#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fh0 n GLU 37 N 0.00 -5.66 0.02 1.61 0.00 -1.26 -4.79 120.64 110.56 2fh0 n GLU 37 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 57.16 57.91 2fh0 n GLU 37 Cb 0.00 -5.65 0.00 0.00 0.00 0.00 0.00 31.44 25.79 2fh0 n GLU 37 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 2fh0 n ASN 38 N -2.70 -0.03 0.00 4.31 2.85 -1.26 -5.06 115.26 113.38 2fh0 n ASN 38 Ca -0.03 0.07 0.00 0.00 -0.11 0.00 0.00 54.58 54.52 2fh0 n ASN 38 Cb 0.57 0.06 0.00 0.00 1.24 0.00 0.00 39.78 41.65 2fh0 n ASN 38 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2fh0 n SER 39 N -2.64 0.00 -2.80 1.20 7.64 -1.26 -4.82 113.62 110.94 2fh0 n SER 39 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 2fh0 n SER 39 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 2fh0 n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fh0 n ALA 40 N 0.00 -3.15 -1.48 -0.43 0.00 -1.26 -4.65 120.51 109.53 2fh0 n ALA 40 Ca 0.00 0.75 -0.12 0.00 0.00 0.00 0.00 53.44 54.07 2fh0 n ALA 40 Cb 0.00 -1.60 -0.10 0.00 0.00 0.00 0.00 19.45 17.76 2fh0 n ALA 40 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2fh0 n PRO 41 N 1.09 0.17 -2.02 0.00 -0.02 -1.26 -4.44 135.00 128.53 2fh0 n PRO 41 Ca -0.08 -1.16 -0.01 0.00 -2.02 0.00 0.00 63.50 60.23 2fh0 n PRO 41 Cb 0.21 -3.28 0.03 0.00 -0.02 0.00 0.00 33.50 30.44 2fh0 n PRO 41 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2fh0 n VAL 42 N 8.15 0.34 0.00 -1.45 0.24 -1.26 -4.92 118.33 119.43 2fh0 n VAL 42 Ca 0.38 -1.29 0.00 0.00 -2.04 0.00 0.00 64.34 61.39 2fh0 n VAL 42 Cb 0.45 0.97 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 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 -0.38 -0.98 0.24 7.63 0.00 -1.26 -4.96 105.19 105.46 2fh0 n GLY 43 Ca -0.07 0.27 0.07 0.00 0.00 0.00 0.00 46.02 46.30 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 1.58 -0.96 4.61 0.00 -1.93 -2.59 119.26 119.98 2fh0 h ALA 44 Ca 0.00 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.82 2fh0 h ALA 44 Cb 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 2fh0 h ALA 44 CO 0.00 0.20 0.62 0.00 0.00 0.00 0.00 179.25 180.08 2fh0 h ALA 45 N 1.84 1.43 0.00 0.00 0.00 -1.93 -1.59 119.26 119.01 2fh0 h ALA 45 Ca -0.00 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 2fh0 h ALA 45 Cb 0.32 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2fh0 h ALA 45 CO 0.02 0.44 -0.62 0.82 0.00 0.00 0.00 179.25 179.91 2fh0 h ILE 46 N 1.14 0.86 -0.25 0.00 2.04 -1.88 -3.26 117.51 116.17 2fh0 h ILE 46 Ca 0.40 -2.24 -0.01 0.00 1.00 0.00 0.00 64.86 64.01 2fh0 h ILE 46 Cb 0.12 2.40 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 2fh0 h ILE 46 CO -0.14 0.49 0.12 0.00 0.00 0.00 0.00 178.15 178.62 2fh0 h ALA 47 N 1.47 1.76 0.00 1.87 0.00 -1.06 0.22 119.26 123.52 2fh0 h ALA 47 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2fh0 h ALA 47 Cb 1.42 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2fh0 h ALA 47 CO 0.07 0.21 -0.18 0.09 0.00 0.00 0.00 179.25 179.43 2fh0 n ASN 48 N -4.46 0.29 -2.06 0.00 4.13 -1.09 -3.75 115.26 108.33 2fh0 n ASN 48 Ca 0.01 0.28 -0.24 0.00 1.68 0.00 0.00 54.58 56.32 2fh0 n ASN 48 Cb 0.10 -0.29 0.08 0.00 -1.54 0.00 0.00 39.78 38.13 2fh0 n ASN 48 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2fh0 n PHE 49 N -1.65 2.38 -3.72 3.10 3.72 0.06 -4.85 117.46 116.50 2fh0 n PHE 49 Ca 0.06 -2.21 -0.12 0.00 -0.05 0.00 0.00 57.45 55.13 2fh0 n PHE 49 Cb 0.36 -1.08 -0.12 0.00 -0.94 0.00 0.00 39.48 37.70 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 -2.73 0.31 0.61 4.37 1.43 -1.25 -3.79 118.68 117.63 2fh0 s LEU 50 Ca 0.47 0.67 -0.19 0.00 -1.03 0.00 0.00 54.13 54.04 2fh0 s LEU 50 Cb 0.37 1.00 -0.03 0.00 0.03 0.00 0.00 46.19 47.57 2fh0 s LEU 50 CO 0.02 -0.16 1.28 -1.61 0.23 0.00 0.00 176.35 176.11 2fh0 s GLU 51 N 1.11 2.82 0.17 1.70 2.02 -1.25 -4.85 118.70 120.42 2fh0 s GLU 51 Ca -0.08 2.03 -0.14 0.00 0.02 0.00 0.00 54.97 56.80 2fh0 s GLU 51 Cb -0.08 -1.96 0.06 0.00 0.10 0.00 0.00 34.13 32.25 2fh0 s GLU 51 CO -0.08 -1.38 1.83 -1.00 0.02 0.00 0.00 175.26 174.65 2fh0 h PRO 52 N 0.86 0.70 -0.25 0.39 0.13 -1.97 -1.37 132.00 130.49 2fh0 h PRO 52 Ca -0.51 -0.05 -0.13 0.00 -0.87 0.00 0.00 66.00 64.44 2fh0 h PRO 52 Cb 1.32 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2fh0 h PRO 52 CO 0.55 0.47 -0.40 1.96 -0.23 0.00 0.00 178.00 180.35 2fh0 h GLN 53 N 0.71 0.59 -0.33 0.86 1.08 -1.98 -2.79 115.11 113.25 2fh0 h GLN 53 Ca 0.19 -0.30 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 2fh0 h GLN 53 Cb -0.07 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 2fh0 h GLN 53 CO -0.04 0.89 0.17 0.00 -0.95 0.00 0.00 178.83 178.90 2fh0 h ALA 54 N 1.08 0.43 -0.59 3.87 0.00 -1.77 -1.27 119.26 121.01 2fh0 h ALA 54 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2fh0 h ALA 54 Cb 0.90 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2fh0 h ALA 54 CO 0.08 -0.03 0.38 -0.07 0.00 0.00 0.00 179.25 179.60 2fh0 h LEU 55 N 0.41 0.69 -0.50 0.00 3.38 -1.21 -0.86 115.31 117.22 2fh0 h LEU 55 Ca 0.12 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2fh0 h LEU 55 Cb 0.08 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2fh0 h LEU 55 CO -0.02 0.52 0.31 -0.08 0.09 0.00 0.00 178.44 179.26 2fh0 h GLU 56 N 0.80 0.67 -0.89 1.13 4.81 -1.28 -1.94 114.58 117.87 2fh0 h GLU 56 Ca 0.21 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 2fh0 h GLU 56 Cb -0.06 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.13 2fh0 h GLU 56 CO -0.04 0.47 0.48 -0.09 -0.73 0.00 0.00 179.01 179.09 2fh0 