6.46 -0.48 -1.22 115.31 120.02 2fh0 h LEU 55 Ca 0.01 -0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2fh0 h LEU 55 Cb 0.74 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.54 2fh0 h LEU 55 CO 0.06 0.35 0.38 -0.08 -0.62 0.00 0.00 178.44 178.52 2fh0 h GLU 56 N 0.60 0.85 -0.43 1.25 4.81 -1.43 -1.99 114.58 118.25 2fh0 h GLU 56 Ca 0.19 -0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.36 2fh0 h GLU 56 Cb -0.01 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 2fh0 h GLU 56 CO -0.08 0.61 0.25 -0.09 -0.73 0.00 0.00 179.01 178.98 2fh0 h ARG 57 N 0.85 0.49 -0.74 1.92 1.12 -1.36 -2.00 114.38 114.67 2fh0 h ARG 57 Ca 0.23 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 59.07 2fh0 h ARG 57 Cb -0.02 -0.11 -0.04 0.00 -0.01 0.00 0.00 29.97 29.79 2fh0 h ARG 57 CO -0.04 0.33 0.47 1.25 -3.11 0.00 0.00 179.97 178.87 2fh0 h LEU 58 N 0.51 0.86 -0.62 3.80 5.85 -0.92 -1.63 115.31 123.16 2fh0 h LEU 58 Ca 0.17 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 2fh0 h LEU 58 Cb 0.01 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 2fh0 h LEU 58 CO -0.08 0.64 0.21 0.28 -0.34 0.00 0.00 178.44 179.15 2fh0 h SER 59 N 1.00 0.89 -0.28 1.25 0.02 -0.73 0.10 113.55 115.80 2fh0 h SER 59 Ca 0.27 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 2fh0 h SER 59 Cb -0.09 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 2fh0 h SER 59 CO -0.05 0.84 0.01 -0.09 -1.14 0.00 0.00 176.83 176.40 2fh0 h ARG 60 N 0.88 0.49 -0.47 3.45 9.65 -0.83 -2.95 114.38 124.61 2fh0 h ARG 60 Ca 0.20 -0.15 -0.13 0.00 -1.10 0.00 0.00 59.98 58.81 2fh0 h ARG 60 Cb 0.26 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 2fh0 h ARG 60 CO -0.01 0.63 -0.21 -0.24 2.80 0.00 0.00 179.97 182.95 2fh0 h VAL 61 N 0.29 1.27 -0.37 0.20 3.04 -1.21 -2.95 116.25 116.51 2fh0 h VAL 61 Ca 0.08 -1.37 0.11 0.00 -1.01 0.00 0.00 66.70 64.51 2fh0 h VAL 61 Cb 0.40 1.15 -0.01 0.00 -2.01 0.00 0.00 31.29 30.82 2fh0 h VAL 61 CO 0.01 0.47 0.27 0.00 -1.01 0.00 0.00 177.57 177.31 2fh0 h ALA 62 N 0.86 2.34 -0.40 3.17 0.00 -0.75 0.35 119.26 124.83 2fh0 h ALA 62 Ca 0.11 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2fh0 h ALA 62 Cb 0.78 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2fh0 h ALA 62 CO 0.06 -0.46 0.03 -0.07 0.00 0.00 0.00 179.25 178.81 2fh0 h LEU 63 N 0.00 0.58 0.00 0.00 3.38 -1.34 -3.09 115.31 114.85 2fh0 h LEU 63 Ca 0.18 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2fh0 h LEU 63 Cb 0.72 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 2fh0 h LEU 63 CO -0.00 0.63 -0.90 0.52 0.09 0.00 0.00 178.44 178.79 2fh0 n VAL 64 N -4.27 1.48 -3.87 1.22 0.31 -0.31 -4.83 118.33 108.05 2fh0 n VAL 64 Ca 0.02 0.15 -0.32 0.00 -0.01 0.00 0.00 64.34 64.18 2fh0 n VAL 64 Cb 0.25 -2.35 -0.12 0.00 -0.91 0.00 0.00 33.84 30.71 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 -2.69 2.29 0.46 5.55 3.00 