#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 -0.34 0.00 8.89 1.01 -1.26 -5.07 120.40 123.63 2ftu s VAL 2 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.08 2ftu s VAL 2 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.85 2ftu s VAL 2 CO 0.00 -0.04 0.00 -1.20 0.00 0.00 0.00 175.10 173.86 2ftu n SER 3 N 5.33 0.00 -3.99 3.32 7.64 -1.26 -4.83 113.62 119.83 2ftu n SER 3 Ca -0.05 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.74 2ftu n SER 3 Cb 0.50 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.60 2ftu n SER 3 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2ftu s HIS 4 N -1.46 0.34 -0.04 1.43 2.46 -1.26 -5.07 115.29 111.69 2ftu s HIS 4 Ca 0.00 -0.78 -0.29 0.00 0.47 0.00 0.00 55.06 54.46 2ftu s HIS 4 Cb 0.00 -0.24 -0.08 0.00 -0.13 0.00 0.00 32.58 32.13 2ftu s HIS 4 CO 0.00 -0.40 2.04 -0.65 -2.47 0.00 0.00 174.74 173.27 2ftu s GLN 5 N -3.39 3.85 0.00 2.88 -1.52 -1.26 -4.73 119.66 115.49 2ftu s GLN 5 Ca 0.02 2.45 0.00 0.00 -1.95 0.00 0.00 55.36 55.88 2ftu s GLN 5 Cb 0.04 -4.23 0.00 0.00 -0.22 0.00 0.00 33.01 28.60 2ftu s GLN 5 CO -0.08 -1.29 0.00 0.41 -0.25 0.00 0.00 175.29 174.08 2ftu n GLY 6 N 4.90 2.65 2.76 3.09 0.00 -1.26 -5.03 105.19 112.31 2ftu n GLY 6 Ca 0.23 0.13 -0.02 0.00 0.00 0.00 0.00 46.02 46.36 2ftu n GLY 6 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2ftu n TYR 7 N 0.00 -0.07 -1.68 1.61 4.11 -1.26 -5.12 117.16 114.75 2ftu n TYR 7 Ca 0.00 -2.04 -0.58 0.00 -0.00 0.00 0.00 57.90 55.27 2ftu n TYR 7 Cb 0.00 0.46 -0.08 0.00 -0.00 0.00 0.00 39.34 39.72 2ftu n TYR 7 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 2ftu n SER 8 N -0.88 2.21 0.19 9.48 3.41 -1.26 -4.87 113.62 121.91 2ftu n SER 8 Ca -0.02 1.03 -0.15 0.00 -0.26 0.00 0.00 58.87 59.47 2ftu n SER 8 Cb 0.83 -1.11 -0.07 0.00 -0.26 0.00 0.00 64.21 63.60 2ftu n SER 8 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ftu h THR 9 N 5.42 0.32 -1.84 6.66 1.03 -2.02 -3.44 112.91 119.04 2ftu h THR 9 Ca -0.44 0.00 0.03 0.00 -0.01 0.00 0.00 66.41 66.00 2ftu h THR 9 Cb 1.33 0.32 -0.23 0.00 -1.07 0.00 0.00 68.15 68.50 2ftu h THR 9 CO 0.97 0.00 0.18 -1.61 -0.01 0.00 0.00 175.52 175.06 2ftu s GLU 10 N -6.02 0.63 -0.43 0.00 2.02 -1.26 -5.13 118.70 108.52 2ftu s GLU 10 Ca -0.16 0.97 0.05 0.00 0.02 0.00 0.00 54.97 55.85 2ftu s GLU 10 Cb 0.06 0.20 0.17 0.00 0.10 0.00 0.00 34.13 34.66 2ftu s GLU 10 CO 0.64 -0.11 0.52 0.00 0.02 0.00 0.00 175.26 176.32 2ftu s ALA 11 N 1.12 -0.91 -2.64 5.21 0.00 -1.26 -4.97 121.76 118.30 2ftu s ALA 11 Ca -0.06 -0.89 0.23 0.00 0.00 0.00 0.00 51.96 51.25 2ftu s ALA 11 Cb -0.05 -2.28 0.34 0.00 0.00 0.00 0.00 23.12 21.13 2ftu s ALA 11 CO -0.13 -2.16 1.35 -1.91 0.00 0.00 0.00 175.76 172.92 2ftu n GLU 12 N 3.63 2.44 -0.76 0.00 2.13 -1.26 -4.93 120.64 121.89 2ftu n GLU 12 Ca 0.17 -2.17 -0.29 0.00 0.66 0.00 0.00 57.16 55.53 2ftu n GLU 12 Cb 0.51 -1.49 0.25 0.00 0.27 0.00 0.00 31.44 30.97 2ftu n GLU 12 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 2ftu s PHE 13 N -1.65 0.73 0.00 4.31 0.08 -1.26 -4.02 117.98 116.17 2ftu s PHE 13 Ca 0.35 0.78 0.00 0.00 0.12 0.00 0.00 56.93 58.18 2ftu s PHE 13 Cb 0.22 -3.17 0.00 0.00 -0.57 0.00 0.00 43.02 39.50 2ftu s PHE 13 CO 0.31 -4.02 0.00 0.39 -0.10 0.00 0.00 175.22 171.80 2ftu n GLU 14 N -4.95 0.00 -1.23 0.44 1.02 -1.26 -4.88 120.64 109.78 2ftu n GLU 14 Ca 0.08 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.92 2ftu n GLU 14 Cb 0.58 -3.14 0.11 0.00 -0.02 0.00 0.00 31.44 28.97 2ftu n GLU 14 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2ftu s GLU 15 N 0.00 1.91 0.00 3.49 0.41 -1.26 -4.72 118.70 118.54 2ftu s GLU 15 Ca 0.00 1.07 0.00 0.00 -0.41 0.00 0.00 54.97 55.63 2ftu s GLU 15 Cb 0.00 -1.87 0.00 0.00 -1.78 0.00 0.00 34.13 30.48 2ftu s GLU 15 CO 0.00 -1.85 0.42 -0.35 -0.49 0.00 0.00 175.26 172.98 2ftu n PRO 16 N -3.65 0.66 -0.00 0.39 -0.04 -1.26 -2.77 135.00 128.33 2ftu n PRO 16 Ca 0.08 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.52 2ftu n PRO 16 Cb 0.54 -1.25 -0.01 0.00 -0.04 0.00 0.00 33.50 32.74 2ftu n PRO 16 