#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmi s SER 2 N 0.00 -0.37 0.33 1.61 0.15 -1.26 -5.19 113.70 108.98 2dmi s SER 2 Ca 0.00 0.18 -0.14 0.00 0.70 0.00 0.00 55.95 56.69 2dmi s SER 2 Cb 0.00 0.35 0.03 0.00 -1.71 0.00 0.00 66.02 64.68 2dmi s SER 2 CO 0.00 -0.49 0.67 -0.55 1.20 0.00 0.00 173.24 174.06 2dmi s SER 3 N -1.89 0.10 0.00 5.45 0.15 -1.26 -5.19 113.70 111.07 2dmi s SER 3 Ca 0.02 -1.05 0.00 0.00 0.70 0.00 0.00 55.95 55.62 2dmi s SER 3 Cb -0.01 0.75 0.00 0.00 -1.71 0.00 0.00 66.02 65.05 2dmi s SER 3 CO -0.04 -1.45 0.00 0.61 1.20 0.00 0.00 173.24 173.56 2dmi n GLY 4 N -0.50 1.80 3.48 9.45 0.00 -1.26 -5.18 105.19 112.98 2dmi n GLY 4 Ca -0.05 -0.64 -0.14 0.00 0.00 0.00 0.00 46.02 45.20 2dmi n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmi s SER 5 N 2.00 -0.60 0.66 1.61 0.01 -1.26 -5.17 113.70 110.95 2dmi s SER 5 Ca 0.00 1.14 -0.09 0.00 1.31 0.00 0.00 55.95 58.31 2dmi s SER 5 Cb 0.00 1.16 0.02 0.00 0.21 0.00 0.00 66.02 67.40 2dmi s SER 5 CO 0.00 -0.22 1.01 -0.44 0.41 0.00 0.00 173.24 174.01 2dmi s SER 6 N 0.25 5.46 0.13 2.44 0.01 -1.26 -5.10 113.70 115.63 2dmi s SER 6 Ca -0.00 0.92 0.06 0.00 1.31 0.00 0.00 55.95 58.24 2dmi s SER 6 Cb -0.04 -1.79 -0.04 0.00 0.21 0.00 0.00 66.02 64.36 2dmi s SER 6 CO 0.01 -1.25 -0.14 -0.83 0.41 0.00 0.00 173.24 171.44 2dmi s GLY 7 N -4.35 1.11 -0.02 3.44 0.00 -1.26 -5.15 107.32 101.09 2dmi s GLY 7 Ca 0.56 -1.31 0.08 0.00 0.00 0.00 0.00 44.72 44.05 2dmi s GLY 7 CO 0.49 -1.37 -0.25 -1.59 0.00 0.00 0.00 173.10 170.38 2dmi s LYS 8 N -2.68 2.12 0.96 2.90 0.00 -1.26 -5.13 119.74 116.64 2dmi s LYS 8 Ca 0.10 -0.92 -0.13 0.00 0.00 0.00 0.00 55.97 55.01 2dmi s LYS 8 Cb -0.05 -2.06 0.17 0.00 0.00 0.00 0.00 37.83 35.88 2dmi s LYS 8 CO 0.03 0.56 1.13 -0.51 0.00 0.00 0.00 175.35 176.56 2dmi s LEU 9 N -0.66 1.82 -0.20 2.77 1.02 -1.26 -5.03 118.68 117.13 2dmi s LEU 9 Ca 0.10 0.97 -0.11 0.00 0.02 0.00 0.00 54.13 55.11 2dmi s LEU 9 Cb -0.10 -3.20 -0.05 0.00 0.02 0.00 0.00 46.19 42.86 2dmi s LEU 9 CO -0.01 -2.83 0.18 -0.72 0.02 0.00 0.00 176.35 172.99 2dmi s TYR 10 N -3.20 3.39 0.00 0.29 1.13 -1.26 -5.09 117.35 112.62 2dmi s TYR 10 Ca 0.65 0.36 0.00 0.00 -1.41 0.00 0.00 57.07 56.68 2dmi s TYR 10 Cb -0.15 -2.24 0.00 0.00 -1.10 0.00 0.00 41.96 38.47 2dmi s TYR 10 CO 0.55 0.21 0.00 0.41 -2.51 0.00 0.00 175.55 174.21 2dmi n GLY 11 N 3.70 3.95 3.50 5.49 0.00 -1.26 -5.16 105.19 115.42 2dmi n GLY 11 Ca -0.15 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.79 2dmi n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dmi s SER 12 N -0.44 -0.43 -0.04 1.61 1.04 -1.26 -5.17 113.70 109.01 2dmi s SER 12 Ca 0.00 0.64 -0.05 0.00 0.48 0.00 0.00 55.95 57.01 2dmi s SER 12 Cb 0.00 1.35 -0.04 0.00 0.10 0.00 0.00 66.02 67.43 2dmi s SER 12 CO 0.00 -0.09 0.20 0.27 0.98 0.00 0.00 173.24 174.59 2dmi s ILE 13 N 1.83 5.41 0.18 -1.02 -4.36 -1.26 -5.11 121.20 116.88 2dmi s ILE 13 Ca -0.05 0.06 0.07 0.00 -0.26 0.00 0.00 60.65 60.46 2dmi s ILE 13 Cb -0.04 -3.51 -0.04 0.00 1.25 0.00 0.00 42.46 40.12 2dmi s ILE 13 CO -0.15 0.43 0.06 -0.36 0.24 0.00 0.00 174.94 175.16 2dmi s PHE 14 N -1.22 2.96 -0.09 1.37 0.08 -1.26 -5.12 117.98 114.69 2dmi s PHE 14 Ca 0.24 -0.10 -0.01 0.00 0.12 0.00 0.00 56.93 57.17 2dmi s PHE 14 Cb -0.13 -1.41 0.03 0.00 -0.57 0.00 0.00 43.02 40.94 2dmi s PHE 14 CO 0.13 0.53 -0.02 0.95 -0.10 0.00 0.00 175.22 176.71 2dmi s THR 15 N -1.82 0.61 -0.11 0.64 -4.23 -1.26 -5.12 115.64 104.34 2dmi s THR 15 Ca 0.29 -0.06 -0.05 0.00 -1.18 0.00 0.00 61.69 60.69 2dmi s THR 15 Cb -0.09 -0.74 0.05 0.00 1.34 0.00 0.00 72.50 73.06 2dmi s THR 15 CO 0.21 0.26 0.25 -0.83 -0.54 0.00 0.00 174.62 173.97 2dmi s GLY 16 N 1.88 -0.13 0.37 3.99 0.00 -1.26 -5.14 107.32 107.03 2dmi s GLY 16 Ca 0.05 0.97 -0.28 0.00 0.00 0.00 0.00 44.72 45.46 2dmi s GLY 16 CO -0.06 1.55 1.45 0.00 0.00 0.00 0.00 173.10 176.04 2dmi n ALA 17 N 4.69 2.18 -4.05 3.20 0.00 -1.26 -5.00 120.51 120.26 2dmi n ALA 17 Ca -0.17 0.34 -0.31 0.00 0.00 0.00 0.00 53.44 53.29 2dmi n ALA 17 Cb 0.52 -2.39 -0.16 0.00 0.00 0.00 0.00 19.45 17.42 2dmi n ALA 17 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2dmi s SER 18 N -0.18 3.08 0.11 0.00 1.04 -1.26 -4.99 113.70 111.50 2dmi s SER 18 Ca 0.54 -0.67 -0.26 0.00 0.48 0.00 0.00 55.95 56.04 2dmi s SER 18 Cb -0.49 -1.32 -0.09 0.00 0.10 0.00 0.00 66.02 64.22 2dmi s SER 18 CO 0.63 -0.06 1.66 0.11 0.98 0.00 0.00 173.24 176.57 2dmi h LYS 19 N 7.98 -0.36 -6.27 4.02 6.56 -1.77 -3.43 116.57 123.31 2dmi h LYS 19 Ca -0.38 0.02 -0.65 0.00 -1.06 0.00 0.00 60.65 58.58 2dmi h LYS 19 Cb 1.12 0.08 -0.11 0.00 -0.57 0.00 0.00 32.23 32.75 2dmi h LYS 19 CO 0.56 -0.24 -0.64 -0.06 -2.06 0.00 0.00 179.45 177.01 2dmi s PHE 20 N -6.11 3.06 -0.09 -1.35 0.40 -0.26 -5.03 117.98 108.60 2dmi s PHE 20 Ca -0.15 0.02 -0.03 0.00 -0.60 0.00 0.00 56.93 56.17 2dmi s PHE 20 Cb 0.08 -1.58 0.04 0.00 0.51 0.00 0.00 43.02 42.07 2dmi s PHE 20 CO 0.66 0.49 0.10 1.03 0.70 0.00 0.00 175.22 178.20 2dmi s ARG 21 N -2.23 -0.00 0.09 0.44 0.52 -1.26 -2.00 118.95 114.51 2dmi s ARG 21 Ca 0.26 0.32 -0.31 0.00 -0.52 0.00 0.00 55.73 55.48 2dmi s ARG 21 Cb -0.12 -0.76 -0.09 0.00 0.52 0.00 0.00 34.95 34.50 2dmi s ARG 21 CO 0.18 -0.41 1.70 0.00 0.02 0.00 0.00 175.30 176.79 2dmi n LYS 23 N 5.52 1.75 0.05 0.00 4.81 -0.39 -4.03 118.16 125.88 2dmi n LYS 23 Ca 0.16 -0.98 0.00 0.00 -0.87 0.00 0.00 58.31 56.63 2dmi n LYS 23 Cb 0.40 -1.53 0.00 0.00 0.02 0.00 0.00 35.03 33.92 2dmi n LYS 23 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2dmi n ASP 24 N 0.07 0.48 -4.95 3.14 9.92 -1.25 -4.85 116.55 119.11 2dmi n ASP 24 Ca 0.15 0.17 -0.23 0.00 -0.53 0.00 0.00 54.79 54.34 2dmi n ASP 24 Cb 0.74 -0.07 0.01 0.00 -0.64 0.00 0.00 41.12 41.16 2dmi n ASP 24 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dmi n SER 26 N -1.90 6.69 -4.36 0.00 2.88 -1.26 -4.68 113.62 110.99 2dmi n SER 26 Ca 0.05 -3.21 -0.28 0.00 -1.33 0.00 0.00 58.87 54.10 2dmi n SER 26 Cb 0.63 -1.07 -0.13 0.00 -0.75 0.00 0.00 64.21 62.89 2dmi n SER 26 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dmi s ALA 27 N -2.16 2.20 -0.00 -1.46 0.00 -1.26 -5.10 121.76 113.98 2dmi s ALA 27 Ca 0.40 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.97 2dmi s ALA 27 Cb 0.31 -0.34 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 2dmi s ALA 27 CO -0.04 0.49 -0.01 0.00 0.00 0.00 0.00 175.76 176.20 2dmi s ALA 28 N -1.08 0.10 0.39 0.00 0.00 -1.26 -2.52 121.76 117.40 2dmi s ALA 28 Ca 0.12 -0.05 0.08 0.00 0.00 0.00 0.00 51.96 52.11 2dmi s ALA 28 Cb -0.10 -0.03 -0.06 0.00 0.00 0.00 0.00 23.12 22.93 2dmi s ALA 28 CO 0.05 0.02 0.06 0.71 0.00 0.00 0.00 175.76 176.61 2dmi s TYR 29 N -0.01 2.55 -0.21 0.00 2.02 -0.85 -5.00 117.35 115.85 2dmi s TYR 29 Ca 0.00 -0.58 -0.08 0.00 -0.37 0.00 0.00 57.07 56.05 2dmi s TYR 29 Cb -0.01 -1.75 -0.19 0.00 -0.40 0.00 0.00 41.96 39.61 2dmi s TYR 29 CO -0.00 0.37 -0.01 -0.25 -1.57 0.00 0.00 175.55 174.10 2dmi n ASP 30 N -1.05 2.00 -4.92 2.29 8.00 -1.26 -1.10 116.55 120.51 2dmi n ASP 30 Ca -0.03 0.15 -0.25 0.00 0.71 0.00 0.00 54.79 55.37 2dmi n ASP 30 Cb 0.65 -0.72 -0.03 0.00 -0.02 0.00 0.00 41.12 41.00 2dmi n ASP 30 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2dmi s THR 31 N -2.50 5.14 0.06 -3.53 -4.23 -1.26 -4.26 115.64 105.06 2dmi s THR 31 Ca -0.31 -0.86 -0.15 0.00 -1.18 0.00 0.00 61.69 59.18 2dmi s THR 31 Cb 0.09 -3.69 -0.21 0.00 1.34 0.00 0.00 72.50 70.03 2dmi s THR 31 CO 0.63 -0.17 1.20 0.25 -0.54 0.00 0.00 174.62 175.99 2dmi h LEU 32 N 1.88 0.81 -0.89 4.79 