#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i9e n LYS 3 N 0.00 0.57 -1.56 0.54 4.81 -1.26 -4.83 118.16 116.44 3i9e n LYS 3 Ca 0.00 0.17 -0.45 0.00 -0.87 0.00 0.00 58.31 57.16 3i9e n LYS 3 Cb 0.00 -1.95 -0.02 0.00 0.02 0.00 0.00 35.03 33.08 3i9e n LYS 3 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 3i9e n MET 4 N 7.19 1.15 -3.91 1.64 0.00 -1.26 -4.99 117.12 116.94 3i9e n MET 4 Ca 0.44 0.40 -0.34 0.00 -0.00 0.00 0.00 57.70 58.20 3i9e n MET 4 Cb 0.08 -1.72 -0.05 0.00 0.00 0.00 0.00 33.22 31.53 3i9e n MET 4 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 3i9e s LYS 5 N -1.45 3.42 0.34 2.12 1.02 -1.26 -5.04 119.74 118.89 3i9e s LYS 5 Ca 0.60 -0.28 -0.26 0.00 0.02 0.00 0.00 55.97 56.04 3i9e s LYS 5 Cb -0.74 -3.11 -0.10 0.00 -0.52 0.00 0.00 37.83 33.37 3i9e s LYS 5 CO 0.59 0.70 0.97 0.95 -0.92 0.00 0.00 175.35 177.64 3i9e s THR 6 N -1.25 4.09 -1.09 2.17 -4.23 -1.26 -4.91 115.64 109.16 3i9e s THR 6 Ca 0.24 1.71 -0.22 0.00 -1.18 0.00 0.00 61.69 62.25 3i9e s THR 6 Cb -0.12 -3.94 0.06 0.00 1.34 0.00 0.00 72.50 69.84 3i9e s THR 6 CO 0.15 0.12 1.51 -2.28 -0.54 0.00 0.00 174.62 173.58 3i9e s HIS 7 N -1.61 2.62 0.28 3.99 2.46 -0.93 -4.87 115.29 117.23 3i9e s HIS 7 Ca 0.52 -1.06 -0.07 0.00 0.47 0.00 0.00 55.06 54.91 3i9e s HIS 7 Cb -0.20 -4.70 0.48 0.00 -0.13 0.00 0.00 32.58 28.03 3i9e s HIS 7 CO 0.25 -1.89 1.57 0.87 -2.47 0.00 0.00 174.74 173.07 3i9e h LYS 8 N 9.20 0.00 -0.89 2.88 1.79 -1.92 -0.20 116.57 127.42 3i9e h LYS 8 Ca 0.26 -0.00 0.17 0.00 -2.18 0.00 0.00 60.65 58.90 3i9e h LYS 8 Cb 0.97 -0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 31.52 3i9e h LYS 8 CO 1.43 0.00 0.46 0.78 -1.08 0.00 0.00 179.45 181.04 3i9e h GLY 9 N 0.00 1.50 1.72 3.86 0.00 -2.00 -2.09 103.07 106.06 3i9e h GLY 9 Ca 0.48 -0.26 -0.20 0.00 0.00 0.00 0.00 47.33 47.36 3i9e h GLY 9 CO -0.98 -0.09 -0.87 0.00 0.00 0.00 0.00 176.54 174.60 3i9e h ALA 10 N 1.61 0.51 0.00 3.60 0.00 -1.45 -3.06 119.26 120.47 3i9e h ALA 10 Ca 0.51 -0.70 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 3i9e h ALA 10 Cb 0.79 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3i9e h ALA 10 CO -0.40 0.88 -0.18 -0.22 0.00 0.00 0.00 179.25 179.33 3i9e h LYS 11 N 0.14 0.00 0.00 0.00 3.64 -1.18 -0.68 116.57 118.50 3i9e h LYS 11 Ca -0.05 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.20 3i9e h LYS 11 Cb 1.49 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.29 3i9e h LYS 11 CO 0.14 0.18 -0.61 0.87 -2.27 0.00 0.00 179.45 177.76 3i9e h LYS 12 N 0.00 0.00 0.00 1.90 1.57 -1.30 -3.37 116.57 115.38 3i9e h LYS 12 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3i9e h LYS 12 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3i9e h LYS 12 CO 0.02 0.61 -0.02 2.89 -0.57 0.00 0.00 179.45 182.37 3i9e n ARG 13 N -3.37 2.09 -4.28 3.15 1.85 -0.90 -5.06 116.66 110.14 3i9e