#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ftu s VAL 2 N 0.00 0.00 0.06 5.15 0.11 -1.26 -5.12 120.40 119.34 2ftu s VAL 2 Ca 0.00 -1.10 -0.01 0.00 -2.93 0.00 0.00 61.98 57.94 2ftu s VAL 2 Cb 0.00 -2.75 0.01 0.00 -1.53 0.00 0.00 36.38 32.12 2ftu s VAL 2 CO 0.00 0.00 0.06 -0.24 -3.33 0.00 0.00 175.10 171.59 2ftu n SER 3 N -1.30 -0.65 -3.49 3.54 2.88 -1.26 -5.04 113.62 108.29 2ftu n SER 3 Ca -0.06 -0.72 -0.27 0.00 -1.33 0.00 0.00 58.87 56.49 2ftu n SER 3 Cb 0.60 -0.05 -0.10 0.00 -0.75 0.00 0.00 64.21 63.91 2ftu n SER 3 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ftu n HIS 4 N -2.42 0.49 -0.71 0.66 1.44 -1.26 -5.04 115.22 108.38 2ftu n HIS 4 Ca 0.01 -3.65 -0.21 0.00 -2.01 0.00 0.00 57.72 51.86 2ftu n HIS 4 Cb 0.03 -0.10 0.18 0.00 0.12 0.00 0.00 29.99 30.22 2ftu n HIS 4 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 2ftu n GLN 5 N 2.29 -2.85 -1.59 -1.40 1.13 -1.26 -5.00 117.38 108.70 2ftu n GLN 5 Ca 0.26 -1.17 -0.21 0.00 -1.94 0.00 0.00 57.00 53.94 2ftu n GLN 5 Cb 0.45 -1.18 0.07 0.00 0.11 0.00 0.00 30.24 29.70 2ftu n GLN 5 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ftu n GLY 6 N -2.90 5.97 5.00 1.08 0.00 -1.26 -5.01 105.19 108.07 2ftu n GLY 6 Ca 0.10 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.86 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 -0.85 0.00 -2.19 1.61 4.02 -1.26 -4.85 117.16 113.64 2ftu n TYR 7 Ca 0.45 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.34 2ftu n TYR 7 Cb 0.90 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.22 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 0.72 -8.74 0.00 7.72 7.64 -1.26 -4.36 113.62 115.34 2ftu n SER 8 Ca 0.00 1.58 0.00 0.00 1.01 0.00 0.00 58.87 61.46 2ftu n SER 8 Cb 0.00 -4.98 0.00 0.00 -1.01 0.00 0.00 64.21 58.22 2ftu n SER 8 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2ftu n THR 9 N 1.92 0.00 0.00 0.44 -1.04 -1.26 -4.53 114.28 109.81 2ftu n THR 9 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2ftu n THR 9 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2ftu n THR 9 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2ftu n GLU 10 N 0.00 0.00 -3.71 -2.82 1.02 -1.26 -5.17 120.64 108.70 2ftu n GLU 10 Ca 0.00 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.92 2ftu n GLU 10 Cb 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 31.44 31.24 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 -2.00 0.48 0.00 0.62 0.00 -1.26 -4.95 121.76 114.65 2ftu s ALA 11 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.94 2ftu s ALA 11 Cb 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 23.12 22.40 2ftu s ALA 11 CO 0.00 -0.55 0.38 0.39 0.00 0.00 0.00 175.76 175.99 2ftu n GLU 12 N 5.22 0.25 0.00 0.00 1.02 -1.26 -4.61 120.64 121.26 2ftu n GLU 12 Ca -0.05 -0.44 0.00 0.00 -0.02 0.00 0.00 57.16 56.65 2ftu n GLU 12 Cb 0.50 -0.60 0.00 0.00 -0.02 0.00 0.00 31.44 31.32 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 -0.06 0.00 -3.85 -0.32 3.72 -1.26 -4.83 117.46 110.86 2ftu n PHE 13 Ca 0.00 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.13 2ftu n PHE 13 Cb 0.35 0.04 -0.17 0.00 -0.94 0.00 0.00 39.48 38.76 2ftu n PHE 13 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 2ftu s GLU 14 N -1.23 1.20 0.00 -1.08 -6.30 -1.26 -4.66 118.70 105.37 2ftu s GLU 14 Ca 0.00 -0.37 0.00 0.00 -2.50 0.00 0.00 54.97 52.10 2ftu s GLU 14 Cb 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 34.13 32.32 2ftu s GLU 14 CO 0.00 -0.42 0.00 0.39 0.02 0.00 0.00 175.26 175.25 2ftu n GLU 15 N 4.95 0.00 -1.56 4.30 1.02 -1.26 -4.90 120.64 123.19 2ftu n GLU 15 Ca -0.11 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.74 2ftu n GLU 15 Cb 0.48 0.00 0.14 0.00 -0.02 0.00 0.00 31.44 32.05 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 0.99 0.00 3.49 0.04 -1.26 -4.95 135.00 133.31 2ftu s PRO 16 Ca 0.00 0.20 0.00 0.00 0.04 0.00 0.00 61.00 61.24 2ftu s PRO 16 Cb 0.00 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.71 2ftu s PRO 16 CO 0.00 -2.28 0.10 0.54 0.04 0.00 0.00 177.00 