#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 -3.12 -3.43 8.89 0.31 -1.26 -4.81 118.33 114.90 2ftu n VAL 2 Ca 0.00 1.18 -0.10 0.00 -0.01 0.00 0.00 64.34 65.41 2ftu n VAL 2 Cb 0.00 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.16 2ftu n VAL 2 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2ftu n SER 3 N -0.65 -1.16 -4.85 4.52 7.64 -1.26 -4.90 113.62 112.97 2ftu n SER 3 Ca 0.00 -0.32 -0.29 0.00 1.01 0.00 0.00 58.87 59.27 2ftu n SER 3 Cb 0.00 -0.42 0.10 0.00 -1.01 0.00 0.00 64.21 62.87 2ftu n SER 3 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2ftu s HIS 4 N -3.66 2.87 -1.13 1.43 2.46 -1.26 -4.18 115.29 111.82 2ftu s HIS 4 Ca 0.08 0.90 -0.07 0.00 0.47 0.00 0.00 55.06 56.44 2ftu s HIS 4 Cb -0.04 -3.33 0.01 0.00 -0.13 0.00 0.00 32.58 29.09 2ftu s HIS 4 CO 0.25 -1.84 0.90 0.94 -2.47 0.00 0.00 174.74 172.53 2ftu n GLN 5 N -3.41 -6.17 0.00 2.88 0.00 -1.26 -4.19 117.38 105.23 2ftu n GLN 5 Ca 0.07 0.69 0.00 0.00 -0.00 0.00 0.00 57.00 57.76 2ftu n GLN 5 Cb 0.59 -5.26 0.00 0.00 0.00 0.00 0.00 30.24 25.57 2ftu n GLN 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2ftu n GLY 6 N -1.69 1.66 1.43 1.69 0.00 -1.26 -4.90 105.19 102.13 2ftu n GLY 6 Ca -0.01 -0.09 0.18 0.00 0.00 0.00 0.00 46.02 46.11 2ftu n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ftu n TYR 7 N 0.00 -3.66 -1.57 1.61 4.02 -1.26 -3.90 117.16 112.40 2ftu n TYR 7 Ca 0.00 1.90 -0.36 0.00 -0.01 0.00 0.00 57.90 59.43 2ftu n TYR 7 Cb 0.00 -3.32 0.08 0.00 -0.02 0.00 0.00 39.34 36.08 2ftu n TYR 7 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2ftu n SER 8 N -4.34 1.69 0.00 7.72 7.64 -1.26 -3.48 113.62 121.60 2ftu n SER 8 Ca -0.03 0.77 0.00 0.00 1.01 0.00 0.00 58.87 60.62 2ftu n SER 8 Cb 0.68 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.35 2ftu n SER 8 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2ftu n THR 9 N -2.22 0.00 -3.00 0.44 5.66 -1.26 -4.37 114.28 109.53 2ftu n THR 9 Ca 0.15 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 61.08 2ftu n THR 9 Cb 0.49 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.27 2ftu n THR 9 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2ftu n GLU 10 N 0.00 -2.12 -2.18 1.09 1.02 -1.23 -4.88 120.64 112.34 2ftu n GLU 10 Ca 0.00 1.88 -0.39 0.00 -0.02 0.00 0.00 57.16 58.64 2ftu n GLU 10 Cb 0.00 -3.65 -0.03 0.00 -0.02 0.00 0.00 31.44 27.74 2ftu n GLU 10 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ftu s ALA 11 N -1.59 2.32 -1.59 0.62 0.00 -1.26 -4.86 121.76 115.39 2ftu s ALA 11 Ca 0.10 -0.89 0.18 0.00 0.00 0.00 0.00 51.96 51.34 2ftu s ALA 11 Cb -0.02 -4.30 0.94 0.00 0.00 0.00 0.00 23.12 19.73 2ftu s ALA 11 CO 0.56 -3.76 1.51 0.39 0.00 0.00 0.00 175.76 174.46 2ftu n GLU 12 N 9.23 0.34 0.11 0.00 1.02 -1.26 -3.43 120.64 126.65 2ftu n GLU 12 Ca 0.16 0.09 0.09 0.00 -0.02 0.00 0.00 57.16 57.48 2ftu n GLU 12 Cb 0.51 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.45 2ftu n GLU 12 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2ftu h PHE 13 N 0.00 0.00 0.00 -0.32 0.04 -1.97 -3.40 116.94 111.30 2ftu h PHE 13 Ca 0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2ftu h PHE 13 Cb 0.12 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.23 2ftu h PHE 13 CO 0.00 0.13 -0.44 -0.85 -0.60 0.00 0.00 178.31 176.55 2ftu n GLU 14 N -2.82 0.00 0.00 1.51 0.28 -1.22 -4.61 120.64 113.78 2ftu n GLU 14 Ca -0.01 -0.88 0.00 0.00 -0.16 0.00 0.00 57.16 56.11 2ftu n GLU 14 Cb 0.61 -0.31 0.00 0.00 1.43 0.00 0.00 31.44 33.17 2ftu n GLU 14 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2ftu n GLU 15 N 0.05 0.00 0.00 3.44 0.00 -1.25 -4.69 120.64 118.19 2ftu n GLU 15 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2ftu n GLU 15 Cb 0.70 -0.15 0.00 0.00 0.00 0.00 0.00 31.44 31.99 2ftu n GLU 15 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 2ftu n PRO 16 N -2.46 -0.37 0.00 5.31 -0.04 -1.26 -4.85 135.00 131.33 2ftu n PRO 16 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2ftu n PRO 16 Cb 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.54 2ftu n PRO 16 