n ARG 13 Ca 0.01 -1.57 -0.18 0.00 -1.00 0.00 0.00 57.85 55.11 3i9e n ARG 13 Cb 0.72 -1.02 -0.09 0.00 -1.05 0.00 0.00 32.46 31.03 3i9e n ARG 13 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3i9e s VAL 14 N -1.22 0.06 -0.30 8.89 0.11 -0.31 -4.58 120.40 123.05 3i9e s VAL 14 Ca 0.07 -2.00 -0.05 0.00 -2.93 0.00 0.00 61.98 57.07 3i9e s VAL 14 Cb 0.06 -2.50 0.18 0.00 -1.53 0.00 0.00 36.38 32.59 3i9e s VAL 14 CO 0.01 0.00 0.70 -0.75 -3.33 0.00 0.00 175.10 171.73 3i9e s LYS 15 N -3.70 0.49 0.14 1.54 2.36 -1.04 -4.80 119.74 114.73 3i9e s LYS 15 Ca 0.39 0.96 -0.30 0.00 -2.55 0.00 0.00 55.97 54.46 3i9e s LYS 15 Cb 0.04 0.54 -0.07 0.00 -1.05 0.00 0.00 37.83 37.29 3i9e s LYS 15 CO 0.22 -0.46 1.26 -1.50 1.55 0.00 0.00 175.35 176.42 3i9e s ILE 16 N 2.86 3.57 0.24 5.43 2.07 -1.26 -1.49 121.20 132.61 3i9e s ILE 16 Ca 0.12 1.21 0.05 0.00 -1.41 0.00 0.00 60.65 60.62 3i9e s ILE 16 Cb -0.13 -3.78 -0.03 0.00 0.13 0.00 0.00 42.46 38.65 3i9e s ILE 16 CO -0.19 0.14 0.35 0.42 -1.91 0.00 0.00 174.94 173.75 3i9e s THR 17 N 0.54 5.20 0.16 4.00 -4.23 0.22 -4.93 115.64 116.60 3i9e s THR 17 Ca 0.58 -1.01 -0.18 0.00 -1.18 0.00 0.00 61.69 59.89 3i9e s THR 17 Cb -0.33 -3.82 0.09 0.00 1.34 0.00 0.00 72.50 69.78 3i9e s THR 17 CO 0.33 -0.32 1.22 0.00 -0.54 0.00 0.00 174.62 175.31 3i9e n ALA 18 N -1.37 -0.26 1.28 3.99 0.00 -1.26 0.22 120.51 123.11 3i9e n ALA 18 Ca -0.09 0.74 0.11 0.00 0.00 0.00 0.00 53.44 54.21 3i9e n ALA 18 Cb 0.57 -0.26 0.64 0.00 0.00 0.00 0.00 19.45 20.40 3i9e n ALA 18 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3i9e n SER 19 N -5.09 0.00 0.00 0.00 3.41 -1.26 -4.85 113.62 105.83 3i9e n SER 19 Ca 0.05 -0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 3i9e n SER 19 Cb 0.27 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 3i9e n SER 19 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i9e n GLY 20 N 0.53 1.62 3.95 5.00 0.00 0.59 -5.10 105.19 111.77 3i9e n GLY 20 Ca 0.14 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 3i9e n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i9e s LYS 21 N -1.65 3.48 -0.10 1.61 1.02 -1.19 -4.79 119.74 118.12 3i9e s LYS 21 Ca 0.00 -0.42 -0.01 0.00 0.02 0.00 0.00 55.97 55.55 3i9e s LYS 21 Cb 0.00 -2.72 -0.03 0.00 -0.52 0.00 0.00 37.83 34.56 3i9e s LYS 21 CO 0.00 0.22 -0.03 0.08 -0.92 0.00 0.00 175.35 174.69 3i9e s VAL 22 N -2.23 3.99 -0.10 3.17 1.01 -1.26 0.71 120.40 125.69 3i9e s VAL 22 Ca 0.39 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 3i9e s VAL 22 Cb -0.09 -2.68 0.03 0.00 0.00 0.00 0.00 36.38 33.63 3i9e s VAL 22 CO 0.34 0.57 -0.02 -0.69 0.00 0.00 0.00 175.10 175.30 3i9e s VAL 23 N -0.49 0.63 0.36 2.92 1.01 -0.56 -3.37 120.40 120.90 3i9e s VAL 23 Ca 0.08 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.98 3i9e s VAL 23 Cb -0.12 -0.77 -0.00 0.00 0.00 0.00 0.00 36.38 35.49 3i9e