#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bea s LEU 7 N 0.00 4.28 -0.08 0.64 1.43 0.63 -4.81 118.68 120.77 2bea s LEU 7 Ca 0.00 1.83 0.02 0.00 -1.03 0.00 0.00 54.13 54.95 2bea s LEU 7 Cb 0.00 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.64 2bea s LEU 7 CO 0.00 -0.58 -0.14 -0.69 0.23 0.00 0.00 176.35 175.17 2bea s VAL 8 N 2.16 3.04 0.72 -1.59 1.01 -1.26 0.64 120.40 125.12 2bea s VAL 8 Ca 0.56 -0.70 -0.12 0.00 0.00 0.00 0.00 61.98 61.72 2bea s VAL 8 Cb -0.25 -2.23 0.17 0.00 0.00 0.00 0.00 36.38 34.08 2bea s VAL 8 CO 0.22 0.56 0.75 -0.90 0.00 0.00 0.00 175.10 175.74 2bea n ASP 9 N 2.81 -1.01 0.10 3.32 3.85 0.14 -4.78 116.55 120.99 2bea n ASP 9 Ca -0.18 -1.07 -0.01 0.00 -0.71 0.00 0.00 54.79 52.83 2bea n ASP 9 Cb 0.52 -0.64 0.28 0.00 -1.35 0.00 0.00 41.12 39.93 2bea n ASP 9 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2bea h ALA 10 N -2.24 1.24 0.00 2.12 0.00 -0.78 -2.90 119.26 116.70 2bea h ALA 10 Ca -0.27 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.29 2bea h ALA 10 Cb 0.78 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2bea h ALA 10 CO 0.18 0.52 -0.05 0.93 0.00 0.00 0.00 179.25 180.82 2bea h GLU 11 N 0.20 0.00 0.00 0.00 5.08 -1.93 -3.46 114.58 114.47 2bea h GLU 11 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2bea h GLU 11 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2bea h GLU 11 CO 0.05 0.05 0.00 0.41 -1.00 0.00 0.00 179.01 178.52 2bea n GLY 12 N -0.08 1.07 3.86 -3.84 0.00 -1.09 -5.10 105.19 100.00 2bea n GLY 12 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2bea n GLY 12 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bea s ASN 13 N -1.84 6.72 0.58 1.61 0.01 -1.26 -4.80 114.94 115.96 2bea s ASN 13 Ca 0.00 1.14 -0.19 0.00 -0.71 0.00 0.00 52.86 53.10 2bea s ASN 13 Cb 0.00 -2.32 -0.04 0.00 0.41 0.00 0.00 41.25 39.31 2bea s ASN 13 CO 0.00 -0.14 1.23 -0.76 -1.51 0.00 0.00 177.10 175.92 2bea s LEU 14 N -2.87 3.71 0.09 0.60 1.43 -1.26 0.25 118.68 120.63 2bea s LEU 14 Ca 0.51 2.45 -0.31 0.00 -1.03 0.00 0.00 54.13 55.76 2bea s LEU 14 Cb -0.11 -4.53 -0.06 0.00 0.03 0.00 0.00 46.19 41.52 2bea s LEU 14 CO 0.19 -1.57 1.23 -0.69 0.23 0.00 0.00 176.35 175.74 2bea s VAL 15 N -1.53 3.83 -0.02 -1.59 1.01 0.21 -4.64 120.40 117.67 2bea s VAL 15 Ca 0.76 1.35 -0.30 0.00 0.00 0.00 0.00 61.98 63.79 2bea s VAL 15 Cb -0.32 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 2bea s VAL 15 CO 0.36 0.12 1.09 -0.70 0.00 0.00 0.00 175.10 175.97 2bea s GLU 16 N 0.84 4.45 0.02 2.72 2.56 -1.26 -3.84 118.70 124.19 2bea s GLU 16 Ca 0.59 1.56 -0.30 0.00 0.00 0.00 0.00 54.97 56.81 2bea s GLU 16 Cb -0.31 -3.48 -0.07 0.00 2.00 0.00 0.00 34.13 32.28 2bea s GLU 16 CO 0.31 -0.25 1.57 0.20 -0.56 0.00 0.00 175.26 176.52 2bea s GLY 17 N 1.15 1.65 0.00 -1.50 0.00 0.25 -1.10 107.32 107.77 2bea s GLY 17 Ca 0.54 1.03 0.00 0.00 0.00 0.00 0.00 44.72 46.29 2bea s GLY 17 CO 0.25 2.80 0.00 0.61 0.00 0.00 0.00 173.10 176.75 2bea n GLY 18 N 3.91 1.16 3.78 0.20 0.00 0.14 -4.88 105.19 109.49 2bea n GLY 18 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 2bea n GLY 18 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bea s GLY 19 N -1.75 1.67 -0.17 -0.02 0.00 -0.26 -4.61 107.32 102.19 2bea s GLY 19 Ca 0.00 0.17 -0.08 0.00 0.00 0.00 0.00 44.72 44.81 2bea s GLY 19 CO 0.00 0.52 0.11 -0.51 0.00 0.00 0.00 173.10 173.22 2bea s THR 20 N -2.95 5.24 0.03 0.90 -4.23 -1.26 -2.23 115.64 111.14 2bea s THR 20 Ca 0.61 0.12 -0.03 0.00 -1.18 0.00 0.00 61.69 61.21 2bea s THR 20 Cb -0.16 -3.34 -0.02 0.00 1.34 0.00 0.00 72.50 70.32 2bea s THR 20 CO 0.56 0.51 0.04 -0.31 -0.54 0.00 0.00 174.62 174.87 2bea s TYR 21 N -0.13 0.25 -0.13 3.99 1.51 0.60 -0.47 117.35 122.97 2bea s TYR 21 Ca 0.09 -0.55 -0.17 0.00 -1.01 0.00 0.00 57.07 55.44 2bea s TYR 21 Cb -0.12 -0.19 -0.04 0.00 -0.11 0.00 0.00 41.96 41.50 2bea s TYR 21 CO 0.00 -0.29 0.41 0.71 -1.11 0.00 0.00 175.55 175.27 2bea s TYR 22 N -2.22 3.51 -0.79 2.71 1.51 0.13 -0.52 117.35 121.67 2bea s TYR 22 Ca -0.09 0.80 -0.18 0.00 -1.01 0.00 0.00 57.07 56.60 2bea s TYR 22 Cb -0.04 -2.47 0.15 0.00 -0.11 0.00 0.00 41.96 39.49 2bea s TYR 22 CO -0.03 0.22 0.89 -0.51 -1.11 0.00 0.00 175.55 175.00 2bea s LEU 23 N 0.48 5.63 0.22 -1.29 1.02 -1.26 -1.42 118.68 122.05 2bea s LEU 23 Ca 0.23 -2.01 -0.05 0.00 0.02 0.00 0.00 54.13 52.32 2bea s LEU 23 Cb -0.14 -2.32 -0.05 0.00 0.02 0.00 0.00 46.19 43.70 2bea s LEU 23 CO 0.08 -0.95 0.47 -0.76 0.02 0.00 0.00 176.35 175.21 2bea s LEU 24 N 2.00 4.17 0.83 1.79 1.43 -0.14 -3.59 118.68 125.17 2bea s LEU 24 Ca 0.22 0.64 -0.12 0.00 -1.03 0.00 0.00 54.13 53.83 2bea s LEU 24 Cb -0.13 -3.41 0.09 0.00 0.03 