#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dsu s LEU 17 N 0.00 4.36 -1.80 1.39 1.02 0.68 -4.12 118.68 120.21 1dsu s LEU 17 Ca 0.00 0.54 0.00 0.00 0.02 0.00 0.00 54.13 54.69 1dsu s LEU 17 Cb 0.00 -2.23 0.00 0.00 0.02 0.00 0.00 46.19 43.98 1dsu s LEU 17 CO 0.00 0.31 0.00 0.61 0.02 0.00 0.00 176.35 177.29 1dsu n GLY 18 N 2.39 0.34 0.00 -3.19 0.00 -1.26 -2.34 105.19 101.13 1dsu n GLY 18 Ca -0.17 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1dsu n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dsu n GLY 19 N -0.87 1.34 3.05 -0.02 0.00 -1.26 -4.84 105.19 102.60 1dsu n GLY 19 Ca -0.22 -2.01 -0.08 0.00 0.00 0.00 0.00 46.02 43.71 1dsu n GLY 19 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1dsu s ARG 20 N -0.66 0.51 0.18 1.61 3.03 -0.60 -4.94 118.95 118.08 1dsu s ARG 20 Ca 0.00 -1.00 -0.31 0.00 2.03 0.00 0.00 55.73 56.45 1dsu s ARG 20 Cb 0.00 0.14 -0.10 0.00 -1.03 0.00 0.00 34.95 33.97 1dsu s ARG 20 CO 0.00 -0.08 1.53 -2.00 -1.13 0.00 0.00 175.30 173.62 1dsu s GLU 21 N -3.00 4.23 0.76 3.89 2.12 -1.26 -1.02 118.70 124.42 1dsu s GLU 21 Ca -0.01 2.33 -0.11 0.00 0.36 0.00 0.00 54.97 57.54 1dsu s GLU 21 Cb 0.01 -3.15 0.05 0.00 0.26 0.00 0.00 34.13 31.30 1dsu s GLU 21 CO -0.06 -0.56 1.08 0.00 -0.54 0.00 0.00 175.26 175.18 1dsu s ALA 22 N 0.91 2.38 0.16 6.30 0.00 0.17 -4.86 121.76 126.82 1dsu s ALA 22 Ca 0.68 -0.08 -0.30 0.00 0.00 0.00 0.00 51.96 52.26 1dsu s ALA 22 Cb -0.43 -3.14 -0.08 0.00 0.00 0.00 0.00 23.12 19.47 1dsu s ALA 22 CO 0.34 -1.57 1.23 -1.21 0.00 0.00 0.00 175.76 174.55 1dsu s GLU 23 N -5.10 4.45 0.00 0.00 8.01 -1.26 -4.88 118.70 119.92 1dsu s GLU 23 Ca 0.60 1.90 0.00 0.00 0.01 0.00 0.00 54.97 57.48 1dsu s GLU 23 Cb -0.14 -3.25 0.00 0.00 -4.31 0.00 0.00 34.13 26.42 1dsu s GLU 23 CO 0.55 -0.18 0.00 0.00 0.01 0.00 0.00 175.26 175.64 1dsu n ALA 24 N 2.92 0.00 -2.64 5.21 0.00 -1.26 -2.08 120.51 122.66 1dsu n ALA 24 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.49 1dsu n ALA 24 Cb 0.44 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.96 1dsu n ALA 24 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1dsu n HIS 25 N -1.43 -0.46 0.54 0.00 8.25 -1.26 -4.39 115.22 116.47 1dsu n HIS 25 Ca 0.00 -1.63 0.10 0.00 -0.26 0.00 0.00 57.72 55.93 1dsu n HIS 25 Cb 0.00 0.65 0.42 0.00 1.12 0.00 0.00 29.99 32.17 1dsu n HIS 25 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1dsu n ALA 26 N -0.86 1.80 -3.61 -1.41 0.00 -0.88 -3.86 120.51 111.68 1dsu n ALA 26 Ca -0.08 -0.01 -0.27 0.00 0.00 0.00 0.00 53.44 53.08 1dsu n ALA 26 Cb 0.86 -1.33 -0.10 0.00 0.00 0.00 0.00 19.45 18.87 1dsu n ALA 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1dsu n ARG 27 N -1.81 1.42 0.00 0.00 1.74 -1.26 -4.97 116.66 111.77 1dsu n ARG 27 Ca 0.04 -4.06 0.06 0.00 -0.77 0.00 0.00 57.85 53.12 1dsu n ARG 27 Cb 0.23 -2.02 0.33 0.00 -1.02 0.00 0.00 32.46 29.98 1dsu n ARG 27 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1dsu n PRO 28 N 1.93 0.18 0.01 5.56 -0.04 -1.25 -2.13 135.00 139.27 1dsu n PRO 28 Ca 0.24 0.17 0.11 0.00 -0.04 0.00 0.00 63.50 63.99 1dsu n PRO 28 Cb 0.41 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.50 1dsu n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1dsu n TYR 29 N -1.29 0.13 -1.94 0.54 0.18 -1.16 -1.88 117.16 111.74 1dsu n TYR 29 Ca 0.06 0.04 -0.42 0.00 1.88 0.00 0.00 57.90 59.46 1dsu n TYR 29 Cb 0.10 -0.30 -0.03 0.00 -0.38 0.00 0.00 39.34 38.73 1dsu n TYR 29 CO 0.00 0.00 0.00 1.41 -2.08 0.00 0.00 176.86 176.19 1dsu s MET 30 N -3.07 4.20 0.13 -3.48 1.75 -0.90 -0.27 119.30 117.65 1dsu s MET 30 Ca 0.08 2.31 0.08 0.00 -1.25 0.00 0.00 55.69 56.91 1dsu s MET 30 Cb 0.16 -3.62 -0.04 0.00 2.84 0.00 0.00 34.83 34.17 1dsu s MET 30 CO 0.75 -0.73 -0.18 0.00 -0.65 0.00 0.00 175.02 174.21 1dsu s ALA 31 N 2.70 1.79 -0.25 4.11 0.00 0.31 -4.45 121.76 125.98 1dsu s ALA 31 Ca 0.74 -1.33 -0.02 0.00 0.00 0.00 0.00 51.96 51.34 1dsu s ALA 31 Cb -0.39 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.56 1dsu s ALA 31 CO 0.32 0.26 -0.05 0.45 0.00 0.00 0.00 175.76 176.74 1dsu s SER 32 N -2.27 4.35 -0.17 0.00 0.15 -0.84 -0.48 113.70 114.44 1dsu s SER 32 Ca 0.10 -0.78 -0.24 0.00 0.70 0.00 0.00 55.95 55.73 1dsu s SER 32 Cb -0.08 -1.69 -0.02 0.00 -1.71 0.00 0.00 66.02 62.53 1dsu s SER 32 CO 0.05 -0.11 0.79 -0.69 1.20 0.00 0.00 173.24 174.47 1dsu s VAL 33 N 1.36 4.91 0.20 4.45 1.01 0.55 -0.48 120.40 132.40 1dsu s VAL 33 Ca 0.01 1.54 0.10 0.00 0.00 0.00 0.00 61.98 63.64 1dsu s VAL 33 Cb -0.16 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 1dsu s VAL 33 CO -0.04 0.05 -0.16 -1.10 0.00 0.00 0.00 175.10 173.85 1dsu s GLN 34 N 2.04 1.80 -0.22 2.72 -0.21 0.18 -1.24 119.66 124.73 1dsu s GLN 34 Ca 0.36 -1.43 0.00 0.00 0.02 0.00 0.00 55.36 54.32 1dsu s GLN 34 Cb -0.16 -1.99 0.06 0.00 1.00 0.00 0.00 33.01 31.91 1dsu s GLN 34 CO 0.12 0.41 -0.05 -1.17 -2.12 0.00 0.00 175.29 172.48 1dsu s LEU 35 N -2.85 2.35 -1.44 2.90 2.96 -0.34 -1.05 118.68 121.21 1dsu s LEU 35 Ca 0.24 -1.07 -0.06 0.00 -0.22 0.00 0.00 54.13 53.01 1dsu s LEU 35 Cb -0.08 -1.12 0.04 0.00 0.50 0.00 0.00 46.19 45.54 1dsu s LEU 35 CO 0.13 -0.23 0.73 0.59 -1.32 0.00 0.00 176.35 176.25 1dsu n ASN 36 N 4.72 -2.31 0.00 3.68 5.03 -0.05 -1.74 115.26 124.59 1dsu n ASN 36 Ca -0.12 -0.87 0.00 0.00 0.87 0.00 0.00 54.58 54.46 1dsu n ASN 36 Cb 0.45 -3.63 0.00 0.00 -1.02 0.00 0.00 39.78 35.58 1dsu n ASN 36 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1dsu n GLY 38 N -1.69 0.60 3.46 7.41 0.00 -1.26 -5.03 105.19 108.67 1dsu n GLY 38 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 1dsu n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dsu s ALA 39 N -2.48 2.62 0.24 4.61 0.00 -0.71 -5.07 121.76 120.97 1dsu s ALA 39 Ca 0.00 -1.04 -0.31 0.00 0.00 0.00 0.00 51.96 50.61 1dsu s ALA 39 Cb 0.00 -0.89 -0.12 0.00 0.00 0.00 0.00 23.12 22.12 1dsu s ALA 39 CO 0.00 0.56 1.68 -1.58 0.00 0.00 0.00 175.76 176.42 1dsu s HIS 40 N -0.77 2.83 -0.00 0.00 5.65 -1.26 -1.19 115.29 120.55 1dsu s HIS 40 Ca 0.12 0.50 -0.02 0.00 0.25 0.00 0.00 55.06 55.91 1dsu s HIS 40 Cb -0.11 -4.13 -0.01 0.00 -1.18 0.00 0.00 32.58 27.16 1dsu s HIS 40 CO 0.02 -4.08 -0.05 -0.11 -0.65 0.00 0.00 174.74 169.86 1dsu n LEU 41 N 3.27 0.68 -4.05 8.88 7.94 -0.37 -4.86 117.00 128.50 1dsu n LEU 41 Ca 0.13 0.10 -0.10 0.00 -1.11 0.00 0.00 56.01 55.03 1dsu n LEU 41 Cb 0.36 -0.24 -0.07 0.00 0.53 0.00 0.00 43.42 44.00 1dsu n LEU 41 CO 0.64 -0.23 0.01 0.00 -1.11 0.00 0.00 177.39 176.70 1dsu s GLY 43 N -3.04 1.76 0.10 0.00 0.00 0.19 -0.33 107.32 105.99 1dsu s GLY 43 Ca 0.26 -1.51 -0.26 0.00 0.00 0.00 0.00 44.72 43.21 1dsu s GLY 43 CO 0.08 -0.90 0.83 -0.32 0.00 0.00 0.00 173.10 172.78 1dsu s GLY 44 N -4.75 -0.40 -0.06 0.20 0.00 0.36 -3.90 107.32 98.77 1dsu s GLY 44 Ca 0.68 0.54 0.00 0.00 0.00 0.00 0.00 44.72 45.94 1dsu s GLY 44 CO 0.47 0.17 -0.03 0.54 0.00 0.00 0.00 173.10 174.25 1dsu s VAL 45 N -3.37 0.52 -0.10 1.40 0.11 -0.38 -0.53 120.40 118.05 1dsu s VAL 45 Ca 0.07 -0.05 -0.29 0.00 -2.93 0.00 0.00 61.98 58.77 1dsu s VAL 45 Cb -0.02 -0.59 -0.05 0.00 -1.53 0.00 0.00 36.38 34.20 1dsu s VAL 45 CO -0.05 0.25 1.67 -0.22 -3.33 0.00 0.00 175.10 173.41 1dsu s LEU 46 N 1.33 4.19 -0.00 2.54 2.96 0.63 -0.51 118.68 129.81 1dsu s LEU 46 Ca -0.05 2.08 0.06 0.00 -0.22 0.00 0.00 54.13 56.01 1dsu s LEU 46 Cb -0.13 -3.53 -0.08 0.00 0.50 0.00 0.00 46.19 42.95 1dsu s LEU 46 CO -0.02 -1.04 0.25 0.55 -1.32 0.00 