#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d8i n SER 2 N 0.00 -4.01 -4.36 1.61 2.88 -1.26 -5.03 113.62 103.45 2d8i n SER 2 Ca 0.00 -0.39 -0.20 0.00 -1.33 0.00 0.00 58.87 56.94 2d8i n SER 2 Cb 0.00 -3.68 -0.10 0.00 -0.75 0.00 0.00 64.21 59.68 2d8i n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2d8i s SER 3 N -3.47 2.77 0.00 -3.46 0.15 -1.26 -4.92 113.70 103.50 2d8i s SER 3 Ca 0.27 -0.98 0.00 0.00 0.70 0.00 0.00 55.95 55.94 2d8i s SER 3 Cb -0.12 -0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 2d8i s SER 3 CO 0.51 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.46 2d8i n GLY 4 N -0.25 2.13 3.75 9.45 0.00 -1.26 -4.91 105.19 114.10 2d8i n GLY 4 Ca -0.09 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 2d8i n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d8i s SER 5 N -4.00 7.02 0.30 1.61 1.04 -1.26 -5.04 113.70 113.37 2d8i s SER 5 Ca 0.00 2.39 0.03 0.00 0.48 0.00 0.00 55.95 58.85 2d8i s SER 5 Cb 0.00 -2.62 -0.06 0.00 0.10 0.00 0.00 66.02 63.44 2d8i s SER 5 CO 0.00 -0.38 0.08 -0.44 0.98 0.00 0.00 173.24 173.47 2d8i s SER 6 N -0.24 1.87 0.00 7.02 0.01 -1.26 -5.02 113.70 116.08 2d8i s SER 6 Ca 0.50 -1.39 0.00 0.00 1.31 0.00 0.00 55.95 56.37 2d8i s SER 6 Cb -0.35 0.04 0.00 0.00 0.21 0.00 0.00 66.02 65.92 2d8i s SER 6 CO 0.42 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 174.01 2d8i n GLY 7 N -0.60 -0.54 3.53 3.44 0.00 -1.26 -5.13 105.19 104.63 2d8i n GLY 7 Ca -0.01 0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 2d8i n GLY 7 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2d8i n GLU 8 N 0.00 -0.69 -1.44 1.61 0.00 -1.26 -4.96 120.64 113.90 2d8i n GLU 8 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 57.16 56.96 2d8i n GLU 8 Cb 0.00 -2.12 0.10 0.00 0.00 0.00 0.00 31.44 29.43 2d8i n GLU 8 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 2d8i n ILE 9 N -4.11 1.93 -3.88 3.84 -5.35 -1.26 -5.05 119.36 105.49 2d8i n ILE 9 Ca 0.08 -3.26 -0.09 0.00 -0.27 0.00 0.00 62.75 59.22 2d8i n ILE 9 Cb 0.53 -0.22 -0.05 0.00 -1.74 0.00 0.00 39.64 38.17 2d8i n ILE 9 CO 0.00 0.00 0.00 -1.83 -1.76 0.00 0.00 176.55 172.96 2d8i s GLU 10 N -3.00 1.46 -0.19 6.28 4.04 -1.26 -5.07 118.70 120.96 2d8i s GLU 10 Ca 0.41 -1.06 0.02 0.00 0.04 0.00 0.00 54.97 54.37 2d8i s GLU 10 Cb 0.38 0.49 -0.22 0.00 0.02 0.00 0.00 34.13 34.81 2d8i s GLU 10 CO -0.04 -0.61 0.09 -0.89 -1.84 0.00 0.00 175.26 171.96 2d8i n ILE 11 N -0.35 1.59 -4.06 1.83 5.41 -1.26 -5.00 119.36 117.51 2d8i n ILE 11 Ca -0.06 -0.65 -0.09 0.00 1.00 0.00 0.00 62.75 62.95 2d8i n ILE 11 Cb 0.62 -1.39 -0.11 0.00 -0.71 0.00 0.00 39.64 38.06 2d8i n ILE 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2d8i n PRO 13 N 0.75 -0.97 -1.38 0.00 -0.04 -1.26 -4.81 135.00 127.29 2d8i n PRO 13 Ca -0.18 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 62.91 2d8i n PRO 13 Cb 0.58 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.10 2d8i n PRO 13 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2d8i n LYS 14 N -1.47 0.46 -5.09 0.54 4.01 -1.26 -4.61 118.16 110.74 2d8i n LYS 14 Ca 0.00 0.19 -0.32 0.00 -0.51 0.00 0.00 58.31 57.67 2d8i n LYS 14 Cb 0.00 -1.86 -0.15 0.00 -0.51 0.00 0.00 35.03 32.50 2d8i n LYS 14 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 2d8i s VAL 15 N -1.79 2.46 -0.38 -0.18 -7.23 0.68 -4.89 120.40 109.06 2d8i s VAL 15 Ca 0.69 -0.91 -0.26 0.00 -1.81 0.00 0.00 61.98 59.69 2d8i s VAL 15 Cb -0.39 -1.94 0.02 0.00 0.56 0.00 0.00 36.38 34.63 2d8i s VAL 15 CO 0.55 0.56 0.93 0.42 -0.31 0.00 0.00 175.10 177.25 2d8i s THR 16 N -0.12 4.56 -0.18 5.32 -4.23 -1.26 -0.36 115.64 119.38 2d8i s THR 16 Ca -0.04 1.14 -0.09 0.00 -1.18 0.00 0.00 61.69 61.53 2d8i s THR 16 Cb -0.14 -4.36 -0.05 0.00 1.34 0.00 0.00 72.50 69.30 2d8i s THR 16 CO 0.04 -0.59 0.12 0.00 -0.54 0.00 