#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fh0 h GLU 37 N 0.00 0.21 -4.11 1.61 4.11 -2.14 -3.47 114.58 110.80 2fh0 h GLU 37 Ca 0.00 -0.36 -0.32 0.00 0.07 0.00 0.00 59.36 58.75 2fh0 h GLU 37 Cb 0.00 0.13 -0.30 0.00 0.50 0.00 0.00 28.75 29.09 2fh0 h GLU 37 CO 0.00 1.02 -0.75 -0.80 0.07 0.00 0.00 179.01 178.55 2fh0 s ASN 38 N -6.82 0.53 0.06 3.06 -0.87 -1.26 -5.16 114.94 104.48 2fh0 s ASN 38 Ca -0.13 -0.07 -0.07 0.00 -1.57 0.00 0.00 52.86 51.01 2fh0 s ASN 38 Cb 0.07 -0.12 -0.01 0.00 -0.02 0.00 0.00 41.25 41.17 2fh0 s ASN 38 CO 0.82 0.02 0.14 -0.44 -2.57 0.00 0.00 177.10 175.07 2fh0 s SER 39 N 0.17 0.15 0.24 -1.22 0.01 -1.26 -5.12 113.70 106.67 2fh0 s SER 39 Ca -0.02 -0.58 0.00 0.00 1.31 0.00 0.00 55.95 56.66 2fh0 s SER 39 Cb -0.05 0.28 0.00 0.00 0.21 0.00 0.00 66.02 66.46 2fh0 s SER 39 CO -0.00 -0.61 0.00 0.00 0.41 0.00 0.00 173.24 173.03 2fh0 n ALA 40 N 0.37 -1.30 -2.31 1.44 0.00 -1.26 -4.89 120.51 112.57 2fh0 n ALA 40 Ca -0.17 0.20 -0.42 0.00 0.00 0.00 0.00 53.44 53.05 2fh0 n ALA 40 Cb 0.60 -0.90 -0.03 0.00 0.00 0.00 0.00 19.45 19.12 2fh0 n ALA 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2fh0 s PRO 41 N -4.73 4.45 -0.18 0.00 0.04 -1.26 -5.03 135.00 128.29 2fh0 s PRO 41 Ca 0.00 1.80 -0.01 0.00 0.04 0.00 0.00 61.00 62.84 2fh0 s PRO 41 Cb 0.00 -3.31 0.05 0.00 0.04 0.00 0.00 34.50 31.27 2fh0 s PRO 41 CO 0.00 -0.21 -0.04 0.54 0.04 0.00 0.00 177.00 177.33 2fh0 s VAL 42 N 0.74 1.11 0.00 -0.36 0.11 -1.26 -4.78 120.40 115.96 2fh0 s VAL 42 Ca 0.57 -0.70 0.00 0.00 -2.93 0.00 0.00 61.98 58.92 2fh0 s VAL 42 Cb -0.30 -1.33 0.00 0.00 -1.53 0.00 0.00 36.38 33.21 2fh0 s VAL 42 CO 0.31 0.06 0.00 0.61 -3.33 0.00 0.00 175.10 172.75 2fh0 n GLY 43 N 4.86 2.72 0.27 6.54 0.00 -1.26 -4.83 105.19 113.49 2fh0 n GLY 43 Ca -0.12 -0.32 -0.01 0.00 0.00 0.00 0.00 46.02 45.58 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 1.28 -0.24 4.61 0.00 -1.97 0.39 119.26 123.33 2fh0 h ALA 44 Ca 0.00 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.74 2fh0 h ALA 44 Cb 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2fh0 h ALA 44 CO 0.00 0.48 0.19 0.00 0.00 0.00 0.00 179.25 179.92 2fh0 h ALA 45 N 1.43 2.13 0.00 0.00 0.00 -1.88 -2.29 119.26 118.66 2fh0 h ALA 45 Ca 0.10 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 2fh0 h ALA 45 Cb 0.41 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2fh0 h ALA 45 CO 0.02 -0.32 -1.75 0.44 0.00 0.00 0.00 179.25 177.65 2fh0 n ILE 46 N -4.29 0.47 0.26 0.00 -0.00 -0.97 -4.47 119.36 110.36 2fh0 n ILE 46 Ca 0.03 -0.43 0.12 0.00 -0.00 0.00 0.00 62.75 62.47 2fh0 n ILE 46 Cb 0.34 -0.29 0.71 0.00 -0.00 0.00 0.00 39.64 40.41 2fh0 n ILE 46 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2fh0 h ALA 47 N 0.89 1.32 0.00 -1.28 0.00 0.12 -1.32 