0.00 0.00 46.19 42.77 2bea s LEU 24 CO -0.04 -0.07 1.14 -2.16 0.23 0.00 0.00 176.35 175.45 2bea s PRO 25 N -3.14 1.79 -0.15 1.29 0.04 -1.26 -0.13 135.00 133.44 2bea s PRO 25 Ca 0.42 0.29 -0.27 0.00 0.04 0.00 0.00 61.00 61.48 2bea s PRO 25 Cb -0.11 -1.91 -0.25 0.00 0.04 0.00 0.00 34.50 32.26 2bea s PRO 25 CO 0.27 -1.75 0.68 1.25 0.04 0.00 0.00 177.00 177.49 2bea h HIS 26 N -1.17 0.04 -3.49 0.56 -0.00 -1.79 -3.40 115.15 105.89 2bea h HIS 26 Ca -0.48 -0.03 -0.70 0.00 -0.00 0.00 0.00 60.37 59.17 2bea h HIS 26 Cb 1.31 -0.00 -0.34 0.00 -0.00 0.00 0.00 27.41 28.38 2bea h HIS 26 CO 0.35 1.11 -0.54 0.42 -0.00 0.00 0.00 177.93 179.26 2bea s ILE 27 N -2.26 3.37 -2.00 6.26 1.01 -1.26 -4.96 121.20 121.36 2bea s ILE 27 Ca -0.20 -1.97 0.19 0.00 0.00 0.00 0.00 60.65 58.66 2bea s ILE 27 Cb -0.01 -3.27 0.53 0.00 0.01 0.00 0.00 42.46 39.72 2bea s ILE 27 CO 0.68 -0.66 1.53 -2.67 0.00 0.00 0.00 174.94 173.83 2bea n TRP 28 N 4.63 0.00 0.21 3.97 4.27 -1.26 -3.03 117.44 126.22 2bea n TRP 28 Ca -0.03 0.00 0.09 0.00 -3.89 0.00 0.00 57.50 53.66 2bea n TRP 28 Cb 0.41 0.00 0.38 0.00 -1.36 0.00 0.00 31.31 30.74 2bea n TRP 28 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2bea h ALA 29 N 3.21 0.97 0.00 -1.67 0.00 -1.94 -2.59 119.26 117.24 2bea h ALA 29 Ca 0.00 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 2bea h ALA 29 Cb 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2bea h ALA 29 CO 0.00 0.33 -0.67 0.45 0.00 0.00 0.00 179.25 179.36 2bea h HIS 30 N 0.00 0.00 0.00 0.00 3.86 -1.97 -3.49 115.15 113.55 2bea h HIS 30 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2bea h HIS 30 Cb 0.85 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.32 2bea h HIS 30 CO 0.00 0.67 0.00 0.41 0.86 0.00 0.00 177.93 179.87 2bea n GLY 31 N 0.77 -1.99 0.00 2.45 0.00 -0.98 -4.96 105.19 100.49 2bea n GLY 31 Ca -0.00 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.79 2bea n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bea n GLY 32 N -0.40 3.12 3.77 -0.02 0.00 -0.78 -4.43 105.19 106.45 2bea n GLY 32 Ca 0.00 -1.74 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 2bea n GLY 32 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bea s GLY 33 N 0.00 1.61 0.04 -0.02 0.00 -0.83 -4.32 107.32 103.79 2bea s GLY 33 Ca 0.00 -0.24 -0.30 0.00 0.00 0.00 0.00 44.72 44.18 2bea s GLY 33 CO 0.00 0.24 1.15 -0.42 0.00 0.00 0.00 173.10 174.07 2bea s ILE 34 N -3.11 4.24 0.04 0.90 -1.09 -1.24 -1.06 121.20 119.88 2bea s ILE 34 Ca 0.62 1.60 0.01 0.00 -2.23 0.00 0.00 60.65 60.65 2bea s ILE 34 Cb -0.16 -4.03 -0.00 0.00 -1.58 0.00 0.00 42.46 36.69 2bea s ILE 34 CO 0.55 0.12 0.03 -1.84 -1.23 0.00 0.00 174.94 172.57 2bea n GLU 35 N 4.01 0.05 -3.99 2.79 0.28 -0.03 0.66 120.64 124.40 2bea n GLU 35 Ca 0.08 -0.34 -0.23 0.00 -0.16 0.00 0.00 57.16 56.52 2bea n GLU 35 Cb 0.47 0.29 -0.06 0.00 1.43 0.00 0.00 31.44 33.58 2bea n GLU 35 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2bea s THR 36 N -2.20 3.00 -0.26 3.84 -4.23 -1.26 -1.90 115.64 112.62 2bea s THR 36 Ca 0.04 -1.59 -0.25 0.00 -1.18 0.00 0.00 61.69 58.70 2bea s THR 36 Cb 0.00 -3.02 0.09 0.00 1.34 0.00 0.00 72.50 70.91 2bea s THR 36 CO 0.03 -0.14 0.86 0.00 -0.54 0.00 0.00 174.62 174.83 2bea s ALA 37 N -2.43 -1.86 -0.33 3.99 0.00 -0.56 -4.87 121.76 115.70 2bea s ALA 37 Ca 0.40 1.92 -0.23 0.00 0.00 0.00 0.00 51.96 54.05 2bea s ALA 37 Cb -0.02 -1.22 0.00 0.00 0.00 0.00 0.00 23.12 21.88 2bea s ALA 37 CO 0.24 -0.30 0.78 -1.59 0.00 0.00 0.00 175.76 174.89 2bea s LYS 38 N 0.20 3.87 0.17 0.00 -2.85 -1.26 -1.29 119.74 118.58 2bea s LYS 38 Ca 0.01 0.46 0.09 0.00 -1.00 0.00 0.00 55.97 55.53 2bea s LYS 38 Cb -0.05 -3.76 -0.04 0.00 -2.06 0.00 0.00 37.83 31.92 2bea s LYS 38 CO -0.02 -0.75 -0.15 0.95 0.10 0.00 0.00 175.35 175.49 2bea s THR 39 N 3.00 2.90 0.00 3.79 -4.23 -1.26 -4.98 115.64 114.86 2bea s THR 39 Ca 0.32 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 59.12 2bea s THR 39 Cb -0.14 -2.40 0.00 0.00 1.34 0.00 0.00 72.50 71.30 2bea s THR 39 CO 0.14 -0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 2bea n GLY 40 N 0.29 4.03 2.40 3.99 0.00 -1.26 -2.82 105.19 111.83 2bea n GLY 40 Ca -0.12 0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 2bea n GLY 40 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bea n ASN 41 N 7.19 6.66 -4.59 1.61 5.03 -1.26 -4.95 115.26 124.95 2bea n ASN 41 Ca 0.00 -3.78 -0.38 0.00 0.87 0.00 0.00 54.58 51.29 2bea n ASN 41 Cb 0.00 -0.78 -0.11 0.00 -1.02 0.00 0.00 39.78 37.87 2bea n ASN 41 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2bea s GLU 42 N -3.79 3.94 0.59 3.52 2.02 -1.13 -5.00 118.70 118.85 2bea s GLU 42 