#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fyu s ARG 2 N 0.00 3.60 0.02 1.61 0.52 -1.26 -5.11 118.95 118.33 2fyu s ARG 2 Ca 0.00 -0.02 0.03 0.00 -0.52 0.00 0.00 55.73 55.22 2fyu s ARG 2 Cb 0.00 -3.12 -0.02 0.00 0.52 0.00 0.00 34.95 32.34 2fyu s ARG 2 CO 0.00 0.68 -0.09 -0.65 0.02 0.00 0.00 175.30 175.26 2fyu s GLN 3 N -1.53 0.62 0.31 3.54 -0.21 -1.26 -5.12 119.66 116.01 2fyu s GLN 3 Ca 0.25 -0.56 -0.29 0.00 0.02 0.00 0.00 55.36 54.78 2fyu s GLN 3 Cb -0.13 -0.53 -0.12 0.00 1.00 0.00 0.00 33.01 33.22 2fyu s GLN 3 CO 0.13 0.13 1.44 1.19 -2.12 0.00 0.00 175.29 176.06 2fyu n PHE 4 N 2.12 2.54 0.00 0.91 3.01 -1.26 -1.92 117.46 122.87 2fyu n PHE 4 Ca -0.18 0.42 0.00 0.00 1.01 0.00 0.00 57.45 58.70 2fyu n PHE 4 Cb 0.56 -2.50 0.00 0.00 -0.01 0.00 0.00 39.48 37.53 2fyu n PHE 4 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2fyu n GLY 5 N 1.42 3.39 0.00 1.37 0.00 -1.26 -4.88 105.19 105.24 2fyu n GLY 5 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2fyu n GLY 5 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2fyu n HIS 6 N -1.77 0.00 0.01 1.61 8.25 -0.81 -4.91 115.22 117.60 2fyu n HIS 6 Ca 0.00 -0.43 -0.01 0.00 -0.26 0.00 0.00 57.72 57.02 2fyu n HIS 6 Cb 0.00 -0.04 -0.00 0.00 1.12 0.00 0.00 29.99 31.06 2fyu n HIS 6 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2fyu h LEU 7 N 0.00 -0.05 -8.01 2.41 3.38 -1.90 -3.47 115.31 107.67 2fyu h LEU 7 Ca 0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2fyu h LEU 7 Cb 0.59 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 2fyu h LEU 7 CO 0.00 0.14 0.22 0.28 0.09 0.00 0.00 178.44 179.17 2fyu s THR 8 N -1.56 0.00 -0.20 0.22 -1.32 -1.26 -5.13 115.64 106.40 2fyu s THR 8 Ca -0.01 -1.02 -0.17 0.00 -1.21 0.00 0.00 61.69 59.29 2fyu s THR 8 Cb 0.00 -2.10 -0.04 0.00 -1.51 0.00 0.00 72.50 68.85 2fyu s THR 8 CO 0.03 0.00 0.43 -0.60 -2.21 0.00 0.00 174.62 172.27 2fyu s ARG 9 N -3.76 4.19 -0.06 7.08 3.52 -1.26 -5.04 118.95 123.61 2fyu s ARG 9 Ca 0.12 0.27 0.02 0.00 -0.13 0.00 0.00 55.73 56.00 2fyu s ARG 9 Cb -0.06 -3.54 0.02 0.00 -1.56 0.00 0.00 34.95 29.81 2fyu s ARG 9 CO 0.08 -0.06 -0.10 0.08 -0.81 0.00 0.00 175.30 174.49 2fyu s VAL 10 N 1.36 0.96 -0.01 7.11 1.01 -1.26 -5.15 120.40 124.42 2fyu s VAL 10 Ca 0.21 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.86 2fyu s VAL 10 Cb -0.15 -0.90 -0.01 0.00 0.00 0.00 0.00 36.38 35.31 2fyu s VAL 10 CO 0.08 0.32 -0.17 -0.13 0.00 0.00 0.00 175.10 175.20 2fyu s ARG 11 N 0.73 1.36 -0.42 2.72 0.52 -1.26 -4.91 118.95 117.68 2fyu s