#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ddc s SER 2 N 0.00 6.88 0.00 4.52 0.15 -1.26 -4.98 113.70 119.01 2ddc s SER 2 Ca 0.00 1.04 0.16 0.00 0.70 0.00 0.00 55.95 57.86 2ddc s SER 2 Cb 0.00 -2.28 0.38 0.00 -1.71 0.00 0.00 66.02 62.40 2ddc s SER 2 CO 0.00 0.30 1.29 1.33 1.20 0.00 0.00 173.24 177.37 2ddc n VAL 3 N 1.83 0.75 -2.29 4.45 0.24 -1.26 -5.00 118.33 117.05 2ddc n VAL 3 Ca -0.13 -0.87 -0.38 0.00 -2.04 0.00 0.00 64.34 60.92 2ddc n VAL 3 Cb 0.52 0.72 -0.02 0.00 -1.47 0.00 0.00 33.84 33.59 2ddc n VAL 3 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2ddc s ILE 4 N -1.10 3.14 0.19 1.34 -1.09 -1.26 -5.03 121.20 117.39 2ddc s ILE 4 Ca 0.31 0.94 0.06 0.00 -2.23 0.00 0.00 60.65 59.73 2ddc s ILE 4 Cb 0.17 -3.52 -0.05 0.00 -1.58 0.00 0.00 42.46 37.49 2ddc s ILE 4 CO 0.23 0.07 -0.11 0.28 -1.23 0.00 0.00 174.94 174.18 2ddc s THR 5 N -1.44 1.47 0.53 2.92 -1.32 -1.26 -5.06 115.64 111.47 2ddc s THR 5 Ca 0.58 -2.14 0.23 0.00 -1.21 0.00 0.00 61.69 59.15 2ddc s THR 5 Cb -0.30 -2.03 0.37 0.00 -1.51 0.00 0.00 72.50 69.02 2ddc s THR 5 CO 0.38 -0.60 2.03 0.77 -2.21 0.00 0.00 174.62 174.99 2ddc h SER 6 N 2.61 0.01 -3.31 8.08 4.64 -1.97 -3.40 113.55 120.21 2ddc h SER 6 Ca -0.38 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.39 2ddc h SER 6 Cb 1.21 -0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.92 2ddc h SER 6 CO 0.63 0.01 -0.80 -1.61 -0.87 0.00 0.00 176.83 174.19 2ddc s GLU 7 N -5.04 1.52 0.05 4.77 2.02 -1.26 -4.03 118.70 116.73 2ddc s GLU 7 Ca -0.05 -0.52 0.03 0.00 0.02 0.00 0.00 54.97 54.45 2ddc s GLU 7 Cb 0.19 -2.00 -0.02 0.00 0.10 0.00 0.00 34.13 32.40 2ddc s GLU 7 CO 0.72 -0.41 -0.10 -1.64 0.02 0.00 0.00 175.26 173.85 2ddc s MET 8 N 1.62 0.63 0.50 1.61 -1.94 -0.81 -4.96 119.30 115.93 2ddc s MET 8 Ca 0.01 -0.76 -0.03 0.00 -1.71 0.00 0.00 55.69 53.20 2ddc s MET 8 Cb -0.15 -0.49 -0.01 0.00 2.01 0.00 0.00 34.83 36.19 2ddc s MET 8 CO -0.08 0.10 0.76 0.15 -0.01 0.00 0.00 175.02 175.95 2ddc s LYS 9 N -1.47 3.15 -0.02 2.03 1.02 0.59 -0.83 119.74 124.22 2ddc s LYS 9 Ca -0.06 -0.17 0.02 0.00 0.02 0.00 0.00 55.97 55.78 2ddc s LYS 9 Cb -0.09 -2.43 0.00 0.00 -0.52 0.00 0.00 37.83 34.79 2ddc s LYS 9 CO 0.01 -0.37 -0.08 0.42 -0.92 0.00 0.00 175.35 174.41 2ddc s ILE 10 N -2.72 0.68 -0.04 2.17 1.01 0.32 -0.78 121.20 121.84 2ddc s ILE 10 Ca 0.49 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.82 2ddc s ILE 10 Cb -0.10 -0.60 0.02 0.00 0.01 0.00 0.00 42.46 41.79 2ddc s ILE 10 CO 0.42 0.21 -0.04 -1.61 0.00 0.00 0.00 174.94 173.91 2ddc s GLU 11 N 0.07 0.83 0.05 2.79 2.02 -0.24 -0.80 118.70 123.42 2ddc s GLU 11 Ca -0.01 -0.10 0.02 0.00 0.02 0.00 0.00 54.97 54.90 2ddc s GLU 11 Cb -0.06 -0.84 -0.03 0.00 0.10 0.00 0.00 34.13 33.30 2ddc s GLU 11 CO 0.00 -0.08 -0.08 0.14 0.02 0.00 0.00 175.26 175.26 2ddc s VAL 12 N 0.92 0.57 -0.12 2.63 -7.23 -0.46 -0.82 120.40 115.90 2ddc s VAL 12 Ca -0.11 -1.19 -0.04 0.00 -1.81 0.00 0.00 61.98 58.83 2ddc s VAL 12 Cb -0.14 -0.75 0.06 0.00 0.56 0.00 0.00 36.38 36.11 2ddc s VAL 12 CO 0.00 -0.44 0.20 -0.60 -0.31 0.00 0.00 175.10 173.95 2ddc s ARG 13 N -1.85 0.09 -0.09 4.82 3.52 -0.79 -1.64 118.95 123.01 2ddc s ARG 13 Ca -0.07 0.56 0.03 0.00 -0.13 0.00 0.00 55.73 56.12 2ddc s ARG 13 Cb -0.08 -0.35 -0.01 0.00 -1.56 0.00 0.00 34.95 32.94 2ddc s ARG 13 CO -0.00 -0.36 -0.18 1.41 -0.81 0.00 0.00 175.30 175.37 2ddc s MET 14 N 2.34 2.98 -0.01 5.12 -2.45 0.15 -1.17 119.30 126.26 2ddc s MET 14 Ca 0.03 -0.77 0.03 0.00 -1.25 0.00 0.00 55.69 53.74 2ddc s MET 14 Cb -0.13 -2.43 -0.01 0.00 1.25 0.00 0.00 34.83 33.52 2ddc s MET 14 CO -0.08 0.32 -0.12 -2.00 1.05 0.00 0.00 175.02 174.20 2ddc s GLU 15 N 0.03 1.02 0.00 4.11 2.12 -0.66 -0.19 118.70 125.14 2ddc s GLU 15 Ca -0.06 -0.42 0.00 0.00 0.36 0.00 0.00 54.97 54.85 2ddc s GLU 15 Cb -0.15 -0.97 0.00 0.00 0.26 0.00 0.00 34.13 33.27 2ddc s GLU 15 CO 0.05 0.23 0.00 0.41 -0.54 0.00 0.00 175.26 175.41 2ddc n GLY 16 N 2.91 0.86 3.51 -1.50 0.00 -0.70 -1.83 105.19 108.44 2ddc n GLY 16 Ca -0.15 -0.69 -0.15 0.00 0.00 0.00 0.00 46.02 45.03 2ddc n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ddc s ALA 17 N -1.00 -1.56 -0.11 4.61 0.00 -0.35 -1.30 121.76 122.05 2ddc s ALA 17 Ca 0.00 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.49 2ddc s ALA 17 Cb 0.00 -0.65 0.02 0.00 0.00 0.00 0.00 23.12 22.50 2ddc s ALA 17 CO 0.00 -0.32 -0.09 0.08 0.00 0.00 0.00 175.76 175.43 2ddc s VAL 18 N -0.24 1.13 -1.44 0.00 1.01 -0.74 -0.91 120.40 119.20 2ddc s VAL 18 Ca -0.04 -0.38 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 2ddc s VAL 18 Cb -0.03 -1.11 0.08 0.00 0.00 0.00 0.00 36.38 35.32 2ddc s VAL 18 CO 0.04 0.38 0.70 0.59 0.00 0.00 0.00 175.10 176.80 2ddc n ASN 19 N 4.70 -4.27 0.00 3.32 4.13 0.95 -1.06 115.26 123.03 2ddc n ASN 19 Ca -0.15 -0.58 0.00 0.00 1.68 0.00 0.00 54.58 55.53 2ddc n ASN 19 Cb 0.50 -3.47 0.00 0.00 -1.54 0.00 0.00 39.78 35.27 2ddc n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ddc n GLY 20 N -1.40 1.72 3.57 7.41 0.00 -1.26 -5.01 105.19 110.22 2ddc n GLY 20 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2ddc n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2ddc s HIS 21 N -2.97 3.03 0.47 1.61 5.04 -0.22 -5.02 115.29 117.23 2ddc s HIS 21 Ca 0.00 0.46 -0.20 0.00 -1.54 0.00 0.00 55.06 53.78 2ddc s HIS 21 Cb 0.00 -3.64 -0.09 0.00 0.04 0.00 0.00 32.58 28.89 2ddc s HIS 21 CO 0.00 -0.89 0.99 0.15 -2.34 0.00 0.00 174.74 172.65 2ddc s LYS 22 N 3.36 3.99 0.10 2.88 1.02 -1.26 -1.80 119.74 128.03 2ddc s LYS 22 Ca 0.33 1.18 -0.25 0.00 0.02 0.00 0.00 55.97 57.26 2ddc s LYS 22 Cb -0.12 -2.14 0.08 0.00 -0.52 0.00 0.00 37.83 35.13 2ddc s LYS 22 CO 0.21 -0.25 0.68 -0.59 -0.92 0.00 0.00 175.35 174.48 2ddc s PHE 23 N -2.20 -0.49 -0.03 3.18 -0.12 -0.42 -4.22 117.98 113.68 2ddc s PHE 23 Ca 0.63 0.34 0.00 0.00 -0.05 0.00 0.00 56.93 57.86 2ddc s PHE 23 Cb -0.12 0.55 0.03 0.00 -0.63 0.00 0.00 43.02 42.84 2ddc s PHE 23 CO 0.19 -0.75 -0.00 0.08 -0.05 0.00 0.00 175.22 174.69 2ddc s VAL 24 N -3.42 0.17 -0.04 -2.49 1.01 -0.67 -1.71 120.40 113.24 2ddc s VAL 24 Ca 0.01 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.09 2ddc s VAL 24 Cb -0.01 -0.26 0.01 0.00 0.00 0.00 0.00 36.38 36.12 2ddc s VAL 24 CO -0.11 0.14 -0.11 -0.63 0.00 0.00 0.00 175.10 174.39 2ddc s ILE 25 N 0.95 0.96 0.28 2.22 1.01 0.74 -1.22 121.20 126.13 2ddc s ILE 25 Ca -0.10 -0.42 0.09 0.00 0.00 0.00 0.00 60.65 60.22 2ddc s ILE 25 Cb -0.13 -0.87 -0.06 0.00 0.01 0.00 0.00 42.46 41.42 2ddc s ILE 25 CO -0.02 0.30 -0.12 0.42 0.00 0.00 0.00 174.94 175.53 2ddc s THR 26 N 0.42 1.99 -0.05 2.92 -4.23 -0.66 0.34 115.64 116.38 2ddc s THR 26 Ca -0.08 -2.22 -0.31 0.00 -1.18 0.00 0.00 61.69 57.89 2ddc s THR 26 Cb -0.12 -2.38 0.12 0.00 1.34 0.00 0.00 72.50 71.45 2ddc s THR 26 CO 0.02 -0.36 1.24 -0.83 -0.54 0.00 0.00 174.62 174.15 2ddc s GLY 27 N -3.47 -0.37 0.04 3.99 0.00 -0.65 -0.58 107.32 106.27 2ddc s GLY 27 Ca 0.29 0.88 0.00 0.00 0.00 0.00 0.00 44.72 45.90 2ddc s GLY 27 CO 0.13 0.22 -0.04 0.54 0.00 0.00 0.00 173.10 173.94 2ddc s LYS 28 N -2.49 0.48 0.00 2.90 1.02 -0.79 -1.35 119.74 119.51 2ddc s LYS 28 Ca 0.13 -0.87 0.00 0.00 0.02 0.00 0.00 55.97 55.24 2ddc s LYS 28 Cb 0.03 0.03 0.00 0.00 -0.52 0.00 0.00 37.83 37.37 2ddc s LYS 28 CO -0.04 -0.04 0.00 0.41 -0.92 0.00 0.00 175.35 174.76 2ddc n GLY 29 N 1.01 1.86 3.34 -3.33 0.00 0.02 -0.52 105.19 107.58 2ddc n GLY 29 Ca -0.20 -0.81 -0.11 0.00 0.00 0.00 0.00 46.02 44.89 2ddc n GLY 29 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ddc s SER 30 N 0.57 -0.32 0.22 1.61 1.04 -0.69 -0.52 113.70 115.61 2ddc s SER 30 Ca 0.00 -0.18 -0.14 0.00 0.48 0.00 0.00 55.95 56.11 2ddc s SER 30 Cb 0.00 0.49 0.01 0.00 0.10 0.00 0.00 66.02 66.62 2ddc s SER 30 CO 0.00 -0.84 0.47 -0.83 0.98 0.00 0.00 173.24 173.02 2ddc s GLY 31 N -2.64 0.31 -0.45 7.32 0.00 -0.01 -0.71 107.32 111.14 2ddc s GLY 31 Ca 0.01 -0.66 0.04 0.00 0.00 0.00 0.00 44.72 44.11 2ddc s GLY 31 CO -0.10 -0.53 0.18 1.20 0.00 0.00 0.00 173.10 173.85 2ddc s GLN 32 N -3.96 1.80 0.27 2.90 -0.21 0.54 -1.93 119.66 119.06 2ddc s GLN 32 Ca 0.17 -2.35 0.01 0.00 0.02 0.00 0.00 55.36 53.21 2ddc s GLN 32 Cb -0.00 -3.28 0.63 0.00 1.00 0.00 0.00 33.01 31.35 2ddc s GLN 32 CO 0.04 -1.05 1.72 -1.35 -2.12 0.00 0.00 175.29 172.53 2ddc h PRO 33 N 6.91 0.46 0.00 2.91 0.11 -1.79 -0.12 132.00 140.48 2ddc h PRO 33 Ca -0.07 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 2ddc h PRO 33 Cb 0.94 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 2ddc h PRO 33 CO 0.63 0.30 -0.05 0.74 -0.21 0.00 0.00 178.00 179.41 2ddc h PHE 34 N 0.47 0.00 0.00 0.65 0.05 -1.85 -3.09 116.94 113.17 2ddc h PHE 34 Ca 0.51 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.30 2ddc h PHE 34 Cb 0.87 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.82 2ddc h PHE 34 CO -0.13 0.05 -1.00 0.39 -0.18 0.00 0.00 178.31 177.44 2ddc n GLU 35 N -3.13 0.04 -2.26 1.51 -0.58 -0.66 -4.54 120.64 111.03 2ddc n GLU 35 Ca 0.02 -0.01 -0.10 0.00 -0.42 0.00 0.00 57.16 56.66 2ddc n GLU 35 Cb 0.45 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 29.81 2ddc n GLU 35 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ddc n GLY 36 N 1.48 0.01 3.28 0.62 0.00 -0.15 -4.50 105.19 105.94 2ddc n GLY 36 Ca 0.04 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.37 2ddc n GLY 36 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ddc s ILE 37 N -2.54 1.62 0.11 -0.61 -4.36 -1.11 -0.21 121.20 114.10 2ddc s ILE 37 Ca 0.03 -1.62 -0.21 0.00 -0.26 0.00 0.00 60.65 58.58 2ddc s ILE 37 Cb -0.01 -1.56 0.06 0.00 1.25 0.00 0.00 42.46 42.20 2ddc s ILE 37 CO 0.03 -0.18 0.53 0.00 0.24 0.00 0.00 174.94 175.56 2ddc s GLN 38 N -2.18 1.14 0.01 0.37 -2.07 -0.59 -0.34 119.66 115.99 2ddc s GLN 38 Ca 0.08 -0.43 0.04 0.00 -1.82 0.00 0.00 55.36 53.24 2ddc s GLN 38 Cb -0.08 0.52 -0.01 0.00 -1.09 0.00 0.00 33.01 32.34 2ddc s GLN 38 CO 0.04 -0.46 -0.14 -0.80 -1.32 0.00 0.00 175.29 172.62 2ddc s ASN 39 N -2.45 1.65 -0.06 12.60 0.02 0.12 -1.78 114.94 125.04 2ddc s ASN 39 Ca -0.01 -0.32 -0.02 0.00 -1.02 0.00 0.00 52.86 51.48 2ddc s ASN 39 Cb -0.00 -0.16 0.04 0.00 0.02 0.00 0.00 41.25 41.15 2ddc s ASN 39 CO -0.08 0.12 0.13 -0.69 0.02 0.00 0.00 177.10 176.60 2ddc s VAL 40 N -0.51 -0.05 -0.25 1.60 1.01 -0.76 -1.70 120.40 119.74 2ddc s VAL 40 Ca 0.04 0.18 -0.07 0.00 0.00 0.00 0.00 61.98 62.13 2ddc s VAL 40 Cb -0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 2ddc s VAL 40 CO 0.00 0.07 0.05 -1.81 0.00 0.00 0.00 175.10 173.42 2ddc s ASP 41 N 1.09 4.98 0.16 3.32 1.01 0.33 -0.48 116.67 127.08 2ddc s ASP 41 Ca -0.09 -0.32 0.07 0.00 0.71 0.00 0.00 52.55 52.93 2ddc s ASP 41 Cb -0.11 -1.88 -0.04 0.00 1.01 0.00 0.00 42.92 41.89 2ddc s ASP 41 CO -0.05 -0.06 -0.03 -0.76 0.21 0.00 0.00 175.17 174.48 2ddc s LEU 42 N 1.57 3.23 -0.03 1.23 1.43 0.11 -1.89 118.68 124.34 2ddc s LEU 42 Ca 0.06 -0.40 -0.00 0.00 -1.03 0.00 0.00 54.13 52.75 2ddc s LEU 42 Cb -0.15 -1.92 0.03 0.00 0.03 0.00 0.00 46.19 44.18 2ddc s LEU 42 CO 0.02 0.11 0.01 -0.89 0.23 0.00 0.00 176.35 175.84 2ddc s THR 43 N -1.62 0.13 -0.36 5.49 2.01 0.26 -1.75 115.64 119.79 2ddc s THR 43 Ca 0.26 0.16 -0.27 0.00 0.31 0.00 0.00 61.69 62.15 2ddc s THR 43 Cb -0.10 -0.26 0.02 0.00 0.01 0.00 0.00 72.50 72.17 2ddc s THR 43 CO 0.17 0.15 0.99 -0.69 -0.69 0.00 0.00 174.62 174.56 2ddc s VAL 44 N 1.30 4.53 -0.69 3.82 1.01 0.29 -1.65 120.40 129.01 2ddc s VAL 44 Ca -0.06 1.36 0.19 0.00 0.00 0.00 0.00 61.98 63.47 2ddc s VAL 44 Cb -0.13 -4.38 -0.24 0.00 0.00 0.00 0.00 36.38 31.63 2ddc s VAL 44 CO -0.02 -0.56 0.72 2.30 0.00 0.00 0.00 175.10 177.54 2ddc n ILE 45 N 6.03 0.00 -3.77 2.22 -5.35 -0.35 -4.84 119.36 113.29 2ddc n ILE 45 Ca 0.09 -0.15 -0.13 0.00 -0.27 0.00 0.00 62.75 62.29 2ddc n ILE 45 Cb 0.48 0.76 -0.11 0.00 -1.74 0.00 0.00 39.64 39.02 2ddc n ILE 45 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2ddc s GLU 46 N -2.97 0.32 0.00 6.28 2.02 -1.08 -4.91 118.70 118.37 2ddc s GLU 46 Ca 0.04 0.41 0.00 0.00 0.02 0.00 0.00 54.97 55.43 2ddc s GLU 46 Cb 0.14 0.14 0.00 0.00 0.10 0.00 0.00 34.13 34.51 2ddc s GLU 46 CO 0.80 -0.05 0.00 0.41 0.02 0.00 0.00 175.26 176.45 2ddc n GLY 47 N 3.02 0.79 3.83 -1.39 0.00 -1.26 -1.67 105.19 108.50 2ddc n GLY 47 Ca -0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 2ddc n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ddc s GLY 48 N -1.65 2.35 0.15 -0.02 0.00 -1.26 -3.70 107.32 103.19 2ddc s GLY 48 Ca 0.00 0.28 -0.30 0.00 0.00 0.00 0.00 44.72 44.70 2ddc s GLY 48 CO 0.00 0.54 0.99 2.56 0.00 0.00 0.00 173.10 177.20 2ddc s PRO 49 N -3.18 4.70 0.28 2.90 0.04 -1.26 -5.11 135.00 133.37 2ddc s PRO 49 Ca 0.60 1.52 -0.30 0.00 0.04 0.00 0.00 61.00 62.86 2ddc s PRO 49 Cb -0.09 -3.34 -0.11 0.00 0.04 0.00 0.00 34.50 31.00 2ddc s PRO 49 CO 0.15 0.22 1.56 -0.51 0.04 0.00 0.00 177.00 178.46 2ddc s LEU 50 N -0.26 4.36 0.00 -3.56 1.43 -1.24 -4.90 118.68 114.50 2ddc s LEU 50 Ca 0.47 2.87 0.29 0.00 -1.03 0.00 0.00 54.13 56.72 2ddc s LEU 50 Cb -0.25 -3.63 1.24 0.00 0.03 0.00 0.00 46.19 43.58 2ddc s LEU 50 CO 0.31 -0.86 1.87 -0.81 0.23 0.00 0.00 176.35 177.10 2ddc n PRO 51 N 2.32 0.59 -4.50 1.29 -0.04 -1.26 -4.89 135.00 128.50 2ddc n PRO 51 Ca 0.08 -0.18 -0.25 0.00 -0.04 0.00 0.00 63.50 63.11 2ddc n PRO 51 Cb 0.38 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.24 2ddc n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2ddc s PHE 52 N -2.54 2.40 0.08 0.54 -0.12 -1.26 -4.65 117.98 112.43 2ddc s PHE 52 Ca 0.27 -0.45 -0.30 0.00 -0.05 0.00 0.00 56.93 56.40 2ddc s PHE 52 Cb 0.20 -1.32 -0.09 0.00 -0.63 0.00 0.00 43.02 41.18 2ddc s PHE 52 CO 0.49 0.60 1.88 0.00 -0.05 0.00 0.00 175.22 178.13 2ddc s ALA 53 N -2.57 3.67 0.52 1.99 0.00 0.21 -4.87 121.76 120.71 2ddc s ALA 53 Ca 0.32 1.36 0.16 0.00 0.00 0.00 0.00 51.96 53.81 2ddc s ALA 53 Cb 0.01 -3.80 1.27 0.00 0.00 0.00 0.00 23.12 20.60 2ddc s ALA 53 CO 0.17 -1.39 2.15 0.35 0.00 0.00 0.00 175.76 177.03 2ddc h PHE 54 N 9.54 0.00 -0.97 0.00 3.57 -1.95 -2.78 116.94 124.36 2ddc h PHE 54 Ca -0.47 0.00 0.26 0.00 3.53 0.00 0.00 57.97 61.29 2ddc h PHE 54 Cb 1.22 -0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.91 2ddc h PHE 54 CO 0.87 0.00 0.67 -0.44 -2.23 0.00 0.00 178.31 177.18 2ddc h ASP 55 N 0.00 0.20 0.59 0.41 3.32 -1.96 -0.37 116.42 118.61 2ddc h ASP 55 Ca 0.01 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2ddc h ASP 55 Cb 0.03 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2ddc h ASP 55 CO -0.00 0.06 0.00 0.16 -1.72 0.00 0.00 179.24 177.74 2ddc h ILE 56 N 0.19 0.00 0.00 0.35 3.07 -1.89 -3.15 117.51 116.07 2ddc h ILE 56 Ca 0.49 -0.27 -0.31 0.00 1.55 0.00 0.00 64.86 66.32 2ddc h ILE 56 Cb 1.61 1.16 -0.06 0.00 -0.27 0.00 0.00 36.82 39.26 2ddc h ILE 56 CO -0.11 0.00 -1.90 0.18 -1.05 0.00 0.00 178.15 175.27 2ddc n LEU 57 N -2.83 0.64 -0.33 0.16 4.77 -0.15 -4.64 117.00 114.61 2ddc n LEU 57 Ca -0.00 0.30 0.24 0.00 -0.03 0.00 0.00 56.01 56.52 2ddc n LEU 57 Cb 0.20 0.26 0.48 0.00 -2.33 0.00 0.00 43.42 42.02 2ddc n LEU 57 CO 0.22 0.42 1.10 0.71 -1.33 0.00 0.00 177.39 178.51 2ddc h THR 58 N 0.00 0.27 0.00 -5.08 1.35 -1.55 -0.91 112.91 106.99 2ddc h THR 58 Ca -0.36 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 2ddc h THR 58 Cb 2.08 -0.