#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aeg n ASN 3 N 0.00 2.66 -3.65 0.00 4.13 -1.26 -4.86 115.26 112.28 2aeg n ASN 3 Ca 0.00 -3.44 -0.03 0.00 1.68 0.00 0.00 54.58 52.79 2aeg n ASN 3 Cb 0.00 -0.54 -0.05 0.00 -1.54 0.00 0.00 39.78 37.65 2aeg n ASN 3 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2aeg s LEU 4 N -3.05 -1.06 0.30 3.41 2.96 -1.26 -4.14 118.68 115.84 2aeg s LEU 4 Ca 0.40 1.53 -0.12 0.00 -0.22 0.00 0.00 54.13 55.72 2aeg s LEU 4 Cb 0.35 2.30 0.01 0.00 0.50 0.00 0.00 46.19 49.35 2aeg s LEU 4 CO 0.02 -0.23 0.57 -0.72 -1.32 0.00 0.00 176.35 174.67 2aeg s TYR 5 N 2.46 0.38 0.00 5.38 1.13 -1.26 -0.24 117.35 125.20 2aeg s TYR 5 Ca -0.07 -0.79 0.00 0.00 -1.41 0.00 0.00 57.07 54.80 2aeg s TYR 5 Cb -0.10 0.33 0.00 0.00 -1.10 0.00 0.00 41.96 41.09 2aeg s TYR 5 CO -0.19 -1.17 0.00 0.54 -2.51 0.00 0.00 175.55 172.22 2aeg n ARG 6 N -0.46 2.53 0.00 -3.49 1.74 0.12 -4.30 116.66 112.80 2aeg n ARG 6 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 2aeg n ARG 6 Cb 0.61 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.05 2aeg n ARG 6 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2aeg n GLU 8 N 0.00 0.00 -1.95 5.56 1.02 -1.26 -0.81 120.64 123.20 2aeg n GLU 8 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 2aeg n GLU 8 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 2aeg n GLU 8 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2aeg s ASP 9 N 0.00 6.45 0.28 1.62 3.68 -1.26 -4.85 116.67 122.58 2aeg s ASP 9 Ca 0.00 2.11 0.25 0.00 2.13 0.00 0.00 52.55 57.03 2aeg s ASP 9 Cb 0.00 -2.53 0.59 0.00 -1.45 0.00 0.00 42.92 39.53 2aeg s ASP 9 CO 0.00 -1.13 1.66 0.11 0.13 0.00 0.00 175.17 175.94 2aeg h LYS 10 N 10.50 0.00 -2.33 4.34 6.56 -2.02 -3.42 116.57 130.20 2aeg h LYS 10 Ca -0.39 0.00 -0.41 0.00 -1.06 0.00 0.00 60.65 58.78 2aeg h LYS 10 Cb 1.19 0.00 -0.35 0.00 -0.57 0.00 0.00 32.23 32.49 2aeg h LYS 10 CO 0.97 0.00 -0.70 0.34 -2.06 0.00 0.00 179.45 177.99 2aeg s ASP 11 N -5.07 2.23 0.00 0.86 2.15 -1.26 -4.94 116.67 110.63 2aeg s ASP 11 Ca 0.09 -1.17 0.00 0.00 0.43 0.00 0.00 52.55 51.90 2aeg s ASP 11 Cb 0.10 0.20 0.00 0.00 -0.30 0.00 0.00 42.92 42.92 2aeg s ASP 11 CO 0.64 -0.38 0.00 -2.67 -0.17 0.00 0.00 175.17 172.59 2aeg n TRP 12 N 5.00 0.00 -0.16 -5.34 4.27 -1.26 -4.90 117.44 115.05 2aeg n TRP 12 Ca 0.00 0.00 -0.03 0.00 -3.89 0.00 0.00 57.50 53.58 2aeg n TRP 12 Cb 0.44 0.00 0.03 0.00 -1.36 0.00 0.00 31.31 30.43 2aeg n TRP 12 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68 2aeg h VAL 13 N 0.00 0.46 -0.87 -1.67 2.07 -1.94 0.44 116.25 114.75 2aeg h VAL 13 Ca 0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 2aeg h VAL 13 Cb 0.00 0.46 -0.10 0.00 -1.52 0.00 0.00 31.29 30.13 2aeg h VAL 13 CO 0.00 0.00 0.45 -1.28 0.02 0.00 0.00 177.57 176.76 2aeg h SER 14 N -0.02 0.55 0.22 0.57 0.87 -1.90 0.26 113.55 114.09 2aeg h SER 14 Ca 0.24 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.90 2aeg h SER 14 Cb 0.39 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 2aeg h SER 14 CO -0.53 0.22 -1.07 2.29 -0.53 0.00 0.00 176.83 177.21 2aeg n LYS 15 N -4.87 0.18 -0.02 2.24 2.85 -0.80 -4.18 118.16 113.57 2aeg n LYS 15 Ca 0.18 -0.03 -0.01 0.00 -1.05 0.00 0.00 58.31 57.40 2aeg n LYS 15 Cb 0.45 -1.54 -0.05 0.00 -0.65 0.00 0.00 35.03 33.25 2aeg n LYS 15 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 2aeg n TRP 16 N -1.76 0.00 -2.71 5.58 7.02 0.08 -4.81 117.44 120.84 2aeg n TRP 16 Ca 0.02 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.35 2aeg n TRP 16 Cb 0.40 -0.25 0.01 0.00 -2.42 0.00 0.00 31.31 29.05 2aeg n TRP 16 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2aeg n ALA 17 N -2.05 3.65 0.34 6.99 0.00 0.88 -4.87 120.51 125.45 2aeg n ALA 17 Ca -0.07 -3.52 0.14 0.00 0.00 0.00 0.00 53.44 50.00 2aeg n ALA 17 Cb 0.51 -0.84 0.50 0.00 0.00 0.00 0.00 19.45 19.62 2aeg n ALA 17 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2aeg h GLN 18 N 2.91 0.00 -0.31 0.00 4.15 -1.71 -3.02 115.11 117.13 2aeg h GLN 18 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 2aeg h GLN 18 Cb 1.06 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.75 2aeg h GLN 18 CO 0.59 0.00 0.00 -0.40 -1.93 0.00 0.00 178.83 177.09 2aeg n ASP 19 N -2.78 3.60 -4.84 -0.69 5.75 -1.26 -4.98 116.55 111.34 2aeg n ASP 19 Ca 0.02 -2.63 -0.37 0.00 -0.01 0.00 0.00 54.79 51.81 2aeg n ASP 19 Cb 0.35 -0.43 -0.07 0.00 -1.03 0.00 0.00 41.12 39.94 2aeg n ASP 19 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2aeg s ALA 20 N -2.14 3.77 -0.56 2.12 0.00 -1.14 -4.53 121.76 119.28 2aeg s ALA 20 Ca 0.36 -0.67 -0.28 0.00 0.00 0.00 0.00 51.96 51.37 2aeg s ALA 20 Cb 0.26 -1.88 0.00 0.00 0.00 0.00 0.00 23.12 21.51 2aeg s ALA 20 CO 0.12 0.62 1.56 -1.21 0.00 0.00 0.00 175.76 176.84 2aeg s GLU 21 N -1.02 3.13 0.21 0.00 2.02 0.22 -4.70 118.70 118.56 2aeg s GLU 21 Ca 0.15 0.55 -0.19 0.00 0.02 0.00 0.00 54.97 55.50 2aeg s GLU 21 Cb -0.12 -4.20 -0.08 0.00 0.10 0.00 0.00 34.13 29.83 2aeg s GLU 21 CO 0.04 -2.14 0.71 0.45 0.02 0.00 0.00 175.26 174.34 2aeg s SER 22 N 5.47 7.03 -0.14 -0.19 0.15 -1.26 -2.26 113.70 122.49 2aeg s SER 22 Ca 0.58 1.38 0.05 0.00 0.70 0.00 0.00 55.95 58.66 2aeg s SER 22 Cb -0.12 -2.41 0.17 0.00 -1.71 0.00 0.00 66.02 61.95 2aeg s SER 22 CO 0.24 0.04 1.18 -0.11 1.20 0.00 0.00 173.24 175.79 2aeg n LEU 23 N 0.73 -1.13 -4.05 3.45 -0.00 -1.25 -4.97 117.00 109.78 2aeg n LEU 23 Ca -0.03 -2.41 -0.08 0.00 -0.00 0.00 0.00 56.01 53.50 2aeg n LEU 23 Cb 0.51 0.07 -0.10 0.00 -0.00 0.00 0.00 43.42 43.90 2aeg n LEU 23 CO 0.43 1.54 -0.35 0.27 -0.00 0.00 0.00 177.39 179.27 2aeg s ILE 24 N 0.05 0.19 -0.52 1.96 -4.36 -1.26 -5.05 121.20 112.21 2aeg s ILE 24 Ca 0.04 -1.53 -0.19 0.00 -0.26 0.00 0.00 60.65 58.71 2aeg s ILE 24 Cb 0.19 -1.14 0.06 0.00 1.25 0.00 0.00 42.46 42.82 2aeg s ILE 24 CO -0.05 -0.84 0.65 0.20 0.24 0.00 0.00 174.94 175.14 2aeg s ASN 25 N -2.48 6.22 0.44 4.36 0.01 -1.26 -5.09 114.94 117.14 2aeg s ASN 25 Ca 0.00 -0.97 0.00 0.00 -0.71 0.00 0.00 52.86 51.18 2aeg s ASN 25 Cb 0.03 -2.30 0.00 0.00 0.41 0.00 0.00 41.25 39.39 2aeg s ASN 25 CO -0.07 -0.95 0.00 -0.11 -1.51 0.00 0.00 177.10 174.46 2aeg n LEU 26 N 6.27 0.00 -0.13 0.60 7.94 -1.26 -5.13 117.00 125.29 2aeg n LEU 26 Ca -0.07 0.00 -0.26 0.00 -1.11 0.00 0.00 56.01 54.57 2aeg n LEU 26 Cb 0.45 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.29 2aeg n LEU 26 CO 0.55 -0.58 -1.39 -0.81 -1.11 0.00 0.00 177.39 174.05 2aeg n PRO 28 N -0.66 0.61 -4.12 1.96 -0.04 -1.26 -5.20 135.00 126.29 2aeg n PRO 28 Ca 0.00 0.24 -0.14 0.00 -0.04 0.00 0.00 63.50 63.56 2aeg n PRO 28 Cb 0.00 -1.51 -0.11 0.00 -0.04 0.00 0.00 33.50 31.84 2aeg n PRO 28 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2aeg s ALA 29 N -2.51 0.87 -0.02 0.55 0.00 -1.26 -4.60 121.76 114.79 2aeg s ALA 29 Ca -0.37 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 50.61 2aeg s ALA 29 Cb 0.13 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.29 2aeg s ALA 29 CO 0.53 -0.02 -0.05 0.71 0.00 0.00 0.00 175.76 176.92 2aeg s TYR 30 N -1.94 0.66 0.12 0.00 2.02 -1.26 -5.00 117.35 111.95 2aeg s TYR 30 Ca -0.02 -0.15 0.07 0.00 -0.37 0.00 0.00 57.07 56.60 2aeg s TYR 30 Cb -0.06 -0.51 -0.04 0.00 -0.40 0.00 0.00 41.96 40.95 2aeg s TYR 30 CO -0.00 -0.10 -0.17 -1.14 -1.57 0.00 0.00 175.55 172.57 2aeg s GLN 31 N 0.38 1.08 0.00 -0.62 0.74 -1.26 -4.18 119.66 115.79 2aeg s GLN 31 Ca -0.05 -1.21 0.00 0.00 0.05 0.00 0.00 55.36 54.16 2aeg s GLN 31 Cb -0.09 -1.14 0.00 0.00 1.10 0.00 0.00 33.01 32.88 2aeg s GLN 31 CO -0.00 0.24 0.00 0.09 -0.55 0.00 0.00 175.29 175.07 2aeg n ASN 33 N 0.77 0.00 -4.57 6.67 3.02 -1.26 -4.95 115.26 114.94 2aeg n ASN 33 Ca -0.17 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 53.94 2aeg n ASN 33 Cb 0.55 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.71 2aeg n ASN 33 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2aeg n PRO 34 N -0.49 1.21 -1.15 3.52 -0.02 -1.26 -2.31 135.00 134.50 2aeg n PRO 34 Ca 0.00 0.43 -0.05 0.00 -2.02 0.00 0.00 63.50 61.85 2aeg n PRO 34 Cb 0.00 -1.80 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2aeg n PRO 34 