5.85 -1.99 -3.02 115.31 122.73 2dmi h LEU 32 Ca -0.49 -0.70 0.13 0.00 0.84 0.00 0.00 57.88 57.65 2dmi h LEU 32 Cb 1.21 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 41.91 2dmi h LEU 32 CO 0.65 1.40 0.50 1.62 -0.34 0.00 0.00 178.44 182.27 2dmi h VAL 33 N 0.29 0.81 -0.17 1.05 3.04 -2.00 0.17 116.25 119.44 2dmi h VAL 33 Ca -0.09 -0.26 -0.12 0.00 -1.01 0.00 0.00 66.70 65.22 2dmi h VAL 33 Cb 1.48 -0.01 -0.01 0.00 -2.01 0.00 0.00 31.29 30.74 2dmi h VAL 33 CO 0.16 0.14 -0.43 -0.33 -1.01 0.00 0.00 177.57 176.10 2dmi h GLU 34 N 0.76 0.40 0.38 4.17 3.07 -1.99 -3.13 114.58 118.25 2dmi h GLU 34 Ca 0.46 -0.21 -0.02 0.00 -0.50 0.00 0.00 59.36 59.10 2dmi h GLU 34 Cb 0.56 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 2dmi h GLU 34 CO -0.31 0.76 -0.18 1.25 -1.40 0.00 0.00 179.01 179.12 2dmi h LEU 35 N 0.33 -0.44 -0.14 1.33 5.85 -0.91 -3.26 115.31 118.07 2dmi h LEU 35 Ca 0.03 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.77 2dmi h LEU 35 Cb 0.89 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 2dmi h LEU 35 CO 0.07 -0.10 -0.08 0.35 -0.34 0.00 0.00 178.44 178.35 2dmi n THR 36 N -4.57 -0.09 -0.25 1.05 -2.24 0.40 0.50 114.28 109.08 2dmi n THR 36 Ca -0.06 1.53 0.24 0.00 -2.27 0.00 0.00 64.05 63.49 2dmi n THR 36 Cb 0.20 -2.01 0.44 0.00 -2.10 0.00 0.00 70.33 66.85 2dmi n THR 36 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2dmi n VAL 37 N -3.26 -0.33 -0.03 2.28 3.14 -1.18 0.14 118.33 119.09 2dmi n VAL 37 Ca 0.00 1.59 -0.14 0.00 -2.96 0.00 0.00 64.34 62.83 2dmi n VAL 37 Cb 0.04 -2.56 -0.11 0.00 -1.06 0.00 0.00 33.84 30.15 2dmi n VAL 37 CO 0.00 0.00 0.00 -0.74 -6.46 0.00 0.00 176.83 169.63 2dmi h HIS 38 N 0.00 0.21 -0.55 1.45 -0.00 0.01 -1.36 115.15 114.92 2dmi h HIS 38 Ca 0.64 -0.10 0.05 0.00 -0.00 0.00 0.00 60.37 60.97 2dmi h HIS 38 Cb 1.67 -0.03 -0.05 0.00 -0.00 0.00 0.00 27.41 29.01 2dmi h HIS 38 CO -0.05 0.85 0.27 0.52 -0.00 0.00 0.00 177.93 179.52 2dmi h MET 39 N -0.49 0.50 0.09 5.26 2.86 0.39 0.15 114.93 123.68 2dmi h MET 39 Ca -0.02 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2dmi h MET 39 Cb 0.88 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.43 2dmi h MET 39 CO 0.03 0.33 -0.04 -0.91 1.06 0.00 0.00 176.91 177.38 2dmi h ASN 40 N 0.51 -0.10 0.37 1.22 2.35 -0.61 1.69 115.58 121.02 2dmi h ASN 40 Ca 0.25 -0.35 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 2dmi h ASN 40 Cb 0.18 0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 2dmi h ASN 40 CO -0.18 0.32 -0.39 -0.33 -1.65 0.00 0.00 177.43 175.19 2dmi h GLU 41 N -0.53 -0.74 -0.08 0.81 4.39 -1.03 -2.95 114.58 114.45 2dmi h GLU 41 Ca -0.01 0.05 -0.14 0.00 0.34 0.00 0.00 59.36 59.60 2dmi h GLU 41 Cb 0.45 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 2dmi h GLU 41 CO 0.02 -0.49 -0.57 1.79 -1.16 0.00 0.00 179.01 178.60 2dmi h THR 42 N -0.76 1.37 0.00 1.13 1.35 -0.82 -3.47 112.91 111.71 2dmi h THR 42 Ca -0.05 -1.90 0.00 0.00 -0.55 0.00 0.00 66.41 63.91 2dmi h THR 42 Cb 0.67 1.94 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 2dmi h THR 42 CO -0.06 0.56 0.00 0.61 -0.25 0.00 0.00 175.52 176.39 2dmi n GLY 43 N 0.19 1.65 3.57 5.82 0.00 0.50 -5.05 105.19 111.87 2dmi n GLY 43 Ca -0.02 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 2dmi n GLY 43 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dmi n HIS 44 N -1.44 -3.02 -3.79 1.61 8.25 0.32 -4.94 115.22 112.20 2dmi n HIS 44 Ca 0.00 -1.60 -0.13 0.00 -0.26 0.00 0.00 57.72 55.74 2dmi n HIS 44 Cb 0.03 -0.68 -0.12 0.00 1.12 0.00 0.00 29.99 30.34 2dmi n HIS 44 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2dmi s TYR 45 N -2.87 -0.25 0.82 4.41 2.02 -1.26 -4.49 117.35 115.73 2dmi s TYR 45 Ca 0.61 0.61 -0.11 0.00 -0.37 0.00 0.00 57.07 57.81 2dmi s