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2ftu n ARG 17 N -1.08 0.82 -0.07 0.54 0.63 -1.26 -3.70 116.66 112.53 2ftu n ARG 17 Ca 0.00 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.87 2ftu n ARG 17 Cb 0.00 -1.34 -0.02 0.00 0.45 0.00 0.00 32.46 31.55 2ftu n ARG 17 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2ftu n VAL 18 N 0.20 1.43 0.02 5.15 0.31 -1.26 -1.26 118.33 122.93 2ftu n VAL 18 Ca 0.00 0.20 0.12 0.00 -0.01 0.00 0.00 64.34 64.65 2ftu n VAL 18 Cb 0.25 -2.38 0.56 0.00 -0.91 0.00 0.00 33.84 31.36 2ftu n VAL 18 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2ftu h ILE 19 N -1.00 0.92 -0.27 2.52 1.08 -1.82 -1.32 117.51 117.62 2ftu h ILE 19 Ca -0.01 -0.09 -0.03 0.00 -0.39 0.00 0.00 64.86 64.34 2ftu h ILE 19 Cb 0.59 0.64 -0.01 0.00 -3.07 0.00 0.00 36.82 34.97 2ftu h ILE 19 CO -0.01 0.05 0.06 -0.78 -0.69 0.00 0.00 178.15 176.78 2ftu h ASP 20 N 0.25 0.41 -0.51 1.72 3.58 -1.71 -1.06 116.42 119.11 2ftu h ASP 20 Ca 0.19 -0.24 0.10 0.00 0.42 0.00 0.00 57.03 57.50 2ftu h ASP 20 Cb 0.43 -0.11 -0.10 0.00 1.72 0.00 0.00 39.33 41.27 2ftu h ASP 20 CO -0.04 0.55 -0.18 0.25 -2.88 0.00 0.00 179.24 176.94 2ftu h LEU 21 N 0.26 -0.63 -1.42 2.28 5.85 -0.10 0.43 115.31 121.99 2ftu h LEU 21 Ca 0.08 0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.92 2ftu h LEU 21 Cb 0.30 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2ftu h LEU 21 CO 0.00 -0.21 -0.21 -0.50 -0.34 0.00 0.00 178.44 177.18 2ftu h TRP 22 N -0.06 0.13 0.48 1.25 -0.00 -1.05 -0.43 115.95 116.27 2ftu h TRP 22 Ca 0.24 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 59.10 2ftu h TRP 22 Cb 0.43 -0.04 -0.01 0.00 -0.00 0.00 0.00 29.16 29.55 2ftu h TRP 22 CO -0.47 0.33 -0.34 0.22 -0.00 0.00 0.00 178.44 178.17 2ftu h ASP 23 N 0.11 -0.89 1.17 -3.49 3.58 0.39 -2.60 116.42 114.69 2ftu h ASP 23 Ca 0.02 0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 2ftu h ASP 23 Cb 0.44 0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.77 2ftu h ASP 23 CO 0.03 -0.52 -0.00 -0.07 -2.88 0.00 0.00 179.24 175.80 2ftu h LEU 24 N -0.80 0.00 -2.01 2.28 4.07 -1.13 -2.55 115.31 115.17 2ftu h LEU 24 Ca -0.05 0.00 0.11 0.00 0.08 0.00 0.00 57.88 58.02 2ftu h LEU 24 Cb 0.68 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.40 2ftu h LEU 24 CO 0.02 0.00 0.41 0.00 -1.08 0.00 0.00 178.44 177.79 2ftu h ALA 25 N 2.00 2.10 0.00 1.53 0.00 -0.67 -1.38 119.26 122.84 2ftu h ALA 25 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ftu h ALA 25 Cb 0.59 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2ftu h ALA 25 CO 0.00 -0.61 0.31 -0.56 0.00 0.00 0.00 179.25 178.40 2ftu h GLN 26 N 0.00 0.00 0.00 0.00 3.07 -1.46 -2.59 115.11 114.13 2ftu h GLN 26 Ca 0.18 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.82 2ftu h GLN 26 Cb 0.99 0.00 -0.14 0.00 0.08 0.00 0.00 27.48 28.41 2ftu h GLN 26 CO -0.00 0.00 -0.37 0.43 0.09 0.00 0.00 178.83 178.98 2ftu n SER 27 N -2.32 -0.45 -2.00 0.06 7.64 -0.60 -5.03 113.62 110.92 2ftu n SER 27 Ca -0.01 -1.82 -0.12 0.00 1.01 0.00 0.00 58.87 57.93 2ftu n SER 27 Cb 0.34 0.13 -0.16 0.00 -1.01 0.00 0.00 64.21 63.51 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 0.08 6.29 -2.84 -0.43 0.00 -0.71 -4.62 120.51 118.27 2ftu n ALA 28 Ca -0.16 -1.81 -0.19 0.00 0.00 0.00 0.00 53.44 51.28 2ftu n ALA 28 Cb 0.74 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.93 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 2.39 -4.52 -4.94 0.00 5.15 -1.26 -4.99 115.26 107.08 2ftu n ASN 29 Ca 0.42 -0.11 -0.24 0.00 -0.60 0.00 0.00 54.58 54.05 2ftu n ASN 29 Cb 0.89 -3.75 0.05 0.00 -0.53 0.00 0.00 39.78 36.43 2ftu n ASN 29 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 2ftu s LEU 30 N -6.15 3.07 0.39 1.20 0.05 -1.26 -4.96 118.68 111.02 2ftu s LEU 30 Ca 0.19 0.31 -0.11 0.00 0.05 0.00 0.00 54.13 54.57 2ftu s LEU 30 Cb -0.09 -3.08 -0.07 0.00 -2.05 0.00 0.00 46.19 40.90 2ftu s LEU 30 CO 0.23 -1.32 0.75 0.42 -0.55 0.00 0.00 176.35 175.88 2ftu s THR 31 N -3.01 4.79 0.11 5.48 -4.23 -1.24 -4.94 115.64 112.60 2ftu s THR 31 Ca 0.58 0.62 0.28 0.00 -1.18 0.00 0.00 