#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f1g s ARG 3 N 0.00 2.82 -0.12 0.00 0.52 -1.26 -4.10 118.95 116.80 3f1g s ARG 3 Ca 0.00 -1.14 -0.05 0.00 -0.52 0.00 0.00 55.73 54.01 3f1g s ARG 3 Cb 0.00 -5.27 -0.03 0.00 0.52 0.00 0.00 34.95 30.17 3f1g s ARG 3 CO 0.00 -3.49 -0.02 0.82 0.02 0.00 0.00 175.30 172.63 3f1g h ILE 4 N 6.31 0.12 0.00 1.52 1.08 -1.53 -3.22 117.51 121.78 3f1g h ILE 4 Ca 0.23 -1.10 0.00 0.00 -0.39 0.00 0.00 64.86 63.60 3f1g h ILE 4 Cb 0.94 0.24 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 3f1g h ILE 4 CO 1.27 0.04 0.00 0.00 -0.69 0.00 0.00 178.15 178.77 3f1g n ALA 5 N -3.08 2.04 -0.11 1.87 0.00 -1.09 -4.80 120.51 115.34 3f1g n ALA 5 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3f1g n ALA 5 Cb 0.14 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.59 3f1g n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f1g n GLY 6 N 0.50 0.86 0.17 0.00 0.00 -1.22 -3.73 105.19 101.77 3f1g n GLY 6 Ca 0.00 0.08 -0.16 0.00 0.00 0.00 0.00 46.02 45.94 3f1g n GLY 6 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3f1g h VAL 7 N 0.00 1.37 -3.46 1.61 2.07 -1.87 -3.44 116.25 112.53 3f1g h VAL 7 Ca 0.00 -1.87 -0.54 0.00 0.82 0.00 0.00 66.70 65.11 3f1g h VAL 7 Cb 0.00 2.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 3f1g h VAL 7 CO 0.00 0.56 0.25 -1.61 0.02 0.00 0.00 177.57 176.79 3f1g s GLU 8 N -3.61 4.56 -0.50 1.57 2.02 -1.24 -4.92 118.70 116.58 3f1g s GLU 8 Ca -0.13 1.22 0.05 0.00 0.02 0.00 0.00 54.97 56.14 3f1g s GLU 8 Cb 0.05 -3.39 0.20 0.00 0.10 0.00 0.00 34.13 31.09 3f1g s GLU 8 CO 0.83 0.18 0.46 -0.89 0.02 0.00 0.00 175.26 175.86 3f1g n ILE 9 N 3.11 -0.07 -2.47 -1.63 5.41 -1.26 -1.25 119.36 121.20 3f1g n ILE 9 Ca 0.01 -4.08 -0.35 0.00 1.00 0.00 0.00 62.75 59.33 3f1g n ILE 9 Cb 0.50 -1.89 -0.03 0.00 -0.71 0.00 0.00 39.64 37.52 3f1g n ILE 9 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3f1g s PRO 10 N -0.85 3.76 0.22 0.38 0.04 -1.26 -4.65 135.00 132.63 3f1g s PRO 10 Ca 0.32 1.46 -0.20 0.00 0.04 0.00 0.00 61.00 62.63 3f1g s PRO 10 Cb 0.06 -2.16 0.03 0.00 0.04 0.00 0.00 34.50 32.48 3f1g s PRO 10 CO -0.15 -0.49 0.60 1.03 0.04 0.00 0.00 177.00 178.03 3f1g s ARG 11 N -3.10 1.49 0.00 4.56 0.52 -1.26 -3.78 118.95 117.37 3f1g s ARG 11 Ca 0.67 -0.83 0.00 0.00 -0.52 0.00 0.00 55.73 55.04 3f1g s ARG 11 Cb -0.19 0.56 0.00 0.00 0.52 0.00 0.00 34.95 35.84 3f1g s ARG 11 CO 0.23 -0.65 0.00 0.09 0.02 0.00 0.00 175.30 174.99 3f1g n ASN 12 N -0.39 -5.41 -4.20 0.23 5.03 -1.26 -4.89 115.26 104.36 3f1g n ASN 12 Ca -0.09 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.24 3f1g n ASN 12 Cb 0.62 -2.97 -0.10 0.00 -1.02 0.00 0.00 39.78 36.31 3f1g n ASN 12 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 3f1g s LYS 13 N -1.65 1.02 -0.13 3.52 2.20 -1.26 -4.88 119.74 118.57 3f1g s LYS 13 Ca 0.00 -1.48 -0.40 0.00 -0.36 0.00 0.00 55.97 53.73 3f1g s LYS 13 Cb 0.00 -0.08 -0.19 0.00 -1.51 0.00 0.00 37.83 36.05 3f1g s LYS 13 CO 0.00 -0.17 1.15 0.54 -0.36 0.00 0.00 175.35 176.51 3f1g n ARG 14 N -0.17 0.00 -0.37 4.03 1.74 -1.26 -3.00 116.66 117.63 3f1g n ARG 14 Ca -0.07 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.01 3f1g n ARG 14 Cb 0.63 -1.42 0.05 0.00 -1.02 0.00 0.00 32.46 30.70 3f1g n ARG 14 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 3f1g n VAL 15 N 2.05 -0.50 -0.16 1.55 0.24 -0.63 -2.14 118.33 118.74 3f1g n VAL 15 Ca 0.22 2.27 -0.06 0.00 -2.04 0.00 0.00 64.34 64.72 3f1g n VAL 15 Cb 0.04 -3.01 -0.00 0.00 -1.47 0.00 0.00 33.84 29.39 3f1g n VAL 15 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 3f1g h ASP 16 N 0.00 -1.11 0.70 -1.34 -0.00 -1.86 -0.87 116.42 111.94 3f1g h ASP 16 Ca 0.35 0.21 -0.00 0.00 -0.00 0.00 0.00 57.03 57.58 3f1g h ASP 16 Cb 0.59 0.53 -0.00 0.00 -0.00 0.00 0.00 39.33 40.46 3f1g h ASP 16 CO -0.97 -0.31 -0.02 0.58 -0.00 0.00 0.00 179.24 178.53 3f1g h VAL 17 N -0.21 0.06 -0.58 4.15 2.07 -1.76 -2.04 116.25 117.94 3f1g h VAL 17 Ca 0.20 