#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ftu n VAL 2 N 0.00 0.00 -3.74 8.89 3.14 -1.26 -5.12 118.33 120.25 2ftu n VAL 2 Ca 0.00 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.24 2ftu n VAL 2 Cb 0.00 0.00 -0.09 0.00 -1.06 0.00 0.00 33.84 32.69 2ftu n VAL 2 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2ftu s SER 3 N 1.99 -0.27 0.00 6.55 0.15 -1.26 -5.03 113.70 115.84 2ftu s SER 3 Ca 0.00 0.26 0.16 0.00 0.70 0.00 0.00 55.95 57.07 2ftu s SER 3 Cb 0.00 0.42 0.15 0.00 -1.71 0.00 0.00 66.02 64.88 2ftu s SER 3 CO 0.00 -0.40 1.03 0.00 1.20 0.00 0.00 173.24 175.07 2ftu n HIS 4 N 1.54 0.06 -0.08 3.44 1.44 -1.26 -4.27 115.22 116.10 2ftu n HIS 4 Ca -0.20 -0.04 -0.15 0.00 -2.01 0.00 0.00 57.72 55.32 2ftu n HIS 4 Cb 0.56 -0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.55 2ftu n HIS 4 CO 0.00 0.00 0.00 0.37 -2.81 0.00 0.00 176.34 173.90 2ftu h GLN 5 N 3.10 0.00 -1.47 -1.40 -0.00 -1.95 -3.49 115.11 109.90 2ftu h GLN 5 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 58.65 58.39 2ftu h GLN 5 Cb 0.68 0.00 -0.04 0.00 0.00 0.00 0.00 27.48 28.11 2ftu h GLN 5 CO 0.00 0.96 -0.31 0.41 0.00 0.00 0.00 178.83 179.90 2ftu n GLY 6 N 1.58 0.32 3.15 2.39 0.00 -1.26 -4.99 105.19 106.38 2ftu n GLY 6 Ca -0.14 -0.36 0.04 0.00 0.00 0.00 0.00 46.02 45.56 2ftu n GLY 6 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2ftu s TYR 7 N -2.60 -1.63 0.35 1.61 6.14 -1.26 -4.75 117.35 115.22 2ftu s TYR 7 Ca 0.00 1.49 -0.07 0.00 0.64 0.00 0.00 57.07 59.12 2ftu s TYR 7 Cb 0.00 0.48 0.03 0.00 0.42 0.00 0.00 41.96 42.89 2ftu s TYR 7 CO 0.00 -0.91 0.59 0.45 0.64 0.00 0.00 175.55 176.33 2ftu n SER 8 N 5.42 -1.70 -0.08 4.32 2.88 -1.24 -5.03 113.62 118.20 2ftu n SER 8 Ca 0.01 -2.68 0.00 0.00 -1.33 0.00 0.00 58.87 54.86 2ftu n SER 8 Cb 0.52 2.97 0.00 0.00 -0.75 0.00 0.00 64.21 66.95 2ftu n SER 8 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2ftu n THR 9 N -0.53 0.00 -2.55 2.46 5.66 -1.26 -3.76 114.28 114.29 2ftu n THR 9 Ca -0.03 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 60.98 2ftu n THR 9 Cb 0.56 -0.19 0.04 0.00 -1.55 0.00 0.00 70.33 69.20 2ftu n THR 9 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2ftu n GLU 10 N -0.40 0.88 0.00 1.09 0.28 -1.26 -5.09 120.64 116.14 2ftu n GLU 10 Ca 0.00 -2.72 0.00 0.00 -0.16 0.00 0.00 57.16 54.28 2ftu n GLU 10 Cb 0.03 -0.78 0.00 0.00 1.43 0.00 0.00 31.44 32.11 2ftu n GLU 10 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2ftu n ALA 11 N -0.05 0.00 -0.77 -1.84 0.00 -1.25 -4.94 120.51 111.67 2ftu n ALA 11 Ca 0.09 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.57 2ftu n ALA 11 Cb 0.99 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.50 2ftu n ALA 11 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ftu n GLU 12 N 0.26 1.69 -3.19 0.00 1.02 -1.26 -3.60 120.64 115.55 2ftu n GLU 12 Ca 0.00 -1.88 -0.27 0.00 -0.02 0.00 0.00 57.16 54.99 2ftu n GLU 12 Cb 0.00 -1.15 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 2ftu n GLU 12 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2ftu n PHE 13 N -0.85 3.85 0.00 -0.32 3.72 -1.26 -4.59 117.46 118.00 2ftu n PHE 13 Ca 0.07 -4.08 0.00 0.00 -0.05 0.00 0.00 57.45 53.39 2ftu n PHE 13 Cb 0.49 -0.53 0.00 0.00 -0.94 0.00 0.00 39.48 38.51 2ftu n PHE 13 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2ftu n GLU 14 N 0.32 0.00 -3.70 -1.08 -0.58 -1.26 -4.91 120.64 109.43 2ftu n GLU 14 Ca 0.30 0.00 -0.28 0.00 -0.42 0.00 0.00 57.16 56.77 2ftu n GLU 14 Cb 0.40 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 31.16 2ftu n GLU 14 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2ftu n GLU 15 N 0.00 1.33 0.00 3.49 1.02 -1.26 -4.98 120.64 120.24 2ftu n GLU 15 Ca 0.00 -4.06 0.00 0.00 -0.02 0.00 0.00 57.16 53.08 2ftu n GLU 15 Cb 0.00 -2.07 0.00 0.00 -0.02 0.00 0.00 31.44 29.35 2ftu n GLU 15 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2ftu n PRO 16 N 2.15 0.00 0.00 3.49 -0.04 -1.26 -4.89 135.00 134.46 2ftu n PRO 16 Ca 0.24 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 64.04 2ftu n PRO 16 Cb 0.40 -1.