#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 -3.34 -3.56 1.61 1.02 -1.26 -5.09 120.64 110.02 2fh0 n GLU 37 Ca 0.00 2.68 -0.13 0.00 -0.02 0.00 0.00 57.16 59.69 2fh0 n GLU 37 Cb 0.00 -4.89 -0.06 0.00 -0.02 0.00 0.00 31.44 26.48 2fh0 n GLU 37 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2fh0 s ASN 38 N -1.30 -0.49 0.11 1.62 2.47 -1.26 -5.08 114.94 111.01 2fh0 s ASN 38 Ca -0.05 0.57 0.00 0.00 0.42 0.00 0.00 52.86 53.80 2fh0 s ASN 38 Cb 0.00 0.45 0.00 0.00 -1.45 0.00 0.00 41.25 40.25 2fh0 s ASN 38 CO 0.71 -0.44 0.00 -0.24 -3.72 0.00 0.00 177.10 173.41 2fh0 n SER 39 N 0.91 -0.76 -3.79 -4.21 2.88 -1.26 -5.16 113.62 102.22 2fh0 n SER 39 Ca -0.14 0.21 -0.10 0.00 -1.33 0.00 0.00 58.87 57.52 2fh0 n SER 39 Cb 0.57 0.95 -0.05 0.00 -0.75 0.00 0.00 64.21 64.93 2fh0 n SER 39 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2fh0 s ALA 40 N -2.00 -0.58 0.16 -1.46 0.00 -1.26 -5.14 121.76 111.48 2fh0 s ALA 40 Ca 0.00 -0.42 -0.34 0.00 0.00 0.00 0.00 51.96 51.20 2fh0 s ALA 40 Cb 0.00 0.77 -0.15 0.00 0.00 0.00 0.00 23.12 23.74 2fh0 s ALA 40 CO 0.00 -0.68 1.44 -2.30 0.00 0.00 0.00 175.76 174.21 2fh0 n PRO 41 N -0.24 1.76 0.00 0.00 -0.02 -1.26 -4.86 135.00 130.38 2fh0 n PRO 41 Ca -0.11 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2fh0 n PRO 41 Cb 0.63 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 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 2.68 0.00 0.18 -1.45 0.24 -1.26 -4.88 118.33 113.84 2fh0 n VAL 42 Ca 0.16 0.00 0.07 0.00 -2.04 0.00 0.00 64.34 62.53 2fh0 n VAL 42 Cb 0.26 -0.38 0.18 0.00 -1.47 0.00 0.00 33.84 32.43 2fh0 n VAL 42 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2fh0 h GLY 43 N 0.00 0.00 1.52 7.63 0.00 -1.98 -3.24 103.07 107.00 2fh0 h GLY 43 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 2fh0 h GLY 43 CO 0.00 0.00 0.28 0.00 0.00 0.00 0.00 176.54 176.82 2fh0 h ALA 44 N 1.69 1.78 -0.81 3.60 0.00 -1.98 0.17 119.26 123.71 2fh0 h ALA 44 Ca -0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2fh0 h ALA 44 Cb 1.12 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2fh0 h ALA 44 CO 0.04 0.18 0.39 0.00 0.00 0.00 0.00 179.25 179.85 2fh0 h ALA 45 N 1.75 1.16 0.00 0.00 0.00 -1.91 -2.80 119.26 117.45 2fh0 h ALA 45 Ca 0.17 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2fh0 h ALA 45 Cb 0.05 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2fh0 h ALA 45 CO -0.04 0.64 -0.95 -0.84 0.00 0.00 0.00 179.25 178.05 2fh0 h ILE 46 N 1.15 0.26 -0.57 0.00 3.07 -1.53 -3.35 117.51 116.54 2fh0 h ILE 46 Ca 0.28 -1.46 0.17 0.00 1.55 0.00 0.00 64.86 65.40 2fh0 h ILE 46 Cb 0.12 1.84 -0.02 0.00 -0.27 0.00 0.00 36.82 38.48 2fh0 h ILE 46 CO -0.03 0.15 0.41 0.00 -1.05 0.00 0.00 178.15 177.62 2fh0 h ALA 47 N 1.76 2.54 0.00 0.16 0.00 -0.42 0.39 