0.00 176.35 174.76 1dsu n VAL 47 N 5.78 0.00 -3.90 1.68 3.14 0.11 -2.36 118.33 122.78 1dsu n VAL 47 Ca 0.18 -0.31 -0.10 0.00 -2.96 0.00 0.00 64.34 61.16 1dsu n VAL 47 Cb 0.43 0.86 -0.01 0.00 -1.06 0.00 0.00 33.84 34.07 1dsu n VAL 47 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1dsu s ALA 48 N -1.79 -0.44 0.41 1.55 0.00 -1.09 -4.68 121.76 115.72 1dsu s ALA 48 Ca 0.01 -0.85 0.13 0.00 0.00 0.00 0.00 51.96 51.25 1dsu s ALA 48 Cb 0.05 0.85 0.87 0.00 0.00 0.00 0.00 23.12 24.89 1dsu s ALA 48 CO 0.27 -0.94 1.93 0.93 0.00 0.00 0.00 175.76 177.94 1dsu h GLU 49 N 2.05 0.06 0.00 0.00 5.08 -1.96 -3.14 114.58 116.68 1dsu h GLU 49 Ca -0.28 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1dsu h GLU 49 Cb 1.25 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1dsu h GLU 49 CO 0.36 0.28 -0.01 0.94 -1.00 0.00 0.00 179.01 179.59 1dsu n GLN 50 N -4.25 1.30 -3.98 2.33 7.27 -1.26 0.08 117.38 118.87 1dsu n GLN 50 Ca -0.02 -2.51 -0.15 0.00 0.07 0.00 0.00 57.00 54.39 1dsu n GLN 50 Cb 0.30 -1.46 -0.15 0.00 2.41 0.00 0.00 30.24 31.34 1dsu n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1dsu s TRP 51 N -2.76 0.25 -0.07 3.69 0.52 -1.19 -1.52 118.94 117.85 1dsu s TRP 51 Ca 0.30 -0.02 0.03 0.00 0.02 0.00 0.00 56.10 56.43 1dsu s TRP 51 Cb 0.27 -0.23 0.01 0.00 -1.15 0.00 0.00 33.47 32.37 1dsu s TRP 51 CO 0.03 -0.05 -0.15 0.08 0.02 0.00 0.00 176.95 176.88 1dsu s VAL 52 N 0.31 1.37 -0.00 4.03 1.01 -0.19 -0.72 120.40 126.21 1dsu s VAL 52 Ca -0.03 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.15 1dsu s VAL 52 Cb -0.05 -1.23 -0.06 0.00 0.00 0.00 0.00 36.38 35.04 1dsu s VAL 52 CO -0.01 0.41 0.52 -0.22 0.00 0.00 0.00 175.10 175.80 1dsu s LEU 53 N 0.57 4.43 0.00 3.92 0.20 0.33 -0.08 118.68 128.05 1dsu s LEU 53 Ca -0.16 1.08 -0.02 0.00 0.69 0.00 0.00 54.13 55.72 1dsu s LEU 53 Cb -0.16 -2.79 0.01 0.00 -0.43 0.00 0.00 46.19 42.81 1dsu s LEU 53 CO 0.05 0.18 0.18 -0.24 -0.29 0.00 0.00 176.35 176.23 1dsu n SER 54 N 2.43 -0.51 -4.78 3.68 2.88 -0.33 -1.25 113.62 115.74 1dsu n SER 54 Ca -0.09 -1.55 -0.36 0.00 -1.33 0.00 0.00 58.87 55.54 1dsu n SER 54 Cb 0.51 0.91 -0.07 0.00 -0.75 0.00 0.00 64.21 64.81 1dsu n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1dsu s ALA 55 N -1.73 3.75 0.28 -1.46 0.00 -1.26 -1.30 121.76 120.04 1dsu s ALA 55 Ca 0.08 -0.66 -0.03 0.00 0.00 0.00 0.00 51.96 51.35 1dsu s ALA 55 Cb -0.01 -2.11 0.39 0.00 0.00 0.00 0.00 23.12 21.39 1dsu s ALA 55 CO 0.05 0.32 1.91 0.00 0.00 0.00 0.00 175.76 178.05 1dsu h ALA 56 N 6.05 1.31 0.00 0.00 0.00 -1.57 -1.58 119.26 123.47 1dsu h ALA 56 Ca -0.46 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 1dsu h ALA 56 Cb 1.18 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1dsu h ALA 56 CO 0.69 0.57 -0.02 1.12 0.00 0.00 0.00 179.25 181.62 1dsu h HIS 57 N 1.07 0.00 0.01 0.00 2.07 -1.78 -2.29 115.15 114.24 1dsu h HIS 57 Ca 0.27 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.79 1dsu h HIS 57 Cb 0.01 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.99 1dsu h HIS 57 CO 0.01 0.02 -0.01 0.00 -3.07 0.00 0.00 177.93 174.88 1dsu h LEU 59 N -0.29 0.00 -0.34 0.00 -0.00 -1.49 -2.94 115.31 110.25 1dsu h LEU 59 Ca -0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.84 1dsu h LEU 59 Cb 0.28 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.93 1dsu h LEU 59 CO 0.00 0.30 0.05 -0.33 -0.00 0.00 0.00 178.44 178.46 1dsu h GLU 60 N 0.00 0.57 -6.10 1.13 4.39 -1.36 -3.45 114.58 109.76 1dsu h GLU 60 Ca -0.00 -0.15 -0.59 0.00 0.34 0.00 0.00 59.36 58.96 1dsu h GLU 60 Cb 0.72 -0.07 -0.08 0.00 -0.10 0.00 0.00 28.75 29.23 1dsu h GLU 60 CO 0.04 0.65 0.67 0.16 -1.16 0.00 0.00 179.01 179.37 1dsu s ASP 61 N -5.99 6.82 0.00 1.42 1.47 -1.10 -5.06 116.67 114.24 1dsu s ASP 61 Ca -0.13 0.89 0.00 0.00 1.18 0.00 0.00 52.55 54.48 1dsu s ASP 61 Cb 0.09 -2.49 0.00 0.00 -0.34 0.00 0.00 42.92 40.18 1dsu s ASP 61 CO 0.76 -0.78 0.00 0.00 0.68 0.00 0.00 175.17 175.83 1dsu n ALA 61 N 6.62 0.03 -2.89 2.11 0.00 -1.26 -5.11 120.51 120.01 1dsu n ALA 61 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.52 1dsu n ALA 61 Cb 0.47 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.93 1dsu n ALA 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dsu s ASP 61 N -0.46 -1.03 0.00 0.00 1.01 -1.26 -5.16 116.67 109.77 1dsu s ASP 61 Ca 0.00 -0.86 0.00 0.00 0.71 0.00 0.00 52.55 52.40 1dsu s ASP 61 Cb 0.00 1.33 0.00 0.00 1.01 0.00 0.00 42.92 45.26 1dsu s ASP 61 CO 0.00 -0.08 0.00 0.61 0.21 0.00 0.00 175.17 175.91 1dsu n GLY 62 N 3.49 -0.68 3.60 0.21 0.00 -1.26 -5.04 105.19 105.51 1dsu n GLY 62 Ca 0.12 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 1dsu n GLY 62 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dsu s LYS 63 N -0.50 3.57 -0.15 1.61 2.20 -1.26 -4.88 119.74 120.33 1dsu s LYS 63 Ca 0.00 1.04 -0.19 0.00 -0.36 0.00 0.00 55.97 56.47 1dsu s LYS 63 Cb 0.00 -4.04 -0.04 0.00 -1.51 0.00 0.00 37.83 32.25 1dsu s LYS 63 CO 0.00 -1.57 0.51 0.08 -0.36 0.00 0.00 175.35 174.02 1dsu s VAL 64 N 5.54 5.14 0.13 4.02 1.01 -1.26 -0.87 120.40 134.11 1dsu s VAL 64 Ca 0.64 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.60 1dsu s VAL 64 Cb -0.15 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1dsu s VAL 64 CO 0.32 0.25 0.01 -1.10 0.00 0.00 0.00 175.10 174.59 1dsu s GLN 65 N 1.09 0.92 -0.10 2.72 -0.21 -0.21 -3.58 119.66 120.28 1dsu s GLN 65 Ca 0.26 -1.42 0.04 0.00 0.02 0.00 0.00 55.36 54.25 1dsu s GLN 65 Cb -0.15 0.03 0.00 0.00 1.00 0.00 0.00 33.01 33.89 1dsu s GLN 65 CO 0.10 -0.17 -0.23 0.08 -2.12 0.00 0.00 175.29 172.96 1dsu s VAL 66 N -3.86 1.98 -0.26 1.09 1.01 0.33 0.49 120.40 121.18 1dsu s VAL 66 Ca 0.20 -0.97 -0.10 0.00 0.00 0.00 0.00 61.98 61.11 1dsu s VAL 66 Cb 0.07 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.68 1dsu s VAL 66 CO -0.00 0.54 0.15 -0.22 0.00 0.00 0.00 175.10 175.57 1dsu s LEU 67 N 0.44 3.91 0.36 3.92 2.96 0.37 -0.76 118.68 129.88 1dsu s LEU 67 Ca -0.17 -0.02 0.08 0.00 -0.22 0.00 0.00 54.13 53.80 1dsu s LEU 67 Cb -0.17 -2.07 -0.05 0.00 0.50 0.00 0.00 46.19 44.40 1dsu s LEU 67 CO 0.07 -0.01 0.10 -0.76 -1.32 0.00 0.00 176.35 174.43 1dsu s LEU 68 N 1.51 3.09 -1.96 -0.68 1.43 0.06 -1.98 118.68 120.15 1dsu s LEU 68 Ca 0.07 -0.97 0.00 0.00 -1.03 0.00 0.00 54.13 52.20 1dsu s LEU 68 Cb -0.15 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.60 1dsu s LEU 68 CO 0.08 -0.35 0.00 0.61 0.23 0.00 0.00 176.35 176.92 1dsu n GLY 69 N -1.09 0.93 3.82 -3.19 0.00 -1.25 -2.06 105.19 102.35 1dsu n GLY 69 Ca -0.03 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 1dsu n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dsu s ALA 70 N -2.85 3.63 0.07 4.61 0.00 -1.26 -3.44 121.76 122.52 1dsu s ALA 70 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.76 1dsu s ALA 70 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.69 1dsu s ALA 70 CO 0.00 0.49 0.00 1.58 0.00 0.00 0.00 175.76 177.83 1dsu n HIS 71 N -0.44 -0.11 -3.29 0.00 -0.00 -1.26 -4.94 115.22 105.19 1dsu n HIS 71 Ca -0.08 0.02 -0.38 0.00 0.46 0.00 0.00 57.72 57.74 1dsu n HIS 71 Cb 0.55 0.03 -0.06 0.00 -0.12 0.00 0.00 29.99 30.39 1dsu n HIS 71 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1dsu s SER 72 N -5.60 6.79 0.19 0.26 0.15 -1.26 -2.16 113.70 112.08 1dsu s SER 72 Ca 0.00 0.95 0.09 0.00 0.70 0.00 0.00 55.95 57.68 1dsu s SER 72 Cb 0.00 -2.31 0.05 0.00 -1.71 0.00 0.00 66.02 62.05 1dsu s SER 72 CO 0.00 0.05 