61.69 61.98 2ftu s THR 31 Cb -0.11 -3.72 0.30 0.00 1.34 0.00 0.00 72.50 70.32 2ftu s THR 31 CO 0.42 -0.47 1.89 0.44 -0.54 0.00 0.00 174.62 176.36 2ftu h ASP 32 N 1.40 0.00 0.29 3.99 3.32 -1.96 0.16 116.42 123.62 2ftu h ASP 32 Ca -0.47 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 2ftu h ASP 32 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2ftu h ASP 32 CO 0.64 0.12 -0.14 0.50 -1.72 0.00 0.00 179.24 178.65 2ftu h LYS 33 N 0.00 -0.37 -0.60 3.56 1.63 -1.94 -2.46 116.57 116.39 2ftu h LYS 33 Ca -0.00 0.03 0.05 0.00 -0.85 0.00 0.00 60.65 59.87 2ftu h LYS 33 Cb 0.65 0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.33 2ftu h LYS 33 CO 0.02 -0.16 0.40 1.49 -3.45 0.00 0.00 179.45 177.74 2ftu h GLU 34 N -1.06 0.61 0.56 1.90 4.22 -1.77 -1.60 114.58 117.44 2ftu h GLU 34 Ca -0.04 -0.04 -0.02 0.00 0.08 0.00 0.00 59.36 59.35 2ftu h GLU 34 Cb 0.38 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2ftu h GLU 34 CO 0.06 0.41 -0.45 1.25 -2.18 0.00 0.00 179.01 178.10 2ftu h LEU 35 N 0.63 -1.19 -1.50 1.64 7.12 -0.73 0.26 115.31 121.55 2ftu h LEU 35 Ca 0.25 0.09 0.01 0.00 0.13 0.00 0.00 57.88 58.35 2ftu h LEU 35 Cb 0.20 0.38 -0.03 0.00 -0.53 0.00 0.00 40.66 40.68 2ftu h LEU 35 CO -0.07 -0.64 0.34 -0.08 -0.13 0.00 0.00 178.44 177.86 2ftu h GLU 36 N -0.98 0.67 0.22 1.25 4.57 -0.88 0.28 114.58 119.71 2ftu h GLU 36 Ca -0.06 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.06 2ftu h GLU 36 Cb 0.83 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 2ftu h GLU 36 CO -0.00 0.44 -0.10 0.00 -1.18 0.00 0.00 179.01 178.17 2ftu h ALA 37 N 1.68 -0.29 -0.82 2.92 0.00 -1.01 -1.78 119.26 119.96 2ftu h ALA 37 Ca 0.19 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 55.12 2ftu h ALA 37 Cb -0.07 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 17.75 2ftu h ALA 37 CO -0.04 -0.60 0.42 0.35 0.00 0.00 0.00 179.25 179.37 2ftu h PHE 38 N -0.42 0.74 -0.38 0.00 3.04 0.17 -1.86 116.94 118.23 2ftu h PHE 38 Ca -0.03 0.03 -0.06 0.00 3.98 0.00 0.00 57.97 61.89 2ftu h PHE 38 Cb 0.32 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.61 2ftu h PHE 38 CO -0.03 0.21 0.00 -0.09 -2.02 0.00 0.00 178.31 176.38 2ftu h ARG 39 N 0.63 0.67 0.10 1.11 1.12 -0.06 0.29 114.38 118.24 2ftu h ARG 39 Ca 0.43 -0.21 -0.00 0.00 -1.11 0.00 0.00 59.98 59.08 2ftu h ARG 39 Cb 0.56 -0.06 0.00 0.00 -0.01 0.00 0.00 29.97 30.46 2ftu h ARG 39 CO -0.33 0.77 -0.05 1.05 -3.11 0.00 0.00 179.97 178.30 2ftu h GLU 40 N 0.49 -0.13 -0.28 0.20 4.11 -1.09 -0.74 114.58 117.14 2ftu h GLU 40 Ca 0.11 0.01 -0.02 0.00 0.07 0.00 0.00 59.36 59.53 2ftu h GLU 40 Cb 0.46 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2ftu h GLU 40 CO 0.02 0.16 0.09 1.05 0.07 0.00 0.00 179.01 180.39 2ftu h GLU 41 N -0.41 0.39 -0.20 1.06 4.11 -1.06 -1.53 114.58 116.93 2ftu h GLU 41 Ca -0.01 -0.05 -0.05 0.00 0.07 0.00 0.00 59.36 59.32 2ftu h GLU 41 Cb 0.34 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2ftu h GLU 41 CO 0.02 0.34 -0.09 -0.07 0.07 0.00 0.00 179.01 179.29 2ftu h LEU 42 N 0.39 0.43 -0.68 3.06 -0.00 -0.42 -1.66 115.31 116.42 2ftu h LEU 42 Ca 0.10 -0.40 0.05 0.00 -0.00 0.00 0.00 57.88 57.62 2ftu h LEU 42 Cb 0.12 -0.12 -0.05 0.00 -0.00 0.00 0.00 40.66 40.61 2ftu h LEU 42 CO -0.01 0.73 0.40 0.50 -0.00 0.00 0.00 178.44 180.07 2ftu h LYS 43 N 0.12 0.73 -0.42 1.13 1.63 -0.18 0.46 116.57 120.05 2ftu h LYS 43 Ca 0.05 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.77 2ftu h LYS 43 Cb 0.56 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 32.01 2ftu h LYS 43 CO 0.03 0.49 0.12 0.45 -3.45 0.00 0.00 179.45 177.08 2ftu h HIS 44 N 0.76 0.69 0.54 1.91 3.86 -1.32 -1.98 115.15 119.61 2ftu h HIS 44 Ca 0.29 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.40 2ftu h HIS 44 Cb 0.12 -0.20 0.01 0.00 1.06 0.00 0.00 27.41 28.40 2ftu h HIS 44 CO -0.06 0.64 -0.26 0.35 0.86 0.00 0.00 177.93 179.46 2ftu h PHE 45 N 0.54 -0.68 -0.82 2.45 3.57 -0.64 -1.89 116.94 119.47 2ftu h PHE 45 Ca 0.13 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.69 2ftu h PHE 45 Cb 0.29 0.22 -0.07 0.00 2.79 0.00 0.00 