#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 0.55 -3.53 1.61 2.13 -1.26 -4.87 120.64 115.26 2fh0 n GLU 37 Ca 0.00 0.11 -0.42 0.00 0.66 0.00 0.00 57.16 57.51 2fh0 n GLU 37 Cb 0.00 -1.40 -0.09 0.00 0.27 0.00 0.00 31.44 30.23 2fh0 n GLU 37 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 2fh0 s ASN 38 N -5.86 5.77 0.23 4.31 3.84 -1.26 -5.04 114.94 116.93 2fh0 s ASN 38 Ca -0.26 -1.69 -0.15 0.00 0.21 0.00 0.00 52.86 50.97 2fh0 s ASN 38 Cb 0.07 -2.04 0.01 0.00 -0.55 0.00 0.00 41.25 38.73 2fh0 s ASN 38 CO 0.47 -0.65 0.51 -0.94 -2.79 0.00 0.00 177.10 173.69 2fh0 s SER 39 N 2.56 -0.15 -0.27 -4.21 1.04 -1.26 -5.15 113.70 106.26 2fh0 s SER 39 Ca 0.04 -0.76 -0.04 0.00 0.48 0.00 0.00 55.95 55.67 2fh0 s SER 39 Cb -0.25 0.59 0.10 0.00 0.10 0.00 0.00 66.02 66.56 2fh0 s SER 39 CO 0.01 -1.13 0.14 0.00 0.98 0.00 0.00 173.24 173.25 2fh0 s ALA 40 N -3.96 0.47 -0.81 5.32 0.00 -1.26 -5.09 121.76 116.43 2fh0 s ALA 40 Ca 0.17 -0.89 -0.23 0.00 0.00 0.00 0.00 51.96 51.01 2fh0 s ALA 40 Cb -0.01 -1.39 -0.19 0.00 0.00 0.00 0.00 23.12 21.53 2fh0 s ALA 40 CO 0.05 -1.59 2.40 -2.30 0.00 0.00 0.00 175.76 174.32 2fh0 n PRO 41 N 5.26 0.43 -1.06 0.00 -0.02 -1.26 -4.91 135.00 133.44 2fh0 n PRO 41 Ca -0.06 -0.28 -0.29 0.00 -2.02 0.00 0.00 63.50 60.85 2fh0 n PRO 41 Cb 0.43 -2.56 0.18 0.00 -0.02 0.00 0.00 33.50 31.53 2fh0 n PRO 41 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2fh0 s VAL 42 N 9.44 2.25 0.00 -1.45 -7.23 -1.26 -3.90 120.40 118.25 2fh0 s VAL 42 Ca 1.12 0.08 0.00 0.00 -1.81 0.00 0.00 61.98 61.37 2fh0 s VAL 42 Cb -0.53 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 33.93 2fh0 s VAL 42 CO 0.32 -0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.62 2fh0 n GLY 43 N -0.74 1.89 0.34 2.32 0.00 -1.26 -4.60 105.19 103.14 2fh0 n GLY 43 Ca 0.06 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 1.43 -0.88 4.61 0.00 -1.99 0.37 119.26 122.80 2fh0 h ALA 44 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2fh0 h ALA 44 Cb 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 2fh0 h ALA 44 CO 0.00 0.49 0.53 0.00 0.00 0.00 0.00 179.25 180.27 2fh0 h ALA 45 N 1.51 1.27 0.00 0.00 0.00 -1.81 -2.68 119.26 117.54 2fh0 h ALA 45 Ca 0.25 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 2fh0 h ALA 45 Cb -0.03 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 2fh0 h ALA 45 CO -0.05 0.62 -1.08 -0.84 0.00 0.00 0.00 179.25 177.91 2fh0 h ILE 46 N 1.21 0.41 -0.22 0.00 3.07 -1.78 -3.34 117.51 116.85 2fh0 h ILE 46 Ca 0.32 -1.73 0.06 0.00 1.55 0.00 0.00 64.86 65.06 2fh0 h ILE 46 Cb -0.04 1.96 -0.01 0.00 -0.27 0.00 0.00 36.82 38.46 2fh0 h ILE 46 CO -0.06 0.23 0.18 0.00 -1.05 0.00 0.00 178.15 177.45 2fh0 h ALA 47 N 1.61 2.11 0.00 0.16 0.00 0.08 -0.12 119.26 123.10 2fh0 h ALA 47 Ca -0.09 