ARG 11 Ca -0.14 -0.64 0.00 0.00 -0.52 0.00 0.00 55.73 54.43 2fyu s ARG 11 Cb -0.15 -1.33 0.00 0.00 0.52 0.00 0.00 34.95 33.99 2fyu s ARG 11 CO 0.03 0.36 0.00 0.72 0.02 0.00 0.00 175.30 176.43 2fyu n HIS 12 N 2.56 -0.06 -3.80 -0.53 8.25 -1.26 -5.04 115.22 115.34 2fyu n HIS 12 Ca -0.15 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 56.95 2fyu n HIS 12 Cb 0.54 -1.26 -0.13 0.00 1.12 0.00 0.00 29.99 30.27 2fyu n HIS 12 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2fyu s VAL 13 N -2.17 3.90 -0.21 1.59 1.01 -1.26 -5.08 120.40 118.17 2fyu s VAL 13 Ca 0.00 -0.49 -0.15 0.00 0.00 0.00 0.00 61.98 61.34 2fyu s VAL 13 Cb 0.00 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 2fyu s VAL 13 CO 0.00 0.25 0.34 -0.63 0.00 0.00 0.00 175.10 175.06 2fyu s ILE 14 N 1.53 5.24 -0.17 2.22 1.09 -1.26 -5.09 121.20 124.75 2fyu s ILE 14 Ca 0.04 0.59 -0.05 0.00 -1.10 0.00 0.00 60.65 60.13 2fyu s ILE 14 Cb -0.16 -3.68 -0.03 0.00 -1.06 0.00 0.00 42.46 37.53 2fyu s ILE 14 CO 0.01 0.28 0.00 -0.89 -0.10 0.00 0.00 174.94 174.24 2fyu s THR 15 N 1.22 4.24 -0.14 2.92 2.01 -1.26 -5.12 115.64 119.50 2fyu s THR 15 Ca 0.17 -0.23 -0.03 0.00 0.31 0.00 0.00 61.69 61.90 2fyu s THR 15 Cb -0.14 -2.88 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 2fyu s THR 15 CO 0.07 0.48 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.13 2fyu s TYR 16 N 0.41 3.02 0.03 4.92 1.51 -1.26 -5.12 117.35 120.87 2fyu s TYR 16 Ca -0.01 -0.22 0.02 0.00 -1.01 0.00 0.00 57.07 55.84 2fyu s TYR 16 Cb -0.14 -1.92 -0.02 0.00 -0.11 0.00 0.00 41.96 39.78 2fyu s TYR 16 CO 0.02 0.05 -0.06 -1.12 -1.11 0.00 0.00 175.55 173.32 2fyu s SER 17 N 0.13 0.68 0.03 2.29 0.01 -1.26 -5.16 113.70 110.42 2fyu s SER 17 Ca -0.01 -0.42 0.04 0.00 1.31 0.00 0.00 55.95 56.87 2fyu s SER 17 Cb -0.14 0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.08 2fyu s SER 17 CO 0.03 -0.15 -0.04 -0.22 0.41 0.00 0.00 173.24 173.26 2fyu s LEU 18 N -1.18 3.28 0.31 2.44 2.96 -1.26 -5.12 118.68 120.11 2fyu s LEU 18 Ca -0.08 -0.16 -0.27 0.00 -0.22 0.00 0.00 54.13 53.41 2fyu s LEU 18 Cb -0.08 -1.94 -0.14 0.00 0.50 0.00 0.00 46.19 44.54 2fyu s LEU 18 CO 0.00 0.25 0.89 -0.24 -1.32 0.00 0.00 176.35 175.93 2fyu n SER 19 N 1.21 0.71 0.23 3.68 2.88 -1.26 -4.95 113.62 116.12 2fyu n SER 19 Ca -0.14 1.12 0.07 0.00 -1.33 0.00 0.00 58.87 58.60 2fyu n SER 19 Cb 0.52 -1.23 0.55 0.00 -0.75 0.00 0.00 64.21 63.30 2fyu n SER 19 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2fyu h PRO 20 N 1.66 0.00 0.00 -1.46 0.13 -2.00 -2.37 