119.26 123.69 2fh0 h ALA 47 Ca -0.05 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 2fh0 h ALA 47 Cb 1.23 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 2fh0 h ALA 47 CO 0.02 -0.71 -0.91 -0.97 0.00 0.00 0.00 179.25 176.69 2fh0 h ASN 48 N 0.00 0.00 0.51 0.00 -0.73 -1.69 -3.30 115.58 110.37 2fh0 h ASN 48 Ca 0.27 0.00 -0.29 0.00 1.87 0.00 0.00 56.30 58.15 2fh0 h ASN 48 Cb 1.09 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.68 2fh0 h ASN 48 CO -0.00 0.91 -1.40 -0.26 -0.37 0.00 0.00 177.43 176.30 2fh0 h PHE 49 N 0.00 0.51 -3.94 0.67 -1.00 -0.93 -3.46 116.94 108.80 2fh0 h PHE 49 Ca -0.01 -0.37 -0.49 0.00 2.81 0.00 0.00 57.97 59.90 2fh0 h PHE 49 Cb 1.70 -0.02 0.03 0.00 3.61 0.00 0.00 35.95 41.27 2fh0 h PHE 49 CO 0.00 1.35 0.45 -0.51 -1.61 0.00 0.00 178.31 177.99 2fh0 s LEU 50 N -7.10 4.20 0.40 1.54 1.02 0.11 -4.12 118.68 114.72 2fh0 s LEU 50 Ca -0.07 2.18 -0.23 0.00 0.02 0.00 0.00 54.13 56.03 2fh0 s LEU 50 Cb 0.07 -4.07 -0.10 0.00 0.02 0.00 0.00 46.19 42.11 2fh0 s LEU 50 CO 0.87 -0.54 1.00 -1.61 0.02 0.00 0.00 176.35 176.10 2fh0 s GLU 51 N -2.32 4.25 0.25 1.70 0.41 -1.21 -4.90 118.70 116.88 2fh0 s GLU 51 Ca 0.56 1.36 -0.05 0.00 -0.41 0.00 0.00 54.97 56.43 2fh0 s GLU 51 Cb -0.26 -2.48 0.28 0.00 -1.78 0.00 0.00 34.13 29.89 2fh0 s GLU 51 CO 0.33 -0.04 1.90 -1.00 -0.49 0.00 0.00 175.26 175.97 2fh0 h PRO 52 N 2.44 1.24 -0.35 0.39 0.13 -1.93 -1.48 132.00 132.44 2fh0 h PRO 52 Ca -0.48 -0.11 -0.06 0.00 -0.87 0.00 0.00 66.00 64.48 2fh0 h PRO 52 Cb 1.20 -0.26 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 2fh0 h PRO 52 CO 0.62 0.86 -0.02 1.96 -0.23 0.00 0.00 178.00 181.19 2fh0 h GLN 53 N 1.26 0.63 -0.78 0.86 1.08 -1.97 -2.69 115.11 113.50 2fh0 h GLN 53 Ca 0.33 -0.21 -0.02 0.00 -1.45 0.00 0.00 58.65 57.29 2fh0 h GLN 53 Cb -0.06 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.28 2fh0 h GLN 53 CO -0.06 0.76 0.40 0.00 -0.95 0.00 0.00 178.83 178.98 2fh0 h ALA 54 N 0.85 1.24 -0.62 3.87 0.00 -1.80 -2.63 119.26 120.16 2fh0 h ALA 54 Ca 0.10 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2fh0 h ALA 54 Cb 0.49 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2fh0 h ALA 54 CO 0.02 0.60 0.38 -0.07 0.00 0.00 0.00 179.25 180.18 2fh0 h LEU 55 N 1.09 0.75 -0.30 0.00 3.38 -1.12 0.74 115.31 119.85 2fh0 h LEU 55 Ca 0.27 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.21 2fh0 h LEU 55 Cb 0.06 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2fh0 h LEU 55 CO -0.04 0.59 0.12 -0.08 0.09 0.00 0.00 178.44 179.12 2fh0 h GLU 56 N 0.84 0.26 -0.53 1.13 4.81 -1.14 -0.11 114.58 119.84 2fh0 h GLU 56 Ca 0.22 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.35 2fh0 h GLU 56 Cb -0.03 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 2fh0 h GLU 56 CO -0.04 0.17 -0.02 -0.09 -0.73 0.00 0.00 179.01 178.30 2fh0 h ARG 57 N 0.27 0.95 -0.39 1.92 1.12 -1.27 -2.83 114.38 114.15 2fh0 h ARG 57 Ca 0.13 -0.31 -0.01 0.00 -1.11 0.00 0.00 59.98 58.67 2fh0 h ARG 57 Cb 0.08 -0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 29.94 2fh0 h ARG 57 CO -0.12 0.98 0.19 1.25 -3.11 0.00 0.00 179.97 179.16 2fh0 h LEU 58 N 0.82 0.47 -0.72 3.80 5.85 -0.43 -2.22 115.31 122.88 2fh0 h LEU 58 Ca 0.15 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 2fh0 h LEU 58 Cb 0.56 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 2fh0 h LEU 58 CO 0.03 0.40 0.17 -1.28 -0.34 0.00 0.00 178.44 177.42 2fh0 h SER 59 N 0.54 1.08 -0.27 1.25 0.87 -0.78 0.14 113.55 116.38 2fh0 h SER 59 Ca 0.14 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.42 2fh0 h SER 59 Cb 0.05 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.71 2fh0 h SER 59 CO -0.02 1.04 -0.00 -0.09 -0.53 0.00 0.00 176.83 177.22 2fh0 h ARG 60 N 1.08 0.48 -0.44 2.24 2.43 -1.31 -2.75 114.38 116.10 2fh0 h ARG 60 Ca 0.22 -0.15 -0.14 0.00 -0.81 0.00 0.00 59.98 59.10 2fh0 h ARG 60 Cb 0.38 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2fh0 h ARG 60 CO 0.00 0.64 -0.27 -0.24 -1.51 0.00 0.00 179.97 178.59 2fh0 h VAL 61 N 0.26 1.27 -0.20 0.20 3.04 -1.33 -2.98 116.25 116.52 2fh0 h VAL 61 Ca 0.08 -1.44 0.06 0.00 -1.01 0.00 0.00 66.70 64.38 2fh0 h VAL 61 Cb 0.43 1.23 -0.01 0.00 -2.01 0.00 0.00 31.29 30.93 2fh0 h VAL 61 CO 0.01 0.49 0.14 0.00 -1.01 0.00 0.00 177.57 177.21 2fh0 h ALA 62 N 0.83 2.18 -0.66 3.17 0.00 -0.67 0.52 119.26 124.63 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 0.86 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2fh0 h ALA 62 CO 0.08 -0.24 0.27 -0.07 0.00 0.00 0.00 179.25 179.29 2fh0 h LEU 63 N 0.01 0.87 0.02 0.00 3.38 -1.32 -1.99 115.31 116.28 2fh0 h LEU 63 Ca 0.10 -0.11 -0.32 0.00 0.09 0.00 0.00 57.88 57.64 2fh0 h LEU 63 Cb 0.37 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2fh0 h LEU 63 CO -0.00 0.77 -1.75 0.52 0.09 0.00 0.00 178.44 178.07 2fh0 n VAL 64 N -4.31 1.58 -3.66 1.22 0.31 -0.56 -4.77 118.33 108.13 2fh0 n VAL 64 Ca 0.06 -0.26 -0.29 0.00 -0.01 0.00 0.00 64.34 63.85 2fh0 n VAL 64 Cb 0.16 -1.91 -0.12 0.00 -0.91 0.00 0.00 33.84 31.06 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 -2.44 1.43 0.48 5.55 1.81 0.17 -4.96 118.95 120.99 2fh0 s ARG 65 Ca -0.30 -2.31 0.14 0.00 -1.72 0.00 0.00 55.73 51.54 2fh0 s ARG 65 Cb 0.08 -2.30 1.14 0.00 -0.45 0.00 0.00 34.95 33.42 2fh0 s ARG 65 CO 0.61 -1.25 2.09 -0.09 -0.68 0.00 0.00 175.30 175.97 2fh0 h ARG 66 N 6.16 0.20 -0.65 3.54 2.43 -1.53 -2.48 114.38 122.05 2fh0 h ARG 66 Ca 0.10 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.33 2fh0 h ARG 66 Cb 0.88 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 30.33 