0.00 174.62 173.65 2d8i s GLN 17 N 3.54 3.95 -0.31 3.99 -2.07 0.23 -4.95 119.66 124.05 2d8i s GLN 17 Ca 0.38 -0.22 -0.28 0.00 -1.82 0.00 0.00 55.36 53.42 2d8i s GLN 17 Cb -0.12 -3.32 0.01 0.00 -1.09 0.00 0.00 33.01 28.50 2d8i s GLN 17 CO 0.20 0.42 1.04 -1.54 -1.32 0.00 0.00 175.29 174.09 2d8i s SER 18 N 0.00 6.93 -0.16 12.60 1.04 -1.26 -2.80 113.70 130.05 2d8i s SER 18 Ca 0.09 1.06 -0.14 0.00 0.48 0.00 0.00 55.95 57.44 2d8i s SER 18 Cb -0.11 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.43 2d8i s SER 18 CO -0.00 -0.83 0.29 -0.63 0.98 0.00 0.00 173.24 173.05 2d8i s ILE 19 N 3.53 5.31 -0.22 -1.02 -1.09 0.48 -5.00 121.20 123.18 2d8i s ILE 19 Ca 0.44 0.55 -0.02 0.00 -2.23 0.00 0.00 60.65 59.39 2d8i s ILE 19 Cb -0.13 -3.63 0.07 0.00 -1.58 0.00 0.00 42.46 37.19 2d8i s ILE 19 CO 0.14 0.39 0.02 -2.28 -1.23 0.00 0.00 174.94 171.98 2d8i s HIS 20 N 0.49 1.49 0.06 3.97 2.46 -1.26 -1.31 115.29 121.19 2d8i s HIS 20 Ca 0.16 -1.24 0.04 0.00 0.47 0.00 0.00 55.06 54.50 2d8i s HIS 20 Cb -0.13 -1.29 -0.04 0.00 -0.13 0.00 0.00 32.58 31.00 2d8i s HIS 20 CO 0.04 -0.70 -0.04 0.42 -2.47 0.00 0.00 174.74 171.99 2d8i s ILE 21 N 1.70 3.80 -0.18 0.89 1.01 -0.72 -5.01 121.20 122.68 2d8i s ILE 21 Ca -0.00 -0.93 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 2d8i s ILE 21 Cb -0.18 -2.74 0.09 0.00 0.01 0.00 0.00 42.46 39.64 2d8i s ILE 21 CO -0.10 0.23 0.30 -1.61 0.00 0.00 0.00 174.94 173.76 2d8i s GLU 22 N -1.93 0.23 0.71 2.79 2.02 -1.26 -1.93 118.70 119.33 2d8i s GLU 22 Ca 0.22 0.64 -0.03 0.00 0.02 0.00 0.00 54.97 55.81 2d8i s GLU 22 Cb -0.11 -0.31 0.10 0.00 0.10 0.00 0.00 34.13 33.91 2d8i s GLU 22 CO 0.13 -0.43 0.99 0.15 0.02 0.00 0.00 175.26 176.12 2d8i s LYS 23 N 2.46 1.85 -0.09 1.61 1.02 0.03 -5.01 119.74 121.60 2d8i s LYS 23 Ca 0.04 -0.79 -0.01 0.00 0.02 0.00 0.00 55.97 55.23 2d8i s LYS 23 Cb -0.13 -2.28 -0.01 0.00 -0.52 0.00 0.00 37.83 34.89 2d8i s LYS 23 CO -0.11 -1.36 0.05 0.77 -0.92 0.00 0.00 175.35 173.77 2d8i h SER 24 N -0.54 -0.04 -3.61 2.83 0.02 -1.87 -3.45 113.55 106.89 2d8i h SER 24 Ca -0.40 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 59.92 2d8i h SER 24 Cb 1.28 0.01 -0.39 0.00 0.14 0.00 0.00 62.40 63.44 2d8i h SER 24 CO 0.47 0.45 -0.76 -1.81 -1.14 0.00 0.00 176.83 174.03 2d8i s ASP 25 N -5.46 4.26 0.53 3.07 1.11 -1.26 -4.97 116.67 113.95 2d8i s ASP 25 Ca -0.01 -1.59 0.40 0.00 0.18 0.00 0.00 52.55 51.53 2d8i s ASP 25 Cb 0.00 -1.33 1.58 0.00 1.07 0.00 0.00 42.92 44.25 2d8i s ASP 25 CO 0.02 -0.30 1.69 0.00 1.18 0.00 0.00 175.17 177.76 2d8i h THR 26 N 6.64 0.23 0.01 -1.27 1.03 -1.87 1.02 112.91 118.70 2d8i h THR 26 Ca -0.13 -0.01 -0.25 0.00 -0.01 0.00 0.00 66.41 66.01 2d8i h THR 26 Cb 1.04 0.19 -0.03 0.00 -1.07 0.00 0.00 68.15 68.28 2d8i h THR 26 CO 0.46 0.01 -1.37 0.00 -0.01 0.00 0.00 175.52 174.61 2d8i n ALA 27 N -2.78 0.81 0.19 0.00 0.00 -1.26 -4.59 120.51 112.88 2d8i n ALA 27 Ca 0.34 -0.52 -0.08 0.00 0.00 0.00 0.00 53.44 53.18 2d8i n ALA 27 Cb 1.54 -0.55 -0.04 0.00 0.00 0.00 0.00 19.45 20.40 2d8i n ALA 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d8i h ALA 28 N -0.46 -0.71 -3.13 0.00 0.00 -1.45 -3.43 119.26 110.07 2d8i h ALA 28 Ca -0.37 -0.12 -0.61 0.00 0.00 0.00 0.00 54.91 53.81 2d8i h ALA 28 Cb 1.38 0.21 -0.13 0.00 0.00 0.00 0.00 17.79 19.24 2d8i h ALA 28 CO -0.19 -0.68 -0.47 -0.51 0.00 0.00 0.00 179.25 177.40 2d8i s ASP 29 N -3.94 6.18 0.05 0.00 1.11 0.33 -4.97 116.67 115.43 2d8i s ASP 29 Ca -0.08 0.20 0.03 0.00 0.18 0.00 0.00 52.55 52.88 2d8i s ASP 29 Cb 0.01 -2.11 -0.03 0.00 1.07 0.00 0.00 42.92 41.86 2d8i s ASP 29 CO 0.23 0.10 -0.09 0.28 1.18 0.00 0.00 175.17 176.87 2d8i s THR 30 N 0.81 0.68 0.55 -1.27 -1.32 -1.26 -3.86 115.64 109.97 2d8i s THR 30 Ca 0.09 -1.16 -0.07 0.00 -1.21 0.00 0.00 61.69 59.33 2d8i s THR 30 Cb -0.13 -0.75 0.12 