#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fic s ARG 3 N 0.00 2.50 -0.13 0.00 0.52 -1.26 -4.57 118.95 116.01 3fic s ARG 3 Ca 0.00 0.86 -0.26 0.00 -0.52 0.00 0.00 55.73 55.81 3fic s ARG 3 Cb 0.00 -4.44 -0.26 0.00 0.52 0.00 0.00 34.95 30.77 3fic s ARG 3 CO 0.00 -2.86 0.72 0.82 0.02 0.00 0.00 175.30 174.00 3fic h ILE 4 N 7.11 1.59 -2.39 1.52 1.08 -1.94 -3.48 117.51 120.99 3fic h ILE 4 Ca -0.26 -2.38 -0.53 0.00 -0.39 0.00 0.00 64.86 61.30 3fic h ILE 4 Cb 1.19 3.18 -0.14 0.00 -3.07 0.00 0.00 36.82 37.99 3fic h ILE 4 CO 1.20 0.61 -0.62 0.00 -0.69 0.00 0.00 178.15 178.64 3fic s ALA 5 N -2.30 2.64 0.00 1.87 0.00 -1.25 -4.78 121.76 117.94 3fic s ALA 5 Ca -0.19 -2.11 0.00 0.00 0.00 0.00 0.00 51.96 49.66 3fic s ALA 5 Cb -0.01 0.38 0.00 0.00 0.00 0.00 0.00 23.12 23.49 3fic s ALA 5 CO 0.71 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.70 3fic n GLY 6 N -0.76 0.00 1.96 0.00 0.00 -1.26 -0.83 105.19 104.31 3fic n GLY 6 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.95 3fic n GLY 6 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3fic n VAL 7 N 0.00 1.33 -4.76 1.61 0.31 -1.26 -5.08 118.33 110.49 3fic n VAL 7 Ca 0.00 -2.72 -0.33 0.00 -0.01 0.00 0.00 64.34 61.28 3fic n VAL 7 Cb 0.00 0.48 -0.13 0.00 -0.91 0.00 0.00 33.84 33.28 3fic n VAL 7 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3fic s GLU 8 N -2.65 2.99 -0.30 5.55 2.02 -0.01 -5.09 118.70 121.22 3fic s GLU 8 Ca 0.36 -0.65 -0.03 0.00 0.02 0.00 0.00 54.97 54.67 3fic s GLU 8 Cb 0.37 -2.56 0.11 0.00 0.10 0.00 0.00 34.13 32.15 3fic s GLU 8 CO -0.06 0.44 0.18 0.42 0.02 0.00 0.00 175.26 176.26 3fic s ILE 9 N -0.23 -0.13 0.93 -1.63 1.09 -1.26 -2.80 121.20 117.16 3fic s ILE 9 Ca 0.02 -0.81 -0.12 0.00 -1.10 0.00 0.00 60.65 58.64 3fic s ILE 9 Cb -0.13 -0.99 0.15 0.00 -1.06 0.00 0.00 42.46 40.43 3fic s ILE 9 CO 0.03 -0.69 1.09 -2.16 -0.10 0.00 0.00 174.94 173.11 3fic s PRO 10 N 2.03 1.00 0.27 2.79 0.04 -1.26 -4.85 135.00 135.01 3fic s PRO 10 Ca 0.10 0.70 0.01 0.00 0.04 0.00 0.00 61.00 61.84 3fic s PRO 10 Cb -0.16 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 3fic s PRO 10 CO -0.31 -2.39 0.26 1.03 0.04 0.00 0.00 177.00 175.64 3fic s ARG 11 N -4.96 1.52 0.00 4.56 0.52 -1.26 -4.30 118.95 115.03 3fic s ARG 11 Ca 0.64 -1.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.10 3fic s ARG 11 Cb -0.18 0.33 0.00 0.00 0.52 0.00 0.00 34.95 35.62 3fic s ARG 11 CO 0.57 -0.56 0.00 0.09 0.02 0.00 0.00 175.30 175.42 3fic n ASN 12 N -0.87 0.00 -3.26 0.23 3.02 -1.26 -4.70 115.26 108.41 3fic n ASN 12 Ca 0.03 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.39 3fic n ASN 12 Cb 0.64 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.73 3fic n ASN 12 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3fic n LYS 13 N -0.22 0.42 -3.16 3.52 5.02 -1.26 -4.89 118.16 117.59 3fic n LYS 13 Ca 0.00 -3.33 -0.39 0.00 -2.02 0.00 0.00 58.31 52.57 3fic n LYS 13 Cb 0.00 2.69 -0.05 0.00 -0.02 0.00 0.00 35.03 37.64 3fic n LYS 13 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3fic s ARG 14 N -3.36 4.39 0.29 1.97 1.70 -1.26 -0.18 118.95 122.50 3fic s ARG 14 Ca 0.39 0.70 0.13 0.00 -0.47 0.00 0.00 55.73 56.48 3fic s ARG 14 Cb 0.02 -3.43 0.98 0.00 -0.57 0.00 0.00 34.95 31.94 3fic s ARG 14 CO 0.27 0.13 1.30 1.33 -1.08 0.00 0.00 175.30 177.25 3fic n VAL 15 N 3.65 -0.35 0.11 4.99 0.24 -1.03 0.51 118.33 126.46 3fic n VAL 15 Ca -0.04 1.72 0.17 0.00 -2.04 0.00 0.00 64.34 64.15 3fic n VAL 15 Cb 0.51 -2.71 0.73 0.00 -1.47 0.00 0.00 33.84 30.91 3fic n VAL 15 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 3fic h ASP 16 N 0.00 0.00 0.04 -1.34 -0.00 -1.88 -1.34 116.42 111.90 3fic h ASP 16 Ca 0.64 0.00 -0.37 0.00 -0.00 0.00 0.00 57.03 57.30 3fic h ASP 16 Cb 1.62 0.00 -0.06 0.00 -0.00 0.00 0.00 39.33 40.89 3fic h ASP 16 CO -0.68 0.00 -2.36 0.52 -0.00 0.00 0.00 179.24 176.72 3fic n VAL 17 N -4.16 1.49 0.00 4.15 0.31 0.18 -4.52 118.33 115.78 3fic n VAL 17 Ca 0.05 -0.69 0.00 0.00 -0.01 0.00 0.00 64.34 63.68 3fic n VAL 17 Cb 0.44 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 3fic n VAL 17 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fic n ALA 18 N -3.01 0.00 -0.12 3.52 0.00 -0.25 -2.44 120.51 118.20 3fic n ALA 18 Ca -0.38 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.16 3fic n ALA 18 Cb 1.06 0.12 0.19 0.00 0.00 0.00 0.00 19.45 20.81 3fic n ALA 18 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3fic n LEU 19 N -0.71 0.08 -0.37 0.00 7.99 -0.77 0.16 117.00 123.38 3fic n LEU 19 Ca 0.00 0.62 0.31 0.00 -0.01 0.00 0.00 56.01 56.93 3fic n LEU 19 Cb 0.00 -0.28 0.58 0.00 -0.11 0.00 0.00 43.42 43.61 3fic n LEU 19 CO 0.00 -0.68 1.15 0.74 -1.51 0.00 0.00 177.39 177.09 3fic h THR 20 N 0.00 0.15 0.00 -5.08 2.02 -1.65 0.36 112.91 108.71 3fic h THR 20 Ca 0.29 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.42 3fic h THR 20 Cb 0.73 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 3fic h THR 20 CO -0.31 0.03 0.00 -1.22 0.37 0.00 0.00 175.52 174.39 3fic n TYR 21 N -4.97 0.00 -4.94 3.16 0.53 0.42 -4.66 117.16 106.70 3fic n TYR 21 Ca 0.36 -0.13 -0.26 0.00 -1.02 0.00 0.00 57.90 56.85 3fic n TYR 21 Cb 1.24 -0.11 -0.15 0.00 -1.03 0.00 0.00 39.34 39.29 3fic n TYR 21 CO 0.00 0.00 0.00 0.42 -1.02 0.00 0.00 176.86 176.26 3fic s ILE 22 N -0.21 1.55 -0.28 -0.72 1.01 0.13 -4.85 121.20 117.83 3fic s ILE 22 Ca 0.00 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.51 3fic s ILE 22 Cb 0.00 -1.29 -0.01 0.00 0.01 0.00 0.00 42.46 41.17 3fic s ILE 22 CO 0.00 0.43 1.52 -0.47 0.00 0.00 0.00 174.94 176.41 3fic s TYR 23 N -0.47 2.28 0.00 3.97 6.14 -1.26 -1.97 117.35 126.03 3fic s TYR 23 Ca 0.07 0.66 0.00 0.00 0.64 0.00 0.00 57.07 58.44 3fic s TYR 23 Cb -0.08 -4.02 0.00 0.00 0.42 0.00 0.00 41.96 38.28 3fic s TYR 23 CO -0.01 -2.47 0.00 0.41 0.64 0.00 0.00 175.55 174.13 3fic n GLY 24 N 4.69 2.46 3.38 8.97 0.00 -1.26 -0.43 105.19 123.01 3fic n GLY 24 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 3fic n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fic s ILE 25 N -2.26 4.38 0.00 -0.61 1.09 -0.83 -4.49 121.20 118.48 3fic s ILE 25 Ca 0.00 -0.71 0.00 0.00 -1.10 0.00 0.00 60.65 58.84 3fic s ILE 25 Cb 0.00 -3.34 0.00 0.00 -1.06 0.00 0.00 42.46 38.06 3fic s ILE 25 CO 0.00 -0.07 0.00 0.61 -0.10 0.00 0.00 174.94 175.38 3fic n GLY 26 N 4.95 2.38 0.10 6.18 0.00 -1.26 -4.19 105.19 113.34 3fic n GLY 26 Ca -0.13 -1.89 -0.14 0.00 0.00 0.00 0.00 46.02 43.85 3fic n GLY 26 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3fic h LYS 27 N 0.00 0.21 0.00 1.61 1.63 -1.95 -3.13 116.57 114.95 3fic h LYS 27 Ca 0.00 -0.36 0.00 0.00 -0.85 0.00 0.00 60.65 59.44 3fic h LYS 27 Cb 0.00 0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.76 3fic h LYS 27 CO 0.00 1.14 0.00 0.00 -3.45 0.00 0.00 179.45 177.14 3fic n ALA 28 N -2.52 -0.16 0.29 5.00 0.00 -1.26 -2.59 120.51 119.27 3fic n ALA 28 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.43 3fic n ALA 28 Cb 1.01 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.88 3fic n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fic h ARG 29 N 0.00 0.00 0.62 0.00 3.08 -1.93 0.12 114.38 116.26 3fic h ARG 29 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 3fic h ARG 29 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.06 3fic h ARG 29 CO 0.00 0.00 -0.30 0.00 -1.07 0.00 0.00 179.97 178.60 3fic h ALA 30 N 0.77 -1.03 0.00 0.04 0.00 -1.44 -2.32 119.26 115.29 3fic h ALA 30 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3fic h ALA 30 Cb 1.16 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3fic h ALA 30 CO 0.00 -0.97 0.00 1.63 0.00 0.00 0.00 179.25 179.91 3fic n LYS 31 N -4.64 0.02 0.08 0.00 5.02 0.27 -1.38 118.16 117.53 3fic n LYS 31 Ca -0.10 0.21 0.13 0.00 -2.02 0.00 0.00 58.31 56.53 3fic n LYS 31 Cb 0.33 -1.50 0.47 0.00 -0.02 0.00 0.00 35.03 34.30 3fic n LYS 31 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3fic n GLU 32 N -1.48 0.18 -2.96 1.97 0.00 -0.37 -3.45 120.64 114.52 3fic n GLU 32 Ca 0.04 0.18 -0.31 0.00 0.00 0.00 0.00 57.16 57.07 3fic n GLU 32 Cb 0.19 -1.72 -0.03 0.00 0.00 0.00 0.00 31.44 29.88 3fic n GLU 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3fic n ALA 33 N -1.70 4.90 0.00 4.31 0.00 -0.48 -4.17 120.51 123.36 3fic n ALA 33 Ca 0.06 -4.71 0.00 0.00 0.00 0.00 0.00 53.44 48.79 3fic n ALA 33 Cb 0.38 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3fic