#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 -0.47 -0.26 1.61 0.01 -1.26 -5.17 113.70 108.16 2dmi s SER 2 Ca 0.00 0.64 -0.19 0.00 1.31 0.00 0.00 55.95 57.71 2dmi s SER 2 Cb 0.00 0.56 0.07 0.00 0.21 0.00 0.00 66.02 66.87 2dmi s SER 2 CO 0.00 -0.34 0.67 -0.44 0.41 0.00 0.00 173.24 173.55 2dmi s SER 3 N -0.69 -0.81 0.00 2.44 0.01 -1.26 -5.15 113.70 108.24 2dmi s SER 3 Ca -0.02 1.42 0.00 0.00 1.31 0.00 0.00 55.95 58.66 2dmi s SER 3 Cb -0.02 1.36 0.00 0.00 0.21 0.00 0.00 66.02 67.57 2dmi s SER 3 CO 0.01 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.03 2dmi n GLY 4 N 3.54 2.57 3.18 3.44 0.00 -1.26 -5.18 105.19 111.48 2dmi n GLY 4 Ca -0.17 0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 1.39 0.13 1.61 0.01 -1.26 -5.17 113.70 110.42 2dmi s SER 5 Ca 0.00 -0.87 0.09 0.00 1.31 0.00 0.00 55.95 56.47 2dmi s SER 5 Cb 0.00 0.03 -0.04 0.00 0.21 0.00 0.00 66.02 66.22 2dmi s SER 5 CO 0.00 -0.32 -0.20 -0.94 0.41 0.00 0.00 173.24 172.19 2dmi s SER 6 N -2.65 2.69 0.15 2.44 1.04 -1.26 -5.15 113.70 110.96 2dmi s SER 6 Ca 0.08 -0.77 0.03 0.00 0.48 0.00 0.00 55.95 55.77 2dmi s SER 6 Cb -0.00 -0.16 -0.04 0.00 0.10 0.00 0.00 66.02 65.92 2dmi s SER 6 CO -0.01 0.03 0.24 -0.83 0.98 0.00 0.00 173.24 173.65 2dmi s GLY 7 N -2.28 1.72 -0.06 7.32 0.00 -1.26 -5.11 107.32 107.64 2dmi s GLY 7 Ca 0.11 -1.08 0.01 0.00 0.00 0.00 0.00 44.72 43.77 2dmi s GLY 7 CO 0.06 -1.08 -0.08 0.54 0.00 0.00 0.00 173.10 172.53 2dmi s LYS 8 N -3.19 1.28 0.40 2.90 3.01 -1.26 -5.12 119.74 117.76 2dmi s LYS 8 Ca 0.33 -0.25 -0.26 0.00 -1.01 0.00 0.00 55.97 54.79 2dmi s LYS 8 Cb -0.11 -1.18 -0.11 0.00 -1.01 0.00 0.00 37.83 35.43 2dmi s LYS 8 CO 0.27 -0.06 1.19 1.28 0.51 0.00 0.00 175.35 178.54 2dmi n LEU 9 N 4.09 3.43 -4.72 3.17 4.32 -1.26 -4.98 117.00 121.05 2dmi n LEU 9 Ca -0.22 1.11 -0.35 0.00 -0.02 0.00 0.00 56.01 56.53 2dmi n LEU 9 Cb 0.51 -1.44 -0.09 0.00 -1.62 0.00 0.00 43.42 40.78 2dmi n LEU 9 CO 0.23 -0.88 -0.25 -0.31 -1.22 0.00 0.00 177.39 174.96 2dmi s TYR 10 N -1.19 3.32 0.00 -1.77 1.51 -1.26 -4.98 117.35 112.98 2dmi s TYR 10 Ca 0.60 0.24 0.00 0.00 -1.01 0.00 0.00 57.07 56.90 2dmi s TYR 10 Cb -0.55 -1.95 0.00 0.00 -0.11 0.00 0.00 41.96 39.35 2dmi s TYR 10 CO 0.59 0.41 0.00 0.41 -1.11 0.00 0.00 175.55 175.85 2dmi n GLY 11 N 2.69 -1.83 1.90 0.71 0.00 -1.26 -5.03 105.19 102.37 2dmi n GLY 11 Ca -0.18 0.80 -0.13 0.00 0.00 0.00 0.00 46.02 46.51 2dmi n GLY 11 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dmi n SER 12 N 0.00 5.92 -4.36 1.61 2.88 -1.26 -4.97 113.62 113.45 2dmi n SER 12 Ca 0.00 -2.79 -0.52 0.00 -1.33 0.00 0.00 58.87 54.23 2dmi n SER 12 Cb 0.00 -1.17 -0.05 0.00 -0.75 0.00 0.00 64.21 62.24 2dmi n SER 12 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2dmi n ILE 13 N 1.16 1.17 -1.69 2.46 5.41 -1.26 -4.76 119.36 121.85 2dmi n ILE 13 Ca 0.27 -0.29 -0.42 0.00 1.00 0.00 0.00 62.75 63.30 2dmi n ILE 13 Cb 0.61 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.51 2dmi n ILE 13 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2dmi n PHE 14 N 0.60 2.62 -3.33 1.39 3.72 -1.26 -4.95 117.46 116.25 2dmi n PHE 14 Ca 0.18 -0.20 -0.46 0.00 -0.05 0.00 0.00 57.45 56.93 2dmi n PHE 14 Cb 0.18 -2.75 -0.05 0.00 -0.94 0.00 0.00 39.48 35.91 2dmi n PHE 14 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2dmi s THR 15 N 3.07 5.14 0.00 4.37 -4.23 -1.26 -4.89 115.64 117.83 2dmi s THR 15 Ca 0.83 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.81 2dmi s THR 15 Cb -0.47 -4.30 0.00 0.00 1.34 0.00 0.00 72.50 69.07 2dmi s THR 15 CO 0.38 -0.86 0.00 0.61 -0.54 0.00 0.00 174.62 174.21 2dmi n GLY 16 N 5.22 3.13 4.02 3.99 0.00 -1.26 -5.13 105.19 115.15 2dmi n GLY 16 Ca -0.13 -1.28 -0.19 0.00 0.00 0.00 0.00 46.02 44.42 2dmi n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dmi s ALA 17 N 0.00 4.57 -0.04 4.61 0.00 -1.26 -5.13 121.76 124.51 2dmi s ALA 17 Ca 0.00 -1.89 -0.02 0.00 0.00 0.00 0.00 51.96 50.05 2dmi s ALA 17 Cb 0.00 -1.58 0.03 0.00 0.00 0.00 0.00 23.12 21.57 2dmi s ALA 17 CO 0.00 -0.62 0.05 -1.54 0.00 0.00 0.00 175.76 173.65 2dmi s SER 18 N -4.52 0.93 -0.09 0.00 1.04 -1.26 -4.95 113.70 104.84 2dmi s SER 18 Ca 0.59 0.07 -0.26 0.00 0.48 0.00 0.00 55.95 56.83 2dmi s SER 18 Cb -0.08 -0.13 -0.26 0.00 0.10 0.00 0.00 66.02 65.65 2dmi s SER 18 CO 0.36 -0.22 0.88 0.11 0.98 0.00 0.00 173.24 175.35 2dmi h LYS 19 N 8.20 0.11 -6.36 4.02 6.56 -1.81 -3.47 116.57 123.83 2dmi h LYS 19 Ca -0.19 -0.16 -0.63 0.00 -1.06 0.00 0.00 60.65 58.61 2dmi h LYS 19 Cb 1.12 0.06 -0.16 0.00 -0.57 0.00 0.00 32.23 32.68 2dmi h LYS 19 CO 0.22 1.02 -0.78 -0.06 -2.06 0.00 0.00 179.45 177.78 2dmi s PHE 20 N -2.57 2.30 0.31 -1.35 0.40 -1.09 -5.03 117.98 110.95 2dmi s PHE 20 Ca -0.17 -0.34 0.04 0.00 -0.60 0.00 0.00 56.93 55.86 2dmi s PHE 20 Cb -0.01 -1.05 -0.03 0.00 0.51 0.00 0.00 43.02 42.43 2dmi s PHE 20 CO 0.73 0.63 0.19 1.03 0.70 0.00 0.00 175.22 178.51 2dmi s ARG 21 N -3.19 1.62 -0.46 0.44 0.52 -1.26 -2.37 118.95 114.25 2dmi s ARG 21 Ca 0.26 -1.93 0.03 0.00 -0.52 0.00 0.00 55.73 53.57 2dmi s ARG 21 Cb -0.06 0.05 0.13 0.00 0.52 0.00 0.00 34.95 35.59 2dmi s ARG 21 CO 0.13 -0.51 0.24 0.00 0.02 0.00 0.00 175.30 175.18 2dmi n LYS 23 N 3.43 -0.01 0.00 0.00 4.81 -1.26 -0.58 118.16 124.56 2dmi n LYS 23 Ca 0.07 0.81 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 2dmi n LYS 23 Cb 0.34 -1.74 0.00 0.00 0.02 0.00 0.00 35.03 33.65 2dmi n LYS 23 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2dmi n ASP 24 N -3.68 0.00 -4.90 3.14 -0.08 -1.26 -4.89 116.55 104.88 2dmi n ASP 24 Ca 0.30 0.65 -0.28 0.00 -1.51 0.00 0.00 54.79 53.94 2dmi n ASP 24 Cb 1.27 -0.45 -0.04 0.00 2.34 0.00 0.00 41.12 44.24 2dmi n ASP 24 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2dmi n SER 26 N -0.15 4.88 -4.32 0.00 7.64 -1.26 -3.77 113.62 116.64 2dmi n SER 26 Ca -0.07 -2.32 -0.35 0.00 1.01 0.00 0.00 58.87 57.14 2dmi n SER 26 Cb 0.53 -1.11 -0.14 0.00 -1.01 0.00 0.00 64.21 62.48 2dmi n SER 26 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dmi s ALA 27 N 0.43 2.83 0.26 -0.43 0.00 -1.26 -5.00 121.76 118.59 2dmi s ALA 27 Ca 0.16 -1.15 0.07 0.00 0.00 0.00 0.00 51.96 51.05 2dmi s ALA 27 Cb 0.08 -1.70 -0.03 0.00 0.00 0.00 0.00 23.12 21.46 2dmi s ALA 27 CO 0.00 -0.39 0.22 0.00 0.00 0.00 0.00 175.76 175.59 2dmi s ALA 28 N 1.41 3.63 0.03 0.00 0.00 -1.26 -3.13 121.76 122.44 2dmi s ALA 28 Ca 0.05 -1.43 0.02 0.00 0.00 0.00 0.00 51.96 50.59 2dmi s ALA 28 Cb -0.14 -1.31 -0.02 0.00 0.00 0.00 0.00 23.12 21.65 2dmi s ALA 28 CO -0.02 0.23 -0.07 0.71 0.00 0.00 0.00 175.76 176.60 2dmi s TYR 29 N -2.14 0.58 0.21 0.00 2.02 -1.00 -5.00 117.35 112.01 2dmi s TYR 29 Ca 0.34 -0.39 -0.08 0.00 -0.37 0.00 0.00 57.07 56.57 2dmi s TYR 29 Cb -0.08 -0.35 0.15 0.00 -0.40 0.00 0.00 41.96 41.28 2dmi s TYR 29 CO 0.25 -0.07 1.79 -0.44 -1.57 0.00 0.00 175.55 175.51 2dmi h ASP 30 N 4.92 1.06 -3.46 2.29 3.32 -1.92 -2.88 116.42 119.74 2dmi h ASP 30 Ca -0.33 -0.15 -0.62 0.00 0.02 0.00 0.00 57.03 55.94 2dmi h ASP 30 Cb 1.20 -0.27 -0.19 0.00 0.22 0.00 0.00 39.33 40.28 2dmi h ASP 30 CO 0.43 0.92 -0.82 0.42 -1.72 0.00 0.00 179.24 178.47 2dmi s THR 31 N -5.62 2.15 0.05 0.35 -4.23 -1.26 -4.57 115.64 102.50 2dmi s THR 31 Ca -0.13 -1.92 -0.23 0.00 -1.18 0.00 0.00 61.69 58.23 2dmi s THR 31 Cb 0.15 -1.98 -0.15 0.00 1.34 0.00 0.00 72.50 71.86 2dmi s THR 31 CO 0.83 -0.13 1.53 0.25 -0.54 0.00 0.00 174.62 176.56 2dmi h LEU 32 N 