#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 1.28 -2.99 8.89 0.24 -1.26 -4.92 118.33 119.57 2ftu n VAL 2 Ca 0.00 -2.97 -0.16 0.00 -2.04 0.00 0.00 64.34 59.17 2ftu n VAL 2 Cb 0.00 1.18 -0.02 0.00 -1.47 0.00 0.00 33.84 33.53 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 -0.56 -1.47 -2.97 -1.34 2.88 -1.26 -4.52 113.62 104.39 2ftu n SER 3 Ca 0.08 -2.93 -0.15 0.00 -1.33 0.00 0.00 58.87 54.55 2ftu n SER 3 Cb 0.81 0.58 -0.01 0.00 -0.75 0.00 0.00 64.21 64.84 2ftu n SER 3 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2ftu n HIS 4 N 1.80 -2.17 0.00 0.66 -0.00 -1.26 -5.08 115.22 109.17 2ftu n HIS 4 Ca 0.17 -2.47 0.00 0.00 -0.00 0.00 0.00 57.72 55.42 2ftu n HIS 4 Cb 0.57 0.78 0.00 0.00 -0.00 0.00 0.00 29.99 31.33 2ftu n HIS 4 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.34 177.28 2ftu n GLN 5 N 1.87 0.00 -3.34 1.57 7.27 -1.26 -4.84 117.38 118.65 2ftu n GLN 5 Ca 0.16 0.00 -0.18 0.00 0.07 0.00 0.00 57.00 57.05 2ftu n GLN 5 Cb 0.57 0.00 0.06 0.00 2.41 0.00 0.00 30.24 33.28 2ftu n GLN 5 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2ftu n GLY 6 N 0.00 -0.20 3.32 1.69 0.00 -1.26 -4.03 105.19 104.71 2ftu n GLY 6 Ca 0.00 0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 2ftu n GLY 6 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2ftu n TYR 7 N -4.41 -2.63 -1.72 1.61 9.36 -1.26 -4.84 117.16 113.27 2ftu n TYR 7 Ca 0.00 1.00 -0.38 0.00 3.32 0.00 0.00 57.90 61.85 2ftu n TYR 7 Cb 0.55 -3.68 -0.03 0.00 -0.63 0.00 0.00 39.34 35.55 2ftu n TYR 7 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 2ftu s SER 8 N -3.04 4.81 0.53 2.98 1.04 -1.26 -4.83 113.70 113.94 2ftu s SER 8 Ca 0.04 0.93 0.19 0.00 0.48 0.00 0.00 55.95 57.59 2ftu s SER 8 Cb -0.01 -2.51 1.36 0.00 0.10 0.00 0.00 66.02 64.95 2ftu s SER 8 CO 0.80 -2.62 2.13 0.00 0.98 0.00 0.00 173.24 174.53 2ftu h THR 9 N 7.38 0.89 -1.55 2.02 1.03 -1.95 -3.46 112.91 117.27 2ftu h THR 9 Ca -0.26 0.00 -0.13 0.00 -0.01 0.00 0.00 66.41 66.01 2ftu h THR 9 Cb 1.23 0.95 0.01 0.00 -1.07 0.00 0.00 68.15 69.27 2ftu h THR 9 CO 1.16 0.00 -0.19 1.21 -0.01 0.00 0.00 175.52 177.69 2ftu n GLU 10 N -4.42 -1.29 -0.86 0.00 2.13 -1.26 -5.04 120.64 109.90 2ftu n GLU 10 Ca -0.01 0.30 0.00 0.00 0.66 0.00 0.00 57.16 58.12 2ftu n GLU 10 Cb 0.19 -3.96 0.00 0.00 0.27 0.00 0.00 31.44 27.94 2ftu n GLU 10 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2ftu n ALA 11 N -2.07 0.00 -0.54 4.31 0.00 -1.26 -4.94 120.51 116.01 2ftu n ALA 11 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2ftu n ALA 11 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2ftu n ALA 11 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ftu n GLU 12 N 0.00 -0.20 -4.34 0.00 4.71 -1.26 -3.98 120.64 115.58 2ftu n GLU 12 Ca 0.00 0.05 -0.39 0.00 -0.01 0.00 0.00 57.16 56.81 2ftu n GLU 12 Cb 0.00 -4.50 -0.05 0.00 -1.01 0.00 0.00 31.44 25.89 2ftu n GLU 12 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 2ftu n PHE 13 N -1.96 -1.53 0.44 -0.32 3.72 -1.26 -4.83 117.46 111.72 2ftu n PHE 13 Ca 0.00 0.76 -0.17 0.00 -0.05 0.00 0.00 57.45 57.99 2ftu n PHE 13 Cb 0.05 -2.57 -0.08 0.00 -0.94 0.00 0.00 39.48 35.94 2ftu n PHE 13 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2ftu h GLU 14 N -1.29 -1.07 -0.91 -1.08 5.08 -1.99 -3.39 114.58 109.94 2ftu h GLU 14 Ca -0.60 0.07 -0.35 0.00 -1.00 0.00 0.00 59.36 57.49 2ftu h GLU 14 Cb 1.39 0.24 -0.27 0.00 0.50 0.00 0.00 28.75 30.61 2ftu h GLU 14 CO 0.82 -0.71 -0.80 -1.91 -1.00 0.00 0.00 179.01 175.41 2ftu n GLU 15 N -5.02 1.01 -1.40 2.33 2.13 -1.26 -5.03 120.64 113.40 2ftu n GLU 15 Ca -0.14 -2.61 -0.29 0.00 0.66 0.00 0.00 57.16 54.78 2ftu n GLU 15 Cb 0.44 -1.29 0.18 0.00 0.27 0.00 0.00 31.44 31.03 2ftu n GLU 15 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2ftu s PRO 16 N -1.04 0.25 0.00 5.31 0.04 -1.26 -4.92 135.00 133.39 2ftu s PRO 16 Ca 0.30 0.12 0.00 0.00 0.04 0.00 0.00 61.00 61.47 2ftu s PRO 16 Cb 0.33 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 33.12 2ftu s PRO 16 CO -0.06 -2.77 0.84 0.54 0.04 