#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dyk s HIS 2 N 0.00 2.33 -0.11 3.17 3.76 -1.26 -4.80 115.29 118.38 2dyk s HIS 2 Ca 0.00 1.48 0.03 0.00 -0.15 0.00 0.00 55.06 56.42 2dyk s HIS 2 Cb 0.00 -3.59 0.01 0.00 1.11 0.00 0.00 32.58 30.11 2dyk s HIS 2 CO 0.00 -2.47 -0.19 0.21 -0.85 0.00 0.00 174.74 171.44 2dyk s LYS 3 N -3.21 2.56 -0.09 1.40 2.20 -1.26 -0.17 119.74 121.17 2dyk s LYS 3 Ca 0.77 -0.70 0.04 0.00 -0.36 0.00 0.00 55.97 55.72 2dyk s LYS 3 Cb -0.34 -2.06 0.00 0.00 -1.51 0.00 0.00 37.83 33.92 2dyk s LYS 3 CO 0.38 0.03 -0.21 0.08 -0.36 0.00 0.00 175.35 175.26 2dyk s VAL 4 N 0.73 1.85 -0.06 4.02 1.01 0.56 -0.24 120.40 128.26 2dyk s VAL 4 Ca -0.11 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.02 2dyk s VAL 4 Cb -0.16 -1.61 -0.00 0.00 0.00 0.00 0.00 36.38 34.61 2dyk s VAL 4 CO 0.02 0.51 -0.21 -0.69 0.00 0.00 0.00 175.10 174.73 2dyk s VAL 5 N 0.42 1.78 -0.08 2.92 1.01 -0.64 -0.20 120.40 125.60 2dyk s VAL 5 Ca -0.18 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 60.73 2dyk s VAL 5 Cb -0.17 -1.53 -0.05 0.00 0.00 0.00 0.00 36.38 34.63 2dyk s VAL 5 CO 0.08 0.50 0.46 -0.63 0.00 0.00 0.00 175.10 175.50 2dyk s ILE 6 N 0.10 5.12 0.00 2.22 1.01 0.16 -0.60 121.20 129.22 2dyk s ILE 6 Ca -0.09 0.92 0.02 0.00 0.00 0.00 0.00 60.65 61.51 2dyk s ILE 6 Cb -0.14 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 2dyk s ILE 6 CO 0.05 0.41 -0.07 -0.69 0.00 0.00 0.00 174.94 174.63 2dyk s VAL 7 N 0.08 0.57 0.00 2.92 1.01 -0.06 -2.51 120.40 122.40 2dyk s VAL 7 Ca 0.25 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.82 2dyk s VAL 7 Cb -0.16 -0.50 0.00 0.00 0.00 0.00 0.00 36.38 35.73 2dyk s VAL 7 CO 0.11 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.91 2dyk n GLY 8 N 2.71 2.28 3.72 4.51 0.00 -1.26 -0.33 105.19 116.83 2dyk n GLY 8 Ca -0.14 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 44.63 2dyk n GLY 8 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2dyk s ARG 9 N -2.00 1.42 0.65 1.61 1.70 -1.26 -4.78 118.95 116.28 2dyk s ARG 9 Ca 0.00 0.92 -0.18 0.00 -0.47 0.00 0.00 55.73 56.00 2dyk s ARG 9 Cb 0.00 -1.82 -0.02 0.00 -0.57 0.00 0.00 34.95 32.54 2dyk s ARG 9 CO 0.00 -2.16 1.16 -2.30 -1.08 0.00 0.00 175.30 170.93 2dyk n PRO 10 N -3.84 0.96 -1.58 3.89 -0.02 -1.26 -3.52 135.00 129.63 2dyk n PRO 10 Ca 0.07 0.38 -0.17 0.00 -2.02 0.00 0.00 63.50 61.77 2dyk n PRO 10 Cb 0.55 -2.40 -0.07 0.00 -0.02 0.00 0.00 33.50 31.56 2dyk n PRO 10 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2dyk n ASN 11 N -1.60 -5.07 -0.06 2.55 3.02 -1.26 -4.87 115.26 107.97 2dyk n ASN 11 Ca 0.15 0.38 0.12 0.00 -0.03 0.00 0.00 54.58 55.20 2dyk n ASN 11 Cb 0.48 -4.09 0.22 0.00 -0.61 0.00 0.00 39.78 35.78 2dyk n ASN 11 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 2dyk n VAL 12 N -2.64 0.00 0.00 2.41 3.14 -1.23 -4.94 118.33 115.07 2dyk n VAL 12 Ca -0.17 -0.03 0.00 0.00 -2.96 0.00 0.00 64.34 61.18 2dyk n VAL 12 Cb 0.57 0.39 0.00 0.00 -1.06 0.00 0.00 33.84 33.75 2dyk n VAL 12 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2dyk n GLY 13 N 1.47 1.43 0.11 7.55 0.00 -1.26 -4.61 105.19 109.88 2dyk n GLY 13 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 2dyk n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dyk h LYS 14 N 0.00 0.28 -0.30 1.61 1.57 -1.92 -1.56 116.57 116.25 2dyk h LYS 14 Ca 0.00 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 2dyk h LYS 14 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2dyk h LYS 14 CO 0.00 0.38 -0.19 0.66 -0.57 0.00 0.00 179.45 179.74 2dyk h SER 15 N 0.12 0.55 -0.39 0.86 4.64 -1.98 0.11 113.55 117.45 2dyk h SER 15 Ca 0.06 -0.17 -0.07 0.00 -0.47 0.00 0.00 61.79 61.14 2dyk h SER 15 Cb 0.22 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2dyk h SER 15 CO -0.00 0.75 -0.05 0.28 -0.87 0.00 0.00 176.83 176.94 2dyk h SER 16 N 0.50 0.71 -0.54 4.97 0.02 -1.97 -1.37 113.55 115.86 2dyk h SER 16 Ca 0.08 -0.34 -0.09 0.00 -0.84 0.00 0.00 61.79 60.60 2dyk h SER 16 Cb 0.61 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.93 2dyk h SER 16 CO 0.04 0.88 -0.01 0.25 -1.14 0.00 0.00 176.83 176.85 2dyk h LEU 17 N 0.52 0.97 -0.38 5.07 5.85 -1.02 -2.49 115.31 123.85 2dyk h LEU 17 Ca 0.10 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2dyk h LEU 17 Cb 0.54 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 2dyk h LEU 17 CO 0.03 1.03 0.25 0.15 -0.34 0.00 0.00 178.44 179.56 2dyk h PHE 18 N 0.91 0.47 -0.66 1.25 3.57 -0.56 -1.77 116.94 120.15 2dyk h PHE 18 Ca 0.16 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 2dyk h PHE 18 Cb 0.54 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 2dyk h PHE 18 CO 0.04 0.30 0.25 -0.91 -2.23 0.00 0.00 178.31 175.75 2dyk h ASN 19 N 0.51 0.90 -0.38 0.41 2.35 -1.16 -1.43 115.58 116.78 2dyk h ASN 19 Ca 0.14 -0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.71 2dyk h ASN 19 Cb -0.06 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.07 2dyk h ASN 19 CO -0.03 0.82 0.05 0.03 -1.65 0.00 0.00 177.43 176.64 2dyk h ARG 20 N 0.96 0.64 -0.41 0.81 2.47 -1.16 -2.13 114.38 115.56 2dyk h ARG 20 Ca 0.22 -0.18 -0.11 0.00 -1.26 0.00 0.00 59.98 58.66 2dyk