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.85 2ftu n PRO 16 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2ftu n ARG 17 N -1.54 0.00 -0.17 0.54 1.74 -1.26 -4.85 116.66 111.13 2ftu n ARG 17 Ca 0.00 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.06 2ftu n ARG 17 Cb 0.00 -0.26 0.05 0.00 -1.02 0.00 0.00 32.46 31.23 2ftu n ARG 17 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 2ftu h VAL 18 N 0.00 0.52 -0.30 1.55 3.04 -1.99 -0.55 116.25 118.52 2ftu h VAL 18 Ca 0.00 -0.02 -0.03 0.00 -1.01 0.00 0.00 66.70 65.65 2ftu h VAL 18 Cb 0.00 0.47 -0.02 0.00 -2.01 0.00 0.00 31.29 29.73 2ftu h VAL 18 CO 0.00 0.01 0.07 0.40 -1.01 0.00 0.00 177.57 177.03 2ftu h ILE 19 N 0.05 1.15 -0.35 3.17 1.08 -1.91 -1.70 117.51 119.00 2ftu h ILE 19 Ca 0.26 -0.52 -0.06 0.00 -0.39 0.00 0.00 64.86 64.16 2ftu h ILE 19 Cb 0.40 0.85 -0.01 0.00 -3.07 0.00 0.00 36.82 34.99 2ftu h ILE 19 CO -0.50 0.19 -0.00 -0.78 -0.69 0.00 0.00 178.15 176.37 2ftu h ASP 20 N 0.42 0.60 -0.54 1.72 3.58 -1.47 0.13 116.42 120.86 2ftu h ASP 20 Ca 0.10 -0.31 0.09 0.00 0.42 0.00 0.00 57.03 57.34 2ftu h ASP 20 Cb 0.18 -0.16 -0.07 0.00 1.72 0.00 0.00 39.33 40.99 2ftu h ASP 20 CO -0.00 0.76 0.13 -0.07 -2.88 0.00 0.00 179.24 177.18 2ftu h LEU 21 N 0.42 0.05 -1.40 2.28 -0.00 -0.92 -0.68 115.31 115.07 2ftu h LEU 21 Ca 0.10 0.09 -0.05 0.00 -0.00 0.00 0.00 57.88 58.02 2ftu h LEU 21 Cb 0.45 0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 41.22 2ftu h LEU 21 CO 0.02 0.05 -0.14 -0.50 -0.00 0.00 0.00 178.44 177.87 2ftu h TRP 22 N 0.28 0.24 0.26 1.13 6.55 -0.50 -0.84 115.95 123.07 2ftu h TRP 22 Ca 0.28 -0.03 0.01 0.00 0.95 0.00 0.00 58.89 60.10 2ftu h TRP 22 Cb 0.37 -0.07 -0.03 0.00 -0.86 0.00 0.00 29.16 28.57 2ftu h TRP 22 CO -0.22 0.37 -0.42 0.22 -1.05 0.00 0.00 178.44 177.34 2ftu h ASP 23 N 0.22 -1.19 1.54 -3.49 1.82 0.71 -2.18 116.42 113.86 2ftu h ASP 23 Ca 0.04 0.12 0.00 0.00 -0.39 0.00 0.00 57.03 56.80 2ftu h ASP 23 Cb 0.38 0.42 0.00 0.00 0.68 0.00 0.00 39.33 40.81 2ftu h ASP 23 CO 0.02 -0.53 0.00 0.17 -1.61 0.00 0.00 179.24 177.30 2ftu h LEU 24 N -0.74 0.00 -1.58 2.28 -0.00 -1.19 -2.24 115.31 111.83 2ftu h LEU 24 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 2ftu h LEU 24 Cb 0.71 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.37 2ftu h LEU 24 CO -0.16 0.00 0.15 0.00 -0.00 0.00 0.00 178.44 178.44 2ftu h ALA 25 N 2.02 1.12 -0.01 0.17 0.00 -0.48 0.49 119.26 122.57 2ftu h ALA 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ftu h ALA 25 Cb 0.77 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 2ftu h ALA 25 CO 0.00 -0.12 0.15 0.37 0.00 0.00 0.00 179.25 179.65 2ftu h GLN 26 N 0.00 0.00 0.00 0.00 5.75 -1.33 -3.25 115.11 116.28 2ftu h GLN 26 Ca 0.00 0.00 -0.13 0.00 -0.15 0.00 0.00 58.65 58.37 2ftu h GLN 26 Cb 0.31 0.00 -0.16 0.00 1.07 0.00 0.00 27.48 28.70 2ftu h GLN 26 CO 0.00 0.00 -0.37 0.43 -2.65 0.00 0.00 178.83 176.24 2ftu n SER 27 N -3.04 -0.69 0.00 -0.69 7.64 -0.20 -5.06 113.62 111.58 2ftu n SER 27 Ca -0.02 -1.96 0.00 0.00 1.01 0.00 0.00 58.87 57.90 2ftu n SER 27 Cb 0.21 0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 2ftu n SER 27 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ftu n ALA 28 N 0.06 -0.32 0.00 -0.43 0.00 -0.01 -4.90 120.51 114.91 2ftu n ALA 28 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2ftu n ALA 28 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.20 2ftu n ALA 28 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ftu n ASN 29 N -1.70 0.00 0.00 0.00 5.15 -1.26 -5.05 115.26 112.39 2ftu n ASN 29 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2ftu n ASN 29 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2ftu n ASN 29 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2ftu n LEU 30 N 0.00 0.00 -3.95 1.20 4.32 -1.26 -4.96 117.00 112.34 2ftu n LEU 30 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.90 2ftu n LEU 30 Cb 0.00 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 41.73 2ftu n LEU 30 CO 0.00 0.00 -0.03 0.42 -1.22 0.00 0.00 177.39 176.56 2ftu s THR 31 N 2.52 0.07 0.30 -5.08 -4.23 -1.26 -4.94 115.64 