0.00 0.00 177.00 175.59 2ftu n ARG 17 N -4.13 0.00 -0.23 4.56 1.74 -1.26 -1.90 116.66 115.45 2ftu n ARG 17 Ca 0.09 0.35 0.01 0.00 -0.77 0.00 0.00 57.85 57.53 2ftu n ARG 17 Cb 0.59 -1.59 0.13 0.00 -1.02 0.00 0.00 32.46 30.56 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 0.81 -0.20 1.55 -1.51 -1.97 0.15 116.25 115.07 2ftu h VAL 18 Ca 0.00 -0.18 -0.13 0.00 -1.23 0.00 0.00 66.70 65.17 2ftu h VAL 18 Cb 0.18 0.25 -0.01 0.00 -2.13 0.00 0.00 31.29 29.59 2ftu h VAL 18 CO 0.00 0.09 -0.41 0.40 -1.23 0.00 0.00 177.57 176.42 2ftu h ILE 19 N 0.51 1.31 -0.18 7.19 1.08 -1.73 -1.92 117.51 123.76 2ftu h ILE 19 Ca 0.33 -1.58 -0.03 0.00 -0.39 0.00 0.00 64.86 63.19 2ftu h ILE 19 Cb 0.38 1.60 -0.01 0.00 -3.07 0.00 0.00 36.82 35.73 2ftu h ILE 19 CO -0.29 0.49 -0.02 -0.78 -0.69 0.00 0.00 178.15 176.87 2ftu h ASP 20 N 0.39 0.33 -0.72 1.72 3.58 -1.56 0.71 116.42 120.88 2ftu h ASP 20 Ca 0.03 -0.33 0.14 0.00 0.42 0.00 0.00 57.03 57.29 2ftu h ASP 20 Cb 0.89 -0.09 -0.14 0.00 1.72 0.00 0.00 39.33 41.72 2ftu h ASP 20 CO 0.08 0.58 -0.20 -0.07 -2.88 0.00 0.00 179.24 176.75 2ftu h LEU 21 N 0.07 -0.74 -0.78 2.28 -0.00 -0.59 0.50 115.31 116.04 2ftu h LEU 21 Ca 0.05 0.22 -0.13 0.00 -0.00 0.00 0.00 57.88 58.02 2ftu h LEU 21 Cb 0.43 0.47 -0.01 0.00 -0.00 0.00 0.00 40.66 41.55 2ftu h LEU 21 CO 0.01 -0.25 -0.50 -0.50 -0.00 0.00 0.00 178.44 177.21 2ftu h TRP 22 N -0.02 0.35 -0.86 1.13 6.55 -0.97 -1.12 115.95 121.00 2ftu h TRP 22 Ca 0.34 -0.11 0.04 0.00 0.95 0.00 0.00 58.89 60.11 2ftu h TRP 22 Cb 0.54 -0.07 -0.06 0.00 -0.86 0.00 0.00 29.16 28.71 2ftu h TRP 22 CO -0.59 0.73 0.55 0.22 -1.05 0.00 0.00 178.44 178.29 2ftu h ASP 23 N 0.23 0.89 0.64 -3.49 1.82 0.13 -2.42 116.42 114.22 2ftu h ASP 23 Ca 0.01 0.00 -0.27 0.00 -0.39 0.00 0.00 57.03 56.38 2ftu h ASP 23 Cb 0.96 -0.19 -0.03 0.00 0.68 0.00 0.00 39.33 40.75 2ftu h ASP 23 CO 0.08 0.60 -1.41 -0.07 -1.61 0.00 0.00 179.24 176.82 2ftu h LEU 24 N 1.04 0.15 -0.96 2.28 3.38 -1.35 -3.36 115.31 116.49 2ftu h LEU 24 Ca 0.36 -0.22 0.28 0.00 0.09 0.00 0.00 57.88 58.39 2ftu h LEU 24 Cb 0.07 -0.05 -0.15 0.00 0.09 0.00 0.00 40.66 40.62 2ftu h LEU 24 CO -0.14 1.18 0.44 0.00 0.09 0.00 0.00 178.44 180.02 2ftu h ALA 25 N 0.79 1.69 -1.50 1.53 0.00 -0.67 -1.77 119.26 119.32 2ftu h ALA 25 Ca -0.18 0.20 0.49 0.00 0.00 0.00 0.00 54.91 55.42 2ftu h ALA 25 Cb 1.94 0.21 -0.12 0.00 0.00 0.00 0.00 17.79 19.82 2ftu h ALA 25 CO 0.13 -0.52 1.01 0.94 0.00 0.00 0.00 179.25 180.81 2ftu n GLN 26 N -5.11 -0.02 -1.18 0.00 7.27 -1.20 -0.59 117.38 116.54 2ftu n GLN 26 Ca 0.28 1.15 0.03 0.00 0.07 0.00 0.00 57.00 58.53 2ftu n GLN 26 Cb 0.86 -2.38 0.03 0.00 2.41 0.00 0.00 30.24 31.16 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 -4.38 0.84 -3.52 1.69 7.64 -0.72 -4.90 113.62 110.26 2ftu n SER 27 Ca 0.40 -2.14 -0.40 0.00 1.01 0.00 0.00 58.87 57.74 2ftu n SER 27 Cb 1.64 -0.29 -0.01 0.00 -1.01 0.00 0.00 64.21 64.53 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 0.25 6.64 -3.50 -0.43 0.00 0.25 -4.71 120.51 119.01 2ftu n ALA 28 Ca 0.06 -3.84 -0.24 0.00 0.00 0.00 0.00 53.44 49.42 2ftu n ALA 28 Cb 1.01 -3.23 0.05 0.00 0.00 0.00 0.00 19.45 17.28 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 3.79 -5.93 -0.80 0.00 5.15 -1.26 -4.96 115.26 111.24 2ftu n ASN 29 Ca 0.64 -0.85 0.00 0.00 -0.60 0.00 0.00 54.58 53.77 2ftu n ASN 29 Cb 0.29 -4.04 0.00 0.00 -0.53 0.00 0.00 39.78 35.50 2ftu n ASN 29 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2ftu n LEU 30 N -3.64 0.00 -4.47 1.20 4.77 -1.26 -4.85 117.00 108.75 2ftu n LEU 30 Ca -0.09 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.64 2ftu n LEU 30 Cb 0.60 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.58 2ftu n LEU 30 CO 0.63 -0.15 -0.49 0.42 -1.33 0.00 0.00 177.39 176.48 2ftu s THR 31 N 1.25 2.56 0.29 -5.08 -4.23 -1.26 -4.99 115.64 104.19 2ftu s THR 31 Ca 0.00 -2.13 0.21 0.00 -1.18 0.00 0.00 61.69 58.58 2ftu s THR 31 Cb 0.00 -2.29 0.19 0.00 1.34 0.00 0.00 72.50 71.74 2ftu s THR 31 CO 0.00 -0.24 1.88 0.44 -0.54 0.00 0.00 174.62 176.15 