TYR 45 Cb -0.03 0.08 0.08 0.00 -0.40 0.00 0.00 41.96 41.69 2dmi s TYR 45 CO 0.41 -0.13 1.09 -0.98 -1.57 0.00 0.00 175.55 174.37 2dmi s ARG 46 N 0.21 1.91 -0.09 -0.62 1.70 -1.26 -1.26 118.95 119.54 2dmi s ARG 46 Ca -0.01 0.95 -0.14 0.00 -0.47 0.00 0.00 55.73 56.07 2dmi s ARG 46 Cb -0.02 -1.87 -0.28 0.00 -0.57 0.00 0.00 34.95 32.20 2dmi s ARG 46 CO -0.00 -1.82 0.57 0.22 -1.08 0.00 0.00 175.30 173.18 2dmi h ASP 47 N -1.25 0.45 -0.57 -2.89 3.58 -1.88 -3.41 116.42 110.45 2dmi h ASP 47 Ca -0.46 -0.88 -0.81 0.00 0.42 0.00 0.00 57.03 55.29 2dmi h ASP 47 Cb 1.25 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 42.14 2dmi h ASP 47 CO 0.54 1.69 1.03 0.47 -2.88 0.00 0.00 179.24 180.09 2dmi n ASP 48 N -3.79 1.11 0.00 2.28 8.00 -1.26 -4.87 116.55 118.01 2dmi n ASP 48 Ca -0.26 0.91 0.00 0.00 0.71 0.00 0.00 54.79 56.16 2dmi n ASP 48 Cb 0.96 -0.92 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 2dmi n ASP 48 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2dmi n ASN 49 N 5.96 0.00 -3.72 -2.24 6.94 -1.26 -4.89 115.26 116.04 2dmi n ASN 49 Ca 0.42 0.62 -0.28 0.00 -0.02 0.00 0.00 54.58 55.32 2dmi n ASN 49 Cb -0.03 -0.25 0.02 0.00 -2.36 0.00 0.00 39.78 37.16 2dmi n ASN 49 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2dmi n HIS 50 N -1.25 -2.15 -3.55 -2.53 8.25 -1.26 -4.97 115.22 107.76 2dmi n HIS 50 Ca 0.00 0.78 -0.20 0.00 -0.26 0.00 0.00 57.72 58.03 2dmi n HIS 50 Cb 0.00 -3.78 -0.02 0.00 1.12 0.00 0.00 29.99 27.30 2dmi n HIS 50 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2dmi s GLU 51 N -6.42 2.71 0.76 -0.41 2.02 -1.26 -5.13 118.70 110.97 2dmi s GLU 51 Ca 0.58 -1.35 -0.09 0.00 0.02 0.00 0.00 54.97 54.13 2dmi s GLU 51 Cb -0.29 -2.52 0.08 0.00 0.10 0.00 0.00 34.13 31.50 2dmi s GLU 51 CO 0.72 -0.08 1.09 0.95 0.02 0.00 0.00 175.26 177.96 2dmi s THR 52 N -2.36 2.16 1.13 3.63 -4.23 -1.26 -5.07 115.64 109.64 2dmi s THR 52 Ca 0.46 -0.17 -0.15 0.00 -1.18 0.00 0.00 61.69 60.65 2dmi s THR 52 Cb -0.06 -2.99 0.26 0.00 1.34 0.00 0.00 72.50 71.05 2dmi s THR 52 CO 0.29 0.00 1.06 -1.81 -0.54 0.00 0.00 174.62 173.62 2dmi s ASP 53 N -4.57 1.41 -0.16 3.99 1.01 -1.26 -4.98 116.67 112.11 2dmi s ASP 53 Ca 0.62 1.12 0.16 0.00 0.71 0.00 0.00 52.55 55.16 2dmi s ASP 53 Cb -0.10 -1.71 0.33 0.00 1.01 0.00 0.00 42.92 42.45 2dmi s ASP 53 CO 0.47 -3.88 1.17 0.59 0.21 0.00 0.00 175.17 173.73 2dmi n ASN 54 N -4.66 2.14 -3.34 0.27 3.02 -1.26 -5.04 115.26 106.39 2dmi n ASN 54 Ca 0.06 -3.35 -0.19 0.00 -0.03 0.00 0.00 54.58 51.08 2dmi n ASN 54 Cb 0.57 -0.46 -0.05 0.00 -0.61 0.00 0.00 39.78 39.24 2dmi n ASN 54 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2dmi n ASN 55 N -1.33 1.87 -2.88 6.41 0.23 -1.26 -5.10 115.26 113.19 2dmi n ASN 55 Ca 0.17 -2.45 -0.28 0.00 -0.53 0.00 0.00 54.58 51.49 2dmi n ASN 55 Cb 0.66 0.50 -0.00 0.00 -2.08 0.00 0.00 39.78 38.85 2dmi n ASN 55 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2dmi n ASN 56 N -1.50 -1.91 -0.16 0.53 4.13 -1.26 -4.68 115.26 110.42 2dmi n ASN 56 Ca -0.08 0.55 0.00 0.00 1.68 0.00 0.00 54.58 56.73 2dmi n ASN 56 Cb 0.41 -0.59 0.00 0.00 -1.54 0.00 0.00 39.78 38.06 2dmi n ASN 56 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 2dmi n PRO 57 N 0.89 0.49 -4.12 3.52 -0.04 -1.26 -4.81 135.00 129.67 2dmi n PRO 57 Ca 0.08 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.24 2dmi n PRO 57 Cb 0.27 -1.08 -0.05 0.00 -0.04 0.00 0.00 33.50 32.60 2dmi n PRO 57 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2dmi n LYS 58 N -0.26 -2.50 -0.87 0.54 4.01 -1.26 -4.77 118.16 113.05 2dmi n LYS 58 Ca 0.00 0.30 -0.28 0.00 -0.51 0.00 0.00 58.31 57.82 2dmi n LYS 58 Cb 0.04 -4.35 -0.00 0.00 -0.51 0.00 0.00 35.03 30.21 2dmi n LYS 58 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 