#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dwb s VAL 17 N 0.00 5.30 -1.54 1.39 1.01 0.77 -4.20 120.40 123.12 1dwb s VAL 17 Ca 0.00 0.55 -0.03 0.00 0.00 0.00 0.00 61.98 62.50 1dwb s VAL 17 Cb 0.00 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.76 1dwb s VAL 17 CO 0.00 0.42 0.34 -0.62 0.00 0.00 0.00 175.10 175.24 1dwb n GLU 18 N 3.30 -3.35 0.00 2.72 -0.58 -1.26 -2.33 120.64 119.14 1dwb n GLU 18 Ca -0.13 0.89 0.00 0.00 -0.42 0.00 0.00 57.16 57.50 1dwb n GLU 18 Cb 0.52 -5.56 0.00 0.00 -0.57 0.00 0.00 31.44 25.83 1dwb n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dwb n GLY 19 N -1.29 1.49 3.47 0.62 0.00 -1.26 -4.77 105.19 103.45 1dwb n GLY 19 Ca -0.16 -1.72 -0.10 0.00 0.00 0.00 0.00 46.02 44.04 1dwb n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dwb s SER 20 N -1.00 -0.22 0.20 1.61 0.01 -0.69 -4.90 113.70 108.71 1dwb s SER 20 Ca 0.00 -0.50 -0.30 0.00 1.31 0.00 0.00 55.95 56.46 1dwb s SER 20 Cb 0.00 0.55 -0.08 0.00 0.21 0.00 0.00 66.02 66.69 1dwb s SER 20 CO 0.00 -1.00 1.12 -1.81 0.41 0.00 0.00 173.24 171.96 1dwb s ASP 21 N -2.87 7.23 0.62 2.44 1.01 -1.26 -0.32 116.67 123.52 1dwb s ASP 21 Ca 0.09 2.17 -0.12 0.00 0.71 0.00 0.00 52.55 55.40 1dwb s ASP 21 Cb -0.00 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.29 1dwb s ASP 21 CO -0.04 -0.23 1.03 0.00 0.21 0.00 0.00 175.17 176.14 1dwb s ALA 22 N -0.43 2.96 0.65 5.23 0.00 0.57 -4.78 121.76 125.95 1dwb s ALA 22 Ca 0.49 0.03 -0.11 0.00 0.00 0.00 0.00 51.96 52.37 1dwb s ALA 22 Cb -0.31 -3.12 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 1dwb s ALA 22 CO 0.37 -0.78 1.05 -1.21 0.00 0.00 0.00 175.76 175.19 1dwb s GLU 23 N -4.91 3.35 0.28 0.00 2.02 -1.26 -4.89 118.70 113.29 1dwb s GLU 23 Ca 0.57 0.65 -0.29 0.00 0.02 0.00 0.00 54.97 55.92 1dwb s GLU 23 Cb -0.12 -2.06 -0.10 0.00 0.10 0.00 0.00 34.13 31.95 1dwb s GLU 23 CO 0.50 -0.73 1.29 0.42 0.02 0.00 0.00 175.26 176.76 1dwb s ILE 24 N -3.24 2.94 -0.90 -1.63 1.01 -1.26 -2.80 121.20 115.32 1dwb s ILE 24 Ca 0.56 0.88 0.00 0.00 0.00 0.00 0.00 60.65 62.09 1dwb s ILE 24 Cb -0.11 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.80 1dwb s ILE 24 CO 0.53 0.18 0.00 0.61 0.00 0.00 0.00 174.94 176.26 1dwb n GLY 25 N 1.40 1.02 0.17 6.18 0.00 -1.26 -4.91 105.19 107.78 1dwb n GLY 25 Ca 0.02 -0.52 -0.07 0.00 0.00 0.00 0.00 46.02 45.45 1dwb n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1dwb h MET 26 N 0.07 0.29 -2.27 1.61 4.05 -1.90 -3.37 114.93 113.42 1dwb h MET 26 Ca -0.17 -0.22 -0.58 0.00 -0.28 0.00 0.00 59.70 58.44 1dwb h MET 26 Cb 0.61 0.04 -0.39 0.00 -0.80 0.00 0.00 31.60 31.06 1dwb h MET 26 CO 0.25 0.86 -0.95 0.43 0.23 0.00 0.00 176.91 177.73 1dwb n SER 27 N -3.84 0.61 0.00 1.39 7.64 -1.26 -4.96 113.62 113.20 1dwb n SER 27 Ca -0.03 -2.71 0.04 0.00 1.01 0.00 0.00 58.87 57.18 1dwb n SER 27 Cb 0.67 -0.62 0.16 0.00 -1.01 0.00 0.00 64.21 63.41 1dwb n SER 27 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1dwb n PRO 28 N 1.94 0.01 -0.02 1.43 -0.04 -1.26 -1.49 135.00 135.57 1dwb n PRO 28 Ca 0.25 0.36 0.12 0.00 -0.04 0.00 0.00 63.50 64.20 1dwb n PRO 28 Cb 0.48 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.69 1dwb n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1dwb n TRP 29 N -1.48 0.05 -2.58 0.54 2.14 -0.96 -1.97 117.44 113.18 1dwb n TRP 29 Ca 0.02 -0.03 -0.42 0.00 2.07 0.00 0.00 57.50 59.14 1dwb n TRP 29 Cb 0.09 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.56 1dwb n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1dwb s GLN 30 N -1.95 4.39 0.05 -2.67 2.00 -0.55 -0.54 119.66 120.40 1dwb s GLN 30 Ca 0.32 1.53 0.07 0.00 -2.00 0.00 0.00 55.36 55.29 1dwb s GLN 30 Cb 0.20 -3.54 -0.03 0.00 0.80 0.00 0.00 33.01 30.44 1dwb s GLN 30 CO 0.31 -0.37 -0.18 0.08 -0.50 0.00 0.00 175.29 174.63 1dwb s VAL 31 N 2.07 2.78 -0.11 1.34 1.01 -0.03 -3.95 120.40 123.50 1dwb s VAL 31 Ca 0.52 -1.25 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1dwb s VAL 31 Cb -0.21 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 1dwb s VAL 31 CO 0.20 0.29 -0.06 -0.32 0.00 0.00 0.00 175.10 175.22 1dwb s MET 32 N -1.56 3.20 -0.48 2.72 1.75 0.12 -1.73 119.30 123.33 1dwb s MET 32 Ca 0.15 -0.54 -0.17 0.00 -1.25 0.00 0.00 55.69 53.88 1dwb s MET 32 Cb -0.10 -2.74 0.06 0.00 2.84 0.00 0.00 34.83 34.89 1dwb s MET 32 CO 0.06 0.45 0.48 -0.51 -0.65 0.00 0.00 175.02 174.85 1dwb s LEU 33 N -0.22 5.29 -0.13 4.11 1.43 0.14 -1.02 118.68 128.29 1dwb s LEU 33 Ca 0.03 -1.10 -0.07 0.00 -1.03 0.00 0.00 54.13 51.97 1dwb s LEU 33 Cb -0.13 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 1dwb s LEU 33 CO 0.03 -0.72 0.12 0.12 0.23 0.00 0.00 176.35 176.13 1dwb s PHE 34 N 2.04 3.50 -0.11 0.29 5.36 0.02 -0.90 117.98 128.19 1dwb s PHE 34 Ca 0.09 0.44 -0.14 0.00 -0.96 0.00 0.00 56.93 56.36 1dwb s PHE 34 Cb -0.22 -1.96 -0.05 0.00 -0.34 0.00 0.00 43.02 40.46 1dwb s PHE 34 CO 0.09 0.62 0.33 0.50 -1.46 0.00 0.00 175.22 175.30 1dwb s ARG 35 N -0.75 4.07 0.04 10.12 3.52 -0.27 0.02 118.95 135.70 1dwb s ARG 35 Ca 0.13 0.19 -0.30 0.00 -0.13 0.00 0.00 55.73 55.62 1dwb s ARG 35 Cb -0.12 -3.34 -0.17 0.00 -1.56 0.00 0.00 34.95 29.76 1dwb s ARG 35 CO 0.03 0.42 1.35 0.87 -0.81 0.00 0.00 175.30 177.16 1dwb h LYS 36 N 5.93 -0.91 -2.49 5.12 1.57 -1.77 -3.04 116.57 120.98 1dwb h LYS 36 Ca -0.46 0.06 -0.21 0.00 -1.87 0.00 0.00 60.65 58.17 1dwb h LYS 36 Cb 1.19 0.21 -0.32 0.00 0.08 0.00 0.00 32.23 33.38 1dwb h LYS 36 CO 0.70 -0.57 -0.53 0.45 -0.57 0.00 0.00 179.45 178.92 1dwb s SER 36 N -4.45 0.54 0.54 0.86 0.15 -1.26 -3.01 113.70 107.07 1dwb s SER 36 Ca -0.16 0.33 -0.18 0.00 0.70 0.00 0.00 55.95 56.63 1dwb s SER 36 Cb 0.02 0.79 -0.06 0.00 -1.71 0.00 0.00 66.02 65.06 1dwb s SER 36 CO 0.53 -0.28 1.06 -2.16 1.20 0.00 0.00 173.24 173.59 1dwb s PRO 37 N 2.45 3.51 -0.08 5.44 0.04 -1.26 -5.07 135.00 140.02 1dwb s PRO 37 Ca 0.05 1.33 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 1dwb s PRO 37 Cb -0.14 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 1dwb s PRO 37 CO -0.12 -0.67 1.57 -0.65 0.04 0.00 0.00 177.00 177.18 1dwb s GLN 38 N -3.61 4.18 -0.00 4.56 -0.21 -1.16 -4.64 119.66 118.77 1dwb s GLN 38 Ca 0.67 2.06 -0.28 0.00 0.02 0.00 0.00 55.36 57.82 1dwb s GLN 38 Cb -0.17 -3.94 0.10 0.00 1.00 0.00 0.00 33.01 29.99 1dwb s GLN 38 CO 0.28 -0.84 0.85 -1.83 -2.12 0.00 0.00 175.29 171.64 1dwb s GLU 39 N 3.95 0.87 -0.38 2.91 -1.05 -1.15 -4.97 118.70 118.88 1dwb s GLU 39 Ca 0.70 -0.25 -0.28 0.00 -0.15 0.00 0.00 54.97 54.98 1dwb s GLU 39 Cb -0.31 0.40 0.02 0.00 -0.44 0.00 0.00 34.13 33.81 1dwb s GLU 39 CO 0.26 -0.37 1.07 -1.17 0.95 0.00 0.00 175.26 176.01 1dwb s LEU 40 N -2.32 3.84 -0.16 1.83 0.20 -1.26 -1.11 118.68 119.70 1dwb s LEU 40 Ca 0.03 0.76 -0.20 0.00 0.69 0.00 0.00 54.13 55.41 1dwb s LEU 40 Cb -0.01 -3.50 -0.17 0.00 -0.43 0.00 0.00 46.19 42.08 1dwb s LEU 40 CO -0.08 -1.01 0.35 -0.07 -0.29 0.00 0.00 176.35 175.26 1dwb h LEU 41 N 10.48 0.00 -7.89 -0.68 3.38 -1.38 -3.49 115.31 115.74 1dwb h LEU 41 Ca -0.22 -0.57 0.17 0.00 0.09 0.00 0.00 57.88 57.35 1dwb h LEU 41 Cb 1.06 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 1dwb h LEU 41 CO 1.06 1.09 0.58 0.00 0.09 0.00 0.00 178.44 181.26 1dwb s GLY 43 N -3.33 1.78 -0.12 0.00 0.00 0.11 -0.68 107.32 105.08 1dwb s GLY 43 Ca 0.20 -1.52 -0.33 0.00 0.00 0.00 0.00 44.72 43.07 1dwb s GLY 43 CO 0.04 -1.09 1.31 0.00 0.00 0.00 0.00 173.10 173.36 1dwb s ALA 44 N -2.97 -2.23 0.13 3.20 0.00 -0.71 -3.79 121.76 115.39 1dwb s ALA 44 Ca 0.62 1.16 0.07 0.00 0.00 0.00 0.00 51.96 53.81 1dwb s ALA 44 Cb -0.08 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1dwb s ALA 44 CO 0.42 -0.86 -0.16 -1.54 0.00 0.00 0.00 175.76 173.61 1dwb s SER 45 N -2.63 2.28 -0.43 0.00 1.04 0.01 -0.85 113.70 113.12 1dwb s SER 45 Ca 0.13 -0.80 -0.19 0.00 0.48 0.00 0.00 55.95 55.56 1dwb s SER 45 Cb 0.03 -0.11 0.02 0.00 0.10 0.00 0.00 66.02 66.07 1dwb s SER 45 CO -0.04 -0.08 0.56 -0.22 0.98 0.00 0.00 173.24 174.44 1dwb s LEU 46 N -2.42 4.67 0.00 2.42 2.96 0.30 -0.88 118.68 125.72 1dwb s LEU 46 Ca 0.10 -0.50 0.24 0.00 -0.22 0.00 0.00 54.13 53.75 1dwb s LEU 46 Cb -0.06 -2.58 0.15 0.00 0.50 0.00 0.00 46.19 44.20 1dwb s LEU 46 CO 0.04 -0.70 1.22 2.30 -1.32 0.00 0.00 176.35 177.89 1dwb n ILE 47 N 5.68 0.00 0.00 6.68 -5.35 -0.83 -1.60 119.36 123.94 1dwb n ILE 47 Ca -0.04 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 61.98 1dwb n ILE 47 Cb 0.48 1.45 0.00 0.00 -1.74 0.00 0.00 39.64 39.83 1dwb n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1dwb n SER 48 N 1.11 0.00 