2fh0 h ARG 66 CO 0.50 0.13 0.33 0.22 -1.51 0.00 0.00 179.97 179.64 2fh0 h ASP 67 N 0.21 0.44 -0.13 -3.80 1.82 -1.93 0.41 116.42 113.43 2fh0 h ASP 67 Ca 0.10 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.80 2fh0 h ASP 67 Cb 0.16 -0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.14 2fh0 h ASP 67 CO -0.02 0.27 0.08 0.03 -1.61 0.00 0.00 179.24 177.99 2fh0 h ARG 68 N 0.58 0.16 -0.31 0.28 3.08 -1.82 -1.02 114.38 115.34 2fh0 h ARG 68 Ca 0.31 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 60.27 2fh0 h ARG 68 Cb 0.28 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2fh0 h ARG 68 CO -0.23 0.11 -0.15 0.00 -1.07 0.00 0.00 179.97 178.62 2fh0 h ALA 69 N 1.05 1.17 -0.44 0.04 0.00 -1.47 -2.74 119.26 116.86 2fh0 h ALA 69 Ca 0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2fh0 h ALA 69 Cb -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2fh0 h ALA 69 CO -0.02 0.53 0.25 0.37 0.00 0.00 0.00 179.25 180.38 2fh0 h GLN 70 N 0.49 0.61 -0.31 0.00 4.15 0.29 -1.27 115.11 119.08 2fh0 h GLN 70 Ca 0.09 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.38 2fh0 h GLN 70 Cb 0.55 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 2fh0 h GLN 70 CO 0.04 0.47 -0.06 0.00 -1.93 0.00 0.00 178.83 177.35 2fh0 h ALA 71 N 1.10 1.34 -0.11 3.38 0.00 -1.05 0.11 119.26 124.02 2fh0 h ALA 71 Ca 0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2fh0 h ALA 71 Cb 0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2fh0 h ALA 71 CO -0.03 0.45 -0.04 0.28 0.00 0.00 0.00 179.25 179.92 2fh0 h VAL 72 N 0.46 1.30 -0.47 0.00 2.07 -1.15 0.26 116.25 118.73 2fh0 h VAL 72 Ca 0.09 -1.01 -0.12 0.00 0.82 0.00 0.00 66.70 66.49 2fh0 h VAL 72 Cb 0.39 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 2fh0 h VAL 72 CO 0.02 0.29 -0.16 1.05 0.02 0.00 0.00 177.57 178.79 2fh0 h GLU 73 N -0.11 0.94 -0.05 1.57 4.11 -1.09 -2.38 114.58 117.57 2fh0 h GLU 73 Ca 0.03 -0.38 -0.14 0.00 0.07 0.00 0.00 59.36 58.94 2fh0 h GLU 73 Cb 0.47 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2fh0 h GLU 73 CO 0.01 1.04 -0.59 1.15 0.07 0.00 0.00 179.01 180.70 2fh0 h THR 74 N 0.79 1.39 -0.24 -1.06 2.02 -0.79 -2.74 112.91 112.28 2fh0 h THR 74 Ca 0.11 -1.96 -0.04 0.00 0.77 0.00 0.00 66.41 65.30 2fh0 h THR 74 Cb 0.72 2.00 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 2fh0 h THR 74 CO 0.05 0.57 -0.01 0.22 0.37 0.00 0.00 175.52 176.73 2fh0 h TYR 75 N 0.13 0.46 -0.33 3.16 5.03 -0.35 -0.55 116.97 124.53 2fh0 h TYR 75 Ca -0.00 -0.08 -0.02 0.00 2.58 0.00 0.00 58.73 61.21 2fh0 h TYR 75 Cb 1.07 -0.12 -0.01 0.00 1.55 0.00 0.00 36.73 39.22 2fh0 h TYR 75 CO 0.02 0.60 0.14 1.25 -1.32 0.00 0.00 178.16 178.85 2fh0 h LEU 76 N 0.19 0.44 -0.96 2.82 5.85 -1.42 -2.11 115.31 120.12 2fh0 h LEU 76 Ca 0.07 -0.15 -0.10 0.00 0.84 0.00 