0.11 -4.93 118.95 122.73 2fh0 s ARG 65 Ca -0.25 -2.77 0.11 0.00 0.00 0.00 0.00 55.73 52.82 2fh0 s ARG 65 Cb 0.04 -3.48 1.06 0.00 0.00 0.00 0.00 34.95 32.57 2fh0 s ARG 65 CO 0.37 -1.17 2.10 -0.09 0.00 0.00 0.00 175.30 176.51 2fh0 h ARG 66 N 6.40 0.28 -0.89 3.54 1.12 -1.70 -2.33 114.38 120.80 2fh0 h ARG 66 Ca -0.01 -0.02 0.09 0.00 -1.11 0.00 0.00 59.98 58.94 2fh0 h ARG 66 Cb 0.88 -0.06 -0.07 0.00 -0.01 0.00 0.00 29.97 30.70 2fh0 h ARG 66 CO 0.71 0.19 0.54 -0.44 -3.11 0.00 0.00 179.97 177.86 2fh0 h ASP 67 N 0.29 0.80 -0.08 -3.80 5.19 -1.91 0.41 116.42 117.32 2fh0 h ASP 67 Ca 0.08 0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.52 2fh0 h ASP 67 Cb -0.01 -0.12 -0.00 0.00 0.18 0.00 0.00 39.33 39.37 2fh0 h ASP 67 CO -0.02 0.46 -0.00 0.03 -3.12 0.00 0.00 179.24 176.59 2fh0 h ARG 68 N 0.91 0.13 -0.53 3.56 -0.00 -1.79 -2.36 114.38 114.31 2fh0 h ARG 68 Ca 0.42 -0.04 -0.08 0.00 -0.50 0.00 0.00 59.98 59.78 2fh0 h ARG 68 Cb 0.35 -0.01 -0.02 0.00 0.00 0.00 0.00 29.97 30.29 2fh0 h ARG 68 CO -0.23 0.40 -0.00 0.00 0.00 0.00 0.00 179.97 180.14 2fh0 h ALA 69 N 0.73 0.71 -0.34 0.04 0.00 -1.39 -2.74 119.26 116.26 2fh0 h ALA 69 Ca 0.02 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 2fh0 h ALA 69 Cb 0.34 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2fh0 h ALA 69 CO 0.00 0.53 -0.00 -0.56 0.00 0.00 0.00 179.25 179.22 2fh0 h GLN 70 N 0.80 0.53 -0.24 0.00 -0.00 -0.22 -2.35 115.11 113.64 2fh0 h GLN 70 Ca 0.15 -0.11 -0.11 0.00 -0.00 0.00 0.00 58.65 58.57 2fh0 h GLN 70 Cb 0.53 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.48 27.92 2fh0 h GLN 70 CO 0.03 0.56 -0.33 0.00 -0.00 0.00 0.00 178.83 179.08 2fh0 h ALA 71 N 1.50 0.98 -0.18 0.06 0.00 -1.27 -2.55 119.26 117.80 2fh0 h ALA 71 Ca 0.11 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2fh0 h ALA 71 Cb 0.33 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2fh0 h ALA 71 CO 0.01 0.60 0.08 0.28 0.00 0.00 0.00 179.25 180.23 2fh0 h VAL 72 N 0.43 1.14 -0.49 0.00 2.07 -1.13 0.14 116.25 118.42 2fh0 h VAL 72 Ca 0.05 -0.42 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 2fh0 h VAL 72 Cb 0.79 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 2fh0 h VAL 72 CO 0.06 0.14 0.14 1.05 0.02 0.00 0.00 177.57 178.98 2fh0 h GLU 73 N 0.16 0.72 -0.20 1.57 4.11 -1.46 -1.61 114.58 117.87 2fh0 h GLU 73 Ca 0.06 -0.13 -0.14 0.00 0.07 0.00 0.00 59.36 59.23 2fh0 h GLU 73 Cb 0.14 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2fh0 h GLU 73 CO -0.01 0.64 -0.46 1.15 0.07 0.00 0.00 179.01 180.40 2fh0 h THR 74 N 0.71 1.31 -0.10 -1.06 2.02 -1.17 -1.35 112.91 113.27 2fh0 h THR 74 Ca 0.16 -1.66 -0.02 0.00 0.77 0.00 0.00 66.41 65.66 2fh0 h THR 74 Cb 0.23 1.66 -0.00 0.00 -1.74 0.00 0.00 68.15 68.29 2fh0 h THR 74 CO -0.01 0.52 -0.01 0.22 0.37 0.00 0.00 175.52 176.61 2fh0 h TYR 75 N 0.41 0.19 -0.27 3.16 5.03 -0.45 -2.13 116.97 122.91 