3.38 0.08 -0.88 4.79 5.85 -1.99 -3.01 115.31 123.53 2dmi h LEU 32 Ca -0.46 -0.23 0.24 0.00 0.84 0.00 0.00 57.88 58.27 2dmi h LEU 32 Cb 1.20 -0.02 -0.15 0.00 0.37 0.00 0.00 40.66 42.06 2dmi h LEU 32 CO 0.47 0.29 0.13 1.62 -0.34 0.00 0.00 178.44 180.61 2dmi h VAL 33 N -0.13 0.23 0.00 1.05 3.04 -1.99 1.38 116.25 119.83 2dmi h VAL 33 Ca 0.02 -0.04 -0.03 0.00 -1.01 0.00 0.00 66.70 65.63 2dmi h VAL 33 Cb 0.24 0.10 -0.00 0.00 -2.01 0.00 0.00 31.29 29.61 2dmi h VAL 33 CO 0.00 0.02 -0.15 -0.33 -1.01 0.00 0.00 177.57 176.11 2dmi h GLU 34 N 0.12 0.00 0.00 4.17 4.39 -1.96 -2.65 114.58 118.66 2dmi h GLU 34 Ca 0.54 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 60.22 2dmi h GLU 34 Cb 1.09 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.73 2dmi h GLU 34 CO -0.74 0.15 -0.14 1.25 -1.16 0.00 0.00 179.01 178.37 2dmi h LEU 35 N 0.00 0.00 -0.91 1.33 5.85 0.17 -3.32 115.31 118.43 2dmi h LEU 35 Ca -0.00 -0.65 0.25 0.00 0.84 0.00 0.00 57.88 58.31 2dmi h LEU 35 Cb 0.28 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.17 2dmi h LEU 35 CO 0.02 0.91 0.34 0.71 -0.34 0.00 0.00 178.44 180.08 2dmi h THR 36 N -1.00 0.35 -0.14 1.05 1.35 -0.35 0.95 112.91 115.13 2dmi h THR 36 Ca -0.03 -0.10 0.03 0.00 -0.55 0.00 0.00 66.41 65.76 2dmi h THR 36 Cb 0.75 0.05 -0.01 0.00 -1.73 0.00 0.00 68.15 67.21 2dmi h THR 36 CO -0.02 0.05 0.10 1.62 -0.25 0.00 0.00 175.52 177.02 2dmi h VAL 37 N 0.28 0.95 0.19 6.82 3.04 -1.60 -1.69 116.25 124.23 2dmi h VAL 37 Ca 0.59 -0.01 -0.35 0.00 -1.01 0.00 0.00 66.70 65.92 2dmi h VAL 37 Cb 1.20 0.92 0.01 0.00 -2.01 0.00 0.00 31.29 31.41 2dmi h VAL 37 CO -0.61 0.01 -1.75 -0.74 -1.01 0.00 0.00 177.57 173.46 2dmi h HIS 38 N 0.03 0.73 -0.90 3.17 -0.00 0.70 -2.43 115.15 116.46 2dmi h HIS 38 Ca 0.06 -0.53 0.06 0.00 -0.00 0.00 0.00 60.37 59.96 2dmi h HIS 38 Cb 0.22 -0.03 -0.06 0.00 -0.00 0.00 0.00 27.41 27.54 2dmi h HIS 38 CO -0.00 1.68 0.59 0.52 -0.00 0.00 0.00 177.93 180.72 2dmi h MET 39 N 0.11 0.99 0.14 5.26 2.86 -0.27 0.02 114.93 124.04 2dmi h MET 39 Ca -0.34 -0.06 -0.24 0.00 -2.06 0.00 0.00 59.70 57.00 2dmi h MET 39 Cb 2.10 -0.22 0.01 0.00 0.06 0.00 0.00 31.60 33.55 2dmi h MET 39 CO 0.18 0.66 -1.13 -0.91 1.06 0.00 0.00 176.91 176.77 2dmi h ASN 40 N 1.02 0.47 0.36 1.22 2.35 -1.46 0.75 115.58 120.30 2dmi h ASN 40 Ca 0.39 -0.91 -0.00 0.00 -0.55 0.00 0.00 56.30 55.23 2dmi h ASN 40 Cb 0.20 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 2dmi h ASN 40 CO -0.14 1.52 -0.42 -0.33 -1.65 0.00 0.00 177.43 176.41 2dmi h GLU 41 N -0.29 -0.78 0.10 0.81 4.39 -1.16 -3.25 114.58 114.39 2dmi h GLU 41 Ca -0.22 0.05 -0.15 0.00 0.34 0.00 0.00 59.36 59.39 2dmi h GLU 41 Cb 1.74 0.18 0.01 0.00 -0.10 0.00 0.00 28.75 30.59 2dmi h GLU 41 CO 0.13 -0.52 -0.67 1.79 -1.16 0.00 0.00 179.01 178.58 2dmi h THR 42 N -0.81 1.54 0.00 1.13 1.35 -1.16 -3.49 112.91 111.46 2dmi h THR 42 Ca -0.03 -2.48 0.00 0.00 -0.55 0.00 0.00 66.41 63.36 2dmi h THR 42 Cb 0.74 3.20 0.00 0.00 -1.73 0.00 0.00 68.15 70.36 2dmi h THR 42 CO -0.10 0.68 0.00 0.61 -0.25 0.00 0.00 175.52 176.46 2dmi n GLY 43 N 1.66 1.20 3.17 5.82 0.00 0.20 -5.07 105.19 112.16 2dmi n GLY 43 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 -2.72 -4.55 1.61 8.25 -0.85 -4.74 115.22 112.22 2dmi n HIS 44 Ca 0.00 0.21 -0.26 0.00 -0.26 0.00 0.00 57.72 57.41 2dmi n HIS 44 Cb 0.00 -1.55 -0.10 0.00 1.12 0.00 0.00 29.99 29.47 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 -2.16 2.00 0.47 4.41 2.02 -1.26 -4.27 117.35 118.57 2dmi s TYR 45 Ca 0.47 -0.99 -0.21 0.00 -0.37 0.00 0.00 57.07 55.97 2dmi s TYR 45 Cb -0.12 -1.39 -0.09 0.00 -0.40 0.00 0.00 41.96 39.95 2dmi s TYR 45 CO 0.72 0.05 1.03 0.50 -1.57 0.00 0.00 175.55 176.28 2dmi s ARG 