2ftu h ASP 32 N 2.72 0.00 0.03 3.99 3.32 -1.99 -0.02 116.42 124.48 2ftu h ASP 32 Ca -0.44 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.61 2ftu h ASP 32 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2ftu h ASP 32 CO 0.54 0.27 -0.02 0.11 -1.72 0.00 0.00 179.24 178.43 2ftu h LYS 33 N 0.00 -0.04 -0.75 3.56 1.57 -1.99 -2.56 116.57 116.36 2ftu h LYS 33 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ftu h LYS 33 Cb 0.64 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.92 2ftu h LYS 33 CO 0.04 0.65 0.48 1.49 -0.57 0.00 0.00 179.45 181.53 2ftu h GLU 34 N -0.86 1.00 0.36 3.15 4.22 -1.83 -0.77 114.58 119.85 2ftu h GLU 34 Ca -0.00 -0.07 -0.00 0.00 0.08 0.00 0.00 59.36 59.36 2ftu h GLU 34 Cb 0.71 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 2ftu h GLU 34 CO 0.01 0.68 -0.48 1.25 -2.18 0.00 0.00 179.01 178.29 2ftu h LEU 35 N 1.03 -1.35 -1.17 1.64 7.12 -1.13 -1.45 115.31 120.00 2ftu h LEU 35 Ca 0.27 0.12 0.16 0.00 0.13 0.00 0.00 57.88 58.56 2ftu h LEU 35 Cb -0.08 0.47 -0.08 0.00 -0.53 0.00 0.00 40.66 40.43 2ftu h LEU 35 CO -0.06 -0.60 0.60 -0.08 -0.13 0.00 0.00 178.44 178.18 2ftu h GLU 36 N -0.88 0.73 0.04 1.25 4.81 -0.74 0.30 114.58 120.08 2ftu h GLU 36 Ca -0.03 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2ftu h GLU 36 Cb 0.80 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.02 2ftu h GLU 36 CO -0.13 0.48 -0.02 0.00 -0.73 0.00 0.00 179.01 178.61 2ftu h ALA 37 N 1.60 -0.05 -0.92 2.92 0.00 -1.09 -1.57 119.26 120.16 2ftu h ALA 37 Ca 0.50 -0.13 0.13 0.00 0.00 0.00 0.00 54.91 55.41 2ftu h ALA 37 Cb 0.77 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.49 2ftu h ALA 37 CO -0.27 -0.40 0.53 0.35 0.00 0.00 0.00 179.25 179.47 2ftu h PHE 38 N -0.30 0.95 -0.13 0.00 3.04 -0.47 -1.97 116.94 118.05 2ftu h PHE 38 Ca -0.00 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 61.94 2ftu h PHE 38 Cb 0.28 -0.29 -0.00 0.00 2.56 0.00 0.00 35.95 38.50 2ftu h PHE 38 CO 0.01 0.31 -0.06 -0.09 -2.02 0.00 0.00 178.31 176.47 2ftu h ARG 39 N 0.80 0.27 -0.29 1.11 1.12 0.09 0.24 114.38 117.72 2ftu h ARG 39 Ca 0.48 -0.12 -0.01 0.00 -1.11 0.00 0.00 59.98 59.21 2ftu h ARG 39 Cb 0.57 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.51 2ftu h ARG 39 CO -0.31 0.60 0.12 1.05 -3.11 0.00 0.00 179.97 178.33 2ftu h GLU 40 N -0.07 0.42 -0.65 0.20 4.11 -1.24 -1.42 114.58 115.93 2ftu h GLU 40 Ca 0.03 -0.07 -0.08 0.00 0.07 0.00 0.00 59.36 59.31 2ftu h GLU 40 Cb 0.52 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 2ftu h GLU 40 CO 0.02 0.43 0.09 1.49 0.07 0.00 0.00 179.01 181.11 2ftu h GLU 41 N 0.32 1.08 -0.22 1.06 4.57 -1.12 -1.60 114.58 118.67 2ftu h GLU 41 Ca 0.10 -0.29 -0.11 0.00 -1.18 0.00 0.00 59.36 57.88 2ftu h GLU 41 Cb 0.16 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 2ftu h GLU 41 CO -0.01 0.99 -0.34 -0.07 -1.18 0.00 0.00 179.01 178.41 2ftu h LEU 42 N 1.01 0.47 -0.43 1.64 -0.00 -0.50 0.20 115.31 117.69 2ftu h LEU 42 Ca 0.20 -0.18 -0.01 0.00 -0.00 0.00 0.00 57.88 57.89 2ftu h LEU 42 Cb 0.45 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.96 2ftu h LEU 42 CO 0.01 0.78 0.24 0.50 -0.00 0.00 0.00 178.44 179.97 2ftu h LYS 43 N 0.39 0.60 -0.34 1.13 3.64 -0.74 0.21 116.57 121.45 2ftu h LYS 43 Ca 0.05 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2ftu h LYS 43 Cb 0.78 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.45 2ftu h LYS 43 CO 0.06 0.47 0.16 0.45 -2.27 0.00 0.00 179.45 178.33 2ftu h HIS 44 N 0.56 0.30 0.36 1.91 3.86 -0.78 -1.97 115.15 119.39 2ftu h HIS 44 Ca 0.15 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 2ftu h HIS 44 Cb 0.05 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.44 2ftu h HIS 44 CO -0.02 0.16 -0.17 0.35 0.86 0.00 0.00 177.93 179.10 2ftu h PHE 45 N 0.34 -0.45 -0.66 2.45 3.04 -0.34 -1.35 116.94 119.98 2ftu h PHE 45 Ca 0.15 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.09 2ftu h PHE 45 Cb 0.06 0.15 -0.03 0.00 2.56 0.00 0.00 35.95 38.69 2ftu h PHE 45 CO -0.10 -0.19 0.43 1.05 -2.02 0.00 0.00 178.31 177.48 