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 2ddc h THR 58 CO 0.07 0.05 0.00 0.35 -0.25 0.00 0.00 175.52 175.74 2ddc n THR 59 N -5.08 0.00 0.94 6.82 -2.24 -1.26 -3.39 114.28 110.07 2ddc n THR 59 Ca 0.32 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.20 2ddc n THR 59 Cb 1.00 -0.36 0.02 0.00 -2.10 0.00 0.00 70.33 68.89 2ddc n THR 59 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ddc n ALA 60 N -0.85 3.21 1.65 6.98 0.00 -0.35 -4.83 120.51 126.33 2ddc n ALA 60 Ca 0.16 -0.64 0.15 0.00 0.00 0.00 0.00 53.44 53.12 2ddc n ALA 60 Cb 0.08 -0.75 0.79 0.00 0.00 0.00 0.00 19.45 19.57 2ddc n ALA 60 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2ddc n PHE 61 N 0.31 0.00 0.00 0.00 3.01 -1.22 -4.94 117.46 114.62 2ddc n PHE 61 Ca 0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.56 2ddc n PHE 61 Cb 0.47 -0.14 0.00 0.00 -0.01 0.00 0.00 39.48 39.80 2ddc n PHE 61 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2ddc n ASN 65 N -1.03 0.00 0.00 4.37 2.85 -1.26 -5.02 115.26 115.17 2ddc n ASN 65 Ca 0.18 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.69 2ddc n ASN 65 Cb 0.20 0.00 0.24 0.00 1.24 0.00 0.00 39.78 41.46 2ddc n ASN 65 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 2ddc n ARG 66 N 0.00 0.48 0.24 1.20 3.00 -1.26 -1.95 116.66 118.37 2ddc n ARG 66 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.85 57.98 2ddc n ARG 66 Cb 0.00 -1.26 0.44 0.00 0.00 0.00 0.00 32.46 31.64 2ddc n ARG 66 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.63 177.39 2ddc h VAL 67 N 0.00 0.22 -1.79 5.15 3.04 -1.96 -3.29 116.25 117.62 2ddc h VAL 67 Ca 0.00 -0.94 -0.77 0.00 -1.01 0.00 0.00 66.70 63.97 2ddc h VAL 67 Cb 0.00 1.78 -0.19 0.00 -2.01 0.00 0.00 31.29 30.87 2ddc h VAL 67 CO 0.00 0.10 1.70 0.49 -1.01 0.00 0.00 177.57 178.85 2ddc n PHE 68 N -3.19 2.71 -3.76 3.17 3.01 -0.82 -4.65 117.46 113.93 2ddc n PHE 68 Ca 0.01 -2.72 -0.13 0.00 1.01 0.00 0.00 57.45 55.63 2ddc n PHE 68 Cb 0.43 -1.74 -0.13 0.00 -0.01 0.00 0.00 39.48 38.03 2ddc n PHE 68 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2ddc s VAL 69 N -0.63 -0.03 -0.53 -4.37 1.01 -1.24 -4.36 120.40 110.25 2ddc s VAL 69 Ca 0.38 0.11 -0.28 0.00 0.00 0.00 0.00 61.98 62.19 2ddc s VAL 69 Cb 0.09 -0.31 0.03 0.00 0.00 0.00 0.00 36.38 36.19 2ddc s VAL 69 CO 0.03 0.05 1.12 -0.75 0.00 0.00 0.00 175.10 175.54 2ddc s LYS 70 N 0.89 3.58 -0.16 2.72 2.20 -0.63 -4.50 119.74 123.83 2ddc s LYS 70 Ca -0.06 0.31 -0.11 0.00 -0.36 0.00 0.00 55.97 55.74 2ddc s LYS 70 Cb -0.08 -3.97 -0.05 0.00 -1.51 0.00 0.00 37.83 32.22 2ddc s LYS 70 CO -0.05 -1.50 0.21 0.71 -0.36 0.00 0.00 175.35 174.36 2ddc s TYR 71 N 4.54 3.47 0.67 4.03 1.51 -1.26 -1.11 117.35 129.20 2ddc s TYR 71 Ca 0.43 0.49 -0.13 0.00 -1.01 0.00 0.00 57.07 56.85 2ddc s TYR 71 Cb -0.08 -2.21 -0.00 0.00 -0.11 0.00 0.00 41.96 39.56 2ddc s TYR 71 CO 0.27 0.34 1.07 -1.25 -1.11 0.00 0.00 175.55 174.88 2ddc s PRO 72 N 0.15 2.93 0.50 -1.71 0.04 -1.26 -4.92 135.00 130.73 2ddc s PRO 72 Ca 0.13 1.15 0.19 0.00 0.04 0.00 0.00 61.00 62.51 2ddc s PRO 72 Cb -0.12 -1.98 1.24 0.00 0.04 0.00 0.00 34.50 33.68 2ddc s PRO 72 CO 0.02 -1.12 2.04 1.05 0.04 0.00 0.00 177.00 179.03 2ddc h GLU 73 N -0.26 0.13 0.00 4.56 4.11 -2.00 -2.38 114.58 118.74 2ddc h GLU 73 Ca -0.45 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2ddc h GLU 73 Cb 1.22 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2ddc h GLU 73 CO 0.56 0.08 0.00 0.39 0.07 0.00 0.00 179.01 180.11 2ddc n GLU 74 N -4.45 0.17 -4.72 1.06 4.71 -1.26 -4.73 120.64 111.41 2ddc n GLU 74 Ca 0.06 0.32 -0.33 0.00 -0.01 0.00 0.00 57.16 57.19 2ddc n GLU 74 Cb 0.37 -1.78 -0.14 0.00 -1.01 0.00 0.00 31.44 28.88 2ddc n GLU 74 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2ddc s ILE 75 N -3.20 3.21 0.21 -3.67 1.01 -0.90 -5.07 121.20 112.80 2ddc s ILE 75 Ca 0.07 -0.61 -0.31 0.00 0.00 0.00 0.00 60.65 59.80 2ddc s ILE 75 Cb 0.11 -2.35 -0.10 0.00 0.01 0.00 0.00 42.46 40.12 2ddc s ILE 75 CO 0.43 0.53 1.55 -0.69 0.00 0.00 0.00 174.94 176.76 2ddc s VAL 76 N 0.20 2.51 -0.65 2.92 1.01 -1.26 -4.68 120.40 120.44 2ddc s VAL 76 Ca -0.07 0.39 -0.15 0.00 0.00 0.00 0.00 61.98 62.15 2ddc s VAL 76 Cb -0.15 -3.25 0.16 0.00 0.00 0.00 0.00 36.38 33.15 2ddc s VAL 76 CO 0.05 0.04 0.60 -0.62 0.00 0.00 0.00 175.10 175.17 2ddc s ASP 77 N 0.84 6.38 0.30 3.32 -1.08 -1.26 -4.65 116.67 120.51 2ddc s ASP 77 Ca 0.66 -2.16 0.00 0.00 -0.52 0.00 0.00 52.55 50.53 2ddc s ASP 77 Cb -0.44 -2.20 0.51 0.00 -1.46 0.00 0.00 42.92 39.33 2ddc s ASP 77 CO 0.37 -0.73 1.90 0.22 0.52 0.00 0.00 175.17 177.45 2ddc h TYR 78 N 8.41 1.08 -0.00 -5.34 3.20 -1.93 -3.09 116.97 119.29 2ddc h TYR 78 Ca -0.13 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.73 2ddc h TYR 78 Cb 1.07 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.99 2ddc h TYR 78 CO 0.85 0.55 -0.14 0.74 -1.64 0.00 0.00 178.16 178.52 2ddc h PHE 79 N 1.05 0.14 0.00 -3.82 -1.00 -1.91 -3.20 116.94 108.20 2ddc h PHE 79 Ca 0.40 -0.08 -0.04 0.00 2.81 0.00 0.00 57.97 61.07 2ddc h PHE 79 Cb 0.21 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.75 2ddc h PHE 79 CO -0.00 0.88 -0.17 0.87 -1.61 0.00 0.00 178.31 178.27 2ddc h LYS 80 N -0.63 0.00 -0.06 1.51 1.57 -1.90 -2.28 116.57 114.78 2ddc h LYS 80 Ca -0.02 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 2ddc h LYS 80 Cb 0.92 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 2ddc h LYS 80 CO 0.03 0.17 -0.43 1.96 -0.57 0.00 0.00 179.45 180.61 2ddc h GLN 81 N 0.00 0.14 0.00 3.15 4.20 -1.62 -3.25 115.11 117.73 2ddc h GLN 81 Ca -0.00 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2ddc h GLN 81 Cb 0.37 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 2ddc h GLN 81 CO 0.02 0.55 0.00 0.66 -0.67 0.00 0.00 178.83 179.40 2ddc h SER 82 N 0.12 0.00 -3.48 1.46 4.64 -1.40 -3.45 113.55 111.43 2ddc h SER 82 Ca 0.01 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.86 2ddc h SER 82 Cb 0.82 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.96 2ddc h SER 82 CO 0.06 0.00 0.13 -0.36 -0.87 0.00 0.00 176.83 175.79 2ddc s PHE 83 N -3.75 3.21 -0.40 4.77 0.40 -1.23 0.17 117.98 121.15 2ddc s PHE 83 Ca -0.00 0.54 0.25 0.00 -0.60 0.00 0.00 56.93 57.12 2ddc s PHE 83 Cb 0.10 -2.71 1.03 0.00 0.51 0.00 0.00 43.02 41.95 2ddc s PHE 83 CO 0.47 -0.80 1.75 -1.00 0.70 0.00 0.00 175.22 176.33 2ddc h PRO 84 N -0.11 0.00 -0.01 0.24 0.13 -1.91 -3.43 132.00 126.92 2ddc h PRO 84 Ca -0.45 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.69 2ddc h PRO 84 Cb 1.26 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 2ddc h PRO 84 CO 0.60 0.00 -0.06 0.93 -0.23 0.00 0.00 178.00 179.23 2ddc h GLU 85 N 0.00 -0.10 0.00 0.86 3.07 -1.92 -3.14 114.58 113.34 2ddc h GLU 85 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2ddc h GLU 85 Cb 0.38 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 2ddc h GLU 85 CO 0.00 -0.07 0.00 0.41 -1.40 0.00 0.00 179.01 177.95 2ddc n GLY 86 N -1.18 -1.70 3.72 -3.84 0.00 0.13 -4.50 105.19 97.82 2ddc n GLY 86 Ca -0.06 -2.04 -0.09 0.00 0.00 0.00 0.00 46.02 43.84 2ddc n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ddc s TYR 87 N 0.00 0.15 0.20 1.61 1.13 -1.06 -1.18 117.35 118.20 2ddc s TYR 87 Ca 0.00 -0.59 0.04 0.00 -1.41 0.00 0.00 57.07 55.11 2ddc s TYR 87 Cb 0.00 0.48 -0.05 0.00 -1.10 0.00 0.00 41.96 41.29 2ddc s TYR 87 CO 0.00 -1.19 -0.03 -1.54 -2.51 0.00 0.00 175.55 