46 N -3.81 3.89 -0.38 -0.62 3.52 -1.26 -3.98 118.95 116.31 2dmi s ARG 46 Ca 0.28 1.35 -0.01 0.00 -0.13 0.00 0.00 55.73 57.22 2dmi s ARG 46 Cb 0.06 -2.15 0.28 0.00 -1.56 0.00 0.00 34.95 31.58 2dmi s ARG 46 CO 0.14 -0.35 1.96 -3.47 -0.81 0.00 0.00 175.30 172.77 2dmi n ASP 47 N -0.83 6.34 -4.40 -2.12 2.03 -1.26 -4.75 116.55 111.56 2dmi n ASP 47 Ca 0.09 -3.18 -0.20 0.00 0.52 0.00 0.00 54.79 52.01 2dmi n ASP 47 Cb 0.52 -1.00 -0.10 0.00 -0.72 0.00 0.00 41.12 39.82 2dmi n ASP 47 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2dmi s ASP 48 N -0.25 2.48 -0.52 1.67 1.01 -1.26 -4.93 116.67 114.87 2dmi s ASP 48 Ca 0.37 -1.21 -0.34 0.00 0.71 0.00 0.00 52.55 52.08 2dmi s ASP 48 Cb 0.30 -0.11 -0.14 0.00 1.01 0.00 0.00 42.92 43.97 2dmi s ASP 48 CO 0.00 -0.41 2.32 -0.46 0.21 0.00 0.00 175.17 176.84 2dmi n ASN 49 N -0.54 1.62 -4.94 0.27 0.23 -1.26 -4.92 115.26 105.73 2dmi n ASN 49 Ca -0.05 0.25 -0.22 0.00 -0.53 0.00 0.00 54.58 54.03 2dmi n ASN 49 Cb 0.64 -1.20 0.00 0.00 -2.08 0.00 0.00 39.78 37.14 2dmi n ASN 49 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 2dmi s HIS 50 N 8.29 2.10 0.55 -2.53 -3.43 -1.26 -5.15 115.29 113.87 2dmi s HIS 50 Ca 1.14 -0.64 0.06 0.00 -0.80 0.00 0.00 55.06 54.82 2dmi s HIS 50 Cb -0.91 -2.13 0.04 0.00 -1.43 0.00 0.00 32.58 28.16 2dmi s HIS 50 CO 0.47 -0.50 0.43 -1.21 -2.00 0.00 0.00 174.74 171.93 2dmi s GLU 51 N -4.33 2.25 -1.40 -0.38 2.02 -1.26 -4.65 118.70 110.95 2dmi s GLU 51 Ca 0.48 -2.01 -0.10 0.00 0.02 0.00 0.00 54.97 53.36 2dmi s GLU 51 Cb -0.04 -2.12 0.07 0.00 0.10 0.00 0.00 34.13 32.14 2dmi s GLU 51 CO 0.29 -0.65 0.62 2.41 0.02 0.00 0.00 175.26 177.95 2dmi n THR 52 N -1.81 -1.33 -4.67 3.63 -1.04 -1.26 -4.95 114.28 102.86 2dmi n THR 52 Ca -0.01 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.70 2dmi n THR 52 Cb 0.64 -2.24 -0.09 0.00 -1.82 0.00 0.00 70.33 66.82 2dmi n THR 52 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 2dmi s ASP 53 N -2.86 3.74 0.67 8.00 1.47 -1.26 -5.13 116.67 121.30 2dmi s ASP 53 Ca 0.46 -1.56 -0.15 0.00 1.18 0.00 0.00 52.55 52.48 2dmi s ASP 53 Cb -0.24 0.22 0.01 0.00 -0.34 0.00 0.00 42.92 42.57 2dmi s ASP 53 CO 0.57 -0.73 1.14 0.21 0.68 0.00 0.00 175.17 177.04 2dmi s ASN 54 N -3.76 4.88 -0.52 2.11 3.84 -1.26 -5.01 114.94 115.22 2dmi s ASN 54 Ca 0.19 2.12 -0.03 0.00 0.21 0.00 0.00 52.86 55.35 2dmi s ASN 54 Cb 0.05 -2.56 0.14 0.00 -0.55 0.00 0.00 41.25 38.32 2dmi s ASN 54 CO 0.10 -1.79 0.33 0.21 -2.79 0.00 0.00 177.10 173.16 2dmi s ASN 55 N -2.35 5.23 0.12 -4.21 2.47 -1.26 -5.08 114.94 109.86 2dmi s ASN 55 Ca 0.70 -2.47 -0.16 0.00 0.42 0.00 0.00 52.86 51.34 2dmi s ASN 55 Cb -0.23 -1.84 -0.07 0.00 -1.45 0.00 0.00 41.25 37.66 2dmi s ASN 55 CO 0.41 -0.45 0.55 0.54 -3.72 0.00 0.00 177.10 174.43 2dmi s ASN 56 N 1.21 6.90 -0.02 -4.21 2.20 -1.26 -5.02 114.94 114.74 2dmi s ASN 56 Ca 0.13 1.13 -0.25 0.00 -0.94 0.00 0.00 52.86 52.94 2dmi s ASN 56 Cb -0.22 -2.31 -0.18 0.00 -2.00 0.00 0.00 41.25 36.54 2dmi s ASN 56 CO -0.04 0.17 1.17 1.55 -2.94 0.00 0.00 177.10 177.01 2dmi h PRO 57 N 3.93 -0.14 -0.55 3.55 0.13 -2.04 -3.39 132.00 133.50 2dmi h PRO 57 Ca -0.49 0.01 -0.32 0.00 -0.87 0.00 0.00 66.00 64.33 2dmi h PRO 57 Cb 1.20 0.03 -0.41 0.00 0.13 0.00 0.00 31.00 31.96 2dmi h PRO 57 CO 0.65 0.29 -1.05 0.36 -0.23 0.00 0.00 178.00 178.02 2dmi n LYS 58 N -4.94 2.17 -3.16 0.86 2.85 -1.26 -4.91 118.16 109.77 2dmi n LYS 58 Ca -0.09 -3.67 -0.22 0.00 -1.05 0.00 0.00 58.31 53.29 2dmi n LYS 58 Cb 0.26 -1.76 -0.05 0.00 -0.65 0.00 0.00 35.03 32.83 2dmi n LYS 58 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2dmi n ARG 59 N -0.60 1.57 -3.72 -1.58 0.00 -1.26 -5.05 116.66 106.02 2dmi n ARG 59 Ca 0.16 -3.80 -0.24 