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2aeg n ASP 35 N 1.16 -5.27 0.00 2.55 2.03 0.07 -4.97 116.55 112.11 2aeg n ASP 35 Ca 0.10 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.54 2aeg n ASP 35 Cb 0.33 -3.22 0.00 0.00 -0.72 0.00 0.00 41.12 37.51 2aeg n ASP 35 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2aeg n GLN 36 N -0.65 0.00 0.00 -0.67 6.02 -0.98 -4.64 117.38 116.46 2aeg n GLN 36 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.94 2aeg n GLN 36 Cb 0.44 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.70 2aeg n GLN 36 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2aeg n GLY 38 N 5.00 2.49 3.75 1.08 0.00 0.31 -1.57 105.19 116.25 2aeg n GLY 38 Ca 0.00 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 2aeg n GLY 38 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2aeg s PRO 39 N -2.00 4.69 0.12 1.61 0.04 -1.26 -1.10 135.00 137.10 2aeg s PRO 39 Ca 0.00 1.68 -0.13 0.00 0.04 0.00 0.00 61.00 62.60 2aeg s PRO 39 Cb 0.00 -3.24 0.02 0.00 0.04 0.00 0.00 34.50 31.31 2aeg s PRO 39 CO 0.00 0.27 0.32 0.96 0.04 0.00 0.00 177.00 178.59 2aeg s ILE 40 N -0.91 0.09 -0.29 0.56 -4.36 -0.29 -4.31 121.20 111.68 2aeg s ILE 40 Ca 0.45 -0.90 0.00 0.00 -0.26 0.00 0.00 60.65 59.94 2aeg s ILE 40 Cb -0.29 -1.33 0.06 0.00 1.25 0.00 0.00 42.46 42.14 2aeg s ILE 40 CO 0.37 -0.42 -0.03 -0.69 0.24 0.00 0.00 174.94 174.41 2aeg s VAL 41 N -3.85 2.66 0.22 8.37 1.01 -0.82 -1.46 120.40 126.52 2aeg s VAL 41 Ca 0.06 -1.57 0.09 0.00 0.00 0.00 0.00 61.98 60.55 2aeg s VAL 41 Cb 0.03 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 2aeg s VAL 41 CO -0.10 -0.14 -0.03 0.00 0.00 0.00 0.00 175.10 174.83 2aeg s ARG 42 N 1.17 2.24 0.59 2.72 1.70 -0.06 -0.72 118.95 126.58 2aeg s ARG 42 Ca -0.05 -1.30 -0.03 0.00 -0.47 0.00 0.00 55.73 53.88 2aeg s ARG 42 Cb -0.20 -2.20 0.03 0.00 -0.57 0.00 0.00 34.95 32.01 2aeg s ARG 42 CO -0.03 0.41 0.86 -0.80 -1.08 0.00 0.00 175.30 174.65 2aeg s ASN 43 N -3.24 5.33 0.24 -2.89 0.01 -0.85 -0.79 114.94 112.76 2aeg s ASN 43 Ca 0.28 0.36 0.05 0.00 -0.71 0.00 0.00 52.86 52.85 2aeg s ASN 43 Cb -0.08 -1.27 -0.05 0.00 0.41 0.00 0.00 41.25 40.25 2aeg s ASN 43 CO 0.18 -1.17 -0.05 -0.89 -1.51 0.00 0.00 177.10 173.66 2aeg s THR 44 N -2.92 1.38 -1.00 1.60 2.01 0.28 -4.74 115.64 112.25 2aeg s THR 44 Ca 0.56 -2.09 0.15 0.00 0.31 0.00 0.00 61.69 60.62 2aeg s THR 44 Cb -0.10 -2.32 0.13 0.00 0.01 0.00 0.00 72.50 70.21 2aeg s THR 44 CO 0.42 -0.37 1.49 0.00 -0.69 0.00 0.00 174.62 175.47 2aeg n ALA 45 N -0.47 1.71 1.46 7.40 0.00 -1.26 -1.25 120.51 128.10 2aeg n ALA 45 Ca -0.06 -0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.47 2aeg n ALA 45 Cb 0.63 -1.25 0.56 0.00 0.00 0.00 0.00 19.45 19.39 2aeg n ALA 45 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2aeg n ASP 46 N -1.50 0.89 -0.83 0.00 8.00 -1.26 -4.91 116.55 116.94 2aeg n ASP 46 Ca 0.04 -1.00 -0.05 0.00 0.71 0.00 0.00 54.79 54.48 2aeg n ASP 46 Cb 0.18 0.01 0.01 0.00 -0.02 0.00 0.00 41.12 41.30 2aeg n ASP 46 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2aeg n GLY 47 N 1.23 0.31 3.19 0.44 0.00 -0.38 -5.04 105.19 104.95 2aeg n GLY 47 Ca 0.16 -0.59 -0.25 0.00 0.00 0.00 0.00 46.02 45.34 2aeg n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2aeg n LYS 48 N -1.54 0.65 -4.56 1.61 5.02 -1.25 -4.92 118.16 113.16 2aeg n LYS 48 Ca -0.04 -3.28 -0.23 0.00 -2.02 0.00 0.00 58.31 52.75 2aeg n LYS 48 Cb 0.54 1.61 -0.14 0.00 -0.02 0.00 0.00 35.03 37.02 2aeg n LYS 48 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2aeg s LYS 49 N -3.50 1.16 -0.01 1.97 1.02 -1.26 -0.55 119.74 118.56 2aeg s LYS 49 Ca 0.16 -0.72 0.02 0.00 0.02 0.00 0.00 55.97 55.45 2aeg s LYS 49 Cb 0.01 -1.17 -0.00 0.00 -0.52 0.00 0.00 37.83 36.14 2aeg s LYS 49 CO 0.11 0.31 -0.07 -0.65 -0.92 0.00 0.00 175.35 174.13 2aeg s GLN 50 N -0.84 0.66 -0.25 1.68 -0.21 0.03 0.69 119.66 121.41 2aeg s GLN 50 Ca 0.05 -0.24 -0.16 0.00 0.02 0.00 0.00 55.36 55.03 2aeg s GLN 50 Cb -0.07 -0.64 -0.04 0.00 1.00 0.00 0.00 33.01 33.26 2aeg s GLN 50 CO 0.01 0.12 0.40 -1.17 -2.12 0.00 0.00 175.29 172.53 2aeg s LEU 51 N 0.02 4.07 0.26 2.90 0.20 -0.96 -0.89 118.68 124.28 2aeg s LEU 51 Ca 0.00 0.38 -0.12 0.00 0.69 0.00 0.00 54.13 55.07 2aeg s LEU 51 Cb -0.05 -2.48 -0.00 0.00 -0.43 0.00 0.00 46.19 43.23 2aeg s LEU 51 CO -0.00 -0.18 0.50 0.68 -0.29 0.00 0.00 176.35 177.06 2aeg s VAL 52 N 1.93 0.00 -0.15 1.68 -7.23 -0.53 -3.74 120.40 112.35 2aeg s VAL 52 Ca 0.17 -1.40 -0.10 0.00 -1.81 0.00 0.00 61.98 58.85 2aeg s VAL 52 Cb -0.15 -2.26 -0.05 0.00 0.56 0.00 0.00 36.38 34.48 2aeg s VAL 52 CO 0.09 0.00 0.17 -1.00 -0.31 0.00 0.00 175.10 174.06 2aeg s HIS 53 N -3.88 3.51 0.06 2.82 3.76 -1.26 -1.14 115.29 119.16 2aeg s HIS 53 Ca 0.22 0.48 0.00 0.00 -0.15 0.00 0.00 55.06 55.62 2aeg s HIS 53 Cb -0.01 -2.11 -0.04 0.00 1.11 0.00 0.00 32.58 31.53 2aeg s HIS 53 CO 0.10 0.47 -0.05 0.00 -0.85 0.00 0.00 174.74 174.41 2aeg s ALA 54 N -0.22 0.59 -0.16 -1.40 0.00 -0.26 -4.89 121.76 115.43 2aeg s ALA 54 Ca 0.13 -1.09 -0.28 0.00 0.00 0.00 0.00 51.96 50.72 2aeg s ALA 54 Cb -0.12 0.19 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 2aeg s ALA 54 CO 0.02 -0.25 0.95 0.50 0.00 0.00 0.00 175.76 176.99 2aeg s ARG 55 N -3.17 4.34 -0.42 0.00 3.52 0.13 -0.53 118.95 122.82 2aeg s ARG 55 Ca 0.02 1.26 -0.28 0.00 -0.13 0.00 0.00 55.73 56.60 2aeg s ARG 55 Cb 0.02 -3.58 -0.00 0.00 -1.56 0.00 0.00 34.95 29.83 2aeg s ARG 55 CO -0.06 -0.40 1.59 -0.46 -0.81 0.00 0.00 175.30 175.17 2aeg s TRP 56 N 2.34 2.11 0.00 5.12 -0.00 -0.61 -1.41 118.94 126.49 2aeg s TRP 56 Ca 0.44 0.64 0.00 0.00 -0.00 0.00 0.00 56.10 57.18 2aeg s TRP 56 Cb -0.17 -4.24 0.00 0.00 -0.00 0.00 0.00 33.47 29.06 2aeg s TRP 56 CO 0.13 -2.34 0.00 0.41 -0.00 0.00 0.00 176.95 175.15 2aeg n GLY 57 N 5.28 2.56 3.73 5.86 0.00 0.22 -0.75 105.19 122.10 2aeg n GLY 57 Ca 0.18 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 2aeg n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aeg s LEU 58 N 0.00 2.10 0.52 0.99 1.43 0.17 -4.21 118.68 119.69 2aeg s LEU 58 Ca 0.00 1.30 -0.23 0.00 -1.03 0.00 0.00 54.13 54.18 2aeg s LEU 58 Cb 0.00 -3.68 -0.06 0.00 0.03 0.00 0.00 46.19 42.48 2aeg s LEU 58 CO 0.00 -2.65 1.37 -2.84 0.23 0.00 0.00 176.35 172.46 2aeg s PRO 59 N -5.03 3.31 0.42 1.29 0.02 -1.26 0.27 135.00 134.02 2aeg s PRO 59 Ca 0.64 2.26 -0.11 0.00 0.02 0.00 0.00 61.00 63.81 2aeg s PRO 59 Cb -0.17 -2.37 -0.06 0.00 0.02 0.00 0.00 34.50 31.91 2aeg s PRO 59 CO 0.56 -1.06 0.79 -1.12 -0.33 0.00 0.00 177.00 175.84 2aeg s SER 60 N -0.85 6.53 0.22 2.53 0.01 -1.26 -4.65 113.70 116.22 2aeg s SER 60 Ca 0.68 1.17 -0.32 0.00 1.31 0.00 0.00 55.95 58.80 2aeg s SER 60 Cb -0.41 -2.34 -0.14 0.00 0.21 0.00 0.00 66.02 63.35 2aeg s SER 60 CO 0.49 -0.42 1.40 -2.65 0.41 0.00 0.00 173.24 172.47 2aeg n PRO 61 N -1.33 1.93 -0.31 12.44 -0.02 -1.26 -4.79 135.00 141.66 2aeg n PRO 61 Ca 0.03 0.69 0.17 0.00 -2.02 0.00 0.00 63.50 62.36 2aeg n PRO 61 Cb 0.54 -2.34 0.35 0.00 -0.02 0.00 0.00 33.50 32.03 2aeg n PRO 61 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2aeg h ILE 62 N 3.08 0.33 0.00 4.25 2.10 -1.99 0.38 117.51 125.66 2aeg h ILE 62 Ca -0.45 -0.09 -0.08 0.00 1.08 0.00 0.00 64.86 65.32 2aeg h ILE 62 Cb 1.28 0.03 -0.01 0.00 -1.09 0.00 0.00 36.82 37.03 2aeg h ILE 62 CO 0.77 0.05 -0.39 -0.26 -1.08 0.00 0.00 178.15 177.23 2aeg h PHE 63 N 0.27 0.00 -0.46 2.19 0.04 -1.99 -0.84 116.94 116.16 2aeg h PHE 63 Ca 0.61 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 61.27 2aeg h PHE 63 Cb 1.29 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.42 2aeg h PHE 63 CO -0.17 0.39 -0.14 0.28 -0.60 0.00 0.00 178.31 178.08 2aeg h VAL 64 N 0.00 1.27 -0.33 -0.55 2.07 -0.61 -1.24 116.25 116.86 2aeg h VAL 64 Ca -0.00 -1.27 -0.12 0.00 0.82 0.00 0.00 66.70 66.12 2aeg h VAL 64 Cb 0.77 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 2aeg h VAL 64 CO 0.05 0.44 -0.28 1.56 0.02 0.00 0.00 177.57 179.36 2aeg h GLN 65 N 0.74 0.77 -0.02 1.57 1.08 -1.03 -2.70 115.11 115.53 2aeg h GLN 65 Ca 0.11 -0.39 -0.00 0.00 -1.45 0.00 0.00 58.65 56.92 2aeg h GLN 65 Cb 0.69 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.13 