103.02 2ftu s THR 31 Ca 0.00 -1.37 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 2ftu s THR 31 Cb 0.00 -1.79 0.17 0.00 1.34 0.00 0.00 72.50 72.21 2ftu s THR 31 CO 0.00 -0.34 1.85 0.44 -0.54 0.00 0.00 174.62 176.04 2ftu h ASP 32 N 2.57 0.72 0.59 3.99 3.32 -1.97 0.12 116.42 125.76 2ftu h ASP 32 Ca -0.32 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 56.58 2ftu h ASP 32 Cb 1.22 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 40.59 2ftu h ASP 32 CO 0.49 0.70 -0.28 0.50 -1.72 0.00 0.00 179.24 178.93 2ftu h LYS 33 N 0.76 -0.77 -0.68 3.56 3.11 -1.97 -1.51 116.57 119.06 2ftu h LYS 33 Ca 0.17 0.05 0.13 0.00 -2.81 0.00 0.00 60.65 58.19 2ftu h LYS 33 Cb 0.26 0.17 -0.09 0.00 -1.00 0.00 0.00 32.23 31.58 2ftu h LYS 33 CO -0.00 -0.46 0.23 1.49 -2.81 0.00 0.00 179.45 177.89 2ftu h GLU 34 N -0.95 0.36 0.00 1.90 4.57 -1.85 -1.66 114.58 116.94 2ftu h GLU 34 Ca -0.08 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.04 2ftu h GLU 34 Cb 0.66 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 2ftu h GLU 34 CO 0.13 0.24 -0.20 1.25 -1.18 0.00 0.00 179.01 179.25 2ftu h LEU 35 N 0.37 0.00 -0.05 1.64 7.12 -0.37 0.37 115.31 124.39 2ftu h LEU 35 Ca 0.37 0.00 -0.13 0.00 0.13 0.00 0.00 57.88 58.25 2ftu h LEU 35 Cb 0.54 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.68 2ftu h LEU 35 CO -0.40 0.20 -0.47 -0.08 -0.13 0.00 0.00 178.44 177.56 2ftu h GLU 36 N 0.00 0.41 -0.04 1.25 4.81 -0.49 -1.30 114.58 119.22 2ftu h GLU 36 Ca -0.00 -0.37 0.01 0.00 -0.13 0.00 0.00 59.36 58.86 2ftu h GLU 36 Cb 0.42 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2ftu h GLU 36 CO 0.03 1.02 -0.01 0.00 -0.73 0.00 0.00 179.01 179.31 2ftu h ALA 37 N 0.39 0.02 -0.67 2.92 0.00 -0.40 -1.61 119.26 119.90 2ftu h ALA 37 Ca -0.04 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2ftu h ALA 37 Cb 1.15 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2ftu h ALA 37 CO 0.10 -0.50 0.20 0.35 0.00 0.00 0.00 179.25 179.39 2ftu h PHE 38 N -0.01 1.08 -0.36 0.00 3.04 -0.41 -1.15 116.94 119.13 2ftu h PHE 38 Ca 0.02 -0.11 -0.01 0.00 3.98 0.00 0.00 57.97 61.85 2ftu h PHE 38 Cb 0.04 -0.31 -0.02 0.00 2.56 0.00 0.00 35.95 38.22 2ftu h PHE 38 CO -0.11 0.86 0.18 -0.09 -2.02 0.00 0.00 178.31 177.13 2ftu h ARG 39 N 1.00 0.51 -0.21 1.11 2.43 -0.73 0.78 114.38 119.27 2ftu h ARG 39 Ca 0.22 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 2ftu h ARG 39 Cb 0.30 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2ftu h ARG 39 CO -0.01 0.45 0.07 1.05 -1.51 0.00 0.00 179.97 180.03 2ftu h GLU 40 N 0.45 0.32 -0.54 0.20 4.11 -1.07 -1.47 114.58 116.58 2ftu h GLU 40 Ca 0.12 -0.07 -0.05 0.00 0.07 0.00 0.00 59.36 59.44 2ftu h GLU 40 Cb 0.10 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2ftu h GLU 40 CO -0.02 0.41 0.14 1.05 0.07 0.00 0.00 179.01 180.66 2ftu h GLU 41 N 0.17 0.86 -0.73 1.06 4.11 -1.00 -1.62 114.58 117.43 2ftu h GLU 41 Ca 0.07 -0.20 0.00 0.00 0.07 0.00 0.00 59.36 59.30 2ftu h GLU 41 Cb 0.21 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 2ftu h GLU 41 CO -0.00 0.81 0.47 -0.07 0.07 0.00 0.00 179.01 180.28 2ftu h LEU 42 N 0.76 0.85 -0.61 3.06 -0.00 -0.85 0.58 115.31 119.10 2ftu h LEU 42 Ca 0.17 -0.04 -0.01 0.00 -0.00 0.00 0.00 57.88 58.00 2ftu h LEU 42 Cb 0.33 -0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 40.75 2ftu h LEU 42 CO 0.00 0.64 0.33 0.50 -0.00 0.00 0.00 178.44 179.90 2ftu h LYS 43 N 0.99 0.86 -0.47 1.13 1.63 -0.48 0.34 116.57 120.57 2ftu h LYS 43 Ca 0.26 -0.11 -0.08 0.00 -0.85 0.00 0.00 60.65 59.88 2ftu h LYS 43 Cb -0.08 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.36 2ftu h LYS 43 CO -0.05 0.66 -0.04 0.45 -3.45 0.00 0.00 179.45 177.02 2ftu h HIS 44 N 0.83 0.86 0.45 1.91 3.86 -0.96 -1.95 115.15 120.15 2ftu h HIS 44 Ca 0.21 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 2ftu h HIS 44 Cb 0.06 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.30 2ftu h HIS 44 CO -0.01 0.82 -0.21 0.35 0.86 0.00 0.00 177.93 179.73 2ftu h PHE 45 N 0.74 -0.55 -0.74 2.45 3.04 -0.06 -1.62 116.94 120.20 2ftu h PHE 45 Ca 0.14 