1.43 -0.07 1.20 0.00 0.00 173.24 175.86 1dsu h LEU 73 N 6.23 0.00 0.00 3.45 3.38 -1.64 -3.36 115.31 123.37 1dsu h LEU 73 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1dsu h LEU 73 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1dsu h LEU 73 CO 0.73 0.81 -1.48 -1.54 0.09 0.00 0.00 178.44 177.05 1dsu n SER 74 N -3.54 0.97 -4.85 -0.43 3.41 -1.26 -4.98 113.62 102.94 1dsu n SER 74 Ca -0.00 -0.28 -0.37 0.00 -0.26 0.00 0.00 58.87 57.96 1dsu n SER 74 Cb 0.79 1.54 -0.06 0.00 -0.26 0.00 0.00 64.21 66.22 1dsu n SER 74 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1dsu s GLN 75 N -3.01 3.80 0.29 4.33 0.74 -1.26 -5.06 119.66 119.50 1dsu s GLN 75 Ca -0.02 0.26 -0.29 0.00 0.05 0.00 0.00 55.36 55.35 1dsu s GLN 75 Cb 0.12 -3.13 -0.10 0.00 1.10 0.00 0.00 33.01 30.99 1dsu s GLN 75 CO 0.71 0.65 1.42 -1.25 -0.55 0.00 0.00 175.29 176.27 1dsu s PRO 76 N -1.39 4.26 -0.04 1.67 0.04 -1.26 -4.82 135.00 133.46 1dsu s PRO 76 Ca 0.26 2.33 -0.02 0.00 0.04 0.00 0.00 61.00 63.61 1dsu s PRO 76 Cb -0.15 -3.08 0.02 0.00 0.04 0.00 0.00 34.50 31.33 1dsu s PRO 76 CO 0.14 -0.38 0.08 -1.21 0.04 0.00 0.00 177.00 175.67 1dsu s GLU 77 N -0.99 0.05 0.63 4.56 2.02 -1.26 -5.05 118.70 118.66 1dsu s GLU 77 Ca 0.56 0.20 0.38 0.00 0.02 0.00 0.00 54.97 56.14 1dsu s GLU 77 Cb -0.42 -0.11 2.14 0.00 0.10 0.00 0.00 34.13 35.85 1dsu s GLU 77 CO 0.49 -0.10 2.31 -1.35 0.02 0.00 0.00 175.26 176.62 1dsu h PRO 78 N 6.76 0.00 0.00 0.39 0.11 -1.95 -2.41 132.00 134.89 1dsu h PRO 78 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1dsu h PRO 78 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1dsu h PRO 78 CO 0.46 0.01 -0.54 -1.13 -0.21 0.00 0.00 178.00 176.58 1dsu n SER 79 N -3.39 0.66 -4.72 -2.05 3.41 -1.26 -4.90 113.62 101.37 1dsu n SER 79 Ca -0.03 0.13 -0.42 0.00 -0.26 0.00 0.00 58.87 58.29 1dsu n SER 79 Cb 0.09 0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 1dsu n SER 79 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1dsu s LYS 80 N -3.14 4.24 -0.15 4.33 1.02 -0.91 -4.25 119.74 120.88 1dsu s LYS 80 Ca 0.07 2.31 -0.09 0.00 0.02 0.00 0.00 55.97 58.28 1dsu s LYS 80 Cb 0.14 -3.17 0.05 0.00 -0.52 0.00 0.00 37.83 34.34 1dsu s LYS 80 CO 0.70 -0.56 0.37 1.03 -0.92 0.00 0.00 175.35 175.97 1dsu s ARG 81 N 1.00 0.36 -0.13 1.68 1.81 -0.88 -4.98 118.95 117.81 1dsu s ARG 81 Ca 0.68 0.68 -0.06 0.00 -1.72 0.00 0.00 55.73 55.31 1dsu s ARG 81 Cb -0.42 -0.00 -0.04 0.00 -0.45 0.00 0.00 34.95 34.03 1dsu s ARG 81 CO 0.32 -0.14 0.08 -1.17 -0.68 0.00 0.00 175.30 173.71 1dsu s LEU 82 N 1.15 4.02 0.08 2.53 2.96 -1.26 -0.76 118.68 127.40 1dsu s LEU 82 Ca -0.08 0.27 0.07 0.00 -0.22 0.00 0.00 54.13 54.17 1dsu s LEU 82 Cb -0.08 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1dsu s LEU 82 CO -0.09 0.32 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.77 1dsu s TYR 83 N -0.51 1.53 0.37 5.38 1.51 0.06 -4.96 117.35 120.72 1dsu s TYR 83 Ca 0.11 -0.43 -0.09 0.00 -1.01 0.00 0.00 57.07 55.65 1dsu s TYR 83 Cb -0.12 -0.85 -0.06 0.00 -0.11 0.00 0.00 41.96 40.82 1dsu s TYR 83 CO 0.02 0.13 0.71 -0.51 -1.11 0.00 0.00 175.55 174.79 1dsu s ASP 84 N -1.74 6.52 -0.35 2.29 1.11 -1.26 -0.51 116.67 122.73 1dsu s ASP 84 Ca 0.03 1.04 -0.14 0.00 0.18 0.00 0.00 52.55 53.66 1dsu s ASP 84 Cb -0.10 -2.28 -0.01 0.00 1.07 0.00 0.00 42.92 41.60 1dsu s ASP 84 CO 0.03 -0.33 0.29 -0.69 1.18 0.00 0.00 175.17 175.65 1dsu s VAL 85 N -2.26 5.24 0.13 -1.27 1.01 -1.23 -0.63 120.40 121.39 1dsu s VAL 85 Ca 0.50 -0.16 -0.10 0.00 0.00 0.00 0.00 61.98 62.22 1dsu s VAL 85 Cb -0.10 -3.77 -0.11 0.00 0.00 0.00 0.00 36.38 32.40 1dsu s VAL 85 CO 0.30 -0.06 1.39 -0.07 0.00 0.00 0.00 175.10 176.66 1dsu h LEU 86 N 8.59 0.88 -7.30 3.92 4.07 -0.12 -3.47 115.31 121.88 1dsu h LEU 86 Ca -0.30 -0.51 0.05 0.00 0.08 0.00 0.00 57.88 57.19 1dsu h LEU 86 Cb 1.15 -0.26 -0.11 0.00 1.08 0.00 0.00 40.66 42.53 1dsu h LEU 86 CO 0.66 1.30 0.30 0.00 -1.08 0.00 0.00 178.44 179.62 1dsu s ARG 87 N -3.95 1.29 -0.13 1.13 1.70 -1.20 -5.01 118.95 112.77 1dsu s ARG 87 Ca -0.10 -0.57 0.00 0.00 -0.47 0.00 0.00 55.73 54.59 1dsu s ARG 87 Cb 0.10 0.53 0.02 0.00 -0.57 0.00 0.00 34.95 35.03 1dsu s ARG 87 CO 0.89 -0.57 -0.12 0.00 -1.08 0.00 0.00 175.30 174.41 1dsu s ALA 88 N -3.60 1.64 -0.37 7.88 0.00 -1.26 -0.53 121.76 125.51 1dsu s ALA 88 Ca 0.05 -0.76 -0.07 0.00 0.00 0.00 0.00 51.96 51.19 1dsu s ALA 88 Cb -0.02 -0.99 0.06 0.00 0.00 0.00 0.00 23.12 22.17 1dsu s ALA 88 CO -0.06 -0.39 0.17 0.08 0.00 0.00 0.00 175.76 175.56 1dsu s VAL 89 N 1.56 3.86 1.05 0.00 1.01 0.73 -4.92 120.40 123.68 1dsu s VAL 89 Ca 0.05 -1.35 -0.14 0.00 0.00 0.00 0.00 61.98 60.54 1dsu s VAL 89 Cb -0.13 -3.30 0.21 0.00 0.00 0.00 0.00 36.38 33.16 1dsu s VAL 89 CO -0.09 -0.36 1.09 -2.16 0.00 0.00 0.00 175.10 173.58 1dsu s PRO 90 N 1.37 0.05 0.57 2.72 0.05 -1.26 -2.46 135.00 136.04 1dsu s PRO 90 Ca 0.01 0.40 0.09 0.00 0.05 0.00 0.00 61.00 61.54 1dsu s PRO 90 Cb -0.21 -1.70 0.08 0.00 0.05 0.00 0.00 34.50 32.71 1dsu s PRO 90 CO 0.02 -2.96 0.71 -3.38 0.05 0.00 0.00 177.00 171.43 1dsu s HIS 91 N -2.97 1.43 0.20 0.56 -3.43 -1.26 -4.96 115.29 104.87 1dsu s HIS 91 Ca 0.66 -0.76 -0.10 0.00 -0.80 0.00 0.00 55.06 54.07 1dsu s HIS 91 Cb -0.17 -2.14 0.23 0.00 -1.43 0.00 0.00 32.58 29.06 1dsu s HIS 91 CO 0.57 -1.01 1.79 -1.35 -2.00 0.00 0.00 174.74 172.74 1dsu h PRO 92 N 0.30 0.55 -0.79 -0.38 0.11 -1.99 -3.23 132.00 126.57 1dsu h PRO 92 Ca -0.31 -0.03 -0.49 0.00 0.11 0.00 0.00 66.00 65.28 1dsu h PRO 92 Cb 1.29 -0.12 -0.27 0.00 0.11 0.00 0.00 31.00 32.01 1dsu h PRO 92 CO 0.44 0.36 0.30 -0.25 -0.21 0.00 0.00 178.00 178.65 1dsu n ASP 93 N -4.87 4.84 -4.70 -2.05 8.00 -1.26 -4.95 116.55 111.56 1dsu n ASP 93 Ca 0.08 -3.74 -0.41 0.00 0.71 0.00 0.00 54.79 51.42 1dsu n ASP 93 Cb 0.19 -0.75 -0.03 0.00 -0.02 0.00 0.00 41.12 40.50 1dsu n ASP 93 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1dsu s SER 94 N -2.16 7.19 0.00 -2.24 0.01 -1.22 -4.87 113.70 110.40 1dsu s SER 94 Ca 0.55 1.44 0.00 0.00 1.31 0.00 0.00 55.95 59.26 1dsu s SER 94 Cb 0.46 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 64.18 1dsu s SER 94 CO 0.03 -0.28 0.00 1.67 0.41 0.00 0.00 173.24 175.07 1dsu n GLN 95 N 4.29 0.00 0.39 12.44 7.27 -1.26 -5.02 117.38 135.48 1dsu n GLN 95 Ca 0.04 0.00 -0.18 0.00 0.07 0.00 0.00 57.00 56.93 1dsu n GLN 95 Cb 0.50 0.00 -0.09 0.00 2.41 0.00 0.00 30.24 33.06 1dsu n GLN 95 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 1dsu h PRO 96 N 0.00 -0.92 0.00 3.69 0.13 -2.03 -3.23 132.00 129.64 1dsu h PRO 96 Ca 0.00 0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1dsu h PRO 96 Cb 0.00 0.21 0.00 0.00 0.13 0.00 0.00 31.00 31.34 1dsu h PRO 96 CO 0.00 -0.61 0.00 -0.40 -0.23 0.00 0.00 178.00 176.76 1dsu n ASP 97 N -5.50 0.00 -0.28 1.44 5.68 -1.26 -3.98 116.55 112.65 1dsu n ASP 97 Ca -0.14 -0.31 0.03 0.00 -0.50 0.00 0.00 54.79 53.87 1dsu n ASP 97 Cb 0.38 -0.19 0.05 0.00 -1.14 0.00 0.00 41.12 40.22 1dsu n ASP 97 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1dsu n THR 98 N -1.19 0.34 0.25 2.12 -2.24 -1.22 -4.73 114.28 107.62 1dsu n THR 98 Ca 0.14 -0.67 0.13 0.00 -2.27 0.00 0.00 64.05 61.38 1dsu n THR 98 Cb 0.16 0.91 0.63 0.00 -2.10 0.00 0.00 70.33 69.93 1dsu n THR 98 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1dsu h ILE 99 N 1.16 0.40 -0.56 2.28 2.10 -1.69 -3.20 117.51 118.01 1dsu h ILE 99 Ca 0.00 -0.75 -0.05 0.00 1.08 0.00 0.00 64.86 65.15 1dsu h ILE 99 Cb 