#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 -0.28 8.89 0.24 -1.26 -5.09 118.33 120.84 2ftu n VAL 2 Ca 0.00 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 2ftu n VAL 2 Cb 0.00 -0.96 0.00 0.00 -1.47 0.00 0.00 33.84 31.41 2ftu n VAL 2 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2ftu n SER 3 N -5.25 0.00 -3.71 -1.34 2.88 -1.26 -5.15 113.62 99.79 2ftu n SER 3 Ca 0.09 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.49 2ftu n SER 3 Cb 0.57 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.94 2ftu n SER 3 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2ftu s HIS 4 N 2.14 -0.42 0.13 0.66 2.46 -1.26 -4.93 115.29 114.07 2ftu s HIS 4 Ca 0.00 0.92 -0.31 0.00 0.47 0.00 0.00 55.06 56.14 2ftu s HIS 4 Cb 0.00 0.17 -0.09 0.00 -0.13 0.00 0.00 32.58 32.53 2ftu s HIS 4 CO 0.00 -0.31 1.50 -1.14 -2.47 0.00 0.00 174.74 172.32 2ftu s GLN 5 N -0.33 4.26 0.00 2.88 0.74 -1.26 -4.78 119.66 121.17 2ftu s GLN 5 Ca -0.05 2.23 0.00 0.00 0.05 0.00 0.00 55.36 57.59 2ftu s GLN 5 Cb -0.03 -3.26 0.00 0.00 1.10 0.00 0.00 33.01 30.82 2ftu s GLN 5 CO 0.02 -0.55 0.00 0.41 -0.55 0.00 0.00 175.29 174.62 2ftu n GLY 6 N 3.68 0.00 1.35 2.59 0.00 -1.26 -5.02 105.19 106.52 2ftu n GLY 6 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.60 -2.34 1.61 4.02 -1.26 -5.07 117.16 113.52 2ftu n TYR 7 Ca 0.00 0.11 -0.40 0.00 -0.01 0.00 0.00 57.90 57.60 2ftu n TYR 7 Cb 0.00 0.18 -0.03 0.00 -0.02 0.00 0.00 39.34 39.47 2ftu n TYR 7 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2ftu s SER 8 N -5.47 6.99 0.00 7.72 0.01 -1.26 -4.92 113.70 116.78 2ftu s SER 8 Ca 0.00 2.40 0.00 0.00 1.31 0.00 0.00 55.95 59.66 2ftu s SER 8 Cb 0.00 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.60 2ftu s SER 8 CO 0.00 -0.35 0.42 1.07 0.41 0.00 0.00 173.24 174.79 2ftu n THR 9 N 0.86 0.00 -3.74 1.44 5.66 -1.26 -4.78 114.28 112.47 2ftu n THR 9 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 2ftu n THR 9 Cb 0.44 -0.25 -0.03 0.00 -1.55 0.00 0.00 70.33 68.94 2ftu n THR 9 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2ftu s GLU 10 N -1.68 1.50 0.52 1.09 -1.05 -1.26 -5.16 118.70 112.66 2ftu s GLU 10 Ca 0.00 -0.86 -0.18 0.00 -0.15 0.00 0.00 54.97 53.78 2ftu s GLU 10 Cb 0.00 0.56 -0.07 0.00 -0.44 0.00 0.00 34.13 34.18 2ftu s GLU 10 CO 0.00 -0.66 1.02 0.00 0.95 0.00 0.00 175.26 176.57 2ftu s ALA 11 N -3.88 2.91 0.00 -0.84 0.00 -1.26 -4.96 121.76 113.73 2ftu s ALA 11 Ca 0.09 0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.44 2ftu s ALA 11 Cb -0.02 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.90 2ftu s ALA 11 CO -0.01 -0.38 0.52 0.39 0.00 0.00 0.00 175.76 176.28 2ftu n GLU 12 N -1.43 0.63 -0.85 0.00 1.02 -1.26 -5.14 120.64 113.62 2ftu n GLU 12 Ca 0.08 -0.65 0.12 0.00 -0.02 0.00 0.00 57.16 56.68 2ftu n GLU 12 Cb 0.53 -0.70 -0.03 0.00 -0.02 0.00 0.00 31.44 31.23 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 -0.13 -2.92 -2.56 -0.32 3.72 -1.26 -4.95 117.46 109.04 2ftu n PHE 13 Ca 0.00 1.06 -0.16 0.00 -0.05 0.00 0.00 57.45 58.30 2ftu n PHE 13 Cb 0.32 -1.90 0.02 0.00 -0.94 0.00 0.00 39.48 36.97 2ftu n PHE 13 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 2ftu n GLU 14 N -3.05 -0.85 0.00 -1.08 0.00 -1.26 -4.61 120.64 109.79 2ftu n GLU 14 Ca 0.01 0.78 0.00 0.00 0.00 0.00 0.00 57.16 57.95 2ftu n GLU 14 Cb 0.39 -1.07 0.00 0.00 0.00 0.00 0.00 31.44 30.75 2ftu n GLU 14 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2ftu n GLU 15 N 0.35 0.00 -0.59 5.31 1.02 -1.26 -4.94 120.64 120.53 2ftu n GLU 15 Ca -0.04 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.80 2ftu n GLU 15 Cb 0.42 0.00 0.21 0.00 -0.02 0.00 0.00 31.44 32.04 2ftu n GLU 15 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2ftu s PRO 16 N 0.00 0.16 0.00 3.49 0.04 -1.26 -4.47 135.00 132.96 2ftu s PRO 16 Ca 0.00 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.35 2ftu s PRO 16 Cb 0.00 -1.65 0.00 0.00 0.04 0.00 0.00 34.50 32.89 2ftu s PRO 16 CO 0.00 -3.13 0.36 2.89 0.04 0.00 0.00 177.00 177.15 2ftu n ARG 17 N -4.56 0.47 -0.08 4.56 1.85 -1.26 -3.19 116.66 114.45 2ftu n ARG 17 Ca 0.08 0.00 -0.16 0.00 -1.00 0.00 0.00 57.85 56.78 2ftu n ARG 17 Cb 0.53 -1.11 -0.13 0.00 -1.05 0.00 0.00 32.46 30.70 2ftu n ARG 17 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2ftu h VAL 18 N 0.00 1.61 -0.80 8.89 2.07 -1.98 0.17 116.25 126.22 2ftu h VAL 18 Ca 0.00 -2.31 0.07 0.00 0.82 0.00 0.00 66.70 65.28 2ftu h VAL 18 Cb 0.11 3.15 -0.05 0.00 -1.52 0.00 0.00 31.29 32.98 2ftu h VAL 18 CO 0.00 0.55 0.52 0.40 0.02 0.00 0.00 177.57 179.06 2ftu h ILE 19 N -1.00 1.01 -0.45 4.57 1.08 -1.93 -0.37 117.51 120.43 2ftu h ILE 19 Ca -0.07 -0.28 -0.12 0.00 -0.39 0.00 0.00 64.86 63.99 2ftu h ILE 19 Cb 1.07 0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 34.91 2ftu h ILE 19 CO -0.04 0.15 -0.19 0.44 -0.69 0.00 0.00 178.15 177.82 2ftu h ASP 20 N 0.83 0.90 -0.49 1.72 3.32 -1.74 -1.22 116.42 119.74 2ftu h ASP 20 Ca 0.35 -0.32 0.10 0.00 0.02 0.00 0.00 57.03 57.18 2ftu h ASP 20 Cb 0.30 -0.25 -0.09 0.00 0.22 0.00 0.00 39.33 39.51 2ftu h ASP 20 CO -0.13 1.07 -0.14 0.25 -1.72 0.00 0.00 179.24 178.58 2ftu h LEU 21 N 0.78 -0.50 -1.12 1.55 7.12 0.73 0.64 115.31 124.51 2ftu h LEU 21 Ca 0.11 0.15 -0.08 0.00 0.13 0.00 0.00 57.88 58.19 2ftu h LEU 21 Cb 0.73 0.32 -0.01 0.00 -0.53 0.00 0.00 40.66 41.16 2ftu h LEU 21 CO 0.06 -0.17 -0.39 -0.50 -0.13 0.00 0.00 178.44 177.30 2ftu h TRP 22 N -0.02 0.00 0.01 1.25 4.06 -1.09 -1.41 115.95 118.74 2ftu h TRP 22 Ca 0.24 0.00 0.03 0.00 2.06 0.00 0.00 58.89 61.22 2ftu h TRP 22 Cb 0.37 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.49 2ftu h TRP 22 CO -0.43 0.39 -0.31 0.22 -3.56 0.00 0.00 178.44 174.75 2ftu h ASP 23 N 0.00 -0.93 0.65 -3.49 3.58 0.33 -2.77 116.42 113.79 2ftu h ASP 23 Ca -0.00 0.12 -0.13 0.00 0.42 0.00 0.00 57.03 57.43 2ftu h ASP 23 Cb 0.79 0.37 -0.02 0.00 1.72 0.00 0.00 39.33 42.20 2ftu h ASP 23 CO 0.05 -0.38 -0.63 -0.07 -2.88 0.00 0.00 179.24 175.33 2ftu h LEU 24 N -0.47 0.00 0.00 2.28 -0.00 -1.15 -2.63 115.31 113.35 2ftu h LEU 24 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 2ftu h LEU 24 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.21 2ftu h LEU 24 CO -0.26 0.63 0.00 0.00 -0.00 0.00 0.00 178.44 178.81 2ftu n ALA 25 N -2.41 1.25 0.94 1.53 0.00 -0.54 -0.07 120.51 121.21 2ftu n ALA 25 Ca -0.01 -0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.51 2ftu n ALA 25 Cb 0.63 -1.06 0.49 0.00 0.00 0.00 0.00 19.45 19.50 2ftu n ALA 25 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2ftu n GLN 26 N -1.42 0.34 0.00 0.00 7.27 -0.99 -4.30 117.38 118.28 2ftu n GLN 26 Ca 0.01 0.09 0.00 0.00 0.07 0.00 0.00 57.00 57.17 2ftu n GLN 26 Cb 0.04 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.19 2ftu n GLN 26 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2ftu n SER 27 N -1.22 0.00 -1.96 1.69 7.64 0.61 -5.04 113.62 115.34 2ftu n SER 27 Ca 0.10 -0.93 -0.09 0.00 1.01 0.00 0.00 58.87 58.96 2ftu n SER 27 Cb 0.13 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.20 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 0.00 5.59 -3.10 -0.43 0.00 0.90 -4.62 120.51 118.85 2ftu n ALA 28 Ca 0.00 -1.40 -0.02 0.00 0.00 0.00 0.00 53.44 52.03 2ftu n ALA 28 Cb 0.27 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.61 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 2.37 -7.64 0.00 0.00 2.85 -1.26 -4.97 115.26 106.61 2ftu n ASN 29 Ca 0.33 -0.13 0.00 0.00 -0.11 0.00 0.00 54.58 54.67 2ftu n ASN 29 Cb 0.78 -5.15 0.00 0.00 1.24 0.00 0.00 39.78 36.65 2ftu n ASN 29 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2ftu n LEU 30 N -1.86 0.00 -3.92 1.20 4.32 -1.26 -5.00 117.00 110.48 2ftu n LEU 30 Ca -0.02 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.89 2ftu n LEU 30 Cb 0.51 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.23 2ftu n LEU 30 CO 0.54 0.00 -0.18 0.42 -1.22 0.00 0.00 177.39 176.95 2ftu s THR 31 N 3.67 0.15 0.30 -5.08 -4.23 -1.26 -5.01 115.64 104.19 2ftu s THR 31 Ca 0.00 -1.25 0.11 0.00 -1.18 0.00 0.00 61.69 59.36 2ftu s THR 31 Cb 0.00 -1.23 0.01 0.00 1.34 0.00 0.00 72.50 72.62 2ftu s THR 31 CO 0.00 -0.69 