170.28 2ddc s SER 88 N -3.00 1.77 0.03 -0.18 1.04 -0.60 -1.28 113.70 111.48 2ddc s SER 88 Ca 0.17 -1.16 -0.02 0.00 0.48 0.00 0.00 55.95 55.43 2ddc s SER 88 Cb -0.03 0.01 -0.02 0.00 0.10 0.00 0.00 66.02 66.08 2ddc s SER 88 CO 0.09 -0.46 0.01 -1.66 0.98 0.00 0.00 173.24 172.20 2ddc s TRP 89 N -3.41 0.31 -0.00 5.02 1.48 -0.19 -0.51 118.94 121.64 2ddc s TRP 89 Ca 0.25 -0.65 0.06 0.00 -1.06 0.00 0.00 56.10 54.69 2ddc s TRP 89 Cb 0.05 -0.23 -0.02 0.00 -1.16 0.00 0.00 33.47 32.12 2ddc s TRP 89 CO 0.06 -0.29 -0.18 -1.21 -4.06 0.00 0.00 176.95 171.28 2ddc s GLU 90 N -2.39 1.41 -0.13 3.25 2.02 -0.39 -1.56 118.70 120.91 2ddc s GLU 90 Ca -0.07 -0.68 -0.12 0.00 0.02 0.00 0.00 54.97 54.13 2ddc s GLU 90 Cb -0.03 -1.38 0.03 0.00 0.10 0.00 0.00 34.13 32.85 2ddc s GLU 90 CO -0.04 0.37 0.34 0.50 0.02 0.00 0.00 175.26 176.45 2ddc s ARG 91 N -0.54 0.39 -0.06 1.61 3.52 0.12 -0.70 118.95 123.27 2ddc s ARG 91 Ca 0.07 0.47 0.03 0.00 -0.13 0.00 0.00 55.73 56.17 2ddc s ARG 91 Cb -0.07 0.18 -0.02 0.00 -1.56 0.00 0.00 34.95 33.48 2ddc s ARG 91 CO -0.00 -0.05 -0.14 -1.54 -0.81 0.00 0.00 175.30 172.76 2ddc s SER 92 N 0.21 4.04 -0.30 -2.12 1.04 -0.35 -1.24 113.70 114.98 2ddc s SER 92 Ca -0.00 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2ddc s SER 92 Cb -0.03 -0.99 0.09 0.00 0.10 0.00 0.00 66.02 65.19 2ddc s SER 92 CO 0.00 0.31 0.06 -0.04 0.98 0.00 0.00 173.24 174.56 2ddc s MET 93 N -0.54 1.00 -0.38 4.02 -1.94 0.71 -1.28 119.30 120.90 2ddc s MET 93 Ca 0.07 -1.22 -0.15 0.00 -1.71 0.00 0.00 55.69 52.69 2ddc s MET 93 Cb -0.12 -2.36 0.00 0.00 2.01 0.00 0.00 34.83 34.37 2ddc s MET 93 CO 0.01 -0.91 0.30 0.45 -0.01 0.00 0.00 175.02 174.87 2ddc s SER 94 N 1.43 6.11 0.34 3.03 0.15 -0.47 -1.23 113.70 123.06 2ddc s SER 94 Ca 0.07 -0.64 -0.16 0.00 0.70 0.00 0.00 55.95 55.93 2ddc s SER 94 Cb -0.18 -2.16 -0.09 0.00 -1.71 0.00 0.00 66.02 61.88 2ddc s SER 94 CO -0.18 -0.38 0.76 -0.31 1.20 0.00 0.00 173.24 174.33 2ddc s TYR 95 N 1.79 3.37 -0.16 3.44 1.51 0.13 -0.92 117.35 126.51 2ddc s TYR 95 Ca 0.07 1.26 0.25 0.00 -1.01 0.00 0.00 57.07 57.63 2ddc s TYR 95 Cb -0.18 -2.57 1.27 0.00 -0.11 0.00 0.00 41.96 40.37 2ddc s TYR 95 CO 0.11 0.07 1.75 1.05 -1.11 0.00 0.00 175.55 177.42 2ddc h GLU 96 N 2.19 0.00 -0.66 -0.62 4.11 -1.47 -2.19 114.58 115.94 2ddc h GLU 96 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2ddc h GLU 96 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2ddc h GLU 96 CO 0.65 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.33 2ddc n ASP 97 N -2.36 4.38 0.00 3.06 5.75 -1.26 -4.93 116.55 121.18 2ddc n ASP 97 Ca -0.01 -2.27 0.00 0.00 -0.01 0.00 0.00 54.79 52.50 2ddc n ASP 97 Cb 0.09 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 39.65 2ddc n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ddc n GLY 98 N 1.27 3.17 3.76 6.12 0.00 -0.82 -4.81 105.19 113.87 2ddc n GLY 98 Ca 0.25 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.88 2ddc n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ddc s GLY 99 N -2.85 2.89 -0.10 -0.02 0.00 -1.21 -4.77 107.32 101.26 2ddc s GLY 99 Ca 0.00 1.26 -0.12 0.00 0.00 0.00 0.00 44.72 45.86 2ddc s GLY 99 CO 0.00 1.82 0.33 -1.50 0.00 0.00 0.00 173.10 173.74 2ddc s ILE 100 N -1.31 0.01 0.04 0.90 2.07 -0.73 -0.69 121.20 121.49 2ddc s ILE 100 Ca 0.63 -0.09 0.04 0.00 -1.41 0.00 0.00 60.65 59.82 2ddc s ILE 100 Cb -0.38 -0.49 -0.02 0.00 0.13 0.00 0.00 42.46 41.69 2ddc s ILE 100 CO 0.48 -0.05 -0.12 0.00 -1.91 0.00 0.00 174.94 173.34 2ddc s LEU 102 N -1.12 2.11 0.04 0.00 1.43 0.11 -0.21 118.68 121.04 2ddc s LEU 102 Ca -0.00 -0.45 -0.10 0.00 -1.03 0.00 0.00 54.13 52.54 2ddc s LEU 102 Cb -0.08 -1.00 0.01 0.00 0.03 0.00 0.00 46.19 45.15 2ddc s LEU 102 CO 0.01 0.20 0.22 0.00 0.23 0.00 0.00 176.35 177.01 2ddc s ALA 103 N -0.65 -0.44 0.05 4.21 0.00 -0.38 -0.85 121.76 123.71 2ddc s ALA 103 Ca 0.08 -0.22 0.02 0.00 0.00 0.00 0.00 51.96 51.83 2ddc s ALA 103 Cb -0.08 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 2ddc s ALA 103 CO 0.01 -0.38 -0.07 0.95 0.00 0.00 0.00 175.76 176.27 2ddc s THR 104 N -2.60 0.49 -0.09 0.00 -4.23 -0.61 -0.71 115.64 107.89 2ddc s THR 104 Ca -0.05 -1.28 -0.04 0.00 -1.18 0.00 0.00 61.69 59.14 2ddc s THR 104 Cb -0.01 -0.84 0.05 0.00 1.34 0.00 0.00 72.50 73.04 2ddc s THR 104 CO -0.04 -0.54 0.20 0.21 -0.54 0.00 0.00 174.62 173.91 2ddc s ASN 105 N -1.95 0.10 -0.29 3.99 3.04 -0.60 -1.76 114.94 117.46 2ddc s ASN 105 Ca -0.05 0.43 -0.07 0.00 0.04 0.00 0.00 52.86 53.21 2ddc s ASN 105 Cb -0.06 0.37 0.00 0.00 -1.54 0.00 0.00 41.25 40.03 2ddc s ASN 105 CO -0.02 -0.19 0.08 0.21 -3.04 0.00 0.00 177.10 174.15 2ddc s ASN 106 N 1.66 5.15 -0.15 -4.21 2.47 -0.43 -1.02 114.94 118.41 2ddc s ASN 106 Ca -0.05 -0.64 -0.02 0.00 0.42 0.00 0.00 52.86 52.56 2ddc s ASN 106 Cb -0.11 -1.89 -0.02 0.00 -1.45 0.00 0.00 41.25 37.77 2ddc s ASN 106 CO -0.07 -0.18 -0.07 -0.63 -3.72 0.00 0.00 177.10 172.43 2ddc s ILE 107 N 1.52 3.56 0.12 -5.21 1.01 -0.41 -1.66 121.20 120.14 2ddc s ILE 107 Ca 0.03 -0.48 -0.02 0.00 0.00 0.00 0.00 60.65 60.18 2ddc s ILE 107 Cb -0.17 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.73 2ddc s ILE 107 CO 0.03 0.51 0.08 0.42 0.00 0.00 0.00 174.94 175.97 2ddc s THR 108 N 0.36 0.11 -0.03 2.92 -4.23 -0.81 -2.57 115.64 111.39 2ddc s THR 108 Ca -0.07 -1.83 -0.01 0.00 -1.18 0.00 0.00 61.69 58.61 2ddc s THR 108 Cb -0.15 -1.95 -0.04 0.00 1.34 0.00 0.00 72.50 71.70 2ddc s THR 108 CO 0.04 -0.51 0.04 -0.04 -0.54 0.00 0.00 174.62 173.62 2ddc s MET 109 N -4.02 2.99 0.47 3.99 -1.94 -1.19 -0.13 119.30 119.47 2ddc s MET 109 Ca 0.21 -0.48 -0.24 0.00 -1.71 0.00 0.00 55.69 53.48 2ddc s MET 109 Cb 0.07 -2.81 -0.07 0.00 2.01 0.00 0.00 34.83 34.03 2ddc s MET 109 CO 0.00 0.66 1.30 0.15 -0.01 0.00 0.00 175.02 177.12 2ddc s LYS 110 N -1.44 3.59 0.26 2.03 1.02 -0.68 -4.91 119.74 119.62 2ddc s LYS 110 Ca 0.19 2.11 -0.02 0.00 0.02 0.00 0.00 55.97 58.27 2ddc s LYS 110 Cb -0.12 -2.48 0.44 0.00 -0.52 0.00 0.00 37.83 35.15 2ddc s LYS 110 CO 0.09 -0.79 1.85 0.87 -0.92 0.00 0.00 175.35 176.45 2ddc h LYS 111 N 2.04 0.97 -7.21 1.68 1.57 -1.98 -3.43 116.57 110.23 2ddc h LYS 111 Ca -0.50 -0.06 -0.50 0.00 -1.87 0.00 0.00 60.65 57.72 2ddc h LYS 111 Cb 1.27 -0.22 0.08 0.00 0.08 0.00 0.00 32.23 33.43 2ddc h LYS 111 CO 0.60 0.65 0.38 0.16 -0.57 0.00 0.00 179.45 180.66 2ddc s ASP 112 N -5.75 5.56 0.00 0.86 1.47 -1.26 -4.90 116.67 112.65 2ddc s ASP 112 Ca -0.12 1.86 -0.03 0.00 1.18 0.00 0.00 52.55 55.44 2ddc s ASP 112 Cb 0.20 -2.54 -0.11 0.00 -0.34 0.00 0.00 42.92 40.13 2ddc s ASP 112 CO 0.80 -1.32 2.30 0.61 0.68 0.00 0.00 175.17 178.24 2ddc n GLY 113 N -0.91 2.32 0.32 2.12 0.00 -1.26 -4.16 105.19 103.63 2ddc n GLY 113 Ca 0.09 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.74 2ddc n GLY 113 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ddc n SER 114 N 2.16 1.11 -3.67 1.61 3.41 -1.26 -4.95 113.62 112.02 2ddc n SER 114 Ca 0.18 -1.15 -0.28 0.00 -0.26 0.00 0.00 58.87 57.36 2ddc n SER 114 Cb 0.57 0.03 0.04 0.00 -0.26 0.00 0.00 64.21 64.59 2ddc n SER 114 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2ddc n ASN 115 N -0.31 -4.28 -4.04 4.04 5.03 -1.26 -4.59 115.26 109.84 2ddc n ASN 115 Ca 0.17 -0.96 -0.23 0.00 0.87 0.00 0.00 54.58 54.43 2ddc n ASN 115 Cb 0.33 -3.62 -0.16 0.00 -1.02 0.00 0.00 39.78 35.30 2ddc n ASN 115 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2ddc s PHE 117 N 0.29 3.64 -0.12 0.00 0.08 0.04 -1.68 117.98 120.23 2ddc s PHE 117 Ca -0.07 0.87 -0.01 0.00 0.12 0.00 0.00 56.93 57.85 2ddc s PHE 117 