2fh0 h TYR 75 Ca 0.03 -0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.27 2fh0 h TYR 75 Cb 0.97 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 39.19 2fh0 h TYR 75 CO 0.04 0.45 0.06 1.25 -1.32 0.00 0.00 178.16 178.64 2fh0 h LEU 76 N -0.12 0.41 -1.62 2.82 5.85 -1.30 -2.79 115.31 118.56 2fh0 h LEU 76 Ca 0.03 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.53 2fh0 h LEU 76 Cb 0.38 -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 0.28 0.07 -0.34 0.00 0.00 178.44 179.01 2fh0 h LYS 77 N 0.26 0.49 -0.25 1.25 5.09 -1.27 -1.26 116.57 120.88 2fh0 h LYS 77 Ca 0.08 -0.03 -0.02 0.00 0.09 0.00 0.00 60.65 60.77 2fh0 h LYS 77 Cb 0.30 -0.11 -0.01 0.00 0.10 0.00 0.00 32.23 32.51 2fh0 h LYS 77 CO 0.00 0.32 0.07 -0.22 -2.09 0.00 0.00 179.45 177.54 2fh0 h LYS 78 N 0.50 0.40 -0.21 0.07 3.11 -1.13 0.30 116.57 119.61 2fh0 h LYS 78 Ca 0.17 -0.09 -0.02 0.00 -2.81 0.00 0.00 60.65 57.89 2fh0 h LYS 78 Cb 0.05 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.21 2fh0 h LYS 78 CO -0.04 0.48 0.05 -0.07 -2.81 0.00 0.00 179.45 177.06 2fh0 h LEU 79 N 0.24 0.33 -0.47 5.20 3.38 -1.17 -0.68 115.31 122.13 2fh0 h LEU 79 Ca 0.08 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 2fh0 h LEU 79 Cb 0.26 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2fh0 h LEU 79 CO -0.00 0.48 0.10 0.40 0.09 0.00 0.00 178.44 179.51 2fh0 h ILE 80 N 0.16 1.24 -0.29 1.22 2.04 -1.03 0.71 117.51 121.56 2fh0 h ILE 80 Ca 0.07 -0.87 -0.06 0.00 1.00 0.00 0.00 64.86 65.00 2fh0 h ILE 80 Cb 0.29 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2fh0 h ILE 80 CO 0.00 0.31 -0.06 0.00 0.00 0.00 0.00 178.15 178.40 2fh0 h ALA 81 N 0.97 1.37 0.23 1.87 0.00 -0.32 -3.27 119.26 120.11 2fh0 h ALA 81 Ca 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2fh0 h ALA 81 Cb 0.35 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2fh0 h ALA 81 CO 0.01 0.43 -0.11 1.15 0.00 0.00 0.00 179.25 180.73 2fh0 h THR 82 N 0.43 0.00 0.00 0.00 2.02 -0.89 -3.49 112.91 110.99 2fh0 h THR 82 Ca 0.09 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.74 2fh0 h THR 82 Cb 0.38 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 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 -4.30 0.00 -4.55 4.18 6.94 -0.41 -5.09 115.26 112.03 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 0.12 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.50 2fh0 n ASN 83 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 2fh0 s ASN 84 N -0.28 4.67 -0.28 0.53 0.01 0.11 -4.73 114.94 114.96 2fh0 s ASN 84 Ca 0.00 0.51 0.18 0.00 -0.71 0.00 0.00 52.86 52.84 2fh0 s ASN 84 Cb 0.00 -2.52 0.49 0.00 0.41 0.00 0.00 41.25 39.63 2fh0 s ASN 84 CO 0.00 -2.88 1.10 0.52 -1.51 0.00 0.00 177.10 174.33 2fh0 n VAL 85 N 7.87 1.51 -2.22 1.60 0.31 -1.26 -2.69 118.33 123.46 2fh0 n VAL 85 Ca 0.34 -3.27 -0.13 0.00 -0.01 0.00 0.00 64.34 61.27 2fh0 n VAL 