Ca 0.57 -0.29 0.30 0.00 0.02 0.00 0.00 54.97 55.56 2bea s GLU 42 Cb 0.46 -3.67 1.81 0.00 0.10 0.00 0.00 34.13 32.84 2bea s GLU 42 CO -0.11 -0.20 2.24 -1.00 0.02 0.00 0.00 175.26 176.21 2bea h PRO 43 N 8.35 0.00 -4.91 0.39 0.13 -1.92 -3.44 132.00 130.61 2bea h PRO 43 Ca -0.35 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.31 2bea h PRO 43 Cb 1.19 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.18 2bea h PRO 43 CO 0.56 0.00 -0.49 0.00 -0.23 0.00 0.00 178.00 177.84 2bea s PRO 45 N -3.48 4.05 0.00 0.00 0.02 -1.26 -4.52 135.00 129.81 2bea s PRO 45 Ca 0.39 1.40 0.00 0.00 0.02 0.00 0.00 61.00 62.82 2bea s PRO 45 Cb 0.02 -3.82 0.00 0.00 0.02 0.00 0.00 34.50 30.72 2bea s PRO 45 CO 0.26 -0.94 0.47 1.28 -0.33 0.00 0.00 177.00 177.75 2bea n LEU 46 N 7.16 0.79 -4.59 -5.54 4.77 -1.17 -4.72 117.00 113.71 2bea n LEU 46 Ca 0.14 -0.79 -0.35 0.00 -0.03 0.00 0.00 56.01 54.98 2bea n LEU 46 Cb 0.46 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.44 2bea n LEU 46 CO 0.60 0.20 -0.25 -0.89 -1.33 0.00 0.00 177.39 175.71 2bea s THR 47 N -0.21 4.73 -0.40 -5.08 2.01 -0.41 -1.36 115.64 114.91 2bea s THR 47 Ca 0.00 -0.05 -0.26 0.00 0.31 0.00 0.00 61.69 61.69 2bea s THR 47 Cb 0.00 -3.16 0.02 0.00 0.01 0.00 0.00 72.50 69.37 2bea s THR 47 CO 0.00 0.42 0.97 -0.69 -0.69 0.00 0.00 174.62 174.62 2bea s VAL 48 N 0.75 4.50 0.35 3.82 1.01 -0.99 -1.50 120.40 128.34 2bea s VAL 48 Ca 0.04 1.13 0.04 0.00 0.00 0.00 0.00 61.98 63.19 2bea s VAL 48 Cb -0.13 -4.40 -0.03 0.00 0.00 0.00 0.00 36.38 31.81 2bea s VAL 48 CO 0.02 -0.67 0.15 0.68 0.00 0.00 0.00 175.10 175.28 2bea s VAL 49 N 3.70 0.48 -0.15 2.92 -7.23 -0.80 -0.57 120.40 118.75 2bea s VAL 49 Ca 0.40 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.50 2bea s VAL 49 Cb -0.11 -2.47 -0.04 0.00 0.56 0.00 0.00 36.38 34.32 2bea s VAL 49 CO 0.22 0.00 0.11 -0.60 -0.31 0.00 0.00 175.10 174.52 2bea s ARG 50 N -3.75 3.66 0.44 4.82 3.52 -1.05 -0.85 118.95 125.73 2bea s ARG 50 Ca 0.32 -0.22 -0.26 0.00 -0.13 0.00 0.00 55.73 55.44 2bea s ARG 50 Cb 0.04 -3.20 -0.09 0.00 -1.56 0.00 0.00 34.95 30.15 2bea s ARG 50 CO 0.17 0.57 1.44 0.45 -0.81 0.00 0.00 175.30 177.11 2bea s SER 51 N -0.44 5.93 0.41 -2.12 0.15 -0.22 -4.45 113.70 112.96 2bea s SER 51 Ca 0.11 2.94 0.26 0.00 0.70 0.00 0.00 55.95 59.96 2bea s SER 51 Cb -0.12 -2.66 0.66 0.00 -1.71 0.00 0.00 66.02 62.19 2bea s SER 51 CO 0.02 -1.14 1.72 1.55 1.20 0.00 0.00 173.24 176.58 2bea h PRO 52 N 2.41 0.00 -6.16 5.44 0.13 -1.93 -2.06 132.00 129.82 2bea h PRO 52 Ca -0.51 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.05 2bea h PRO 52 Cb 1.26 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.34 2bea h PRO 52 CO 0.61 0.00 0.63 1.21 -0.23 0.00 0.00 178.00 180.22 2bea s ASN 53 N -5.68 7.16 0.40 1.44 3.84 -1.26 -4.78 114.94 116.06 2bea s ASN 53 Ca 0.06 1.44 0.21 0.00 0.21 0.00 0.00 52.86 54.79 2bea s ASN 53 Cb 0.07 -2.54 0.73 0.00 -0.55 0.00 0.00 41.25 38.97 2bea s ASN 53 CO 0.62 -0.52 1.75 -0.33 -2.79 0.00 0.00 177.10 175.83 2bea h GLU 54 N 7.25 0.00 0.00 0.43 5.08 -1.85 -3.08 114.58 122.41 2bea h GLU 54 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2bea h GLU 54 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2bea h GLU 54 CO 0.90 0.30 -0.87 1.55 -1.00 0.00 0.00 179.01 179.89 2bea n VAL 55 N -3.42 0.38 -2.52 3.13 3.14 -1.26 -4.55 118.33 113.24 2bea n VAL 55 Ca 0.00 -0.35 -0.41 0.00 -2.96 0.00 0.00 64.34 60.62 2bea n VAL 55 Cb 0.49 -0.10 -0.04 0.00 -1.06 0.00 0.00 33.84 33.13 2bea n VAL 55 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2bea s SER 56 N -4.49 7.27 0.10 6.55 0.15 -1.23 -4.96 113.70 117.09 2bea s SER 56 Ca 0.03 2.10 0.25 0.00 0.70 0.00 0.00 55.95 59.03 2bea s SER 56 Cb 0.12 -2.61 0.46 0.00 -1.71 0.00 0.00 66.02 62.29 2bea s SER 56 CO 0.77 -0.21 1.40 0.29 1.20 0.00 0.00 173.24 176.69 2bea n LYS 57 N 2.27 0.22 0.00 5.44 5.02 -1.26 -1.97 118.16 127.88 2bea n LYS 57 Ca 0.02 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 2bea n LYS 57 Cb 0.46 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 2bea n LYS 57 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bea n GLY 58 N 1.37 -1.63 3.85 0.72 0.00 -1.26 -3.76 105.19 104.49 2bea n GLY 58 Ca 0.04 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 44.19 2bea n GLY 58 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bea s GLU 59 N 0.00 3.91 -0.11 1.61 0.41 0.21 -4.90 118.70 119.83 2bea s GLU 59 Ca 0.00 0.40 -0.30 0.00 -0.41 0.00 0.00 54.97 54.66 2bea s GLU 59 Cb 0.00 -2.92 -0.02 0.00 -1.78 0.00 0.00 34.13 29.41 2bea s GLU 59 CO 0.00 0.48 1.18 -1.25 -0.49 0.00 0.00 175.26 175.18 2bea s PRO 60 N -2.03 4.31 -0.02 0.39 