#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sfu s THR 7 N 0.00 0.12 -0.37 0.00 -4.23 -1.26 -5.11 115.64 104.80 1sfu s THR 7 Ca 0.00 -0.97 -0.29 0.00 -1.18 0.00 0.00 61.69 59.25 1sfu s THR 7 Cb 0.00 -0.48 0.02 0.00 1.34 0.00 0.00 72.50 73.37 1sfu s THR 7 CO 0.00 -0.53 1.17 -0.69 -0.54 0.00 0.00 174.62 174.03 1sfu s VAL 8 N -1.81 4.29 0.82 2.29 1.01 -1.26 -5.01 120.40 120.74 1sfu s VAL 8 Ca -0.12 1.43 -0.09 0.00 0.00 0.00 0.00 61.98 63.19 1sfu s VAL 8 Cb -0.07 -4.39 0.14 0.00 0.00 0.00 0.00 36.38 32.06 1sfu s VAL 8 CO -0.02 -0.65 1.14 0.54 0.00 0.00 0.00 175.10 176.12 1sfu s ASN 9 N 2.32 3.96 0.18 3.32 2.20 -1.26 -4.80 114.94 120.85 1sfu s ASN 9 Ca 0.50 0.14 -0.23 0.00 -0.94 0.00 0.00 52.86 52.33 1sfu s ASN 9 Cb -0.12 -0.45 0.08 0.00 -2.00 0.00 0.00 41.25 38.76 1sfu s ASN 9 CO 0.23 -2.16 1.58 0.44 -2.94 0.00 0.00 177.10 174.25 1sfu h ASP 10 N -1.03 -1.30 -0.60 3.54 3.32 -1.99 0.23 116.42 118.59 1sfu h ASP 10 Ca -0.42 0.23 0.10 0.00 0.02 0.00 0.00 57.03 56.96 1sfu h ASP 10 Cb 1.27 0.62 -0.04 0.00 0.22 0.00 0.00 39.33 41.40 1sfu h ASP 10 CO 0.45 -0.32 0.40 0.00 -1.72 0.00 0.00 179.24 178.05 1sfu h ALA 11 N 0.82 2.04 0.06 3.45 0.00 -1.99 -0.29 119.26 123.35 1sfu h ALA 11 Ca 0.21 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.86 1sfu h ALA 11 Cb 0.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1sfu h ALA 11 CO -0.68 -0.18 -1.07 0.93 0.00 0.00 0.00 179.25 178.26 1sfu h GLU 12 N 0.39 0.34 -0.05 0.00 5.08 -1.36 -3.06 114.58 115.92 1sfu h GLU 12 Ca 0.28 -0.44 -0.14 0.00 -1.00 0.00 0.00 59.36 58.05 1sfu h GLU 12 Cb 0.57 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1sfu h GLU 12 CO -0.07 1.15 -0.62 0.82 -1.00 0.00 0.00 179.01 179.28 1sfu h ILE 13 N 0.16 1.41 -0.49 3.13 2.04 -0.52 -2.88 117.51 120.36 1sfu h ILE 13 Ca -0.10 -2.06 0.06 0.00 1.00 0.00 0.00 64.86 63.76 1sfu h ILE 13 Cb 1.74 2.07 -0.05 0.00 -0.74 0.00 0.00 36.82 39.84 1sfu h ILE 13 CO 0.18 0.60 0.18 0.15 0.00 0.00 0.00 178.15 179.26 1sfu h PHE 14 N 0.12 0.33 -0.68 1.37 3.57 -1.05 -0.42 116.94 120.17 1sfu h PHE 14 Ca -0.01 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1sfu h PHE 14 Cb 1.13 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1sfu h PHE 14 CO 0.02 0.12 0.27 0.77 -2.23 0.00 0.00 178.31 177.26 1sfu h SER 15 N 0.37 0.94 -0.38 0.41 0.02 -1.41 0.16 113.55 113.65 1sfu h SER 15 Ca 0.23 -0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1sfu h SER 15 Cb 0.23 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1sfu h SER 15 CO -0.23 0.85 0.13 -0.07 -1.14 0.00 0.00 176.83 176.37 1sfu h LEU 16 N 0.96 0.55 -0.40 5.07 3.38 -1.19 -1.41 115.31 122.27 1sfu h LEU 16 Ca 0.23 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 1sfu h LEU 16 Cb 0.20 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1sfu h LEU 16 CO -0.02 0.60 -0.19 0.58 0.09 0.00 0.00 178.44 179.50 1sfu h VAL 17 N 0.47 1.28 -0.92 1.22 2.07 -0.92 -2.73 116.25 116.73 1sfu h VAL 17 Ca 0.12 -1.33 0.05 0.00 0.82 0.00 0.00 66.70 66.36 1sfu h VAL 17 Cb 0.24 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 1sfu h VAL 17 CO -0.01 0.45 0.60 0.50 0.02 0.00 0.00 177.57 179.13 1sfu h LYS 18 N 0.66 1.07 -0.40 1.57 3.64 -0.47 -1.71 116.57 120.92 1sfu h LYS 18 Ca 0.09 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.31 1sfu h LYS 18 Cb 0.75 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 1sfu h LYS 18 CO 0.06 0.71 -0.14 -0.22 -2.27 0.00 0.00 179.45 177.59 1sfu h LYS 19 N 1.10 0.81 -0.48 1.90 3.11 -1.10 -1.41 116.57 120.50 1sfu h LYS 19 Ca 0.38 -0.33 -0.03 0.00 -2.81 0.00 0.00 60.65 57.86 1sfu h LYS 19 Cb 0.10 -0.04 -0.02 0.00 -1.00 0.00 0.00 32.23 31.28 1sfu h LYS 19 CO -0.13 0.95 0.18 0.93 -2.81 0.00 0.00 179.45 178.57 1sfu h GLU 20 N 0.62 0.72 -0.36 1.90 4.39 -1.15 -2.25 114.58 118.45 1sfu h GLU 20 Ca 0.10 -0.14 -0.11 0.00 0.34 0.00 0.00 59.36 59.55 1sfu h GLU 20 Cb 0.67 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.20 1sfu h GLU 20 CO 0.05 0.66 -0.23 0.28 -1.16 0.00 0.00 179.01 178.61 1sfu h VAL 21 N 0.63 1.27 0.00 3.13 2.07 -1.28 -2.16 116.25 119.92 1sfu h VAL 21 Ca 0.16 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1sfu h VAL 21 Cb 0.22 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1sfu h VAL 21 CO -0.01 0.44 0.00 0.18 0.02 0.00 0.00 177.57 178.20 1sfu n LEU 22 N -4.11 0.20 -0.81 2.57 4.77 -0.54 -2.35 117.00 116.73 1sfu n LEU 22 Ca 0.00 0.54 0.12 0.00 -0.03 0.00 0.00 56.01 56.64 1sfu n LEU 22 Cb 0.43 -0.51 0.30 0.00 -2.33 0.00 0.00 43.42 41.30 1sfu n LEU 22 CO 0.44 -0.29 0.74 -1.54 -1.33 0.00 0.00 177.39 175.41 1sfu n SER 23 N -1.71 2.45 -4.80 -1.43 3.41 -0.81 -4.93 113.62 105.80 1sfu n SER 23 Ca 0.04 -1.82 -0.34 0.00 -0.26 0.00 0.00 58.87 56.48 1sfu n SER 23 Cb 0.22 -0.11 -0.05 0.00 -0.26 0.00 0.00 64.21 64.01 1sfu n SER 23 