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 3f1g h VAL 17 Cb 0.54 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 3f1g h VAL 17 CO -0.60 0.02 0.11 0.00 0.02 0.00 0.00 177.57 177.11 3f1g h ALA 18 N 1.98 1.09 0.00 1.67 0.00 -1.16 -2.59 119.26 120.26 3f1g h ALA 18 Ca -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3f1g h ALA 18 Cb 0.37 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3f1g h ALA 18 CO 0.00 0.59 -0.07 -0.07 0.00 0.00 0.00 179.25 179.71 3f1g h LEU 19 N 0.88 0.00 -0.97 0.00 -0.00 -1.34 -2.27 115.31 111.60 3f1g h LEU 19 Ca 0.18 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 58.01 3f1g h LEU 19 Cb 0.37 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.00 3f1g h LEU 19 CO 0.01 0.07 0.12 0.74 -0.00 0.00 0.00 178.44 179.38 3f1g h THR 20 N 0.00 1.23 0.00 0.22 2.02 -1.52 -2.09 112.91 112.77 3f1g h THR 20 Ca -0.00 -0.86 0.00 0.00 0.77 0.00 0.00 66.41 66.32 3f1g h THR 20 Cb 0.51 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 3f1g h THR 20 CO 0.01 0.32 0.00 -1.22 0.37 0.00 0.00 175.52 175.00 3f1g n TYR 21 N -4.26 0.00 -2.84 3.16 4.02 -0.85 -4.56 117.16 111.82 3f1g n TYR 21 Ca 0.04 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.53 3f1g n TYR 21 Cb 0.24 -0.46 -0.05 0.00 -0.02 0.00 0.00 39.34 39.04 3f1g n TYR 21 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3f1g s ILE 22 N -2.92 4.38 0.05 -0.72 -1.09 -0.79 -5.01 121.20 115.11 3f1g s ILE 22 Ca 0.02 1.91 -0.31 0.00 -2.23 0.00 0.00 60.65 60.04 3f1g s ILE 22 Cb 0.02 -4.24 -0.07 0.00 -1.58 0.00 0.00 42.46 36.59 3f1g s ILE 22 CO 0.06 0.43 1.50 -0.47 -1.23 0.00 0.00 174.94 175.22 3f1g s TYR 23 N -0.63 2.79 0.00 3.97 6.14 -1.26 -2.22 117.35 126.13 3f1g s TYR 23 Ca 0.41 0.66 0.00 0.00 0.64 0.00 0.00 57.07 58.78 3f1g s TYR 23 Cb -0.24 -3.79 0.00 0.00 0.42 0.00 0.00 41.96 38.36 3f1g s TYR 23 CO 0.28 -2.98 0.00 0.41 0.64 0.00 0.00 175.55 173.90 3f1g n GLY 24 N 3.74 0.51 2.90 8.97 0.00 -1.26 -1.13 105.19 118.92 3f1g n GLY 24 Ca 0.14 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 45.17 3f1g n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f1g s ILE 25 N -2.00 -0.05 0.00 -0.61 -1.09 -0.94 -4.91 121.20 111.60 3f1g s ILE 25 Ca 0.00 0.17 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 3f1g s ILE 25 Cb 0.00 -0.20 0.00 0.00 -1.58 0.00 0.00 42.46 40.68 3f1g s ILE 25 CO 0.00 0.07 0.00 0.61 -1.23 0.00 0.00 174.94 174.39 3f1g n GLY 26 N 4.08 5.06 0.27 6.18 0.00 -1.26 -4.30 105.19 115.20 3f1g n GLY 26 Ca -0.25 -1.62 0.04 0.00 0.00 0.00 0.00 46.02 44.19 3f1g n GLY 26 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3f1g h LYS 27 N 0.00 0.28 0.05 1.61 1.63 -1.96 -2.30 116.57 115.88 3f1g h LYS 27 Ca 0.00 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 3f1g h LYS 27 Cb 0.00 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.58 3f1g h LYS 27 CO 0.00 0.28 -0.02 0.00 -3.45 0.00 0.00 179.45 176.25 3f1g h ALA 28 N 1.77 -0.07 0.00 5.00 0.00 -2.01 -3.20 119.26 120.74 3f1g h ALA 28 Ca 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3f1g h ALA 28 Cb 0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3f1g h ALA 28 CO -0.00 -0.14 0.00 0.54 0.00 0.00 0.00 179.25 179.65 3f1g n ARG 29 N -4.77 0.10 0.03 0.00 1.74 -1.19 -2.74 116.66 109.84 3f1g n ARG 29 Ca -0.08 0.23 -0.02 0.00 -0.77 0.00 0.00 57.85 57.20 3f1g n ARG 29 Cb 0.32 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.25 3f1g n ARG 29 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3f1g h ALA 30 N 2.45 -0.21 -0.51 7.54 0.00 -1.41 -2.63 119.26 124.49 3f1g h ALA 30 Ca 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3f1g h ALA 30 Cb 0.12 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3f1g h ALA 30 CO 0.00 -0.20 0.32 0.87 0.00 0.00 0.00 179.25 180.24 3f1g h LYS 31 N -0.74 0.62 -0.95 0.00 1.57 -1.59 -1.21 116.57 114.26 3f1g h LYS 31 Ca -0.02 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.80 3f1g h LYS 31 Cb 0.12 -0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.23 