#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i8l s HIS 4 N 0.00 3.66 -0.11 1.12 5.65 -1.26 -4.24 115.29 120.11 1i8l s HIS 4 Ca 0.00 1.16 0.02 0.00 0.25 0.00 0.00 55.06 56.49 1i8l s HIS 4 Cb 0.00 -2.59 0.01 0.00 -1.18 0.00 0.00 32.58 28.82 1i8l s HIS 4 CO 0.00 0.34 -0.15 0.08 -0.65 0.00 0.00 174.74 174.36 1i8l s VAL 5 N -0.12 1.50 -0.04 0.89 1.01 -1.26 -0.81 120.40 121.57 1i8l s VAL 5 Ca 0.30 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.69 1i8l s VAL 5 Cb -0.18 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 1i8l s VAL 5 CO 0.16 0.44 -0.21 0.00 0.00 0.00 0.00 175.10 175.50 1i8l s ALA 6 N 0.96 2.37 0.05 5.51 0.00 0.15 -4.15 121.76 126.65 1i8l s ALA 6 Ca -0.07 -1.04 -0.06 0.00 0.00 0.00 0.00 51.96 50.79 1i8l s ALA 6 Cb -0.15 -0.76 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 1i8l s ALA 6 CO -0.01 0.50 0.10 1.14 0.00 0.00 0.00 175.76 177.50 1i8l s GLN 7 N -0.52 0.63 0.42 0.00 -2.07 -1.26 -0.43 119.66 116.42 1i8l s GLN 7 Ca 0.07 -0.81 -0.26 0.00 -1.82 0.00 0.00 55.36 52.54 1i8l s GLN 7 Cb -0.11 0.25 -0.10 0.00 -1.09 0.00 0.00 33.01 31.96 1i8l s GLN 7 CO 0.01 -0.16 1.27 -0.35 -1.32 0.00 0.00 175.29 174.74 1i8l n PRO 8 N 0.60 1.95 0.03 9.60 -0.04 -1.25 -4.83 135.00 141.06 1i8l n PRO 8 Ca -0.18 0.69 -0.06 0.00 -0.04 0.00 0.00 63.50 63.91 1i8l n PRO 8 Cb 0.59 -2.38 0.12 0.00 -0.04 0.00 0.00 33.50 31.79 1i8l n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1i8l h ALA 9 N 2.12 0.88 -2.84 0.55 0.00 -1.95 -3.30 119.26 114.72 1i8l h ALA 9 Ca -0.48 -0.47 -0.14 0.00 0.00 0.00 0.00 54.91 53.83 1i8l h ALA 9 Cb 1.29 -0.09 -0.24 0.00 0.00 0.00 0.00 17.79 18.75 1i8l h ALA 9 CO 0.60 0.66 -0.32 0.08 0.00 0.00 0.00 179.25 180.27 1i8l s VAL 10 N -4.09 0.01 -0.14 0.00 1.01 -1.26 -0.83 120.40 115.10 1i8l s VAL 10 Ca -0.06 -0.11 -0.09 0.00 0.00 0.00 0.00 61.98 61.72 1i8l s VAL 10 Cb 0.12 -0.50 0.05 0.00 0.00 0.00 0.00 36.38 36.05 1i8l s VAL 10 CO 0.81 -0.06 0.35 -0.69 0.00 0.00 0.00 175.10 175.51 1i8l s VAL 11 N -0.16 -0.02 -0.02 2.92 1.01 0.57 -4.88 120.40 119.82 1i8l s VAL 11 Ca -0.03 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 1i8l s VAL 11 Cb -0.03 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 1i8l s VAL 11 CO 0.01 0.03 0.10 -1.48 0.00 0.00 0.00 175.10 173.76 1i8l s LEU 12 N 0.94 4.01 0.00 3.92 -0.00 -1.26 -0.46 118.68 125.83 1i8l s LEU 12 Ca -0.06 0.22 0.00 0.00 -0.00 0.00 0.00 54.13 54.29 1i8l s LEU 12 Cb -0.07 -2.28 0.00 0.00 -0.00 0.00 0.00 46.19 43.84 1i8l s LEU 12 CO -0.07 0.29 0.00 0.00 -0.00 0.00 0.00 176.35 176.57 1i8l n ALA 13 N 1.29 0.00 -2.55 1.48 0.00 0.69 -4.83 120.51 116.58 1i8l n ALA 13 Ca -0.14 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.05 1i8l n ALA 13 Cb 0.53 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.87 1i8l n ALA 13 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1i8l s SER 14 N -1.66 3.28 0.27 0.00 1.04 -0.81 -4.96 113.70 110.87 1i8l s SER 14 Ca 0.00 -1.38 0.01 0.00 0.48 0.00 0.00 55.95 55.06 1i8l s SER 14 Cb 0.00 -0.26 0.60 0.00 0.10 0.00 0.00 66.02 66.46 1i8l s SER 14 CO 0.00 -0.52 1.75 0.77 0.98 0.00 0.00 173.24 176.22 1i8l h SER 15 N 1.90 0.53 0.00 7.02 4.64 -1.92 -3.29 113.55 122.44 1i8l h SER 15 Ca -0.43 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1i8l h SER 15 Cb 1.24 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1i8l h SER 15 CO 0.76 0.19 0.00 0.54 -0.87 0.00 0.00 176.83 177.45 1i8l n ARG 16 N -4.88 0.00 -0.01 4.77 3.00 -1.26 -4.66 116.66 113.62 1i8l n ARG 16 Ca 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 58.03 1i8l n ARG 16 Cb 0.49 -0.33 0.00 0.00 0.00 0.00 0.00 32.46 32.62 1i8l n ARG 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1i8l n GLY 17 N 0.46 0.16 3.73 -0.13 0.00 -1.24 -4.86 105.19 103.32 1i8l n GLY 17 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1i8l n GLY 17 