#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhi n SER 2 N 0.00 1.53 -4.02 1.61 2.88 -1.26 0.29 113.62 114.65 2dhi n SER 2 Ca 0.00 0.64 -0.31 0.00 -1.33 0.00 0.00 58.87 57.87 2dhi n SER 2 Cb 0.00 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 2dhi n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dhi n SER 3 N 8.05 -3.46 0.00 -3.46 7.64 -1.26 -2.04 113.62 119.08 2dhi n SER 3 Ca 0.45 -0.89 0.00 0.00 1.01 0.00 0.00 58.87 59.43 2dhi n SER 3 Cb 0.09 -3.39 0.00 0.00 -1.01 0.00 0.00 64.21 59.90 2dhi n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dhi n GLY 4 N -1.61 -2.44 3.55 0.23 0.00 0.14 -3.89 105.19 101.17 2dhi n GLY 4 Ca -0.01 -1.92 -0.36 0.00 0.00 0.00 0.00 46.02 43.72 2dhi n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dhi n SER 5 N 0.10 2.15 -4.11 1.61 7.64 -1.26 -2.43 113.62 117.32 2dhi n SER 5 Ca 0.00 -0.46 -0.33 0.00 1.01 0.00 0.00 58.87 59.09 2dhi n SER 5 Cb 0.00 -1.53 -0.02 0.00 -1.01 0.00 0.00 64.21 61.65 2dhi n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dhi n SER 6 N 15.53 -2.92 -4.40 6.43 2.88 -1.26 -4.81 113.62 125.07 2dhi n SER 6 Ca 0.39 -0.97 -0.44 0.00 -1.33 0.00 0.00 58.87 56.53 2dhi n SER 6 Cb 0.51 -3.04 -0.01 0.00 -0.75 0.00 0.00 64.21 60.92 2dhi n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dhi n GLY 7 N -1.58 -1.84 3.73 0.46 0.00 -0.87 -4.83 105.19 100.26 2dhi n GLY 7 Ca -0.02 0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.34 3.54 0.12 1.61 0.08 -1.26 -4.17 117.98 116.56 2dhi s PHE 8 Ca 0.62 1.00 -0.33 0.00 0.12 0.00 0.00 56.93 58.34 2dhi s PHE 8 Cb -0.73 -2.61 -0.12 0.00 -0.57 0.00 0.00 43.02 38.99 2dhi s PHE 8 CO 0.59 0.17 1.53 0.28 -0.10 0.00 0.00 175.22 177.70 2dhi h VAL 9 N 4.67 0.00 -3.80 -0.44 2.07 -0.50 -3.44 116.25 114.81 2dhi h VAL 9 Ca -0.41 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 66.92 2dhi h VAL 9 Cb 1.19 0.00 -0.23 0.00 -1.52 0.00 0.00 31.29 30.72 2dhi h VAL 9 CO 0.75 0.00 -0.66 -0.75 0.02 0.00 0.00 177.57 176.93 2dhi s LYS 10 N -5.60 0.25 -0.02 1.57 2.20 -1.26 -5.01 119.74 111.87 2dhi s LYS 10 Ca -0.15 -0.37 0.00 0.00 -0.36 0.00 0.00 55.97 55.10 2dhi s LYS 10 Cb 0.07 0.09 0.02 0.00 -1.51 0.00 0.00 37.83 36.51 2dhi s LYS 10 CO 0.59 -0.05 0.01 -1.54 -0.36 0.00 0.00 175.35 174.01 2dhi s SER 11 N -0.97 0.19 0.23 1.43 1.04 -1.26 -2.44 113.70 111.91 2dhi s SER 11 Ca -0.11 0.01 -0.22 0.00 0.48 0.00 0.00 55.95 56.11 2dhi s SER 11 Cb -0.07 -0.11 0.05 0.00 0.10 0.00 0.00 66.02 65.99 2dhi s SER 11 CO -0.00 -0.09 0.85 -0.83 0.98 0.00 0.00 173.24 174.15 2dhi s GLY 12 N 0.83 -0.11 -0.12 7.32 0.00 -1.20 -5.05 107.32 108.99 2dhi s GLY 12 Ca -0.07 -0.15 -0.23 0.00 0.00 0.00 0.00 44.72 44.27 2dhi s GLY 12 CO -0.02 0.07 0.69 -0.98 0.00 0.00 0.00 173.10 172.86 2dhi s TRP 13 N -3.42 3.50 -0.01 1.90 0.52 -1.26 -2.82 118.94 117.35 2dhi s TRP 13 Ca 0.13 1.14 -0.06 0.00 0.02 0.00 0.00 56.10 57.33 2dhi s TRP 13 Cb -0.04 -2.82 0.00 0.00 -1.15 0.00 0.00 33.47 29.47 2dhi s TRP 13 CO 0.05 -0.02 0.12 -0.51 0.02 0.00 0.00 176.95 176.60 2dhi s LEU 14 N 1.28 1.63 0.16 2.99 1.43 -0.13 -4.60 118.68 121.44 2dhi s LEU 14 Ca 0.35 -0.15 -0.12 0.00 -1.03 0.00 0.00 54.13 53.17 2dhi s LEU 14 Cb -0.17 0.56 -0.07 0.00 0.03 0.00 0.00 46.19 46.54 2dhi s LEU 14 CO 0.15 -0.30 0.53 -0.76 0.23 0.00 0.00 176.35 176.19 2dhi s LEU 15 N -1.11 4.29 -0.02 1.79 1.43 -0.99 0.27 118.68 124.34 2dhi s LEU 15 Ca -0.12 0.99 0.02 0.00 -1.03 0.00 0.00 54.13 53.99 2dhi s LEU 15 Cb -0.07 -3.34 0.01 0.00 0.03 0.00 0.00 46.19 42.82 2dhi s LEU 15 CO 0.01 0.06 -0.06 -0.60 0.23 0.00 0.00 176.35 176.00 2dhi s ARG 16 N -2.19 0.65 -0.42 1.70 3.52 -1.14 -1.66 118.95 119.40 2dhi s ARG 16 Ca 0.40 -0.19 -0.24 0.00 -0.13 0.00 0.00 55.73 