0.00 -0.00 0.00 0.00 57.85 53.96 2dmi n ARG 59 Cb 0.84 -1.77 -0.17 0.00 0.00 0.00 0.00 32.46 31.36 2dmi n ARG 59 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.63 179.30 2dmi s TRP 60 N -2.38 0.62 0.01 -0.14 -2.14 -1.26 -4.75 118.94 108.90 2dmi s TRP 60 Ca 0.41 -0.34 -0.28 0.00 2.66 0.00 0.00 56.10 58.55 2dmi s TRP 60 Cb 0.27 -0.81 0.10 0.00 -3.10 0.00 0.00 33.47 29.93 2dmi s TRP 60 CO -0.09 -0.42 1.25 -1.54 -2.66 0.00 0.00 176.95 173.49 2dmi s SER 61 N 1.99 -0.00 -0.09 -2.66 1.04 -1.26 -5.16 113.70 107.55 2dmi s SER 61 Ca 0.03 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.20 2dmi s SER 61 Cb -0.14 0.20 -0.03 0.00 0.10 0.00 0.00 66.02 66.15 2dmi s SER 61 CO -0.06 -0.39 -0.09 -1.59 0.98 0.00 0.00 173.24 172.09 2dmi s LYS 62 N -2.08 3.01 1.02 4.02 0.00 -1.26 -5.10 119.74 119.35 2dmi s LYS 62 Ca 0.27 -0.59 -0.13 0.00 0.00 0.00 0.00 55.97 55.52 2dmi s LYS 62 Cb -0.00 -2.63 0.20 0.00 0.00 0.00 0.00 37.83 35.40 2dmi s LYS 62 CO -0.00 0.49 1.09 -1.25 0.00 0.00 0.00 175.35 175.68 2dmi s PRO 63 N -0.35 0.29 -0.29 1.78 0.04 -1.26 -5.09 135.00 130.12 2dmi s PRO 63 Ca 0.05 0.48 -0.16 0.00 0.04 0.00 0.00 61.00 61.40 2dmi s PRO 63 Cb -0.12 -1.72 0.17 0.00 0.04 0.00 0.00 34.50 32.87 2dmi s PRO 63 CO 0.02 -2.82 1.10 0.50 0.04 0.00 0.00 177.00 175.84 2dmi s ARG 64 N -4.96 0.23 -0.29 4.56 3.52 -1.26 -5.10 118.95 115.65 2dmi s ARG 64 Ca 0.66 0.41 -0.16 0.00 -0.13 0.00 0.00 55.73 56.51 2dmi s ARG 64 Cb -0.19 0.06 0.14 0.00 -1.56 0.00 0.00 34.95 33.40 2dmi s ARG 64 CO 0.58 -0.05 0.95 -1.59 -0.81 0.00 0.00 175.30 174.37 2dmi s LYS 65 N 1.26 0.41 -0.30 5.12 0.00 -1.26 -5.15 119.74 119.82 2dmi s LYS 65 Ca -0.08 0.71 -0.16 0.00 0.00 0.00 0.00 55.97 56.44 2dmi s LYS 65 Cb -0.03 0.08 0.18 0.00 0.00 0.00 0.00 37.83 38.06 2dmi s LYS 65 CO -0.13 -0.09 1.13 -0.98 0.00 0.00 0.00 175.35 175.29 2dmi s ARG 66 N 1.36 0.14 -0.29 1.78 1.70 -1.26 -5.12 118.95 117.26 2dmi s ARG 66 Ca -0.09 0.30 -0.17 0.00 -0.47 0.00 0.00 55.73 55.30 2dmi s ARG 66 Cb -0.04 0.17 0.17 0.00 -0.57 0.00 0.00 34.95 34.68 2dmi s ARG 66 CO -0.15 -0.10 1.08 -1.12 -1.08 0.00 0.00 175.30 173.92 2dmi s SER 67 N 2.61 -0.35 -0.53 -2.89 0.01 -1.26 -5.05 113.70 106.23 2dmi s SER 67 Ca -0.02 0.57 0.03 0.00 1.31 0.00 0.00 55.95 57.83 2dmi s SER 67 Cb -0.06 1.10 0.42 0.00 0.21 0.00 0.00 66.02 67.69 2dmi s SER 67 CO -0.13 -0.09 1.52 -0.11 0.41 0.00 0.00 173.24 174.84 2dmi n LEU 68 N 3.38 6.00 -3.33 2.44 -0.00 -1.26 -4.80 117.00 119.43 2dmi n LEU 68 Ca -0.18 -4.80 -0.26 0.00 -0.00 0.00 0.00 56.01 50.77 2dmi n LEU 68 Cb 0.57 -0.66 -0.08 0.00 -0.00 0.00 0.00 43.42 43.25 2dmi n LEU 68 CO 0.03 1.94 -0.08 -0.11 -0.00 0.00 0.00 177.39 179.17 2dmi n LEU 69 N -0.66 2.25 -3.19 -1.96 0.00 -1.26 -4.94 117.00 107.24 2dmi n LEU 69 Ca 0.49 -5.12 -0.23 0.00 0.00 0.00 0.00 56.01 51.14 2dmi n LEU 69 Cb 0.67 -0.12 -0.05 0.00 0.00 0.00 0.00 43.42 43.91 2dmi n LEU 69 CO 0.49 2.06 -0.12 -1.84 0.00 0.00 0.00 177.39 177.97 2dmi n GLU 70 N 1.10 1.60 -3.78 1.96 0.28 -1.26 -5.01 120.64 115.53 2dmi n GLU 70 Ca 0.26 -3.85 -0.33 0.00 -0.16 0.00 0.00 57.16 53.08 2dmi n GLU 70 Cb 0.46 -1.75 -0.10 0.00 1.43 0.00 0.00 31.44 31.48 2dmi n GLU 70 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 2dmi s MET 71 N -2.22 2.64 0.43 3.44 -1.94 -1.26 -5.06 119.30 115.33 2dmi s MET 71 Ca 0.40 -2.98 0.03 0.00 -1.71 0.00 0.00 55.69 51.44 2dmi s MET 71 Cb 0.24 -3.64 -0.02 0.00 2.01 0.00 0.00 34.83 33.41 2dmi s MET 71 CO -0.09 -1.22 0.10 -1.83 -0.01 0.00 0.00 175.02 171.98 2dmi s GLU 72 N -0.84 1.97 0.00 2.03 -1.05 -1.26 -5.10 118.70 114.46 2dmi s GLU 72 Ca 0.22 -2.21 0.00 0.00 -0.15 0.00 0.00 54.97 52.83 2dmi s GLU 72 Cb -0.14 -0.82 0.00 0.00 -0.44 0.00 0.00 