3f1g h LYS 31 CO 0.03 0.41 0.60 1.49 -0.57 0.00 0.00 179.45 181.41 3f1g h GLU 32 N 0.63 1.04 0.00 3.15 4.22 -1.67 0.18 114.58 122.14 3f1g h GLU 32 Ca 0.20 -0.06 -0.06 0.00 0.08 0.00 0.00 59.36 59.52 3f1g h GLU 32 Cb -0.01 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 3f1g h GLU 32 CO -0.08 0.69 -0.30 0.00 -2.18 0.00 0.00 179.01 177.15 3f1g h ALA 33 N 1.45 0.95 0.00 2.92 0.00 -1.05 0.78 119.26 124.31 3f1g h ALA 33 Ca 0.42 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3f1g h ALA 33 Cb 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3f1g h ALA 33 CO -0.19 0.37 -0.32 -0.07 0.00 0.00 0.00 179.25 179.04 3f1g h LEU 34 N 0.00 0.00 0.16 0.00 3.38 0.15 -3.10 115.31 115.90 3f1g h LEU 34 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 3f1g h LEU 34 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3f1g h LEU 34 CO 0.04 0.16 -1.75 -0.33 0.09 0.00 0.00 178.44 176.65 3f1g h GLU 35 N 0.00 0.35 -0.01 1.13 5.08 -0.50 0.45 114.58 121.09 3f1g h GLU 35 Ca -0.01 -0.59 0.00 0.00 -1.00 0.00 0.00 59.36 57.76 3f1g h GLU 35 Cb 1.13 0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.60 3f1g h GLU 35 CO 0.02 1.26 0.00 1.63 -1.00 0.00 0.00 179.01 180.92 3f1g n LYS 36 N -3.54 0.60 0.00 2.33 4.76 0.25 -1.77 118.16 120.78 3f1g n LYS 36 Ca -0.24 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.20 3f1g n LYS 36 Cb 1.07 -1.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.25 3f1g n LYS 36 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3f1g n THR 37 N -0.49 0.00 -4.39 -0.18 -2.24 -1.17 -5.02 114.28 100.79 3f1g n THR 37 Ca 0.00 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.42 3f1g n THR 37 Cb 0.00 0.70 -0.08 0.00 -2.10 0.00 0.00 70.33 68.85 3f1g n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f1g n GLY 38 N 0.00 -0.28 3.89 3.38 0.00 -0.05 -4.93 105.19 107.20 3f1g n GLY 38 Ca 0.00 0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3f1g n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f1g s ILE 39 N -3.74 5.11 -0.24 -0.61 -1.09 -0.07 -5.01 121.20 115.56 3f1g s ILE 39 Ca 0.45 0.22 -0.29 0.00 -2.23 0.00 0.00 60.65 58.79 3f1g s ILE 39 Cb -0.26 -3.63 -0.01 0.00 -1.58 0.00 0.00 42.46 36.98 3f1g s ILE 39 CO 1.00 0.09 1.45 0.21 -1.23 0.00 0.00 174.94 176.46 3f1g s ASN 40 N -2.23 6.58 0.56 3.58 2.47 -1.26 -4.79 114.94 119.85 3f1g s ASN 40 Ca 0.40 1.48 0.28 0.00 0.42 0.00 0.00 52.86 55.44 3f1g s ASN 40 Cb -0.12 -2.54 1.64 0.00 -1.45 0.00 0.00 41.25 38.78 3f1g s ASN 40 CO 0.22 -1.11 2.17 -0.65 -3.72 0.00 0.00 177.10 174.01 3f1g h PRO 41 N 9.78 0.00 -0.12 0.43 0.11 -1.96 -3.25 132.00 136.98 3f1g h PRO 41 Ca -0.30 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 3f1g h PRO 41 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3f1g h PRO 41 CO 1.01 0.06 -0.05 0.00 -0.21 0.00 0.00 178.00 178.80 3f1g h ALA 42 N 1.94 0.17 -2.38 -0.75 0.00 -1.96 -3.24 119.26 113.04 3f1g h ALA 42 Ca -0.00 -0.25 -0.48 0.00 0.00 0.00 0.00 54.91 54.18 3f1g h ALA 42 Cb 0.15 -0.04 0.04 0.00 0.00 0.00 0.00 17.79 17.93 3f1g h ALA 42 CO 0.01 -0.06 0.39 0.95 0.00 0.00 0.00 179.25 180.55 3f1g s THR 43 N -4.58 3.66 0.58 0.00 -4.23 -1.23 -4.52 115.64 105.32 3f1g s THR 43 Ca -0.14 1.03 -0.13 0.00 -1.18 0.00 0.00 61.69 61.26 3f1g s THR 43 Cb 0.05 -3.41 -0.05 0.00 1.34 0.00 0.00 72.50 70.42 3f1g s THR 43 CO 0.72 -0.23 1.01 -0.13 -0.54 0.00 0.00 174.62 175.45 3f1g s ARG 44 N -3.27 3.70 0.46 3.99 1.81 -1.26 -1.60 118.95 122.78 3f1g s ARG 44 Ca 0.68 0.86 0.15 0.00 -1.72 0.00 0.00 55.73 55.70 3f1g s ARG 44 Cb -0.18 -2.10 1.11 0.00 -0.45 0.00 0.00 34.95 33.33 3f1g s ARG 44 CO 0.22 -0.48 2.03 0.28 -0.68 0.00 0.00 175.30 176.67 3f1g h VAL 45 N 0.20 0.93 0.13 3.52 2.07 -1.85 -3.10 116.25 118.15 3f1g h VAL 45 Ca -0.45 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 66.98 3f1g h VAL 45 Cb 1.19 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 3f1g h VAL 45 CO 0.61 0.05 -0.51 0.07 0.02 0.00 0.00 