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i8l s ILE 18 N 0.00 4.95 -0.03 -0.61 1.09 -1.26 -2.00 121.20 123.34 1i8l s ILE 18 Ca 0.00 1.41 0.02 0.00 -1.10 0.00 0.00 60.65 60.98 1i8l s ILE 18 Cb 0.00 -4.02 0.01 0.00 -1.06 0.00 0.00 42.46 37.39 1i8l s ILE 18 CO 0.00 0.32 -0.06 0.00 -0.10 0.00 0.00 174.94 175.10 1i8l s ALA 19 N 0.36 0.70 0.27 9.38 0.00 -0.60 -1.92 121.76 129.95 1i8l s ALA 19 Ca 0.36 -0.19 0.04 0.00 0.00 0.00 0.00 51.96 52.17 1i8l s ALA 19 Cb -0.18 -0.32 -0.06 0.00 0.00 0.00 0.00 23.12 22.56 1i8l s ALA 19 CO 0.19 0.07 0.00 -1.12 0.00 0.00 0.00 175.76 174.90 1i8l s SER 20 N 0.43 2.20 0.00 0.00 0.01 -1.26 -0.35 113.70 114.73 1i8l s SER 20 Ca -0.06 -1.26 0.00 0.00 1.31 0.00 0.00 55.95 55.94 1i8l s SER 20 Cb -0.10 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.07 1i8l s SER 20 CO 0.00 -0.50 0.00 2.22 0.41 0.00 0.00 173.24 175.37 1i8l n PHE 21 N -0.54 0.00 -3.96 2.43 -1.74 -0.52 -4.94 117.46 108.20 1i8l n PHE 21 Ca -0.04 0.00 -0.35 0.00 -0.56 0.00 0.00 57.45 56.50 1i8l n PHE 21 Cb 0.65 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.56 1i8l n PHE 21 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1i8l s VAL 22 N -2.00 5.04 -0.14 1.97 1.01 -1.26 -1.76 120.40 123.25 1i8l s VAL 22 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 1i8l s VAL 22 Cb 0.00 -3.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 1i8l s VAL 22 CO 0.00 0.51 -0.11 0.00 0.00 0.00 0.00 175.10 175.50 1i8l s GLU 24 N 0.48 1.98 0.24 0.00 2.12 0.43 0.44 118.70 124.40 1i8l s GLU 24 Ca -0.08 -0.50 0.10 0.00 0.36 0.00 0.00 54.97 54.85 1i8l s GLU 24 Cb -0.15 -1.65 -0.04 0.00 0.26 0.00 0.00 34.13 32.54 1i8l s GLU 24 CO 0.04 0.00 -0.08 1.52 -0.54 0.00 0.00 175.26 176.20 1i8l s TYR 25 N 0.78 2.58 -1.19 5.30 1.13 -0.82 0.33 117.35 125.46 1i8l s TYR 25 Ca -0.12 -0.25 -0.11 0.00 -1.41 0.00 0.00 57.07 55.18 1i8l s TYR 25 Cb -0.16 -1.18 0.21 0.00 -1.10 0.00 0.00 41.96 39.73 1i8l s TYR 25 CO 0.02 0.60 1.44 0.00 -2.51 0.00 0.00 175.55 175.10 1i8l n ALA 26 N -0.50 4.31 -1.54 9.51 0.00 0.01 -4.74 120.51 127.56 1i8l n ALA 26 Ca -0.08 -4.40 -0.32 0.00 0.00 0.00 0.00 53.44 48.64 1i8l n ALA 26 Cb 0.58 -2.84 -0.06 0.00 0.00 0.00 0.00 19.45 17.13 1i8l n ALA 26 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1i8l n SER 27 N 4.29 1.87 -2.72 0.00 2.88 -1.26 -4.69 113.62 113.98 1i8l n SER 27 Ca 0.33 -0.63 -0.27 0.00 -1.33 0.00 0.00 58.87 56.97 1i8l n SER 27 Cb 0.40 -1.50 -0.09 0.00 -0.75 0.00 0.00 64.21 62.28 1i8l n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1i8l n PRO 28 N 8.80 2.98 -0.34 -1.46 -0.04 -1.26 -4.87 135.00 138.81 1i8l n PRO 28 Ca 0.43 -1.82 0.00 0.00 -0.04 0.00 0.00 63.50 62.07 1i8l n PRO 28 Cb 0.46 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.51 1i8l n PRO 28 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1i8l n GLY 29 N 2.79 0.78 3.56 0.55 0.00 -1.26 -5.03 105.19 106.58 1i8l n GLY 29 Ca 0.61 -1.86 -0.28 0.00 0.00 0.00 0.00 46.02 44.49 1i8l n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i8l s LYS 30 N -1.84 2.44 0.00 1.61 0.00 -1.26 -4.92 119.74 115.77 1i8l s LYS 30 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 55.97 56.02 1i8l s LYS 30 Cb 0.00 -4.88 0.00 0.00 0.00 0.00 0.00 37.83 32.95 1i8l s LYS 30 CO 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 175.35 171.98 1i8l n ALA 31 N 14.34 0.00 0.00 0.59 0.00 -1.26 -4.64 120.51 129.55 1i8l n ALA 31 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1i8l n ALA 31 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1i8l n ALA 31 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1i8l n THR 32 N 0.00 0.00 -3.92 0.00 -1.04 -1.26 -4.03 114.28 104.03 1i8l n THR 32 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.72 1i8l n THR 32 Cb 0.00 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.35 1i8l n THR 32 