0.00 -1.51 0.00 0.00 72.50 70.23 2d8i s THR 30 CO 0.02 -0.36 0.26 -1.22 -2.21 0.00 0.00 174.62 171.12 2d8i n TYR 31 N 1.37 -2.01 -1.86 9.09 4.01 -1.26 -4.99 117.16 121.51 2d8i n TYR 31 Ca -0.22 -0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.40 2d8i n TYR 31 Cb 0.55 -0.65 0.00 0.00 -0.31 0.00 0.00 39.34 38.93 2d8i n TYR 31 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2d8i n GLY 32 N -1.19 0.27 3.65 2.72 0.00 -1.26 -5.06 105.19 104.32 2d8i n GLY 32 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 2d8i n GLY 32 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2d8i s PHE 33 N 0.00 3.27 0.17 1.61 -0.71 -1.26 -3.78 117.98 117.28 2d8i s PHE 33 Ca 0.00 0.11 -0.00 0.00 -1.04 0.00 0.00 56.93 56.00 2d8i s PHE 33 Cb 0.00 -2.09 -0.04 0.00 -1.21 0.00 0.00 43.02 39.68 2d8i s PHE 33 CO 0.00 0.17 0.34 0.45 -1.34 0.00 0.00 175.22 174.85 2d8i s SER 34 N 0.36 6.38 -0.14 1.98 0.15 -1.15 -5.02 113.70 116.27 2d8i s SER 34 Ca 0.04 0.34 0.02 0.00 0.70 0.00 0.00 55.95 57.04 2d8i s SER 34 Cb -0.12 -1.98 0.00 0.00 -1.71 0.00 0.00 66.02 62.21 2d8i s SER 34 CO -0.00 0.01 -0.20 -0.76 1.20 0.00 0.00 173.24 173.49 2d8i s LEU 35 N -3.18 2.25 -0.20 3.45 1.43 -1.26 -2.22 118.68 118.96 2d8i s LEU 35 Ca 0.37 -0.54 -0.07 0.00 -1.03 0.00 0.00 54.13 52.86 2d8i s LEU 35 Cb -0.11 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.59 2d8i s LEU 35 CO 0.28 0.10 0.06 -0.55 0.23 0.00 0.00 176.35 176.47 2d8i s SER 36 N 0.73 5.47 0.07 2.29 0.15 0.48 -4.88 113.70 118.00 2d8i s SER 36 Ca -0.08 0.00 -0.22 0.00 0.70 0.00 0.00 55.95 56.35 2d8i s SER 36 Cb -0.16 -1.95 -0.06 0.00 -1.71 0.00 0.00 66.02 62.14 2d8i s SER 36 CO 0.01 0.13 0.67 -0.55 1.20 0.00 0.00 173.24 174.69 2d8i s SER 37 N 0.66 7.15 -0.20 5.45 0.15 -1.26 -1.54 113.70 124.11 2d8i s SER 37 Ca 0.03 1.37 -0.03 0.00 0.70 0.00 0.00 55.95 58.02 2d8i s SER 37 Cb -0.13 -2.42 0.06 0.00 -1.71 0.00 0.00 66.02 61.82 2d8i s SER 37 CO 0.02 0.15 0.04 -0.69 1.20 0.00 0.00 173.24 173.96 2d8i s VAL 38 N -0.62 0.49 -0.45 4.45 1.01 -0.23 -4.96 120.40 120.10 2d8i s VAL 38 Ca 0.33 -0.57 -0.21 0.00 0.00 0.00 0.00 61.98 61.54 2d8i s VAL 38 Cb -0.20 -1.03 0.03 0.00 0.00 0.00 0.00 36.38 35.18 2d8i s VAL 38 CO 0.21 -0.24 0.65 -0.70 0.00 0.00 0.00 175.10 175.01 2d8i s GLU 39 N 1.87 3.26 -0.40 2.72 2.12 -1.26 -1.94 118.70 125.08 2d8i s GLU 39 Ca -0.00 -0.42 -0.10 0.00 0.36 0.00 0.00 54.97 54.81 2d8i s GLU 39 Cb -0.17 -3.96 0.05 0.00 0.26 0.00 0.00 34.13 30.31 2d8i s GLU 39 CO -0.09 -1.04 0.23 -2.00 -0.54 0.00 0.00 175.26 171.83 2d8i s GLU 40 N 2.82 2.73 -1.84 4.30 -6.30 0.49 -4.48 118.70 116.41 2d8i s GLU 40 Ca 0.22 -1.26 0.00 0.00 -2.50 0.00 0.00 54.97 51.43 2d8i s GLU 40 Cb -0.14 -3.76 0.00 0.00 0.00 0.00 0.00 34.13 30.23 2d8i s GLU 40 CO 0.18 -0.82 0.00 -0.25 0.02 0.00 0.00 175.26 174.39 2d8i n ASP 41 N 4.96 -5.53 0.00 -1.70 8.00 -1.26 -0.83 116.55 120.19 2d8i n ASP 41 Ca -0.11 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.56 2d8i n ASP 41 Cb 0.44 -4.70 0.00 0.00 -0.02 0.00 0.00 41.12 36.84 2d8i n ASP 41 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d8i n GLY 42 N -0.78 2.57 3.59 0.44 0.00 -1.26 -5.04 105.19 104.71 2d8i n GLY 42 Ca -0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 2d8i n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d8i s ILE 43 N -2.62 4.28 0.26 -0.61 1.01 -0.01 -5.01 121.20 118.49 2d8i s ILE 43 Ca 0.00 1.13 -0.30 0.00 0.00 0.00 0.00 60.65 61.48 2d8i s ILE 43 Cb 0.00 -4.56 -0.09 0.00 0.01 0.00 0.00 42.46 37.82 2d8i s ILE 43 CO 0.00 -0.95 0.98 -0.60 0.00 0.00 0.00 174.94 174.38 2d8i s ARG 44 N 4.25 4.78 0.16 2.79 3.52 -1.26 -0.38 118.95 132.81 2d8i s ARG 44 Ca 0.45 1.56 -0.07 0.00 -0.13 0.00 0.00 55.73 57.54 2d8i s ARG 44 Cb -0.08 -3.22 -0.02 0.00 -1.56 0.00 0.00 34.95 30.08 2d8i s ARG 44 CO 0.30 0.42 