132.00 127.96 2fyu h PRO 20 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2fyu h PRO 20 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2fyu h PRO 20 CO 0.58 0.20 0.00 1.19 -0.23 0.00 0.00 178.00 179.74 2fyu n PHE 21 N -4.05 0.69 1.12 1.56 3.01 -1.26 -3.20 117.46 115.33 2fyu n PHE 21 Ca -0.02 0.26 0.12 0.00 1.01 0.00 0.00 57.45 58.82 2fyu n PHE 21 Cb 0.27 -0.91 0.24 0.00 -0.01 0.00 0.00 39.48 39.07 2fyu n PHE 21 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2fyu n GLU 22 N -2.11 0.55 -4.06 -1.08 -0.58 -0.89 -5.02 120.64 107.45 2fyu n GLU 22 Ca 0.03 -0.36 -0.10 0.00 -0.42 0.00 0.00 57.16 56.31 2fyu n GLU 22 Cb 0.26 -1.49 -0.08 0.00 -0.57 0.00 0.00 31.44 29.55 2fyu n GLU 22 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 2fyu s GLN 23 N -2.70 1.10 0.11 3.49 -2.07 -1.19 -5.04 119.66 113.36 2fyu s GLN 23 Ca 0.18 -1.32 -0.27 0.00 -1.82 0.00 0.00 55.36 52.13 2fyu s GLN 23 Cb 0.18 0.32 -0.06 0.00 -1.09 0.00 0.00 33.01 32.36 2fyu s GLN 23 CO 0.61 -0.37 0.84 1.03 -1.32 0.00 0.00 175.29 176.08 2fyu s ARG 24 N -4.02 4.60 0.18 9.60 0.52 -1.26 -4.94 118.95 123.63 2fyu s ARG 24 Ca 0.22 1.23 -0.02 0.00 -0.52 0.00 0.00 55.73 56.64 2fyu s ARG 24 Cb 0.05 -3.33 0.06 0.00 0.52 0.00 0.00 34.95 32.25 2fyu s ARG 24 CO 0.02 0.36 1.45 0.00 0.02 0.00 0.00 175.30 177.15 2fyu h ALA 25 N 5.17 0.61 -2.21 2.13 0.00 -2.02 -3.38 119.26 119.56 2fyu h ALA 25 Ca -0.44 -0.58 -0.59 0.00 0.00 0.00 0.00 54.91 53.29 2fyu h ALA 25 Cb 1.21 -0.06 -0.42 0.00 0.00 0.00 0.00 17.79 18.52 2fyu h ALA 25 CO 0.70 0.74 -0.64 1.19 0.00 0.00 0.00 179.25 181.23 2fyu n PHE 26 N -3.87 3.56 -2.44 0.00 3.01 -1.26 -5.09 117.46 111.37 2fyu n PHE 26 Ca -0.04 -4.08 -0.43 0.00 1.01 0.00 0.00 57.45 53.91 2fyu n PHE 26 Cb 0.68 -0.53 -0.02 0.00 -0.01 0.00 0.00 39.48 39.60 2fyu n PHE 26 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2fyu s PRO 27 N -2.74 4.16 -1.31 -1.08 0.04 -1.26 -3.54 135.00 129.27 2fyu s PRO 27 Ca 0.43 1.55 -0.03 0.00 0.04 0.00 0.00 61.00 62.98 2fyu s PRO 27 Cb 0.20 -3.78 -0.00 0.00 0.04 0.00 0.00 34.50 30.95 2fyu s PRO 27 CO -0.06 -0.79 0.61 0.72 0.04 0.00 0.00 177.00 177.52 2fyu n HIS 28 N 6.82 -1.82 -0.18 0.56 8.25 -1.26 -4.89 115.22 122.70 2fyu n HIS 28 Ca 0.14 0.74 -0.08 0.00 -0.26 0.00 0.00 57.72 58.26 2fyu n HIS 28 Cb 0.45 -3.98 0.02 0.00 1.12 0.00 0.00 29.99 27.59 2fyu n HIS 28 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2fyu h TYR 29 N -1.84 0.77 0.07 4.41 5.03 -1.98 -1.32 116.97 122.11 2fyu h TYR 29 Ca -0.63 -0.05 -0.28 0.00 2.58 