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 2fh0 h ALA 47 Cb 1.37 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 2fh0 h ALA 47 CO 0.04 -0.29 -0.86 -0.91 0.00 0.00 0.00 179.25 177.22 2fh0 h ASN 48 N 0.00 0.00 0.12 0.00 2.35 -1.67 -3.25 115.58 113.13 2fh0 h ASN 48 Ca 0.11 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.78 2fh0 h ASN 48 Cb 0.46 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 2fh0 h ASN 48 CO -0.00 0.85 -0.27 -0.26 -1.65 0.00 0.00 177.43 176.10 2fh0 h PHE 49 N 0.00 0.28 -3.58 1.19 -1.00 -1.19 -3.43 116.94 109.21 2fh0 h PHE 49 Ca -0.01 -0.05 -0.52 0.00 2.81 0.00 0.00 57.97 60.20 2fh0 h PHE 49 Cb 1.66 -0.07 -0.03 0.00 3.61 0.00 0.00 35.95 41.12 2fh0 h PHE 49 CO 0.00 0.51 0.09 -0.51 -1.61 0.00 0.00 178.31 176.79 2fh0 s LEU 50 N -8.51 4.28 0.52 1.54 1.02 -1.06 -4.03 118.68 112.44 2fh0 s LEU 50 Ca -0.05 1.35 -0.17 0.00 0.02 0.00 0.00 54.13 55.29 2fh0 s LEU 50 Cb 0.14 -3.67 -0.07 0.00 0.02 0.00 0.00 46.19 42.61 2fh0 s LEU 50 CO 0.75 -0.02 1.00 -1.61 0.02 0.00 0.00 176.35 176.50 2fh0 s GLU 51 N -2.21 3.84 0.23 1.70 0.41 -1.24 -4.89 118.70 116.54 2fh0 s GLU 51 Ca 0.45 1.04 -0.08 0.00 -0.41 0.00 0.00 54.97 55.97 2fh0 s GLU 51 Cb -0.15 -2.12 0.23 0.00 -1.78 0.00 0.00 34.13 30.32 2fh0 s GLU 51 CO 0.20 -0.37 1.89 -1.00 -0.49 0.00 0.00 175.26 175.49 2fh0 h PRO 52 N 0.92 1.08 -0.29 0.39 0.13 -1.95 0.10 132.00 132.38 2fh0 h PRO 52 Ca -0.47 -0.07 -0.08 0.00 -0.87 0.00 0.00 66.00 64.52 2fh0 h PRO 52 Cb 1.19 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 32.07 2fh0 h PRO 52 CO 0.60 0.72 -0.11 1.96 -0.23 0.00 0.00 178.00 180.94 2fh0 h GLN 53 N 1.11 0.60 -0.64 0.86 1.08 -1.99 -2.72 115.11 113.41 2fh0 h GLN 53 Ca 0.33 -0.25 -0.06 0.00 -1.45 0.00 0.00 58.65 57.22 2fh0 h GLN 53 Cb -0.06 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.32 2fh0 h GLN 53 CO -0.09 0.81 0.14 0.00 -0.95 0.00 0.00 178.83 178.74 2fh0 h ALA 54 N 0.77 1.05 -0.89 3.87 0.00 -1.82 -2.79 119.26 119.45 2fh0 h ALA 54 Ca 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2fh0 h ALA 54 Cb 0.62 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2fh0 h ALA 54 CO 0.04 0.62 0.57 1.25 0.00 0.00 0.00 179.25 181.73 2fh0 h LEU 55 N 0.96 1.05 -0.94 0.00 6.46 -0.73 -1.97 115.31 120.15 2fh0 h LEU 55 Ca 0.20 -0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 57.91 2fh0 h LEU 55 Cb 0.36 -0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 39.98 2fh0 h LEU 55 CO 0.00 0.78 0.57 -0.08 -0.62 0.00 0.00 178.44 179.10 2fh0 h GLU 56 N 1.22 1.27 -0.25 1.25 4.57 -1.22 -2.20 114.58 119.22 2fh0 h GLU 56 Ca 0.32 -0.11 -0.03 0.00 -1.18 0.00 0.00 59.36 58.36 2fh0 h GLU 56 Cb -0.10 -0.27 -0.01 0.00 -0.16 0.00 0.00 28.75 28.22 2fh0 h GLU 56 CO -0.07 0.88 0.04 -0.09 -1.18 0.00 0.00 179.01 