0.25 1.03 -0.81 0.00 0.00 175.30 176.48 2d8i s ARG 45 N -1.32 1.14 0.01 5.12 1.81 -0.82 -4.60 118.95 120.29 2d8i s ARG 45 Ca 0.43 -1.25 0.03 0.00 -1.72 0.00 0.00 55.73 53.22 2d8i s ARG 45 Cb -0.27 0.35 -0.01 0.00 -0.45 0.00 0.00 34.95 34.57 2d8i s ARG 45 CO 0.34 -0.40 -0.10 -0.51 -0.68 0.00 0.00 175.30 173.95 2d8i s LEU 46 N -2.99 2.08 0.02 2.53 2.01 -1.26 -1.07 118.68 119.99 2d8i s LEU 46 Ca 0.20 -0.26 -0.02 0.00 0.01 0.00 0.00 54.13 54.05 2d8i s LEU 46 Cb 0.04 -0.44 -0.01 0.00 0.01 0.00 0.00 46.19 45.78 2d8i s LEU 46 CO 0.01 0.06 0.03 -0.31 1.01 0.00 0.00 176.35 177.14 2d8i s TYR 47 N -0.47 0.21 -0.45 0.29 1.51 -0.59 -2.29 117.35 115.56 2d8i s TYR 47 Ca 0.01 -0.45 -0.24 0.00 -1.01 0.00 0.00 57.07 55.38 2d8i s TYR 47 Cb -0.05 -0.16 0.03 0.00 -0.11 0.00 0.00 41.96 41.67 2d8i s TYR 47 CO 0.00 -0.24 0.85 0.08 -1.11 0.00 0.00 175.55 175.13 2d8i s VAL 48 N -1.68 4.57 0.01 0.71 1.01 -1.19 -0.39 120.40 123.44 2d8i s VAL 48 Ca -0.13 0.59 -0.26 0.00 0.00 0.00 0.00 61.98 62.18 2d8i s VAL 48 Cb -0.08 -4.37 -0.15 0.00 0.00 0.00 0.00 36.38 31.79 2d8i s VAL 48 CO -0.01 -0.77 1.09 -1.13 0.00 0.00 0.00 175.10 174.29 2d8i h ASN 49 N 9.01 -0.71 -5.01 3.32 -0.73 -1.81 -0.34 115.58 119.32 2d8i h ASN 49 Ca -0.24 -0.01 -0.14 0.00 1.87 0.00 0.00 56.30 57.78 2d8i h ASN 49 Cb 1.08 0.18 -0.20 0.00 0.27 0.00 0.00 38.32 39.66 2d8i h ASN 49 CO 0.99 -0.33 -0.46 -0.44 -0.37 0.00 0.00 177.43 176.82 2d8i s SER 50 N -4.60 0.03 -0.06 1.15 0.01 -1.26 -4.34 113.70 104.62 2d8i s SER 50 Ca -0.14 -0.24 0.03 0.00 1.31 0.00 0.00 55.95 56.91 2d8i s SER 50 Cb 0.02 0.23 0.01 0.00 0.21 0.00 0.00 66.02 66.48 2d8i s SER 50 CO 0.43 -0.42 -0.14 -0.69 0.41 0.00 0.00 173.24 172.83 2d8i s VAL 51 N -1.68 1.27 -0.26 3.43 1.01 -1.26 -2.93 120.40 119.97 2d8i s VAL 51 Ca -0.12 -0.57 -0.39 0.00 0.00 0.00 0.00 61.98 60.90 2d8i s VAL 51 Cb -0.06 -1.13 -0.15 0.00 0.00 0.00 0.00 36.38 35.04 2d8i s VAL 51 CO 0.00 0.38 1.82 2.29 0.00 0.00 0.00 175.10 179.59 2d8i n LYS 52 N 3.62 1.30 0.00 2.72 2.85 -1.25 -4.86 118.16 122.55 2d8i n LYS 52 Ca -0.21 0.47 0.00 0.00 -1.05 0.00 0.00 58.31 57.51 2d8i n LYS 52 Cb 0.52 -2.22 0.00 0.00 -0.65 0.00 0.00 35.03 32.68 2d8i n LYS 52 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2d8i n GLU 53 N 5.90 0.00 -1.90 -1.58 2.13 -1.26 -1.32 120.64 122.61 2d8i n GLU 53 Ca 0.28 0.55 -0.41 0.00 0.66 0.00 0.00 57.16 58.24 2d8i n GLU 53 Cb 0.16 -0.91 -0.00 0.00 0.27 0.00 0.00 31.44 30.96 2d8i n GLU 53 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2d8i n THR 54 N -1.88 4.24 -4.52 6.31 -2.24 -1.26 -4.76 114.28 110.17 2d8i n THR 54 Ca 0.00 -3.62 -0.27 0.00 -2.27 0.00 0.00 64.05 57.89 2d8i n THR 54 Cb 0.00 -2.43 -0.10 0.00 -2.10 0.00 0.00 70.33 65.70 2d8i n THR 54 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2d8i s GLY 55 N 1.72 2.45 0.17 3.38 0.00 -0.44 -5.04 107.32 109.56 2d8i s GLY 55 Ca 0.50 -2.25 0.01 0.00 0.00 0.00 0.00 44.72 42.98 2d8i s GLY 55 CO -0.05 -2.06 1.41 1.41 0.00 0.00 0.00 173.10 173.81 2d8i h LEU 56 N 1.72 0.36 -0.01 0.66 3.38 -1.91 -3.12 115.31 116.39 2d8i h LEU 56 Ca -0.44 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.27 2d8i h LEU 56 Cb 1.24 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 2d8i h LEU 56 CO 0.78 1.03 0.00 0.00 0.09 0.00 0.00 178.44 180.34 2d8i h ALA 57 N 0.96 0.01 0.25 1.53 0.00 -1.94 -3.03 119.26 117.04 2d8i h ALA 57 Ca -0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2d8i h ALA 57 Cb 1.40 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 2d8i h ALA 57 CO 0.13 -0.34 -0.38 1.03 0.00 0.00 0.00 179.25 179.69 2d8i h SER 58 N -0.28 -1.09 -0.94 0.00 0.87 -1.69 -1.65 113.55 108.76 2d8i h SER 58 Ca 0.00 0.10 0.10 0.00 -1.23 0.00 0.00 61.79 60.76 2d8i h SER 58 Cb 0.30 0.38 -0.12 0.00 -0.44 0.00 0.00 62.40 62.52 2d8i h SER 58 CO 