35.95 39.19 2ftu h PHE 45 CO 0.01 -0.37 0.49 1.05 -2.23 0.00 0.00 178.31 177.26 2ftu h GLU 46 N -0.87 0.83 0.17 1.11 -0.00 -0.14 0.13 114.58 115.82 2ftu h GLU 46 Ca -0.07 -0.05 -0.01 0.00 -0.00 0.00 0.00 59.36 59.23 2ftu h GLU 46 Cb 0.61 -0.19 0.00 0.00 -0.00 0.00 0.00 28.75 29.18 2ftu h GLU 46 CO 0.12 0.55 -0.08 0.00 -0.00 0.00 0.00 179.01 179.60 2ftu h ALA 47 N 1.42 -0.23 -0.76 1.06 0.00 -1.37 -0.42 119.26 118.95 2ftu h ALA 47 Ca 0.37 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.31 2ftu h ALA 47 Cb 0.25 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.05 2ftu h ALA 47 CO -0.20 -0.60 0.39 0.87 0.00 0.00 0.00 179.25 179.71 2ftu h LYS 48 N -0.29 0.63 0.00 0.00 1.79 -0.35 -1.74 116.57 116.61 2ftu h LYS 48 Ca -0.02 -0.04 -0.15 0.00 -2.18 0.00 0.00 60.65 58.26 2ftu h LYS 48 Cb 0.23 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.71 2ftu h LYS 48 CO 0.04 0.42 -0.78 0.97 -1.08 0.00 0.00 179.45 179.02 2ftu h ILE 49 N 0.65 1.07 -0.38 1.86 2.10 -0.61 0.05 117.51 122.24 2ftu h ILE 49 Ca 0.38 -2.55 -0.05 0.00 1.08 0.00 0.00 64.86 63.72 2ftu h ILE 49 Cb 0.43 2.50 -0.02 0.00 -1.09 0.00 0.00 36.82 38.64 2ftu h ILE 49 CO -0.28 0.61 0.04 -0.33 -1.08 0.00 0.00 178.15 177.10 2ftu h GLU 50 N 0.00 0.58 -0.11 2.19 4.39 -0.79 0.14 114.58 120.98 2ftu h GLU 50 Ca -0.03 -0.12 -0.21 0.00 0.34 0.00 0.00 59.36 59.34 2ftu h GLU 50 Cb 1.53 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 30.10 2ftu h GLU 50 CO 0.08 0.58 -0.78 0.87 -1.16 0.00 0.00 179.01 178.61 2ftu h LYS 51 N 0.56 0.61 0.26 2.33 1.79 -0.86 0.24 116.57 121.51 2ftu h LYS 51 Ca 0.12 -0.51 0.01 0.00 -2.18 0.00 0.00 60.65 58.09 2ftu h LYS 51 Cb 0.30 0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 31.03 2ftu h LYS 51 CO 0.01 1.13 -0.46 1.25 -1.08 0.00 0.00 179.45 180.30 2ftu h HIS 52 N 0.41 -1.30 -0.88 -1.35 2.76 -0.73 -1.51 115.15 112.55 2ftu h HIS 52 Ca -0.05 0.02 0.23 0.00 -2.20 0.00 0.00 60.37 58.37 2ftu h HIS 52 Cb 1.38 0.53 -0.13 0.00 1.55 0.00 0.00 27.41 30.74 2ftu h HIS 52 CO 0.07 -0.58 0.32 -0.97 -1.30 0.00 0.00 177.93 175.46 2ftu h ASN 53 N -0.79 0.17 -0.28 3.26 -1.24 -0.72 0.15 115.58 116.13 2ftu h ASN 53 Ca -0.01 0.17 -0.01 0.00 0.71 0.00 0.00 56.30 57.16 2ftu h ASN 53 Cb 0.76 0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.99 2ftu h ASN 53 CO -0.18 -0.08 0.15 -0.74 -1.29 0.00 0.00 177.43 175.29 2ftu h HIS 54 N 0.30 0.38 0.14 0.67 2.76 -0.71 -1.37 115.15 117.33 2ftu h HIS 54 Ca 0.56 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.71 2ftu h HIS 54 Cb 1.10 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.94 2ftu h HIS 54 CO -0.19 0.33 -0.07 1.88 -1.30 0.00 0.00 177.93 178.58 2ftu h TYR 55 N 0.33 -0.17 -0.70 5.26 -1.99 0.18 -1.84 116.97 118.03 2ftu h TYR 55 Ca 0.10 -0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.85 2ftu h TYR 55 Cb 0.08 0.06 -0.04 0.00 2.00 0.00 0.00 36.73 38.83 2ftu h TYR 55 CO -0.03 0.10 0.47 -0.56 -0.00 0.00 0.00 178.16 178.13 2ftu h GLN 56 N -0.44 0.86 0.16 4.88 3.07 -0.81 0.30 115.11 123.13 2ftu h GLN 56 Ca -0.02 -0.05 -0.01 0.00 0.09 0.00 0.00 58.65 58.66 2ftu h GLN 56 Cb 0.35 -0.19 0.00 0.00 0.08 0.00 0.00 27.48 27.72 2ftu h GLN 56 CO 0.03 0.57 -0.08 -0.22 0.09 0.00 0.00 178.83 179.23 2ftu h LYS 57 N 0.89 -0.21 -0.45 0.06 1.63 -1.18 -0.16 116.57 117.16 2ftu h LYS 57 Ca 0.27 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 60.12 2ftu h LYS 57 Cb -0.00 0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.65 2ftu h LYS 57 CO -0.07 -0.05 0.30 1.96 -3.45 0.00 0.00 179.45 178.14 2ftu h GLN 58 N -0.33 0.47 0.02 1.90 1.08 -0.71 -1.94 115.11 115.60 2ftu h GLN 58 Ca -0.02 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2ftu h GLN 58 Cb 0.26 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 2ftu h GLN 58 CO 0.04 0.31 -0.01 1.25 -0.95 0.00 0.00 178.83 179.46 2ftu h LEU 59 N 0.48 -0.03 -0.32 1.46 5.85 0.28 0.42 115.31 123.46 2ftu h LEU 59 Ca 0.18 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2ftu h LEU 59 Cb 0.13 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2ftu h LEU 59 CO -0.04 