175.40 2ftu n ARG 17 N -3.81 0.12 -0.35 4.56 1.74 -1.26 -3.86 116.66 113.81 2ftu n ARG 17 Ca 0.08 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.15 2ftu n ARG 17 Cb 0.59 -1.02 0.13 0.00 -1.02 0.00 0.00 32.46 31.14 2ftu n ARG 17 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 2ftu h VAL 18 N 0.00 1.16 -0.52 1.55 -1.51 -1.90 0.40 116.25 115.43 2ftu h VAL 18 Ca 0.00 -0.40 -0.04 0.00 -1.23 0.00 0.00 66.70 65.02 2ftu h VAL 18 Cb 0.02 -0.13 -0.02 0.00 -2.13 0.00 0.00 31.29 29.03 2ftu h VAL 18 CO 0.00 0.22 0.16 0.40 -1.23 0.00 0.00 177.57 177.11 2ftu h ILE 19 N 1.18 1.21 -0.64 7.19 1.08 -1.83 -1.74 117.51 123.96 2ftu h ILE 19 Ca 0.37 -0.71 -0.08 0.00 -0.39 0.00 0.00 64.86 64.04 2ftu h ILE 19 Cb 0.00 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.37 2ftu h ILE 19 CO -0.12 0.27 0.07 -0.78 -0.69 0.00 0.00 178.15 176.90 2ftu h ASP 20 N 0.75 1.05 -0.20 1.72 1.82 -1.59 -0.79 116.42 119.19 2ftu h ASP 20 Ca 0.17 -0.28 0.05 0.00 -0.39 0.00 0.00 57.03 56.59 2ftu h ASP 20 Cb 0.23 -0.28 -0.05 0.00 0.68 0.00 0.00 39.33 39.91 2ftu h ASP 20 CO -0.01 1.06 -0.12 -0.07 -1.61 0.00 0.00 179.24 178.50 2ftu h LEU 21 N 1.00 -0.39 -1.50 2.28 4.07 -0.13 -0.14 115.31 120.50 2ftu h LEU 21 Ca 0.19 0.09 -0.05 0.00 0.08 0.00 0.00 57.88 58.19 2ftu h LEU 21 Cb 0.48 0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.42 2ftu h LEU 21 CO 0.02 -0.16 -0.23 -0.50 -1.08 0.00 0.00 178.44 176.49 2ftu h TRP 22 N -0.11 0.00 0.05 1.13 -0.00 -1.12 -1.66 115.95 114.24 2ftu h TRP 22 Ca 0.11 0.00 0.03 0.00 -0.00 0.00 0.00 58.89 59.03 2ftu h TRP 22 Cb 0.28 0.00 -0.04 0.00 -0.00 0.00 0.00 29.16 29.40 2ftu h TRP 22 CO -0.27 0.23 -0.27 0.22 -0.00 0.00 0.00 178.44 178.35 2ftu h ASP 23 N 0.00 -0.78 0.82 -3.49 3.58 0.45 -2.63 116.42 114.38 2ftu h ASP 23 Ca -0.00 0.10 -0.08 0.00 0.42 0.00 0.00 57.03 57.47 2ftu h ASP 23 Cb 0.55 0.31 -0.01 0.00 1.72 0.00 0.00 39.33 41.89 2ftu h ASP 23 CO 0.03 -0.34 -0.38 -0.07 -2.88 0.00 0.00 179.24 175.60 2ftu h LEU 24 N -0.44 0.00 -0.61 2.28 -0.00 -0.98 -2.73 115.31 112.83 2ftu h LEU 24 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 2ftu h LEU 24 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.16 2ftu h LEU 24 CO -0.20 0.38 0.11 0.00 -0.00 0.00 0.00 178.44 178.73 2ftu n ALA 25 N -2.30 0.84 0.15 1.53 0.00 -0.65 -0.55 120.51 119.52 2ftu n ALA 25 Ca -0.00 0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.60 2ftu n ALA 25 Cb 0.51 -0.95 0.39 0.00 0.00 0.00 0.00 19.45 19.39 2ftu n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ftu n GLN 26 N -1.80 0.10 0.00 0.00 10.64 -1.03 -3.71 117.38 121.57 2ftu n GLN 26 Ca -0.01 0.56 0.00 0.00 -1.83 0.00 0.00 57.00 55.73 2ftu n GLN 26 Cb 0.13 -1.79 0.00 0.00 -0.86 0.00 0.00 30.24 27.71 2ftu n GLN 26 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2ftu n SER 27 N -1.99 0.00 -0.03 2.61 7.64 0.11 -5.06 113.62 116.89 2ftu n SER 27 Ca -0.01 -0.85 -0.13 0.00 1.01 0.00 0.00 58.87 58.89 2ftu n SER 27 Cb 0.04 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.16 2ftu n SER 27 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ftu h ALA 28 N 0.00 -0.83 0.00 -0.43 0.00 -0.90 -3.41 119.26 113.69 2ftu h ALA 28 Ca 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2ftu h ALA 28 Cb 0.43 0.99 -0.04 0.00 0.00 0.00 0.00 17.79 19.17 2ftu h ALA 28 CO 0.00 -1.02 -0.09 -1.71 0.00 0.00 0.00 179.25 176.44 2ftu n ASN 29 N -5.12 -0.34 -0.12 0.00 2.85 -1.26 -5.05 115.26 106.22 2ftu n ASN 29 Ca -0.05 -0.79 0.00 0.00 -0.11 0.00 0.00 54.58 53.63 2ftu n ASN 29 Cb 0.33 0.12 0.00 0.00 1.24 0.00 0.00 39.78 41.47 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 -0.11 0.00 -4.21 1.20 4.32 -1.26 -5.01 117.00 111.92 2ftu n LEU 30 Ca -0.08 0.00 -0.12 0.00 -0.02 0.00 0.00 56.01 55.79 2ftu n LEU 30 Cb 0.44 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.14 2ftu n LEU 30 CO -0.04 0.00 -0.34 0.42 -1.22 0.00 0.00 177.39 176.21 2ftu s THR 31 N 3.22 0.59 0.40 -5.08 -4.23 -1.26 -5.03 115.64 104.26 2ftu s THR 31 Ca 0.00 -1.95 0.21 0.00 -1.18 0.00 0.00 61.69 58.76 