#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhi s SER 2 N 0.00 -0.31 0.37 1.61 0.15 -1.26 -5.17 113.70 109.09 2dhi s SER 2 Ca 0.00 0.12 -0.05 0.00 0.70 0.00 0.00 55.95 56.72 2dhi s SER 2 Cb 0.00 0.41 -0.05 0.00 -1.71 0.00 0.00 66.02 64.68 2dhi s SER 2 CO 0.00 -0.60 0.66 -0.94 1.20 0.00 0.00 173.24 173.56 2dhi s SER 3 N -1.73 6.39 0.36 5.45 1.04 -1.26 -4.88 113.70 119.07 2dhi s SER 3 Ca -0.08 0.81 0.00 0.00 0.48 0.00 0.00 55.95 57.16 2dhi s SER 3 Cb -0.02 -2.19 0.00 0.00 0.10 0.00 0.00 66.02 63.91 2dhi s SER 3 CO 0.01 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.48 2dhi n GLY 4 N -1.51 0.73 2.85 7.32 0.00 -1.26 -4.86 105.19 108.46 2dhi n GLY 4 Ca -0.01 -1.14 -0.15 0.00 0.00 0.00 0.00 46.02 44.72 2dhi n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhi s SER 5 N -4.00 0.24 0.07 1.61 0.01 -1.26 -5.13 113.70 105.24 2dhi s SER 5 Ca 0.00 0.24 -0.31 0.00 1.31 0.00 0.00 55.95 57.19 2dhi s SER 5 Cb 0.00 0.13 -0.06 0.00 0.21 0.00 0.00 66.02 66.30 2dhi s SER 5 CO 0.00 -0.18 1.25 -0.44 0.41 0.00 0.00 173.24 174.28 2dhi s SER 6 N 1.51 7.01 0.04 2.44 0.01 -1.26 -5.01 113.70 118.44 2dhi s SER 6 Ca -0.05 2.09 -0.22 0.00 1.31 0.00 0.00 55.95 59.08 2dhi s SER 6 Cb -0.12 -2.58 -0.06 0.00 0.21 0.00 0.00 66.02 63.47 2dhi s SER 6 CO -0.05 -0.53 0.65 -0.83 0.41 0.00 0.00 173.24 172.89 2dhi s GLY 7 N 1.10 2.70 0.02 3.44 0.00 -1.26 -5.05 107.32 108.27 2dhi s GLY 7 Ca 0.60 0.12 -0.22 0.00 0.00 0.00 0.00 44.72 45.22 2dhi s GLY 7 CO 0.29 0.78 0.65 -1.36 0.00 0.00 0.00 173.10 173.46 2dhi s PHE 8 N -0.46 3.72 0.09 1.90 0.08 -1.26 -4.09 117.98 117.96 2dhi s PHE 8 Ca 0.33 1.31 -0.27 0.00 0.12 0.00 0.00 56.93 58.42 2dhi s PHE 8 Cb -0.20 -2.67 -0.11 0.00 -0.57 0.00 0.00 43.02 39.48 2dhi s PHE 8 CO 0.20 0.35 1.43 0.28 -0.10 0.00 0.00 175.22 177.38 2dhi h VAL 9 N 4.05 0.00 -3.93 -0.44 2.07 -0.07 -3.44 116.25 114.49 2dhi h VAL 9 Ca -0.45 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 66.77 2dhi h VAL 9 Cb 1.20 0.00 -0.25 0.00 -1.52 0.00 0.00 31.29 30.72 2dhi h VAL 9 CO 0.69 0.00 -0.74 -0.75 0.02 0.00 0.00 177.57 176.79 2dhi s LYS 10 N -5.12 0.46 0.00 1.57 2.20 -1.26 -5.00 119.74 112.60 2dhi s LYS 10 Ca -0.12 -0.44 0.01 0.00 -0.36 0.00 0.00 55.97 55.06 2dhi s LYS 10 Cb 0.05 -0.35 -0.01 0.00 -1.51 0.00 0.00 37.83 36.02 2dhi s LYS 10 CO 0.47 0.08 -0.04 -1.54 -0.36 0.00 0.00 175.35 173.96 2dhi s SER 11 N -0.77 0.51 -0.04 1.43 1.04 -1.26 -2.24 113.70 112.37 2dhi s SER 11 Ca -0.03 -0.16 -0.30 0.00 0.48 0.00 0.00 55.95 55.94 2dhi s SER 11 Cb -0.06 -0.03 0.11 0.00 0.10 0.00 0.00 66.02 66.15 2dhi s SER 11 CO 0.00 -0.00 1.32 -0.83 0.98 0.00 0.00 173.24 174.71 2dhi s GLY 12 N -0.36 -0.29 -0.03 7.32 0.00 -1.11 -5.03 107.32 107.83 2dhi s GLY 12 Ca -0.01 0.40 -0.16 0.00 0.00 0.00 0.00 44.72 44.95 2dhi s GLY 12 CO -0.00 3.23 0.43 -0.98 0.00 0.00 0.00 173.10 175.78 2dhi s TRP 13 N -2.13 3.68 -0.08 1.90 0.52 -1.26 -1.86 118.94 119.70 2dhi s TRP 13 Ca 0.23 0.98 -0.10 0.00 0.02 0.00 0.00 56.10 57.22 2dhi s TRP 13 Cb 0.03 -2.37 0.02 0.00 -1.15 0.00 0.00 33.47 30.00 2dhi s TRP 13 CO -0.03 0.52 0.27 -0.51 0.02 0.00 0.00 176.95 177.22 2dhi s LEU 14 N -0.63 0.97 -0.10 2.99 1.43 -0.50 -4.55 118.68 118.28 2dhi s LEU 14 Ca 0.24 0.43 -0.26 0.00 -1.03 0.00 0.00 54.13 53.51 2dhi s LEU 14 Cb -0.16 0.99 -0.02 0.00 0.03 0.00 0.00 46.19 47.02 2dhi s LEU 14 CO 0.13 -0.17 0.82 -0.76 0.23 0.00 0.00 176.35 176.60 2dhi s LEU 15 N -0.21 4.26 -0.21 1.79 1.43 -0.87 -0.13 118.68 124.75 2dhi s LEU 15 Ca -0.03 1.28 0.02 0.00 -1.03 0.00 0.00 54.13 54.36 2dhi s LEU 15 Cb -0.03 -3.26 0.04 0.00 0.03 0.00 0.00 46.19 42.97 2dhi s LEU 15 CO 0.01 -0.29 -0.15 -0.60 0.23 0.00 0.00 176.35 175.56 2dhi s ARG 16 N 1.52 2.50 -0.06 1.70 3.52 0.00 -0.94 118.95 127.19 2dhi s ARG 16 Ca 0.41 -0.98 -0.30 0.00 -0.13 0.00 0.00 55.73 54.73 2dhi s ARG 16 Cb -0.18 -2.61 -0.04 