1.68 -0.78 -0.54 0.00 0.00 174.62 174.28 2ftu h ASP 32 N 3.12 0.02 0.02 3.99 3.58 -1.94 0.22 116.42 125.42 2ftu h ASP 32 Ca -0.33 -0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.04 2ftu h ASP 32 Cb 1.18 -0.01 0.01 0.00 1.72 0.00 0.00 39.33 42.23 2ftu h ASP 32 CO 0.56 0.56 -0.27 0.11 -2.88 0.00 0.00 179.24 177.32 2ftu h LYS 33 N 0.01 0.15 -0.97 0.28 1.57 -1.98 -3.11 116.57 112.52 2ftu h LYS 33 Ca -0.00 -0.18 0.21 0.00 -1.87 0.00 0.00 60.65 58.80 2ftu h LYS 33 Cb 0.96 0.06 -0.09 0.00 0.08 0.00 0.00 32.23 33.24 2ftu h LYS 33 CO 0.07 0.98 0.62 1.49 -0.57 0.00 0.00 179.45 182.04 2ftu h GLU 34 N -0.60 0.53 -0.09 3.15 4.22 -1.33 0.33 114.58 120.79 2ftu h GLU 34 Ca -0.04 -0.03 -0.11 0.00 0.08 0.00 0.00 59.36 59.25 2ftu h GLU 34 Cb 1.08 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 2ftu h GLU 34 CO 0.05 0.35 -0.46 1.25 -2.18 0.00 0.00 179.01 178.02 2ftu h LEU 35 N 0.54 0.22 -0.21 1.64 7.12 -1.01 0.11 115.31 123.73 2ftu h LEU 35 Ca 0.54 -0.10 -0.12 0.00 0.13 0.00 0.00 57.88 58.32 2ftu h LEU 35 Cb 1.14 -0.06 -0.00 0.00 -0.53 0.00 0.00 40.66 41.21 2ftu h LEU 35 CO -0.28 0.66 -0.36 -0.08 -0.13 0.00 0.00 178.44 178.25 2ftu h GLU 36 N 0.17 0.61 -0.12 1.25 4.81 -0.89 -0.92 114.58 119.48 2ftu h GLU 36 Ca 0.01 -0.38 -0.01 0.00 -0.13 0.00 0.00 59.36 58.85 2ftu h GLU 36 Cb 0.89 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 2ftu h GLU 36 CO 0.07 0.99 0.03 0.00 -0.73 0.00 0.00 179.01 179.37 2ftu h ALA 37 N 0.61 0.16 -0.64 2.92 0.00 -1.07 -1.00 119.26 120.24 2ftu h ALA 37 Ca 0.01 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.82 2ftu h ALA 37 Cb 0.95 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 2ftu h ALA 37 CO 0.08 -0.20 0.38 0.35 0.00 0.00 0.00 179.25 179.86 2ftu h PHE 38 N -0.00 0.71 0.03 0.00 3.04 -0.88 -1.98 116.94 117.87 2ftu h PHE 38 Ca 0.04 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.01 2ftu h PHE 38 Cb 0.25 -0.23 0.00 0.00 2.56 0.00 0.00 35.95 38.53 2ftu h PHE 38 CO 0.01 0.39 -0.02 -0.09 -2.02 0.00 0.00 178.31 176.58 2ftu h ARG 39 N 0.74 -0.04 -0.32 1.11 2.43 -0.41 0.19 114.38 118.08 2ftu h ARG 39 Ca 0.27 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.39 2ftu h ARG 39 Cb 0.07 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2ftu h ARG 39 CO -0.13 0.04 0.02 1.05 -1.51 0.00 0.00 179.97 179.44 2ftu h GLU 40 N -0.11 0.55 -0.45 0.20 4.11 -1.10 0.13 114.58 117.91 2ftu h GLU 40 Ca -0.00 -0.16 -0.05 0.00 0.07 0.00 0.00 59.36 59.21 2ftu h GLU 40 Cb 0.10 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2ftu h GLU 40 CO 0.01 0.67 0.10 1.49 0.07 0.00 0.00 179.01 181.34 2ftu h GLU 41 N 0.37 0.73 -0.08 1.06 4.57 -1.21 -1.69 114.58 118.33 2ftu h GLU 41 Ca 0.09 -0.18 -0.07 0.00 -1.18 0.00 0.00 59.36 58.02 2ftu h GLU 41 Cb 0.40 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 2ftu h GLU 41 CO 0.01 0.74 -0.27 -0.07 -1.18 0.00 0.00 179.01 178.24 2ftu h LEU 42 N 0.60 0.14 -0.36 1.64 -0.00 -0.49 0.11 115.31 116.94 2ftu h LEU 42 Ca 0.14 -0.04 -0.17 0.00 -0.00 0.00 0.00 57.88 57.81 2ftu h LEU 42 Cb 0.35 -0.04 -0.00 0.00 -0.00 0.00 0.00 40.66 40.97 2ftu h LEU 42 CO 0.00 0.42 -0.49 0.50 -0.00 0.00 0.00 178.44 178.87 2ftu h LYS 43 N 0.13 0.85 -0.87 1.13 3.11 -0.69 0.28 116.57 120.52 2ftu h LYS 43 Ca 0.02 -0.51 -0.01 0.00 -2.81 0.00 0.00 60.65 57.34 2ftu h LYS 43 Cb 0.56 0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 31.79 2ftu h LYS 43 CO 0.04 1.15 0.51 0.45 -2.81 0.00 0.00 179.45 178.79 2ftu h HIS 44 N 0.67 1.16 0.65 1.91 3.86 -0.69 -1.95 115.15 120.77 2ftu h HIS 44 Ca 0.03 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 2ftu h HIS 44 Cb 1.09 -0.38 0.01 0.00 1.06 0.00 0.00 27.41 29.19 2ftu h HIS 44 CO 0.07 0.78 -0.31 0.35 0.86 0.00 0.00 177.93 179.67 2ftu h PHE 45 N 1.20 -0.81 -0.61 2.45 3.04 -0.39 -1.78 116.94 120.03 2ftu h PHE 45 Ca 0.31 -0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.26 2ftu h PHE 45 Cb -0.03 0.27 -0.04 0.00 2.56 0.00 0.00 35.95 38.71 2ftu h PHE 45 CO 0.00 -0.48 0.39 1.05 -2.02 0.00 0.00 178.31 177.25 2ftu h GLU 46 N -0.96 0.76 -0.23 1.11 -0.00 -0.43 0.15 114.58 114.98 2ftu h GLU 46 Ca -0.09 -0.05 0.04 0.00 -0.00 0.00 0.00 59.36 59.26 2ftu h GLU 46 Cb 0.70 -0.17 -0.04 0.00 -0.00 0.00 0.00 28.75 29.24 2ftu h GLU 46 CO 0.15 0.50 -0.01 0.00 -0.00 0.00 0.00 179.01 179.65 2ftu h ALA 47 N 1.25 0.19 -0.43 1.06 0.00 -1.36 0.15 119.26 120.12 2ftu h ALA 47 Ca 0.24 0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.28 2ftu h ALA 47 Cb -0.03 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 2ftu h ALA 47 CO -0.08 -0.43 0.08 0.87 0.00 0.00 0.00 179.25 179.69 2ftu h LYS 48 N 0.06 0.20 0.00 0.00 6.56 -0.43 -1.75 116.57 121.22 2ftu h LYS 48 Ca 0.11 -0.01 -0.16 0.00 -1.06 0.00 0.00 60.65 59.53 2ftu h LYS 48 Cb 0.14 -0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 31.73 2ftu h LYS 48 CO -0.19 0.13 -0.80 0.97 -2.06 0.00 0.00 179.45 177.51 2ftu h ILE 49 N 0.21 1.15 -0.78 1.86 2.10 -0.35 -0.85 117.51 120.84 2ftu h ILE 49 Ca 0.21 -2.66 0.09 0.00 1.08 0.00 0.00 64.86 63.58 2ftu h ILE 49 Cb 0.27 2.55 -0.07 0.00 -1.09 0.00 0.00 36.82 38.47 2ftu h ILE 49 CO -0.28 0.65 0.43 -0.33 -1.08 0.00 0.00 178.15 177.55 2ftu h GLU 50 N 0.00 0.71 -0.01 2.19 5.08 -0.61 0.11 114.58 122.05 2ftu h GLU 50 Ca -0.03 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.10 2ftu h GLU 50 Cb 1.56 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 2ftu h GLU 50 CO 0.09 0.47 -0.83 0.87 -1.00 0.00 0.00 179.01 178.61 2ftu h LYS 51 N 0.73 0.19 -0.04 2.33 1.57 -0.59 0.31 116.57 121.07 2ftu h LYS 51 Ca 0.38 -0.19 0.03 0.00 -1.87 0.00 0.00 60.65 59.00 2ftu h LYS 51 Cb 0.35 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.66 2ftu h LYS 51 CO -0.25 0.91 -0.42 1.25 -0.57 0.00 0.00 179.45 180.37 2ftu h HIS 52 N 0.11 -1.21 -0.49 -1.35 -0.00 -0.92 -1.41 115.15 109.88 2ftu h HIS 52 Ca -0.04 0.04 0.09 0.00 -0.00 0.00 0.00 60.37 60.46 2ftu h HIS 52 Cb 1.43 0.54 -0.07 0.00 -0.00 0.00 0.00 27.41 29.31 2ftu h HIS 52 CO 0.03 -0.49 0.07 -0.97 -0.00 0.00 0.00 177.93 176.56 2ftu h ASN 53 N -0.55 -0.06 -0.17 3.26 -1.24 -0.38 0.21 115.58 116.65 2ftu h ASN 53 Ca 0.05 0.10 0.03 0.00 0.71 0.00 0.00 56.30 57.19 2ftu h ASN 53 Cb 0.65 0.15 -0.03 0.00 0.73 0.00 0.00 38.32 39.82 2ftu h ASN 53 CO -0.34 -0.00 -0.01 -0.74 -1.29 0.00 0.00 177.43 175.05 2ftu h HIS 54 N 0.20 -0.02 0.50 0.67 2.76 -0.27 0.77 115.15 119.76 2ftu h HIS 54 Ca 0.25 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.41 2ftu h HIS 54 Cb 0.35 0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.35 2ftu h HIS 54 CO -0.25 -0.03 -0.24 1.88 -1.30 0.00 0.00 177.93 177.99 2ftu h TYR 55 N 0.05 -0.62 -0.06 5.26 -1.99 -0.39 -1.81 116.97 117.40 2ftu h TYR 55 Ca 0.08 -0.01 -0.05 0.00 2.00 0.00 0.00 58.73 60.75 2ftu h TYR 55 Cb 0.10 0.20 -0.01 0.00 2.00 0.00 0.00 36.73 39.03 2ftu h TYR 55 CO -0.17 -0.33 -0.19 -0.56 -0.00 0.00 0.00 178.16 176.91 2ftu h GLN 56 N -0.78 0.10 0.01 4.88 -0.00 -0.36 0.30 115.11 119.25 2ftu h GLN 56 Ca -0.07 -0.02 -0.00 0.00 -0.00 0.00 0.00 58.65 58.56 2ftu h GLN 56 Cb 0.56 -0.01 0.00 0.00 -0.00 0.00 0.00 27.48 28.03 2ftu h GLN 56 CO 0.11 0.29 -0.01 -0.22 -0.00 0.00 0.00 178.83 179.01 2ftu h LYS 57 N 0.09 -0.02 -0.38 0.06 1.63 -0.79 0.07 116.57 117.24 2ftu h LYS 57 Ca 0.02 0.00 0.01 0.00 -0.85 0.00 0.00 60.65 59.82 2ftu h LYS 57 Cb 0.40 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.01 2ftu h LYS 57 CO 0.03 0.19 0.25 1.96 -3.45 0.00 0.00 179.45 178.43 2ftu h GLN 58 N -0.22 0.50 -0.07 1.90 1.08 -0.57 -1.90 115.11 115.83 2ftu h GLN 58 Ca -0.00 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 2ftu h GLN 58 Cb 0.21 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.53 2ftu h GLN 58 CO 0.00 0.33 0.02 1.25 -0.95 0.00 0.00 178.83 179.48 2ftu h LEU 59 N 0.51 0.11 0.07 1.46 5.85 0.11 0.18 115.31 123.60 2ftu h LEU 59 Ca 0.14 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2ftu h LEU 59 Cb -0.05 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2ftu h LEU 59 CO -0.03 0.29 -0.04 -0.08 -0.34 0.00 0.00 178.44 178.24 2ftu h GLU 60 N -0.08 -0.09 -0.18 1.25 4.57 -0.70 0.32 114.58 119.67 2ftu h GLU 60 Ca 0.02 