34.13 32.74 2dmi s GLU 72 CO -0.09 -0.44 0.00 0.41 0.95 0.00 0.00 175.26 176.09 2dmi n GLY 73 N -0.97 -0.09 1.59 -3.83 0.00 -1.26 -5.01 105.19 95.61 2dmi n GLY 73 Ca -0.08 0.08 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 2dmi n GLY 73 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dmi n LYS 74 N 0.00 1.19 -3.69 1.61 4.81 -1.26 -4.68 118.16 116.14 2dmi n LYS 74 Ca 0.00 -0.37 -0.28 0.00 -0.87 0.00 0.00 58.31 56.79 2dmi n LYS 74 Cb 0.00 -1.14 -0.16 0.00 0.02 0.00 0.00 35.03 33.75 2dmi n LYS 74 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2dmi s GLU 75 N -0.43 0.51 -0.07 1.64 0.41 -1.26 -5.01 118.70 114.49 2dmi s GLU 75 Ca 0.07 -0.51 -0.00 0.00 -0.41 0.00 0.00 54.97 54.12 2dmi s GLU 75 Cb 0.06 -1.90 0.05 0.00 -1.78 0.00 0.00 34.13 30.55 2dmi s GLU 75 CO -0.00 -0.77 1.96 -3.47 -0.49 0.00 0.00 175.26 172.49 2dmi n ASP 76 N 5.08 5.50 -4.00 -0.19 2.03 -1.26 -4.79 116.55 118.91 2dmi n ASP 76 Ca -0.07 -2.55 -0.26 0.00 0.52 0.00 0.00 54.79 52.43 2dmi n ASP 76 Cb 0.46 -1.08 -0.07 0.00 -0.72 0.00 0.00 41.12 39.70 2dmi n ASP 76 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dmi n ALA 77 N 1.18 -1.86 -3.81 -1.67 0.00 -1.26 -0.23 120.51 112.86 2dmi n ALA 77 Ca 0.07 -0.36 -0.25 0.00 0.00 0.00 0.00 53.44 52.91 2dmi n ALA 77 Cb 0.52 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 19.19 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 -3.97 -0.74 -0.05 0.00 10.64 -1.26 -4.78 117.38 117.22 2dmi n GLN 78 Ca -0.26 -0.05 -0.05 0.00 -1.83 0.00 0.00 57.00 54.81 2dmi n GLN 78 Cb 0.57 -1.72 -0.07 0.00 -0.86 0.00 0.00 30.24 28.16 2dmi n GLN 78 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 2dmi n LYS 79 N -3.42 2.04 -4.75 2.61 0.00 0.68 -5.02 118.16 110.31 2dmi n LYS 79 Ca -0.14 0.01 -0.30 0.00 0.00 0.00 0.00 58.31 57.88 2dmi n LYS 79 Cb 0.40 -1.23 -0.14 0.00 0.00 0.00 0.00 35.03 34.06 2dmi n LYS 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2dmi s VAL 80 N -2.22 2.32 -0.48 3.15 0.11 -1.26 -5.09 120.40 116.93 2dmi s VAL 80 Ca -0.07 -1.41 -0.29 0.00 -2.93 0.00 0.00 61.98 57.28 2dmi s VAL 80 Cb 0.03 -1.94 0.03 0.00 -1.53 0.00 0.00 36.38 32.97 2dmi s VAL 80 CO 0.34 0.31 1.13 -0.76 -3.33 0.00 0.00 175.10 172.78 2dmi s LEU 81 N -1.44 3.66 0.04 2.54 1.43 -1.26 -4.99 118.68 118.65 2dmi s LEU 81 Ca 0.13 0.45 -0.10 0.00 -1.03 0.00 0.00 54.13 53.58 2dmi s LEU 81 Cb -0.10 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.59 2dmi s LEU 81 CO 0.04 -1.24 0.20 -0.75 0.23 0.00 0.00 176.35 174.83 2dmi s LYS 82 N 4.42 0.70 -0.47 1.70 2.20 -1.26 -0.08 119.74 126.95 2dmi s LYS 82 Ca 0.47 -0.62 -0.13 0.00 -0.36 0.00 0.00 55.97 55.33 2dmi s LYS 82 Cb -0.07 0.29 0.09 0.00 -1.51 0.00 0.00 37.83 36.63 2dmi s LYS 82 CO 0.31 -0.20 0.37 0.00 -0.36 0.00 0.00 175.35 175.47 2dmi h MET 84 N 8.66 0.55 -0.47 0.00 4.05 -1.96 2.22 114.93 127.98 2dmi h MET 84 Ca -0.27 -0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.16 2dmi h MET 84 Cb 1.10 -0.12 -0.06 0.00 -0.80 0.00 0.00 31.60 31.72 2dmi h MET 84 CO 0.87 0.36 -0.28 0.98 0.23 0.00 0.00 176.91 179.08 2dmi n TYR 85 N -4.89 -0.21 -0.12 1.39 4.19 -1.26 -3.88 117.16 112.38 2dmi n TYR 85 Ca 0.11 0.59 -0.26 0.00 3.31 0.00 0.00 57.90 61.66 2dmi n TYR 85 Cb 0.29 -0.53 -0.09 0.00 0.49 0.00 0.00 39.34 39.50 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 1.53 0.81 2.64 0.00 0.00 0.75 -5.04 105.19 105.88 2dmi n GLY 87 Ca -0.48 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 44.68 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 0.00 0.09 0.24 1.61 3.76 -1.23 -4.88 115.29 114.88 2dmi s HIS 88 Ca 0.00 -0.20 -0.30 0.00 -0.15 0.00 0.00 55.06 54.42 2dmi s HIS 88 Cb 0.00 -0.62 -0.09 0.00 1.11 0.00 