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1i8l s GLU 33 N 0.00 1.62 -0.04 -2.82 2.12 -0.15 -1.43 118.70 117.99 1i8l s GLU 33 Ca 0.00 -0.56 0.04 0.00 0.36 0.00 0.00 54.97 54.80 1i8l s GLU 33 Cb 0.00 -2.06 -0.00 0.00 0.26 0.00 0.00 34.13 32.33 1i8l s GLU 33 CO 0.00 -0.41 -0.15 0.08 -0.54 0.00 0.00 175.26 174.25 1i8l s VAL 34 N 1.58 1.23 -0.14 3.70 1.01 -0.99 -1.27 120.40 125.53 1i8l s VAL 34 Ca 0.01 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1i8l s VAL 34 Cb -0.15 -1.07 -0.00 0.00 0.00 0.00 0.00 36.38 35.16 1i8l s VAL 34 CO -0.08 0.36 -0.17 -0.60 0.00 0.00 0.00 175.10 174.62 1i8l s ARG 35 N 0.13 3.23 -0.14 2.72 3.52 0.35 -1.33 118.95 127.43 1i8l s ARG 35 Ca -0.04 -0.76 -0.03 0.00 -0.13 0.00 0.00 55.73 54.77 1i8l s ARG 35 Cb -0.11 -2.56 -0.03 0.00 -1.56 0.00 0.00 34.95 30.70 1i8l s ARG 35 CO 0.02 0.11 -0.06 0.08 -0.81 0.00 0.00 175.30 174.64 1i8l s VAL 36 N 0.58 3.72 -0.05 7.11 1.01 0.11 -0.46 120.40 132.43 1i8l s VAL 36 Ca -0.10 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1i8l s VAL 36 Cb -0.16 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1i8l s VAL 36 CO 0.03 0.51 -0.11 -0.89 0.00 0.00 0.00 175.10 174.65 1i8l s THR 37 N 0.25 0.98 -0.30 3.92 2.01 0.43 -1.15 115.64 121.78 1i8l s THR 37 Ca -0.04 -0.42 -0.09 0.00 0.31 0.00 0.00 61.69 61.45 1i8l s THR 37 Cb -0.14 -0.89 -0.01 0.00 0.01 0.00 0.00 72.50 71.47 1i8l s THR 37 CO 0.03 0.31 0.14 -0.69 -0.69 0.00 0.00 174.62 173.73 1i8l s VAL 38 N 0.48 4.57 -0.05 3.82 1.01 -0.41 0.14 120.40 129.97 1i8l s VAL 38 Ca -0.10 -0.39 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 1i8l s VAL 38 Cb -0.13 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 1i8l s VAL 38 CO 0.02 0.10 0.05 -0.76 0.00 0.00 0.00 175.10 174.51 1i8l s LEU 39 N 1.61 3.79 -0.27 3.92 1.43 0.20 0.14 118.68 129.51 1i8l s LEU 39 Ca 0.05 0.17 -0.05 0.00 -1.03 0.00 0.00 54.13 53.27 1i8l s LEU 39 Cb -0.17 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 44.02 1i8l s LEU 39 CO 0.06 0.33 0.02 -0.60 0.23 0.00 0.00 176.35 176.39 1i8l s ARG 40 N -1.30 3.08 -0.06 1.70 3.52 0.29 0.39 118.95 126.56 1i8l s ARG 40 Ca 0.18 -0.84 -0.08 0.00 -0.13 0.00 0.00 55.73 54.86 1i8l s ARG 40 Cb -0.12 -3.21 -0.04 0.00 -1.56 0.00 0.00 34.95 30.02 1i8l s ARG 40 CO 0.08 -0.39 0.21 -1.14 -0.81 0.00 0.00 175.30 173.25 1i8l s GLN 41 N 1.45 3.54 -0.30 5.12 0.74 0.04 -1.63 119.66 128.63 1i8l s GLN 41 Ca 0.02 -0.05 -0.16 0.00 0.05 0.00 0.00 55.36 55.22 1i8l s GLN 41 Cb -0.17 -3.16 0.17 0.00 1.10 0.00 0.00 33.01 30.96 1i8l s GLN 41 CO -0.00 0.73 1.10 0.00 -0.55 0.00 0.00 175.29 176.56 1i8l s ALA 42 N -1.13 -2.61 -1.52 1.58 0.00 -1.15 -3.51 121.76 113.43 1i8l s ALA 42 Ca 0.20 2.06 0.00 0.00 0.00 0.00 0.00 51.96 54.22 1i8l s ALA 42 Cb -0.13 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.05 1i8l s ALA 42 CO 0.10 -0.54 0.00 -0.40 0.00 0.00 0.00 175.76 174.91 1i8l n ASP 43 N 3.90 -4.87 -0.30 0.00 5.75 -1.26 -1.08 116.55 118.70 1i8l n ASP 43 Ca -0.15 0.35 -0.04 0.00 -0.01 0.00 0.00 54.79 54.95 1i8l n ASP 43 Cb 0.56 -3.63 -0.02 0.00 -1.03 0.00 0.00 41.12 37.00 1i8l n ASP 43 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1i8l n SER 44 N -0.49 -4.04 -4.35 -1.12 7.64 -1.26 -5.00 113.62 105.00 1i8l n SER 44 Ca -0.14 0.10 -0.39 0.00 1.01 0.00 0.00 58.87 59.44 1i8l n SER 44 Cb 0.49 -1.88 -0.12 0.00 -1.01 0.00 0.00 64.21 61.69 1i8l n SER 44 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1i8l s GLN 45 N -1.70 2.86 0.56 1.43 -1.52 -0.24 -5.09 119.66 115.96 1i8l s GLN 45 Ca 0.00 -1.03 -0.17 0.00 -1.95 0.00 0.00 55.36 52.21 1i8l s GLN 45 Cb 0.00 -3.57 -0.05 0.00 -0.22 0.00 0.00 33.01 29.17 1i8l s GLN 45 CO 0.00 -0.62 1.05 0.14 -0.25 0.00 0.00 175.29 175.61 1i8l s VAL 46 N 1.50 3.85 -0.18 1.09 -7.23 -1.26 -2.94 120.40 115.24 1i8l s VAL 46 Ca 0.01 0.94 -0.09 0.00 -1.81 0.00 0.00 61.98 61.03 1i8l s VAL 46 Cb -0.19 -3.42 0.07 0.00 0.56 0.00 0.00 36.38 33.40 1i8l s VAL 46 CO 0.05 -0.46 0.41 -0.89 -0.31 0.00 0.00 175.10 173.90 1i8l s THR 47 N -2.36 -0.16 0.29 5.32 2.01 -0.65 -4.94 115.64 115.15 1i8l s THR 47 Ca 0.64 0.