85 Cb 0.51 0.64 0.05 0.00 -0.91 0.00 0.00 33.84 34.13 2fh0 n VAL 85 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2fh0 n THR 86 N -0.53 2.03 -3.77 2.52 -2.24 -1.26 -5.06 114.28 105.96 2fh0 n THR 86 Ca 0.16 -3.61 -0.00 0.00 -2.27 0.00 0.00 64.05 58.32 2fh0 n THR 86 Cb 0.83 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 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 -3.44 -0.03 0.03 4.78 -3.43 -1.26 -5.19 115.29 106.76 2fh0 s HIS 87 Ca 0.42 -0.19 -0.05 0.00 -0.80 0.00 0.00 55.06 54.44 2fh0 s HIS 87 Cb 0.38 0.60 -0.01 0.00 -1.43 0.00 0.00 32.58 32.12 2fh0 s HIS 87 CO -0.00 -0.54 0.09 0.15 -2.00 0.00 0.00 174.74 172.43 2fh0 s LYS 88 N -2.51 0.56 -0.68 -0.38 3.01 -1.26 -5.01 119.74 113.48 2fh0 s LYS 88 Ca 0.18 -0.73 -0.27 0.00 -1.01 0.00 0.00 55.97 54.14 2fh0 s LYS 88 Cb 0.01 0.22 0.02 0.00 -1.01 0.00 0.00 37.83 37.07 2fh0 s LYS 88 CO 0.00 -0.14 1.35 0.42 0.51 0.00 0.00 175.35 177.49 2fh0 s ILE 89 N -2.47 3.73 0.93 2.17 1.01 -1.07 -4.92 121.20 120.57 2fh0 s ILE 89 Ca -0.06 0.49 -0.14 0.00 0.00 0.00 0.00 60.65 60.94 2fh0 s ILE 89 Cb -0.02 -4.73 0.16 0.00 0.01 0.00 0.00 42.46 37.88 2fh0 s ILE 89 CO -0.04 -1.60 1.20 0.42 0.00 0.00 0.00 174.94 174.92 2fh0 s THR 90 N 6.03 1.96 0.26 2.92 -4.23 -1.26 -3.65 115.64 117.67 2fh0 s THR 90 Ca 0.42 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.91 2fh0 s THR 90 Cb -0.09 -2.86 0.25 0.00 1.34 0.00 0.00 72.50 71.14 2fh0 s THR 90 CO 0.18 0.00 1.82 -0.08 -0.54 0.00 0.00 174.62 176.01 2fh0 h GLU 91 N -1.54 0.88 -0.34 3.99 4.81 -1.88 0.40 114.58 120.89 2fh0 h GLU 91 Ca -0.47 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 58.57 2fh0 h GLU 91 Cb 1.30 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 2fh0 h GLU 91 CO 0.53 0.58 -0.34 0.00 -0.73 0.00 0.00 179.01 179.04 2fh0 h ALA 92 N 1.50 0.50 -0.41 2.92 0.00 -2.00 -2.82 119.26 118.96 2fh0 h ALA 92 Ca 0.45 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 2fh0 h ALA 92 Cb 0.42 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2fh0 h ALA 92 CO -0.25 0.57 -0.15 0.93 0.00 0.00 0.00 179.25 180.35 2fh0 h GLU 93 N 0.63 0.83 -0.52 0.00 4.39 -1.64 -2.72 114.58 115.55 2fh0 h GLU 93 Ca 0.05 -0.34 -0.04 0.00 0.34 0.00 0.00 59.36 59.38 2fh0 h GLU 93 Cb 0.93 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.52 2fh0 h GLU 93 CO 0.09 0.97 0.18 0.97 -1.16 0.00 0.00 179.01 180.05 2fh0 h ILE 94 N 0.64 1.20 -0.27 3.13 2.10 -0.25 -0.13 117.51 123.93 2fh0 h ILE 94 Ca 0.10 -0.67 -0.05 0.00 1.08 0.00 0.00 64.86 65.32 2fh0 h ILE 94 Cb 0.70 0.61 -0.01 0.00 -1.09 0.00 0.00 36.82 37.03 2fh0 h ILE 94 CO 0.05 0.26 -0.02 0.58 -1.08 0.00 0.00 178.15 177.93 2fh0 h VAL 95 N 0.75 1.27 -0.29 2.19 2.07 -1.41 0.40 116.25 121.22 2fh0 h VAL 95 Ca 0.18 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.68 2fh0 h VAL 95 Cb 0.20 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2fh0 