Cb -0.12 -2.31 -0.02 0.00 -0.57 0.00 0.00 43.02 40.01 2ddc s PHE 117 CO 0.02 0.51 -0.11 0.08 -0.10 0.00 0.00 175.22 175.62 2ddc s VAL 118 N -0.54 3.30 -0.20 -0.44 1.01 0.81 -1.08 120.40 123.26 2ddc s VAL 118 Ca 0.22 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2ddc s VAL 118 Cb -0.15 -2.39 0.03 0.00 0.00 0.00 0.00 36.38 33.87 2ddc s VAL 118 CO 0.10 0.53 -0.16 0.20 0.00 0.00 0.00 175.10 175.77 2ddc s ASN 119 N 0.17 3.44 -0.40 3.32 0.01 0.00 -1.92 114.94 119.57 2ddc s ASN 119 Ca -0.06 -0.85 -0.13 0.00 -0.71 0.00 0.00 52.86 51.11 2ddc s ASN 119 Cb -0.15 -1.44 0.03 0.00 0.41 0.00 0.00 41.25 40.10 2ddc s ASN 119 CO 0.04 -0.07 0.27 -0.70 -1.51 0.00 0.00 177.10 175.13 2ddc s GLU 120 N 1.28 2.90 -0.07 -0.60 2.12 -0.66 -1.88 118.70 121.78 2ddc s GLU 120 Ca 0.01 -1.07 0.03 0.00 0.36 0.00 0.00 54.97 54.30 2ddc s GLU 120 Cb -0.15 -3.89 -0.02 0.00 0.26 0.00 0.00 34.13 30.34 2ddc s GLU 120 CO -0.10 -0.75 -0.17 0.42 -0.54 0.00 0.00 175.26 174.12 2ddc s ILE 121 N 1.62 2.74 -0.07 -3.70 1.01 -0.32 -1.31 121.20 121.18 2ddc s ILE 121 Ca 0.04 -0.82 0.05 0.00 0.00 0.00 0.00 60.65 59.92 2ddc s ILE 121 Cb -0.19 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.19 2ddc s ILE 121 CO 0.08 0.57 -0.22 -0.60 0.00 0.00 0.00 174.94 174.77 2ddc s ARG 122 N -0.28 2.65 -0.04 2.79 6.06 -0.73 -1.65 118.95 127.76 2ddc s ARG 122 Ca 0.01 -0.85 -0.00 0.00 -2.50 0.00 0.00 55.73 52.39 2ddc s ARG 122 Cb -0.13 -2.25 0.03 0.00 0.06 0.00 0.00 34.95 32.66 2ddc s ARG 122 CO 0.03 0.39 0.01 0.12 -2.50 0.00 0.00 175.30 173.35 2ddc s PHE 123 N -0.17 0.33 -0.02 5.12 2.19 -0.76 -1.57 117.98 123.10 2ddc s PHE 123 Ca -0.03 0.01 0.01 0.00 0.33 0.00 0.00 56.93 57.25 2ddc s PHE 123 Cb -0.14 -0.47 0.01 0.00 -1.31 0.00 0.00 43.02 41.12 2ddc s PHE 123 CO 0.04 -0.16 -0.02 -0.51 1.83 0.00 0.00 175.22 176.39 2ddc s ASP 124 N 1.29 0.42 0.01 6.13 1.01 -0.03 -1.21 116.67 124.28 2ddc s ASP 124 Ca -0.06 -0.05 0.01 0.00 0.71 0.00 0.00 52.55 53.16 2ddc s ASP 124 Cb -0.13 -0.14 -0.01 0.00 1.01 0.00 0.00 42.92 43.65 2ddc s ASP 124 CO -0.02 -0.02 -0.03 -0.83 0.21 0.00 0.00 175.17 174.47 2ddc s GLY 125 N 0.44 0.18 0.21 0.21 0.00 -0.09 0.06 107.32 108.33 2ddc s GLY 125 Ca -0.04 -0.26 -0.05 0.00 0.00 0.00 0.00 44.72 44.37 2ddc s GLY 125 CO -0.01 -0.26 0.25 -1.34 0.00 0.00 0.00 173.10 171.74 2ddc s VAL 126 N -0.43 0.01 -1.64 1.40 -7.23 -0.20 -0.04 120.40 112.28 2ddc s VAL 126 Ca -0.03 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 2ddc s VAL 126 Cb -0.03 -2.32 0.00 0.00 0.56 0.00 0.00 36.38 34.59 2ddc s VAL 126 CO -0.00 -0.06 0.00 0.59 -0.31 0.00 0.00 175.10 175.32 2ddc n ASN 127 N -0.29 -5.22 -4.65 4.85 5.03 -1.26 -1.77 115.26 111.95 2ddc n ASN 127 Ca -0.00 0.11 -0.42 0.00 0.87 0.00 0.00 54.58 55.13 2ddc n ASN 127 Cb 0.64 -4.29 -0.04 0.00 -1.02 0.00 0.00 39.78 35.07 2ddc n ASN 127 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2ddc s PHE 128 N -2.84 3.33 0.36 3.10 0.08 -1.26 -3.30 117.98 117.45 2ddc s PHE 128 Ca 0.00 1.19 -0.28 0.00 0.12 0.00 0.00 56.93 57.96 2ddc s PHE 128 Cb 0.00 -3.06 -0.12 0.00 -0.57 0.00 0.00 43.02 39.27 2ddc s PHE 128 CO 0.00 -0.38 1.37 -2.30 -0.10 0.00 0.00 175.22 173.81 2ddc n PRO 129 N 5.88 2.34 -0.02 0.24 -0.02 -1.26 -4.89 135.00 137.27 2ddc n PRO 129 Ca 0.06 0.82 0.07 0.00 -2.02 0.00 0.00 63.50 62.43 2ddc n PRO 129 Cb 0.48 -2.46 0.45 0.00 -0.02 0.00 0.00 33.50 31.95 2ddc n PRO 129 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ddc h ALA 130 N 2.70 1.81 -0.55 3.55 0.00 -1.98 -0.97 119.26 123.82 2ddc h ALA 130 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2ddc h ALA 130 Cb 1.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2ddc h ALA 130 CO 0.63 0.13 0.00 0.27 0.00 0.00 0.00 179.25 180.28 2ddc n ASN 131 N -4.48 3.02 -4.90 0.00 2.04 -1.26 -4.40 115.26 105.29 2ddc n ASN 131 Ca 0.05 -2.03 -0.29 0.00 -0.44 0.00 0.00 54.58 51.87 2ddc n ASN 131 Cb 0.16 -0.38 0.06 0.00 -2.53 0.00 0.00 39.78 37.09 2ddc n ASN 131 CO 0.00 0.00 0.00 -0.83 -0.44 0.00 0.00 177.26 175.99 2ddc s GLY 132 N -0.98 1.62 0.54 4.83 0.00 -0.37 -4.88 107.32 108.08 2ddc s GLY 132 Ca 0.37 -0.58 0.28 0.00 0.00 0.00 0.00 44.72 44.80 2ddc s GLY 132 CO 0.25 -0.17 2.12 -0.56 0.00 0.00 0.00 173.10 174.74 2ddc h PRO 133 N -0.74 0.00 0.04 2.90 0.13 -1.93 -1.47 132.00 130.93 2ddc h PRO 133 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2ddc h PRO 133 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2ddc h PRO 133 CO 0.64 0.09 -0.02 0.28 -0.23 0.00 0.00 178.00 178.76 2ddc h VAL 134 N 0.00 1.37 0.00 1.56 2.07 -1.93 0.70 116.25 120.01 2ddc h VAL 134 Ca -0.00 -1.67 -0.02 0.00 0.82 0.00 0.00 66.70 65.83 2ddc h VAL 134 Cb 0.24 2.42 -0.00 0.00 -1.52 0.00 0.00 31.29 32.43 2ddc h VAL 134 CO 0.01 0.40 -0.11 0.24 0.02 0.00 0.00 177.57 178.14 2ddc h MET 135 N -0.83 0.00 -0.02 1.57 2.86 -1.76 0.71 114.93 117.46 2ddc h MET 135 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2ddc h MET 135 Cb 0.69 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.35 2ddc h MET 135 CO 0.01 0.11 -0.11 1.04 1.06 0.00 0.00 176.91 179.02 2ddc n GLN 136 N -3.19 1.72 -3.68 1.72 1.13 -0.56 -4.70 117.38 109.82 2ddc n GLN 136 Ca 0.01 -1.25 -0.26 0.00 -1.94 0.00 0.00 57.00 53.57 2ddc n GLN 136 Cb 0.43 -1.47 0.03 0.00 0.11 0.00 0.00 30.24 29.34 2ddc n GLN 136 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2ddc n ARG 137 N 0.45 -2.67 -0.53 -1.09 1.74 -0.55 -4.91 116.66 109.09 2ddc n ARG 137 Ca 0.15 0.54 0.06 0.00 -0.77 0.00 0.00 57.85 57.83 2ddc n ARG 137 Cb 0.46 -4.67 0.25 0.00 -1.02 0.00 0.00 32.46 27.49 2ddc n ARG 137 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2ddc n LYS 138 N -4.13 2.81 -3.43 5.56 4.76 0.13 -5.00 118.16 118.86 2ddc n LYS 138 Ca -0.18 -2.91 -0.33 0.00 -2.87 0.00 0.00 58.31 52.02 2ddc n LYS 138 Cb 0.63 -1.87 -0.05 0.00 -1.84 0.00 0.00 35.03 31.90 2ddc n LYS 138 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2ddc s THR 139 N -2.90 4.94 -0.20 -0.18 -4.23 -1.26 -0.68 115.64 111.13 2ddc s THR 139 Ca 0.43 0.50 -0.10 0.00 -1.18 0.00 0.00 61.69 61.34 2ddc s THR 139 Cb 0.36 -3.64 -0.08 0.00 1.34 0.00 0.00 72.50 70.48 2ddc s THR 139 CO 0.08 0.01 -0.26 0.52 -0.54 0.00 0.00 174.62 174.42 2ddc n VAL 140 N 0.09 1.12 -3.63 2.29 0.31 0.71 -4.76 118.33 114.45 2ddc n VAL 140 Ca -0.01 -0.26 -0.01 0.00 -0.01 0.00 0.00 64.34 64.05 2ddc n VAL 140 Cb 0.52 -1.79 -0.01 0.00 -0.91 0.00 0.00 33.84 31.65 2ddc n VAL 140 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2ddc s LYS 141 N -2.38 0.54 0.04 5.55 -2.85 -1.23 -4.99 119.74 114.43 2ddc s LYS 141 Ca -0.28 -0.28 -0.18 0.00 -1.00 0.00 0.00 55.97 54.24 2ddc s LYS 141 Cb 0.11 0.20 -0.06 0.00 -2.06 0.00 0.00 37.83 36.01 2ddc s LYS 141 CO 0.35 -0.25 0.51 -1.58 0.10 0.00 0.00 175.35 174.49 2ddc s TRP 142 N -2.62 3.78 0.78 1.78 0.52 -1.26 -0.74 118.94 121.18 2ddc s TRP 142 Ca 0.12 1.17 -0.12 0.00 0.02 0.00 0.00 56.10 57.30 2ddc s TRP 142 Cb 0.02 -2.43 0.06 0.00 -1.15 0.00 0.00 33.47 29.98 2ddc s TRP 142 CO -0.03 0.60 1.14 -1.21 0.02 0.00 0.00 176.95 177.46 2ddc s GLU 143 N -1.06 2.20 1.07 4.98 0.41 -0.16 -4.83 118.70 121.30 2ddc s GLU 143 Ca 0.27 0.32 -0.13 0.00 -0.41 0.00 0.00 54.97 55.02 2ddc s GLU 143 Cb -0.18 -1.96 0.23 0.00 -1.78 0.00 0.00 34.13 30.44 2ddc s GLU 143 CO 0.17 -1.47 1.07 -1.12 -0.49 0.00 0.00 175.26 173.42 2ddc s SER 144 N -4.36 1.94 0.28 -0.19 0.01 -1.26 -4.76 113.70 105.35 2ddc s SER 144 Ca 0.61 1.24 -0.17 0.00 1.31 0.00 0.00 55.95 58.94 2ddc s SER 144 Cb -0.12 -1.95 0.01 0.00 0.21 0.00 0.00 66.02 64.18 2ddc s SER 144 