119.26 118.98 2fh0 h ALA 47 Ca -0.19 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2fh0 h ALA 47 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2fh0 h ALA 47 CO 0.01 0.15 0.00 0.09 0.00 0.00 0.00 179.25 179.50 2fh0 n ASN 48 N -3.69 0.00 -1.97 0.00 5.03 -0.89 -3.44 115.26 110.30 2fh0 n ASN 48 Ca -0.02 -0.03 -0.18 0.00 0.87 0.00 0.00 54.58 55.22 2fh0 n ASN 48 Cb 0.24 -0.32 0.15 0.00 -1.02 0.00 0.00 39.78 38.83 2fh0 n ASN 48 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 2fh0 n PHE 49 N -1.32 2.44 -4.29 3.10 7.35 -0.50 -4.89 117.46 119.34 2fh0 n PHE 49 Ca 0.13 -1.55 -0.18 0.00 -0.76 0.00 0.00 57.45 55.09 2fh0 n PHE 49 Cb 0.25 -0.80 -0.14 0.00 0.35 0.00 0.00 39.48 39.15 2fh0 n PHE 49 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2fh0 s LEU 50 N -2.63 2.12 0.56 -2.13 1.02 -1.22 -3.32 118.68 113.09 2fh0 s LEU 50 Ca 0.46 -0.34 -0.21 0.00 0.02 0.00 0.00 54.13 54.05 2fh0 s LEU 50 Cb 0.38 -0.45 -0.04 0.00 0.02 0.00 0.00 46.19 46.10 2fh0 s LEU 50 CO 0.09 0.02 1.36 -1.61 0.02 0.00 0.00 176.35 176.23 2fh0 s GLU 51 N -0.81 3.03 0.16 1.70 0.41 -1.22 -4.81 118.70 117.16 2fh0 s GLU 51 Ca 0.00 2.23 -0.15 0.00 -0.41 0.00 0.00 54.97 56.64 2fh0 s GLU 51 Cb -0.06 -2.19 0.04 0.00 -1.78 0.00 0.00 34.13 30.13 2fh0 s GLU 51 CO 0.00 -1.28 1.81 -1.00 -0.49 0.00 0.00 175.26 174.30 2fh0 h PRO 52 N 1.30 0.63 -0.53 0.39 0.13 -1.98 0.13 132.00 132.07 2fh0 h PRO 52 Ca -0.51 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 64.55 2fh0 h PRO 52 Cb 1.31 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 2fh0 h PRO 52 CO 0.56 0.44 0.23 1.96 -0.23 0.00 0.00 178.00 180.97 2fh0 h GLN 53 N 0.63 0.77 -0.41 0.86 1.08 -1.99 -0.24 115.11 115.81 2fh0 h GLN 53 Ca 0.17 -0.13 -0.06 0.00 -1.45 0.00 0.00 58.65 57.18 2fh0 h GLN 53 Cb -0.03 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 2fh0 h GLN 53 CO -0.03 0.66 0.00 0.00 -0.95 0.00 0.00 178.83 178.51 2fh0 h ALA 54 N 1.08 0.55 -0.42 3.87 0.00 -1.85 -2.92 119.26 119.55 2fh0 h ALA 54 Ca 0.18 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 2fh0 h ALA 54 Cb 0.16 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2fh0 h ALA 54 CO -0.02 0.32 0.05 -0.07 0.00 0.00 0.00 179.25 179.54 2fh0 h LEU 55 N 0.55 0.61 -0.28 0.00 3.38 -0.56 -0.46 115.31 118.55 2fh0 h LEU 55 Ca 0.12 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2fh0 h LEU 55 Cb 0.47 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2fh0 h LEU 55 CO 0.02 0.65 0.15 -0.08 0.09 0.00 0.00 178.44 179.27 2fh0 h GLU 56 N 0.63 0.30 -0.03 1.13 4.57 -0.86 -1.95 114.58 118.37 2fh0 h GLU 56 Ca 0.14 -0.02 -0.19 0.00 -1.18 0.00 0.00 59.36 58.11 2fh0 h GLU 56 Cb 0.32 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 2fh0 h GLU 56 CO 0.01 0.20 -0.81 -0.09 -1.18 0.00 0.00 