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1sfu s LEU 24 N -1.69 3.96 0.68 1.04 1.43 -0.99 -5.03 118.68 118.07 1sfu s LEU 24 Ca 0.34 1.88 -0.11 0.00 -1.03 0.00 0.00 54.13 55.22 1sfu s LEU 24 Cb 0.20 -4.45 -0.00 0.00 0.03 0.00 0.00 46.19 41.97 1sfu s LEU 24 CO 0.30 -0.57 1.06 0.20 0.23 0.00 0.00 176.35 177.56 1sfu s ASN 25 N -1.93 5.60 0.02 2.29 0.01 -1.26 -4.95 114.94 114.72 1sfu s ASN 25 Ca 0.63 1.50 -0.04 0.00 -0.71 0.00 0.00 52.86 54.24 1sfu s ASN 25 Cb -0.16 -2.42 -0.01 0.00 0.41 0.00 0.00 41.25 39.08 1sfu s ASN 25 CO 0.20 -1.29 0.54 0.41 -1.51 0.00 0.00 177.10 175.45 1sfu n THR 26 N -3.02 -0.08 -0.84 1.60 -1.04 -1.26 -1.97 114.28 107.67 1sfu n THR 26 Ca 0.07 0.83 0.08 0.00 -2.04 0.00 0.00 64.05 62.99 1sfu n THR 26 Cb 0.54 -1.08 0.36 0.00 -1.82 0.00 0.00 70.33 68.34 1sfu n THR 26 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1sfu n ASN 27 N -3.02 5.11 -4.92 8.00 5.03 -1.26 -4.62 115.26 119.57 1sfu n ASN 27 Ca 0.00 -2.82 -0.30 0.00 0.87 0.00 0.00 54.58 52.33 1sfu n ASN 27 Cb 0.03 -0.62 -0.04 0.00 -1.02 0.00 0.00 39.78 38.13 1sfu n ASN 27 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.26 176.94 1sfu s ASP 28 N -1.04 6.36 0.54 6.41 1.47 -0.83 -5.08 116.67 124.49 1sfu s ASP 28 Ca 0.51 0.26 0.02 0.00 1.18 0.00 0.00 52.55 54.52 1sfu s ASP 28 Cb 0.38 -1.96 0.01 0.00 -0.34 0.00 0.00 42.92 41.01 1sfu s ASP 28 CO 0.17 0.16 0.13 -0.72 0.68 0.00 0.00 175.17 175.58 1sfu s TYR 29 N -1.54 1.69 0.29 2.11 -0.85 -1.26 -4.44 117.35 113.35 1sfu s TYR 29 Ca 0.35 -0.96 -0.03 0.00 -0.52 0.00 0.00 57.07 55.91 1sfu s TYR 29 Cb -0.13 -1.68 -0.01 0.00 0.38 0.00 0.00 41.96 40.52 1sfu s TYR 29 CO 0.28 -0.02 0.37 -0.08 -1.52 0.00 0.00 175.55 174.58 1sfu s THR 30 N -2.87 0.00 0.17 -3.49 -1.32 -0.61 -4.91 115.64 102.60 1sfu s THR 30 Ca 0.11 -1.71 0.05 0.00 -1.21 0.00 0.00 61.69 58.93 1sfu s THR 30 Cb -0.00 -2.50 -0.05 0.00 -1.51 0.00 0.00 72.50 68.44 1sfu s THR 30 CO 0.07 0.00 -0.09 0.42 -2.21 0.00 0.00 174.62 172.81 1sfu s THR 31 N -3.56 1.19 0.17 5.08 -4.23 -1.26 -0.39 115.64 112.64 1sfu s THR 31 Ca 0.32 -2.07 -0.14 0.00 -1.18 0.00 0.00 61.69 58.63 1sfu s THR 31 Cb 0.02 -1.96 0.07 0.00 1.34 0.00 0.00 72.50 71.96 1sfu s THR 31 CO 0.17 -0.65 1.77 0.00 -0.54 0.00 0.00 174.62 175.37 1sfu h ALA 32 N 2.70 0.58 -0.39 3.99 0.00 -1.97 -1.19 119.26 122.98 1sfu h ALA 32 Ca -0.37 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 