h ARG 20 Cb 0.21 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.44 2dyk h ARG 20 CO -0.02 0.71 -0.18 -0.07 0.56 0.00 0.00 179.97 180.98 2dyk h LEU 21 N 0.48 0.79 -1.20 3.04 3.38 -1.10 -1.38 115.31 119.31 2dyk h LEU 21 Ca 0.11 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 2dyk h LEU 21 Cb 0.39 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2dyk h LEU 21 CO 0.01 0.96 -0.20 0.25 0.09 0.00 0.00 178.44 179.55 2dyk h LEU 22 N 0.70 0.29 0.00 1.67 5.85 -1.21 -2.36 115.31 120.25 2dyk h LEU 22 Ca 0.11 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2dyk h LEU 22 Cb 0.68 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.63 2dyk h LEU 22 CO 0.05 0.51 -0.01 0.11 -0.34 0.00 0.00 178.44 178.76 2dyk h LYS 23 N 0.28 0.00 -6.55 1.25 1.79 -0.95 -3.45 116.57 108.94 2dyk h LYS 23 Ca 0.05 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.92 2dyk h LYS 23 Cb 0.52 0.00 0.11 0.00 -1.58 0.00 0.00 32.23 31.28 2dyk h LYS 23 CO 0.03 0.00 0.20 1.63 -1.08 0.00 0.00 179.45 180.23 2dyk n LYS 24 N -2.82 1.50 -4.58 3.15 4.76 -0.56 -5.02 118.16 114.59 2dyk n LYS 24 Ca 0.04 0.53 -0.27 0.00 -2.87 0.00 0.00 58.31 55.74 2dyk n LYS 24 Cb 0.50 -1.96 -0.08 0.00 -1.84 0.00 0.00 35.03 31.65 2dyk n LYS 24 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2dyk s ARG 25 N -1.67 1.97 -0.17 1.97 0.52 -1.26 -4.59 118.95 115.72 2dyk s ARG 25 Ca 0.58 -2.21 0.15 0.00 -0.52 0.00 0.00 55.73 53.74 2dyk s ARG 25 Cb -0.66 -0.93 0.37 0.00 0.52 0.00 0.00 34.95 34.26 2dyk s ARG 25 CO 0.60 -0.40 1.23 0.45 0.02 0.00 0.00 175.30 177.20 2dyk n SER 26 N -1.21 2.32 -0.43 0.23 2.88 -1.26 -4.87 113.62 111.27 2dyk n SER 26 Ca -0.09 -3.39 0.00 0.00 -1.33 0.00 0.00 58.87 54.06 2dyk n SER 26 Cb 0.66 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 2dyk n SER 26 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2dyk n ASP 38 N -1.22 0.00 -4.79 -3.46 5.68 -1.26 -4.96 116.55 106.54 2dyk n ASP 38 Ca 0.19 0.00 -0.36 0.00 -0.50 0.00 0.00 54.79 54.12 2dyk n ASP 38 Cb 0.71 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.62 2dyk n ASP 38 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2dyk s LEU 39 N -0.00 4.09 -0.20 -2.12 2.96 -1.26 -3.27 118.68 118.87 2dyk s LEU 39 Ca 0.00 0.33 -0.05 0.00 -0.22 0.00 0.00 54.13 54.18 2dyk s LEU 39 Cb 0.00 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 2dyk s LEU 39 CO 0.00 0.37 0.01 -0.54 -1.32 0.00 0.00 176.35 174.87 2dyk s LYS 40 N -0.78 3.64 -0.02 1.98 1.02 -0.88 -4.97 119.74 119.73 2dyk s LYS 40 Ca 0.13 -0.51 0.06 0.00 0.02 0.00 0.00 55.97 55.67 2dyk s LYS 40 Cb -0.12 -3.11 -0.01 0.00 -0.52 0.00 0.00 37.83 34.07 2dyk s LYS 40 CO 0.03 0.00 -0.19 -1.21 -0.92 0.00 0.00 175.35 173.06 2dyk s GLU 41 N 1.03 1.71 -0.07 1.68 2.02 -1.26 -0.24 118.70 123.58 2dyk s GLU 41 Ca 0.02 -0.70 -0.26 0.00 0.02 0.00 0.00 54.97 54.06 2dyk s GLU 41 Cb -0.14 -1.59 0.06 0.00 0.10 0.00 0.00 34.13 32.55 2dyk s GLU 41 CO 0.02 0.38 0.58 0.20 0.02 0.00 0.00 175.26 176.46 2dyk s GLY 42 N -0.32 -0.46 -0.32 -1.39 0.00 -0.17 -4.99 107.32 99.67 2dyk s GLY 42 Ca 0.04 1.14 -0.16 0.00 0.00 0.00 0.00 44.72 45.74 2dyk s GLY 42 CO 0.00 0.84 0.43 0.14 0.00 0.00 0.00 173.10 174.51 2dyk s VAL 43 N -1.01 5.11 -0.06 1.40 1.01 -1.26 0.34 120.40 125.92 2dyk s VAL 43 Ca -0.10 0.35 -0.18 0.00 0.00 0.00 0.00 61.98 62.05 2dyk s VAL 43 Cb -0.02 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.47 2dyk s VAL 43 CO 0.07 -0.06 0.47 -0.69 0.00 0.00 0.00 175.10 174.89 2dyk s VAL 44 N 2.19 5.09 -0.05 2.92 1.01 -0.10 -4.91 120.40 126.55 2dyk s VAL 44 Ca 0.16 0.97 -0.02 0.00 0.00 0.00 0.00 61.98 63.09 2dyk s VAL 44 Cb -0.16 -3.80 0.04 0.00 0.00 0.00 0.00 36.38 32.45 2dyk s VAL 44 CO 0.12 0.42 0.09 -0.70 0.00 0.00 0.00 175.10 175.03 2dyk s GLU 45 N -0.03 0.01 0.23 2.72 2.12 -1.26 -1.44 118.70 121.05 2dyk s GLU 45 Ca 0.26 0.34 0.01 0.00 0.36 0.00 0.00 54.97 55.94 2dyk s GLU 45 Cb -0.16 -0.27 -0.00 0.00 0.26 0.00 0.00 34.13 33.96 2dyk s GLU 45 CO 0.12 -0.21 0.28 0.25 -0.54 0.00 0.00 175.26 175.15 2dyk n THR 46 N 4.54 0.00 0.23 -1.70 -2.24 -0.66 -4.51 114.28 109.94 2dyk n THR 46 Ca -0.20 -1.36 0.11 0.00 -2.27 0.00 0.00 64.05 60.34 2dyk n THR 46 Cb 0.51 0.76 0.56 0.00 -2.10 0.00 0.00 70.33 70.06 2dyk n THR 46 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dyk n ASP 47 N -1.92 0.59 0.17 3.42 5.68 -1.26 -0.92 116.55 122.32 2dyk n ASP 47 Ca 0.02 0.73 0.13 0.00 -0.50 0.00 0.00 54.79 55.17 2dyk n ASP 47 Cb 0.40 -0.83 0.32 0.00 -1.14 0.00 0.00 41.12 39.87 2dyk n ASP 47 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 2dyk h ARG 48 N 0.00 0.00 0.00 0.11 3.08 -1.99 -3.50 114.38 112.08 2dyk h ARG 48 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2dyk h ARG 48 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2dyk h ARG 48 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 2dyk n GLY 49 N 1.04 0.81 3.25 0.04 0.00 -0.10 -5.10 105.19 105.13 2dyk n GLY 49 Ca 0.04 -2.03 -0.21 0.00 0.00 0.00 0.00 46.02 43.82 2dyk n GLY 49 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2dyk s ARG 50 N -1.32 1.04 0.09 1.61 1.70 -1.26 -1.66 118.95 119.14 2dyk s ARG 50 Ca 0.00 -1.14 -0.18 0.00 -0.47 0.00 0.00 55.73 53.94 2dyk s ARG 50 Cb 0.00 -1.15 0.04 0.00 -0.57 0.00 0.00 34.95 33.27 2dyk s ARG 50 CO 0.00 0.26 0.43 -0.59 -1.08 0.00 0.00 175.30 174.31 2dyk s PHE 51 N -1.43 -0.27 -0.21 5.89 -0.12 -0.52 -4.43 117.98 116.89 2dyk s PHE 51 Ca 0.05 0.09 -0.19 0.00 -0.05 0.00 0.00 56.93 56.84 2dyk s PHE 51 Cb -0.09 0.27 -0.03 0.00 -0.63 0.00 0.00 43.02 42.54 2dyk s PHE 51 CO 0.04 -0.66 0.54 -1.17 -0.05 0.00 0.00 175.22 173.92 2dyk s LEU 52 N -2.43 4.13 -0.19 -1.99 2.96 0.77 -0.93 118.68 121.00 2dyk s LEU 52 Ca -0.01 0.69 -0.08 0.00 -0.22 0.00 0.00 54.13 54.51 2dyk s LEU 52 Cb 0.01 -2.74 -0.04 0.00 0.50 0.00 0.00 46.19 43.91 2dyk s LEU 52 CO -0.08 -0.22 0.07 -0.22 -1.32 0.00 0.00 176.35 174.59 2dyk s LEU 53 N 1.80 3.87 -0.08 -0.68 2.96 0.15 -0.32 118.68 126.37 2dyk s LEU 53 Ca 0.25 0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.29 2dyk s LEU 53 Cb -0.15 -1.98 0.00 0.00 0.50 0.00 0.00 46.19 44.55 2dyk s LEU 53 CO 0.10 0.17 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.39 2dyk s VAL 54 N 0.42 1.79 -0.22 1.68 1.01 0.72 -1.00 120.40 124.79 2dyk s VAL 54 Ca 0.04 -0.87 -0.06 0.00 0.00 0.00 0.00 61.98 61.08 2dyk s VAL 54 Cb -0.12 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 2dyk s VAL 54 CO 0.00 0.50 0.03 -0.62 0.00 0.00 0.00 175.10 175.01 2dyk s ASP 55 N 0.30 4.92 0.00 3.32 2.15 0.67 0.36 116.67 128.39 2dyk s ASP 55 Ca -0.14 -0.22 0.24 0.00 0.43 0.00 0.00 52.55 52.86 2dyk s ASP 55 Cb -0.16 -1.86 0.67 0.00 -0.30 0.00 0.00 42.92 41.27 2dyk s ASP 55 CO 0.06 0.01 1.52 0.35 -0.17 0.00 0.00 175.17 176.95 2dyk n THR 56 N 4.59 0.18 -0.33 1.71 -2.24 -1.04 -2.08 114.28 115.06 2dyk n THR 56 Ca -0.17 -0.43 0.14 0.00 -2.27 0.00 0.00 64.05 61.33 2dyk n THR 56 Cb 0.51 0.71 0.36 0.00 -2.10 0.00 0.00 70.33 69.81 2dyk n THR 56 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2dyk h GLY 57 N 4.83 1.60 2.00 3.38 0.00 -1.85 -0.66 103.07 112.37 2dyk h GLY 57 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2dyk h GLY 57 CO 0.00 -0.05 0.00 -1.33 0.00 0.00 0.00 176.54 175.16 2dyk h GLY 58 N 0.70 0.00 2.00 4.60 0.00 -1.79 -2.55 103.07 106.03 2dyk h GLY 58 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.89 2dyk h GLY 58 CO -0.34 0.00 0.00 1.41 0.00 0.00 0.00 176.54 177.61 2dyk h LEU 59 N 0.00 0.00 -9.77 3.11 3.38 -1.22 -3.44 115.31 107.37 2dyk h LEU 59 Ca 0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 2dyk h LEU 59 Cb 0.22 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2dyk h LEU 59 CO 0.00 0.00 0.02 0.26 0.09 0.00 0.00 178.44 178.81 2dyk s TRP 60 N -3.32 3.74 -0.16 1.13 0.52 -0.96 -4.78 118.94 115.11 2dyk s TRP 60 Ca 0.05 1.31 -0.15 0.00 0.02 0.00 0.00 56.10 57.34 2dyk s TRP 60 Cb 0.10 -2.54 -0.11 0.00 -1.15 0.00 0.00 33.47 29.77 2dyk s TRP 60 CO 0.46 0.48 0.07 0.77 0.02 0.00 0.00 176.95 178.75 2dyk h SER 61 N 4.03 0.00 -0.65 2.95 0.02 -1.89 -3.50 113.55 114.52 2dyk h SER 61 Ca -0.49 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.19 2dyk h SER 61 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2dyk h SER 61 CO 0.65 1.03 0.00 0.61 -1.14 0.00 0.00 176.83 177.98 2dyk n GLY 62 N 1.56 6.93 0.81 -3.77 0.00 -1.26 -5.06 105.19 104.41 2dyk n GLY 62 Ca -0.16 -1.82 0.09 0.00 0.00 0.00 0.00 46.02 44.13 2dyk n GLY 62 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dyk n ASP 63 N 0.00 2.39 -4.80 1.61 5.75 -1.26 -4.78 116.55 115.45 2dyk n ASP 63 Ca 0.00 -1.92 -0.37 0.00 -0.01 0.00 0.00 54.79 52.50 2dyk n ASP 63 Cb 0.00 -0.24 -0.07 0.00 -1.03 0.00 0.00 41.12 39.78 2dyk n ASP 63 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2dyk s LYS 64 N -1.51 3.88 -0.19 0.11 2.20 -1.26 -4.80 119.74 118.16 2dyk s LYS 64 Ca 0.33 -0.00 -0.28 0.00 -0.36 0.00 0.00 55.97 55.65 2dyk s LYS 64 Cb 0.17 -3.30 -0.00 0.00 -1.51 0.00 0.00 37.83 33.19 2dyk s LYS 64 CO 0.24 0.53 0.97 -0.46 -0.36 0.00 0.00 175.35 176.27 2dyk s TRP 65 N -0.38 3.39 0.14 4.03 -0.11 -1.26 -4.93 118.94 119.82 2dyk s TRP 65 Ca 0.15 1.42 -0.04 0.00 1.22 0.00 0.00 56.10 58.85 2dyk s TRP 65 Cb -0.13 -3.18 -0.03 0.00 -1.50 0.00 0.00 33.47 28.64 2dyk s TRP 65 CO 0.04 -0.37 0.15 -1.83 -4.62 0.00 0.00 176.95 170.32 2dyk s GLU 66 N 2.71 1.02 0.31 5.86 -1.05 -1.26 -5.04 118.70 121.25 2dyk s GLU 66 Ca 0.43 -1.32 0.08 0.00 -0.15 0.00 0.00 54.97 54.01 2dyk s GLU 66 Cb -0.16 0.30 0.85 0.00 -0.44 0.00 0.00 34.13 34.68 2dyk s GLU 66 CO 0.10 -0.33 1.71 -0.22 0.95 0.00 0.00 175.26 177.47 2dyk h LYS 67 N 2.73 0.48 -0.52 -4.83 3.64 -1.98 -0.17 116.57 115.92 2dyk h LYS 67 Ca -0.34 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2dyk h LYS 67 Cb 1.21 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.90 2dyk h LYS 67 CO 0.54 0.32 0.31 -0.22 -2.27 0.00 0.00 179.45 178.13 2dyk h LYS 68 N 0.50 0.70 -0.20 1.90 3.11 -1.99 0.19 116.57 120.77 2dyk h LYS 68 Ca 0.62 -0.07 -0.11 0.00 -2.81 0.00 0.00 60.65 58.29 2dyk h LYS 68 Cb 1.21 -0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 32.29 2dyk h LYS 68 CO -0.51 0.51 -0.31 0.82 -2.81 0.00 0.00 179.45 177.15 2dyk h ILE 69 N 0.69 1.33 -0.78 2.00 2.04 -1.55 -2.95 117.51 118.30 2dyk h ILE 69 Ca 0.19 -1.53 0.06 0.00 