178.60 2fh0 h ARG 57 N 1.29 0.41 -0.71 1.92 1.12 -1.26 -2.70 114.38 114.45 2fh0 h ARG 57 Ca 0.34 -0.11 0.05 0.00 -1.11 0.00 0.00 59.98 59.15 2fh0 h ARG 57 Cb -0.07 -0.05 -0.04 0.00 -0.01 0.00 0.00 29.97 29.80 2fh0 h ARG 57 CO -0.06 0.53 0.47 1.25 -3.11 0.00 0.00 179.97 179.04 2fh0 h LEU 58 N 0.22 0.68 -0.67 3.80 5.85 -1.11 -1.42 115.31 122.65 2fh0 h LEU 58 Ca 0.08 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 2fh0 h LEU 58 Cb 0.32 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 2fh0 h LEU 58 CO 0.00 0.45 0.08 0.28 -0.34 0.00 0.00 178.44 178.91 2fh0 h SER 59 N 0.78 1.07 -0.29 1.25 0.02 -1.21 0.17 113.55 115.34 2fh0 h SER 59 Ca 0.30 -0.27 -0.04 0.00 -0.84 0.00 0.00 61.79 60.94 2fh0 h SER 59 Cb 0.19 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 2fh0 h SER 59 CO -0.09 1.07 0.01 -0.09 -1.14 0.00 0.00 176.83 176.59 2fh0 h ARG 60 N 1.03 0.51 -0.49 3.45 2.43 -0.97 -2.68 114.38 117.65 2fh0 h ARG 60 Ca 0.20 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 59.09 2fh0 h ARG 60 Cb 0.48 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 2fh0 h ARG 60 CO 0.02 0.64 -0.18 -0.24 -1.51 0.00 0.00 179.97 178.70 2fh0 h VAL 61 N 0.31 1.27 -0.22 0.20 3.04 -1.23 -2.94 116.25 116.68 2fh0 h VAL 61 Ca 0.08 -1.34 0.03 0.00 -1.01 0.00 0.00 66.70 64.46 2fh0 h VAL 61 Cb 0.40 1.09 -0.01 0.00 -2.01 0.00 0.00 31.29 30.77 2fh0 h VAL 61 CO 0.01 0.47 0.15 0.00 -1.01 0.00 0.00 177.57 177.19 2fh0 h ALA 62 N 0.88 2.00 -0.44 3.17 0.00 -0.90 0.46 119.26 124.42 2fh0 h ALA 62 Ca 0.12 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2fh0 h ALA 62 Cb 0.76 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2fh0 h ALA 62 CO 0.06 -0.04 0.06 -0.07 0.00 0.00 0.00 179.25 179.27 2fh0 h LEU 63 N 0.16 0.64 0.01 0.00 3.38 -1.29 -2.50 115.31 115.72 2fh0 h LEU 63 Ca 0.09 -0.12 -0.29 0.00 0.09 0.00 0.00 57.88 57.65 2fh0 h LEU 63 Cb 0.17 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2fh0 h LEU 63 CO -0.01 0.67 -1.59 0.52 0.09 0.00 0.00 178.44 178.11 2fh0 n VAL 64 N -4.28 1.55 -3.60 1.22 0.31 -0.63 -4.81 118.33 108.10 2fh0 n VAL 64 Ca 0.03 -0.15 -0.29 0.00 -0.01 0.00 0.00 64.34 63.92 2fh0 n VAL 64 Cb 0.24 -1.98 -0.13 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 -2.41 0.99 0.46 5.55 3.00 0.15 -4.98 118.95 121.71 2fh0 s ARG 65 Ca -0.31 -1.75 0.11 0.00 0.00 0.00 0.00 55.73 53.79 2fh0 s ARG 65 Cb 0.08 -1.90 1.04 0.00 0.00 0.00 0.00 34.95 34.17 2fh0 s ARG 65 CO 0.58 -1.19 2.09 -0.09 0.00 0.00 0.00 175.30 176.70 2fh0 h ARG 66 N 6.80 0.28 -0.80 3.54 1.12 -1.61 -2.58 114.38 121.13 2fh0 h ARG 66 Ca 0.03 -0.02 0.09 0.00 -1.11 0.00 0.00 59.98 58.97 2fh0 h ARG 66 Cb 0.94 -0.06 -0.07 0.00 -0.01 0.00 0.00 29.97 30.77 2fh0 h ARG 66 CO 0.39 0.20 0.44 -0.44 -3.11 0.00 0.00 179.97 177.45 2fh0 