0.00 32.58 32.98 2dmi s HIS 88 CO 0.00 -0.54 1.06 -1.54 -0.85 0.00 0.00 174.74 172.88 2dmi s SER 89 N 2.18 7.36 0.27 1.40 1.04 -1.26 -2.99 113.70 121.69 2dmi s SER 89 Ca 0.03 2.15 0.01 0.00 0.48 0.00 0.00 55.95 58.62 2dmi s SER 89 Cb -0.16 -2.62 -0.00 0.00 0.10 0.00 0.00 66.02 63.34 2dmi s SER 89 CO -0.10 -0.09 0.04 0.49 0.98 0.00 0.00 173.24 174.56 2dmi n PHE 90 N 1.55 0.39 -0.08 5.02 3.01 0.89 -4.98 117.46 123.27 2dmi n PHE 90 Ca -0.00 -1.50 -0.13 0.00 1.01 0.00 0.00 57.45 56.82 2dmi n PHE 90 Cb 0.46 -0.10 -0.06 0.00 -0.01 0.00 0.00 39.48 39.76 2dmi n PHE 90 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 2dmi n GLU 91 N -0.64 0.35 -4.53 -1.08 0.28 -1.26 -4.50 120.64 109.26 2dmi n GLU 91 Ca -0.08 0.11 -0.30 0.00 -0.16 0.00 0.00 57.16 56.73 2dmi n GLU 91 Cb 0.37 -1.19 -0.12 0.00 1.43 0.00 0.00 31.44 31.93 2dmi n GLU 91 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2dmi s SER 92 N -5.86 3.91 0.22 -1.84 0.15 -1.26 -4.92 113.70 104.09 2dmi s SER 92 Ca -0.21 -0.44 -0.09 0.00 0.70 0.00 0.00 55.95 55.91 2dmi s SER 92 Cb 0.07 -0.64 0.32 0.00 -1.71 0.00 0.00 66.02 64.06 2dmi s SER 92 CO 0.31 0.23 1.72 0.25 1.20 0.00 0.00 173.24 176.96 2dmi h LEU 93 N 4.27 0.13 -0.77 3.45 7.12 -1.98 -1.65 115.31 125.87 2dmi h LEU 93 Ca -0.48 0.10 0.16 0.00 0.13 0.00 0.00 57.88 57.79 2dmi h LEU 93 Cb 1.16 0.11 -0.15 0.00 -0.53 0.00 0.00 40.66 41.25 2dmi h LEU 93 CO 0.48 0.07 -0.16 -0.61 -0.13 0.00 0.00 178.44 178.09 2dmi h GLN 94 N 0.35 0.01 -0.22 1.25 -0.00 -1.99 0.29 115.11 114.80 2dmi h GLN 94 Ca 0.33 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.98 2dmi h GLN 94 Cb 0.47 -0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.94 2dmi h GLN 94 CO -0.37 0.01 0.14 0.22 0.00 0.00 0.00 178.83 178.83 2dmi h ASP 95 N 0.01 0.25 0.54 -0.69 1.82 -1.73 -0.06 116.42 116.57 2dmi h ASP 95 Ca 0.38 -0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.98 2dmi h ASP 95 Cb 0.60 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 40.54 2dmi h ASP 95 CO -0.78 0.20 -0.33 0.25 -1.61 0.00 0.00 179.24 176.96 2dmi h LEU 96 N 0.29 -0.84 0.42 2.28 5.85 -0.56 -2.27 115.31 120.48 2dmi h LEU 96 Ca 0.08 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2dmi h LEU 96 Cb -0.02 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2dmi h LEU 96 CO -0.02 -0.52 -0.46 0.28 -0.34 0.00 0.00 178.44 177.38 2dmi h SER 97 N -0.83 -1.27 -0.71 1.25 0.02 -0.50 -2.14 113.55 109.36 2dmi h SER 97 Ca -0.06 0.10 0.06 0.00 -0.84 0.00 0.00 61.79 61.05 2dmi h SER 97 Cb 0.68 0.42 -0.09 0.00 0.14 0.00 0.00 62.40 63.56 2dmi h SER 97 CO 0.07 -0.59 -0.42 0.52 -1.14 0.00 0.00 176.83 175.26 2dmi n VAL 98 N -5.20 -0.49 -0.03 2.27 0.31 -0.04 -1.04 118.33 114.11 2dmi n VAL 98 Ca -0.11 2.10 -0.06 0.00 -0.01 0.00 0.00 64.34 66.27 2dmi n VAL 98 Cb 0.41 -2.63 -0.04 0.00 -0.91 0.00 0.00 33.84 30.67 2dmi n VAL 98 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 2dmi h HIS 99 N 0.00 -0.68 -1.63 3.52 6.17 -1.30 0.49 115.15 121.73 2dmi h HIS 99 Ca 0.11 0.03 0.49 0.00 0.71 0.00 0.00 60.37 61.72 2dmi h HIS 99 Cb 0.29 0.31 -0.09 0.00 2.52 0.00 0.00 27.41 30.44 2dmi h HIS 99 CO -0.97 -0.21 1.14 0.52 0.71 0.00 0.00 177.93 179.12 2dmi h MET 100 N -0.20 0.03 0.00 5.26 2.86 -0.65 0.34 114.93 122.58 2dmi h MET 100 Ca 0.02 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2dmi h MET 100 Cb 0.26 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2dmi h MET 100 CO -0.21 0.02 -0.00 0.82 1.06 0.00 0.00 176.91 178.60 2dmi h ILE 101 N 0.03 0.00 -0.47 -1.22 2.04 0.10 0.57 117.51 118.56 2dmi h ILE 101 Ca 0.84 -0.99 0.09 0.00 1.00 0.00 0.00 64.86 65.81 2dmi h ILE 101 Cb 3.14 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 