0.00 -0.46 -0.50 0.29 -0.53 0.00 0.00 176.83 175.63 2d8i n LYS 59 N -4.66 -0.36 -0.06 2.24 5.02 -1.18 -1.00 118.16 118.16 2d8i n LYS 59 Ca -0.08 1.43 -0.12 0.00 -2.02 0.00 0.00 58.31 57.51 2d8i n LYS 59 Cb 0.32 -2.10 -0.08 0.00 -0.02 0.00 0.00 35.03 33.15 2d8i n LYS 59 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2d8i h LYS 60 N 0.00 -0.41 0.00 1.97 1.79 -1.38 -3.45 116.57 115.09 2d8i h LYS 60 Ca 0.20 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 2d8i h LYS 60 Cb 0.43 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.18 2d8i h LYS 60 CO -0.90 -0.28 0.00 0.41 -1.08 0.00 0.00 179.45 177.61 2d8i n GLY 61 N -1.35 0.04 3.41 3.86 0.00 -0.17 -5.14 105.19 105.85 2d8i n GLY 61 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 2d8i n GLY 61 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d8i n LEU 62 N 0.00 -0.33 -3.62 0.99 4.77 -0.68 -4.90 117.00 113.23 2d8i n LEU 62 Ca 0.00 0.70 -0.05 0.00 -0.03 0.00 0.00 56.01 56.63 2d8i n LEU 62 Cb 0.00 -1.10 -0.05 0.00 -2.33 0.00 0.00 43.42 39.94 2d8i n LEU 62 CO 0.00 -3.50 1.01 -0.75 -1.33 0.00 0.00 177.39 172.82 2d8i s LYS 63 N -1.89 0.26 -0.58 3.23 2.47 -1.26 -4.00 119.74 117.97 2d8i s LYS 63 Ca 0.65 0.12 -0.37 0.00 -1.56 0.00 0.00 55.97 54.81 2d8i s LYS 63 Cb -0.45 0.12 -0.17 0.00 -1.46 0.00 0.00 37.83 35.88 2d8i s LYS 63 CO 0.58 -0.07 2.31 0.00 0.16 0.00 0.00 175.35 178.32 2d8i n ALA 64 N 0.96 0.50 0.00 3.13 0.00 -1.26 -3.02 120.51 120.82 2d8i n ALA 64 Ca -0.06 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2d8i n ALA 64 Cb 0.58 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.71 2d8i n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d8i n GLY 65 N 6.91 0.95 3.67 0.00 0.00 -0.14 -5.00 105.19 111.59 2d8i n GLY 65 Ca 0.53 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.28 2d8i n GLY 65 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2d8i s ASP 66 N -0.91 4.11 -0.17 1.61 -4.77 -1.17 -4.96 116.67 110.40 2d8i s ASP 66 Ca 0.00 -1.26 -0.01 0.00 -3.30 0.00 0.00 52.55 47.98 2d8i s ASP 66 Cb 0.00 -0.40 0.05 0.00 -1.09 0.00 0.00 42.92 41.47 2d8i s ASP 66 CO 0.00 -0.50 -0.02 -0.70 0.70 0.00 0.00 175.17 174.64 2d8i s GLU 67 N -3.80 1.17 0.32 2.11 2.56 -1.26 -3.14 118.70 116.65 2d8i s GLU 67 Ca 0.37 -0.49 -0.27 0.00 0.00 0.00 0.00 54.97 54.58 2d8i s GLU 67 Cb 0.07 -2.01 -0.10 0.00 2.00 0.00 0.00 34.13 34.10 2d8i s GLU 67 CO 0.20 -0.50 0.98 0.42 -0.56 0.00 0.00 175.26 175.80 2d8i s ILE 68 N 1.70 4.01 -0.06 -3.70 -1.09 -0.97 -4.22 121.20 116.86 2d8i s ILE 68 Ca -0.00 1.74 0.03 0.00 -2.23 0.00 0.00 60.65 60.20 2d8i s ILE 68 Cb -0.16 -4.00 -0.06 0.00 -1.58 0.00 0.00 42.46 36.66 2d8i s ILE 68 CO -0.07 0.21 -0.01 0.18 -1.23 0.00 0.00 174.94 174.02 2d8i n LEU 69 N 0.70 1.08 -3.53 2.97 4.77 0.48 -4.59 117.00 118.87 2d8i n LEU 69 Ca 0.01 -0.01 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 2d8i n LEU 69 Cb 0.49 -0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.53 2d8i n LEU 69 CO 0.47 0.31 0.59 -1.61 -1.33 0.00 0.00 177.39 175.82 2d8i s GLU 70 N -2.14 0.88 -0.21 3.23 2.02 -1.25 -4.20 118.70 117.03 2d8i s GLU 70 Ca -0.05 0.09 -0.02 0.00 0.02 0.00 0.00 54.97 55.01 2d8i s GLU 70 Cb 0.02 0.41 0.06 0.00 0.10 0.00 0.00 34.13 34.72 2d8i s GLU 70 CO 0.20 -0.30 0.01 0.42 0.02 0.00 0.00 175.26 175.61 2d8i s ILE 71 N -1.62 0.87 -1.22 -1.63 1.01 -0.58 -1.86 121.20 116.17 2d8i s ILE 71 Ca -0.05 -0.80 -0.08 0.00 0.00 0.00 0.00 60.65 59.73 2d8i s ILE 71 Cb -0.00 -1.30 0.01 0.00 0.01 0.00 0.00 42.46 41.17 2d8i s ILE 71 CO 0.03 -0.18 1.07 0.59 0.00 0.00 0.00 174.94 176.44 2d8i n ASN 72 N 4.92 -5.88 -2.61 3.58 3.02 -0.70 -2.39 115.26 115.19 2d8i n ASN 72 Ca -0.10 -0.49 -0.16 0.00 -0.03 0.00 0.00 54.58 53.80 2d8i n ASN 72 Cb 0.46 -4.60 0.05 0.00 -0.61 0.00 0.00 39.78 35.09 2d8i n ASN 72 