1sfu h ALA 32 Cb 1.20 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1sfu h ALA 32 CO 0.64 -0.16 0.11 0.97 0.00 0.00 0.00 179.25 180.80 1sfu h ILE 33 N 0.42 1.17 -0.22 0.00 6.09 -1.95 0.14 117.51 123.16 1sfu h ILE 33 Ca 0.21 -0.60 -0.03 0.00 -1.37 0.00 0.00 64.86 63.06 1sfu h ILE 33 Cb 0.16 0.76 -0.01 0.00 0.47 0.00 0.00 36.82 38.20 1sfu h ILE 33 CO -0.17 0.22 0.00 -1.28 -3.07 0.00 0.00 178.15 173.85 1sfu h SER 34 N 0.56 0.38 -0.23 2.19 0.87 -1.75 -1.20 113.55 114.38 1sfu h SER 34 Ca 0.13 -0.31 -0.07 0.00 -1.23 0.00 0.00 61.79 60.32 1sfu h SER 34 Cb 0.20 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 1sfu h SER 34 CO -0.01 0.59 -0.08 -0.07 -0.53 0.00 0.00 176.83 176.74 1sfu h LEU 35 N 0.16 0.57 -0.67 2.23 3.38 -0.83 0.12 115.31 120.27 1sfu h LEU 35 Ca 0.06 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1sfu h LEU 35 Cb 0.40 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1sfu h LEU 35 CO 0.01 0.70 0.43 -1.28 0.09 0.00 0.00 178.44 178.38 1sfu h SER 36 N 0.55 0.79 -0.04 -0.43 0.87 -0.46 -0.09 113.55 114.74 1sfu h SER 36 Ca 0.10 -0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.59 1sfu h SER 36 Cb 0.47 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.24 1sfu h SER 36 CO 0.03 0.59 -0.09 0.78 -0.53 0.00 0.00 176.83 177.60 1sfu h ASN 37 N 0.91 0.15 0.08 6.23 2.35 -0.57 -3.19 115.58 121.53 1sfu h ASN 37 Ca 0.24 -0.60 -0.01 0.00 -0.55 0.00 0.00 56.30 55.38 1sfu h ASN 37 Cb -0.07 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 1sfu h ASN 37 CO -0.05 0.72 -0.05 -0.09 -1.65 0.00 0.00 177.43 176.31 1sfu h ARG 38 N -0.42 0.00 0.00 0.81 2.43 -0.70 -3.42 114.38 113.08 1sfu h ARG 38 Ca -0.00 0.00 -0.53 0.00 -0.81 0.00 0.00 59.98 58.64 1sfu h ARG 38 Cb 0.70 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.21 1sfu h ARG 38 CO 0.02 0.05 -0.24 1.28 -1.51 0.00 0.00 179.97 179.57 1sfu n LEU 39 N -4.20 0.00 -2.49 3.80 4.77 -0.05 -5.04 117.00 113.79 1sfu n LEU 39 Ca -0.03 -2.65 -0.30 0.00 -0.03 0.00 0.00 56.01 53.00 1sfu n LEU 39 Cb 0.14 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.18 1sfu n LEU 39 CO 0.32 -0.57 0.59 0.29 -1.33 0.00 0.00 177.39 176.68 1sfu n LYS 40 N -1.74 3.26 -5.01 3.23 4.76 -1.25 -4.75 118.16 116.66 1sfu n LYS 40 Ca -0.01 -4.14 -0.27 0.00 -2.87 0.00 0.00 58.31 51.02 1sfu n LYS 40 Cb 0.58 -2.26 -0.16 0.00 -1.84 0.00 0.00 35.03 31.35 1sfu n LYS 40 