0.22 0.21 -0.08 -0.34 0.00 0.00 178.44 178.40 2ftu h GLU 60 N -0.27 0.42 -0.43 1.25 4.57 -0.75 0.38 114.58 119.75 2ftu h GLU 60 Ca -0.00 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.08 2ftu h GLU 60 Cb 0.26 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 2ftu h GLU 60 CO 0.01 0.29 -0.01 0.82 -1.18 0.00 0.00 179.01 178.94 2ftu h ILE 61 N 0.43 1.26 -0.01 2.32 2.04 -1.33 -0.67 117.51 121.54 2ftu h ILE 61 Ca 0.12 -1.04 -0.06 0.00 1.00 0.00 0.00 64.86 64.87 2ftu h ILE 61 Cb -0.03 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2ftu h ILE 61 CO -0.02 0.36 -0.28 0.00 0.00 0.00 0.00 178.15 178.20 2ftu h ALA 62 N 0.90 1.51 -0.16 1.87 0.00 -0.64 -1.67 119.26 121.07 2ftu h ALA 62 Ca 0.12 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 2ftu h ALA 62 Cb 0.50 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2ftu h ALA 62 CO 0.02 0.36 -0.13 1.25 0.00 0.00 0.00 179.25 180.76 2ftu h HIS 63 N 0.02 0.43 0.12 0.00 -0.00 0.33 0.13 115.15 116.18 2ftu h HIS 63 Ca 0.00 -0.12 0.01 0.00 -0.00 0.00 0.00 60.37 60.26 2ftu h HIS 63 Cb 0.51 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 27.80 2ftu h HIS 63 CO 0.00 0.73 -0.19 0.93 -0.00 0.00 0.00 177.93 179.40 2ftu h GLU 64 N 0.01 -0.36 -0.92 5.26 5.08 -0.96 0.16 114.58 122.85 2ftu h GLU 64 Ca 0.03 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.47 2ftu h GLU 64 Cb 0.64 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.91 2ftu h GLU 64 CO 0.03 -0.24 0.60 0.87 -1.00 0.00 0.00 179.01 179.27 2ftu h LYS 65 N -0.37 1.03 0.18 2.33 1.57 -1.25 -1.61 116.57 118.44 2ftu h LYS 65 Ca 0.02 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2ftu h LYS 65 Cb 0.38 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2ftu h LYS 65 CO -0.09 0.68 -0.09 1.25 -0.57 0.00 0.00 179.45 180.63 2ftu h LEU 66 N 1.06 -0.20 -1.70 2.94 5.85 -0.35 -0.06 115.31 122.84 2ftu h LEU 66 Ca 0.39 -0.31 0.08 0.00 0.84 0.00 0.00 57.88 58.88 2ftu h LEU 66 Cb 0.18 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2ftu h LEU 66 CO -0.15 0.24 0.34 -0.09 -0.34 0.00 0.00 178.44 178.45 2ftu h ARG 67 N -0.70 0.35 0.30 1.25 2.43 -0.41 0.44 114.38 118.04 2ftu h ARG 67 Ca -0.02 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2ftu h ARG 67 Cb 0.50 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2ftu h ARG 67 CO 0.04 0.23 -0.14 0.45 -1.51 0.00 0.00 179.97 179.04 2ftu h HIS 68 N 0.36 -0.37 0.00 2.20 3.86 -1.26 -3.29 115.15 116.64 2ftu h HIS 68 Ca 0.23 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.41 2ftu h HIS 68 Cb 0.43 0.12 -0.00 0.00 1.06 0.00 0.00 27.41 29.02 2ftu h HIS 68 CO -0.00 -0.06 -0.08 0.00 0.86 0.00 0.00 177.93 178.65 2ftu h ALA 69 N -0.11 1.45 0.00 2.45 0.00 0.11 -2.23 119.26 120.94 2ftu h ALA 69 Ca -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ftu h ALA 69 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2ftu h ALA 69 CO 0.07 0.10 0.00 0.39 0.00 0.00 0.00 179.25 179.81 2ftu n GLU 70 N -3.84 0.17 -0.35 0.00 1.02 0.13 -1.54 120.64 116.23 2ftu n GLU 70 Ca -0.02 0.45 0.08 0.00 -0.02 0.00 0.00 57.16 57.65 2ftu n GLU 70 Cb 0.18 -1.86 0.25 0.00 -0.02 0.00 0.00 31.44 29.99 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 -2.18 3.69 -0.03 1.62 7.64 -0.84 -3.99 113.62 119.53 2ftu n SER 71 Ca 0.02 -2.24 -0.16 0.00 1.01 0.00 0.00 58.87 57.49 2ftu n SER 71 Cb 0.19 -0.41 -0.14 0.00 -1.01 0.00 0.00 64.21 62.84 2ftu n SER 71 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2ftu n VAL 72 N 0.73 1.67 -0.55 0.44 3.14 -0.59 -5.02 118.33 118.14 2ftu n VAL 72 Ca 0.19 -0.71 0.00 0.00 -2.96 0.00 0.00 64.34 60.86 2ftu n VAL 72 Cb 0.64 -1.38 0.00 0.00 -1.06 0.00 0.00 33.84 32.03 2ftu n VAL 72 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2ftu n GLY 73 N 1.87 0.71 0.35 7.55 0.00 -1.19 -4.97 105.19 109.51 2ftu n GLY 73 Ca -0.29 -0.15 0.18 0.00 0.00 0.00 0.00 46.02 45.76 2ftu n GLY 73 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2ftu h ASP 74 N 0.00 0.00 0.00 1.61 3.58 -1.92 -3.46 116.42 116.23 2ftu h ASP 74 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2ftu h