2ftu s THR 31 Cb 0.00 -1.98 0.22 0.00 1.34 0.00 0.00 72.50 72.08 2ftu s THR 31 CO 0.00 -0.60 1.98 0.44 -0.54 0.00 0.00 174.62 175.91 2ftu h ASP 32 N 2.80 0.00 0.09 3.99 3.32 -1.98 0.14 116.42 124.78 2ftu h ASP 32 Ca -0.36 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.41 2ftu h ASP 32 Cb 1.19 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2ftu h ASP 32 CO 0.63 0.20 -1.50 0.50 -1.72 0.00 0.00 179.24 177.34 2ftu h LYS 33 N 0.00 0.19 -0.14 3.56 3.64 -1.98 -2.76 116.57 119.08 2ftu h LYS 33 Ca -0.00 -0.32 0.04 0.00 -1.27 0.00 0.00 60.65 59.10 2ftu h LYS 33 Cb 0.43 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 2ftu h LYS 33 CO 0.03 1.15 0.11 1.49 -2.27 0.00 0.00 179.45 179.96 2ftu h GLU 34 N -0.38 0.00 0.37 1.90 4.81 -1.80 -1.42 114.58 118.06 2ftu h GLU 34 Ca -0.34 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.87 2ftu h GLU 34 Cb 1.71 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.10 2ftu h GLU 34 CO 0.00 0.00 -0.18 1.25 -0.73 0.00 0.00 179.01 179.35 2ftu h LEU 35 N 0.00 -0.42 -0.90 1.64 7.12 -0.80 -1.62 115.31 120.33 2ftu h LEU 35 Ca 0.07 -0.14 0.14 0.00 0.13 0.00 0.00 57.88 58.08 2ftu h LEU 35 Cb 0.28 0.11 -0.09 0.00 -0.53 0.00 0.00 40.66 40.43 2ftu h LEU 35 CO -0.00 -0.06 0.50 -0.08 -0.13 0.00 0.00 178.44 178.68 2ftu h GLU 36 N -0.84 0.72 0.40 1.25 4.81 -0.99 0.32 114.58 120.25 2ftu h GLU 36 Ca -0.05 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 2ftu h GLU 36 Cb 0.53 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2ftu h GLU 36 CO 0.08 0.47 -0.19 0.00 -0.73 0.00 0.00 179.01 178.65 2ftu h ALA 37 N 1.55 -0.53 -1.00 2.92 0.00 -1.37 -1.81 119.26 119.02 2ftu h ALA 37 Ca 0.48 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.40 2ftu h ALA 37 Cb 0.62 0.21 -0.09 0.00 0.00 0.00 0.00 17.79 18.52 2ftu h ALA 37 CO -0.33 -0.77 0.62 0.35 0.00 0.00 0.00 179.25 179.13 2ftu h PHE 38 N -0.60 1.09 0.03 0.00 3.04 -0.45 -1.89 116.94 118.16 2ftu h PHE 38 Ca -0.05 0.03 -0.28 0.00 3.98 0.00 0.00 57.97 61.65 2ftu h PHE 38 Cb 0.45 -0.34 0.02 0.00 2.56 0.00 0.00 35.95 38.65 2ftu h PHE 38 CO -0.03 0.36 -1.09 -0.09 -2.02 0.00 0.00 178.31 175.43 2ftu h ARG 39 N 0.88 0.69 -0.37 1.11 1.12 0.16 0.39 114.38 118.35 2ftu h ARG 39 Ca 0.53 -0.78 -0.07 0.00 -1.11 0.00 0.00 59.98 58.55 2ftu h ARG 39 Cb 0.67 0.23 -0.01 0.00 -0.01 0.00 0.00 29.97 30.85 2ftu h ARG 39 CO -0.30 1.34 -0.04 1.05 -3.11 0.00 0.00 179.97 178.92 2ftu h GLU 40 N 0.37 0.67 -0.93 0.20 4.11 -1.24 -0.91 114.58 116.86 2ftu h GLU 40 Ca -0.14 -0.23 0.03 0.00 0.07 0.00 0.00 59.36 59.09 2ftu h GLU 40 Cb 1.75 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 30.89 2ftu h GLU 40 CO 0.21 0.80 0.60 1.49 0.07 0.00 0.00 179.01 182.19 2ftu h GLU 41 N 0.48 1.14 -0.26 1.06 4.81 -1.08 -0.71 114.58 120.02 2ftu h GLU 41 Ca 0.10 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.10 2ftu h GLU 41 Cb 0.52 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2ftu h GLU 41 CO 0.03 0.75 -0.47 -0.07 -0.73 0.00 0.00 179.01 178.52 2ftu h LEU 42 N 1.17 0.76 -0.66 1.64 -0.00 -0.21 0.20 115.31 118.21 2ftu h LEU 42 Ca 0.37 -0.38 -0.05 0.00 -0.00 0.00 0.00 57.88 57.83 2ftu h LEU 42 Cb -0.00 -0.22 -0.03 0.00 -0.00 0.00 0.00 40.66 40.41 2ftu h LEU 42 CO -0.12 1.11 0.23 0.50 -0.00 0.00 0.00 178.44 180.17 2ftu h LYS 43 N 0.56 1.00 -0.27 1.13 3.64 -0.19 0.45 116.57 122.89 2ftu h LYS 43 Ca 0.03 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 2ftu h LYS 43 Cb 1.03 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 2ftu h LYS 43 CO 0.10 0.86 0.11 0.45 -2.27 0.00 0.00 179.45 178.70 2ftu h HIS 44 N 0.94 0.41 0.51 1.91 3.86 -1.05 -1.96 115.15 119.77 2ftu h HIS 44 Ca 0.22 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.37 2ftu h HIS 44 Cb 0.25 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.60 2ftu h HIS 44 CO 0.02 0.41 -0.24 0.35 0.86 0.00 0.00 177.93 179.32 2ftu h PHE 45 N 0.30 -0.63 -0.53 2.45 3.57 -0.59 -1.80 116.94 119.71 2ftu h PHE 45 Ca 0.09 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.66 2ftu h PHE 45 Cb 0.17 0.21 -0.07 0.00 2.79 0.00 0.00 35.95 39.05 2ftu h PHE 45 CO -0.01 -0.33 0.16 1.05 -2.23 0.00 0.00 178.31 176.95 2ftu h GLU 46 N -0.82 0.32 -0.17 1.11 -0.00 -0.13 0.20 114.58 115.09 2ftu h GLU 46 Ca -0.07 -0.02 0.02 0.00 -0.00 0.00 0.00 59.36 59.30 2ftu h GLU 46 Cb 0.58 -0.07 -0.02 0.00 -0.00 0.00 0.00 28.75 29.24 2ftu h GLU 46 CO 0.11 0.21 0.02 0.00 -0.00 0.00 0.00 179.01 179.35 2ftu h ALA 47 N 1.37 0.16 -0.16 1.06 0.00 -1.35 -1.01 119.26 119.34 2ftu h ALA 47 Ca 0.26 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2ftu h ALA 47 Cb 0.32 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2ftu h ALA 47 CO -0.29 -0.42 0.10 0.87 0.00 0.00 0.00 179.25 179.51 2ftu h LYS 48 N 0.08 0.21 -0.71 0.00 6.56 -0.15 -1.45 116.57 121.10 2ftu h LYS 48 Ca 0.08 -0.01 -0.04 0.00 -1.06 0.00 0.00 60.65 59.61 2ftu h LYS 48 Cb 0.08 -0.05 -0.03 0.00 -0.57 0.00 0.00 32.23 31.66 2ftu h LYS 48 CO -0.12 0.15 0.27 0.97 -2.06 0.00 0.00 179.45 178.67 2ftu h ILE 49 N 0.20 1.24 -0.22 1.86 6.09 -0.50 0.28 117.51 126.47 2ftu h ILE 49 Ca 0.06 -0.77 -0.11 0.00 -1.37 0.00 0.00 64.86 62.66 2ftu h ILE 49 Cb -0.01 0.41 -0.01 0.00 0.47 0.00 0.00 36.82 37.67 2ftu h ILE 49 CO -0.01 0.31 -0.34 -0.08 -3.07 0.00 0.00 178.15 174.96 2ftu h GLU 50 N 1.02 0.47 -0.12 2.19 4.22 -0.92 0.17 114.58 121.62 2ftu h GLU 50 Ca 0.24 -0.21 -0.20 0.00 0.08 0.00 0.00 59.36 59.27 2ftu h GLU 50 Cb 0.21 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.46 2ftu h GLU 50 CO -0.02 0.75 -0.69 0.87 -2.18 0.00 0.00 179.01 177.74 2ftu h LYS 51 N 0.40 0.68 -0.25 1.92 1.57 -0.94 0.11 116.57 120.05 2ftu h LYS 51 Ca 0.05 -0.57 0.06 0.00 -1.87 0.00 0.00 60.65 58.32 2ftu h LYS 51 Cb 0.79 0.12 -0.07 0.00 0.08 0.00 0.00 32.23 33.15 2ftu h LYS 51 CO 0.06 1.19 -0.24 1.25 -0.57 0.00 0.00 179.45 181.14 2ftu h HIS 52 N 0.36 -0.64 -0.45 -1.35 2.76 -0.74 -1.10 115.15 113.97 2ftu h HIS 52 Ca -0.05 0.04 0.09 0.00 -2.20 0.00 0.00 60.37 58.25 2ftu h HIS 52 Cb 1.33 0.32 -0.09 0.00 1.55 0.00 0.00 27.41 30.53 2ftu h HIS 52 CO 0.10 -0.32 -0.13 -0.97 -1.30 0.00 0.00 177.93 175.31 2ftu h ASN 53 N -0.24 -0.46 -0.95 3.26 -1.24 -0.56 0.10 115.58 115.49 2ftu h ASN 53 Ca 0.14 0.14 0.05 0.00 0.71 0.00 0.00 56.30 57.34 2ftu h ASN 53 Cb 0.46 0.30 -0.06 0.00 0.73 0.00 0.00 38.32 39.75 2ftu h ASN 53 CO -0.40 -0.16 0.62 -0.74 -1.29 0.00 0.00 177.43 175.46 2ftu h HIS 54 N -0.02 1.14 -0.01 0.67 2.76 -0.35 -1.56 115.15 117.78 2ftu h HIS 54 Ca 0.22 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.40 2ftu h HIS 54 Cb 0.35 -0.38 0.00 0.00 1.55 0.00 0.00 27.41 28.94 2ftu h HIS 54 CO -0.40 0.62 -0.07 1.88 -1.30 0.00 0.00 177.93 178.65 2ftu h TYR 55 N 1.14 0.09 -0.71 5.26 -1.99 0.16 -1.80 116.97 119.11 2ftu h TYR 55 Ca 0.40 -0.04 0.12 0.00 2.00 0.00 0.00 58.73 61.21 2ftu h TYR 55 Cb 0.11 -0.01 -0.05 0.00 2.00 0.00 0.00 36.73 38.78 2ftu h TYR 55 CO -0.00 0.78 0.47 -0.56 -0.00 0.00 0.00 178.16 178.85 2ftu h GLN 56 N -0.63 0.45 -0.06 4.88 3.07 -0.65 0.33 115.11 122.50 2ftu h GLN 56 Ca -0.01 -0.03 -0.05 0.00 0.09 0.00 0.00 58.65 58.66 2ftu h GLN 56 Cb 0.80 -0.10 0.00 0.00 0.08 0.00 0.00 27.48 28.25 2ftu h GLN 56 CO 0.01 0.30 -0.14 -0.22 0.09 0.00 0.00 178.83 178.87 2ftu h LYS 57 N 0.46 0.21 -0.22 0.06 3.64 -1.27 -1.70 116.57 117.74 2ftu h LYS 57 Ca 0.34 -0.14 0.06 0.00 -1.27 0.00 0.00 60.65 59.65 2ftu h LYS 57 Cb 0.69 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 2ftu h LYS 57 CO -0.11 0.74 0.25 1.96 -2.27 0.00 0.00 179.45 180.02 2ftu h GLN 58 N -0.30 0.00 -0.01 1.90 1.08 -0.38 -1.75 115.11 115.64 2ftu h GLN 58 Ca -0.00 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.05 2ftu h GLN 58 Cb 0.74 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.18 2ftu h GLN 58 CO 0.03 0.00 -0.58 1.25 -0.95 0.00 0.00 178.83 178.58 2ftu h LEU 59 N 0.00 0.53 0.23 1.46 6.46 0.06 0.67 115.31 124.72 2ftu h LEU 59 Ca 0.10 -0.75 -0.00 0.00 -0.12 0.00 0.00 57.88 57.11 2ftu h LEU 59 Cb 0.60 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 2ftu h LEU 59 CO -0.00 1.21 -0.16 -0.08 -0.62 0.00 0.00 178.44 178.78 2ftu