#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 -0.88 -0.24 1.61 1.04 -1.26 -5.16 113.70 108.81 2dhi s SER 2 Ca 0.00 0.63 -0.19 0.00 0.48 0.00 0.00 55.95 56.87 2dhi s SER 2 Cb 0.00 1.77 0.07 0.00 0.10 0.00 0.00 66.02 67.95 2dhi s SER 2 CO 0.00 -0.16 0.62 -0.44 0.98 0.00 0.00 173.24 174.23 2dhi s SER 3 N 2.86 -0.71 0.00 7.02 0.01 -1.26 -5.10 113.70 116.52 2dhi s SER 3 Ca 0.08 1.28 0.00 0.00 1.31 0.00 0.00 55.95 58.62 2dhi s SER 3 Cb -0.12 1.24 0.00 0.00 0.21 0.00 0.00 66.02 67.35 2dhi s SER 3 CO -0.16 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 173.88 2dhi n GLY 4 N 3.33 -0.61 1.70 3.44 0.00 -1.26 -4.96 105.19 106.83 2dhi n GLY 4 Ca -0.16 -0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.74 2dhi n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dhi n SER 5 N 0.00 5.63 -4.55 1.61 3.41 -1.26 -4.90 113.62 113.56 2dhi n SER 5 Ca 0.00 -2.60 -0.38 0.00 -0.26 0.00 0.00 58.87 55.63 2dhi n SER 5 Cb 0.00 -1.16 -0.04 0.00 -0.26 0.00 0.00 64.21 62.74 2dhi n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2dhi n SER 6 N 1.37 2.23 -4.69 4.04 7.64 -1.26 -4.88 113.62 118.07 2dhi n SER 6 Ca 0.15 -0.30 -0.44 0.00 1.01 0.00 0.00 58.87 59.29 2dhi n SER 6 Cb 0.58 -1.50 -0.03 0.00 -1.01 0.00 0.00 64.21 62.25 2dhi n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dhi n GLY 7 N 6.06 1.08 3.77 0.23 0.00 -1.26 -4.96 105.19 110.11 2dhi n GLY 7 Ca 0.39 0.55 -0.39 0.00 0.00 0.00 0.00 46.02 46.58 2dhi n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dhi s PHE 8 N 0.38 3.69 0.09 1.61 0.08 -1.26 -4.30 117.98 118.25 2dhi s PHE 8 Ca 0.71 1.15 -0.35 0.00 0.12 0.00 0.00 56.93 58.56 2dhi s PHE 8 Cb -0.61 -2.55 -0.16 0.00 -0.57 0.00 0.00 43.02 39.12 2dhi s PHE 8 CO 0.44 0.39 1.55 0.28 -0.10 0.00 0.00 175.22 177.78 2dhi h VAL 9 N 4.07 0.00 -3.62 -0.44 2.07 -0.04 -3.45 116.25 114.84 2dhi h VAL 9 Ca -0.46 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 66.92 2dhi h VAL 9 Cb 1.20 0.00 -0.20 0.00 -1.52 0.00 0.00 31.29 30.77 2dhi h VAL 9 CO 0.69 0.00 -0.51 -0.75 0.02 0.00 0.00 177.57 177.02 2dhi s LYS 10 N -5.78 0.51 0.02 1.57 2.20 -1.25 -4.99 119.74 112.02 2dhi s LYS 10 Ca -0.17 -0.51 0.02 0.00 -0.36 0.00 0.00 55.97 54.94 2dhi s LYS 10 Cb 0.05 0.21 -0.01 0.00 -1.51 0.00 0.00 37.83 36.56 2dhi s LYS 10 CO 0.59 -0.12 -0.07 -1.54 -0.36 0.00 0.00 175.35 173.85 2dhi s SER 11 N -1.61 0.76 -0.17 1.43 1.04 -1.26 -2.28 113.70 111.61 2dhi s SER 11 Ca -0.12 -0.33 -0.35 0.00 0.48 0.00 0.00 55.95 55.64 2dhi s SER 11 Cb -0.06 -0.02 0.14 0.00 0.10 0.00 0.00 66.02 66.18 2dhi s SER 11 CO -0.00 -0.07 1.30 -0.83 0.98 0.00 0.00 173.24 174.62 2dhi s GLY 12 N -0.86 -0.32 0.14 7.32 0.00 -1.16 -5.05 107.32 107.39 2dhi s GLY 12 Ca -0.04 1.41 -0.27 0.00 0.00 0.00 0.00 44.72 45.82 2dhi s GLY 12 CO 0.00 0.43 0.83 -0.98 0.00 0.00 0.00 173.10 173.38 2dhi s TRP 13 N -2.28 3.87 -0.11 1.90 0.52 -1.26 -2.65 118.94 118.94 2dhi s TRP 13 Ca 0.12 1.68 -0.16 0.00 0.02 0.00 0.00 56.10 57.76 2dhi s TRP 13 Cb 0.01 -2.87 0.04 0.00 -1.15 0.00 0.00 33.47 29.50 2dhi s TRP 13 CO -0.04 0.40 0.40 -0.51 0.02 0.00 0.00 176.95 177.22 2dhi s LEU 14 N -0.71 0.46 0.03 2.99 1.43 -0.86 -4.50 118.68 117.52 2dhi s LEU 14 Ca 0.39 0.61 -0.18 0.00 -1.03 0.00 0.00 54.13 53.93 2dhi s LEU 14 Cb -0.23 1.46 -0.06 0.00 0.03 0.00 0.00 46.19 47.39 2dhi s LEU 14 CO 0.27 -0.27 0.51 -0.76 0.23 0.00 0.00 176.35 176.33 2dhi s LEU 15 N -0.33 4.49 -0.06 1.79 1.43 0.17 -1.20 118.68 124.97 2dhi s LEU 15 Ca -0.05 1.13 0.04 0.00 -1.03 0.00 0.00 54.13 54.22 2dhi s LEU 15 Cb -0.03 -2.77 -0.00 0.00 0.03 0.00 0.00 46.19 43.41 2dhi s LEU 15 CO 0.02 0.27 -0.19 -0.60 0.23 0.00 0.00 176.35 176.09 2dhi s ARG 16 N -0.98 2.14 -0.47 1.70 3.52 -0.88 -0.32 118.95 123.66 2dhi s ARG 16 Ca 0.27 -0.67 -0.28 0.00 -0.13 0.00 