177.57 177.82 3f1g h LYS 46 N 0.29 -0.70 -4.92 1.57 2.10 -1.91 -3.39 116.57 109.61 3f1g h LYS 46 Ca 0.19 0.05 -0.64 0.00 -2.00 0.00 0.00 60.65 58.25 3f1g h LYS 46 Cb 0.39 0.16 -0.17 0.00 -0.90 0.00 0.00 32.23 31.71 3f1g h LYS 46 CO -0.04 -0.47 -0.49 0.16 -2.00 0.00 0.00 179.45 176.61 3f1g s ASP 47 N -4.53 6.04 -0.03 7.07 1.47 -1.17 -5.04 116.67 120.48 3f1g s ASP 47 Ca -0.16 0.00 -0.29 0.00 1.18 0.00 0.00 52.55 53.29 3f1g s ASP 47 Cb 0.06 -2.13 0.10 0.00 -0.34 0.00 0.00 42.92 40.60 3f1g s ASP 47 CO 0.58 -0.07 1.30 -1.48 0.68 0.00 0.00 175.17 176.18 3f1g s LEU 48 N 1.79 0.00 0.17 2.11 2.34 -1.26 -4.56 118.68 119.27 3f1g s LEU 48 Ca 0.08 -0.16 -0.30 0.00 0.06 0.00 0.00 54.13 53.81 3f1g s LEU 48 Cb -0.16 1.26 -0.07 0.00 -0.56 0.00 0.00 46.19 46.65 3f1g s LEU 48 CO 0.11 -0.24 1.02 -0.89 -1.06 0.00 0.00 176.35 175.29 3f1g s THR 49 N -2.03 4.12 0.49 5.48 2.01 -1.26 -4.93 115.64 119.51 3f1g s THR 49 Ca 0.29 1.87 0.14 0.00 0.31 0.00 0.00 61.69 64.30 3f1g s THR 49 Cb -0.00 -4.19 0.25 0.00 0.01 0.00 0.00 72.50 68.57 3f1g s THR 49 CO -0.01 0.34 2.11 -0.33 -0.69 0.00 0.00 174.62 176.03 3f1g h GLU 50 N 5.05 0.09 -0.08 4.92 5.08 -2.01 -1.11 114.58 126.52 3f1g h GLU 50 Ca -0.44 -0.01 -0.23 0.00 -1.00 0.00 0.00 59.36 57.69 3f1g h GLU 50 Cb 1.21 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.45 3f1g h GLU 50 CO 0.71 0.09 -0.85 0.00 -1.00 0.00 0.00 179.01 177.97 3f1g h ALA 51 N 1.92 0.34 -0.39 3.43 0.00 -1.99 -2.77 119.26 119.80 3f1g h ALA 51 Ca 0.02 -0.64 0.05 0.00 0.00 0.00 0.00 54.91 54.35 3f1g h ALA 51 Cb 0.05 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3f1g h ALA 51 CO -0.00 0.72 0.11 0.93 0.00 0.00 0.00 179.25 181.01 3f1g h GLU 52 N 0.41 0.24 0.28 0.00 5.08 -1.62 0.40 114.58 119.37 3f1g h GLU 52 Ca -0.07 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3f1g h GLU 52 Cb 1.47 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.66 3f1g h GLU 52 CO 0.16 0.16 -0.18 0.28 -1.00 0.00 0.00 179.01 178.44 3f1g h VAL 53 N 0.25 0.63 -0.89 3.13 2.07 -1.35 0.15 116.25 120.24 3f1g h VAL 53 Ca 0.18 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.74 3f1g h VAL 53 Cb 0.19 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 3f1g h VAL 53 CO -0.21 0.00 0.58 0.58 0.02 0.00 0.00 177.57 178.54 3f1g h VAL 54 N -0.44 1.14 0.44 2.57 2.07 -1.21 -0.22 116.25 120.61 3f1g h VAL 54 Ca -0.03 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 3f1g h VAL 54 Cb 0.37 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 3f1g h VAL 54 CO 0.02 0.20 -0.25 -0.09 0.02 0.00 0.00 177.57 177.48 3f1g h ARG 55 N 1.11 -0.61 -0.56 1.57 2.43 0.41 0.25 114.38 118.97 3f1g h ARG 55 Ca 0.36 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.67 3f1g h ARG 55 Cb 0.03 0.14 -0.08 0.00 -0.42 0.00 0.00 29.97 29.64 3f1g h ARG 55 CO -0.11 -0.41 0.11 -0.07 -1.51 0.00 0.00 179.97 177.99 3f1g h LEU 56 N -0.63 -0.01 0.22 3.80 -0.00 -0.59 0.18 115.31 118.28 3f1g h LEU 56 Ca -0.06 0.10 -0.00 0.00 -0.00 0.00 0.00 57.88 57.92 3f1g h LEU 56 Cb 0.50 0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 41.30 3f1g h LEU 56 CO 0.08 0.01 -0.15 -0.09 -0.00 0.00 0.00 178.44 178.29 3f1g h ARG 57 N 0.25 -0.35 -0.86 1.13 2.43 -0.99 0.31 114.38 116.30 3f1g h ARG 57 Ca 0.29 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.48 3f1g h ARG 57 Cb 0.42 0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 30.01 3f1g h ARG 57 CO -0.38 -0.23 0.50 0.93 -1.51 0.00 0.00 179.97 179.28 3f1g h GLU 58 N -0.37 1.17 0.45 0.20 4.39 0.06 0.24 114.58 120.72 3f1g h GLU 58 Ca -0.02 -0.11 -0.02 0.00 0.34 0.00 0.00 59.36 59.55 3f1g h GLU 58 Cb 0.31 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3f1g h GLU 58 CO 0.01 0.83 -0.22 -0.92 -1.16 0.00 0.00 179.01 177.55 3f1g h TYR 59 N 1.19 -0.56 -0.17 4.33 3.20 -0.40 -3.01 116.97 121.56 3f1g h TYR 59 Ca 0.31 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.18 3f1g h TYR 59 Cb -0.03 0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 