2aeg h GLN 65 CO 0.05 1.01 0.01 -0.22 -0.95 0.00 0.00 178.83 178.73 2aeg h LYS 66 N 0.54 0.03 -0.87 1.46 3.64 -1.08 -0.64 116.57 119.64 2aeg h LYS 66 Ca 0.06 -0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.55 2aeg h LYS 66 Cb 0.85 -0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.59 2aeg h LYS 66 CO 0.07 0.15 0.50 -0.22 -2.27 0.00 0.00 179.45 177.68 2aeg h LYS 67 N -0.10 0.77 -0.44 1.90 3.64 -1.27 0.22 116.57 121.30 2aeg h LYS 67 Ca 0.01 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.23 2aeg h LYS 67 Cb 0.13 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 2aeg h LYS 67 CO -0.00 0.51 -0.17 0.00 -2.27 0.00 0.00 179.45 177.52 2aeg h ALA 68 N 1.50 0.86 -0.47 5.00 0.00 -1.17 -1.30 119.26 123.68 2aeg h ALA 68 Ca 0.44 -0.36 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 2aeg h ALA 68 Cb 0.46 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2aeg h ALA 68 CO -0.28 0.64 -0.24 0.00 0.00 0.00 0.00 179.25 179.37 2aeg h ALA 69 N 1.05 0.68 -0.42 0.00 0.00 0.47 -1.44 119.26 119.60 2aeg h ALA 69 Ca 0.11 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 2aeg h ALA 69 Cb 0.70 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2aeg h ALA 69 CO 0.05 0.68 -0.28 0.93 0.00 0.00 0.00 179.25 180.62 2aeg h GLU 70 N 0.85 0.91 -0.48 0.00 5.08 -0.53 -0.96 114.58 119.45 2aeg h GLU 70 Ca 0.10 -0.42 -0.05 0.00 -1.00 0.00 0.00 59.36 57.99 2aeg h GLU 70 Cb 0.82 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 2aeg h GLU 70 CO 0.07 1.07 0.07 0.00 -1.00 0.00 0.00 179.01 179.23 2aeg h ALA 71 N 0.90 1.24 -0.39 3.43 0.00 -1.09 -1.19 119.26 122.16 2aeg h ALA 71 Ca 0.09 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2aeg h ALA 71 Cb 0.85 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2aeg h ALA 71 CO 0.08 0.52 -0.12 -0.09 0.00 0.00 0.00 179.25 179.63 2aeg h ARG 72 N 0.71 0.78 -0.81 0.00 2.43 -0.97 -2.78 114.38 113.75 2aeg h ARG 72 Ca 0.15 -0.31 0.01 0.00 -0.81 0.00 0.00 59.98 59.02 2aeg h ARG 72 Cb 0.33 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.80 2aeg h ARG 72 CO 0.00 0.93 0.53 0.00 -1.51 0.00 0.00 179.97 179.92 2aeg h ALA 73 N 0.83 1.40 -0.71 2.80 0.00 -0.61 -1.46 119.26 121.51 2aeg h ALA 73 Ca 0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2aeg h ALA 73 Cb 0.66 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2aeg h ALA 73 CO 0.04 0.55 0.33 -0.44 0.00 0.00 0.00 179.25 179.73 2aeg h ASP 74 N 1.10 0.94 -0.34 0.00 3.32 -1.02 0.16 116.42 120.58 2aeg h ASP 74 Ca 0.30 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2aeg h ASP 74 Cb -0.11 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.18 2aeg h ASP 74 CO -0.06 0.82 0.12 0.50 -1.72 0.00 0.00 179.24 178.89 2aeg h LYS 75 N 1.00 0.53 -0.29 3.56 3.64 -1.13 0.08 116.57 123.95 2aeg h LYS 75 Ca 0.24 -0.11 -0.09 0.00 -1.27 0.00 0.00 60.65 59.43 2aeg h LYS 75 Cb 0.14 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 2aeg h LYS 75 CO -0.03 0.55 -0.19 -0.07 -2.27 0.00 0.00 179.45 177.44 2aeg h LEU 76 N 0.40 0.52 -0.59 5.20 4.07 -1.03 -1.51 115.31 122.38 2aeg h LEU 76 Ca 0.11 -0.16 -0.06 0.00 0.08 0.00 0.00 57.88 57.85 2aeg h LEU 76 Cb 0.23 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.81 2aeg h LEU 76 CO -0.01 0.73 0.13 0.50 -1.08 0.00 0.00 178.44 178.71 2aeg h LYS 77 N 0.48 0.96 -0.65 1.13 1.63 -0.35 0.77 116.57 120.53 2aeg h LYS 77 Ca 0.08 -0.24 -0.08 0.00 -0.85 0.00 0.00 60.65 59.56 2aeg h LYS 77 Cb 0.60 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 32.08 2aeg h LYS 77 CO 0.04 0.89 0.11 0.00 -3.45 0.00 0.00 179.45 177.04 2aeg h ALA 78 N 1.02 0.96 0.00 5.00 0.00 -0.53 -0.94 119.26 124.77 2aeg h ALA 78 Ca 0.18 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2aeg h ALA 78 Cb 0.38 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2aeg h ALA 78 CO 0.01 0.65 0.00 1.63 0.00 0.00 0.00 179.25 181.54 2aeg n LYS 79 N -4.22 0.72 -3.00 0.00 5.02 -0.61 -4.88 118.16 111.20 2aeg n LYS 79 Ca 0.04 0.01 -0.12 0.00 -2.02 0.00 0.00 58.31 56.22 2aeg n LYS 79 Cb 0.28 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.83 2aeg n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2aeg n GLY 80 N 0.82 0.15 3.67 0.72 0.00 -0.36 -5.04 105.19 105.16 2aeg n GLY 80 Ca 0.18 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 2aeg n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2aeg s LYS 81 N -5.59 2.66 0.43 1.61 -0.14 0.25 -4.99 119.74 113.97 2aeg s LYS 81 Ca 0.28 -0.71 -0.24 0.00 -1.36 0.00 0.00 55.97 53.94 2aeg s LYS 81 Cb -0.12 -2.59 -0.08 0.00 -1.68 0.00 0.00 37.83 33.35 2aeg s LYS 81 CO 0.35 0.59 1.13 0.00 -0.76 0.00 0.00 175.35 176.66 2aeg s ALA 82 N -1.15 3.04 0.25 5.17 0.00 -1.26 -4.26 121.76 123.55 2aeg s ALA 82 Ca 0.21 0.87 -0.19 0.00 0.00 0.00 0.00 51.96 52.85 2aeg s ALA 82 Cb -0.11 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 19.68 2aeg s ALA 82 CO 0.13 -0.49 0.62 -0.59 0.00 0.00 0.00 175.76 175.42 2aeg s PHE 83 N -1.56 -0.08 -0.27 0.00 -0.71 -1.26 -5.03 117.98 109.07 2aeg s PHE 83 Ca 0.61 -0.32 -0.03 0.00 -1.04 0.00 0.00 56.93 56.14 2aeg s PHE 83 Cb -0.27 0.52 0.10 0.00 -1.21 0.00 0.00 43.02 42.16 2aeg s PHE 83 CO 0.33 -1.09 0.17 0.34 -1.34 0.00 0.00 175.22 173.63 2aeg s ASP 84 N -2.92 2.79 0.25 1.98 3.68 -1.26 -5.04 116.67 116.15 2aeg s ASP 84 Ca 0.12 -1.00 -0.12 0.00 2.13 0.00 0.00 52.55 53.69 2aeg s ASP 84 Cb -0.03 -0.08 0.35 0.00 -1.45 0.00 0.00 42.92 41.71 2aeg s ASP 84 CO 0.04 -0.41 1.50 2.30 0.13 0.00 0.00 175.17 178.74 2aeg n ILE 85 N 5.27 -0.45 -0.24 4.11 -5.35 -1.26 0.65 119.36 122.10 2aeg n ILE 85 Ca -0.05 2.23 -0.01 0.00 -0.27 0.00 0.00 62.75 64.65 2aeg n ILE 85 Cb 0.44 -3.03 0.10 0.00 -1.74 0.00 0.00 39.64 35.42 2aeg n ILE 85 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 2aeg h ASN 86 N 0.00 0.55 0.76 7.28 2.35 -1.99 0.48 115.58 125.01 2aeg h ASN 86 Ca 0.41 0.03 -0.13 0.00 -0.55 0.00 0.00 56.30 56.06 2aeg h ASN 86 Cb 0.65 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.93 2aeg h ASN 86 CO -0.98 0.35 -0.61 -0.08 -1.65 0.00 0.00 177.43 174.46 2aeg h GLU 87 N 0.69 0.00 -0.23 0.81 4.57 -0.78 -2.82 114.58 116.82 2aeg h GLU 87 Ca 0.31 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.33 2aeg h GLU 87 Cb 0.21 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 2aeg h GLU 87 CO -0.19 0.61 -0.49 -0.07 -1.18 0.00 0.00 179.01 177.69 2aeg h LEU 88 N 0.00 0.69 -0.94 1.64 4.07 0.18 -2.92 115.31 118.03 2aeg h LEU 88 Ca -0.01 -0.34 -0.10 0.00 0.08 0.00 0.00 57.88 57.51 2aeg h LEU 88 Cb 1.16 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.69 2aeg h LEU 88 CO 0.08 1.06 -0.35 0.40 -1.08 0.00 0.00 178.44 178.55 2aeg h ILE 89 N 0.50 1.29 0.00 1.22 2.04 0.02 -0.76 117.51 121.82 2aeg h ILE 89 Ca 0.02 -1.40 0.00 0.00 1.00 0.00 0.00 64.86 64.48 2aeg h ILE 89 Cb 1.03 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.65 2aeg h ILE 89 CO 0.10 0.43 0.00 0.54 0.00 0.00 0.00 178.15 179.22 2aeg n ARG 90 N -4.07 0.46 -1.81 2.37 1.74 -1.08 -4.95 116.66 109.33 2aeg n ARG 90 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 2aeg n ARG 90 Cb 0.45 -1.21 0.00 0.00 -1.02 0.00 0.00 32.46 30.68 2aeg n ARG 90 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2aeg n GLU 92 N 0.20 -4.10 -1.63 5.56 4.07 -0.29 -4.51 120.64 119.93 2aeg n GLU 92 Ca 0.00 3.06 -0.46 0.00 -0.06 0.00 0.00 57.16 59.69 2aeg n GLU 92 Cb 0.11 -3.39 -0.03 0.00 -0.06 0.00 0.00 31.44 28.06 2aeg n GLU 92 CO 0.00 0.00 0.00 -2.30 -0.06 0.00 0.00 177.13 174.77 2aeg n PRO 93 N 1.41 1.69 -4.06 5.31 -0.02 -1.26 -4.48 135.00 133.59 2aeg n PRO 93 Ca 0.00 0.60 -0.32 0.00 -2.02 0.00 0.00 63.50 61.76 2aeg n PRO 93 Cb 0.00 -2.18 -0.15 0.00 -0.02 0.00 0.00 33.50 31.14 2aeg n PRO 93 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2aeg s ASP 94 N 0.14 4.19 0.37 2.55 -1.08 0.20 -4.99 116.67 118.04 2aeg s ASP 94 Ca 0.69 -1.27 0.16 0.00 -0.52 0.00 0.00 52.55 51.61 2aeg s ASP 94 Cb -0.72 -1.49 0.73 0.00 -1.46 0.00 0.00 42.92 39.97 2aeg s ASP 94 CO 0.51 -0.17 1.79 -0.09 0.52 0.00 0.00 175.17 177.73 2aeg h ARG 95 N 7.82 0.00 0.00 4.34 9.65 -1.84 -3.38 114.38 130.97 2aeg h ARG 95 Ca -0.22 