2ftu h GLU 46 N -0.63 0.87 0.32 1.11 -0.00 -0.59 -0.74 114.58 114.92 2ftu h GLU 46 Ca -0.05 -0.06 -0.02 0.00 -0.00 0.00 0.00 59.36 59.24 2ftu h GLU 46 Cb 0.46 -0.19 0.00 0.00 -0.00 0.00 0.00 28.75 29.02 2ftu h GLU 46 CO 0.08 0.58 -0.15 0.00 -0.00 0.00 0.00 179.01 179.52 2ftu h ALA 47 N 1.58 -0.43 -0.44 1.06 0.00 -1.24 0.54 119.26 120.33 2ftu h ALA 47 Ca 0.24 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.08 2ftu h ALA 47 Cb -0.09 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 17.78 2ftu h ALA 47 CO -0.05 -0.70 -0.56 0.87 0.00 0.00 0.00 179.25 178.81 2ftu h LYS 48 N -0.51 -0.36 -0.65 0.00 6.56 -0.27 -1.16 116.57 120.19 2ftu h LYS 48 Ca -0.04 0.02 -0.08 0.00 -1.06 0.00 0.00 60.65 59.49 2ftu h LYS 48 Cb 0.38 0.08 -0.03 0.00 -0.57 0.00 0.00 32.23 32.10 2ftu h LYS 48 CO 0.07 -0.24 0.08 0.97 -2.06 0.00 0.00 179.45 178.27 2ftu h ILE 49 N -0.37 1.26 -0.69 1.86 6.09 -1.14 -1.71 117.51 122.81 2ftu h ILE 49 Ca 0.08 -1.07 0.10 0.00 -1.37 0.00 0.00 64.86 62.60 2ftu h ILE 49 Cb 0.59 0.68 -0.04 0.00 0.47 0.00 0.00 36.82 38.51 2ftu h ILE 49 CO -0.62 0.40 0.45 -0.33 -3.07 0.00 0.00 178.15 174.98 2ftu h GLU 50 N 1.01 0.53 0.22 2.19 5.08 -0.15 0.21 114.58 123.67 2ftu h GLU 50 Ca 0.19 -0.03 -0.32 0.00 -1.00 0.00 0.00 59.36 58.20 2ftu h GLU 50 Cb 0.47 -0.12 0.03 0.00 0.50 0.00 0.00 28.75 29.63 2ftu h GLU 50 CO 0.02 0.35 -1.43 0.87 -1.00 0.00 0.00 179.01 177.82 2ftu h LYS 51 N 0.55 0.46 -0.12 2.33 1.57 -0.70 -0.15 116.57 120.51 2ftu h LYS 51 Ca 0.32 -0.79 0.04 0.00 -1.87 0.00 0.00 60.65 58.34 2ftu h LYS 51 Cb 0.51 0.30 -0.07 0.00 0.08 0.00 0.00 32.23 33.05 2ftu h LYS 51 CO -0.10 1.38 -0.42 1.25 -0.57 0.00 0.00 179.45 180.98 2ftu h HIS 52 N 0.13 -1.21 -0.56 -1.35 2.76 -0.75 -1.32 115.15 112.84 2ftu h HIS 52 Ca -0.23 0.05 0.11 0.00 -2.20 0.00 0.00 60.37 58.10 2ftu h HIS 52 Cb 2.12 0.55 -0.11 0.00 1.55 0.00 0.00 27.41 31.52 2ftu h HIS 52 CO 0.11 -0.48 -0.24 -0.97 -1.30 0.00 0.00 177.93 175.05 2ftu h ASN 53 N -0.50 -0.83 -0.97 3.26 -0.73 -0.56 0.23 115.58 115.48 2ftu h ASN 53 Ca 0.07 0.20 0.01 0.00 1.87 0.00 0.00 56.30 58.46 2ftu h ASN 53 Cb 0.63 0.46 -0.05 0.00 0.27 0.00 0.00 38.32 39.63 2ftu h ASN 53 CO -0.39 -0.26 0.64 -0.74 -0.37 0.00 0.00 177.43 176.31 2ftu h HIS 54 N -0.10 1.22 -0.31 0.67 2.76 -0.75 -0.86 115.15 117.77 2ftu h HIS 54 Ca 0.26 0.03 -0.18 0.00 -2.20 0.00 0.00 60.37 58.28 2ftu h HIS 54 Cb 0.50 -0.41 -0.00 0.00 1.55 0.00 0.00 27.41 29.05 2ftu h HIS 54 CO -0.55 0.76 -0.50 1.88 -1.30 0.00 0.00 177.93 178.22 2ftu h TYR 55 N 1.30 1.09 -0.88 5.26 -1.99 0.05 -1.89 116.97 119.91 2ftu h TYR 55 Ca 0.36 -0.37 0.08 0.00 2.00 0.00 0.00 58.73 60.80 2ftu h TYR 55 Cb -0.12 -0.21 -0.06 0.00 2.00 0.00 0.00 36.73 38.33 2ftu h TYR 55 CO -0.00 1.20 0.57 1.96 -0.00 0.00 0.00 178.16 181.88 2ftu h GLN 56 N 0.69 0.90 0.16 4.88 4.20 0.15 0.33 115.11 126.42 2ftu h GLN 56 Ca 0.03 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 2ftu h GLN 56 Cb 1.10 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.68 2ftu h GLN 56 CO 0.11 0.59 -0.08 -0.22 -0.67 0.00 0.00 178.83 178.57 2ftu h LYS 57 N 0.93 -0.21 0.00 1.46 1.63 -1.07 -1.01 116.57 118.30 2ftu h LYS 57 Ca 0.39 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 60.19 2ftu h LYS 57 Cb 0.31 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 31.99 2ftu h LYS 57 CO -0.16 0.02 -0.08 1.96 -3.45 0.00 0.00 179.45 177.74 2ftu h GLN 58 N -0.41 0.00 -0.10 1.90 1.08 -0.65 -1.94 115.11 114.99 2ftu h GLN 58 Ca -0.02 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.09 2ftu h GLN 58 Cb 0.32 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.76 2ftu h GLN 58 CO 0.04 0.08 -0.27 1.25 -0.95 0.00 0.00 178.83 178.98 2ftu h LEU 59 N 0.00 0.41 -0.10 1.46 5.85 0.23 -0.67 115.31 122.50 2ftu h LEU 59 Ca -0.00 -0.59 0.00 0.00 0.84 0.00 0.00 57.88 58.13 2ftu h LEU 59 Cb 0.18 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2ftu h LEU 59 CO 0.01 0.93 0.06 -0.08 -0.34 0.00 0.00 178.44 179.02 2ftu h GLU 60 N -0.08 0.12 -0.71 1.25 4.81 -1.05 -0.29 114.58 