179.01 177.14 2fh0 h ARG 57 N 0.30 0.30 -0.72 1.92 1.12 -1.39 -3.17 114.38 112.74 2fh0 h ARG 57 Ca 0.11 -0.28 0.07 0.00 -1.11 0.00 0.00 59.98 58.78 2fh0 h ARG 57 Cb 0.03 0.07 -0.05 0.00 -0.01 0.00 0.00 29.97 30.01 2fh0 h ARG 57 CO -0.07 0.96 0.48 1.25 -3.11 0.00 0.00 179.97 179.47 2fh0 h LEU 58 N 0.19 0.63 -0.67 3.80 5.85 -0.74 -0.95 115.31 123.42 2fh0 h LEU 58 Ca -0.04 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 2fh0 h LEU 58 Cb 1.40 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 2fh0 h LEU 58 CO 0.13 0.40 0.08 0.28 -0.34 0.00 0.00 178.44 178.99 2fh0 h SER 59 N 0.71 1.07 -0.37 1.25 0.02 -1.33 -2.01 113.55 112.90 2fh0 h SER 59 Ca 0.32 -0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 2fh0 h SER 59 Cb 0.32 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2fh0 h SER 59 CO -0.11 1.08 0.16 -0.09 -1.14 0.00 0.00 176.83 176.73 2fh0 h ARG 60 N 1.03 0.54 -0.74 3.45 2.43 -1.25 -2.92 114.38 116.92 2fh0 h ARG 60 Ca 0.20 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 2fh0 h ARG 60 Cb 0.48 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 2fh0 h ARG 60 CO 0.02 0.50 0.22 -0.24 -1.51 0.00 0.00 179.97 178.96 2fh0 h VAL 61 N 0.45 1.26 -0.75 0.20 3.04 -1.28 -2.65 116.25 116.53 2fh0 h VAL 61 Ca 0.12 -0.93 0.19 0.00 -1.01 0.00 0.00 66.70 65.08 2fh0 h VAL 61 Cb 0.15 0.46 -0.04 0.00 -2.01 0.00 0.00 31.29 29.85 2fh0 h VAL 61 CO -0.01 0.36 0.53 0.00 -1.01 0.00 0.00 177.57 177.44 2fh0 h ALA 62 N 1.11 2.47 0.00 3.17 0.00 -1.17 0.71 119.26 125.56 2fh0 h ALA 62 Ca 0.24 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 2fh0 h ALA 62 Cb 0.33 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2fh0 h ALA 62 CO -0.01 -0.69 -0.52 -0.07 0.00 0.00 0.00 179.25 177.97 2fh0 h LEU 63 N 0.16 0.00 0.00 0.00 4.07 -1.40 -3.01 115.31 115.13 2fh0 h LEU 63 Ca 0.37 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 58.18 2fh0 h LEU 63 Cb 1.22 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.94 2fh0 h LEU 63 CO -0.06 0.52 -1.19 0.52 -1.08 0.00 0.00 178.44 177.14 2fh0 n VAL 64 N -3.92 1.49 -3.70 1.22 0.31 0.56 -4.83 118.33 109.46 2fh0 n VAL 64 Ca -0.01 0.03 -0.29 0.00 -0.01 0.00 0.00 64.34 64.05 2fh0 n VAL 64 Cb 0.53 -2.20 -0.13 0.00 -0.91 0.00 0.00 33.84 31.14 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 -2.48 1.41 0.47 5.55 1.81 0.22 -4.96 118.95 120.96 2fh0 s ARG 65 Ca -0.26 -2.21 0.12 0.00 -1.72 0.00 0.00 55.73 51.66 2fh0 s ARG 65 Cb 0.06 -2.38 1.07 0.00 -0.45 0.00 0.00 34.95 33.25 2fh0 s ARG 65 CO 0.41 -1.21 2.09 0.07 -0.68 0.00 0.00 175.30 175.99 2fh0 h ARG 66 N 6.41 0.22 -0.80 3.54 0.11 -1.68 -2.67 114.38 119.51 2fh0 h ARG 66 Ca 0.05 -0.02 0.10 0.00 0.10 0.00 0.00 59.98 60.21 2fh0 h ARG 66 Cb 0.90 -0.05 -0.07 0.00 1.11 0.00 0.00 29.97 31.86 2fh0 h