h GLU 60 N -0.09 -0.38 -0.18 1.25 4.22 -0.65 0.48 114.58 119.23 2ftu h GLU 60 Ca -0.07 0.03 -0.09 0.00 0.08 0.00 0.00 59.36 59.31 2ftu h GLU 60 Cb 1.29 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 2ftu h GLU 60 CO 0.12 -0.25 -0.28 0.82 -2.18 0.00 0.00 179.01 177.23 2ftu h ILE 61 N -0.39 1.27 0.55 2.32 2.04 -1.42 -1.39 117.51 120.48 2ftu h ILE 61 Ca -0.02 -1.27 -0.03 0.00 1.00 0.00 0.00 64.86 64.55 2ftu h ILE 61 Cb 0.34 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 2ftu h ILE 61 CO 0.00 0.39 -0.28 0.00 0.00 0.00 0.00 178.15 178.27 2ftu h ALA 62 N 1.39 -0.76 -0.42 1.87 0.00 -0.56 -1.79 119.26 118.99 2ftu h ALA 62 Ca 0.04 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.85 2ftu h ALA 62 Cb 0.67 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 2ftu h ALA 62 CO 0.05 -0.93 0.12 1.25 0.00 0.00 0.00 179.25 179.74 2ftu h HIS 63 N -0.76 0.21 -0.10 0.00 -0.00 -0.58 0.28 115.15 114.19 2ftu h HIS 63 Ca -0.07 0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.34 2ftu h HIS 63 Cb 0.59 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.94 2ftu h HIS 63 CO -0.04 0.06 -0.04 1.49 -0.00 0.00 0.00 177.93 179.39 2ftu h GLU 64 N 0.27 -0.03 -0.20 5.26 4.81 -1.23 -1.33 114.58 122.13 2ftu h GLU 64 Ca 0.20 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.30 2ftu h GLU 64 Cb 0.22 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2ftu h GLU 64 CO -0.23 -0.02 -0.46 0.87 -0.73 0.00 0.00 179.01 178.44 2ftu h LYS 65 N -0.03 0.51 0.08 1.92 1.57 -0.84 -1.81 116.57 117.98 2ftu h LYS 65 Ca 0.06 -0.28 0.01 0.00 -1.87 0.00 0.00 60.65 58.57 2ftu h LYS 65 Cb 0.11 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 2ftu h LYS 65 CO -0.12 0.87 -0.43 1.25 -0.57 0.00 0.00 179.45 180.45 2ftu h LEU 66 N 0.42 -1.30 -1.16 2.94 6.46 -0.19 0.81 115.31 123.29 2ftu h LEU 66 Ca 0.03 0.14 -0.08 0.00 -0.12 0.00 0.00 57.88 57.84 2ftu h LEU 66 Cb 0.96 0.48 -0.01 0.00 -0.73 0.00 0.00 40.66 41.36 2ftu h LEU 66 CO 0.09 -0.44 -0.29 -0.09 -0.62 0.00 0.00 178.44 177.08 2ftu h ARG 67 N -0.60 0.21 0.00 1.25 2.43 -1.15 0.14 114.38 116.67 2ftu h ARG 67 Ca -0.00 -0.08 -0.12 0.00 -0.81 0.00 0.00 59.98 58.97 2ftu h ARG 67 Cb 0.61 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 2ftu h ARG 67 CO -0.24 0.49 -0.56 1.25 -1.51 0.00 0.00 179.97 179.39 2ftu h HIS 68 N 0.19 0.00 0.00 2.20 2.76 -1.17 -2.01 115.15 117.12 2ftu h HIS 68 Ca 0.03 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.06 2ftu h HIS 68 Cb 0.62 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.56 2ftu h HIS 68 CO 0.01 0.56 -0.64 0.00 -1.30 0.00 0.00 177.93 176.56 2ftu h ALA 69 N 1.44 0.89 -0.79 5.26 0.00 0.61 -2.56 119.26 124.12 2ftu h ALA 69 Ca -0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 2ftu h ALA 69 Cb 1.01 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 2ftu h ALA 69 CO 0.07 0.80 0.36 0.93 0.00 0.00 0.00 179.25 181.42 2ftu h GLU 70 N 0.00 1.15 0.00 0.00 5.08 -0.54 -2.31 114.58 117.95 2ftu h GLU 70 Ca -0.01 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2ftu h GLU 70 Cb 1.17 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.22 2ftu h GLU 70 CO 0.08 0.90 0.00 0.43 -1.00 0.00 0.00 179.01 179.42 2ftu n SER 71 N -4.30 0.00 -0.04 1.42 7.64 -0.78 -2.08 113.62 115.48 2ftu n SER 71 Ca 0.08 -0.52 -0.04 0.00 1.01 0.00 0.00 58.87 59.39 2ftu n SER 71 Cb 0.15 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.29 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 -0.66 0.55 0.00 0.44 3.14 -0.88 -5.06 118.33 115.86 2ftu n VAL 72 Ca 0.02 -0.33 0.00 0.00 -2.96 0.00 0.00 64.34 61.07 2ftu n VAL 72 Cb 0.01 -0.79 0.00 0.00 -1.06 0.00 0.00 33.84 32.00 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 2.53 0.47 3.55 7.55 0.00 -0.88 -5.03 105.19 113.38 2ftu n GLY 73 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.34 5.38 0.42 1.61 -1.08 -1.26 -4.86 116.67 114.54 2ftu s ASP 74 Ca 0.00 0.09 0.08 0.00 -0.52 0.00 0.00 52.55 52.20 2ftu s ASP 74 Cb 0.00 -2.54 0.88 0.00 -1.46 0.00 0.00 42.92 39.81 2ftu s ASP 74 CO 0.00 -2.35 2.04 