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.17 2ftu h PHE 45 Cb 0.50 0.18 -0.07 0.00 2.56 0.00 0.00 35.95 39.13 2ftu h PHE 45 CO 0.03 -0.23 0.38 1.05 -2.02 0.00 0.00 178.31 177.52 2ftu h GLU 46 N -0.97 0.62 -0.13 1.11 -0.00 -0.41 -1.11 114.58 113.69 2ftu h GLU 46 Ca -0.06 -0.04 0.01 0.00 -0.00 0.00 0.00 59.36 59.27 2ftu h GLU 46 Cb 0.57 -0.14 -0.01 0.00 -0.00 0.00 0.00 28.75 29.17 2ftu h GLU 46 CO 0.10 0.41 0.06 0.00 -0.00 0.00 0.00 179.01 179.59 2ftu h ALA 47 N 1.44 0.16 -0.55 1.06 0.00 -1.35 0.66 119.26 120.68 2ftu h ALA 47 Ca 0.37 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.37 2ftu h ALA 47 Cb 0.38 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 2ftu h ALA 47 CO -0.27 -0.38 0.16 0.87 0.00 0.00 0.00 179.25 179.63 2ftu h LYS 48 N 0.14 0.30 -0.14 0.00 6.56 -0.22 -1.64 116.57 121.58 2ftu h LYS 48 Ca 0.05 -0.02 -0.19 0.00 -1.06 0.00 0.00 60.65 59.43 2ftu h LYS 48 Cb 0.01 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.60 2ftu h LYS 48 CO -0.04 0.20 -0.70 0.97 -2.06 0.00 0.00 179.45 177.81 2ftu h ILE 49 N 0.31 1.33 -0.64 1.86 6.09 -0.85 -1.65 117.51 123.95 2ftu h ILE 49 Ca 0.28 -2.00 0.10 0.00 -1.37 0.00 0.00 64.86 61.87 2ftu h ILE 49 Cb 0.36 1.98 -0.04 0.00 0.47 0.00 0.00 36.82 39.59 2ftu h ILE 49 CO -0.32 0.62 0.43 -0.33 -3.07 0.00 0.00 178.15 175.47 2ftu h GLU 50 N 0.42 0.44 0.20 2.19 4.39 -0.47 0.27 114.58 122.02 2ftu h GLU 50 Ca -0.03 -0.03 -0.28 0.00 0.34 0.00 0.00 59.36 59.36 2ftu h GLU 50 Cb 1.29 -0.10 0.03 0.00 -0.10 0.00 0.00 28.75 29.88 2ftu h GLU 50 CO 0.13 0.29 -1.22 0.87 -1.16 0.00 0.00 179.01 177.92 2ftu h LYS 51 N 0.45 0.47 0.07 2.33 1.57 -1.10 -1.00 116.57 119.36 2ftu h LYS 51 Ca 0.30 -0.78 0.01 0.00 -1.87 0.00 0.00 60.65 58.31 2ftu h LYS 51 Cb 0.56 0.29 -0.04 0.00 0.08 0.00 0.00 32.23 33.11 2ftu h LYS 51 CO -0.09 1.37 -0.46 1.25 -0.57 0.00 0.00 179.45 180.96 2ftu h HIS 52 N -0.02 -1.32 -0.89 -1.35 2.76 -0.65 -1.40 115.15 112.28 2ftu h HIS 52 Ca -0.21 0.04 0.19 0.00 -2.20 0.00 0.00 60.37 58.18 2ftu h HIS 52 Cb 1.96 0.57 -0.17 0.00 1.55 0.00 0.00 27.41 31.32 2ftu h HIS 52 CO 0.15 -0.51 -0.17 -0.97 -1.30 0.00 0.00 177.93 175.13 2ftu h ASN 53 N -0.63 -0.74 -0.43 3.26 -1.24 -0.59 0.18 115.58 115.39 2ftu h ASN 53 Ca -0.00 0.26 0.08 0.00 0.71 0.00 0.00 56.30 57.35 2ftu h ASN 53 Cb 0.64 0.52 -0.07 0.00 0.73 0.00 0.00 38.32 40.15 2ftu h ASN 53 CO -0.26 -0.29 0.00 0.45 -1.29 0.00 0.00 177.43 176.04 2ftu h HIS 54 N 0.01 -0.02 -0.15 0.67 3.86 -0.65 -0.83 115.15 118.04 2ftu h HIS 54 Ca 0.44 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.66 2ftu h HIS 54 Cb 0.72 0.07 -0.00 0.00 1.06 0.00 0.00 27.41 29.26 2ftu h HIS 54 CO -0.65 -0.08 -0.03 1.88 0.86 0.00 0.00 177.93 179.91 2ftu h TYR 55 N 0.11 0.31 -0.83 2.45 -1.99 0.29 -1.84 116.97 115.47 2ftu h TYR 55 Ca 0.21 -0.06 0.12 0.00 2.00 0.00 0.00 58.73 61.00 2ftu h TYR 55 Cb 0.30 -0.08 -0.06 0.00 2.00 0.00 0.00 36.73 38.90 2ftu h TYR 55 CO -0.28 0.55 0.54 1.96 -0.00 0.00 0.00 178.16 180.93 2ftu h GLN 56 N -0.01 0.64 0.05 4.88 4.20 -0.08 0.33 115.11 125.12 2ftu h GLN 56 Ca 0.04 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2ftu h GLN 56 Cb 0.44 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.07 2ftu h GLN 56 CO 0.01 0.42 -0.02 -0.22 -0.67 0.00 0.00 178.83 178.35 2ftu h LYS 57 N 0.66 -0.07 -0.01 1.46 3.64 -1.17 -1.64 116.57 119.44 2ftu h LYS 57 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.79 2ftu h LYS 57 Cb 0.63 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 2ftu h LYS 57 CO -0.16 0.49 0.07 1.96 -2.27 0.00 0.00 179.45 179.53 2ftu h GLN 58 N -0.68 0.00 0.11 1.90 1.08 -0.44 -1.83 115.11 115.26 2ftu h GLN 58 Ca -0.01 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 56.99 2ftu h GLN 58 Cb 0.58 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.02 2ftu h GLN 58 CO 0.01 0.00 -0.96 1.25 -0.95 0.00 0.00 178.83 178.18 2ftu h LEU 59 N 0.00 0.36 -0.05 1.46 5.85 -0.12 0.51 115.31 123.32 2ftu h LEU 59 Ca 0.01 -0.90 0.01 0.00 0.84 0.00 0.00 57.88 57.84 2ftu h LEU 59 Cb 0.15 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2ftu h LEU 59 CO -0.00 1.43 -0.02 -0.08 -0.34 0.00 0.00 178.44 179.43 2ftu h GLU 60 N -0.45 -0.01 -0.57 1.25 4.81 -1.06 0.26 114.58 118.80 2ftu h GLU 60 Ca -0.19 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.98 2ftu h GLU 60 Cb 1.60 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.95 2ftu h GLU 60 CO 0.08 -0.01 0.12 0.82 -0.73 0.00 0.00 179.01 179.29 2ftu h ILE 61 N -0.01 1.24 -0.49 2.32 2.04 -1.44 -0.60 117.51 120.57 2ftu h ILE 61 Ca 0.03 -0.88 0.03 0.00 1.00 0.00 0.00 64.86 65.03 2ftu h ILE 61 Cb 0.06 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 2ftu h ILE 61 CO -0.06 0.33 0.28 0.00 0.00 0.00 0.00 178.15 178.69 2ftu h ALA 62 N 1.28 0.62 -0.21 1.87 0.00 -0.53 -1.93 119.26 120.36 2ftu h ALA 62 Ca 0.18 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 2ftu h ALA 62 Cb 0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2ftu h ALA 62 CO 0.00 -0.03 -0.41 1.25 0.00 0.00 0.00 179.25 180.06 2ftu h HIS 63 N 0.56 0.58 0.00 0.00 6.17 0.13 0.26 115.15 122.85 2ftu h HIS 63 Ca 0.20 -0.17 0.01 0.00 0.71 0.00 0.00 60.37 61.12 2ftu h HIS 63 Cb 0.04 -0.12 -0.01 0.00 2.52 0.00 0.00 27.41 29.83 2ftu h HIS 63 CO -0.07 0.82 -0.15 0.93 0.71 0.00 0.00 177.93 180.17 2ftu h GLU 64 N 0.40 -0.18 0.00 5.26 5.08 -1.03 -1.35 114.58 122.76 2ftu h GLU 64 Ca 0.04 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2ftu h GLU 64 Cb 0.89 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.18 2ftu h GLU 64 CO 0.08 -0.12 -0.06 1.57 -1.00 0.00 0.00 179.01 179.48 2ftu h LYS 65 N -0.19 0.00 0.80 2.33 2.10 -0.76 -1.66 116.57 119.19 2ftu h LYS 65 Ca 0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.61 2ftu h LYS 65 Cb 0.20 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.54 2ftu h LYS 65 CO -0.09 0.06 -0.38 1.25 -2.00 0.00 0.00 179.45 178.28 2ftu h LEU 66 N 0.00 -0.90 -1.33 7.07 6.46 -0.37 0.13 115.31 126.37 2ftu h LEU 66 Ca -0.00 0.03 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 2ftu h LEU 66 Cb 0.39 0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.54 2ftu h LEU 66 CO 0.01 -0.56 -0.18 -0.09 -0.62 0.00 0.00 178.44 177.00 2ftu h ARG 67 N -1.24 0.24 -0.42 1.25 2.43 -0.90 0.25 114.38 115.98 2ftu h ARG 67 Ca -0.11 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 58.98 2ftu h ARG 67 Cb 0.82 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.32 2ftu h ARG 67 CO 0.18 0.41 0.20 0.45 -1.51 0.00 0.00 179.97 179.71 2ftu h HIS 68 N 0.22 0.60 -0.55 2.20 3.86 -1.34 -1.93 115.15 118.21 2ftu h HIS 68 Ca 0.04 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.19 2ftu h HIS 68 Cb 0.45 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.70 2ftu h HIS 68 CO 0.01 0.49 0.21 0.00 0.86 0.00 0.00 177.93 179.50 2ftu h ALA 69 N 1.05 1.34 0.00 2.45 0.00 0.63 -1.00 119.26 123.73 2ftu h ALA 69 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ftu h ALA 69 Cb 0.11 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2ftu h ALA 69 CO -0.02 0.49 0.00 0.39 0.00 0.00 0.00 179.25 180.11 2ftu n GLU 70 N -4.33 0.57 0.00 0.00 1.02 0.71 -0.45 120.64 118.15 2ftu n GLU 70 Ca 0.04 0.02 0.09 0.00 -0.02 0.00 0.00 57.16 57.29 2ftu n GLU 70 Cb 0.17 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.00 2ftu n GLU 70 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2ftu n SER 71 N -1.05 1.02 0.07 1.62 7.64 -0.41 -4.56 113.62 117.95 2ftu n SER 71 Ca 0.14 -1.01 0.07 0.00 1.01 0.00 0.00 58.87 59.08 2ftu n SER 71 Cb 0.08 0.92 -0.04 0.00 -1.01 0.00 0.00 64.21 64.17 2ftu n SER 71 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2ftu n VAL 72 N -1.23 0.84 0.00 0.44 0.24 0.40 -4.99 118.33 114.04 2ftu n VAL 72 Ca 0.04 -0.61 0.00 0.00 -2.04 0.00 0.00 64.34 61.73 2ftu n VAL 72 Cb 0.31 -0.50 0.00 0.00 -1.47 0.00 0.00 33.84 32.18 2ftu n VAL 72 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ftu n GLY 73 N 1.27 2.76 3.58 7.63 0.00 -1.09 -4.97 105.19 114.37 2ftu n GLY 73 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 2ftu n GLY 73 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ftu s ASP 74 N -1.80 5.39 0.57 1.61 2.15 -1.26 -4.86 116.67 118.47 2ftu s ASP 74 Ca 0.00 