2dmi n ARG 59 N -4.44 0.00 -1.01 1.97 0.63 -1.26 -4.89 116.66 107.66 2dmi n ARG 59 Ca -0.24 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.40 2dmi n ARG 59 Cb 0.65 -0.68 0.22 0.00 0.45 0.00 0.00 32.46 33.11 2dmi n ARG 59 CO 0.00 0.00 0.00 1.67 -2.51 0.00 0.00 177.63 176.79 2dmi s TRP 60 N -1.17 1.13 1.02 -0.14 1.48 -1.26 -4.97 118.94 115.04 2dmi s TRP 60 Ca 0.40 0.75 -0.23 0.00 -1.06 0.00 0.00 56.10 55.97 2dmi s TRP 60 Cb -0.42 -3.30 -0.11 0.00 -1.16 0.00 0.00 33.47 28.48 2dmi s TRP 60 CO 0.43 -3.60 -0.96 -1.13 -4.06 0.00 0.00 176.95 167.63 2dmi n SER 61 N -4.63 -3.41 -4.59 -2.66 3.41 -1.26 -4.84 113.62 95.64 2dmi n SER 61 Ca 0.09 0.03 -0.35 0.00 -0.26 0.00 0.00 58.87 58.38 2dmi n SER 61 Cb 0.58 -0.69 0.09 0.00 -0.26 0.00 0.00 64.21 63.93 2dmi n SER 61 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2dmi n LYS 62 N 1.27 0.35 -0.18 4.33 4.76 -1.26 -5.00 118.16 122.42 2dmi n LYS 62 Ca -0.01 0.18 -0.05 0.00 -2.87 0.00 0.00 58.31 55.55 2dmi n LYS 62 Cb 0.68 -2.16 0.04 0.00 -1.84 0.00 0.00 35.03 31.75 2dmi n LYS 62 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2dmi n PRO 63 N -1.91 -1.38 -0.67 1.97 -0.04 -1.26 -4.87 135.00 126.83 2dmi n PRO 63 Ca 0.12 -0.31 -0.23 0.00 -0.04 0.00 0.00 63.50 63.05 2dmi n PRO 63 Cb 0.50 -0.29 -0.01 0.00 -0.04 0.00 0.00 33.50 33.66 2dmi n PRO 63 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2dmi n ARG 64 N -2.09 0.00 -0.75 0.54 1.74 -1.26 -4.80 116.66 110.04 2dmi n ARG 64 Ca 0.03 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.78 2dmi n ARG 64 Cb 0.10 -0.48 0.14 0.00 -1.02 0.00 0.00 32.46 31.20 2dmi n ARG 64 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 2dmi n LYS 65 N 0.48 -0.90 -2.07 5.56 -0.00 -1.26 -5.02 118.16 114.95 2dmi n LYS 65 Ca 0.09 -0.24 -0.10 0.00 -0.00 0.00 0.00 58.31 58.06 2dmi n LYS 65 Cb 0.12 -1.71 0.02 0.00 -0.00 0.00 0.00 35.03 33.47 2dmi n LYS 65 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2dmi n ARG 66 N -1.53 0.89 -1.03 -1.58 0.00 -1.26 -5.00 116.66 107.15 2dmi n ARG 66 Ca 0.03 -1.47 -0.40 0.00 -0.00 0.00 0.00 57.85 56.01 2dmi n ARG 66 Cb 0.59 -0.04 -0.05 0.00 -0.00 0.00 0.00 32.46 32.95 2dmi n ARG 66 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2dmi n SER 67 N -2.51 -0.01 -0.81 2.89 3.41 -1.26 -4.75 113.62 110.59 2dmi n SER 67 Ca 0.05 0.79 0.00 0.00 -0.26 0.00 0.00 58.87 59.46 2dmi n SER 67 Cb 0.28 -0.63 0.06 0.00 -0.26 0.00 0.00 64.21 63.65 2dmi n SER 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dmi n LEU 68 N 1.03 2.09 -0.39 1.04 -0.00 -1.26 -4.45 117.00 115.06 2dmi n LEU 68 Ca 0.14 -1.06 0.33 0.00 -0.00 0.00 0.00 56.01 55.43 2dmi n LEU 68 Cb 0.05 -0.53 0.56 0.00 -0.00 0.00 0.00 43.42 43.51 2dmi n LEU 68 CO 0.42 0.36 1.02 -0.11 -0.00 0.00 0.00 177.39 179.07 2dmi n LEU 69 N 0.12 0.18 -3.13 1.47 -0.00 -1.26 0.88 117.00 115.26 2dmi n LEU 69 Ca 0.05 1.17 -0.36 0.00 -0.00 0.00 0.00 56.01 56.87 2dmi n LEU 69 Cb 0.45 -0.57 0.01 0.00 -0.00 0.00 0.00 43.42 43.31 2dmi n LEU 69 CO 0.06 -1.27 1.05 -1.84 -0.00 0.00 0.00 177.39 175.39 2dmi n GLU 70 N -4.39 3.96 -1.36 1.96 0.28 -1.26 -5.02 120.64 114.80 2dmi n GLU 70 Ca 0.34 -4.35 -0.58 0.00 -0.16 0.00 0.00 57.16 52.41 2dmi n GLU 70 Cb 1.30 -2.34 -0.10 0.00 1.43 0.00 0.00 31.44 31.73 2dmi n GLU 70 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 2dmi n MET 71 N -0.30 0.35 -4.96 3.44 2.81 0.25 -4.92 117.12 113.80 2dmi n MET 71 Ca 0.45 0.10 -0.27 0.00 -1.81 0.00 0.00 57.70 56.17 2dmi n MET 71 Cb 0.33 -1.79 -0.15 0.00 -0.71 0.00 0.00 33.22 30.90 2dmi n MET 71 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 2dmi s GLU 72 N 5.70 1.61 0.00 0.03 -1.05 -1.26 -5.11 118.70 118.62 2dmi s GLU 72 Ca 1.15 -0.72 0.00 0.00 -0.15 0.00 0.00 54.97 