h ASP 67 N 0.29 0.63 -0.08 -3.80 3.32 -1.93 0.16 116.42 115.01 2fh0 h ASP 67 Ca 0.08 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2fh0 h ASP 67 Cb -0.02 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.46 2fh0 h ASP 67 CO -0.02 0.36 0.00 0.03 -1.72 0.00 0.00 179.24 177.89 2fh0 h ARG 68 N 0.75 0.14 -0.81 3.56 2.47 -1.83 -2.42 114.38 116.23 2fh0 h ARG 68 Ca 0.38 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 59.03 2fh0 h ARG 68 Cb 0.36 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.63 2fh0 h ARG 68 CO -0.25 0.40 0.38 0.00 0.56 0.00 0.00 179.97 181.06 2fh0 h ALA 69 N 0.74 1.15 -0.68 0.04 0.00 -1.42 -2.68 119.26 116.40 2fh0 h ALA 69 Ca 0.02 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 2fh0 h ALA 69 Cb 0.33 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2fh0 h ALA 69 CO 0.00 0.64 0.12 -0.56 0.00 0.00 0.00 179.25 179.45 2fh0 h GLN 70 N 1.15 1.13 -0.41 0.00 3.07 -0.68 -2.33 115.11 117.04 2fh0 h GLN 70 Ca 0.28 -0.30 -0.03 0.00 0.09 0.00 0.00 58.65 58.69 2fh0 h GLN 70 Cb 0.12 -0.13 -0.02 0.00 0.08 0.00 0.00 27.48 27.53 2fh0 h GLN 70 CO -0.03 1.02 0.13 0.00 0.09 0.00 0.00 178.83 180.04 2fh0 h ALA 71 N 1.06 1.46 -0.08 0.06 0.00 -1.17 0.34 119.26 120.93 2fh0 h ALA 71 Ca 0.21 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2fh0 h ALA 71 Cb 0.44 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2fh0 h ALA 71 CO 0.01 0.40 -0.05 0.28 0.00 0.00 0.00 179.25 179.89 2fh0 h VAL 72 N 0.59 1.34 -0.29 0.00 2.07 -1.15 0.31 116.25 119.12 2fh0 h VAL 72 Ca 0.14 -1.11 -0.07 0.00 0.82 0.00 0.00 66.70 66.48 2fh0 h VAL 72 Cb 0.17 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2fh0 h VAL 72 CO -0.01 0.31 -0.09 -0.33 0.02 0.00 0.00 177.57 177.47 2fh0 h GLU 73 N -0.20 0.57 -0.19 1.57 4.39 -1.19 -2.13 114.58 117.41 2fh0 h GLU 73 Ca 0.02 -0.23 -0.06 0.00 0.34 0.00 0.00 59.36 59.42 2fh0 h GLU 73 Cb 0.52 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2fh0 h GLU 73 CO 0.01 0.79 -0.16 1.15 -1.16 0.00 0.00 179.01 179.64 2fh0 h THR 74 N 0.33 1.21 -0.14 1.13 2.02 -0.37 -1.65 112.91 115.44 2fh0 h THR 74 Ca 0.07 -0.94 -0.02 0.00 0.77 0.00 0.00 66.41 66.29 2fh0 h THR 74 Cb 0.59 1.24 -0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2fh0 h THR 74 CO 0.03 0.29 -0.01 0.22 0.37 0.00 0.00 175.52 176.43 2fh0 h TYR 75 N 0.29 0.28 -0.31 3.16 3.20 -0.76 -1.92 116.97 120.90 2fh0 h TYR 75 Ca 0.06 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 2fh0 h TYR 75 Cb 0.46 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 2fh0 h TYR 75 CO 0.01 0.50 0.12 1.25 -1.64 0.00 0.00 178.16 178.39 2fh0 h LEU 76 N -0.03 0.44 -1.42 2.82 5.85 -1.18 -2.55 115.31 119.24 2fh0 h LEU 76 Ca 0.04 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 2fh0 h LEU 76 Cb 0.40 