1.20 0.26 0.00 0.43 0.00 0.00 52.55 54.44 2ftu s ASP 74 Cb 0.00 -2.52 1.66 0.00 -0.30 0.00 0.00 42.92 41.76 2ftu s ASP 74 CO 0.00 -2.12 2.21 1.23 -0.17 0.00 0.00 175.17 176.31 2ftu h GLY 75 N 15.67 0.00 0.23 2.66 0.00 -1.93 -2.69 103.07 117.01 2ftu h GLY 75 Ca -0.32 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2ftu h GLY 75 CO 1.08 0.00 -0.11 -2.09 0.00 0.00 0.00 176.54 175.41 2ftu h GLU 76 N 0.00 -0.30 0.00 4.80 4.22 -2.00 -1.40 114.58 119.90 2ftu h GLU 76 Ca 0.01 0.02 -0.03 0.00 0.08 0.00 0.00 59.36 59.44 2ftu h GLU 76 Cb 0.08 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 2ftu h GLU 76 CO -0.00 -0.20 -0.16 0.07 -2.18 0.00 0.00 179.01 176.54 2ftu h ARG 77 N -0.31 0.00 0.93 1.92 0.11 -1.96 -1.25 114.38 113.82 2ftu h ARG 77 Ca -0.03 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.00 2ftu h ARG 77 Cb 0.24 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.33 2ftu h ARG 77 CO 0.05 0.16 -0.45 0.28 0.10 0.00 0.00 179.97 180.11 2ftu h VAL 78 N 0.00 0.08 -0.78 0.08 2.07 -1.41 -1.05 116.25 115.23 2ftu h VAL 78 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 2ftu h VAL 78 Cb 0.42 0.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.23 2ftu h VAL 78 CO 0.02 0.00 0.50 0.28 0.02 0.00 0.00 177.57 178.39 2ftu h SER 79 N -1.25 0.81 -0.59 0.57 0.02 -0.88 -1.22 113.55 111.01 2ftu h SER 79 Ca -0.13 -0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.75 2ftu h SER 79 Cb 0.96 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.30 2ftu h SER 79 CO 0.21 0.56 0.11 -0.09 -1.14 0.00 0.00 176.83 176.47 2ftu h ARG 80 N 0.96 1.00 -0.11 3.45 9.65 -1.18 0.11 114.38 128.26 2ftu h ARG 80 Ca 0.32 -0.25 -0.00 0.00 -1.10 0.00 0.00 59.98 58.95 2ftu h ARG 80 Cb 0.03 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.48 2ftu h ARG 80 CO -0.12 0.92 0.07 0.77 2.80 0.00 0.00 179.97 184.40 2ftu h SER 81 N 0.95 0.13 -0.39 -3.80 0.02 -0.85 -1.98 113.55 107.61 2ftu h SER 81 Ca 0.19 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2ftu h SER 81 Cb 0.40 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 2ftu h SER 81 CO 0.01 0.12 0.25 0.03 -1.14 0.00 0.00 176.83 176.10 2ftu h ARG 82 N 0.12 0.53 0.27 3.45 3.08 -0.14 0.88 114.38 122.56 2ftu h ARG 82 Ca 0.04 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2ftu h ARG 82 Cb 0.02 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.95 2ftu h ARG 82 CO -0.01 0.36 -0.13 1.49 -1.07 0.00 0.00 179.97 180.61 2ftu h GLU 83 N 0.54 -0.35 -0.12 0.04 4.81 -0.60 -1.24 114.58 117.66 2ftu h GLU 83 Ca 0.14 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.36 2ftu h GLU 83 Cb -0.04 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2ftu h GLU 83 CO -0.03 -0.09 -0.09 -0.22 -0.73 0.00 0.00 179.01 177.85 2ftu h LYS 84 N -0.58 0.19 0.78 1.92 1.63 -1.01 -1.84 116.57 117.66 2ftu h LYS 84 Ca -0.04 -0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 59.69 2ftu h LYS 84 Cb 0.42 -0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.02 2ftu h LYS 84 CO 0.06 0.29 -0.46 1.25 -3.45 0.00 0.00 179.45 177.14 2ftu h HIS 85 N 0.18 -1.21 -0.67 1.91 2.76 -0.47 -0.87 115.15 116.77 2ftu h HIS 85 Ca 0.04 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 2ftu h HIS 85 Cb 0.28 0.43 -0.03 0.00 1.55 0.00 0.00 27.41 29.63 2ftu h HIS 85 CO 0.00 -0.69 0.43 0.00 -1.30 0.00 0.00 177.93 176.37 2ftu h ALA 86 N -1.27 1.49 0.42 5.26 0.00 -1.00 0.77 119.26 124.93 2ftu h ALA 86 Ca -0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2ftu h ALA 86 Cb 0.91 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2ftu h ALA 86 CO 0.12 0.46 -0.47 1.25 0.00 0.00 0.00 179.25 180.61 2ftu h LEU 87 N 0.92 -1.30 0.03 0.00 5.85 -1.29 -0.05 115.31 119.48 2ftu h LEU 87 Ca 0.25 0.11 0.01 0.00 0.84 0.00 0.00 57.88 59.08 2ftu h LEU 87 Cb -0.08 0.44 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2ftu h LEU 87 CO -0.05 -0.62 -0.07 -0.07 -0.34 0.00 0.00 178.44 177.29 2ftu h LEU 88 N -0.91 -0.21 -0.58 2.25 3.38 -0.34 -1.99 115.31 116.92 2ftu h LEU 88 Ca -0.04 0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.07 2ftu h LEU 88 Cb 