0.04 -1.26 -4.62 135.00 131.81 2bea s PRO 60 Ca 0.38 1.60 -0.03 0.00 0.04 0.00 0.00 61.00 62.99 2bea s PRO 60 Cb -0.14 -3.63 -0.04 0.00 0.04 0.00 0.00 34.50 30.73 2bea s PRO 60 CO 0.19 -0.53 0.15 0.42 0.04 0.00 0.00 177.00 177.27 2bea s ILE 61 N 2.69 5.25 -0.24 0.56 -1.09 0.32 -1.66 121.20 127.03 2bea s ILE 61 Ca 0.53 -0.18 -0.14 0.00 -2.23 0.00 0.00 60.65 58.63 2bea s ILE 61 Cb -0.22 -3.42 -0.04 0.00 -1.58 0.00 0.00 42.46 37.20 2bea s ILE 61 CO 0.17 0.37 0.31 -0.60 -1.23 0.00 0.00 174.94 173.96 2bea s ARG 62 N -1.78 4.07 -0.22 2.79 3.52 0.44 -0.29 118.95 127.49 2bea s ARG 62 Ca 0.25 -0.03 -0.05 0.00 -0.13 0.00 0.00 55.73 55.77 2bea s ARG 62 Cb -0.12 -3.59 -0.02 0.00 -1.56 0.00 0.00 34.95 29.66 2bea s ARG 62 CO 0.16 -0.11 0.00 0.42 -0.81 0.00 0.00 175.30 174.97 2bea s ILE 63 N 1.54 3.88 0.37 4.11 1.01 -0.95 -1.64 121.20 129.52 2bea s ILE 63 Ca 0.13 -0.33 0.05 0.00 0.00 0.00 0.00 60.65 60.51 2bea s ILE 63 Cb -0.15 -2.77 -0.03 0.00 0.01 0.00 0.00 42.46 39.52 2bea s ILE 63 CO 0.08 0.41 0.20 -0.44 0.00 0.00 0.00 174.94 175.19 2bea s SER 64 N 1.26 2.20 0.32 3.58 0.01 -0.69 0.29 113.70 120.66 2bea s SER 64 Ca 0.04 -1.71 0.03 0.00 1.31 0.00 0.00 55.95 55.62 2bea s SER 64 Cb -0.15 0.54 -0.04 0.00 0.21 0.00 0.00 66.02 66.59 2bea s SER 64 CO 0.01 -1.00 0.16 -0.94 0.41 0.00 0.00 173.24 171.88 2bea s SER 65 N -3.49 1.69 0.42 2.44 1.04 -1.26 -0.81 113.70 113.72 2bea s SER 65 Ca 0.32 -1.57 0.09 0.00 0.48 0.00 0.00 55.95 55.28 2bea s SER 65 Cb 0.02 0.38 0.90 0.00 0.10 0.00 0.00 66.02 67.43 2bea s SER 65 CO 0.21 -0.88 2.02 -0.61 0.98 0.00 0.00 173.24 174.95 2bea h GLN 66 N 2.17 0.34 -0.09 4.02 4.15 -1.97 -3.04 115.11 120.68 2bea h GLN 66 Ca -0.34 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 58.95 2bea h GLN 66 Cb 1.25 -0.07 -0.12 0.00 0.21 0.00 0.00 27.48 28.76 2bea h GLN 66 CO 0.53 0.31 -0.64 1.19 -1.93 0.00 0.00 178.83 178.28 2bea n PHE 67 N -4.41 0.33 -4.17 3.99 3.72 -1.26 -4.99 117.46 110.67 2bea n PHE 67 Ca 0.01 -1.43 -0.29 0.00 -0.05 0.00 0.00 57.45 55.68 2bea n PHE 67 Cb 0.14 -0.24 -0.07 0.00 -0.94 0.00 0.00 39.48 38.37 2bea n PHE 67 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2bea n LEU 68 N -0.80 -1.47 -4.71 4.37 4.77 -1.15 -4.85 117.00 113.16 2bea n LEU 68 Ca 0.19 -1.17 -0.42 0.00 -0.03 0.00 0.00 56.01 54.58 2bea n LEU 68 Cb 0.80 -1.85 -0.03 0.00 -2.33 0.00 0.00 43.42 40.01 2bea n LEU 68 CO 0.01 0.46 1.05 -0.94 -1.33 0.00 0.00 177.39 176.64 2bea s SER 69 N -4.38 6.86 0.28 -1.43 1.04 -1.26 -4.89 113.70 109.91 2bea s SER 69 Ca 0.00 2.26 -0.08 0.00 0.48 0.00 0.00 55.95 58.61 2bea s SER 69 Cb -0.00 -2.58 0.46 0.00 0.10 0.00 0.00 66.02 63.99 2bea s SER 69 CO 0.95 -0.64 1.56 0.25 0.98 0.00 0.00 173.24 176.34 2bea h LEU 70 N 7.05 -0.91 -8.98 2.42 7.12 -1.89 -3.36 115.31 116.75 2bea h LEU 70 Ca -0.41 0.30 -0.68 0.00 0.13 0.00 0.00 57.88 57.21 2bea h LEU 70 Cb 1.21 0.61 -0.22 0.00 -0.53 0.00 0.00 40.66 41.73 2bea h LEU 70 CO 0.86 -0.33 -0.78 -0.36 -0.13 0.00 0.00 178.44 177.71 2bea s PHE 71 N -6.25 2.64 -0.45 1.25 2.99 -1.26 0.84 117.98 117.72 2bea s PHE 71 Ca -0.15 -0.21 -0.12 0.00 0.00 0.00 0.00 56.93 56.45 2bea s PHE 71 Cb 0.27 -1.52 0.08 0.00 0.00 0.00 0.00 43.02 41.85 2bea s PHE 71 CO 0.78 0.25 0.34 0.42 -0.00 0.00 0.00 175.22 177.01 2bea s ILE 72 N -0.89 4.70 1.04 0.64 1.01 -1.25 -4.88 121.20 121.57 2bea s ILE 72 Ca 0.14 -1.31 -0.15 0.00 0.00 0.00 0.00 60.65 59.33 2bea s ILE 72 Cb -0.11 -3.88 0.08 0.00 0.01 0.00 0.00 42.46 38.57 2bea s ILE 72 CO 0.04 -0.59 0.28 -2.65 0.00 0.00 0.00 174.94 172.02 2bea n PRO 73 N 5.06 -1.01 0.00 2.79 -0.02 -1.26 -0.27 135.00 140.28 2bea n PRO 73 Ca -0.11 -0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.10 2bea n PRO 73 Cb 0.43 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 2bea n PRO 73 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2bea n ARG 74 N -2.11 0.00 -3.01 -0.52 1.85 -1.26 -3.30 116.66 108.30 2bea n ARG 74 Ca 0.04 0.00 -0.24 0.00 -1.00 0.00 0.00 57.85 56.66 2bea n ARG 74 Cb 0.58 -0.01 -0.03 0.00 -1.05 0.00 0.00 32.46 31.94 2bea n ARG 74 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2bea n GLY 75 N -0.18 4.87 3.90 2.89 0.00 -1.26 -4.73 105.19 110.68 2bea n GLY 75 Ca 0.00 -2.38 -0.34 0.00 0.00 0.00 0.00 46.02 43.30 2bea n GLY 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bea s SER 76 N -3.11 6.39 0.47 1.61 1.04 -1.21 -5.07 113.70 113.83 2bea s SER 76 Ca 0.46 0.39 -0.22 0.00 0.48 0.00 0.00 55.95 57.05 2bea s SER 76 Cb 0.31 -2.02 -0.07 0.00 0.10 0.00 0.00 66.02 64.34 2bea s SER 76 CO -0.12 0.27 1.15 -0.76 0.98 0.00 0.00 173.24 174.75 2bea s LEU 77 N -1.88 3.98 0.24 2.42 1.43 -1.26 -4.63 