n ALA 33 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3fic n LEU 34 N 0.06 0.00 0.13 0.00 4.77 -1.22 -4.42 117.00 116.32 3fic n LEU 34 Ca 0.34 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 3fic n LEU 34 Cb 0.36 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.57 3fic n LEU 34 CO 0.41 0.00 0.39 1.05 -1.33 0.00 0.00 177.39 177.91 3fic h GLU 35 N 0.00 0.00 0.00 3.23 4.11 -1.72 -2.49 114.58 117.70 3fic h GLU 35 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 3fic h GLU 35 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3fic h GLU 35 CO 0.00 0.00 -1.26 1.63 0.07 0.00 0.00 179.01 179.45 3fic n LYS 36 N -2.65 1.37 -0.07 1.06 4.76 -1.26 -4.80 118.16 116.57 3fic n LYS 36 Ca 0.02 -0.03 -0.06 0.00 -2.87 0.00 0.00 58.31 55.38 3fic n LYS 36 Cb 0.51 -1.12 -0.02 0.00 -1.84 0.00 0.00 35.03 32.57 3fic n LYS 36 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3fic n THR 37 N -1.86 1.43 -0.51 -0.18 -2.24 -1.25 -5.08 114.28 104.58 3fic n THR 37 Ca -0.03 0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 3fic n THR 37 Cb 0.33 -2.37 0.00 0.00 -2.10 0.00 0.00 70.33 66.19 3fic n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fic n GLY 38 N 1.60 -0.25 3.42 3.38 0.00 -0.94 -4.95 105.19 107.45 3fic n GLY 38 Ca -0.09 -0.50 -0.16 0.00 0.00 0.00 0.00 46.02 45.27 3fic n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fic s ILE 39 N -0.22 0.02 -0.40 -0.61 1.01 -1.26 -5.07 121.20 114.67 3fic s ILE 39 Ca 0.00 -0.18 -0.23 0.00 0.00 0.00 0.00 60.65 60.23 3fic s ILE 39 Cb 0.00 -0.90 0.02 0.00 0.01 0.00 0.00 42.46 41.58 3fic s ILE 39 CO 0.00 -0.10 0.79 0.21 0.00 0.00 0.00 174.94 175.84 3fic s ASN 40 N -1.47 6.49 0.37 3.58 2.47 -1.26 -4.94 114.94 120.19 3fic s ASN 40 Ca -0.10 0.16 0.15 0.00 0.42 0.00 0.00 52.86 53.49 3fic s ASN 40 Cb -0.01 -2.39 1.02 0.00 -1.45 0.00 0.00 41.25 38.41 3fic s ASN 40 CO 0.05 -0.82 1.76 -0.65 -3.72 0.00 0.00 177.10 173.72 3fic h PRO 41 N 8.71 0.46 0.00 0.43 0.11 -2.00 -1.59 132.00 138.12 3fic h PRO 41 Ca -0.25 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3fic h PRO 41 Cb 1.09 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3fic h PRO 41 CO 0.94 0.30 0.03 0.00 -0.21 0.00 0.00 178.00 179.06 3fic n ALA 42 N -2.42 1.09 -2.34 -0.75 0.00 -1.26 -3.78 120.51 111.06 3fic n ALA 42 Ca 0.26 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.30 3fic n ALA 42 Cb 0.82 -0.86 -0.05 0.00 0.00 0.00 0.00 19.45 19.36 3fic n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3fic s THR 43 N -2.31 4.72 0.53 0.00 -4.23 -0.60 -4.88 115.64 108.87 3fic s THR 43 Ca 0.00 1.49 -0.18 0.00 -1.18 0.00 0.00 61.69 61.82 3fic s THR 43 Cb 0.00 -4.04 -0.07 0.00 1.34 0.00 0.00 72.50 69.73 3fic s THR 43 CO 0.00 0.43 1.03 -0.13 -0.54 0.00 0.00 174.62 175.41 3fic s ARG 44 N -0.41 3.69 0.00 3.99 1.81 -1.26 -2.45 118.95 124.32 3fic s ARG 44 Ca 0.35 1.21 0.18 0.00 -1.72 0.00 0.00 55.73 55.75 3fic s ARG 44 Cb -0.20 -2.09 0.78 0.00 -0.45 0.00 0.00 34.95 32.99 3fic s ARG 44 CO 0.21 -0.51 1.56 0.28 -0.68 0.00 0.00 175.30 176.16 3fic n VAL 45 N -1.43 0.74 0.02 3.52 0.31 0.75 -3.02 118.33 119.21 3fic n VAL 45 Ca 0.08 0.18 -0.12 0.00 -0.01 0.00 0.00 64.34 64.48 3fic n VAL 45 Cb 0.53 -0.88 -0.09 0.00 -0.91 0.00 0.00 33.84 32.49 3fic n VAL 45 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 3fic h LYS 46 N 0.00 -0.12 -5.26 5.55 2.10 -1.92 -3.44 116.57 113.48 3fic h LYS 46 Ca 0.00 0.01 -0.64 0.00 -2.00 0.00 0.00 60.65 58.02 3fic h LYS 46 Cb 0.28 0.03 -0.21 0.00 -0.90 0.00 0.00 32.23 31.42 3fic h LYS 46 CO 0.00 0.40 -0.65 0.16 -2.00 0.00 0.00 179.45 177.36 3fic s ASP 47 N -5.64 4.90 0.00 7.07 1.47 -1.17 -5.06 116.67 118.25 3fic s ASP 47 Ca -0.14 -0.12 0.00 0.00 1.18 0.00 0.00 52.55 53.46 3fic s ASP 47 Cb 0.00 -1.81 0.00 0.00 -0.34 0.00 0.00 42.92 40.77 3fic s ASP 47 CO 0.56 0.15 0.00 0.00 0.68 0.00 0.00 175.17 176.56 3fic n LEU 48 N 3.69 0.00 -3.06 2.11 -0.00 -1.26 -4.32 117.00 114.16 3fic n LEU 48 Ca -0.17 0.00 -0.35 0.00 -0.00 0.00 0.00 56.01 55.49 3fic n LEU 48 Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.91 3fic n LEU 48 CO 0.33 0.00 0.10 0.41 -0.00 0.00 0.00 177.39 178.23 3fic n THR 49 N -0.23 1.01 -0.20 1.47 -1.04 -1.26 -4.80 114.28 109.22 3fic n THR 49 Ca 0.00 -0.25 0.02 0.00 -2.04 0.00 0.00 64.05 61.77 3fic n THR 49 Cb 0.00 0.00 0.27 0.00 -1.82 0.00 0.00 70.33 68.78 3fic n THR 49 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3fic h GLU 50 N 1.07 0.92 -0.38 -2.82 4.39 -2.01 -2.26 114.58 113.49 3fic h GLU 50 Ca -0.24 -0.06 -0.14 0.00 0.34 0.00 0.00 59.36 59.27 3fic h GLU 50 Cb 0.99 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.43 3fic h GLU 50 CO 0.41 0.61 -0.32 0.00 -1.16 0.00 0.00 179.01 178.55 3fic h ALA 51 N 1.56 0.55 -0.65 3.43 0.00 -2.00 -3.13 119.26 119.01 3fic h ALA 51 Ca 0.27 -0.43 0.13 0.00 0.00 0.00 0.00 54.91 54.89 3fic h ALA 51 Cb -0.06 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.51 3fic h ALA 51 CO -0.07 0.60 0.10 0.93 0.00 0.00 0.00 179.25 180.81 3fic h GLU 52 N 0.69 0.20 -0.46 0.00 5.08 -1.74 0.41 114.58 118.76 3fic h GLU 52 Ca 0.07 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.49 3fic h GLU 52 Cb 0.90 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 30.05 3fic h GLU 52 CO 0.08 0.13 0.10 0.28 -1.00 0.00 0.00 179.01 178.61 3fic h VAL 53 N 0.21 0.76 0.83 3.13 2.07 -1.48 0.34 116.25 122.10 3fic h VAL 53 Ca 0.35 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.75 3fic h VAL 53 Cb 0.56 0.50 0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3fic h VAL 53 CO -0.48 0.04 -0.40 0.58 0.02 0.00 0.00 177.57 177.33 3fic h VAL 54 N 0.24 0.00 -0.51 2.57 2.07 -0.62 1.21 116.25 121.21 3fic h VAL 54 Ca 0.23 -0.10 0.15 0.00 0.82 0.00 0.00 66.70 67.79 3fic h VAL 54 Cb 0.29 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 3fic h VAL 54 CO -0.29 0.00 0.58 -0.09 0.02 0.00 0.00 177.57 177.79 3fic h ARG 55 N -1.22 0.00 0.01 1.57 2.43 -0.14 1.89 114.38 118.93 3fic h ARG 55 Ca -0.11 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3fic h ARG 55 Cb 0.86 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.41 3fic h ARG 55 CO 0.19 0.00 -0.01 1.25 -1.51 0.00 0.00 179.97 179.89 3fic h LEU 56 N 0.00 -0.01 -0.92 3.80 7.12 0.48 -2.89 115.31 122.89 3fic h LEU 56 Ca 0.24 0.00 0.25 0.00 0.13 0.00 0.00 57.88 58.50 3fic h LEU 56 Cb 1.40 0.00 -0.14 0.00 -0.53 0.00 0.00 40.66 41.39 3fic h LEU 56 CO -0.00 0.03 0.38 -0.09 -0.13 0.00 0.00 178.44 178.63 3fic h ARG 57 N -0.10 0.30 0.06 1.25 2.43 0.30 -0.62 114.38 118.00 3fic h ARG 57 Ca -0.00 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3fic h ARG 57 Cb 0.01 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 3fic h ARG 57 CO 0.00 0.20 -0.10 0.93 -1.51 0.00 0.00 179.97 179.49 3fic h GLU 58 N 0.31 -0.17 -0.23 0.20 4.39 0.28 -0.95 114.58 118.41 3fic h GLU 58 Ca 0.60 0.01 0.03 0.00 0.34 0.00 0.00 59.36 60.34 3fic h GLU 58 Cb 1.23 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.87 3fic h GLU 58 CO -0.60 -0.11 -0.29 -0.92 -1.16 0.00 0.00 179.01 175.94 3fic h TYR 59 N -0.17 -0.89 0.00 4.33 3.20 -1.02 0.38 116.97 122.80 3fic h TYR 59 Ca -0.01 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 3fic h TYR 59 Cb 0.16 0.42 0.00 0.00 1.54 0.00 0.00 36.73 38.84 3fic h TYR 59 CO -0.20 -0.25 0.00 0.28 -1.64 0.00 0.00 178.16 176.35 3fic n VAL 60 N -4.08 0.00 -0.12 1.81 0.31 -0.35 0.56 118.33 116.45 3fic n VAL 60 Ca -0.02 1.14 -0.04 0.00 -0.01 0.00 0.00 64.34 65.41 3fic n VAL 60 Cb 0.17 -1.69 0.03 0.00 -0.91 0.00 0.00 33.84 31.45 3fic n VAL 60 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3fic h GLU 61 N 0.00 0.16 0.94 5.55 4.81 -1.14 -3.20 114.58 121.71 3fic h GLU 61 Ca 0.00 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 3fic h GLU 61 Cb 0.00 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 29.35 3fic h GLU 61 CO 0.00 0.11 -0.48 -0.97 -0.73 0.00 0.00 179.01 176.93 3fic h ASN 62 N 0.17 -1.17 0.00 1.04 -1.24 -0.00 -3.38 115.58 111.00 3fic h ASN 62 Ca 0.20 0.05 0.00 0.00 0.71 0.00 0.00 56.30 57.26 3fic h ASN 62 Cb 0.26 0.31 0.00 0.00 0.73 0.00 0.00 38.32 39.62 3fic h ASN 62 CO -0.29 -0.80 0.00 0.41 -1.29 0.00 0.00 177.43 175.46 3fic n THR 63 N -5.66 0.00 0.00 -3.57 -1.04 0.19 -4.86 114.28 99.35 3fic n THR 63 Ca -0.16 0.66 0.00 0.00 -2.04 0.00 0.00 64.05 62.51 3fic n THR 63 Cb 0.52 -1.08 0.00 0.00 -1.82 0.00 0.00 70.33 67.96 