0.81 0.08 -0.09 0.00 0.09 0.00 0.00 40.66 41.56 2ftu h LEU 88 CO -0.09 -0.11 0.06 -0.33 0.09 0.00 0.00 178.44 178.05 2ftu h GLU 89 N -0.15 0.17 -0.11 1.13 4.39 -0.87 0.82 114.58 119.96 2ftu h GLU 89 Ca 0.02 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 2ftu h GLU 89 Cb 0.16 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 2ftu h GLU 89 CO -0.05 0.11 0.07 0.78 -1.16 0.00 0.00 179.01 178.76 2ftu h GLY 90 N 0.18 0.17 1.03 -3.84 0.00 -0.69 -0.41 103.07 99.51 2ftu h GLY 90 Ca 0.30 -0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.53 2ftu h GLY 90 CO -0.45 0.07 0.40 -0.09 0.00 0.00 0.00 176.54 176.47 2ftu h ARG 91 N 0.12 1.18 -0.54 4.80 1.12 -0.64 -1.83 114.38 118.59 2ftu h ARG 91 Ca 0.04 -0.17 -0.12 0.00 -1.11 0.00 0.00 59.98 58.62 2ftu h ARG 91 Cb 0.03 -0.21 -0.02 0.00 -0.01 0.00 0.00 29.97 29.76 2ftu h ARG 91 CO -0.01 0.91 -0.12 1.79 -3.11 0.00 0.00 179.97 179.43 2ftu h THR 92 N 1.17 1.27 -0.36 0.20 1.35 -0.38 0.90 112.91 117.05 2ftu h THR 92 Ca 0.28 -1.28 -0.02 0.00 -0.55 0.00 0.00 66.41 64.85 2ftu h THR 92 Cb 0.12 0.97 -0.02 0.00 -1.73 0.00 0.00 68.15 67.50 2ftu h THR 92 CO -0.04 0.45 0.16 0.50 -0.25 0.00 0.00 175.52 176.35 2ftu h LYS 93 N 0.91 0.52 -0.11 4.72 3.64 -1.02 0.64 116.57 125.88 2ftu h LYS 93 Ca 0.14 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 2ftu h LYS 93 Cb 0.69 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2ftu h LYS 93 CO 0.05 0.49 0.02 1.49 -2.27 0.00 0.00 179.45 179.23 2ftu h GLU 94 N 0.44 0.17 -0.58 1.90 4.81 -1.12 -0.76 114.58 119.44 2ftu h GLU 94 Ca 0.12 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.21 2ftu h GLU 94 Cb 0.15 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 2ftu h GLU 94 CO -0.01 0.36 -0.01 1.25 -0.73 0.00 0.00 179.01 179.87 2ftu h LEU 95 N -0.05 1.01 -0.38 1.64 7.12 -0.82 -1.51 115.31 122.33 2ftu h LEU 95 Ca 0.03 -0.31 0.08 0.00 0.13 0.00 0.00 57.88 57.81 2ftu h LEU 95 Cb 0.27 -0.27 -0.08 0.00 -0.53 0.00 0.00 40.66 40.04 2ftu h LEU 95 CO 0.00 1.08 -0.17 1.23 -0.13 0.00 0.00 178.44 180.45 2ftu h GLY 96 N 0.92 0.13 0.55 3.75 0.00 -0.71 0.30 103.07 108.01 2ftu h GLY 96 Ca 0.16 0.21 0.05 0.00 0.00 0.00 0.00 47.33 47.75 2ftu h GLY 96 CO 0.03 -0.18 -0.01 -1.82 0.00 0.00 0.00 176.54 174.56 2ftu h TYR 97 N -0.10 -0.04 0.71 5.60 3.20 -1.00 0.42 116.97 125.76 2ftu h TYR 97 Ca 0.19 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 2ftu h TYR 97 Cb 0.38 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.71 2ftu h TYR 97 CO -0.40 -0.06 -0.40 1.15 -1.64 0.00 0.00 178.16 176.81 2ftu h THR 98 N 0.07 0.19 -0.91 1.81 2.02 -0.16 -1.94 112.91 113.99 2ftu h THR 98 Ca 0.13 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.37 2ftu h THR 98 Cb 0.18 0.19 -0.06 0.00 -1.74 0.00 0.00 68.15 66.71 2ftu h THR 98 CO -0.23 0.00 0.58 0.58 0.37 0.00 0.00 175.52 176.82 2ftu h VAL 99 N -1.03 1.09 0.03 3.16 2.07 -0.39 0.14 116.25 121.32 2ftu h VAL 99 Ca -0.09 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.09 2ftu h VAL 99 Cb 0.82 -0.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 2ftu h VAL 99 CO 0.11 0.20 -0.34 0.50 0.02 0.00 0.00 177.57 178.06 2ftu h LYS 100 N 1.08 -0.49 0.23 1.57 3.64 -0.63 0.30 116.57 122.27 2ftu h LYS 100 Ca 0.39 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.79 2ftu h LYS 100 Cb 0.12 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2ftu h LYS 100 CO -0.16 -0.33 -0.11 0.87 -2.27 0.00 0.00 179.45 177.45 2ftu h LYS 101 N -0.51 -0.30 -0.92 1.90 1.79 -0.73 -1.85 116.57 115.94 2ftu h LYS 101 Ca 0.05 0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.55 2ftu h LYS 101 Cb 0.58 0.07 -0.05 0.00 -1.58 0.00 0.00 32.23 31.25 2ftu h LYS 101 CO -0.26 -0.13 0.61 1.25 -1.08 0.00 0.00 179.45 179.84 2ftu h HIS 102 N -0.40 1.17 -0.08 -1.35 2.76 -0.53 -1.02 115.15 115.69 2ftu h HIS 102 Ca -0.03 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2ftu h HIS 102 Cb 0.30 -0.39 -0.00 0.00 1.55 0.00 0.00 27.41 28.87 2ftu h HIS 102 CO -0.04 0.74 0.05 -0.07 -1.30 0.00 0.00 177.93 177.31 2ftu h LEU 103 N 1.26 0.09 -1.12 0.26 3.38 -0.38 -1.10 115.31 117.69 