0.00 55.73 54.92 2dhi s ARG 16 Cb -0.18 -1.77 0.03 0.00 -1.56 0.00 0.00 34.95 31.47 2dhi s ARG 16 CO 0.16 0.21 1.07 -1.14 -0.81 0.00 0.00 175.30 174.80 2dhi s GLN 17 N 0.19 3.66 0.52 5.12 0.74 -1.00 -2.32 119.66 126.57 2dhi s GLN 17 Ca -0.09 0.44 -0.12 0.00 0.05 0.00 0.00 55.36 55.64 2dhi s GLN 17 Cb -0.14 -3.91 -0.06 0.00 1.10 0.00 0.00 33.01 30.00 2dhi s GLN 17 CO 0.04 -1.34 0.93 0.45 -0.55 0.00 0.00 175.29 174.83 2dhi s SER 18 N 2.40 6.42 -0.13 6.67 0.15 -1.16 -4.75 113.70 123.31 2dhi s SER 18 Ca 0.45 1.35 -0.13 0.00 0.70 0.00 0.00 55.95 58.31 2dhi s SER 18 Cb -0.08 -2.42 -0.12 0.00 -1.71 0.00 0.00 66.02 61.69 2dhi s SER 18 CO 0.30 -0.64 0.29 0.74 1.20 0.00 0.00 173.24 175.13 2dhi h THR 19 N 0.45 0.75 0.66 6.45 2.02 -1.95 -2.05 112.91 119.24 2dhi h THR 19 Ca -0.46 -1.60 -0.03 0.00 0.77 0.00 0.00 66.41 65.09 2dhi h THR 19 Cb 1.19 1.46 0.01 0.00 -1.74 0.00 0.00 68.15 69.06 2dhi h THR 19 CO 0.62 0.25 -0.32 0.40 0.37 0.00 0.00 175.52 176.85 2dhi h ILE 20 N -1.00 0.26 -0.69 3.11 2.04 -2.00 -3.15 117.51 116.09 2dhi h ILE 20 Ca -0.03 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.58 2dhi h ILE 20 Cb 0.53 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 2dhi h ILE 20 CO -0.02 0.02 0.25 -0.07 0.00 0.00 0.00 178.15 178.33 2dhi h LEU 21 N -1.05 0.95 -1.38 1.44 4.07 -2.00 -3.47 115.31 113.89 2dhi h LEU 21 Ca -0.09 -0.15 -0.34 0.00 0.08 0.00 0.00 57.88 57.38 2dhi h LEU 21 Cb 0.72 -0.25 0.15 0.00 1.08 0.00 0.00 40.66 42.36 2dhi h LEU 21 CO 0.15 0.87 -0.70 0.29 -1.08 0.00 0.00 178.44 177.97 2dhi n LYS 22 N -4.28 -6.74 -3.53 1.13 5.02 -0.77 -5.00 118.16 103.99 2dhi n LYS 22 Ca 0.06 0.80 -0.12 0.00 -2.02 0.00 0.00 58.31 57.02 2dhi n LYS 22 Cb 0.20 -5.70 -0.04 0.00 -0.02 0.00 0.00 35.03 29.47 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 -5.63 1.14 -0.39 1.97 1.70 -1.25 -4.93 118.95 111.55 2dhi s ARG 23 Ca 0.20 -0.45 -0.29 0.00 -0.47 0.00 0.00 55.73 54.72 2dhi s ARG 23 Cb -0.09 0.52 0.01 0.00 -0.57 0.00 0.00 34.95 34.83 2dhi s ARG 23 CO 0.69 -0.46 1.27 -1.58 -1.08 0.00 0.00 175.30 174.14 2dhi s TRP 24 N -3.31 2.67 -0.13 5.89 0.52 -1.26 -2.99 118.94 120.33 2dhi s TRP 24 Ca -0.01 0.79 -0.00 0.00 0.02 0.00 0.00 56.10 56.90 2dhi s TRP 24 Cb -0.00 -4.18 -0.02 0.00 -1.15 0.00 0.00 33.47 28.13 2dhi s TRP 24 CO -0.09 -1.58 -0.12 -1.59 0.02 0.00 0.00 176.95 173.59 2dhi s LYS 25 N 4.47 3.40 0.35 4.98 -2.85 -0.98 -4.86 119.74 124.23 2dhi s LYS 25 Ca 0.54 -0.67 -0.29 0.00 -1.00 0.00 0.00 55.97 54.56 2dhi s LYS 25 Cb -0.12 -2.65 -0.11 0.00 -2.06 0.00 0.00 37.83 32.88 2dhi s LYS 25 CO 0.28 0.22 1.52 1.17 0.10 0.00 0.00 175.35 178.64 2dhi n LYS 26 N 3.50 2.66 -3.81 1.78 4.81 -1.26 -2.06 118.16 123.78 2dhi n LYS 26 Ca -0.18 0.94 -0.10 0.00 -0.87 0.00 0.00 58.31 58.09 2dhi n LYS 26 Cb 0.53 -2.68 -0.08 0.00 0.02 0.00 0.00 35.03 32.82 2dhi n LYS 26 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2dhi s ASN 27 N 0.07 -0.02 -0.37 3.14 -0.87 -0.34 -4.81 114.94 111.75 2dhi s ASN 27 Ca 0.57 -0.36 -0.17 0.00 -1.57 0.00 0.00 52.86 51.33 2dhi s ASN 27 Cb -0.49 0.33 0.00 0.00 -0.02 0.00 0.00 41.25 41.07 2dhi s ASN 27 CO 0.59 -0.62 0.44 0.86 -2.57 0.00 0.00 177.10 175.80 2dhi s TRP 28 N -2.85 3.18 0.10 2.20 -0.00 0.26 -2.03 118.94 119.80 2dhi s TRP 28 Ca -0.03 -0.05 0.02 0.00 -0.00 0.00 0.00 56.10 56.04 2dhi s TRP 28 Cb 0.00 -2.84 -0.04 0.00 -0.00 0.00 0.00 33.47 30.60 2dhi s TRP 28 CO -0.05 -0.55 0.20 -0.06 -0.00 0.00 0.00 176.95 176.48 2dhi s PHE 29 N 2.20 3.41 -0.28 5.86 0.40 -1.08 0.51 117.98 129.00 2dhi s PHE 29 Ca 0.15 0.15 -0.14 0.00 -0.60 0.00 0.00 56.93 56.49 2dhi s PHE 29 Cb -0.16 -1.68 0.09 0.00 0.51 0.00 0.00 43.02 41.78 2dhi s PHE 29 CO 0.13 0.55 0.66 -0.51 0.70 0.00 0.00 175.22 176.75 2dhi s ASP 30 N -2.75 -0.98 0.07 1.36 1.11 -1.07 -3.00 116.67 111.40 2dhi s ASP 30 Ca 0.33 1.50 -0.08 0.00 0.18 0.00 0.00 52.55 54.48 2dhi s ASP 30 Cb -0.12 1.64 -0.05 0.00 1.07 0.00 0.00 42.92 45.45 2dhi s ASP 30 CO 0.27 -0.23 0.37 -0.22 1.18 0.00 0.00 175.17 176.53 2dhi s LEU 31 N 2.03 4.35 0.31 1.23 2.96 -0.97 -1.82 118.68 126.77 2dhi s LEU 31 Ca -0.09 0.71 0.06 0.00 -0.22 0.00 0.00 54.13 54.60 2dhi s LEU 31 Cb -0.07 -2.94 -0.02 0.00 0.50 0.00 0.00 46.19 43.66 2dhi s LEU 31 CO -0.19 0.18 0.43 0.26 -1.32 0.00 0.00 176.35 175.71 2dhi s TRP 32 N -1.40 3.17 0.35 5.38 0.52 0.14 0.66 118.94 127.75 2dhi s TRP 32 Ca 0.32 -0.18 0.05 0.00 0.02 0.00 0.00 56.10 56.32 2dhi s TRP 32 Cb -0.14 -1.88 0.64 0.00 -1.15 0.00 0.00 33.47 30.94 2dhi s TRP 32 CO 0.18 0.11 1.89 0.66 0.02 0.00 0.00 176.95 179.81 2dhi h SER 33 N 0.99 0.46 -0.16 2.95 4.64 -1.85 -1.36 113.55 119.23 2dhi h SER 33 Ca -0.47 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 2dhi h SER 33 Cb 1.25 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2dhi h SER 33 CO 0.55 0.53 0.00 0.47 -0.87 0.00 0.00 176.83 177.51 2dhi n ASP 34 N -4.29 1.70 0.00 4.97 8.00 -1.26 -4.87 116.55 120.80 2dhi n ASP 34 Ca 0.01 -2.14 0.00 0.00 0.71 0.00 0.00 54.79 53.37 2dhi n ASP 34 Cb 0.24 -0.38 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 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 0.39 1.83 3.24 0.44 0.00 -0.51 -4.94 105.19 105.64 2dhi n GLY 35 Ca 0.06 -0.32 -0.51 0.00 0.00 0.00 0.00 46.02 45.25 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 0.17 -5.17 1.61 8.25 -1.26 -4.14 115.22 114.68 2dhi n HIS 36 Ca 0.00 0.96 -0.32 0.00 -0.26 0.00 0.00 57.72 58.10 2dhi n HIS 36 Cb 0.00 -1.91 -0.17 0.00 1.12 0.00 0.00 29.99 29.03 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 1.13 2.11 -0.06 2.41 2.96 0.09 0.24 118.68 127.57 2dhi s LEU 37 Ca 0.75 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 2dhi s LEU 37 Cb -1.06 -1.42 0.02 0.00 0.50 0.00 0.00 46.19 44.24 2dhi s LEU 37 CO 0.53 0.16 -0.03 -0.63 -1.32 0.00 0.00 176.35 175.05 2dhi s ILE 38 N 0.37 0.51 -0.00 6.68 1.01 -0.76 -0.81 121.20 128.20 2dhi s ILE 38 Ca -0.18 -0.05 0.06 0.00 0.00 0.00 0.00 60.65 60.48 2dhi s ILE 38 Cb -0.18 -0.58 -0.03 0.00 0.01 0.00 0.00 42.46 41.69 2dhi s ILE 38 CO 0.08 0.24 -0.19 -0.72 0.00 0.00 0.00 174.94 174.36 2dhi s TYR 39 N 1.29 2.55 0.18 3.97 1.13 -1.10 -2.61 117.35 122.77 2dhi s TYR 39 Ca -0.05 -0.26 0.07 0.00 -1.41 0.00 0.00 57.07 55.42 2dhi s TYR 39 Cb -0.14 -1.52 -0.04 0.00 -1.10 0.00 0.00 41.96 39.16 2dhi s TYR 39 CO -0.02 0.17 0.01 0.71 -2.51 0.00 0.00 175.55 173.90 2dhi s TYR 40 N -0.79 2.85 0.34 -3.49 1.51 0.18 -2.16 117.35 115.78 2dhi s TYR 40 Ca 0.13 -0.14 0.13 0.00 -1.01 0.00 0.00 57.07 56.17 2dhi s TYR 40 Cb -0.10 -1.37 0.99 0.00 -0.11 0.00 0.00 41.96 41.37 2dhi s TYR 40 CO 0.02 0.52 1.70 0.22 -1.11 0.00 0.00 175.55 176.91 2dhi h ASP 41 N 2.61 0.59 -5.75 2.29 3.58 -1.63 0.77 116.42 118.88 2dhi h ASP 41 Ca -0.47 0.16 0.31 0.00 0.42 0.00 0.00 57.03 57.45 2dhi h ASP 41 Cb 1.21 0.07 -0.08 0.00 1.72 0.00 0.00 39.33 42.26 2dhi h ASP 41 CO 0.58 0.00 0.83 1.51 -2.88 0.00 0.00 179.24 179.29 2dhi s ASP 42 N -5.07 -0.01 0.52 2.28 1.47 -1.26 -4.20 116.67 110.40 2dhi s ASP 42 Ca -0.10 -0.26 0.34 0.00 1.18 0.00 0.00 52.55 53.71 2dhi s ASP 42 Cb 0.28 0.20 1.17 0.00 -0.34 0.00 0.00 42.92 44.24 2dhi s ASP 42 CO 0.79 -0.40 1.27 0.00 0.68 0.00 0.00 175.17 177.52 2dhi n GLN 43 N -0.77 0.01 -0.68 2.11 -0.00 -1.26 -0.35 117.38 116.43 2dhi n GLN 43 Ca -0.00 0.94 0.52 0.00 -0.00 0.00 0.00 57.00 58.45 2dhi n GLN 43 Cb 0.60 -2.25 0.81 0.00 -0.00 0.00 0.00 30.24 29.40 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 0.01 -4.79 -0.39 1.35 -1.96 -3.43 112.91 103.70 2dhi h THR 44 Ca 0.64 -0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 66.38 