118.68 118.97 2bea s LEU 77 Ca 0.27 2.25 0.05 0.00 -1.03 0.00 0.00 54.13 55.68 2bea s LEU 77 Cb -0.13 -4.30 -0.05 0.00 0.03 0.00 0.00 46.19 41.74 2bea s LEU 77 CO 0.18 -0.93 -0.05 0.68 0.23 0.00 0.00 176.35 176.46 2bea s VAL 78 N -1.60 1.40 -0.06 -1.59 -7.23 0.14 -4.47 120.40 106.99 2bea s VAL 78 Ca 0.65 -2.10 0.02 0.00 -1.81 0.00 0.00 61.98 58.74 2bea s VAL 78 Cb -0.27 -2.31 -0.03 0.00 0.56 0.00 0.00 36.38 34.33 2bea s VAL 78 CO 0.32 -0.38 -0.11 0.00 -0.31 0.00 0.00 175.10 174.63 2bea s ALA 79 N -3.18 2.82 -0.07 1.32 0.00 0.01 -3.34 121.76 119.31 2bea s ALA 79 Ca 0.27 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.33 2bea s ALA 79 Cb 0.04 -1.10 0.01 0.00 0.00 0.00 0.00 23.12 22.06 2bea s ALA 79 CO 0.09 0.56 -0.17 -0.51 0.00 0.00 0.00 175.76 175.72 2bea s LEU 80 N -0.75 1.85 -0.14 0.00 1.43 -1.26 -1.70 118.68 118.13 2bea s LEU 80 Ca 0.11 -0.40 -0.26 0.00 -1.03 0.00 0.00 54.13 52.55 2bea s LEU 80 Cb -0.11 -1.06 0.06 0.00 0.03 0.00 0.00 46.19 45.11 2bea s LEU 80 CO 0.01 0.10 0.64 -0.83 0.23 0.00 0.00 176.35 176.51 2bea s GLY 81 N 0.42 -0.51 0.46 -3.19 0.00 -0.65 0.77 107.32 104.62 2bea s GLY 81 Ca -0.14 1.49 -0.23 0.00 0.00 0.00 0.00 44.72 45.84 2bea s GLY 81 CO 0.05 1.19 1.19 -1.36 0.00 0.00 0.00 173.10 174.17 2bea s PHE 82 N -0.51 2.82 -0.19 1.90 0.40 -1.10 0.17 117.98 121.46 2bea s PHE 82 Ca -0.06 1.51 0.16 0.00 -0.60 0.00 0.00 56.93 57.94 2bea s PHE 82 Cb -0.02 -3.44 0.07 0.00 0.51 0.00 0.00 43.02 40.13 2bea s PHE 82 CO 0.05 -1.68 1.37 0.00 0.70 0.00 0.00 175.22 175.67 2bea h ALA 83 N 2.04 0.70 -2.65 5.36 0.00 -1.66 -3.37 119.26 119.67 2bea h ALA 83 Ca -0.49 -0.43 -0.60 0.00 0.00 0.00 0.00 54.91 53.38 2bea h ALA 83 Cb 1.25 -0.02 -0.41 0.00 0.00 0.00 0.00 17.79 18.61 2bea h ALA 83 CO 0.60 0.57 -0.69 0.09 0.00 0.00 0.00 179.25 179.81 2bea n ASN 84 N -3.15 2.35 -4.83 0.00 4.13 -1.26 -5.11 115.26 107.39 2bea n ASN 84 Ca 0.01 -3.08 -0.33 0.00 1.68 0.00 0.00 54.58 52.86 2bea n ASN 84 Cb 0.72 -0.69 -0.05 0.00 -1.54 0.00 0.00 39.78 38.22 2bea n ASN 84 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 2bea s PRO 85 N -1.43 4.03 0.79 3.52 0.04 -1.26 -5.05 135.00 135.64 2bea s PRO 85 Ca 0.31 1.05 -0.13 0.00 0.04 0.00 0.00 61.00 62.27 2bea s PRO 85 Cb 0.04 -2.15 0.07 0.00 0.04 0.00 0.00 34.50 32.50 2bea s PRO 85 CO -0.13 -0.21 1.17 -2.14 0.04 0.00 0.00 177.00 175.73 2bea s PRO 86 N -3.69 1.82 0.10 0.56 0.02 -1.26 -4.97 135.00 127.59 2bea s PRO 86 Ca 0.61 1.60 -0.34 0.00 0.02 0.00 0.00 61.00 62.89 2bea s PRO 86 Cb -0.10 -1.81 -0.14 0.00 0.02 0.00 0.00 34.50 32.47 2bea s PRO 86 CO 0.24 -2.04 1.57 0.66 -0.33 0.00 0.00 177.00 177.09 2bea h SER 87 N -0.89 -1.49 -0.90 2.53 4.64 -1.97 -3.02 113.55 112.46 2bea h SER 87 Ca -0.46 0.15 0.19 0.00 -0.47 0.00 0.00 61.79 61.21 2bea h SER 87 Cb 1.28 0.54 -0.07 0.00 -0.31 0.00 0.00 62.40 63.84 2bea h SER 87 CO 0.47 -0.56 0.59 0.00 -0.87 0.00 0.00 176.83 176.46 2bea s ALA 89 N -5.46 3.74 -2.24 0.00 0.00 -1.14 -4.50 121.76 112.15 2bea s ALA 89 Ca -0.08 1.40 0.28 0.00 0.00 0.00 0.00 51.96 53.56 2bea s ALA 89 Cb 0.23 -3.61 1.14 0.00 0.00 0.00 0.00 23.12 20.87 2bea s ALA 89 CO 0.78 -0.80 1.79 0.00 0.00 0.00 0.00 175.76 177.53 2bea n ALA 90 N 3.23 2.68 -3.39 0.00 0.00 -0.93 -4.87 120.51 117.24 2bea n ALA 90 Ca 0.11 -0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.01 2bea n ALA 90 Cb 0.39 -1.22 -0.05 0.00 0.00 0.00 0.00 19.45 18.56 2bea n ALA 90 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2bea s SER 91 N -2.12 -0.52 0.09 0.00 0.15 -1.26 -4.81 113.70 105.22 2bea s SER 91 Ca 0.36 0.29 0.24 0.00 0.70 0.00 0.00 55.95 57.54 2bea s SER 91 Cb 0.21 0.52 0.23 0.00 -1.71 0.00 0.00 66.02 65.27 2bea s SER 91 CO 0.38 -0.73 1.20 -0.81 1.20 0.00 0.00 173.24 174.48 2bea n PRO 92 N 0.40 0.29 -1.99 5.44 -0.04 -1.26 -4.67 135.00 133.17 2bea n PRO 92 Ca -0.18 0.05 -0.42 0.00 -0.04 0.00 0.00 63.50 62.91 2bea n PRO 92 Cb 0.60 -1.65 -0.03 0.00 -0.04 0.00 0.00 33.50 32.39 2bea n PRO 92 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2bea s TRP 93 N -3.18 3.05 0.71 0.54 0.52 -1.26 -2.69 118.94 116.62 2bea s TRP 93 Ca 0.05 0.89 -0.12 0.00 0.02 0.00 0.00 56.10 56.94 2bea s TRP 93 Cb 0.14 -3.85 0.02 0.00 -1.15 0.00 0.00 33.47 28.63 2bea s TRP 93 CO 0.75 -2.91 1.09 -1.58 0.02 0.00 0.00 176.95 174.32 2bea s TRP 94 N 0.45 2.74 0.10 -1.98 0.51 0.23 -4.70 118.94 116.29 2bea s TRP 94 Ca 0.63 1.52 -0.17 0.00 -2.12 0.00 0.00 56.10 55.97 2bea s TRP 94 Cb -0.42 -3.04 0.04 0.00 -0.81 0.00 0.00 33.47 29.23 2bea s TRP 94 CO 0.38 -1.58 0.42 -0.08 -0.51 0.00 0.00 176.95 175.58 2bea s THR 95 N -2.73 0.06 -0.32 2.01 -1.32 -0.13 -4.59 115.64 108.62 2bea s THR 95 