ASP 74 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2ftu h ASP 74 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 2ftu n GLY 75 N -1.38 1.83 0.42 -0.78 0.00 -1.26 -4.54 105.19 99.47 2ftu n GLY 75 Ca 0.03 -0.01 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 2ftu n GLY 75 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2ftu h GLU 76 N 0.00 -0.83 -0.01 1.61 4.22 -2.00 0.14 114.58 117.70 2ftu h GLU 76 Ca 0.00 0.06 -0.09 0.00 0.08 0.00 0.00 59.36 59.41 2ftu h GLU 76 Cb 0.00 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2ftu h GLU 76 CO 0.00 -0.55 -0.41 0.07 -2.18 0.00 0.00 179.01 175.94 2ftu h ARG 77 N -0.86 0.02 0.26 1.92 0.11 -2.00 -2.76 114.38 111.06 2ftu h ARG 77 Ca -0.05 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 60.01 2ftu h ARG 77 Cb 0.74 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.83 2ftu h ARG 77 CO -0.02 0.43 -0.12 0.28 0.10 0.00 0.00 179.97 180.64 2ftu h VAL 78 N 0.02 0.79 0.04 0.08 2.07 -1.62 0.08 116.25 117.71 2ftu h VAL 78 Ca -0.00 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 67.04 2ftu h VAL 78 Cb 0.73 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 2ftu h VAL 78 CO 0.05 0.11 -0.36 0.28 0.02 0.00 0.00 177.57 177.67 2ftu h SER 79 N -0.61 -1.09 -0.69 0.57 0.02 -1.02 -0.67 113.55 110.06 2ftu h SER 79 Ca -0.04 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2ftu h SER 79 Cb 0.44 0.42 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 2ftu h SER 79 CO 0.06 -0.43 0.44 -0.09 -1.14 0.00 0.00 176.83 175.67 2ftu h ARG 80 N -0.55 0.92 0.72 3.45 2.43 -1.44 -0.94 114.38 118.97 2ftu h ARG 80 Ca 0.05 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 2ftu h ARG 80 Cb 0.61 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2ftu h ARG 80 CO -0.26 0.62 -0.49 0.77 -1.51 0.00 0.00 179.97 179.09 2ftu h SER 81 N 0.94 -1.27 0.30 -3.80 0.02 -0.47 -1.81 113.55 107.46 2ftu h SER 81 Ca 0.25 0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.25 2ftu h SER 81 Cb -0.08 0.38 -0.00 0.00 0.14 0.00 0.00 62.40 62.83 2ftu h SER 81 CO -0.05 -0.73 -0.14 -0.09 -1.14 0.00 0.00 176.83 174.67 2ftu h ARG 82 N -1.16 0.00 0.39 3.45 2.43 -0.49 0.27 114.38 119.27 2ftu h ARG 82 Ca -0.10 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.05 2ftu h ARG 82 Cb 0.94 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 2ftu h ARG 82 CO 0.07 0.14 -0.19 1.49 -1.51 0.00 0.00 179.97 179.97 2ftu h GLU 83 N 0.00 -0.51 -0.03 0.20 4.22 -1.11 -1.72 114.58 115.64 2ftu h GLU 83 Ca -0.00 0.03 -0.09 0.00 0.08 0.00 0.00 59.36 59.39 2ftu h GLU 83 Cb 0.33 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2ftu h GLU 83 CO 0.02 -0.20 -0.39 -0.22 -2.18 0.00 0.00 179.01 176.04 2ftu h LYS 84 N -0.89 0.05 0.65 1.92 3.11 -0.98 -1.78 116.57 118.65 2ftu h LYS 84 Ca -0.05 -0.02 -0.02 0.00 -2.81 0.00 0.00 60.65 57.74 2ftu h LYS 84 Cb 0.55 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.77 2ftu h LYS 84 CO 0.09 0.43 -0.44 1.25 -2.81 0.00 0.00 179.45 177.98 2ftu h HIS 85 N 0.05 -1.17 -0.89 1.91 2.76 -0.46 -0.22 115.15 117.13 2ftu h HIS 85 Ca 0.00 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.18 2ftu h HIS 85 Cb 0.71 0.43 -0.04 0.00 1.55 0.00 0.00 27.41 30.05 2ftu h HIS 85 CO 0.00 -0.64 0.59 0.00 -1.30 0.00 0.00 177.93 176.58 2ftu h ALA 86 N -0.83 1.37 0.17 5.26 0.00 -1.14 0.11 119.26 124.20 2ftu h ALA 86 Ca -0.08 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2ftu h ALA 86 Cb 0.85 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 2ftu h ALA 86 CO 0.06 0.58 -0.33 1.25 0.00 0.00 0.00 179.25 180.80 2ftu h LEU 87 N 1.19 -0.94 -0.21 0.00 5.85 -1.19 0.17 115.31 120.20 2ftu h LEU 87 Ca 0.33 0.10 0.02 0.00 0.84 0.00 0.00 57.88 59.17 2ftu h LEU 87 Cb -0.12 0.35 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 2ftu h LEU 87 CO -0.07 -0.43 0.05 -0.07 -0.34 0.00 0.00 178.44 177.58 2ftu h LEU 88 N -0.59 0.04 -1.22 2.25 4.07 -0.15 -1.36 115.31 118.35 2ftu h LEU 88 Ca 0.02 0.03 -0.02 0.00 0.08 0.00 0.00 57.88 57.99 2ftu h LEU 88 Cb 0.59 0.03 -0.03 0.00 1.08 0.00 0.00 40.66 42.33 2ftu h