3fic n THR 63 CO 0.00 0.00 0.00 -2.67 -0.64 0.00 0.00 175.07 171.76 3fic n TRP 64 N -0.54 0.00 -3.16 -1.42 2.14 -1.25 -5.12 117.44 108.08 3fic n TRP 64 Ca 0.00 0.00 0.03 0.00 2.07 0.00 0.00 57.50 59.60 3fic n TRP 64 Cb 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 31.31 30.50 3fic n TRP 64 CO 0.00 0.00 0.00 -1.59 2.07 0.00 0.00 177.69 178.17 3fic s LYS 65 N 4.70 0.66 0.00 -2.67 -2.85 -1.26 -4.93 119.74 113.38 3fic s LYS 65 Ca 0.00 0.11 0.00 0.00 -1.00 0.00 0.00 55.97 55.08 3fic s LYS 65 Cb 0.00 0.16 0.00 0.00 -2.06 0.00 0.00 37.83 35.93 3fic s LYS 65 CO 0.00 -1.06 0.00 1.28 0.10 0.00 0.00 175.35 175.67 3fic n LEU 66 N 4.85 -1.31 -1.22 2.77 4.77 -0.85 -4.84 117.00 121.16 3fic n LEU 66 Ca 0.08 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.95 3fic n LEU 66 Cb 0.56 -0.66 0.01 0.00 -2.33 0.00 0.00 43.42 41.00 3fic n LEU 66 CO -0.03 0.00 -0.46 1.21 -1.33 0.00 0.00 177.39 176.77 3fic n GLU 67 N 0.49 0.00 0.00 3.23 4.07 0.43 -0.57 120.64 128.29 3fic n GLU 67 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 3fic n GLU 67 Cb 0.00 -0.31 0.00 0.00 -0.06 0.00 0.00 31.44 31.07 3fic n GLU 67 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3fic n GLY 68 N 1.07 1.21 0.00 8.31 0.00 -1.26 -2.33 105.19 112.18 3fic n GLY 68 Ca -0.01 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.59 3fic n GLY 68 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3fic n GLU 69 N 0.00 0.00 0.09 1.61 2.13 -1.26 0.17 120.64 123.38 3fic n GLU 69 Ca 0.00 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.79 3fic n GLU 69 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.69 3fic n GLU 69 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3fic h LEU 70 N 0.00 -0.19 -0.98 4.31 6.46 -0.43 -3.47 115.31 121.01 3fic h LEU 70 Ca 0.00 0.01 0.25 0.00 -0.12 0.00 0.00 57.88 58.01 3fic h LEU 70 Cb 0.00 0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 39.95 3fic h LEU 70 CO 0.00 -0.13 1.14 -0.09 -0.62 0.00 0.00 178.44 178.74 3fic h ARG 71 N -0.25 0.00 0.20 1.25 2.43 -0.13 0.66 114.38 118.54 3fic h ARG 71 Ca -0.02 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.83 3fic h ARG 71 Cb 0.17 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.75 3fic h ARG 71 CO 0.04 0.00 -1.41 0.00 -1.51 0.00 0.00 179.97 177.09 3fic h ALA 72 N 0.52 -0.04 0.29 2.80 0.00 0.15 -3.33 119.26 119.65 3fic h ALA 72 Ca 0.41 -0.89 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 3fic h ALA 72 Cb 2.68 0.13 0.00 0.00 0.00 0.00 0.00 17.79 20.61 3fic h ALA 72 CO -0.00 0.83 -0.14 1.49 0.00 0.00 0.00 179.25 181.42 3fic h GLU 73 N 0.12 -0.37 -0.67 0.00 4.81 0.16 -2.93 114.58 115.70 3fic h GLU 73 Ca -0.22 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.15 3fic h GLU 73 Cb 2.09 0.09 -0.11 0.00 0.63 0.00 0.00 28.75 31.45 3fic h GLU 73 CO 0.24 -0.22 -0.24 0.28 -0.73 0.00 0.00 179.01 178.35 3fic n VAL 74 N -5.24 -0.33 0.00 0.32 0.31 -1.10 -0.61 118.33 111.67 3fic n VAL 74 Ca -0.10 1.55 0.00 0.00 -0.01 0.00 0.00 64.34 65.78 3fic n VAL 74 Cb 0.19 -2.07 0.00 0.00 -0.91 0.00 0.00 33.84 31.04 3fic n VAL 74 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fic n ALA 75 N -3.67 -0.14 -0.10 3.52 0.00 -1.11 -2.67 120.51 116.34 3fic n ALA 75 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.50 3fic n ALA 75 Cb 0.28 0.20 -0.01 0.00 0.00 0.00 0.00 19.45 19.93 3fic n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fic n ALA 76 N -1.77 -0.09 -0.05 0.00 0.00 0.22 0.23 120.51 119.05 3fic n ALA 76 Ca 0.00 0.23 -0.14 0.00 0.00 0.00 0.00 53.44 53.53 3fic n ALA 76 Cb 0.00 -0.08 -0.09 0.00 0.00 0.00 0.00 19.45 19.28 3fic n ALA 76 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3fic h ASN 77 N 0.00 -1.73 -0.58 0.00 2.35 -1.26 2.01 115.58 116.37 3fic h ASN 77 Ca 0.07 0.21 0.08 0.00 -0.55 0.00 0.00 56.30 56.11 3fic h ASN 77 Cb 0.13 0.69 -0.06 0.00 0.05 0.00 0.00 38.32 39.12 3fic h ASN 77 CO -0.24 -0.46 0.25 0.40 -1.65 0.00 0.00 177.43 175.73 3fic h ILE 78 N -0.52 0.83 -0.13 2.81 2.04 0.32 0.28 117.51 123.14 3fic h ILE 78 Ca 0.05 -0.15 0.05 0.00 1.00 0.00 0.00 64.86 65.80 3fic h ILE 78 Cb 0.65 0.34 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 3fic h ILE 78 CO -0.48 