1.23 0.52 0.00 0.00 175.17 176.61 2ftu h GLY 75 N 16.15 0.46 1.10 2.66 0.00 -1.96 -2.53 103.07 118.95 2ftu h GLY 75 Ca -0.21 -0.19 -0.15 0.00 0.00 0.00 0.00 47.33 46.78 2ftu h GLY 75 CO 1.23 0.19 -0.35 -2.09 0.00 0.00 0.00 176.54 175.51 2ftu h GLU 76 N 0.44 0.91 -0.03 4.80 4.57 -2.00 -0.50 114.58 122.77 2ftu h GLU 76 Ca 0.11 -0.47 -0.13 0.00 -1.18 0.00 0.00 59.36 57.69 2ftu h GLU 76 Cb 0.03 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 2ftu h GLU 76 CO -0.02 1.12 -0.59 0.07 -1.18 0.00 0.00 179.01 178.41 2ftu h ARG 77 N 0.73 0.10 0.43 1.92 0.11 -1.96 -3.07 114.38 112.64 2ftu h ARG 77 Ca 0.06 -0.07 -0.02 0.00 0.10 0.00 0.00 59.98 60.05 2ftu h ARG 77 Cb 0.94 0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.04 2ftu h ARG 77 CO 0.09 0.66 -0.21 0.28 0.10 0.00 0.00 179.97 180.90 2ftu h VAL 78 N 0.07 0.55 -0.31 0.08 2.07 -0.96 -0.70 116.25 117.06 2ftu h VAL 78 Ca -0.01 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.23 2ftu h VAL 78 Cb 1.07 0.71 -0.07 0.00 -1.52 0.00 0.00 31.29 31.47 2ftu h VAL 78 CO 0.08 0.06 -0.54 0.28 0.02 0.00 0.00 177.57 177.47 2ftu h SER 79 N -0.77 -1.78 0.79 0.57 0.02 -1.20 -0.40 113.55 110.78 2ftu h SER 79 Ca -0.06 0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 61.07 2ftu h SER 79 Cb 0.53 0.72 -0.01 0.00 0.14 0.00 0.00 62.40 63.79 2ftu h SER 79 CO 0.10 -0.42 -0.24 -0.09 -1.14 0.00 0.00 176.83 175.04 2ftu h ARG 80 N -0.45 0.00 0.31 3.45 2.43 -1.54 0.64 114.38 119.22 2ftu h ARG 80 Ca 0.06 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2ftu h ARG 80 Cb 0.61 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 2ftu h ARG 80 CO -0.53 0.24 -0.15 1.03 -1.51 0.00 0.00 179.97 179.05 2ftu h SER 81 N 0.00 -0.35 -0.17 -3.80 0.87 -0.49 -1.73 113.55 107.88 2ftu h SER 81 Ca -0.00 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2ftu h SER 81 Cb 0.70 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.74 2ftu h SER 81 CO 0.03 -0.22 0.11 -0.09 -0.53 0.00 0.00 176.83 176.13 2ftu h ARG 82 N -0.45 0.18 0.11 2.24 2.43 0.61 -0.19 114.38 119.30 2ftu h ARG 82 Ca -0.04 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2ftu h ARG 82 Cb 0.34 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2ftu h ARG 82 CO 0.07 0.12 -0.05 1.49 -1.51 0.00 0.00 179.97 180.08 2ftu h GLU 83 N 0.18 -0.14 -0.14 0.20 4.81 -0.75 -0.53 114.58 118.21 2ftu h GLU 83 Ca 0.07 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 2ftu h GLU 83 Cb 0.05 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2ftu h GLU 83 CO -0.01 0.16 -0.21 -0.22 -0.73 0.00 0.00 179.01 178.00 2ftu h LYS 84 N -0.45 0.24 0.80 1.92 1.63 -0.96 -1.85 116.57 117.90 2ftu h LYS 84 Ca -0.01 -0.07 -0.04 0.00 -0.85 0.00 0.00 60.65 59.68 2ftu h LYS 84 Cb 0.37 -0.03 0.01 0.00 -0.60 0.00 0.00 32.23 31.98 2ftu h LYS 84 CO 0.02 0.45 -0.40 1.25 -3.45 0.00 0.00 179.45 177.32 2ftu h HIS 85 N 0.22 -1.04 -0.92 1.91 2.76 -0.72 -0.74 115.15 116.61 2ftu h HIS 85 Ca 0.04 -0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.25 2ftu h HIS 85 Cb 0.50 0.35 -0.06 0.00 1.55 0.00 0.00 27.41 29.75 2ftu h HIS 85 CO 0.01 -0.64 0.60 0.00 -1.30 0.00 0.00 177.93 176.60 2ftu h ALA 86 N -0.90 1.49 0.19 5.26 0.00 -0.94 0.12 119.26 124.48 2ftu h ALA 86 Ca -0.11 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2ftu h ALA 86 Cb 0.85 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2ftu h ALA 86 CO 0.17 0.38 -0.33 1.25 0.00 0.00 0.00 179.25 180.72 2ftu h LEU 87 N 1.06 -0.93 -0.12 0.00 5.85 -1.23 -0.10 115.31 119.85 2ftu h LEU 87 Ca 0.40 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 59.21 2ftu h LEU 87 Cb 0.18 0.34 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 2ftu h LEU 87 CO -0.15 -0.43 0.05 -0.07 -0.34 0.00 0.00 178.44 177.50 2ftu h LEU 88 N -0.60 0.15 -0.71 2.25 3.38 -0.24 -1.90 115.31 117.64 2ftu h LEU 88 Ca 0.01 -0.13 0.09 0.00 0.09 0.00 0.00 57.88 57.94 2ftu h LEU 88 Cb 0.60 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.24 2ftu h LEU 88 CO -0.15 0.24 0.36 -0.08 0.09 0.00 0.00 178.44 178.90 2ftu h GLU 89 N 0.05 