55.25 2dmi s GLU 72 Cb -1.31 -1.56 0.00 0.00 -0.44 0.00 0.00 34.13 30.82 2dmi s GLU 72 CO 0.63 0.43 0.00 0.41 0.95 0.00 0.00 175.26 177.67 2dmi n GLY 73 N 2.56 4.66 3.32 -3.83 0.00 -1.26 -5.09 105.19 105.54 2dmi n GLY 73 Ca -0.15 -0.60 -0.46 0.00 0.00 0.00 0.00 46.02 44.81 2dmi n GLY 73 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dmi s LYS 74 N 3.81 3.00 1.02 1.61 2.20 -1.26 -5.06 119.74 125.06 2dmi s LYS 74 Ca 0.00 -1.65 -0.21 0.00 -0.36 0.00 0.00 55.97 53.74 2dmi s LYS 74 Cb 0.00 -4.29 -0.03 0.00 -1.51 0.00 0.00 37.83 31.99 2dmi s LYS 74 CO 0.00 -1.35 -0.69 0.39 -0.36 0.00 0.00 175.35 173.34 2dmi n GLU 75 N 5.39 -0.87 -0.03 4.03 -0.58 -1.26 -4.77 120.64 122.55 2dmi n GLU 75 Ca -0.13 -0.25 0.00 0.00 -0.42 0.00 0.00 57.16 56.36 2dmi n GLU 75 Cb 0.40 -1.32 0.02 0.00 -0.57 0.00 0.00 31.44 29.97 2dmi n GLU 75 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2dmi n ASP 76 N 0.97 0.74 -4.53 1.62 5.68 -1.26 -4.80 116.55 114.97 2dmi n ASP 76 Ca -0.00 -2.02 -0.14 0.00 -0.50 0.00 0.00 54.79 52.13 2dmi n ASP 76 Cb 0.63 -0.28 -0.10 0.00 -1.14 0.00 0.00 41.12 40.23 2dmi n ASP 76 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2dmi n ALA 77 N -0.17 0.40 -2.53 2.12 0.00 -1.26 -4.70 120.51 114.36 2dmi n ALA 77 Ca 0.01 -1.52 -0.24 0.00 0.00 0.00 0.00 53.44 51.70 2dmi n ALA 77 Cb 0.17 -3.06 0.00 0.00 0.00 0.00 0.00 19.45 16.56 2dmi n ALA 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dmi n GLN 78 N 8.04 3.01 -0.00 0.00 10.64 -1.26 -4.78 117.38 133.04 2dmi n GLN 78 Ca 0.46 -4.30 -0.17 0.00 -1.83 0.00 0.00 57.00 51.16 2dmi n GLN 78 Cb 0.41 -2.07 -0.14 0.00 -0.86 0.00 0.00 30.24 27.57 2dmi n GLN 78 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.06 176.80 2dmi h LYS 79 N 2.67 0.17 -6.49 2.61 2.10 -2.02 -3.47 116.57 112.14 2dmi h LYS 79 Ca 0.22 -0.29 -0.66 0.00 -2.00 0.00 0.00 60.65 57.92 2dmi h LYS 79 Cb 0.95 0.11 -0.27 0.00 -0.90 0.00 0.00 32.23 32.11 2dmi h LYS 79 CO 0.79 0.95 -0.87 0.54 -2.00 0.00 0.00 179.45 178.86 2dmi s VAL 80 N -2.57 1.97 -0.49 0.07 0.11 -1.26 -5.08 120.40 113.14 2dmi s VAL 80 Ca -0.15 -1.23 -0.27 0.00 -2.93 0.00 0.00 61.98 57.39 2dmi s VAL 80 Cb 0.07 -1.67 -0.02 0.00 -1.53 0.00 0.00 36.38 33.23 2dmi s VAL 80 CO 0.79 0.39 1.80 -0.76 -3.33 0.00 0.00 175.10 173.99 2dmi s LEU 81 N -1.00 3.40 0.11 2.54 1.43 -1.26 -4.97 118.68 118.92 2dmi s LEU 81 Ca 0.10 0.74 0.08 0.00 -1.03 0.00 0.00 54.13 54.03 2dmi s LEU 81 Cb -0.10 -2.99 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 2dmi s LEU 81 CO 0.01 -2.04 -0.21 -0.75 0.23 0.00 0.00 176.35 173.58 2dmi s LYS 82 N 6.33 1.15 -0.49 1.70 2.47 -1.26 -2.44 119.74 127.21 2dmi s LYS 82 Ca 0.71 -1.19 -0.15 0.00 -1.56 0.00 0.00 55.97 53.79 2dmi s LYS 82 Cb -0.16 -1.43 0.09 0.00 -1.46 0.00 0.00 37.83 34.87 2dmi s LYS 82 CO 0.27 0.33 0.41 0.00 0.16 0.00 0.00 175.35 176.52 2dmi h MET 84 N 8.75 0.16 -0.15 0.00 4.05 -1.96 2.01 114.93 127.80 2dmi h MET 84 Ca -0.28 -0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.14 2dmi h MET 84 Cb 1.10 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.85 2dmi h MET 84 CO 0.92 0.11 -0.09 0.98 0.23 0.00 0.00 176.91 179.06 2dmi n TYR 85 N -5.13 -0.07 -0.13 1.39 4.19 -1.26 -3.70 117.16 112.45 2dmi n TYR 85 Ca 0.02 0.18 -0.27 0.00 3.31 0.00 0.00 57.90 61.15 2dmi n TYR 85 Cb 0.19 -0.40 -0.09 0.00 0.49 0.00 0.00 39.34 39.53 2dmi n TYR 85 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2dmi n GLY 87 N 1.44 0.74 3.16 0.00 0.00 0.68 -5.05 105.19 106.16 2dmi n GLY 87 Ca -0.51 -0.67 -0.17 0.00 0.00 0.00 0.00 46.02 44.67 2dmi n GLY 87 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dmi s HIS 88 N -0.54 1.13 0.16 1.61 3.76 -1.21 -4.88 115.29 115.32 2dmi s HIS 88 Ca 0.00 -0.47 0.03 0.00 -0.15 0.00 