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.66 2aeg h ARG 95 Cb 1.06 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 2aeg h ARG 95 CO 0.48 0.39 0.00 0.41 2.80 0.00 0.00 179.97 184.04 2aeg n GLY 96 N -0.18 2.26 3.14 2.80 0.00 -1.26 -4.67 105.19 107.29 2aeg n GLY 96 Ca -0.01 -1.85 -0.33 0.00 0.00 0.00 0.00 46.02 43.82 2aeg n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aeg s VAL 97 N -2.69 2.43 -0.17 1.61 1.01 0.14 -4.77 120.40 117.95 2aeg s VAL 97 Ca 0.00 -1.16 0.16 0.00 0.00 0.00 0.00 61.98 60.98 2aeg s VAL 97 Cb 0.00 -2.22 0.07 0.00 0.00 0.00 0.00 36.38 34.22 2aeg s VAL 97 CO 0.00 0.25 1.41 0.71 0.00 0.00 0.00 175.10 177.47 2aeg h THR 98 N 6.24 0.78 -4.28 3.92 1.35 -1.86 0.50 112.91 119.55 2aeg h THR 98 Ca -0.33 -2.12 -0.53 0.00 -0.55 0.00 0.00 66.41 62.88 2aeg h THR 98 Cb 1.10 2.36 -0.29 0.00 -1.73 0.00 0.00 68.15 69.59 2aeg h THR 98 CO 0.56 0.44 -0.83 0.20 -0.25 0.00 0.00 175.52 175.65 2aeg s ASN 99 N -6.39 1.97 -0.32 5.36 0.01 -1.26 -2.34 114.94 111.96 2aeg s ASN 99 Ca 0.04 -0.31 -0.05 0.00 -0.71 0.00 0.00 52.86 51.83 2aeg s ASN 99 Cb 0.07 -0.21 0.04 0.00 0.41 0.00 0.00 41.25 41.56 2aeg s ASN 99 CO 0.75 0.20 0.07 -0.69 -1.51 0.00 0.00 177.10 175.91 2aeg s VAL 100 N -0.42 3.52 -0.13 1.60 1.01 -0.29 -4.93 120.40 120.76 2aeg s VAL 100 Ca 0.06 -1.18 -0.10 0.00 0.00 0.00 0.00 61.98 60.77 2aeg s VAL 100 Cb -0.07 -2.99 -0.06 0.00 0.00 0.00 0.00 36.38 33.27 2aeg s VAL 100 CO -0.01 -0.13 -0.22 -1.14 0.00 0.00 0.00 175.10 173.61 2aeg n ARG 101 N 4.75 0.34 -2.72 2.72 3.00 -1.26 -1.31 116.66 122.18 2aeg n ARG 101 Ca -0.13 0.14 -0.42 0.00 -0.00 0.00 0.00 57.85 57.44 2aeg n ARG 101 Cb 0.44 -1.08 -0.03 0.00 0.00 0.00 0.00 32.46 31.79 2aeg n ARG 101 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2aeg s LYS 102 N -2.41 3.30 0.00 -0.14 1.02 -1.26 -4.87 119.74 115.38 2aeg s LYS 102 Ca -0.21 -0.86 0.13 0.00 0.02 0.00 0.00 55.97 55.05 2aeg s LYS 102 Cb 0.06 -4.54 0.77 0.00 -0.52 0.00 0.00 37.83 33.60 2aeg s LYS 102 CO 0.28 -1.99 1.20 1.28 -0.92 0.00 0.00 175.35 175.20 2aeg n LEU 103 N 8.26 0.00 -0.45 3.17 4.77 -1.26 -2.17 117.00 129.31 2aeg n LEU 103 Ca 0.10 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.16 2aeg n LEU 103 Cb 0.48 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.59 2aeg n LEU 103 CO 0.64 0.00 0.34 -0.46 -1.33 0.00 0.00 177.39 176.58 2aeg n ASN 104 N -0.91 1.84 -4.70 -1.43 6.94 -1.26 -4.87 115.26 110.86 2aeg n ASN 104 Ca 0.10 -1.42 -0.42 0.00 -0.02 0.00 0.00 54.58 52.82 2aeg n ASN 104 Cb 0.04 0.32 -0.03 0.00 -2.36 0.00 0.00 39.78 37.75 2aeg n ASN 104 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2aeg s LEU 105 N -1.79 4.35 0.44 -4.53 2.96 -0.92 -4.89 118.68 114.30 2aeg s LEU 105 Ca 0.15 2.28 0.22 0.00 -0.22 0.00 0.00 54.13 56.56 2aeg s LEU 105 Cb 0.13 -3.57 1.20 0.00 0.50 0.00 0.00 46.19 44.44 2aeg s LEU 105 CO 0.33 -0.71 1.83 -0.65 -1.32 0.00 0.00 176.35 175.82 2aeg h PRO 106 N 7.40 0.29 -0.92 0.98 0.11 -1.93 -1.91 132.00 136.02 2aeg h PRO 106 Ca -0.41 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.77 2aeg h PRO 106 Cb 1.20 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.18 2aeg h PRO 106 CO 0.89 0.19 0.59 1.25 -0.21 0.00 0.00 178.00 180.71 2aeg h HIS 107 N 0.30 1.03 0.00 0.65 2.76 -1.96 -2.72 115.15 115.20 2aeg h HIS 107 Ca 0.52 0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.60 2aeg h HIS 107 Cb 1.48 -0.33 -0.02 0.00 1.55 0.00 0.00 27.41 30.09 2aeg h HIS 107 CO -0.00 0.50 -0.90 -1.49 -1.30 0.00 0.00 177.93 174.74 2aeg h TRP 108 N 0.97 0.00 -0.88 5.26 -0.00 -1.70 -3.38 115.95 116.22 2aeg h TRP 108 Ca 0.41 0.00 0.26 0.00 -0.00 0.00 0.00 58.89 59.56 2aeg h TRP 108 Cb 0.32 0.00 -0.04 0.00 -0.00 0.00 0.00 29.16 29.44 2aeg h TRP 108 CO -0.00 0.45 0.85 1.79 -0.00 0.00 0.00 178.44 181.54 2aeg h THR 109 N 0.00 0.23 0.00 1.49 1.35 -1.46 0.47 112.91 114.99 2aeg h THR 109 Ca -0.07 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 2aeg h THR 109 Cb 1.41 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 2aeg h THR 109 CO 0.05 0.00 0.00 0.08 -0.25 0.00 0.00 175.52 175.40 2aeg h ARG 110 N 0.00 0.00 -0.37 4.72 0.11 -1.75 -3.31 114.38 113.78 2aeg h ARG 110 Ca 0.42 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 60.29 2aeg h ARG 110 Cb 2.12 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 33.07 2aeg h ARG 110 CO -0.00 0.00 -0.16 0.91 0.10 0.00 0.00 179.97 180.82 2aeg n TRP 111 N -2.75 1.18 0.98 4.08 8.01 0.16 -4.55 117.44 124.54 2aeg n TRP 111 Ca 0.04 -1.71 0.12 0.00 -1.31 0.00 0.00 57.50 54.64 2aeg n TRP 111 Cb 0.44 -0.49 0.09 0.00 -2.01 0.00 0.00 31.31 29.34 2aeg n TRP 111 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.69 177.87 2aeg n PHE 112 N -1.09 0.00 -1.25 -5.99 3.72 -1.25 -4.76 117.46 106.84 2aeg n PHE 112 Ca 0.34 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.43 2aeg n PHE 112 Cb 0.98 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 39.62 2aeg n PHE 112 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2aeg s GLY 113 N -2.00 1.67 0.29 1.37 0.00 -1.26 -4.32 107.32 103.08 2aeg s GLY 113 Ca 0.27 0.25 0.01 0.00 0.00 0.00 0.00 44.72 45.25 2aeg s GLY 113 CO 0.31 0.60 1.89 -2.08 0.00 0.00 0.00 173.10 173.82 2aeg h VAL 114 N -1.16 1.03 0.00 1.40 2.07 -1.93 -2.08 116.25 115.58 2aeg h VAL 114 Ca -0.44 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 66.73 2aeg h VAL 114 Cb 1.23 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2aeg h VAL 114 CO 0.51 0.19 0.00 -1.84 0.02 0.00 0.00 177.57 176.45 2aeg n GLU 115 N -4.52 0.15 -0.52 1.57 0.00 -1.26 -2.15 120.64 113.91 2aeg n GLU 115 Ca 0.15 0.53 0.08 0.00 0.00 0.00 0.00 57.16 57.93 2aeg n GLU 115 Cb 0.24 -1.88 0.30 0.00 0.00 0.00 0.00 31.44 30.10 2aeg n GLU 115 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2aeg n HIS 116 N -2.18 1.22 -3.51 -1.84 8.25 -0.78 -4.09 115.22 112.30 2aeg n HIS 116 Ca 0.00 -0.68 -0.37 0.00 -0.26 0.00 0.00 57.72 56.42 2aeg n HIS 116 Cb 0.11 -0.25 -0.06 0.00 1.12 0.00 0.00 29.99 30.91 2aeg n HIS 116 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2aeg s ARG 117 N -2.06 3.88 0.09 -0.41 1.81 -0.91 -1.49 118.95 119.86 2aeg s ARG 117 Ca 0.44 0.35 -0.07 0.00 -1.72 0.00 0.00 55.73 54.73 2aeg s ARG 117 Cb 0.30 -3.12 -0.01 0.00 -0.45 0.00 0.00 34.95 31.67 2aeg s ARG 117 CO 0.18 0.63 0.15 0.00 -0.68 0.00 0.00 175.30 175.57 2aeg s LEU 119 N -2.88 3.55 -0.44 0.00 1.02 0.10 -1.20 118.68 118.83 2aeg s LEU 119 Ca 0.06 0.03 -0.03 0.00 0.02 0.00 0.00 54.13 54.22 2aeg s LEU 119 Cb 0.06 -1.85 0.12 0.00 0.02 0.00 0.00 46.19 44.53 2aeg s LEU 119 CO -0.10 0.24 0.24 -0.69 0.02 0.00 0.00 176.35 176.06 2aeg s VAL 120 N -0.05 3.32 0.26 -1.59 1.01 -1.05 -1.95 120.40 120.35 2aeg s VAL 120 Ca 0.04 -2.21 -0.31 0.00 0.00 0.00 0.00 61.98 59.50 2aeg s VAL 120 Cb -0.13 -3.27 -0.12 0.00 0.00 0.00 0.00 36.38 32.87 2aeg s VAL 120 CO 0.02 -0.72 1.63 -0.81 0.00 0.00 0.00 175.10 175.22 2aeg n PRO 121 N 4.41 2.68 -3.73 2.72 -0.04 -1.26 -0.62 135.00 139.15 2aeg n PRO 121 Ca -0.01 0.96 -0.13 0.00 -0.04 0.00 0.00 63.50 64.28 2aeg n PRO 121 Cb 0.41 -2.76 -0.10 0.00 -0.04 0.00 0.00 33.50 31.01 2aeg n PRO 121 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2aeg s VAL 122 N 0.44 0.00 -0.15 0.52 0.11 -1.26 -4.91 120.40 115.16 2aeg s VAL 122 Ca 0.69 -0.03 0.12 0.00 -2.93 0.00 0.00 61.98 59.83 2aeg s VAL 122 Cb -0.51 -0.59 -0.18 0.00 -1.53 0.00 0.00 36.38 33.57 2aeg s VAL 122 CO 0.42 -0.02 0.33 0.35 -3.33 0.00 0.00 175.10 172.86 2aeg n THR 123 N 2.72 0.00 -3.59 5.04 -2.24 0.01 -4.51 114.28 111.70 2aeg n THR 123 Ca -0.14 -0.27 -0.11 0.00 -2.27 0.00 0.00 64.05 61.27 2aeg n THR 123 Cb 0.57 0.39 -0.06 0.00 -2.10 0.00 0.00 70.33 69.14 2aeg n THR 123 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2aeg s SER 124 N -3.15 -0.42 0.04 3.42 1.04 -1.19 -4.51 113.70 108.94 2aeg s SER 124 Ca -0.02 0.58 0.04 0.00 0.48 0.00 0.00 55.95 57.02 2aeg s SER 124 Cb 0.08 0.51 -0.02 0.00 0.10 0.00 0.00 66.02 66.69 2aeg s SER 124 CO 0.52 -0.29 -0.11 0.72 0.98 0.00 0.00 173.24 175.06 2aeg s PHE 125 N -0.66 0.93 0.08 5.02 -0.12 -0.93 0.14 117.98 122.43 2aeg s PHE 125 Ca -0.01 -0.40 0.02 