CO 0.51 -3.57 0.62 -0.94 0.41 0.00 0.00 173.24 170.28 2ddc s SER 145 N -3.17 -0.15 -0.18 2.44 1.04 -0.56 -4.88 113.70 108.25 2ddc s SER 145 Ca 0.67 -0.79 -0.02 0.00 0.48 0.00 0.00 55.95 56.28 2ddc s SER 145 Cb -0.21 0.68 0.05 0.00 0.10 0.00 0.00 66.02 66.65 2ddc s SER 145 CO 0.60 -1.29 0.02 -0.89 0.98 0.00 0.00 173.24 172.66 2ddc s THR 146 N -3.83 0.64 0.03 2.02 2.01 -1.26 -0.28 115.64 114.96 2ddc s THR 146 Ca 0.16 -0.53 -0.23 0.00 0.31 0.00 0.00 61.69 61.41 2ddc s THR 146 Cb -0.04 -1.05 -0.06 0.00 0.01 0.00 0.00 72.50 71.37 2ddc s THR 146 CO 0.08 -0.11 0.68 -0.70 -0.69 0.00 0.00 174.62 173.89 2ddc s GLU 147 N 1.82 4.41 -0.28 4.92 2.12 0.32 -4.58 118.70 127.42 2ddc s GLU 147 Ca -0.00 0.90 -0.15 0.00 0.36 0.00 0.00 54.97 56.09 2ddc s GLU 147 Cb -0.16 -3.35 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 2ddc s GLU 147 CO -0.07 0.34 0.35 0.15 -0.54 0.00 0.00 175.26 175.49 2ddc s LYS 148 N -0.19 3.94 -0.21 4.30 3.01 0.55 -1.23 119.74 129.90 2ddc s LYS 148 Ca 0.35 -0.07 -0.08 0.00 -1.01 0.00 0.00 55.97 55.16 2ddc s LYS 148 Cb -0.19 -3.68 -0.04 0.00 -1.01 0.00 0.00 37.83 32.90 2ddc s LYS 148 CO 0.20 -0.31 0.08 -1.64 0.51 0.00 0.00 175.35 174.19 2ddc s MET 149 N 2.03 3.92 -0.03 1.68 -1.94 0.13 -1.27 119.30 123.82 2ddc s MET 149 Ca 0.14 -0.36 -0.13 0.00 -1.71 0.00 0.00 55.69 53.62 2ddc s MET 149 Cb -0.16 -3.29 0.02 0.00 2.01 0.00 0.00 34.83 33.41 2ddc s MET 149 CO 0.10 0.14 0.28 1.52 -0.01 0.00 0.00 175.02 177.05 2ddc s TYR 150 N 0.76 -0.17 0.25 -0.03 1.13 -0.27 -1.72 117.35 117.30 2ddc s TYR 150 Ca 0.04 0.29 -0.22 0.00 -1.41 0.00 0.00 57.07 55.76 2ddc s TYR 150 Cb -0.13 0.08 -0.09 0.00 -1.10 0.00 0.00 41.96 40.72 2ddc s TYR 150 CO 0.02 -0.34 0.81 0.08 -2.51 0.00 0.00 175.55 173.61 2ddc s VAL 151 N -1.11 4.42 -0.18 -3.49 1.01 -1.26 -0.12 120.40 119.68 2ddc s VAL 151 Ca -0.12 1.52 -0.06 0.00 0.00 0.00 0.00 61.98 63.32 2ddc s VAL 151 Cb -0.05 -3.94 0.08 0.00 0.00 0.00 0.00 36.38 32.47 2ddc s VAL 151 CO 0.03 0.21 0.36 -0.60 0.00 0.00 0.00 175.10 175.10 2ddc s ARG 152 N -1.93 0.26 -1.48 2.72 6.06 -0.18 -4.90 118.95 119.50 2ddc s ARG 152 Ca 0.45 0.89 -0.07 0.00 -2.50 0.00 0.00 55.73 54.50 2ddc s ARG 152 Cb -0.18 0.13 0.05 0.00 0.06 0.00 0.00 34.95 35.01 2ddc s ARG 152 CO 0.22 -0.30 0.67 -0.25 -2.50 0.00 0.00 175.30 173.15 2ddc n ASP 153 N 5.37 -2.05 0.00 -2.12 8.00 -1.26 -1.95 116.55 122.55 2ddc n ASP 153 Ca -0.07 -0.93 0.00 0.00 0.71 0.00 0.00 54.79 54.50 2ddc n ASP 153 Cb 0.50 -3.35 0.00 0.00 -0.02 0.00 0.00 41.12 38.25 2ddc n ASP 153 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ddc n GLY 154 N -1.73 1.66 3.62 0.44 0.00 -1.26 -5.01 105.19 102.92 2ddc n GLY 154 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 2ddc n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ddc s VAL 155 N -3.53 1.22 -0.14 1.61 -7.23 -0.82 -5.01 120.40 106.50 2ddc s VAL 155 Ca 0.00 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.13 2ddc s VAL 155 Cb 0.00 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 2ddc s VAL 155 CO 0.00 0.00 0.02 -0.22 -0.31 0.00 0.00 175.10 174.59 2ddc s LEU 156 N -3.71 3.60 0.06 1.32 2.96 -1.03 -1.01 118.68 120.86 2ddc s LEU 156 Ca 0.21 0.06 0.06 0.00 -0.22 0.00 0.00 54.13 54.24 2ddc s LEU 156 Cb 0.05 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 2ddc s LEU 156 CO 0.11 0.26 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.77 2ddc s LYS 157 N -0.15 2.29 -0.05 1.98 -0.14 0.83 0.30 119.74 124.80 2ddc s LYS 157 Ca 0.05 -0.91 -0.01 0.00 -1.36 0.00 0.00 55.97 53.74 2ddc s LYS 157 Cb -0.12 -2.37 0.03 0.00 -1.68 0.00 0.00 37.83 33.68 2ddc s LYS 157 CO 0.02 0.54 0.03 0.20 -0.76 0.00 0.00 175.35 175.38 2ddc s GLY 158 N -1.86 0.32 -0.06 -3.33 0.00 -0.13 -1.12 107.32 101.15 2ddc s GLY 158 Ca 0.19 0.06 0.06 0.00 0.00 0.00 0.00 44.72 45.03 2ddc s GLY 158 CO 0.11 1.18 -0.23 0.99 0.00 0.00 0.00 173.10 175.15 2ddc s ASP 159 N 1.93 3.24 -0.12 1.64 -0.00 -0.40 -0.53 116.67 122.44 2ddc s ASP 159 Ca 0.03 -0.46 -0.09 0.00 -0.00 0.00 0.00 52.55 52.04 2ddc s ASP 159 Cb -0.12 -0.82 0.04 0.00 -0.00 0.00 0.00 42.92 42.02 2ddc s ASP 159 CO -0.04 0.26 0.30 0.54 -0.00 0.00 0.00 175.17 176.23 2ddc s VAL 160 N -0.26 -0.02 -0.41 -1.27 0.11 -0.82 -0.33 120.40 117.39 2ddc s VAL 160 Ca -0.00 0.06 -0.26 0.00 -2.93 0.00 0.00 61.98 58.85 2ddc s VAL 160 Cb -0.13 -0.43 0.02 0.00 -1.53 0.00 0.00 36.38 34.31 2ddc s VAL 160 CO 0.03 0.02 0.94 0.20 -3.33 0.00 0.00 175.10 172.96 2ddc s ASN 161 N 0.68 6.60 0.23 3.54 0.02 -1.26 -1.46 114.94 123.29 2ddc s ASN 161 Ca -0.04 0.39 0.07 0.00 -1.02 0.00 0.00 52.86 52.26 2ddc s ASN 161 Cb -0.06 -2.46 -0.04 0.00 0.02 0.00 0.00 41.25 38.71 2ddc s ASN 161 CO -0.04 -0.96 0.11 -0.04 0.02 0.00 0.00 177.10 176.19 2ddc s MET 162 N 3.64 2.68 -0.16 -0.60 -1.94 0.34 -4.75 119.30 118.51 2ddc s MET 162 Ca 0.38 -1.12 -0.10 0.00 -1.71 0.00 0.00 55.69 53.14 2ddc s MET 162 Cb -0.11 -2.45 0.05 0.00 2.01 0.00 0.00 34.83 34.34 2ddc s MET 162 CO 0.22 0.41 0.40 0.00 -0.01 0.00 0.00 175.02 176.05 2ddc s ALA 163 N -2.05 -1.01 -0.21 3.03 0.00 -1.26 -1.32 121.76 118.94 2ddc s ALA 163 Ca 0.31 1.40 -0.09 0.00 0.00 0.00 0.00 51.96 53.58 2ddc s ALA 163 Cb -0.08 -0.84 -0.05 0.00 0.00 0.00 0.00 23.12 22.15 2ddc s ALA 163 CO 0.22 -0.24 0.11 -0.51 0.00 0.00 0.00 175.76 175.35 2ddc s LEU 164 N 1.08 4.01 0.19 0.00 1.43 0.07 -0.99 118.68 124.48 2ddc s LEU 164 Ca -0.07 0.12 -0.30 0.00 -1.03 0.00 0.00 54.13 52.85 2ddc s LEU 164 Cb -0.07 -2.05 -0.08 0.00 0.03 0.00 0.00 46.19 44.03 2ddc s LEU 164 CO -0.09 0.13 1.04 -0.22 0.23 0.00 0.00 176.35 177.44 2ddc s LEU 165 N 0.65 4.53 0.15 1.79 2.96 0.08 -0.81 118.68 128.03 2ddc s LEU 165 Ca 0.06 2.03 0.03 0.00 -0.22 0.00 0.00 54.13 56.04 2ddc s LEU 165 Cb -0.12 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 2ddc s LEU 165 CO 0.01 -0.10 0.23 -0.76 -1.32 0.00 0.00 176.35 174.41 2ddc s LEU 166 N -0.63 4.15 0.19 -0.68 1.43 -0.24 -0.21 118.68 122.69 2ddc s LEU 166 Ca 0.46 0.07 -0.12 0.00 -1.03 0.00 0.00 54.13 53.51 2ddc s LEU 166 Cb -0.28 -2.73 0.18 0.00 0.03 0.00 0.00 46.19 43.38 2ddc s LEU 166 CO 0.34 0.06 1.76 1.56 0.23 0.00 0.00 176.35 180.30 2ddc h GLN 167 N 2.27 0.39 0.00 1.70 4.20 -1.20 0.38 115.11 122.84 2ddc h GLN 167 Ca -0.48 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.21 2ddc h GLN 167 Cb 1.20 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.89 2ddc h GLN 167 CO 0.67 0.26 0.00 0.41 -0.67 0.00 0.00 178.83 179.49 2ddc n GLY 168 N -1.26 -0.88 0.00 3.46 0.00 -1.26 -4.97 105.19 100.28 2ddc n GLY 168 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2ddc n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ddc n GLY 169 N 0.43 -0.07 0.00 -0.02 0.00 0.12 -5.11 105.19 100.54 2ddc n GLY 169 Ca 0.03 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.32 2ddc n GLY 169 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ddc n GLY 170 N 0.06 -0.71 3.45 -0.02 0.00 -1.26 -4.48 105.19 102.24 2ddc n GLY 170 Ca 0.00 -1.68 -0.24 0.00 0.00 0.00 0.00 46.02 44.09 2ddc n GLY 170 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ddc s HIS 171 N -2.07 2.27 -0.25 1.61 0.09 -1.26 -1.08 115.29 114.60 2ddc s HIS 171 Ca 0.00 -0.35 0.01 0.00 -0.00 0.00 0.00 55.06 54.72 2ddc s HIS 171 Cb 0.00 -1.01 0.07 0.00 -0.00 0.00 0.00 32.58 31.63 2ddc s HIS 171 CO 0.00 0.66 -0.04 -0.47 -0.00 0.00 0.00 174.74 174.89 2ddc s TYR 172 N -2.34 2.52 0.35 1.40 5.04 0.01 -4.94 117.35 119.38 2ddc s TYR 172 Ca 0.28 -1.89 -0.18 0.00 -2.44 0.00 0.00 57.07 52.83 2ddc s TYR 172 Cb -0.05 -1.72 -0.10 0.00 0.35 