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2ftu h GLU 60 Cb 0.22 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 2ftu h GLU 60 CO -0.00 -0.06 0.09 0.82 -1.18 0.00 0.00 179.01 178.68 2ftu h ILE 61 N -0.10 1.12 -0.56 2.32 2.04 -1.34 -1.79 117.51 119.20 2ftu h ILE 61 Ca -0.01 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.53 2ftu h ILE 61 Cb 0.08 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 2ftu h ILE 61 CO 0.02 0.11 0.37 0.00 0.00 0.00 0.00 178.15 178.65 2ftu h ALA 62 N 0.97 1.65 -0.12 1.87 0.00 -0.28 -1.82 119.26 121.52 2ftu h ALA 62 Ca 0.06 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.74 2ftu h ALA 62 Cb 0.10 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.70 2ftu h ALA 62 CO -0.01 0.30 -0.71 1.25 0.00 0.00 0.00 179.25 180.08 2ftu h HIS 63 N 0.71 0.96 0.71 0.00 6.17 -0.05 0.14 115.15 123.80 2ftu h HIS 63 Ca 0.22 -0.43 -0.03 0.00 0.71 0.00 0.00 60.37 60.83 2ftu h HIS 63 Cb -0.00 -0.14 0.00 0.00 2.52 0.00 0.00 27.41 29.79 2ftu h HIS 63 CO -0.00 1.25 -0.37 1.49 0.71 0.00 0.00 177.93 181.01 2ftu h GLU 64 N 0.39 -0.96 0.00 5.26 4.22 -0.94 -1.06 114.58 121.49 2ftu h GLU 64 Ca -0.05 0.07 -0.02 0.00 0.08 0.00 0.00 59.36 59.43 2ftu h GLU 64 Cb 1.35 0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.81 2ftu h GLU 64 CO 0.15 -0.64 -0.12 1.57 -2.18 0.00 0.00 179.01 177.79 2ftu h LYS 65 N -1.00 0.00 0.97 1.92 2.10 -1.40 -1.75 116.57 117.40 2ftu h LYS 65 Ca -0.10 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.51 2ftu h LYS 65 Cb 0.78 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.12 2ftu h LYS 65 CO 0.14 0.12 -0.46 1.25 -2.00 0.00 0.00 179.45 178.49 2ftu h LEU 66 N 0.00 -1.10 -1.81 7.07 5.85 -0.36 -0.75 115.31 124.20 2ftu h LEU 66 Ca -0.00 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2ftu h LEU 66 Cb 0.42 0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.73 2ftu h LEU 66 CO 0.02 -0.77 -0.05 0.03 -0.34 0.00 0.00 178.44 177.33 2ftu h ARG 67 N -1.34 0.05 -0.51 1.25 3.08 -0.71 0.35 114.38 116.55 2ftu h ARG 67 Ca -0.13 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 59.86 2ftu h ARG 67 Cb 1.00 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.01 2ftu h ARG 67 CO 0.22 0.11 0.12 0.45 -1.07 0.00 0.00 179.97 179.80 2ftu h HIS 68 N 0.05 0.80 0.00 3.04 3.86 -1.24 -2.11 115.15 119.55 2ftu h HIS 68 Ca 0.01 -0.07 -0.25 0.00 -1.16 0.00 0.00 60.37 58.91 2ftu h HIS 68 Cb 0.12 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.32 2ftu h HIS 68 CO 0.00 0.68 -1.48 0.00 0.86 0.00 0.00 177.93 177.99 2ftu h ALA 69 N 1.38 0.68 0.00 2.45 0.00 0.75 -3.17 119.26 121.35 2ftu h ALA 69 Ca 0.17 -1.21 -0.04 0.00 0.00 0.00 0.00 54.91 53.83 2ftu h ALA 69 Cb 0.28 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2ftu h ALA 69 CO -0.00 1.36 -0.21 0.93 0.00 0.00 0.00 179.25 181.33 2ftu h GLU 70 N 0.00 0.00 0.00 0.00 5.08 -0.47 -2.62 114.58 116.57 2ftu h GLU 70 Ca -0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2ftu h GLU 70 Cb 1.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.11 2ftu h GLU 70 CO 0.08 0.21 0.00 0.43 -1.00 0.00 0.00 179.01 178.73 2ftu n SER 71 N -4.24 0.00 -0.00 1.42 7.64 -0.80 -1.76 113.62 115.89 2ftu n SER 71 Ca -0.02 -1.21 0.03 0.00 1.01 0.00 0.00 58.87 58.68 2ftu n SER 71 Cb 0.27 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.42 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 -0.55 0.00 0.00 0.44 3.14 -0.99 -5.07 118.33 115.30 2ftu n VAL 72 Ca 0.02 -0.20 0.00 0.00 -2.96 0.00 0.00 64.34 61.19 2ftu n VAL 72 Cb 0.01 0.49 0.00 0.00 -1.06 0.00 0.00 33.84 33.28 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 1.88 1.30 5.00 7.55 0.00 -0.72 -4.99 105.19 115.22 2ftu n GLY 73 Ca -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2ftu n GLY 73 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ftu n ASP 74 N 3.62 0.00 0.00 1.61 -0.08 -1.26 -4.69 116.55 115.75 2ftu n ASP 74 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2ftu n ASP 74 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2ftu n ASP 74 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2ftu