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1sfu s ILE 41 N -5.22 1.64 0.33 -0.18 1.01 -1.23 -5.11 121.20 112.43 1sfu s ILE 41 Ca 0.51 -0.88 -0.27 0.00 0.00 0.00 0.00 60.65 60.01 1sfu s ILE 41 Cb 0.42 -1.36 -0.13 0.00 0.01 0.00 0.00 42.46 41.40 1sfu s ILE 41 CO -0.19 0.46 1.05 0.59 0.00 0.00 0.00 174.94 176.85 1sfu n ASN 42 N 2.64 1.49 -0.33 3.58 3.02 -1.26 -4.50 115.26 119.90 1sfu n ASN 42 Ca -0.16 1.15 0.04 0.00 -0.03 0.00 0.00 54.58 55.58 1sfu n ASN 42 Cb 0.53 -1.33 0.19 0.00 -0.61 0.00 0.00 39.78 38.55 1sfu n ASN 42 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1sfu h LYS 43 N 1.96 0.93 -0.47 3.52 3.64 -1.92 -1.78 116.57 122.45 1sfu h LYS 43 Ca -0.42 -0.06 0.06 0.00 -1.27 0.00 0.00 60.65 58.97 1sfu h LYS 43 Cb 1.33 -0.21 -0.05 0.00 -0.41 0.00 0.00 32.23 32.89 1sfu h LYS 43 CO 0.60 0.61 0.16 -0.22 -2.27 0.00 0.00 179.45 178.33 1sfu h LYS 44 N 0.95 0.32 -0.19 1.90 3.64 -1.97 -0.30 116.57 120.92 1sfu h LYS 44 Ca 0.43 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.76 1sfu h LYS 44 Cb 0.33 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1sfu h LYS 44 CO -0.23 0.21 -0.04 0.87 -2.27 0.00 0.00 179.45 177.99 1sfu h LYS 45 N 0.33 0.29 0.08 1.90 1.57 -1.70 -0.34 116.57 118.70 1sfu h LYS 45 Ca 0.22 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1sfu h LYS 45 Cb 0.23 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1sfu h LYS 45 CO -0.23 0.35 -0.04 0.82 -0.57 0.00 0.00 179.45 179.79 1sfu h ILE 46 N 0.28 1.12 -0.68 1.86 1.08 -0.53 -2.99 117.51 117.65 1sfu h ILE 46 Ca 0.06 -0.71 0.01 0.00 -0.39 0.00 0.00 64.86 63.83 1sfu h ILE 46 Cb 0.26 1.58 -0.03 0.00 -3.07 0.00 0.00 36.82 35.56 1sfu h ILE 46 CO 0.01 0.17 0.45 0.78 -0.69 0.00 0.00 178.15 178.87 1sfu h ASN 47 N -0.42 0.78 -1.01 1.72 2.35 -0.72 -0.61 115.58 117.68 1sfu h ASN 47 Ca -0.01 -0.02 0.10 0.00 -0.55 0.00 0.00 56.30 55.81 1sfu h ASN 47 Cb 0.36 -0.20 -0.08 0.00 0.05 0.00 0.00 38.32 38.46 1sfu h ASN 47 CO 0.02 0.57 0.64 1.56 -1.65 0.00 0.00 177.43 178.57 1sfu h GLN 48 N 0.92 1.05 0.06 0.81 4.20 -1.01 -1.77 115.11 119.36 1sfu h GLN 48 Ca 0.25 -0.06 -0.25 0.00 0.06 0.00 0.00 58.65 58.65 1sfu h GLN 48 Cb -0.10 -0.24 0.02 0.00 0.30 0.00 0.00 27.48 27.47 1sfu h GLN 48 CO -0.05 0.69 -1.01 1.96 -0.67 0.00 0.00 178.83 179.75 1sfu h GLN 49 N 1.08 0.58 -0.31 1.46 1.08 -1.15 -3.23 115.11 114.63 1sfu h GLN 49 Ca 0.47 -0.71 0.05 0.00 -1.45 0.00 