0.03 7.28 3.41 -1.13 -4.72 113.62 119.60 1dwb n SER 48 Ca 0.13 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.87 1dwb n SER 48 Cb 0.57 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.72 1dwb n SER 48 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1dwb n ASP 49 N 0.00 0.00 0.00 4.04 2.03 -1.26 -1.91 116.55 119.45 1dwb n ASP 49 Ca 0.00 0.54 0.00 0.00 0.52 0.00 0.00 54.79 55.85 1dwb n ASP 49 Cb 0.00 -0.12 0.00 0.00 -0.72 0.00 0.00 41.12 40.28 1dwb n ASP 49 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1dwb n ARG 50 N -2.58 0.00 -5.21 -0.67 1.74 -1.26 -0.35 116.66 108.33 1dwb n ARG 50 Ca 0.11 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.89 1dwb n ARG 50 Cb 1.08 -0.31 -0.16 0.00 -1.02 0.00 0.00 32.46 32.05 1dwb n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1dwb s TRP 51 N 0.00 2.21 -0.07 -1.55 0.52 -0.80 -0.36 118.94 118.88 1dwb s TRP 51 Ca 0.00 -0.42 0.05 0.00 0.02 0.00 0.00 56.10 55.75 1dwb s TRP 51 Cb 0.00 -1.41 -0.00 0.00 -1.15 0.00 0.00 33.47 30.90 1dwb s TRP 51 CO 0.00 -0.03 -0.22 0.08 0.02 0.00 0.00 176.95 176.80 1dwb s VAL 52 N -0.59 1.84 -0.18 4.03 1.01 -0.72 -1.96 120.40 123.82 1dwb s VAL 52 Ca 0.10 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 61.10 1dwb s VAL 52 Cb -0.09 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 1dwb s VAL 52 CO -0.01 0.51 0.01 -0.22 0.00 0.00 0.00 175.10 175.39 1dwb s LEU 53 N 0.17 3.39 0.00 3.92 2.96 -0.06 -0.84 118.68 128.22 1dwb s LEU 53 Ca -0.11 -0.12 0.05 0.00 -0.22 0.00 0.00 54.13 53.73 1dwb s LEU 53 Cb -0.15 -1.85 -0.02 0.00 0.50 0.00 0.00 46.19 44.67 1dwb s LEU 53 CO 0.06 0.12 0.18 1.07 -1.32 0.00 0.00 176.35 176.45 1dwb n THR 54 N 3.90 0.00 -3.42 3.68 5.66 -0.12 -0.81 114.28 123.17 1dwb n THR 54 Ca -0.17 -1.55 -0.36 0.00 -3.05 0.00 0.00 64.05 58.92 1dwb n THR 54 Cb 0.52 0.77 -0.06 0.00 -1.55 0.00 0.00 70.33 70.01 1dwb n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1dwb s ALA 55 N -2.86 3.63 0.08 1.79 0.00 -1.26 -1.34 121.76 121.80 1dwb s ALA 55 Ca 0.25 -0.19 -0.20 0.00 0.00 0.00 0.00 51.96 51.82 1dwb s ALA 55 Cb 0.01 -2.46 -0.10 0.00 0.00 0.00 0.00 23.12 20.57 1dwb s ALA 55 CO 0.18 0.48 1.57 0.00 0.00 0.00 0.00 175.76 177.99 1dwb h ALA 56 N 3.76 0.23 0.00 0.00 0.00 -1.69 -2.85 119.26 118.72 1dwb h ALA 56 Ca -0.49 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1dwb h ALA 56 Cb 1.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1dwb h ALA 56 CO 0.65 -0.14 0.11 -2.39 0.00 0.00 0.00 179.25 177.49 1dwb n HIS 57 N -4.80 0.00 0.12 0.00 1.44 -1.26 0.09 115.22 110.81 1dwb n HIS 57 Ca -0.05 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.74 1dwb n HIS 57 Cb 0.16 -0.16 0.02 0.00 0.12 0.00 0.00 29.99 30.14 1dwb n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1dwb n LEU 59 N -2.92 0.85 -3.65 0.00 4.77 0.11 -4.86 117.00 111.31 1dwb n LEU 59 Ca -0.01 -0.02 -0.19 0.00 -0.03 0.00 0.00 56.01 55.76 1dwb n LEU 59 Cb 0.64 0.06 -0.16 0.00 -2.33 0.00 0.00 43.42 41.63 1dwb n LEU 59 CO 0.39 0.44 -0.28 -0.22 -1.33 0.00 0.00 177.39 176.40 1dwb s LEU 60 N -5.20 0.03 0.15 2.23 0.20 -0.72 -1.22 118.68 114.14 1dwb s LEU 60 Ca -0.10 0.13 -0.18 0.00 0.69 0.00 0.00 54.13 54.66 1dwb s LEU 60 Cb 0.04 0.11 0.04 0.00 -0.43 0.00 0.00 46.19 45.95 1dwb s LEU 60 CO 0.47 -0.26 0.48 -0.47 -0.29 0.00 0.00 176.35 176.27 1dwb s TYR 60 N 2.24 -0.30 0.00 5.38 5.04 -0.20 -4.18 117.35 125.33 1dwb s TYR 60 Ca 0.04 0.01 0.00 0.00 -2.44 0.00 0.00 57.07 54.68 1dwb s TYR 60 Cb -0.13 0.37 0.00 0.00 0.35 0.00 0.00 41.96 42.55 1dwb s TYR 60 CO -0.06 -0.78 0.00 -2.30 -1.34 0.00 0.00 175.55 171.08 1dwb n PRO 60 N -0.29 0.00 -0.74 4.97 -0.02 -1.26 -1.50 135.00 136.16 1dwb n PRO 60 Ca -0.16 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.38 1dwb n PRO 60 Cb 0.64 -1.72 0.10 0.00 -0.02 0.00 0.00 33.50 32.50 1dwb n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1dwb n TRP 60 N -0.43 0.00 -2.53 6.00 8.01 -1.26 -4.95 117.44 122.28 1dwb n TRP 60 Ca 0.00 -0.81 -0.16 0.00 -1.31 0.00 0.00 57.50 55.22 1dwb n TRP 60 Cb 0.00 -0.16 -0.00 0.00 -2.01 0.00 0.00 31.31 29.13 1dwb n TRP 60 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1dwb n ASP 60 N -0.48 -4.45 -4.60 -0.99 -0.08 -1.19 -4.91 116.55 99.84 1dwb n ASP 60 Ca 0.11 0.08 -0.42 0.00 -1.51 0.00 0.00 54.79 53.05 1dwb n ASP 60 Cb 0.82 -3.74 -0.06 0.00 2.34 0.00 0.00 41.12 40.48 1dwb n ASP 60 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1dwb s LYS 60 N -5.15 3.86 -0.47 -0.67 2.20 -0.56 -4.97 119.74 113.98 1dwb s LYS 60 Ca 0.05 0.36 0.06 0.00 -0.36 0.00 0.00 55.97 56.08 1dwb s LYS 60 Cb -0.02 -3.75 0.23 0.00 -1.51 0.00 0.00 37.83 32.77 1dwb s LYS 60 CO 0.06 -0.68 0.75 -1.71 -0.36 0.00 0.00 175.35 173.41 1dwb n ASN 60 N 6.10 -2.28 -4.77 1.43 2.85 -1.24 -1.03 115.26 116.32 1dwb n ASN 60 Ca 0.01 -3.06 -0.36 0.00 -0.11 0.00 0.00 54.58 51.07 1dwb n ASN 60 Cb 0.48 1.20 0.00 0.00 1.24 0.00 0.00 39.78 42.71 1dwb n ASN 60 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1dwb s PHE 60 N 0.34 2.67 0.28 1.20 0.08 -0.36 -5.01 117.98 117.17 1dwb s PHE 60 Ca 0.32 1.54 0.09 0.00 0.12 0.00 0.00 56.93 58.99 1dwb s PHE 60 Cb 0.16 -3.33 -0.06 0.00 -0.57 0.00 0.00 43.02 39.22 1dwb s PHE 60 CO -0.18 -1.65 -0.11 0.95 -0.10 0.00 0.00 175.22 174.13 1dwb s THR 60 N -1.71 1.96 0.55 0.64 -4.23 -1.26 -4.90 115.64 106.70 1dwb s THR 60 Ca 0.72 -2.22 0.42 0.00 -1.18 0.00 0.00 61.69 59.43 1dwb s THR 60 Cb -0.26 -2.39 0.62 0.00 1.34 0.00 0.00 72.50 71.82 1dwb s THR 60 CO 0.29 -0.35 1.70 -0.33 -0.54 0.00 0.00 174.62 175.39 1dwb h GLU 61 N 2.27 0.00 0.00 3.99 3.07 -1.95 -0.36 114.58 121.59 1dwb h GLU 61 Ca -0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.46 1dwb h GLU 61 Cb 1.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 1dwb h GLU 61 CO 0.66 0.00 -0.71 0.09 -1.40 0.00 0.00 179.01 177.65 1dwb n ASN 62 N -4.04 0.61 0.11 1.42 3.02 -1.26 -4.03 115.26 111.09 1dwb n ASN 62 Ca 0.33 -0.17 0.13 0.00 -0.03 0.00 0.00 54.58 54.84 1dwb n ASN 62 Cb 1.56 0.41 0.31 0.00 -0.61 0.00 0.00 39.78 41.45 1dwb n ASN 62 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1dwb h ASP 63 N 0.00 0.00 -1.70 6.41 3.32 -1.46 -3.47 116.42 119.52 1dwb h ASP 63 Ca 0.00 -0.05 -0.62 0.00 0.02 0.00 0.00 57.03 56.38 1dwb h ASP 63 Cb 0.63 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.06 1dwb h ASP 63 CO 0.00 0.03 -0.60 -0.76 -1.72 0.00 0.00 179.24 176.19 1dwb s LEU 64 N -4.67 2.89 0.07 1.55 1.02 -1.25 -2.24 118.68 116.05 1dwb s LEU 64 Ca 0.09 -1.30 0.02 0.00 0.02 0.00 0.00 54.13 52.96 1dwb s LEU 64 Cb 0.12 -0.99 -0.03 0.00 0.02 0.00 0.00 46.19 45.30 1dwb s LEU 64 CO 0.64 -0.42 -0.07 -0.76 0.02 0.00 0.00 176.35 175.76 1dwb s LEU 65 N -3.72 2.37 -0.14 1.79 1.43 0.10 -4.48 118.68 116.04 1dwb s LEU 65 Ca 0.35 -0.76 0.01 0.00 -1.03 0.00 0.00 54.13 52.70 1dwb s LEU 65 Cb 0.08 -0.11 0.02 0.00 0.03 0.00 0.00 46.19 46.20 1dwb s LEU 65 CO 0.18 -0.33 -0.17 -0.69 0.23 0.00 0.00 176.35 175.58 1dwb s VAL 66 N -2.44 1.70 -0.24 -1.59 1.01 -0.42 -0.79 120.40 117.63 1dwb s VAL 66 Ca 0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.23 1dwb s VAL 66 Cb -0.03 -1.55 0.03 0.00 0.00 0.00 0.00 36.38 34.82 1dwb s VAL 66 CO -0.02 0.48 -0.08 -0.13 0.00 0.00 0.00 175.10 175.35 1dwb s ARG 67 N 1.16 2.85 -0.09 2.72 0.52 -0.19 -0.13 118.95 125.80 1dwb s ARG 67 Ca -0.01 -0.96 -0.00 0.00 -0.52 0.00 0.00 55.73 54.24 1dwb s ARG 67 Cb -0.14 -2.92 -0.03 0.00 0.52 0.00 0.00 34.95 32.38 1dwb s ARG 67 CO -0.06 -0.37 -0.07 0.42 0.02 0.00 0.00 175.30 175.24 1dwb s ILE 68 N 1.31 3.72 0.00 1.52 1.01 -0.02 -0.70 121.20 128.04 1dwb s ILE 68 Ca 0.01 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.19 1dwb s ILE 68 Cb -0.16 -2.54 0.00 0.00 0.01 0.00 0.00 42.46 39.77 1dwb s ILE 68 CO -0.06 0.58 0.00 0.61 0.00 0.00 0.00 174.94 176.07 1dwb n GLY 69 N 2.51 0.83 3.90 6.18 0.00 -1.25 0.74 105.19 118.09 1dwb n GLY 69 Ca -0.18 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1dwb n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dwb s LYS 70 N -0.55 3.68 0.10 1.61 1.02 -1.26 -4.04 119.74 120.29 1dwb s LYS 70 Ca 0.00 0.15 0.00 0.00 0.02 0.00 0.00 55.97 56.14 1dwb s LYS 70 Cb 0.00 -2.57 0.00 0.00 -0.52 0.00 0.00 37.83 34.74 1dwb s LYS 70 CO 0.00 0.14 0.00 1.58 -0.92 0.00 0.00 175.35 176.15 1dwb n HIS 71 N -1.04 -0.35 -2.66 3.18 -0.00 -1.26 -4.91 115.22 108.18 1dwb n HIS 71 Ca -0.00 0.06 -0.37 0.00 -0.00 0.00 0.00 57.72 57.40 1dwb n HIS 71 Cb 0.54 0.10 -0.05 0.00 -0.00 0.00 0.00 29.99 30.58 1dwb