#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 -0.56 1.61 0.15 -1.26 -5.11 113.70 108.83 2dhi s SER 2 Ca 0.00 0.43 -0.18 0.00 0.70 0.00 0.00 55.95 56.90 2dhi s SER 2 Cb 0.00 0.40 0.10 0.00 -1.71 0.00 0.00 66.02 64.81 2dhi s SER 2 CO 0.00 -0.21 0.64 -0.94 1.20 0.00 0.00 173.24 173.93 2dhi s SER 3 N 1.94 6.19 0.00 5.45 1.04 -1.26 -4.98 113.70 122.09 2dhi s SER 3 Ca -0.02 -1.42 0.00 0.00 0.48 0.00 0.00 55.95 54.99 2dhi s SER 3 Cb -0.12 -2.28 0.00 0.00 0.10 0.00 0.00 66.02 63.73 2dhi s SER 3 CO -0.07 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 173.75 2dhi n GLY 4 N 5.26 1.39 3.58 7.32 0.00 -1.26 -5.10 105.19 116.38 2dhi n GLY 4 Ca -0.10 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 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 0.00 5.44 0.19 1.61 0.01 -1.26 -4.93 113.70 114.76 2dhi s SER 5 Ca 0.00 1.27 -0.31 0.00 1.31 0.00 0.00 55.95 58.22 2dhi s SER 5 Cb 0.00 -2.52 -0.09 0.00 0.21 0.00 0.00 66.02 63.62 2dhi s SER 5 CO 0.00 -2.07 1.46 -0.44 0.41 0.00 0.00 173.24 172.60 2dhi s SER 6 N 7.98 6.69 0.28 2.44 0.01 -1.26 -4.97 113.70 124.86 2dhi s SER 6 Ca 0.86 2.56 -0.29 0.00 1.31 0.00 0.00 55.95 60.39 2dhi s SER 6 Cb -0.23 -2.60 -0.09 0.00 0.21 0.00 0.00 66.02 63.30 2dhi s SER 6 CO 0.31 -0.72 1.16 -0.83 0.41 0.00 0.00 173.24 173.57 2dhi s GLY 7 N 0.77 2.99 -0.08 3.44 0.00 -1.26 -4.95 107.32 108.22 2dhi s GLY 7 Ca 0.64 0.98 -0.18 0.00 0.00 0.00 0.00 44.72 46.16 2dhi s GLY 7 CO 0.36 1.65 0.48 -1.36 0.00 0.00 0.00 173.10 174.23 2dhi s PHE 8 N -0.98 3.57 0.10 1.90 0.08 -1.26 -2.74 117.98 118.65 2dhi s PHE 8 Ca 0.47 0.95 -0.35 0.00 0.12 0.00 0.00 56.93 58.12 2dhi s PHE 8 Cb -0.34 -2.52 -0.15 0.00 -0.57 0.00 0.00 43.02 39.45 2dhi s PHE 8 CO 0.43 0.27 1.56 0.28 -0.10 0.00 0.00 175.22 177.66 2dhi h VAL 9 N 4.47 0.03 -2.95 -0.44 2.07 -0.65 -3.45 116.25 115.34 2dhi h VAL 9 Ca -0.43 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 66.95 2dhi h VAL 9 Cb 1.19 0.03 -0.24 0.00 -1.52 0.00 0.00 31.29 30.74 2dhi h VAL 9 CO 0.73 0.00 -0.33 -0.75 0.02 0.00 0.00 177.57 177.24 2dhi s LYS 10 N -5.82 0.41 -0.04 1.57 2.20 -1.26 -5.01 119.74 111.78 2dhi s LYS 10 Ca -0.17 0.39 0.03 0.00 -0.36 0.00 0.00 55.97 55.86 2dhi s LYS 10 Cb 0.06 0.20 0.01 0.00 -1.51 0.00 0.00 37.83 36.58 2dhi s LYS 10 CO 0.61 -0.06 -0.11 -1.54 -0.36 0.00 0.00 175.35 173.89 2dhi s SER 11 N 0.02 1.52 0.22 1.43 1.04 -1.26 -2.68 113.70 114.00 2dhi s SER 11 Ca -0.01 -0.24 -0.22 0.00 0.48 0.00 0.00 55.95 55.96 2dhi s SER 11 Cb -0.03 -0.54 0.07 0.00 0.10 0.00 0.00 66.02 65.62 2dhi s SER 11 CO 0.01 0.06 0.95 -0.83 0.98 0.00 0.00 173.24 174.41 2dhi s GLY 12 N 0.38 0.06 0.06 7.32 0.00 -1.22 -5.06 107.32 108.86 2dhi s GLY 12 Ca -0.08 -0.29 -0.20 0.00 0.00 0.00 0.00 44.72 44.16 2dhi s GLY 12 CO 0.02 1.08 0.58 -0.98 0.00 0.00 0.00 173.10 173.80 2dhi s TRP 13 N -2.59 3.79 -0.07 1.90 0.52 -1.26 -2.68 118.94 118.54 2dhi s TRP 13 Ca 0.17 1.27 -0.20 0.00 0.02 0.00 0.00 56.10 57.36 2dhi s TRP 13 Cb -0.03 -2.52 0.04 0.00 -1.15 0.00 0.00 33.47 29.81 2dhi s TRP 13 CO 0.06 0.55 0.47 -0.51 0.02 0.00 0.00 176.95 177.54 2dhi s LEU 14 N -0.97 0.20 0.27 2.99 1.43 -0.07 -4.63 118.68 117.91 2dhi s LEU 14 Ca 0.29 0.52 -0.12 0.00 -1.03 0.00 0.00 54.13 53.79 2dhi s LEU 14 Cb -0.19 1.77 -0.08 0.00 0.03 0.00 0.00 46.19 47.71 2dhi s LEU 14 CO 0.19 -0.42 0.64 -0.76 0.23 0.00 0.00 176.35 176.22 2dhi s LEU 15 N -0.87 4.12 -0.18 1.79 1.43 -0.91 0.46 118.68 124.52 2dhi s LEU 15 Ca -0.09 1.09 -0.03 0.00 -1.03 0.00 0.00 54.13 54.06 2dhi s LEU 15 Cb -0.03 -3.87 0.06 0.00 0.03 0.00 0.00 46.19 42.38 2dhi s LEU 15 CO 0.05 -0.14 0.05 -0.60 0.23 0.00 0.00 176.35 175.95 2dhi s ARG 16 N -2.90 0.45 -0.47 1.70 3.52 -0.01 -1.96 118.95 119.28 2dhi s ARG 16 Ca 0.51 -0.27 -0.27 0.00 -0.13 0.00 0.00 55.73 55.56 2dhi s ARG 16 Cb -0.11 -1.93 -0.02 0.00 -1.56 0.00 0.00 34.95 31.34 2dhi s ARG 16 CO 0.19 -0.62 1.82 -1.14 -0.81 0.00 0.00 175.30 174.74 2dhi s GLN 17 N 1.96 2.99 1.07 5.12 0.74 -1.07 -3.49 119.66 126.97 2dhi s GLN 17 Ca 0.00 1.03 -0.18 0.00 0.05 0.00 0.00 55.36 56.27 2dhi s GLN 17 Cb -0.16 -4.28 0.26 0.00 1.10 0.00 0.00 33.01 29.93 2dhi s GLN 17 CO -0.08 -2.28 0.96 0.43 -0.55 0.00 0.00 175.29 173.78 2dhi n SER 18 N 11.49 -1.87 -0.03 6.67 7.64 -1.22 -4.66 113.62 131.65 2dhi n SER 18 Ca 0.22 -1.10 0.01 0.00 1.01 0.00 0.00 58.87 59.01 2dhi n SER 18 Cb 0.49 -0.88 -0.10 0.00 -1.01 0.00 0.00 64.21 62.71 2dhi n SER 18 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2dhi n THR 19 N -4.52 0.40 -0.07 0.44 -1.04 -1.26 -3.68 114.28 104.54 2dhi n THR 19 Ca 0.13 -0.41 -0.20 0.00 -2.04 0.00 0.00 64.05 61.53 2dhi n THR 19 Cb 0.51 -0.20 -0.12 0.00 -1.82 0.00 0.00 70.33 68.70 2dhi n THR 19 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 2dhi h ILE 20 N 0.00 1.13 0.00 12.58 2.04 -1.99 -3.36 117.51 127.91 2dhi h ILE 20 Ca -0.16 -2.27 0.00 0.00 1.00 0.00 0.00 64.86 63.43 2dhi h ILE 20 Cb 1.15 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 39.84 2dhi h ILE 20 CO 0.01 0.49 -0.29 0.18 0.00 0.00 0.00 178.15 178.53 2dhi n LEU 21 N -4.33 0.72 -4.29 1.44 4.77 -1.26 -4.94 117.00 109.11 2dhi n LEU 21 Ca -0.25 0.40 -0.31 0.00 -0.03 0.00 0.00 56.01 55.82 2dhi n LEU 21 Cb 0.70 -0.26 -0.09 0.00 -2.33 0.00 0.00 43.42 41.43 2dhi n LEU 21 CO 0.28 -0.11 -0.45 0.29 -1.33 0.00 0.00 177.39 176.08 2dhi n LYS 22 N -2.14 -1.17 -3.68 3.23 4.76 -1.24 -4.92 118.16 113.00 2dhi n LYS 22 Ca 0.05 0.12 -0.13 0.00 -2.87 0.00 0.00 58.31 55.48 2dhi n LYS 22 Cb 0.43 -3.70 -0.07 0.00 -1.84 0.00 0.00 35.03 29.84 2dhi n LYS 22 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2dhi s ARG 23 N -7.30 0.86 -0.29 1.97 1.70 -1.26 -4.96 118.95 109.67 2dhi s ARG 23 Ca 0.02 -0.27 -0.29 0.00 -0.47 0.00 0.00 55.73 54.72 2dhi s ARG 23 Cb -0.01 0.39 -0.01 0.00 -0.57 0.00 0.00 34.95 34.75 2dhi s ARG 23 CO 0.99 -0.28 1.43 -1.58 -1.08 0.00 0.00 175.30 174.78 2dhi s TRP 24 N -2.08 2.43 -0.07 5.89 0.52 -1.26 -3.38 118.94 120.99 2dhi s TRP 24 Ca -0.08 0.73 0.04 0.00 0.02 0.00 0.00 56.10 56.82 2dhi s TRP 24 Cb -0.02 -3.99 -0.02 0.00 -1.15 0.00 0.00 33.47 28.30 2dhi s TRP 24 CO 0.00 -2.18 -0.20 -1.59 0.02 0.00 0.00 176.95 173.00 2dhi s LYS 25 N 4.47 2.69 0.23 4.98 -2.85 -1.23 -4.89 119.74 123.14 2dhi s LYS 25 Ca 0.63 -0.81 -0.31 0.00 -1.00 0.00 0.00 55.97 54.48 2dhi s LYS 25 Cb -0.19 -2.30 -0.10 0.00 -2.06 0.00 0.00 37.83 33.17 2dhi s LYS 25 CO 0.27 0.41 1.51 0.21 0.10 0.00 0.00 175.35 177.85 2dhi s LYS 26 N -0.21 4.23 0.14 1.78 2.20 -1.26 -0.83 119.74 125.78 2dhi s LYS 26 Ca -0.01 2.37 -0.04 0.00 -0.36 0.00 0.00 55.97 57.93 2dhi s LYS 26 Cb -0.13 -3.11 -0.03 0.00 -1.51 0.00 0.00 37.83 33.05 2dhi s LYS 26 CO 0.03 -0.52 0.13 -0.80 -0.36 0.00 0.00 175.35 173.83 2dhi s ASN 27 N 0.64 0.23 -0.16 1.43 0.02 0.17 -4.89 114.94 112.38 2dhi s ASN 27 Ca 0.64 -1.09 -0.05 0.00 -1.02 0.00 0.00 52.86 51.34 2dhi s ASN 27 Cb -0.43 0.34 -0.03 0.00 0.02 0.00 0.00 41.25 41.14 2dhi s ASN 27 CO 0.40 -0.78 -0.01 0.86 0.02 0.00 0.00 177.10 177.59 2dhi s TRP 28 N -4.02 3.07 0.28 2.20 -0.11 -0.91 -0.89 118.94 118.56 2dhi s TRP 28 Ca 0.21 -0.22 0.11 0.00 1.22 0.00 0.00 56.10 57.42 2dhi s TRP 28 Cb 0.06 -1.99 -0.05 0.00 -1.50 0.00 0.00 33.47 29.99 2dhi s TRP 28 CO 0.01 -0.00 -0.13 -0.06 -4.62 0.00 0.00 176.95 172.15 2dhi s PHE 29 N 0.39 2.43 -0.30 5.86 0.40 -1.09 0.45 117.98 126.12 2dhi s PHE 29 Ca -0.02 -0.30 -0.10 0.00 -0.60 0.00 0.00 56.93 55.91 2dhi s PHE 29 Cb -0.14 -1.08 0.15 0.00 0.51 0.00 0.00 43.02 42.46 2dhi s PHE 29 CO 0.02 0.68 0.72 -0.51 0.70 0.00 0.00 175.22 176.83 2dhi s ASP 30 N -3.57 -1.06 0.08 1.36 1.01 -0.38 -3.39 116.67 110.71 2dhi s