0.00 58.65 57.01 1sfu h GLN 49 Cb 0.35 0.22 -0.04 0.00 -0.05 0.00 0.00 27.48 27.95 1sfu h GLN 49 CO -0.22 1.30 0.05 -0.07 -0.95 0.00 0.00 178.83 178.93 1sfu h LEU 50 N 0.19 -0.01 -1.47 1.46 -0.00 -0.62 0.12 115.31 114.98 1sfu h LEU 50 Ca -0.14 0.05 -0.06 0.00 -0.00 0.00 0.00 57.88 57.73 1sfu h LEU 50 Cb 1.70 0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 42.43 1sfu h LEU 50 CO 0.20 0.03 -0.27 1.88 -0.00 0.00 0.00 178.44 180.28 1sfu h TYR 51 N 0.16 0.00 -0.14 1.13 -1.99 -1.46 -0.56 116.97 114.11 1sfu h TYR 51 Ca 0.15 0.00 -0.22 0.00 2.00 0.00 0.00 58.73 60.65 1sfu h TYR 51 Cb 0.17 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.91 1sfu h TYR 51 CO -0.18 0.27 -0.79 0.87 -0.00 0.00 0.00 178.16 178.32 1sfu h LYS 52 N 0.00 0.76 -0.23 4.88 1.57 -1.39 -2.39 116.57 119.77 1sfu h LYS 52 Ca -0.00 -0.63 -0.02 0.00 -1.87 0.00 0.00 60.65 58.13 1sfu h LYS 52 Cb 0.49 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1sfu h LYS 52 CO 0.04 1.24 0.05 -0.07 -0.57 0.00 0.00 179.45 180.13 1sfu h LEU 53 N 0.51 0.29 -0.35 2.94 -0.00 -0.22 -1.80 115.31 116.69 1sfu h LEU 53 Ca -0.06 -0.03 -0.18 0.00 -0.00 0.00 0.00 57.88 57.61 1sfu h LEU 53 Cb 1.42 -0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 42.00 1sfu h LEU 53 CO 0.16 0.31 -0.59 -0.61 -0.00 0.00 0.00 178.44 177.71 1sfu h GLN 54 N 0.32 0.74 0.00 1.13 4.15 -0.96 -0.59 115.11 119.90 1sfu h GLN 54 Ca 0.08 -0.49 -0.03 0.00 0.77 0.00 0.00 58.65 58.97 1sfu h GLN 54 Cb 0.14 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.89 1sfu h GLN 54 CO -0.00 1.12 -0.17 0.87 -1.93 0.00 0.00 178.83 178.72 1sfu h LYS 55 N 0.56 0.00 -0.29 1.69 1.57 -0.83 -1.82 116.57 117.45 1sfu h LYS 55 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1sfu h LYS 55 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1sfu h LYS 55 CO 0.12 0.17 0.00 0.39 -0.57 0.00 0.00 179.45 179.56 1sfu n GLU 56 N -4.24 1.88 -2.64 3.15 1.02 -0.77 -4.94 120.64 114.10 1sfu n GLU 56 Ca -0.02 -1.34 -0.20 0.00 -0.02 0.00 0.00 57.16 55.58 1sfu n GLU 56 Cb 0.24 -1.36 0.01 0.00 -0.02 0.00 0.00 31.44 30.30 1sfu n GLU 56 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1sfu n ASP 57 N 0.57 -5.70 -0.07 1.62 8.00 -0.68 -4.89 116.55 115.40 1sfu n ASP 57 Ca 0.15 -0.13 -0.13 0.00 0.71 0.00 0.00 54.79 55.39 1sfu n ASP 57 Cb 0.35 -4.64 -0.14 0.00 -0.02 0.00 0.00 41.12 36.67 1sfu n ASP 57 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1sfu n THR 58 N -4.21 1.53 -4.32 -3.53 -1.04 -0.26 -4.66 114.28 97.79 1sfu n THR 58 Ca -0.17 -0.76 -0.17 0.00 -2.04 0.00 0.00 64.05 60.91 1sfu n THR 58 Cb 0.65 -1.