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 2fh0 h LEU 76 CO 0.01 0.50 0.12 0.07 -0.34 0.00 0.00 178.44 178.79 2fh0 h LYS 77 N 0.35 0.50 -0.43 1.25 5.09 -1.32 -1.31 116.57 120.70 2fh0 h LYS 77 Ca 0.10 -0.07 -0.04 0.00 0.09 0.00 0.00 60.65 60.73 2fh0 h LYS 77 Cb 0.20 -0.09 -0.02 0.00 0.10 0.00 0.00 32.23 32.42 2fh0 h LYS 77 CO -0.01 0.44 0.10 -0.22 -2.09 0.00 0.00 179.45 177.67 2fh0 h LYS 78 N 0.50 0.69 -0.17 0.07 3.64 -1.08 0.21 116.57 120.43 2fh0 h LYS 78 Ca 0.12 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 2fh0 h LYS 78 Cb 0.14 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 2fh0 h LYS 78 CO -0.01 0.70 -0.02 -0.07 -2.27 0.00 0.00 179.45 177.78 2fh0 h LEU 79 N 0.56 0.31 -0.78 5.20 4.07 -1.05 0.50 115.31 124.13 2fh0 h LEU 79 Ca 0.13 -0.34 -0.03 0.00 0.08 0.00 0.00 57.88 57.73 2fh0 h LEU 79 Cb 0.33 -0.09 -0.04 0.00 1.08 0.00 0.00 40.66 41.95 2fh0 h LEU 79 CO 0.00 0.58 0.38 0.40 -1.08 0.00 0.00 178.44 178.72 2fh0 h ILE 80 N 0.04 1.25 -0.05 1.22 2.04 -1.21 0.71 117.51 121.51 2fh0 h ILE 80 Ca 0.05 -0.69 -0.13 0.00 1.00 0.00 0.00 64.86 65.09 2fh0 h ILE 80 Cb 0.43 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 2fh0 h ILE 80 CO 0.01 0.29 -0.56 0.00 0.00 0.00 0.00 178.15 177.89 2fh0 h ALA 81 N 1.19 0.97 -2.93 1.87 0.00 -0.89 -3.39 119.26 116.08 2fh0 h ALA 81 Ca 0.27 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2fh0 h ALA 81 Cb 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2fh0 h ALA 81 CO -0.03 0.70 0.00 2.41 0.00 0.00 0.00 179.25 182.33 2fh0 n THR 82 N -3.89 0.00 -2.32 0.00 -1.04 0.16 -5.00 114.28 102.19 2fh0 n THR 82 Ca -0.02 0.01 -0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2fh0 n THR 82 Cb 0.58 -0.06 0.01 0.00 -1.82 0.00 0.00 70.33 69.04 2fh0 n THR 82 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 2fh0 n ASN 83 N -0.56 -0.10 -2.35 8.00 2.04 -0.03 -5.03 115.26 117.23 2fh0 n ASN 83 Ca 0.00 -0.91 -0.18 0.00 -0.44 0.00 0.00 54.58 53.05 2fh0 n ASN 83 Cb 0.00 0.04 0.02 0.00 -2.53 0.00 0.00 39.78 37.32 2fh0 n ASN 83 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 2fh0 n ASN 84 N -0.09 3.88 -4.47 0.53 5.03 0.23 -5.01 115.26 115.36 2fh0 n ASN 84 Ca -0.01 -3.29 -0.29 0.00 0.87 0.00 0.00 54.58 51.85 2fh0 n ASN 84 Cb 0.48 -0.41 0.19 0.00 -1.02 0.00 0.00 39.78 39.01 2fh0 n ASN 84 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2fh0 s VAL 85 N -4.51 1.91 -0.75 2.41 1.01 -1.25 -4.14 120.40 115.07 2fh0 s VAL 85 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.41 2fh0 s VAL 85 Cb 0.39 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 34.21 2fh0 s VAL 85 CO -0.03 0.00 0.00 0.35 0.00 0.00 0.00 175.10 175.42 2fh0 n THR 86 N -4.24 -0.30 -0.04 3.92 -2.24 -1.26 -4.97 114.28 105.17 2fh0 n THR 86 Ca 0.08 