3f1g h TYR 59 CO 0.01 -0.35 0.04 0.28 -1.64 0.00 0.00 178.16 176.49 3f1g h VAL 60 N -0.75 0.93 -0.24 1.81 2.07 -0.30 0.90 116.25 120.67 3f1g h VAL 60 Ca -0.06 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 3f1g h VAL 60 Cb 0.46 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3f1g h VAL 60 CO 0.10 0.02 -0.05 -0.08 0.02 0.00 0.00 177.57 177.58 3f1g h GLU 61 N 0.11 0.37 0.14 1.57 4.81 -1.10 -3.05 114.58 117.43 3f1g h GLU 61 Ca 0.07 -0.08 -0.24 0.00 -0.13 0.00 0.00 59.36 58.99 3f1g h GLU 61 Cb 0.06 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.40 3f1g h GLU 61 CO -0.09 0.44 -1.14 -0.91 -0.73 0.00 0.00 179.01 176.58 3f1g h ASN 62 N 0.36 0.46 -1.01 1.04 4.21 -1.29 -3.39 115.58 115.95 3f1g h ASN 62 Ca 0.08 -0.91 0.24 0.00 1.21 0.00 0.00 56.30 56.93 3f1g h ASN 62 Cb 0.32 -0.15 -0.11 0.00 -1.12 0.00 0.00 38.32 37.26 3f1g h ASN 62 CO 0.01 1.52 0.62 0.74 -1.29 0.00 0.00 177.43 179.03 3f1g h THR 63 N -0.30 0.56 -3.13 2.81 2.02 0.94 -3.44 112.91 112.36 3f1g h THR 63 Ca -0.23 -0.19 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 3f1g h THR 63 Cb 1.74 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 3f1g h THR 63 CO 0.12 0.10 0.22 -1.66 0.37 0.00 0.00 175.52 174.67 3f1g s TRP 64 N -5.71 0.20 0.07 3.16 -2.14 -1.24 -5.09 118.94 108.19 3f1g s TRP 64 Ca -0.10 -0.81 -0.20 0.00 2.66 0.00 0.00 56.10 57.65 3f1g s TRP 64 Cb 0.26 0.73 -0.07 0.00 -3.10 0.00 0.00 33.47 31.29 3f1g s TRP 64 CO 0.80 -1.50 0.58 -1.59 -2.66 0.00 0.00 176.95 172.58 3f1g s LYS 65 N -2.52 4.22 0.00 3.25 -2.85 -1.26 -4.78 119.74 115.80 3f1g s LYS 65 Ca 0.17 0.75 0.00 0.00 -1.00 0.00 0.00 55.97 55.89 3f1g s LYS 65 Cb -0.05 -3.25 0.00 0.00 -2.06 0.00 0.00 37.83 32.47 3f1g s LYS 65 CO 0.12 0.61 0.00 1.47 0.10 0.00 0.00 175.35 177.65 3f1g n LEU 66 N 1.83 0.00 0.00 2.77 -0.00 -1.26 -4.78 117.00 115.56 3f1g n LEU 66 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.91 3f1g n LEU 66 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.93 3f1g n LEU 66 CO 0.42 0.00 0.00 1.21 -0.00 0.00 0.00 177.39 179.02 3f1g n GLU 67 N 0.00 0.00 -0.20 1.47 4.07 -0.28 -2.44 120.64 123.26 3f1g n GLU 67 Ca 0.00 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.09 3f1g n GLU 67 Cb 0.00 0.00 0.10 0.00 -0.06 0.00 0.00 31.44 31.48 3f1g n GLU 67 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 3f1g h GLY 68 N 0.00 0.84 1.10 8.31 0.00 -1.96 -1.26 103.07 110.10 3f1g h GLY 68 Ca 0.00 -0.13 0.09 0.00 0.00 0.00 0.00 47.33 47.29 3f1g h GLY 68 CO 0.00 0.01 0.38 1.05 0.00 0.00 0.00 176.54 177.98 3f1g h GLU 69 N 0.43 0.38 0.23 4.80 4.11 -1.98 0.45 114.58 123.00 3f1g h GLU 69 Ca 0.29 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 59.69 3f1g h GLU 69 Cb 0.33 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3f1g h GLU 69 CO -0.28 0.25 -0.11 1.25 0.07 0.00 0.00 179.01 180.19 3f1g h LEU 70 N 0.39 -0.26 -1.15 3.06 6.46 -0.89 -2.86 115.31 120.07 3f1g h LEU 70 Ca 0.26 -0.04 -0.06 0.00 -0.12 0.00 0.00 57.88 57.92 3f1g h LEU 70 Cb 0.51 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.49 3f1g h LEU 70 CO -0.07 -0.13 -0.06 -0.09 -0.62 0.00 0.00 178.44 177.47 3f1g h ARG 71 N -0.37 0.52 -0.89 1.25 2.43 -0.98 -2.69 114.38 113.65 3f1g h ARG 71 Ca -0.03 -0.13 0.15 0.00 -0.81 0.00 0.00 59.98 59.16 3f1g h ARG 71 Cb 0.29 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 29.70 3f1g h ARG 71 CO 0.05 0.60 0.57 0.00 -1.51 0.00 0.00 179.97 179.68 3f1g h ALA 72 N 1.45 1.89 0.01 2.80 0.00 0.05 0.13 119.26 125.59 3f1g h ALA 72 Ca 0.10 0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.77 3f1g h ALA 72 Cb 0.41 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.11 3f1g h ALA 72 CO 0.02 -0.14 -1.02 1.49 0.00 0.00 0.00 179.25 179.60 3f1g h GLU 73 N 0.64 0.58 -0.09 0.00 4.81 -1.37 -2.79 114.58 116.37 3f1g h GLU 73 Ca 0.45 -0.64 0.03 0.00 -0.13 0.00 0.00 59.36 59.07 3f1g h GLU 73 Cb 0.79 0.18 -0.00 0.00 0.63 0.00 0.00 28.75 30.35 3f1g h GLU 73 CO -0.20 1.25 