0.38 1.54 -0.03 0.00 -1.09 0.00 0.00 36.82 37.63 1dsu h ILE 99 CO 0.00 0.13 0.15 0.44 -1.08 0.00 0.00 178.15 177.79 1dsu h ASP 100 N 0.00 0.78 -0.50 2.19 5.19 -1.88 -3.21 116.42 118.99 1dsu h ASP 100 Ca -0.00 -0.13 -0.37 0.00 -0.62 0.00 0.00 57.03 55.91 1dsu h ASP 100 Cb 0.53 -0.20 -0.34 0.00 0.18 0.00 0.00 39.33 39.50 1dsu h ASP 100 CO 0.02 0.75 -0.82 1.41 -3.12 0.00 0.00 179.24 177.48 1dsu n HIS 101 N -4.28 1.79 -4.05 4.55 8.25 -1.22 -4.47 115.22 115.78 1dsu n HIS 101 Ca 0.04 -1.96 -0.27 0.00 -0.26 0.00 0.00 57.72 55.27 1dsu n HIS 101 Cb 0.21 -0.29 -0.05 0.00 1.12 0.00 0.00 29.99 30.98 1dsu n HIS 101 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1dsu s ASP 102 N -3.47 5.64 0.24 0.41 1.01 -1.21 -4.84 116.67 114.46 1dsu s ASP 102 Ca 0.43 -0.05 0.07 0.00 0.71 0.00 0.00 52.55 53.71 1dsu s ASP 102 Cb 0.39 -1.52 -0.04 0.00 1.01 0.00 0.00 42.92 42.76 1dsu s ASP 102 CO -0.01 0.09 0.20 -0.76 0.21 0.00 0.00 175.17 174.90 1dsu s LEU 103 N -2.94 3.84 -0.10 1.23 1.43 -1.26 -1.78 118.68 119.09 1dsu s LEU 103 Ca 0.31 -0.22 -0.05 0.00 -1.03 0.00 0.00 54.13 53.14 1dsu s LEU 103 Cb -0.11 -2.38 0.04 0.00 0.03 0.00 0.00 46.19 43.78 1dsu s LEU 103 CO 0.24 -0.03 0.23 -0.22 0.23 0.00 0.00 176.35 176.80 1dsu s LEU 104 N -3.78 0.47 -0.29 1.79 2.96 -0.42 -4.37 118.68 115.04 1dsu s LEU 104 Ca 0.33 0.50 -0.11 0.00 -0.22 0.00 0.00 54.13 54.62 1dsu s LEU 104 Cb -0.08 0.69 -0.04 0.00 0.50 0.00 0.00 46.19 47.26 1dsu s LEU 104 CO 0.25 -0.16 0.19 -0.76 -1.32 0.00 0.00 176.35 174.55 1dsu s LEU 105 N 1.22 4.07 -0.22 -0.68 1.43 -1.03 -1.18 118.68 122.29 1dsu s LEU 105 Ca -0.09 -0.12 -0.11 0.00 -1.03 0.00 0.00 54.13 52.78 1dsu s LEU 105 Cb -0.10 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 1dsu s LEU 105 CO -0.08 -0.09 0.19 -0.76 0.23 0.00 0.00 176.35 175.85 1dsu s LEU 106 N 1.74 4.16 -0.28 1.79 1.02 0.88 -0.19 118.68 127.79 1dsu s LEU 106 Ca 0.07 0.23 -0.10 0.00 0.02 0.00 0.00 54.13 54.35 1dsu s LEU 106 Cb -0.16 -2.18 -0.04 0.00 0.02 0.00 0.00 46.19 43.83 1dsu s LEU 106 CO 0.10 0.08 0.16 -1.58 0.02 0.00 0.00 176.35 175.13 1dsu s GLN 107 N 0.84 3.78 0.72 1.70 0.74 0.31 -1.02 119.66 126.73 1dsu s GLN 107 Ca 0.10 -0.42 -0.12 0.00 0.05 0.00 0.00 55.36 54.96 1dsu s GLN 107 Cb -0.13 -3.57 0.03 0.00 1.10 0.00 0.00 33.01 30.44 1dsu s GLN 107 CO 0.03 -0.22 1.10 -0.51 -0.55 0.00 0.00 175.29 175.13 1dsu s LEU 108 N 1.70 3.18 0.59 3.68 1.43 -0.58 0.55 118.68 129.24 1dsu s LEU 108 Ca 0.07 1.88 0.35 0.00 -1.03 0.00 0.00 54.13 55.40 1dsu s LEU 108 Cb -0.16 -4.53 1.88 0.00 0.03 0.00 0.00 46.19 43.41 1dsu s LEU 108 CO 0.08 -1.84 2.21 0.77 0.23 0.00 0.00 176.35 177.80 1dsu h SER 109 N -0.66 0.00 -5.02 2.29 4.64 -1.22 -3.40 113.55 110.18 1dsu h SER 109 Ca -0.45 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.88 1dsu h SER 109 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.30 1dsu h SER 109 CO 0.53 0.03 0.24 -1.83 -0.87 0.00 0.00 176.83 174.93 1dsu s GLU 110 N -4.19 2.03 0.10 4.77 -1.05 -1.26 -5.02 118.70 114.09 1dsu s GLU 110 Ca -0.03 -1.26 -0.31 0.00 -0.15 0.00 0.00 54.97 53.22 1dsu s GLU 110 Cb 0.13 0.61 -0.07 0.00 -0.44 0.00 0.00 34.13 34.36 1dsu s GLU 110 CO 0.51 -0.94 1.27 0.15 0.95 0.00 0.00 175.26 177.19 1dsu s LYS 111 N -3.02 4.40 0.36 -4.83 1.02 -1.26 -4.61 119.74 111.80 1dsu s LYS 111 Ca 0.14 1.90 -0.27 0.00 0.02 0.00 0.00 55.97 57.76 1dsu s LYS 111 Cb -0.05 -3.29 -0.10 0.00 -0.52 0.00 0.00 37.83 33.87 1dsu s LYS 111 CO 0.10 -0.30 1.31 0.00 -0.92 0.00 0.00 175.35 175.54 1dsu s ALA 112 N 0.88 3.39 -0.46 5.17 0.00 0.11 -4.95 121.76 125.90 1dsu s ALA 112 Ca 0.60 1.25 -0.29 0.00 0.00 0.00 0.00 51.96 53.52 1dsu s ALA 112 Cb -0.33 -3.48 0.03 0.00 0.00 0.00 0.00 23.12 19.34 1dsu s ALA 112 CO 0.31 -0.72 1.14 0.99 0.00 0.00 0.00 175.76 177.48 1dsu s THR 113 N -1.20 4.22 0.40 0.00 2.01 -1.26 -4.94 115.64 114.87 1dsu s THR 113 Ca 0.52 1.26 -0.07 0.00 0.31 0.00 0.00 61.69 63.71 1dsu s THR 113 Cb -0.39 -4.58 -0.05 0.00 0.01 0.00 0.00 72.50 67.49 1dsu s THR 113 CO 0.51 -0.97 0.72 -0.76 -0.69 0.00 0.00 174.62 173.44 1dsu s LEU 114 N 4.42 3.82 0.00 4.42 1.43 -1.26 -4.80 118.68 126.70 1dsu s LEU 114 Ca 0.48 0.96 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 1dsu s LEU 114 Cb -0.08 -3.85 0.00 0.00 0.03 0.00 0.00 46.19 42.30 1dsu s LEU 114 CO 0.31 -0.41 0.00 0.61 0.23 0.00 0.00 176.35 177.08 1dsu n GLY 115 N -1.56 0.57 0.25 -3.19 0.00 0.11 -4.93 105.19 96.44 1dsu n GLY 115 Ca 0.01 -0.81 0.17 0.00 0.00 0.00 0.00 46.02 45.39 1dsu n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dsu h PRO 118 N 0.00 0.00 -0.05 1.61 0.13 -1.98 -2.11 132.00 129.59 1dsu h PRO 118 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1dsu h PRO 118 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1dsu h PRO 118 CO 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 177.77 1dsu n ALA 119 N -1.92 2.44 -3.50 -0.56 0.00 -1.26 -4.77 120.51 110.94 1dsu n ALA 119 Ca -0.02 -0.65 -0.19 0.00 0.00 0.00 0.00 53.44 52.58 1dsu n ALA 119 Cb 0.05 -0.35 -0.13 0.00 0.00 0.00 0.00 19.45 19.03 1dsu n ALA 119 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1dsu s VAL 120 N -0.86 -0.32 -0.24 0.00 1.01 -0.79 -3.90 120.40 115.30 1dsu s VAL 120 Ca 0.13 -0.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.87 1dsu s VAL 120 Cb 0.09 -0.68 0.08 0.00 0.00 0.00 0.00 36.38 35.87 1dsu s VAL 120 CO 0.13 -0.21 0.56 -0.13 0.00 0.00 0.00 175.10 175.45 1dsu s ARG 121 N 2.32 0.55 0.89 2.72 0.52 -0.79 -0.71 118.95 124.46 1dsu s ARG 121 Ca 0.07 1.08 -0.11 0.00 -0.52 0.00 0.00 55.73 56.24 1dsu s ARG 121 Cb -0.16 0.17 0.11 0.00 0.52 0.00 0.00 34.95 35.59 1dsu s ARG 121 CO -0.12 -0.17 1.03 -2.30 0.02 0.00 0.00 175.30 173.76 1dsu n PRO 122 N 4.50 -0.27 -4.83 3.54 -0.02 -1.26 -2.98 135.00 133.68 1dsu n PRO 122 Ca -0.19 -0.01 -0.33 0.00 -2.02 0.00 0.00 63.50 60.95 1dsu n PRO 122 Cb 0.56 -2.29 -0.16 0.00 -0.02 0.00 0.00 33.50 31.58 1dsu n PRO 122 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1dsu s LEU 123 N -5.35 2.24 0.57 2.45 2.96 -1.00 -4.89 118.68 115.66 1dsu s LEU 123 Ca 0.67 -0.54 -0.20 0.00 -0.22 0.00 0.00 54.13 53.84 1dsu s LEU 123 Cb -0.24 -1.47 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 1dsu s LEU 123 CO 0.58 0.12 1.25 -2.16 -1.32 0.00 0.00 176.35 174.82 1dsu s PRO 124 N 0.62 3.05 0.30 0.98 0.05 -1.26 -4.74 135.00 133.99 1dsu s PRO 124 Ca -0.11 1.96 0.09 0.00 0.05 0.00 0.00 61.00 62.99 1dsu s PRO 124 Cb -0.16 -2.06 -0.04 0.00 0.05 0.00 0.00 34.50 32.28 1dsu s PRO 124 CO 0.03 -1.18 0.04 1.67 0.05 0.00 0.00 177.00 177.61 1dsu s TRP 124 N -1.48 2.69 0.00 0.56 -2.14 -1.26 -2.11 118.94 115.20 1dsu s TRP 124 Ca 0.75 -0.29 -0.30 0.00 2.66 0.00 0.00 56.10 58.91 1dsu s TRP 124 Cb -0.34 -1.37 -0.05 0.00 -3.10 0.00 0.00 33.47 28.62 1dsu s TRP 124 CO 0.38 0.52 1.23 -1.14 -2.66 0.00 0.00 176.95 175.27 1dsu s GLN 125 N -3.73 4.38 0.00 3.25 2.00 -0.67 -4.86 119.66 120.03 1dsu s GLN 125 Ca 0.34 1.75 0.08 0.00 -2.00 0.00 0.00 55.36 55.53 1dsu s GLN 125 Cb -0.04 -3.47 0.08 0.00 0.80 0.00 0.00 33.01 30.38 1dsu s GLN 125 CO 0.21 -0.38 0.79 2.89 -0.50 0.00 0.00 175.29 178.30 1dsu n ARG 126 N 4.67 0.40 -3.68 1.67 1.85 -1.26 -3.32 116.66 116.98 1dsu n ARG 126 Ca 0.10 -1.06 -0.38 0.00 -1.00 0.00 0.00 57.85 55.51 1dsu n ARG 126 Cb 0.46 -1.15 -0.12 0.00 -1.05 0.00 0.00 32.46 30.60 1dsu n ARG 126 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1dsu s VAL 127 N -0.68 4.61 -1.12 8.89 1.01 -1.26 -4.94 120.40 126.92 1dsu s VAL 127 Ca 0.10 -0.25 -0.22 0.00 0.00 0.00 0.00 61.98 61.60 1dsu s VAL 127 Cb 0.07 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 1dsu s VAL 127 CO 0.10 0.18 1.85 -0.62 0.00 0.00 0.00 175.10 176.61 1dsu s ASP 128 N 1.64 5.55 -0.09 3.32 -1.08 -1.26 -4.82 116.67 119.93 1dsu s ASP 128 Ca 0.06 -1.54 -0.07 0.00 -0.52 0.00 0.00 52.55 50.48 1dsu s ASP 128 Cb -0.16 -2.58 0.03 0.00 -1.46 0.00 0.00 42.92 38.75 1dsu s ASP 128 CO 0.06 -2.47 0.23 -0.60 0.52 0.00 0.00 175.17 172.91 1dsu s ARG 129 N 6.03 0.24 0.44 4.34 3.52 -1.26 -5.09 118.95 127.17 1dsu s ARG 129 Ca 0.64 0.37 -0.23 0.00 -0.13 0.00 0.00 55.73 56.38 1dsu s ARG 129 Cb -0.01 0.05 -0.08 0.00 -1.56 0.00 0.00 34.95 33.35 1dsu s ARG 129 CO 0.06 -0.07 1.12 -0.51 -0.81 0.00 0.00 175.30 175.09 1dsu s ASP 129 N 0.46 6.38 0.22 -2.12 1.01 -1.26 -5.00 116.67 116.36 1dsu s ASP 129 Ca -0.03 2.19 -0.30 0.00 0.71 0.00 0.00 52.55 55.13 1dsu s ASP 129 Cb -0.04 -2.59 -0.09 0.00 1.01 0.00 0.00 42.92 41.21 1dsu s ASP 129 CO -0.02 -0.76 1.25 -0.69 0.21 0.00 0.00 175.17 175.16 1dsu s VAL 130 N -1.61 3.29 0.32 -1.27 1.01 -1.26 -4.96 120.40 115.92 1dsu s VAL 130 Ca 0.62 1.11 -0.29 0.00 0.00 0.00 0.00 61.98 63.41 1dsu s VAL 130 Cb -0.26 -3.71 -0.11 0.00 0.00 0.00 0.00 36.38 32.31 1dsu s VAL 130 CO 0.31 0.19 1.51 0.00 0.00 0.00 0.00 175.10 177.11 1dsu s ALA 131 N -0.21 3.65 0.52 5.51 0.00 -1.26 -4.93 121.76 125.04 1dsu s ALA 131 Ca 0.53 1.51 -0.22 0.00 0.00 0.00 0.00 51.96 53.78 1dsu s ALA 131 Cb -0.35 -3.61 -0.07 0.00 0.00 0.00 0.00 23.12 19.09 1dsu s ALA 131 CO 0.40 -0.94 1.12 -2.30 0.00 0.00 0.00 175.76 174.04 1dsu n PRO 132 N 1.53 1.36 0.00 0.00 -0.02 -1.26 -2.21 135.00 134.39 1dsu n PRO 132 Ca 0.05 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1dsu n PRO 132 Cb 0.39 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1dsu n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dsu n GLY 133 N 1.06 2.03 3.75 -1.23 0.00 0.72 -4.93 105.19 106.59 1dsu n GLY 133 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1dsu n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dsu s THR 134 N -2.46 2.44 -0.26 2.61 2.01 -0.94 -4.50 115.64 114.55 1dsu s THR 134 Ca 0.00 0.39 -0.21 0.00 0.31 0.00 0.00 61.69 62.17 1dsu s THR 134 Cb 0.00 -3.25 -0.01 0.00 0.01 0.00 0.00 72.50 69.25 1dsu s THR 134 CO 0.00 0.07 0.67 -0.76 -0.69 0.00 0.00 174.62 173.91 1dsu s LEU 135 N -0.81 4.08 0.12 4.42 2.01 -1.26 0.22 118.68 127.46 1dsu s LEU 135 Ca 0.58 0.72 0.11 0.00 0.01 0.00 0.00 54.13 55.55 1dsu s LEU 135 Cb -0.44 -2.92 -0.04 0.00 0.01 0.00 0.00 46.19 42.81 1dsu s LEU 135 CO 0.48 -0.42 -0.25 0.00 1.01 0.00 0.00 176.35 177.16 1dsu s ASP 137 N -2.05 6.05 -0.12 0.00 2.15 0.26 -0.66 116.67 122.30 1dsu s ASP 137 Ca 0.15 0.15 0.01 0.00 0.43 0.00 0.00 52.55 53.29 1dsu s ASP 137 Cb -0.10 -2.07 -0.01 0.00 -0.30 0.00 0.00 42.92 40.44 1dsu s ASP 137 CO 0.07 0.13 -0.17 -0.69 -0.17 0.00 0.00 175.17 174.33 1dsu s VAL 138 N 0.69 2.66 0.22 1.11 1.01 -0.50 -0.92 120.40 124.67 1dsu s VAL 138 Ca 0.07 -0.80 0.09 0.00 0.00 0.00 0.00 61.98 61.34 1dsu s VAL 138 Cb -0.12 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 1dsu s VAL 138 CO 0.01 0.54 -0.17 0.00 0.00 0.00 0.00 175.10 175.47 1dsu s ALA 139 N 0.37 2.29 0.00 5.51 0.00 -1.24 -1.05 121.76 127.63 1dsu s ALA 139 Ca -0.14 -1.70 0.00 0.00 0.00 0.00 0.00 51.96 50.12 1dsu s ALA 139 Cb -0.17 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 22.78 1dsu s ALA 139 CO 0.07 0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.42 1dsu n GLY 140 N -0.31 1.07 1.03 0.00 0.00 -0.40 -4.54 105.19 102.04 1dsu n GLY 140 Ca -0.08 -0.92 -0.01 0.00 0.00 0.00 0.00 46.02 45.00 1dsu n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dsu n TRP 141 N -0.41 0.89 -1.73 1.61 8.01 -1.26 -1.91 117.44 122.65 1dsu n TRP 141 Ca 0.00 -1.50 -0.20 0.00 -1.31 0.00 0.00 57.50 54.48 1dsu n TRP 141 Cb 0.00 -0.43 0.14 0.00 -2.01 0.00 0.00 31.31 29.01 1dsu n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1dsu n GLY 142 N -1.08 -1.21 3.62 6.99 0.00 -1.25 -4.50 105.19 107.77 1dsu n GLY 142 Ca 0.30 -1.73 -0.45 0.00 0.00 0.00 0.00 46.02 44.14 1dsu n GLY 142 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1dsu n ILE 143 N -3.21 1.43 0.52 -0.61 -0.00 0.35 -3.16 119.36 114.68 1dsu n ILE 143 Ca 0.12 -0.36 0.08 0.00 -0.00 0.00 0.00 62.75 62.59 1dsu n ILE 143 Cb 0.41 -1.16 -0.11 0.00 -0.00 0.00 0.00 39.64 38.77 1dsu n ILE 143 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 176.55 177.10 1dsu n VAL 144 N 1.02 0.00 -4.02 1.39 3.14 -0.04 -0.72 118.33 119.10 1dsu n VAL 144 Ca 0.11 -0.21 -0.10 0.00 -2.96 0.00 0.00 64.34 61.19 1dsu n VAL 144 Cb 0.30 0.68 -0.06 0.00 -1.06 0.00 0.00 33.84 33.70 1dsu n VAL 144 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1dsu s ASN 145 N -3.14 -0.03 0.48 6.55 2.20 -1.26 -4.44 114.94 115.30 1dsu s ASN 145 Ca 0.02 -0.98 0.30 0.00 -0.94 0.00 0.00 52.86 51.26 1dsu s ASN 145 Cb 0.12 0.52 1.13 0.00 -2.00 0.00 0.00 41.25 41.02 1dsu s ASN 145 CO 0.72 -1.03 1.88 0.45 -2.94 0.00 0.00 177.10 176.18 1dsu h HIS 146 N 2.38 0.00 0.00 1.54 3.86 -1.96 -2.40 115.15 118.58 1dsu h HIS 146 Ca -0.29 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.92 1dsu h HIS 146 Cb 1.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.72 1dsu h HIS 146 CO 0.39 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.18 1dsu n ALA 147 N -2.03 2.20 -0.16 2.45 0.00 -1.26 -4.91 120.51 116.81 1dsu n ALA 147 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1dsu n ALA 147 Cb 0.33 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1dsu n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dsu n GLY 149 N 1.00 0.90 3.68 0.00 0.00 -0.90 -5.04 105.19 104.84 1dsu n GLY 149 Ca 0.08 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1dsu n GLY 149 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1dsu s ARG 150 N -0.34 4.15 -0.17 1.61 3.52 -1.26 -4.83 118.95 121.63 1dsu s ARG 150 Ca 0.00 2.55 -0.14 0.00 -0.13 0.00 0.00 55.73 58.00 1dsu s ARG 150 Cb 0.00 -3.79 -0.04 0.00 -1.56 0.00 0.00 34.95 29.55 1dsu s ARG 150 CO 0.00 -0.86 0.32 1.03 -0.81 0.00 0.00 175.30 174.98 1dsu s ARG 151 N 3.33 4.24 0.62 5.12 1.81 -1.26 -0.86 118.95 131.94 1dsu s ARG 151 Ca 0.82 0.13 -0.10 0.00 -1.72 0.00 0.00 55.73 54.85 1dsu s ARG 151 Cb -0.44 -3.45 -0.03 0.00 -0.45 0.00 0.00 34.95 30.58 1dsu s ARG 151 CO 0.37 0.17 1.01 -1.25 -0.68 0.00 0.00 175.30 174.92 1dsu s PRO 152 N 0.68 3.49 -0.21 3.54 0.04 -1.26 -4.98 135.00 136.29 1dsu s PRO 152 Ca 0.17 0.64 -0.08 0.00 0.04 0.00 0.00 61.00 61.77 1dsu s PRO 152 Cb -0.13 -2.11 -0.19 0.00 0.04 0.00 0.00 34.50 32.11 1dsu s PRO 152 CO 0.05 -0.59 0.00 -3.47 0.04 0.00 0.00 177.00 173.03 1dsu n ASP 153 N -2.73 2.00 -4.91 6.66 2.03 -1.26 -4.94 116.55 113.41 1dsu n ASP 153 Ca 0.05 0.17 -0.29 0.00 0.52 0.00 0.00 54.79 55.24 1dsu n ASP 153 Cb 0.55 -0.73 -0.04 0.00 -0.72 0.00 0.00 41.12 40.18 1dsu n ASP 153 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1dsu s SER 154 N -6.94 6.44 0.19 1.67 0.01 -1.26 -1.54 113.70 112.26 1dsu s SER 154 Ca -0.31 0.60 -0.32 0.00 1.31 0.00 0.00 55.95 57.24 1dsu s SER 154 Cb 0.09 -2.10 -0.11 0.00 0.21 0.00 0.00 66.02 64.11 1dsu s SER 154 CO 0.63 -0.10 1.68 -0.22 0.41 0.00 0.00 173.24 175.64 1dsu s LEU 155 N -3.30 4.37 0.36 2.44 2.96 -0.92 -4.89 118.68 119.70 1dsu s LEU 155 Ca 0.42 2.78 0.08 0.00 -0.22 0.00 0.00 54.13 57.19 1dsu s LEU 155 Cb -0.11 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 1dsu s LEU 155 CO 0.28 -0.93 0.24 -1.10 -1.32 0.00 0.00 176.35 173.52 1dsu s GLN 156 N 1.30 2.51 0.00 1.98 -1.52 -0.80 0.44 119.66 123.56 1dsu s GLN 156 Ca 0.74 -1.48 -0.28 0.00 -1.95 0.00 0.00 55.36 52.39 1dsu s GLN 156 Cb -0.48 -2.30 0.10 0.00 -0.22 0.00 0.00 33.01 30.11 1dsu s GLN 156 CO 0.32 0.03 0.82 -3.38 -0.25 0.00 0.00 175.29 172.83 1dsu s HIS 157 N -2.41 -0.43 0.03 0.91 -3.43 -0.19 -1.28 115.29 108.50 1dsu s HIS 157 Ca 0.41 0.42 -0.10 0.00 -0.80 0.00 0.00 55.06 54.98 1dsu s HIS 157 Cb -0.03 0.51 0.01 0.00 -1.43 0.00 0.00 32.58 31.64 1dsu s HIS 157 CO 0.25 -0.59 0.21 0.14 -2.00 0.00 0.00 174.74 172.75 1dsu s VAL 158 N -2.70 0.09 -0.28 -5.38 -7.23 -0.22 -1.56 120.40 103.12 1dsu s VAL 158 Ca 0.01 -0.78 -0.12 0.00 -1.81 0.00 0.00 61.98 59.28 1dsu s VAL 158 Cb -0.01 -0.79 -0.04 0.00 0.56 0.00 0.00 36.38 36.10 1dsu s VAL 158 CO -0.06 -0.43 0.25 -0.76 -0.31 0.00 0.00 175.10 173.79 1dsu s LEU 159 N -1.86 4.08 -0.10 1.32 1.02 -1.26 -1.41 118.68 120.47 1dsu s LEU 159 Ca -0.08 0.02 0.03 0.00 0.02 0.00 0.00 54.13 54.12 1dsu s LEU 159 Cb -0.03 -2.20 0.01 0.00 0.02 0.00 0.00 46.19 43.99 1dsu s LEU 159 CO -0.02 -0.11 -0.19 -0.76 0.02 0.00 0.00 176.35 175.29 1dsu s LEU 160 N 1.84 1.92 0.29 1.79 1.43 0.16 -4.92 118.68 121.19 1dsu s LEU 160 Ca 0.09 -0.48 -0.29 0.00 -1.03 0.00 0.00 54.13 52.42 1dsu s LEU 160 Cb -0.16 -1.21 -0.10 0.00 0.03 0.00 0.00 46.19 44.75 1dsu s LEU 160 CO 0.11 0.10 1.18 -2.16 0.23 0.00 0.00 176.35 175.80 1dsu s PRO 161 N 0.58 4.53 0.24 1.29 0.04 -1.26 -1.05 135.00 139.38 1dsu s PRO 161 Ca -0.15 1.94 -0.30 0.00 0.04 0.00 0.00 61.00 62.54 1dsu s PRO 161 Cb -0.17 -3.16 -0.09 0.00 0.04 0.00 0.00 34.50 31.12 1dsu s PRO 161 CO 0.05 0.05 1.27 0.08 0.04 0.00 0.00 177.00 178.49 1dsu s VAL 162 N -1.02 3.15 -0.17 -0.36 1.01 0.13 -2.00 120.40 121.13 1dsu s VAL 162 Ca 0.47 1.02 -0.09 0.00 0.00 0.00 0.00 61.98 63.38 1dsu s VAL 162 Cb -0.35 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 1dsu s VAL 162 CO 0.44 0.19 0.12 -0.22 0.00 0.00 0.00 175.10 175.63 1dsu s LEU 163 N -0.73 4.18 0.33 3.92 0.20 -0.19 -0.20 118.68 126.19 1dsu s LEU 163 Ca 0.53 0.27 -0.28 0.00 0.69 0.00 0.00 54.13 55.33 1dsu s LEU 163 Cb -0.36 -2.06 -0.10 0.00 -0.43 0.00 0.00 46.19 43.24 1dsu s LEU 163 CO 0.42 0.24 1.25 1.51 -0.29 0.00 0.00 176.35 179.49 1dsu s ASP 164 N -0.02 6.80 0.38 3.68 -4.77 -1.26 -4.09 116.67 117.40 1dsu s ASP 164 Ca 0.09 2.57 0.10 0.00 -3.30 0.00 0.00 52.55 52.01 1dsu s ASP 164 Cb -0.11 -2.64 0.86 0.00 -1.09 0.00 0.00 42.92 39.93 1dsu s ASP 164 CO -0.00 -0.50 1.93 -0.09 0.70 0.00 0.00 175.17 177.21 1dsu h ARG 165 N 3.33 0.61 0.07 2.11 2.43 -1.96 -1.79 114.38 119.18 1dsu h ARG 165 Ca -0.49 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 58.66 1dsu h ARG 165 Cb 1.23 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.62 1dsu h ARG 165 CO 0.65 0.40 -0.12 0.00 -1.51 0.00 0.00 179.97 179.39 1dsu h ALA 166 N 1.62 -0.20 -0.33 2.80 0.00 -1.98 -0.63 119.26 120.55 1dsu h ALA 166 Ca 0.36 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 1dsu h ALA 166 Cb 0.54 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1dsu h ALA 166 CO -0.13 -0.64 -0.12 1.15 0.00 0.00 0.00 179.25 179.52 1dsu h THR 167 N -0.24 1.24 0.00 0.00 2.02 -1.79 -2.67 112.91 111.47 1dsu h THR 167 Ca 0.02 -1.06 -0.07 0.00 0.77 0.00 0.00 66.41 66.07 1dsu h THR 167 Cb 0.26 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1dsu h THR 167 CO -0.07 0.35 -0.34 0.00 0.37 0.00 0.00 175.52 175.83 1dsu s ASN 169 N -6.66 6.60 -0.13 0.00 0.02 -0.28 -0.68 114.94 113.81 1dsu s ASN 169 Ca -0.02 -1.97 0.17 0.00 -1.02 0.00 0.00 52.86 50.03 1dsu s ASN 169 Cb 0.13 -2.41 -0.24 0.00 0.02 0.00 0.00 41.25 38.75 1dsu s ASN 169 CO 0.69 -1.10 0.30 -1.14 0.02 0.00 0.00 177.10 175.88 1dsu n ARG 170 N 6.70 0.67 0.20 -0.60 0.63 -1.26 -1.97 116.66 121.04 1dsu n ARG 170 Ca 0.23 0.06 0.10 0.00 -0.92 0.00 0.00 57.85 57.31 1dsu n ARG 170 Cb 0.49 -1.60 0.21 0.00 0.45 0.00 0.00 32.46 32.01 1dsu n ARG 170 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1dsu h THR 170 N 0.00 0.29 0.00 5.15 1.35 -1.95 -3.39 112.91 114.35 1dsu h THR 170 Ca -0.40 -1.30 0.00 0.00 -0.55 0.00 0.00 66.41 64.16 1dsu h THR 170 Cb 2.01 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 70.48 1dsu h THR 170 CO 0.04 0.16 0.00 1.41 -0.25 0.00 0.00 175.52 176.87 1dsu n HIS 171 N -3.16 0.00 -0.45 4.73 8.25 -1.26 -4.78 115.22 118.55 1dsu n HIS 171 Ca 0.03 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.58 1dsu n HIS 171 Cb 0.55 0.00 0.29 0.00 1.12 0.00 0.00 29.99 31.95 1dsu n HIS 171 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1dsu n HIS 172 N 0.00 1.02 -4.38 4.41 8.25 0.15 -4.82 115.22 119.85 1dsu n HIS 172 Ca 0.00 -0.56 -0.39 0.00 -0.26 0.00 0.00 57.72 56.51 1dsu n HIS 172 Cb 0.00 -0.11 -0.06 0.00 1.12 0.00 0.00 29.99 30.95 1dsu n HIS 172 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1dsu n ASP 173 N 1.06 -2.34 0.00 0.41 -0.08 -1.21 -1.93 116.55 112.46 1dsu n ASP 173 Ca 0.22 -1.14 0.00 0.00 -1.51 0.00 0.00 54.79 52.36 1dsu n ASP 173 Cb 0.68 -2.16 0.00 0.00 2.34 0.00 0.00 41.12 41.98 1dsu n ASP 173 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1dsu n GLY 174 N -1.31 0.72 0.23 0.27 0.00 -0.83 -4.93 105.19 99.35 1dsu n GLY 174 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 1dsu n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dsu h ALA 175 N 0.00 0.99 -1.75 4.61 0.00 -1.70 -3.43 119.26 117.98 1dsu h ALA 175 Ca 0.00 -0.03 -0.57 0.00 0.00 0.00 0.00 54.91 54.31 1dsu h ALA 175 Cb 0.00 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.70 1dsu h ALA 175 CO 0.00 0.04 0.84 0.42 0.00 0.00 0.00 179.25 180.54 1dsu s ILE 176 N -3.35 4.24 0.66 0.00 -1.09 -1.26 -5.01 121.20 115.39 1dsu s ILE 176 Ca 0.05 1.02 0.02 0.00 -2.23 0.00 0.00 60.65 59.51 1dsu s ILE 176 Cb 0.06 -4.58 0.13 0.00 -1.58 0.00 0.00 42.46 36.49 1dsu s ILE 176 CO 0.63 -1.03 0.90 0.35 -1.23 0.00 0.00 174.94 174.57 1dsu n THR 177 N 6.70 0.00 0.31 2.92 -2.24 -1.26 -4.96 114.28 115.75 1dsu n THR 177 Ca 0.10 -1.57 0.20 0.00 -2.27 0.00 0.00 64.05 60.51 1dsu n THR 177 Cb 0.49 -0.83 0.99 0.00 -2.10 0.00 0.00 70.33 68.88 1dsu n THR 177 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1dsu h GLU 178 N 0.00 0.00 -0.01 -0.78 4.11 -2.00 -1.81 114.58 114.09 1dsu h GLU 178 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.13 1dsu h GLU 178 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1dsu h GLU 178 CO 0.34 0.00 -0.13 0.54 0.07 0.00 0.00 179.01 179.83 1dsu n ARG 179 N -3.03 1.38 -4.43 1.06 1.74 -1.26 -4.91 116.66 107.20 1dsu n ARG 179 Ca -0.02 -0.88 -0.24 0.00 -0.77 0.00 0.00 57.85 55.95 1dsu n ARG 179 Cb 0.16 -1.48 -0.09 0.00 -1.02 0.00 0.00 32.46 30.02 1dsu n ARG 179 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1dsu s LEU 180 N -2.23 2.74 0.05 0.55 1.43 -0.68 -0.24 118.68 120.30 1dsu s LEU 180 Ca 0.30 -0.96 -0.04 0.00 -1.03 0.00 0.00 54.13 52.41 1dsu s LEU 180 Cb 0.20 -1.23 -0.02 0.00 0.03 0.00 0.00 46.19 45.17 1dsu s LEU 180 CO 0.42 0.01 0.05 0.00 0.23 0.00 0.00 176.35 177.06 1dsu s MET 181 N -3.56 0.65 0.22 1.70 0.23 0.01 -4.71 119.30 113.83 1dsu s MET 181 Ca 0.31 -1.01 0.11 0.00 -1.03 0.00 0.00 55.69 54.06 1dsu s MET 181 Cb -0.05 0.24 -0.05 0.00 -1.53 0.00 0.00 34.83 33.45 1dsu s MET 181 