0.00 57.88 58.54 2fh0 h LEU 76 Cb 0.43 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 2fh0 h LEU 76 CO 0.01 0.48 -0.29 0.07 -0.34 0.00 0.00 178.44 178.37 2fh0 h LYS 77 N 0.38 0.41 -0.32 1.25 2.10 -1.48 -2.25 116.57 116.66 2fh0 h LYS 77 Ca 0.11 -0.16 -0.02 0.00 -2.00 0.00 0.00 60.65 58.58 2fh0 h LYS 77 Cb 0.16 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.46 2fh0 h LYS 77 CO -0.01 0.66 0.11 0.87 -2.00 0.00 0.00 179.45 179.09 2fh0 h LYS 78 N 0.36 0.49 -0.48 0.07 1.57 -0.87 0.16 116.57 117.87 2fh0 h LYS 78 Ca 0.05 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 2fh0 h LYS 78 Cb 0.69 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 2fh0 h LYS 78 CO 0.05 0.51 0.13 -0.07 -0.57 0.00 0.00 179.45 179.50 2fh0 h LEU 79 N 0.36 0.72 -0.42 2.94 4.07 -1.27 -1.50 115.31 120.20 2fh0 h LEU 79 Ca 0.10 -0.22 -0.10 0.00 0.08 0.00 0.00 57.88 57.75 2fh0 h LEU 79 Cb 0.22 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.76 2fh0 h LEU 79 CO -0.01 0.75 -0.11 0.40 -1.08 0.00 0.00 178.44 178.40 2fh0 h ILE 80 N 0.65 1.27 0.00 1.22 2.04 -1.29 0.20 117.51 121.60 2fh0 h ILE 80 Ca 0.15 -1.21 -0.05 0.00 1.00 0.00 0.00 64.86 64.75 2fh0 h ILE 80 Cb 0.31 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 2fh0 h ILE 80 CO -0.00 0.41 -0.22 0.00 0.00 0.00 0.00 178.15 178.34 2fh0 h ALA 81 N 0.85 1.56 0.00 1.87 0.00 -0.57 -3.31 119.26 119.67 2fh0 h ALA 81 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2fh0 h ALA 81 Cb 0.64 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2fh0 h ALA 81 CO 0.04 0.27 -0.17 1.79 0.00 0.00 0.00 179.25 181.19 2fh0 h THR 82 N 0.00 0.00 0.00 0.00 1.35 -1.07 -3.50 112.91 109.69 2fh0 h THR 82 Ca -0.00 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 2fh0 h THR 82 Cb 0.41 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.83 2fh0 h THR 82 CO 0.03 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 174.84 2fh0 n ASN 83 N -3.62 0.00 -4.55 5.36 6.94 0.19 -5.10 115.26 114.50 2fh0 n ASN 83 Ca -0.02 0.00 -0.34 0.00 -0.02 0.00 0.00 54.58 54.20 2fh0 n ASN 83 Cb 0.09 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.46 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 1.99 -3.21 0.53 3.02 0.46 -4.83 115.26 113.23 2fh0 n ASN 84 Ca 0.00 -0.57 -0.19 0.00 -0.03 0.00 0.00 54.58 53.80 2fh0 n ASN 84 Cb 0.00 -1.51 -0.07 0.00 -0.61 0.00 0.00 39.78 37.59 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 12.08 -0.18 0.00 2.41 1.01 -1.26 -3.25 120.40 131.22 2fh0 s VAL 85 Ca 1.02 -1.84 0.00 0.00 0.00 0.00 0.00 61.98 61.16 2fh0 s VAL 85 Cb -0.29 -0.78 0.00 0.00 0.00 0.00 0.00 36.38 35.31 2fh0 s VAL 85 CO 0.27 -0.76 0.86 0.35 0.00 0.00 0.00 175.10 175.82 2fh0 n THR 86 N 3.17 0.00 -4.02 3.92 -2.24 -1.26 -5.12 114.28 108.74 2fh0 n THR 86 Ca 0.22 