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2ftu n ARG 17 N 0.00 0.05 0.00 0.54 1.85 -1.26 -4.54 116.66 113.30 2ftu n ARG 17 Ca 0.00 0.02 0.00 0.00 -1.00 0.00 0.00 57.85 56.87 2ftu n ARG 17 Cb 0.12 -0.59 0.00 0.00 -1.05 0.00 0.00 32.46 30.94 2ftu n ARG 17 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2ftu n VAL 18 N -3.23 0.00 0.29 8.89 0.31 -1.11 -1.65 118.33 121.82 2ftu n VAL 18 Ca -0.04 0.73 0.19 0.00 -0.01 0.00 0.00 64.34 65.20 2ftu n VAL 18 Cb 0.42 -1.44 0.99 0.00 -0.91 0.00 0.00 33.84 32.91 2ftu n VAL 18 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2ftu h ILE 19 N 0.00 0.00 0.01 2.52 1.08 -1.83 -1.27 117.51 118.03 2ftu h ILE 19 Ca 0.00 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2ftu h ILE 19 Cb 0.00 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 34.56 2ftu h ILE 19 CO 0.00 0.00 -0.01 -0.78 -0.69 0.00 0.00 178.15 176.67 2ftu h ASP 20 N 0.00 -0.02 -0.88 1.72 3.58 -1.70 0.14 116.42 119.26 2ftu h ASP 20 Ca 0.00 -0.61 0.09 0.00 0.42 0.00 0.00 57.03 56.93 2ftu h ASP 20 Cb 0.08 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.06 2ftu h ASP 20 CO 0.00 0.61 0.53 0.17 -2.88 0.00 0.00 179.24 177.67 2ftu h LEU 21 N -0.65 0.79 -1.30 2.28 8.10 -0.31 0.15 115.31 124.37 2ftu h LEU 21 Ca -0.00 0.04 -0.06 0.00 0.11 0.00 0.00 57.88 57.97 2ftu h LEU 21 Cb 0.63 -0.12 -0.01 0.00 -0.44 0.00 0.00 40.66 40.72 2ftu h LEU 21 CO 0.00 0.46 -0.29 -0.50 -4.11 0.00 0.00 178.44 174.00 2ftu h TRP 22 N 0.90 0.00 0.69 0.17 6.55 -1.36 -1.05 115.95 121.86 2ftu h TRP 22 Ca 0.42 0.00 -0.03 0.00 0.95 0.00 0.00 58.89 60.23 2ftu h TRP 22 Cb 0.33 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.62 2ftu h TRP 22 CO -0.04 0.29 -0.49 0.22 -1.05 0.00 0.00 178.44 177.37 2ftu h ASP 23 N 0.00 -1.26 1.49 -3.49 1.82 0.21 -3.08 116.42 112.11 2ftu h ASP 23 Ca -0.00 0.08 -0.02 0.00 -0.39 0.00 0.00 57.03 56.70 2ftu h ASP 23 Cb 0.67 0.38 -0.00 0.00 0.68 0.00 0.00 39.33 41.06 2ftu h ASP 23 CO 0.04 -0.72 -0.08 -0.07 -1.61 0.00 0.00 179.24 176.80 2ftu h LEU 24 N -1.13 0.00 -0.46 2.28 4.07 -1.21 -1.60 115.31 117.26 2ftu h LEU 24 Ca -0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.87 2ftu h LEU 24 Cb 0.92 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.66 2ftu h LEU 24 CO 0.05 0.08 0.11 0.00 -1.08 0.00 0.00 178.44 177.61 2ftu n ALA 25 N -2.13 0.82 0.22 1.53 0.00 -0.41 -0.67 120.51 119.88 2ftu n ALA 25 Ca 0.02 0.06 0.14 0.00 0.00 0.00 0.00 53.44 53.66 2ftu n ALA 25 Cb 0.47 -0.91 0.72 0.00 0.00 0.00 0.00 19.45 19.72 2ftu n ALA 25 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2ftu h GLN 26 N 0.00 0.00 0.00 0.00 3.07 -1.31 -3.35 115.11 113.52 2ftu h GLN 26 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2ftu h GLN 26 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.79 2ftu h GLN 26 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 178.83 177.79 2ftu n SER 27 N -2.44 0.00 0.00 0.06 3.41 -0.65 -5.08 113.62 108.91 2ftu n SER 27 Ca -0.01 -0.75 0.00 0.00 -0.26 0.00 0.00 58.87 57.84 2ftu n SER 27 Cb 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2ftu n SER 27 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ftu n ALA 28 N 0.00 0.00 -2.65 7.33 0.00 0.16 -4.37 120.51 120.97 2ftu n ALA 28 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2ftu n ALA 28 Cb 0.19 0.22 0.09 0.00 0.00 0.00 0.00 19.45 19.94 2ftu n ALA 28 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ftu n ASN 29 N -1.59 -1.36 -4.97 0.00 2.85 -1.26 -5.06 115.26 103.87 2ftu n ASN 29 Ca 0.00 -2.04 -0.18 0.00 -0.11 0.00 0.00 54.58 52.25 2ftu n ASN 29 Cb 0.00 0.75 -0.00 0.00 1.24 0.00 0.00 39.78 41.77 2ftu n ASN 29 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2ftu s LEU 30 N -2.94 3.67 0.48 1.20 2.01 -1.26 -4.97 118.68 116.87 2ftu s LEU 30 Ca 0.11 -0.44 0.00 0.00 0.01 0.00 0.00 54.13 53.82 2ftu s LEU 30 Cb 0.31 -2.53 0.00 0.00 0.01 0.00 0.00 46.19 43.98 2ftu s LEU 30 CO -0.08 -0.63 0.70 0.42 1.01 0.00 0.00 176.35 177.77 2ftu s THR 31 N -2.33 3.72 0.27 5.49 -4.23 -1.26 -4.93 115.64 112.36 2ftu s THR 31 