ASP 30 Ca 0.31 1.30 -0.12 0.00 0.71 0.00 0.00 52.55 54.74 2dhi s ASP 30 Cb -0.05 2.15 -0.06 0.00 1.01 0.00 0.00 42.92 45.96 2dhi s ASP 30 CO 0.17 -0.20 0.45 -0.22 0.21 0.00 0.00 175.17 175.57 2dhi s LEU 31 N 2.81 4.38 0.13 1.23 2.96 -1.09 -1.24 118.68 127.86 2dhi s LEU 31 Ca -0.01 0.92 -0.01 0.00 -0.22 0.00 0.00 54.13 54.81 2dhi s LEU 31 Cb -0.11 -2.96 -0.04 0.00 0.50 0.00 0.00 46.19 43.58 2dhi s LEU 31 CO -0.19 0.19 0.30 0.26 -1.32 0.00 0.00 176.35 175.60 2dhi s TRP 32 N -1.33 3.49 0.50 5.38 0.52 0.17 0.03 118.94 127.70 2dhi s TRP 32 Ca 0.32 0.32 0.25 0.00 0.02 0.00 0.00 56.10 57.01 2dhi s TRP 32 Cb -0.15 -1.83 1.33 0.00 -1.15 0.00 0.00 33.47 31.67 2dhi s TRP 32 CO 0.17 0.49 1.91 1.03 0.02 0.00 0.00 176.95 180.57 2dhi h SER 33 N 2.63 0.14 1.47 2.95 0.87 -1.83 0.67 113.55 120.46 2dhi h SER 33 Ca -0.46 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.07 2dhi h SER 33 Cb 1.17 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2dhi h SER 33 CO 0.72 0.06 -0.17 0.44 -0.53 0.00 0.00 176.83 177.35 2dhi h ASP 34 N 0.14 0.00 0.00 6.23 3.32 -1.94 -3.47 116.42 120.70 2dhi h ASP 34 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 2dhi h ASP 34 Cb 1.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.90 2dhi h ASP 34 CO -0.06 0.17 0.00 0.61 -1.72 0.00 0.00 179.24 178.24 2dhi n GLY 35 N 0.73 0.70 3.60 2.75 0.00 0.23 -5.00 105.19 108.20 2dhi n GLY 35 Ca 0.02 -0.06 -0.47 0.00 0.00 0.00 0.00 46.02 45.52 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 1.45 -4.98 1.61 8.25 -1.26 -4.17 115.22 116.12 2dhi n HIS 36 Ca 0.00 0.64 -0.32 0.00 -0.26 0.00 0.00 57.72 57.78 2dhi n HIS 36 Cb 0.00 -2.30 -0.16 0.00 1.12 0.00 0.00 29.99 28.65 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 0.48 2.41 -0.04 2.41 2.96 0.15 0.41 118.68 127.46 2dhi s LEU 37 Ca 0.68 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 54.15 2dhi s LEU 37 Cb -0.77 -1.51 0.02 0.00 0.50 0.00 0.00 46.19 44.43 2dhi s LEU 37 CO 0.54 0.16 -0.05 -0.63 -1.32 0.00 0.00 176.35 175.05 2dhi s ILE 38 N 0.37 0.56 0.24 6.68 1.01 -0.38 -1.32 121.20 128.36 2dhi s ILE 38 Ca -0.15 -0.17 0.11 0.00 0.00 0.00 0.00 60.65 60.45 2dhi s ILE 38 Cb -0.17 -0.56 -0.05 0.00 0.01 0.00 0.00 42.46 41.70 2dhi s ILE 38 CO 0.07 0.22 -0.19 -0.72 0.00 0.00 0.00 174.94 174.32 2dhi s TYR 39 N 0.70 2.36 0.39 3.97 1.13 -1.12 -1.25 117.35 123.53 2dhi s TYR 39 Ca -0.10 -0.32 0.05 0.00 -1.41 0.00 0.00 57.07 55.29 2dhi s TYR 39 Cb -0.13 -1.08 -0.06 0.00 -1.10 0.00 0.00 41.96 39.60 2dhi s TYR 39 CO 0.00 0.62 0.04 0.71 -2.51 0.00 0.00 175.55 174.42 2dhi s TYR 40 N -2.16 2.12 0.22 -3.49 1.51 0.17 -2.29 117.35 113.43 2dhi s TYR 40 Ca 0.27 -0.90 0.09 0.00 -1.01 0.00 0.00 57.07 55.52 2dhi s TYR 40 Cb -0.06 -1.48 0.15 0.00 -0.11 0.00 0.00 41.96 40.45 2dhi s TYR 40 CO 0.14 0.15 1.49 0.22 -1.11 0.00 0.00 175.55 176.44 2dhi h ASP 41 N 1.86 0.02 -2.16 2.29 3.58 -1.84 -2.42 116.42 117.75 2dhi h ASP 41 Ca -0.42 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 56.98 2dhi h ASP 41 Cb 1.26 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 42.30 2dhi h ASP 41 CO 0.73 0.77 0.10 -0.90 -2.88 0.00 0.00 179.24 177.05 2dhi n ASP 42 N -3.65 -1.09 0.00 2.28 5.68 -1.26 -4.63 116.55 113.88 2dhi n ASP 42 Ca -0.01 -1.85 0.09 0.00 -0.50 0.00 0.00 54.79 52.52 2dhi n ASP 42 Cb 0.73 1.84 0.43 0.00 -1.14 0.00 0.00 41.12 42.99 2dhi n ASP 42 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2dhi n GLN 43 N -0.28 0.19 0.21 0.11 0.00 -1.26 -2.49 117.38 113.86 2dhi n GLN 43 Ca -0.04 0.14 0.09 0.00 0.00 0.00 0.00 57.00 57.19 2dhi n GLN 43 Cb 0.30 -1.50 0.32 0.00 0.00 0.00 0.00 30.24 29.36 2dhi n GLN 43 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 2dhi h THR 44 N 0.00 0.46 -3.52 -0.39 1.35 -1.99 -3.46 112.91 105.35 2dhi h THR 44 Ca 0.00 -1.31 -0.25 