h ARG 57 N 0.67 1.25 -0.29 1.92 1.12 -0.87 -2.26 114.38 115.93 2fh0 h ARG 57 Ca 0.18 -0.16 -0.04 0.00 -1.11 0.00 0.00 59.98 58.86 2fh0 h ARG 57 Cb -0.04 -0.24 -0.02 0.00 -0.01 0.00 0.00 29.97 29.66 2fh0 h ARG 57 CO -0.04 0.93 0.02 1.25 -3.11 0.00 0.00 179.97 179.02 2fh0 h LEU 58 N 1.26 0.40 -0.63 3.80 5.85 -0.68 -2.55 115.31 122.75 2fh0 h LEU 58 Ca 0.31 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.92 2fh0 h LEU 58 Cb 0.05 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 2fh0 h LEU 58 CO -0.05 0.45 0.19 0.28 -0.34 0.00 0.00 178.44 178.97 2fh0 h SER 59 N 0.42 0.92 -0.31 1.25 0.02 -0.76 0.17 113.55 115.26 2fh0 h SER 59 Ca 0.10 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 60.80 2fh0 h SER 59 Cb 0.25 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2fh0 h SER 59 CO 0.00 0.88 0.04 -0.09 -1.14 0.00 0.00 176.83 176.53 2fh0 h ARG 60 N 0.90 0.52 -0.44 3.45 2.43 -1.32 -2.69 114.38 117.23 2fh0 h ARG 60 Ca 0.20 -0.15 -0.14 0.00 -0.81 0.00 0.00 59.98 59.08 2fh0 h ARG 60 Cb 0.30 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 2fh0 h ARG 60 CO -0.01 0.63 -0.28 -0.24 -1.51 0.00 0.00 179.97 178.56 2fh0 h VAL 61 N 0.33 1.27 -0.25 0.20 3.04 -1.35 -2.97 116.25 116.52 2fh0 h VAL 61 Ca 0.09 -1.45 0.06 0.00 -1.01 0.00 0.00 66.70 64.39 2fh0 h VAL 61 Cb 0.37 1.23 -0.01 0.00 -2.01 0.00 0.00 31.29 30.87 2fh0 h VAL 61 CO 0.01 0.49 0.18 0.00 -1.01 0.00 0.00 177.57 177.24 2fh0 h ALA 62 N 0.83 2.16 -0.41 3.17 0.00 -0.59 0.31 119.26 124.73 2fh0 h ALA 62 Ca 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2fh0 h ALA 62 Cb 0.87 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2fh0 h ALA 62 CO 0.08 -0.23 0.13 -0.07 0.00 0.00 0.00 179.25 179.16 2fh0 h LEU 63 N 0.06 0.54 0.00 0.00 3.38 -1.31 -2.90 115.31 115.09 2fh0 h LEU 63 Ca 0.12 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2fh0 h LEU 63 Cb 0.39 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2fh0 h LEU 63 CO -0.01 0.52 -0.99 0.52 0.09 0.00 0.00 178.44 178.56 2fh0 n VAL 64 N -4.35 1.47 -3.91 1.22 0.31 -0.42 -4.82 118.33 107.83 2fh0 n VAL 64 Ca 0.03 0.10 -0.30 0.00 -0.01 0.00 0.00 64.34 64.15 2fh0 n VAL 64 Cb 0.17 -2.29 -0.13 0.00 -0.91 0.00 0.00 33.84 30.68 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 -2.55 2.15 0.47 5.55 1.81 0.96 -4.94 118.95 122.40 2fh0 s ARG 65 Ca -0.24 -2.76 0.12 0.00 -1.72 0.00 0.00 55.73 51.13 2fh0 s ARG 65 Cb 0.05 -3.39 1.08 0.00 -0.45 0.00 0.00 34.95 32.24 2fh0 s ARG 65 CO 0.37 -1.15 2.10 0.07 -0.68 0.00 0.00 175.30 176.01 2fh0 h ARG 66 N 6.34 0.23 -0.84 3.54 -0.00 -1.69 -2.30 114.38 119.66 2fh0 h ARG 66 Ca -0.03 -0.02 0.13 0.00 -0.00 0.00 0.00 59.98 60.06 2fh0 h ARG 66 Cb 0.87 -0.05 -0.06 0.00 -0.00 0.00 0.00 29.97 30.73 2fh0 h ARG 66 CO 0.70 0.16 0.55 -0.44 -0.00 0.00 0.00 179.97 180.94 2fh0 h ASP 67 N 0.23 0.63 -0.50 0.08 3.32 -1.92 -1.01 116.42 117.26 2fh0 h ASP 67 Ca 0.06 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 2fh0 h ASP 67 Cb -0.00 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2fh0 h ASP 67 CO -0.01 0.34 0.29 0.03 -1.72 0.00 0.00 179.24 178.17 2fh0 h ARG 68 N 0.68 0.69 -0.28 3.56 3.08 -1.78 -2.39 114.38 117.95 2fh0 h ARG 68 Ca 0.41 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.36 2fh0 h ARG 68 Cb 0.62 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 2fh0 h ARG 68 CO -0.17 0.52 0.05 0.00 -1.07 0.00 0.00 179.97 179.30 2fh0 h ALA 69 N 1.13 1.58 -0.14 0.04 0.00 -1.30 -2.38 119.26 118.19 2fh0 h ALA 69 Ca 0.18 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2fh0 h ALA 69 Cb 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2fh0 h ALA 69 CO -0.03 0.32 0.02 1.96 0.00 0.00 0.00 179.25 181.52 2fh0 h GLN 70 N 0.40 0.24 -0.30 0.00 1.08 -0.92 -0.39 115.11 115.21 2fh0 h GLN 70 Ca 0.09 -0.07 -0.03 0.00 -1.45 0.00 0.00 58.65 57.20 2fh0 h GLN 70 Cb 0.18 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 2fh0 h GLN 70 CO -0.00 0.43 0.07 0.00 -0.95 0.00 0.00 178.83 178.38 2fh0 h ALA 71 N 0.80 0.40 -0.44 3.87 0.00 -1.31 0.69 119.26 123.26 2fh0 h ALA 71 Ca 0.04 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2fh0 h ALA 71 Cb 0.31 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2fh0 h ALA 71 CO 0.00 0.07 0.09 -0.39 0.00 0.00 0.00 179.25 179.02 2fh0 h VAL 72 N 0.33 1.24 -0.62 0.00 -1.51 -1.44 0.33 116.25 114.58 2fh0 h VAL 72 Ca 0.10 -0.86 -0.08 0.00 -1.23 0.00 0.00 66.70 64.63 2fh0 h VAL 72 Cb 0.30 0.94 -0.02 0.00 -2.13 0.00 0.00 31.29 30.38 2fh0 h VAL 72 CO 0.00 0.30 0.09 -0.33 -1.23 0.00 0.00 177.57 176.40 2fh0 h GLU 73 N 0.59 1.03 -0.06 5.19 4.39 -1.00 -1.84 114.58 122.88 2fh0 h GLU 73 Ca 0.14 -0.28 -0.14 0.00 0.34 0.00 0.00 59.36 59.42 2fh0 h GLU 73 Cb 0.35 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2fh0 h GLU 73 CO 0.01 0.97 -0.58 1.15 -1.16 0.00 0.00 179.01 179.39 2fh0 h THR 74 N 0.93 1.38 -0.34 1.13 2.02 -0.70 -2.78 112.91 114.56 2fh0 h THR 74 Ca 0.19 -1.94 -0.04 0.00 0.77 0.00 0.00 66.41 65.39 2fh0 h THR 74 Cb 0.44 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.82 2fh0 h THR 74 CO 0.01 0.57 0.06 0.22 0.37 0.00 0.00 175.52 176.76 2fh0 h TYR 75 N 0.16 0.58 -0.30 3.16 5.03 -0.05 0.15 116.97 125.70 2fh0 h TYR 75 Ca -0.00 -0.08 -0.01 0.00 2.58 0.00 0.00 58.73 61.22 2fh0 h TYR 75 Cb 1.07 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 39.17 2fh0 h TYR 75 CO 0.02 0.61 0.14 1.25 -1.32 0.00 0.00 178.16 178.85 2fh0 h LEU 76 N 0.39 0.41 -0.74 2.82 5.85 -1.30 -1.44 115.31 121.30 2fh0 h LEU 76 Ca 0.10 -0.14 -0.13 0.00 0.84 0.00 0.00 57.88 58.55 2fh0 h LEU 76 Cb 