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.46 1i8l s THR 47 Cb -0.16 -0.62 -0.10 0.00 0.01 0.00 0.00 72.50 71.63 1i8l s THR 47 CO 0.33 0.05 1.44 -1.61 -0.69 0.00 0.00 174.62 174.14 1i8l s GLU 48 N 1.68 4.24 -0.18 4.92 2.02 -1.26 -0.55 118.70 129.57 1i8l s GLU 48 Ca -0.08 2.36 0.08 0.00 0.02 0.00 0.00 54.97 57.35 1i8l s GLU 48 Cb -0.09 -3.07 -0.16 0.00 0.10 0.00 0.00 34.13 30.90 1i8l s GLU 48 CO -0.13 -0.42 -0.06 0.28 0.02 0.00 0.00 175.26 174.95 1i8l n VAL 49 N 1.80 1.12 0.00 2.63 0.31 0.12 -4.84 118.33 119.47 1i8l n VAL 49 Ca 0.05 -0.56 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 1i8l n VAL 49 Cb 0.40 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.43 1i8l n VAL 49 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1i8l s ALA 51 N -2.00 -1.68 -0.00 0.00 0.00 -1.26 -1.29 121.76 115.53 1i8l s ALA 51 Ca 0.00 0.81 -0.29 0.00 0.00 0.00 0.00 51.96 52.48 1i8l s ALA 51 Cb 0.00 0.54 0.08 0.00 0.00 0.00 0.00 23.12 23.74 1i8l s ALA 51 CO 0.00 -0.63 0.70 0.00 0.00 0.00 0.00 175.76 175.83 1i8l s ALA 52 N -2.86 -1.74 -0.02 0.00 0.00 -0.30 -4.77 121.76 112.06 1i8l s ALA 52 Ca -0.02 1.12 0.07 0.00 0.00 0.00 0.00 51.96 53.13 1i8l s ALA 52 Cb -0.01 0.18 -0.02 0.00 0.00 0.00 0.00 23.12 23.27 1i8l s ALA 52 CO -0.05 -0.48 -0.23 0.99 0.00 0.00 0.00 175.76 175.98 1i8l s THR 53 N -1.91 2.27 0.03 0.00 2.01 -1.26 0.06 115.64 116.84 1i8l s THR 53 Ca -0.06 -1.03 0.00 0.00 0.31 0.00 0.00 61.69 60.91 1i8l s THR 53 Cb -0.00 -1.81 -0.02 0.00 0.01 0.00 0.00 72.50 70.67 1i8l s THR 53 CO 0.03 0.58 -0.04 -0.72 -0.69 0.00 0.00 174.62 173.77 1i8l s TYR 54 N -0.64 0.43 -0.28 4.92 -0.85 -0.44 -4.74 117.35 115.75 1i8l s TYR 54 Ca 0.10 -0.62 -0.18 0.00 -0.52 0.00 0.00 57.07 55.86 1i8l s TYR 54 Cb -0.10 -0.28 -0.02 0.00 0.38 0.00 0.00 41.96 41.93 1i8l s TYR 54 CO -0.01 -0.19 0.50 -1.64 -1.52 0.00 0.00 175.55 172.69 1i8l s MET 55 N -1.97 3.99 -0.73 -3.49 -1.94 -1.26 -2.34 119.30 111.56 1i8l s MET 55 Ca -0.10 0.21 -0.34 0.00 -1.71 0.00 0.00 55.69 53.75 1i8l s MET 55 Cb -0.07 -3.68 -0.18 0.00 2.01 0.00 0.00 34.83 32.92 1i8l s MET 55 CO -0.02 -0.39 2.47 -0.12 -0.01 0.00 0.00 175.02 176.94 1i8l n MET 56 N 5.56 0.29 0.00 2.03 1.56 -0.52 -0.68 117.12 125.36 1i8l n MET 56 Ca -0.05 0.04 0.00 0.00 -0.27 0.00 0.00 57.70 57.42 1i8l n MET 56 Cb 0.50 -1.90 0.00 0.00 2.15 0.00 0.00 33.22 33.97 1i8l n MET 56 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1i8l n GLY 57 N 6.67 0.15 3.15 -5.12 0.00 -1.26 -4.70 105.19 104.07 1i8l n GLY 57 Ca 0.56 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.47 1i8l n GLY 57 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1i8l s ASN 58 N -0.79 1.06 0.02 1.61 0.01 0.14 -5.12 114.94 111.87 1i8l s ASN 58 Ca 0.00 -0.92 -0.30 0.00 -0.71 0.00 0.00 52.86 50.93 1i8l s ASN 58 Cb 0.00 0.09 -0.06 0.00 0.41 0.00 0.00 41.25 41.69 1i8l s ASN 58 CO 0.00 -0.42 1.39 -1.83 -1.51 0.00 0.00 177.10 174.73 1i8l s GLU 59 N -3.40 4.30 0.00 -0.60 -1.05 -1.26 -4.70 118.70 111.98 1i8l s GLU 59 Ca 0.07 1.96 -0.33 0.00 -0.15 0.00 0.00 54.97 56.53 1i8l s GLU 59 Cb 0.02 -3.52 -0.12 0.00 -0.44 0.00 0.00 34.13 30.08 1i8l s GLU 59 CO -0.04 -0.54 1.84 -0.11 0.95 0.00 0.00 175.26 177.36 1i8l n LEU 60 N 5.11 3.59 -3.90 1.83 7.94 -1.26 -4.93 117.00 125.38 1i8l n LEU 60 Ca 0.13 0.98 -0.29 0.00 -1.11 0.00 0.00 56.01 55.72 1i8l n LEU 60 Cb 0.44 -1.43 -0.16 0.00 0.53 0.00 0.00 43.42 42.79 1i8l n LEU 60 CO 0.58 -0.02 -0.42 -0.89 -1.11 0.00 0.00 177.39 175.53 1i8l s THR 61 N 3.44 1.19 1.04 1.96 2.01 -1.26 -4.34 115.64 119.69 1i8l s THR 61 Ca 0.88 -0.76 -0.18 0.00 0.31 0.00 0.00 61.69 61.95 1i8l s THR 61 Cb -0.62 -1.39 0.24 0.00 0.01 0.00 0.00 72.50 70.74 1i8l s THR 61 CO 0.46 0.07 1.31 -0.36 -0.69 0.00 0.00 174.62 175.41 1i8l s PHE 62 N 1.59 1.07 0.00 4.92 0.40 -1.26 -4.79 117.98 119.90 1i8l s PHE 62 Ca -0.01 0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.57 1i8l s PHE 62 Cb -0.16 -4.12 0.00 0.00 0.51 0.00 0.00 43.02 39.25 1i8l s PHE 62 CO -0.08 -3.09 0.00 1.28 0.70 0.00 0.00 175.22 174.04 1i8l n LEU 63 N -4.06 0.00 -0.07 -0.37 4.77 -1.26 -5.00 117.00 111.00 1i8l n LEU 63 Ca 0.17 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.98 1i8l n LEU 63 Cb 0.59 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.55 1i8l n LEU 63 CO 0.43 -0.45 -1.04 0.47 -1.33 0.00 0.00 177.39 175.48 1i8l n ASP 64 N -2.68 1.49 0.21 -1.43 8.00 -1.26 -3.75 116.55 117.14 1i8l n ASP 64 Ca 0.00 0.07 0.18 0.00 0.71 0.00 0.00 54.79 55.75 1i8l n ASP 64 Cb 0.00 -0.22 0.84 0.00 -0.02 0.00 0.00 41.12 41.72 1i8l n ASP 64 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1i8l h ASP 65 N 0.02 0.00 -3.99 -2.24 3.32 -2.00 -3.44 116.42 108.09 1i8l h ASP 65 Ca -0.49 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.07 1i8l h ASP 65 Cb 2.02 0.00 0.04 0.00 0.22 0.00 0.00 39.33 41.62 1i8l h ASP 65 CO 0.01 0.00 0.45 -0.55 -1.72 0.00 0.00 179.24 177.43 1i8l s SER 66 N -5.40 6.39 -0.12 6.45 0.15 -1.25 -5.00 113.70 114.92 1i8l s SER 66 Ca -0.04 2.19 -0.14 0.00 0.70 0.00 0.00 55.95 58.65 1i8l s SER 66 Cb 0.14 -2.59 -0.26 0.00 -1.71 0.00 0.00 66.02 61.59 1i8l s SER 66 CO 0.49 -0.76 0.47 0.40 1.20 0.00 0.00 173.24 175.05 1i8l h ILE 67 N 1.96 0.90 -3.78 6.45 2.04 -1.86 -3.48 117.51 119.75 1i8l h ILE 67 Ca -0.49 -2.37 -0.42 0.00 1.00 0.00 0.00 64.86 62.58 1i8l h ILE 67 Cb 1.23 2.60 0.18 0.00 -0.74 0.00 0.00 36.82 40.09 1i8l h ILE 67 CO 0.61 0.72 0.39 0.00 0.00 0.00 0.00 178.15 179.86 1i8l s THR 69 N -3.80 0.00 0.05 0.00 -1.32 -0.96 -4.87 115.64 104.74 1i8l s THR 69 Ca 0.75 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.96 1i8l s THR 69 Cb -0.02 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.06 1i8l s THR 69 CO 0.53 0.00 1.21 -0.83 -2.21 0.00 0.00 174.62 173.32 1i8l s GLY 70 N -1.94 -0.09 -0.00 6.08 0.00 -1.26 -0.09 107.32 110.01 1i8l s GLY 70 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 44.72 44.71 1i8l s GLY 70 CO -0.05 3.94 0.10 -0.51 0.00 0.00 0.00 173.10 176.59 1i8l s THR 71 N -2.14 0.07 0.03 0.90 -4.23 -1.18 -4.36 115.64 104.73 1i8l s THR 71 Ca 0.25 -0.62 0.05 0.00 -1.18 0.00 0.00 61.69 60.19 1i8l s THR 71 Cb -0.01 -0.36 -0.03 0.00 1.34 0.00 0.00 72.50 73.45 1i8l s THR 71 CO 0.01 -0.34 -0.12 -0.55 -0.54 0.00 0.00 174.62 173.08 1i8l s SER 72 N -1.15 4.24 -0.31 3.99 0.15 -1.26 0.28 113.70 119.63 1i8l s SER 72 Ca -0.12 -0.28 0.01 0.00 0.70 0.00 0.00 55.95 56.25 1i8l s SER 72 Cb -0.07 -0.86 0.15 0.00 -1.71 0.00 0.00 66.02 63.53 1i8l s SER 72 CO 0.01 0.26 0.34 -0.55 1.20 0.00 0.00 173.24 174.51 1i8l s SER 73 N -1.47 1.24 1.26 5.45 0.15 0.33 -4.85 113.70 115.81 1i8l s SER 73 Ca 0.16 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 55.92 1i8l s SER 73 Cb -0.11 0.66 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 1i8l s SER 73 CO 0.07 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 174.77 1i8l n GLY 74 N 5.03 3.05 1.61 9.45 0.00 -1.26 -1.80 105.19 121.27 1i8l n GLY 74 Ca 0.02 -0.31 -0.04 0.00 0.00 0.00 0.00 46.02 45.69 1i8l n GLY 74 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1i8l n ASN 75 N 2.41 5.58 -3.85 1.61 5.03 -1.26 -4.79 115.26 119.98 1i8l n ASN 75 Ca 0.00 -2.55 -0.13 0.00 0.87 0.00 0.00 54.58 52.77 1i8l n ASN 75 Cb 0.00 -1.13 -0.14 0.00 -1.02 0.00 0.00 39.78 37.49 1i8l n ASN 75 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 1i8l s GLN 76 N -0.34 0.01 -0.01 3.52 0.74 -0.74 -1.95 119.66 120.89 1i8l s GLN 76 Ca 0.09 0.05 0.05 0.00 0.05 0.00 0.00 55.36 55.60 1i8l s GLN 76 Cb 0.06 -0.04 -0.01 0.00 1.10 0.00 0.00 33.01 34.12 1i8l s GLN 76 CO -0.00 -0.03 -0.15 0.08 -0.55 0.00 0.00 175.29 174.63 1i8l s VAL 77 N 0.20 1.20 -1.04 1.34 1.01 0.17 -0.51 120.40 122.77 1i8l s VAL 77 Ca -0.02 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.25 1i8l s VAL 77 Cb -0.02 -1.01 0.29 0.00 0.00 0.00 0.00 36.38 35.64 1i8l s VAL 77 CO -0.01 0.33 1.30 0.59 0.00 0.00 0.00 175.10 177.31 1i8l n ASN 78 N 2.67 5.87 -4.75 3.32 4.13 0.14 -0.56 115.26 126.08 1i8l n ASN 78 Ca -0.14 -3.32 -0.41 0.00 1.68 0.00 0.00 54.58 52.39 1i8l n ASN 78 Cb 0.55 -1.23 -0.03 0.00 -1.54 0.00 0.00 39.78 37.52 1i8l n ASN 78 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1i8l s LEU 79 N -2.35 4.49 -0.32 3.41 1.43 -0.72 -3.11 118.68 121.50 1i8l s LEU 79 Ca 0.32 2.38 -0.02 0.00 -1.03 0.00 0.00 54.13 55.78 1i8l s LEU 79 Cb 0.02 -3.63 0.11 0.00 0.03 0.00 0.00 46.19 42.72 1i8l s LEU 79 CO 0.04 -0.33 0.15 -0.89 0.23 0.00 0.00 176.35 175.55 1i8l s THR 80 N -0.78 0.41 0.52 5.49 2.01 0.87 -1.43 115.64 122.72 1i8l s THR 80 Ca 0.49 -1.34 -0.14 0.00 0.31 0.00 0.00 61.69 61.00 1i8l s THR 80 Cb -0.34 -1.32 -0.07 0.00 0.01 0.00 0.00 72.50 70.78 1i8l s THR 80 CO 0.43 -0.79 0.96 -0.63 -0.69 0.00 0.00 174.62 173.89 1i8l s ILE 81 N 1.55 4.62 0.21 1.82 1.01 0.53 -2.27 121.20 128.67 1i8l s ILE 81 Ca 0.12 1.02 -0.00 0.00 0.00 0.00 0.00 60.65 61.79 1i8l s ILE 81 Cb -0.19 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 1i8l s ILE 81 CO -0.21 -0.77 0.10 -1.10 0.00 0.00 0.00 174.94 172.96 1i8l s GLN 82 N -4.30 1.22 -1.44 2.79 -0.21 -1.18 -1.56 119.66 114.98 1i8l s GLN 82 Ca 0.57 -1.64 -0.07 0.00 0.02 0.00 0.00 55.36 54.24 1i8l s GLN 82 Cb -0.10 0.08 0.04 0.00 1.00 0.00 0.00 33.01 34.03 1i8l s GLN 82 CO 0.37 -0.33 0.60 0.41 -2.12 0.00 0.00 175.29 174.21 1i8l n GLY 83 N -0.30 -0.51 3.70 3.09 0.00 -1.12 -4.93 105.19 105.12 1i8l n GLY 83 Ca -0.00 0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1i8l n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i8l s LEU 84 N -6.65 4.29 0.08 0.99 1.02 -0.85 -5.04 118.68 112.53 1i8l s LEU 84 Ca 0.37 1.40 -0.06 0.00 0.02 0.00 0.00 54.13 55.86 1i8l s LEU 84 Cb -0.18 -3.36 -0.05 0.00 0.02 0.00 0.00 46.19 42.62 1i8l s LEU 84 CO 0.45 -0.28 0.34 -0.13 0.02 0.00 0.00 176.35 176.75 1i8l s ARG 85 N 1.37 3.62 0.64 1.70 3.00 -1.26 -4.66 118.95 123.35 1i8l s ARG 85 Ca 0.44 -0.06 0.21 0.00 0.00 0.00 0.00 55.73 56.33 1i8l s ARG 85 Cb -0.19 -2.97 1.04 0.00 0.00 0.00 0.00 34.95 32.84 1i8l s ARG 85 CO 0.20 0.55 1.57 0.00 0.00 0.00 0.00 175.30 177.62 1i8l h ALA 86 N 3.39 1.92 0.00 2.13 0.00 -1.85 0.32 119.26 125.17 1i8l h ALA 86 Ca -0.48 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 1i8l h ALA 86 Cb 1.18 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1i8l h ALA 86 CO 0.70 -0.80 -0.43 0.00 0.00 0.00 0.00 179.25 178.72 1i8l h MET 87 N 0.00 0.00 -0.56 0.00 -0.00 -1.92 -2.98 114.93 109.47 1i8l h MET 87 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.81 1i8l h MET 87 Cb 1.47 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.07 1i8l h MET 87 CO -0.00 0.43 0.00 -0.40 -0.00 0.00 0.00 176.91 176.94 1i8l n ASP 88 N -3.63 3.04 -4.77 -0.10 5.68 0.11 -4.93 116.55 111.94 1i8l n ASP 88 Ca -0.01 -2.17 -0.41 0.00 -0.50 0.00 0.00 54.79 51.71 1i8l n ASP 88 Cb 0.52 -0.41 0.01 0.00 -1.14 0.00 0.00 41.12 40.10 1i8l n ASP 88 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1i8l s THR 89 N -1.58 2.05 -3.23 2.12 -1.32 -1.13 -4.90 115.64 107.65 1i8l s THR 89 Ca 0.34 0.05 0.00 0.00 -1.21 0.00 0.00 61.69 60.87 1i8l s THR 89 Cb 0.20 -3.03 0.00 0.00 -1.51 0.00 0.00 72.50 68.16 1i8l s THR 89 CO 0.19 0.01 0.00 0.61 -2.21 0.00 0.00 174.62 173.22 1i8l n GLY 90 N 0.50 -0.93 3.63 6.08 0.00 -0.89 -5.02 105.19 108.56 1i8l n GLY 90 Ca 0.02 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1i8l n GLY 90 