39.13 2dmi h ILE 101 CO -0.16 0.00 -0.08 0.11 0.00 0.00 0.00 178.15 178.02 2dmi h LYS 102 N -0.99 0.03 -0.23 2.37 6.56 0.16 0.48 116.57 124.95 2dmi h LYS 102 Ca -0.00 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2dmi h LYS 102 Cb 0.00 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 2dmi h LYS 102 CO 0.00 0.02 0.00 0.25 -2.06 0.00 0.00 179.45 177.66 2dmi n THR 103 N -5.31 0.00 -3.94 -0.16 -2.24 0.10 -4.85 114.28 97.89 2dmi n THR 103 Ca 0.04 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.51 2dmi n THR 103 Cb 0.25 -0.12 -0.05 0.00 -2.10 0.00 0.00 70.33 68.31 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 -0.38 -1.67 0.04 -0.78 4.01 0.17 -4.78 118.16 114.77 2dmi n LYS 104 Ca 0.00 0.15 -0.07 0.00 -0.51 0.00 0.00 58.31 57.88 2dmi n LYS 104 Cb 0.06 -4.74 -0.12 0.00 -0.51 0.00 0.00 35.03 29.72 2dmi n LYS 104 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2dmi h HIS 105 N -0.72 0.00 -0.00 2.13 3.86 -0.16 -3.09 115.15 117.17 2dmi h HIS 105 Ca -0.44 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 58.60 2dmi h HIS 105 Cb 1.29 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.74 2dmi h HIS 105 CO 0.75 0.98 -0.80 0.10 0.86 0.00 0.00 177.93 179.82 2dmi h TYR 106 N 0.00 0.06 0.00 2.45 -0.00 -1.41 -3.20 116.97 114.88 2dmi h TYR 106 Ca -0.07 -0.03 0.00 0.00 -0.00 0.00 0.00 58.73 58.63 2dmi h TYR 106 Cb 1.81 -0.01 0.00 0.00 -0.00 0.00 0.00 36.73 38.53 2dmi h TYR 106 CO 0.00 0.82 0.00 0.94 -0.00 0.00 0.00 178.16 179.92 2dmi n GLN 107 N -3.62 0.00 -0.09 0.10 0.00 -1.24 -4.29 117.38 108.24 2dmi n GLN 107 Ca -0.01 0.46 -0.02 0.00 -0.00 0.00 0.00 57.00 57.42 2dmi n GLN 107 Cb 0.76 -1.11 -0.02 0.00 0.00 0.00 0.00 30.24 29.88 2dmi n GLN 107 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2dmi n LYS 108 N -1.87 -0.10 -1.43 3.69 4.01 -1.17 -4.34 118.16 116.96 2dmi n LYS 108 Ca 0.00 0.94 -0.43 0.00 -0.51 0.00 0.00 58.31 58.32 2dmi n LYS 108 Cb 0.00 -1.40 -0.00 0.00 -0.51 0.00 0.00 35.03 33.12 2dmi n LYS 108 CO 0.00 0.00 0.00 1.55 -1.11 0.00 0.00 177.40 177.84 2dmi n VAL 109 N -3.42 1.60 -1.08 -0.18 3.14 -1.21 -4.56 118.33 112.63 2dmi n VAL 109 Ca 0.00 -0.50 -0.47 0.00 -2.96 0.00 0.00 64.34 60.42 2dmi n VAL 109 Cb 0.06 -0.41 -0.08 0.00 -1.06 0.00 0.00 33.84 32.34 2dmi n VAL 109 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2dmi n SER 110 N 1.55 0.70 0.00 6.55 7.64 -1.26 -4.77 113.62 124.03 2dmi n SER 110 Ca 0.12 0.66 0.00 0.00 1.01 0.00 0.00 58.87 60.66 2dmi n SER 110 Cb 0.37 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 62.91 2dmi n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dmi n GLY 111 N 4.47 3.88 1.34 0.23 0.00 -1.26 -5.04 105.19 108.80 2dmi n GLY 111 Ca 0.33 -0.24 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 2dmi n GLY 111 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dmi n PRO 112 N 0.00 -1.85 -3.56 1.61 -0.04 -1.26 -5.10 135.00 124.80 2dmi n PRO 112 Ca 0.00 -0.67 -0.14 0.00 -0.04 0.00 0.00 63.50 62.66 2dmi n PRO 112 Cb 0.00 -0.63 -0.05 0.00 -0.04 0.00 0.00 33.50 32.78 2dmi n PRO 112 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dmi n SER 113 N -3.72 -0.56 0.02 3.54 2.88 -1.26 -5.11 113.62 109.41 2dmi n SER 113 Ca 0.06 -2.54 -0.02 0.00 -1.33 0.00 0.00 58.87 55.04 2dmi n SER 113 Cb 0.22 1.27 -0.01 0.00 -0.75 0.00 0.00 64.21 64.94 2dmi n SER 113 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dmi n SER 114 N -2.03 0.99 0.00 -3.46 3.41 -1.26 -5.30 113.62 105.98 2dmi n SER 114 Ca 0.05 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2dmi n SER 114 Cb 0.43 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2dmi n SER 114 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49