2dhi h THR 44 Cb 3.00 0.01 -0.02 0.00 -1.73 0.00 0.00 68.15 69.40 2dhi h THR 44 CO -0.01 0.00 -0.16 0.54 -0.25 0.00 0.00 175.52 175.65 2dhi n ARG 45 N -4.03 -2.70 0.00 4.72 5.12 0.52 -4.65 116.66 115.63 2dhi n ARG 45 Ca 0.44 0.20 0.00 0.00 -1.93 0.00 0.00 57.85 56.56 2dhi n ARG 45 Cb 1.97 -4.74 0.00 0.00 -1.16 0.00 0.00 32.46 28.53 2dhi n ARG 45 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dhi n GLN 46 N -2.71 3.02 -3.48 5.56 10.64 -1.26 -4.94 117.38 124.21 2dhi n GLN 46 Ca -0.04 0.00 -0.43 0.00 -1.83 0.00 0.00 57.00 54.71 2dhi n GLN 46 Cb 0.53 -0.92 -0.06 0.00 -0.86 0.00 0.00 30.24 28.93 2dhi n GLN 46 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 2dhi s SER 47 N -2.79 6.03 -0.01 2.61 0.01 -1.26 -5.05 113.70 113.24 2dhi s SER 47 Ca 0.00 -2.36 -0.30 0.00 1.31 0.00 0.00 55.95 54.60 2dhi s SER 47 Cb 0.00 -2.07 -0.07 0.00 0.21 0.00 0.00 66.02 64.09 2dhi s SER 47 CO 0.00 -0.61 1.76 -0.63 0.41 0.00 0.00 173.24 174.17 2dhi s ILE 48 N 0.69 3.35 -0.07 1.44 -1.09 -1.26 -1.71 121.20 122.55 2dhi s ILE 48 Ca 0.12 0.46 -0.15 0.00 -2.23 0.00 0.00 60.65 58.85 2dhi s ILE 48 Cb -0.20 -3.30 -0.11 0.00 -1.58 0.00 0.00 42.46 37.27 2dhi s ILE 48 CO -0.04 -0.04 0.58 -0.33 -1.23 0.00 0.00 174.94 173.89 2dhi h GLU 49 N 9.78 -0.22 -1.49 2.79 4.39 -1.74 -3.46 114.58 124.63 2dhi h GLU 49 Ca -0.43 0.01 0.29 0.00 0.34 0.00 0.00 59.36 59.57 2dhi h GLU 49 Cb 1.20 0.05 -0.15 0.00 -0.10 0.00 0.00 28.75 29.75 2dhi h GLU 49 CO 0.95 0.10 0.81 0.34 -1.16 0.00 0.00 179.01 180.05 2dhi s ASP 50 N -5.43 -0.10 -0.01 1.42 -1.08 -1.18 -5.04 116.67 105.26 2dhi s ASP 50 Ca -0.09 -0.09 0.04 0.00 -0.52 0.00 0.00 52.55 51.90 2dhi s ASP 50 Cb 0.00 0.17 -0.01 0.00 -1.46 0.00 0.00 42.92 41.62 2dhi s ASP 50 CO 0.32 -0.29 -0.13 -0.75 0.52 0.00 0.00 175.17 174.83 2dhi s LYS 51 N -2.46 1.09 -0.17 4.34 2.20 -1.26 -2.71 119.74 120.76 2dhi s LYS 51 Ca 0.12 -0.47 -0.16 0.00 -0.36 0.00 0.00 55.97 55.10 2dhi s LYS 51 Cb 0.02 -1.05 0.05 0.00 -1.51 0.00 0.00 37.83 35.34 2dhi s LYS 51 CO -0.04 0.28 0.46 0.08 -0.36 0.00 0.00 175.35 175.77 2dhi s VAL 52 N -0.30 -0.00 0.64 4.02 1.01 0.01 -5.03 120.40 120.75 2dhi s VAL 52 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 2dhi s VAL 52 Cb -0.05 -0.65 0.03 0.00 0.00 0.00 0.00 36.38 35.71 2dhi s VAL 52 CO -0.00 0.00 0.95 -2.28 0.00 0.00 0.00 175.10 173.76 2dhi s HIS 53 N 0.27 3.11 0.00 5.22 2.46 -1.26 -0.73 115.29 124.36 2dhi s HIS 53 Ca -0.00 0.56 0.00 0.00 0.47 0.00 0.00 55.06 56.09 2dhi s HIS 53 Cb -0.03 -2.93 0.00 0.00 -0.13 0.00 0.00 32.58 29.49 2dhi s HIS 53 CO 0.00 -1.07 0.00 -1.33 -2.47 0.00 0.00 174.74 169.88 2dhi n MET 54 N -2.72 0.00 0.00 2.88 2.81 -1.26 -2.66 117.12 116.17 2dhi n MET 54 Ca 0.06 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 56.00 2dhi n MET 54 Cb 0.59 -0.36 0.29 0.00 -0.71 0.00 0.00 33.22 33.03 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 -2.45 0.49 0.00 0.03 -0.04 -1.26 0.02 135.00 131.80 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 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 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 -0.81 0.00 -0.03 0.52 0.31 -1.26 -4.87 118.33 112.18 2dhi n VAL 56 Ca 0.07 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.19 2dhi n VAL 56 Cb 0.03 -1.11 -0.13 0.00 -0.91 0.00 0.00 33.84 31.72 2dhi n VAL 56 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2dhi n ASP 57 N -2.77 2.07 -4.72 4.52 8.00 -1.21 -4.84 116.55 117.60 2dhi n ASP 57 Ca 0.00 0.18 -0.40 0.00 0.71 0.00 0.00 54.79 55.28 2dhi n ASP 57 Cb 0.42 -0.80 -0.05 0.00 -0.02 0.00 0.00 41.12 40.68 2dhi n ASP 57 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dhi n ILE 59 N 3.65 0.12 -3.85 0.00 -5.35 -0.23 -4.26 119.36 109.43 2dhi n ILE 59 Ca -0.02 -0.13 -0.11 0.00 -0.27 