0.08 -0.23 0.11 0.00 0.00 0.00 178.15 177.63 3fic h LYS 79 N 0.45 -0.28 -0.98 2.37 1.57 0.22 -0.20 116.57 119.72 3fic h LYS 79 Ca 0.28 0.02 0.17 0.00 -1.87 0.00 0.00 60.65 59.25 3fic h LYS 79 Cb 0.30 0.06 -0.09 0.00 0.08 0.00 0.00 32.23 32.58 3fic h LYS 79 CO -0.26 -0.19 0.61 -0.09 -0.57 0.00 0.00 179.45 178.96 3fic h ARG 80 N -0.29 0.75 -0.00 3.15 2.43 0.49 0.34 114.38 121.25 3fic h ARG 80 Ca 0.10 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3fic h ARG 80 Cb 0.44 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3fic h ARG 80 CO -0.30 0.50 0.00 -0.07 -1.51 0.00 0.00 179.97 178.59 3fic h LEU 81 N 0.78 0.00 -1.48 3.80 3.38 0.13 0.03 115.31 121.95 3fic h LEU 81 Ca 0.53 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.46 3fic h LEU 81 Cb 0.81 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 3fic h LEU 81 CO -0.31 0.00 -0.16 -0.03 0.09 0.00 0.00 178.44 178.03 3fic h MET 82 N 0.00 0.13 0.00 1.13 1.85 0.08 -3.35 114.93 114.77 3fic h MET 82 Ca 0.00 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 59.06 3fic h MET 82 Cb 0.00 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.01 3fic h MET 82 CO -0.00 0.30 0.00 -0.40 -0.40 0.00 0.00 176.91 176.41 3fic n ASP 83 N -4.28 0.00 0.09 1.39 3.85 -0.00 -2.05 116.55 115.55 3fic n ASP 83 Ca -0.01 0.00 0.09 0.00 -0.71 0.00 0.00 54.79 54.15 3fic n ASP 83 Cb 0.27 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.02 3fic n ASP 83 CO 0.00 0.00 0.00 0.40 -1.01 0.00 0.00 177.20 176.59 3fic h ILE 84 N 0.00 0.12 0.00 2.12 1.08 -1.86 -3.48 117.51 115.48 3fic h ILE 84 Ca 0.00 -1.24 0.00 0.00 -0.39 0.00 0.00 64.86 63.23 3fic h ILE 84 Cb 0.00 1.64 0.00 0.00 -3.07 0.00 0.00 36.82 35.39 3fic h ILE 84 CO 0.00 0.07 0.00 0.61 -0.69 0.00 0.00 178.15 178.14 3fic n GLY 85 N 1.23 0.99 3.48 5.37 0.00 -0.87 -5.10 105.19 110.29 3fic n GLY 85 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 3fic n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fic h TYR 87 N -0.15 -0.30 -0.32 0.00 3.20 -1.93 1.20 116.97 118.68 3fic h TYR 87 Ca -0.46 0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.52 3fic h TYR 87 Cb 1.36 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.77 3fic h TYR 87 CO 0.34 -0.07 0.38 -0.09 -1.64 0.00 0.00 178.16 177.08 3fic h ARG 88 N -0.03 0.00 -0.31 1.82 2.43 -1.94 0.40 114.38 116.74 3fic h ARG 88 Ca 0.02 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3fic h ARG 88 Cb 0.08 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3fic h ARG 88 CO -0.13 0.00 0.13 0.78 -1.51 0.00 0.00 179.97 179.25 3fic h GLY 89 N 0.00 0.49 0.00 2.80 0.00 0.11 -3.39 103.07 103.08 3fic h GLY 89 Ca 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3fic h GLY 89 CO -0.00 0.25 0.00 1.04 0.00 0.00 0.00 176.54 177.82 3fic n LEU 90 N -4.74 0.00 0.00 3.11 4.77 0.14 -3.74 117.00 116.54 3fic n LEU 90 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3fic n LEU 90 Cb 0.12 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 3fic n LEU 90 CO 0.36 -0.07 0.00 0.54 -1.33 0.00 0.00 177.39 176.89 3fic n ARG 91 N 0.00 0.00 0.01 3.23 5.12 -1.26 -3.28 116.66 120.49 3fic n ARG 91 Ca 0.00 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 55.85 3fic n ARG 91 Cb 0.00 0.00 0.12 0.00 -1.16 0.00 0.00 32.46 31.42 3fic n ARG 91 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3fic h HIS 92 N 0.00 0.61 -0.26 -1.55 3.86 -1.76 2.10 115.15 118.14 3fic h HIS 92 Ca 0.00 -0.18 -0.04 0.00 -1.16 0.00 0.00 60.37 58.99 3fic h HIS 92 Cb 0.00 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 3fic h HIS 92 CO 0.00 0.85 -0.00 0.00 0.86 0.00 0.00 177.93 179.64 3fic h ARG 93 N 0.42 0.47 -0.40 2.45 -0.00 -1.64 -2.95 114.38 112.73 3fic h ARG 93 Ca 0.03 -0.15 0.00 0.00 -0.50 0.00 0.00 59.98 59.36 3fic h ARG 93 Cb 0.92 -0.04 0.00 0.00 0.00 0.00 0.00 29.97 30.84 3fic h ARG 93 CO 0.08 0.64 0.00 -2.13 0.00 0.00 0.00 179.97 178.56 3fic n ARG 94 N -4.61 2.04 -3.88 0.04 3.00 -0.91 -4.94 116.66 107.40 3fic n ARG 94 Ca -0.03 -1.60 -0.29 0.00 -0.00 0.00 0.00 57.85 55.92 3fic n ARG 94 Cb 0.25 -1.38 0.03 0.00 0.00 0.00 0.00 32.46 31.37 3fic n ARG 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3fic n GLY 95 N 1.24 -0.50 3.47 5.14 0.00 0.63 -4.91 105.19 110.26 3fic n GLY 95 Ca 0.16 0.20 -0.26 0.00 0.00 0.00 0.00 46.02 46.12 3fic n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fic s LEU 96 N -7.28 2.62 -0.10 0.99 1.43 0.32 -4.28 118.68 112.39 3fic s LEU 96 Ca 0.64 -0.81 -0.34 0.00 -1.03 0.00 0.00 54.13 52.59 3fic s LEU 96 Cb -0.32 -1.30 -0.12 0.00 0.03 0.00 0.00 46.19 44.48 3fic s LEU 96 CO 0.82 0.10 1.89 -0.81 0.23 0.00 0.00 176.35 178.58 3fic n PRO 97 N 0.06 2.15 -3.93 1.29 -0.04 -1.26 -4.35 135.00 128.92 3fic n PRO 97 Ca -0.11 0.79 -0.31 0.00 -0.04 0.00 0.00 63.50 63.83 3fic n PRO 97 Cb 0.56 -2.64 -0.15 0.00 -0.04 0.00 0.00 33.50 31.24 3fic n PRO 97 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3fic s VAL 98 N 4.12 1.83 -0.43 0.52 1.01 -1.26 -4.52 120.40 121.67 3fic s VAL 98 Ca 0.93 -2.00 0.07 0.00 0.00 0.00 0.00 61.98 60.99 3fic s VAL 98 Cb -0.70 -2.34 0.26 0.00 0.00 0.00 0.00 36.38 33.60 3fic s VAL 98 CO 0.52 -0.59 0.70 0.54 0.00 0.00 0.00 175.10 176.28 3fic n ARG 99 N 4.45 0.77 -1.13 2.72 1.74 -1.26 -4.98 116.66 118.97 3fic n ARG 99 Ca 0.01 -2.63 0.00 0.00 -0.77 0.00 0.00 57.85 54.46 3fic n ARG 99 Cb 0.42 -1.33 0.00 0.00 -1.02 0.00 0.00 32.46 30.53 3fic n ARG 99 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fic n GLY 100 N 1.35 0.00 0.00 -0.13 0.00 -1.26 -5.01 105.19 100.13 3fic n GLY 100 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3fic n GLY 100 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fic n GLN 101 N 1.48 0.06 -3.31 1.61 6.02 -1.26 -5.10 117.38 116.88 3fic n GLN 101 Ca 0.00 0.00 -0.47 0.00 -0.01 0.00 0.00 57.00 56.52 3fic n GLN 101 Cb 0.02 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.26 3fic n GLN 101 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3fic s ARG 102 N -0.66 3.62 0.55 -1.09 0.52 -1.26 -4.82 118.95 115.80 3fic s ARG 102 Ca 0.00 -2.45 0.29 0.00 -0.52 0.00 0.00 55.73 53.05 3fic s ARG 102 Cb 0.00 -4.46 1.58 0.00 0.52 0.00 0.00 34.95 32.60 3fic s ARG 102 CO 0.00 -1.31 2.13 1.79 0.02 0.00 0.00 175.30 177.92 3fic h THR 103 N 4.80 0.51 -0.34 0.02 1.35 -1.98 -2.80 112.91 114.47 3fic h THR 103 Ca 0.11 -0.38 0.06 0.00 -0.55 0.00 0.00 66.41 65.65 3fic h THR 103 Cb 1.04 1.25 -0.08 0.00 -1.73 0.00 0.00 68.15 68.62 3fic h THR 103 CO 0.77 0.08 -0.42 -0.09 -0.25 0.00 0.00 175.52 175.61 3fic h ARG 104 N 0.00 -0.35 0.00 4.72 2.43 -2.03 -3.41 114.38 115.74 3fic h ARG 104 Ca -0.00 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3fic h ARG 104 Cb 0.25 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3fic h ARG 104 CO 0.01 -0.23 0.00 0.25 -1.51 0.00 0.00 179.97 178.49 3fic n THR 105 N -5.42 0.00 0.00 0.20 -2.24 -1.06 -5.07 114.28 100.69 3fic n THR 105 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 3fic n THR 105 Cb 0.35 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 3fic n THR 105 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3fic n ASN 106 N 0.00 0.00 -0.17 3.42 4.13 -1.21 -4.71 115.26 116.72 3fic n ASN 106 Ca 0.00 0.00 -0.02 0.00 1.68 0.00 0.00 54.58 56.24 3fic n ASN 106 Cb 0.00 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.23 3fic n ASN 106 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3fic n ALA 107 N -3.00 -0.03 0.19 5.41 0.00 -1.26 -4.71 120.51 117.11 3fic n ALA 107 Ca 0.00 0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.56 3fic n ALA 107 Cb 0.00 -0.58 0.39 0.00 0.00 0.00 0.00 19.45 19.26 3fic n ALA 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3fic n ARG 108 N -2.56 0.10 0.09 0.00 3.00 -1.26 -0.72 116.66 115.30 3fic n ARG 108 Ca -0.02 0.52 -0.07 0.00 -0.01 0.00 0.00 57.85 58.27 3fic n ARG 108 Cb 0.12 -1.78 -0.00 0.00 0.00 0.00 0.00 32.46 30.80 3fic n ARG 108 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 3fic h THR 109 N 0.00 1.53 0.00 0.55 2.02 -1.90 -3.26 112.91 111.85 3fic h THR 109 Ca 0.00 -2.71 -0.02 0.00 0.77 0.00 0.00 66.41 64.45 3fic h THR 109 Cb 0.09 2.50 -0.00 0.00 -1.74 0.00 0.00 68.15 69.00 3fic h THR 109 CO 0.00 0.78 -1.94 0.54 0.37 0.00 0.00 175.52 175.27 3fic n ARG 110 N -3.62 0.63 -1.82 6.66 1.74 -0.77 -4.94 116.66 114.54 3fic n ARG 110 Ca -0.03 -0.17 -0.31 0.00 -0.77 0.00 0.00 57.85 56.57 3fic n ARG 