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2d8i n ASN 73 N -2.59 -4.99 -3.96 6.41 3.02 -1.26 -5.03 115.26 106.87 2d8i n ASN 73 Ca 0.00 -0.37 -0.13 0.00 -0.03 0.00 0.00 54.58 54.05 2d8i n ASN 73 Cb 0.56 -3.59 -0.13 0.00 -0.61 0.00 0.00 39.78 36.00 2d8i n ASN 73 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2d8i s ARG 74 N -5.89 0.32 0.00 3.52 1.81 -1.00 -5.12 118.95 112.58 2d8i s ARG 74 Ca 0.40 -0.31 -0.30 0.00 -1.72 0.00 0.00 55.73 53.80 2d8i s ARG 74 Cb -0.18 -0.22 -0.06 0.00 -0.45 0.00 0.00 34.95 34.05 2d8i s ARG 74 CO 0.50 0.05 1.46 0.00 -0.68 0.00 0.00 175.30 176.63 2d8i s ALA 75 N -0.52 3.61 0.19 2.13 0.00 -1.26 -1.53 121.76 124.38 2d8i s ALA 75 Ca -0.03 0.92 -0.13 0.00 0.00 0.00 0.00 51.96 52.72 2d8i s ALA 75 Cb -0.04 -3.63 0.20 0.00 0.00 0.00 0.00 23.12 19.65 2d8i s ALA 75 CO -0.00 -1.00 1.69 0.00 0.00 0.00 0.00 175.76 176.45 2d8i h ALA 76 N 8.08 0.51 0.00 0.00 0.00 -1.93 0.12 119.26 126.04 2d8i h ALA 76 Ca -0.38 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2d8i h ALA 76 Cb 1.18 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 2d8i h ALA 76 CO 0.91 -0.37 -0.09 0.38 0.00 0.00 0.00 179.25 180.09 2d8i h ASP 77 N 0.15 0.00 0.43 0.00 2.03 -1.91 -1.81 116.42 115.32 2d8i h ASP 77 Ca 0.26 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 56.41 2d8i h ASP 77 Cb 0.38 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.87 2d8i h ASP 77 CO -0.40 0.09 -0.65 0.00 -1.03 0.00 0.00 179.24 177.24 2d8i h ALA 78 N 1.91 0.80 -2.34 4.15 0.00 -1.19 -3.43 119.26 119.16 2d8i h ALA 78 Ca -0.00 -0.58 -0.55 0.00 0.00 0.00 0.00 54.91 53.78 2d8i h ALA 78 Cb 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2d8i h ALA 78 CO 0.01 0.77 0.67 -0.51 0.00 0.00 0.00 179.25 180.19 2d8i s LEU 79 N -7.80 4.29 0.26 0.00 1.43 -0.49 -5.03 118.68 111.35 2d8i s LEU 79 Ca -0.03 1.83 0.06 0.00 -1.03 0.00 0.00 54.13 54.95 2d8i s LEU 79 Cb 0.12 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.75 2d8i s LEU 79 CO 0.80 -0.55 0.32 0.54 0.23 0.00 0.00 176.35 177.69 2d8i s ASN 80 N 1.39 6.01 0.16 2.29 2.20 -1.26 -4.85 114.94 120.87 2d8i s ASN 80 Ca 0.56 -0.08 -0.17 0.00 -0.94 0.00 0.00 52.86 52.23 2d8i s ASN 80 Cb -0.25 -1.62 0.09 0.00 -2.00 0.00 0.00 41.25 37.47 2d8i s ASN 80 CO 0.23 -0.12 1.19 -1.54 -2.94 0.00 0.00 177.10 173.92 2d8i n SER 81 N -1.37 -0.62 -0.02 3.54 3.41 -1.26 -0.30 113.62 117.00 2d8i n SER 81 Ca -0.07 1.35 -0.02 0.00 -0.26 0.00 0.00 58.87 59.86 2d8i n SER 81 Cb 0.58 -0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 64.25 2d8i n SER 81 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2d8i h SER 82 N 0.00 -0.30 -0.51 4.04 0.87 -2.00 0.61 113.55 116.27 2d8i h SER 82 Ca 0.21 0.04 0.10 0.00 -1.23 0.00 0.00 61.79 60.91 2d8i h SER 82 Cb 0.40 0.12 -0.10 0.00 -0.44 0.00 0.00 62.40 62.39 2d8i h SER 82 CO -0.75 -0.07 -0.13 0.24 -0.53 0.00 0.00 176.83 175.60 2d8i h MET 83 N -0.07 -0.01 -0.81 2.24 2.86 -1.47 -0.37 114.93 117.30 2d8i h MET 83 Ca 0.01 0.00 0.19 0.00 -2.06 0.00 0.00 59.70 57.84 2d8i h MET 83 Cb 0.10 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 31.64 2d8i h MET 83 CO -0.09 -0.01 0.24 -0.07 1.06 0.00 0.00 176.91 178.04 2d8i h LEU 84 N -0.01 0.07 -1.10 1.22 3.38 0.07 0.35 115.31 119.29 2d8i h LEU 84 Ca 0.24 0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.40 2d8i h LEU 84 Cb 0.38 0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 2d8i h LEU 84 CO -0.53 -0.06 0.61 0.11 0.09 0.00 0.00 178.44 178.66 2d8i h LYS 85 N 0.28 1.16 -0.12 1.13 1.57 0.86 -1.22 116.57 120.24 2d8i h LYS 85 Ca 0.48 -0.07 -0.17 0.00 -1.87 0.00 0.00 60.65 59.02 2d8i h LYS 85 Cb 0.89 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2d8i h LYS 85 CO -0.56 0.77 -0.64 0.22 -0.57 0.00 0.00 179.45 178.68 2d8i h ASP 86 N 1.20 0.52 0.15 0.86 3.58 -0.11 -2.76 