55.57 2dhi s ARG 16 Cb -0.14 -0.65 0.02 0.00 -1.56 0.00 0.00 34.95 32.63 2dhi s ARG 16 CO 0.20 0.06 0.81 -1.14 -0.81 0.00 0.00 175.30 174.42 2dhi s GLN 17 N 0.25 3.54 0.39 5.12 0.74 -1.00 -2.52 119.66 126.17 2dhi s GLN 17 Ca -0.03 0.08 -0.11 0.00 0.05 0.00 0.00 55.36 55.35 2dhi s GLN 17 Cb -0.07 -3.89 -0.07 0.00 1.10 0.00 0.00 33.01 30.07 2dhi s GLN 17 CO -0.00 -1.05 0.76 0.45 -0.55 0.00 0.00 175.29 174.90 2dhi s SER 18 N 2.07 6.57 0.15 6.67 0.15 -1.23 -4.73 113.70 123.35 2dhi s SER 18 Ca 0.32 1.16 0.02 0.00 0.70 0.00 0.00 55.95 58.15 2dhi s SER 18 Cb -0.12 -2.33 -0.06 0.00 -1.71 0.00 0.00 66.02 61.79 2dhi s SER 18 CO 0.22 -0.36 1.34 0.74 1.20 0.00 0.00 173.24 176.37 2dhi h THR 19 N 1.27 1.52 0.05 6.45 2.02 -1.96 0.23 112.91 122.49 2dhi h THR 19 Ca -0.47 -2.76 -0.00 0.00 0.77 0.00 0.00 66.41 63.95 2dhi h THR 19 Cb 1.18 2.56 0.00 0.00 -1.74 0.00 0.00 68.15 70.16 2dhi h THR 19 CO 0.64 0.80 -0.02 0.40 0.37 0.00 0.00 175.52 177.71 2dhi h ILE 20 N 0.09 0.19 0.00 3.11 1.08 -1.99 -3.34 117.51 116.65 2dhi h ILE 20 Ca -0.05 -1.08 -0.06 0.00 -0.39 0.00 0.00 64.86 63.28 2dhi h ILE 20 Cb 1.59 0.35 -0.01 0.00 -3.07 0.00 0.00 36.82 35.68 2dhi h ILE 20 CO 0.14 0.06 -0.29 -0.07 -0.69 0.00 0.00 178.15 177.30 2dhi h LEU 21 N -1.01 0.00 -1.86 1.44 3.38 -1.99 -3.47 115.31 111.80 2dhi h LEU 21 Ca -0.01 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.49 2dhi h LEU 21 Cb 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2dhi h LEU 21 CO 0.01 0.29 -0.87 0.29 0.09 0.00 0.00 178.44 178.26 2dhi n LYS 22 N -3.66 -3.76 -3.51 1.13 5.02 0.07 -4.96 118.16 108.49 2dhi n LYS 22 Ca -0.01 0.47 -0.12 0.00 -2.02 0.00 0.00 58.31 56.62 2dhi n LYS 22 Cb 0.41 -4.72 -0.04 0.00 -0.02 0.00 0.00 35.03 30.66 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 -6.39 0.91 -0.24 1.97 1.70 -1.25 -4.94 118.95 110.71 2dhi s ARG 23 Ca 0.01 -0.07 -0.29 0.00 -0.47 0.00 0.00 55.73 54.91 2dhi s ARG 23 Cb -0.00 0.42 -0.01 0.00 -0.57 0.00 0.00 34.95 34.79 2dhi s ARG 23 CO 0.87 -0.34 1.38 -1.58 -1.08 0.00 0.00 175.30 174.54 2dhi s TRP 24 N -2.20 2.56 -0.12 5.89 0.52 -1.26 -3.49 118.94 120.84 2dhi s TRP 24 Ca -0.02 0.80 0.02 0.00 0.02 0.00 0.00 56.10 56.92 2dhi s TRP 24 Cb -0.01 -3.83 0.01 0.00 -1.15 0.00 0.00 33.47 28.50 2dhi s TRP 24 CO -0.02 -2.08 -0.18 -1.59 0.02 0.00 0.00 176.95 173.10 2dhi s LYS 25 N 4.11 2.54 0.11 4.98 -2.85 -1.05 -4.87 119.74 122.72 2dhi s LYS 25 Ca 0.60 -0.68 -0.34 0.00 -1.00 0.00 0.00 55.97 54.55 2dhi s LYS 25 Cb -0.20 -2.11 -0.18 0.00 -2.06 0.00 0.00 37.83 33.28 2dhi s LYS 25 CO 0.23 -0.05 0.95 1.17 0.10 0.00 0.00 175.35 177.75 2dhi n LYS 26 N 4.17 0.40 -3.93 1.78 4.81 -1.26 -2.90 118.16 121.23 2dhi n LYS 26 Ca -0.19 0.14 -0.09 0.00 -0.87 0.00 0.00 58.31 57.30 2dhi n LYS 26 Cb 0.51 -1.50 -0.09 0.00 0.02 0.00 0.00 35.03 33.97 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 -0.28 0.19 -0.35 3.14 0.02 0.14 -4.90 114.94 112.91 2dhi s ASN 27 Ca 0.77 -0.58 -0.10 0.00 -1.02 0.00 0.00 52.86 51.94 2dhi s ASN 27 Cb -1.03 0.24 0.02 0.00 0.02 0.00 0.00 41.25 40.49 2dhi s ASN 27 CO 0.55 -0.54 0.18 0.86 0.02 0.00 0.00 177.10 178.18 2dhi s TRP 28 N -2.82 3.22 0.11 2.20 -0.11 -1.07 -0.96 118.94 119.52 2dhi s TRP 28 Ca -0.03 -0.88 0.00 0.00 1.22 0.00 0.00 56.10 56.41 2dhi s TRP 28 Cb 0.00 -2.40 -0.04 0.00 -1.50 0.00 0.00 33.47 29.53 2dhi s TRP 28 CO -0.06 -0.60 0.27 -0.06 -4.62 0.00 0.00 176.95 171.89 2dhi s PHE 29 N 1.56 3.50 -0.25 5.86 0.40 -1.13 0.04 117.98 127.96 2dhi s PHE 29 Ca 0.03 0.25 -0.03 0.00 -0.60 0.00 0.00 56.93 56.57 2dhi s PHE 29 Cb -0.19 -1.77 0.14 0.00 0.51 0.00 0.00 43.02 41.72 2dhi s PHE 29 CO 0.06 0.53 0.45 -0.51 0.70 0.00 0.00 175.22 176.45 2dhi s ASP 30 N -2.80 -0.31 0.16 