0.00 -0.55 0.00 0.00 66.41 64.30 2dhi h THR 44 Cb 0.20 1.95 -0.02 0.00 -1.73 0.00 0.00 68.15 68.56 2dhi h THR 44 CO 0.00 0.22 -0.31 0.54 -0.25 0.00 0.00 175.52 175.72 2dhi n ARG 45 N -3.25 -2.10 0.05 4.72 1.74 -1.04 -4.83 116.66 111.94 2dhi n ARG 45 Ca 0.01 0.62 -0.22 0.00 -0.77 0.00 0.00 57.85 57.50 2dhi n ARG 45 Cb 0.51 -5.18 -0.14 0.00 -1.02 0.00 0.00 32.46 26.63 2dhi n ARG 45 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2dhi h GLN 46 N 0.00 0.32 -4.62 5.56 1.08 -1.90 -3.43 115.11 112.12 2dhi h GLN 46 Ca -0.29 -0.54 -0.69 0.00 -1.45 0.00 0.00 58.65 55.68 2dhi h GLN 46 Cb 1.17 0.20 -0.35 0.00 -0.05 0.00 0.00 27.48 28.46 2dhi h GLN 46 CO 0.35 1.26 -0.63 -1.12 -0.95 0.00 0.00 178.83 177.75 2dhi s SER 47 N -7.11 5.05 -0.10 1.46 0.01 -1.26 -5.07 113.70 106.68 2dhi s SER 47 Ca -0.16 -1.78 -0.29 0.00 1.31 0.00 0.00 55.95 55.03 2dhi s SER 47 Cb 0.03 -1.76 -0.05 0.00 0.21 0.00 0.00 66.02 64.45 2dhi s SER 47 CO 0.82 -0.42 1.78 -0.63 0.41 0.00 0.00 173.24 175.21 2dhi s ILE 48 N 1.15 3.42 0.04 1.44 1.01 -1.26 -2.92 121.20 124.07 2dhi s ILE 48 Ca 0.04 0.49 -0.28 0.00 0.00 0.00 0.00 60.65 60.89 2dhi s ILE 48 Cb -0.21 -3.37 -0.16 0.00 0.01 0.00 0.00 42.46 38.73 2dhi s ILE 48 CO -0.04 -0.11 1.36 -0.33 0.00 0.00 0.00 174.94 175.83 2dhi h GLU 49 N 10.77 -0.98 -1.83 2.79 4.39 -1.74 -3.48 114.58 124.50 2dhi h GLU 49 Ca -0.40 0.07 0.24 0.00 0.34 0.00 0.00 59.36 59.60 2dhi h GLU 49 Cb 1.19 0.22 -0.13 0.00 -0.10 0.00 0.00 28.75 29.94 2dhi h GLU 49 CO 0.96 -0.66 0.68 0.34 -1.16 0.00 0.00 179.01 179.18 2dhi s ASP 50 N -3.69 -0.16 0.00 1.42 2.15 -1.22 -5.06 116.67 110.12 2dhi s ASP 50 Ca -0.15 -0.16 0.04 0.00 0.43 0.00 0.00 52.55 52.71 2dhi s ASP 50 Cb 0.01 0.28 -0.01 0.00 -0.30 0.00 0.00 42.92 42.90 2dhi s ASP 50 CO 0.45 -0.50 -0.13 -0.75 -0.17 0.00 0.00 175.17 174.07 2dhi s LYS 51 N -2.77 0.97 -0.07 4.34 2.20 -1.26 -2.78 119.74 120.38 2dhi s LYS 51 Ca 0.11 -0.52 -0.24 0.00 -0.36 0.00 0.00 55.97 54.96 2dhi s LYS 51 Cb 0.01 -0.95 0.05 0.00 -1.51 0.00 0.00 37.83 35.43 2dhi s LYS 51 CO -0.03 0.25 0.54 0.08 -0.36 0.00 0.00 175.35 175.83 2dhi s VAL 52 N -0.44 0.02 0.50 4.02 1.01 -0.44 -5.04 120.40 120.03 2dhi s VAL 52 Ca 0.04 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 61.88 2dhi s VAL 52 Cb -0.06 -0.84 0.02 0.00 0.00 0.00 0.00 36.38 35.50 2dhi s VAL 52 CO -0.00 -0.08 0.72 -2.28 0.00 0.00 0.00 175.10 173.45 2dhi s HIS 53 N -0.98 3.01 0.00 5.22 2.46 -1.26 -0.68 115.29 123.06 2dhi s HIS 53 Ca -0.10 0.07 0.00 0.00 0.47 0.00 0.00 55.06 55.50 2dhi s HIS 53 Cb -0.02 -2.55 0.00 0.00 -0.13 0.00 0.00 32.58 29.88 2dhi s HIS 53 CO 0.07 -0.63 0.00 -1.33 -2.47 0.00 0.00 174.74 170.37 2dhi n MET 54 N -2.20 0.00 0.00 2.88 2.81 -1.26 -2.82 117.12 116.53 2dhi n MET 54 Ca 0.05 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 55.99 2dhi n MET 54 Cb 0.59 -0.41 0.30 0.00 -0.71 0.00 0.00 33.22 32.99 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 -2.46 0.49 0.02 0.03 -0.04 -1.26 -0.62 135.00 131.15 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 0.38 -0.03 0.52 0.31 -1.26 -4.88 118.33 112.55 2dhi n VAL 56 Ca 0.08 0.13 -0.20 0.00 -0.01 0.00 0.00 64.34 64.33 2dhi n VAL 56 Cb 0.04 -1.50 -0.13 0.00 -0.91 0.00 0.00 33.84 31.34 2dhi n VAL 56 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2dhi h ASP 57 N 0.00 0.23 -3.84 4.52 3.32 -1.60 -3.47 116.42 115.58 2dhi h ASP 57 Ca 0.00 -0.82 -0.47 0.00 0.02 0.00 0.00 57.03 55.76 2dhi h ASP 57 Cb 0.66 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 2dhi h ASP 57 CO 0.00 1.44 0.22 0.00 -1.72 0.00 0.00 179.24 179.18 2dhi n ILE 59 N -0.14 0.00 -3.84 0.00 -5.35 0.81 -4.35 119.36 106.48 2dhi n ILE 59 Ca 0.04 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.42 2dhi n ILE 59 Cb 0.53 -0.78 -0.07 0.00 -1.74 0.00 0.00 