ARG 66 CO 0.50 0.17 0.44 -0.44 0.10 0.00 0.00 179.97 180.74 2fh0 h ASP 67 N 0.22 0.62 -0.05 0.08 3.32 -1.93 0.69 116.42 119.37 2fh0 h ASP 67 Ca 0.06 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 2fh0 h ASP 67 Cb 0.02 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 2fh0 h ASP 67 CO -0.01 0.35 0.01 0.03 -1.72 0.00 0.00 179.24 177.90 2fh0 h ARG 68 N 0.74 0.08 -0.32 3.56 2.47 -1.86 -2.26 114.38 116.79 2fh0 h ARG 68 Ca 0.39 -0.02 -0.08 0.00 -1.26 0.00 0.00 59.98 59.00 2fh0 h ARG 68 Cb 0.38 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.67 2fh0 h ARG 68 CO -0.26 0.32 -0.15 0.00 0.56 0.00 0.00 179.97 180.44 2fh0 h ALA 69 N 0.76 1.15 -0.66 0.04 0.00 -1.45 -2.68 119.26 116.42 2fh0 h ALA 69 Ca 0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2fh0 h ALA 69 Cb 0.27 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2fh0 h ALA 69 CO 0.00 0.54 0.37 1.96 0.00 0.00 0.00 179.25 182.12 2fh0 h GLN 70 N 0.51 0.92 -0.02 0.00 4.20 0.50 -2.20 115.11 119.01 2fh0 h GLN 70 Ca 0.09 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 2fh0 h GLN 70 Cb 0.56 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2fh0 h GLN 70 CO 0.04 0.68 -0.48 0.00 -0.67 0.00 0.00 178.83 178.40 2fh0 h ALA 71 N 1.18 1.17 -0.20 3.87 0.00 -1.24 -2.60 119.26 121.44 2fh0 h ALA 71 Ca 0.23 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2fh0 h ALA 71 Cb 0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2fh0 h ALA 71 CO -0.04 0.61 0.01 0.28 0.00 0.00 0.00 179.25 180.11 2fh0 h VAL 72 N 0.04 1.24 -0.43 0.00 2.07 -1.09 0.30 116.25 118.38 2fh0 h VAL 72 Ca -0.00 -0.82 -0.06 0.00 0.82 0.00 0.00 66.70 66.65 2fh0 h VAL 72 Cb 0.86 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 2fh0 h VAL 72 CO 0.06 0.25 0.03 1.05 0.02 0.00 0.00 177.57 178.98 2fh0 h GLU 73 N 0.12 0.68 -0.05 1.57 4.11 -1.36 -1.95 114.58 117.70 2fh0 h GLU 73 Ca 0.06 -0.16 -0.16 0.00 0.07 0.00 0.00 59.36 59.17 2fh0 h GLU 73 Cb 0.36 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2fh0 h GLU 73 CO 0.01 0.68 -0.67 1.79 0.07 0.00 0.00 179.01 180.89 2fh0 h THR 74 N 0.65 1.41 -0.38 -1.06 1.35 -1.33 -2.79 112.91 110.76 2fh0 h THR 74 Ca 0.14 -2.13 -0.07 0.00 -0.55 0.00 0.00 66.41 63.80 2fh0 h THR 74 Cb 0.37 2.11 -0.01 0.00 -1.73 0.00 0.00 68.15 68.88 2fh0 h THR 74 CO 0.01 0.63 -0.02 0.22 -0.25 0.00 0.00 175.52 176.11 2fh0 h TYR 75 N 0.16 0.75 -0.29 4.73 5.03 -0.50 -2.56 116.97 124.29 2fh0 h TYR 75 Ca -0.02 -0.14 -0.02 0.00 2.58 0.00 0.00 58.73 61.14 2fh0 h TYR 75 Cb 1.20 -0.19 -0.01 0.00 1.55 0.00 0.00 36.73 39.28 2fh0 h TYR 75 CO 0.02 0.78 0.11 1.25 -1.32 0.00 0.00 178.16 179.00 2fh0 h LEU 76 N 0.50 0.41 -1.60 2.82 5.85 -1.35 -2.73 115.31 119.21 2fh0 h LEU 76 Ca 0.11 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.65 