0.00 -1.56 0.00 0.00 34.95 30.56 2dhi s ARG 16 CO 0.17 -0.38 1.38 -1.14 -0.81 0.00 0.00 175.30 174.53 2dhi s GLN 17 N 1.26 4.26 0.45 5.12 0.74 -0.99 -2.91 119.66 127.59 2dhi s GLN 17 Ca -0.01 1.88 0.07 0.00 0.05 0.00 0.00 55.36 57.35 2dhi s GLN 17 Cb -0.16 -3.70 0.01 0.00 1.10 0.00 0.00 33.01 30.27 2dhi s GLN 17 CO -0.09 -0.64 0.61 0.45 -0.55 0.00 0.00 175.29 175.07 2dhi s SER 18 N 2.11 5.58 -0.04 6.67 0.15 -1.09 -4.64 113.70 122.44 2dhi s SER 18 Ca 0.62 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.93 2dhi s SER 18 Cb -0.28 -0.70 -0.26 0.00 -1.71 0.00 0.00 66.02 63.07 2dhi s SER 18 CO 0.23 -0.84 0.68 0.74 1.20 0.00 0.00 173.24 175.25 2dhi h THR 19 N 0.52 0.94 0.07 6.45 2.02 -1.95 -3.00 112.91 117.97 2dhi h THR 19 Ca -0.40 -2.66 -0.00 0.00 0.77 0.00 0.00 66.41 64.11 2dhi h THR 19 Cb 1.28 2.61 0.00 0.00 -1.74 0.00 0.00 68.15 70.30 2dhi h THR 19 CO 0.46 0.76 -0.03 0.40 0.37 0.00 0.00 175.52 177.48 2dhi h ILE 20 N 0.05 0.00 0.00 3.11 2.04 -1.98 -3.24 117.51 117.49 2dhi h ILE 20 Ca -0.30 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.46 2dhi h ILE 20 Cb 2.02 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 2dhi h ILE 20 CO 0.12 0.00 0.00 0.18 0.00 0.00 0.00 178.15 178.45 2dhi n LEU 21 N -2.53 0.00 -3.95 1.44 4.77 -1.26 -4.85 117.00 110.61 2dhi n LEU 21 Ca -0.01 0.41 -0.30 0.00 -0.03 0.00 0.00 56.01 56.08 2dhi n LEU 21 Cb 0.04 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.68 2dhi n LEU 21 CO 0.03 -0.30 -0.27 0.29 -1.33 0.00 0.00 177.39 175.82 2dhi n LYS 22 N -1.41 -0.71 -3.69 3.23 5.02 -1.13 -4.87 118.16 114.60 2dhi n LYS 22 Ca 0.03 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.27 2dhi n LYS 22 Cb 0.08 -2.27 -0.02 0.00 -0.02 0.00 0.00 35.03 32.80 2dhi n LYS 22 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2dhi s ARG 23 N -6.63 1.14 -0.11 1.97 1.70 -1.25 -4.96 118.95 110.81 2dhi s ARG 23 Ca 0.17 -0.58 -0.29 0.00 -0.47 0.00 0.00 55.73 54.55 2dhi s ARG 23 Cb -0.09 0.42 -0.01 0.00 -0.57 0.00 0.00 34.95 34.69 2dhi s ARG 23 CO 0.76 -0.52 1.00 -1.58 -1.08 0.00 0.00 175.30 173.88 2dhi s TRP 24 N -3.29 3.51 -0.08 5.89 0.52 -1.26 -2.67 118.94 121.55 2dhi s TRP 24 Ca 0.10 1.58 0.02 0.00 0.02 0.00 0.00 56.10 57.82 2dhi s TRP 24 Cb -0.01 -3.18 0.01 0.00 -1.15 0.00 0.00 33.47 29.14 2dhi s TRP 24 CO -0.01 -0.22 -0.15 -1.59 0.02 0.00 0.00 176.95 175.01 2dhi s LYS 25 N 1.98 2.07 0.21 4.98 -2.85 -1.15 -4.88 119.74 120.10 2dhi s LYS 25 Ca 0.48 -0.53 -0.31 0.00 -1.00 0.00 0.00 55.97 54.61 2dhi s LYS 25 Cb -0.18 -1.69 -0.10 0.00 -2.06 0.00 0.00 37.83 33.79 2dhi s LYS 25 CO 0.18 0.03 1.54 0.21 0.10 0.00 0.00 175.35 177.41 2dhi s LYS 26 N 0.71 4.21 0.32 1.78 2.47 -1.26 -0.82 119.74 127.15 2dhi s LYS 26 Ca -0.13 2.39 0.04 0.00 -1.56 0.00 0.00 55.97 56.71 2dhi s LYS 26 Cb -0.16 -3.12 -0.03 0.00 -1.46 0.00 0.00 37.83 33.06 2dhi s LYS 26 CO 0.03 -0.56 0.19 -0.80 0.16 0.00 0.00 175.35 174.37 2dhi s ASN 27 N 0.82 1.65 -0.27 1.43 0.02 0.82 -4.86 114.94 114.56 2dhi s ASN 27 Ca 0.66 -1.62 -0.02 0.00 -1.02 0.00 0.00 52.86 50.87 2dhi s ASN 27 Cb -0.44 0.45 0.03 0.00 0.02 0.00 0.00 41.25 41.31 2dhi s ASN 27 CO 0.37 -0.94 -0.04 0.86 0.02 0.00 0.00 177.10 177.37 2dhi s TRP 28 N -3.55 3.14 0.06 2.20 -0.11 -0.91 -1.41 118.94 118.36 2dhi s TRP 28 Ca 0.36 -1.67 0.00 0.00 1.22 0.00 0.00 56.10 56.00 2dhi s TRP 28 Cb 0.04 -2.07 -0.04 0.00 -1.50 0.00 0.00 33.47 29.90 2dhi s TRP 28 CO 0.19 -0.76 0.21 -0.06 -4.62 0.00 0.00 176.95 171.92 2dhi s PHE 29 N 1.30 3.51 -0.26 5.86 0.40 -0.78 0.13 117.98 128.15 2dhi s PHE 29 Ca -0.02 0.24 -0.04 0.00 -0.60 0.00 0.00 56.93 56.52 2dhi s PHE 29 Cb -0.18 -1.75 0.14 0.00 0.51 0.00 0.00 43.02 41.74 2dhi s PHE 29 CO -0.03 0.59 0.47 -0.51 0.70 0.00 0.00 175.22 176.44 2dhi s ASP 30 N -2.53 -0.45 0.15 1.36 1.11 -0.68 -2.74 116.67 112.89 2dhi s ASP 30 Ca 0.35 0.69 -0.23 0.00 