0.00 55.06 54.47 2dmi s HIS 88 Cb 0.00 -0.64 -0.04 0.00 1.11 0.00 0.00 32.58 33.01 2dmi s HIS 88 CO 0.00 0.04 0.27 -1.54 -0.85 0.00 0.00 174.74 172.66 2dmi s SER 89 N -1.74 6.21 0.27 1.40 1.04 -1.26 -1.67 113.70 117.95 2dmi s SER 89 Ca -0.03 0.11 -0.09 0.00 0.48 0.00 0.00 55.95 56.42 2dmi s SER 89 Cb -0.10 -1.83 -0.00 0.00 0.10 0.00 0.00 66.02 64.18 2dmi s SER 89 CO 0.02 0.04 0.46 -0.36 0.98 0.00 0.00 173.24 174.38 2dmi s PHE 90 N -1.77 0.59 -0.18 5.02 0.40 -1.02 -5.02 117.98 115.99 2dmi s PHE 90 Ca 0.34 -0.92 -0.15 0.00 -0.60 0.00 0.00 56.93 55.60 2dmi s PHE 90 Cb -0.11 0.08 -0.07 0.00 0.51 0.00 0.00 43.02 43.44 2dmi s PHE 90 CO 0.28 -1.01 -0.27 0.39 0.70 0.00 0.00 175.22 175.31 2dmi n GLU 91 N -0.42 0.52 -3.91 0.44 1.02 -1.26 -4.48 120.64 112.55 2dmi n GLU 91 Ca -0.01 0.33 -0.24 0.00 -0.02 0.00 0.00 57.16 57.22 2dmi n GLU 91 Cb 0.62 -1.53 -0.05 0.00 -0.02 0.00 0.00 31.44 30.46 2dmi n GLU 91 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2dmi s SER 92 N -6.14 4.67 0.02 1.62 0.01 -1.26 -4.89 113.70 107.73 2dmi s SER 92 Ca -0.26 -1.00 -0.25 0.00 1.31 0.00 0.00 55.95 55.74 2dmi s SER 92 Cb 0.05 -0.34 -0.17 0.00 0.21 0.00 0.00 66.02 65.77 2dmi s SER 92 CO 0.39 -0.68 1.34 -0.07 0.41 0.00 0.00 173.24 174.63 2dmi h LEU 93 N 1.17 -0.25 -0.85 2.44 3.38 -2.00 -3.17 115.31 116.04 2dmi h LEU 93 Ca -0.41 -0.20 0.16 0.00 0.09 0.00 0.00 57.88 57.52 2dmi h LEU 93 Cb 1.27 0.06 -0.15 0.00 0.09 0.00 0.00 40.66 41.93 2dmi h LEU 93 CO 0.64 0.07 -0.25 1.67 0.09 0.00 0.00 178.44 180.66 2dmi n GLN 94 N -5.09 -0.11 -0.32 1.13 -0.06 -1.26 0.20 117.38 111.86 2dmi n GLN 94 Ca -0.09 1.32 0.01 0.00 -2.00 0.00 0.00 57.00 56.24 2dmi n GLN 94 Cb 0.23 -1.96 0.15 0.00 -4.06 0.00 0.00 30.24 24.60 2dmi n GLN 94 CO 0.00 0.00 0.00 -0.44 -0.20 0.00 0.00 177.06 176.42 2dmi h ASP 95 N 0.00 0.86 0.28 1.69 3.32 -1.98 -0.00 116.42 120.59 2dmi h ASP 95 Ca 0.37 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.43 2dmi h ASP 95 Cb 0.58 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2dmi h ASP 95 CO -0.86 0.54 -0.13 0.25 -1.72 0.00 0.00 179.24 177.31 2dmi h LEU 96 N 0.99 -0.31 -0.26 1.55 7.12 0.22 -2.32 115.31 122.30 2dmi h LEU 96 Ca 0.39 -0.21 0.06 0.00 0.13 0.00 0.00 57.88 58.25 2dmi h LEU 96 Cb 0.20 0.08 -0.07 0.00 -0.53 0.00 0.00 40.66 40.34 2dmi h LEU 96 CO -0.18 0.09 -0.20 0.28 -0.13 0.00 0.00 178.44 178.30 2dmi h SER 97 N -0.78 -0.65 0.29 1.25 0.02 -0.44 -1.18 113.55 112.06 2dmi h SER 97 Ca -0.04 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2dmi h SER 97 Cb 0.51 0.32 -0.04 0.00 0.14 0.00 0.00 62.40 63.33 2dmi h SER 97 CO 0.06 -0.24 -0.48 0.58 -1.14 0.00 0.00 176.83 175.62 2dmi h VAL 98 N -0.19 0.07 -0.59 2.27 2.07 -1.06 -0.43 116.25 118.39 2dmi h VAL 98 Ca 0.14 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.78 2dmi h VAL 98 Cb 0.41 0.07 -0.12 0.00 -1.52 0.00 0.00 31.29 30.13 2dmi h VAL 98 CO -0.38 0.00 -0.24 -0.74 0.02 0.00 0.00 177.57 176.23 2dmi h HIS 99 N -0.82 -0.62 0.00 1.57 -0.00 -1.09 0.38 115.15 114.57 2dmi h HIS 99 Ca -0.02 0.06 0.00 0.00 -0.00 0.00 0.00 60.37 60.41 2dmi h HIS 99 Cb 0.78 0.36 0.00 0.00 -0.00 0.00 0.00 27.41 28.55 2dmi h HIS 99 CO -0.33 -0.33 0.00 -1.33 -0.00 0.00 0.00 177.93 175.94 2dmi n MET 100 N -5.44 0.00 -0.38 5.26 2.00 -0.47 0.04 117.12 118.13 2dmi n MET 100 Ca 0.06 0.50 0.30 0.00 0.00 0.00 0.00 57.70 58.56 2dmi n MET 100 Cb 0.34 -1.42 0.57 0.00 0.00 0.00 0.00 33.22 32.71 2dmi n MET 100 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 2dmi h ILE 101 N 0.00 0.24 -0.19 2.02 2.04 -0.88 1.74 117.51 122.49 2dmi h ILE 101 Ca 0.00 -0.07 -0.14 0.00 1.00 0.00 0.00 64.86 65.65 2dmi h ILE 101 Cb 0.00 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.08 2dmi h ILE 101 CO 0.00 0.04 -0.48 0.11 0.00 0.00 0.00 178.15 177.82 2dmi h LYS 102 N 0.21 0.49 -0.47 2.37 1.57 0.06 -3.02 116.57 117.77 2dmi h LYS 102 Ca 0.75 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 2dmi h LYS 102 Cb 2.07 0.02 0.00 0.00 0.08 0.00 0.00 32.23 34.40 2dmi h LYS 102 CO -0.48 0.86 0.00 0.25 -0.57 0.00 0.00 179.45 179.51 2dmi n THR 103 N -3.99 1.92 -4.38 -0.16 -2.24 0.38 -4.95 114.28 100.87 2dmi n THR 103 Ca -0.02 -1.39 -0.38 0.00 -2.27 0.00 0.00 64.05 59.99 2dmi n THR 103 Cb 0.55 0.04 -0.07 0.00 -2.10 0.00 0.00 70.33 68.76 2dmi n THR 103 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2dmi n LYS 104 N 0.47 -1.55 0.02 -0.78 5.02 0.50 -4.81 118.16 117.03 2dmi n LYS 104 Ca 0.22 0.21 -0.09 0.00 -2.02 0.00 0.00 58.31 56.63 2dmi n LYS 104 Cb 0.84 -4.57 -0.13 0.00 -0.02 0.00 0.00 35.03 31.15 2dmi n LYS 104 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2dmi h HIS 105 N -1.28 0.03 0.00 2.13 3.86 -1.70 -3.33 115.15 114.87 2dmi h HIS 105 Ca -0.61 -0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 58.45 2dmi h HIS 105 Cb 1.39 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.84 2dmi h HIS 105 CO 0.64 1.03 -0.76 0.10 0.86 0.00 0.00 177.93 179.80 2dmi h TYR 106 N 0.01 0.00 -0.38 2.45 -0.00 -1.87 -3.33 116.97 113.84 2dmi h TYR 106 Ca -0.18 0.00 -0.03 0.00 -0.00 0.00 0.00 58.73 58.52 2dmi h TYR 106 Cb 1.92 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 38.64 2dmi h TYR 106 CO 0.00 0.51 0.10 0.37 -0.00 0.00 0.00 178.16 179.15 2dmi h GLN 107 N 0.00 0.60 -1.03 0.10 4.15 -1.91 -2.81 115.11 114.22 2dmi h GLN 107 Ca -0.05 -0.14 0.27 0.00 0.77 0.00 0.00 58.65 59.51 2dmi h GLN 107 Cb 1.43 -0.08 -0.12 0.00 0.21 0.00 0.00 27.48 28.92 2dmi h GLN 107 CO 0.06 0.63 0.62 0.87 -1.93 0.00 0.00 178.83 179.08 2dmi h LYS 108 N 0.47 0.46 -7.00 1.69 1.57 -1.67 -3.40 116.57 108.69 2dmi h LYS 108 Ca 0.12 -0.03 -0.47 0.00 -1.87 0.00 0.00 60.65 58.40 2dmi h LYS 108 Cb 0.29 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.50 2dmi h LYS 108 CO -0.00 0.30 0.39 0.08 -0.57 0.00 0.00 179.45 179.65 2dmi s VAL 109 N -5.67 3.89 0.39 0.50 1.01 -1.06 -5.04 120.40 114.42 2dmi s VAL 109 Ca -0.10 1.34 -0.16 0.00 0.00 0.00 0.00 61.98 63.06 2dmi s VAL 109 Cb 0.27 -3.64 -0.09 0.00 0.00 0.00 0.00 36.38 32.92 2dmi s VAL 109 CO 0.80 -0.09 0.83 -0.55 0.00 0.00 0.00 175.10 176.08 2dmi s SER 110 N -1.77 6.77 0.00 3.32 0.15 -1.26 -4.92 113.70 115.98 2dmi s SER 110 Ca 0.60 1.41 0.00 0.00 0.70 0.00 0.00 55.95 58.66 2dmi s SER 110 Cb -0.18 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 2dmi s SER 110 CO 0.23 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.96 2dmi n GLY 111 N -0.71 1.60 0.08 9.45 0.00 -1.26 -5.03 105.19 109.32 2dmi n GLY 111 Ca 0.05 -0.94 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 2dmi n GLY 111 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmi h PRO 112 N 0.00 -0.07 -6.08 1.61 0.13 -1.99 -3.46 132.00 122.14 2dmi h PRO 112 Ca 0.00 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.73 2dmi h PRO 112 Cb 0.00 0.02 -0.19 0.00 0.13 0.00 0.00 31.00 30.96 2dmi h PRO 112 CO 0.00 0.39 -0.61 -1.13 -0.23 0.00 0.00 178.00 176.42 2dmi n SER 113 N -4.89 -0.19 0.08 1.44 3.41 -1.26 -4.62 113.62 107.59 2dmi n SER 113 Ca -0.08 -0.82 0.00 0.00 -0.26 0.00 0.00 58.87 57.70 2dmi n SER 113 Cb 0.25 -1.04 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 2dmi n SER 113 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2dmi n SER 114 N -1.57 0.13 0.00 4.04 3.41 -1.26 -5.32 113.62 113.06 2dmi n SER 114 Ca -0.08 0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2dmi n SER 114 Cb 0.38 0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2dmi n SER 114 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49