n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1dwb s SER 72 N -5.61 7.15 0.00 0.26 0.15 -1.26 -0.02 113.70 114.37 1dwb s SER 72 Ca 0.00 1.96 -0.21 0.00 0.70 0.00 0.00 55.95 58.40 1dwb s SER 72 Cb 0.00 -2.59 -0.20 0.00 -1.71 0.00 0.00 66.02 61.52 1dwb s SER 72 CO 0.00 -0.21 1.17 -0.09 1.20 0.00 0.00 173.24 175.31 1dwb h ARG 73 N 3.06 0.33 0.00 5.44 2.43 -0.79 -3.39 114.38 121.47 1dwb h ARG 73 Ca -0.47 -0.28 -0.11 0.00 -0.81 0.00 0.00 59.98 58.31 1dwb h ARG 73 Cb 1.20 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.79 1dwb h ARG 73 CO 0.64 0.93 -1.88 0.25 -1.51 0.00 0.00 179.97 178.40 1dwb n THR 74 N -4.41 0.55 -1.16 0.20 -2.24 -1.26 -5.01 114.28 100.95 1dwb n THR 74 Ca -0.09 -0.61 -0.31 0.00 -2.27 0.00 0.00 64.05 60.77 1dwb n THR 74 Cb 0.52 -0.25 0.11 0.00 -2.10 0.00 0.00 70.33 68.61 1dwb n THR 74 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1dwb s ARG 75 N -3.19 1.92 -0.64 -0.78 0.52 -1.26 -4.99 118.95 110.53 1dwb s ARG 75 Ca -0.07 1.18 -0.05 0.00 -0.52 0.00 0.00 55.73 56.27 1dwb s ARG 75 Cb 0.11 -1.86 0.17 0.00 0.52 0.00 0.00 34.95 33.89 1dwb s ARG 75 CO 0.86 -1.89 0.47 -0.47 0.02 0.00 0.00 175.30 174.30 1dwb s TYR 76 N -2.87 3.47 -1.23 -0.53 5.04 -1.26 -4.95 117.35 115.02 1dwb s TYR 76 Ca 0.62 -2.56 -0.21 0.00 -2.44 0.00 0.00 57.07 52.49 1dwb s TYR 76 Cb -0.18 -3.31 -0.01 0.00 0.35 0.00 0.00 41.96 38.81 1dwb s TYR 76 CO 0.57 -0.88 1.83 -1.21 -1.34 0.00 0.00 175.55 174.52 1dwb s GLU 77 N 0.09 3.20 0.21 4.97 2.02 -1.26 -4.84 118.70 123.10 1dwb s GLU 77 Ca 0.16 -1.53 -0.13 0.00 0.02 0.00 0.00 54.97 53.49 1dwb s GLU 77 Cb -0.19 -5.38 0.24 0.00 0.10 0.00 0.00 34.13 28.90 1dwb s GLU 77 CO -0.04 -3.14 1.63 0.07 0.02 0.00 0.00 175.26 173.80 1dwb h ARG 77 N 8.78 0.00 0.00 1.61 -0.00 -1.94 0.03 114.38 122.87 1dwb h ARG 77 Ca 0.32 -0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 60.29 1dwb h ARG 77 Cb 0.91 -0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 30.88 1dwb h ARG 77 CO 1.34 0.00 -0.05 -2.95 -0.00 0.00 0.00 179.97 178.31 1dwb h ASN 78 N 0.01 0.00 0.00 0.08 -1.07 -2.03 -3.41 115.58 109.16 1dwb h ASN 78 Ca 0.30 0.00 -0.22 0.00 0.07 0.00 0.00 56.30 56.45 1dwb h ASN 78 Cb 0.47 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.68 1dwb h ASN 78 CO -0.64 0.05 -1.78 -0.38 0.07 0.00 0.00 177.43 174.74 1dwb n ILE 79 N -3.11 0.77 -1.62 6.14 5.41 -0.88 -5.06 119.36 121.01 1dwb n ILE 79 Ca 0.04 -0.23 -0.30 0.00 1.00 0.00 0.00 62.75 63.25 1dwb n ILE 79 Cb 0.54 -1.42 0.06 0.00 -0.71 0.00 0.00 39.64 38.11 1dwb n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1dwb s GLU 80 N -2.26 2.66 -0.09 0.38 -1.05 -0.06 -4.77 118.70 113.52 1dwb s GLU 80 Ca -0.19 0.77 0.00 0.00 -0.15 0.00 0.00 54.97 55.40 1dwb s GLU 80 Cb 0.06 -1.97 0.02 0.00 -0.44 0.00 0.00 34.13 31.80 1dwb s GLU 80 CO 0.27 -1.25 -0.07 0.15 0.95 0.00 0.00 175.26 175.31 1dwb s LYS 81 N -5.13 1.33 -0.40 -4.83 3.01 0.23 -4.87 119.74 109.08 1dwb s LYS 81 Ca 0.59 -0.22 -0.15 0.00 -1.01 0.00 0.00 55.97 55.18 1dwb s LYS 81 Cb -0.14 -1.34 0.01 0.00 -1.01 0.00 0.00 37.83 35.36 1dwb s LYS 81 CO 0.54 -0.17 0.30 0.42 0.51 0.00 0.00 175.35 176.95 1dwb s ILE 82 N 1.38 5.25 0.11 2.17 1.01 -1.26 -0.84 121.20 129.02 1dwb s ILE 82 Ca -0.02 -0.56 0.06 0.00 0.00 0.00 0.00 60.65 60.13 1dwb s ILE 82 Cb -0.14 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.39 1dwb s ILE 82 CO -0.04 -0.27 -0.04 -0.44 0.00 0.00 0.00 174.94 174.16 1dwb s SER 83 N 1.70 4.75 0.02 3.58 0.01 0.81 -4.96 113.70 119.61 1dwb s SER 83 Ca 0.06 -0.30 -0.01 0.00 1.31 0.00 0.00 55.95 57.01 1dwb s SER 83 Cb -0.19 -1.03 -0.04 0.00 0.21 0.00 0.00 66.02 64.98 1dwb s SER 83 CO 0.10 0.16 0.14 -0.04 0.41 0.00 0.00 173.24 174.01 1dwb s MET 84 N -2.42 3.22 0.20 12.44 -1.94 -1.26 -1.30 119.30 128.23 1dwb s MET 84 Ca 0.25 -0.46 -0.29 0.00 -1.71 0.00 0.00 55.69 53.48 1dwb s MET 84 Cb -0.11 -2.95 -0.08 0.00 2.01 0.00 0.00 34.83 33.70 1dwb s MET 84 CO 0.17 0.64 0.92 -0.51 -0.01 0.00 0.00 175.02 176.22 1dwb s LEU 85 N -2.04 4.60 -0.22 -0.03 1.43 -1.26 -1.89 118.68 119.27 1dwb s LEU 85 Ca 0.27 1.86 0.10 0.00 -1.03 0.00 0.00 54.13 55.34 1dwb s LEU 85 Cb -0.12 -3.55 -0.22 0.00 0.03 0.00 0.00 46.19 42.33 1dwb s LEU 85 CO 0.19 0.11 -0.02 1.21 0.23 0.00 0.00 176.35 178.07 1dwb n GLU 86 N 1.82 0.67 -3.61 1.70 2.13 0.65 -4.72 120.64 119.29 1dwb n GLU 86 Ca -0.02 0.08 -0.11 0.00 0.66 0.00 0.00 57.16 57.77 1dwb n GLU 86 Cb 0.48 -1.54 -0.06 0.00 0.27 0.00 0.00 31.44 30.59 1dwb n GLU 86 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1dwb s LYS 87 N -2.51 0.62 -0.06 5.31 2.47 -1.17 -4.98 119.74 119.42 1dwb s LYS 87 Ca -0.21 0.47 0.04 0.00 -1.56 0.00 0.00 55.97 54.71 1dwb s LYS 87 Cb 0.07 0.30 -0.02 0.00 -1.46 0.00 0.00 37.83 36.72 1dwb s LYS 87 CO 0.73 -0.13 -0.18 0.42 0.16 0.00 0.00 175.35 176.35 1dwb s ILE 88 N -0.30 2.74 -0.16 5.43 1.01 -1.26 -0.24 121.20 128.41 1dwb s ILE 88 Ca -0.00 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.82 1dwb s ILE 88 Cb -0.03 -2.06 0.03 0.00 0.01 0.00 0.00 42.46 40.41 1dwb s ILE 88 CO -0.01 0.57 -0.11 -0.31 0.00 0.00 0.00 174.94 175.08 1dwb s TYR 89 N -0.42 2.11 -0.08 3.97 1.51 0.27 -5.01 117.35 119.69 1dwb s TYR 89 Ca 0.05 -1.26 -0.04 0.00 -1.01 0.00 0.00 57.07 54.81 1dwb s TYR 89 Cb -0.12 -1.53 -0.04 0.00 -0.11 0.00 0.00 41.96 40.16 1dwb s TYR 89 CO 0.02 -0.67 0.08 0.42 -1.11 0.00 0.00 175.55 174.29 1dwb s ILE 90 N 1.50 4.90 0.08 2.71 1.01 -1.26 -0.83 121.20 129.32 1dwb s ILE 90 Ca 0.03 -0.10 -0.32 0.00 0.00 0.00 0.00 60.65 60.25 1dwb s ILE 90 Cb -0.14 -3.14 -0.12 0.00 0.01 0.00 0.00 42.46 39.08 1dwb s ILE 90 CO -0.09 0.55 1.80 1.57 0.00 0.00 0.00 174.94 178.77 1dwb n HIS 91 N 1.84 2.48 -0.02 3.97 -0.00 -1.10 -4.82 115.22 117.57 1dwb n HIS 91 Ca -0.18 -0.04 0.22 0.00 -0.00 0.00 0.00 57.72 57.72 1dwb n HIS 91 Cb 0.54 -2.68 0.72 0.00 -0.00 0.00 0.00 29.99 28.57 1dwb n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1dwb h PRO 92 N 8.26 0.00 -0.64 1.57 0.13 -1.94 -1.35 132.00 138.04 1dwb h PRO 92 Ca -0.47 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.38 1dwb h PRO 92 Cb 1.24 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.20 1dwb h PRO 92 CO 0.94 0.00 0.24 0.54 -0.23 0.00 0.00 178.00 179.49 1dwb n ARG 93 N -4.14 2.49 -1.88 0.86 3.00 -1.26 -4.97 116.66 110.76 1dwb n ARG 93 Ca 0.11 -3.08 -0.42 0.00 -0.01 0.00 0.00 57.85 54.45 1dwb n ARG 93 Cb 0.70 -2.02 -0.03 0.00 0.00 0.00 0.00 32.46 31.11 1dwb n ARG 93 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.63 177.16 1dwb s TYR 94 N -3.17 1.70 -0.98 -1.55 5.04 -0.51 -4.73 117.35 113.16 1dwb s TYR 94 Ca 0.51 0.06 -0.08 0.00 -2.44 0.00 0.00 57.07 55.11 1dwb s TYR 94 Cb 0.43 -4.03 0.25 0.00 0.35 0.00 0.00 41.96 38.96 1dwb s TYR 94 CO 0.07 -4.30 0.93 1.21 -1.34 0.00 0.00 175.55 172.12 1dwb s ASN 95 N 4.23 6.81 0.00 4.32 2.47 -0.63 -4.86 114.94 127.27 1dwb s ASN 95 Ca 0.80 -3.38 0.28 0.00 0.42 0.00 0.00 52.86 50.98 1dwb s ASN 95 Cb -0.35 -2.13 1.24 0.00 -1.45 0.00 0.00 41.25 38.56 1dwb s ASN 95 CO 0.34 -0.33 1.91 -2.67 -3.72 0.00 0.00 177.10 172.62 1dwb n TRP 96 N 2.95 0.00 0.13 0.43 4.27 -1.26 0.11 117.44 124.08 1dwb n TRP 96 Ca 0.20 0.00 -0.24 0.00 -3.89 0.00 0.00 57.50 53.57 1dwb n TRP 96 Cb 0.40 -0.45 -0.16 0.00 -1.36 0.00 0.00 31.31 29.75 1dwb n TRP 96 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1dwb h ARG 97 N 0.00 0.50 0.00 -2.67 3.08 -2.00 -3.44 114.38 109.85 1dwb h ARG 97 Ca 0.00 -0.85 -0.07 0.00 0.07 0.00 0.00 59.98 59.13 1dwb h ARG 97 Cb 0.42 0.32 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 1dwb h ARG 97 CO 0.00 1.41 -1.26 -0.85 -1.07 0.00 0.00 179.97 178.20 1dwb n GLU 97 N -3.68 0.11 0.00 0.04 0.28 -1.24 -4.94 120.64 111.21 1dwb n GLU 97 Ca -0.18 0.03 0.00 0.00 -0.16 0.00 0.00 57.16 56.84 1dwb n GLU 97 Cb 1.10 -1.08 0.00 0.00 1.43 0.00 0.00 31.44 32.89 1dwb n GLU 97 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1dwb n ASN 98 N -2.65 0.00 -2.43 -1.84 6.94 -1.21 -4.79 115.26 109.29 1dwb n ASN 98 Ca -0.08 -1.00 -0.14 0.00 -0.02 0.00 0.00 54.58 53.34 1dwb n ASN 98 Cb 0.59 0.00 0.05 0.00 -2.36 0.00 0.00 39.78 38.06 1dwb n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1dwb n LEU 99 N 0.00 -2.93 -4.77 -4.53 4.77 0.31 -4.94 117.00 104.91 1dwb n LEU 99 Ca 0.00 -0.34 -0.38 0.00 -0.03 0.00 0.00 56.01 55.26 1dwb n LEU 99 Cb 0.32 -2.08 -0.04 0.00 -2.33 0.00 0.00 43.42 39.29 1dwb n LEU 99 CO 0.00 0.38 0.74 -0.62 -1.33 0.00 0.00 177.39 176.57 1dwb s ASP 100 N -3.30 7.01 -1.20 -1.43 2.15 -1.19 -3.37 116.67 115.36 1dwb s ASP 100 Ca 0.31 2.10 -0.01 0.00 