0.00 0.00 58.73 60.35 2fyu h TYR 29 Cb 1.36 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 39.39 2fyu h TYR 29 CO 0.45 0.63 -1.54 0.74 -1.32 0.00 0.00 178.16 177.12 2fyu h PHE 30 N 0.70 0.25 -0.34 -3.82 0.04 -1.92 -3.02 116.94 108.83 2fyu h PHE 30 Ca 0.18 -0.19 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 2fyu h PHE 30 Cb 0.17 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 2fyu h PHE 30 CO 0.00 1.60 0.07 0.66 -0.60 0.00 0.00 178.31 180.04 2fyu h SER 31 N -0.49 0.45 0.00 2.17 4.64 -1.96 -2.12 113.55 116.24 2fyu h SER 31 Ca -0.36 -0.06 -0.19 0.00 -0.47 0.00 0.00 61.79 60.70 2fyu h SER 31 Cb 1.65 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 63.58 2fyu h SER 31 CO -0.05 0.47 -2.17 1.17 -0.87 0.00 0.00 176.83 175.37 2fyu n LYS 32 N -4.34 0.72 0.23 4.77 4.81 -0.50 -4.62 118.16 119.23 2fyu n LYS 32 Ca 0.02 -0.09 -0.10 0.00 -0.87 0.00 0.00 58.31 57.27 2fyu n LYS 32 Cb 0.19 -1.50 -0.05 0.00 0.02 0.00 0.00 35.03 33.69 2fyu n LYS 32 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 2fyu h GLY 33 N 3.88 -0.65 1.02 3.14 0.00 -1.35 -3.07 103.07 106.04 2fyu h GLY 33 Ca -0.29 0.24 0.07 0.00 0.00 0.00 0.00 47.33 47.35 2fyu h GLY 33 CO 0.02 -0.24 0.48 0.16 0.00 0.00 0.00 176.54 176.96 2fyu h ILE 34 N -0.94 1.02 -0.89 2.60 3.07 -1.57 -1.50 117.51 119.29 2fyu h ILE 34 Ca -0.06 -0.26 0.14 0.00 1.55 0.00 0.00 64.86 66.22 2fyu h ILE 34 Cb 0.48 0.19 -0.07 0.00 -0.27 0.00 0.00 36.82 37.15 2fyu h ILE 34 CO 0.10 0.14 0.57 -0.65 -1.05 0.00 0.00 178.15 177.27 2fyu h PRO 35 N 0.76 0.70 -0.00 0.16 0.11 -1.78 -1.93 132.00 130.02 2fyu h PRO 35 Ca 0.32 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.39 2fyu h PRO 35 Cb 0.27 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.22 2fyu h PRO 35 CO -0.11 0.46 -0.00 -0.91 -0.21 0.00 0.00 178.00 177.23 2fyu h ASN 36 N 0.72 0.00 -0.74 -2.05 2.35 -1.19 -1.28 115.58 113.39 2fyu h ASN 36 Ca 0.44 -0.51 0.06 0.00 -0.55 0.00 0.00 56.30 55.75 2fyu h ASN 36 Cb 0.68 -0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.00 2fyu h ASN 36 CO -0.20 0.51 0.48 1.62 -1.65 0.00 0.00 177.43 178.19 2fyu h VAL 37 N -0.50 1.03 -0.29 2.81 3.04 -1.42 0.97 116.25 121.88 2fyu h VAL 37 Ca 0.00 -0.27 -0.02 0.00 -1.01 0.00 0.00 66.70 65.40 2fyu h VAL 37 Cb 0.51 0.18 -0.01 0.00 -2.01 0.00 0.00 31.29 29.95 2fyu h VAL 37 CO 0.00 0.14 0.11 -0.07 -1.01 0.00 0.00 177.57 176.75 2fyu h LEU 38 N 0.78 0.40 -1.06 3.16 -0.00 -1.24 0.69 115.31 118.05 2fyu h LEU 38 Ca 0.32 -0.17 -0.02 0.00 -0.00 0.00 0.00 57.88 58.01 