0.00 -0.05 0.00 0.00 56.93 56.49 2aeg s PHE 125 Cb -0.02 -0.55 -0.04 0.00 -0.63 0.00 0.00 43.02 41.78 2aeg s PHE 125 CO -0.00 -0.01 0.15 0.00 -0.05 0.00 0.00 175.22 175.31 2aeg s ALA 126 N -1.05 3.79 -0.02 1.99 0.00 0.66 -1.44 121.76 125.69 2aeg s ALA 126 Ca -0.03 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.01 2aeg s ALA 126 Cb -0.08 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.41 2aeg s ALA 126 CO 0.01 0.77 -0.08 -1.21 0.00 0.00 0.00 175.76 175.25 2aeg s GLU 127 N -2.51 0.88 0.24 0.00 0.41 -0.53 -4.51 118.70 112.69 2aeg s GLU 127 Ca 0.32 -0.28 -0.31 0.00 -0.41 0.00 0.00 54.97 54.29 2aeg s GLU 127 Cb -0.12 -0.83 -0.12 0.00 -1.78 0.00 0.00 34.13 31.27 2aeg s GLU 127 CO 0.25 0.11 1.60 -2.30 -0.49 0.00 0.00 175.26 174.43 2aeg n PRO 128 N 3.28 2.53 -3.66 0.39 -0.02 -1.26 -0.67 135.00 135.60 2aeg n PRO 128 Ca -0.18 0.91 -0.28 0.00 -2.02 0.00 0.00 63.50 61.93 2aeg n PRO 128 Cb 0.55 -2.69 -0.10 0.00 -0.02 0.00 0.00 33.50 31.24 2aeg n PRO 128 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2aeg n ASP 129 N 2.92 3.48 0.31 2.55 -0.08 0.15 -4.47 116.55 121.41 2aeg n ASP 129 Ca 0.13 -3.32 0.20 0.00 -1.51 0.00 0.00 54.79 50.28 2aeg n ASP 129 Cb 0.34 -0.74 1.01 0.00 2.34 0.00 0.00 41.12 44.07 2aeg n ASP 129 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2aeg h PRO 130 N 4.84 0.00 0.00 -0.67 0.13 -1.82 -2.04 132.00 132.44 2aeg h PRO 130 Ca 0.17 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 2aeg h PRO 130 Cb 0.71 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.84 2aeg h PRO 130 CO 0.79 0.01 -0.03 0.00 -0.23 0.00 0.00 178.00 178.54 2aeg h ALA 131 N 1.99 1.03 -0.52 -0.56 0.00 -1.91 -2.50 119.26 116.79 2aeg h ALA 131 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2aeg h ALA 131 Cb 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2aeg h ALA 131 CO 0.00 0.04 0.00 0.43 0.00 0.00 0.00 179.25 179.72 2aeg n SER 132 N -3.17 3.52 -4.76 0.00 7.64 -0.77 -4.99 113.62 111.09 2aeg n SER 132 Ca -0.00 -1.97 -0.38 0.00 1.01 0.00 0.00 58.87 57.52 2aeg n SER 132 Cb 0.26 -0.35 0.01 0.00 -1.01 0.00 0.00 64.21 63.12 2aeg n SER 132 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2aeg s LYS 133 N -1.13 3.66 0.12 1.43 2.20 -0.94 -4.84 119.74 120.24 2aeg s LYS 133 Ca 0.39 2.02 -0.01 0.00 -0.36 0.00 0.00 55.97 58.01 2aeg s LYS 133 Cb 0.21 -2.48 0.03 0.00 -1.51 0.00 0.00 37.83 34.08 2aeg s LYS 133 CO 0.28 -0.70 0.16 0.00 -0.36 0.00 0.00 175.35 174.73 2aeg n GLN 134 N -0.43 0.16 0.00 4.03 10.64 -1.26 -5.00 117.38 125.52 2aeg n GLN 134 Ca 0.07 -0.33 0.00 0.00 -1.83 0.00 0.00 57.00 54.91 2aeg n GLN 134 Cb 0.46 -0.14 0.00 0.00 -0.86 0.00 0.00 30.24 29.70 2aeg n GLN 134 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 2aeg n GLU 135 N -1.32 0.00 -1.64 2.61 4.07 -1.26 -3.81 120.64 119.29 2aeg n GLU 135 Ca 0.02 0.24 -0.28 0.00 -0.06 0.00 0.00 57.16 57.09 2aeg n GLU 135 Cb 0.08 -1.03 0.06 0.00 -0.06 0.00 0.00 31.44 30.49 2aeg n GLU 135 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2aeg n GLY 136 N -0.73 6.07 3.91 8.31 0.00 -1.26 -5.02 105.19 116.47 2aeg n GLY 136 Ca 0.00 -2.41 -0.21 0.00 0.00 0.00 0.00 46.02 43.40 2aeg n GLY 136 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2aeg s GLY 137 N -2.74 2.12 0.66 -0.02 0.00 -1.25 -5.11 107.32 100.98 2aeg s GLY 137 Ca 0.57 -1.80 -0.12 0.00 0.00 0.00 0.00 44.72 43.37 2aeg s GLY 137 CO 0.02 -1.71 1.05 -1.31 0.00 0.00 0.00 173.10 171.15 2aeg s ASN 138 N -4.22 5.63 -0.07 1.64 0.02 -1.26 -4.64 114.94 112.04 2aeg s ASN 138 Ca 0.48 1.61 -0.30 0.00 -1.02 0.00 0.00 52.86 53.64 2aeg s ASN 138 Cb -0.04 -2.50 -0.04 0.00 0.02 0.00 0.00 41.25 38.69 2aeg s ASN 138 CO 0.28 -1.27 1.46 -0.69 0.02 0.00 0.00 177.10 176.90 2aeg s VAL 139 N -2.96 3.84 0.83 1.60 1.01 -1.26 -4.58 120.40 118.87 2aeg s VAL 139 Ca 0.58 1.08 -0.10 0.00 0.00 0.00 0.00 61.98 63.55 2aeg s VAL 139 Cb -0.14 -3.70 0.14 0.00 0.00 0.00 0.00 36.38 32.69 2aeg s VAL 139 CO 0.51 -0.07 1.16 -2.16 0.00 0.00 0.00 175.10 174.54 2aeg s PRO 140 N 3.38 1.37 0.36 2.72 0.04 -1.26 -3.93 135.00 137.68 2aeg s PRO 140 Ca 0.65 -0.52 0.08 0.00 0.04 0.00 0.00 61.00 61.25 2aeg s PRO 140 Cb -0.29 -2.05 -0.07 0.00 0.04 0.00 0.00 34.50 32.12 2aeg s PRO 140 CO 0.24 -1.83 -0.04 -0.80 0.04 0.00 0.00 177.00 174.61 2aeg s ASN 141 N -4.74 3.64 -0.11 6.66 0.01 -0.11 -0.67 114.94 119.61 2aeg s ASN 141 Ca 0.68 -1.27 0.03 0.00 -0.71 0.00 0.00 52.86 51.59 2aeg s ASN 141 Cb -0.06 -0.34 0.00 0.00 0.41 0.00 0.00 41.25 41.26 2aeg s ASN 141 CO 0.48 -0.33 -0.23 0.00 -1.51 0.00 0.00 177.10 175.51 2aeg s ALA 142 N -2.72 2.20 -0.21 0.60 0.00 0.16 -2.70 121.76 119.09 2aeg s ALA 142 Ca 0.33 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.20 2aeg s ALA 142 Cb 0.06 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.26 2aeg s ALA 142 CO 0.17 0.19 0.10 -1.58 0.00 0.00 0.00 175.76 174.63 2aeg s TRP 143 N 0.49 3.24 0.14 0.00 0.52 0.52 -1.45 118.94 122.40 2aeg s TRP 143 Ca -0.15 0.03 0.05 0.00 0.02 0.00 0.00 56.10 56.05 2aeg s TRP 143 Cb -0.17 -2.17 -0.04 0.00 -1.15 0.00 0.00 33.47 29.94 2aeg s TRP 143 CO 0.05 0.03 0.10 -0.06 0.02 0.00 0.00 176.95 177.09 2aeg s PHE 144 N 0.84 3.13 0.20 -1.98 0.08 -0.52 -1.15 117.98 118.58 2aeg s PHE 144 Ca 0.05 0.00 -0.17 0.00 0.12 0.00 0.00 56.93 56.93 2aeg s PHE 144 Cb -0.13 -1.54 0.03 0.00 -0.57 0.00 0.00 43.02 40.81 2aeg s PHE 144 CO 0.02 0.52 0.53 0.00 -0.10 0.00 0.00 175.22 176.19 2aeg s ALA 145 N -1.62 -0.91 0.10 5.36 0.00 -0.64 -2.19 121.76 121.86 2aeg s ALA 145 Ca 0.30 -0.26 -0.16 0.00 0.00 0.00 0.00 51.96 51.83 2aeg s ALA 145 Cb -0.11 0.87 -0.07 0.00 0.00 0.00 0.00 23.12 23.81 2aeg s ALA 145 CO 0.22 -0.82 1.48 -0.09 0.00 0.00 0.00 175.76 176.56 2aeg h ARG 146 N 2.19 0.60 0.00 0.00 9.65 -1.81 -0.84 114.38 124.17 2aeg h ARG 146 Ca -0.28 -0.24 -0.11 0.00 -1.10 0.00 0.00 59.98 58.25 2aeg h ARG 146 Cb 1.26 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.80 2aeg h ARG 146 CO 0.36 0.80 0.10 -0.40 2.80 0.00 0.00 179.97 183.64 2aeg n ASP 147 N -4.45 -1.71 0.26 -3.80 5.68 -1.26 -4.48 116.55 106.80 2aeg n ASP 147 Ca -0.03 -2.51 0.14 0.00 -0.50 0.00 0.00 54.79 51.89 2aeg n ASP 147 Cb 0.34 2.94 0.71 0.00 -1.14 0.00 0.00 41.12 43.97 2aeg n ASP 147 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2aeg h GLU 148 N 0.00 0.00 -0.00 0.11 5.08 -1.99 -0.48 114.58 117.31 2aeg h GLU 148 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2aeg h GLU 148 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2aeg h GLU 148 CO 0.36 0.11 -0.10 0.00 -1.00 0.00 0.00 179.01 178.38 2aeg n ALA 149 N -2.22 2.69 -3.40 3.43 0.00 -1.26 -4.94 120.51 114.80 2aeg n ALA 149 Ca -0.01 -0.21 -0.19 0.00 0.00 0.00 0.00 53.44 53.03 2aeg n ALA 149 Cb 0.27 -1.38 0.07 0.00 0.00 0.00 0.00 19.45 18.41 2aeg n ALA 149 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2aeg n LYS 150 N -1.23 -3.12 -1.93 0.00 5.02 -0.19 -4.90 118.16 111.82 2aeg n LYS 150 Ca 0.12 0.77 -0.41 0.00 -2.02 0.00 0.00 58.31 56.77 2aeg n LYS 150 Cb 0.29 -5.49 -0.01 0.00 -0.02 0.00 0.00 35.03 29.81 2aeg n LYS 150 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2aeg s SER 151 N -3.67 6.49 1.04 4.39 0.01 -1.26 -4.82 113.70 115.87 2aeg s SER 151 Ca 0.33 2.90 -0.16 0.00 1.31 0.00 0.00 55.95 60.34 2aeg s SER 151 Cb -0.06 -2.66 0.08 0.00 0.21 0.00 0.00 66.02 63.59 2aeg s SER 151 CO 0.77 -0.76 0.21 -0.11 0.41 0.00 0.00 173.24 173.76 2aeg n LEU 152 N 0.55 -1.33 -3.64 2.44 7.94 -1.26 -4.61 117.00 117.09 2aeg n LEU 152 Ca 0.01 0.09 -0.09 0.00 -1.11 0.00 0.00 56.01 54.90 2aeg n LEU 152 Cb 0.40 -1.08 -0.07 0.00 0.53 0.00 0.00 43.42 43.21 2aeg n LEU 152 CO 0.62 -3.35 0.40 -0.36 -1.11 0.00 0.00 177.39 173.59 2aeg s PHE 154 N -2.31 -0.93 0.47 1.96 0.08 -0.90 -4.98 117.98 111.37 2aeg s PHE 154 Ca 0.57 1.98 -0.18 0.00 0.12 0.00 0.00 56.93 59.42 2aeg s PHE 154 Cb -0.16 0.49 -0.09 0.00 -0.57 0.00 0.00 43.02 42.68 2aeg s PHE 154 CO 0.67 -0.46 0.95 -0.06 -0.10 0.00 0.00 175.22 176.23 2aeg s PHE 155 N 1.13 3.39 -0.82 0.36 0.08 0.20 -0.02 117.98 122.31 2aeg s PHE 155 Ca -0.06 1.51 -0.23 0.00 0.12 0.00 0.00 56.93 58.27 2aeg s PHE 155 Cb -0.05 -2.80 0.07 0.00 -0.57 0.00 0.00 43.02 39.67 2aeg s PHE 155 CO -0.12 -0.23 1.18 0.00 -0.10 0.00 0.00 175.22 175.95 2aeg s ALA 156 N -2.40 3.00 0.35 5.36 0.00 -1.22 -2.53 121.76 124.33 2aeg s ALA 156 Ca 0.60 -2.03 0.04 0.00 0.00 0.00 0.00 51.96 50.57 2aeg s ALA 156 Cb -0.10 -4.14 -0.01 0.00 0.00 0.00 0.00 23.12 18.87 2aeg s ALA 156 CO 0.23 -3.13 0.52 0.20 0.00 0.00 0.00 175.76 173.58 2aeg s GLY 157 N 3.97 1.48 -0.03 0.00 0.00 -0.34 -1.44 107.32 110.97 2aeg s GLY 157 Ca 0.33 -1.23 0.01 0.00 0.00 0.00 0.00 44.72 43.83 2aeg s GLY 157 CO 0.03 -1.14 -0.05 -0.42 0.00 0.00 0.00 173.10 171.52 2aeg s ILE 158 N -2.27 0.52 0.17 0.90 1.01 -0.15 -1.40 121.20 119.98 2aeg s ILE 158 Ca 0.43 -0.16 0.09 0.00 0.00 0.00 0.00 60.65 61.02 2aeg s ILE 158 Cb -0.10 -0.52 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 2aeg s ILE 158 CO 0.33 0.20 -0.20 -1.38 0.00 0.00 0.00 174.94 173.90 2aeg s HIS 159 N 0.63 1.96 -0.21 3.97 -3.43 -0.55 -0.44 115.29 117.21 2aeg s HIS 159 Ca -0.08 -0.43 -0.02 0.00 -0.80 0.00 0.00 55.06 53.73 2aeg s HIS 159 Cb -0.12 -0.97 0.06 0.00 -1.43 0.00 0.00 32.58 30.13 2aeg s HIS 159 CO 0.00 0.38 0.02 0.08 -2.00 0.00 0.00 174.74 173.22 2aeg s VAL 160 N -1.95 0.82 0.52 -5.38 1.01 0.93 -4.74 120.40 111.61 2aeg s VAL 160 Ca 0.17 -0.80 -0.19 0.00 0.00 0.00 0.00 61.98 61.17 2aeg s VAL 160 Cb -0.06 -1.29 -0.07 0.00 0.00 0.00 0.00 36.38 34.96 2aeg s VAL 160 CO 0.08 -0.21 1.03 -2.16 0.00 0.00 0.00 175.10 173.84 2aeg s PRO 161 N 1.71 3.71 -0.79 2.72 0.04 -1.26 -0.25 135.00 140.88 2aeg s PRO 161 Ca -0.02 1.26 -0.14 0.00 0.04 0.00 0.00 61.00 62.15 2aeg s PRO 161 Cb -0.18 -2.09 0.02 0.00 0.04 0.00 0.00 34.50 32.30 2aeg s PRO 161 CO -0.09 -0.50 0.49 1.04 0.04 0.00 0.00 177.00 177.99 2aeg n GLN 162 N -1.31 -0.80 -3.65 4.56 1.13 -1.20 -4.88 117.38 111.23 2aeg n GLN 162 Ca 0.09 0.25 -0.36 0.00 -1.94 0.00 0.00 57.00 55.04 2aeg n GLN 162 Cb 0.53 -1.69 -0.08 0.00 0.11 0.00 0.00 30.24 29.12 2aeg n GLN 162 CO 0.00 0.00 0.00 -0.46 -1.44 0.00 0.00 177.06 175.16 2aeg s TRP 163 N -3.31 3.44 -0.18 1.08 -0.11 0.47 -4.78 118.94 115.56 2aeg s TRP 163 Ca 0.19 0.45 -0.12 0.00 1.22 0.00 0.00 56.10 57.85 2aeg s TRP 163 Cb -0.11 -2.23 -0.05 0.00 -1.50 0.00 0.00 33.47 29.59 2aeg s TRP 163 CO 0.73 0.29 0.21 0.21 -4.62 0.00 0.00 176.95 173.76 2aeg s LYS 164 N 0.33 4.19 0.00 5.86 2.20 -1.26 -0.88 119.74 130.17 2aeg s LYS 164 Ca 0.12 -0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.66 2aeg s LYS 164 Cb -0.12 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.79 2aeg s LYS 164 CO 0.01 0.30 0.00 -1.13 -0.36 0.00 0.00 175.35 174.16 2aeg n SER 165 N 3.46 0.00 -4.55 1.43 3.41 -0.16 -4.96 113.62 112.25 2aeg n SER 165 Ca -0.14 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.04 2aeg n SER 165 Cb 0.52 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.41 2aeg n SER 165 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2aeg s VAL 166 N -2.00 4.79 -0.12 -3.33 1.01 -1.26 -1.77 120.40 117.71 2aeg s VAL 166 Ca 0.00 0.48 -0.15 0.00 0.00 0.00 0.00 61.98 62.31 2aeg s VAL 166 Cb 0.00 -4.19 -0.26 0.00 0.00 0.00 0.00 36.38 31.93 2aeg s VAL 166 CO 0.00 -0.50 0.47 0.03 0.00 0.00 0.00 175.10 175.10 2aeg h ARG 167 N 8.69 0.20 -4.39 2.72 2.47 -1.75 0.56 114.38 122.89 2aeg h ARG 167 Ca -0.25 -0.35 -0.53 0.00 -1.26 0.00 0.00 59.98 57.59 2aeg h ARG 167 Cb 1.10 0.13 -0.35 0.00 -1.65 0.00 0.00 29.97 29.19 2aeg h ARG 167 CO 0.89 1.17 -0.81 0.15 0.56 0.00 0.00 179.97 181.93 2aeg s LYS 168 N -2.47 1.65 0.35 0.04 1.02 -1.26 -4.34 119.74 114.73 2aeg s LYS 168 Ca -0.22 -0.34 0.15 0.00 0.02 0.00 0.00 55.97 55.59 2aeg s LYS 168 Cb 0.05 -1.55 1.11 0.00 -0.52 0.00 0.00 37.83 36.92 2aeg s LYS 168 CO 0.74 -0.14 1.66 -0.24 -0.92 0.00 0.00 175.35 176.45 2aeg h VAL 169 N 6.08 0.29 -0.18 3.17 3.04 -1.88 -0.30 116.25 126.48 2aeg h VAL 169 Ca -0.31 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.27 2aeg h VAL 169 Cb 1.15 -0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.38 2aeg h VAL 169 CO 0.44 0.06 0.12 -0.09 -1.01 0.00 0.00 177.57 177.09 2aeg h ARG 170 N 0.31 0.24 0.00 4.17 2.43 -2.01 -2.65 114.38 116.87 2aeg h ARG 170 Ca 0.74 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.89 2aeg h ARG 170 Cb 1.71 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.21 2aeg h ARG 170 CO -0.59 0.16 0.00 -0.25 -1.51 0.00 0.00 179.97 177.78 2aeg n ASP 171 N -4.96 0.71 0.00 -3.80 9.92 -0.17 -5.01 116.55 113.25 2aeg n ASP 171 Ca -0.04 0.63 0.00 0.00 -0.53 0.00 0.00 54.79 54.85 2aeg n ASP 171 Cb 0.03 -0.80 0.00 0.00 -0.64 0.00 0.00 41.12 39.71 2aeg n ASP 171 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2aeg n GLY 172 N 0.50 -0.03 3.69 0.44 0.00 -0.90 -4.73 105.19 104.17 2aeg n GLY 172 Ca 0.03 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 2aeg n GLY 172 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2aeg s LEU 173 N 0.00 4.28 0.13 0.99 1.98 -1.26 -4.15 118.68 120.65 2aeg s LEU 173 Ca 0.00 1.69 0.00 0.00 -2.89 0.00 0.00 54.13 52.93 2aeg s LEU 173 Cb 0.00 -3.56 -0.04 0.00 0.66 0.00 0.00 46.19 43.25 2aeg s LEU 173 CO 0.00 -0.48 0.02 0.42 -1.89 0.00 0.00 176.35 174.42 2aeg s THR 174 N 1.89 0.37 -0.22 3.68 -4.23 -0.73 -4.94 115.64 111.46 2aeg s THR 174 Ca 0.52 -1.93 -0.03 0.00 -1.18 0.00 0.00 61.69 59.08 2aeg s THR 174 Cb -0.22 -1.98 0.00 0.00 1.34 0.00 0.00 72.50 71.64 2aeg s THR 174 CO 0.22 -0.56 -0.06 -0.89 -0.54 0.00 0.00 174.62 172.78 2aeg s THR 175 N -3.86 3.12 0.06 3.99 2.01 -1.26 -0.99 115.64 118.72 2aeg s THR 175 Ca 0.21 -0.64 0.03 0.00 0.31 0.00 0.00 61.69 61.60 2aeg s THR 175 Cb 0.07 -2.44 -0.03 0.00 0.01 0.00 0.00 72.50 70.11 2aeg s THR 175 CO 0.01 0.40 -0.10 -1.81 -0.69 0.00 0.00 174.62 172.42 2aeg s ASP 176 N 1.43 1.17 -0.18 3.53 1.01 -0.06 -4.82 116.67 118.75 2aeg s ASP 176 Ca 0.05 -0.61 -0.23 0.00 0.71 0.00 0.00 52.55 52.47 2aeg s ASP 176 Cb -0.14 0.01 -0.02 0.00 1.01 0.00 0.00 42.92 43.77 2aeg s ASP 176 CO -0.05 -0.18 0.73 -1.81 0.21 0.00 0.00 175.17 174.07 2aeg s ASP 177 N -1.76 6.83 0.19 0.27 1.01 -1.26 -0.40 116.67 121.55 2aeg s ASP 177 Ca -0.05 1.02 0.07 0.00 0.71 0.00 0.00 52.55 54.30 2aeg s ASP 177 Cb -0.09 -2.40 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 2aeg s ASP 177 CO 0.01 -0.32 0.02 -0.76 0.21 0.00 0.00 175.17 174.33 2aeg s LEU 178 N 1.95 3.38 0.06 1.23 1.43 0.65 -0.69 118.68 126.68 2aeg s LEU 178 Ca 0.34 -0.38 -0.13 0.00 -1.03 0.00 0.00 54.13 52.92 2aeg s LEU 178 Cb -0.16 -2.01 0.02 0.00 0.03 0.00 0.00 46.19 44.07 2aeg s LEU 178 CO 0.12 0.07 0.30 -0.72 0.23 0.00 0.00 176.35 176.35 2aeg s TYR 179 N -1.81 -0.08 0.37 0.29 -0.85 -0.50 -0.05 117.35 114.73 2aeg s TYR 179 Ca 0.28 -0.12 -0.09 0.00 -0.52 0.00 0.00 57.07 56.63 2aeg s TYR 179 Cb -0.09 0.09 0.04 0.00 0.38 0.00 0.00 41.96 42.38 2aeg s TYR 179 CO 0.20 -0.53 0.65 0.41 -1.52 0.00 0.00 175.55 174.76 2aeg n GLY 180 N 0.40 1.48 3.24 5.49 0.00 0.41 0.73 105.19 116.94 2aeg n GLY 180 Ca -0.18 -1.42 -0.10 0.00 0.00 0.00 0.00 46.02 44.33 2aeg n GLY 180 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2aeg s PHE 181 N -2.55 0.00 0.48 1.61 -0.71 -0.99 -0.97 117.98 114.86 2aeg s PHE 181 Ca 0.22 -0.32 -0.21 0.00 -1.04 0.00 0.00 56.93 55.58 2aeg s PHE 181 Cb -0.03 0.05 -0.08 0.00 -1.21 0.00 0.00 43.02 41.75 2aeg s PHE 181 CO 0.16 -0.56 1.05 -0.51 -1.34 0.00 0.00 175.22 174.02 2aeg s LEU 182 N -2.59 3.87 0.36 -1.99 1.02 -0.52 -1.14 118.68 117.69 2aeg s LEU 182 Ca 0.01 1.98 0.04 0.00 0.02 0.00 0.00 54.13 56.19 2aeg s LEU 182 Cb 0.02 -4.52 -0.06 0.00 0.02 0.00 0.00 46.19 41.66 2aeg s LEU 182 CO -0.09 -0.81 0.06 0.42 0.02 0.00 0.00 176.35 175.94 2aeg s THR 183 N -1.91 1.22 0.24 5.49 -4.23 -0.43 -1.80 115.64 114.23 2aeg s THR 183 Ca 0.67 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 59.10 2aeg s THR 183 Cb -0.18 -2.72 0.03 0.00 1.34 0.00 0.00 72.50 70.97 2aeg s THR 183 CO 0.22 0.00 0.45 1.07 -0.54 0.00 0.00 174.62 175.82 2aeg n THR 184 N -0.80 0.00 -1.82 3.99 5.66 -1.26 -4.58 114.28 115.46 2aeg n THR 184 Ca -0.04 -0.69 -0.41 0.00 -3.05 0.00 0.00 64.05 59.86 2aeg n THR 184 Cb 0.66 0.62 -0.00 0.00 -1.55 0.00 0.00 70.33 70.06 2aeg n THR 184 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2aeg