LEU 88 CO -0.16 0.05 0.32 -0.08 -1.08 0.00 0.00 178.44 177.49 2ftu h GLU 89 N 0.14 0.86 -0.42 1.13 4.22 -0.70 -0.27 114.58 119.54 2ftu h GLU 89 Ca 0.09 -0.10 -0.09 0.00 0.08 0.00 0.00 59.36 59.34 2ftu h GLU 89 Cb 0.08 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2ftu h GLU 89 CO -0.11 0.65 -0.10 0.78 -2.18 0.00 0.00 179.01 178.05 2ftu h GLY 90 N 0.94 0.89 1.20 1.92 0.00 -0.26 -1.43 103.07 106.33 2ftu h GLY 90 Ca 0.22 -0.73 -0.07 0.00 0.00 0.00 0.00 47.33 46.75 2ftu h GLY 90 CO -0.03 0.67 0.08 -0.09 0.00 0.00 0.00 176.54 177.16 2ftu h ARG 91 N 0.64 0.98 -0.61 4.80 1.12 -0.58 -1.08 114.38 119.65 2ftu h ARG 91 Ca 0.11 -0.25 -0.08 0.00 -1.11 0.00 0.00 59.98 58.65 2ftu h ARG 91 Cb 0.63 -0.12 -0.02 0.00 -0.01 0.00 0.00 29.97 30.45 2ftu h ARG 91 CO 0.04 0.91 0.07 1.79 -3.11 0.00 0.00 179.97 179.68 2ftu h THR 92 N 0.92 1.26 0.01 0.20 1.35 -0.83 0.74 112.91 116.56 2ftu h THR 92 Ca 0.18 -1.05 0.02 0.00 -0.55 0.00 0.00 66.41 65.02 2ftu h THR 92 Cb 0.43 0.74 -0.03 0.00 -1.73 0.00 0.00 68.15 67.56 2ftu h THR 92 CO 0.01 0.39 -0.16 0.11 -0.25 0.00 0.00 175.52 175.62 2ftu h LYS 93 N 0.94 -0.26 0.66 4.72 1.57 -1.05 -1.30 116.57 121.85 2ftu h LYS 93 Ca 0.18 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2ftu h LYS 93 Cb 0.46 0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.84 2ftu h LYS 93 CO 0.02 -0.18 -0.32 0.93 -0.57 0.00 0.00 179.45 179.34 2ftu h GLU 94 N -0.27 -0.85 -0.39 3.15 5.08 -1.01 -1.87 114.58 118.41 2ftu h GLU 94 Ca 0.05 0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2ftu h GLU 94 Cb 0.33 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 2ftu h GLU 94 CO -0.14 -0.54 0.15 1.25 -1.00 0.00 0.00 179.01 178.73 2ftu h LEU 95 N -1.00 0.55 -0.45 1.33 7.12 -0.90 -0.76 115.31 121.20 2ftu h LEU 95 Ca -0.09 -0.18 0.09 0.00 0.13 0.00 0.00 57.88 57.83 2ftu h LEU 95 Cb 0.71 -0.14 -0.08 0.00 -0.53 0.00 0.00 40.66 40.61 2ftu h LEU 95 CO 0.15 0.58 -0.08 1.23 -0.13 0.00 0.00 178.44 180.18 2ftu h GLY 96 N 0.48 0.36 0.79 3.75 0.00 -1.27 0.28 103.07 107.48 2ftu h GLY 96 Ca 0.13 0.13 0.03 0.00 0.00 0.00 0.00 47.33 47.62 2ftu h GLY 96 CO -0.01 -0.16 0.23 -1.82 0.00 0.00 0.00 176.54 174.78 2ftu h TYR 97 N 0.03 0.42 -0.42 5.60 3.20 -1.01 -0.47 116.97 124.32 2ftu h TYR 97 Ca 0.22 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.07 2ftu h TYR 97 Cb 0.34 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 2ftu h TYR 97 CO -0.37 0.22 0.10 1.15 -1.64 0.00 0.00 178.16 177.62 2ftu h THR 98 N 0.45 1.23 0.43 1.81 2.02 0.46 -1.46 112.91 117.86 2ftu h THR 98 Ca 0.19 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 2ftu h THR 98 Cb 0.08 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 2ftu h THR 98 CO -0.13 0.29 -0.36 0.58 0.37 0.00 0.00 175.52 176.27 2ftu h VAL 99 N 0.55 0.00 -0.83 3.16 2.07 -0.44 -1.94 116.25 118.82 2ftu h VAL 99 Ca 0.13 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.86 2ftu h VAL 99 Cb 0.33 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.97 2ftu h VAL 99 CO 0.00 0.00 0.23 0.50 0.02 0.00 0.00 177.57 178.32 2ftu h LYS 100 N -0.77 0.24 0.20 1.57 3.11 -0.64 0.50 116.57 120.79 2ftu h LYS 100 Ca -0.06 -0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.76 2ftu h LYS 100 Cb 0.65 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.81 2ftu h LYS 100 CO -0.00 0.16 -0.20 0.87 -2.81 0.00 0.00 179.45 177.46 2ftu h LYS 101 N 0.25 -0.39 -0.77 1.90 1.79 -1.23 -1.42 116.57 116.70 2ftu h LYS 101 Ca 0.51 0.03 0.13 0.00 -2.18 0.00 0.00 60.65 59.13 2ftu h LYS 101 Cb 0.96 0.09 -0.09 0.00 -1.58 0.00 0.00 32.23 31.62 2ftu h LYS 101 CO -0.60 -0.26 0.37 1.25 -1.08 0.00 0.00 179.45 179.13 2ftu h HIS 102 N -0.41 0.64 -0.71 -1.35 2.76 -0.14 -1.36 115.15 114.59 2ftu h HIS 102 Ca -0.03 0.03 0.10 0.00 -2.20 0.00 0.00 60.37 58.28 2ftu h HIS 102 Cb 0.35 -0.17 -0.08 0.00 1.55 0.00 0.00 27.41 29.07 2ftu h HIS 102 CO -0.14 0.17 0.33 1.25 -1.30 0.00 0.00 177.93 178.23 2ftu h LEU 103 N 0.57 0.40 -0.10 0.26 5.85 -0.02 0.95 115.31 123.23 2ftu h LEU 103 Ca 0.41 0.07 -0.21 0.00 0.84 0.00 0.00 57.88 58.99 2ftu h LEU 103 