0.43 0.00 0.00 52.55 55.37 1dwb s ASP 100 Cb -0.14 -2.60 -0.01 0.00 -0.30 0.00 0.00 42.92 39.87 1dwb s ASP 100 CO 0.45 -0.31 0.92 0.54 -0.17 0.00 0.00 175.17 176.60 1dwb n ARG 101 N 0.48 -5.49 -2.06 4.34 1.74 -1.26 -1.61 116.66 112.80 1dwb n ARG 101 Ca 0.02 0.80 -0.42 0.00 -0.77 0.00 0.00 57.85 57.48 1dwb n ARG 101 Cb 0.48 -5.69 0.00 0.00 -1.02 0.00 0.00 32.46 26.23 1dwb n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1dwb n ASP 102 N -3.12 4.37 -4.09 0.55 2.03 -1.22 -4.35 116.55 110.72 1dwb n ASP 102 Ca -0.25 -2.92 -0.11 0.00 0.52 0.00 0.00 54.79 52.03 1dwb n ASP 102 Cb 0.66 -1.63 -0.11 0.00 -0.72 0.00 0.00 41.12 39.32 1dwb n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1dwb s ILE 103 N 2.69 0.52 -0.20 5.18 2.07 -1.26 -3.33 121.20 126.87 1dwb s ILE 103 Ca 0.46 -1.39 -0.27 0.00 -1.41 0.00 0.00 60.65 58.04 1dwb s ILE 103 Cb 0.11 -0.99 0.10 0.00 0.13 0.00 0.00 42.46 41.81 1dwb s ILE 103 CO -0.04 -0.60 0.89 0.00 -1.91 0.00 0.00 174.94 173.29 1dwb s ALA 104 N -2.30 -1.88 0.16 1.50 0.00 -0.45 -2.71 121.76 116.08 1dwb s ALA 104 Ca -0.02 1.73 0.08 0.00 0.00 0.00 0.00 51.96 53.74 1dwb s ALA 104 Cb -0.04 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 1dwb s ALA 104 CO -0.02 -0.30 -0.05 -0.51 0.00 0.00 0.00 175.76 174.88 1dwb s LEU 105 N -0.35 3.15 -0.05 0.00 1.43 -0.01 -0.95 118.68 121.92 1dwb s LEU 105 Ca -0.01 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.66 1dwb s LEU 105 Cb -0.03 -1.85 0.01 0.00 0.03 0.00 0.00 46.19 44.36 1dwb s LEU 105 CO 0.00 0.11 -0.09 -0.04 0.23 0.00 0.00 176.35 176.57 1dwb s MET 106 N -2.74 1.19 -0.33 1.70 -1.94 -0.02 -0.57 119.30 116.59 1dwb s MET 106 Ca 0.25 -0.29 -0.14 0.00 -1.71 0.00 0.00 55.69 53.81 1dwb s MET 106 Cb -0.10 -1.06 -0.02 0.00 2.01 0.00 0.00 34.83 35.66 1dwb s MET 106 CO 0.17 0.03 0.32 0.21 -0.01 0.00 0.00 175.02 175.73 1dwb s LYS 107 N 0.57 3.62 0.46 2.03 2.20 0.67 -1.76 119.74 127.53 1dwb s LYS 107 Ca -0.10 -0.42 -0.24 0.00 -0.36 0.00 0.00 55.97 54.85 1dwb s LYS 107 Cb -0.13 -3.78 -0.07 0.00 -1.51 0.00 0.00 37.83 32.34 1dwb s LYS 107 CO 0.02 -0.46 1.26 -0.51 -0.36 0.00 0.00 175.35 175.30 1dwb s LEU 108 N 1.93 4.05 0.27 5.43 1.43 0.52 -0.25 118.68 132.05 1dwb s LEU 108 Ca 0.10 2.53 -0.03 0.00 -1.03 0.00 0.00 54.13 55.70 1dwb s LEU 108 Cb -0.17 -4.13 0.34 0.00 0.03 0.00 0.00 46.19 42.27 1dwb s LEU 108 CO 0.11 -1.04 1.86 0.11 0.23 0.00 0.00 176.35 177.62 1dwb h LYS 109 N 2.14 1.02 -3.89 1.70 1.57 -1.66 -3.42 116.57 114.02 1dwb h LYS 109 Ca -0.50 -0.15 -0.23 0.00 -1.87 0.00 0.00 60.65 57.90 1dwb h LYS 109 Cb 1.26 -0.18 -0.26 0.00 0.08 0.00 0.00 32.23 33.12 1dwb h LYS 109 CO 0.60 0.81 -0.72 0.15 -0.57 0.00 0.00 179.45 179.72 1dwb s LYS 110 N -5.53 0.14 0.65 3.15 1.02 -1.26 -5.00 119.74 112.91 1dwb s LYS 110 Ca -0.11 -0.17 -0.18 0.00 0.02 0.00 0.00 55.97 55.53 1dwb s LYS 110 Cb 0.16 -0.05 -0.01 0.00 -0.52 0.00 0.00 37.83 37.41 1dwb s LYS 110 CO 0.81 0.01 1.16 -2.30 -0.92 0.00 0.00 175.35 174.11 1dwb n PRO 111 N 2.72 0.94 -4.04 -1.68 -0.01 -1.26 -4.89 135.00 126.78 1dwb n PRO 111 Ca -0.15 0.37 -0.32 0.00 -0.01 0.00 0.00 63.50 63.40 1dwb n PRO 111 Cb 0.59 -2.39 -0.06 0.00 -0.01 0.00 0.00 33.50 31.62 1dwb n PRO 111 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 175.50 176.03 1dwb s VAL 112 N -1.50 4.79 -0.23 -1.45 0.11 0.53 -5.01 120.40 117.64 1dwb s VAL 112 Ca 0.80 -0.55 -0.20 0.00 -2.93 0.00 0.00 61.98 59.09 1dwb s VAL 112 Cb -0.38 -3.27 -0.02 0.00 -1.53 0.00 0.00 36.38 31.18 1dwb s VAL 112 CO 0.43 0.21 0.62 0.00 -3.33 0.00 0.00 175.10 173.03 1dwb s ALA 113 N -1.34 3.58 0.82 1.54 0.00 -1.26 -4.81 121.76 120.30 1dwb s ALA 113 Ca 0.28 -0.38 -0.12 0.00 0.00 0.00 0.00 51.96 51.74 1dwb s ALA 113 Cb -0.12 -2.98 0.09 0.00 0.00 0.00 0.00 23.12 20.10 1dwb s ALA 113 CO 0.20 -0.68 1.18 -0.06 0.00 0.00 0.00 175.76 176.40 1dwb s PHE 114 N 2.20 1.84 0.00 0.00 0.08 -1.26 -4.88 117.98 115.95 1dwb s PHE 114 Ca 0.27 1.69 0.00 0.00 0.12 0.00 0.00 56.93 59.01 1dwb s PHE 114 Cb -0.16 -3.41 0.00 0.00 -0.57 0.00 0.00 43.02 38.88 1dwb s PHE 114 CO 0.09 -2.72 0.00 -1.13 -0.10 0.00 0.00 175.22 171.36 1dwb n SER 115 N -3.50 0.00 0.14 1.36 3.41 0.20 -4.90 113.62 110.34 1dwb n SER 115 Ca 0.13 -0.12 0.13 0.00 -0.26 0.00 0.00 58.87 58.75 1dwb n SER 115 Cb 0.51 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.83 1dwb n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1dwb h ASP 116 N 0.00 0.00 0.00 4.04 3.32 -1.99 -3.23 116.42 118.56 1dwb h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1dwb h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1dwb h ASP 116 CO 0.00 0.00 -1.22 -1.22 -1.72 0.00 0.00 179.24 175.08 1dwb n TYR 117 N -2.49 0.00 -3.95 4.55 4.01 -1.26 -4.80 117.16 113.22 1dwb n TYR 117 Ca 0.05 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.48 1dwb n TYR 117 Cb 0.43 -0.18 -0.15 0.00 -0.31 0.00 0.00 39.34 39.13 1dwb n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1dwb s ILE 118 N -2.55 1.61 -0.16 -0.72 1.01 -1.22 -4.38 121.20 114.79 1dwb s ILE 118 Ca -0.02 -1.29 -0.13 0.00 0.00 0.00 0.00 60.65 59.22 1dwb s ILE 118 Cb 0.07 -1.87 0.05 0.00 0.01 0.00 0.00 42.46 40.72 1dwb s ILE 118 CO 0.45 -0.10 0.41 -2.28 0.00 0.00 0.00 174.94 173.42 1dwb s HIS 119 N 1.35 -0.50 0.61 3.97 2.46 -0.83 0.62 115.29 122.97 1dwb s HIS 119 Ca -0.06 1.15 -0.17 0.00 0.47 0.00 0.00 55.06 56.46 1dwb s HIS 119 Cb -0.19 0.19 -0.03 0.00 -0.13 0.00 0.00 32.58 32.42 1dwb s HIS 119 CO -0.06 -0.26 1.11 -1.25 -2.47 0.00 0.00 174.74 171.81 1dwb s PRO 120 N 0.59 3.09 0.25 2.88 0.04 -1.26 -2.27 135.00 138.33 1dwb s PRO 120 Ca -0.03 1.45 0.04 0.00 0.04 0.00 0.00 61.00 62.50 1dwb s PRO 120 Cb -0.05 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1dwb s PRO 120 CO -0.04 -1.03 0.39 0.54 0.04 0.00 0.00 177.00 176.90 1dwb s VAL 121 N -2.14 5.23 0.25 -0.36 0.11 -0.62 -4.89 120.40 117.98 1dwb s VAL 121 Ca 0.69 -0.87 -0.02 0.00 -2.93 0.00 0.00 61.98 58.85 1dwb s VAL 121 Cb -0.21 -3.85 -0.05 0.00 -1.53 0.00 0.00 36.38 30.74 1dwb s VAL 121 CO 0.35 -0.36 0.47 0.00 -3.33 0.00 0.00 175.10 172.24 1dwb s LEU 123 N -3.51 4.38 0.62 0.00 1.43 -1.26 -0.77 118.68 119.57 1dwb s LEU 123 Ca 0.41 0.48 -0.14 0.00 -1.03 0.00 0.00 54.13 53.84 1dwb s LEU 123 Cb -0.11 -2.44 -0.02 0.00 0.03 0.00 0.00 46.19 43.65 1dwb s LEU 123 CO 0.30 0.32 1.06 -2.16 0.23 0.00 0.00 176.35 176.09 1dwb s PRO 124 N -1.53 3.21 0.42 1.29 0.04 -1.26 -4.91 135.00 132.26 1dwb s PRO 124 Ca 0.23 1.14 0.08 0.00 0.04 0.00 0.00 61.00 62.48 1dwb s PRO 124 Cb -0.13 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 1dwb s PRO 124 CO 0.12 -0.89 0.34 0.16 0.04 0.00 0.00 177.00 176.78 1dwb s ASP 125 N -3.06 4.92 0.17 6.66 1.47 -1.26 -4.98 116.67 120.59 1dwb s ASP 125 Ca 0.62 -0.83 -0.19 0.00 1.18 0.00 0.00 52.55 53.34 1dwb s ASP 125 Cb -0.15 -0.52 0.10 0.00 -0.34 0.00 0.00 42.92 42.00 1dwb s ASP 125 CO 0.42 -0.65 1.64 -0.09 0.68 0.00 0.00 175.17 177.17 1dwb h ARG 126 N 1.09 -0.11 -0.39 2.11 2.43 -1.98 -2.76 114.38 114.78 1dwb h ARG 126 Ca -0.41 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 58.71 1dwb h ARG 126 Cb 1.26 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1dwb h ARG 126 CO 0.60 -0.07 0.03 0.93 -1.51 0.00 0.00 179.97 179.95 1dwb h GLU 127 N -0.11 0.66 0.00 0.20 5.08 -2.05 -0.98 114.58 117.39 1dwb h GLU 127 Ca 0.20 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1dwb h GLU 127 Cb 0.41 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1dwb h GLU 127 CO -0.47 0.73 0.00 2.41 -1.00 0.00 0.00 179.01 180.68 1dwb n THR 128 N -4.50 0.00 0.00 1.13 -1.04 -1.04 -0.99 114.28 107.83 1dwb n THR 128 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1dwb n THR 128 Cb 0.26 -0.18 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 1dwb n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dwb n ALA 129 N 0.12 0.00 0.72 2.41 0.00 -0.37 -0.98 120.51 122.42 1dwb n ALA 129 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1dwb n ALA 129 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1dwb n ALA 129 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1dwb n SER 129 N 0.00 0.83 -0.07 0.00 3.41 -0.16 -4.51 113.62 113.12 1dwb n SER 129 Ca 0.00 -0.79 -0.14 0.00 -0.26 0.00 0.00 58.87 57.68 1dwb n SER 129 Cb 0.00 1.12 -0.14 0.00 -0.26 0.00 0.00 64.21 64.93 1dwb n SER 129 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1dwb n LEU 129 N -1.52 1.46 -3.70 1.04 4.77 -0.15 -4.62 117.00 114.28 1dwb n LEU 129 Ca 0.02 0.09 -0.42 0.00 -0.03 0.00 0.00 56.01 55.68 1dwb n LEU 129 Cb 