s VAL 23 CO 0.02 0.26 0.04 0.00 0.00 0.00 0.00 175.10 175.42 3i9e n ALA 24 N 5.06 0.37 -1.00 5.51 0.00 -0.74 -2.51 120.51 127.21 3i9e n ALA 24 Ca -0.09 -1.68 0.00 0.00 0.00 0.00 0.00 53.44 51.67 3i9e n ALA 24 Cb 0.50 1.00 0.00 0.00 0.00 0.00 0.00 19.45 20.94 3i9e n ALA 24 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3i9e n MET 25 N -0.86 2.84 -3.83 0.00 2.81 -1.26 -2.11 117.12 114.71 3i9e n MET 25 Ca -0.11 0.00 -0.28 0.00 -1.81 0.00 0.00 57.70 55.49 3i9e n MET 25 Cb 0.48 0.00 -0.16 0.00 -0.71 0.00 0.00 33.22 32.83 3i9e n MET 25 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3i9e s LYS 26 N 0.00 1.09 0.05 0.03 -0.14 -1.26 -4.54 119.74 114.96 3i9e s LYS 26 Ca 0.00 -0.57 -0.33 0.00 -1.36 0.00 0.00 55.97 53.71 3i9e s LYS 26 Cb 0.00 -2.17 -0.12 0.00 -1.68 0.00 0.00 37.83 33.87 3i9e s LYS 26 CO 0.00 -0.57 1.80 0.25 -0.76 0.00 0.00 175.35 176.08 3i9e n THR 27 N 4.91 0.39 0.00 2.17 -2.24 -1.26 -3.98 114.28 114.28 3i9e n THR 27 Ca -0.10 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3i9e n THR 27 Cb 0.47 -1.90 0.00 0.00 -2.10 0.00 0.00 70.33 66.79 3i9e n THR 27 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i9e n GLY 28 N 4.12 -0.24 0.00 3.38 0.00 -1.26 -5.11 105.19 106.09 3i9e n GLY 28 Ca 0.20 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.32 3i9e n GLY 28 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3i9e n LYS 29 N 0.00 0.00 -0.69 1.61 3.00 -1.26 -4.59 118.16 116.24 3i9e n LYS 29 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.01 3i9e n LYS 29 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 34.98 3i9e n LYS 29 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 3i9e n ARG 30 N 0.00 0.00 0.00 1.64 3.00 -1.26 -4.03 116.66 116.00 3i9e n ARG 30 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 3i9e n ARG 30 Cb 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 32.46 31.75 3i9e n ARG 30 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 3i9e n HIS 31 N 2.86 0.00 -1.28 -0.14 -0.00 -1.26 -4.92 115.22 110.48 3i9e n HIS 31 Ca 0.21 0.00 -0.25 0.00 0.46 0.00 0.00 57.72 58.14 3i9e n HIS 31 Cb -0.02 0.00 0.16 0.00 -0.12 0.00 0.00 29.99 30.00 3i9e n HIS 31 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 3i9e n LEU 32 N 0.00 6.79 0.29 0.27 4.77 -1.26 -4.53 117.00 123.33 3i9e n LEU 32 Ca 0.00 -3.79 0.18 0.00 -0.03 0.00 0.00 56.01 52.37 3i9e n LEU 32 Cb 0.00 -0.85 0.93 0.00 -2.33 0.00 0.00 43.42 41.17 3i9e n LEU 32 CO 0.00 1.18 1.15 0.78 -1.33 0.00 0.00 177.39 179.17 3i9e h ASN 33 N 1.25 0.00 0.00 -1.43 2.35 -1.92 -3.37 115.58 112.47 3i9e h ASN 33 Ca 0.60 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.35 3i9e h ASN 33 Cb 2.