0.59 0.19 1.13 4.22 -0.78 0.24 114.58 120.21 2ftu h GLU 89 Ca 0.04 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.44 2ftu h GLU 89 Cb 0.13 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2ftu h GLU 89 CO -0.00 0.39 -0.15 0.78 -2.18 0.00 0.00 179.01 177.85 2ftu h GLY 90 N 0.61 -0.34 1.87 1.92 0.00 -0.82 -0.88 103.07 105.43 2ftu h GLY 90 Ca 0.35 0.17 -0.09 0.00 0.00 0.00 0.00 47.33 47.76 2ftu h GLY 90 CO -0.27 -0.15 -0.36 -0.09 0.00 0.00 0.00 176.54 175.67 2ftu h ARG 91 N -0.35 0.15 -0.38 4.80 9.65 -0.57 -1.31 114.38 126.37 2ftu h ARG 91 Ca -0.01 -0.06 -0.11 0.00 -1.10 0.00 0.00 59.98 58.70 2ftu h ARG 91 Cb 0.31 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 2ftu h ARG 91 CO -0.01 0.49 -0.20 1.79 2.80 0.00 0.00 179.97 184.84 2ftu h THR 92 N 0.13 1.28 0.43 0.20 1.35 -0.20 0.12 112.91 116.21 2ftu h THR 92 Ca 0.01 -1.33 -0.01 0.00 -0.55 0.00 0.00 66.41 64.53 2ftu h THR 92 Cb 0.70 1.33 -0.02 0.00 -1.73 0.00 0.00 68.15 68.43 2ftu h THR 92 CO 0.05 0.44 -0.40 0.11 -0.25 0.00 0.00 175.52 175.48 2ftu h LYS 93 N 0.61 -0.81 -0.10 4.72 1.79 -1.08 0.16 116.57 121.86 2ftu h LYS 93 Ca 0.08 0.06 0.02 0.00 -2.18 0.00 0.00 60.65 58.63 2ftu h LYS 93 Cb 0.75 0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 31.57 2ftu h LYS 93 CO 0.06 -0.54 -0.02 1.49 -1.08 0.00 0.00 179.45 179.36 2ftu h GLU 94 N -0.84 0.01 -0.00 3.15 4.81 -1.13 -0.51 114.58 120.08 2ftu h GLU 94 Ca -0.04 -0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 58.99 2ftu h GLU 94 Cb 0.74 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 2ftu h GLU 94 CO -0.05 0.01 -0.87 1.25 -0.73 0.00 0.00 179.01 178.61 2ftu h LEU 95 N 0.01 0.29 -0.49 1.64 7.12 -0.78 -1.30 115.31 121.80 2ftu h LEU 95 Ca 0.05 -0.23 0.04 0.00 0.13 0.00 0.00 57.88 57.87 2ftu h LEU 95 Cb 0.07 -0.09 -0.04 0.00 -0.53 0.00 0.00 40.66 40.07 2ftu h LEU 95 CO -0.10 1.03 0.24 1.23 -0.13 0.00 0.00 178.44 180.71 2ftu h GLY 96 N 1.76 0.67 0.73 3.75 0.00 -0.35 0.26 103.07 109.90 2ftu h GLY 96 Ca -0.05 -0.16 0.04 0.00 0.00 0.00 0.00 47.33 47.16 2ftu h GLY 96 CO 0.14 0.10 0.19 -1.82 0.00 0.00 0.00 176.54 175.14 2ftu h TYR 97 N 0.47 0.34 -0.13 5.60 3.20 -0.99 -0.17 116.97 125.29 2ftu h TYR 97 Ca 0.21 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 2ftu h TYR 97 Cb 0.13 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 2ftu h TYR 97 CO -0.11 0.16 0.03 1.15 -1.64 0.00 0.00 178.16 177.76 2ftu h THR 98 N 0.38 1.19 -0.12 1.81 2.02 -0.10 0.10 112.91 118.20 2ftu h THR 98 Ca 0.18 -0.60 0.01 0.00 0.77 0.00 0.00 66.41 66.78 2ftu h THR 98 Cb 0.12 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 2ftu h THR 98 CO -0.15 0.18 -0.15 0.58 0.37 0.00 0.00 175.52 176.34 2ftu h VAL 99 N 0.00 0.00 -0.71 3.16 2.07 -0.50 -1.95 116.25 118.33 2ftu h VAL 99 Ca 0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.64 2ftu h VAL 99 Cb 0.25 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.95 2ftu h VAL 99 CO 0.00 0.00 0.37 0.50 0.02 0.00 0.00 177.57 178.46 2ftu h LYS 100 N -0.10 0.63 0.80 1.57 3.11 -0.60 0.27 116.57 122.25 2ftu h LYS 100 Ca 0.02 -0.04 -0.04 0.00 -2.81 0.00 0.00 60.65 57.79 2ftu h LYS 100 Cb 0.16 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.25 2ftu h LYS 100 CO -0.17 0.42 -0.43 0.87 -2.81 0.00 0.00 179.45 177.33 2ftu h LYS 101 N 0.65 -1.09 0.00 1.90 1.79 -0.70 -1.47 116.57 117.65 2ftu h LYS 101 Ca 0.34 0.07 -0.03 0.00 -2.18 0.00 0.00 60.65 58.85 2ftu h LYS 101 Cb 0.30 0.25 -0.00 0.00 -1.58 0.00 0.00 32.23 31.20 2ftu h LYS 101 CO -0.24 -0.73 -0.13 0.45 -1.08 0.00 0.00 179.45 177.72 2ftu h HIS 102 N -1.13 0.00 0.21 -1.35 3.86 -0.95 -1.32 115.15 114.47 2ftu h HIS 102 Ca -0.11 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 2ftu h HIS 102 Cb 0.89 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.36 2ftu h HIS 102 CO -0.02 0.13 -0.10 1.25 0.86 0.00 0.00 177.93 180.04 2ftu h LEU 103 N 0.00 -0.24 -1.38 2.43 7.12 -0.11 0.18 115.31 123.30 2ftu h LEU 103 Ca -0.00 -0.00 -0.04 0.00 0.13 0.00 0.00 57.88 57.96 2ftu h LEU 103 Cb 0.36 