0.31 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1dwb n LEU 129 CO 0.37 0.66 2.60 0.18 -1.33 0.00 0.00 177.39 179.86 1dwb n LEU 130 N -3.08 6.40 -4.09 2.23 4.77 -1.26 -4.87 117.00 117.10 1dwb n LEU 130 Ca -0.33 -3.92 -0.23 0.00 -0.03 0.00 0.00 56.01 51.51 1dwb n LEU 130 Cb 1.07 -1.56 -0.15 0.00 -2.33 0.00 0.00 43.42 40.45 1dwb n LEU 130 CO 0.39 0.86 -0.47 -1.10 -1.33 0.00 0.00 177.39 175.74 1dwb s GLN 131 N 3.50 1.27 0.22 3.23 -0.21 -1.26 -4.95 119.66 121.46 1dwb s GLN 131 Ca 0.49 -0.49 -0.31 0.00 0.02 0.00 0.00 55.36 55.07 1dwb s GLN 131 Cb 0.14 -1.18 -0.14 0.00 1.00 0.00 0.00 33.01 32.83 1dwb s GLN 131 CO -0.05 0.25 1.25 0.00 -2.12 0.00 0.00 175.29 174.62 1dwb n ALA 132 N 2.95 0.13 0.00 6.09 0.00 -1.26 -1.65 120.51 126.77 1dwb n ALA 132 Ca -0.16 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1dwb n ALA 132 Cb 0.54 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1dwb n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dwb n GLY 133 N 1.93 3.11 3.78 0.00 0.00 -0.55 -4.92 105.19 108.55 1dwb n GLY 133 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1dwb n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dwb s TYR 134 N -2.86 3.60 0.01 1.61 2.02 -0.66 -4.70 117.35 116.37 1dwb s TYR 134 Ca 0.00 1.75 -0.10 0.00 -0.37 0.00 0.00 57.07 58.35 1dwb s TYR 134 Cb 0.00 -2.95 -0.05 0.00 -0.40 0.00 0.00 41.96 38.55 1dwb s TYR 134 CO 0.00 0.05 0.33 0.15 -1.57 0.00 0.00 175.55 174.51 1dwb s LYS 135 N -2.21 3.71 0.54 -0.62 1.02 -1.26 -1.19 119.74 119.74 1dwb s LYS 135 Ca 0.52 0.13 0.03 0.00 0.02 0.00 0.00 55.97 56.67 1dwb s LYS 135 Cb -0.18 -3.10 0.02 0.00 -0.52 0.00 0.00 37.83 34.05 1dwb s LYS 135 CO 0.24 0.65 0.20 0.20 -0.92 0.00 0.00 175.35 175.71 1dwb s GLY 136 N -1.47 2.77 -0.04 -3.33 0.00 0.20 -4.83 107.32 100.62 1dwb s GLY 136 Ca 0.27 -0.57 -0.01 0.00 0.00 0.00 0.00 44.72 44.41 1dwb s GLY 136 CO 0.14 -2.10 0.02 -1.60 0.00 0.00 0.00 173.10 169.57 1dwb s ARG 137 N -4.10 0.21 0.05 2.90 3.52 -0.15 -1.64 118.95 119.74 1dwb s ARG 137 Ca 0.16 0.18 0.03 0.00 -0.13 0.00 0.00 55.73 55.97 1dwb s ARG 137 Cb -0.01 -0.56 -0.04 0.00 -1.56 0.00 0.00 34.95 32.78 1dwb s ARG 137 CO 0.10 -0.23 0.03 0.08 -0.81 0.00 0.00 175.30 174.47 1dwb s VAL 138 N 1.54 4.25 0.01 7.11 1.01 0.27 -2.14 120.40 132.45 1dwb s VAL 138 Ca -0.03 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.21 1dwb s VAL 138 Cb -0.13 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 1dwb s VAL 138 CO -0.03 0.23 -0.03 0.42 0.00 0.00 0.00 175.10 175.69 1dwb s THR 139 N -1.24 0.17 0.00 3.92 -4.23 -1.26 -1.13 115.64 111.87 1dwb s THR 139 Ca 0.24 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.26 1dwb s THR 139 Cb -0.12 -0.23 0.00 0.00 1.34 0.00 0.00 72.50 73.50 1dwb s THR 139 CO 0.16 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.64 1dwb n GLY 140 N 2.32 -0.90 0.29 3.99 0.00 -0.78 -4.56 105.19 105.55 1dwb n GLY 140 Ca -0.18 -1.02 0.05 0.00 0.00 0.00 0.00 46.02 44.88 1dwb n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dwb n TRP 141 N -0.09 0.24 -1.63 1.61 8.01 -1.26 -0.55 117.44 123.77 1dwb n TRP 141 Ca 0.00 -0.70 -0.29 0.00 -1.31 0.00 0.00 57.50 55.19 1dwb n TRP 141 Cb 0.00 -0.12 0.17 0.00 -2.01 0.00 0.00 31.31 29.35 1dwb n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1dwb s GLY 142 N -1.69 1.66 0.18 6.99 0.00 -1.26 -4.47 107.32 108.72 1dwb s GLY 142 Ca 0.20 -0.88 -0.31 0.00 0.00 0.00 0.00 44.72 43.73 1dwb s GLY 142 CO 0.05 -0.19 0.82 0.70 0.00 0.00 0.00 173.10 174.49 1dwb n ASN 143 N -3.92 -0.09 0.08 1.64 3.02 -0.39 -2.07 115.26 113.52 1dwb n ASN 143 Ca 0.11 1.15 0.12 0.00 -0.03 0.00 0.00 54.58 55.93 1dwb n ASN 143 Cb 0.60 -1.06 0.22 0.00 -0.61 0.00 0.00 39.78 38.92 1dwb n ASN 143 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1dwb h LEU 144 N 1.97 0.00 -7.61 3.41 3.38 -1.06 -0.78 115.31 114.63 1dwb h LEU 144 Ca -0.37 -0.15 -0.14 0.00 0.09 0.00 0.00 57.88 57.31 1dwb h LEU 144 Cb 1.40 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.94 1dwb h LEU 144 CO 0.62 0.08 -0.40 -0.54 0.09 0.00 0.00 178.44 178.28 1dwb s LYS 145 N -3.16 0.50 0.29 1.13 1.02 -1.26 -4.42 119.74 113.84 1dwb s LYS 145 Ca 0.07 -0.16 -0.02 0.00 0.02 0.00 0.00 55.97 55.88 1dwb s LYS 145 Cb 0.13 0.22 0.41 0.00 -0.52 0.00 0.00 37.83 38.06 1dwb s LYS 145 CO 0.70 -0.12 1.91 1.49 -0.92 0.00 0.00 175.35 178.41 1dwb h GLU 146 N 4.48 1.02 -3.76 1.68 4.81 -1.90 -3.45 114.58 117.46 1dwb h GLU 146 Ca -0.29 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 58.74 1dwb h GLU 146 Cb 1.19 -0.20 -0.12 0.00 0.63 0.00 0.00 28.75 30.25 1dwb h GLU 146 CO 0.39 0.75 -0.24 -0.08 -0.73 0.00 0.00 179.01 179.10 1dwb s THR 147 N -5.68 0.05 -0.10 0.32 -1.32 -1.26 -4.93 115.64 102.73 1dwb s THR 147 Ca -0.11 -1.27 -0.32 0.00 -1.21 0.00 0.00 61.69 58.78 1dwb s THR 147 Cb 0.17 -1.81 0.12 0.00 -1.51 0.00 0.00 72.50 69.47 1dwb s THR 147 CO 0.80 -0.25 1.05 -1.66 -2.21 0.00 0.00 174.62 172.35 1dwb s TRP 148 N -3.95 -0.24 -0.25 9.09 -2.14 -1.26 -5.10 118.94 115.07 1dwb s TRP 148 Ca 0.16 0.18 -0.28 0.00 2.66 0.00 0.00 56.10 58.81 1dwb s TRP 148 Cb 0.02 0.52 -0.03 0.00 -3.10 0.00 0.00 33.47 30.88 1dwb s TRP 148 CO -0.00 -0.37 1.92 0.99 -2.66 0.00 0.00 176.95 176.84 1dwb s THR 149 N -2.63 3.32 0.27 0.66 2.01 -1.26 -4.93 115.64 113.08 1dwb s THR 149 Ca 0.07 0.34 -0.29 0.00 0.31 0.00 0.00 61.69 62.12 1dwb s THR 149 Cb -0.01 -3.40 -0.14 0.00 0.01 0.00 0.00 72.50 68.95 1dwb s THR 149 CO -0.06 -0.23 1.00 0.00 -0.69 0.00 0.00 174.62 174.63 1dwb n ALA 149 N 10.33 -0.47 -0.18 7.40 0.00 -1.26 -1.84 120.51 134.48 1dwb n ALA 149 Ca 0.24 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.09 1dwb n ALA 149 Cb 0.46 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 17.91 1dwb n ALA 149 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1dwb n ASN 149 N 1.39 0.00 -3.90 0.00 3.02 -1.26 -4.83 115.26 109.69 1dwb n ASN 149 Ca 0.11 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.27 1dwb n ASN 149 Cb 0.31 -1.59 -0.02 0.00 -0.61 0.00 0.00 39.78 37.87 1dwb n ASN 149 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1dwb n VAL 149 N -2.00 4.40 0.00 2.41 0.31 -0.77 -4.95 118.33 117.73 1dwb n VAL 149 Ca 0.00 -5.67 0.00 0.00 -0.01 0.00 0.00 64.34 58.66 1dwb n VAL 149 Cb 0.00 -2.14 0.00 0.00 -0.91 0.00 0.00 33.84 30.79 1dwb n VAL 149 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1dwb n GLY 149 N 1.38 0.37 3.32 2.92 0.00 -1.26 -4.78 105.19 107.14 1dwb n GLY 149 Ca 0.26 -1.81 -0.01 0.00 0.00 0.00 0.00 46.02 44.47 1dwb n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dwb s LYS 149 N -0.77 0.52 0.42 1.61 -0.14 -1.26 -5.04 119.74 115.07 1dwb s LYS 149 Ca 0.00 1.12 0.29 0.00 -1.36 0.00 0.00 55.97 56.02 1dwb s LYS 149 Cb 0.00 0.53 1.45 0.00 -1.68 0.00 0.00 37.83 38.13 1dwb s LYS 149 CO 0.00 -0.42 1.88 0.78 -0.76 0.00 0.00 175.35 176.83 1dwb h GLY 150 N 8.04 0.00 -4.77 -3.33 0.00 -1.96 -3.44 103.07 97.61 1dwb h GLY 150 Ca -0.20 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.48 1dwb h GLY 150 CO 0.19 0.00 -0.62 1.20 0.00 0.00 0.00 176.54 177.31 1dwb s GLN 151 N -3.65 2.85 0.49 4.80 1.11 -1.26 -0.67 119.66 123.33 1dwb s GLN 151 Ca -0.01 -0.64 -0.16 0.00 0.01 0.00 0.00 55.36 54.55 1dwb s GLN 151 Cb 0.09 -2.71 -0.08 0.00 -1.01 0.00 0.00 33.01 29.29 1dwb s GLN 151 CO 0.34 0.60 0.95 -1.25 0.01 0.00 0.00 175.29 175.94 1dwb s PRO 152 N -1.99 3.97 0.08 2.91 0.04 -1.26 -4.98 135.00 133.77 1dwb s PRO 152 Ca 0.25 0.92 -0.04 0.00 0.04 0.00 0.00 61.00 62.17 1dwb s PRO 152 Cb -0.12 -2.17 -0.25 0.00 0.04 0.00 0.00 34.50 32.00 1dwb s PRO 152 CO 0.16 -0.21 1.17 0.77 0.04 0.00 0.00 177.00 178.93 1dwb h SER 153 N 1.11 0.44 -3.74 6.66 0.02 -1.96 -3.42 113.55 112.65 1dwb h SER 153 Ca -0.47 -0.45 -0.38 0.00 -0.84 0.00 0.00 61.79 59.65 1dwb h SER 153 Cb 1.18 -0.14 -0.14 0.00 0.14 0.00 0.00 62.40 63.44 1dwb h SER 153 CO 0.62 1.33 -0.68 0.68 -1.14 0.00 0.00 176.83 177.64 1dwb s VAL 154 N -2.75 1.21 0.15 2.27 -7.23 -1.26 -0.13 120.40 112.66 1dwb s VAL 154 Ca -0.04 -2.07 -0.34 0.00 -1.81 0.00 0.00 61.98 57.72 1dwb s VAL 154 Cb 0.07 -2.17 -0.15 0.00 0.56 0.00 0.00 36.38 34.69 1dwb s VAL 154 CO 0.88 -0.48 1.31 -0.11 -0.31 0.00 0.00 175.10 176.39 1dwb n LEU 155 N -0.36 1.99 -4.89 1.32 7.94 0.97 -4.81 117.00 119.16 1dwb n LEU 155 Ca -0.07 1.13 -0.28 0.00 -1.11 0.00 0.00 56.01 55.67 1dwb n LEU 155 Cb 0.62 -1.26 -0.04 0.00 0.53 0.00 0.00 43.42 43.27 1dwb n LEU 155 CO 0.35 -0.98 -0.16 -1.10 -1.11 0.00 0.00 177.39 174.40 1dwb s GLN 156 N 0.05 3.27 0.00 1.96 -1.52 