2fyu h LEU 38 Cb 0.24 -0.10 -0.04 0.00 -0.00 0.00 0.00 40.66 40.76 2fyu h LEU 38 CO -0.11 0.46 0.40 -0.09 -0.00 0.00 0.00 178.44 179.11 2fyu h ARG 39 N 0.32 1.06 -0.40 1.13 2.43 -0.56 -1.83 114.38 116.53 2fyu h ARG 39 Ca 0.10 -0.13 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 2fyu h ARG 39 Cb 0.19 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 2fyu h ARG 39 CO -0.01 0.79 -0.20 0.00 -1.51 0.00 0.00 179.97 179.04 2fyu h ARG 40 N 1.06 0.84 0.20 0.20 3.08 -0.46 -2.44 114.38 116.86 2fyu h ARG 40 Ca 0.27 -0.37 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 2fyu h ARG 40 Cb 0.05 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 2fyu h ARG 40 CO -0.04 1.01 -0.12 1.15 -1.07 0.00 0.00 179.97 180.90 2fyu h THR 41 N 0.65 0.74 -0.82 2.04 2.02 -0.44 -2.83 112.91 114.28 2fyu h THR 41 Ca 0.09 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.40 2fyu h THR 41 Cb 0.76 0.74 -0.09 0.00 -1.74 0.00 0.00 68.15 67.82 2fyu h THR 41 CO 0.06 0.00 0.41 -0.09 0.37 0.00 0.00 175.52 176.27 2fyu h ARG 42 N -0.31 0.58 0.00 6.66 2.43 -1.40 0.11 114.38 122.45 2fyu h ARG 42 Ca -0.02 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 2fyu h ARG 42 Cb 0.26 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 2fyu h ARG 42 CO 0.02 0.38 -0.18 0.00 -1.51 0.00 0.00 179.97 178.68 2fyu h ALA 43 N 1.54 1.23 0.00 2.80 0.00 -1.20 -3.29 119.26 120.34 2fyu h ALA 43 Ca 0.44 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2fyu h ALA 43 Cb 0.60 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2fyu h ALA 43 CO -0.35 0.22 -1.09 0.00 0.00 0.00 0.00 179.25 178.03 2fyu h ILE 45 N 0.00 0.44 0.00 0.00 -0.00 -0.88 -1.42 117.51 115.64 2fyu h ILE 45 Ca -0.01 -0.08 -0.01 0.00 -0.00 0.00 0.00 64.86 64.76 2fyu h ILE 45 Cb 0.20 0.17 -0.00 0.00 -0.00 0.00 0.00 36.82 37.19 2fyu h ILE 45 CO 0.00 0.04 -0.07 -0.07 -0.00 0.00 0.00 178.15 178.06 2fyu h LEU 46 N 0.25 0.00 0.11 0.16 3.38 -1.86 0.73 115.31 118.08 2fyu h LEU 46 Ca 0.46 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 58.10 2fyu h LEU 46 Cb 0.83 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2fyu h LEU 46 CO -0.57 0.07 -1.77 0.03 0.09 0.00 0.00 178.44 176.29 2fyu h ARG 47 N 0.00 0.24 0.00 1.13 -0.00 -1.68 -3.42 114.38 110.65 2fyu h ARG 47 Ca -0.00 -0.40 -0.00 0.00 -0.50 0.00 0.00 59.98 59.07 2fyu h ARG 47 Cb 0.50 0.15 -0.00 0.00 0.00 0.00 0.00 29.97 30.62 2fyu h ARG 47 CO 0.01 1.19 -0.15 0.28 0.00 0.00 0.00 179.97 181.30 2fyu h VAL 48 N -0.15 0.04 -0.10 2.04 2.07 -0.91 -3.43 116.25 