s ASP 185 N -2.28 6.38 0.49 1.09 1.01 -1.26 -4.54 116.67 117.56 2aeg s ASP 185 Ca 0.11 3.01 -0.19 0.00 0.71 0.00 0.00 52.55 56.19 2aeg s ASP 185 Cb -0.03 -2.66 -0.08 0.00 1.01 0.00 0.00 42.92 41.16 2aeg s ASP 185 CO 0.08 -0.85 1.02 -2.16 0.21 0.00 0.00 175.17 173.47 2aeg s PRO 186 N -1.87 3.82 0.36 8.23 0.04 -1.26 -4.39 135.00 139.93 2aeg s PRO 186 Ca 0.54 1.26 0.01 0.00 0.04 0.00 0.00 61.00 62.84 2aeg s PRO 186 Cb -0.46 -2.10 0.07 0.00 0.04 0.00 0.00 34.50 32.04 2aeg s PRO 186 CO 0.61 -0.40 0.49 0.27 0.04 0.00 0.00 177.00 178.01 2aeg n ASN 187 N -1.12 0.75 0.23 6.66 2.04 -1.26 -4.65 115.26 117.91 2aeg n ASN 187 Ca 0.09 -1.61 0.13 0.00 -0.44 0.00 0.00 54.58 52.75 2aeg n ASN 187 Cb 0.53 -0.31 0.76 0.00 -2.53 0.00 0.00 39.78 38.22 2aeg n ASN 187 CO 0.00 0.00 0.00 0.44 -0.44 0.00 0.00 177.26 177.26 2aeg h ASP 188 N -0.25 0.00 -0.13 0.53 3.32 -1.95 0.17 116.42 118.11 2aeg h ASP 188 Ca -0.16 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.76 2aeg h ASP 188 Cb 0.63 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.18 2aeg h ASP 188 CO 0.18 0.00 -0.41 0.25 -1.72 0.00 0.00 179.24 177.55 2aeg h LEU 189 N 0.00 0.59 0.09 1.55 5.85 -1.93 -3.37 115.31 118.08 2aeg h LEU 189 Ca 0.05 -0.60 -0.18 0.00 0.84 0.00 0.00 57.88 57.99 2aeg h LEU 189 Cb 0.23 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.09 2aeg h LEU 189 CO -0.00 1.09 -0.88 0.58 -0.34 0.00 0.00 178.44 178.88 2aeg h VAL 190 N 0.12 1.35 -0.85 1.05 2.07 -1.77 -3.40 116.25 114.82 2aeg h VAL 190 Ca -0.01 -2.41 0.21 0.00 0.82 0.00 0.00 66.70 65.31 2aeg h VAL 190 Cb 1.03 2.97 -0.15 0.00 -1.52 0.00 0.00 31.29 33.63 2aeg h VAL 190 CO 0.09 0.64 0.08 0.50 0.02 0.00 0.00 177.57 178.90 2aeg h LYS 191 N -0.56 0.11 0.00 1.57 3.64 -0.65 0.81 116.57 121.48 2aeg h LYS 191 Ca -0.19 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.18 2aeg h LYS 191 Cb 1.50 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.29 2aeg h LYS 191 CO 0.05 0.07 -0.03 -1.35 -2.27 0.00 0.00 179.45 175.92 2aeg h PRO 192 N 0.11 0.00 0.00 1.90 0.11 -1.77 -3.15 132.00 129.20 2aeg h PRO 192 Ca 0.50 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 66.18 2aeg h PRO 192 Cb 0.96 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.00 2aeg h PRO 192 CO -0.72 0.03 -2.49 -0.89 -0.21 0.00 0.00 178.00 173.71 2aeg n ILE 193 N -3.52 1.52 -3.79 4.15 5.41 0.11 -4.93 119.36 118.30 2aeg n ILE 193 Ca -0.03 -0.46 -0.24 0.00 1.00 0.00 0.00 62.75 63.02 2aeg n ILE 193 Cb 0.13 -1.69 -0.17 0.00 -0.71 0.00 0.00 39.64 37.20 2aeg n ILE 193 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 2aeg s HIS 194 N -2.51 0.86 -0.06 1.39 5.04 0.24 -4.62 115.29 115.63 2aeg s HIS 194 Ca -0.37 -0.36 0.14 0.00 -1.54 0.00 0.00 55.06 52.93 2aeg s HIS 194 Cb 0.12 -0.91 -0.21 0.00 0.04 0.00 0.00 32.58 31.63 2aeg s HIS 194 CO 0.54 -0.40 0.70 -1.91 -2.34 0.00 0.00 174.74 171.33 2aeg n GLU 195 N 5.10 0.63 -0.14 2.88 2.13 -1.23 -3.24 120.64 126.76 2aeg n GLU 195 Ca -0.08 0.28 -0.04 0.00 0.66 0.00 0.00 57.16 57.98 2aeg n GLU 195 Cb 0.50 -1.80 0.03 0.00 0.27 0.00 0.00 31.44 30.44 2aeg n GLU 195 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2aeg h LYS 196 N 0.00 0.01 0.00 5.31 3.64 -1.96 -3.43 116.57 120.14 2aeg h LYS 196 Ca -0.26 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 2aeg h LYS 196 Cb 1.91 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.73 2aeg h LYS 196 CO 0.07 0.01 0.00 0.00 -2.27 0.00 0.00 179.45 177.26 2aeg n ALA 197 N -2.77 0.00 -2.69 5.00 0.00 -1.26 -4.77 120.51 114.02 2aeg n ALA 197 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.20 2aeg n ALA 197 Cb 0.25 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.62 2aeg n ALA 197 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2aeg s PRO 199 N -0.96 2.51 0.01 0.00 0.04 -1.26 -4.68 135.00 130.66 2aeg s PRO 199 Ca 0.00 -0.99 -0.30 0.00 0.04 0.00 0.00 61.00 59.76 2aeg s PRO 199 Cb 0.00 -2.45 -0.03 0.00 0.04 0.00 0.00 34.50 32.05 2aeg s PRO 199 CO 0.00 0.49 0.96 0.08 0.04 0.00 0.00 177.00 178.57 2aeg s VAL 200 N -1.59 4.83 -0.03 -0.36 1.01 -0.74 -4.73 120.40 118.78 2aeg s VAL 200 Ca 0.27 2.02 0.04 0.00 0.00 0.00 0.00 61.98 64.32 2aeg s VAL 200 Cb -0.10 -4.30 -0.00 0.00 0.00 0.00 0.00 36.38 31.97 2aeg s VAL 200 CO 0.19 0.19 -0.15 -0.76 0.00 0.00 0.00 175.10 174.57 2aeg s LEU 201 N 0.85 1.91 -0.26 3.92 1.43 -1.26 -3.37 118.68 121.90 2aeg s LEU 201 Ca 0.50 -0.31 -0.07 0.00 -1.03 0.00 0.00 54.13 53.22 2aeg s LEU 201 Cb -0.21 -0.86 -0.02 0.00 0.03 0.00 0.00 46.19 45.14 2aeg s LEU 201 CO 0.28 0.15 0.08 -0.76 0.23 0.00 0.00 176.35 176.32 2aeg s LEU 202 N -0.02 3.58 -0.01 1.79 1.43 0.97 -4.97 118.68 121.44 2aeg s LEU 202 Ca -0.01 -0.36 0.22 0.00 -1.03 0.00 0.00 54.13 52.94 2aeg s LEU 202 Cb -0.10 -1.91 -0.30 0.00 0.03 0.00 0.00 46.19 43.91 2aeg s LEU 202 CO 0.01 -0.09 0.52 0.18 0.23 0.00 0.00 176.35 177.20 2aeg n LEU 203 N 4.91 0.10 -4.50 1.79 4.77 -1.26 -2.12 117.00 120.69 2aeg n LEU 203 Ca -0.16 0.04 -0.25 0.00 -0.03 0.00 0.00 56.01 55.61 2aeg n LEU 203 Cb 0.50 0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.51 2aeg n LEU 203 CO 0.31 0.01 -0.43 0.42 -1.33 0.00 0.00 177.39 176.37 2aeg s THR 204 N -3.44 2.35 0.26 -5.08 -4.23 -1.26 -5.01 115.64 99.24 2aeg s THR 204 Ca -0.07 -2.31 -0.02 0.00 -1.18 0.00 0.00 61.69 58.11 2aeg s THR 204 Cb 0.13 -2.47 0.12 0.00 1.34 0.00 0.00 72.50 71.62 2aeg s THR 204 CO 0.89 -0.30 1.76 -0.09 -0.54 0.00 0.00 174.62 176.34 2aeg h ARG 205 N 2.15 0.82 -0.81 3.99 2.43 -1.99 -1.74 114.38 119.23 2aeg h ARG 205 Ca -0.41 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 58.55 2aeg h ARG 205 Cb 1.25 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.67 2aeg h ARG 205 CO 0.65 0.80 0.50 1.05 -1.51 0.00 0.00 179.97 181.47 2aeg h GLU 206 N 0.77 1.09 -0.16 0.20 9.09 -1.99 0.26 114.58 123.84 2aeg h GLU 206 Ca 0.15 -0.09 -0.18 0.00 0.05 0.00 0.00 59.36 59.29 2aeg h GLU 206 Cb 0.43 -0.23 -0.00 0.00 -1.65 0.00 0.00 28.75 27.29 2aeg h GLU 206 CO 0.02 0.75 -0.65 0.93 0.05 0.00 0.00 179.01 180.11 2aeg h GLU 207 N 1.11 0.58 -0.24 1.06 5.08 -1.85 -1.68 114.58 118.64 2aeg h GLU 207 Ca 0.29 -0.42 -0.12 0.00 -1.00 0.00 0.00 59.36 58.12 2aeg h GLU 207 Cb -0.07 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2aeg h GLU 207 CO -0.06 1.03 -0.35 1.79 -1.00 0.00 0.00 179.01 180.43 2aeg h THR 208 N 0.42 1.29 -0.22 1.13 1.35 -0.87 -1.85 112.91 114.16 2aeg h THR 208 Ca -0.01 -1.47 -0.13 0.00 -0.55 0.00 0.00 66.41 64.24 2aeg h THR 208 Cb 1.22 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 69.12 2aeg h THR 208 CO 0.12 0.46 -0.38 -0.33 -0.25 0.00 0.00 175.52 175.14 2aeg h GLU 209 N 0.45 0.65 -0.57 4.72 4.39 -0.88 -3.13 114.58 120.22 2aeg h GLU 209 Ca 0.05 -0.41 0.02 0.00 0.34 0.00 0.00 59.36 59.36 2aeg h GLU 209 Cb 0.82 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.48 2aeg h GLU 209 CO 0.07 1.02 0.35 0.82 -1.16 0.00 0.00 179.01 180.11 2aeg h ILE 210 N 0.36 1.09 0.00 3.13 1.08 -1.22 0.91 117.51 122.86 2aeg h ILE 210 Ca 0.02 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 64.24 2aeg h ILE 210 Cb 0.98 0.32 0.00 0.00 -3.07 0.00 0.00 36.82 35.05 2aeg h ILE 210 CO 0.09 0.13 0.00 1.87 -0.69 0.00 0.00 178.15 179.55 2aeg n TRP 211 N -4.74 0.00 0.00 1.37 -0.00 -0.70 -0.15 117.44 113.21 2aeg n TRP 211 Ca 0.04 -0.02 0.00 0.00 -0.00 0.00 0.00 57.50 57.53 2aeg n TRP 211 Cb 0.06 -0.04 0.00 0.00 -0.00 0.00 0.00 31.31 31.33 2aeg n TRP 211 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 2aeg n ARG 213 N 0.57 0.00 -2.20 5.87 1.74 0.32 -4.90 116.66 118.06 2aeg n ARG 213 Ca 0.00 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.71 2aeg n ARG 213 Cb 0.04 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.47 2aeg n ARG 213 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2aeg s ALA 214 N -2.31 2.96 0.59 7.54 0.00 0.78 -4.98 121.76 126.35 2aeg s ALA 214 Ca 0.00 0.99 -0.18 0.00 0.00 0.00 0.00 51.96 52.76 2aeg s ALA 214 Cb 0.00 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 2aeg s ALA 214 CO 0.00 -0.75 1.16 -1.25 0.00 0.00 0.00 175.76 174.93 2aeg s PRO 215 N -2.72 3.04 0.25 