0.18 0.00 0.00 52.55 53.54 2dhi s ASP 30 Cb -0.13 1.57 -0.08 0.00 1.07 0.00 0.00 42.92 45.36 2dhi s ASP 30 CO 0.28 -0.27 0.71 -0.22 1.18 0.00 0.00 175.17 176.85 2dhi s LEU 31 N 2.68 4.55 0.37 1.23 2.96 -0.95 -2.13 118.68 127.39 2dhi s LEU 31 Ca 0.11 1.51 0.01 0.00 -0.22 0.00 0.00 54.13 55.53 2dhi s LEU 31 Cb -0.14 -3.22 -0.03 0.00 0.50 0.00 0.00 46.19 43.30 2dhi s LEU 31 CO -0.17 0.21 0.57 0.26 -1.32 0.00 0.00 176.35 175.90 2dhi s TRP 32 N -1.19 3.42 0.34 5.38 0.52 0.15 0.62 118.94 128.18 2dhi s TRP 32 Ca 0.35 0.30 0.26 0.00 0.02 0.00 0.00 56.10 57.03 2dhi s TRP 32 Cb -0.21 -1.99 1.30 0.00 -1.15 0.00 0.00 33.47 31.41 2dhi s TRP 32 CO 0.24 0.01 2.00 0.66 0.02 0.00 0.00 176.95 179.87 2dhi h SER 33 N 0.67 0.00 -0.36 2.95 4.64 -1.85 -1.54 113.55 118.06 2dhi h SER 33 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2dhi h SER 33 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2dhi h SER 33 CO 0.60 0.15 0.00 0.47 -0.87 0.00 0.00 176.83 177.18 2dhi n ASP 34 N -3.57 1.95 0.00 4.97 8.00 -1.26 -4.91 116.55 121.73 2dhi n ASP 34 Ca -0.01 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.49 2dhi n ASP 34 Cb 0.29 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.15 2dhi n ASP 34 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dhi n GLY 35 N 1.08 2.56 3.49 0.44 0.00 -0.58 -4.98 105.19 107.20 2dhi n GLY 35 Ca 0.12 -0.56 -0.51 0.00 0.00 0.00 0.00 46.02 45.07 2dhi n GLY 35 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dhi n HIS 36 N 0.00 0.49 -5.17 1.61 8.25 -1.26 -4.05 115.22 115.10 2dhi n HIS 36 Ca 0.00 0.89 -0.32 0.00 -0.26 0.00 0.00 57.72 58.04 2dhi n HIS 36 Cb 0.00 -2.11 -0.17 0.00 1.12 0.00 0.00 29.99 28.83 2dhi n HIS 36 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2dhi s LEU 37 N 1.24 2.08 -0.02 2.41 2.96 -0.37 0.32 118.68 127.29 2dhi s LEU 37 Ca 0.75 -0.56 0.01 0.00 -0.22 0.00 0.00 54.13 54.11 2dhi s LEU 37 Cb -1.00 -1.40 0.01 0.00 0.50 0.00 0.00 46.19 44.31 2dhi s LEU 37 CO 0.55 0.15 -0.04 -0.63 -1.32 0.00 0.00 176.35 175.07 2dhi s ILE 38 N 0.38 0.37 0.13 6.68 1.01 -0.90 -1.02 121.20 127.86 2dhi s ILE 38 Ca -0.18 -0.11 0.09 0.00 0.00 0.00 0.00 60.65 60.45 2dhi s ILE 38 Cb -0.18 -0.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.88 2dhi s ILE 38 CO 0.08 0.15 -0.21 -0.72 0.00 0.00 0.00 174.94 174.24 2dhi s TYR 39 N 0.44 1.92 0.53 3.97 1.13 -1.16 -1.69 117.35 122.49 2dhi s TYR 39 Ca -0.05 -0.42 0.02 0.00 -1.41 0.00 0.00 57.07 55.21 2dhi s TYR 39 Cb -0.08 -1.01 0.01 0.00 -1.10 0.00 0.00 41.96 39.77 2dhi s TYR 39 CO -0.00 0.29 0.11 0.71 -2.51 0.00 0.00 175.55 174.15 2dhi s TYR 40 N -1.48 1.76 -0.27 -3.49 1.51 0.12 -1.28 117.35 114.22 2dhi s TYR 40 Ca 0.12 -0.94 0.19 0.00 -1.01 0.00 0.00 57.07 55.42 2dhi s TYR 40 Cb -0.08 -1.68 0.15 0.00 -0.11 0.00 0.00 41.96 40.24 2dhi s TYR 40 CO 0.06 0.03 1.44 0.22 -1.11 0.00 0.00 175.55 176.18 2dhi h ASP 41 N 1.16 0.00 -1.81 2.29 3.58 -1.85 -2.42 116.42 117.37 2dhi h ASP 41 Ca -0.42 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.06 2dhi h ASP 41 Cb 1.32 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.36 2dhi h ASP 41 CO 0.69 0.28 0.21 0.47 -2.88 0.00 0.00 179.24 178.01 2dhi n ASP 42 N -3.12 -1.04 -1.97 2.28 8.00 -1.26 -4.62 116.55 114.83 2dhi n ASP 42 Ca 0.02 -1.66 -0.08 0.00 0.71 0.00 0.00 54.79 53.79 2dhi n ASP 42 Cb 0.65 1.72 -0.11 0.00 -0.02 0.00 0.00 41.12 43.36 2dhi n ASP 42 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dhi n GLN 43 N -0.31 1.47 -0.00 -1.24 0.00 -1.26 -3.53 117.38 112.51 2dhi n GLN 43 Ca -0.03 -0.64 0.03 0.00 0.00 0.00 0.00 57.00 56.36 2dhi n GLN 43 Cb 0.30 -1.72 -0.04 0.00 0.00 0.00 0.00 30.24 28.77 2dhi n GLN 43 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2dhi n THR 44 N 2.35 0.00 -2.45 -0.39 -2.24 -1.26 -4.98 114.28 105.31 2dhi n THR 44 Ca 0.28 -0.26 -0.01 0.00 -2.27 0.00 0.00 