0.29 -0.32 119.66 123.40 1dwb s GLN 156 Ca 0.77 -0.60 0.00 0.00 -1.95 0.00 0.00 55.36 53.58 1dwb s GLN 156 Cb -0.83 -2.91 -0.00 0.00 -0.22 0.00 0.00 33.01 29.05 1dwb s GLN 156 CO 0.48 0.55 -0.01 0.54 -0.25 0.00 0.00 175.29 176.60 1dwb s VAL 157 N -1.61 0.10 -0.07 1.09 0.11 0.56 -1.87 120.40 118.71 1dwb s VAL 157 Ca 0.33 -0.12 -0.08 0.00 -2.93 0.00 0.00 61.98 59.19 1dwb s VAL 157 Cb -0.12 -0.11 0.02 0.00 -1.53 0.00 0.00 36.38 34.64 1dwb s VAL 157 CO 0.27 -0.01 0.21 0.54 -3.33 0.00 0.00 175.10 172.77 1dwb s VAL 158 N -0.14 0.01 -0.27 2.04 0.11 -0.28 -1.70 120.40 120.16 1dwb s VAL 158 Ca -0.01 -0.05 -0.07 0.00 -2.93 0.00 0.00 61.98 58.92 1dwb s VAL 158 Cb -0.01 -0.32 -0.01 0.00 -1.53 0.00 0.00 36.38 34.52 1dwb s VAL 158 CO -0.00 -0.03 0.06 0.20 -3.33 0.00 0.00 175.10 172.00 1dwb s ASN 159 N -0.01 5.04 0.10 3.54 0.01 -1.26 0.96 114.94 123.32 1dwb s ASN 159 Ca -0.01 -0.51 0.09 0.00 -0.71 0.00 0.00 52.86 51.72 1dwb s ASN 159 Cb -0.02 -1.88 -0.03 0.00 0.41 0.00 0.00 41.25 39.73 1dwb s ASN 159 CO 0.00 -0.12 -0.23 -0.76 -1.51 0.00 0.00 177.10 174.48 1dwb s LEU 160 N 1.54 2.28 0.45 0.60 1.43 -0.65 -4.89 118.68 119.43 1dwb s LEU 160 Ca 0.04 -0.68 -0.06 0.00 -1.03 0.00 0.00 54.13 52.40 1dwb s LEU 160 Cb -0.16 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 1dwb s LEU 160 CO 0.02 0.11 0.77 -2.16 0.23 0.00 0.00 176.35 175.32 1dwb s PRO 161 N -1.82 3.60 0.12 1.29 0.04 -1.26 0.58 135.00 137.55 1dwb s PRO 161 Ca 0.09 0.25 -0.25 0.00 0.04 0.00 0.00 61.00 61.13 1dwb s PRO 161 Cb -0.10 -2.40 -0.07 0.00 0.04 0.00 0.00 34.50 31.97 1dwb s PRO 161 CO 0.04 -0.14 0.76 0.42 0.04 0.00 0.00 177.00 178.13 1dwb s ILE 162 N -2.61 4.50 -0.01 0.56 1.01 -0.34 -0.72 121.20 123.59 1dwb s ILE 162 Ca 0.48 1.66 -0.02 0.00 0.00 0.00 0.00 60.65 62.77 1dwb s ILE 162 Cb -0.10 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 1dwb s ILE 162 CO 0.41 0.47 0.12 -0.69 0.00 0.00 0.00 174.94 175.25 1dwb s VAL 163 N -0.79 5.05 0.14 2.92 1.01 -0.47 -1.48 120.40 126.77 1dwb s VAL 163 Ca 0.36 -0.27 -0.31 0.00 0.00 0.00 0.00 61.98 61.76 1dwb s VAL 163 Cb -0.22 -3.32 -0.11 0.00 0.00 0.00 0.00 36.38 32.73 1dwb s VAL 163 CO 0.25 0.36 1.83 -0.62 0.00 0.00 0.00 175.10 176.92 1dwb n GLU 164 N 1.15 2.82 -0.30 2.72 4.71 -1.26 -4.55 120.64 125.93 1dwb n GLU 164 Ca -0.13 1.02 -0.03 0.00 -0.01 0.00 0.00 57.16 58.01 1dwb n GLU 164 Cb 0.53 -2.92 -0.01 0.00 -1.01 0.00 0.00 31.44 28.03 1dwb n GLU 164 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1dwb n ARG 165 N 5.48 -0.23 -0.24 3.49 1.74 -1.26 0.26 116.66 125.89 1dwb n ARG 165 Ca 0.18 1.15 0.05 0.00 -0.77 0.00 0.00 57.85 58.45 1dwb n ARG 165 Cb 0.37 -1.70 0.17 0.00 -1.02 0.00 0.00 32.46 30.29 1dwb n ARG 165 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1dwb h PRO 166 N 0.00 0.34 -0.52 5.56 0.13 -1.99 0.25 132.00 135.76 1dwb h PRO 166 Ca 0.21 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1dwb h PRO 166 Cb 0.40 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.43 1dwb h PRO 166 CO -0.73 0.22 0.32 0.28 -0.23 0.00 0.00 178.00 177.86 1dwb h VAL 167 N 0.35 1.15 0.02 1.56 2.07 -0.56 -1.30 116.25 119.54 1dwb h VAL 167 Ca 0.40 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1dwb h VAL 167 Cb 0.63 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1dwb h VAL 167 CO -0.44 0.15 -0.02 0.00 0.02 0.00 0.00 177.57 177.29 1dwb h LYS 169 N -0.04 0.49 -0.17 0.00 2.10 -0.41 0.12 116.57 118.67 1dwb h LYS 169 Ca 0.00 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1dwb h LYS 169 Cb 0.04 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.26 1dwb h LYS 169 CO -0.01 0.33 0.00 -0.25 -2.00 0.00 0.00 179.45 177.52 1dwb n ASP 170 N -4.95 0.17 -0.20 7.07 8.00 -0.51 -3.34 116.55 122.79 1dwb n ASP 170 Ca 0.14 -1.87 0.05 0.00 0.71 0.00 0.00 54.79 53.81 1dwb n ASP 170 Cb 0.38 -0.09 -0.01 0.00 -0.02 0.00 0.00 41.12 41.38 1dwb n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1dwb n SER 171 N -0.40 1.13 -4.04 -2.24 3.41 0.03 -5.00 113.62 106.51 1dwb n SER 171 Ca 0.00 -1.07 -0.10 0.00 -0.26 0.00 0.00 58.87 57.44 1dwb n SER 171 Cb 0.04 0.52 -0.11 0.00 -0.26 0.00 0.00 64.21 64.40 1dwb n SER 171 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1dwb s THR 172 N -1.40 0.33 -1.14 6.66 2.01 -1.21 -4.89 115.64 116.00 1dwb s THR 172 Ca 0.08 -1.14 0.27 0.00 0.31 0.00 0.00 61.69 61.20 1dwb s THR 172 Cb 0.08 -0.63 0.14 0.00 0.01 0.00 0.00 72.50 72.10 1dwb s THR 172 CO 0.26 -0.53 1.61 -2.11 -0.69 0.00 0.00 174.62 173.16 1dwb n ARG 173 N 1.27 0.15 -2.05 4.92 0.00 -1.26 -4.86 116.66 114.83 1dwb n ARG 173 Ca -0.22 -0.07 -0.33 0.00 -0.00 0.00 0.00 57.85 57.23 1dwb n ARG 173 Cb 0.56 -1.50 0.02 0.00 -0.00 0.00 0.00 32.46 31.54 1dwb n ARG 173 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1dwb s ILE 174 N -2.90 3.52 -0.58 8.89 1.01 -1.26 -4.99 121.20 124.89 1dwb s ILE 174 Ca 0.15 0.78 -0.23 0.00 0.00 0.00 0.00 60.65 61.34 1dwb s ILE 174 Cb 0.18 -3.29 0.05 0.00 0.01 0.00 0.00 42.46 39.42 1dwb s ILE 174 CO 0.62 -0.37 0.93 -0.60 0.00 0.00 0.00 174.94 175.52 1dwb s ARG 175 N -3.86 3.25 0.45 2.79 3.52 -1.26 -5.02 118.95 118.81 1dwb s ARG 175 Ca 0.67 -0.47 -0.12 0.00 -0.13 0.00 0.00 55.73 55.67 1dwb s ARG 175 Cb -0.19 -4.11 -0.07 0.00 -1.56 0.00 0.00 34.95 29.03 1dwb s ARG 175 CO 0.35 -1.58 0.84 0.96 -0.81 0.00 0.00 175.30 175.06 1dwb s ILE 176 N 3.92 4.72 0.52 4.11 -4.36 -1.26 -4.78 121.20 124.07 1dwb s ILE 176 Ca 0.27 0.77 0.00 0.00 -0.26 0.00 0.00 60.65 61.43 1dwb s ILE 176 Cb -0.14 -3.74 -0.00 0.00 1.25 0.00 0.00 42.46 39.82 1dwb s ILE 176 CO 0.16 -0.61 0.00 0.42 0.24 0.00 0.00 174.94 175.16 1dwb s THR 177 N -2.49 1.03 -1.90 8.37 -4.23 -1.26 -4.99 115.64 110.17 1dwb s THR 177 Ca 0.53 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 59.30 1dwb s THR 177 Cb -0.10 -2.05 0.70 0.00 1.34 0.00 0.00 72.50 72.38 1dwb s THR 177 CO 0.33 0.00 1.91 0.47 -0.54 0.00 0.00 174.62 176.79 1dwb n ASP 178 N -1.31 0.00 -0.98 3.99 9.92 -1.26 -2.29 116.55 124.62 1dwb n ASP 178 Ca -0.21 -0.70 0.10 0.00 -0.53 0.00 0.00 54.79 53.46 1dwb n ASP 178 Cb 0.67 -0.05 0.26 0.00 -0.64 0.00 0.00 41.12 41.36 1dwb n ASP 178 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1dwb n ASN 179 N -1.05 2.87 -4.30 -2.24 3.02 -1.26 -4.91 115.26 107.39 1dwb n ASN 179 Ca 0.18 -1.94 -0.19 0.00 -0.03 0.00 0.00 54.58 52.60 1dwb n ASN 179 Cb 0.11 -0.28 -0.10 0.00 -0.61 0.00 0.00 39.78 38.89 1dwb n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1dwb s MET 180 N -1.43 1.55 0.04 3.52 -1.94 -0.97 -0.27 119.30 119.79 1dwb s MET 180 Ca 0.37 -1.86 -0.28 0.00 -1.71 0.00 0.00 55.69 52.21 1dwb s MET 180 Cb 0.20 -0.46 0.07 0.00 2.01 0.00 0.00 34.83 36.65 1dwb s MET 180 CO 0.28 -0.30 0.65 -0.59 -0.01 0.00 0.00 175.02 175.05 1dwb s PHE 181 N -3.55 -0.61 0.25 -0.03 -0.12 -0.85 -4.77 117.98 108.30 1dwb s PHE 181 Ca 0.36 0.79 0.11 0.00 -0.05 0.00 0.00 56.93 58.15 1dwb s PHE 181 Cb 0.07 0.47 -0.05 0.00 -0.63 0.00 0.00 43.02 42.89 1dwb s PHE 181 CO 0.15 -0.71 -0.18 0.00 -0.05 0.00 0.00 175.22 174.43 1dwb s ALA 183 N -2.20 -0.26 0.00 0.00 0.00 -0.94 -1.37 121.76 116.98 1dwb s ALA 183 Ca 0.27 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1dwb s ALA 183 Cb -0.06 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.36 1dwb s ALA 183 CO 0.14 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1dwb n GLY 184 N 0.57 3.75 3.88 0.00 0.00 0.10 -2.06 105.19 111.44 1dwb n GLY 184 Ca -0.18 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 43.98 1dwb n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dwb s TYR 184 N -2.00 3.56 0.30 1.61 2.02 -1.26 -4.47 117.35 117.11 1dwb s TYR 184 Ca 0.00 1.13 0.01 0.00 -0.37 0.00 0.00 57.07 57.84 1dwb s TYR 184 Cb 0.00 -2.56 -0.03 0.00 -0.40 0.00 0.00 41.96 38.97 1dwb s TYR 184 CO 0.00 -0.43 0.49 0.15 -1.57 0.00 0.00 175.55 174.19 1dwb s LYS 185 N -4.70 3.49 0.37 -0.62 1.02 -1.26 -4.87 119.74 113.17 1dwb s LYS 185 Ca 0.53 -0.41 0.15 0.00 0.02 0.00 0.00 55.97 56.25 1dwb s LYS 185 Cb -0.11 -2.73 1.00 0.00 -0.52 0.00 0.00 37.83 35.48 1dwb s LYS 185 CO 0.45 0.24 1.78 -1.35 -0.92 0.00 0.00 175.35 175.55 1dwb h PRO 186 N 1.03 0.48 -0.10 -1.68 0.11 -1.97 0.43 132.00 130.30 1dwb h PRO 186 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1dwb h PRO 186 Cb 1.22 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1dwb h PRO 186 CO 0.62 0.32 0.00 -0.40 -0.21 0.00 0.00 178.00 178.33 1dwb n ASP 186 N -4.66 1.33 0.06 -2.05 5.75 -1.26 -4.12 116.55 111.60 1dwb n ASP 186 Ca 0.24 -1.59 0.13 0.00 -0.01 0.00 0.00 