118.63 2ftu h GLU 60 Ca -0.00 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2ftu h GLU 60 Cb 0.88 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.20 2ftu h GLU 60 CO 0.06 0.08 0.29 0.82 -0.73 0.00 0.00 179.01 179.52 2ftu h ILE 61 N 0.12 1.24 -0.55 2.32 2.04 -1.32 0.25 117.51 121.61 2ftu h ILE 61 Ca 0.04 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.18 2ftu h ILE 61 Cb -0.00 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.43 2ftu h ILE 61 CO -0.02 0.30 0.33 0.00 0.00 0.00 0.00 178.15 178.77 2ftu h ALA 62 N 1.29 0.71 -0.14 1.87 0.00 -0.92 -1.91 119.26 120.16 2ftu h ALA 62 Ca 0.24 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.15 2ftu h ALA 62 Cb 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2ftu h ALA 62 CO -0.02 0.05 0.02 1.25 0.00 0.00 0.00 179.25 180.56 2ftu h HIS 63 N 0.66 0.04 0.42 0.00 6.17 0.82 0.28 115.15 123.55 2ftu h HIS 63 Ca 0.22 0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.30 2ftu h HIS 63 Cb 0.02 0.00 -0.02 0.00 2.52 0.00 0.00 27.41 29.92 2ftu h HIS 63 CO -0.06 0.01 -0.44 1.49 0.71 0.00 0.00 177.93 179.65 2ftu h GLU 64 N 0.08 -0.84 -0.70 5.26 4.81 -1.13 -1.75 114.58 120.30 2ftu h GLU 64 Ca 0.06 0.06 0.08 0.00 -0.13 0.00 0.00 59.36 59.43 2ftu h GLU 64 Cb 0.06 0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 2ftu h GLU 64 CO -0.09 -0.56 0.46 0.87 -0.73 0.00 0.00 179.01 178.97 2ftu h LYS 65 N -0.87 0.64 0.47 1.92 1.79 -0.99 -1.60 116.57 117.93 2ftu h LYS 65 Ca -0.04 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.37 2ftu h LYS 65 Cb 0.78 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 2ftu h LYS 65 CO -0.07 0.42 -0.23 1.25 -1.08 0.00 0.00 179.45 179.74 2ftu h LEU 66 N 0.66 -0.54 -0.85 2.94 5.85 -0.18 -0.86 115.31 122.33 2ftu h LEU 66 Ca 0.31 -0.04 0.20 0.00 0.84 0.00 0.00 57.88 59.19 2ftu h LEU 66 Cb 0.37 0.14 -0.12 0.00 0.37 0.00 0.00 40.66 41.42 2ftu h LEU 66 CO -0.11 -0.12 0.35 0.03 -0.34 0.00 0.00 178.44 178.26 2ftu h ARG 67 N -1.11 0.39 -0.35 1.25 3.08 -1.13 0.31 114.38 116.83 2ftu h ARG 67 Ca -0.06 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 59.84 2ftu h ARG 67 Cb 0.54 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 2ftu h ARG 67 CO 0.11 0.26 -0.29 1.25 -1.07 0.00 0.00 179.97 180.22 2ftu h HIS 68 N 0.40 0.87 0.00 3.04 2.76 -1.23 -1.26 115.15 119.73 2ftu h HIS 68 Ca 0.51 -0.22 -0.16 0.00 -2.20 0.00 0.00 60.37 58.31 2ftu h HIS 68 Cb 0.92 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.66 2ftu h HIS 68 CO -0.16 0.95 -0.91 0.00 -1.30 0.00 0.00 177.93 176.51 2ftu h ALA 69 N 1.03 0.60 -0.36 5.26 0.00 0.15 -3.18 119.26 122.76 2ftu h ALA 69 Ca 0.08 -0.72 -0.08 0.00 0.00 0.00 0.00 54.91 54.18 2ftu h ALA 69 Cb 0.81 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2ftu h ALA 69 CO 0.07 0.91 -0.11 0.93 0.00 0.00 0.00 179.25 181.05 2ftu h GLU 70 N 0.00 0.62 0.00 0.00 5.08 -0.26 -2.71 114.58 117.31 2ftu h GLU 70 Ca -0.06 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2ftu h GLU 70 Cb 1.57 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.75 2ftu h GLU 70 CO 0.08 0.72 0.00 0.45 -1.00 0.00 0.00 179.01 179.26 2ftu n SER 71 N -4.19 0.00 -0.05 1.42 2.88 -0.49 -2.49 113.62 110.70 2ftu n SER 71 Ca 0.01 -0.93 -0.07 0.00 -1.33 0.00 0.00 58.87 56.55 2ftu n SER 71 Cb 0.34 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.74 2ftu n SER 71 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2ftu n VAL 72 N -0.54 0.63 -1.11 2.46 3.14 -1.03 -5.06 118.33 116.83 2ftu n VAL 72 Ca 0.01 -0.29 0.00 0.00 -2.96 0.00 0.00 64.34 61.10 2ftu n VAL 72 Cb 0.00 -0.86 0.00 0.00 -1.06 0.00 0.00 33.84 31.93 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 2.81 0.21 0.00 7.55 0.00 -1.04 -5.11 105.19 109.61 2ftu n GLY 73 Ca -0.18 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.83 0.00 0.00 1.61 -0.08 -1.26 -5.10 116.55 110.90 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 0.37 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.83 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 