64.05 61.79 2dhi n THR 44 Cb 0.69 0.70 -0.00 0.00 -2.10 0.00 0.00 70.33 69.62 2dhi n THR 44 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dhi n ARG 45 N -1.40 -2.86 -0.00 -0.78 1.74 -1.23 -4.63 116.66 107.50 2dhi n ARG 45 Ca 0.00 0.06 -0.00 0.00 -0.77 0.00 0.00 57.85 57.13 2dhi n ARG 45 Cb 0.12 -4.55 -0.01 0.00 -1.02 0.00 0.00 32.46 27.00 2dhi n ARG 45 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dhi n GLN 46 N -2.48 2.59 -3.29 5.56 10.64 -1.26 -4.85 117.38 124.28 2dhi n GLN 46 Ca -0.01 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.74 2dhi n GLN 46 Cb 0.50 -1.02 -0.01 0.00 -0.86 0.00 0.00 30.24 28.84 2dhi n GLN 46 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2dhi n SER 47 N -2.20 5.50 -4.63 2.61 7.64 -1.26 -5.03 113.62 116.26 2dhi n SER 47 Ca -0.01 -3.19 -0.47 0.00 1.01 0.00 0.00 58.87 56.20 2dhi n SER 47 Cb 0.52 -1.25 -0.05 0.00 -1.01 0.00 0.00 64.21 62.42 2dhi n SER 47 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2dhi n ILE 48 N 2.09 0.51 -0.03 0.44 5.41 -1.26 -3.07 119.36 123.44 2dhi n ILE 48 Ca 0.25 -0.19 -0.14 0.00 1.00 0.00 0.00 62.75 63.66 2dhi n ILE 48 Cb 0.37 -2.01 -0.10 0.00 -0.71 0.00 0.00 39.64 37.19 2dhi n ILE 48 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2dhi h GLU 49 N 10.85 0.13 -2.15 0.38 4.39 -1.48 -3.48 114.58 123.23 2dhi h GLU 49 Ca -0.44 -0.11 0.22 0.00 0.34 0.00 0.00 59.36 59.37 2dhi h GLU 49 Cb 1.27 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.86 2dhi h GLU 49 CO 0.96 0.76 0.60 0.34 -1.16 0.00 0.00 179.01 180.51 2dhi s ASP 50 N -6.08 -0.10 -0.03 1.42 2.15 -1.18 -5.06 116.67 107.80 2dhi s ASP 50 Ca -0.16 -0.39 -0.01 0.00 0.43 0.00 0.00 52.55 52.42 2dhi s ASP 50 Cb 0.01 0.40 0.02 0.00 -0.30 0.00 0.00 42.92 43.06 2dhi s ASP 50 CO 0.72 -0.75 0.05 -0.75 -0.17 0.00 0.00 175.17 174.26 2dhi s LYS 51 N -2.81 0.02 -0.17 4.34 2.20 -1.26 -2.97 119.74 119.08 2dhi s LYS 51 Ca 0.15 0.16 -0.14 0.00 -0.36 0.00 0.00 55.97 55.79 2dhi s LYS 51 Cb -0.00 -0.13 0.05 0.00 -1.51 0.00 0.00 37.83 36.24 2dhi s LYS 51 CO 0.01 -0.10 0.45 0.08 -0.36 0.00 0.00 175.35 175.43 2dhi s VAL 52 N 0.67 -0.01 0.69 4.02 1.01 -0.19 -5.03 120.40 121.57 2dhi s VAL 52 Ca -0.05 0.02 -0.09 0.00 0.00 0.00 0.00 61.98 61.86 2dhi s VAL 52 Cb -0.08 -0.64 0.03 0.00 0.00 0.00 0.00 36.38 35.70 2dhi s VAL 52 CO -0.02 0.01 1.05 -2.28 0.00 0.00 0.00 175.10 173.85 2dhi s HIS 53 N 0.58 3.17 0.00 5.22 2.46 -1.26 -1.24 115.29 124.22 2dhi s HIS 53 Ca -0.03 0.79 0.00 0.00 0.47 0.00 0.00 55.06 56.29 2dhi s HIS 53 Cb -0.05 -3.08 0.00 0.00 -0.13 0.00 0.00 32.58 29.33 2dhi s HIS 53 CO -0.04 -1.23 0.00 -1.33 -2.47 0.00 0.00 174.74 169.67 2dhi n MET 54 N -2.94 0.00 0.00 2.88 2.81 -1.26 -2.46 117.12 116.15 2dhi n MET 54 Ca 0.07 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 56.01 2dhi n MET 54 Cb 0.58 -0.47 0.31 0.00 -0.71 0.00 0.00 33.22 32.93 2dhi n MET 54 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2dhi n PRO 55 N -2.50 0.49 0.00 0.03 -0.04 -1.26 -1.65 135.00 130.07 2dhi n PRO 55 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2dhi n PRO 55 Cb 0.00 -1.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2dhi n PRO 55 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2dhi n VAL 56 N -0.83 0.04 -0.05 0.52 0.31 -1.26 -4.92 118.33 112.13 2dhi n VAL 56 Ca 0.08 0.01 -0.02 0.00 -0.01 0.00 0.00 64.34 64.40 2dhi n VAL 56 Cb 0.04 -1.38 -0.01 0.00 -0.91 0.00 0.00 33.84 31.58 2dhi n VAL 56 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 2dhi h ASP 57 N 0.00 0.00 -3.34 4.52 1.82 -1.57 -3.46 116.42 114.39 2dhi h ASP 57 Ca 0.00 0.00 -0.52 0.00 -0.39 0.00 0.00 57.03 56.12 2dhi h ASP 57 Cb 0.85 0.00 0.03 0.00 0.68 0.00 0.00 39.33 40.89 2dhi h ASP 57 CO 0.00 0.50 0.66 0.00 -1.61 0.00 0.00 179.24 178.80 2dhi n ILE 59 N 2.77 0.55 -4.11 0.00 -5.35 0.11 -4.40 119.36 108.93 2dhi