Ca 0.50 -0.50 0.16 0.00 -1.18 0.00 0.00 61.69 60.67 2ftu s THR 31 Cb -0.08 -3.38 0.10 0.00 1.34 0.00 0.00 72.50 70.47 2ftu s THR 31 CO 0.31 -0.28 1.76 -0.78 -0.54 0.00 0.00 174.62 175.09 2ftu h ASP 32 N 0.30 0.00 0.03 3.99 3.58 -1.99 -1.44 116.42 120.89 2ftu h ASP 32 Ca -0.45 0.00 -0.39 0.00 0.42 0.00 0.00 57.03 56.61 2ftu h ASP 32 Cb 1.26 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.26 2ftu h ASP 32 CO 0.56 0.41 -2.31 1.17 -2.88 0.00 0.00 179.24 176.19 2ftu n LYS 33 N -3.76 0.66 -0.26 0.28 3.00 -1.26 -3.51 118.16 113.30 2ftu n LYS 33 Ca -0.01 0.21 0.04 0.00 -0.00 0.00 0.00 58.31 58.56 2ftu n LYS 33 Cb 0.48 -1.57 0.18 0.00 0.00 0.00 0.00 35.03 34.11 2ftu n LYS 33 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 2ftu h GLU 34 N -0.18 0.54 0.37 1.64 4.22 -1.86 -1.55 114.58 117.76 2ftu h GLU 34 Ca -0.55 -0.03 -0.01 0.00 0.08 0.00 0.00 59.36 58.85 2ftu h GLU 34 Cb 1.86 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.98 2ftu h GLU 34 CO -0.10 0.36 -0.34 1.25 -2.18 0.00 0.00 179.01 178.00 2ftu h LEU 35 N 0.56 -0.91 -1.03 1.64 7.12 -1.44 -1.82 115.31 119.42 2ftu h LEU 35 Ca 0.40 0.07 0.18 0.00 0.13 0.00 0.00 57.88 58.66 2ftu h LEU 35 Cb 0.52 0.29 -0.10 0.00 -0.53 0.00 0.00 40.66 40.84 2ftu h LEU 35 CO -0.34 -0.46 0.61 -0.08 -0.13 0.00 0.00 178.44 178.05 2ftu h GLU 36 N -0.70 0.75 0.02 1.25 4.57 -1.41 0.20 114.58 119.27 2ftu h GLU 36 Ca -0.05 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 2ftu h GLU 36 Cb 0.59 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 2ftu h GLU 36 CO -0.02 0.50 -0.01 0.00 -1.18 0.00 0.00 179.01 178.29 2ftu h ALA 37 N 1.63 -0.03 -0.20 2.92 0.00 -1.29 -1.62 119.26 120.67 2ftu h ALA 37 Ca 0.57 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.39 2ftu h ALA 37 Cb 0.88 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2ftu h ALA 37 CO -0.36 -0.37 0.15 0.35 0.00 0.00 0.00 179.25 179.02 2ftu h PHE 38 N -0.33 0.00 0.05 0.00 3.04 -0.24 -0.90 116.94 118.55 2ftu h PHE 38 Ca -0.00 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.94 2ftu h PHE 38 Cb 0.31 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.82 2ftu h PHE 38 CO 0.03 0.00 -0.03 -0.09 -2.02 0.00 0.00 178.31 176.20 2ftu h ARG 39 N 0.00 -0.07 -0.29 1.11 1.12 -0.27 -1.36 114.38 114.62 2ftu h ARG 39 Ca 0.10 0.00 -0.13 0.00 -1.11 0.00 0.00 59.98 58.84 2ftu h ARG 39 Cb 0.39 0.02 -0.00 0.00 -0.01 0.00 0.00 29.97 30.36 2ftu h ARG 39 CO -0.00 0.44 -0.33 1.05 -3.11 0.00 0.00 179.97 178.02 2ftu h GLU 40 N -0.62 0.73 -0.94 0.20 4.11 -1.05 -0.96 114.58 116.04 2ftu h GLU 40 Ca -0.01 -0.40 0.07 0.00 0.07 0.00 0.00 59.36 59.09 2ftu h GLU 40 Cb 0.54 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.75 2ftu h GLU 40 CO 0.01 1.02 0.60 1.05 0.07 0.00 0.00 179.01 181.76 2ftu h GLU 41 N 0.48 1.05 -0.14 1.06 4.11 -1.22 -1.61 114.58 118.29 2ftu h GLU 41 Ca 0.04 -0.06 -0.19 0.00 0.07 0.00 0.00 59.36 59.22 2ftu h GLU 41 Cb 0.91 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 2ftu h GLU 41 CO 0.08 0.69 -0.68 -0.07 0.07 0.00 0.00 179.01 179.11 2ftu h LEU 42 N 1.08 0.68 -1.03 3.06 3.38 -1.16 -1.11 115.31 120.20 2ftu h LEU 42 Ca 0.41 -0.41 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2ftu h LEU 42 Cb 0.19 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2ftu h LEU 42 CO -0.18 1.17 0.64 0.50 0.09 0.00 0.00 178.44 180.66 2ftu h LYS 43 N 0.42 1.29 0.25 1.13 1.63 -0.34 0.44 116.57 121.39 2ftu h LYS 43 Ca -0.02 -0.08 -0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2ftu h LYS 43 Cb 1.26 -0.29 -0.01 0.00 -0.60 0.00 0.00 32.23 32.59 2ftu h LYS 43 CO 0.13 0.86 -0.20 1.25 -3.45 0.00 0.00 179.45 178.04 2ftu h HIS 44 N 1.33 -0.51 0.30 1.91 2.76 -1.23 -1.97 115.15 117.74 2ftu h HIS 44 Ca 0.36 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.51 2ftu h HIS 44 Cb -0.15 0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.01 2ftu h HIS 44 CO 0.00 -0.30 -0.15 0.35 -1.30 0.00 0.00 177.93 176.54 2ftu h PHE 45 N -0.46 -0.38 -0.81 5.26 3.04 0.00 -1.23 116.94 122.37 2ftu h PHE 45 Ca -0.01 -0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.90 2ftu h PHE 45 Cb 0.40 0.13 -0.04 0.00 2.56 0.00 0.00 35.95 39.00 2ftu h PHE 45 CO -0.12 -0.21 0.39 1.05 -2.02 0.00 0.00 178.31 177.40 2ftu h GLU 46 N -0.44 1.15 -0.48 1.11 -0.00 -0.26 0.88 114.58 116.54 2ftu h GLU 46 Ca -0.04 -0.16 0.02 0.00 -0.00 0.00 0.00 59.36 59.17 2ftu h GLU 46 Cb 0.34 -0.21 -0.03 0.00 -0.00 0.00 0.00 28.75 28.85 2ftu h GLU 46 CO 0.07 0.88 0.29 0.00 -0.00 0.00 0.00 179.01 180.25 2ftu h ALA 47 N 1.28 0.61 0.03 1.06 0.00 -1.17 0.33 119.26 121.40 2ftu h ALA 47 Ca 0.28 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.19 2ftu h ALA 47 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2ftu h ALA 47 CO -0.04 -0.01 -0.12 -0.22 0.00 0.00 0.00 179.25 178.86 2ftu h LYS 48 N 0.58 -0.22 -0.01 0.00 1.63 0.10 -1.73 116.57 116.92 2ftu h LYS 48 Ca 0.19 0.01 -0.19 0.00 -0.85 0.00 0.00 60.65 59.82 2ftu h LYS 48 Cb -0.00 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 2ftu h LYS 48 CO -0.08 -0.14 -0.81 0.97 -3.45 0.00 0.00 179.45 175.94 2ftu h ILE 49 N -0.22 1.47 -0.33 2.00 2.10 -0.77 -1.63 117.51 120.13 2ftu h ILE 49 Ca 0.03 -2.47 -0.07 0.00 1.08 0.00 0.00 64.86 63.43 2ftu h ILE 49 Cb 0.26 2.35 -0.02 0.00 -1.09 0.00 0.00 36.82 38.33 2ftu h ILE 49 CO -0.10 0.72 -0.11 -0.33 -1.08 0.00 0.00 178.15 177.25 2ftu h GLU 50 N 0.13 0.57 -0.28 2.19 4.39 -0.88 0.18 114.58 120.87 2ftu h GLU 50 Ca -0.03 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.47 2ftu h GLU 50 Cb 1.41 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.99 2ftu h GLU 50 CO 0.12 0.67 0.06 0.87 -1.16 0.00 0.00 179.01 179.58 2ftu h LYS 51 N 0.52 0.46 -0.29 2.33 1.57 -1.08 0.16 116.57 120.25 2ftu h LYS 51 Ca 0.10 -0.12 0.07 0.00 -1.87 0.00 0.00 60.65 58.83 2ftu h LYS 51 Cb 0.50 -0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.68 2ftu h LYS 51 CO 0.03 0.55 -0.21 1.25 -0.57 0.00 0.00 179.45 180.50 2ftu h HIS 52 N 0.29 -0.55 -0.65 -1.35 -0.00 -0.56 0.16 115.15 112.49 2ftu h HIS 52 Ca 0.09 0.04 0.14 0.00 -0.00 0.00 0.00 60.37 60.63 2ftu h HIS 52 Cb 0.31 0.28 -0.11 0.00 -0.00 0.00 0.00 27.41 27.89 2ftu h HIS 52 CO 0.02 -0.29 -0.03 -0.97 -0.00 0.00 0.00 177.93 176.66 2ftu h ASN 53 N -0.19 -0.35 -0.29 3.26 -0.73 -0.54 0.26 115.58 116.99 2ftu h ASN 53 Ca 0.15 0.17 -0.05 0.00 1.87 0.00 0.00 56.30 58.44 2ftu h ASN 53 Cb 0.42 0.31 -0.01 0.00 0.27 0.00 0.00 38.32 39.32 2ftu h ASN 53 CO -0.40 -0.15 -0.01 -0.74 -0.37 0.00 0.00 177.43 175.76 2ftu h HIS 54 N 0.09 0.58 0.13 0.67 2.76 0.04 -1.88 115.15 117.54 2ftu h HIS 54 Ca 0.34 -0.10 -0.01 0.00 -2.20 0.00 0.00 60.37 58.40 2ftu h HIS 54 Cb 0.56 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 29.37 2ftu h HIS 54 CO -0.41 0.67 -0.06 1.88 -1.30 0.00 0.00 177.93 178.71 2ftu h TYR 55 N 0.31 -0.16 -0.96 5.26 -1.99 0.34 -1.92 116.97 117.85 2ftu h TYR 55 Ca 0.08 -0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.83 2ftu h TYR 55 Cb 0.45 0.05 -0.05 0.00 2.00 0.00 0.00 36.73 39.18 2ftu h TYR 55 CO 0.04 0.15 0.64 -0.56 -0.00 0.00 0.00 178.16 178.43 2ftu h GLN 56 N -0.49 1.24 0.07 4.88 -0.00 -0.55 0.49 115.11 120.75 2ftu h GLN 56 Ca -0.02 -0.07 -0.00 0.00 -0.00 0.00 0.00 58.65 58.55 2ftu h GLN 56 Cb 0.39 -0.28 0.00 0.00 -0.00 0.00 0.00 27.48 27.59 2ftu h GLN 56 CO 0.03 0.82 -0.03 0.87 -0.00 0.00 0.00 178.83 180.52 2ftu h LYS 57 N 1.28 -0.09 0.00 0.06 1.57 -1.21 -0.92 116.57 117.25 2ftu h LYS 57 Ca 0.36 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2ftu h LYS 57 Cb -0.10 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.23 2ftu h LYS 57 CO -0.09 -0.02 0.00 1.96 -0.57 0.00 0.00 179.45 180.73 2ftu h GLN 58 N -0.13 0.00 -0.10 3.15 1.08 -0.51 -1.86 115.11 116.74 2ftu h GLN 58 Ca -0.01 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 2ftu h GLN 58 Cb 0.11 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 2ftu h GLN 58 CO 0.02 0.00 -0.02 1.25 -0.95 0.00 0.00 178.83 179.12 2ftu h LEU 59 N 0.00 0.19 -0.37 1.46 5.85 0.41 -0.37 115.31 122.48 2ftu h LEU 59 Ca 0.00 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 2ftu h