1.00 0.00 0.00 64.86 64.58 2dyk h ILE 69 Cb -0.01 1.83 -0.05 0.00 -0.74 0.00 0.00 36.82 37.85 2dyk h ILE 69 CO -0.03 0.47 0.51 -0.61 0.00 0.00 0.00 178.15 178.49 2dyk h GLN 70 N 0.24 0.81 -0.08 2.37 4.15 -0.78 -0.03 115.11 121.79 2dyk h GLN 70 Ca 0.02 -0.05 -0.11 0.00 0.77 0.00 0.00 58.65 59.28 2dyk h GLN 70 Cb 0.90 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.39 2dyk h GLN 70 CO 0.07 0.54 -0.42 0.93 -1.93 0.00 0.00 178.83 178.02 2dyk h GLU 71 N 0.84 0.19 0.02 1.69 5.08 -0.91 0.50 114.58 121.99 2dyk h GLU 71 Ca 0.34 -0.09 -0.26 0.00 -1.00 0.00 0.00 59.36 58.35 2dyk h GLU 71 Cb 0.24 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.51 2dyk h GLU 71 CO -0.12 0.58 -1.05 0.87 -1.00 0.00 0.00 179.01 178.30 2dyk h LYS 72 N 0.16 0.59 -0.53 2.33 1.57 -1.03 -3.00 116.57 116.65 2dyk h LYS 72 Ca 0.01 -0.67 -0.09 0.00 -1.87 0.00 0.00 60.65 58.04 2dyk h LYS 72 Cb 0.82 0.20 -0.02 0.00 0.08 0.00 0.00 32.23 33.30 2dyk h LYS 72 CO 0.06 1.27 -0.02 0.28 -0.57 0.00 0.00 179.45 180.47 2dyk h VAL 73 N 0.32 1.26 -0.64 0.50 2.07 -0.87 -1.40 116.25 117.48 2dyk h VAL 73 Ca -0.12 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.37 2dyk h VAL 73 Cb 1.70 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 32.28 2dyk h VAL 73 CO 0.20 0.39 0.31 0.44 0.02 0.00 0.00 177.57 178.93 2dyk h ASP 74 N 0.85 0.41 -0.10 0.57 3.32 -0.89 -0.28 116.42 120.29 2dyk h ASP 74 Ca 0.15 0.05 -0.17 0.00 0.02 0.00 0.00 57.03 57.09 2dyk h ASP 74 Cb 0.52 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 2dyk h ASP 74 CO 0.03 0.25 -0.53 0.03 -1.72 0.00 0.00 179.24 177.30 2dyk h ARG 75 N 0.56 0.68 0.00 3.56 3.08 -1.34 -2.66 114.38 118.26 2dyk h ARG 75 Ca 0.31 -0.42 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 2dyk h ARG 75 Cb 0.29 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 2dyk h ARG 75 CO -0.24 1.04 -0.12 0.00 -1.07 0.00 0.00 179.97 179.57 2dyk h ALA 76 N 0.88 1.34 -0.01 0.04 0.00 -0.56 -2.46 119.26 118.49 2dyk h ALA 76 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2dyk h ALA 76 Cb 1.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2dyk h ALA 76 CO 0.11 0.16 -0.25 1.28 0.00 0.00 0.00 179.25 180.55 2dyk n LEU 77 N -3.73 1.14 0.00 0.00 4.77 -0.18 -4.71 117.00 114.28 2dyk n LEU 77 Ca -0.02 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 2dyk n LEU 77 Cb 0.23 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2dyk n LEU 77 CO 0.31 0.21 0.17 -0.62 -1.33 0.00 0.00 177.39 176.13 2dyk n GLU 78 N -0.53 0.00 -1.51 3.23 -0.58 -0.93 -1.60 120.64 118.72 2dyk n GLU 78 Ca 0.13 0.35 -0.22 0.00 -0.42 0.00 0.00 57.16 56.99 2dyk n GLU 78 Cb 0.36 -0.53 0.08 0.00 -0.57 0.00 0.00 31.44 30.78 2dyk n GLU 78 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2dyk n ASP 79 N -2.13 5.05 -4.75 1.62 5.75 -1.26 -5.02 116.55 115.81 2dyk n ASP 79 Ca 0.00 -3.77 -0.41 0.00 -0.01 0.00 0.00 54.79 50.60 2dyk n ASP 79 Cb 0.00 -0.60 -0.04 0.00 -1.03 0.00 0.00 41.12 39.45 2dyk n ASP 79 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2dyk s ALA 80 N -3.57 3.43 -0.07 2.12 0.00 -0.63 -4.60 121.76 118.44 2dyk s ALA 80 Ca 0.53 0.97 0.12 0.00 0.00 0.00 0.00 51.96 53.59 2dyk s ALA 80 Cb 0.44 -3.38 -0.23 0.00 0.00 0.00 0.00 23.12 19.95 2dyk s ALA 80 CO 0.01 -0.30 0.57 0.39 0.00 0.00 0.00 175.76 176.43 2dyk n GLU 81 N 1.53 0.64 -3.82 0.00 4.71 0.67 -4.96 120.64 119.41 2dyk n GLU 81 Ca 0.01 0.26 -0.12 0.00 -0.01 0.00 0.00 57.16 57.29 2dyk n GLU 81 Cb 0.44 -1.76 -0.11 0.00 -1.01 0.00 0.00 31.44 29.01 2dyk n GLU 81 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2dyk s VAL 82 N -2.58 0.04 -0.09 2.62 1.01 -1.18 -4.28 120.40 115.94 2dyk s VAL 82 Ca -0.06 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.61 2dyk s VAL 82 Cb 0.08 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 36.03 2dyk s VAL 82 CO 0.82 -0.18 -0.17 -0.69 0.00 0.00 0.00 175.10 174.88 2dyk s VAL 83 N -0.67 2.75 -0.41 2.92 1.01 -0.42 -1.63 120.40 123.96 2dyk s VAL 83 Ca -0.08 -0.80 -0.10 0.00 0.00 0.00 0.00 61.98 61.00 2dyk s VAL 83 Cb -0.04 -2.09 0.06 0.00 0.00 0.00 0.00 36.38 34.31 2dyk s VAL 83 CO 0.01 0.56 0.26 -0.76 0.00 0.00 0.00 175.10 175.17 2dyk s LEU 84 N -0.08 5.07 -0.52 3.92 1.43 0.23 0.03 118.68 128.77 2dyk s LEU 84 Ca -0.04 -1.34 -0.22 0.00 -1.03 0.00 0.00 54.13 51.50 2dyk s LEU 84 Cb -0.14 -2.02 0.04 0.00 0.03 0.00 0.00 46.19 44.11 2dyk s LEU 84 CO 0.04 -0.51 0.81 0.12 0.23 0.00 0.00 176.35 177.04 2dyk s PHE 85 N 1.48 2.91 -0.22 0.29 5.36 -0.06 -0.89 117.98 126.85 2dyk s PHE 85 Ca 0.03 -0.16 -0.20 0.00 -0.96 0.00 0.00 56.93 55.63 2dyk s PHE 85 Cb -0.22 -3.81 -0.02 0.00 -0.34 0.00 0.00 43.02 38.62 2dyk s PHE 85 CO 0.04 -1.18 0.60 0.00 -1.46 0.00 0.00 175.22 173.22 2dyk s ALA 86 N 3.39 3.57 -0.00 11.12 0.00 0.55 -0.90 121.76 139.49 2dyk s ALA 86 Ca 0.25 -0.38 0.05 0.00 0.00 0.00 0.00 51.96 51.87 2dyk s ALA 86 Cb -0.15 -2.97 -0.01 0.00 0.00 0.00 0.00 23.12 20.00 2dyk s ALA 86 CO 0.17 -0.65 -0.14 0.14 0.00 0.00 0.00 175.76 175.28 2dyk s VAL 87 N 2.13 1.13 0.14 0.00 -7.23 -0.84 -4.37 120.40 111.37 2dyk s VAL 87 Ca 0.26 -0.68 -0.32 0.00 -1.81 0.00 0.00 61.98 59.43 2dyk s VAL 87 Cb -0.16 -0.96 -0.12 0.00 0.56 0.00 0.00 36.38 35.71 2dyk s VAL 87 CO 0.09 0.27 1.74 -0.67 -0.31 0.00 0.00 175.10 176.22 2dyk n ASP 88 N 2.58 3.75 -0.01 4.85 -0.08 -1.26 -1.24 116.55 125.14 2dyk n ASP 88 Ca -0.15 1.03 0.14 0.00 -1.51 0.00 0.00 54.79 54.30 2dyk n ASP 88 Cb 0.55 -1.51 0.55 0.00 2.34 0.00 0.00 41.12 43.05 2dyk n ASP 88 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dyk n GLY 89 N 3.96 -1.39 0.54 0.27 0.00 0.24 -4.28 105.19 104.55 2dyk n GLY 89 Ca 0.17 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 2dyk n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dyk n ARG 90 N -1.44 0.29 -1.18 1.61 1.74 -1.25 -4.83 116.66 111.61 2dyk n ARG 90 Ca 0.08 0.13 -0.31 0.00 -0.77 0.00 0.00 57.85 56.97 2dyk n ARG 90 Cb 0.33 -1.01 0.10 0.00 -1.02 0.00 0.00 32.46 30.86 2dyk n ARG 90 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dyk s ALA 91 N -2.25 2.14 0.54 7.54 0.00 -1.26 -5.01 121.76 123.46 2dyk s ALA 91 Ca -0.19 0.32 -0.17 0.00 0.00 0.00 0.00 51.96 51.92 2dyk s ALA 91 Cb 0.07 -3.30 -0.06 0.00 0.00 0.00 0.00 23.12 19.83 2dyk s ALA 91 CO 0.25 -1.92 1.03 -1.21 0.00 0.00 0.00 175.76 173.91 2dyk s GLU 92 N -4.86 3.63 0.58 0.00 0.41 -1.26 -4.83 118.70 112.38 2dyk s GLU 92 Ca 0.62 1.17 -0.21 0.00 -0.41 0.00 0.00 54.97 56.15 2dyk s GLU 92 Cb -0.18 -2.08 -0.04 0.00 -1.78 0.00 0.00 34.13 30.05 2dyk s GLU 92 CO 0.56 -0.55 1.34 -0.51 -0.49 0.00 0.00 175.26 175.62 2dyk s LEU 93 N -4.10 3.77 0.40 1.80 1.43 -1.26 -5.00 118.68 115.73 2dyk s LEU 93 Ca 0.63 2.73 0.07 0.00 -1.03 0.00 0.00 54.13 56.54 2dyk s LEU 93 Cb -0.14 -4.37 -0.05 0.00 0.03 0.00 0.00 46.19 41.65 2dyk s LEU 93 CO 0.30 -1.70 0.16 0.42 0.23 0.00 0.00 176.35 175.76 2dyk s THR 94 N -1.33 2.36 0.20 5.49 -4.23 -1.26 -4.99 115.64 111.89 2dyk s THR 94 Ca 0.75 -1.73 -0.10 0.00 -1.18 0.00 0.00 61.69 59.43 2dyk s THR 94 Cb -0.40 -2.98 0.14 0.00 1.34 0.00 0.00 72.50 70.60 2dyk s THR 94 CO 0.46 -0.03 1.73 -0.61 -0.54 0.00 0.00 174.62 175.63 2dyk h GLN 95 N 1.47 0.35 -0.84 3.99 5.75 -1.99 -0.72 115.11 123.12 2dyk h GLN 95 Ca -0.43 -0.02 0.01 0.00 -0.15 0.00 0.00 58.65 58.06 2dyk h GLN 95 Cb 1.25 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 29.68 2dyk h GLN 95 CO 0.70 0.23 0.55 0.00 -2.65 0.00 0.00 178.83 177.66 2dyk h ALA 96 N 1.42 1.42 -0.46 3.38 0.00 -1.96 -1.05 119.26 122.01 2dyk h ALA 96 Ca 0.30 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2dyk h ALA 96 Cb 0.38 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2dyk h ALA 96 CO -0.32 0.53 0.20 -0.44 0.00 0.00 0.00 179.25 179.22 2dyk h ASP 97 N 1.12 0.61 -0.30 0.00 3.32 -1.56 -0.56 116.42 119.05 2dyk h ASP 97 Ca 0.31 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 57.13 2dyk h ASP 97 Cb -0.10 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 2dyk h ASP 97 CO -0.07 0.59 -0.10 1.88 -1.72 0.00 0.00 179.24 179.82 2dyk h TYR 98 N 0.60 0.77 -0.29 4.55 0.05 -0.69 -0.69 116.97 121.26 2dyk h TYR 98 Ca 0.15 -0.13 -0.17 0.00 0.05 0.00 0.00 58.73 58.63 2dyk h TYR 98 Cb 0.16 -0.20 -0.00 0.00 1.01 0.00 0.00 36.73 37.69 2dyk h TYR 98 CO -0.00 0.77 -0.50 0.93 -1.05 0.00 0.00 178.16 178.31 2dyk h GLU 99 N 0.65 0.83 -0.30 4.88 5.08 -1.00 -2.04 114.58 122.67 2dyk h GLU 99 Ca 0.11 -0.50 -0.11 0.00 -1.00 0.00 0.00 59.36 57.87 2dyk h GLU 99 Cb 0.54 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2dyk h GLU 99 CO 0.03 1.13 -0.27 0.28 -1.00 0.00 0.00 179.01 179.18 2dyk h VAL 100 N 0.65 1.28 -0.68 3.13 2.07 -0.95 -1.58 116.25 120.16 2dyk h VAL 100 Ca 0.03 -1.36 -0.05 0.00 0.82 0.00 0.00 66.70 66.14 2dyk h VAL 100 Cb 1.09 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 32.17 2dyk h VAL 100 CO 0.11 0.44 0.24 0.00 0.02 0.00 0.00 177.57 178.38 2dyk h ALA 101 N 1.17 0.89 -0.48 1.67 0.00 -0.97 -0.97 119.26 120.56 2dyk h ALA 101 Ca 0.07 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 2dyk h ALA 101 Cb 0.75 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2dyk h ALA 101 CO 0.06 0.54 -0.01 1.49 0.00 0.00 0.00 179.25 181.33 2dyk h GLU 102 N 0.98 0.86 -0.61 0.00 4.57 -1.12 -1.32 114.58 117.94 2dyk h GLU 102 Ca 0.22 -0.28 0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2dyk h GLU 102 Cb 0.26 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.73 2dyk h GLU 102 CO -0.01 0.90 0.38 -0.92 -1.18 0.00 0.00 179.01 178.18 2dyk h TYR 103 N 0.71 0.71 -0.40 0.92 3.20 -1.06 -1.41 116.97 119.64 2dyk h TYR 103 Ca 0.14 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.91 2dyk h TYR 103 Cb 0.52 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 2dyk h TYR 103 CO 0.04 0.41 -0.21 -0.07 -1.64 0.00 0.00 178.16 176.69 2dyk h LEU 104 N 0.75 0.81 -0.50 2.82 3.38 -0.93 0.86 115.31 122.51 2dyk h LEU 104 Ca 0.24 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2dyk h LEU 104 Cb 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2dyk h LEU 104 CO -0.10 1.00 0.20 0.03 0.09 0.00 0.00 178.44 179.66 2dyk h ARG 105 N 0.70 0.74 -0.62 1.13 3.08 -0.96 -2.24 114.38 116.22 2dyk h ARG 105 Ca 0.10 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 2dyk h ARG 105 Cb 0.73 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.63 2dyk h ARG 