39.64 37.57 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 -2.79 0.04 -0.16 7.28 3.84 -1.21 -5.03 114.94 116.91 2dhi s ASN 60 Ca 0.00 -0.65 0.01 0.00 0.21 0.00 0.00 52.86 52.43 2dhi s ASN 60 Cb 0.00 0.39 0.02 0.00 -0.55 0.00 0.00 41.25 41.11 2dhi s ASN 60 CO 0.00 -0.79 -0.17 -0.63 -2.79 0.00 0.00 177.10 172.72 2dhi s ILE 61 N -3.88 1.79 -0.19 -5.21 1.01 -1.26 -1.01 121.20 112.45 2dhi s ILE 61 Ca 0.07 -0.78 -0.03 0.00 0.00 0.00 0.00 60.65 59.92 2dhi s ILE 61 Cb 0.04 -1.64 -0.01 0.00 0.01 0.00 0.00 42.46 40.86 2dhi s ILE 61 CO -0.09 0.50 -0.07 -0.13 0.00 0.00 0.00 174.94 175.15 2dhi s ARG 62 N 1.31 3.40 -0.02 2.79 0.52 -0.43 -4.99 118.95 121.52 2dhi s ARG 62 Ca 0.03 -0.63 0.05 0.00 -0.52 0.00 0.00 55.73 54.65 2dhi s ARG 62 Cb -0.13 -2.89 -0.01 0.00 0.52 0.00 0.00 34.95 32.43 2dhi s ARG 62 CO -0.10 -0.05 -0.16 0.95 0.02 0.00 0.00 175.30 175.96 2dhi s THR 63 N 1.08 1.29 0.00 0.02 -4.23 -1.26 0.10 115.64 112.64 2dhi s THR 63 Ca 0.01 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 2dhi s THR 63 Cb -0.15 -1.09 0.00 0.00 1.34 0.00 0.00 72.50 72.61 2dhi s THR 63 CO -0.01 0.37 0.00 0.61 -0.54 0.00 0.00 174.62 175.05 2dhi n GLY 64 N 2.88 2.72 0.29 3.99 0.00 -1.13 -2.92 105.19 111.01 2dhi n GLY 64 Ca -0.16 -0.28 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 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 0.82 -0.30 1.61 3.86 -1.95 -2.31 115.15 116.88 2dhi h HIS 65 Ca 0.00 -0.11 0.09 0.00 -1.16 0.00 0.00 60.37 59.19 2dhi h HIS 65 Cb 0.00 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.23 2dhi h HIS 65 CO 0.00 0.75 0.43 0.93 0.86 0.00 0.00 177.93 180.90 2dhi h GLU 66 N 0.74 0.00 -5.96 2.45 5.08 -1.88 -3.42 114.58 111.58 2dhi h GLU 66 Ca 0.15 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.32 2dhi h GLU 66 Cb 0.41 0.00 0.11 0.00 0.50 0.00 0.00 28.75 29.77 2dhi h GLU 66 CO 0.01 0.00 -0.14 0.00 -1.00 0.00 0.00 179.01 177.89 2dhi n ARG 68 N -1.79 3.83 -2.39 0.00 1.74 -1.26 -4.63 116.66 112.16 2dhi n ARG 68 Ca 0.07 -3.28 -0.05 0.00 -0.77 0.00 0.00 57.85 53.82 2dhi n ARG 68 Cb 0.31 -2.87 -0.00 0.00 -1.02 0.00 0.00 32.46 28.88 2dhi n ARG 68 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2dhi n ASP 69 N 3.45 -2.01 -3.01 0.55 2.03 -1.26 -4.90 116.55 111.40 2dhi n ASP 69 Ca 0.51 0.37 -0.13 0.00 0.52 0.00 0.00 54.79 56.06 2dhi n ASP 69 Cb 0.32 -1.83 0.09 0.00 -0.72 0.00 0.00 41.12 38.98 2dhi n ASP 69 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2dhi n ILE 70 N -2.73 0.00 -3.88 5.18 -5.35 -1.26 -5.11 119.36 106.21 2dhi n ILE 70 Ca -0.05 -0.56 -0.12 0.00 -0.27 0.00 0.00 62.75 61.75 2dhi n ILE 70 Cb 0.52 -1.59 -0.14 0.00 -1.74 0.00 0.00 39.64 36.68 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 -4.23 0.02 0.87 6.28 -2.07 -1.26 -5.06 119.66 114.21 2dhi s GLN 71 Ca 0.36 -0.00 -0.11 0.00 -1.82 0.00 0.00 55.36 53.78 2dhi s GLN 71 Cb -0.01 -0.03 0.12 0.00 -1.09 0.00 0.00 33.01 32.00 2dhi s GLN 71 CO 0.25 -0.00 1.09 -1.25 -1.32 0.00 0.00 175.29 174.06 2dhi s PRO 72 N 0.03 1.43 1.02 9.60 0.04 -1.26 -5.04 135.00 140.82 2dhi s PRO 72 Ca -0.00 0.88 -0.13 0.00 0.04 0.00 0.00 61.00 61.80 2dhi s PRO 72 Cb -0.01 -1.82 0.20 0.00 0.04 0.00 0.00 34.50 32.91 2dhi s PRO 72 CO -0.00 -2.14 1.09 -1.25 0.04 0.00 0.00 177.00 174.74 2dhi s PRO 73 N -4.93 0.28 0.65 0.56 0.04 -1.26 -4.94 135.00 125.39 2dhi s PRO 73 Ca 0.63 0.47 -0.18 0.00 0.04 0.00 0.00 61.00 61.96 2dhi s PRO 73 Cb -0.18 -1.72 -0.01 0.00 0.04 0.00 0.00 34.50 32.63 2dhi s PRO 73 CO 0.57 -2.83 1.30 -3.47 0.04 0.00 0.00 177.00 172.61 2dhi n ASP 74 N -4.23 2.11 -3.84 6.66 2.03 -1.26 -2.62 116.55 115.39 2dhi n ASP 74 Ca 0.05 0.83 -0.30 0.00 0.52 0.00 0.00 54.79 55.89 2dhi n ASP 74 Cb 0.57 -1.56 -0.00 0.00 -0.72 0.00 0.00 41.12 39.41 2dhi n ASP 74 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dhi