0.08 0.28 -0.73 0.00 0.00 179.01 179.69 3f1g h VAL 74 N 0.32 0.62 0.38 0.32 2.07 -0.82 1.18 116.25 120.32 3f1g h VAL 74 Ca -0.11 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 3f1g h VAL 74 Cb 1.67 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.38 3f1g h VAL 74 CO 0.19 0.00 -0.18 0.00 0.02 0.00 0.00 177.57 177.60 3f1g h ALA 75 N 1.91 -0.98 0.00 1.67 0.00 -0.58 -3.11 119.26 118.18 3f1g h ALA 75 Ca 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3f1g h ALA 75 Cb 0.21 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3f1g h ALA 75 CO -0.00 -0.94 -0.06 0.00 0.00 0.00 0.00 179.25 178.25 3f1g h ALA 76 N -1.70 1.33 -0.55 0.00 0.00 -1.14 -1.95 119.26 115.26 3f1g h ALA 76 Ca -0.05 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.86 3f1g h ALA 76 Cb 0.39 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3f1g h ALA 76 CO 0.08 0.07 0.36 -0.91 0.00 0.00 0.00 179.25 178.86 3f1g h ASN 77 N 0.00 0.46 0.02 0.00 2.35 0.14 -2.03 115.58 116.52 3f1g h ASN 77 Ca -0.00 -0.00 -0.39 0.00 -0.55 0.00 0.00 56.30 55.36 3f1g h ASN 77 Cb 0.17 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.38 3f1g h ASN 77 CO 0.01 0.30 -2.40 -0.38 -1.65 0.00 0.00 177.43 173.30 3f1g n ILE 78 N -4.47 1.53 0.33 2.81 5.41 -0.81 -3.85 119.36 120.30 3f1g n ILE 78 Ca 0.07 -0.55 0.20 0.00 1.00 0.00 0.00 62.75 63.47 3f1g n ILE 78 Cb 0.23 -1.53 1.06 0.00 -0.71 0.00 0.00 39.64 38.69 3f1g n ILE 78 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3f1g h LYS 79 N -0.13 0.00 0.21 0.38 1.57 -1.32 0.94 116.57 118.22 3f1g h LYS 79 Ca -0.57 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 57.88 3f1g h LYS 79 Cb 1.87 0.00 0.02 0.00 0.08 0.00 0.00 32.23 34.21 3f1g h LYS 79 CO -0.11 0.00 -1.48 0.07 -0.57 0.00 0.00 179.45 177.36 3f1g h ARG 80 N 0.00 0.44 0.00 3.15 0.11 -1.54 0.57 114.38 117.11 3f1g h ARG 80 Ca 0.01 -0.76 -0.02 0.00 0.10 0.00 0.00 59.98 59.31 3f1g h ARG 80 Cb 0.26 0.28 -0.00 0.00 1.11 0.00 0.00 29.97 31.61 3f1g h ARG 80 CO -0.00 1.35 -0.08 -0.07 0.10 0.00 0.00 179.97 181.27 3f1g h LEU 81 N 0.12 0.00 0.13 0.08 3.38 0.02 -2.59 115.31 116.45 3f1g h LEU 81 Ca -0.25 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 3f1g h LEU 81 Cb 2.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.86 3f1g h LEU 81 CO 0.24 0.08 -0.06 -0.03 0.09 0.00 0.00 178.44 178.75 3f1g h MET 82 N 0.00 -0.17 -0.57 1.13 4.05 0.76 -1.21 114.93 118.92 3f1g h MET 82 Ca -0.00 0.01 0.11 0.00 -0.28 0.00 0.00 59.70 59.54 3f1g h MET 82 Cb 0.17 0.04 -0.11 0.00 -0.80 0.00 0.00 31.60 30.90 3f1g h MET 82 CO 0.01 -0.06 -0.29 0.22 0.23 0.00 0.00 176.91 177.02 3f1g h ASP 83 N -1.04 -1.01 0.00 1.39 3.58 0.25 -2.41 116.42 117.18 3f1g h ASP 83 Ca -0.02 0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.64 3f1g h ASP 83 Cb 0.20 0.52 0.00 0.00 1.72 0.00 0.00 39.33 41.77 3f1g h ASP 83 CO 0.03 -0.29 -0.00 -0.29 -2.88 0.00 0.00 179.24 175.81 3f1g h ILE 84 N -0.14 1.75 -2.36 2.25 6.09 -1.65 -3.50 117.51 119.95 3f1g h ILE 84 Ca 0.24 -2.22 0.00 0.00 -1.37 0.00 0.00 64.86 61.51 3f1g h ILE 84 Cb 0.53 3.25 0.00 0.00 0.47 0.00 0.00 36.82 41.07 3f1g h ILE 84 CO -0.65 0.57 0.00 0.61 -3.07 0.00 0.00 178.15 175.61 3f1g n GLY 85 N 1.47 -1.22 0.00 8.18 0.00 -0.46 -5.10 105.19 108.07 3f1g n GLY 85 Ca -0.10 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.64 3f1g n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f1g h TYR 87 N -0.43 -0.08 -0.08 0.00 3.20 -2.00 -2.51 116.97 115.07 3f1g h TYR 87 Ca 0.00 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 3f1g h TYR 87 Cb 0.00 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 3f1g h TYR 87 CO 0.00 0.19 0.14 0.00 -1.64 0.00 0.00 178.16 176.85 3f1g h ARG 88 N -0.36 0.00 0.24 1.82 3.08 -1.94 -2.67 114.38 114.56 3f1g h ARG 88 Ca -0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3f1g h ARG 88 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3f1g h ARG 88 CO 0.02 0.00 -0.12 0.78 -1.07 0.00 0.00 179.97 179.58 3f1g h