1.36 1.01 -0.82 -3.26 116.67 112.01 2dhi s ASP 30 Ca 0.36 0.58 -0.24 0.00 0.71 0.00 0.00 52.55 53.96 2dhi s ASP 30 Cb -0.12 1.47 -0.08 0.00 1.01 0.00 0.00 42.92 45.20 2dhi s ASP 30 CO 0.28 -0.27 0.75 -0.22 0.21 0.00 0.00 175.17 175.91 2dhi s LEU 31 N 2.65 4.58 0.53 1.23 2.96 -1.02 -2.14 118.68 127.47 2dhi s LEU 31 Ca 0.11 1.59 0.02 0.00 -0.22 0.00 0.00 54.13 55.63 2dhi s LEU 31 Cb -0.15 -3.25 0.03 0.00 0.50 0.00 0.00 46.19 43.32 2dhi s LEU 31 CO -0.17 0.21 0.74 0.26 -1.32 0.00 0.00 176.35 176.08 2dhi s TRP 32 N -1.16 2.87 0.28 5.38 0.52 0.82 0.18 118.94 127.83 2dhi s TRP 32 Ca 0.35 -0.05 0.11 0.00 0.02 0.00 0.00 56.10 56.53 2dhi s TRP 32 Cb -0.22 -2.68 0.41 0.00 -1.15 0.00 0.00 33.47 29.82 2dhi s TRP 32 CO 0.25 -0.79 1.64 1.03 0.02 0.00 0.00 176.95 179.10 2dhi h SER 33 N 0.16 0.00 0.52 2.95 0.87 -1.86 -2.62 113.55 113.57 2dhi h SER 33 Ca -0.42 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 2dhi h SER 33 Cb 1.29 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.25 2dhi h SER 33 CO 0.51 0.58 -0.02 -0.90 -0.53 0.00 0.00 176.83 176.48 2dhi n ASP 34 N -3.82 0.05 0.00 6.23 5.68 -1.26 -4.90 116.55 118.54 2dhi n ASP 34 Ca -0.01 -0.23 0.00 0.00 -0.50 0.00 0.00 54.79 54.05 2dhi n ASP 34 Cb 0.59 -0.24 0.00 0.00 -1.14 0.00 0.00 41.12 40.33 2dhi n ASP 34 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dhi n GLY 35 N 1.27 2.24 3.63 6.12 0.00 -0.99 -4.96 105.19 112.51 2dhi n GLY 35 Ca 0.15 -0.05 -0.46 0.00 0.00 0.00 0.00 46.02 45.67 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 1.75 -5.06 1.61 8.25 -1.26 -3.78 115.22 116.72 2dhi n HIS 36 Ca 0.00 0.57 -0.32 0.00 -0.26 0.00 0.00 57.72 57.71 2dhi n HIS 36 Cb 0.00 -2.36 -0.16 0.00 1.12 0.00 0.00 29.99 28.59 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 0.20 2.32 -0.04 2.41 2.96 0.34 -0.13 118.68 126.74 2dhi s LEU 37 Ca 0.66 -0.47 0.01 0.00 -0.22 0.00 0.00 54.13 54.11 2dhi s LEU 37 Cb -0.71 -1.48 0.02 0.00 0.50 0.00 0.00 46.19 44.53 2dhi s LEU 37 CO 0.54 0.17 -0.03 -0.63 -1.32 0.00 0.00 176.35 175.08 2dhi s ILE 38 N 0.29 0.41 0.16 6.68 1.01 -0.91 -1.10 121.20 127.75 2dhi s ILE 38 Ca -0.15 -0.05 0.10 0.00 0.00 0.00 0.00 60.65 60.54 2dhi s ILE 38 Cb -0.17 -0.46 -0.04 0.00 0.01 0.00 0.00 42.46 41.80 2dhi s ILE 38 CO 0.07 0.20 -0.17 -0.72 0.00 0.00 0.00 174.94 174.32 2dhi s TYR 39 N 0.93 2.50 0.49 3.97 1.13 -1.15 -1.94 117.35 123.29 2dhi s TYR 39 Ca -0.11 -0.28 0.04 0.00 -1.41 0.00 0.00 57.07 55.31 2dhi s TYR 39 Cb -0.14 -1.26 -0.01 0.00 -1.10 0.00 0.00 41.96 39.44 2dhi s TYR 39 CO -0.00 0.46 0.15 0.71 -2.51 0.00 0.00 175.55 174.36 2dhi s TYR 40 N -1.50 1.99 0.04 -3.49 2.02 0.11 -1.45 117.35 115.07 2dhi s TYR 40 Ca 0.21 -0.83 -0.16 0.00 -0.37 0.00 0.00 57.07 55.92 2dhi s TYR 40 Cb -0.09 -1.78 -0.27 0.00 -0.40 0.00 0.00 41.96 39.42 2dhi s TYR 40 CO 0.12 0.04 1.10 0.22 -1.57 0.00 0.00 175.55 175.46 2dhi h ASP 41 N 1.23 0.80 -3.70 2.29 1.82 -1.41 -2.83 116.42 114.62 2dhi h ASP 41 Ca -0.42 -0.81 -0.27 0.00 -0.39 0.00 0.00 57.03 55.14 2dhi h ASP 41 Cb 1.29 -0.25 -0.07 0.00 0.68 0.00 0.00 39.33 40.98 2dhi h ASP 41 CO 0.69 1.52 -0.21 -0.90 -1.61 0.00 0.00 179.24 178.73 2dhi n ASP 42 N -3.90 -0.81 0.15 2.28 5.68 -1.26 -4.55 116.55 114.14 2dhi n ASP 42 Ca -0.13 -2.51 0.12 0.00 -0.50 0.00 0.00 54.79 51.77 2dhi n ASP 42 Cb 0.90 1.62 0.54 0.00 -1.14 0.00 0.00 41.12 43.05 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 -0.45 0.18 0.16 0.11 -0.00 -1.26 -1.72 117.38 114.40 2dhi n GLN 43 Ca 0.03 0.52 0.13 0.00 -0.00 0.00 0.00 57.00 57.68 2dhi n GLN 43 Cb 0.44 -1.93 0.51 0.00 -0.00 0.00 0.00 30.24 29.27 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 0.00 -6.78 -0.39 1.35 -2.00 -3.46 112.91 101.63 2dhi h THR 44 