4.56 1.21 0.36 0.27 0.00 -1.26 -4.97 105.19 105.36 2ftu n GLY 75 Ca 0.00 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 2ftu n GLY 75 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ftu h GLU 76 N 0.00 -0.84 -0.27 1.61 4.39 -1.98 -0.69 114.58 116.79 2ftu h GLU 76 Ca 0.00 0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.77 2ftu h GLU 76 Cb 0.00 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2ftu h GLU 76 CO 0.00 -0.52 0.18 0.07 -1.16 0.00 0.00 179.01 177.58 2ftu h ARG 77 N -1.10 0.32 0.70 2.33 0.11 -1.98 0.25 114.38 115.01 2ftu h ARG 77 Ca -0.09 -0.02 -0.03 0.00 0.10 0.00 0.00 59.98 59.94 2ftu h ARG 77 Cb 0.71 -0.07 0.01 0.00 1.11 0.00 0.00 29.97 31.72 2ftu h ARG 77 CO 0.15 0.21 -0.34 0.28 0.10 0.00 0.00 179.97 180.37 2ftu h VAL 78 N 0.33 0.09 0.36 0.08 2.07 -1.88 -1.12 116.25 116.18 2ftu h VAL 78 Ca 0.10 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 2ftu h VAL 78 Cb 0.01 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 2ftu h VAL 78 CO -0.02 0.01 -0.37 0.28 0.02 0.00 0.00 177.57 177.49 2ftu h SER 79 N -1.20 -1.00 -0.81 0.57 0.02 -0.58 -0.59 113.55 109.96 2ftu h SER 79 Ca -0.10 0.09 0.13 0.00 -0.84 0.00 0.00 61.79 61.07 2ftu h SER 79 Cb 0.74 0.34 -0.09 0.00 0.14 0.00 0.00 62.40 63.53 2ftu h SER 79 CO 0.16 -0.51 0.40 -0.09 -1.14 0.00 0.00 176.83 175.65 2ftu h ARG 80 N -0.75 0.58 0.77 3.45 1.12 -0.62 0.13 114.38 119.04 2ftu h ARG 80 Ca -0.02 -0.03 -0.03 0.00 -1.11 0.00 0.00 59.98 58.78 2ftu h ARG 80 Cb 0.68 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.50 2ftu h ARG 80 CO -0.07 0.38 -0.50 0.77 -3.11 0.00 0.00 179.97 177.44 2ftu h SER 81 N 0.59 -1.28 -0.93 -3.80 0.02 -0.76 -1.38 113.55 106.01 2ftu h SER 81 Ca 0.43 0.08 0.18 0.00 -0.84 0.00 0.00 61.79 61.64 2ftu h SER 81 Cb 0.59 0.38 -0.08 0.00 0.14 0.00 0.00 62.40 63.43 2ftu h SER 81 CO -0.35 -0.75 0.60 0.03 -1.14 0.00 0.00 176.83 175.22 2ftu h ARG 82 N -1.20 0.60 0.68 3.45 3.08 0.39 0.40 114.38 121.80 2ftu h ARG 82 Ca -0.10 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.88 2ftu h ARG 82 Cb 0.97 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.89 2ftu h ARG 82 CO 0.08 0.40 -0.33 1.49 -1.07 0.00 0.00 179.97 180.54 2ftu h GLU 83 N 0.62 -0.88 0.00 0.04 4.22 -0.71 0.56 114.58 118.42 2ftu h GLU 83 Ca 0.49 0.06 -0.02 0.00 0.08 0.00 0.00 59.36 59.98 2ftu h GLU 83 Cb 0.93 0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 2ftu h GLU 83 CO -0.24 -0.58 -0.08 -0.22 -2.18 0.00 0.00 179.01 175.71 2ftu h LYS 84 N -0.95 0.00 0.35 1.92 3.11 -0.47 -1.94 116.57 118.59 2ftu h LYS 84 Ca -0.09 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.73 2ftu h LYS 84 Cb 0.71 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.95 2ftu h LYS 84 CO 0.15 0.08 -0.17 0.45 -2.81 0.00 0.00 179.45 177.15 2ftu h HIS 85 N 0.00 -0.43 -0.76 1.91 3.86 0.17 -1.49 115.15 118.40 2ftu h HIS 85 Ca -0.00 -0.01 0.13 0.00 -1.16 0.00 0.00 60.37 59.33 2ftu h HIS 85 Cb 0.64 0.14 -0.09 0.00 1.06 0.00 0.00 27.41 29.17 2ftu h HIS 85 CO 0.00 -0.10 0.35 0.00 0.86 0.00 0.00 177.93 179.04 2ftu h ALA 86 N -0.38 1.08 0.14 2.45 0.00 -0.71 0.12 119.26 121.96 2ftu h ALA 86 Ca -0.05 0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.97 2ftu h ALA 86 Cb 0.53 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2ftu h ALA 86 CO 0.08 -0.13 -0.35 1.25 0.00 0.00 0.00 179.25 180.10 2ftu h LEU 87 N 0.53 -1.00 -1.35 0.00 5.85 -1.38 -0.16 115.31 117.80 2ftu h LEU 87 Ca 0.41 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 59.22 2ftu h LEU 87 Cb 0.55 0.38 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 2ftu h LEU 87 CO -0.35 -0.43 0.25 0.25 -0.34 0.00 0.00 178.44 177.81 2ftu h LEU 88 N -0.58 0.62 -0.96 2.25 5.85 0.23 -1.08 115.31 121.63 2ftu h LEU 88 Ca 0.03 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 2ftu h LEU 88 Cb 0.61 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2ftu h LEU 88 CO -0.19 0.52 0.29 -0.08 -0.34 0.00 0.00 178.44 178.63 2ftu h GLU 89 N 0.70 1.03 -0.22 1.25 4.22 -0.76 -0.45 114.58 120.35 2ftu