115.80 2fyu h VAL 48 Ca -0.39 -1.03 0.02 0.00 0.82 0.00 0.00 66.70 66.12 2fyu h VAL 48 Cb 1.89 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2fyu h VAL 48 CO 0.05 0.01 -0.04 0.00 0.02 0.00 0.00 177.57 177.61 2fyu h ALA 49 N -0.98 0.05 -0.51 1.67 0.00 -1.11 -3.34 119.26 115.04 2fyu h ALA 49 Ca -0.00 0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.05 2fyu h ALA 49 Cb 0.17 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2fyu h ALA 49 CO -0.00 -0.50 0.35 -1.35 0.00 0.00 0.00 179.25 177.75 2fyu h PRO 50 N -0.03 0.25 -0.87 0.00 0.11 -1.81 -0.24 132.00 129.41 2fyu h PRO 50 Ca 0.06 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.16 2fyu h PRO 50 Cb 0.11 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 31.12 2fyu h PRO 50 CO -0.12 0.16 0.58 -1.35 -0.21 0.00 0.00 178.00 177.06 2fyu h PRO 51 N 0.26 1.14 -0.15 1.05 0.11 -1.85 -2.74 132.00 129.81 2fyu h PRO 51 Ca 0.24 -0.07 -0.18 0.00 0.11 0.00 0.00 66.00 66.10 2fyu h PRO 51 Cb 0.61 -0.26 0.01 0.00 0.11 0.00 0.00 31.00 31.47 2fyu h PRO 51 CO -0.05 0.76 -0.61 0.74 -0.21 0.00 0.00 178.00 178.62 2fyu h PHE 52 N 1.18 0.91 -0.78 0.65 0.04 -1.22 -0.82 116.94 116.89 2fyu h PHE 52 Ca 0.32 -0.39 0.11 0.00 2.80 0.00 0.00 57.97 60.82 2fyu h PHE 52 Cb -0.13 -0.15 -0.08 0.00 2.20 0.00 0.00 35.95 37.79 2fyu h PHE 52 CO -0.01 1.19 0.40 -0.39 -0.60 0.00 0.00 178.31 178.90 2fyu h VAL 53 N 0.37 0.81 -0.03 -0.55 -1.51 -1.55 0.58 116.25 114.37 2fyu h VAL 53 Ca -0.03 -0.22 -0.07 0.00 -1.23 0.00 0.00 66.70 65.15 2fyu h VAL 53 Cb 1.24 0.12 -0.01 0.00 -2.13 0.00 0.00 31.29 30.51 2fyu h VAL 53 CO 0.13 0.12 -0.30 0.00 -1.23 0.00 0.00 177.57 176.28 2fyu h ALA 54 N 1.48 1.45 0.30 5.19 0.00 -1.25 0.13 119.26 126.56 2fyu h ALA 54 Ca 0.40 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2fyu h ALA 54 Cb 0.47 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2fyu h ALA 54 CO -0.30 0.41 -0.14 0.35 0.00 0.00 0.00 179.25 179.56 2fyu h PHE 55 N 0.05 -0.38 -0.74 0.00 3.04 -0.95 -2.96 116.94 115.00 2fyu h PHE 55 Ca 0.00 -0.01 0.13 0.00 3.98 0.00 0.00 57.97 62.08 2fyu h PHE 55 Cb 0.56 0.12 -0.09 0.00 2.56 0.00 0.00 35.95 39.10 2fyu h PHE 55 CO 0.00 -0.07 0.30 -0.92 -2.02 0.00 0.00 178.31 175.60 2fyu h TYR 56 N -0.67 0.51 -0.70 0.41 5.03 0.22 0.27 116.97 122.04 2fyu h TYR 56 Ca -0.04 0.04 -0.07 0.00 2.58 0.00 0.00 58.73 61.24 2fyu h TYR 56 Cb 0.47 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.61 2fyu h TYR 56 CO 0.01 0.08 0.17 -0.07 -1.32 0.00 0.00 178.16 177.03 2fyu h LEU 57 N 0.45 1.06 -0.46 2.82 3.38 -0.90 -0.17 115.31 121.49 2fyu h LEU 57 Ca 0.40 -0.22 -0.17 0.00 0.09 0.00 0.00 57.88 57.97 2fyu h LEU 57 Cb 0.58 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2fyu h LEU 57 CO -0.38 1.01 -0.65 0.58 0.09 0.00 0.00 178.44 179.09 2fyu h VAL 58 N 1.06 1.35 0.17 1.22 2.07 -1.30 -1.61 116.25 119.21 2fyu h VAL 58 Ca 0.22 -1.97 0.01 0.00 0.82 0.00 0.00 66.70 65.77 2fyu h VAL 58 Cb 0.37 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 2fyu h VAL 58 CO 0.00 0.60 -0.18 0.22 0.02 0.00 0.00 177.57 178.24 2fyu h TYR 59 N 0.34 -0.46 -0.22 1.57 3.20 -0.32 -0.67 116.97 120.41 2fyu h TYR 59 Ca -0.01 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.69 2fyu h TYR 59 Cb 1.21 0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.66 2fyu h TYR 59 CO 0.05 -0.26 -0.54 1.79 -1.64 0.00 0.00 178.16 177.55 2fyu h THR 60 N -0.38 1.30 0.21 1.81 1.35 -1.00 -2.40 112.91 113.80 2fyu h THR 60 Ca 0.00 -1.75 0.01 0.00 -0.55 0.00 0.00 66.41 64.13 2fyu h THR 60 Cb 0.36 1.82 -0.03 0.00 -1.73 0.00 0.00 68.15 68.57 2fyu h THR 60 CO -0.05 0.56 -0.27 -0.25 -0.25 0.00 0.00 175.52 175.26 2fyu h TRP 61 N 0.48 -0.71 -0.92 4.73 7.01 -1.40 -2.68 115.95 122.46 2fyu h TRP 61 Ca -0.00 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.01 2fyu h TRP 61 Cb 1.15 0.29 -0.05 0.00 -2.10 0.00 0.00 29.16 28.45 2fyu h TRP 61 CO 0.08 -0.38 0.61 0.78 -2.79 0.00 0.00 178.44 176.74 2fyu h GLY 62 N -0.53 1.30 0.93 2.65 0.00 -1.16 0.56 103.07 106.82 2fyu h GLY 62 Ca 0.01 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 2fyu h GLY 62 CO -0.09 0.48 -0.10 -0.84 0.00 0.00 0.00 176.54 175.99 2fyu h THR 63 N 1.25 1.28 -0.43 4.70 2.02 -1.53 -2.64 112.91 117.56 2fyu h THR 63 Ca 0.34 -1.16 -0.02 0.00 0.77 0.00 0.00 66.41 66.34 2fyu h THR 63 Cb -0.14 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 2fyu h THR 63 CO -0.07 0.38 0.20 1.56 0.37 0.00 0.00 175.52 177.96 2fyu h GLN 64 N 0.43 0.62 -0.27 6.66 4.20 -1.01 -2.44 115.11 123.30 2fyu h GLN 64 Ca 0.08 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2fyu h GLN 64 Cb 0.60 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 2fyu h GLN 64 CO 0.04 0.54 0.12 1.49 -0.67 0.00 0.00 178.83 180.35 2fyu h GLU 65 N 0.56 0.39 -0.12 1.46 4.57 -0.95 -2.19 114.58 118.30 2fyu h GLU 65 Ca 0.15 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 2fyu h GLU 65 Cb 0.13 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.64 2fyu h GLU 65 CO -0.02 0.39 0.03 0.35 -1.18 0.00 0.00 179.01 178.58 2fyu h PHE 66 N 0.30 0.21 -0.78 