0.00 0.00 62.75 62.23 2dhi n ILE 59 Cb 0.51 -0.16 -0.09 0.00 -1.74 0.00 0.00 39.64 38.17 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 -2.91 0.03 -0.20 7.28 2.47 -1.14 -5.05 114.94 115.41 2dhi s ASN 60 Ca -0.02 -0.31 0.00 0.00 0.42 0.00 0.00 52.86 52.95 2dhi s ASN 60 Cb 0.02 0.26 0.05 0.00 -1.45 0.00 0.00 41.25 40.13 2dhi s ASN 60 CO 0.17 -0.50 -0.06 -0.63 -3.72 0.00 0.00 177.10 172.35 2dhi s ILE 61 N -2.20 1.38 -0.30 -5.21 1.01 -1.26 -0.71 121.20 113.90 2dhi s ILE 61 Ca -0.08 -0.94 -0.12 0.00 0.00 0.00 0.00 60.65 59.52 2dhi s ILE 61 Cb -0.03 -1.57 -0.04 0.00 0.01 0.00 0.00 42.46 40.83 2dhi s ILE 61 CO -0.02 0.05 0.21 -0.13 0.00 0.00 0.00 174.94 175.05 2dhi s ARG 62 N 1.49 3.76 -0.02 2.79 0.52 -0.72 -4.98 118.95 121.80 2dhi s ARG 62 Ca -0.02 -0.45 -0.01 0.00 -0.52 0.00 0.00 55.73 54.72 2dhi s ARG 62 Cb -0.17 -3.72 0.01 0.00 0.52 0.00 0.00 34.95 31.60 2dhi s ARG 62 CO -0.07 -0.29 0.04 0.95 0.02 0.00 0.00 175.30 175.95 2dhi s THR 63 N 1.74 -0.02 0.00 0.02 -4.23 -1.26 -0.97 115.64 110.92 2dhi s THR 63 Ca 0.07 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.63 2dhi s THR 63 Cb -0.17 -0.07 0.00 0.00 1.34 0.00 0.00 72.50 73.60 2dhi s THR 63 CO 0.11 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2dhi n GLY 64 N 3.37 1.83 2.11 3.99 0.00 -1.20 -3.82 105.19 111.46 2dhi n GLY 64 Ca -0.16 -0.24 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 2dhi n GLY 64 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dhi n HIS 65 N 0.00 2.57 -0.02 1.61 8.25 -1.26 -4.14 115.22 122.23 2dhi n HIS 65 Ca 0.00 -2.31 -0.02 0.00 -0.26 0.00 0.00 57.72 55.13 2dhi n HIS 65 Cb 0.00 -1.13 -0.02 0.00 1.12 0.00 0.00 29.99 29.97 2dhi n HIS 65 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2dhi n GLU 66 N -0.57 0.58 -3.04 -0.41 1.02 -1.25 -5.00 120.64 111.98 2dhi n GLU 66 Ca 0.50 0.02 -0.40 0.00 -0.02 0.00 0.00 57.16 57.25 2dhi n GLU 66 Cb 0.89 -1.06 -0.05 0.00 -0.02 0.00 0.00 31.44 31.20 2dhi n GLU 66 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dhi n ARG 68 N 4.79 1.48 0.00 0.00 1.74 -1.26 -4.72 116.66 118.68 2dhi n ARG 68 Ca 0.00 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.12 2dhi n ARG 68 Cb 0.50 -0.74 0.19 0.00 -1.02 0.00 0.00 32.46 31.39 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 -1.40 0.00 -3.35 0.55 2.03 -1.26 -4.69 116.55 108.43 2dhi n ASP 69 Ca 0.00 0.17 -0.17 0.00 0.52 0.00 0.00 54.79 55.31 2dhi n ASP 69 Cb 0.24 -0.28 -0.04 0.00 -0.72 0.00 0.00 41.12 40.32 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 -1.28 0.00 -3.70 5.18 -5.35 -1.26 -5.17 119.36 107.78 2dhi n ILE 70 Ca 0.04 -1.35 -0.12 0.00 -0.27 0.00 0.00 62.75 61.04 2dhi n ILE 70 Cb 0.06 0.32 -0.09 0.00 -1.74 0.00 0.00 39.64 38.18 2dhi n ILE 70 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2dhi s GLN 71 N -3.00 0.56 0.50 6.28 -0.21 -1.26 -5.09 119.66 117.44 2dhi s GLN 71 Ca 0.03 0.75 -0.21 0.00 0.02 0.00 0.00 55.36 55.94 2dhi s GLN 71 Cb 0.00 0.22 -0.07 0.00 1.00 0.00 0.00 33.01 34.16 2dhi s GLN 71 CO 0.02 -0.09 1.15 -1.25 -2.12 0.00 0.00 175.29 172.99 2dhi s PRO 72 N 0.58 3.56 0.13 2.91 0.04 -1.26 -4.98 135.00 135.97 2dhi s PRO 72 Ca -0.03 1.69 -0.31 0.00 0.04 0.00 0.00 61.00 62.40 2dhi s PRO 72 Cb -0.05 -2.21 -0.08 0.00 0.04 0.00 0.00 34.50 32.21 2dhi s PRO 72 CO -0.03 -0.70 1.35 -1.25 0.04 0.00 0.00 177.00 176.40 2dhi s PRO 73 N -2.99 4.35 -0.41 0.56 0.04 -1.26 -4.85 135.00 130.44 2dhi s PRO 73 Ca 0.68 2.04 -0.37 0.00 0.04 0.00 0.00 61.00 63.39 2dhi s PRO 73 Cb -0.26 -3.24 -0.16 0.00 0.04 0.00 0.00 34.50 30.88 2dhi s PRO 73 CO 0.31 -0.37 1.64 -3.47 0.04 0.00 0.00 177.00 175.15 2dhi n ASP 74 N 3.57 0.71 0.00 6.66 2.03 -1.26 -0.13 116.55 128.12 2dhi n ASP 74 Ca 0.10 0.66 0.00 0.00 0.52 0.00 0.00 54.79 56.07 2dhi n ASP 74 Cb 