h VAL 95 CO -0.01 0.31 0.05 0.77 0.02 0.00 0.00 177.57 178.71 2fh0 h SER 96 N 0.27 0.46 -0.49 0.57 4.64 -1.20 0.20 113.55 117.99 2fh0 h SER 96 Ca 0.07 -0.26 -0.11 0.00 -0.47 0.00 0.00 61.79 61.03 2fh0 h SER 96 Cb 0.47 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.42 2fh0 h SER 96 CO 0.02 0.60 -0.10 0.40 -0.87 0.00 0.00 176.83 176.88 2fh0 h ILE 97 N 0.31 1.27 -0.33 0.95 2.04 -1.00 -0.37 117.51 120.38 2fh0 h ILE 97 Ca 0.09 -1.24 -0.02 0.00 1.00 0.00 0.00 64.86 64.69 2fh0 h ILE 97 Cb 0.33 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 2fh0 h ILE 97 CO 0.01 0.43 0.13 0.25 0.00 0.00 0.00 178.15 178.97 2fh0 h LEU 98 N 0.80 0.44 -1.00 1.44 5.85 -0.07 0.23 115.31 123.00 2fh0 h LEU 98 Ca 0.13 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 2fh0 h LEU 98 Cb 0.66 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2fh0 h LEU 98 CO 0.05 0.48 0.03 0.78 -0.34 0.00 0.00 178.44 179.44 2fh0 h ASN 99 N 0.38 0.71 0.49 1.25 2.35 -0.51 -2.65 115.58 117.61 2fh0 h ASN 99 Ca 0.11 -0.15 -0.17 0.00 -0.55 0.00 0.00 56.30 55.53 2fh0 h ASN 99 Cb 0.17 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 2fh0 h ASN 99 CO -0.01 0.76 -0.74 1.23 -1.65 0.00 0.00 177.43 177.02 2fh0 h GLY 100 N 0.95 0.23 0.56 2.83 0.00 -0.76 -3.16 103.07 103.71 2fh0 h GLY 100 Ca 0.15 -0.34 0.09 0.00 0.00 0.00 0.00 47.33 47.22 2fh0 h GLY 100 CO 0.01 0.30 0.44 -2.22 0.00 0.00 0.00 176.54 175.07 2fh0 h ILE 101 N 0.13 0.92 -0.05 2.60 2.04 -0.19 0.17 117.51 123.14 2fh0 h ILE 101 Ca -0.02 -0.26 -0.10 0.00 1.00 0.00 0.00 64.86 65.48 2fh0 h ILE 101 Cb 1.31 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2fh0 h ILE 101 CO 0.11 0.14 -0.43 0.00 0.00 0.00 0.00 178.15 177.97 2fh0 h ALA 102 N 1.43 1.18 -0.10 1.87 0.00 -1.53 -2.71 119.26 119.40 2fh0 h ALA 102 Ca 0.37 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2fh0 h ALA 102 Cb 0.32 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.03 2fh0 h ALA 102 CO -0.23 0.58 -0.44 0.87 0.00 0.00 0.00 179.25 180.03 2fh0 h LYS 103 N 0.09 0.47 0.00 0.00 1.79 -1.09 -3.14 116.57 114.69 2fh0 h LYS 103 Ca 0.01 -0.37 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 2fh0 h LYS 103 Cb 0.81 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.53 2fh0 h LYS 103 CO 0.06 1.00 0.00 -0.56 -1.08 0.00 0.00 179.45 178.88 2fh0 h GLN 104 N 0.04 0.00 -5.35 3.15 3.07 -0.67 -3.41 115.11 111.93 2fh0 h GLN 104 Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.68 2fh0 h GLN 104 Cb 1.08 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.64 2fh0 h GLN 104 CO 0.09 0.00 0.11 1.04 0.09 0.00 0.00 178.83 180.16 2fh0 n GLN 105 N -3.08 0.57 0.00 0.06 1.13 -1.03 -3.03 117.38 112.00 2fh0 n GLN 105 Ca -0.01 -0.81 0.00 0.00 -1.94 0.00 0.00 57.00 54.24 2fh0 n GLN 105 Cb 0.20 -3.66 0.00 0.00 0.11 0.00 0.00 30.24 26.89 2fh0 n GLN 105 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2fh0 