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.84 2fh0 n THR 86 Cb 0.58 -1.38 -0.01 0.00 -2.10 0.00 0.00 70.33 67.42 2fh0 n THR 86 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2fh0 h HIS 87 N 0.00 0.00 -3.44 4.78 2.76 -1.99 -3.51 115.15 113.75 2fh0 h HIS 87 Ca -0.19 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.98 2fh0 h HIS 87 Cb 0.99 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.95 2fh0 h HIS 87 CO 0.22 0.00 -0.61 1.63 -1.30 0.00 0.00 177.93 177.88 2fh0 n LYS 88 N -3.69 -3.36 -3.31 5.26 4.01 -1.26 -4.94 118.16 110.86 2fh0 n LYS 88 Ca -0.03 2.60 -0.42 0.00 -0.51 0.00 0.00 58.31 59.95 2fh0 n LYS 88 Cb 0.11 -2.94 -0.09 0.00 -0.51 0.00 0.00 35.03 31.60 2fh0 n LYS 88 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2fh0 s ILE 89 N -0.35 5.07 0.68 -0.18 1.01 -1.26 -5.01 121.20 121.16 2fh0 s ILE 89 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 60.65 60.47 2fh0 s ILE 89 Cb 0.00 -4.01 0.10 0.00 0.01 0.00 0.00 42.46 38.56 2fh0 s ILE 89 CO 0.00 -0.36 0.94 0.42 0.00 0.00 0.00 174.94 175.94 2fh0 s THR 90 N 2.20 2.26 0.26 2.92 -4.23 -1.26 -3.62 115.64 114.16 2fh0 s THR 90 Ca 0.14 -0.60 -0.02 0.00 -1.18 0.00 0.00 61.69 60.02 2fh0 s THR 90 Cb -0.17 -2.66 0.24 0.00 1.34 0.00 0.00 72.50 71.25 2fh0 s THR 90 CO 0.14 0.00 1.83 1.05 -0.54 0.00 0.00 174.62 177.09 2fh0 h GLU 91 N -0.39 0.87 -0.34 3.99 4.11 -1.91 0.34 114.58 121.25 2fh0 h GLU 91 Ca -0.38 -0.05 -0.16 0.00 0.07 0.00 0.00 59.36 58.84 2fh0 h GLU 91 Cb 1.28 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 2fh0 h GLU 91 CO 0.44 0.58 -0.42 0.00 0.07 0.00 0.00 179.01 179.67 2fh0 h ALA 92 N 1.48 0.60 -0.29 1.06 0.00 -2.00 -2.84 119.26 117.27 2fh0 h ALA 92 Ca 0.43 -0.47 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2fh0 h ALA 92 Cb 0.37 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2fh0 h ALA 92 CO -0.24 0.68 -0.26 1.49 0.00 0.00 0.00 179.25 180.91 2fh0 h GLU 93 N 0.70 0.69 -0.60 0.00 4.81 -1.67 -2.96 114.58 115.53 2fh0 h GLU 93 Ca 0.05 -0.35 -0.04 0.00 -0.13 0.00 0.00 59.36 58.89 2fh0 h GLU 93 Cb 1.00 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.36 2fh0 h GLU 93 CO 0.10 0.96 0.23 0.97 -0.73 0.00 0.00 179.01 180.54 2fh0 h ILE 94 N 0.43 1.22 -0.55 2.32 2.10 -0.39 -1.62 117.51 121.02 2fh0 h ILE 94 Ca 0.05 -0.70 -0.05 0.00 1.08 0.00 0.00 64.86 65.25 2fh0 h ILE 94 Cb 0.82 0.51 -0.02 0.00 -1.09 0.00 0.00 36.82 37.04 2fh0 h ILE 94 CO 0.07 0.28 0.17 0.58 -1.08 0.00 0.00 178.15 178.16 2fh0 h VAL 95 N 0.87 1.24 -0.49 2.19 2.07 -1.49 -0.97 116.25 119.67 2fh0 h VAL 95 Ca 0.20 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 2fh0 h VAL 95 Cb 0.19 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 2fh0 h VAL 95 CO -0.02 0.30 0.21 0.28 0.02 0.00 0.00 177.57 178.36 2fh0 h SER 96 