0.00 0.00 41.96 40.44 2ddc s TYR 172 CO 0.13 -0.80 0.82 1.03 -1.34 0.00 0.00 175.55 175.39 2ddc s ARG 173 N 1.35 4.14 -0.10 4.97 1.81 -1.26 -0.75 118.95 129.12 2ddc s ARG 173 Ca -0.04 0.89 -0.07 0.00 -1.72 0.00 0.00 55.73 54.79 2ddc s ARG 173 Cb -0.19 -2.41 0.03 0.00 -0.45 0.00 0.00 34.95 31.94 2ddc s ARG 173 CO -0.07 0.12 0.25 0.00 -0.68 0.00 0.00 175.30 174.91 2ddc s ASP 175 N 0.60 5.27 -0.13 0.00 -0.00 -0.09 -0.50 116.67 121.81 2ddc s ASP 175 Ca -0.04 -0.14 -0.11 0.00 -0.00 0.00 0.00 52.55 52.26 2ddc s ASP 175 Cb -0.05 -1.94 -0.05 0.00 -0.00 0.00 0.00 42.92 40.88 2ddc s ASP 175 CO -0.03 0.00 0.24 -0.36 -0.00 0.00 0.00 175.17 175.02 2ddc s PHE 176 N 1.39 3.54 -0.20 4.23 0.40 -0.53 -1.37 117.98 125.44 2ddc s PHE 176 Ca 0.05 0.60 -0.02 0.00 -0.60 0.00 0.00 56.93 56.96 2ddc s PHE 176 Cb -0.15 -2.19 0.06 0.00 0.51 0.00 0.00 43.02 41.26 2ddc s PHE 176 CO 0.04 0.46 0.01 1.03 0.70 0.00 0.00 175.22 177.46 2ddc s ARG 177 N -0.24 0.89 0.07 0.44 0.52 -0.40 -1.95 118.95 118.27 2ddc s ARG 177 Ca 0.16 -0.54 0.09 0.00 -0.52 0.00 0.00 55.73 54.91 2ddc s ARG 177 Cb -0.13 -2.20 -0.03 0.00 0.52 0.00 0.00 34.95 33.11 2ddc s ARG 177 CO 0.04 -0.62 -0.22 0.99 0.02 0.00 0.00 175.30 175.51 2ddc s THR 178 N 1.75 2.49 -0.12 0.02 2.01 0.31 -1.21 115.64 120.89 2ddc s THR 178 Ca -0.02 -1.40 0.02 0.00 0.31 0.00 0.00 61.69 60.60 2ddc s THR 178 Cb -0.17 -2.05 0.01 0.00 0.01 0.00 0.00 72.50 70.30 2ddc s THR 178 CO -0.07 0.27 -0.16 -0.89 -0.69 0.00 0.00 174.62 173.07 2ddc s THR 179 N -0.94 1.60 -0.18 -0.82 2.01 0.12 -0.95 115.64 116.48 2ddc s THR 179 Ca 0.14 -0.70 -0.05 0.00 0.31 0.00 0.00 61.69 61.39 2ddc s THR 179 Cb -0.10 -1.46 -0.03 0.00 0.01 0.00 0.00 72.50 70.92 2ddc s THR 179 CO 0.05 0.46 0.01 -0.31 -0.69 0.00 0.00 174.62 174.14 2ddc s TYR 180 N 1.01 3.11 -0.25 4.92 2.02 0.15 -1.26 117.35 127.05 2ddc s TYR 180 Ca -0.05 -0.19 0.01 0.00 -0.37 0.00 0.00 57.07 56.46 2ddc s TYR 180 Cb -0.15 -2.04 0.07 0.00 -0.40 0.00 0.00 41.96 39.45 2ddc s TYR 180 CO -0.03 -0.01 -0.01 0.15 -1.57 0.00 0.00 175.55 174.08 2ddc s LYS 181 N 0.52 1.41 0.49 -0.62 1.02 0.34 -2.47 119.74 120.43 2ddc s LYS 181 Ca -0.00 -1.06 -0.22 0.00 0.02 0.00 0.00 55.97 54.70 2ddc s LYS 181 Cb -0.14 -2.54 -0.07 0.00 -0.52 0.00 0.00 37.83 34.56 2ddc s LYS 181 CO 0.02 -0.69 1.21 0.00 -0.92 0.00 0.00 175.35 174.96 2ddc s ALA 182 N 1.40 2.92 -2.19 5.17 0.00 -1.26 -1.56 121.76 126.24 2ddc s ALA 182 Ca -0.02 1.02 0.27 0.00 0.00 0.00 0.00 51.96 53.23 2ddc s ALA 182 Cb -0.19 -3.42 1.33 0.00 0.00 0.00 0.00 23.12 20.84 2ddc s ALA 182 CO -0.09 -0.83 1.89 1.63 0.00 0.00 0.00 175.76 178.36 2ddc n LYS 183 N -0.67 1.31 -3.90 0.00 5.02 -0.33 -4.85 118.16 114.74 2ddc n LYS 183 Ca 0.08 -0.45 -0.09 0.00 -2.02 0.00 0.00 58.31 55.82 2ddc n LYS 183 Cb 0.48 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 33.99 2ddc n LYS 183 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2ddc s LYS 184 N -1.97 1.25 0.04 1.97 -2.85 -1.26 -5.01 119.74 111.91 2ddc s LYS 184 Ca 0.39 -1.09 -0.30 0.00 -1.00 0.00 0.00 55.97 53.97 2ddc s LYS 184 Cb 0.19 0.43 -0.07 0.00 -2.06 0.00 0.00 37.83 36.32 2ddc s LYS 184 CO 0.31 -0.49 1.53 0.08 0.10 0.00 0.00 175.35 176.88 2ddc s VAL 185 N -3.94 3.36 0.14 1.79 1.01 -1.26 -4.98 120.40 116.52 2ddc s VAL 185 Ca 0.15 0.79 0.03 0.00 0.00 0.00 0.00 61.98 62.95 2ddc s VAL 185 Cb 0.02 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 2ddc s VAL 185 CO -0.00 -0.00 -0.06 0.68 0.00 0.00 0.00 175.10 175.72 2ddc s VAL 186 N 2.48 0.89 0.29 2.92 -7.23 -1.26 -5.02 120.40 113.47 2ddc s VAL 186 Ca 0.69 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.57 2ddc s VAL 186 Cb -0.36 -1.88 -0.10 0.00 0.56 0.00 0.00 36.38 34.60 2ddc s VAL 186 CO 0.29 -0.70 1.29 -1.58 -0.31 0.00 0.00 175.10 174.08 2ddc s GLN 187 N -3.82 4.40 -0.05 4.82 0.74 -1.26 -5.00 119.66 119.49 2ddc s GLN 187 Ca 0.17 2.12 -0.15 0.00 0.05 0.00 0.00 55.36 57.55 2ddc s GLN 187 Cb 0.04 -3.12 -0.05 0.00 1.10 0.00 0.00 33.01 30.98 2ddc s GLN 187 CO -0.00 -0.16 0.40 -0.51 -0.55 0.00 0.00 175.29 174.48 2ddc s LEU 188 N -1.26 4.40 0.51 3.68 1.43 -1.26 -4.61 118.68 121.57 2ddc s LEU 188 Ca 0.51 0.86 -0.07 0.00 -1.03 0.00 0.00 54.13 54.40 2ddc s LEU 188 Cb -0.38 -2.57 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 2ddc s LEU 188 CO 0.47 0.23 0.85 -2.16 0.23 0.00 0.00 176.35 175.97 2ddc s PRO 189 N -0.50 3.59 0.75 1.29 0.04 -1.26 -4.95 135.00 133.96 2ddc s PRO 189 Ca 0.23 0.39 -0.10 0.00 0.04 0.00 0.00 61.00 61.56 2ddc s PRO 189 Cb -0.16 -2.30 0.06 0.00 0.04 0.00 0.00 34.50 32.15 2ddc s PRO 189 CO 0.11 -0.28 1.09 -0.51 0.04 0.00 0.00 177.00 177.46 2ddc s ASP 190 N -4.00 4.76 0.13 6.66 1.01 -1.26 -4.57 116.67 119.40 2ddc s ASP 190 Ca 0.50 0.68 -0.35 0.00 0.71 0.00 0.00 52.55 54.09 2ddc s ASP 190 Cb -0.10 -1.29 -0.15 0.00 1.01 0.00 0.00 42.92 42.39 2ddc s ASP 190 CO 0.45 -1.69 1.46 0.00 0.21 0.00 0.00 175.17 175.60 2ddc n TYR 191 N -3.10 1.90 -3.48 4.23 9.36 -1.26 -4.86 117.16 119.94 2ddc n TYR 191 Ca 0.08 0.45 -0.04 0.00 3.32 0.00 0.00 57.90 61.71 2ddc n TYR 191 Cb 0.60 -2.44 0.00 0.00 -0.63 0.00 0.00 39.34 36.87 2ddc n TYR 191 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69 2ddc n HIS 192 N 2.96 -1.12 -4.20 2.98 1.44 -0.70 -4.99 115.22 111.59 2ddc n HIS 192 Ca 0.18 -0.69 -0.16 0.00 -2.01 0.00 0.00 57.72 55.04 2ddc n HIS 192 Cb 0.24 0.24 -0.11 0.00 0.12 0.00 0.00 29.99 30.49 2ddc n HIS 192 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2ddc s PHE 193 N -5.61 1.19 -0.15 -1.40 0.40 -0.41 -0.70 117.98 111.30 2ddc s PHE 193 Ca 0.07 -0.61 -0.02 0.00 -0.60 0.00 0.00 56.93 55.77 2ddc s PHE 193 Cb -0.01 -0.64 0.04 0.00 0.51 0.00 0.00 43.02 42.92 2ddc s PHE 193 CO 0.05 0.06 -0.00 0.08 0.70 0.00 0.00 175.22 176.11 2ddc s VAL 194 N -2.31 0.66 0.21 -0.44 1.01 -0.37 -0.80 120.40 118.37 2ddc s VAL 194 Ca 0.07 -0.36 -0.25 0.00 0.00 0.00 0.00 61.98 61.44 2ddc s VAL 194 Cb -0.04 -0.95 -0.08 0.00 0.00 0.00 0.00 36.38 35.31 2ddc s VAL 194 CO 0.01 0.05 0.81 -1.81 0.00 0.00 0.00 175.10 174.16 2ddc s ASP 195 N 1.83 7.34 0.04 3.32 1.01 0.21 -0.52 116.67 129.89 2ddc s ASP 195 Ca 0.02 1.66 0.05 0.00 0.71 0.00 0.00 52.55 54.98 2ddc s ASP 195 Cb -0.15 -2.51 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 2ddc s ASP 195 CO -0.07 0.12 -0.14 -1.00 0.21 0.00 0.00 175.17 174.29 2ddc s HIS 196 N -1.32 1.23 -0.11 4.23 3.76 0.62 -1.61 115.29 122.09 2ddc s HIS 196 Ca 0.40 -0.36 -0.05 0.00 -0.15 0.00 0.00 55.06 54.91 2ddc s HIS 196 Cb -0.21 -0.73 0.05 0.00 1.11 0.00 0.00 32.58 32.80 2ddc s HIS 196 CO 0.25 0.04 0.25 -0.48 -0.85 0.00 0.00 174.74 173.94 2ddc s LEU 197 N -1.17 0.14 0.25 0.89 0.05 -0.36 -1.49 118.68 117.00 2ddc s LEU 197 Ca 0.01 0.54 0.02 0.00 0.05 0.00 0.00 54.13 54.75 2ddc s LEU 197 Cb -0.08 0.69 -0.03 0.00 -2.05 0.00 0.00 46.19 44.72 2ddc s LEU 197 CO 0.01 -0.20 0.21 0.00 -0.55 0.00 0.00 176.35 175.82 2ddc s MET 198 N 1.73 1.44 -0.22 1.48 0.23 -1.26 -0.80 119.30 121.90 2ddc s MET 198 Ca -0.05 -1.76 -0.30 0.00 -1.03 0.00 0.00 55.69 52.54 2ddc s MET 198 Cb -0.11 0.30 0.16 0.00 -1.53 0.00 0.00 34.83 33.65 2ddc s MET 198 CO -0.08 -0.51 1.18 -1.83 -2.03 0.00 0.00 175.02 171.75 2ddc s GLU 199 N -3.86 0.33 -0.44 3.16 -1.05 -0.69 -4.88 118.70 111.27 2ddc s GLU 199 Ca 0.39 0.05 -0.21 0.00 -0.15 0.00 0.00 54.97 55.05 2ddc s GLU 199 Cb 0.05 0.16 0.03 0.00 -0.44 0.00 0.00 34.13 33.92 2ddc s GLU 199 CO 0.18 -0.11 0.66 0.42 0.95 0.00 0.00 175.26 177.36 2ddc s ILE 200 N -1.27 4.80 -0.55 1.83 1.01 -1.26 -1.72 121.20 124.05 2ddc s ILE 200 Ca 0.04 0.12 