h GLU 89 Ca 0.18 -0.17 -0.02 0.00 0.08 0.00 0.00 59.36 59.43 2ftu h GLU 89 Cb 0.06 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2ftu h GLU 89 CO -0.03 0.84 0.08 0.78 -2.18 0.00 0.00 179.01 178.50 2ftu h GLY 90 N 1.08 0.37 1.63 1.92 0.00 0.18 -2.01 103.07 106.24 2ftu h GLY 90 Ca 0.24 -0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.26 2ftu h GLY 90 CO -0.02 0.20 -0.29 -0.09 0.00 0.00 0.00 176.54 176.34 2ftu h ARG 91 N 0.20 0.43 0.63 4.80 1.12 -0.93 -0.99 114.38 119.63 2ftu h ARG 91 Ca 0.07 -0.17 -0.03 0.00 -1.11 0.00 0.00 59.98 58.74 2ftu h ARG 91 Cb 0.21 -0.02 0.01 0.00 -0.01 0.00 0.00 29.97 30.16 2ftu h ARG 91 CO -0.00 0.68 -0.30 1.79 -3.11 0.00 0.00 179.97 179.02 2ftu h THR 92 N 0.37 0.38 -0.72 0.20 1.35 -0.98 -0.58 112.91 112.93 2ftu h THR 92 Ca 0.05 -0.02 -0.00 0.00 -0.55 0.00 0.00 66.41 65.89 2ftu h THR 92 Cb 0.70 0.39 -0.03 0.00 -1.73 0.00 0.00 68.15 67.47 2ftu h THR 92 CO 0.05 0.00 0.44 0.50 -0.25 0.00 0.00 175.52 176.27 2ftu h LYS 93 N -0.86 0.97 -0.03 4.72 3.64 -1.14 -0.18 116.57 123.68 2ftu h LYS 93 Ca -0.09 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.21 2ftu h LYS 93 Cb 0.65 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2ftu h LYS 93 CO 0.14 0.68 0.02 0.93 -2.27 0.00 0.00 179.45 178.95 2ftu h GLU 94 N 0.98 0.05 0.05 1.90 5.08 -1.16 -1.62 114.58 119.85 2ftu h GLU 94 Ca 0.26 -0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.34 2ftu h GLU 94 Cb -0.05 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.21 2ftu h GLU 94 CO -0.05 0.06 -1.10 1.25 -1.00 0.00 0.00 179.01 178.17 2ftu h LEU 95 N 0.02 0.81 -0.75 1.33 7.12 -0.77 -1.23 115.31 121.85 2ftu h LEU 95 Ca 0.01 -0.69 0.14 0.00 0.13 0.00 0.00 57.88 57.47 2ftu h LEU 95 Cb 0.02 -0.25 -0.09 0.00 -0.53 0.00 0.00 40.66 39.81 2ftu h LEU 95 CO -0.00 1.49 0.30 1.23 -0.13 0.00 0.00 178.44 181.33 2ftu h GLY 96 N 0.59 1.12 0.96 3.75 0.00 -1.06 0.16 103.07 108.59 2ftu h GLY 96 Ca -0.14 -0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.04 2ftu h GLY 96 CO 0.21 -0.09 0.08 -1.82 0.00 0.00 0.00 176.54 174.92 2ftu h TYR 97 N 0.44 0.18 -0.44 5.60 3.20 -1.14 -0.76 116.97 124.06 2ftu h TYR 97 Ca 0.41 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.30 2ftu h TYR 97 Cb 0.61 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.79 2ftu h TYR 97 CO -0.17 0.16 0.26 1.15 -1.64 0.00 0.00 178.16 177.92 2ftu h THR 98 N 0.15 1.04 -0.14 1.81 2.02 0.09 -0.49 112.91 117.40 2ftu h THR 98 Ca 0.05 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 67.07 2ftu h THR 98 Cb 0.03 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 2ftu h THR 98 CO -0.01 0.09 0.04 0.58 0.37 0.00 0.00 175.52 176.60 2ftu h VAL 99 N 0.52 0.96 -0.64 3.16 2.07 -0.71 -1.54 116.25 120.07 2ftu h VAL 99 Ca 0.18 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.69 2ftu h VAL 99 Cb 0.02 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 2ftu h VAL 99 CO -0.08 0.02 0.39 0.50 0.02 0.00 0.00 177.57 178.41 2ftu h LYS 100 N 0.11 0.74 0.24 1.57 3.64 -0.03 0.28 116.57 123.11 2ftu h LYS 100 Ca 0.06 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 2ftu h LYS 100 Cb 0.04 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 2ftu h LYS 100 CO -0.07 0.49 -0.11 0.87 -2.27 0.00 0.00 179.45 178.35 2ftu h LYS 101 N 0.76 -0.31 -0.72 1.90 1.79 -1.07 -1.72 116.57 117.20 2ftu h LYS 101 Ca 0.26 0.02 0.11 0.00 -2.18 0.00 0.00 60.65 58.86 2ftu h LYS 101 Cb 0.04 0.07 -0.08 0.00 -1.58 0.00 0.00 32.23 30.68 2ftu h LYS 101 CO -0.11 -0.00 0.33 0.45 -1.08 0.00 0.00 179.45 179.04 2ftu h HIS 102 N -0.62 0.59 0.04 -1.35 3.86 -1.02 -0.99 115.15 115.65 2ftu h HIS 102 Ca -0.03 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 2ftu h HIS 102 Cb 0.45 -0.15 -0.05 0.00 1.06 0.00 0.00 27.41 28.72 2ftu h HIS 102 CO 0.02 0.17 -0.33 -0.07 0.86 0.00 0.00 177.93 178.58 2ftu h LEU 103 N 0.54 -0.96 -1.97 2.43 3.38 -0.40 0.93 115.31 119.27 2ftu h LEU 103 Ca 0.37 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.46 2ftu h LEU 103 Cb 0.46 0.38 