2ftu h LEU 103 Ca 0.34 -0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.36 2ftu h LEU 103 Cb -0.14 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.52 2ftu h LEU 103 CO -0.07 0.11 0.60 -0.61 0.09 0.00 0.00 178.44 178.56 2ftu h GLN 104 N 0.07 0.93 0.03 1.13 5.75 -0.44 0.80 115.11 123.39 2ftu h GLN 104 Ca 0.03 -0.06 -0.08 0.00 -0.15 0.00 0.00 58.65 58.39 2ftu h GLN 104 Cb 0.04 -0.21 0.01 0.00 1.07 0.00 0.00 27.48 28.39 2ftu h GLN 104 CO -0.01 0.62 -0.34 0.22 -2.65 0.00 0.00 178.83 176.67 2ftu h ASP 105 N 0.96 0.24 -0.16 -0.69 3.58 -0.90 -1.29 116.42 118.17 2ftu h ASP 105 Ca 0.44 -0.87 -0.07 0.00 0.42 0.00 0.00 57.03 56.95 2ftu h ASP 105 Cb 0.39 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.34 2ftu h ASP 105 CO -0.20 1.09 -0.11 -0.07 -2.88 0.00 0.00 179.24 177.07 2ftu h LEU 106 N -0.57 0.51 -0.31 2.28 4.07 -1.14 0.74 115.31 120.89 2ftu h LEU 106 Ca -0.05 -0.13 0.04 0.00 0.08 0.00 0.00 57.88 57.82 2ftu h LEU 106 Cb 1.17 -0.14 -0.04 0.00 1.08 0.00 0.00 40.66 42.73 2ftu h LEU 106 CO 0.07 0.66 0.09 -1.28 -1.08 0.00 0.00 178.44 176.89 2ftu h SER 107 N 0.49 0.07 -0.48 -0.43 0.87 -0.89 0.25 113.55 113.42 2ftu h SER 107 Ca 0.09 0.04 0.07 0.00 -1.23 0.00 0.00 61.79 60.76 2ftu h SER 107 Cb 0.49 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.47 2ftu h SER 107 CO 0.03 0.08 0.32 1.23 -0.53 0.00 0.00 176.83 177.96 2ftu h GLY 108 N 0.21 0.48 0.00 5.77 0.00 0.14 -2.11 103.07 107.56 2ftu h GLY 108 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2ftu h GLY 108 CO -0.17 0.11 0.00 0.54 0.00 0.00 0.00 176.54 177.03 2ftu n ARG 109 N -4.47 0.00 -0.08 4.80 3.00 0.09 -4.31 116.66 115.69 2ftu n ARG 109 Ca 0.07 0.25 0.21 0.00 -0.01 0.00 0.00 57.85 58.37 2ftu n ARG 109 Cb 0.28 -0.87 0.65 0.00 0.00 0.00 0.00 32.46 32.52 2ftu n ARG 109 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2ftu h ILE 110 N 0.00 0.71 -0.25 0.55 1.08 -0.51 0.11 117.51 119.20 2ftu h ILE 110 Ca 0.00 -0.03 0.06 0.00 -0.39 0.00 0.00 64.86 64.49 2ftu h ILE 110 Cb 0.00 0.60 -0.06 0.00 -3.07 0.00 0.00 36.82 34.30 2ftu h ILE 110 CO 0.00 0.02 -0.11 0.28 -0.69 0.00 0.00 178.15 177.65 2ftu h SER 111 N 0.10 -0.37 -0.34 1.72 0.02 -1.58 -3.12 113.55 109.98 2ftu h SER 111 Ca 0.32 0.09 -0.08 0.00 -0.84 0.00 0.00 61.79 61.28 2ftu h SER 111 Cb 1.13 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.87 2ftu h SER 111 CO -0.03 -0.14 -0.12 0.08 -1.14 0.00 0.00 176.83 175.48 2ftu h ARG 112 N -0.07 0.68 -6.49 3.45 0.11 -0.96 -3.48 114.38 107.61 2ftu h ARG 112 Ca 0.13 -0.28 -0.39 0.00 0.10 0.00 0.00 59.98 59.54 2ftu h ARG 112 Cb 0.27 -0.03 0.01 0.00 1.11 0.00 0.00 29.97 31.33 2ftu h ARG 112 CO -0.30 0.87 -1.03 0.00 0.10 0.00 0.00 179.97 179.61 2ftu n ALA 113 N -2.44 -2.61 -0.86 0.08 0.00 -1.18 -4.97 120.51 108.53 2ftu n ALA 113 Ca -0.02 0.07 -0.29 0.00 0.00 0.00 0.00 53.44 53.19 2ftu n ALA 113 Cb 0.36 -1.53 0.20 0.00 0.00 0.00 0.00 19.45 18.48 2ftu n ALA 113 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2ftu s ARG 114 N -3.73 0.15 0.00 0.00 1.81 -1.26 -4.93 118.95 111.00 2ftu s ARG 114 Ca 0.16 0.86 0.23 0.00 -1.72 0.00 0.00 55.73 55.27 2ftu s ARG 114 Cb -0.02 -1.68 0.15 0.00 -0.45 0.00 0.00 34.95 32.95 2ftu s ARG 114 CO 0.87 -3.01 1.16 1.58 -0.68 0.00 0.00 175.30 175.22 2ftu n HIS 115 N -4.42 0.02 -2.06 -0.53 -0.00 -1.26 -4.57 115.22 102.40 2ftu n HIS 115 Ca 0.06 0.01 -0.28 0.00 0.46 0.00 0.00 57.72 57.96 2ftu n HIS 115 Cb 0.55 -0.15 0.12 0.00 -0.12 0.00 0.00 29.99 30.38 2ftu n HIS 115 CO 0.00 0.00 0.00 -0.80 0.46 0.00 0.00 176.34 176.00 2ftu s ASN 116 N -3.07 4.11 0.79 0.26 -0.87 -1.26 -4.92 114.94 109.98 2ftu s ASN 116 Ca 0.09 0.42 -0.14 0.00 -1.57 0.00 0.00 52.86 51.66 2ftu s ASN 116 Cb 0.17 -0.79 0.06 0.00 -0.02 0.00 0.00 41.25 40.67 2ftu s ASN 116 CO 0.78 -2.10 1.12 1.21 -2.57 0.00 0.00 177.10 175.55 2ftu n GLU 117 N -3.32 0.29 0.00 -0.60 0.00 -1.26 -4.85 120.64 110.90 2ftu n GLU 117 Ca 0.11 0.17 0.15 0.00 0.00 0.00 0.00 57.16 57.59 2ftu n GLU 117 Cb 0.60 -2.37 0.69 0.00 0.00 0.00 0.00 31.44 30.36 2ftu n GLU 117 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41