54.79 53.56 1dwb n ASP 186 Cb 0.77 -0.06 0.48 0.00 -1.03 0.00 0.00 41.12 41.28 1dwb n ASP 186 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1dwb n GLU 186 N 0.08 0.14 -1.01 0.11 1.02 0.15 -4.94 120.64 116.19 1dwb n GLU 186 Ca 0.17 0.18 -0.00 0.00 -0.02 0.00 0.00 57.16 57.48 1dwb n GLU 186 Cb 0.29 -1.68 -0.00 0.00 -0.02 0.00 0.00 31.44 30.03 1dwb n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dwb n GLY 186 N 1.05 0.29 3.22 0.62 0.00 -1.26 -4.95 105.19 104.16 1dwb n GLY 186 Ca 0.05 -0.02 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 1dwb n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dwb s LYS 186 N -1.05 1.06 0.33 1.61 1.02 -1.26 -5.18 119.74 116.27 1dwb s LYS 186 Ca 0.00 -1.51 0.06 0.00 0.02 0.00 0.00 55.97 54.54 1dwb s LYS 186 Cb 0.00 -0.13 -0.03 0.00 -0.52 0.00 0.00 37.83 37.15 1dwb s LYS 186 CO 0.00 -0.17 0.23 1.03 -0.92 0.00 0.00 175.35 175.52 1dwb s ARG 187 N -3.95 1.72 0.00 1.68 0.52 -1.26 -4.70 118.95 112.96 1dwb s ARG 187 Ca 0.24 -2.00 0.00 0.00 -0.52 0.00 0.00 55.73 53.45 1dwb s ARG 187 Cb 0.06 0.11 0.00 0.00 0.52 0.00 0.00 34.95 35.65 1dwb s ARG 187 CO 0.03 -0.58 0.00 0.41 0.02 0.00 0.00 175.30 175.19 1dwb n GLY 188 N -0.64 4.71 3.61 -3.53 0.00 -1.26 -4.90 105.19 103.18 1dwb n GLY 188 Ca 0.04 -1.01 -0.04 0.00 0.00 0.00 0.00 46.02 45.01 1dwb n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dwb s ASP 189 N 0.00 -0.19 0.75 1.61 2.15 -0.98 -4.68 116.67 115.33 1dwb s ASP 189 Ca 0.00 -0.13 -0.06 0.00 0.43 0.00 0.00 52.55 52.79 1dwb s ASP 189 Cb 0.00 0.29 0.11 0.00 -0.30 0.00 0.00 42.92 43.02 1dwb s ASP 189 CO 0.00 -0.51 1.05 0.00 -0.17 0.00 0.00 175.17 175.54 1dwb s ALA 190 N -2.81 3.22 0.36 3.66 0.00 -1.26 -0.16 121.76 124.76 1dwb s ALA 190 Ca 0.10 -1.30 -0.13 0.00 0.00 0.00 0.00 51.96 50.63 1dwb s ALA 190 Cb 0.00 -2.38 0.04 0.00 0.00 0.00 0.00 23.12 20.78 1dwb s ALA 190 CO -0.04 -1.55 0.69 0.00 0.00 0.00 0.00 175.76 174.86 1dwb n GLU 192 N -0.53 1.22 0.00 0.00 2.13 -1.26 -0.88 120.64 121.33 1dwb n GLU 192 Ca -0.05 0.44 0.00 0.00 0.66 0.00 0.00 57.16 58.21 1dwb n GLU 192 Cb 0.60 -2.12 0.00 0.00 0.27 0.00 0.00 31.44 30.20 1dwb n GLU 192 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1dwb n GLY 193 N 3.36 2.45 0.10 8.31 0.00 -1.26 -1.27 105.19 116.88 1dwb n GLY 193 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1dwb n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1dwb h ASP 194 N 0.37 0.00 -2.83 1.61 3.32 -1.36 -3.32 116.42 114.21 1dwb h ASP 194 Ca 0.00 -0.10 -0.59 0.00 0.02 0.00 0.00 57.03 56.36 1dwb h ASP 194 Cb 0.00 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.69 1dwb h ASP 194 CO 0.00 0.05 -0.04 -1.20 -1.72 0.00 0.00 179.24 176.33 1dwb n SER 195 N -2.40 0.45 0.00 6.45 7.64 -1.26 -1.79 113.62 122.72 1dwb n SER 195 Ca 0.03 0.97 0.00 0.00 1.01 0.00 0.00 58.87 60.88 1dwb n SER 195 Cb 0.48 -1.27 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 1dwb n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dwb n GLY 196 N 1.41 2.45 3.66 0.23 0.00 -0.76 0.04 105.19 112.21 1dwb n GLY 196 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1dwb n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dwb s GLY 197 N -1.88 1.62 -0.14 -0.02 0.00 -0.74 -2.94 107.32 103.23 1dwb s GLY 197 Ca 0.00 0.12 -0.06 0.00 0.00 0.00 0.00 44.72 44.78 1dwb s GLY 197 CO 0.00 0.63 0.08 2.56 0.00 0.00 0.00 173.10 176.37 1dwb s PRO 198 N -4.75 3.55 -0.51 2.90 0.04 -1.26 -0.02 135.00 134.96 1dwb s PRO 198 Ca 0.65 -0.27 -0.15 0.00 0.04 0.00 0.00 61.00 61.27 1dwb s PRO 198 Cb -0.21 -3.12 0.11 0.00 0.04 0.00 0.00 34.50 31.32 1dwb s PRO 198 CO 0.59 0.56 0.44 0.12 0.04 0.00 0.00 177.00 178.75 1dwb s PHE 199 N -0.45 3.26 0.26 0.56 2.19 0.47 -3.98 117.98 120.30 1dwb s PHE 199 Ca 0.10 -1.21 0.08 0.00 0.33 0.00 0.00 56.93 56.24 1dwb s PHE 199 Cb -0.12 -3.51 -0.04 0.00 -1.31 0.00 0.00 43.02 38.04 1dwb s PHE 199 CO 0.02 -0.93 0.12 0.14 1.83 0.00 0.00 175.22 176.40 1dwb s VAL 200 N 1.59 3.97 0.06 3.12 -7.23 -0.91 -1.54 120.40 119.46 1dwb s VAL 200 Ca 0.04 -1.62 0.03 0.00 -1.81 0.00 0.00 61.98 58.62 1dwb s VAL 200 Cb -0.27 -3.16 -0.03 0.00 0.56 0.00 0.00 36.38 33.48 1dwb s VAL 200 CO 0.04 -0.35 -0.10 -0.04 -0.31 0.00 0.00 175.10 174.34 1dwb s MET 201 N -3.78 0.68 -0.18 4.82 -1.94 0.37 -0.98 119.30 118.30 1dwb s MET 201 Ca 0.33 -0.89 -0.06 0.00 -1.71 0.00 0.00 55.69 53.36 1dwb s MET 201 Cb -0.07 -0.50 -0.03 0.00 2.01 0.00 0.00 34.83 36.23 1dwb s MET 201 CO 0.23 0.10 0.02 0.21 -0.01 0.00 0.00 175.02 175.56 1dwb s LYS 202 N -1.84 3.80 -0.32 2.03 2.20 -1.26 -0.40 119.74 123.94 1dwb s LYS 202 Ca -0.05 -0.44 -0.24 0.00 -0.36 0.00 0.00 55.97 54.88 1dwb s LYS 202 Cb -0.09 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1dwb s LYS 202 CO 0.01 0.21 0.82 0.45 -0.36 0.00 0.00 175.35 176.48 1dwb s SER 203 N 0.48 6.66 0.56 1.43 0.15 -0.09 -4.92 113.70 117.98 1dwb s SER 203 Ca -0.00 0.63 0.32 0.00 0.70 0.00 0.00 55.95 57.59 1dwb s SER 203 Cb -0.13 -2.42 1.67 0.00 -1.71 0.00 0.00 66.02 63.43 1dwb s SER 203 CO 0.02 -0.67 2.14 1.55 1.20 0.00 0.00 173.24 177.48 1dwb h PRO 204 N 8.21 0.00 0.04 5.44 0.13 -1.95 0.23 132.00 144.09 1dwb h PRO 204 Ca -0.24 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.62 1dwb h PRO 204 Cb 1.09 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 1dwb h PRO 204 CO 0.90 0.07 -1.42 0.74 -0.23 0.00 0.00 178.00 178.07 1dwb h PHE 204 N 0.00 0.15 -0.00 1.56 0.04 -1.97 -3.38 116.94 113.33 1dwb h PHE 204 Ca -0.00 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1dwb h PHE 204 Cb 0.26 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.40 1dwb h PHE 204 CO 0.00 1.13 -0.13 0.27 -0.60 0.00 0.00 178.31 178.98 1dwb n ASN 204 N -3.28 0.73 -0.25 2.17 0.23 -1.17 -5.02 115.26 108.67 1dwb n ASN 204 Ca -0.11 -0.87 -0.03 0.00 -0.53 0.00 0.00 54.58 53.04 1dwb n ASN 204 Cb 1.01 0.59 -0.01 0.00 -2.08 0.00 0.00 39.78 39.28 1dwb n ASN 204 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1dwb n ASN 205 N -0.53 -4.46 -4.88 0.53 5.15 0.80 -5.01 115.26 106.87 1dwb n ASN 205 Ca 0.02 0.08 -0.29 0.00 -0.60 0.00 0.00 54.58 53.79 1dwb n ASN 205 Cb 0.10 -2.25 -0.04 0.00 -0.53 0.00 0.00 39.78 37.05 1dwb n ASN 205 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1dwb s ARG 206 N -1.60 3.25 -0.00 1.20 0.52 -1.24 -4.81 118.95 116.27 1dwb s ARG 206 Ca 0.00 -0.59 -0.19 0.00 -0.52 0.00 0.00 55.73 54.43 1dwb s ARG 206 Cb 0.00 -2.91 -0.06 0.00 0.52 0.00 0.00 34.95 32.51 1dwb s ARG 206 CO 0.00 0.56 0.55 -1.58 0.02 0.00 0.00 175.30 174.86 1dwb s TRP 207 N -1.57 3.69 -0.02 -0.53 0.52 -1.26 -0.92 118.94 118.85 1dwb s TRP 207 Ca 0.33 1.15 0.06 0.00 0.02 0.00 0.00 56.10 57.66 1dwb s TRP 207 Cb -0.12 -2.54 -0.01 0.00 -1.15 0.00 0.00 33.47 29.65 1dwb s TRP 207 CO 0.26 0.41 -0.20 0.71 0.02 0.00 0.00 176.95 178.16 1dwb s TYR 208 N -0.39 1.79 -0.60 -1.98 2.02 0.46 -2.54 117.35 116.12 1dwb s TYR 208 Ca 0.29 -0.37 -0.21 0.00 -0.37 0.00 0.00 57.07 56.41 1dwb s TYR 208 Cb -0.18 -1.16 0.07 0.00 -0.40 0.00 0.00 41.96 40.30 1dwb s TYR 208 CO 0.16 -0.06 0.83 -1.14 -1.57 0.00 0.00 175.55 173.78 1dwb s GLN 209 N -0.38 3.12 0.01 -0.62 0.74 0.05 -0.47 119.66 122.10 1dwb s GLN 209 Ca 0.06 -0.91 0.00 0.00 0.05 0.00 0.00 55.36 54.56 1dwb s GLN 209 Cb -0.08 -4.20 -0.26 0.00 1.10 0.00 0.00 33.01 29.57 1dwb s GLN 209 CO -0.00 -1.60 0.86 0.52 -0.55 0.00 0.00 175.29 174.52 1dwb h MET 210 N 9.34 0.19 -4.36 1.67 2.86 -1.61 -3.40 114.93 119.62 1dwb h MET 210 Ca -0.28 -0.32 -0.30 0.00 -2.06 0.00 0.00 59.70 56.74 1dwb h MET 210 Cb 1.08 0.12 -0.11 0.00 0.06 0.00 0.00 31.60 32.75 1dwb h MET 210 CO 1.11 1.02 -0.34 0.20 1.06 0.00 0.00 176.91 179.96 1dwb s GLY 211 N -4.97 1.59 -0.04 8.32 0.00 -0.83 -1.58 107.32 109.81 1dwb s GLY 211 Ca -0.08 -1.62 0.05 0.00 0.00 0.00 0.00 44.72 43.07 1dwb s GLY 211 CO 0.84 -1.15 -0.21 -0.42 0.00 0.00 0.00 173.10 172.16 1dwb s ILE 212 N -3.47 1.70 -0.08 0.90 1.01 -1.06 -0.40 121.20 119.81 1dwb s ILE 212 Ca 0.34 -0.88 -0.31 0.00 0.00 0.00 0.00 60.65 59.80 1dwb s ILE 212 Cb 0.02 -1.44 -0.09 0.00 0.01 0.00 0.00 42.46 40.95 1dwb s ILE 212 CO 0.19 0.48 2.03 0.52 0.00 0.00 0.00 174.94 178.16 1dwb n VAL 213 N 2.94 0.60 0.00 2.92 0.31 0.98 -1.21 118.33 124.86 1dwb n VAL 213 Ca -0.17 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1dwb n VAL 213 Cb 0.53 -2.23 0.00 0.00 -0.91 0.00 0.00 33.84 31.22 1dwb n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1dwb n SER 214 N 8.45 0.00 -3.08 4.52 2.88 -0.55 -1.83 113.62 124.00 1dwb n SER 214 Ca 0.24 