Ca 0.00 -0.35 -0.56 0.00 -0.55 0.00 0.00 66.41 64.96 2dhi h THR 44 Cb 0.22 1.18 -0.21 0.00 -1.73 0.00 0.00 68.15 67.61 2dhi h THR 44 CO 0.00 0.00 -0.85 0.54 -0.25 0.00 0.00 175.52 174.96 2dhi n ARG 45 N -2.45 -2.88 -0.01 4.72 1.74 -0.70 -4.82 116.66 112.26 2dhi n ARG 45 Ca 0.02 0.34 0.10 0.00 -0.77 0.00 0.00 57.85 57.54 2dhi n ARG 45 Cb 0.28 -4.96 -0.15 0.00 -1.02 0.00 0.00 32.46 26.62 2dhi n ARG 45 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2dhi n GLN 46 N -4.37 0.60 -3.88 5.56 6.02 -1.26 -4.81 117.38 115.25 2dhi n GLN 46 Ca 0.03 -0.16 -0.30 0.00 -0.01 0.00 0.00 57.00 56.55 2dhi n GLN 46 Cb 0.51 -1.45 -0.15 0.00 1.02 0.00 0.00 30.24 30.17 2dhi n GLN 46 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2dhi s SER 47 N -4.11 4.36 -0.50 1.08 0.15 -1.26 -5.06 113.70 108.35 2dhi s SER 47 Ca -0.06 -2.05 -0.27 0.00 0.70 0.00 0.00 55.95 54.27 2dhi s SER 47 Cb 0.13 -1.28 -0.03 0.00 -1.71 0.00 0.00 66.02 63.13 2dhi s SER 47 CO 0.80 -0.38 1.93 -0.63 1.20 0.00 0.00 173.24 176.17 2dhi s ILE 48 N 1.06 3.33 0.12 6.45 1.01 -1.26 -1.06 121.20 130.86 2dhi s ILE 48 Ca 0.11 0.25 -0.29 0.00 0.00 0.00 0.00 60.65 60.72 2dhi s ILE 48 Cb -0.19 -3.69 -0.07 0.00 0.01 0.00 0.00 42.46 38.51 2dhi s ILE 48 CO -0.14 -0.61 1.59 -0.33 0.00 0.00 0.00 174.94 175.46 2dhi h GLU 49 N 15.07 -0.52 -1.99 2.79 4.39 -1.51 -3.48 114.58 129.33 2dhi h GLU 49 Ca -0.28 0.04 0.28 0.00 0.34 0.00 0.00 59.36 59.73 2dhi h GLU 49 Cb 1.18 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 29.87 2dhi h GLU 49 CO 1.15 -0.35 0.75 0.34 -1.16 0.00 0.00 179.01 179.75 2dhi s ASP 50 N -4.81 -0.04 -0.02 1.42 2.15 -1.21 -5.06 116.67 109.10 2dhi s ASP 50 Ca -0.16 -0.31 0.01 0.00 0.43 0.00 0.00 52.55 52.53 2dhi s ASP 50 Cb 0.09 0.27 0.01 0.00 -0.30 0.00 0.00 42.92 42.99 2dhi s ASP 50 CO 0.64 -0.52 -0.04 -0.75 -0.17 0.00 0.00 175.17 174.32 2dhi s LYS 51 N -2.36 0.54 -0.10 4.34 2.20 -1.26 -2.91 119.74 120.19 2dhi s LYS 51 Ca 0.20 -0.13 -0.14 0.00 -0.36 0.00 0.00 55.97 55.54 2dhi s LYS 51 Cb 0.01 -0.56 0.03 0.00 -1.51 0.00 0.00 37.83 35.80 2dhi s LYS 51 CO -0.00 0.03 0.36 0.08 -0.36 0.00 0.00 175.35 175.46 2dhi s VAL 52 N 0.34 0.02 0.64 4.02 1.01 -0.26 -5.03 120.40 121.14 2dhi s VAL 52 Ca -0.04 -0.15 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 2dhi s VAL 52 Cb -0.08 -0.57 0.03 0.00 0.00 0.00 0.00 36.38 35.77 2dhi s VAL 52 CO -0.00 -0.08 0.95 -2.28 0.00 0.00 0.00 175.10 173.68 2dhi s HIS 53 N -0.31 3.07 0.00 5.22 2.46 -1.26 -0.51 115.29 123.96 2dhi s HIS 53 Ca -0.04 0.51 0.00 0.00 0.47 0.00 0.00 55.06 55.99 2dhi s HIS 53 Cb -0.03 -2.95 0.00 0.00 -0.13 0.00 0.00 32.58 29.46 2dhi s HIS 53 CO 0.02 -1.10 0.00 -1.33 -2.47 0.00 0.00 174.74 169.86 2dhi n MET 54 N -2.73 0.00 0.00 2.88 2.81 -1.25 -2.85 117.12 115.98 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 -0.33 0.31 0.00 -0.71 0.00 0.00 33.22 33.07 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 -2.48 0.49 0.00 0.03 -0.04 -1.26 -0.41 135.00 131.34 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 0.00 -0.08 0.52 0.31 -1.26 -4.88 118.33 112.11 2dhi n VAL 56 Ca 0.08 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.18 2dhi n VAL 56 Cb 0.04 -1.47 -0.12 0.00 -0.91 0.00 0.00 33.84 31.38 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 -2.98 1.94 -4.66 4.52 9.92 -1.21 -4.81 116.55 119.27 2dhi n ASP 57 Ca 0.00 0.34 -0.43 0.00 -0.53 0.00 0.00 54.79 54.18 2dhi n ASP 57 Cb 0.49 -0.92 -0.02 0.00 -0.64 0.00 0.00 41.12 40.03 2dhi n ASP 57 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dhi n ILE 59 N 5.35 1.34 -4.15 0.00 -5.35 0.74 -4.29 119.36 113.01 2dhi n ILE 59 Ca 0.13 -0.79 -0.12 0.00 -0.27 0.00 0.00 62.75 61.69 2dhi n ILE 59 Cb 0.46 -0.59 -0.08 0.00 -1.74 0.00 0.00 39.64 37.68 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 -5.51 0.28 -0.23 7.28 2.47 -0.98 -5.05 114.94 113.21 2dhi s ASN 60 Ca -0.12 -1.32 -0.04 0.00 0.42 0.00 0.00 52.86 51.80 2dhi s ASN 60 Cb 0.06 0.47 0.07 0.00 -1.45 0.00 0.00 41.25 40.40 2dhi s ASN 60 CO 0.77 -0.97 0.08 -0.63 -3.72 0.00 0.00 177.10 172.64 2dhi s ILE 61 N -3.98 0.24 -0.27 -5.21 1.01 -1.26 -1.61 121.20 110.12 2dhi s ILE 61 Ca 0.35 -0.60 -0.17 0.00 0.00 0.00 0.00 60.65 60.22 2dhi s ILE 61 Cb 0.04 -0.96 -0.03 0.00 0.01 0.00 0.00 42.46 41.52 2dhi s ILE 61 CO 0.13 -0.42 0.49 -0.13 0.00 0.00 0.00 174.94 175.01 2dhi s ARG 62 N 1.97 4.03 -0.01 2.79 0.52 -0.05 -4.94 118.95 123.26 2dhi s ARG 62 Ca 0.04 0.24 0.01 0.00 -0.52 0.00 0.00 55.73 55.50 2dhi s ARG 62 Cb -0.17 -3.66 0.00 0.00 0.52 0.00 0.00 34.95 31.64 2dhi s ARG 62 CO -0.18 -0.36 -0.04 0.95 0.02 0.00 0.00 175.30 175.69 2dhi s THR 63 N 2.28 0.35 0.00 0.02 -4.23 -1.26 0.20 115.64 113.00 2dhi s THR 63 Ca 0.20 -0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.54 2dhi s THR 63 Cb -0.16 -0.31 0.00 0.00 1.34 0.00 0.00 72.50 73.37 2dhi s THR 63 CO 0.10 0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.90 2dhi n GLY 64 N 3.11 1.65 1.96 3.99 0.00 -1.08 -3.89 105.19 110.93 2dhi n GLY 64 Ca -0.15 -0.58 -0.20 0.00 0.00 0.00 0.00 46.02 45.09 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 4.39 2.15 -0.10 1.61 8.25 -1.26 -4.17 115.22 126.08 2dhi n HIS 65 Ca 0.00 -1.93 -0.17 0.00 -0.26 0.00 0.00 57.72 55.36 2dhi n HIS 65 Cb 0.00 -0.95 -0.08 0.00 1.12 0.00 0.00 29.99 30.08 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 -0.37 0.45 -2.56 -0.41 1.02 -1.25 -4.88 120.64 112.63 2dhi n GLU 66 Ca 0.42 0.14 -0.42 0.00 -0.02 0.00 0.00 57.16 57.29 2dhi n GLU 66 Cb 0.93 -1.30 -0.03 0.00 -0.02 0.00 0.00 31.44 31.02 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 8.97 1.69 -0.13 0.00 3.00 -1.26 -4.26 116.66 124.67 2dhi n ARG 68 Ca 0.05 -0.55 0.12 0.00 -0.00 0.00 0.00 57.85 57.47 2dhi n ARG 68 Cb 0.49 -1.28 0.25 0.00 0.00 0.00 0.00 32.46 31.92 2dhi n ARG 68 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 2dhi n ASP 69 N -0.53 2.91 -4.45 6.15 5.68 -1.26 -4.94 116.55 120.11 2dhi n ASP 69 Ca 0.06 -1.91 -0.21 0.00 -0.50 0.00 0.00 54.79 52.22 2dhi n ASP 69 Cb 0.32 -0.17 -0.11 0.00 -1.14 0.00 0.00 41.12 40.02 2dhi n ASP 69 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 2dhi s ILE 70 N -1.66 1.21 -0.02 2.12 -4.36 -1.26 -5.16 121.20 112.07 2dhi s ILE 70 Ca 0.36 -2.01 0.03 0.00 -0.26 0.00 0.00 60.65 58.77 2dhi s ILE 70 Cb 0.21 -2.77 -0.00 0.00 1.25 0.00 0.00 42.46 41.15 2dhi s ILE 70 CO 0.30 -0.02 -0.09 0.00 0.24 0.00 0.00 174.94 175.37 2dhi s GLN 71 N -3.88 0.84 0.44 0.37 -2.07 -1.26 -5.04 119.66 109.05 2dhi s GLN 71 Ca 0.36 -0.30 -0.24 0.00 -1.82 0.00 0.00 55.36 53.36 2dhi s GLN 71 Cb 0.08 -0.80 -0.08 0.00 -1.09 0.00 0.00 33.01 31.13 2dhi s GLN 71 CO 0.15 0.15 1.17 -1.25 -1.32 0.00 0.00 175.29 174.19 2dhi s PRO 72 N 0.02 3.85 0.15 9.60 0.04 -1.26 -4.99 135.00 142.42 2dhi s PRO 72 Ca -0.00 1.81 -0.31 0.00 0.04 0.00 0.00 61.00 62.54 2dhi s PRO 72 Cb -0.06 -2.50 -0.08 0.00 0.04 0.00 0.00 34.50 31.90 2dhi s PRO 72 CO 0.00 -0.48 1.33 -1.25 0.04 0.00 0.00 177.00 176.64 2dhi s PRO 73 N -2.57 4.36 -0.35 0.56 0.04 -1.26 -4.90 135.00 130.88 2dhi s PRO 73 Ca 0.61 2.04 -0.42 0.00 0.04 0.00 0.00 61.00 63.27 2dhi s PRO 73 Cb -0.29 -3.23 -0.17 0.00 0.04 0.00 0.00 34.50 30.85 2dhi s PRO 73 CO 0.36 -0.33 1.73 -0.25 0.04 0.00 0.00 177.00 178.56 2dhi n ASP 74 N 3.28 2.01 0.00 6.66 8.00 -1.26 -0.89 116.55 134.35 2dhi n ASP 74 Ca 0.09 1.07 0.00 0.00 0.71 0.00 0.00 54.79 56.66 2dhi n ASP 74 Cb 0.43 -1.06 0.00 0.00 -0.02 0.00 