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.06 1sfu n THR 58 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1sfu s VAL 59 N -2.54 1.11 -0.03 12.58 -7.23 -1.18 -0.72 120.40 122.40 1sfu s VAL 59 Ca -0.15 -2.05 0.01 0.00 -1.81 0.00 0.00 61.98 57.99 1sfu s VAL 59 Cb 0.07 -2.26 0.01 0.00 0.56 0.00 0.00 36.38 34.76 1sfu s VAL 59 CO 0.78 -0.40 -0.05 -0.75 -0.31 0.00 0.00 175.10 174.37 1sfu s LYS 60 N -3.83 0.65 -0.11 4.82 2.47 0.76 -4.33 119.74 120.18 1sfu s LYS 60 Ca 0.26 -0.12 -0.03 0.00 -1.56 0.00 0.00 55.97 54.52 1sfu s LYS 60 Cb 0.05 -0.67 -0.03 0.00 -1.46 0.00 0.00 37.83 35.72 1sfu s LYS 60 CO 0.07 -0.01 0.02 1.41 0.16 0.00 0.00 175.35 177.00 1sfu s MET 61 N 0.55 3.20 -0.23 4.03 -2.45 -1.26 -0.67 119.30 122.48 1sfu s MET 61 Ca -0.07 -0.38 -0.00 0.00 -1.25 0.00 0.00 55.69 53.99 1sfu s MET 61 Cb -0.10 -2.89 0.03 0.00 1.25 0.00 0.00 34.83 33.11 1sfu s MET 61 CO -0.00 0.62 -0.11 0.08 1.05 0.00 0.00 175.02 176.66 1sfu s VAL 62 N -0.65 2.55 0.43 10.11 1.01 -0.32 -4.99 120.40 128.54 1sfu s VAL 62 Ca 0.11 -1.06 -0.25 0.00 0.00 0.00 0.00 61.98 60.77 1sfu s VAL 62 Cb -0.12 -2.26 -0.09 0.00 0.00 0.00 0.00 36.38 33.91 1sfu s VAL 62 CO 0.02 0.28 1.27 -0.81 0.00 0.00 0.00 175.10 175.86 1sfu n PRO 63 N 4.62 1.90 0.00 2.72 -0.04 -1.26 -1.91 135.00 141.03 1sfu n PRO 63 Ca -0.18 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 1sfu n PRO 63 Cb 0.47 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 1sfu n PRO 63 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1sfu n SER 64 N 0.10 0.00 -4.06 3.54 3.41 -1.26 -4.82 113.62 110.52 1sfu n SER 64 Ca 0.07 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.35 1sfu n SER 64 Cb 0.40 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.21 1sfu n SER 64 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1sfu s ASN 65 N 0.00 4.85 0.62 4.04 0.01 -1.26 -0.40 114.94 122.80 1sfu s ASN 65 Ca 0.00 -1.95 -0.08 0.00 -0.71 0.00 0.00 52.86 50.12 1sfu s ASN 65 Cb 0.00 -1.67 0.00 0.00 0.41 0.00 0.00 41.25 39.99 1sfu s ASN 65 CO 0.00 -0.38 0.97 -2.16 -1.51 0.00 0.00 177.10 174.02 1sfu s PRO 66 N 1.01 3.04 0.37 -0.60 0.04 -1.26 -5.11 135.00 132.50 1sfu s PRO 66 Ca 0.06 0.27 -0.27 