0.43 -0.73 0.00 0.00 -0.72 0.00 0.00 41.12 40.10 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 5.42 3.02 3.81 0.27 0.00 -1.26 -5.09 105.19 111.37 2dhi n GLY 75 Ca 0.40 -1.13 -0.37 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 4.25 0.00 1.61 1.02 0.81 -5.08 119.74 122.35 2dhi s LYS 76 Ca 0.00 0.82 0.00 0.00 0.02 0.00 0.00 55.97 56.81 2dhi s LYS 76 Cb 0.00 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 2dhi s LYS 76 CO 0.00 0.51 0.00 -0.35 -0.92 0.00 0.00 175.35 174.59 2dhi n PRO 77 N 1.19 -0.43 -0.12 -1.68 -0.04 -1.26 -4.57 135.00 128.09 2dhi n PRO 77 Ca -0.06 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.23 2dhi n PRO 77 Cb 0.51 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.84 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 -1.07 0.65 0.24 0.54 0.63 -1.26 -4.28 116.66 112.12 2dhi n ARG 78 Ca 0.00 0.13 0.17 0.00 -0.92 0.00 0.00 57.85 57.22 2dhi n ARG 78 Cb 0.00 -1.52 0.86 0.00 0.45 0.00 0.00 32.46 32.25 2dhi n ARG 78 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 2dhi h ASP 79 N 0.00 0.00 -0.30 6.15 3.32 -1.96 0.30 116.42 123.93 2dhi h ASP 79 Ca -0.57 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.48 2dhi h ASP 79 Cb 1.94 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.49 2dhi h ASP 79 CO -0.07 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.45 2dhi s LEU 81 N -1.03 4.37 -0.06 0.00 1.43 0.09 -1.78 118.68 121.71 2dhi s LEU 81 Ca 0.21 0.94 0.03 0.00 -1.03 0.00 0.00 54.13 54.29 2dhi s LEU 81 Cb 0.12 -2.71 0.00 0.00 0.03 0.00 0.00 46.19 43.63 2dhi s LEU 81 CO 0.13 0.13 -0.16 -0.22 0.23 0.00 0.00 176.35 176.46 2dhi s LEU 82 N -0.12 1.84 -0.01 1.79 2.96 0.39 -3.26 118.68 122.27 2dhi s LEU 82 Ca 0.26 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.82 2dhi s LEU 82 Cb -0.16 -1.00 0.00 0.00 0.50 0.00 0.00 46.19 45.53 2dhi s LEU 82 CO 0.13 0.11 -0.05 -1.58 -1.32 0.00 0.00 176.35 173.64 2dhi s GLN 83 N 0.35 0.49 -0.36 1.98 0.74 -0.14 0.72 119.66 123.43 2dhi s GLN 83 Ca -0.11 -0.15 0.01 0.00 0.05 0.00 0.00 55.36 55.15 2dhi s GLN 83 Cb -0.14 -0.50 0.10 0.00 1.10 0.00 0.00 33.01 33.56 2dhi s GLN 83 CO 0.04 0.06 0.10 0.42 -0.55 0.00 0.00 175.29 175.36 2dhi s ILE 84 N 0.16 2.75 -0.42 -2.34 -1.09 -0.17 -1.75 121.20 118.34 2dhi s ILE 84 Ca -0.02 -2.12 -0.28 0.00 -2.23 0.00 0.00 60.65 56.00 2dhi s ILE 84 Cb -0.05 -2.91 0.00 0.00 -1.58 0.00 0.00 42.46 37.92 2dhi s ILE 84 CO -0.00 -0.57 1.53 -0.69 -1.23 0.00 0.00 174.94 173.98 2dhi s VAL 85 N 1.04 3.76 0.26 2.92 1.01 0.12 -0.57 120.40 128.93 2dhi s VAL 85 Ca 0.08 0.75 -0.02 0.00 0.00 0.00 0.00 61.98 62.78 2dhi s VAL 85 Cb -0.21 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 2dhi s VAL 85 CO -0.06 -0.73 0.49 0.00 0.00 0.00 0.00 175.10 174.80 2dhi n ARG 87 N -0.95 -2.53 -3.75 0.00 1.74 0.88 -0.72 116.66 111.33 2dhi n ARG 87 Ca -0.03 -0.75 -0.24 0.00 -0.77 0.00 0.00 57.85 56.05 2dhi n ARG 87 Cb 0.54 -1.54 0.04 0.00 -1.02 0.00 0.00 32.46 30.48 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 -1.81 -2.98 -3.28 0.55 2.03 -1.26 -1.28 116.55 108.53 2dhi n ASP 88 Ca 0.06 -0.77 -0.21 0.00 0.52 0.00 0.00 54.79 54.39 2dhi n ASP 88 Cb 0.39 -4.15 -0.01 0.00 -0.72 0.00 0.00 41.12 36.63 2dhi n ASP 88 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dhi n GLY 89 N -1.63 -0.48 3.96 0.27 0.00 -1.25 -4.93 105.19 101.12 2dhi n GLY 89 Ca -0.15 0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 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 -5.91 3.46 -0.25 1.61 2.20 0.10 -4.99 119.74 115.96 2dhi s LYS 90 Ca 0.35 -0.62 -0.22 0.00 -0.36 0.00 0.00 55.97 55.13 2dhi s LYS 90 Cb -0.19 -2.86 0.06 0.00 -1.51 0.00 0.00 37.83 33.33 2dhi s LYS 90 CO 0.44 0.40 0.65 0.99 -0.36 0.00 0.00 175.35 177.47 2dhi s THR 91 N -1.97 -0.00 -0.14 