0.00 41.12 40.47 2dhi n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dhi n GLY 75 N 4.33 0.94 3.05 0.44 0.00 -1.26 -5.09 105.19 107.60 2dhi n GLY 75 Ca 0.29 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.72 0.70 0.57 1.61 -0.14 -0.07 -5.14 119.74 116.56 2dhi s LYS 76 Ca 0.00 -0.51 -0.10 0.00 -1.36 0.00 0.00 55.97 54.00 2dhi s LYS 76 Cb 0.00 -0.64 0.14 0.00 -1.68 0.00 0.00 37.83 35.65 2dhi s LYS 76 CO 0.00 0.16 0.51 -0.35 -0.76 0.00 0.00 175.35 174.91 2dhi n PRO 77 N 2.33 -2.02 -0.16 -1.68 -0.04 -1.26 -4.66 135.00 127.52 2dhi n PRO 77 Ca -0.16 -0.82 0.09 0.00 -0.04 0.00 0.00 63.50 62.57 2dhi n PRO 77 Cb 0.56 -0.76 0.17 0.00 -0.04 0.00 0.00 33.50 33.43 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 -3.07 2.23 0.00 0.54 0.63 -1.26 -4.23 116.66 111.50 2dhi n ARG 78 Ca 0.07 -2.04 0.10 0.00 -0.92 0.00 0.00 57.85 55.06 2dhi n ARG 78 Cb 0.27 -1.40 -0.04 0.00 0.45 0.00 0.00 32.46 31.74 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 1.12 0.91 -1.04 6.15 8.00 -1.26 -3.98 116.55 126.45 2dhi n ASP 79 Ca 0.15 -0.85 0.12 0.00 0.71 0.00 0.00 54.79 54.92 2dhi n ASP 79 Cb 0.51 0.84 0.18 0.00 -0.02 0.00 0.00 41.12 42.63 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 -1.72 4.39 -0.12 0.00 1.43 -1.26 -1.02 118.68 120.38 2dhi s LEU 81 Ca 0.34 2.10 -0.01 0.00 -1.03 0.00 0.00 54.13 55.53 2dhi s LEU 81 Cb 0.21 -3.58 0.03 0.00 0.03 0.00 0.00 46.19 42.88 2dhi s LEU 81 CO 0.31 -0.48 -0.05 -0.22 0.23 0.00 0.00 176.35 176.15 2dhi s LEU 82 N 0.83 1.18 -0.09 1.79 2.96 0.82 -2.65 118.68 123.51 2dhi s LEU 82 Ca 0.58 -0.39 0.04 0.00 -0.22 0.00 0.00 54.13 54.14 2dhi s LEU 82 Cb -0.31 -0.76 -0.01 0.00 0.50 0.00 0.00 46.19 45.61 2dhi s LEU 82 CO 0.31 -0.17 -0.22 -1.58 -1.32 0.00 0.00 176.35 173.37 2dhi s GLN 83 N 1.75 2.98 -0.77 1.98 0.74 0.13 0.96 119.66 127.44 2dhi s GLN 83 Ca 0.03 -0.85 -0.11 0.00 0.05 0.00 0.00 55.36 54.48 2dhi s GLN 83 Cb -0.14 -2.33 0.20 0.00 1.10 0.00 0.00 33.01 31.85 2dhi s GLN 83 CO -0.07 0.24 0.67 0.42 -0.55 0.00 0.00 175.29 176.00 2dhi s ILE 84 N 0.21 5.12 -0.27 -2.34 -1.09 -0.35 -0.87 121.20 121.60 2dhi s ILE 84 Ca -0.14 -2.56 -0.28 0.00 -2.23 0.00 0.00 60.65 55.44 2dhi s ILE 84 Cb -0.17 -4.20 -0.04 0.00 -1.58 0.00 0.00 42.46 36.48 2dhi s ILE 84 CO 0.07 -0.98 2.09 -0.69 -1.23 0.00 0.00 174.94 174.20 2dhi s VAL 85 N 0.16 3.16 0.59 2.92 1.01 -0.63 -2.57 120.40 125.03 2dhi s VAL 85 Ca 0.17 0.16 -0.00 0.00 0.00 0.00 0.00 61.98 62.31 2dhi s VAL 85 Cb -0.13 -3.22 0.04 0.00 0.00 0.00 0.00 36.38 33.07 2dhi s VAL 85 CO -0.07 -0.15 0.83 0.00 0.00 0.00 0.00 175.10 175.71 2dhi n ARG 87 N -2.46 0.00 -1.07 0.00 1.74 0.17 -4.28 116.66 110.75 2dhi n ARG 87 Ca 0.09 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.87 2dhi n ARG 87 Cb 0.60 -0.95 -0.11 0.00 -1.02 0.00 0.00 32.46 30.98 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 1.43 0.22 0.00 0.55 -0.08 -1.26 -2.18 116.55 115.23 2dhi n ASP 88 Ca 0.15 0.14 0.00 0.00 -1.51 0.00 0.00 54.79 53.57 2dhi n ASP 88 Cb 0.15 -0.66 0.00 0.00 2.34 0.00 0.00 41.12 42.94 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 4.70 1.06 3.63 0.27 0.00 -1.26 -5.14 105.19 108.45 2dhi n GLY 89 Ca 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.44 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 0.00 0.25 -0.25 1.61 2.20 -0.93 -5.09 119.74 117.54 2dhi s LYS 90 Ca 0.00 0.22 -0.17 0.00 -0.36 0.00 0.00 55.97 55.66 2dhi s LYS 90 Cb 0.00 0.12 0.07 0.00 -1.51 0.00 0.00 37.83 36.51 2dhi s LYS 90 CO 0.00 -0.05 0.63 0.99 -0.36 0.00 0.00 175.35 176.56 2dhi s THR 91 N -0.25 -0.00 -0.11 3.43 2.01 -1.26 -1.40 115.64 118.06 2dhi s THR 91 Ca 0.05 0.02 -0.04 0.00 0.31 0.00 0.00 61.69 62.03 2dhi s THR 91 Cb -0.04 