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.63 1dwb n SER 214 Cb 0.38 -0.26 -0.03 0.00 -0.75 0.00 0.00 64.21 63.55 1dwb n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1dwb n TRP 215 N -2.13 -1.47 0.00 0.66 4.27 -0.98 -4.91 117.44 112.88 1dwb n TRP 215 Ca 0.00 -2.46 0.00 0.00 -3.89 0.00 0.00 57.50 51.15 1dwb n TRP 215 Cb 0.00 0.56 0.00 0.00 -1.36 0.00 0.00 31.31 30.51 1dwb n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1dwb n GLY 216 N -0.60 1.15 3.35 -1.67 0.00 -1.26 -1.52 105.19 104.64 1dwb n GLY 216 Ca 0.01 -0.64 -0.46 0.00 0.00 0.00 0.00 46.02 44.92 1dwb n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dwb s GLU 217 N -2.00 3.70 2.93 1.61 2.02 -1.26 -4.95 118.70 120.74 1dwb s GLU 217 Ca 0.00 -2.48 0.00 0.00 0.02 0.00 0.00 54.97 52.51 1dwb s GLU 217 Cb 0.00 -4.52 0.00 0.00 0.10 0.00 0.00 34.13 29.71 1dwb s GLU 217 CO 0.00 -1.36 0.00 0.41 0.02 0.00 0.00 175.26 174.33 1dwb n GLY 219 N 3.99 -0.28 3.10 -1.39 0.00 -1.26 -4.73 105.19 104.63 1dwb n GLY 219 Ca 0.17 -1.14 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 1dwb n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dwb n ASP 221 N 5.03 -5.02 -4.77 0.00 2.03 -1.26 -4.47 116.55 108.09 1dwb n ASP 221 Ca -0.12 0.22 -0.39 0.00 0.52 0.00 0.00 54.79 55.02 1dwb n ASP 221 Cb 0.51 -4.06 -0.03 0.00 -0.72 0.00 0.00 41.12 36.81 1dwb n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1dwb s ARG 221 N -4.07 4.34 0.39 -0.67 0.52 -1.26 -4.92 118.95 113.29 1dwb s ARG 221 Ca 0.00 1.75 -0.25 0.00 -0.52 0.00 0.00 55.73 56.72 1dwb s ARG 221 Cb 0.00 -2.87 -0.09 0.00 0.52 0.00 0.00 34.95 32.51 1dwb s ARG 221 CO 0.00 -0.04 1.12 -0.51 0.02 0.00 0.00 175.30 175.89 1dwb s ASP 222 N -1.11 6.64 -0.64 0.23 1.01 -1.26 -2.96 116.67 118.58 1dwb s ASP 222 Ca 0.52 2.22 0.00 0.00 0.71 0.00 0.00 52.55 56.00 1dwb s ASP 222 Cb -0.29 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.03 1dwb s ASP 222 CO 0.37 -0.58 0.00 0.61 0.21 0.00 0.00 175.17 175.78 1dwb n GLY 223 N 0.56 0.82 3.21 0.21 0.00 -1.26 -5.01 105.19 103.73 1dwb n GLY 223 Ca 0.04 -0.49 -0.18 0.00 0.00 0.00 0.00 46.02 45.39 1dwb n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dwb s LYS 224 N -2.19 0.94 0.21 1.61 -0.14 -1.16 -4.85 119.74 114.16 1dwb s LYS 224 Ca 0.00 -1.13 0.01 0.00 -1.36 0.00 0.00 55.97 53.48 1dwb s LYS 224 Cb 0.00 -0.85 -0.05 0.00 -1.68 0.00 0.00 37.83 35.26 1dwb s LYS 224 CO 0.00 0.17 0.07 0.71 -0.76 0.00 0.00 175.35 175.54 1dwb s TYR 225 N -1.87 1.30 0.09 3.18 2.02 -1.26 -4.81 117.35 116.01 1dwb s TYR 225 Ca 0.05 -1.17 -0.10 0.00 -0.37 0.00 0.00 57.07 55.47 1dwb s TYR 225 Cb -0.06 -0.73 -0.06 0.00 -0.40 0.00 0.00 41.96 40.70 1dwb s TYR 225 CO 0.02 -0.37 0.42 0.20 -1.57 0.00 0.00 175.55 174.26 1dwb s GLY 226 N -3.22 2.35 -0.14 0.71 0.00 -0.87 -4.52 107.32 101.63 1dwb s GLY 226 Ca 0.32 -0.35 -0.05 0.00 0.00 0.00 0.00 44.72 44.64 1dwb s GLY 226 CO 0.09 -0.12 0.04 -1.36 0.00 0.00 0.00 173.10 171.74 1dwb s PHE 227 N -1.42 3.23 0.06 1.90 0.40 -0.58 -2.22 117.98 119.35 1dwb s PHE 227 Ca 0.34 0.10 0.09 0.00 -0.60 0.00 0.00 56.93 56.86 1dwb s PHE 227 Cb -0.14 -1.96 -0.03 0.00 0.51 0.00 0.00 43.02 41.40 1dwb s PHE 227 CO 0.18 0.27 -0.25 0.71 0.70 0.00 0.00 175.22 176.84 1dwb s TYR 228 N -0.13 2.17 0.13 0.36 1.51 -0.32 -1.48 117.35 119.59 1dwb s TYR 228 Ca 0.06 -0.40 -0.31 0.00 -1.01 0.00 0.00 57.07 55.41 1dwb s TYR 228 Cb -0.12 -1.28 -0.08 0.00 -0.11 0.00 0.00 41.96 40.37 1dwb s TYR 228 CO 0.02 0.15 1.40 0.99 -1.11 0.00 0.00 175.55 176.99 1dwb s THR 229 N -0.86 3.23 -0.90 -0.71 2.01 -0.35 -2.00 115.64 116.06 1dwb s THR 229 Ca 0.11 0.90 -0.24 0.00 0.31 0.00 0.00 61.69 62.76 1dwb s THR 229 Cb -0.10 -3.57 0.01 0.00 0.01 0.00 0.00 72.50 68.85 1dwb s THR 229 CO 0.03 0.08 1.63 -2.28 -0.69 0.00 0.00 174.62 173.38 1dwb s HIS 230 N 0.99 2.17 0.38 4.92 2.46 0.62 -2.57 115.29 124.27 1dwb s HIS 230 Ca 0.64 -0.09 0.10 0.00 0.47 0.00 0.00 55.06 56.18 1dwb s HIS 230 Cb -0.37 -4.42 0.86 0.00 -0.13 0.00 0.00 32.58 28.51 1dwb s HIS 230 CO 0.31 -1.94 1.91 0.28 -2.47 0.00 0.00 174.74 172.84 1dwb h VAL 231 N 6.85 0.88 -0.63 0.89 2.07 -1.61 -2.91 116.25 121.80 1dwb h VAL 231 Ca 0.05 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1dwb h VAL 231 Cb 1.03 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 1dwb h VAL 231 CO 1.32 0.12 0.32 0.15 0.02 0.00 0.00 177.57 179.50 1dwb h PHE 232 N 0.64 0.88 -0.13 1.57 3.57 -1.87 -2.74 116.94 118.86 1dwb h PHE 232 Ca 0.38 -0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.68 1dwb h PHE 232 Cb 0.60 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 1dwb h PHE 232 CO -0.00 0.65 -0.64 0.00 -2.23 0.00 0.00 178.31 176.09 1dwb h ARG 233 N 0.86 0.47 -0.00 1.11 3.08 -1.89 -2.95 114.38 115.06 1dwb h ARG 233 Ca 0.22 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1dwb h ARG 233 Cb 0.08 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1dwb h ARG 233 CO -0.03 0.95 0.00 1.28 -1.07 0.00 0.00 179.97 181.10 1dwb n LEU 234 N -3.90 0.00 -0.24 3.04 4.77 -1.18 -4.16 117.00 115.33 1dwb n LEU 234 Ca -0.04 -0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.98 1dwb n LEU 234 Cb 0.65 -0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.91 1dwb n LEU 234 CO 0.47 0.00 1.00 0.50 -1.33 0.00 0.00 177.39 178.04 1dwb h LYS 235 N 0.00 0.41 -0.80 3.23 3.64 -1.30 -2.05 116.57 119.71 1dwb h LYS 235 Ca 0.00 -0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.46 1dwb h LYS 235 Cb 0.00 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.67 1dwb h LYS 235 CO 0.00 0.27 0.52 0.87 -2.27 0.00 0.00 179.45 178.84 1dwb h LYS 236 N 0.42 0.67 -0.44 1.90 1.79 -1.83 0.19 116.57 119.27 1dwb h LYS 236 Ca 0.39 -0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 58.73 1dwb h LYS 236 Cb 0.56 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 1dwb h LYS 236 CO -0.39 0.44 -0.05 2.35 -1.08 0.00 0.00 179.45 180.72 1dwb h TRP 237 N 0.69 0.90 -0.13 -1.35 7.01 -1.68 0.14 115.95 121.53 1dwb h TRP 237 Ca 0.37 -0.18 0.00 0.00 2.11 0.00 0.00 58.89 61.20 1dwb h TRP 237 Cb 0.52 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 27.35 1dwb h TRP 237 CO -0.00 0.89 0.07 0.82 -2.79 0.00 0.00 178.44 177.43 1dwb h ILE 238 N 0.64 1.01 -0.23 2.65 2.04 -0.91 0.92 117.51 123.63 1dwb h ILE 238 Ca 0.12 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 65.98 1dwb h ILE 238 Cb 0.57 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 37.43 1dwb h ILE 238 CO 0.03 0.03 -0.20 -0.61 0.00 0.00 0.00 178.15 177.40 1dwb h GLN 239 N 0.15 -0.19 -0.67 2.37 4.15 -0.46 0.72 115.11 121.19 1dwb h GLN 239 Ca 0.05 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 1dwb h GLN 239 Cb -0.00 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.70 1dwb h GLN 239 CO -0.02 -0.13 0.37 -0.22 -1.93 0.00 0.00 178.83 176.90 1dwb h LYS 240 N -0.20 0.91 -0.08 1.69 3.64 -0.32 -2.71 116.57 119.51 1dwb h LYS 240 Ca 0.13 -0.09 -0.09 0.00 -1.27 0.00 0.00 60.65 59.33 1dwb h LYS 240 Cb 0.40 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1dwb h LYS 240 CO -0.35 0.67 -0.29 0.28 -2.27 0.00 0.00 179.45 177.48 1dwb h VAL 241 N 0.92 1.42 -0.73 2.00 2.07 0.25 -3.33 116.25 118.85 1dwb h VAL 241 Ca 0.24 -1.68 -0.07 0.00 0.82 0.00 0.00 66.70 66.01 1dwb h VAL 241 Cb 0.01 2.28 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 1dwb h VAL 241 CO -0.04 0.48 0.20 0.40 0.02 0.00 0.00 177.57 178.63 1dwb h ILE 242 N -0.15 1.26 -6.35 4.57 2.04 -0.89 -3.48 117.51 114.51 1dwb h ILE 242 Ca -0.02 -0.96 -0.48 0.00 1.00 0.00 0.00 64.86 64.41 1dwb h ILE 242 Cb 0.93 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 1dwb h ILE 242 CO 0.06 0.37 -0.81 0.47 0.00 0.00 0.00 178.15 178.24 1dwb n ASP 243 N -4.24 -2.72 0.00 1.72 8.00 -1.02 -4.83 116.55 113.46 1dwb n ASP 243 Ca 0.06 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.69 1dwb n ASP 243 Cb 0.25 -3.59 0.00 0.00 -0.02 0.00 0.00 41.12 37.76 1dwb n ASP 243 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dwb n GLN 244 N -4.48 0.00 0.00 -1.24 6.02 -1.26 -1.91 117.38 114.51 1dwb n GLN 244 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 1dwb n GLN 244 Cb 0.59 -1.17 0.00 0.00 1.02 0.00 0.00 30.24 30.68 1dwb n GLN 244 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1dwb n PHE 245 N -0.63 0.00 0.00 1.08 3.72 -1.26 -5.30 117.46 115.07 1dwb n PHE 245 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1dwb n PHE 245 Cb 0.00 0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.56 1dwb n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12