N 0.76 0.66 -0.22 0.57 0.02 -1.30 -0.68 113.55 113.36 2fh0 h SER 96 Ca 0.18 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2fh0 h SER 96 Cb 0.29 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 2fh0 h SER 96 CO -0.00 0.63 0.10 0.40 -1.14 0.00 0.00 176.83 176.82 2fh0 h ILE 97 N 0.65 1.15 -0.88 3.27 2.04 -1.12 -1.24 117.51 121.38 2fh0 h ILE 97 Ca 0.16 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.61 2fh0 h ILE 97 Cb 0.17 1.03 -0.05 0.00 -0.74 0.00 0.00 36.82 37.23 2fh0 h ILE 97 CO -0.02 0.15 0.58 -0.07 0.00 0.00 0.00 178.15 178.78 2fh0 h LEU 98 N 0.22 0.98 -0.94 1.44 3.38 -1.04 0.17 115.31 119.51 2fh0 h LEU 98 Ca 0.07 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 2fh0 h LEU 98 Cb 0.14 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2fh0 h LEU 98 CO -0.01 0.70 0.13 0.78 0.09 0.00 0.00 178.44 180.13 2fh0 h ASN 99 N 1.15 0.85 -0.10 -0.43 2.35 -0.86 -2.05 115.58 116.48 2fh0 h ASN 99 Ca 0.33 -0.16 -0.19 0.00 -0.55 0.00 0.00 56.30 55.73 2fh0 h ASN 99 Cb -0.09 -0.22 0.01 0.00 0.05 0.00 0.00 38.32 38.07 2fh0 h ASN 99 CO -0.09 0.83 -0.66 1.23 -1.65 0.00 0.00 177.43 177.10 2fh0 h GLY 100 N 1.00 0.69 0.59 2.83 0.00 -0.60 -2.94 103.07 104.63 2fh0 h GLY 100 Ca 0.19 -1.02 0.10 0.00 0.00 0.00 0.00 47.33 46.60 2fh0 h GLY 100 CO 0.00 0.90 0.63 -2.22 0.00 0.00 0.00 176.54 175.86 2fh0 h ILE 101 N 0.27 0.98 -0.32 2.60 2.04 -0.52 -1.76 117.51 120.80 2fh0 h ILE 101 Ca -0.05 -0.36 -0.05 0.00 1.00 0.00 0.00 64.86 65.40 2fh0 h ILE 101 Cb 1.31 -0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2fh0 h ILE 101 CO 0.14 0.19 0.01 0.00 0.00 0.00 0.00 178.15 178.49 2fh0 h ALA 102 N 1.52 0.43 -0.62 1.87 0.00 -1.37 -2.91 119.26 118.18 2fh0 h ALA 102 Ca 0.47 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 55.19 2fh0 h ALA 102 Cb 0.38 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2fh0 h ALA 102 CO -0.22 0.17 0.41 0.87 0.00 0.00 0.00 179.25 180.47 2fh0 h LYS 103 N 0.36 0.67 -1.00 0.00 1.57 -1.17 -1.88 116.57 115.13 2fh0 h LYS 103 Ca 0.09 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.85 2fh0 h LYS 103 Cb 0.42 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.53 2fh0 h LYS 103 CO 0.01 0.44 0.66 1.96 -0.57 0.00 0.00 179.45 181.96 2fh0 h GLN 104 N 0.69 1.29 -2.85 3.15 4.20 -1.15 -3.16 115.11 117.28 2fh0 h GLN 104 Ca 0.25 -0.08 -0.79 0.00 0.06 0.00 0.00 58.65 58.09 2fh0 h GLN 104 Cb 0.14 -0.29 -0.24 0.00 0.30 0.00 0.00 27.48 27.38 2fh0 h GLN 104 CO -0.07 0.85 1.20 0.94 -0.67 0.00 0.00 178.83 181.08 2fh0 n GLN 105 N -4.40 4.55 -2.41 1.46 7.27 -0.71 -4.53 117.38 118.61 2fh0 n GLN 105 Ca 0.13 -4.31 0.00 0.00 0.07 0.00 0.00 57.00 52.89 2fh0 n GLN 105 Cb 0.04 -2.59 0.05 0.00 2.41 0.00 0.00 30.24 30.16 2fh0 n GLN 105 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 