Ca 0.62 -0.51 -0.10 0.00 -1.21 0.00 0.00 61.69 60.50 2bea s THR 95 Cb -0.17 -1.10 0.00 0.00 -1.51 0.00 0.00 72.50 69.72 2bea s THR 95 CO 0.50 -0.28 0.17 -0.69 -2.21 0.00 0.00 174.62 172.10 2bea s VAL 96 N -3.43 4.61 -0.18 5.08 1.01 -1.26 -0.11 120.40 126.13 2bea s VAL 96 Ca 0.01 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.47 2bea s VAL 96 Cb 0.01 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 33.00 2bea s VAL 96 CO -0.09 -0.00 -0.16 -0.69 0.00 0.00 0.00 175.10 174.15 2bea s VAL 97 N 1.60 2.42 0.61 2.92 1.01 0.50 -4.88 120.40 124.59 2bea s VAL 97 Ca 0.04 -0.83 -0.19 0.00 0.00 0.00 0.00 61.98 61.01 2bea s VAL 97 Cb -0.18 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 2bea s VAL 97 CO 0.06 0.51 1.18 -0.67 0.00 0.00 0.00 175.10 176.19 2bea n ASP 98 N 4.51 1.68 -3.12 3.32 -0.08 -1.26 -1.07 116.55 120.52 2bea n ASP 98 Ca -0.20 0.85 -0.12 0.00 -1.51 0.00 0.00 54.79 53.81 2bea n ASP 98 Cb 0.51 -1.50 -0.01 0.00 2.34 0.00 0.00 41.12 42.46 2bea n ASP 98 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2bea s SER 99 N -1.24 0.53 0.54 1.67 1.04 -0.74 -4.78 113.70 110.71 2bea s SER 99 Ca 0.78 -1.33 0.30 0.00 0.48 0.00 0.00 55.95 56.18 2bea s SER 99 Cb -0.40 0.74 1.54 0.00 0.10 0.00 0.00 66.02 68.00 2bea s SER 99 CO 0.44 -1.46 2.09 -0.65 0.98 0.00 0.00 173.24 174.64 2bea h PRO 100 N 2.06 0.00 -0.59 4.02 0.11 -2.03 -1.05 132.00 134.52 2bea h PRO 100 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2bea h PRO 100 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2bea h PRO 100 CO 0.39 0.09 0.00 1.04 -0.21 0.00 0.00 178.00 179.31 2bea n GLN 101 N -3.50 2.70 0.00 1.05 6.02 -1.26 -5.05 117.38 117.35 2bea n GLN 101 Ca -0.02 -2.09 0.00 0.00 -0.01 0.00 0.00 57.00 54.89 2bea n GLN 101 Cb 0.23 -1.60 0.00 0.00 1.02 0.00 0.00 30.24 29.90 2bea n GLN 101 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2bea n GLY 102 N 1.15 -4.10 3.61 1.08 0.00 -0.40 -4.78 105.19 101.74 2bea n GLY 102 Ca 0.19 -2.08 -0.43 0.00 0.00 0.00 0.00 46.02 43.70 2bea n GLY 102 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2bea s PRO 103 N -0.93 3.21 -0.09 1.61 0.02 -1.26 -1.80 135.00 135.76 2bea s PRO 103 Ca 0.00 2.08 -0.04 0.00 0.02 0.00 0.00 61.00 63.06 2bea s PRO 103 Cb 0.00 -4.36 -0.04 0.00 0.02 0.00 0.00 34.50 30.13 2bea s PRO 103 CO 0.00 -2.01 0.05 0.00 -0.33 0.00 0.00 177.00 174.71 2bea s ALA 104 N 7.99 3.51 -0.35 -1.55 0.00 -0.24 -1.42 121.76 129.71 2bea s ALA 104 Ca 1.00 -0.75 -0.27 0.00 0.00 0.00 0.00 51.96 51.93 2bea s ALA 104 Cb -0.34 -1.66 0.02 0.00 0.00 0.00 0.00 23.12 21.14 2bea s ALA 104 CO 0.36 0.60 1.00 0.08 0.00 0.00 0.00 175.76 177.80 2bea s VAL 105 N -0.95 4.54 0.32 0.00 1.01 -0.36 -0.37 120.40 124.59 2bea s VAL 105 Ca 0.14 1.46 0.04 0.00 0.00 0.00 0.00 61.98 63.62 2bea s VAL 105 Cb -0.12 -4.38 -0.04 0.00 0.00 0.00 0.00 36.38 31.85 2bea s VAL 105 CO 0.03 -0.52 0.17 -0.54 0.00 0.00 0.00 175.10 174.25 2bea s LYS 106 N 3.58 1.64 0.00 2.72 -0.14 0.85 -2.35 119.74 126.04 2bea s LYS 106 Ca 0.42 -1.94 0.00 0.00 -1.36 0.00 0.00 55.97 53.08 2bea s LYS 106 Cb -0.12 -0.09 0.00 0.00 -1.68 0.00 0.00 37.83 35.94 2bea s LYS 106 CO 0.17 -0.48 0.00 1.28 -0.76 0.00 0.00 175.35 175.57 2bea n LEU 107 N -0.61 0.00 -3.57 3.17 4.77 -0.47 -0.95 117.00 119.34 2bea n LEU 107 Ca 0.01 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.85 2bea n LEU 107 Cb 0.65 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.67 2bea n LEU 107 CO 0.34 0.00 0.53 -0.55 -1.33 0.00 0.00 177.39 176.38 2bea s SER 108 N -1.00 -0.61 0.37 -1.43 0.15 -1.26 -4.82 113.70 105.11 2bea s SER 108 Ca 0.00 0.87 0.21 0.00 0.70 0.00 0.00 55.95 57.73 2bea s SER 108 Cb 0.00 0.77 0.24 0.00 -1.71 0.00 0.00 66.02 65.32 2bea s SER 108 CO 0.00 -0.42 1.49 1.56 1.20 0.00 0.00 173.24 177.08 2bea h GLN 109 N 3.57 0.00 -5.96 5.44 4.20 -1.94 -2.48 115.11 117.94 2bea h GLN 109 Ca -0.26 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 57.89 2bea h GLN 109 Cb 1.15 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.85 2bea h GLN 109 CO 0.26 0.09 -0.51 1.14 -0.67 0.00 0.00 178.83 179.14 2bea s GLN 110 N -3.18 2.25 0.50 1.46 0.00 -1.26 -3.54 119.66 115.89 2bea s GLN 110 Ca 0.05 -1.77 -0.22 0.00 -0.00 0.00 0.00 55.36 53.42 2bea s GLN 110 Cb 0.06 -2.03 -0.06 0.00 0.00 0.00 0.00 33.01 30.98 2bea s GLN 110 CO 0.70 -0.06 1.20 0.15 0.00 0.00 0.00 175.29 177.28 2bea s LYS 111 N -3.89 3.53 -0.06 9.60 1.02 -1.26 -4.58 119.74 124.10 2bea s LYS 111 Ca 0.40 1.85 0.03 0.00 0.02 0.00 0.00 55.97 58.27 2bea s LYS 111 Cb 0.02 -2.29 -0.03 0.00 -0.52 0.00 0.00 37.83 35.01 2bea s LYS 111 CO 0.23 -0.76 -0.13 -0.51 -0.92 0.00 0.00 175.35 173.25 