n ILE 59 Ca 0.07 -0.39 -0.08 0.00 -0.27 0.00 0.00 62.75 62.08 2dhi n ILE 59 Cb 0.43 -0.52 -0.10 0.00 -1.74 0.00 0.00 39.64 37.71 2dhi n ILE 59 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2dhi s ASN 60 N -4.04 0.45 -0.05 7.28 3.84 -1.17 -5.04 114.94 116.21 2dhi s ASN 60 Ca -0.05 -1.06 0.00 0.00 0.21 0.00 0.00 52.86 51.96 2dhi s ASN 60 Cb 0.04 0.23 0.02 0.00 -0.55 0.00 0.00 41.25 40.99 2dhi s ASN 60 CO 0.42 -0.64 -0.02 -0.63 -2.79 0.00 0.00 177.10 173.45 2dhi s ILE 61 N -3.95 0.42 0.09 -5.21 1.01 -1.26 -1.38 121.20 110.92 2dhi s ILE 61 Ca 0.12 -0.01 0.08 0.00 0.00 0.00 0.00 60.65 60.83 2dhi s ILE 61 Cb 0.08 -0.50 -0.03 0.00 0.01 0.00 0.00 42.46 42.01 2dhi s ILE 61 CO -0.06 0.22 -0.20 -0.13 0.00 0.00 0.00 174.94 174.76 2dhi s ARG 62 N 1.23 1.14 0.04 2.79 0.52 -1.11 -5.02 118.95 118.54 2dhi s ARG 62 Ca -0.06 -1.09 0.00 0.00 -0.52 0.00 0.00 55.73 54.06 2dhi s ARG 62 Cb -0.14 -1.36 -0.03 0.00 0.52 0.00 0.00 34.95 33.95 2dhi s ARG 62 CO -0.02 0.32 -0.04 0.95 0.02 0.00 0.00 175.30 176.53 2dhi s THR 63 N -1.09 0.27 0.00 0.02 -4.23 -1.26 -0.90 115.64 108.45 2dhi s THR 63 Ca 0.06 -1.18 0.00 0.00 -1.18 0.00 0.00 61.69 59.39 2dhi s THR 63 Cb -0.10 -0.66 0.00 0.00 1.34 0.00 0.00 72.50 73.08 2dhi s THR 63 CO 0.04 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 2dhi n GLY 64 N 1.19 2.65 0.40 3.99 0.00 -0.91 -1.62 105.19 110.88 2dhi n GLY 64 Ca -0.21 -0.32 0.19 0.00 0.00 0.00 0.00 46.02 45.67 2dhi n GLY 64 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2dhi h HIS 65 N 0.00 0.65 -1.05 1.61 -0.00 -1.94 0.86 115.15 115.28 2dhi h HIS 65 Ca 0.00 0.02 0.28 0.00 -0.00 0.00 0.00 60.37 60.67 2dhi h HIS 65 Cb 0.00 -0.20 -0.08 0.00 -0.00 0.00 0.00 27.41 27.13 2dhi h HIS 65 CO 0.00 0.15 0.69 0.93 -0.00 0.00 0.00 177.93 179.71 2dhi h GLU 66 N 0.47 0.29 -7.03 2.45 5.08 -1.69 -3.42 114.58 110.73 2dhi h GLU 66 Ca 0.51 -0.02 -0.48 0.00 -1.00 0.00 0.00 59.36 58.37 2dhi h GLU 66 Cb 1.18 -0.07 0.21 0.00 0.50 0.00 0.00 28.75 30.57 2dhi h GLU 66 CO -0.23 0.19 -0.22 0.00 -1.00 0.00 0.00 179.01 177.76 2dhi n ARG 68 N -3.68 -1.14 -0.60 0.00 5.12 -1.26 -4.66 116.66 110.43 2dhi n ARG 68 Ca 0.06 -0.39 -0.05 0.00 -1.93 0.00 0.00 57.85 55.55 2dhi n ARG 68 Cb 0.55 -0.68 -0.07 0.00 -1.16 0.00 0.00 32.46 31.09 2dhi n ARG 68 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2dhi n ASP 69 N -1.99 4.16 -3.17 0.55 8.00 -1.26 -4.84 116.55 117.99 2dhi n ASP 69 Ca 0.04 -2.19 -0.12 0.00 0.71 0.00 0.00 54.79 53.22 2dhi n ASP 69 Cb 0.16 -1.01 0.07 0.00 -0.02 0.00 0.00 41.12 40.32 2dhi n ASP 69 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2dhi n ILE 70 N 2.13 0.00 -3.83 0.53 -5.35 -1.26 -5.13 119.36 106.46 2dhi n ILE 70 Ca 0.18 -0.70 -0.12 0.00 -0.27 0.00 0.00 62.75 61.83 2dhi n ILE 70 Cb 0.57 -1.28 -0.12 0.00 -1.74 0.00 0.00 39.64 37.06 2dhi n ILE 70 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dhi s GLN 71 N -3.88 0.23 0.66 6.28 0.00 -1.26 -5.13 119.66 116.56 2dhi s GLN 71 Ca 0.33 0.12 -0.15 0.00 -0.00 0.00 0.00 55.36 55.66 2dhi s GLN 71 Cb -0.02 0.11 0.00 0.00 0.00 0.00 0.00 33.01 33.10 2dhi s GLN 71 CO 0.23 -0.04 1.11 -1.25 0.00 0.00 0.00 175.29 175.34 2dhi s PRO 72 N -0.15 2.78 0.00 9.60 0.04 -1.26 -5.06 135.00 140.95 2dhi s PRO 72 Ca -0.02 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.40 2dhi s PRO 72 Cb -0.02 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2dhi s PRO 72 CO 0.00 -1.26 0.00 -0.35 0.04 0.00 0.00 177.00 175.43 2dhi n PRO 73 N -2.45 0.07 -2.84 0.56 -0.04 -1.26 -4.98 135.00 124.05 2dhi n PRO 73 Ca 0.10 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.23 2dhi n PRO 73 Cb 0.52 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.91 2dhi n PRO 73 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dhi s ASP 74 N -1.51 6.96 -1.61 3.54 1.11 -1.26 -3.90 116.67 120.00 2dhi s ASP 74 Ca 