116.42 119.87 2d8i h ASP 86 Ca 0.36 -0.31 -0.08 0.00 0.42 0.00 0.00 57.03 57.42 2d8i h ASP 86 Cb -0.05 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.84 2d8i h ASP 86 CO -0.10 1.03 -0.29 -0.26 -2.88 0.00 0.00 179.24 176.74 2d8i h PHE 87 N 0.33 0.24 0.00 0.28 -1.00 -0.08 -2.40 116.94 114.32 2d8i h PHE 87 Ca -0.01 -0.05 -0.02 0.00 2.81 0.00 0.00 57.97 60.70 2d8i h PHE 87 Cb 1.19 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 40.69 2d8i h PHE 87 CO 0.04 0.49 -0.11 -0.07 -1.61 0.00 0.00 178.31 177.06 2d8i h LEU 88 N 0.20 0.00 -1.33 1.54 3.38 -1.16 -3.10 115.31 114.84 2d8i h LEU 88 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2d8i h LEU 88 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2d8i h LEU 88 CO 0.04 0.11 0.00 -0.24 0.09 0.00 0.00 178.44 178.44 2d8i n SER 89 N -3.14 1.82 -4.90 -0.43 2.88 -0.90 -4.81 113.62 104.14 2d8i n SER 89 Ca 0.03 -2.16 -0.33 0.00 -1.33 0.00 0.00 58.87 55.08 2d8i n SER 89 Cb 0.54 -0.39 -0.05 0.00 -0.75 0.00 0.00 64.21 63.57 2d8i n SER 89 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2d8i s GLN 90 N -1.58 3.44 0.43 -1.46 -1.52 -1.17 -4.90 119.66 112.91 2d8i s GLN 90 Ca 0.14 -0.31 0.22 0.00 -1.95 0.00 0.00 55.36 53.47 2d8i s GLN 90 Cb 0.10 -3.10 0.96 0.00 -0.22 0.00 0.00 33.01 30.74 2d8i s GLN 90 CO 0.06 0.68 1.86 -1.00 -0.25 0.00 0.00 175.29 176.64 2d8i h PRO 91 N 3.85 0.00 -3.66 2.91 0.13 -1.90 -3.42 132.00 129.91 2d8i h PRO 91 Ca -0.49 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.25 2d8i h PRO 91 Cb 1.19 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.95 2d8i h PRO 91 CO 0.69 0.26 -0.76 -1.54 -0.23 0.00 0.00 178.00 176.42 2d8i s SER 92 N -6.32 1.06 0.12 1.44 1.04 -1.26 -0.79 113.70 108.99 2d8i s SER 92 Ca -0.01 -0.04 0.08 0.00 0.48 0.00 0.00 55.95 56.47 2d8i s SER 92 Cb 0.11 -0.31 -0.04 0.00 0.10 0.00 0.00 66.02 65.89 2d8i s SER 92 CO 0.65 -0.16 -0.19 -0.76 0.98 0.00 0.00 173.24 173.75 2d8i s LEU 93 N 1.60 2.36 -0.28 2.42 1.43 -0.81 -5.01 118.68 120.39 2d8i s LEU 93 Ca -0.01 -0.76 0.01 0.00 -1.03 0.00 0.00 54.13 52.34 2d8i s LEU 93 Cb -0.13 -0.81 0.08 0.00 0.03 0.00 0.00 46.19 45.36 2d8i s LEU 93 CO -0.03 -0.00 0.02 -0.83 0.23 0.00 0.00 176.35 175.74 2d8i s GLY 94 N -2.22 1.35 0.24 -3.19 0.00 -1.26 -1.76 107.32 100.47 2d8i s GLY 94 Ca 0.10 -1.70 -0.00 0.00 0.00 0.00 0.00 44.72 43.11 2d8i s GLY 94 CO 0.05 1.17 0.43 1.08 0.00 0.00 0.00 173.10 175.83 2d8i s LEU 95 N 1.37 4.18 -0.34 0.66 1.43 -0.42 -1.73 118.68 123.83 2d8i s LEU 95 Ca 0.03 0.41 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2d8i s LEU 95 Cb -0.18 -3.20 0.10 0.00 0.03 0.00 0.00 46.19 42.94 2d8i s LEU 95 CO -0.13 -0.10 0.09 -0.22 0.23 0.00 0.00 176.35 176.22 2d8i s LEU 96 N -3.57 3.53 0.31 1.79 2.96 -0.78 -0.39 118.68 122.53 2d8i s LEU 96 Ca 0.39 -2.00 0.10 0.00 -0.22 0.00 0.00 54.13 52.40 2d8i s LEU 96 Cb -0.11 -1.26 -0.05 0.00 0.50 0.00 0.00 46.19 45.27 2d8i s LEU 96 CO 0.30 -0.38 -0.08 0.68 -1.32 0.00 0.00 176.35 175.55 2d8i s VAL 97 N 1.12 2.63 0.14 1.68 -7.23 -1.12 -0.39 120.40 117.23 2d8i s VAL 97 Ca 0.11 -2.15 0.11 0.00 -1.81 0.00 0.00 61.98 58.24 2d8i s VAL 97 Cb -0.19 -2.62 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 2d8i s VAL 97 CO -0.15 -0.29 -0.25 0.00 -0.31 0.00 0.00 175.10 174.11 2d8i s ARG 98 N -3.62 1.49 0.17 4.82 1.70 -1.26 0.76 118.95 123.00 2d8i s ARG 98 Ca 0.32 -1.35 -0.04 0.00 -0.47 0.00 0.00 55.73 54.19 2d8i s ARG 98 Cb -0.02 -1.93 -0.03 0.00 -0.57 0.00 0.00 34.95 32.40 2d8i s ARG 98 CO 0.17 0.45 0.17 -0.08 -1.08 0.00 0.00 175.30 174.93 2d8i s THR 99 N -1.18 0.05 0.04 4.99 -1.32 0.51 -4.86 115.64 113.88 2d8i s THR 99 Ca 0.16 -1.78 -0.30 0.00 -1.21 0.00 0.00 61.69 58.55 2d8i s THR 99 Cb -0.10 -2.17 -0.04 0.00 -1.51 0.00 0.00 72.50 68.69 2d8i s THR 99 CO 0.07 -0.23 1.03 -0.31 -2.21 0.00 