2bea s LEU 112 N -3.29 2.80 0.40 3.17 2.01 -1.26 -5.11 118.68 117.40 2bea s LEU 112 Ca 0.67 -0.18 -0.24 0.00 0.01 0.00 0.00 54.13 54.39 2bea s LEU 112 Cb -0.30 -1.58 -0.09 0.00 0.01 0.00 0.00 46.19 44.23 2bea s LEU 112 CO 0.36 0.33 1.06 -2.16 1.01 0.00 0.00 176.35 176.95 2bea s PRO 113 N -0.63 4.14 0.44 1.29 0.04 -1.26 -4.90 135.00 134.12 2bea s PRO 113 Ca 0.09 1.52 0.30 0.00 0.04 0.00 0.00 61.00 62.95 2bea s PRO 113 Cb -0.11 -2.52 1.40 0.00 0.04 0.00 0.00 34.50 33.30 2bea s PRO 113 CO 0.01 -0.17 1.66 1.49 0.04 0.00 0.00 177.00 180.03 2bea h GLU 114 N 2.45 0.12 0.00 4.56 4.81 -2.00 0.49 114.58 125.01 2bea h GLU 114 Ca -0.48 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.73 2bea h GLU 114 Cb 1.22 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.57 2bea h GLU 114 CO 0.62 0.08 -0.03 1.57 -0.73 0.00 0.00 179.01 180.52 2bea h LYS 115 N 0.13 0.00 -0.02 1.92 2.10 -1.91 -1.76 116.57 117.02 2bea h LYS 115 Ca 0.77 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.42 2bea h LYS 115 Cb 2.45 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.78 2bea h LYS 115 CO -0.35 0.03 -0.14 -0.25 -2.00 0.00 0.00 179.45 176.74 2bea n ASP 116 N -3.29 2.43 -0.05 7.07 10.43 0.17 -4.45 116.55 128.86 2bea n ASP 116 Ca -0.02 -1.74 -0.06 0.00 2.57 0.00 0.00 54.79 55.54 2bea n ASP 116 Cb 0.17 0.13 -0.05 0.00 1.84 0.00 0.00 41.12 43.21 2bea n ASP 116 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 2bea n ILE 117 N 0.71 0.56 -1.85 0.53 -6.64 -0.85 -4.43 119.36 107.38 2bea n ILE 117 Ca 0.13 -0.23 -0.42 0.00 -1.77 0.00 0.00 62.75 60.47 2bea n ILE 117 Cb 0.52 -0.84 -0.00 0.00 -1.44 0.00 0.00 39.64 37.88 2bea n ILE 117 CO 0.00 0.00 0.00 0.18 -1.77 0.00 0.00 176.55 174.96 2bea n LEU 118 N -2.72 6.99 0.00 7.28 4.77 -0.72 -4.31 117.00 128.29 2bea n LEU 118 Ca -0.17 -4.30 0.00 0.00 -0.03 0.00 0.00 56.01 51.51 2bea n LEU 118 Cb 0.69 -1.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.18 2bea n LEU 118 CO 0.11 1.28 0.40 1.33 -1.33 0.00 0.00 177.39 179.17 2bea n VAL 119 N 4.45 0.62 -4.22 4.08 0.24 -1.25 -4.86 118.33 117.40 2bea n VAL 119 Ca 0.51 -0.67 -0.29 0.00 -2.04 0.00 0.00 64.34 61.85 2bea n VAL 119 Cb 0.37 0.73 -0.09 0.00 -1.47 0.00 0.00 33.84 33.37 2bea n VAL 119 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2bea s PHE 120 N -0.62 2.77 -0.19 6.34 0.08 -1.21 -0.21 117.98 124.93 2bea s PHE 120 Ca 0.00 -0.15 -0.11 0.00 0.12 0.00 0.00 56.93 56.79 2bea s PHE 120 Cb 0.00 -1.41 0.06 0.00 -0.57 0.00 0.00 43.02 41.10 2bea s PHE 120 CO 0.00 0.46 0.47 0.21 -0.10 0.00 0.00 175.22 176.26 2bea s LYS 121 N -2.44 0.46 0.21 0.44 2.20 -0.90 0.27 119.74 119.98 2bea s LYS 121 Ca 0.23 0.87 -0.25 0.00 -0.36 0.00 0.00 55.97 56.47 2bea s LYS 121 Cb -0.10 0.02 -0.08 0.00 -1.51 0.00 0.00 37.83 36.15 2bea s LYS 121 CO 0.15 -0.15 0.80 -0.06 -0.36 0.00 0.00 175.35 175.73 2bea s PHE 122 N 1.41 3.83 -0.21 4.03 0.08 -1.26 -0.01 117.98 125.85 2bea s PHE 122 Ca -0.09 1.63 -0.01 0.00 0.12 0.00 0.00 56.93 58.58 2bea s PHE 122 Cb -0.08 -2.78 0.06 0.00 -0.57 0.00 0.00 43.02 39.65 2bea s PHE 122 CO -0.14 0.43 -0.01 -2.00 -0.10 0.00 0.00 175.22 173.40 2bea s GLU 123 N -1.46 1.15 0.21 0.44 2.12 -0.12 -4.69 118.70 116.34 2bea s GLU 123 Ca 0.40 -0.66 -0.31 0.00 0.36 0.00 0.00 54.97 54.76 2bea s GLU 123 Cb -0.21 -2.28 -0.15 0.00 0.26 0.00 0.00 34.13 31.74 2bea s GLU 123 CO 0.25 -0.59 1.02 1.17 -0.54 0.00 0.00 175.26 176.57 2bea n LYS 124 N 4.87 1.05 -4.05 4.30 4.81 -1.26 -0.85 118.16 127.03 2bea n LYS 124 Ca -0.11 0.37 -0.32 0.00 -0.87 0.00 0.00 58.31 57.39 2bea n LYS 124 Cb 0.46 -1.76 -0.15 0.00 0.02 0.00 0.00 35.03 33.60 2bea n LYS 124 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2bea s VAL 125 N -0.60 1.99 -0.05 3.15 1.01 -0.67 -4.82 120.40 120.41 2bea s VAL 125 Ca 0.67 -1.38 -0.30 0.00 0.00 0.00 0.00 61.98 60.97 2bea s VAL 125 Cb -0.82 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2bea s VAL 125 CO 0.56 0.07 1.55 -0.44 0.00 0.00 0.00 175.10 176.84 2bea s SER 126 N 1.21 6.73 -0.38 3.32 0.01 -1.26 -4.00 113.70 119.34 2bea s SER 126 Ca -0.05 2.16 0.02 0.00 1.31 0.00 0.00 55.95 59.39 2bea s SER 126 Cb -0.18 -2.54 0.15 0.00 0.21 0.00 0.00 66.02 63.66 2bea s SER 126 CO -0.07 -0.86 0.29 -2.28 0.41 0.00 0.00 173.24 170.73 2bea s HIS 127 N 3.50 0.65 0.00 2.43 5.65 -1.26 -5.08 115.29 121.18 2bea s HIS 127 Ca 0.69 -1.74 0.00 0.00 0.25 0.00 0.00 55.06 54.26 2bea s HIS 127 Cb -0.32 -0.81 0.00 0.00 -1.18 0.00 0.00 32.58 30.27 2bea s HIS 127 CO 0.27 -0.86 0.00 0.43 -0.65 0.00 0.00 174.74 173.93 2bea n SER 128 N 3.61 0.00 0.18 9.88 7.64 -1.26 -2.21 113.62 131.45 2bea n SER 128 Ca 0.18 0.00 0.05 0.00 1.01 0.00 0.00 