0.00 1.67 -0.12 0.00 0.18 0.00 0.00 52.55 54.28 2dhi s ASP 74 Cb 0.00 -2.53 0.10 0.00 1.07 0.00 0.00 42.92 41.56 2dhi s ASP 74 CO 0.00 -0.32 0.61 0.61 1.18 0.00 0.00 175.17 177.25 2dhi n GLY 75 N -0.52 -0.35 3.06 0.21 0.00 -1.26 -4.95 105.19 101.38 2dhi n GLY 75 Ca 0.06 0.14 -0.12 0.00 0.00 0.00 0.00 46.02 46.10 2dhi n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dhi s LYS 76 N -6.87 0.21 1.10 1.61 -0.14 -1.25 -5.15 119.74 109.25 2dhi s LYS 76 Ca 0.47 0.48 -0.16 0.00 -1.36 0.00 0.00 55.97 55.41 2dhi s LYS 76 Cb -0.26 -0.08 0.24 0.00 -1.68 0.00 0.00 37.83 36.06 2dhi s LYS 76 CO 0.93 -0.14 1.10 -1.25 -0.76 0.00 0.00 175.35 175.23 2dhi s PRO 77 N 1.04 -0.42 -0.04 -1.68 0.04 -1.26 -4.65 135.00 128.03 2dhi s PRO 77 Ca -0.08 0.23 0.19 0.00 0.04 0.00 0.00 61.00 61.38 2dhi s PRO 77 Cb -0.09 -1.66 0.62 0.00 0.04 0.00 0.00 34.50 33.41 2dhi s PRO 77 CO -0.07 -3.24 1.52 -2.13 0.04 0.00 0.00 177.00 173.13 2dhi n ARG 78 N -4.48 3.08 -0.00 4.56 0.63 -1.26 -4.15 116.66 115.04 2dhi n ARG 78 Ca 0.09 -2.66 0.08 0.00 -0.92 0.00 0.00 57.85 54.44 2dhi n ARG 78 Cb 0.58 -1.64 -0.10 0.00 0.45 0.00 0.00 32.46 31.75 2dhi n ARG 78 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2dhi n ASP 79 N 1.26 0.88 -1.10 6.15 9.92 -1.26 -4.06 116.55 128.34 2dhi n ASP 79 Ca 0.23 -0.62 0.12 0.00 -0.53 0.00 0.00 54.79 53.99 2dhi n ASP 79 Cb 0.69 1.24 0.24 0.00 -0.64 0.00 0.00 41.12 42.64 2dhi n ASP 79 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dhi s LEU 81 N -1.46 4.43 -0.03 0.00 1.43 -1.26 -1.17 118.68 120.61 2dhi s LEU 81 Ca 0.39 2.18 0.02 0.00 -1.03 0.00 0.00 54.13 55.68 2dhi s LEU 81 Cb 0.22 -3.81 0.01 0.00 0.03 0.00 0.00 46.19 42.65 2dhi s LEU 81 CO 0.31 -0.24 -0.06 -0.22 0.23 0.00 0.00 176.35 176.37 2dhi s LEU 82 N -1.82 1.63 0.09 1.79 2.96 -0.03 -2.15 118.68 121.15 2dhi s LEU 82 Ca 0.49 -0.14 0.04 0.00 -0.22 0.00 0.00 54.13 54.30 2dhi s LEU 82 Cb -0.28 -0.45 -0.03 0.00 0.50 0.00 0.00 46.19 45.93 2dhi s LEU 82 CO 0.36 0.01 -0.12 -1.58 -1.32 0.00 0.00 176.35 173.70 2dhi s GLN 83 N 0.45 0.85 -0.06 1.98 0.74 -0.08 0.78 119.66 124.32 2dhi s GLN 83 Ca -0.06 -1.08 0.01 0.00 0.05 0.00 0.00 55.36 54.27 2dhi s GLN 83 Cb -0.10 -0.68 0.02 0.00 1.10 0.00 0.00 33.01 33.35 2dhi s GLN 83 CO 0.00 0.13 -0.06 0.42 -0.55 0.00 0.00 175.29 175.23 2dhi s ILE 84 N -1.95 0.71 -0.26 -2.34 -1.09 -1.05 -2.77 121.20 112.44 2dhi s ILE 84 Ca 0.03 -0.20 -0.15 0.00 -2.23 0.00 0.00 60.65 58.10 2dhi s ILE 84 Cb -0.06 -0.72 -0.04 0.00 -1.58 0.00 0.00 42.46 40.06 2dhi s ILE 84 CO 0.01 0.27 0.37 -0.69 -1.23 0.00 0.00 174.94 173.68 2dhi s VAL 85 N 1.05 5.18 0.48 2.92 1.01 -0.48 -2.44 120.40 128.11 2dhi s VAL 85 Ca -0.09 0.58 -0.03 0.00 0.00 0.00 0.00 61.98 62.44 2dhi s VAL 85 Cb -0.14 -3.70 0.10 0.00 0.00 0.00 0.00 36.38 32.64 2dhi s VAL 85 CO -0.00 0.17 0.65 0.00 0.00 0.00 0.00 175.10 175.91 2dhi n ARG 87 N -2.27 0.14 -1.77 0.00 1.74 -0.85 -4.05 116.66 109.60 2dhi n ARG 87 Ca 0.10 -0.08 -0.33 0.00 -0.77 0.00 0.00 57.85 56.76 2dhi n ARG 87 Cb 0.34 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.33 2dhi n ARG 87 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2dhi n ASP 88 N -1.36 6.75 -1.30 0.55 8.00 -1.26 -4.87 116.55 123.07 2dhi n ASP 88 Ca 0.07 -3.79 -0.08 0.00 0.71 0.00 0.00 54.79 51.70 2dhi n ASP 88 Cb 0.34 -0.82 -0.03 0.00 -0.02 0.00 0.00 41.12 40.59 2dhi n ASP 88 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dhi n GLY 89 N -0.72 0.66 3.90 0.44 0.00 -1.26 -4.89 105.19 103.32 2dhi n GLY 89 Ca 0.54 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.28 2dhi n GLY 89 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dhi s LYS 90 N -2.80 3.63 -0.03 1.61 2.20 -1.26 -4.96 119.74 118.13 2dhi s LYS 90 Ca 0.00 0.14 -0.01 0.00 -0.36 0.00 0.00 55.97 55.74 2dhi s LYS 90 Cb 0.00 -2.51 0.03 0.00 -1.51 0.00 0.00 37.83 33.84 2dhi s LYS 90 