0.33 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2fh0 h LEU 76 CO 0.00 0.43 -0.48 0.07 -0.34 0.00 0.00 178.44 178.13 2fh0 h LYS 77 N 0.35 0.37 -0.25 1.25 2.10 -1.44 -2.52 116.57 116.42 2fh0 h LYS 77 Ca 0.10 -0.20 -0.03 0.00 -2.00 0.00 0.00 60.65 58.52 2fh0 h LYS 77 Cb 0.14 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.48 2fh0 h LYS 77 CO -0.01 0.77 0.05 -0.22 -2.00 0.00 0.00 179.45 178.04 2fh0 h LYS 78 N 0.29 0.41 -0.25 0.07 1.63 -0.49 0.15 116.57 118.39 2fh0 h LYS 78 Ca 0.02 -0.10 -0.02 0.00 -0.85 0.00 0.00 60.65 59.69 2fh0 h LYS 78 Cb 0.95 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.52 2fh0 h LYS 78 CO 0.08 0.52 0.07 -0.07 -3.45 0.00 0.00 179.45 176.61 2fh0 h LEU 79 N 0.24 0.36 -1.04 5.20 4.07 -1.25 -1.33 115.31 121.56 2fh0 h LEU 79 Ca 0.08 -0.21 -0.08 0.00 0.08 0.00 0.00 57.88 57.75 2fh0 h LEU 79 Cb 0.30 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.93 2fh0 h LEU 79 CO 0.00 0.48 -0.18 0.40 -1.08 0.00 0.00 178.44 178.06 2fh0 h ILE 80 N 0.23 1.24 0.00 1.22 2.04 -1.42 -1.29 117.51 119.54 2fh0 h ILE 80 Ca 0.08 -1.12 -0.11 0.00 1.00 0.00 0.00 64.86 64.71 2fh0 h ILE 80 Cb 0.25 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2fh0 h ILE 80 CO -0.00 0.36 -0.53 0.00 0.00 0.00 0.00 178.15 177.98 2fh0 h ALA 81 N 1.38 1.10 0.00 1.87 0.00 -0.48 -3.37 119.26 119.75 2fh0 h ALA 81 Ca 0.07 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2fh0 h ALA 81 Cb 0.56 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2fh0 h ALA 81 CO 0.04 0.66 -0.10 1.15 0.00 0.00 0.00 179.25 181.00 2fh0 h THR 82 N 0.00 0.00 0.00 0.00 2.02 -0.94 -3.50 112.91 110.49 2fh0 h THR 82 Ca -0.01 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.85 2fh0 h THR 82 Cb 0.96 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 2fh0 h THR 82 CO 0.07 0.00 0.00 -0.46 0.37 0.00 0.00 175.52 175.50 2fh0 n ASN 83 N -2.96 0.00 -4.56 4.18 0.23 -0.54 -5.08 115.26 106.53 2fh0 n ASN 83 Ca -0.01 0.00 -0.17 0.00 -0.53 0.00 0.00 54.58 53.86 2fh0 n ASN 83 Cb 0.05 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 37.69 2fh0 n ASN 83 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 2fh0 s ASN 84 N -0.64 4.10 -0.46 0.53 0.02 -0.85 -4.80 114.94 112.84 2fh0 s ASN 84 Ca 0.00 0.06 0.06 0.00 -1.02 0.00 0.00 52.86 51.96 2fh0 s ASN 84 Cb 0.00 -2.55 0.21 0.00 0.02 0.00 0.00 41.25 38.93 2fh0 s ASN 84 CO 0.00 -3.65 0.46 0.52 0.02 0.00 0.00 177.10 174.46 2fh0 n VAL 85 N 8.59 -0.39 -0.02 1.60 0.31 -1.26 -3.65 118.33 123.52 2fh0 n VAL 85 Ca 0.45 -3.96 0.04 0.00 -0.01 0.00 0.00 64.34 60.86 2fh0 n VAL 85 Cb 0.45 -1.86 -0.11 0.00 -0.91 0.00 0.00 33.84 31.40 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 2.03 0.20 -3.72 2.52 -2.24 -1.26 -5.09 114.28 106.73 2fh0 n THR 86 Ca 0.26 -0.38 -0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2fh0 n THR 86 Cb 0.48 -0.01 0.01 0.00 -2.10 0.00 0.00 70.33 68.71 2fh0 n THR 86 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fh0 n HIS 87 N -2.11 -0.70 -3.51 4.78 1.44 -1.26 -5.19 115.22 108.68 2fh0 n HIS 87 Ca -0.07 -0.46 -0.23 0.00 -2.01 0.00 0.00 57.72 54.95 2fh0 n HIS 87 Cb 0.50 0.22 0.02 0.00 0.12 0.00 0.00 29.99 30.85 2fh0 n HIS 87 CO 0.00 0.00 0.00 -1.59 -2.81 0.00 0.00 176.34 171.94 2fh0 s LYS 88 N -2.02 2.33 -0.59 -1.40 0.00 -1.26 -5.03 119.74 111.77 2fh0 s LYS 88 Ca 0.11 -1.79 -0.20 0.00 0.00 0.00 0.00 55.97 54.08 2fh0 s LYS 88 Cb -0.01 -2.36 0.09 0.00 0.00 0.00 0.00 37.83 35.55 2fh0 s LYS 88 CO 0.02 -0.64 0.75 0.42 0.00 0.00 0.00 175.35 175.90 2fh0 s ILE 89 N -2.68 4.71 1.03 3.79 1.01 -1.25 -4.94 121.20 122.87 2fh0 s ILE 89 Ca 0.47 -0.72 -0.16 0.00 0.00 0.00 0.00 60.65 60.24 2fh0 s ILE 89 Cb -0.04 -4.50 0.21 0.00 0.01 0.00 0.00 42.46 38.14 2fh0 s ILE 89 CO 0.29 -1.13 1.17 0.42 0.00 0.00 0.00 174.94 175.68 2fh0 s THR 90 N 3.01 1.86 0.25 2.92 -4.23 -1.26 -3.78 115.64 114.41 2fh0 s THR 90 Ca 0.15 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 60.62 2fh0 s THR 90 Cb -0.21 -2.70 0.23 0.00 1.34 0.00 0.00 72.50 71.16 2fh0 s THR 90 CO 0.09 0.00 1.83 -0.08 -0.54 0.00 0.00 174.62 175.92 2fh0 h GLU 91 N -1.94 0.87 -0.37 3.99 4.81 -1.92 0.62 114.58 120.65 2fh0 h GLU 91 Ca -0.48 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 58.54 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 0.47 0.58 -0.41 0.00 -0.73 0.00 0.00 179.01 178.91 2fh0 h ALA 92 N 1.45 0.56 -0.33 2.92 0.00 -2.00 -2.81 119.26 119.05 2fh0 h ALA 92 Ca 0.41 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 2fh0 h ALA 92 Cb 0.31 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2fh0 h ALA 92 CO -0.22 0.68 -0.31 1.49 0.00 0.00 0.00 179.25 180.89 2fh0 h GLU 93 N 0.75 0.80 -0.48 0.00 4.57 -1.64 -2.99 114.58 115.59 2fh0 h GLU 93 Ca 0.06 -0.41 -0.04 0.00 -1.18 0.00 0.00 59.36 57.78 2fh0 h GLU 93 Cb 1.01 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.58 2fh0 h GLU 93 CO 0.10 1.04 0.12 0.97 -1.18 0.00 0.00 179.01 180.06 2fh0 h ILE 94 N 0.57 1.21 -0.42 2.32 2.10 0.20 -2.27 117.51 121.23 2fh0 h ILE 94 Ca 0.06 -0.75 -0.06 0.00 1.08 0.00 0.00 64.86 65.19 2fh0 h ILE 94 Cb 0.88 0.72 -0.02 0.00 -1.09 0.00 0.00 36.82 37.32 2fh0 h ILE 94 CO 0.08 0.28 0.03 0.58 -1.08 0.00 0.00 178.15 178.03 2fh0 h VAL 95 N 0.71 1.25 -0.41 2.19 2.07 -1.47 0.56 116.25 121.15 2fh0 h VAL 95 Ca 0.16 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 2fh0 h VAL 95 Cb 0.27 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 2fh0 h VAL 95 CO -0.00 0.33 0.24 -1.28 0.02 0.00 0.00 177.57 176.88 2fh0 h SER 96 N 0.56 0.50 -0.20 0.57 0.87 -1.35 0.48 113.55 114.98 2fh0 h SER 96 Ca 0.12 -0.06 -0.14 0.00 -1.23 0.00 0.00 61.79 60.48 2fh0 h SER 96 Cb 0.44 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2fh0 h SER 96 CO 0.02 0.42 -0.41 0.40 -0.53 0.00 0.00 176.83 176.72 2fh0 h ILE 97 N 0.54 1.32 -0.86 2.23 2.04 -1.32 -3.05 117.51 118.41 2fh0 h ILE 97 Ca 0.15 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.36 2fh0 h ILE 97 Cb 0.02 1.