GLY 89 N 0.00 -0.34 1.68 0.04 0.00 -1.65 -3.34 103.07 99.46 3f1g h GLY 89 Ca 0.04 0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.52 3f1g h GLY 89 CO -0.00 -0.12 0.14 1.41 0.00 0.00 0.00 176.54 177.96 3f1g h LEU 90 N -1.06 0.00 -1.23 3.11 3.38 -1.11 0.11 115.31 118.51 3f1g h LEU 90 Ca -0.03 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 3f1g h LEU 90 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3f1g h LEU 90 CO 0.05 0.00 -0.09 0.03 0.09 0.00 0.00 178.44 178.52 3f1g h ARG 91 N 0.00 0.42 0.00 1.13 2.47 -1.64 -0.07 114.38 116.69 3f1g h ARG 91 Ca 0.04 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 3f1g h ARG 91 Cb 0.31 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.58 3f1g h ARG 91 CO -0.00 0.52 -0.32 0.45 0.56 0.00 0.00 179.97 181.19 3f1g h HIS 92 N 0.39 0.00 -0.05 3.04 3.86 -0.94 0.26 115.15 121.71 3f1g h HIS 92 Ca 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 3f1g h HIS 92 Cb 0.41 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.88 3f1g h HIS 92 CO 0.01 0.00 0.00 0.54 0.86 0.00 0.00 177.93 179.34 3f1g n ARG 93 N -2.28 1.25 -0.08 2.45 3.00 -0.11 -3.78 116.66 117.11 3f1g n ARG 93 Ca 0.04 -0.38 0.00 0.00 -0.01 0.00 0.00 57.85 57.51 3f1g n ARG 93 Cb 0.45 -1.33 0.00 0.00 0.00 0.00 0.00 32.46 31.57 3f1g n ARG 93 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 3f1g n ARG 94 N -0.41 0.00 -0.62 5.56 0.63 -0.75 -5.00 116.66 116.07 3f1g n ARG 94 Ca 0.15 -0.25 0.00 0.00 -0.92 0.00 0.00 57.85 56.83 3f1g n ARG 94 Cb 0.16 -0.22 0.00 0.00 0.45 0.00 0.00 32.46 32.85 3f1g n ARG 94 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3f1g n GLY 95 N 0.00 0.08 3.81 5.14 0.00 -0.57 -4.94 105.19 108.71 3f1g n GLY 95 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3f1g n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f1g s LEU 96 N 0.00 3.39 1.16 0.99 1.43 0.83 -4.27 118.68 122.21 3f1g s LEU 96 Ca 0.00 1.74 -0.15 0.00 -1.03 0.00 0.00 54.13 54.68 3f1g s LEU 96 Cb 0.00 -4.52 0.22 0.00 0.03 0.00 0.00 46.19 41.92 3f1g s LEU 96 CO 0.00 -1.21 0.60 -0.81 0.23 0.00 0.00 176.35 175.17 3f1g n PRO 97 N -2.34 -2.18 0.00 1.29 -0.04 -1.26 -4.22 135.00 126.26 3f1g n PRO 97 Ca 0.08 -0.61 0.05 0.00 -0.04 0.00 0.00 63.50 62.98 3f1g n PRO 97 Cb 0.53 -1.97 -0.01 0.00 -0.04 0.00 0.00 33.50 32.01 3f1g n PRO 97 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3f1g n VAL 98 N -4.78 0.00 -0.36 0.52 0.31 -1.26 -4.49 118.33 108.27 3f1g n VAL 98 Ca 0.02 -0.36 0.09 0.00 -0.01 0.00 0.00 64.34 64.08 3f1g n VAL 98 Cb 0.57 1.11 0.27 0.00 -0.91 0.00 0.00 33.84 34.89 3f1g n VAL 98 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3f1g n ARG 99 N -0.38 2.91 -1.48 5.55 3.00 -1.26 -4.94 116.66 120.06 3f1g n ARG 99 Ca 0.04 -2.50 -0.17 0.00 -0.01 0.00 0.00 57.85 55.21 3f1g n ARG 99 Cb 0.22 -1.52 -0.07 0.00 0.00 0.00 0.00 32.46 31.09 3f1g n ARG 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3f1g n GLY 100 N 1.15 1.59 0.00 -0.13 0.00 -1.26 -4.94 105.19 101.60 3f1g n GLY 100 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3f1g n GLY 100 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3f1g n GLN 101 N -1.79 2.69 -2.64 1.61 6.02 -1.26 -4.82 117.38 117.19 3f1g n GLN 101 Ca -0.17 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.39 3f1g n GLN 101 Cb 0.63 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.86 3f1g n GLN 101 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3f1g s ARG 102 N 0.00 4.14 -0.14 -1.09 1.81 -1.26 -4.85 118.95 117.56 3f1g s ARG 102 Ca 0.00 1.20 0.10 0.00 -1.72 0.00 0.00 55.73 55.30 3f1g s ARG 102 Cb 0.00 -3.70 -0.15 0.00 -0.45 0.00 0.00 34.95 30.65 3f1g s ARG 102 CO 0.00 -0.80 0.01 0.25 -0.68 0.00 0.00 175.30 174.08 3f1g n THR 103 N 5.66 0.91 0.39 0.02 -2.24 -1.26 -4.03 114.28 113.73 3f1g n THR 103 Ca 0.12 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3f1g n THR 103 Cb 0.47 -0.74 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 3f1g n THR 103 