0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.54 2ftu h LEU 103 CO 0.02 -0.16 -0.05 1.56 -0.13 0.00 0.00 178.44 179.68 2ftu h GLN 104 N -0.30 0.35 0.89 1.25 4.20 -0.86 0.11 115.11 120.75 2ftu h GLN 104 Ca -0.03 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 2ftu h GLN 104 Cb 0.23 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 27.97 2ftu h GLN 104 CO 0.05 0.42 -0.43 0.22 -0.67 0.00 0.00 178.83 178.42 2ftu h ASP 105 N 0.34 -1.01 -0.54 1.46 1.82 -0.49 -1.18 116.42 116.82 2ftu h ASP 105 Ca 0.07 0.03 0.09 0.00 -0.39 0.00 0.00 57.03 56.84 2ftu h ASP 105 Cb 0.30 0.26 -0.11 0.00 0.68 0.00 0.00 39.33 40.47 2ftu h ASP 105 CO 0.01 -0.70 -0.37 -0.07 -1.61 0.00 0.00 179.24 176.50 2ftu h LEU 106 N -1.24 -1.28 -1.43 2.28 3.38 -0.62 0.35 115.31 116.75 2ftu h LEU 106 Ca -0.12 0.23 0.08 0.00 0.09 0.00 0.00 57.88 58.15 2ftu h LEU 106 Cb 0.92 0.60 -0.05 0.00 0.09 0.00 0.00 40.66 42.22 2ftu h LEU 106 CO 0.20 -0.32 0.47 -1.28 0.09 0.00 0.00 178.44 177.60 2ftu h SER 107 N -0.22 0.60 0.02 -0.43 0.87 -0.63 0.26 113.55 114.02 2ftu h SER 107 Ca 0.20 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.76 2ftu h SER 107 Cb 0.56 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 2ftu h SER 107 CO -0.65 0.37 -0.01 1.23 -0.53 0.00 0.00 176.83 177.24 2ftu h GLY 108 N 0.67 -0.02 0.57 5.77 0.00 -0.22 -3.22 103.07 106.61 2ftu h GLY 108 Ca 0.32 0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.66 2ftu h GLY 108 CO -0.11 -0.01 -0.02 3.21 0.00 0.00 0.00 176.54 179.62 2ftu h ARG 109 N -0.79 -0.04 0.28 4.80 2.47 0.06 -2.37 114.38 118.79 2ftu h ARG 109 Ca -0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2ftu h ARG 109 Cb 0.73 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 29.05 2ftu h ARG 109 CO 0.00 0.38 -0.24 0.82 0.56 0.00 0.00 179.97 181.49 2ftu h ILE 110 N -0.47 0.49 0.00 2.04 1.08 -0.75 -1.18 117.51 118.72 2ftu h ILE 110 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2ftu h ILE 110 Cb 0.44 0.49 0.00 0.00 -3.07 0.00 0.00 36.82 34.68 2ftu h ILE 110 CO 0.01 0.00 0.00 -1.20 -0.69 0.00 0.00 178.15 176.27 2ftu n SER 111 N -5.37 0.23 0.00 1.72 7.64 -1.21 -1.89 113.62 114.74 2ftu n SER 111 Ca -0.09 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.35 2ftu n SER 111 Cb 0.27 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 2ftu n SER 111 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2ftu n ARG 112 N -1.75 0.00 -1.99 1.43 3.00 -0.89 -5.07 116.66 111.38 2ftu n ARG 112 Ca 0.03 0.46 0.00 0.00 -0.00 0.00 0.00 57.85 58.34 2ftu n ARG 112 Cb 0.20 -1.03 0.00 0.00 0.00 0.00 0.00 32.46 31.62 2ftu n ARG 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ftu n ALA 113 N -1.88 -1.67 -0.10 5.13 0.00 -0.47 -5.05 120.51 116.46 2ftu n ALA 113 Ca 0.00 0.33 -0.16 0.00 0.00 0.00 0.00 53.44 53.62 2ftu n ALA 113 Cb 0.00 -1.17 -0.05 0.00 0.00 0.00 0.00 19.45 18.23 2ftu n ALA 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ftu n ARG 114 N 1.85 0.55 0.00 0.00 5.12 -1.26 -5.03 116.66 117.88 2ftu n ARG 114 Ca 0.00 0.24 0.00 0.00 -1.93 0.00 0.00 57.85 56.16 2ftu n ARG 114 Cb 0.00 -1.46 0.00 0.00 -1.16 0.00 0.00 32.46 29.84 2ftu n ARG 114 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2ftu n HIS 115 N -4.40 0.00 -4.11 -1.55 8.25 -1.26 -5.13 115.22 107.02 2ftu n HIS 115 Ca -0.27 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.11 2ftu n HIS 115 Cb 0.63 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.64 2ftu n HIS 115 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2ftu s ASN 116 N 0.00 0.46 0.69 0.41 0.01 -1.26 -4.67 114.94 110.57 2ftu s ASN 116 Ca 0.00 -1.07 -0.17 0.00 -0.71 0.00 0.00 52.86 50.91 2ftu s ASN 116 Cb 0.00 0.23 0.01 0.00 0.41 0.00 0.00 41.25 41.90 2ftu s ASN 116 CO 0.00 -0.64 1.19 -0.62 -1.51 0.00 0.00 177.10 175.52 2ftu n GLU 117 N 0.03 0.79 0.00 -0.60 4.71 -1.26 -4.89 120.64 119.43 2ftu n GLU 117 Ca -0.11 0.33 0.12 0.00 -0.01 0.00 0.00 57.16 57.49 2ftu n GLU 117 Cb 0.62 -2.42 0.20 0.00 -1.01 0.00 0.00 31.44 28.82 2ftu n GLU 117 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50