3.43 2.01 -1.26 0.10 115.64 117.81 2dhi s THR 91 Ca 0.35 0.00 -0.02 0.00 0.31 0.00 0.00 61.69 62.34 2dhi s THR 91 Cb -0.10 -0.91 -0.02 0.00 0.01 0.00 0.00 72.50 71.48 2dhi s THR 91 CO 0.30 0.00 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.51 2dhi s ILE 92 N 0.48 3.45 -0.23 1.82 1.01 0.27 -4.89 121.20 123.10 2dhi s ILE 92 Ca -0.01 -0.52 -0.14 0.00 0.00 0.00 0.00 60.65 59.97 2dhi s ILE 92 Cb -0.05 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 2dhi s ILE 92 CO -0.01 0.52 0.34 -0.44 0.00 0.00 0.00 174.94 175.35 2dhi s SER 93 N 0.28 6.31 0.07 3.58 0.01 -1.26 -1.00 113.70 121.68 2dhi s SER 93 Ca -0.07 0.35 0.02 0.00 1.31 0.00 0.00 55.95 57.56 2dhi s SER 93 Cb -0.15 -2.20 -0.03 0.00 0.21 0.00 0.00 66.02 63.85 2dhi s SER 93 CO 0.04 -0.09 -0.06 -0.76 0.41 0.00 0.00 173.24 172.78 2dhi s LEU 94 N 1.52 2.41 -0.06 2.44 1.43 0.22 -2.36 118.68 124.29 2dhi s LEU 94 Ca 0.15 -0.83 -0.02 0.00 -1.03 0.00 0.00 54.13 52.40 2dhi s LEU 94 Cb -0.15 -0.07 0.03 0.00 0.03 0.00 0.00 46.19 46.04 2dhi s LEU 94 CO 0.08 -0.39 0.13 0.00 0.23 0.00 0.00 176.35 176.40 2dhi s ALA 96 N 1.05 3.59 0.22 0.00 0.00 -0.73 -0.66 121.76 125.24 2dhi s ALA 96 Ca -0.08 -0.43 -0.10 0.00 0.00 0.00 0.00 51.96 51.35 2dhi s ALA 96 Cb -0.11 -2.37 0.33 0.00 0.00 0.00 0.00 23.12 20.97 2dhi s ALA 96 CO -0.05 0.34 1.66 1.49 0.00 0.00 0.00 175.76 179.19 2dhi h GLU 97 N 2.01 0.11 -3.80 0.00 4.57 -1.88 -3.44 114.58 112.14 2dhi h GLU 97 Ca -0.47 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 57.61 2dhi h GLU 97 Cb 1.18 -0.03 -0.12 0.00 -0.16 0.00 0.00 28.75 29.62 2dhi h GLU 97 CO 0.67 0.07 -0.28 0.45 -1.18 0.00 0.00 179.01 178.75 2dhi s SER 98 N -5.23 0.01 0.27 1.04 0.15 -1.26 -4.97 113.70 103.71 2dhi s SER 98 Ca -0.13 -0.80 -0.10 0.00 0.70 0.00 0.00 55.95 55.62 2dhi s SER 98 Cb 0.20 0.44 0.41 0.00 -1.71 0.00 0.00 66.02 65.37 2dhi s SER 98 CO 0.74 -0.90 1.56 0.74 1.20 0.00 0.00 173.24 176.59 2dhi h THR 99 N 2.52 0.01 -0.13 6.45 2.02 -1.89 0.22 112.91 122.10 2dhi h THR 99 Ca -0.32 0.00 0.05 0.00 0.77 0.00 0.00 66.41 66.91 2dhi h THR 99 Cb 1.23 0.01 -0.06 0.00 -1.74 0.00 0.00 68.15 67.59 2dhi h THR 99 CO 0.48 0.00 -0.30 0.44 0.37 0.00 0.00 175.52 176.50 2dhi h ASP 100 N -0.00 -0.94 -0.68 4.18 3.32 -1.96 -0.24 116.42 120.10 2dhi h ASP 100 Ca 0.45 0.14 0.11 0.00 0.02 0.00 0.00 57.03 57.75 2dhi h ASP 100 Cb 0.70 0.40 -0.08 0.00 0.22 0.00 0.00 39.33 40.57 2dhi h ASP 100 CO -1.01 -0.34 0.27 0.44 -1.72 0.00 0.00 179.24 176.88 2dhi h ASP 101 N -0.37 0.28 0.68 6.45 5.19 -1.00 -1.39 116.42 126.26 2dhi h ASP 101 Ca 0.10 0.09 -0.03 0.00 -0.62 0.00 0.00 57.03 56.56 2dhi h ASP 101 Cb 0.53 0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.10 2dhi h ASP 101 CO -0.34 0.14 -0.36 0.00 -3.12 0.00 0.00 179.24 175.56 2dhi h LEU 103 N -0.95 -1.45 -0.74 0.00 3.38 -0.83 0.13 115.31 114.84 2dhi h LEU 103 Ca -0.09 0.25 0.08 0.00 0.09 0.00 0.00 57.88 58.20 2dhi h LEU 103 Cb 0.74 0.67 -0.11 0.00 0.09 0.00 0.00 40.66 42.06 2dhi h LEU 103 CO 0.13 -0.32 -0.56 0.00 0.09 0.00 0.00 178.44 177.78 2dhi h ALA 104 N 0.73 -0.59 -0.54 1.53 0.00 -1.23 0.25 119.26 119.41 2dhi h ALA 104 Ca 0.20 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.21 2dhi h ALA 104 Cb 0.56 1.23 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 2dhi h ALA 104 CO -0.71 -0.98 0.33 -1.49 0.00 0.00 0.00 179.25 176.40 2dhi h TRP 105 N -0.17 0.61 -0.18 0.00 4.06 -0.92 -2.59 115.95 116.75 2dhi h TRP 105 Ca 0.14 0.02 0.05 0.00 2.06 0.00 0.00 58.89 61.16 2dhi h TRP 105 Cb 0.50 -0.20 -0.06 0.00 -1.00 0.00 0.00 29.16 28.41 2dhi h TRP 105 CO -0.88 0.35 -0.19 -0.22 -3.56 0.00 0.00 178.44 173.93 2dhi h LYS 106 N 0.65 -0.21 -0.24 0.49 3.64 0.14 0.13 116.57 121.17 2dhi h LYS 106 Ca 0.22 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.67 