Cb 0.54 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2ftu h LEU 103 CO -0.34 0.22 -0.97 -0.61 -0.34 0.00 0.00 178.44 176.40 2ftu h GLN 104 N 0.55 0.04 0.61 1.25 4.15 -0.33 -1.31 115.11 120.06 2ftu h GLN 104 Ca 0.36 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.69 2ftu h GLN 104 Cb 0.42 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.13 2ftu h GLN 104 CO -0.30 0.97 -0.32 0.22 -1.93 0.00 0.00 178.83 177.47 2ftu h ASP 105 N 0.01 -0.78 -0.28 -0.69 1.82 -0.19 0.81 116.42 117.13 2ftu h ASP 105 Ca -0.02 0.03 0.06 0.00 -0.39 0.00 0.00 57.03 56.72 2ftu h ASP 105 Cb 1.69 0.21 -0.08 0.00 0.68 0.00 0.00 39.33 41.84 2ftu h ASP 105 CO 0.13 -0.53 -0.34 -0.07 -1.61 0.00 0.00 179.24 176.82 2ftu h LEU 106 N -0.86 -1.10 -1.44 2.28 3.38 -0.96 0.14 115.31 116.76 2ftu h LEU 106 Ca -0.08 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2ftu h LEU 106 Cb 0.67 0.49 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2ftu h LEU 106 CO 0.11 -0.35 0.00 -1.28 0.09 0.00 0.00 178.44 177.02 2ftu h SER 107 N -0.33 0.00 -0.00 -0.43 0.87 -0.87 0.30 113.55 113.08 2ftu h SER 107 Ca 0.13 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2ftu h SER 107 Cb 0.55 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 2ftu h SER 107 CO -0.46 0.00 -0.87 0.61 -0.53 0.00 0.00 176.83 175.58 2ftu n GLY 108 N -0.51 -0.75 0.03 5.77 0.00 0.25 -3.79 105.19 106.19 2ftu n GLY 108 Ca 0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 46.02 45.45 2ftu n GLY 108 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2ftu h ARG 109 N 0.29 0.00 0.00 1.61 3.08 0.78 -3.41 114.38 116.73 2ftu h ARG 109 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ftu h ARG 109 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2ftu h ARG 109 CO 0.00 0.00 0.00 0.82 -1.07 0.00 0.00 179.97 179.72 2ftu h ILE 110 N -0.45 0.00 0.00 2.04 2.04 -0.72 -1.10 117.51 119.32 2ftu h ILE 110 Ca 0.00 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2ftu h ILE 110 Cb 0.09 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2ftu h ILE 110 CO 0.00 0.00 0.18 0.77 0.00 0.00 0.00 178.15 179.10 2ftu h SER 111 N 0.00 0.00 0.00 1.72 4.64 -1.73 -3.20 113.55 114.98 2ftu h SER 111 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ftu h SER 111 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2ftu h SER 111 CO 0.00 0.00 -0.40 -1.14 -0.87 0.00 0.00 176.83 174.42 2ftu n ARG 112 N -2.76 0.16 -3.89 4.77 0.63 -1.06 -5.08 116.66 109.43 2ftu n ARG 112 Ca -0.02 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.57 2ftu n ARG 112 Cb 0.23 -0.70 0.01 0.00 0.45 0.00 0.00 32.46 32.45 2ftu n ARG 112 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2ftu n ALA 113 N -1.83 -2.70 -1.48 5.13 0.00 -0.44 -4.81 120.51 114.38 2ftu n ALA 113 Ca 0.00 -0.40 -0.31 0.00 0.00 0.00 0.00 53.44 52.73 2ftu n ALA 113 Cb 0.20 -1.80 0.08 0.00 0.00 0.00 0.00 19.45 17.93 2ftu n ALA 113 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2ftu s ARG 114 N -6.06 2.41 3.35 0.00 1.70 -1.26 -3.62 118.95 115.47 2ftu s ARG 114 Ca 0.25 0.88 0.00 0.00 -0.47 0.00 0.00 55.73 56.39 2ftu s ARG 114 Cb -0.13 -1.94 0.00 0.00 -0.57 0.00 0.00 34.95 32.31 2ftu s ARG 114 CO 0.92 -1.45 0.00 1.58 -1.08 0.00 0.00 175.30 175.27 2ftu n HIS 115 N -3.36 -0.63 -2.91 5.89 -0.00 -1.26 -3.93 115.22 109.02 2ftu n HIS 115 Ca 0.08 0.00 -0.44 0.00 -0.00 0.00 0.00 57.72 57.36 2ftu n HIS 115 Cb 0.54 0.16 0.00 0.00 -0.00 0.00 0.00 29.99 30.70 2ftu n HIS 115 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 2ftu n ASN 116 N -2.98 5.68 -1.34 0.26 4.13 -1.26 -4.50 115.26 115.25 2ftu n ASN 116 Ca 0.00 -3.17 0.18 0.00 1.68 0.00 0.00 54.58 53.27 2ftu n ASN 116 Cb 0.00 -1.40 -0.05 0.00 -1.54 0.00 0.00 39.78 36.79 2ftu n ASN 116 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2ftu n GLU 117 N 3.02 -2.73 0.00 3.52 1.02 -1.25 -4.89 120.64 119.33 2ftu n GLU 117 Ca 0.31 1.83 0.02 0.00 -0.02 0.00 0.00 57.16 59.30 2ftu n GLU 117 Cb 0.37 -3.31 0.01 0.00 -0.02 0.00 0.00 31.44 28.49 2ftu n GLU 117 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59