LEU 59 Cb 0.49 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2ftu h LEU 59 CO 0.00 0.51 0.14 -0.08 -0.34 0.00 0.00 178.44 178.67 2ftu h GLU 60 N -0.14 0.57 -0.27 1.25 4.57 -0.67 0.45 114.58 120.35 2ftu h GLU 60 Ca 0.02 -0.11 -0.04 0.00 -1.18 0.00 0.00 59.36 58.06 2ftu h GLU 60 Cb 0.43 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.92 2ftu h GLU 60 CO 0.01 0.56 0.01 0.82 -1.18 0.00 0.00 179.01 179.23 2ftu h ILE 61 N 0.46 1.25 -0.50 2.32 2.04 -1.43 -1.98 117.51 119.66 2ftu h ILE 61 Ca 0.12 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 2ftu h ILE 61 Cb 0.21 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 2ftu h ILE 61 CO -0.01 0.28 0.18 0.00 0.00 0.00 0.00 178.15 178.60 2ftu h ALA 62 N 0.83 1.38 0.41 1.87 0.00 -0.78 -1.65 119.26 121.32 2ftu h ALA 62 Ca 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2ftu h ALA 62 Cb 0.40 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2ftu h ALA 62 CO 0.01 0.46 -0.35 1.25 0.00 0.00 0.00 179.25 180.63 2ftu h HIS 63 N 0.72 -0.93 -0.69 0.00 -0.00 0.18 0.25 115.15 114.69 2ftu h HIS 63 Ca 0.17 0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.47 2ftu h HIS 63 Cb 0.17 0.35 -0.03 0.00 -0.00 0.00 0.00 27.41 27.91 2ftu h HIS 63 CO 0.01 -0.50 0.15 1.49 -0.00 0.00 0.00 177.93 179.08 2ftu h GLU 64 N -0.76 1.11 -0.34 5.26 4.81 -1.17 0.78 114.58 124.27 2ftu h GLU 64 Ca -0.04 -0.28 -0.12 0.00 -0.13 0.00 0.00 59.36 58.79 2ftu h GLU 64 Cb 0.66 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2ftu h GLU 64 CO -0.02 1.00 -0.28 0.87 -0.73 0.00 0.00 179.01 179.84 2ftu h LYS 65 N 1.04 0.71 0.00 1.92 1.79 -1.07 -1.79 116.57 119.18 2ftu h LYS 65 Ca 0.21 -0.31 -0.15 0.00 -2.18 0.00 0.00 60.65 58.22 2ftu h LYS 65 Cb 0.40 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.00 2ftu h LYS 65 CO 0.01 0.91 -0.70 1.37 -1.08 0.00 0.00 179.45 179.96 2ftu h LEU 66 N 0.61 0.00 -0.30 2.94 -0.00 -0.38 -1.23 115.31 116.94 2ftu h LEU 66 Ca 0.08 0.00 0.06 0.00 -0.00 0.00 0.00 57.88 58.02 2ftu h LEU 66 Cb 0.79 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.40 2ftu h LEU 66 CO 0.07 0.70 -0.07 0.03 -0.00 0.00 0.00 178.44 179.17 2ftu h ARG 67 N 0.00 0.01 0.00 0.17 3.08 -0.52 0.37 114.38 117.49 2ftu h ARG 67 Ca -0.01 -0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 2ftu h ARG 67 Cb 1.49 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.53 2ftu h ARG 67 CO 0.09 0.01 -0.52 0.45 -1.07 0.00 0.00 179.97 178.92 2ftu h HIS 68 N 0.01 0.00 -0.20 3.04 3.86 -1.27 -2.27 115.15 118.32 2ftu h HIS 68 Ca 0.15 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.20 2ftu h HIS 68 Cb 0.22 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 2ftu h HIS 68 CO -0.28 0.52 -0.53 0.00 0.86 0.00 0.00 177.93 178.50 2ftu h ALA 69 N 1.48 0.70 0.00 2.45 0.00 -0.38 -2.92 119.26 120.60 2ftu h ALA 69 Ca -0.01 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.36 2ftu h ALA 69 Cb 0.96 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2ftu h ALA 69 CO 0.07 0.68 -0.20 0.93 0.00 0.00 0.00 179.25 180.73 2ftu h GLU 70 N 0.45 0.00 0.00 0.00 5.08 -0.06 -1.07 114.58 118.98 2ftu h GLU 70 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2ftu h GLU 70 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2ftu h GLU 70 CO 0.10 0.20 0.00 0.45 -1.00 0.00 0.00 179.01 178.76 2ftu n SER 71 N -4.21 0.00 -0.07 1.42 2.88 -0.88 -2.88 113.62 109.89 2ftu n SER 71 Ca -0.02 -1.11 -0.09 0.00 -1.33 0.00 0.00 58.87 56.32 2ftu n SER 71 Cb 0.27 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.65 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 -0.87 0.85 0.00 2.46 3.14 -0.49 -5.05 118.33 118.37 2ftu n VAL 72 Ca 0.16 -0.40 0.00 0.00 -2.96 0.00 0.00 64.34 61.13 2ftu n VAL 72 Cb 0.07 -0.90 0.00 0.00 -1.06 0.00 0.00 33.84 31.96 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 2.57 0.53 3.56 7.55 0.00 -0.72 -5.02 105.19 113.65 2ftu n GLY 73 Ca -0.24 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.93 4.34 0.60 1.61 -1.08 -1.25 -4.82 116.67 113.13 2ftu s ASP 74 Ca 0.00 0.25 0.37 0.00 -0.52 0.00 0.00 52.55 52.65 2ftu s ASP 74 Cb 0.00 -2.54 1.85 0.00 -1.46 0.00 0.00 42.92 40.78 2ftu s ASP 74 CO 0.00 -3.31 2.17 1.23 0.52 0.00 0.00 175.17 175.78 2ftu h GLY 75 N 20.54 0.00 0.71 2.66 0.00 -1.95 -0.15 103.07 124.88 2ftu h GLY 75 Ca -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 2ftu h GLY 75 CO 1.10 0.00 -0.07 -2.09 0.00 0.00 0.00 176.54 175.48 2ftu h GLU 76 N 0.00 -0.19 0.03 4.80 4.22 -2.01 -1.99 114.58 119.45 2ftu h GLU 76 Ca -0.00 0.01 -0.22 0.00 0.08 0.00 0.00 59.36 59.23 2ftu h GLU 76 Cb 0.25 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2ftu h GLU 76 CO 0.00 0.11 -0.97 0.07 -2.18 0.00 0.00 179.01 176.04 2ftu h ARG 77 N -0.49 0.28 0.43 1.92 0.11 -1.94 -3.34 114.38 111.35 2ftu h ARG 77 Ca -0.02 -0.34 -0.02 0.00 0.10 0.00 0.00 59.98 59.70 2ftu h ARG 77 Cb 0.39 0.11 0.00 0.00 1.11 0.00 0.00 29.97 31.58 2ftu h ARG 77 CO 0.03 1.06 -0.21 0.28 0.10 0.00 0.00 179.97 181.24 2ftu h VAL 78 N 0.14 0.42 -0.11 0.08 2.07 -0.99 -1.32 116.25 116.55 2ftu h VAL 78 Ca -0.07 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 2ftu h VAL 78 Cb 1.63 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 2ftu h VAL 78 CO 0.16 0.07 0.06 -1.28 0.02 0.00 0.00 177.57 176.60 2ftu h SER 79 N -0.95 0.13 -1.01 0.57 0.87 -1.55 0.63 113.55 112.24 2ftu h SER 79 Ca -0.06 -0.06 0.06 0.00 -1.23 0.00 0.00 61.79 60.50 2ftu h SER 79 Cb 0.56 -0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 62.43 2ftu h SER 79 CO 0.10 0.15 0.65 -0.09 -0.53 0.00 0.00 176.83 177.11 2ftu h ARG 80 N 0.10 1.18 0.64 2.24 2.43 -1.68 -0.28 114.38 119.00 2ftu h ARG 80 Ca 0.04 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 2ftu h ARG 80 Cb 0.04 -0.27 0.01 0.00 -0.42 0.00 0.00 29.97 29.33 2ftu h ARG 80 CO -0.01 0.78 -0.31 0.77 -1.51 0.00 0.00 179.97 179.70 2ftu h SER 81 N 1.22 -0.73 -0.74 -3.80 0.02 -0.34 -1.97 113.55 107.21 2ftu h SER 81 Ca 0.42 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.44 2ftu h SER 81 Cb 0.11 0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.79 2ftu h SER 81 CO -0.16 -0.51 0.48 -0.09 -1.14 0.00 0.00 176.83 175.42 2ftu h ARG 82 N -0.87 0.80 0.41 3.45 2.43 -0.07 0.23 114.38 120.75 2ftu h ARG 82 Ca -0.09 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.01 2ftu h ARG 82 Cb 0.66 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2ftu h ARG 82 CO 0.14 0.53 -0.20 1.49 -1.51 0.00 0.00 179.97 180.43 2ftu h GLU 83 N 0.82 -0.53 -0.35 0.20 4.81 -1.10 -1.15 114.58 117.28 2ftu h GLU 83 Ca 0.31 0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 2ftu h GLU 83 Cb 0.18 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 2ftu h GLU 83 CO -0.10 -0.22 0.12 -0.22 -0.73 0.00 0.00 179.01 177.86 2ftu h LYS 84 N -0.85 0.50 -0.31 1.92 3.11 -0.82 -1.84 116.57 118.29 2ftu h LYS 84 Ca -0.06 -0.07 -0.02 0.00 -2.81 0.00 0.00 60.65 57.69 2ftu h LYS 84 Cb 0.55 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.67 2ftu h LYS 84 CO 0.09 0.44 0.11 1.25 -2.81 0.00 0.00 179.45 178.53 2ftu h HIS 85 N 0.50 0.49 -0.79 1.91 2.76 -0.41 0.53 115.15 120.15 2ftu h HIS 85 Ca 0.12 -0.05 0.01 0.00 -2.20 0.00 0.00 60.37 58.26 2ftu h HIS 85 Cb 0.14 -0.14 -0.04 0.00 1.55 0.00 0.00 27.41 28.92 2ftu h HIS 85 CO 0.01 0.49 0.52 0.00 -1.30 0.00 0.00 177.93 177.65 2ftu h ALA 86 N 0.94 1.00 -0.30 5.26 0.00 -0.85 -0.15 119.26 125.16 2ftu h ALA 86 Ca 0.10 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2ftu h ALA 86 Cb 0.23 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2ftu h ALA 86 CO -0.00 0.40 0.04 1.25 0.00 0.00 0.00 179.25 180.93 2ftu h LEU 87 N 1.06 -0.03 -0.05 0.00 5.85 -0.75 0.12 115.31 121.50 2ftu h LEU 87 Ca 0.29 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 59.07 2ftu h LEU 87 Cb -0.11 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 2ftu h LEU 87 CO -0.07 0.02 0.03 -0.07 -0.34 0.00 0.00 178.44 178.01 2ftu h LEU 88 N 0.14 0.07 -0.29 2.25 4.07 -0.53 -0.92 115.31 120.10 2ftu h LEU 88 Ca 0.14 -0.08 0.03 0.00 0.08 0.00 0.00 57.88 58.05 2ftu h LEU 88 Cb 0.16 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 