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 62.04 2fh0 n THR 86 Cb 0.49 0.61 0.01 0.00 -2.10 0.00 0.00 70.33 69.35 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 0.00 -0.15 -4.57 4.78 1.44 -1.26 -5.19 115.22 110.27 2fh0 n HIS 87 Ca 0.00 -0.50 -0.27 0.00 -2.01 0.00 0.00 57.72 54.94 2fh0 n HIS 87 Cb 0.64 0.22 -0.08 0.00 0.12 0.00 0.00 29.99 30.89 2fh0 n HIS 87 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2fh0 s LYS 88 N -2.01 1.98 -0.64 -1.40 1.02 -1.26 -5.08 119.74 112.35 2fh0 s LYS 88 Ca 0.27 -2.22 -0.07 0.00 0.02 0.00 0.00 55.97 53.97 2fh0 s LYS 88 Cb -0.00 -0.82 0.17 0.00 -0.52 0.00 0.00 37.83 36.66 2fh0 s LYS 88 CO -0.02 -0.44 0.50 0.42 -0.92 0.00 0.00 175.35 174.89 2fh0 s ILE 89 N -3.14 4.33 0.82 2.17 1.01 -1.26 -4.95 121.20 120.19 2fh0 s ILE 89 Ca 0.20 -2.54 -0.14 0.00 0.00 0.00 0.00 60.65 58.17 2fh0 s ILE 89 Cb 0.03 -3.78 0.19 0.00 0.01 0.00 0.00 42.46 38.91 2fh0 s ILE 89 CO 0.12 -0.89 1.03 0.35 0.00 0.00 0.00 174.94 175.55 2fh0 n THR 90 N 3.97 0.00 -0.32 2.92 -2.24 -1.26 -3.32 114.28 114.02 2fh0 n THR 90 Ca 0.06 -0.70 0.07 0.00 -2.27 0.00 0.00 64.05 61.20 2fh0 n THR 90 Cb 0.41 -1.53 0.27 0.00 -2.10 0.00 0.00 70.33 67.39 2fh0 n THR 90 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2fh0 h GLU 91 N 0.00 0.91 -0.30 -0.78 4.81 -1.92 0.47 114.58 117.76 2fh0 h GLU 91 Ca -0.34 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 58.70 2fh0 h GLU 91 Cb 0.96 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 2fh0 h GLU 91 CO 0.24 0.60 -0.33 0.00 -0.73 0.00 0.00 179.01 178.79 2fh0 h ALA 92 N 1.54 0.44 -0.28 2.92 0.00 -2.00 -2.64 119.26 119.25 2fh0 h ALA 92 Ca 0.45 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2fh0 h ALA 92 Cb 0.45 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2fh0 h ALA 92 CO -0.21 0.49 -0.22 0.93 0.00 0.00 0.00 179.25 180.25 2fh0 h GLU 93 N 0.50 0.64 -0.70 0.00 4.39 -1.61 -2.18 114.58 115.62 2fh0 h GLU 93 Ca 0.04 -0.31 -0.03 0.00 0.34 0.00 0.00 59.36 59.40 2fh0 h GLU 93 Cb 0.91 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.53 2fh0 h GLU 93 CO 0.08 0.91 0.32 0.97 -1.16 0.00 0.00 179.01 180.13 2fh0 h ILE 94 N 0.37 1.24 -0.43 3.13 2.10 -0.16 -0.22 117.51 123.54 2fh0 h ILE 94 Ca 0.05 -0.68 -0.10 0.00 1.08 0.00 0.00 64.86 65.21 2fh0 h ILE 94 Cb 0.76 0.39 -0.01 0.00 -1.09 0.00 0.00 36.82 36.87 2fh0 h ILE 94 CO 0.06 0.28 -0.12 0.58 -1.08 0.00 0.00 178.15 177.87 2fh0 h VAL 95 N 0.98 1.27 -0.36 2.19 2.07 -1.49 0.25 116.25 121.17 2fh0 h VAL 95 Ca 0.24 -1.23 -0.02 0.00 0.82 0.00 0.00 66.70 66.51 2fh0 h VAL 95 Cb 0.14 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 2fh0 h VAL 95 CO -0.03 0.42 0.16 0.28 0.02 0.00 0.00 177.57 178.42 2fh0 h SER 96 N 0.66 0.48 -0.37 0.57 0.02 -1.14 0.46 113.55 114.22 2fh0 h SER 96 Ca 