n GLY 75 N 0.00 2.08 0.31 0.27 0.00 -1.26 -4.76 105.19 101.83 2ftu n GLY 75 Ca 0.00 -0.56 -0.05 0.00 0.00 0.00 0.00 46.02 45.41 2ftu n GLY 75 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2ftu h GLU 76 N 0.00 1.07 -0.40 1.61 -0.00 -2.00 -0.80 114.58 114.06 2ftu h GLU 76 Ca 0.00 -0.13 -0.06 0.00 -0.00 0.00 0.00 59.36 59.17 2ftu h GLU 76 Cb 0.00 -0.21 -0.02 0.00 -0.00 0.00 0.00 28.75 28.52 2ftu h GLU 76 CO 0.00 0.79 -0.01 0.00 -0.00 0.00 0.00 179.01 179.80 2ftu h ARG 77 N 1.06 0.63 -0.02 1.06 3.08 -1.91 -2.03 114.38 116.25 2ftu h ARG 77 Ca 0.27 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 2ftu h ARG 77 Cb 0.03 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 2ftu h ARG 77 CO -0.04 0.66 -0.01 0.28 -1.07 0.00 0.00 179.97 179.78 2ftu h VAL 78 N 0.60 1.37 0.38 2.04 2.07 -1.56 -0.72 116.25 120.43 2ftu h VAL 78 Ca 0.12 -1.11 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 2ftu h VAL 78 Cb 0.39 2.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 2ftu h VAL 78 CO 0.01 0.29 -0.48 0.28 0.02 0.00 0.00 177.57 177.70 2ftu h SER 79 N -0.41 -1.35 0.58 0.57 0.02 -1.08 -1.91 113.55 109.97 2ftu h SER 79 Ca 0.00 0.12 -0.11 0.00 -0.84 0.00 0.00 61.79 60.96 2ftu h SER 79 Cb 0.48 0.46 -0.02 0.00 0.14 0.00 0.00 62.40 63.47 2ftu h SER 79 CO 0.00 -0.60 -0.53 0.08 -1.14 0.00 0.00 176.83 174.64 2ftu h ARG 80 N -0.89 0.00 0.81 3.45 -0.00 -1.40 -0.22 114.38 116.13 2ftu h ARG 80 Ca -0.05 0.00 -0.04 0.00 -0.00 0.00 0.00 59.98 59.90 2ftu h ARG 80 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.77 2ftu h ARG 80 CO -0.11 0.53 -0.43 0.66 -0.00 0.00 0.00 179.97 180.62 2ftu h SER 81 N 0.00 -1.03 -0.32 0.08 4.64 -1.10 -1.95 113.55 113.86 2ftu h SER 81 Ca -0.01 0.05 0.05 0.00 -0.47 0.00 0.00 61.79 61.41 2ftu h SER 81 Cb 0.96 0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 2ftu h SER 81 CO 0.07 -0.70 0.22 -0.09 -0.87 0.00 0.00 176.83 175.46 2ftu h ARG 82 N -1.13 0.23 0.57 4.77 2.43 -0.97 0.95 114.38 121.23 2ftu h ARG 82 Ca -0.11 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.02 2ftu h ARG 82 Cb 0.89 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 30.39 2ftu h ARG 82 CO 0.16 0.15 -0.27 1.49 -1.51 0.00 0.00 179.97 179.98 2ftu h GLU 83 N 0.24 -0.74 -0.08 0.20 4.81 -0.93 0.11 114.58 118.18 2ftu h GLU 83 Ca 0.14 0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 2ftu h GLU 83 Cb 0.26 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2ftu h GLU 83 CO -0.03 -0.47 -0.25 -0.22 -0.73 0.00 0.00 179.01 177.32 2ftu h LYS 84 N -1.17 0.14 0.60 1.92 3.11 -1.15 -1.84 116.57 118.19 2ftu h LYS 84 Ca -0.08 -0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 57.70 2ftu h LYS 84 Cb 0.61 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.82 2ftu h LYS 84 CO 0.13 0.39 -0.44 1.25 -2.81 0.00 0.00 179.45 177.96 2ftu h HIS 85 N 0.13 -1.20 -0.84 1.91 2.76 -0.74 -0.07 115.15 117.10 2ftu h HIS 85 Ca 0.02 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.20 2ftu h HIS 85 Cb 0.51 0.44 -0.04 0.00 1.55 0.00 0.00 27.41 29.88 2ftu h HIS 85 CO 0.00 -0.63 0.56 0.00 -1.30 0.00 0.00 177.93 176.56 2ftu h ALA 86 N -1.16 1.06 -0.17 5.26 0.00 -0.77 0.16 119.26 123.65 2ftu h ALA 86 Ca -0.08 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.82 2ftu h ALA 86 Cb 0.83 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2ftu h ALA 86 CO 0.04 0.47 -0.16 1.25 0.00 0.00 0.00 179.25 180.85 2ftu h LEU 87 N 1.14 -0.50 0.22 0.00 5.85 -1.31 0.66 115.31 121.36 2ftu h LEU 87 Ca 0.31 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 59.12 2ftu h LEU 87 Cb -0.13 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2ftu h LEU 87 CO -0.07 -0.20 -0.15 -0.07 -0.34 0.00 0.00 178.44 177.61 2ftu h LEU 88 N -0.18 -0.38 -0.59 2.25 4.07 0.04 -1.93 115.31 118.60 2ftu h LEU 88 Ca 0.11 0.03 0.03 0.00 0.08 0.00 0.00 57.88 58.12 2ftu h LEU 88 Cb 0.34 0.12 -0.04 0.00 1.08 0.00 0.00 40.66 42.16 2ftu h LEU 88 CO -0.27 -0.24 0.36 -0.08 -1.08 0.00 0.00 178.44 177.13 2ftu h GLU 89 N -0.36 0.70 -0.19 1.13 4.22 -0.54 0.81 114.58 