n ASN 106 N 18.49 0.00 -3.22 1.08 5.15 -1.26 -5.06 115.26 130.44 2fh0 n ASN 106 Ca 0.47 0.00 -0.05 0.00 -0.60 0.00 0.00 54.58 54.40 2fh0 n ASN 106 Cb 0.43 0.04 0.02 0.00 -0.53 0.00 0.00 39.78 39.74 2fh0 n ASN 106 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2fh0 s SER 107 N -1.95 0.00 0.00 1.20 1.04 -1.17 -5.13 113.70 107.70 2fh0 s SER 107 Ca 0.00 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.60 2fh0 s SER 107 Cb 0.00 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.73 2fh0 s SER 107 CO 0.00 -1.22 0.00 1.67 0.98 0.00 0.00 173.24 174.67 2fh0 n GLN 108 N -0.65 0.00 0.00 4.02 -0.06 -1.26 -4.98 117.38 114.45 2fh0 n GLN 108 Ca -0.05 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.95 2fh0 n GLN 108 Cb 0.60 -0.14 0.00 0.00 -4.06 0.00 0.00 30.24 26.63 2fh0 n GLN 108 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 2fh0 n ASN 109 N -1.81 -3.83 -4.27 1.69 3.02 -1.26 -4.44 115.26 104.36 2fh0 n ASN 109 Ca 0.00 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.11 2fh0 n ASN 109 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 2fh0 n ASN 109 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2fh0 s ASN 110 N -4.00 6.01 0.14 6.41 -0.87 -1.26 -4.92 114.94 116.44 2fh0 s ASN 110 Ca 0.00 -1.90 -0.09 0.00 -1.57 0.00 0.00 52.86 49.30 2fh0 s ASN 110 Cb 0.00 -2.12 -0.06 0.00 -0.02 0.00 0.00 41.25 39.05 2fh0 s ASN 110 CO 0.00 -0.77 1.40 -1.28 -2.57 0.00 0.00 177.10 173.87 2fh0 h SER 111 N 8.63 0.86 0.00 -1.22 0.87 -2.02 -3.36 113.55 117.31 2fh0 h SER 111 Ca -0.24 -0.50 -0.10 0.00 -1.23 0.00 0.00 61.79 59.72 2fh0 h SER 111 Cb 1.08 -0.25 -0.22 0.00 -0.44 0.00 0.00 62.40 62.58 2fh0 h SER 111 CO 0.95 1.28 -0.77 2.29 -0.53 0.00 0.00 176.83 180.05 2fh0 n LYS 112 N -3.96 0.49 -1.19 2.24 0.00 -1.26 -4.79 118.16 109.68 2fh0 n LYS 112 Ca -0.05 -2.25 0.03 0.00 -0.00 0.00 0.00 58.31 56.04 2fh0 n LYS 112 Cb 0.67 -0.57 0.11 0.00 -0.00 0.00 0.00 35.03 35.24 2fh0 n LYS 112 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2fh0 n ILE 113 N -0.09 1.19 0.02 0.58 -0.00 -1.26 -4.77 119.36 115.03 2fh0 n ILE 113 Ca 0.09 -2.28 -0.13 0.00 -0.00 0.00 0.00 62.75 60.43 2fh0 n ILE 113 Cb 0.95 0.34 -0.14 0.00 -0.00 0.00 0.00 39.64 40.79 2fh0 n ILE 113 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 2fh0 h ILE 114 N 3.97 1.00 -0.11 1.39 2.04 -1.87 -3.35 117.51 120.57 2fh0 h ILE 114 Ca -0.09 -2.75 -0.23 0.00 1.00 0.00 0.00 64.86 62.79 2fh0 h ILE 114 Cb 1.44 2.58 0.01 0.00 -0.74 0.00 0.00 36.82 40.11 2fh0 h ILE 114 CO 0.09 0.70 -0.82 0.15 0.00 0.00 0.00 178.15 178.27 2fh0 h PHE 115 N 0.03 0.99 0.00 1.37 3.04 -1.96 -3.54 116.94 116.87 2fh0 h PHE 115 Ca -0.26 -0.46 0.00 0.00 3.98 0.00 0.00 57.97 61.23 2fh0 h PHE 115 Cb 1.99 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 40.35 2fh0 h PHE 115 CO 0.03 1.28 0.00 -1.91 -2.02 0.00 0.00 178.31 175.69