0.11 -0.14 -0.13 0.00 -0.84 0.00 0.00 61.79 60.78 2fh0 h SER 96 Cb 0.66 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.07 2fh0 h SER 96 CO 0.05 0.49 -0.29 0.40 -1.14 0.00 0.00 176.83 176.34 2fh0 h ILE 97 N 0.44 1.28 -0.59 3.27 2.04 -0.99 -2.34 117.51 120.62 2fh0 h ILE 97 Ca 0.12 -1.45 -0.02 0.00 1.00 0.00 0.00 64.86 64.51 2fh0 h ILE 97 Cb 0.15 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 2fh0 h ILE 97 CO -0.01 0.48 0.29 0.25 0.00 0.00 0.00 178.15 179.15 2fh0 h LEU 98 N 0.65 0.77 -1.22 1.44 6.46 -0.29 -0.32 115.31 122.79 2fh0 h LEU 98 Ca 0.07 -0.13 -0.04 0.00 -0.12 0.00 0.00 57.88 57.66 2fh0 h LEU 98 Cb 0.87 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 40.58 2fh0 h LEU 98 CO 0.08 0.68 0.09 0.78 -0.62 0.00 0.00 178.44 179.45 2fh0 h ASN 99 N 0.80 0.58 0.22 1.25 2.35 -0.01 -2.30 115.58 118.46 2fh0 h ASN 99 Ca 0.20 -0.09 -0.20 0.00 -0.55 0.00 0.00 56.30 55.66 2fh0 h ASN 99 Cb 0.12 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 2fh0 h ASN 99 CO -0.03 0.59 -0.80 1.23 -1.65 0.00 0.00 177.43 176.77 2fh0 h GLY 100 N 0.84 0.51 0.82 2.83 0.00 -1.01 -3.13 103.07 103.93 2fh0 h GLY 100 Ca 0.14 -0.77 0.03 0.00 0.00 0.00 0.00 47.33 46.72 2fh0 h GLY 100 CO -0.00 0.69 0.21 -2.22 0.00 0.00 0.00 176.54 175.21 2fh0 h ILE 101 N 0.30 0.99 -0.30 2.60 2.04 -0.61 -1.84 117.51 120.68 2fh0 h ILE 101 Ca -0.05 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 2fh0 h ILE 101 Cb 1.40 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 2fh0 h ILE 101 CO 0.14 0.08 0.19 0.00 0.00 0.00 0.00 178.15 178.55 2fh0 h ALA 102 N 1.21 1.76 -0.81 1.87 0.00 -1.44 -2.13 119.26 119.70 2fh0 h ALA 102 Ca 0.17 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2fh0 h ALA 102 Cb 0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2fh0 h ALA 102 CO -0.11 0.22 0.42 -0.22 0.00 0.00 0.00 179.25 179.55 2fh0 h LYS 103 N 0.41 1.15 -0.65 0.00 3.64 -1.29 -2.72 116.57 117.12 2fh0 h LYS 103 Ca 0.11 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 2fh0 h LYS 103 Cb -0.02 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.55 2fh0 h LYS 103 CO -0.02 0.87 0.20 1.96 -2.27 0.00 0.00 179.45 180.19 2fh0 h GLN 104 N 1.14 1.00 -4.17 1.90 1.08 -1.18 -3.36 115.11 111.53 2fh0 h GLN 104 Ca 0.28 -0.22 -0.76 0.00 -1.45 0.00 0.00 58.65 56.51 2fh0 h GLN 104 Cb 0.07 -0.15 -0.23 0.00 -0.05 0.00 0.00 27.48 27.12 2fh0 h GLN 104 CO -0.04 0.88 0.44 1.14 -0.95 0.00 0.00 178.83 180.30 2fh0 s GLN 105 N -5.41 3.74 0.00 1.46 -2.07 -1.03 -4.25 119.66 112.10 2fh0 s GLN 105 Ca -0.12 -2.42 0.00 0.00 -1.82 0.00 0.00 55.36 51.00 2fh0 s GLN 105 Cb 0.14 -4.63 0.00 0.00 -1.09 0.00 0.00 33.01 27.43 2fh0 s GLN 105 CO 0.82 -1.44 0.00 -1.71 -1.32 0.00 0.00 175.29 171.64 2fh0 n ASN 106 N 4.56 0.00 0.00 12.60 5.15 -1.26 -4.85 115.26 