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 2fh0 h ILE 97 CO -0.03 0.51 0.50 0.25 0.00 0.00 0.00 178.15 179.38 2fh0 h LEU 98 N 0.33 1.06 -1.16 1.44 6.46 0.32 -0.97 115.31 122.78 2fh0 h LEU 98 Ca 0.01 -0.08 0.05 0.00 -0.12 0.00 0.00 57.88 57.74 2fh0 h LEU 98 Cb 1.02 -0.27 -0.05 0.00 -0.73 0.00 0.00 40.66 40.62 2fh0 h LEU 98 CO 0.09 0.83 0.58 0.78 -0.62 0.00 0.00 178.44 180.10 2fh0 h ASN 99 N 1.19 0.91 0.17 1.25 2.35 -0.01 -1.33 115.58 120.12 2fh0 h ASN 99 Ca 0.31 -0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.84 2fh0 h ASN 99 Cb -0.01 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.16 2fh0 h ASN 99 CO -0.05 0.60 -0.86 1.23 -1.65 0.00 0.00 177.43 176.70 2fh0 h GLY 100 N 1.04 0.58 0.71 2.83 0.00 -1.32 -1.93 103.07 104.98 2fh0 h GLY 100 Ca 0.37 -0.91 0.05 0.00 0.00 0.00 0.00 47.33 46.84 2fh0 h GLY 100 CO -0.13 0.81 0.31 -2.22 0.00 0.00 0.00 176.54 175.31 2fh0 h ILE 101 N 0.33 0.96 -0.02 2.60 2.04 -0.29 -0.59 117.51 122.55 2fh0 h ILE 101 Ca -0.07 -0.20 -0.20 0.00 1.00 0.00 0.00 64.86 65.39 2fh0 h ILE 101 Cb 1.47 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 2fh0 h ILE 101 CO 0.16 0.11 -0.86 0.00 0.00 0.00 0.00 178.15 177.55 2fh0 h ALA 102 N 1.31 0.49 -0.44 1.87 0.00 -1.31 -3.18 119.26 118.01 2fh0 h ALA 102 Ca 0.26 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2fh0 h ALA 102 Cb 0.16 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2fh0 h ALA 102 CO -0.17 0.84 0.28 -0.22 0.00 0.00 0.00 179.25 179.98 2fh0 h LYS 103 N 0.18 0.59 -0.13 0.00 3.64 -0.70 -2.32 116.57 117.83 2fh0 h LYS 103 Ca -0.05 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.24 2fh0 h LYS 103 Cb 1.48 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.16 2fh0 h LYS 103 CO 0.14 0.42 -0.11 -0.56 -2.27 0.00 0.00 179.45 177.07 2fh0 h GLN 104 N 0.59 0.20 -7.27 1.90 3.07 -1.19 -3.44 115.11 108.97 2fh0 h GLN 104 Ca 0.16 -0.04 -0.46 0.00 0.09 0.00 0.00 58.65 58.40 2fh0 h GLN 104 Cb -0.03 -0.03 0.09 0.00 0.08 0.00 0.00 27.48 27.59 2fh0 h GLN 104 CO -0.03 0.32 0.19 -0.65 0.09 0.00 0.00 178.83 178.74 2fh0 s GLN 105 N -4.78 1.75 -1.29 0.06 -0.21 -0.87 -4.98 119.66 109.33 2fh0 s GLN 105 Ca -0.05 -0.68 -0.13 0.00 0.02 0.00 0.00 55.36 54.52 2fh0 s GLN 105 Cb 0.16 -2.21 0.13 0.00 1.00 0.00 0.00 33.01 32.08 2fh0 s GLN 105 CO 0.72 -1.47 1.77 0.09 -2.12 0.00 0.00 175.29 174.28 2fh0 n ASN 106 N -2.97 