CO 0.00 0.03 0.05 0.99 -0.36 0.00 0.00 175.35 176.06 2dhi s THR 91 N -2.35 -0.07 -0.25 3.43 2.01 -1.26 -2.14 115.64 115.01 2dhi s THR 91 Ca 0.46 0.24 -0.06 0.00 0.31 0.00 0.00 61.69 62.65 2dhi s THR 91 Cb -0.10 -0.11 -0.01 0.00 0.01 0.00 0.00 72.50 72.29 2dhi s THR 91 CO 0.35 0.10 0.02 -0.63 -0.69 0.00 0.00 174.62 173.77 2dhi s ILE 92 N 1.23 3.78 -0.20 1.82 1.01 -1.02 -4.98 121.20 122.84 2dhi s ILE 92 Ca -0.07 -0.47 -0.22 0.00 0.00 0.00 0.00 60.65 59.89 2dhi s ILE 92 Cb -0.13 -2.81 -0.02 0.00 0.01 0.00 0.00 42.46 39.52 2dhi s ILE 92 CO -0.03 0.30 0.67 -0.44 0.00 0.00 0.00 174.94 175.44 2dhi s SER 93 N 1.52 6.72 0.24 3.58 0.01 -1.26 -2.54 113.70 121.97 2dhi s SER 93 Ca 0.05 0.88 0.05 0.00 1.31 0.00 0.00 55.95 58.24 2dhi s SER 93 Cb -0.15 -2.37 -0.05 0.00 0.21 0.00 0.00 66.02 63.66 2dhi s SER 93 CO 0.00 -0.32 -0.05 -0.76 0.41 0.00 0.00 173.24 172.52 2dhi s LEU 94 N 2.09 2.38 -0.07 2.44 1.43 0.23 -2.36 118.68 124.83 2dhi s LEU 94 Ca 0.30 -1.17 -0.05 0.00 -1.03 0.00 0.00 54.13 52.17 2dhi s LEU 94 Cb -0.16 -0.47 0.02 0.00 0.03 0.00 0.00 46.19 45.61 2dhi s LEU 94 CO 0.10 -0.40 0.17 0.00 0.23 0.00 0.00 176.35 176.45 2dhi s ALA 96 N 0.37 3.48 0.26 0.00 0.00 -0.32 -2.05 121.76 123.50 2dhi s ALA 96 Ca -0.02 -0.79 -0.04 0.00 0.00 0.00 0.00 51.96 51.11 2dhi s ALA 96 Cb -0.04 -1.60 0.52 0.00 0.00 0.00 0.00 23.12 21.99 2dhi s ALA 96 CO -0.02 0.62 1.38 -1.91 0.00 0.00 0.00 175.76 175.83 2dhi n GLU 97 N 1.89 -0.08 -3.99 0.00 2.13 -1.26 -4.62 120.64 114.72 2dhi n GLU 97 Ca -0.18 1.36 -0.10 0.00 0.66 0.00 0.00 57.16 58.91 2dhi n GLU 97 Cb 0.54 -2.08 -0.07 0.00 0.27 0.00 0.00 31.44 30.09 2dhi n GLU 97 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2dhi s SER 98 N -5.14 0.07 0.19 4.31 1.04 -1.26 -4.97 113.70 107.94 2dhi s SER 98 Ca -0.13 -0.92 -0.21 0.00 0.48 0.00 0.00 55.95 55.17 2dhi s SER 98 Cb 0.25 0.42 0.12 0.00 0.10 0.00 0.00 66.02 66.91 2dhi s SER 98 CO 0.69 -0.88 1.58 0.74 0.98 0.00 0.00 173.24 176.36 2dhi h THR 99 N 2.58 0.16 -0.78 2.02 2.02 -1.86 0.15 112.91 117.20 2dhi h THR 99 Ca -0.32 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.03 2dhi h THR 99 Cb 1.23 0.16 -0.11 0.00 -1.74 0.00 0.00 68.15 67.68 2dhi h THR 99 CO 0.49 0.00 0.25 0.44 0.37 0.00 0.00 175.52 177.07 2dhi h ASP 100 N -0.16 0.12 -0.61 4.18 3.32 -1.96 0.82 116.42 122.13 2dhi h ASP 100 Ca 0.23 0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.41 2dhi h ASP 100 Cb 0.55 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.24 2dhi h ASP 100 CO -0.69 -0.01 0.33 0.44 -1.72 0.00 0.00 179.24 177.59 2dhi h ASP 101 N 0.33 0.77 0.31 6.45 5.19 -1.13 -2.01 116.42 126.33 2dhi h ASP 101 Ca 0.45 -0.10 -0.02 0.00 -0.62 0.00 0.00 57.03 56.74 2dhi h ASP 101 Cb 0.78 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 40.10 2dhi h ASP 101 CO -0.50 0.65 -0.15 0.00 -3.12 0.00 0.00 179.24 176.12 2dhi h LEU 103 N -0.50 -0.27 -0.61 0.00 3.38 -0.95 -0.26 115.31 116.11 2dhi h LEU 103 Ca -0.04 0.12 0.12 0.00 0.09 0.00 0.00 57.88 58.17 2dhi h LEU 103 Cb 0.37 0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.25 2dhi h LEU 103 CO 0.07 -0.09 0.06 0.00 0.09 0.00 0.00 178.44 178.57 2dhi h ALA 104 N 1.43 0.66 -0.24 1.53 0.00 -1.26 0.19 119.26 121.57 2dhi h ALA 104 Ca 0.23 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 2dhi h ALA 104 Cb 0.35 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2dhi h ALA 104 CO -0.42 -0.36 0.05 -1.49 0.00 0.00 0.00 179.25 177.04 2dhi h TRP 105 N 0.18 0.41 -0.30 0.00 -0.00 -0.94 -1.96 115.95 113.33 2dhi h TRP 105 Ca 0.32 -0.05 0.03 0.00 -0.00 0.00 0.00 58.89 59.19 2dhi h TRP 105 Cb 0.50 -0.11 -0.03 0.00 -0.00 0.00 0.00 29.16 29.52 2dhi h TRP 105 CO -0.31 0.49 0.09 -0.22 -0.00 0.00 0.00 178.44 178.49 2dhi h LYS 106 N 0.21 0.21 0.07 0.49 3.64 -0.09 0.25 116.57 121.35 2dhi h LYS 106 Ca 0.07 