0.00 0.04 0.00 0.00 61.00 61.10 1sfu s PRO 66 Cb -0.20 -2.17 -0.11 0.00 0.04 0.00 0.00 34.50 32.05 1sfu s PRO 66 CO -0.06 -0.75 1.32 -2.30 0.04 0.00 0.00 177.00 175.25 1sfu n PRO 67 N -2.72 2.18 -3.68 0.56 -0.02 0.47 -4.99 135.00 126.81 1sfu n PRO 67 Ca 0.05 0.77 -0.37 0.00 -2.02 0.00 0.00 63.50 61.93 1sfu n PRO 67 Cb 0.57 -2.41 -0.06 0.00 -0.02 0.00 0.00 33.50 31.58 1sfu n PRO 67 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1sfu s LYS 68 N -2.01 3.73 -0.22 -0.52 1.02 -0.80 -4.51 119.74 116.42 1sfu s LYS 68 Ca 0.56 0.12 0.02 0.00 0.02 0.00 0.00 55.97 56.70 1sfu s LYS 68 Cb -0.53 -3.23 0.04 0.00 -0.52 0.00 0.00 37.83 33.59 1sfu s LYS 68 CO 0.61 0.69 -0.15 -1.58 -0.92 0.00 0.00 175.35 174.00 1sfu s TRP 69 N -0.90 3.02 0.18 3.18 0.52 0.48 -1.17 118.94 124.25 1sfu s TRP 69 Ca 0.19 -1.96 0.06 0.00 0.02 0.00 0.00 56.10 54.40 1sfu s TRP 69 Cb -0.14 -1.93 -0.04 0.00 -1.15 0.00 0.00 33.47 30.21 1sfu s TRP 69 CO 0.08 -0.84 0.11 -0.06 0.02 0.00 0.00 176.95 176.26 1sfu s PHE 70 N 1.20 3.08 0.26 -1.98 0.40 0.16 -1.58 117.98 119.53 1sfu s PHE 70 Ca -0.02 -0.05 -0.29 0.00 -0.60 0.00 0.00 56.93 55.97 1sfu s PHE 70 Cb -0.16 -1.47 -0.09 0.00 0.51 0.00 0.00 43.02 41.80 1sfu s PHE 70 CO -0.09 0.52 1.15 0.21 0.70 0.00 0.00 175.22 177.72 1sfu s LYS 71 N -3.15 4.56 0.27 0.44 2.20 -1.26 -0.17 119.74 122.63 1sfu s LYS 71 Ca 0.30 1.89 -0.30 0.00 -0.36 0.00 0.00 55.97 57.50 1sfu s LYS 71 Cb -0.10 -3.18 -0.10 0.00 -1.51 0.00 0.00 37.83 32.94 1sfu s LYS 71 CO 0.23 0.08 1.40 1.21 -0.36 0.00 0.00 175.35 177.90 1sfu s ASN 72 N -0.57 6.70 0.62 1.43 3.84 0.10 -4.68 114.94 122.38 1sfu s ASN 72 Ca 0.47 2.65 0.27 0.00 0.21 0.00 0.00 52.86 56.46 1sfu s ASN 72 Cb -0.33 -2.63 1.35 0.00 -0.55 0.00 0.00 41.25 39.08 1sfu s ASN 72 CO 0.42 -0.65 1.77 1.88 -2.79 0.00 0.00 177.10 177.72 1sfu h TYR 73 N 4.65 0.00 -0.88 0.43 0.99 -1.90 0.11 116.97 120.37 1sfu h TYR 73 Ca -0.47 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.28 1sfu h TYR 73 Cb 1.22 0.00 -0.04 0.00 1.00 0.00 0.00 36.73 38.90 1sfu h TYR 73 CO 0.59 0.00 0.58 -0.91 -0.00 0.00 0.00 178.16 178.43 1sfu h ASN 74 N 0.00 1.01 0.00 3.88 2.35 -1.89 -3.54 115.58 117.39 1sfu h ASN 74 Ca 0.16 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1sfu h ASN 74 Cb 1.28 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 39.40 1sfu h ASN 74 CO -0.00 0.73 0.00 0.00 -1.65 0.00 0.00 177.43 176.50