2fh0 h LEU 76 Cb 0.50 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 2fh0 h LEU 76 CO 0.02 0.47 0.26 0.07 -0.34 0.00 0.00 178.44 178.93 2fh0 h LYS 77 N 0.31 0.53 -0.28 1.25 2.10 -1.48 -1.38 116.57 117.61 2fh0 h LYS 77 Ca 0.09 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 58.69 2fh0 h LYS 77 Cb 0.20 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 31.40 2fh0 h LYS 77 CO -0.01 0.35 0.10 0.87 -2.00 0.00 0.00 179.45 178.77 2fh0 h LYS 78 N 0.54 0.44 -0.21 0.07 1.57 -1.17 0.34 116.57 118.15 2fh0 h LYS 78 Ca 0.15 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2fh0 h LYS 78 Cb -0.05 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 2fh0 h LYS 78 CO -0.03 0.48 0.05 -0.07 -0.57 0.00 0.00 179.45 179.31 2fh0 h LEU 79 N 0.30 0.33 -0.59 2.94 3.38 -1.15 0.91 115.31 121.43 2fh0 h LEU 79 Ca 0.09 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 2fh0 h LEU 79 Cb 0.22 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2fh0 h LEU 79 CO -0.00 0.48 -0.05 0.40 0.09 0.00 0.00 178.44 179.35 2fh0 h ILE 80 N 0.16 1.27 -0.28 1.22 2.04 -1.04 0.50 117.51 121.37 2fh0 h ILE 80 Ca 0.07 -1.21 -0.14 0.00 1.00 0.00 0.00 64.86 64.58 2fh0 h ILE 80 Cb 0.28 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2fh0 h ILE 80 CO 0.00 0.44 -0.38 0.00 0.00 0.00 0.00 178.15 178.21 2fh0 h ALA 81 N 0.96 0.81 0.42 1.87 0.00 -0.23 -3.31 119.26 119.77 2fh0 h ALA 81 Ca 0.16 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2fh0 h ALA 81 Cb 0.62 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2fh0 h ALA 81 CO 0.04 0.65 -0.20 1.79 0.00 0.00 0.00 179.25 181.53 2fh0 h THR 82 N 0.54 0.10 0.00 0.00 1.35 -0.70 -3.48 112.91 110.72 2fh0 h THR 82 Ca 0.05 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2fh0 h THR 82 Cb 0.90 0.16 0.00 0.00 -1.73 0.00 0.00 68.15 67.47 2fh0 h THR 82 CO 0.08 0.02 0.00 -0.46 -0.25 0.00 0.00 175.52 174.91 2fh0 n ASN 83 N -5.15 0.00 -4.55 5.36 6.94 -0.45 -5.09 115.26 112.32 2fh0 n ASN 83 Ca -0.08 0.00 -0.31 0.00 -0.02 0.00 0.00 54.58 54.17 2fh0 n ASN 83 Cb 0.24 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.62 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 2.18 -2.81 0.53 3.02 0.16 -4.70 115.26 113.64 2fh0 n ASN 84 Ca 0.00 -0.72 -0.01 0.00 -0.03 0.00 0.00 54.58 53.82 2fh0 n ASN 84 Cb 0.00 -1.60 0.05 0.00 -0.61 0.00 0.00 39.78 37.63 2fh0 n ASN 84 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2fh0 n VAL 85 N 8.17 1.18 -1.62 2.41 0.31 -1.26 -2.67 118.33 124.85 2fh0 n VAL 85 Ca 0.40 -2.85 0.06 0.00 -0.01 0.00 0.00 64.34 61.94 2fh0 n VAL 85 Cb 0.52 1.23 0.14 0.00 -0.91 0.00 0.00 33.84 34.83 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 -0.59 1.61 -3.74 2.52 -2.24 -1.26 -5.06 114.28 105.51 2fh0 n THR 86 Ca 0.06 -2.37 0.01 0.00 -2.27 0.00 0.00 64.05 59.48 2fh0 n THR 86 Cb 0.81 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 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 -2.39 -0.03 0.08 4.78 -3.43 -1.26 -5.18 115.29 107.86 2fh0 s HIS 87 Ca 0.33 -0.14 0.04 0.00 -0.80 0.00 0.00 55.06 54.49 2fh0 s HIS 87 Cb 0.32 0.58 -0.03 0.00 -1.43 0.00 0.00 32.58 32.01 2fh0 s HIS 87 CO -0.05 -0.41 -0.10 0.15 -2.00 0.00 0.00 174.74 172.32 2fh0 s LYS 88 N -2.41 0.77 -0.84 -0.38 3.01 -1.26 -5.05 119.74 113.58 2fh0 s LYS 88 Ca 0.18 -1.03 -0.25 0.00 -1.01 0.00 0.00 55.97 53.86 2fh0 s LYS 88 Cb 0.02 -0.54 -0.04 0.00 -1.01 0.00 0.00 37.83 36.26 2fh0 s LYS 88 CO -0.01 0.10 1.89 0.42 0.51 0.00 0.00 175.35 178.25 2fh0 s ILE 89 N -1.97 3.45 1.14 2.17 1.01 -1.21 -4.90 121.20 120.89 2fh0 s ILE 89 Ca 0.01 -0.24 -0.19 0.00 0.00 0.00 0.00 60.65 60.23 2fh0 s ILE 89 Cb -0.06 -4.05 0.27 0.00 0.01 0.00 0.00 42.46 38.63 2fh0 s ILE 89 CO 0.01 -1.00 1.20 0.42 0.00 0.00 0.00 174.94 175.57 2fh0 s THR 90 N 9.54 1.71 0.28 2.92 -4.23 -1.26 -3.39 115.64 121.21 2fh0 s THR 90 Ca 0.68 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 61.20 2fh0 s THR 90 Cb -0.08 -2.69 0.28 0.00 1.34 0.00 0.00 72.50 71.36 2fh0 s THR 90 CO 0.04 0.00 1.84 -0.08 -0.54 0.00 0.00 174.62 175.88 2fh0 h GLU 91 N -2.33 0.98 -0.35 3.99 4.22 -1.94 0.31 114.58 119.46 2fh0 h GLU 91 Ca -0.43 -0.06 -0.16 0.00 0.08 0.00 0.00 59.36 58.79 2fh0 h GLU 91 Cb 1.26 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 2fh0 h GLU 91 CO 0.31 0.65 -0.41 0.00 -2.18 0.00 0.00 179.01 177.38 2fh0 h ALA 92 N 1.53 0.61 -0.19 2.92 0.00 -1.99 -2.78 119.26 119.36 2fh0 h ALA 92 Ca 0.49 -0.46 -0.16 0.00 0.00 0.00 0.00 54.91 54.78 2fh0 h ALA 92 Cb 0.46 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2fh0 h ALA 92 CO -0.26 0.68 -0.50 0.93 0.00 0.00 0.00 179.25 180.09 2fh0 h GLU 93 N 0.71 0.67 -0.66 0.00 5.08 -1.59 -2.92 114.58 115.87 2fh0 h GLU 93 Ca 0.05 -0.47 -0.04 0.00 -1.00 0.00 0.00 59.36 57.90 2fh0 h GLU 93 Cb 0.99 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.29 2fh0 h GLU 93 CO 0.10 1.09 0.25 0.97 -1.00 0.00 0.00 179.01 180.42 2fh0 h ILE 94 N 0.36 1.23 -0.39 3.13 2.10 -0.47 -2.03 117.51 121.45 2fh0 h ILE 94 Ca -0.01 -0.75 -0.06 0.00 1.08 0.00 0.00 64.86 65.12 2fh0 h ILE 94 Cb 1.12 0.46 -0.01 0.00 -1.09 0.00 0.00 36.82 37.29 2fh0 h ILE 94 CO 0.11 0.30 0.01 0.58 -1.08 0.00 0.00 178.15 178.07 2fh0 h VAL 95 N 0.96 1.26 -0.62 2.19 2.07 -1.53 0.01 116.25 120.59 2fh0 h VAL 95 Ca 0.22 -0.97 0.03 0.00 0.82 0.00 0.00 66.70 66.80 2fh0 h VAL 95 Cb 0.21 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2fh0 h VAL 95 CO -0.02 0.33 0.37 0.28 0.02 0.00 0.00 177.57 178.56 2fh0 h SER 96 N 0.51 0.60 -0.14 0.57 0.02 -1.29 0.38 113.55 114.20 2fh0 h SER 96 Ca 0.11 