2dhi h LYS 106 Cb 0.02 0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 31.82 2dhi h LYS 106 CO -0.10 -0.14 -0.20 0.74 -2.27 0.00 0.00 179.45 177.48 2dhi h PHE 107 N -0.22 -0.52 -0.23 1.91 0.04 -0.33 0.24 116.94 117.82 2dhi h PHE 107 Ca 0.12 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.94 2dhi h PHE 107 Cb 0.39 0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.79 2dhi h PHE 107 CO -0.33 -0.28 0.10 1.15 -0.60 0.00 0.00 178.31 178.36 2dhi h THR 108 N -0.20 0.97 -0.55 -1.55 2.02 -1.06 -2.49 112.91 110.05 2dhi h THR 108 Ca 0.14 -0.08 0.03 0.00 0.77 0.00 0.00 66.41 67.27 2dhi h THR 108 Cb 0.41 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 2dhi h THR 108 CO -0.36 0.04 0.33 -0.07 0.37 0.00 0.00 175.52 175.83 2dhi h LEU 109 N 0.22 0.53 -2.56 2.58 3.38 -0.15 0.19 115.31 119.51 2dhi h LEU 109 Ca 0.10 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2dhi h LEU 109 Cb 0.04 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2dhi h LEU 109 CO -0.08 0.37 0.00 1.56 0.09 0.00 0.00 178.44 180.38 2dhi h GLN 110 N 0.65 0.00 0.00 1.13 1.08 -0.20 -2.16 115.11 115.62 2dhi h GLN 110 Ca 0.22 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.22 2dhi h GLN 110 Cb 0.04 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 2dhi h GLN 110 CO -0.10 0.00 -1.39 -3.47 -0.95 0.00 0.00 178.83 172.91 2dhi n ASP 111 N -2.88 1.89 -0.34 1.46 2.03 -0.16 -4.05 116.55 114.51 2dhi n ASP 111 Ca -0.02 0.43 0.21 0.00 0.52 0.00 0.00 54.79 55.93 2dhi n ASP 111 Cb 0.07 -0.87 0.45 0.00 -0.72 0.00 0.00 41.12 40.05 2dhi n ASP 111 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2dhi h SER 112 N -1.00 0.56 0.41 1.67 4.64 -0.52 0.90 113.55 120.20 2dhi h SER 112 Ca -0.31 0.12 -0.05 0.00 -0.47 0.00 0.00 61.79 61.08 2dhi h SER 112 Cb 1.16 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 2dhi h SER 112 CO -0.19 0.08 -0.23 0.08 -0.87 0.00 0.00 176.83 175.70 2dhi h ARG 113 N 0.48 0.00 -1.03 4.77 0.11 -1.59 -3.14 114.38 113.98 2dhi h ARG 113 Ca 0.63 0.00 0.35 0.00 0.10 0.00 0.00 59.98 61.06 2dhi h ARG 113 Cb 1.41 0.00 -0.10 0.00 1.11 0.00 0.00 29.97 32.39 2dhi h ARG 113 CO -0.40 0.23 0.67 -2.37 0.10 0.00 0.00 179.97 178.20 2dhi n THR 114 N -3.87 -0.17 -4.16 0.08 5.66 0.31 -4.58 114.28 107.56 2dhi n THR 114 Ca -0.02 1.28 -0.29 0.00 -3.05 0.00 0.00 64.05 61.96 2dhi n THR 114 Cb 0.32 -2.09 -0.06 0.00 -1.55 0.00 0.00 70.33 66.95 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 -4.06 -0.13 0.00 1.09 2.88 -1.19 -4.78 113.62 107.44 2dhi n SER 115 Ca 0.29 -1.13 0.00 0.00 -1.33 0.00 0.00 58.87 56.70 2dhi n SER 115 Cb 1.16 -2.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.25 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 -2.13 -0.80 3.70 0.46 0.00 -1.26 -5.12 105.19 100.03 2dhi n GLY 116 Ca -0.26 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.30 2dhi n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dhi s PRO 117 N -1.50 4.30 -0.16 1.61 0.04 -1.26 -4.95 135.00 133.09 2dhi s PRO 117 Ca 0.00 2.03 -0.27 0.00 0.04 0.00 0.00 61.00 62.80 2dhi s PRO 117 Cb 0.00 -3.41 -0.24 0.00 0.04 0.00 0.00 34.50 30.88 2dhi s PRO 117 CO 0.00 -0.50 0.64 1.03 0.04 0.00 0.00 177.00 178.20 2dhi h SER 118 N 7.34 0.00 -3.71 6.66 0.87 -1.97 -3.47 113.55 119.26 2dhi h SER 118 Ca -0.40 -0.88 -0.54 0.00 -1.23 0.00 0.00 61.79 58.73 2dhi h SER 118 Cb 1.20 0.00 -0.19 0.00 -0.44 0.00 0.00 62.40 62.97 2dhi h SER 118 CO 0.88 1.11 -0.80 -0.94 -0.53 0.00 0.00 176.83 176.55 2dhi s SER 119 N -6.36 2.69 0.00 6.23 1.04 -1.26 -5.23 113.70 110.81 2dhi s SER 119 Ca -0.21 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 55.41 2dhi s SER 119 Cb -0.01 -0.16 0.00 0.00 0.10 0.00 0.00 66.02 65.95 2dhi s SER 119 CO 0.66 0.00 0.10 0.61 0.98 0.00 0.00 173.24 175.59