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 2ftu h LEU 103 CO -0.31 -0.40 0.00 1.56 0.09 0.00 0.00 178.44 179.38 2ftu h GLN 104 N -0.51 0.02 0.37 1.13 4.20 -0.43 0.19 115.11 120.09 2ftu h GLN 104 Ca 0.05 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 2ftu h GLN 104 Cb 0.57 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.35 2ftu h GLN 104 CO -0.24 0.02 -0.18 0.22 -0.67 0.00 0.00 178.83 177.99 2ftu h ASP 105 N 0.02 -0.42 0.63 1.46 3.58 -0.09 0.29 116.42 121.89 2ftu h ASP 105 Ca 0.01 -0.14 -0.03 0.00 0.42 0.00 0.00 57.03 57.29 2ftu h ASP 105 Cb 0.01 0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.17 2ftu h ASP 105 CO -0.00 -0.01 -0.38 -0.07 -2.88 0.00 0.00 179.24 175.89 2ftu h LEU 106 N -0.92 -0.96 -1.11 2.28 3.38 -0.61 -0.59 115.31 116.79 2ftu h LEU 106 Ca -0.05 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.07 2ftu h LEU 106 Cb 0.54 0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.50 2ftu h LEU 106 CO 0.08 -0.59 0.61 -1.28 0.09 0.00 0.00 178.44 177.35 2ftu h SER 107 N -0.95 0.89 -0.40 -0.43 0.87 -0.79 0.61 113.55 113.36 2ftu h SER 107 Ca -0.08 0.03 0.07 0.00 -1.23 0.00 0.00 61.79 60.57 2ftu h SER 107 Cb 0.75 -0.16 -0.09 0.00 -0.44 0.00 0.00 62.40 62.47 2ftu h SER 107 CO 0.09 0.52 -0.43 1.23 -0.53 0.00 0.00 176.83 177.70 2ftu h GLY 108 N 0.98 -0.58 0.07 5.77 0.00 -0.28 -1.67 103.07 107.36 2ftu h GLY 108 Ca 0.44 0.55 -0.00 0.00 0.00 0.00 0.00 47.33 48.32 2ftu h GLY 108 CO -0.20 -0.18 -0.03 3.21 0.00 0.00 0.00 176.54 179.34 2ftu h ARG 109 N -0.34 -0.07 -0.03 4.80 3.08 -0.16 -3.29 114.38 118.38 2ftu h ARG 109 Ca 0.13 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.20 2ftu h ARG 109 Cb 0.59 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 2ftu h ARG 109 CO -0.57 0.22 0.11 0.82 -1.07 0.00 0.00 179.97 179.48 2ftu h ILE 110 N -1.00 0.12 0.00 2.04 2.04 -1.00 -0.40 117.51 119.31 2ftu h ILE 110 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2ftu h ILE 110 Cb 0.32 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2ftu h ILE 110 CO 0.01 0.00 0.01 -1.20 0.00 0.00 0.00 178.15 176.98 2ftu n SER 111 N -3.21 0.00 -0.10 1.72 7.64 -0.63 -0.91 113.62 118.14 2ftu n SER 111 Ca -0.02 0.41 -0.11 0.00 1.01 0.00 0.00 58.87 60.16 2ftu n SER 111 Cb 0.18 -0.41 -0.13 0.00 -1.01 0.00 0.00 64.21 62.84 2ftu n SER 111 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2ftu n ARG 112 N -1.41 0.94 0.00 1.43 1.85 -0.16 -5.02 116.66 114.29 2ftu n ARG 112 Ca 0.00 0.03 0.00 0.00 -1.00 0.00 0.00 57.85 56.88 2ftu n ARG 112 Cb 0.01 -1.46 0.00 0.00 -1.05 0.00 0.00 32.46 29.97 2ftu n ARG 112 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2ftu n ALA 113 N -2.81 0.00 -0.90 2.89 0.00 -0.09 -4.92 120.51 114.68 2ftu n ALA 113 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2ftu n ALA 113 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.48 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 0.00 0.00 -1.77 0.00 3.00 -1.26 -4.62 116.66 112.01 2ftu n ARG 114 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.85 57.88 2ftu n ARG 114 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 32.46 32.49 2ftu n ARG 114 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 2ftu n HIS 115 N -0.67 0.25 -3.95 -0.14 8.25 -1.26 -4.85 115.22 112.85 2ftu n HIS 115 Ca 0.00 -0.84 -0.08 0.00 -0.26 0.00 0.00 57.72 56.53 2ftu n HIS 115 Cb 0.00 -0.15 -0.04 0.00 1.12 0.00 0.00 29.99 30.92 2ftu n HIS 115 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2ftu s ASN 116 N -2.35 -0.13 0.74 0.41 4.22 -1.26 -4.92 114.94 111.65 2ftu s ASN 116 Ca 0.32 -0.83 -0.13 0.00 -2.14 0.00 0.00 52.86 50.08 2ftu s ASN 116 Cb 0.37 0.64 0.04 0.00 1.28 0.00 0.00 41.25 43.58 2ftu s ASN 116 CO -0.14 -1.23 1.12 -1.61 -2.04 0.00 0.00 177.10 173.20 2ftu s GLU 117 N -3.94 2.30 0.00 3.55 2.02 -1.26 -4.89 118.70 116.48 2ftu s GLU 117 Ca 0.18 1.36 0.19 0.00 0.02 0.00 0.00 54.97 56.72 2ftu s GLU 117 Cb -0.03 -1.89 0.15 0.00 0.10 0.00 0.00 34.13 32.46 2ftu s GLU 117 CO 0.09 -1.63 1.11 1.28 0.02 0.00 0.00 175.26 176.12