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 2fh0 h SER 96 Cb 0.45 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 2fh0 h SER 96 CO 0.02 0.42 -0.04 0.40 -1.14 0.00 0.00 176.83 176.48 2fh0 h ILE 97 N 0.73 1.29 -0.62 3.27 2.04 -1.23 -0.56 117.51 122.44 2fh0 h ILE 97 Ca 0.25 -1.01 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2fh0 h ILE 97 Cb 0.04 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 2fh0 h ILE 97 CO -0.11 0.29 0.39 -0.07 0.00 0.00 0.00 178.15 178.65 2fh0 h LEU 98 N -0.03 0.73 -0.75 1.44 3.38 -0.68 0.35 115.31 119.75 2fh0 h LEU 98 Ca 0.04 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2fh0 h LEU 98 Cb 0.47 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2fh0 h LEU 98 CO 0.02 0.55 -0.12 0.78 0.09 0.00 0.00 178.44 179.75 2fh0 h ASN 99 N 0.84 0.82 0.13 -0.43 2.35 -0.22 -2.67 115.58 116.41 2fh0 h ASN 99 Ca 0.22 -0.26 -0.21 0.00 -0.55 0.00 0.00 56.30 55.51 2fh0 h ASN 99 Cb -0.06 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.09 2fh0 h ASN 99 CO -0.05 0.96 -0.81 1.23 -1.65 0.00 0.00 177.43 177.12 2fh0 h GLY 100 N 0.97 0.60 0.77 2.83 0.00 -0.71 -2.93 103.07 104.60 2fh0 h GLY 100 Ca 0.12 -0.90 0.06 0.00 0.00 0.00 0.00 47.33 46.61 2fh0 h GLY 100 CO 0.04 0.80 0.63 -2.22 0.00 0.00 0.00 176.54 175.79 2fh0 h ILE 101 N 0.36 1.10 -0.16 2.60 2.04 -0.18 -1.60 117.51 121.66 2fh0 h ILE 101 Ca -0.05 -0.40 -0.13 0.00 1.00 0.00 0.00 64.86 65.27 2fh0 h ILE 101 Cb 1.41 -0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2fh0 h ILE 101 CO 0.15 0.21 -0.47 0.00 0.00 0.00 0.00 178.15 178.04 2fh0 h ALA 102 N 1.44 0.89 -0.73 1.87 0.00 -1.46 -3.04 119.26 118.22 2fh0 h ALA 102 Ca 0.42 -0.46 0.07 0.00 0.00 0.00 0.00 54.91 54.93 2fh0 h ALA 102 Cb 0.13 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2fh0 h ALA 102 CO -0.16 0.65 0.48 0.87 0.00 0.00 0.00 179.25 181.09 2fh0 h LYS 103 N 0.33 0.73 -0.22 0.00 1.57 -1.10 -0.99 116.57 116.90 2fh0 h LYS 103 Ca 0.02 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2fh0 h LYS 103 Cb 0.95 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 2fh0 h LYS 103 CO 0.08 0.48 0.06 1.96 -0.57 0.00 0.00 179.45 181.46 2fh0 h GLN 104 N 0.75 0.30 -6.30 3.15 1.08 -1.39 -3.41 115.11 109.31 2fh0 h GLN 104 Ca 0.32 -0.04 -0.57 0.00 -1.45 0.00 0.00 58.65 56.91 2fh0 h GLN 104 Cb 0.28 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.63 2fh0 h GLN 104 CO -0.11 0.28 1.19 -0.65 -0.95 0.00 0.00 178.83 178.60 2fh0 s GLN 105 N -5.11 3.59 -0.30 1.46 -1.52 -0.38 -4.94 119.66 112.46 2fh0 s GLN 105 Ca -0.06 1.53 -0.11 0.00 -1.95 0.00 0.00 55.36 54.77 2fh0 s GLN 105 Cb 0.17 -4.11 0.15 0.00 -0.22 0.00 0.00 33.01 28.99 2fh0 s GLN 105 CO 0.72 -1.55 0.78 1.21 -0.25 0.00 0.00 175.29 176.19 2fh0 s ASN 106 N 5.03 -0.95 -0.02 5.90 2.47 -1.26 -5.04 114.94 121.07 2fh0 s ASN 106 Ca 0.75 1.24 -0.00 0.00 0.42 0.00 0.00 52.86 55.26 2fh0 s ASN 106 Cb -0.23 2.05 0.03 0.00 -1.45 0.00 0.00 41.25 41.65 2fh0 s ASN 106 CO 0.32 -0.18 0.04 -0.44 -3.72 0.00 0.00 177.10 173.11 2fh0 s SER 107 N 2.74 0.28 0.00 -4.21 0.01 -1.26 -4.97 113.70 106.29 2fh0 s SER 107 Ca -0.03 0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.28 2fh0 s SER 107 Cb -0.10 -0.08 0.00 0.00 0.21 0.00 0.00 66.02 66.05 2fh0 s SER 107 CO -0.18 -0.15 0.00 1.67 0.41 0.00 0.00 173.24 174.98 2fh0 n GLN 108 N 4.41 0.00 -1.62 12.44 -0.06 -1.26 -4.71 117.38 126.58 2fh0 n GLN 108 Ca -0.23 0.00 -0.18 0.00 -2.00 0.00 0.00 57.00 54.59 2fh0 n GLN 108 Cb 0.50 0.00 -0.07 0.00 -4.06 0.00 0.00 30.24 26.61 2fh0 n GLN 108 CO 0.00 0.00 0.00 -1.71 -0.20 0.00 0.00 177.06 175.15 2fh0 n ASN 109 N 2.24 -4.69 -1.05 1.69 4.05 -1.26 -4.79 115.26 111.45 2fh0 n ASN 109 Ca 0.00 0.39 0.05 0.00 0.45 0.00 0.00 54.58 55.47 2fh0 n ASN 109 Cb 0.00 -4.18 0.08 0.00 1.23 0.00 0.00 39.78 36.91 2fh0 n ASN 109 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2fh0 n ASN 110 N -1.11 1.19 -4.85 1.20 4.13 -1.26 -5.04 115.26 109.53 2fh0 n ASN 110 Ca -0.18 -2.64 -0.38 0.00 1.68 0.00 0.00 54.58 53.06 2fh0 n ASN 110 Cb 0.59 -0.37 -0.06 0.00 -1.54 0.00 0.00 39.78 38.40 2fh0 n ASN 110 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2fh0 s SER 111 N -2.33 6.70 -0.32 6.41 1.04 -1.26 -3.89 113.70 120.05 2fh0 s SER 111 Ca 0.32 0.84 0.00 0.00 0.48 0.00 0.00 55.95 57.59 2fh0 s SER 111 Cb 0.34 -2.20 0.00 0.00 0.10 0.00 0.00 66.02 64.26 2fh0 s SER 111 CO -0.11 0.34 0.00 1.17 0.98 0.00 0.00 173.24 175.61 2fh0 n LYS 112 N 1.80 -1.11 -0.02 4.02 3.00 -1.26 -4.78 118.16 119.80 2fh0 n LYS 112 Ca -0.15 0.45 -0.03 0.00 -0.00 0.00 0.00 58.31 58.58 2fh0 n LYS 112 Cb 0.53 -4.38 -0.03 0.00 0.00 0.00 0.00 35.03 31.16 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 -2.46 0.28 0.28 3.15 2.08 -1.26 -4.78 119.36 116.65 2fh0 n ILE 113 Ca -0.03 -0.13 -0.17 0.00 0.56 0.00 0.00 62.75 62.98 2fh0 n ILE 113 Cb 0.32 -0.75 -0.09 0.00 -0.75 0.00 0.00 39.64 38.37 2fh0 n ILE 113 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 2fh0 h ILE 114 N 0.00 0.00 0.00 1.39 1.08 -1.87 -3.44 117.51 114.67 2fh0 h ILE 114 Ca -0.11 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.36 2fh0 h ILE 114 Cb 1.20 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.95 2fh0 h ILE 114 CO -0.01 0.00 0.00 0.33 -0.69 0.00 0.00 178.15 177.78 2fh0 n PHE 115 N -5.34 0.00 -0.15 1.37 7.35 -1.26 -5.20 117.46 114.23 2fh0 n PHE 115 Ca -0.11 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.58 2fh0 n PHE 115 Cb 0.44 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.27 2fh0 n PHE 115 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39