105 CO 0.06 0.66 0.34 0.00 -1.07 0.00 0.00 179.97 179.96 2dyk h ARG 106 N 0.66 0.86 -0.49 0.04 3.08 -0.99 -2.37 114.38 115.18 2dyk h ARG 106 Ca 0.17 -0.10 0.05 0.00 0.07 0.00 0.00 59.98 60.17 2dyk h ARG 106 Cb 0.19 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 2dyk h ARG 106 CO -0.01 0.66 0.33 0.87 -1.07 0.00 0.00 179.97 180.74 2dyk h LYS 107 N 0.84 0.43 -0.10 0.04 1.79 -0.53 -3.47 116.57 115.57 2dyk h LYS 107 Ca 0.22 -0.03 -0.04 0.00 -2.18 0.00 0.00 60.65 58.62 2dyk h LYS 107 Cb 0.04 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.58 2dyk h LYS 107 CO -0.03 0.28 -0.04 0.41 -1.08 0.00 0.00 179.45 178.99 2dyk n GLY 108 N -1.50 0.50 3.85 3.86 0.00 -0.87 -5.03 105.19 106.00 2dyk n GLY 108 Ca 0.06 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 2dyk n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dyk s LYS 109 N -1.25 3.98 0.29 1.61 3.01 -1.26 -5.00 119.74 121.12 2dyk s LYS 109 Ca 0.00 0.71 -0.30 0.00 -1.01 0.00 0.00 55.97 55.38 2dyk s LYS 109 Cb 0.00 -2.36 -0.13 0.00 -1.01 0.00 0.00 37.83 34.34 2dyk s LYS 109 CO 0.00 0.04 1.41 -2.30 0.51 0.00 0.00 175.35 175.01 2dyk n PRO 110 N -0.74 2.22 -4.73 -1.68 -0.02 -1.26 -4.85 135.00 123.94 2dyk n PRO 110 Ca 0.04 0.79 -0.26 0.00 -2.02 0.00 0.00 63.50 62.05 2dyk n PRO 110 Cb 0.54 -2.44 -0.16 0.00 -0.02 0.00 0.00 33.50 31.41 2dyk n PRO 110 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2dyk s VAL 111 N -0.43 1.32 -0.25 -1.45 1.01 -1.26 -1.30 120.40 118.04 2dyk s VAL 111 Ca 0.63 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.94 2dyk s VAL 111 Cb -0.59 -1.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 2dyk s VAL 111 CO 0.54 0.39 0.03 -0.63 0.00 0.00 0.00 175.10 175.43 2dyk s ILE 112 N 0.42 3.84 -0.26 2.22 1.01 0.10 -4.96 121.20 123.57 2dyk s ILE 112 Ca -0.12 -0.47 -0.28 0.00 0.00 0.00 0.00 60.65 59.78 2dyk s ILE 112 Cb -0.15 -2.84 0.01 0.00 0.01 0.00 0.00 42.46 39.49 2dyk s ILE 112 CO 0.04 0.28 1.02 -0.22 0.00 0.00 0.00 174.94 176.06 2dyk s LEU 113 N 1.52 4.04 -0.23 2.97 2.96 -1.26 -0.88 118.68 127.80 2dyk s LEU 113 Ca 0.05 1.21 -0.04 0.00 -0.22 0.00 0.00 54.13 55.13 2dyk s LEU 113 Cb -0.15 -3.49 -0.01 0.00 0.50 0.00 0.00 46.19 43.03 2dyk s LEU 113 CO 0.01 -0.73 -0.03 -0.69 -1.32 0.00 0.00 176.35 173.59 2dyk s VAL 114 N 3.31 3.47 -0.12 1.68 1.01 -0.08 -0.47 120.40 129.21 2dyk s VAL 114 Ca 0.43 -0.49 -0.19 0.00 0.00 0.00 0.00 61.98 61.74 2dyk s VAL 114 Cb -0.14 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2dyk s VAL 114 CO 0.09 0.39 0.50 0.00 0.00 0.00 0.00 175.10 176.09 2dyk s ALA 115 N 1.49 3.46 0.35 5.51 0.00 -0.36 -1.98 121.76 130.23 2dyk s ALA 115 Ca 0.06 -0.16 0.07 0.00 0.00 0.00 0.00 51.96 51.93 2dyk s ALA 115 Cb -0.15 -2.69 -0.02 0.00 0.00 0.00 0.00 23.12 20.27 2dyk s ALA 115 CO -0.02 -0.03 0.38 0.95 0.00 0.00 0.00 175.76 177.04 2dyk s THR 116 N 0.68 3.63 -1.73 0.00 -4.23 -0.38 -0.35 115.64 113.27 2dyk s THR 116 Ca 0.27 -1.20 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 2dyk s THR 116 Cb -0.15 -3.24 0.00 0.00 1.34 0.00 0.00 72.50 70.44 2dyk s THR 116 CO 0.11 -0.14 0.00 0.29 -0.54 0.00 0.00 174.62 174.34 2dyk n LYS 117 N -1.52 -1.72 -2.28 3.99 5.02 -1.08 0.83 118.16 121.40 2dyk n LYS 117 Ca -0.00 0.98 -0.43 0.00 -2.02 0.00 0.00 58.31 56.84 2dyk n LYS 117 Cb 0.59 -5.59 0.00 0.00 -0.02 0.00 0.00 35.03 30.01 2dyk n LYS 117 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2dyk n VAL 118 N -3.67 3.96 0.22 -0.18 0.31 0.16 -4.68 118.33 114.46 2dyk n VAL 118 Ca -0.23 -3.94 0.07 0.00 -0.01 0.00 0.00 64.34 60.24 2dyk n VAL 118 Cb 0.67 -2.46 0.53 0.00 -0.91 0.00 0.00 33.84 31.67 2dyk n VAL 118 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2dyk h ASP 119 N 6.40 0.00 -4.48 4.52 3.32 -1.90 -3.39 116.42 120.89 2dyk h ASP 119 Ca 0.45 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.15 2dyk h ASP 119 Cb 0.72 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.04 2dyk h ASP 119 CO 1.62 0.23 -0.76 -0.62 -1.72 0.00 0.00 179.24 177.99 2dyk s ASP 120 N -6.60 1.22 0.51 6.45 -1.08 -1.26 -4.90 116.67 111.01 2dyk s ASP 120 Ca -0.03 -0.49 0.28 0.00 -0.52 0.00 0.00 52.55 51.79 2dyk s ASP 120 Cb 0.14 -0.03 1.38 0.00 -1.46 0.00 0.00 42.92 42.95 2dyk s ASP 120 CO 0.66 -0.08 1.90 -0.65 0.52 0.00 0.00 175.17 177.52 2dyk h PRO 121 N 4.75 0.08 -0.05 4.34 0.11 -2.02 -1.36 132.00 137.85 2dyk h PRO 121 Ca -0.37 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.71 2dyk h PRO 121 Cb 1.19 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2dyk h PRO 121 CO 0.42 0.06 -0.10 1.57 -0.21 0.00 0.00 178.00 179.74 2dyk h LYS 122 N 0.09 0.07 0.00 1.05 2.10 -1.97 -1.21 116.57 116.70 2dyk h LYS 122 Ca 0.41 -0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 59.02 2dyk h LYS 122 Cb 1.48 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.79 2dyk h LYS 122 CO -0.04 0.17 -0.10 0.45 -2.00 0.00 0.00 179.45 177.93 2dyk h HIS 123 N 0.07 0.00 0.00 0.07 3.86 -1.63 -2.45 115.15 115.07 2dyk h HIS 123 Ca 0.02 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 2dyk h HIS 123 Cb 0.22 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.69 2dyk h HIS 123 CO 0.00 0.10 -0.12 0.93 0.86 0.00 0.00 177.93 179.70 2dyk h GLU 124 N 0.00 0.00 0.00 2.45 5.08 -1.35 -1.75 114.58 119.01 2dyk h GLU 124 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2dyk h GLU 124 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2dyk h GLU 124 CO 0.01 0.12 0.00 1.25 -1.00 0.00 0.00 179.01 179.39 2dyk h LEU 125 N 0.00 0.00 -3.59 1.33 5.85 -1.57 -3.09 115.31 114.25 2dyk h LEU 125 Ca -0.00 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.43 2dyk h LEU 125 Cb 0.31 0.00 -0.17 0.00 0.37 0.00 0.00 40.66 41.17 2dyk h LEU 125 CO 0.02 0.00 0.19 -1.22 -0.34 0.00 0.00 178.44 177.08 2dyk n TYR 126 N -2.55 1.83 0.63 1.25 4.01 -0.66 -4.57 117.16 117.09 2dyk n TYR 126 Ca 0.01 -1.65 0.12 0.00 -0.16 0.00 0.00 57.90 56.22 2dyk n TYR 126 Cb 0.21 -0.65 0.22 0.00 -0.31 0.00 0.00 39.34 38.81 2dyk n TYR 126 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2dyk n LEU 127 N -1.07 3.08 -0.34 7.72 4.77 -1.17 -4.70 117.00 125.31 2dyk n LEU 127 Ca 0.42 -1.25 0.03 0.00 -0.03 0.00 0.00 56.01 55.18 2dyk n LEU 127 Cb 1.27 -0.17 0.09 0.00 -2.33 0.00 0.00 43.42 42.28 2dyk n LEU 127 CO 0.34 0.62 0.57 0.61 -1.33 0.00 0.00 177.39 178.21 2dyk n GLY 128 N 1.42 -1.67 0.38 -0.72 0.00 -1.26 -0.50 105.19 102.83 2dyk n GLY 128 Ca 0.18 0.99 0.20 0.00 0.00 0.00 0.00 46.02 47.39 2dyk n GLY 128 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2dyk h PRO 129 N 0.00 0.00 -0.27 1.61 0.11 -1.99 -2.20 132.00 129.25 2dyk h PRO 129 Ca 0.39 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.39 2dyk h PRO 129 Cb 0.62 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 2dyk h PRO 129 CO -0.92 0.00 -0.27 -0.07 -0.21 0.00 0.00 178.00 176.53 2dyk h LEU 130 N 0.00 0.54 -1.19 2.35 4.07 -1.16 -2.84 115.31 117.08 2dyk h LEU 130 Ca 0.20 -0.19 0.00 0.00 0.08 0.00 0.00 57.88 57.97 2dyk h LEU 130 Cb 0.98 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.57 2dyk h LEU 130 CO -0.00 0.80 0.00 -1.22 -1.08 0.00 0.00 178.44 176.93 2dyk n TYR 131 N -4.11 0.74 1.17 1.13 4.01 -0.83 -1.80 117.16 117.47 2dyk n TYR 131 Ca -0.00 0.35 0.12 0.00 -0.16 0.00 0.00 57.90 58.22 2dyk n TYR 131 Cb 0.42 -1.07 0.30 0.00 -0.31 0.00 0.00 39.34 38.69 2dyk n TYR 131 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2dyk n GLY 132 N -0.93 -0.65 0.20 2.72 0.00 -1.07 -4.03 105.19 101.43 2dyk n GLY 132 Ca -0.00 -0.43 0.14 0.00 0.00 0.00 0.00 46.02 45.73 2dyk n GLY 132 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dyk h LEU 133 N 1.11 0.00 0.00 0.99 3.38 -1.49 -3.46 115.31 115.83 2dyk h LEU 133 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dyk h LEU 133 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2dyk h LEU 133 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2dyk n GLY 134 N -0.30 0.90 0.06 0.83 0.00 -1.26 -4.94 105.19 100.47 2dyk n GLY 134 Ca 0.01 -0.46 0.04 0.00 0.00 0.00 0.00 46.02 45.61 2dyk n GLY 134 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2dyk n PHE 135 N -2.41 0.00 -3.03 1.61 3.72 -1.26 -5.08 117.46 111.01 2dyk n PHE 135 Ca 0.00 -0.66 0.00 0.00 -0.05 0.00 0.00 57.45 56.74 2dyk n PHE 135 Cb 0.07 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 2dyk n PHE 135 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dyk n GLY 136 N -0.84 -2.04 3.74 1.37 0.00 -1.26 -4.56 105.19 101.60 2dyk n GLY 136 Ca 0.07 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 2dyk n GLY 136 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dyk s ASP 137 N -3.90 6.49 0.48 1.61 1.11 -1.26 -4.63 116.67 116.56 2dyk s ASP 137 Ca 0.00 2.82 -0.19 0.00 0.18 0.00 0.00 52.55 55.36 2dyk s ASP 137 Cb 0.00 -2.63 -0.09 0.00 1.07 0.00 0.00 42.92 41.28 2dyk s ASP 137 CO 0.00 -0.83 0.99 -2.16 1.18 0.00 0.00 175.17 174.35 2dyk s PRO 138 N -0.22 3.96 -0.35 8.23 0.04 -1.26 -4.67 135.00 140.73 2dyk s PRO 138 Ca 0.63 1.14 -0.13 0.00 0.04 0.00 0.00 61.00 62.68 2dyk s PRO 138 Cb -0.45 -2.13 -0.01 0.00 0.04 0.00 0.00 34.50 31.94 2dyk s PRO 138 CO 0.44 -0.27 0.24 0.42 0.04 0.00 0.00 177.00 177.87 2dyk s ILE 139 N -2.28 5.23 0.04 0.56 1.01 0.38 -4.87 121.20 121.27 2dyk s ILE 139 Ca 0.63 -0.30 -0.31 0.00 0.00 0.00 0.00 60.65 60.67 2dyk s ILE 139 Cb -0.12 -3.72 -0.06 0.00 0.01 0.00 0.00 42.46 38.57 2dyk s ILE 139 CO 0.22 -0.05 1.31 -2.16 0.00 0.00 0.00 174.94 174.26 2dyk s PRO 140 N 1.71 4.35 0.16 2.79 0.04 -1.26 -1.22 135.00 141.56 2dyk s PRO 140 Ca 0.06 1.90 0.02 0.00 0.04 0.00 0.00 61.00 63.02 2dyk s PRO 140 Cb -0.18 -3.42 -0.05 0.00 0.04 0.00 0.00 34.50 30.90 2dyk s PRO 140 CO 0.10 -0.43 -0.00 0.95 0.04 0.00 0.00 177.00 177.66 2dyk s THR 141 N 1.62 0.66 -0.18 1.26 -4.23 0.53 -4.10 115.64 111.21 2dyk s THR 141 Ca 0.62 -1.97 -0.05 0.00 -1.18 0.00 0.00 61.69 59.10 2dyk s THR 141 Cb -0.31 -2.08 0.09 0.00 1.34 0.00 0.00 72.50 71.53 2dyk s THR 141 CO 0.28 -0.51 0.32 -0.55 -0.54 0.00 0.00 174.62 173.61 2dyk s SER 142 N -3.16 0.32 0.15 3.99 0.15 -0.64 -0.66 113.70 113.84 2dyk s SER 142 Ca 0.23 0.52 0.08 0.00 0.70 0.00 0.00 55.95 57.48 2dyk s SER 142 Cb 0.06 0.89 -0.12 0.00 -1.71 0.00 0.00 66.02 65.15 2dyk s SER 142 CO 0.03 -0.26 1.34 0.28 1.20 0.00 0.00 173.24 175.83 2dyk h SER 143 N 8.24 0.00 -0.50 5.45 0.02 -1.91 0.12 113.55 124.98 2dyk h SER 143 Ca -0.16 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.72 2dyk h SER 143 Cb 1.12 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.65 2dyk h SER 143 CO 0.17 0.94 0.05 -0.08 -1.14 0.00 0.00 176.83 176.76 2dyk h GLU 144 N 0.00 0.85 -0.46 3.45 4.57 -1.95 -3.20 114.58 117.84 2dyk h GLU 144 Ca -0.01 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.92 2dyk h GLU 144 Cb 1.66 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 30.16 2dyk h GLU 144 CO 0.12 0.86 0.00 0.72 -1.18 0.00 0.00 179.01 179.53 2dyk n HIS 145 N -4.37 0.61 -3.80 0.92 8.25 -1.23 -4.99 115.22 110.60 2dyk n HIS 145 Ca 0.01 -0.45 -0.26 0.00 -0.26 0.00 0.00 57.72 56.76 2dyk n HIS 145 Cb 0.28 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.39 2dyk n HIS 145 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dyk n ALA 146 N 0.97 -2.16 -2.68 -1.41 0.00 0.19 -4.98 120.51 110.43 2dyk n ALA 146 Ca 0.16 -0.23 -0.32 0.00 0.00 0.00 0.00 53.44 53.05 2dyk n ALA 146 Cb 0.50 -2.36 -0.09 0.00 0.00 0.00 0.00 19.45 17.50 2dyk n ALA 146 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2dyk s ARG 147 N -6.21 2.73 0.00 0.00 0.52 0.04 -4.60 118.95 111.42 2dyk s ARG 147 Ca 0.13 -0.66 0.00 0.00 -0.52 0.00 0.00 55.73 54.68 2dyk s ARG 147 Cb -0.05 -2.64 0.00 0.00 0.52 0.00 0.00 34.95 32.79 2dyk s ARG 147 CO 0.86 0.61 0.00 0.41 0.02 0.00 0.00 175.30 177.19 2dyk n GLY 148 N 1.22 0.36 0.21 -3.53 0.00 -1.26 -1.62 105.19 100.58 2dyk n GLY 148 Ca -0.14 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 2dyk n GLY 148 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dyk h LEU 149 N 0.00 0.43 -0.23 0.99 3.38 -1.87 -1.28 115.31 116.73 2dyk h LEU 149 Ca 0.00 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 2dyk h LEU 149 Cb 0.31 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2dyk h LEU 149 CO 0.00 0.78 -0.16 -0.33 0.09 0.00 0.00 178.44 178.82 2dyk h GLU 150 N 0.34 0.51 -0.93 1.13 4.39 -1.94 -1.86 114.58 116.23 2dyk h GLU 150 Ca 0.03 -0.25 0.04 0.00 0.34 0.00 0.00 59.36 59.52 2dyk h GLU 150 Cb 0.85 -0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.44 2dyk h GLU 150 CO 0.07 0.81 0.60 1.49 -1.16 0.00 0.00 179.01 180.82 2dyk h GLU 151 N 0.21 1.13 -0.23 2.33 4.81 -1.94 -1.36 114.58 119.52 2dyk h GLU 151 Ca 0.04 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 2dyk h GLU 151 Cb 0.69 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 2dyk h GLU 151 CO 0.04 0.74 0.06 1.25 -0.73 0.00 0.00 179.01 180.38 2dyk h LEU 152 N 1.16 0.35 -1.14 1.64 5.85 -1.11 -1.87 115.31 120.19 2dyk h LEU 152 Ca 0.37 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 2dyk h LEU 152 Cb 0.02 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2dyk h LEU 152 CO -0.13 0.48 0.15 -0.07 -0.34 0.00 0.00 178.44 178.54 2dyk h LEU 153 N 0.20 0.70 -0.46 2.25 3.38 -1.00 -0.57 115.31 119.82 2dyk h LEU 153 Ca 0.07 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2dyk h LEU 153 Cb 0.27 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2dyk h LEU 153 CO 0.00 0.67 0.13 -0.08 0.09 0.00 0.00 178.44 179.25 2dyk h GLU 154 N 0.74 0.72 -0.61 1.13 4.81 -1.08 -1.71 114.58 118.58 2dyk h GLU 154 Ca 0.17 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 2dyk h GLU 154 Cb 0.23 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 2dyk h GLU 154 CO -0.01 0.70 0.14 0.00 -0.73 0.00 0.00 179.01 179.11 2dyk h ALA 155 N 0.99 0.80 -0.02 2.92 0.00 -0.86 -1.91 119.26 121.18 2dyk h ALA 155 Ca 0.15 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2dyk h ALA 155 Cb 0.29 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2dyk h ALA 155 CO -0.00 0.52 0.01 0.82 0.00 0.00 0.00 179.25 180.60 2dyk h ILE 156 N 0.89 1.03 0.00 0.00 2.04 -0.96 -2.87 117.51 117.64 2dyk h ILE 156 Ca 0.19 -0.07 -0.05 0.00 1.00 0.00 0.00 64.86 65.93 2dyk h ILE 156 Cb 0.36 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2dyk h ILE 156 CO 0.00 0.02 -0.24 -0.50 0.00 0.00 0.00 178.15 177.44 2dyk h TRP 157 N -0.00 0.00 0.00 1.37 4.06 -1.23 -2.05 115.95 118.10 2dyk h TRP 157 Ca 0.01 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.96 2dyk h TRP 157 Cb 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.19 2dyk h TRP 157 CO -0.07 0.24 0.00 0.93 -3.56 0.00 0.00 178.44 175.98 2dyk h GLU 158 N 0.00 0.00 -0.01 0.49 5.08 -1.11 -2.84 114.58 116.19 2dyk h GLU 158 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2dyk h GLU 158 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2dyk h GLU 158 CO 0.03 0.00 -0.40 0.54 -1.00 0.00 0.00 179.01 178.19 2dyk n ARG 159 N -2.82 2.33 -2.88 2.33 1.74 -0.83 -4.93 116.66 111.60 2dyk n ARG 159 Ca 0.01 -0.42 -0.42 0.00 -0.77 0.00 0.00 57.85 56.25 2dyk n ARG 159 Cb 0.25 -1.13 -0.04 0.00 -1.02 0.00 0.00 32.46 30.51 2dyk n ARG 159 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dyk s LEU 160 N -2.13 4.06 0.00 0.55 1.43 -0.85 -4.94 118.68 116.80 2dyk s LEU 160 Ca 0.08 0.83 0.25 0.00 -1.03 0.00 0.00 54.13 54.26 2dyk s LEU 160 Cb 0.10 -3.19 1.49 0.00 0.03 0.00 0.00 46.19 44.62 2dyk s LEU 160 CO 0.40 -0.63 1.85 -0.81 0.23 0.00 0.00 176.35 177.38