41.86 2ftu h LEU 88 CO -0.20 0.12 0.11 -0.33 -1.08 0.00 0.00 178.44 177.06 2ftu h GLU 89 N 0.01 0.24 -0.64 1.13 4.39 -0.87 -0.09 114.58 118.75 2ftu h GLU 89 Ca 0.02 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.77 2ftu h GLU 89 Cb 0.07 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 28.61 2ftu h GLU 89 CO -0.00 0.16 0.32 0.78 -1.16 0.00 0.00 179.01 179.11 2ftu h GLY 90 N 0.25 0.92 0.90 -3.84 0.00 -0.61 -0.75 103.07 99.94 2ftu h GLY 90 Ca 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2ftu h GLY 90 CO -0.12 0.10 -0.14 -0.09 0.00 0.00 0.00 176.54 176.30 2ftu h ARG 91 N 0.59 -0.37 -0.75 4.80 1.12 -0.75 -1.31 114.38 117.70 2ftu h ARG 91 Ca 0.30 0.03 -0.04 0.00 -1.11 0.00 0.00 59.98 59.15 2ftu h ARG 91 Cb 0.24 0.08 -0.03 0.00 -0.01 0.00 0.00 29.97 30.25 2ftu h ARG 91 CO -0.21 -0.17 0.32 1.79 -3.11 0.00 0.00 179.97 178.59 2ftu h THR 92 N -0.49 1.25 0.37 0.20 1.35 -0.43 0.19 112.91 115.35 2ftu h THR 92 Ca -0.04 -0.75 -0.02 0.00 -0.55 0.00 0.00 66.41 65.05 2ftu h THR 92 Cb 0.37 0.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.11 2ftu h THR 92 CO 0.06 0.31 -0.18 0.50 -0.25 0.00 0.00 175.52 175.96 2ftu h LYS 93 N 1.09 -0.48 -0.72 4.72 3.64 -1.18 0.53 116.57 124.16 2ftu h LYS 93 Ca 0.26 0.03 0.13 0.00 -1.27 0.00 0.00 60.65 59.79 2ftu h LYS 93 Cb 0.17 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.01 2ftu h LYS 93 CO -0.03 -0.29 0.30 0.93 -2.27 0.00 0.00 179.45 178.10 2ftu h GLU 94 N -0.55 0.45 -0.12 1.90 5.08 -0.87 -1.85 114.58 118.62 2ftu h GLU 94 Ca -0.05 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2ftu h GLU 94 Cb 0.42 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 2ftu h GLU 94 CO 0.08 0.30 -0.07 1.25 -1.00 0.00 0.00 179.01 179.57 2ftu h LEU 95 N 0.47 0.27 -0.59 1.33 7.12 -0.37 -0.93 115.31 122.60 2ftu h LEU 95 Ca 0.39 -0.43 0.11 0.00 0.13 0.00 0.00 57.88 58.07 2ftu h LEU 95 Cb 0.54 -0.08 -0.08 0.00 -0.53 0.00 0.00 40.66 40.51 2ftu h LEU 95 CO -0.36 0.64 0.13 1.23 -0.13 0.00 0.00 178.44 179.95 2ftu h GLY 96 N -0.10 0.76 0.90 3.75 0.00 -0.53 0.33 103.07 108.19 2ftu h GLY 96 Ca 0.02 -0.03 0.02 0.00 0.00 0.00 0.00 47.33 47.34 2ftu h GLY 96 CO 0.02 -0.11 0.25 -1.82 0.00 0.00 0.00 176.54 174.89 2ftu h TYR 97 N 0.27 0.47 -0.25 5.60 3.20 -1.24 0.63 116.97 125.64 2ftu h TYR 97 Ca 0.31 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.19 2ftu h TYR 97 Cb 0.45 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 2ftu h TYR 97 CO -0.24 0.28 0.13 1.15 -1.64 0.00 0.00 178.16 177.84 2ftu h THR 98 N 0.51 1.13 0.37 1.81 2.02 0.35 -1.37 112.91 117.73 2ftu h THR 98 Ca 0.17 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 2ftu h THR 98 Cb 0.01 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2ftu h THR 98 CO -0.08 0.13 -0.30 0.58 0.37 0.00 0.00 175.52 176.22 2ftu h VAL 99 N 0.29 0.37 -0.75 3.16 2.07 -0.24 -1.11 116.25 120.05 2ftu h VAL 99 Ca 0.09 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.71 2ftu h VAL 99 Cb 0.08 0.37 -0.08 0.00 -1.52 0.00 0.00 31.29 30.15 2ftu h VAL 99 CO -0.01 0.00 0.37 0.50 0.02 0.00 0.00 177.57 178.45 2ftu h LYS 100 N -0.68 0.59 0.56 1.57 3.64 -0.66 0.29 116.57 121.88 2ftu h LYS 100 Ca -0.03 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2ftu h LYS 100 Cb 0.59 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 2ftu h LYS 100 CO -0.02 0.39 -0.37 0.87 -2.27 0.00 0.00 179.45 178.05 2ftu h LYS 101 N 0.60 -0.85 -0.41 1.90 1.57 -0.98 0.03 116.57 118.42 2ftu h LYS 101 Ca 0.38 0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 59.18 2ftu h LYS 101 Cb 0.44 0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.92 2ftu h LYS 101 CO -0.30 -0.57 0.10 1.25 -0.57 0.00 0.00 179.45 179.36 2ftu h HIS 102 N -0.89 0.62 -0.31 -1.35 2.76 -0.34 -1.23 115.15 114.42 2ftu h HIS 102 Ca -0.07 -0.04 0.04 0.00 -2.20 0.00 0.00 60.37 58.10 2ftu h HIS 102 Cb 0.73 -0.19 -0.07 0.00 1.55 0.00 0.00 27.41 29.44 2ftu h HIS 102 CO -0.12 0.54 -0.49 -0.07 -1.30 0.00 0.00 177.93 176.49 2ftu h LEU 103 N 0.60 -1.63 -0.64 0.26 -0.00 -0.31 0.19 