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 2dhi s THR 91 CO -0.09 0.01 0.05 -0.63 -0.69 0.00 0.00 174.62 173.26 2dhi s ILE 92 N 1.24 4.74 -0.23 1.82 1.01 -1.06 -4.96 121.20 123.76 2dhi s ILE 92 Ca -0.07 -0.08 -0.05 0.00 0.00 0.00 0.00 60.65 60.45 2dhi s ILE 92 Cb -0.05 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 2dhi s ILE 92 CO -0.13 0.59 0.01 -0.44 0.00 0.00 0.00 174.94 174.97 2dhi s SER 93 N -0.77 4.70 0.16 3.58 0.01 -1.26 -1.21 113.70 118.91 2dhi s SER 93 Ca 0.12 -0.29 0.08 0.00 1.31 0.00 0.00 55.95 57.17 2dhi s SER 93 Cb -0.12 -1.83 -0.04 0.00 0.21 0.00 0.00 66.02 64.25 2dhi s SER 93 CO 0.03 -0.02 -0.18 -0.76 0.41 0.00 0.00 173.24 172.72 2dhi s LEU 94 N 1.49 2.43 -0.13 2.44 1.43 0.27 -2.39 118.68 124.24 2dhi s LEU 94 Ca 0.06 -0.86 -0.04 0.00 -1.03 0.00 0.00 54.13 52.26 2dhi s LEU 94 Cb -0.15 -0.80 0.05 0.00 0.03 0.00 0.00 46.19 45.33 2dhi s LEU 94 CO 0.00 -0.05 0.08 0.00 0.23 0.00 0.00 176.35 176.62 2dhi s ALA 96 N 2.15 2.97 0.09 0.00 0.00 -0.19 -2.36 121.76 124.43 2dhi s ALA 96 Ca 0.03 0.31 -0.35 0.00 0.00 0.00 0.00 51.96 51.95 2dhi s ALA 96 Cb -0.15 -3.16 -0.16 0.00 0.00 0.00 0.00 23.12 19.66 2dhi s ALA 96 CO -0.07 -0.32 1.57 0.93 0.00 0.00 0.00 175.76 177.87 2dhi h GLU 97 N 1.02 -0.87 -5.35 0.00 5.08 -1.88 -3.45 114.58 109.13 2dhi h GLU 97 Ca -0.47 0.06 -0.40 0.00 -1.00 0.00 0.00 59.36 57.55 2dhi h GLU 97 Cb 1.20 0.20 -0.18 0.00 0.50 0.00 0.00 28.75 30.47 2dhi h GLU 97 CO 0.60 -0.58 -0.75 -1.12 -1.00 0.00 0.00 179.01 176.16 2dhi s SER 98 N -4.48 1.95 0.28 1.42 0.01 -1.26 -4.88 113.70 106.75 2dhi s SER 98 Ca -0.17 -0.84 -0.08 0.00 1.31 0.00 0.00 55.95 56.17 2dhi s SER 98 Cb 0.05 -0.06 0.47 0.00 0.21 0.00 0.00 66.02 66.69 2dhi s SER 98 CO 0.61 -0.18 1.56 0.41 0.41 0.00 0.00 173.24 176.05 2dhi n THR 99 N 0.41 -0.42 -0.20 1.44 -1.04 -1.26 0.78 114.28 113.99 2dhi n THR 99 Ca -0.15 2.28 0.00 0.00 -2.04 0.00 0.00 64.05 64.15 2dhi n THR 99 Cb 0.58 -3.17 0.11 0.00 -1.82 0.00 0.00 70.33 66.03 2dhi n THR 99 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2dhi h ASP 100 N 0.00 0.11 -0.62 8.00 3.32 -1.96 -0.15 116.42 125.12 2dhi h ASP 100 Ca 0.48 0.10 0.03 0.00 0.02 0.00 0.00 57.03 57.66 2dhi h ASP 100 Cb 0.75 0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.36 2dhi h ASP 100 CO -1.02 0.07 0.38 0.44 -1.72 0.00 0.00 179.24 177.38 2dhi h ASP 101 N 0.33 0.61 0.46 6.45 3.32 -0.03 -1.50 116.42 126.05 2dhi h ASP 101 Ca 0.31 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.35 2dhi h ASP 101 Cb 0.43 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.86 2dhi h ASP 101 CO -0.36 0.42 -0.22 0.00 -1.72 0.00 0.00 179.24 177.36 2dhi h LEU 103 N -0.75 0.70 -0.03 0.00 3.38 -0.92 -0.41 115.31 117.29 2dhi h LEU 103 Ca -0.06 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.01 2dhi h LEU 103 Cb 0.53 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2dhi h LEU 103 CO 0.10 0.24 -0.08 0.00 0.09 0.00 0.00 178.44 178.80 2dhi h ALA 104 N 1.64 -0.05 0.34 1.53 0.00 -1.06 -1.97 119.26 119.69 2dhi h ALA 104 Ca 0.57 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.48 2dhi h ALA 104 Cb 0.99 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2dhi h ALA 104 CO -0.35 -0.56 -0.16 -1.49 0.00 0.00 0.00 179.25 176.69 2dhi h TRP 105 N -0.12 -0.43 -0.84 0.00 4.06 -0.94 -2.95 115.95 114.74 2dhi h TRP 105 Ca 0.04 -0.01 0.16 0.00 2.06 0.00 0.00 58.89 61.14 2dhi h TRP 105 Cb 0.17 0.14 -0.16 0.00 -1.00 0.00 0.00 29.16 28.32 2dhi h TRP 105 CO -0.16 -0.14 -0.26 -0.22 -3.56 0.00 0.00 178.44 174.10 2dhi h LYS 106 N -0.67 -0.02 -0.05 0.49 3.64 -1.06 0.94 116.57 119.84 2dhi h LYS 106 Ca -0.05 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2dhi h LYS 106 Cb 0.47 