110 Cb 0.81 -1.48 0.02 0.00 -1.02 0.00 0.00 32.46 30.79 3fic n ARG 110 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3fic s LYS 111 N -3.33 3.31 -0.01 5.56 1.02 0.10 -4.69 119.74 121.69 3fic s LYS 111 Ca -0.07 0.93 -0.30 0.00 0.02 0.00 0.00 55.97 56.55 3fic s LYS 111 Cb 0.12 -2.04 -0.06 0.00 -0.52 0.00 0.00 37.83 35.33 3fic s LYS 111 CO 0.83 -0.81 1.62 0.20 -0.92 0.00 0.00 175.35 176.27 3fic s GLY 112 N -3.68 1.59 0.06 -3.33 0.00 -1.26 -4.82 107.32 95.88 3fic s GLY 112 Ca 0.58 1.00 0.00 0.00 0.00 0.00 0.00 44.72 46.30 3fic s GLY 112 CO 0.49 2.92 0.00 -1.55 0.00 0.00 0.00 173.10 174.97 3fic n PRO 113 N 6.47 -1.29 -2.41 2.90 -0.04 -1.26 -4.85 135.00 134.51 3fic n PRO 113 Ca 0.16 0.92 -0.38 0.00 -0.04 0.00 0.00 63.50 64.15 3fic n PRO 113 Cb 0.42 -1.38 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 3fic n PRO 113 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3fic s ARG 114 N -0.49 3.19 -0.35 0.54 0.52 -1.26 -4.88 118.95 116.21 3fic s ARG 114 Ca 0.00 -0.52 -0.23 0.00 -0.52 0.00 0.00 55.73 54.46 3fic s ARG 114 Cb 0.00 -4.84 -0.24 0.00 0.52 0.00 0.00 34.95 30.39 3fic s ARG 114 CO 0.00 -2.44 1.70 1.63 0.02 0.00 0.00 175.30 176.20 3fic n LYS 115 N 9.07 0.70 0.00 3.54 5.02 -1.26 -4.85 118.16 130.38 3fic n LYS 115 Ca 0.24 -1.30 0.00 0.00 -2.02 0.00 0.00 58.31 55.23 3fic n LYS 115 Cb 0.50 -2.61 0.00 0.00 -0.02 0.00 0.00 35.03 32.90 3fic n LYS 115 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3fic n THR 116 N 6.25 0.00 -0.91 -0.18 -1.04 -1.26 -4.96 114.28 112.18 3fic n THR 116 Ca 0.43 0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.47 3fic n THR 116 Cb 0.36 -0.15 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 3fic n THR 116 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3fic n VAL 117 N 0.00 -3.18 -3.11 12.58 0.31 -1.26 -5.12 118.33 118.55 3fic n VAL 117 Ca 0.00 1.29 0.00 0.00 -0.01 0.00 0.00 64.34 65.62 3fic n VAL 117 Cb 0.00 -1.82 0.00 0.00 -0.91 0.00 0.00 33.84 31.11 3fic n VAL 117 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fic n ALA 118 N -1.13 0.00 -1.03 3.52 0.00 -1.26 -5.14 120.51 115.47 3fic n ALA 118 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3fic n ALA 118 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.49 3fic n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fic n GLY 119 N -0.07 0.08 3.77 0.00 0.00 -1.26 -5.09 105.19 102.61 3fic n GLY 119 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3fic n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fic s LYS 120 N 0.00 3.11 0.05 1.61 -0.14 -1.26 -5.06 119.74 118.05 3fic s LYS 120 Ca 0.00 1.60 0.03 0.00 -1.36 0.00 0.00 55.97 56.24 3fic s LYS 120 Cb 0.00 -1.97 -0.03 0.00 -1.68 0.00 0.00 37.83 34.15 3fic s LYS 120 CO 0.00 -1.04 -0.10 0.15 -0.76 0.00 0.00 175.35 173.60 3fic s LYS 121 N -3.51 0.63 -0.06 1.68 1.02 -1.26 -5.16 119.74 113.08 3fic s LYS 121 Ca 0.72 -0.83 0.05 0.00 0.02 0.00 0.00 55.97 55.93 3fic s LYS 121 Cb -0.24 -0.46 -0.00 0.00 -0.52 0.00 0.00 37.83 36.60 3fic s LYS 121 CO 0.32 0.09 -0.21 0.15 -0.92 0.00 0.00 175.35 174.78 3fic s LYS 122 N -1.67 2.36 0.22 1.68 1.02 -1.26 -5.10 119.74 116.99 3fic s LYS 122 Ca -0.07 -0.76 -0.32 0.00 0.02 0.00 0.00 55.97 54.84 3fic s LYS 122 Cb -0.10 -1.93 -0.13 0.00 -0.52 0.00 0.00 37.83 35.15 3fic s LYS 122 CO 0.01 0.25 1.58 0.00 -0.92 0.00 0.00 175.35 176.27 3fic n ALA 123 N 3.25 1.96 -0.03 5.17 0.00 -1.26 -4.93 120.51 124.67 3fic n ALA 123 Ca -0.19 0.41 -0.14 0.00 0.00 0.00 0.00 53.44 53.52 3fic n ALA 123 Cb 0.52 -2.40 -0.10 0.00 0.00 0.00 0.00 19.45 17.47 3fic n ALA 123 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3fic h PRO 124 N 5.46 0.13 -4.15 0.00 0.13 -2.08 -3.35 132.00 128.14 3fic h PRO 124 Ca -0.45 -0.10 -0.43 0.00 -0.87 0.00 0.00 66.00 64.15 3fic h PRO 124 Cb 1.24 0.02 0.05 0.00 0.13 0.00 0.00 31.00 32.43 3fic h PRO 124 CO 0.85 0.74 1.97 0.54 -0.23 0.00 0.00 178.00 181.87 3fic n ARG 125 N -4.65 1.11 0.00 0.86 1.74 -1.26 -5.37 116.66 109.09 3fic n ARG 125 Ca -0.09 -1.30 0.00 0.00 -0.77 0.00 0.00 57.85 55.69 3fic n ARG 125 Cb 0.38 -2.52 0.00 0.00 -1.02 0.00 0.00 32.46 29.31 3fic n ARG 125 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74