4.89 -4.10 5.90 4.13 -1.26 -4.90 115.26 116.94 2fh0 n ASN 106 Ca 0.12 -2.98 -0.35 0.00 1.68 0.00 0.00 54.58 53.04 2fh0 n ASN 106 Cb 0.60 -1.60 -0.12 0.00 -1.54 0.00 0.00 39.78 37.13 2fh0 n ASN 106 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2fh0 s SER 107 N 2.60 5.17 0.25 6.41 0.01 -1.25 -5.06 113.70 121.82 2fh0 s SER 107 Ca 0.45 -2.21 -0.11 0.00 1.31 0.00 0.00 55.95 55.39 2fh0 s SER 107 Cb 0.05 -1.80 -0.01 0.00 0.21 0.00 0.00 66.02 64.47 2fh0 s SER 107 CO 0.00 -0.49 0.45 -1.58 0.41 0.00 0.00 173.24 172.03 2fh0 s GLN 108 N 0.87 1.55 -0.29 12.44 0.74 -1.26 -4.94 119.66 128.77 2fh0 s GLN 108 Ca 0.10 -1.32 0.02 0.00 0.05 0.00 0.00 55.36 54.21 2fh0 s GLN 108 Cb -0.22 0.45 0.18 0.00 1.10 0.00 0.00 33.01 34.52 2fh0 s GLN 108 CO -0.04 -0.63 0.54 1.21 -0.55 0.00 0.00 175.29 175.82 2fh0 s ASN 109 N -3.05 -1.05 -1.05 6.67 3.84 -1.26 -5.09 114.94 113.95 2fh0 s ASN 109 Ca 0.24 0.31 -0.21 0.00 0.21 0.00 0.00 52.86 53.41 2fh0 s ASN 109 Cb 0.00 1.84 0.07 0.00 -0.55 0.00 0.00 41.25 42.61 2fh0 s ASN 109 CO 0.10 -0.30 1.43 0.20 -2.79 0.00 0.00 177.10 175.75 2fh0 s ASN 110 N 2.76 6.60 0.09 -4.21 -0.87 -1.26 -4.29 114.94 113.76 2fh0 s ASN 110 Ca 0.14 -1.77 0.00 0.00 -1.57 0.00 0.00 52.86 49.66 2fh0 s ASN 110 Cb -0.12 -2.53 0.00 0.00 -0.02 0.00 0.00 41.25 38.57 2fh0 s ASN 110 CO -0.24 -1.35 0.00 -1.20 -2.57 0.00 0.00 177.10 171.74 2fh0 n SER 111 N 8.25 -0.50 0.12 -1.22 7.64 -1.26 -4.90 113.62 121.75 2fh0 n SER 111 Ca 0.34 0.16 -0.02 0.00 1.01 0.00 0.00 58.87 60.36 2fh0 n SER 111 Cb 0.50 0.68 0.19 0.00 -1.01 0.00 0.00 64.21 64.57 2fh0 n SER 111 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2fh0 h LYS 112 N 0.00 0.10 -1.07 1.43 1.57 -2.06 -3.08 116.57 113.46 2fh0 h LYS 112 Ca 0.00 -0.06 -0.58 0.00 -1.87 0.00 0.00 60.65 58.14 2fh0 h LYS 112 Cb 0.00 0.01 -0.27 0.00 0.08 0.00 0.00 32.23 32.05 2fh0 h LYS 112 CO 0.00 0.62 0.74 -0.89 -0.57 0.00 0.00 179.45 179.36 2fh0 n ILE 113 N -3.90 3.35 -1.23 1.86 -0.00 -1.26 -4.34 119.36 113.85 2fh0 n ILE 113 Ca -0.02 -2.44 0.03 0.00 -0.00 0.00 0.00 62.75 60.33 2fh0 n ILE 113 Cb 0.57 -1.01 0.22 0.00 -0.00 0.00 0.00 39.64 39.41 2fh0 n ILE 113 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 2fh0 n ILE 114 N -0.78 2.35 -0.02 1.39 2.08 -1.16 -4.63 119.36 118.59 2fh0 n ILE 114 Ca 0.56 -2.36 -0.21 0.00 0.56 0.00 0.00 62.75 61.31 2fh0 n ILE 114 Cb 0.90 -0.28 -0.13 0.00 -0.75 0.00 0.00 39.64 39.37 2fh0 n ILE 114 CO 0.00 0.00 0.00 0.15 0.56 0.00 0.00 176.55 177.26 2fh0 h PHE 115 N 1.19 0.33 0.00 1.39 3.57 -1.84 -3.51 116.94 118.07 2fh0 h PHE 115 Ca 0.10 -0.24 0.00 0.00 3.53 0.00 0.00 57.97 61.36 2fh0 h PHE 115 Cb 1.47 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.19 2fh0 h PHE 115 CO 0.68 1.55 0.00 -0.85 -2.23 0.00 0.00 178.31 177.45