n GLY 75 N 0.92 -0.48 3.11 0.27 0.00 -1.26 -4.95 105.19 102.80 2dhi n GLY 75 Ca 0.16 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.19 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 -6.53 0.27 0.48 1.61 -0.14 -1.08 -5.17 119.74 109.18 2dhi s LYS 76 Ca 0.61 0.42 -0.08 0.00 -1.36 0.00 0.00 55.97 55.56 2dhi s LYS 76 Cb -0.32 0.05 0.12 0.00 -1.68 0.00 0.00 37.83 36.00 2dhi s LYS 76 CO 0.75 -0.08 0.42 -0.35 -0.76 0.00 0.00 175.35 175.33 2dhi n PRO 77 N 3.41 -1.84 -0.02 -1.68 -0.04 -1.26 -4.59 135.00 128.98 2dhi n PRO 77 Ca -0.17 -0.68 0.05 0.00 -0.04 0.00 0.00 63.50 62.66 2dhi n PRO 77 Cb 0.56 -0.63 -0.12 0.00 -0.04 0.00 0.00 33.50 33.27 2dhi n PRO 77 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2dhi n ARG 78 N -2.80 0.71 0.00 0.54 0.63 -1.26 -4.32 116.66 110.16 2dhi n ARG 78 Ca 0.06 -0.12 0.10 0.00 -0.92 0.00 0.00 57.85 56.97 2dhi n ARG 78 Cb 0.23 -1.38 0.47 0.00 0.45 0.00 0.00 32.46 32.23 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 -2.16 0.00 -1.37 6.15 8.00 -1.26 -2.26 116.55 123.65 2dhi n ASP 79 Ca -0.07 0.23 0.11 0.00 0.71 0.00 0.00 54.79 55.77 2dhi n ASP 79 Cb 0.53 -0.39 0.32 0.00 -0.02 0.00 0.00 41.12 41.57 2dhi n ASP 79 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dhi s LEU 81 N -1.26 4.43 -0.07 0.00 1.43 -0.96 -0.80 118.68 121.46 2dhi s LEU 81 Ca 0.48 1.05 -0.00 0.00 -1.03 0.00 0.00 54.13 54.63 2dhi s LEU 81 Cb 0.27 -2.92 0.02 0.00 0.03 0.00 0.00 46.19 43.59 2dhi s LEU 81 CO 0.30 0.23 -0.04 -0.22 0.23 0.00 0.00 176.35 176.84 2dhi s LEU 82 N -1.46 1.06 0.12 1.79 2.96 0.61 -2.85 118.68 120.90 2dhi s LEU 82 Ca 0.31 -0.17 0.09 0.00 -0.22 0.00 0.00 54.13 54.13 2dhi s LEU 82 Cb -0.17 -0.58 -0.04 0.00 0.50 0.00 0.00 46.19 45.91 2dhi s LEU 82 CO 0.17 -0.11 -0.21 -1.58 -1.32 0.00 0.00 176.35 173.30 2dhi s GLN 83 N 1.46 1.19 -0.08 1.98 0.74 0.28 0.10 119.66 125.33 2dhi s GLN 83 Ca -0.02 -1.23 0.02 0.00 0.05 0.00 0.00 55.36 54.18 2dhi s GLN 83 Cb -0.13 -1.46 0.01 0.00 1.10 0.00 0.00 33.01 32.54 2dhi s GLN 83 CO -0.03 0.33 -0.13 0.42 -0.55 0.00 0.00 175.29 175.33 2dhi s ILE 84 N -1.28 1.24 -0.13 -2.34 -1.09 -0.74 -1.32 121.20 115.55 2dhi s ILE 84 Ca 0.09 -0.52 -0.14 0.00 -2.23 0.00 0.00 60.65 57.85 2dhi s ILE 84 Cb -0.09 -1.15 -0.05 0.00 -1.58 0.00 0.00 42.46 39.59 2dhi s ILE 84 CO 0.05 0.39 0.33 -0.69 -1.23 0.00 0.00 174.94 173.78 2dhi s VAL 85 N 0.85 5.26 0.37 2.92 1.01 -0.18 -2.02 120.40 128.61 2dhi s VAL 85 Ca -0.11 0.63 0.03 0.00 0.00 0.00 0.00 61.98 62.54 2dhi s VAL 85 Cb -0.15 -3.66 0.07 0.00 0.00 0.00 0.00 36.38 32.64 2dhi s VAL 85 CO 0.01 0.42 0.50 0.00 0.00 0.00 0.00 175.10 176.04 2dhi n ARG 87 N -1.87 0.50 -0.89 0.00 1.74 -1.06 -3.90 116.66 111.18 2dhi n ARG 87 Ca 0.09 0.08 -0.05 0.00 -0.77 0.00 0.00 57.85 57.20 2dhi n ARG 87 Cb 0.34 -1.75 0.25 0.00 -1.02 0.00 0.00 32.46 30.28 2dhi n ARG 87 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2dhi n ASP 88 N -2.43 3.92 0.00 0.55 -0.08 -1.26 -4.91 116.55 112.33 2dhi n ASP 88 Ca 0.01 -3.38 0.00 0.00 -1.51 0.00 0.00 54.79 49.91 2dhi n ASP 88 Cb 0.51 -0.69 0.00 0.00 2.34 0.00 0.00 41.12 43.28 2dhi n ASP 88 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dhi n GLY 89 N -0.61 2.80 3.58 0.27 0.00 -1.25 -4.97 105.19 105.00 2dhi n GLY 89 Ca 0.38 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.91 2dhi n GLY 89 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dhi n LYS 90 N -0.96 1.19 -4.40 1.61 4.81 -1.26 -4.62 118.16 114.54 2dhi n LYS 90 Ca 0.00 0.43 -0.20 0.00 -0.87 0.00 0.00 58.31 57.66 2dhi n LYS 90 Cb 0.00 -1.97 -0.15 0.00 0.02 0.00 0.00 35.03 32.93 2dhi n LYS 90 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2dhi s THR 91 N -0.01 0.80 -0.16 3.15 2.01 -1.26 -0.53 115.64 119.64 2dhi s THR 91 Ca 0.76 -0.37 -0.02 0.00 0.31 0.00 