0.25 0.00 0.00 0.00 0.00 60.65 61.06 2ddc s ILE 200 Cb -0.01 -4.23 0.31 0.00 0.01 0.00 0.00 42.46 38.55 2ddc s ILE 200 CO -0.04 -0.63 1.71 0.71 0.00 0.00 0.00 174.94 176.69 2ddc h THR 201 N 5.89 0.00 -1.55 2.92 1.35 -1.36 -3.47 112.91 116.69 2ddc h THR 201 Ca -0.25 -0.70 0.08 0.00 -0.55 0.00 0.00 66.41 64.98 2ddc h THR 201 Cb 1.09 1.69 -0.23 0.00 -1.73 0.00 0.00 68.15 68.97 2ddc h THR 201 CO 0.91 0.00 0.55 -0.55 -0.25 0.00 0.00 175.52 176.18 2ddc s SER 202 N -5.34 -0.37 -0.04 5.36 0.15 -1.21 -4.97 113.70 107.29 2ddc s SER 202 Ca 0.08 0.42 -0.29 0.00 0.70 0.00 0.00 55.95 56.87 2ddc s SER 202 Cb 0.09 0.33 0.10 0.00 -1.71 0.00 0.00 66.02 64.83 2ddc s SER 202 CO 0.62 -0.32 0.87 -1.38 1.20 0.00 0.00 173.24 174.23 2ddc s HIS 203 N -1.02 -0.40 0.72 3.44 -0.00 -1.26 0.07 115.29 116.84 2ddc s HIS 203 Ca -0.01 0.42 -0.00 0.00 -0.00 0.00 0.00 55.06 55.47 2ddc s HIS 203 Cb -0.01 0.50 0.13 0.00 -0.00 0.00 0.00 32.58 33.21 2ddc s HIS 203 CO 0.01 -0.52 0.99 0.16 -0.00 0.00 0.00 174.74 175.38 2ddc s ASP 204 N -2.01 4.36 0.16 7.38 1.47 -0.78 -4.94 116.67 122.31 2ddc s ASP 204 Ca 0.01 -0.42 -0.30 0.00 1.18 0.00 0.00 52.55 53.03 2ddc s ASP 204 Cb -0.01 0.05 -0.04 0.00 -0.34 0.00 0.00 42.92 42.59 2ddc s ASP 204 CO -0.05 -1.86 1.55 0.50 0.68 0.00 0.00 175.17 175.99 2ddc h LYS 205 N -0.50 -0.11 -0.64 2.11 3.64 -2.03 -1.99 116.57 117.06 2ddc h LYS 205 Ca -0.36 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 2ddc h LYS 205 Cb 1.27 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 2ddc h LYS 205 CO 0.40 -0.07 0.00 -0.25 -2.27 0.00 0.00 179.45 177.25 2ddc n ASP 206 N -5.32 4.12 -3.15 4.20 8.00 -1.26 -4.94 116.55 118.21 2ddc n ASP 206 Ca 0.02 -2.43 -0.23 0.00 0.71 0.00 0.00 54.79 52.86 2ddc n ASP 206 Cb 0.30 -0.54 0.05 0.00 -0.02 0.00 0.00 41.12 40.90 2ddc n ASP 206 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2ddc n TYR 207 N 0.82 -2.19 0.18 1.24 4.02 -0.75 -4.37 117.16 116.12 2ddc n TYR 207 Ca 0.21 0.64 0.09 0.00 -0.01 0.00 0.00 57.90 58.83 2ddc n TYR 207 Cb 0.80 -4.65 0.11 0.00 -0.02 0.00 0.00 39.34 35.58 2ddc n TYR 207 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2ddc h ASN 208 N -1.70 0.00 -3.28 7.72 2.35 -1.92 -3.43 115.58 115.32 2ddc h ASN 208 Ca -0.54 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 54.67 2ddc h ASN 208 Cb 1.37 0.00 -0.35 0.00 0.05 0.00 0.00 38.32 39.39 2ddc h ASN 208 CO 0.57 0.15 -0.82 -0.54 -1.65 0.00 0.00 177.43 175.14 2ddc s LYS 209 N -3.15 1.80 -0.03 0.81 -0.14 -1.26 -0.54 119.74 117.22 2ddc s LYS 209 Ca 0.05 -0.40 -0.02 0.00 -1.36 0.00 0.00 55.97 54.24 2ddc s LYS 209 Cb 0.06 -1.62 0.02 0.00 -1.68 0.00 0.00 37.83 34.61 2ddc s LYS 209 CO 0.71 -0.11 0.07 0.08 -0.76 0.00 0.00 175.35 175.34 2ddc s VAL 210 N 1.15 -0.03 -0.12 3.17 1.01 -0.72 -1.86 120.40 123.01 2ddc s VAL 210 Ca -0.05 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2ddc s VAL 210 Cb -0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 2ddc s VAL 210 CO -0.03 0.04 -0.09 -0.54 0.00 0.00 0.00 175.10 174.49 2ddc s LYS 211 N 0.61 3.28 0.17 2.72 1.02 0.11 0.10 119.74 127.75 2ddc s LYS 211 Ca -0.05 -0.60 0.11 0.00 0.02 0.00 0.00 55.97 55.45 2ddc s LYS 211 Cb -0.07 -2.70 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 2ddc s LYS 211 CO -0.02 0.35 -0.25 -0.51 -0.92 0.00 0.00 175.35 174.00 2ddc s LEU 212 N 0.02 2.40 -0.02 3.17 1.43 0.37 -0.91 118.68 125.14 2ddc s LEU 212 Ca -0.02 -0.83 -0.01 0.00 -1.03 0.00 0.00 54.13 52.25 2ddc s LEU 212 Cb -0.14 -1.19 0.02 0.00 0.03 0.00 0.00 46.19 44.91 2ddc s LEU 212 CO 0.03 0.14 0.04 -0.47 0.23 0.00 0.00 176.35 176.33 2ddc s TYR 213 N -1.47 -0.02 0.00 0.29 5.04 -0.70 -1.84 117.35 118.65 2ddc s TYR 213 Ca 0.19 0.14 0.01 0.00 -2.44 0.00 0.00 57.07 54.97 2ddc s TYR 213 Cb -0.09 -0.09 -0.01 0.00 0.35 0.00 0.00 41.96 42.12 2ddc s TYR 213 CO 0.09 -0.06 -0.02 -2.00 -1.34 0.00 0.00 175.55 172.21 2ddc s GLU 214 N 0.55 0.19 -0.06 4.97 2.12 -0.73 -1.71 118.70 124.03 2ddc s GLU 214 Ca -0.04 -0.18 0.02 0.00 0.36 0.00 0.00 54.97 55.13 2ddc s GLU 214 Cb -0.06 -0.12 0.01 0.00 0.26 0.00 0.00 34.13 34.22 2ddc s GLU 214 CO -0.02 0.03 -0.11 -1.58 -0.54 0.00 0.00 175.26 173.04 2ddc s HIS 215 N -0.31 1.39 -0.01 5.30 5.65 0.02 -1.54 115.29 125.79 2ddc s HIS 215 Ca -0.02 -0.51 -0.02 0.00 0.25 0.00 0.00 55.06 54.77 2ddc s HIS 215 Cb -0.02 -1.03 -0.00 0.00 -1.18 0.00 0.00 32.58 30.34 2ddc s HIS 215 CO -0.00 -0.27 0.04 0.00 -0.65 0.00 0.00 174.74 173.85 2ddc s ALA 216 N 0.70 -0.08 -0.07 1.58 0.00 0.70 -1.22 121.76 123.38 2ddc s ALA 216 Ca -0.14 -0.02 -0.03 0.00 0.00 0.00 0.00 51.96 51.76 2ddc s ALA 216 Cb -0.16 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 22.98 2ddc s ALA 216 CO 0.03 -0.06 0.15 0.21 0.00 0.00 0.00 175.76 176.10 2ddc s LYS 217 N -0.33 0.12 0.33 0.00 2.20 -0.63 -1.60 119.74 119.83 2ddc s LYS 217 Ca -0.04 0.34 -0.10 0.00 -0.36 0.00 0.00 55.97 55.81 2ddc s LYS 217 Cb -0.03 -0.12 -0.07 0.00 -1.51 0.00 0.00 37.83 36.11 2ddc s LYS 217 CO -0.00 -0.13 0.68 0.00 -0.36 0.00 0.00 175.35 175.54 2ddc s ALA 218 N 0.92 3.44 0.27 3.13 0.00 -0.26 -0.62 121.76 128.64 2ddc s ALA 218 Ca -0.07 -0.24 -0.21 0.00 0.00 0.00 0.00 51.96 51.44 2ddc s ALA 218 Cb -0.09 -2.59 0.04 0.00 0.00 0.00 0.00 23.12 20.48 2ddc s ALA 218 CO -0.05 0.20 0.80 -3.38 0.00 0.00 0.00 175.76 173.33 2ddc s HIS 219 N -2.14 -0.10 -0.92 0.00 -0.00 0.02 -4.49 115.29 107.66 2ddc s HIS 219 Ca 0.50 -0.37 0.17 0.00 -0.00 0.00 0.00 55.06 55.35 2ddc s HIS 219 Cb -0.10 0.72 0.66 0.00 -0.00 0.00 0.00 32.58 33.86 2ddc s HIS 219 CO 0.27 -1.21 1.58 -1.13 -0.00 0.00 0.00 174.74 174.24 2ddc n SER 220 N -0.70 4.54 0.00 7.38 3.41 -1.26 -1.29 113.62 125.70 2ddc n SER 220 Ca -0.05 -2.51 0.00 0.00 -0.26 0.00 0.00 58.87 56.05 2ddc n SER 220 Cb 0.60 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2ddc n SER 220 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ddc n GLY 221 N 0.82 -0.96 3.72 5.00 0.00 -1.26 -4.89 105.19 107.62 2ddc n GLY 221 Ca 0.24 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 2ddc n GLY 221 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ddc s LEU 222 N -1.88 4.37 0.54 0.99 2.96 -1.26 -4.97 118.68 119.43 2ddc s LEU 222 Ca 0.00 2.74 -0.20 0.00 -0.22 0.00 0.00 54.13 56.44 2ddc s LEU 222 Cb 0.00 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.03 2ddc s LEU 222 CO 0.00 -0.88 1.17 -2.16 -1.32 0.00 0.00 176.35 173.17 2ddc s PRO 223 N 0.93 3.32 0.35 0.98 0.04 -1.26 -4.92 135.00 134.44 2ddc s PRO 223 Ca 0.70 1.74 0.05 0.00 0.04 0.00 0.00 61.00 63.53 2ddc s PRO 223 Cb -0.46 -2.09 0.70 0.00 0.04 0.00 0.00 34.50 32.69 2ddc s PRO 223 CO 0.34 -0.90 1.96 -0.09 0.04 0.00 0.00 177.00 178.35 2ddc h ARG 224 N 1.31 0.78 -6.17 4.56 2.43 -1.99 -3.42 114.38 111.89 2ddc h ARG 224 Ca -0.50 -0.05 -0.58 0.00 -0.81 0.00 0.00 59.98 58.04 2ddc h ARG 224 Cb 1.27 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.60 2ddc h ARG 224 CO 0.57 0.52 -0.09 -0.51 -1.51 0.00 0.00 179.97 178.95 2ddc s LEU 225 N -9.74 4.50 0.56 3.80 1.43 -1.26 -5.07 118.68 112.90 2ddc s LEU 225 Ca -0.10 1.15 -0.16 0.00 -1.03 0.00 0.00 54.13 53.99 2ddc s LEU 225 Cb 0.19 -2.82 -0.05 0.00 0.03 0.00 0.00 46.19 43.54 2ddc s LEU 225 CO 0.77 0.28 1.03 0.00 0.23 0.00 0.00 176.35 178.66 2ddc s ALA 226 N -1.12 2.87 0.00 4.21 0.00 -1.26 -5.18 121.76 121.28 2ddc s ALA 226 Ca 0.28 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2ddc s ALA 226 Cb -0.18 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.75 2ddc s ALA 226 CO 0.17 -0.57 0.00 1.17 0.00 0.00 0.00 175.76 176.53