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i8l s LEU 91 N 0.00 4.07 -0.63 0.99 2.96 -1.23 -0.88 118.68 123.96 1i8l s LEU 91 Ca 0.00 0.79 -0.09 0.00 -0.22 0.00 0.00 54.13 54.62 1i8l s LEU 91 Cb 0.00 -2.93 0.16 0.00 0.50 0.00 0.00 46.19 43.92 1i8l s LEU 91 CO 0.00 -0.40 0.51 -0.31 -1.32 0.00 0.00 176.35 174.83 1i8l s TYR 92 N 2.54 3.52 0.40 5.38 1.51 0.79 -0.78 117.35 130.70 1i8l s TYR 92 Ca 0.28 -2.18 -0.25 0.00 -1.01 0.00 0.00 57.07 53.91 1i8l s TYR 92 Cb -0.15 -3.50 -0.09 0.00 -0.11 0.00 0.00 41.96 38.11 1i8l s TYR 92 CO 0.08 -0.94 1.18 0.42 -1.11 0.00 0.00 175.55 175.18 1i8l s ILE 93 N 0.52 3.10 -0.22 2.71 1.01 0.16 -1.92 121.20 126.56 1i8l s ILE 93 Ca 0.13 0.93 0.00 0.00 0.00 0.00 0.00 60.65 61.72 1i8l s ILE 93 Cb -0.19 -3.53 0.03 0.00 0.01 0.00 0.00 42.46 38.78 1i8l s ILE 93 CO -0.04 0.10 -0.12 0.00 0.00 0.00 0.00 174.94 174.88 1i8l s LYS 95 N 1.27 3.09 -0.04 0.00 2.20 0.12 -1.37 119.74 125.02 1i8l s LYS 95 Ca 0.00 -0.35 0.03 0.00 -0.36 0.00 0.00 55.97 55.29 1i8l s LYS 95 Cb -0.16 -2.89 0.00 0.00 -1.51 0.00 0.00 37.83 33.27 1i8l s LYS 95 CO -0.08 0.72 -0.12 0.08 -0.36 0.00 0.00 175.35 175.59 1i8l s VAL 96 N -0.95 1.00 -0.05 4.02 1.01 0.12 -0.43 120.40 125.12 1i8l s VAL 96 Ca 0.15 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.71 1i8l s VAL 96 Cb -0.12 -0.88 -0.01 0.00 0.00 0.00 0.00 36.38 35.38 1i8l s VAL 96 CO 0.04 0.30 -0.20 -1.61 0.00 0.00 0.00 175.10 173.64 1i8l s GLU 97 N 0.22 2.04 -0.66 2.72 2.02 0.39 0.07 118.70 125.50 1i8l s GLU 97 Ca -0.05 -0.70 -0.16 0.00 0.02 0.00 0.00 54.97 54.08 1i8l s GLU 97 Cb -0.10 -1.75 0.16 0.00 0.10 0.00 0.00 34.13 32.54 1i8l s GLU 97 CO 0.01 0.28 0.63 -0.51 0.02 0.00 0.00 175.26 175.70 1i8l s LEU 98 N -0.01 6.31 0.06 1.80 1.43 0.61 -0.50 118.68 128.38 1i8l s LEU 98 Ca -0.04 -2.11 -0.14 0.00 -1.03 0.00 0.00 54.13 50.81 1i8l s LEU 98 Cb -0.12 -2.22 -0.29 0.00 0.03 0.00 0.00 46.19 43.59 1i8l s LEU 98 CO 0.03 -0.78 1.10 0.24 0.23 0.00 0.00 176.35 177.17 1i8l h MET 99 N 8.50 0.60 -1.95 1.70 2.86 -1.47 -3.04 114.93 122.13 1i8l h MET 99 Ca -0.14 -0.82 -0.03 0.00 -2.06 0.00 0.00 59.70 56.65 1i8l h MET 99 Cb 1.07 0.27 -0.21 0.00 0.06 0.00 0.00 31.60 32.80 1i8l h MET 99 CO 0.94 1.37 0.18 -0.47 1.06 0.00 0.00 176.91 180.00 1i8l s TYR 100 N -2.95 -0.72 0.78 -0.22 5.04 -1.19 -4.44 117.35 113.65 1i8l s TYR 100 Ca -0.09 1.64 -0.11 0.00 -2.44 0.00 0.00 57.07 56.07 1i8l s TYR 100 Cb 0.06 0.31 0.06 0.00 0.35 0.00 0.00 41.96 42.74 1i8l s TYR 100 CO 0.93 -0.42 1.10 -1.25 -1.34 0.00 0.00 175.55 174.57 1i8l s PRO 101 N -0.03 2.25 1.02 4.97 0.04 -1.26 -0.98 135.00 141.02 1i8l s PRO 101 Ca -0.02 0.62 -0.13 0.00 0.04 0.00 0.00 61.00 61.51 1i8l s PRO 101 Cb -0.04 -1.94 0.20 0.00 0.04 0.00 0.00 34.50 32.76 1i8l s PRO 101 CO 0.02 -1.50 1.09 -1.25 0.04 0.00 0.00 177.00 175.41 1i8l s PRO 102 N -5.19 0.26 0.79 0.56 0.04 -1.26 -4.72 135.00 125.49 1i8l s PRO 102 Ca 0.60 0.50 -0.11 0.00 0.04 0.00 0.00 61.00 62.03 1i8l s PRO 102 Cb -0.14 -1.72 0.07 0.00 0.04 0.00 0.00 34.50 32.75 1i8l s PRO 102 CO 0.54 -2.84 1.09 -1.25 0.04 0.00 0.00 177.00 174.58 1i8l s PRO 103 N -4.95 2.13 0.03 0.56 0.04 -1.26 -5.13 135.00 126.42 1i8l s PRO 103 Ca 0.66 1.14 -0.23 0.00 0.04 0.00 0.00 61.00 62.61 1i8l s PRO 103 Cb -0.19 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.41 1i8l s PRO 103 CO 0.58 -1.72 0.68 -0.47 0.04 0.00 0.00 177.00 176.11 1i8l s TYR 104 N -2.90 3.73 -0.01 0.56 5.04 -1.26 -4.88 117.35 117.62 1i8l s TYR 104 Ca 0.61 1.35 0.05 0.00 -2.44 0.00 0.00 57.07 56.65 1i8l s TYR 104 Cb -0.17 -2.71 -0.01 0.00 0.35 0.00 0.00 41.96 39.42 1i8l s TYR 104 CO 0.56 0.34 -0.17 0.71 -1.34 0.00 0.00 175.55 175.65 1i8l s TYR 105 N -0.23 1.54 -0.01 4.97 1.51 -1.15 -4.99 117.35 119.00 1i8l s TYR 105 Ca 0.35 -0.30 0.07 0.00 -1.01 0.00 0.00 57.07 56.18 1i8l s TYR 105 Cb -0.20 -0.99 -0.02 0.00 -0.11 0.00 0.00 41.96 40.65 