120.35 2ftu h GLU 89 Ca -0.02 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.38 2ftu h GLU 89 Cb 0.31 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2ftu h GLU 89 CO 0.01 0.46 0.11 0.78 -2.18 0.00 0.00 179.01 178.19 2ftu h GLY 90 N 0.72 0.28 1.01 1.92 0.00 -0.85 -1.38 103.07 104.77 2ftu h GLY 90 Ca 0.24 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2ftu h GLY 90 CO -0.10 0.12 0.57 -0.09 0.00 0.00 0.00 176.54 177.04 2ftu h ARG 91 N 0.21 1.21 -0.42 4.80 1.12 -0.54 -0.73 114.38 120.04 2ftu h ARG 91 Ca 0.07 -0.09 -0.07 0.00 -1.11 0.00 0.00 59.98 58.78 2ftu h ARG 91 Cb 0.05 -0.26 -0.02 0.00 -0.01 0.00 0.00 29.97 29.73 2ftu h ARG 91 CO -0.01 0.82 -0.00 1.79 -3.11 0.00 0.00 179.97 179.46 2ftu h THR 92 N 1.23 1.26 0.31 0.20 1.35 -0.54 0.12 112.91 116.84 2ftu h THR 92 Ca 0.33 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 2ftu h THR 92 Cb -0.09 1.09 -0.03 0.00 -1.73 0.00 0.00 68.15 67.39 2ftu h THR 92 CO -0.07 0.35 -0.44 0.11 -0.25 0.00 0.00 175.52 175.22 2ftu h LYS 93 N 0.58 -0.78 -0.71 4.72 1.57 -1.02 0.20 116.57 121.13 2ftu h LYS 93 Ca 0.12 0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.97 2ftu h LYS 93 Cb 0.49 0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 2ftu h LYS 93 CO 0.02 -0.52 0.46 0.93 -0.57 0.00 0.00 179.45 179.78 2ftu h GLU 94 N -0.81 0.90 -0.13 3.15 5.08 -1.00 0.43 114.58 122.20 2ftu h GLU 94 Ca -0.02 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.09 2ftu h GLU 94 Cb 0.75 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2ftu h GLU 94 CO -0.14 0.60 -0.72 1.25 -1.00 0.00 0.00 179.01 179.00 2ftu h LEU 95 N 0.93 0.68 -0.15 1.33 7.12 -0.67 -0.29 115.31 124.25 2ftu h LEU 95 Ca 0.27 -0.43 0.04 0.00 0.13 0.00 0.00 57.88 57.89 2ftu h LEU 95 Cb -0.06 -0.20 -0.04 0.00 -0.53 0.00 0.00 40.66 39.83 2ftu h LEU 95 CO -0.08 1.19 -0.10 1.23 -0.13 0.00 0.00 178.44 180.55 2ftu h GLY 96 N 0.98 0.03 0.43 3.75 0.00 -0.10 0.14 103.07 108.29 2ftu h GLY 96 Ca -0.03 0.12 0.07 0.00 0.00 0.00 0.00 47.33 47.49 2ftu h GLY 96 CO 0.13 -0.11 0.02 -1.82 0.00 0.00 0.00 176.54 174.76 2ftu h TYR 97 N -0.10 0.01 0.13 5.60 3.20 -0.80 0.16 116.97 125.18 2ftu h TYR 97 Ca 0.09 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.00 2ftu h TYR 97 Cb 0.23 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 2ftu h TYR 97 CO -0.23 -0.05 -0.19 1.15 -1.64 0.00 0.00 178.16 177.19 2ftu h THR 98 N 0.13 0.57 0.22 1.81 2.02 -0.34 -1.82 112.91 115.49 2ftu h THR 98 Ca 0.19 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.36 2ftu h THR 98 Cb 0.25 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2ftu h THR 98 CO -0.29 0.00 -0.17 0.58 0.37 0.00 0.00 175.52 176.01 2ftu h VAL 99 N -0.38 0.64 -0.36 3.16 2.07 -0.53 -1.11 116.25 119.74 2ftu h VAL 99 Ca 0.02 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.61 2ftu h VAL 99 Cb 0.38 0.64 -0.08 0.00 -1.52 0.00 0.00 31.29 30.72 2ftu h VAL 99 CO -0.09 0.00 -0.16 0.50 0.02 0.00 0.00 177.57 177.85 2ftu h LYS 100 N -0.39 -0.09 0.30 1.57 3.11 -0.27 0.32 116.57 121.11 2ftu h LYS 100 Ca -0.01 0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.82 2ftu h LYS 100 Cb 0.35 0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.59 2ftu h LYS 100 CO -0.01 -0.06 -0.18 0.87 -2.81 0.00 0.00 179.45 177.26 2ftu h LYS 101 N -0.09 -0.44 0.21 1.90 1.79 -1.30 -1.68 116.57 116.96 2ftu h LYS 101 Ca 0.18 0.03 0.01 0.00 -2.18 0.00 0.00 60.65 58.69 2ftu h LYS 101 Cb 0.37 0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.09 2ftu h LYS 101 CO -0.42 -0.29 -0.30 0.45 -1.08 0.00 0.00 179.45 177.81 2ftu h HIS 102 N -0.46 -0.80 -0.89 -1.35 3.86 0.11 -0.82 115.15 114.81 2ftu h HIS 102 Ca -0.03 0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.29 2ftu h HIS 102 Cb 0.38 0.32 -0.08 0.00 1.06 0.00 0.00 27.41 29.09 2ftu h HIS 102 CO -0.09 -0.41 0.53 -0.07 0.86 0.00 0.00 177.93 178.75 2ftu h LEU 103 N -0.57 0.77 -0.70 2.43 3.38 -0.44 0.23 115.31 120.40 2ftu h LEU 103 Ca 0.01 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2ftu h LEU 103 Cb 0.56 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 