0.92 3.57 -1.45 0.20 116.94 119.91 2fyu h PHE 66 Ca 0.09 -0.03 0.16 0.00 3.53 0.00 0.00 57.97 61.72 2fyu h PHE 66 Cb 0.13 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 38.71 2fyu h PHE 66 CO -0.02 0.37 0.30 1.49 -2.23 0.00 0.00 178.31 178.22 2fyu h GLU 67 N -0.01 0.40 0.00 1.11 4.81 -1.46 -3.02 114.58 116.42 2fyu h GLU 67 Ca 0.04 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 2fyu h GLU 67 Cb 0.27 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2fyu h GLU 67 CO 0.00 0.27 -0.40 0.87 -0.73 0.00 0.00 179.01 179.02 2fyu h LYS 68 N 0.42 0.00 0.00 1.92 1.57 -1.15 -3.19 116.57 116.14 2fyu h LYS 68 Ca 0.44 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.14 2fyu h LYS 68 Cb 0.71 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 2fyu h LYS 68 CO -0.44 0.20 -0.38 1.03 -0.57 0.00 0.00 179.45 179.29 2fyu h SER 69 N 0.00 0.00 -0.48 0.86 0.87 -0.53 -3.33 113.55 110.94 2fyu h SER 69 Ca -0.01 0.00 -0.32 0.00 -1.23 0.00 0.00 61.79 60.22 2fyu h SER 69 Cb 1.18 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 63.00 2fyu h SER 69 CO 0.03 0.38 0.41 0.29 -0.53 0.00 0.00 176.83 177.41 2fyu n LYS 70 N -3.78 1.81 -3.85 2.24 4.76 -1.15 -4.80 118.16 113.39 2fyu n LYS 70 Ca -0.01 -1.57 -0.12 0.00 -2.87 0.00 0.00 58.31 53.74 2fyu n LYS 70 Cb 0.46 -1.62 -0.12 0.00 -1.84 0.00 0.00 35.03 31.90 2fyu n LYS 70 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2fyu s ARG 71 N -1.80 0.19 0.68 1.97 0.52 -1.25 -5.08 118.95 114.17 2fyu s ARG 71 Ca 0.31 -0.00 0.01 0.00 -0.52 0.00 0.00 55.73 55.53 2fyu s ARG 71 Cb 0.24 0.08 0.11 0.00 0.52 0.00 0.00 34.95 35.91 2fyu s ARG 71 CO -0.01 -0.03 0.93 0.15 0.02 0.00 0.00 175.30 176.36 2fyu s LYS 72 N -0.28 1.88 0.00 3.54 1.02 -1.26 -5.09 119.74 119.55 2fyu s LYS 72 Ca -0.03 -1.16 0.00 0.00 0.02 0.00 0.00 55.97 54.80 2fyu s LYS 72 Cb -0.03 -2.40 0.00 0.00 -0.52 0.00 0.00 37.83 34.88 2fyu s LYS 72 CO 0.00 -1.27 0.00 0.09 -0.92 0.00 0.00 175.35 173.26 2fyu n ASN 73 N -2.68 0.00 -4.72 2.83 3.02 -1.26 -5.14 115.26 107.31 2fyu n ASN 73 Ca 0.14 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.44 2fyu n ASN 73 Cb 0.61 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.71 2fyu n ASN 73 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2fyu s PRO 74 N -1.00 2.59 0.00 3.52 0.05 -1.26 -5.39 135.00 133.51 2fyu s PRO 74 Ca 0.00 -1.10 0.00 0.00 0.05 0.00 0.00 61.00 59.95 2fyu s PRO 74 Cb 0.00 -2.43 0.00 0.00 0.05 0.00 0.00 34.50 32.12 2fyu s PRO 74 CO 0.00 0.44 0.03 0.00 0.05 0.00 0.00 177.00 177.52