0.00 61.69 62.37 2dhi s THR 91 Cb -0.87 -0.71 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 2dhi s THR 91 CO 0.51 0.25 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.98 2dhi s ILE 92 N 0.20 3.41 -0.21 1.82 1.01 -0.85 -4.97 121.20 121.61 2dhi s ILE 92 Ca -0.03 -0.52 -0.13 0.00 0.00 0.00 0.00 60.65 59.97 2dhi s ILE 92 Cb -0.09 -2.48 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 2dhi s ILE 92 CO 0.01 0.49 0.26 -0.44 0.00 0.00 0.00 174.94 175.26 2dhi s SER 93 N 0.61 6.30 0.19 3.58 0.01 -1.26 -1.79 113.70 121.33 2dhi s SER 93 Ca -0.05 0.34 0.04 0.00 1.31 0.00 0.00 55.95 57.59 2dhi s SER 93 Cb -0.15 -2.16 -0.05 0.00 0.21 0.00 0.00 66.02 63.87 2dhi s SER 93 CO 0.03 0.04 -0.04 -0.76 0.41 0.00 0.00 173.24 172.91 2dhi s LEU 94 N 0.95 2.32 -0.02 2.44 1.43 0.28 -2.59 118.68 123.49 2dhi s LEU 94 Ca 0.13 -1.13 -0.07 0.00 -1.03 0.00 0.00 54.13 52.03 2dhi s LEU 94 Cb -0.14 -0.28 0.01 0.00 0.03 0.00 0.00 46.19 45.81 2dhi s LEU 94 CO 0.05 -0.44 0.15 0.00 0.23 0.00 0.00 176.35 176.34 2dhi s ALA 96 N -0.83 3.43 0.37 0.00 0.00 0.02 -2.14 121.76 122.61 2dhi s ALA 96 Ca -0.09 -1.62 0.06 0.00 0.00 0.00 0.00 51.96 50.32 2dhi s ALA 96 Cb -0.05 -0.97 0.76 0.00 0.00 0.00 0.00 23.12 22.86 2dhi s ALA 96 CO 0.01 0.19 1.96 1.49 0.00 0.00 0.00 175.76 179.41 2dhi h GLU 97 N 1.63 0.71 -3.00 0.00 4.81 -1.87 -3.46 114.58 113.40 2dhi h GLU 97 Ca -0.45 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 58.79 2dhi h GLU 97 Cb 1.25 -0.16 -0.06 0.00 0.63 0.00 0.00 28.75 30.41 2dhi h GLU 97 CO 0.61 0.47 0.23 0.45 -0.73 0.00 0.00 179.01 180.04 2dhi s SER 98 N -6.22 -0.30 0.25 1.04 0.15 -1.26 -5.01 113.70 102.35 2dhi s SER 98 Ca -0.10 -0.53 -0.05 0.00 0.70 0.00 0.00 55.95 55.97 2dhi s SER 98 Cb 0.19 0.71 0.49 0.00 -1.71 0.00 0.00 66.02 65.71 2dhi s SER 98 CO 0.77 -1.30 1.65 0.74 1.20 0.00 0.00 173.24 176.30 2dhi h THR 99 N 2.00 0.38 -0.39 6.45 2.02 -1.88 0.90 112.91 122.39 2dhi h THR 99 Ca -0.21 -0.06 0.07 0.00 0.77 0.00 0.00 66.41 66.98 2dhi h THR 99 Cb 1.26 0.20 -0.06 0.00 -1.74 0.00 0.00 68.15 67.81 2dhi h THR 99 CO 0.25 0.03 0.05 -0.78 0.37 0.00 0.00 175.52 175.43 2dhi h ASP 100 N 0.16 -0.06 -0.78 4.18 3.58 -1.96 0.98 116.42 122.52 2dhi h ASP 100 Ca 0.44 0.08 -0.04 0.00 0.42 0.00 0.00 57.03 57.93 2dhi h ASP 100 Cb 0.79 0.12 -0.03 0.00 1.72 0.00 0.00 39.33 41.93 2dhi h ASP 100 CO -0.62 0.00 0.33 0.44 -2.88 0.00 0.00 179.24 176.51 2dhi h ASP 101 N 0.16 1.06 0.57 2.28 5.19 -1.31 -1.83 116.42 122.56 2dhi h ASP 101 Ca 0.19 -0.16 -0.03 0.00 -0.62 0.00 0.00 57.03 56.41 2dhi h ASP 101 Cb 0.25 -0.28 0.01 0.00 0.18 0.00 0.00 39.33 39.49 2dhi h ASP 101 CO -0.28 0.93 -0.28 0.00 -3.12 0.00 0.00 179.24 176.50 2dhi h LEU 103 N -0.91 0.28 0.08 0.00 3.38 -0.80 -1.65 115.31 115.70 2dhi h LEU 103 Ca -0.08 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2dhi h LEU 103 Cb 0.64 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.40 2dhi h LEU 103 CO 0.13 0.13 -0.50 0.00 0.09 0.00 0.00 178.44 178.29 2dhi h ALA 104 N 1.49 -0.91 -0.07 1.53 0.00 -1.24 -0.30 119.26 119.76 2dhi h ALA 104 Ca 0.37 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.23 2dhi h ALA 104 Cb 0.51 0.86 -0.05 0.00 0.00 0.00 0.00 17.79 19.12 2dhi h ALA 104 CO -0.36 -1.08 -0.23 -1.49 0.00 0.00 0.00 179.25 176.09 2dhi h TRP 105 N -0.70 -0.61 -0.25 0.00 4.06 -1.11 -1.62 115.95 115.71 2dhi h TRP 105 Ca 0.01 0.03 0.04 0.00 2.06 0.00 0.00 58.89 61.03 2dhi h TRP 105 Cb 0.73 0.28 -0.07 0.00 -1.00 0.00 0.00 29.16 29.10 2dhi h TRP 105 CO -0.45 -0.32 -0.54 -0.22 -3.56 0.00 0.00 178.44 173.35 2dhi h LYS 106 N -0.32 -0.48 -0.98 0.49 3.64 -0.96 0.17 116.57 118.12 2dhi h LYS 106 Ca 0.08 0.03 0.21 0.00 -1.27 0.00 0.00 60.65 59.71 2dhi h LYS 106 Cb 0.44 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.28 2dhi h LYS 106 CO -0.26 -0.32 0.62 0.74 -2.27 0.00 0.00 179.45 177.96 2dhi h PHE 107 N -0.50 0.81 0.22 1.91 0.04 -0.80 0.20 116.94 118.81 2dhi h PHE 107 Ca 0.05 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.84 2dhi h PHE 107 Cb 0.65 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 38.55 2dhi h PHE 107 CO -0.64 0.16 -0.10 1.15 -0.60 0.00 0.00 178.31 178.28 2dhi h THR 108 N 0.57 0.87 -0.16 -1.55 2.02 0.14 -2.55 112.91 112.24 2dhi h THR 108 Ca 0.55 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 67.12 2dhi h THR 108 Cb 1.13 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 2dhi h THR 108 CO -0.30 0.13 0.10 -0.07 0.37 0.00 0.00 175.52 175.76 2dhi h LEU 109 N -0.61 0.19 -2.14 2.58 3.38 0.23 0.81 115.31 119.74 2dhi h LEU 109 Ca -0.03 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.00 2dhi h LEU 109 Cb 0.44 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2dhi h LEU 109 CO 0.05 0.14 0.28 1.56 0.09 0.00 0.00 178.44 180.57 2dhi h GLN 110 N 0.21 0.00 0.16 1.13 4.20 -0.69 -1.08 115.11 119.03 2dhi h GLN 110 Ca 0.06 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.41 2dhi h GLN 110 Cb -0.01 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 2dhi h GLN 110 CO -0.01 0.00 -1.87 0.22 -0.67 0.00 0.00 178.83 176.49 2dhi h ASP 111 N 0.00 0.51 0.12 1.46 3.58 -0.86 -3.32 116.42 117.91 2dhi h ASP 111 Ca 0.12 -0.95 0.00 0.00 0.42 0.00 0.00 57.03 56.62 2dhi h ASP 111 Cb 0.68 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.57 2dhi h ASP 111 CO -0.00 1.83 0.00 -1.54 -2.88 0.00 0.00 179.24 176.65 2dhi n SER 112 N -3.55 0.60 -0.09 2.28 3.41 0.18 -2.29 113.62 114.17 2dhi n SER 112 Ca -0.29 0.76 -0.08 0.00 -0.26 0.00 0.00 58.87 59.00 2dhi n SER 112 Cb 1.06 -0.84 -0.01 0.00 -0.26 0.00 0.00 64.21 64.16 2dhi n SER 112 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2dhi h ARG 113 N 0.00 0.35 -4.48 4.33 3.08 -1.52 -3.42 114.38 112.71 2dhi h ARG 113 Ca 0.00 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 2dhi h ARG 113 Cb 0.06 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 29.97 2dhi h ARG 113 CO 0.00 0.23 -0.14 -2.37 -1.07 0.00 0.00 179.97 176.62 2dhi n THR 114 N -4.92 0.00 -1.30 2.04 5.66 -0.97 -4.65 114.28 110.14 2dhi n THR 114 Ca -0.01 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.70 2dhi n THR 114 Cb 0.06 -0.08 0.05 0.00 -1.55 0.00 0.00 70.33 68.81 2dhi n THR 114 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2dhi n SER 115 N -1.25 7.18 0.00 1.09 2.88 -1.26 -4.80 113.62 117.46 2dhi n SER 115 Ca 0.02 -3.51 0.00 0.00 -1.33 0.00 0.00 58.87 54.05 2dhi n SER 115 Cb 0.37 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 62.79 2dhi n SER 115 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dhi n GLY 116 N -0.28 0.31 0.16 0.46 0.00 -1.26 -4.99 105.19 99.59 2dhi n GLY 116 Ca 0.50 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2dhi n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhi h PRO 117 N 0.00 0.01 -0.28 1.61 0.13 -1.99 -3.24 132.00 128.24 2dhi h PRO 117 Ca 0.00 -0.01 0.07 0.00 -0.87 0.00 0.00 66.00 65.19 2dhi h PRO 117 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.05 2dhi h PRO 117 CO 0.00 0.50 -0.27 0.77 -0.23 0.00 0.00 178.00 178.77 2dhi h SER 118 N 0.01 -0.87 -3.42 1.44 0.02 -2.01 -3.38 113.55 105.34 2dhi h SER 118 Ca -0.00 0.15 -0.64 0.00 -0.84 0.00 0.00 61.79 60.46 2dhi h SER 118 Cb 0.87 0.41 -0.22 0.00 0.14 0.00 0.00 62.40 63.59 2dhi h SER 118 CO 0.06 -0.30 -0.66 -0.55 -1.14 0.00 0.00 176.83 174.25 2dhi s SER 119 N -5.04 4.88 0.00 3.07 0.15 -1.22 -5.29 113.70 110.25 2dhi s SER 119 Ca -0.15 -0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.32 2dhi s SER 119 Cb 0.12 -1.83 0.00 0.00 -1.71 0.00 0.00 66.02 62.60 2dhi s SER 119 CO 0.68 0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.81