2fh0 n ASN 106 N 1.51 0.78 -4.00 1.69 2.85 -1.20 -4.98 115.26 111.91 2fh0 n ASN 106 Ca 0.36 -2.05 -0.28 0.00 -0.11 0.00 0.00 54.58 52.50 2fh0 n ASN 106 Cb 0.31 -0.20 -0.02 0.00 1.24 0.00 0.00 39.78 41.12 2fh0 n ASN 106 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 2fh0 n SER 107 N -0.49 -1.14 -4.78 1.20 3.41 -1.26 -4.93 113.62 105.62 2fh0 n SER 107 Ca 0.00 -1.00 -0.34 0.00 -0.26 0.00 0.00 58.87 57.28 2fh0 n SER 107 Cb 0.88 -3.04 0.01 0.00 -0.26 0.00 0.00 64.21 61.79 2fh0 n SER 107 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fh0 s GLN 108 N -6.63 3.33 -1.31 4.33 -2.07 -1.26 -4.95 119.66 111.09 2fh0 s GLN 108 Ca 0.18 1.42 -0.08 0.00 -1.82 0.00 0.00 55.36 55.07 2fh0 s GLN 108 Cb -0.10 -2.02 0.14 0.00 -1.09 0.00 0.00 33.01 29.94 2fh0 s GLN 108 CO 0.89 -0.84 2.08 -1.71 -1.32 0.00 0.00 175.29 174.40 2fh0 n ASN 109 N -1.62 6.08 -1.02 12.60 2.85 -1.26 -4.92 115.26 127.96 2fh0 n ASN 109 Ca 0.10 -3.09 0.05 0.00 -0.11 0.00 0.00 54.58 51.52 2fh0 n ASN 109 Cb 0.52 -1.45 -0.03 0.00 1.24 0.00 0.00 39.78 40.06 2fh0 n ASN 109 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2fh0 n ASN 110 N 3.26 -5.51 -4.05 1.20 3.02 -1.26 -4.79 115.26 107.13 2fh0 n ASN 110 Ca 0.48 1.15 -0.32 0.00 -0.03 0.00 0.00 54.58 55.87 2fh0 n ASN 110 Cb 0.32 -3.18 -0.15 0.00 -0.61 0.00 0.00 39.78 36.16 2fh0 n ASN 110 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2fh0 s SER 111 N -5.22 4.21 -1.64 6.41 0.01 -1.26 -4.68 113.70 111.53 2fh0 s SER 111 Ca 0.00 -1.28 0.00 0.00 1.31 0.00 0.00 55.95 55.98 2fh0 s SER 111 Cb 0.00 -1.48 0.00 0.00 0.21 0.00 0.00 66.02 64.75 2fh0 s SER 111 CO 0.00 -0.18 0.00 0.29 0.41 0.00 0.00 173.24 173.76 2fh0 n LYS 112 N 4.49 -1.33 -2.29 12.44 5.02 -1.26 -4.87 118.16 130.37 2fh0 n LYS 112 Ca -0.14 0.95 0.01 0.00 -2.02 0.00 0.00 58.31 57.11 2fh0 n LYS 112 Cb 0.43 -5.34 0.04 0.00 -0.02 0.00 0.00 35.03 30.15 2fh0 n LYS 112 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2fh0 n ILE 113 N -3.41 0.88 -1.18 -0.18 5.41 -1.26 -4.83 119.36 114.78 2fh0 n ILE 113 Ca -0.19 -2.29 0.03 0.00 1.00 0.00 0.00 62.75 61.30 2fh0 n ILE 113 Cb 0.62 1.08 0.23 0.00 -0.71 0.00 0.00 39.64 40.86 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 -0.23 2.38 -0.08 1.39 -0.00 -1.26 -4.60 119.36 116.96 2fh0 n ILE 114 Ca 0.08 -2.25 -0.23 0.00 -0.00 0.00 0.00 62.75 60.35 2fh0 n ILE 114 Cb 0.93 -0.28 -0.12 0.00 -0.00 0.00 0.00 39.64 40.16 2fh0 n ILE 114 CO 0.00 0.00 0.00 0.33 -0.00 0.00 0.00 176.55 176.88 2fh0 n PHE 115 N -0.84 0.87 -0.60 1.39 -0.00 -1.26 -5.21 117.46 111.82 2fh0 n PHE 115 Ca 0.26 0.30 0.00 0.00 -0.00 0.00 0.00 57.45 58.01 2fh0 n PHE 115 Cb 0.94 -1.10 0.00 0.00 -0.00 0.00 0.00 39.48 39.32 2fh0 n PHE 115 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15