2ftu h LEU 103 CO -0.11 0.43 0.28 1.56 0.09 0.00 0.00 178.44 180.68 2ftu h GLN 104 N 0.87 1.05 0.17 1.13 1.08 -0.68 0.97 115.11 119.70 2ftu h GLN 104 Ca 0.43 -0.19 -0.01 0.00 -1.45 0.00 0.00 58.65 57.43 2ftu h GLN 104 Cb 0.40 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 2ftu h GLN 104 CO -0.25 0.87 -0.08 0.22 -0.95 0.00 0.00 178.83 178.63 2ftu h ASP 105 N 1.00 -0.20 -0.57 1.46 1.82 0.09 -1.74 116.42 118.28 2ftu h ASP 105 Ca 0.23 -0.33 0.11 0.00 -0.39 0.00 0.00 57.03 56.65 2ftu h ASP 105 Cb 0.21 0.05 -0.11 0.00 0.68 0.00 0.00 39.33 40.16 2ftu h ASP 105 CO -0.02 0.35 -0.22 -0.07 -1.61 0.00 0.00 179.24 177.68 2ftu h LEU 106 N -0.88 -0.77 -0.24 2.28 3.38 -0.69 0.48 115.31 118.87 2ftu h LEU 106 Ca -0.02 0.19 0.03 0.00 0.09 0.00 0.00 57.88 58.17 2ftu h LEU 106 Cb 0.51 0.44 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 2ftu h LEU 106 CO 0.04 -0.24 0.03 -1.28 0.09 0.00 0.00 178.44 177.08 2ftu h SER 107 N -0.08 -0.02 -0.80 -0.43 0.87 -0.82 0.22 113.55 112.49 2ftu h SER 107 Ca 0.26 0.04 0.12 0.00 -1.23 0.00 0.00 61.79 60.99 2ftu h SER 107 Cb 0.49 0.06 -0.06 0.00 -0.44 0.00 0.00 62.40 62.45 2ftu h SER 107 CO -0.63 0.02 0.52 1.23 -0.53 0.00 0.00 176.83 177.45 2ftu h GLY 108 N 0.12 0.97 0.00 5.77 0.00 -0.03 0.28 103.07 110.19 2ftu h GLY 108 Ca 0.11 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2ftu h GLY 108 CO -0.16 0.12 0.00 0.54 0.00 0.00 0.00 176.54 177.04 2ftu n ARG 109 N -4.51 0.00 -0.25 4.80 5.12 -0.23 -4.04 116.66 117.54 2ftu n ARG 109 Ca 0.14 0.40 0.22 0.00 -1.93 0.00 0.00 57.85 56.69 2ftu n ARG 109 Cb 0.42 -1.17 0.56 0.00 -1.16 0.00 0.00 32.46 31.11 2ftu n ARG 109 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 2ftu h ILE 110 N 0.00 0.61 -0.72 0.55 1.08 -0.53 0.66 117.51 119.16 2ftu h ILE 110 Ca 0.00 -0.11 0.13 0.00 -0.39 0.00 0.00 64.86 64.49 2ftu h ILE 110 Cb 0.00 0.27 -0.09 0.00 -3.07 0.00 0.00 36.82 33.93 2ftu h ILE 110 CO 0.00 0.06 0.29 -1.28 -0.69 0.00 0.00 178.15 176.53 2ftu h SER 111 N 0.31 0.29 0.11 1.72 0.87 -1.09 -2.69 113.55 113.08 2ftu h SER 111 Ca 0.49 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 61.15 2ftu h SER 111 Cb 1.39 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.42 2ftu h SER 111 CO -0.17 0.13 -0.05 -0.09 -0.53 0.00 0.00 176.83 176.12 2ftu h ARG 112 N 0.46 -0.15 0.00 2.24 2.43 -1.00 -3.47 114.38 114.89 2ftu h ARG 112 Ca 0.39 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.57 2ftu h ARG 112 Cb 0.55 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2ftu h ARG 112 CO -0.37 0.35 0.00 0.00 -1.51 0.00 0.00 179.97 178.44 2ftu n ALA 113 N -2.52 0.00 -0.93 2.80 0.00 -1.02 -4.93 120.51 113.92 2ftu n ALA 113 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2ftu n ALA 113 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.73 2ftu n ALA 113 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2ftu n ARG 114 N -0.56 0.00 -0.67 0.00 0.00 -1.26 -4.40 116.66 109.78 2ftu n ARG 114 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 57.83 2ftu n ARG 114 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.44 2ftu n ARG 114 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 2ftu n HIS 115 N 14.00 0.00 0.00 -0.14 -0.00 -1.26 -4.97 115.22 122.84 2ftu n HIS 115 Ca 0.00 -0.18 0.00 0.00 0.46 0.00 0.00 57.72 58.00 2ftu n HIS 115 Cb 0.00 0.34 0.00 0.00 -0.12 0.00 0.00 29.99 30.21 2ftu n HIS 115 CO 0.00 0.00 0.00 -1.71 0.46 0.00 0.00 176.34 175.09 2ftu n ASN 116 N 0.00 0.00 0.00 0.26 5.15 -1.26 -4.95 115.26 114.46 2ftu n ASN 116 Ca -0.10 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.88 2ftu n ASN 116 Cb 0.56 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.81 2ftu n ASN 116 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2ftu n GLU 117 N -2.30 0.00 0.00 1.20 0.00 -1.26 -2.93 120.64 115.34 2ftu n GLU 117 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 57.16 57.20 2ftu n GLU 117 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 31.44 31.47 2ftu n GLU 117 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41