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.25 2dhi h LYS 106 CO 0.08 -0.02 -0.28 0.74 -2.27 0.00 0.00 179.45 177.70 2dhi h PHE 107 N -0.03 -0.76 -0.16 1.91 0.04 -1.31 0.31 116.94 116.95 2dhi h PHE 107 Ca 0.37 0.03 0.04 0.00 2.80 0.00 0.00 57.97 61.21 2dhi h PHE 107 Cb 0.61 0.34 -0.05 0.00 2.20 0.00 0.00 35.95 39.06 2dhi h PHE 107 CO -0.70 -0.37 -0.12 1.15 -0.60 0.00 0.00 178.31 177.67 2dhi h THR 108 N -0.40 0.64 -0.69 -1.55 2.02 -0.74 -1.23 112.91 110.96 2dhi h THR 108 Ca 0.08 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.34 2dhi h THR 108 Cb 0.51 0.64 -0.07 0.00 -1.74 0.00 0.00 68.15 67.49 2dhi h THR 108 CO -0.27 0.00 0.34 -0.07 0.37 0.00 0.00 175.52 175.89 2dhi h LEU 109 N -0.13 0.45 -0.83 2.58 3.38 -0.54 0.68 115.31 120.90 2dhi h LEU 109 Ca 0.10 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.14 2dhi h LEU 109 Cb 0.28 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2dhi h LEU 109 CO -0.24 0.26 0.55 1.56 0.09 0.00 0.00 178.44 180.66 2dhi h GLN 110 N 0.59 1.09 0.00 1.13 4.20 -0.26 -0.35 115.11 121.51 2dhi h GLN 110 Ca 0.34 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.98 2dhi h GLN 110 Cb 0.35 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 27.88 2dhi h GLN 110 CO -0.26 0.72 0.00 0.22 -0.67 0.00 0.00 178.83 178.84 2dhi h ASP 111 N 1.12 0.00 0.81 1.46 3.58 -0.17 -2.97 116.42 120.26 2dhi h ASP 111 Ca 0.30 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.54 2dhi h ASP 111 Cb -0.13 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 2dhi h ASP 111 CO -0.07 0.00 -1.01 0.77 -2.88 0.00 0.00 179.24 176.06 2dhi h SER 112 N 0.00 0.15 0.81 2.28 4.64 0.13 -2.20 113.55 119.35 2dhi h SER 112 Ca 0.00 -0.15 -0.24 0.00 -0.47 0.00 0.00 61.79 60.93 2dhi h SER 112 Cb 0.98 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 2dhi h SER 112 CO 0.00 1.06 -1.13 0.08 -0.87 0.00 0.00 176.83 175.97 2dhi h ARG 113 N 0.04 0.14 0.00 4.77 0.11 -1.11 -3.27 114.38 115.05 2dhi h ARG 113 Ca -0.04 -0.23 -0.11 0.00 0.10 0.00 0.00 59.98 59.69 2dhi h ARG 113 Cb 1.72 0.09 -0.02 0.00 1.11 0.00 0.00 29.97 32.87 2dhi h ARG 113 CO 0.14 1.10 -0.52 1.79 0.10 0.00 0.00 179.97 182.59 2dhi h THR 114 N 0.04 0.89 -3.05 0.08 1.35 -1.58 -3.43 112.91 107.21 2dhi h THR 114 Ca -0.08 -2.24 -0.60 0.00 -0.55 0.00 0.00 66.41 62.94 2dhi h THR 114 Cb 1.87 2.43 -0.12 0.00 -1.73 0.00 0.00 68.15 70.61 2dhi h THR 114 CO 0.17 0.51 0.65 -0.55 -0.25 0.00 0.00 175.52 176.04 2dhi s SER 115 N -6.47 6.31 0.00 5.36 0.15 -0.83 -4.90 113.70 113.33 2dhi s SER 115 Ca 0.04 -0.41 0.00 0.00 0.70 0.00 0.00 55.95 56.28 2dhi s SER 115 Cb 0.08 -2.46 0.00 0.00 -1.71 0.00 0.00 66.02 61.93 2dhi s SER 115 CO 0.75 -1.34 0.00 0.61 1.20 0.00 0.00 173.24 174.46 2dhi n GLY 116 N 5.16 -0.06 0.13 9.45 0.00 -1.26 -4.78 105.19 113.83 2dhi n GLY 116 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.43 0.19 -2.10 1.61 -0.04 -1.26 -4.69 135.00 128.28 2dhi n PRO 117 Ca 0.00 0.42 -0.43 0.00 -0.04 0.00 0.00 63.50 63.45 2dhi n PRO 117 Cb 0.00 -1.86 -0.03 0.00 -0.04 0.00 0.00 33.50 31.58 2dhi n PRO 117 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dhi s SER 118 N -4.19 6.13 0.11 3.54 0.15 -1.26 -4.90 113.70 113.28 2dhi s SER 118 Ca 0.04 1.33 -0.28 0.00 0.70 0.00 0.00 55.95 57.74 2dhi s SER 118 Cb 0.09 -2.53 -0.09 0.00 -1.71 0.00 0.00 66.02 61.78 2dhi s SER 118 CO 0.38 -1.51 1.63 -1.28 1.20 0.00 0.00 173.24 173.66 2dhi h SER 119 N 11.78 -0.84 0.00 5.45 0.87 -1.97 -3.49 113.55 125.35 2dhi h SER 119 Ca -0.33 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 2dhi h SER 119 Cb 1.15 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 63.43 2dhi h SER 119 CO 1.03 -0.39 0.00 0.61 -0.53 0.00 0.00 176.83 177.55