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.68 3i9e h ASN 33 CO 1.17 0.00 0.00 1.87 -1.65 0.00 0.00 177.43 178.82 3i9e n TRP 34 N -3.24 0.00 -3.20 1.19 -0.00 -1.26 -2.54 117.44 108.39 3i9e n TRP 34 Ca -0.01 0.00 -0.05 0.00 -0.00 0.00 0.00 57.50 57.44 3i9e n TRP 34 Cb 0.29 0.00 -0.03 0.00 -0.00 0.00 0.00 31.31 31.57 3i9e n TRP 34 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 3i9e s GLN 35 N -0.43 0.81 0.25 5.87 -1.52 -1.26 -5.11 119.66 118.28 3i9e s GLN 35 Ca 0.00 -0.60 0.09 0.00 -1.95 0.00 0.00 55.36 52.90 3i9e s GLN 35 Cb 0.00 -0.19 -0.04 0.00 -0.22 0.00 0.00 33.01 32.56 3i9e s GLN 35 CO 0.00 -1.22 0.06 0.15 -0.25 0.00 0.00 175.29 174.03 3i9e s LYS 36 N 1.54 2.50 1.05 2.91 1.02 -1.05 -5.09 119.74 122.61 3i9e s LYS 36 Ca 0.19 -1.27 -0.13 0.00 0.02 0.00 0.00 55.97 54.77 3i9e s LYS 36 Cb -0.06 -2.31 0.16 0.00 -0.52 0.00 0.00 37.83 35.10 3i9e s LYS 36 CO -0.06 0.39 0.72 -1.13 -0.92 0.00 0.00 175.35 174.35 3i9e n SER 37 N -0.91 -1.36 0.09 2.83 3.41 -1.26 -4.78 113.62 111.64 3i9e n SER 37 Ca -0.07 0.11 -0.03 0.00 -0.26 0.00 0.00 58.87 58.62 3i9e n SER 37 Cb 0.58 -1.25 0.17 0.00 -0.26 0.00 0.00 64.21 63.45 3i9e n SER 37 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3i9e h GLY 38 N -2.11 0.23 2.00 5.00 0.00 -2.00 -0.28 103.07 105.91 3i9e h GLY 38 Ca -0.51 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 46.56 3i9e h GLY 38 CO 0.41 0.23 0.00 1.17 0.00 0.00 0.00 176.54 178.36 3i9e n LYS 39 N -3.93 0.01 0.00 4.80 0.00 -1.26 -2.14 118.16 115.64 3i9e n LYS 39 Ca -0.02 0.46 0.00 0.00 0.00 0.00 0.00 58.31 58.75 3i9e n LYS 39 Cb 0.56 -1.53 0.00 0.00 0.00 0.00 0.00 35.03 34.06 3i9e n LYS 39 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 3i9e n GLU 40 N -1.55 0.00 -0.62 1.64 4.07 -0.12 -3.12 120.64 120.94 3i9e n GLU 40 Ca 0.01 0.05 0.49 0.00 -0.06 0.00 0.00 57.16 57.65 3i9e n GLU 40 Cb 0.03 -0.34 0.80 0.00 -0.06 0.00 0.00 31.44 31.88 3i9e n GLU 40 CO 0.00 0.00 0.00 -0.84 -0.06 0.00 0.00 177.13 176.23 3i9e h ILE 41 N 0.00 0.08 -0.21 6.31 3.07 -1.61 1.42 117.51 126.57 3i9e h ILE 41 Ca 0.00 0.00 -0.17 0.00 1.55 0.00 0.00 64.86 66.24 3i9e h ILE 41 Cb 0.00 0.08 -0.00 0.00 -0.27 0.00 0.00 36.82 36.63 3i9e h ILE 41 CO 0.00 0.00 -0.57 -0.09 -1.05 0.00 0.00 178.15 176.44 3i9e h ARG 42 N 0.00 0.66 -1.10 0.16 2.43 -1.61 -3.19 114.38 111.73 3i9e h ARG 42 Ca 0.86 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 59.60 3i9e h ARG 42 Cb 3.48 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 33.08 3i9e h ARG 42 CO -0.01 1.05 0.00 0.94 -1.51 0.00 0.00 179.97 180.44 3i9e n GLN 43 N -3.96 0.66 -3.43 0.20 -0.06 0.48 -4.45 117.38 106.82 3i9e n GLN 43 Ca -0.04 0.00 -0.33 0.00 -2.00 0.00 0.00 57.00 54.64 3i9e n GLN 43 Cb 0.63 -1.23 -0.06 0.00 -4.06 0.00 0.00 30.24 25.52 3i9e n GLN 43 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 3i9e n LYS 44 N 0.49 2.91 -1.18 3.69 4.01 -1.21 -5.00 118.16 121.88 3i9e n LYS 44 Ca 0.00 -4.59 0.00 0.00 -0.51 0.00 0.00 58.31 53.21 3i9e n LYS 44 Cb 0.27 -2.35 0.00 0.00 -0.51 0.00 0.00 35.03 32.44 3i9e n LYS 44 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3i9e n GLY 45 N 1.38 3.56 0.00 0.72 0.00 -1.26 -4.89 105.19 104.70 3i9e n GLY 45 Ca 0.26 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 44.14 3i9e n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i9e n ARG 46 N -0.37 1.12 0.00 1.61 1.74 -1.26 -4.17 116.66 115.34 3i9e n ARG 46 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3i9e n ARG 46 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 3i9e n ARG 46 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 3i9e n LYS 47 N 0.00 0.00 -3.90 5.56 -0.00 -0.89 -4.82 118.16 114.10 3i9e n LYS 47 Ca 0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 58.04 3i9e n LYS 47 Cb 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 35.03 34.86 3i9e n LYS 47 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.40 176.81 3i9e s PHE 48 N -2.00 1.54 1.24 5.58 -0.71 -1.26 -1.80 117.98 120.58 3i9e s PHE 48 Ca 0.00 -0.84 -0.15 0.00 -1.04 0.00 0.00 56.93 54.89 3i9e s PHE 48 Cb 0.00 -1.26 0.31 0.00 -1.21 0.00 0.00 43.02 40.86 3i9e s PHE 48 CO 0.00 -0.54 1.00 0.14 -1.34 0.00 0.00 175.22 174.47 3i9e s VAL 49 N 1.69 1.79 -0.20 -2.49 -7.23 -1.22 -5.00 120.40 107.74 3i9e s VAL 49 Ca 0.04 0.00 -0.27 0.00 -1.81 0.00 0.00 61.98 59.94 3i9e s VAL 49 Cb -0.13 -2.08 0.08 0.00 0.56 0.00 0.00 36.38 34.81 3i9e s VAL 49 CO -0.08 0.00 0.75 -0.22 -0.31 0.00 0.00 175.10 175.24 3i9e s LEU 50 N -7.40 -0.68 -1.66 1.32 2.96 -1.26 -4.70 118.68 107.27 3i9e s LEU 50 Ca 0.69 1.14 0.00 0.00 -0.22 0.00 0.00 54.13 55.73 3i9e s LEU 50 Cb -0.22 2.40 0.00 0.00 0.50 0.00 0.00 46.19 48.87 3i9e s LEU 50 CO 0.63 -0.35 0.00 0.00 -1.32 0.00 0.00 176.35 175.31 3i9e n ALA 51 N 2.05 -0.35 -1.84 5.97 0.00 -1.26 -4.55 120.51 120.54 3i9e n ALA 51 Ca -0.15 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3i9e n ALA 51 Cb 0.56 -1.70 0.00 0.00 0.00 0.00 0.00 19.45 18.31 3i9e n ALA 51 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3i9e n LYS 52 N -2.26 0.00 -0.00 0.00 3.00 -1.26 -4.84 118.16 112.80 3i9e n LYS 52 Ca -0.17 -0.08 0.06 0.00 -0.00 0.00 0.00 58.31 58.12 3i9e n LYS 52 Cb 0.56 -0.08 -0.09 0.00 0.00 0.00 0.00 35.03 35.41 3i9e n LYS 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 3i9e n PRO 53 N 0.00 0.70 -0.34 1.64 -0.04 -1.26 -4.12 135.00 131.58 3i9e n PRO 53 Ca 0.00 -0.10 0.20 0.00 -0.04 0.00 0.00 63.50 63.56 3i9e n PRO 53 Cb 0.50 -1.27 0.43 0.00 -0.04 0.00 0.00 33.50 33.13 3i9e n PRO 53 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3i9e h GLU 54 N 0.00 0.49 0.02 0.54 5.08 -1.94 1.13 114.58 119.90 3i9e h GLU 54 Ca 0.00 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3i9e h GLU 54 Cb 0.53 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 3i9e h GLU 54 CO 0.00 0.33 -0.10 0.00 -1.00 0.00 0.00 