CO 0.16 -0.15 -0.20 0.00 -2.03 0.00 0.00 175.02 172.80 1dsu s ALA 183 N -2.23 0.94 0.42 0.00 0.00 -0.90 -1.02 121.76 118.97 1dsu s ALA 183 Ca 0.24 -1.06 -0.25 0.00 0.00 0.00 0.00 51.96 50.89 1dsu s ALA 183 Cb -0.05 0.04 -0.08 0.00 0.00 0.00 0.00 23.12 23.02 1dsu s ALA 183 CO 0.11 -0.03 1.26 -1.21 0.00 0.00 0.00 175.76 175.88 1dsu s GLU 184 N -2.44 3.89 -0.16 0.00 2.02 -0.85 -1.81 118.70 119.35 1dsu s GLU 184 Ca 0.01 2.03 0.16 0.00 0.02 0.00 0.00 54.97 57.19 1dsu s GLU 184 Cb -0.05 -2.65 0.34 0.00 0.10 0.00 0.00 34.13 31.87 1dsu s GLU 184 CO -0.00 -0.52 1.17 -1.13 0.02 0.00 0.00 175.26 174.81 1dsu n SER 185 N -0.06 2.09 -4.56 -0.19 3.41 -1.26 -4.68 113.62 108.38 1dsu n SER 185 Ca 0.05 -3.37 -0.27 0.00 -0.26 0.00 0.00 58.87 55.02 1dsu n SER 185 Cb 0.45 -0.46 -0.05 0.00 -0.26 0.00 0.00 64.21 63.89 1dsu n SER 185 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1dsu s ASN 186 N -2.99 5.02 0.00 4.04 2.47 -1.26 -2.98 114.94 119.24 1dsu s ASN 186 Ca 0.34 -0.47 0.00 0.00 0.42 0.00 0.00 52.86 53.15 1dsu s ASN 186 Cb 0.31 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.56 1dsu s ASN 186 CO -0.01 -2.82 0.00 -1.14 -3.72 0.00 0.00 177.10 169.41 1dsu n ARG 187 N 8.89 0.00 -2.34 0.43 3.00 -1.11 -4.84 116.66 120.69 1dsu n ARG 187 Ca 0.39 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.82 1dsu n ARG 187 Cb 0.47 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.90 1dsu n ARG 187 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1dsu s ARG 188 N 0.00 4.44 -0.19 -0.14 0.52 -1.26 -4.36 118.95 117.96 1dsu s ARG 188 Ca 0.00 1.90 -0.36 0.00 -0.52 0.00 0.00 55.73 56.75 1dsu s ARG 188 Cb 0.00 -3.26 0.15 0.00 0.52 0.00 0.00 34.95 32.36 1dsu s ARG 188 CO 0.00 -0.19 1.39 0.34 0.02 0.00 0.00 175.30 176.86 1dsu s ASP 189 N 0.50 -0.02 0.40 0.23 2.15 -0.99 -4.11 116.67 114.84 1dsu s ASP 189 Ca 0.56 -0.01 -0.05 0.00 0.43 0.00 0.00 52.55 53.48 1dsu s ASP 189 Cb -0.33 0.03 -0.04 0.00 -0.30 0.00 0.00 42.92 42.27 1dsu s ASP 189 CO 0.34 -0.05 0.69 -0.94 -0.17 0.00 0.00 175.17 175.04 1dsu s SER 190 N -2.46 6.36 0.00 -0.34 1.04 -1.26 -0.23 113.70 116.81 1dsu s SER 190 Ca 0.13 0.84 0.00 0.00 0.48 0.00 0.00 55.95 57.40 1dsu s SER 190 Cb 0.03 -2.20 0.00 0.00 0.10 0.00 0.00 66.02 63.95 1dsu s SER 190 CO -0.04 -0.41 0.00 0.00 0.98 0.00 0.00 173.24 173.77 1dsu n LYS 192 N 0.00 1.28 -0.17 0.00 4.81 -1.26 -1.10 118.16 121.72 1dsu n LYS 192 Ca 0.00 0.47 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 1dsu n LYS 192 Cb 0.00 -2.17 0.00 0.00 0.02 0.00 0.00 35.03 32.88 1dsu n LYS 192 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1dsu n GLY 193 N 4.07 0.63 0.01 3.14 0.00 -1.26 -0.49 105.19 111.28 1dsu n GLY 193 Ca 0.25 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.38 1dsu n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dsu n ASP 194 N 0.00 0.70 -4.75 1.61 8.00 -0.26 -3.79 116.55 118.06 1dsu n ASP 194 Ca 0.00 -0.66 -0.40 0.00 0.71 0.00 0.00 54.79 54.45 1dsu n ASP 194 Cb 0.00 1.21 0.03 0.00 -0.02 0.00 0.00 41.12 42.34 1dsu n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1dsu n SER 195 N -1.73 2.97 0.00 -2.24 7.64 -1.26 -2.23 113.62 116.77 1dsu n SER 195 Ca 0.02 1.07 0.00 0.00 1.01 0.00 0.00 58.87 60.96 1dsu n SER 195 Cb 0.40 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.02 1dsu n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dsu n GLY 196 N 0.68 1.91 3.85 0.23 0.00 0.17 -0.64 105.19 111.38 1dsu n GLY 196 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1dsu n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dsu s GLY 197 N -2.00 1.70 0.44 -0.02 0.00 -0.95 -3.18 107.32 103.32 1dsu s GLY 197 Ca 0.00 0.01 -0.21 0.00 0.00 0.00 0.00 44.72 44.52 1dsu s GLY 197 CO 0.00 0.29 0.98 2.56 0.00 0.00 0.00 173.10 176.93 1dsu s PRO 198 N -5.02 4.10 -0.32 2.90 0.05 -1.26 -0.43 135.00 135.03 1dsu s PRO 198 Ca 0.57 1.21 0.04 0.00 0.05 0.00 0.00 61.00 62.86 1dsu s PRO 198 Cb -0.12 -2.18 0.09 0.00 0.05 0.00 0.00 34.50 32.34 1dsu s PRO 198 CO 0.52 -0.15 0.00 -1.17 0.05 0.00 0.00 177.00 176.26 1dsu s LEU 199 N -3.23 4.36 -0.18 -3.56 1.98 -0.43 -3.69 118.68 113.91 1dsu s LEU 199 Ca 0.63 -1.91 -0.05 0.00 -2.89 0.00 0.00 54.13 49.91 1dsu s LEU 199 Cb -0.12 -1.61 -0.03 0.00 0.66 0.00 0.00 46.19 45.10 1dsu s LEU 199 CO 0.16 -0.32 -0.01 -0.69 -1.89 0.00 0.00 176.35 173.60 1dsu s VAL 200 N 0.97 3.97 -0.12 1.68 1.01 -0.10 -1.28 120.40 126.53 1dsu s VAL 200 Ca 0.05 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.73 1dsu s VAL 200 Cb -0.19 -2.78 0.01 0.00 0.00 0.00 0.00 36.38 33.42 1dsu s VAL 200 CO -0.07 0.45 -0.18 0.00 0.00 0.00 0.00 175.10 175.30 1dsu n GLY 202 N 4.12 -0.10 1.81 0.00 0.00 -1.26 -1.80 105.19 107.95 1dsu n GLY 202 Ca -0.19 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1dsu n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dsu n GLY 207 N -0.92 0.57 3.24 -0.02 0.00 -1.26 -5.02 105.19 101.77 1dsu n GLY 207 Ca -0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 1dsu n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dsu s VAL 208 N -2.07 1.79 -0.08 1.61 1.01 -0.75 -4.75 120.40 117.17 1dsu s VAL 208 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 60.74 1dsu s VAL 208 Cb 0.00 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 1dsu s VAL 208 CO 0.00 0.51 1.52 -0.22 0.00 0.00 0.00 175.10 176.91 1dsu s LEU 209 N -0.34 4.28 -0.07 3.92 0.20 -0.89 -0.95 118.68 124.82 1dsu s LEU 209 Ca 0.04 2.07 0.05 0.00 0.69 0.00 0.00 54.13 56.97 1dsu s LEU 209 Cb -0.10 -3.54 -0.08 0.00 -0.43 0.00 0.00 46.19 42.04 1dsu s LEU 209 CO 0.01 -0.87 -0.00 -0.62 -0.29 0.00 0.00 176.35 174.58 1dsu n GLU 210 N 6.88 2.21 -4.11 1.98 -0.58 -0.41 -1.66 120.64 124.95 1dsu n GLU 210 Ca 0.16 0.01 -0.12 0.00 -0.42 0.00 0.00 57.16 56.79 1dsu n GLU 210 Cb 0.43 -1.17 -0.07 0.00 -0.57 0.00 0.00 31.44 30.06 1dsu n GLU 210 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1dsu s GLY 211 N -4.09 1.15 -0.06 0.62 0.00 -0.94 -2.05 107.32 101.95 1dsu s GLY 211 Ca -0.05 -1.37 0.02 0.00 0.00 0.00 0.00 44.72 43.31 1dsu s GLY 211 CO 0.26 -1.04 -0.10 0.14 0.00 0.00 0.00 173.10 172.36 1dsu s VAL 212 N -3.88 0.97 0.15 1.40 1.01 -0.65 -1.32 120.40 118.09 1dsu s VAL 212 Ca 0.31 -0.39 -0.31 0.00 0.00 0.00 0.00 61.98 61.59 1dsu s VAL 212 Cb 0.03 -0.90 -0.11 0.00 0.00 0.00 0.00 36.38 35.40 1dsu s VAL 212 CO 0.13 0.32 1.78 -0.69 0.00 0.00 0.00 175.10 176.64 1dsu s VAL 213 N 0.66 2.39 -0.40 2.92 1.01 0.43 -1.72 120.40 125.69 1dsu s VAL 213 Ca -0.13 0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.01 1dsu s VAL 213 Cb -0.15 -3.04 0.29 0.00 0.00 0.00 0.00 36.38 33.48 1dsu s VAL 213 CO 0.03 0.00 0.70 1.07 0.00 0.00 0.00 175.10 176.90 1dsu n THR 214 N 4.46 -0.36 -0.12 3.92 5.66 -1.08 0.42 114.28 127.19 1dsu n THR 214 Ca 0.17 -3.65 -0.12 0.00 -3.05 0.00 0.00 64.05 57.40 1dsu n THR 214 Cb 0.37 -0.58 -0.03 0.00 -1.55 0.00 0.00 70.33 68.54 1dsu n THR 214 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 1dsu h SER 215 N 3.55 0.80 0.00 1.09 0.87 -1.82 -3.44 113.55 114.60 1dsu h SER 215 Ca 0.04 -0.43 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 1dsu h SER 215 Cb 0.95 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1dsu h SER 215 CO 0.42 1.05 0.00 0.61 -0.53 0.00 0.00 176.83 178.39 1dsu n GLY 216 N 0.01 1.95 2.10 5.77 0.00 -1.26 -2.75 105.19 111.00 1dsu n GLY 216 Ca -0.02 -0.56 -0.18 0.00 0.00 0.00 0.00 46.02 45.26 