1i8l s TYR 105 CO 0.20 -0.02 -0.22 -1.17 -1.11 0.00 0.00 175.55 173.24 1i8l s LEU 106 N -0.47 2.05 -0.02 -1.29 2.96 -1.26 -0.29 118.68 120.36 1i8l s LEU 106 Ca 0.06 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.57 1i8l s LEU 106 Cb -0.07 -1.12 0.03 0.00 0.50 0.00 0.00 46.19 45.53 1i8l s LEU 106 CO -0.00 0.27 0.02 -0.83 -1.32 0.00 0.00 176.35 174.48 1i8l s GLY 107 N -0.54 0.12 -0.13 7.98 0.00 0.11 -2.88 107.32 111.98 1i8l s GLY 107 Ca 0.08 0.26 0.02 0.00 0.00 0.00 0.00 44.72 45.09 1i8l s GLY 107 CO -0.01 0.64 -0.21 -0.42 0.00 0.00 0.00 173.10 173.10 1i8l s ILE 108 N 1.00 2.15 0.85 0.90 -1.09 -1.26 0.11 121.20 123.86 1i8l s ILE 108 Ca -0.09 -0.96 -0.10 0.00 -2.23 0.00 0.00 60.65 57.27 1i8l s ILE 108 Cb -0.12 -1.86 0.15 0.00 -1.58 0.00 0.00 42.46 39.05 1i8l s ILE 108 CO -0.03 0.55 1.18 -0.83 -1.23 0.00 0.00 174.94 174.58 1i8l s GLY 109 N 0.70 1.75 0.00 6.18 0.00 -0.47 -4.45 107.32 111.03 1i8l s GLY 109 Ca -0.09 -1.28 0.29 0.00 0.00 0.00 0.00 44.72 43.64 1i8l s GLY 109 CO 0.01 -0.63 1.91 -2.01 0.00 0.00 0.00 173.10 172.38 1i8l n ASN 110 N -3.36 0.13 0.00 1.64 2.85 -1.26 -4.55 115.26 110.70 1i8l n ASN 110 Ca 0.14 0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.63 1i8l n ASN 110 Cb 0.60 -0.28 0.00 0.00 1.24 0.00 0.00 39.78 41.34 1i8l n ASN 110 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1i8l n GLY 111 N 1.39 -2.36 3.83 8.20 0.00 -1.26 -4.79 105.19 110.20 1i8l n GLY 111 Ca 0.11 -1.11 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 1i8l n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i8l s ALA 112 N -1.17 3.65 -0.26 4.61 0.00 -0.81 -4.76 121.76 123.01 1i8l s ALA 112 Ca 0.00 -0.14 -0.20 0.00 0.00 0.00 0.00 51.96 51.62 1i8l s ALA 112 Cb 0.00 -2.47 -0.02 0.00 0.00 0.00 0.00 23.12 20.63 1i8l s ALA 112 CO 0.00 0.46 0.61 -1.14 0.00 0.00 0.00 175.76 175.69 1i8l s GLN 113 N -1.34 4.07 -0.22 0.00 2.00 -0.01 -0.15 119.66 124.01 1i8l s GLN 113 Ca 0.29 0.47 -0.08 0.00 -2.00 0.00 0.00 55.36 54.04 1i8l s GLN 113 Cb -0.17 -3.66 -0.04 0.00 0.80 0.00 0.00 33.01 29.94 1i8l s GLN 113 CO 0.17 -0.42 0.09 0.42 -0.50 0.00 0.00 175.29 175.04 1i8l s ILE 114 N 2.48 4.76 -0.26 -2.34 1.01 -0.06 -0.32 121.20 126.48 1i8l s ILE 114 Ca 0.25 -0.03 -0.08 0.00 0.00 0.00 0.00 60.65 60.79 1i8l s ILE 114 Cb -0.15 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 1i8l s ILE 114 CO 0.09 0.39 0.10 -0.31 0.00 0.00 0.00 174.94 175.20 1i8l s TYR 115 N 0.97 3.11 -0.02 3.97 2.02 0.40 -2.09 117.35 125.71 1i8l s TYR 115 Ca 0.05 -0.34 0.04 0.00 -0.37 0.00 0.00 57.07 56.45 1i8l s TYR 115 Cb -0.14 -2.27 -0.01 0.00 -0.40 0.00 0.00 41.96 39.14 1i8l s TYR 115 CO 0.03 -0.33 -0.15 0.54 -1.57 0.00 0.00 175.55 174.07 1i8l s VAL 116 N 1.64 1.20 -0.08 0.71 0.11 -1.26 0.25 120.40 122.96 1i8l s VAL 116 Ca 0.06 -0.64 0.01 0.00 -2.93 0.00 0.00 61.98 58.49 1i8l s VAL 116 Cb -0.15 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.71 1i8l s VAL 116 CO 0.05 0.34 -0.09 -0.63 -3.33 0.00 0.00 175.10 171.44 1i8l s ILE 117 N -0.27 1.02 -0.37 7.04 1.01 -1.26 -4.11 121.20 124.25 1i8l s ILE 117 Ca 0.04 -0.35 -0.29 0.00 0.00 0.00 0.00 60.65 60.05 1i8l s ILE 117 Cb -0.07 -0.99 -0.00 0.00 0.01 0.00 0.00 42.46 41.41 1i8l s ILE 117 CO -0.00 0.35 1.61 -1.81 0.00 0.00 0.00 174.94 175.08 1i8l s ASP 118 N 1.16 6.12 0.49 3.58 1.01 -1.26 -4.72 116.67 123.04 1i8l s ASP 118 Ca -0.06 1.07 -0.18 0.00 0.71 0.00 0.00 52.55 54.10 1i8l s ASP 118 Cb -0.14 -2.53 -0.15 0.00 1.01 0.00 0.00 42.92 41.11 1i8l s ASP 118 CO -0.02 -1.57 -0.11 -2.65 0.21 0.00 0.00 175.17 171.03 1i8l n PRO 119 N 8.25 0.00 0.00 8.23 -0.02 -1.26 -5.00 135.00 145.20 1i8l n PRO 119 Ca 0.20 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1i8l n PRO 119 Cb 0.47 -0.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.98 1i8l n PRO 119 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63