0.00 174.62 172.97 2d8i s TYR 100 N -4.06 3.63 0.53 9.09 1.51 -1.26 -0.23 117.35 126.56 2d8i s TYR 100 Ca 0.27 1.62 -0.20 0.00 -1.01 0.00 0.00 57.07 57.76 2d8i s TYR 100 Cb 0.06 -3.18 -0.06 0.00 -0.11 0.00 0.00 41.96 38.66 2d8i s TYR 100 CO 0.05 -0.29 1.13 -1.25 -1.11 0.00 0.00 175.55 174.09 2d8i s PRO 101 N 0.81 3.41 0.23 -1.71 0.04 -1.26 -4.93 135.00 131.59 2d8i s PRO 101 Ca 0.53 1.63 0.10 0.00 0.04 0.00 0.00 61.00 63.29 2d8i s PRO 101 Cb -0.24 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 2d8i s PRO 101 CO 0.29 -0.81 -0.09 -1.21 0.04 0.00 0.00 177.00 175.22 2d8i s GLU 102 N -3.21 2.05 0.48 4.56 2.02 -1.26 -5.10 118.70 118.24 2d8i s GLU 102 Ca 0.72 -1.42 -0.23 0.00 0.02 0.00 0.00 54.97 54.05 2d8i s GLU 102 Cb -0.24 -2.07 -0.07 0.00 0.10 0.00 0.00 34.13 31.85 2d8i s GLU 102 CO 0.28 0.39 1.32 -0.51 0.02 0.00 0.00 175.26 176.76 2d8i s LEU 103 N -3.24 4.00 -1.70 1.80 1.43 -1.26 -2.78 118.68 116.93 2d8i s LEU 103 Ca 0.28 2.69 -0.14 0.00 -1.03 0.00 0.00 54.13 55.92 2d8i s LEU 103 Cb -0.07 -4.13 0.14 0.00 0.03 0.00 0.00 46.19 42.16 2d8i s LEU 103 CO 0.16 -1.23 0.36 -1.84 0.23 0.00 0.00 176.35 174.03 2d8i n GLU 104 N -0.54 -0.80 -4.45 1.70 0.00 -1.26 -4.90 120.64 110.38 2d8i n GLU 104 Ca 0.07 0.12 -0.26 0.00 0.00 0.00 0.00 57.16 57.09 2d8i n GLU 104 Cb 0.45 -4.14 -0.17 0.00 0.00 0.00 0.00 31.44 27.58 2d8i n GLU 104 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 2d8i s GLU 105 N -7.12 1.88 0.00 3.44 0.41 -1.12 -4.91 118.70 111.29 2d8i s GLU 105 Ca 0.50 -0.45 0.00 0.00 -0.41 0.00 0.00 54.97 54.61 2d8i s GLU 105 Cb -0.29 -1.62 0.00 0.00 -1.78 0.00 0.00 34.13 30.44 2d8i s GLU 105 CO 0.98 -0.05 0.00 0.41 -0.49 0.00 0.00 175.26 176.12 2d8i n GLY 106 N 4.12 -0.17 3.52 -1.39 0.00 -1.26 -4.72 105.19 105.28 2d8i n GLY 106 Ca -0.20 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2d8i n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d8i s VAL 107 N -2.00 3.41 -0.28 1.61 0.11 -1.26 -5.10 120.40 116.88 2d8i s VAL 107 Ca 0.00 -0.58 -0.03 0.00 -2.93 0.00 0.00 61.98 58.44 2d8i s VAL 107 Cb 0.00 -2.38 0.16 0.00 -1.53 0.00 0.00 36.38 32.63 2d8i s VAL 107 CO 0.00 0.58 0.56 -0.70 -3.33 0.00 0.00 175.10 172.21 2d8i s GLU 108 N -0.61 0.52 0.69 1.54 2.12 -1.26 -5.17 118.70 116.54 2d8i s GLU 108 Ca 0.09 1.00 0.01 0.00 0.36 0.00 0.00 54.97 56.43 2d8i s GLU 108 Cb -0.11 0.41 0.12 0.00 0.26 0.00 0.00 34.13 34.81 2d8i s GLU 108 CO 0.02 -0.54 0.96 -1.54 -0.54 0.00 0.00 175.26 173.61 2d8i s SER 109 N 2.80 4.48 -0.14 -1.70 1.04 -1.26 -4.89 113.70 114.03 2d8i s SER 109 Ca 0.14 -0.46 -0.01 0.00 0.48 0.00 0.00 55.95 56.10 2d8i s SER 109 Cb -0.14 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.03 2d8i s SER 109 CO -0.19 -1.77 0.03 0.61 0.98 0.00 0.00 173.24 172.90 2d8i n GLY 110 N -2.72 -3.18 3.77 7.32 0.00 -1.26 -5.01 105.19 104.11 2d8i n GLY 110 Ca 0.15 0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 2d8i n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d8i s PRO 111 N -0.81 2.93 -0.39 1.61 0.04 -1.26 -4.85 135.00 132.27 2d8i s PRO 111 Ca 0.01 1.44 -0.38 0.00 0.04 0.00 0.00 61.00 62.11 2d8i s PRO 111 Cb -0.00 -1.96 -0.16 0.00 0.04 0.00 0.00 34.50 32.41 2d8i s PRO 111 CO 0.33 -1.15 1.29 -1.13 0.04 0.00 0.00 177.00 176.38 2d8i n SER 112 N -2.15 0.96 -3.61 6.66 3.41 -1.26 -4.91 113.62 112.71 2d8i n SER 112 Ca 0.11 0.97 -0.25 0.00 -0.26 0.00 0.00 58.87 59.43 2d8i n SER 112 Cb 0.52 -0.72 0.18 0.00 -0.26 0.00 0.00 64.21 63.93 2d8i n SER 112 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2d8i n SER 113 N 3.20 -0.07 0.00 4.04 3.41 -1.26 -5.33 113.62 117.61 2d8i n SER 113 Ca 0.25 -1.39 0.13 0.00 -0.26 0.00 0.00 58.87 57.61 2d8i n SER 113 Cb -0.05 -0.87 0.80 0.00 -0.26 0.00 0.00 64.21 63.83 2d8i n SER 113 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49