131.46 2fh0 n ASN 106 Ca 0.20 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.18 2fh0 n ASN 106 Cb 0.46 0.14 0.00 0.00 -0.53 0.00 0.00 39.78 39.85 2fh0 n ASN 106 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2fh0 n SER 107 N -2.10 0.00 -2.01 1.20 7.64 -1.26 -5.11 113.62 111.99 2fh0 n SER 107 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 2fh0 n SER 107 Cb 0.00 0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 2fh0 n SER 107 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2fh0 n GLN 108 N -1.47 -0.85 -4.25 1.43 7.27 -1.26 -5.05 117.38 113.20 2fh0 n GLN 108 Ca 0.00 1.08 -0.34 0.00 0.07 0.00 0.00 57.00 57.81 2fh0 n GLN 108 Cb 0.00 -3.05 -0.12 0.00 2.41 0.00 0.00 30.24 29.48 2fh0 n GLN 108 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 2fh0 s ASN 109 N -1.67 4.79 -1.28 1.69 3.84 -1.26 -5.03 114.94 116.03 2fh0 s ASN 109 Ca 0.08 -0.17 -0.19 0.00 0.21 0.00 0.00 52.86 52.80 2fh0 s ASN 109 Cb -0.02 -1.80 0.03 0.00 -0.55 0.00 0.00 41.25 38.91 2fh0 s ASN 109 CO 0.28 0.12 1.81 0.59 -2.79 0.00 0.00 177.10 177.11 2fh0 n ASN 110 N 3.86 4.45 0.00 -4.21 3.02 -1.26 -4.35 115.26 116.77 2fh0 n ASN 110 Ca -0.17 -2.87 0.00 0.00 -0.03 0.00 0.00 54.58 51.51 2fh0 n ASN 110 Cb 0.52 -1.73 0.00 0.00 -0.61 0.00 0.00 39.78 37.96 2fh0 n ASN 110 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2fh0 n SER 111 N 9.54 3.20 -0.05 6.41 3.41 -1.26 -4.59 113.62 130.28 2fh0 n SER 111 Ca 0.48 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.98 2fh0 n SER 111 Cb 0.46 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.26 2fh0 n SER 111 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2fh0 n LYS 112 N -2.40 0.67 -0.00 4.33 4.76 -1.26 -4.25 118.16 120.00 2fh0 n LYS 112 Ca 0.00 0.20 -0.08 0.00 -2.87 0.00 0.00 58.31 55.56 2fh0 n LYS 112 Cb 0.43 -1.69 0.08 0.00 -1.84 0.00 0.00 35.03 32.01 2fh0 n LYS 112 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2fh0 h ILE 113 N 0.01 1.31 -0.13 -0.18 5.03 -1.87 -2.95 117.51 118.72 2fh0 h ILE 113 Ca -0.40 -1.69 0.04 0.00 -0.12 0.00 0.00 64.86 62.69 2fh0 h ILE 113 Cb 2.07 1.67 -0.01 0.00 -3.03 0.00 0.00 36.82 37.52 2fh0 h ILE 113 CO 0.06 0.53 0.18 0.16 -0.68 0.00 0.00 178.15 178.40 2fh0 h ILE 114 N 0.45 0.37 -1.50 -0.67 -0.00 -1.81 -3.40 117.51 110.95 2fh0 h ILE 114 Ca 0.02 0.00 -0.46 0.00 -0.00 0.00 0.00 64.86 64.43 2fh0 h ILE 114 Cb 1.01 0.85 0.00 0.00 -0.00 0.00 0.00 36.82 38.67 2fh0 h ILE 114 CO 0.09 0.00 1.62 0.33 -0.00 0.00 0.00 178.15 180.19 2fh0 n PHE 115 N -3.62 1.37 1.77 0.16 -0.00 -1.12 -5.11 117.46 110.92 2fh0 n PHE 115 Ca 0.00 0.13 0.15 0.00 -0.00 0.00 0.00 57.45 57.74 2fh0 n PHE 115 Cb 0.29 -2.62 0.75 0.00 -0.00 0.00 0.00 39.48 37.90 2fh0 n PHE 115 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.76 175.91