1dsu n GLY 216 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dsu n SER 217 N 2.90 3.98 -4.77 1.61 3.41 -1.26 -4.93 113.62 114.56 1dsu n SER 217 Ca 0.00 -3.51 -0.39 0.00 -0.26 0.00 0.00 58.87 54.71 1dsu n SER 217 Cb 0.00 -0.80 -0.01 0.00 -0.26 0.00 0.00 64.21 63.14 1dsu n SER 217 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1dsu s ARG 218 N -3.21 4.02 0.48 4.33 3.52 -1.11 -5.01 118.95 121.97 1dsu s ARG 218 Ca 0.56 1.95 -0.21 0.00 -0.13 0.00 0.00 55.73 57.89 1dsu s ARG 218 Cb 0.46 -2.71 -0.07 0.00 -1.56 0.00 0.00 34.95 31.08 1dsu s ARG 218 CO 0.11 -0.38 1.12 0.08 -0.81 0.00 0.00 175.30 175.42 1dsu s VAL 219 N -1.35 3.31 0.01 7.11 1.01 -1.26 -4.90 120.40 124.33 1dsu s VAL 219 Ca 0.57 0.90 0.04 0.00 0.00 0.00 0.00 61.98 63.50 1dsu s VAL 219 Cb -0.33 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1dsu s VAL 219 CO 0.42 -0.09 -0.10 0.00 0.00 0.00 0.00 175.10 175.33 1dsu n GLY 221 N 1.57 0.47 3.57 0.00 0.00 -1.26 -5.01 105.19 104.54 1dsu n GLY 221 Ca -0.16 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 1dsu n GLY 221 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1dsu s ASN 222 N -2.22 6.18 0.57 1.61 3.84 -1.16 -2.77 114.94 121.00 1dsu s ASN 222 Ca 0.00 -0.04 0.27 0.00 0.21 0.00 0.00 52.86 53.29 1dsu s ASN 222 Cb 0.00 -2.19 1.69 0.00 -0.55 0.00 0.00 41.25 40.20 1dsu s ASN 222 CO 0.00 -0.25 2.22 0.08 -2.79 0.00 0.00 177.10 176.35 1dsu h ARG 223 N 8.36 0.00 0.00 0.43 -0.00 -1.95 -1.26 114.38 119.96 1dsu h ARG 223 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.67 1dsu h ARG 223 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.13 1dsu h ARG 223 CO 0.66 0.00 0.00 0.87 -0.00 0.00 0.00 179.97 181.50 1dsu h LYS 223 N 0.00 0.00 -2.81 0.08 1.79 -1.91 -3.36 116.57 110.35 1dsu h LYS 223 Ca 0.01 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 57.87 1dsu h LYS 223 Cb 0.05 0.00 -0.42 0.00 -1.58 0.00 0.00 32.23 30.28 1dsu h LYS 223 CO -0.00 0.00 -0.58 1.63 -1.08 0.00 0.00 179.45 179.42 1dsu n LYS 224 N -2.67 2.02 -0.92 3.15 4.76 -0.48 -4.01 118.16 120.01 1dsu n LYS 224 Ca 0.04 -4.53 -0.33 0.00 -2.87 0.00 0.00 58.31 50.62 1dsu n LYS 224 Cb 0.40 -2.27 0.14 0.00 -1.84 0.00 0.00 35.03 31.47 1dsu n LYS 224 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1dsu n PRO 225 N 1.64 -0.10 -2.23 1.97 -0.05 -1.26 -4.68 135.00 130.29 1dsu n PRO 225 Ca 0.23 0.05 -0.37 0.00 -0.05 0.00 0.00 63.50 63.36 1dsu n PRO 225 Cb 0.37 -2.36 -0.00 0.00 -0.05 0.00 0.00 33.50 31.45 1dsu n PRO 225 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 175.50 175.65 1dsu s GLY 226 N -2.29 2.75 -0.08 0.55 0.00 -0.75 -4.88 107.32 102.61 1dsu s GLY 226 Ca 0.70 0.93 0.04 0.00 0.00 0.00 0.00 44.72 46.39 1dsu s GLY 226 CO 0.55 1.36 -0.21 -0.42 0.00 0.00 0.00 173.10 174.38 1dsu s ILE 227 N -1.59 2.38 -0.04 0.90 1.01 -1.26 -2.12 121.20 120.48 1dsu s ILE 227 Ca 0.67 -0.94 0.02 0.00 0.00 0.00 0.00 60.65 60.40 1dsu s ILE 227 Cb -0.28 -1.91 0.01 0.00 0.01 0.00 0.00 42.46 40.29 1dsu s ILE 227 CO 0.33 0.56 -0.06 -0.31 0.00 0.00 0.00 174.94 175.46 1dsu s TYR 228 N -0.07 0.84 0.12 3.97 1.51 -0.34 -2.64 117.35 120.74 1dsu s TYR 228 Ca -0.05 -0.23 -0.22 0.00 -1.01 0.00 0.00 57.07 55.55 1dsu s TYR 228 Cb -0.14 -0.68 -0.07 0.00 -0.11 0.00 0.00 41.96 40.96 1dsu s TYR 228 CO 0.04 -0.16 0.66 -0.08 -1.11 0.00 0.00 175.55 174.90 1dsu s THR 229 N 0.62 4.58 -0.08 -0.71 -1.32 -0.70 -0.81 115.64 117.22 1dsu s THR 229 Ca -0.09 1.42 -0.30 0.00 -1.21 0.00 0.00 61.69 61.51 1dsu s THR 229 Cb -0.12 -3.99 -0.02 0.00 -1.51 0.00 0.00 72.50 66.85 1dsu s THR 229 CO 0.01 0.53 1.14 -0.13 -2.21 0.00 0.00 174.62 173.96 1dsu s ARG 230 N -1.16 4.36 0.34 7.08 0.52 0.66 -1.63 118.95 129.13 1dsu s ARG 230 Ca 0.32 1.58 0.18 0.00 -0.52 0.00 0.00 55.73 57.30 1dsu s ARG 230 Cb -0.21 -3.56 0.38 0.00 0.52 0.00 0.00 34.95 32.08 1dsu s ARG 230 CO 0.22 -0.43 1.59 -0.39 0.02 0.00 0.00 175.30 176.31 1dsu h VAL 231 N 5.07 0.74 -0.32 3.52 -1.51 -1.74 -3.06 116.25 118.95 1dsu h VAL 231 Ca -0.32 -1.78 -0.01 0.00 -1.23 0.00 0.00 66.70 63.36 1dsu h VAL 231 Cb 1.15 2.17 -0.02 0.00 -2.13 0.00 0.00 31.29 32.46 1dsu h VAL 231 CO 0.88 0.38 0.15 0.00 -1.23 0.00 0.00 177.57 177.75 1dsu h ALA 232 N 1.61 1.66 0.00 5.19 0.00 -1.77 -1.15 119.26 124.80 1dsu h ALA 232 Ca -0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1dsu h ALA 232 Cb 1.14 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1dsu h ALA 232 CO 0.05 0.28 -0.07 0.77 0.00 0.00 0.00 179.25 180.28 1dsu h SER 233 N 0.45 0.00 -0.20 0.00 0.02 -1.84 -2.61 113.55 109.36 1dsu h SER 233 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1dsu h SER 233 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 1dsu h SER 233 CO -0.02 0.07 0.00 -1.22 -1.14 0.00 0.00 176.83 174.53 1dsu n TYR 234 N -3.98 0.59 -0.13 3.45 4.01 -0.50 -4.77 117.16 115.82 1dsu n TYR 234 Ca -0.03 -0.82 -0.05 0.00 -0.16 0.00 0.00 57.90 56.85 1dsu n TYR 234 Cb 0.16 -0.21 0.04 0.00 -0.31 0.00 0.00 39.34 39.01 1dsu n TYR 234 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dsu h ALA 235 N 1.31 0.52 -0.62 -0.72 0.00 -0.98 -0.68 119.26 118.09 1dsu h ALA 235 Ca 0.00 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1dsu h ALA 235 Cb 1.17 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 1dsu h ALA 235 CO 0.12 -0.22 0.39 0.00 0.00 0.00 0.00 179.25 179.55 1dsu h ALA 236 N 1.27 0.80 -0.32 0.00 0.00 -1.86 -0.66 119.26 118.50 1dsu h ALA 236 Ca 0.20 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1dsu h ALA 236 Cb 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1dsu h ALA 236 CO -0.19 0.15 -0.01 2.35 0.00 0.00 0.00 179.25 181.55 1dsu h TRP 237 N 0.77 0.63 -0.89 0.00 7.01 -1.83 -1.26 115.95 120.38 1dsu h TRP 237 Ca 0.25 -0.11 -0.00 0.00 2.11 0.00 0.00 58.89 61.13 1dsu h TRP 237 Cb -0.00 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 26.85 1dsu h TRP 237 CO -0.05 0.71 0.54 0.82 -2.79 0.00 0.00 178.44 177.67 1dsu h ILE 238 N 0.37 1.24 0.28 2.65 2.04 -0.86 -2.22 117.51 121.00 1dsu h ILE 238 Ca 0.09 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.42 1dsu h ILE 238 Cb 0.46 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 1dsu h ILE 238 CO 0.02 0.25 -0.20 0.44 0.00 0.00 0.00 178.15 178.66 1dsu h ASP 239 N 1.22 -0.52 -0.05 1.72 3.32 -0.87 -1.53 116.42 119.70 1dsu h ASP 239 Ca 0.32 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.43 1dsu h ASP 239 Cb -0.06 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1dsu h ASP 239 CO -0.06 -0.32 -0.06 0.77 -1.72 0.00 0.00 179.24 177.85 1dsu h SER 240 N -0.48 -0.20 0.17 6.45 4.64 -1.02 -0.80 113.55 122.32 1dsu h SER 240 Ca -0.02 0.04 -0.05 0.00 -0.47 0.00 0.00 61.79 61.29 1dsu h SER 240 Cb 0.42 0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 1dsu h SER 240 CO -0.00 -0.09 -0.21 0.58 -0.87 0.00 0.00 176.83 176.24 1dsu h VAL 241 N -0.09 1.18 0.04 0.95 2.07 -1.32 -2.63 116.25 116.44 1dsu h VAL 241 Ca 0.04 -0.82 -0.23 0.00 0.82 0.00 0.00 66.70 66.51 1dsu h VAL 241 Cb 0.15 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1dsu h VAL 241 CO -0.11 0.24 -1.09 -0.07 0.02 0.00 0.00 177.57 176.57 1dsu h LEU 242 N 0.07 0.13 0.00 2.57 4.07 -1.05 -3.52 115.31 117.58 1dsu h LEU 242 Ca 0.01 -0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.83 1dsu h LEU 242 Cb 0.41 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.11 1dsu h LEU 242 CO 0.03 1.11 0.00 0.00 -1.08 0.00 0.00 178.44 178.50