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2dhi h LYS 106 Cb 0.29 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 2dhi h LYS 106 CO 0.00 0.14 -0.11 0.74 -2.27 0.00 0.00 179.45 177.95 2dhi h PHE 107 N 0.22 -0.29 -0.57 1.91 0.04 -0.58 0.35 116.94 118.01 2dhi h PHE 107 Ca 0.13 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.88 2dhi h PHE 107 Cb 0.11 0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.35 2dhi h PHE 107 CO -0.14 -0.17 0.26 1.15 -0.60 0.00 0.00 178.31 178.81 2dhi h THR 108 N -0.23 1.20 -0.01 -1.55 2.02 -1.09 0.85 112.91 114.11 2dhi h THR 108 Ca 0.02 -0.57 -0.14 0.00 0.77 0.00 0.00 66.41 66.49 2dhi h THR 108 Cb 0.24 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 2dhi h THR 108 CO -0.06 0.23 -0.64 -0.07 0.37 0.00 0.00 175.52 175.35 2dhi h LEU 109 N 0.81 0.03 0.08 2.58 3.38 -0.02 0.91 115.31 123.09 2dhi h LEU 109 Ca 0.20 -0.02 -0.28 0.00 0.09 0.00 0.00 57.88 57.87 2dhi h LEU 109 Cb 0.11 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 40.87 2dhi h LEU 109 CO -0.02 0.67 -1.22 1.56 0.09 0.00 0.00 178.44 179.51 2dhi h GLN 110 N 0.02 0.43 0.00 1.13 1.08 0.38 -2.97 115.11 115.18 2dhi h GLN 110 Ca -0.01 -0.63 -0.01 0.00 -1.45 0.00 0.00 58.65 56.55 2dhi h GLN 110 Cb 1.14 0.22 -0.00 0.00 -0.05 0.00 0.00 27.48 28.79 2dhi h GLN 110 CO 0.09 1.27 -0.35 0.22 -0.95 0.00 0.00 178.83 179.11 2dhi h ASP 111 N 0.17 0.00 1.75 1.46 1.82 -0.83 -3.08 116.42 117.70 2dhi h ASP 111 Ca -0.16 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.45 2dhi h ASP 111 Cb 1.91 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.92 2dhi h ASP 111 CO 0.22 0.06 -0.25 0.77 -1.61 0.00 0.00 179.24 178.43 2dhi h SER 112 N 0.00 0.00 0.51 2.28 4.64 -0.86 -3.28 113.55 116.84 2dhi h SER 112 Ca -0.01 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.02 2dhi h SER 112 Cb 1.05 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.10 2dhi h SER 112 CO 0.01 0.15 -1.63 0.08 -0.87 0.00 0.00 176.83 174.57 2dhi h ARG 113 N 0.00 0.05 -1.67 4.77 0.11 -1.55 -3.36 114.38 112.74 2dhi h ARG 113 Ca -0.01 -0.09 -0.37 0.00 0.10 0.00 0.00 59.98 59.62 2dhi h ARG 113 Cb 1.12 0.03 -0.15 0.00 1.11 0.00 0.00 29.97 32.09 2dhi h ARG 113 CO 0.02 0.69 0.39 0.25 0.10 0.00 0.00 179.97 181.42 2dhi n THR 114 N -3.17 2.94 -2.50 0.08 -2.24 -1.16 -4.68 114.28 103.55 2dhi n THR 114 Ca -0.16 -2.03 -0.43 0.00 -2.27 0.00 0.00 64.05 59.16 2dhi n THR 114 Cb 1.04 -1.43 -0.02 0.00 -2.10 0.00 0.00 70.33 67.82 2dhi n THR 114 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2dhi s SER 115 N 0.27 6.48 0.00 3.42 1.04 -1.26 -4.73 113.70 118.92 2dhi s SER 115 Ca 0.40 0.54 0.00 0.00 0.48 0.00 0.00 55.95 57.37 2dhi s SER 115 Cb 0.29 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.86 2dhi s SER 115 CO -0.07 -1.37 0.00 0.61 0.98 0.00 0.00 173.24 173.39 2dhi n GLY 116 N 4.98 -0.52 0.00 7.32 0.00 -1.26 -5.01 105.19 110.70 2dhi n GLY 116 Ca 0.13 0.40 0.07 0.00 0.00 0.00 0.00 46.02 46.62 2dhi n GLY 116 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dhi n PRO 117 N 0.00 0.10 -1.83 1.61 -0.04 -1.26 -4.78 135.00 128.79 2dhi n PRO 117 Ca 0.00 0.20 -0.32 0.00 -0.04 0.00 0.00 63.50 63.35 2dhi n PRO 117 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 2dhi n PRO 117 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dhi s SER 118 N -2.80 5.74 -0.13 3.54 1.04 -1.26 -5.08 113.70 114.75 2dhi s SER 118 Ca 0.10 1.64 -0.22 0.00 0.48 0.00 0.00 55.95 57.95 2dhi s SER 118 Cb 0.10 -2.50 0.05 0.00 0.10 0.00 0.00 66.02 63.77 2dhi s SER 118 CO 0.24 -1.20 0.55 -0.94 0.98 0.00 0.00 173.24 172.87 2dhi s SER 119 N -3.49 -0.53 0.00 7.02 1.04 -1.26 -5.21 113.70 111.26 2dhi s SER 119 Ca 0.59 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.85 2dhi s SER 119 Cb -0.14 0.83 0.00 0.00 0.10 0.00 0.00 66.02 66.82 2dhi s SER 119 CO 0.47 -0.35 0.26 0.61 0.98 0.00 0.00 173.24 175.21