179.01 178.23 3i9e h ALA 55 N 1.68 -0.13 0.62 3.43 0.00 -1.94 -2.06 119.26 120.86 3i9e h ALA 55 Ca 0.63 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.51 3i9e h ALA 55 Cb 1.34 0.18 0.01 0.00 0.00 0.00 0.00 17.79 19.32 3i9e h ALA 55 CO -0.40 -0.60 -0.30 0.93 0.00 0.00 0.00 179.25 178.87 3i9e h GLU 56 N -0.19 -0.81 -0.85 0.00 3.07 0.88 -2.65 114.58 114.04 3i9e h GLU 56 Ca 0.03 0.05 0.31 0.00 -0.50 0.00 0.00 59.36 59.26 3i9e h GLU 56 Cb 0.23 0.18 -0.10 0.00 -0.84 0.00 0.00 28.75 28.22 3i9e h GLU 56 CO -0.09 -0.54 0.52 0.54 -1.40 0.00 0.00 179.01 178.05 3i9e n ARG 57 N -4.46 -0.03 0.08 2.33 1.74 0.98 0.34 116.66 117.64 3i9e n ARG 57 Ca -0.10 0.87 -0.08 0.00 -0.77 0.00 0.00 57.85 57.77 3i9e n ARG 57 Cb 0.33 -1.67 0.03 0.00 -1.02 0.00 0.00 32.46 30.13 3i9e n ARG 57 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3i9e h ILE 58 N 0.00 1.45 0.00 0.55 1.08 -1.03 -3.15 117.51 116.41 3i9e h ILE 58 Ca 0.59 -2.38 0.00 0.00 -0.39 0.00 0.00 64.86 62.68 3i9e h ILE 58 Cb 1.79 2.29 0.00 0.00 -3.07 0.00 0.00 36.82 37.84 3i9e h ILE 58 CO -0.38 0.70 -0.40 0.29 -0.69 0.00 0.00 178.15 177.67 3i9e n LYS 59 N -3.74 0.17 -1.44 2.37 5.02 1.03 -3.02 118.16 118.55 3i9e n LYS 59 Ca -0.03 0.07 -0.34 0.00 -2.02 0.00 0.00 58.31 55.99 3i9e n LYS 59 Cb 0.74 -1.63 0.07 0.00 -0.02 0.00 0.00 35.03 34.19 3i9e n LYS 59 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3i9e n LEU 60 N -1.90 7.34 -4.61 -0.35 4.77 -0.27 -2.18 117.00 119.79 3i9e n LEU 60 Ca 0.05 -4.37 -0.43 0.00 -0.03 0.00 0.00 56.01 51.24 3i9e n LEU 60 Cb 0.40 -0.90 -0.04 0.00 -2.33 0.00 0.00 43.42 40.56 3i9e n LEU 60 CO 0.34 1.56 0.77 -0.76 -1.33 0.00 0.00 177.39 177.97 3i9e s LEU 61 N -3.80 4.00 0.00 2.23 1.43 -1.17 -2.66 118.68 118.71 3i9e s LEU 61 Ca 0.63 0.72 0.00 0.00 -1.03 0.00 0.00 54.13 54.45 3i9e s LEU 61 Cb 0.49 -3.29 0.00 0.00 0.03 0.00 0.00 46.19 43.42 3i9e s LEU 61 CO -0.01 -0.81 0.00 0.18 0.23 0.00 0.00 176.35 175.94 3i9e n LEU 62 N 6.67 0.00 0.20 1.79 4.77 -1.26 -4.68 117.00 124.49 3i9e n LEU 62 Ca 0.08 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.93 3i9e n LEU 62 Cb 0.48 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.50 3i9e n LEU 62 CO 0.57 0.00 0.52 -0.65 -1.33 0.00 0.00 177.39 176.49 3i9e h PRO 63 N 0.00 -0.65 0.00 3.23 0.11 -1.89 -3.46 132.00 129.33 3i9e h PRO 63 Ca 0.00 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.15 3i9e h PRO 63 Cb 0.00 0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.26 3i9e h PRO 63 CO 0.00 -0.43 0.00 0.66 -0.21 0.00 0.00 178.00 178.02 3i9e n TYR 64 N -4.40 0.00 -0.82 0.65 0.53 -1.25 -5.20 117.16 106.66 3i9e n TYR 64 Ca -0.08 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.80 3i9e n TYR 64 Cb 0.31 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.62 3i9e n TYR 64 CO 0.00 0.00 0.00 -0.85 -1.02 0.00 0.00 176.86 174.99