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3f1g n ARG 104 N -2.58 0.26 -3.57 -0.78 0.63 -1.26 -4.67 116.66 104.69 3f1g n ARG 104 Ca -0.23 0.00 0.03 0.00 -0.92 0.00 0.00 57.85 56.73 3f1g n ARG 104 Cb 0.90 -1.06 -0.00 0.00 0.45 0.00 0.00 32.46 32.75 3f1g n ARG 104 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3f1g s THR 105 N -1.51 0.00 0.00 5.15 -4.23 -1.26 -5.15 115.64 108.63 3f1g s THR 105 Ca 0.00 -0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.46 3f1g s THR 105 Cb 0.00 -1.93 0.00 0.00 1.34 0.00 0.00 72.50 71.91 3f1g s THR 105 CO 0.00 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 174.67 3f1g n ASN 106 N -0.47 0.00 -1.01 3.99 4.13 -1.26 -4.74 115.26 115.90 3f1g n ASN 106 Ca -0.09 0.00 -0.13 0.00 1.68 0.00 0.00 54.58 56.04 3f1g n ASN 106 Cb 0.63 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.82 3f1g n ASN 106 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3f1g n ALA 107 N 4.22 -0.20 0.10 5.41 0.00 -1.26 -4.84 120.51 123.95 3f1g n ALA 107 Ca 0.00 0.21 0.14 0.00 0.00 0.00 0.00 53.44 53.79 3f1g n ALA 107 Cb 0.00 -1.82 0.64 0.00 0.00 0.00 0.00 19.45 18.27 3f1g n ALA 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3f1g h ARG 108 N 0.00 0.07 -0.77 0.00 -0.00 -1.86 -2.39 114.38 109.43 3f1g h ARG 108 Ca -0.27 -0.00 0.14 0.00 -0.50 0.00 0.00 59.98 59.35 3f1g h ARG 108 Cb 1.20 -0.02 -0.09 0.00 0.00 0.00 0.00 29.97 31.06 3f1g h ARG 108 CO 0.39 0.04 0.33 1.15 0.00 0.00 0.00 179.97 181.88 3f1g h THR 109 N 0.07 0.67 0.00 2.04 2.02 -1.89 1.07 112.91 116.89 3f1g h THR 109 Ca 0.15 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 3f1g h THR 109 Cb 0.51 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.06 3f1g h THR 109 CO -0.01 0.09 -1.15 0.54 0.37 0.00 0.00 175.52 175.36 3f1g n ARG 110 N -4.98 0.61 0.17 6.66 1.74 -0.97 -4.14 116.66 115.76 3f1g n ARG 110 Ca 0.15 0.11 0.11 0.00 -0.77 0.00 0.00 57.85 57.45 3f1g n ARG 110 Cb 0.42 -1.80 0.10 0.00 -1.02 0.00 0.00 32.46 30.16 3f1g n ARG 110 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3f1g h LYS 111 N 0.00 0.00 0.00 5.56 1.57 -0.59 -3.43 116.57 119.67 3f1g h LYS 111 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3f1g h LYS 111 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.39 3f1g h LYS 111 CO 0.01 0.02 0.00 0.41 -0.57 0.00 0.00 179.45 179.32 3f1g n GLY 112 N 1.14 -1.21 3.72 3.86 0.00 0.35 -4.94 105.19 108.11 3f1g n GLY 112 Ca 0.02 -1.61 -0.32 0.00 0.00 0.00 0.00 46.02 44.12 3f1g n GLY 112 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3f1g s PRO 113 N 0.00 1.84 0.68 1.61 0.04 -1.26 -4.63 135.00 133.27 3f1g s PRO 113 Ca 0.00 1.48 -0.14 0.00 0.04 0.00 0.00 61.00 62.38 3f1g s PRO 113 Cb 0.00 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.72 3f1g s PRO 113 CO 0.00 -2.00 1.11 1.03 0.04 0.00 0.00 177.00 177.17 3f1g s ARG 114 N -4.47 2.70 0.00 4.56 0.52 -1.26 -4.98 118.95 116.02 3f1g s ARG 114 Ca 0.67 1.35 0.00 0.00 -0.52 0.00 0.00 55.73 57.23 3f1g s ARG 114 Cb -0.22 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.30 3f1g s ARG 114 CO 0.52 -1.32 0.42 1.63 0.02 0.00 0.00 175.30 176.57 3f1g n LYS 115 N -2.61 -0.51 0.00 3.54 4.01 -1.26 -5.07 118.16 116.26 3f1g n LYS 115 Ca 0.10 -0.45 0.00 0.00 -0.51 0.00 0.00 58.31 57.45 3f1g n LYS 115 Cb 0.52 -0.88 0.00 0.00 -0.51 0.00 0.00 35.03 34.16 3f1g n LYS 115 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 3f1g n THR 116 N -0.03 0.00 -2.04 -0.18 -1.04 -1.26 -4.94 114.28 104.79 3f1g n THR 116 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3f1g n THR 116 Cb 0.08 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 3f1g n THR 116 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3f1g n VAL 117 N 0.00-12.01 0.00 12.58 0.31 -1.26 -5.33 118.33 112.61 3f1g n VAL 117 Ca 0.00 2.85 0.00 0.00 -0.01 0.00 0.00 64.34 67.18 3f1g n VAL 117 Cb 0.00 -5.45 0.00 0.00 -0.91 0.00 0.00 33.84 27.48 3f1g n VAL 117 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51