115.31 113.78 2ftu h LEU 103 Ca 0.14 0.21 0.03 0.00 -0.00 0.00 0.00 57.88 58.25 2ftu h LEU 103 Cb 0.23 0.66 -0.04 0.00 -0.00 0.00 0.00 40.66 41.51 2ftu h LEU 103 CO -0.00 -0.37 0.40 1.56 -0.00 0.00 0.00 178.44 180.02 2ftu h GLN 104 N -0.39 0.76 0.64 1.13 4.20 -0.02 -0.07 115.11 121.36 2ftu h GLN 104 Ca 0.06 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 2ftu h GLN 104 Cb 0.54 -0.17 0.01 0.00 0.30 0.00 0.00 27.48 28.16 2ftu h GLN 104 CO -0.50 0.50 -0.31 -0.44 -0.67 0.00 0.00 178.83 177.42 2ftu h ASP 105 N 0.78 -0.73 -0.98 1.46 3.32 -1.07 -1.11 116.42 118.09 2ftu h ASP 105 Ca 0.25 0.01 0.08 0.00 0.02 0.00 0.00 57.03 57.39 2ftu h ASP 105 Cb 0.01 0.19 -0.07 0.00 0.22 0.00 0.00 39.33 39.68 2ftu h ASP 105 CO -0.10 -0.34 0.63 -0.07 -1.72 0.00 0.00 179.24 177.63 2ftu h LEU 106 N -1.20 0.98 -0.59 1.55 4.07 -0.63 0.19 115.31 119.67 2ftu h LEU 106 Ca -0.09 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 57.86 2ftu h LEU 106 Cb 0.67 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 42.20 2ftu h LEU 106 CO 0.14 0.61 0.26 -1.28 -1.08 0.00 0.00 178.44 177.09 2ftu h SER 107 N 1.11 0.80 0.64 -0.43 0.87 -1.00 0.36 113.55 115.89 2ftu h SER 107 Ca 0.44 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 2ftu h SER 107 Cb 0.23 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 2ftu h SER 107 CO -0.19 0.73 0.00 0.61 -0.53 0.00 0.00 176.83 177.45 2ftu n GLY 108 N -0.87 -1.14 0.00 5.77 0.00 -0.31 -2.25 105.19 106.40 2ftu n GLY 108 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2ftu n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ftu n ARG 109 N -1.71 0.00 0.04 1.61 1.74 0.50 -4.69 116.66 114.16 2ftu n ARG 109 Ca 0.04 0.04 0.21 0.00 -0.77 0.00 0.00 57.85 57.37 2ftu n ARG 109 Cb 0.21 -0.32 0.66 0.00 -1.02 0.00 0.00 32.46 31.99 2ftu n ARG 109 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2ftu h ILE 110 N 0.00 0.24 0.00 0.55 1.08 -0.42 0.28 117.51 119.24 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 0.00 0.48 0.00 0.00 -3.07 0.00 0.00 36.82 34.23 2ftu h ILE 110 CO 0.00 0.00 0.07 -1.20 -0.69 0.00 0.00 178.15 176.33 2ftu n SER 111 N -3.50 0.06 -4.31 1.72 7.64 -0.95 -4.52 113.62 109.75 2ftu n SER 111 Ca 0.10 0.47 -0.16 0.00 1.01 0.00 0.00 58.87 60.29 2ftu n SER 111 Cb 0.83 -0.47 -0.10 0.00 -1.01 0.00 0.00 64.21 63.46 2ftu n SER 111 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2ftu s ARG 112 N -2.94 1.35 -0.37 1.43 3.00 1.00 -5.13 118.95 117.29 2ftu s ARG 112 Ca -0.00 -1.71 0.01 0.00 -1.00 0.00 0.00 55.73 53.03 2ftu s ARG 112 Cb 0.01 -0.36 0.18 0.00 0.00 0.00 0.00 34.95 34.78 2ftu s ARG 112 CO 0.02 -0.22 0.79 0.00 0.00 0.00 0.00 175.30 175.89 2ftu s ALA 113 N -3.65 -3.16 0.54 6.12 0.00 -1.26 -4.90 121.76 115.45 2ftu s ALA 113 Ca 0.33 0.70 0.09 0.00 0.00 0.00 0.00 51.96 53.08 2ftu s ALA 113 Cb 0.07 -2.82 0.09 0.00 0.00 0.00 0.00 23.12 20.46 2ftu s ALA 113 CO 0.11 -2.28 0.74 2.89 0.00 0.00 0.00 175.76 177.22 2ftu n ARG 114 N 4.28 0.62 -0.93 0.00 1.85 -1.26 -4.84 116.66 116.38 2ftu n ARG 114 Ca 0.09 -2.87 -0.15 0.00 -1.00 0.00 0.00 57.85 53.91 2ftu n ARG 114 Cb 0.59 -0.23 -0.12 0.00 -1.05 0.00 0.00 32.46 31.65 2ftu n ARG 114 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2ftu n HIS 115 N -2.17 0.44 -3.58 2.89 8.25 -1.26 -4.60 115.22 115.18 2ftu n HIS 115 Ca 0.15 -1.62 -0.05 0.00 -0.26 0.00 0.00 57.72 55.95 2ftu n HIS 115 Cb 0.55 -1.62 -0.02 0.00 1.12 0.00 0.00 29.99 30.02 2ftu n HIS 115 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2ftu s ASN 116 N 2.21 -0.17 1.14 0.41 3.04 -1.26 -5.15 114.94 115.16 2ftu s ASN 116 Ca 0.59 -0.01 -0.15 0.00 0.04 0.00 0.00 52.86 53.33 2ftu s ASN 116 Cb 0.25 0.18 0.26 0.00 -1.54 0.00 0.00 41.25 40.41 2ftu s ASN 116 CO -0.01 -0.30 1.07 -1.61 -3.04 0.00 0.00 177.10 173.21 2ftu s GLU 117 N -2.53 -0.69 0.00 0.43 8.01 -1.26 -4.79 118.70 117.86 2ftu s GLU 117 Ca 0.09 0.34 0.03 0.00 0.01 0.00 0.00 54.97 55.45 2ftu s GLU 117 Cb -0.01 -1.62 0.03 0.00 -4.31 0.00 0.00 34.13 28.22 2ftu s GLU 117 CO -0.05 -3.45 0.61 1.28 0.01 0.00 0.00 175.26 173.66