0.00 0.04 -1.26 -4.58 135.00 129.76 2aeg s PRO 215 Ca 0.64 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 63.24 2aeg s PRO 215 Cb -0.30 -1.95 0.34 0.00 0.04 0.00 0.00 34.50 32.62 2aeg s PRO 215 CO 0.36 -1.12 1.58 2.35 0.04 0.00 0.00 177.00 180.22 2aeg h TRP 216 N 0.80 -0.57 -1.13 0.56 -0.00 -1.95 -0.18 115.95 113.48 2aeg h TRP 216 Ca -0.50 0.08 0.33 0.00 -0.00 0.00 0.00 58.89 58.80 2aeg h TRP 216 Cb 1.28 0.38 -0.11 0.00 -0.00 0.00 0.00 29.16 30.71 2aeg h TRP 216 CO 0.50 -0.38 0.73 0.22 -0.00 0.00 0.00 178.44 179.51 2aeg h ASP 217 N -0.02 0.37 0.04 2.65 1.82 -1.94 -0.11 116.42 119.25 2aeg h ASP 217 Ca 0.39 0.11 -0.29 0.00 -0.39 0.00 0.00 57.03 56.85 2aeg h ASP 217 Cb 0.62 0.06 -0.03 0.00 0.68 0.00 0.00 39.33 40.66 2aeg h ASP 217 CO -0.88 -0.02 -1.59 1.21 -1.61 0.00 0.00 179.24 176.35 2aeg n GLU 218 N -4.67 0.64 -0.16 0.28 2.13 -0.20 -4.40 120.64 114.26 2aeg n GLU 218 Ca 0.30 0.45 0.09 0.00 0.66 0.00 0.00 57.16 58.65 2aeg n GLU 218 Cb 1.07 -1.72 0.40 0.00 0.27 0.00 0.00 31.44 31.46 2aeg n GLU 218 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2aeg h ALA 219 N -0.31 1.81 0.00 4.31 0.00 -0.45 -1.56 119.26 123.05 2aeg h ALA 219 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2aeg h ALA 219 Cb 1.58 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.22 2aeg h ALA 219 CO -0.11 0.06 0.00 1.57 0.00 0.00 0.00 179.25 180.77 2aeg h LYS 220 N 0.65 0.00 0.00 0.00 2.10 -1.25 -2.53 116.57 115.53 2aeg h LYS 220 Ca 0.31 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.91 2aeg h LYS 220 Cb 0.38 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.71 2aeg h LYS 220 CO -0.11 0.00 -0.24 0.45 -2.00 0.00 0.00 179.45 177.55 2aeg h HIS 221 N 0.00 0.00 -0.03 0.07 3.86 -1.51 -2.03 115.15 115.51 2aeg h HIS 221 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2aeg h HIS 221 Cb 0.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.59 2aeg h HIS 221 CO 0.00 0.24 0.00 1.47 0.86 0.00 0.00 177.93 180.50 2aeg n LEU 222 N -4.13 0.23 -4.43 2.43 -0.00 -0.95 -4.44 117.00 105.71 2aeg n LEU 222 Ca -0.02 -0.10 -0.43 0.00 -0.00 0.00 0.00 56.01 55.46 2aeg n LEU 222 Cb 0.31 -0.02 0.00 0.00 -0.00 0.00 0.00 43.42 43.71 2aeg n LEU 222 CO 0.36 0.05 1.78 0.00 -0.00 0.00 0.00 177.39 179.58 2aeg n ALA 223 N -0.60 3.94 -2.85 1.47 0.00 -0.76 -4.83 120.51 116.87 2aeg n ALA 223 Ca 0.13 -4.05 -0.10 0.00 0.00 0.00 0.00 53.44 49.41 2aeg n ALA 223 Cb 0.09 -3.33 -0.06 0.00 0.00 0.00 0.00 19.45 16.16 2aeg n ALA 223 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2aeg s ARG 224 N 2.77 0.93 0.55 0.00 1.70 -1.26 -5.00 118.95 118.63 2aeg s ARG 224 Ca 0.48 -0.74 -0.20 0.00 -0.47 0.00 0.00 55.73 54.80 2aeg s ARG 224 Cb 0.02 0.40 -0.05 0.00 -0.57 0.00 0.00 34.95 34.75 2aeg s ARG 224 CO 0.03 -0.33 1.22 -1.25 -1.08 0.00 0.00 175.30 173.89 2aeg s PRO 225 N -3.50 3.22 0.56 3.89 0.04 -1.26 -4.70 135.00 133.26 2aeg s PRO 225 Ca 0.02 1.86 -0.16 0.00 0.04 0.00 0.00 61.00 62.76 2aeg s PRO 225 Cb 0.02 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 2aeg s PRO 225 CO -0.09 -1.01 1.03 -0.51 0.04 0.00 0.00 177.00 176.45 2aeg s LEU 226 N -3.70 3.55 0.69 -3.56 1.43 -1.26 -5.01 118.68 110.82 2aeg s LEU 226 Ca 0.73 1.73 -0.16 0.00 -1.03 0.00 0.00 54.13 55.39 2aeg s LEU 226 Cb -0.31 -4.53 -0.00 0.00 0.03 0.00 0.00 46.19 41.38 2aeg s LEU 226 CO 0.35 -0.95 1.03 -2.65 0.23 0.00 0.00 176.35 174.36 2aeg n PRO 227 N -1.84 0.65 -0.26 1.29 -0.02 -1.26 -4.81 135.00 128.75 2aeg n PRO 227 Ca 0.08 0.28 0.07 0.00 -2.02 0.00 0.00 63.50 61.90 2aeg n PRO 227 Cb 0.53 -2.27 0.31 0.00 -0.02 0.00 0.00 33.50 32.05 2aeg n PRO 227 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2aeg h ASN 228 N -0.04 0.77 -0.21 2.55 2.35 -1.96 -1.48 115.58 117.56 2aeg h ASN 228 Ca -0.48 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 2aeg h ASN 228 Cb 1.34 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2aeg h ASN 228 CO 0.48 0.48 0.00 -0.90 -1.65 0.00 0.00 177.43 175.84 2aeg n ASP 229 N -4.50 1.24 0.03 5.81 5.68 -1.26 -4.03 116.55 119.52 2aeg n ASP 229 Ca 0.13 -1.90 -0.14 0.00 -0.50 0.00 0.00 54.79 52.39 2aeg n ASP 229 Cb 0.27 -0.14 -0.03 0.00 -1.14 0.00 0.00 41.12 40.08 2aeg n ASP 229 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2aeg h ALA 230 N 3.56 0.41 -1.70 2.12 0.00 -1.60 -3.46 119.26 118.58 2aeg h ALA 230 Ca 0.00 -0.64 -0.60 0.00 0.00 0.00 0.00 54.91 53.67 2aeg h ALA 230 Cb 0.32 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 17.98 2aeg h ALA 230 CO 0.00 0.75 -0.57 -0.51 0.00 0.00 0.00 179.25 178.92 2aeg s LEU 231 N -8.04 2.97 0.12 0.00 1.43 -1.26 -4.67 118.68 109.24 2aeg s LEU 231 Ca -0.07 -1.19 0.02 0.00 -1.03 0.00 0.00 54.13 51.85 2aeg s LEU 231 Cb 0.09 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 45.09 2aeg s LEU 231 CO 0.87 -0.43 -0.04 0.27 0.23 0.00 0.00 176.35 177.25 2aeg s ILE 232 N -2.63 0.69 -0.68 -0.59 -4.36 -0.32 -4.97 121.20 108.34 2aeg s ILE 232 Ca 0.37 -1.95 -0.18 0.00 -0.26 0.00 0.00 60.65 58.63 2aeg s ILE 232 Cb 0.06 -1.83 0.13 0.00 1.25 0.00 0.00 42.46 42.06 2aeg s ILE 232 CO 0.20 -0.74 0.77 -0.63 0.24 0.00 0.00 174.94 174.79 2aeg s ILE 233 N -3.63 4.93 0.24 8.37 1.01 -1.26 -1.62 121.20 129.23 2aeg s ILE 233 Ca 0.16 -1.31 -0.00 0.00 0.00 0.00 0.00 60.65 59.50 2aeg s ILE 233 Cb 0.05 -4.53 0.02 0.00 0.01 0.00 0.00 42.46 38.02 2aeg s ILE 233 CO -0.02 -1.17 1.64 0.25 0.00 0.00 0.00 174.94 175.64 2aeg h LEU 234 N 9.69 0.55 -7.52 2.97 6.46 -1.46 -3.48 115.31 122.52 2aeg h LEU 234 Ca -0.17 -0.23 0.13 0.00 -0.12 0.00 0.00 57.88 57.50 2aeg h LEU 234 Cb 1.07 -0.15 -0.09 0.00 -0.73 0.00 0.00 40.66 40.75 2aeg h LEU 234 CO 1.05 0.86 0.43 -0.94 -0.62 0.00 0.00 178.44 179.22 2aeg s SER 235 N -6.83 -0.26 -0.18 1.25 1.04 -1.17 -5.03 113.70 102.51 2aeg s SER 235 Ca -0.07 -0.32 -0.01 0.00 0.48 0.00 0.00 55.95 56.04 2aeg s SER 235 Cb 0.13 0.51 0.05 0.00 0.10 0.00 0.00 66.02 66.81 2aeg s SER 235 CO 0.81 -0.91 -0.04 -0.13 0.98 0.00 0.00 173.24 173.95 2aeg s ARG 236 N -3.38 1.36 0.20 4.02 0.52 -1.26 -0.35 118.95 120.06 2aeg s ARG 236 Ca 0.10 -0.61 0.10 0.00 -0.52 0.00 0.00 55.73 54.80 2aeg s ARG 236 Cb -0.02 -2.15 -0.04 0.00 0.52 0.00 0.00 34.95 33.26 2aeg s ARG 236 CO -0.01 -0.50 -0.20 -1.21 0.02 0.00 0.00 175.30 173.41 2aeg s GLU 237 N 1.61 1.44 1.01 3.54 2.02 -1.10 -4.98 118.70 122.24 2aeg s GLU 237 Ca -0.01 -1.54 -0.14 0.00 0.02 0.00 0.00 54.97 53.30 2aeg s GLU 237 Cb -0.16 -1.55 0.20 0.00 0.10 0.00 0.00 34.13 32.71 2aeg s GLU 237 CO -0.07 0.31 1.14 -1.25 0.02 0.00 0.00 175.26 175.41 2aeg s PRO 238 N -2.99 0.29 0.22 0.39 0.04 -1.26 -0.93 135.00 130.76 2aeg s PRO 238 Ca 0.21 0.17 -0.30 0.00 0.04 0.00 0.00 61.00 61.11 2aeg s PRO 238 Cb -0.06 -1.75 -0.10 0.00 0.04 0.00 0.00 34.50 32.64 2aeg s PRO 238 CO 0.09 -2.75 1.39 -0.47 0.04 0.00 0.00 177.00 175.31 2aeg s TYR 239 N -3.21 3.12 0.00 0.56 6.14 -1.25 -2.74 117.35 119.97 2aeg s TYR 239 Ca 0.67 1.09 0.00 0.00 0.64 0.00 0.00 57.07 59.47 2aeg s TYR 239 Cb -0.13 -3.74 0.00 0.00 0.42 0.00 0.00 41.96 38.51 2aeg s TYR 239 CO 0.55 -2.38 0.00 0.41 0.64 0.00 0.00 175.55 174.77 2aeg n GLY 240 N 2.34 3.45 3.67 8.97 0.00 -1.26 -5.03 105.19 117.32 2aeg n GLY 240 Ca 0.07 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.60 2aeg n GLY 240 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2aeg n SER 241 N 0.00 2.95 -4.08 1.61 2.88 -1.11 -4.96 113.62 110.91 2aeg n SER 241 Ca 0.00 1.05 -0.11 0.00 -1.33 0.00 0.00 58.87 58.47 2aeg n SER 241 Cb 0.00 -1.35 -0.11 0.00 -0.75 0.00 0.00 64.21 62.01 2aeg n SER 241 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2aeg s SER 242 N 2.24 0.82 0.00 -3.46 0.15 -1.26 -5.03 113.70 107.17 2aeg s SER 242 Ca 0.86 -0.70 0.20 0.00 0.70 0.00 0.00 55.95 57.02 2aeg s SER 242 Cb -0.76 0.07 0.53 0.00 -1.71 0.00 0.00 66.02 64.16 2aeg s SER 242 CO 0.47 -0.32 1.45 2.30 1.20 0.00 0.00 173.24 178.34 2aeg n ILE 243 N 0.96 0.66 -0.90 6.45 -5.35 -1.26 -5.18 119.36 114.74 2aeg n ILE 243 Ca -0.19 -0.75 0.00 0.00 -0.27 0.00 0.00 62.75 61.54 2aeg n ILE 243 Cb 0.57 0.57 0.00 0.00 -1.74 0.00 0.00 39.64 39.04 2aeg n ILE 243 CO 0.00 0.00 0.00 0.55 -1.76 0.00 0.00 176.55 175.34