58.87 60.11 2bea n SER 128 Cb 0.42 0.00 0.28 0.00 -1.01 0.00 0.00 64.21 63.91 2bea n SER 128 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 2bea h ASN 129 N 2.18 0.00 -3.76 6.43 -0.73 -1.99 -3.46 115.58 114.25 2bea h ASN 129 Ca 0.00 0.00 -0.51 0.00 1.87 0.00 0.00 56.30 57.66 2bea h ASN 129 Cb 0.00 0.00 0.02 0.00 0.27 0.00 0.00 38.32 38.61 2bea h ASN 129 CO 0.00 0.41 0.50 0.27 -0.37 0.00 0.00 177.43 178.24 2bea s ILE 130 N -3.50 3.42 -0.88 2.57 -0.00 -0.94 -4.97 121.20 116.90 2bea s ILE 130 Ca 0.01 1.39 -0.25 0.00 -0.00 0.00 0.00 60.65 61.80 2bea s ILE 130 Cb 0.10 -3.89 -0.00 0.00 -0.00 0.00 0.00 42.46 38.68 2bea s ILE 130 CO 0.70 0.32 1.69 -1.00 -0.00 0.00 0.00 174.94 176.64 2bea s HIS 131 N -0.98 2.08 0.13 1.37 3.76 -1.26 -4.18 115.29 116.20 2bea s HIS 131 Ca 0.46 0.09 0.05 0.00 -0.15 0.00 0.00 55.06 55.51 2bea s HIS 131 Cb -0.33 -4.34 -0.04 0.00 1.11 0.00 0.00 32.58 28.99 2bea s HIS 131 CO 0.42 -1.93 0.06 0.08 -0.85 0.00 0.00 174.74 172.52 2bea s VAL 132 N 7.75 4.24 -0.10 -0.90 1.01 -1.26 -4.60 120.40 126.55 2bea s VAL 132 Ca 0.58 -1.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2bea s VAL 132 Cb -0.06 -3.10 0.03 0.00 0.00 0.00 0.00 36.38 33.26 2bea s VAL 132 CO 0.01 0.00 0.25 -0.31 0.00 0.00 0.00 175.10 175.05 2bea s TYR 133 N -1.55 -0.29 0.40 5.22 2.02 -0.39 -1.67 117.35 121.09 2bea s TYR 133 Ca 0.29 0.71 0.02 0.00 -0.37 0.00 0.00 57.07 57.71 2bea s TYR 133 Cb -0.11 0.08 -0.01 0.00 -0.40 0.00 0.00 41.96 41.52 2bea s TYR 133 CO 0.21 -0.17 0.60 0.15 -1.57 0.00 0.00 175.55 174.77 2bea s LYS 134 N 0.52 3.18 -0.10 -0.62 1.02 -0.03 0.30 119.74 124.01 2bea s LYS 134 Ca -0.03 -0.55 0.00 0.00 0.02 0.00 0.00 55.97 55.41 2bea s LYS 134 Cb -0.05 -2.64 -0.02 0.00 -0.52 0.00 0.00 37.83 34.60 2bea s LYS 134 CO -0.03 -0.09 -0.11 -1.17 -0.92 0.00 0.00 175.35 173.03 2bea s LEU 135 N -4.41 2.89 0.09 3.17 2.96 -1.24 -0.95 118.68 121.19 2bea s LEU 135 Ca 0.45 -0.20 0.05 0.00 -0.22 0.00 0.00 54.13 54.21 2bea s LEU 135 Cb -0.10 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 2bea s LEU 135 CO 0.36 0.25 -0.00 -0.76 -1.32 0.00 0.00 176.35 174.87 2bea s LEU 136 N -0.15 3.45 -0.17 -0.68 1.43 0.98 -1.27 118.68 122.28 2bea s LEU 136 Ca 0.00 -0.18 -0.02 0.00 -1.03 0.00 0.00 54.13 52.91 2bea s LEU 136 Cb -0.13 -2.17 -0.01 0.00 0.03 0.00 0.00 46.19 43.90 2bea s LEU 136 CO 0.03 0.18 -0.09 -0.47 0.23 0.00 0.00 176.35 176.23 2bea s TYR 137 N -1.30 2.89 -0.14 0.29 5.04 -0.19 -2.13 117.35 121.82 2bea s TYR 137 Ca 0.25 -0.74 -0.02 0.00 -2.44 0.00 0.00 57.07 54.12 2bea s TYR 137 Cb -0.12 -1.95 -0.02 0.00 0.35 0.00 0.00 41.96 40.22 2bea s TYR 137 CO 0.18 -0.33 -0.07 0.00 -1.34 0.00 0.00 175.55 173.98 2bea s GLN 139 N 0.27 3.81 -0.57 0.00 1.11 0.36 -4.74 119.66 119.90 2bea s GLN 139 Ca -0.06 0.99 -0.26 0.00 0.01 0.00 0.00 55.36 56.04 2bea s GLN 139 Cb -0.15 -3.90 -0.09 0.00 -1.01 0.00 0.00 33.01 27.87 2bea s GLN 139 CO 0.04 -1.26 2.40 -3.38 0.01 0.00 0.00 175.29 173.10 2bea s HIS 140 N 4.55 1.10 -0.10 0.91 -3.43 -1.26 -3.28 115.29 113.77 2bea s HIS 140 Ca 0.54 1.66 -0.10 0.00 -0.80 0.00 0.00 55.06 56.36 2bea s HIS 140 Cb -0.13 -3.55 0.03 0.00 -1.43 0.00 0.00 32.58 27.49 2bea s HIS 140 CO 0.26 -2.29 0.28 0.54 -2.00 0.00 0.00 174.74 171.54 2bea s VAL 145 N 12.82 0.00 0.03 -5.38 0.11 -1.26 -5.15 120.40 121.57 2bea s VAL 145 Ca 0.96 -0.03 -0.02 0.00 -2.93 0.00 0.00 61.98 59.96 2bea s VAL 145 Cb -0.16 -0.41 -0.02 0.00 -1.53 0.00 0.00 36.38 34.26 2bea s VAL 145 CO 0.21 -0.02 0.01 -1.59 -3.33 0.00 0.00 175.10 170.38 2bea s LYS 146 N 0.07 0.47 -0.24 1.54 -2.85 -1.21 -5.14 119.74 112.38 2bea s LYS 146 Ca -0.01 -0.81 -0.00 0.00 -1.00 0.00 0.00 55.97 54.15 2bea s LYS 146 Cb -0.02 0.17 0.07 0.00 -2.06 0.00 0.00 37.83 35.98 2bea s LYS 146 CO 0.01 -0.09 -0.01 0.00 0.10 0.00 0.00 175.35 175.36 2bea n ASP 148 N 4.79 0.67 -4.37 0.00 10.43 -1.25 -5.01 116.55 121.80 2bea n ASP 148 Ca -0.09 -1.09 -0.27 0.00 2.57 0.00 0.00 54.79 55.90 2bea n ASP 148 Cb 0.45 0.00 -0.13 0.00 1.84 0.00 0.00 41.12 43.28 2bea n ASP 148 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 2bea s GLN 149 N -0.09 1.37 0.03 -1.24 -0.21 -1.25 -5.05 119.66 113.22 2bea s GLN 149 Ca 0.00 -1.35 0.08 0.00 0.02 0.00 0.00 55.36 54.11 2bea s GLN 149 Cb 0.00 -1.76 -0.02 0.00 1.00 0.00 0.00 33.01 32.22 2bea s GLN 149 CO 0.00 0.41 -0.24 0.71 -2.12 0.00 0.00 175.29 174.05 2bea s TYR 150 N -1.25 2.09 0.37 0.91 1.51 -1.26 -1.02 117.35 118.70 2bea s TYR 150 Ca 0.14 -0.39 -0.23 0.00 -1.01 0.00 0.00 57.07 55.58 2bea s TYR 150 Cb -0.09 -1.27 -0.10 0.00 -0.11 0.00 0.00 41.96 40.38 2bea s TYR 150 CO 0.06 0.07 0.94 0.42 -1.11 0.00 0.00 175.55 175.93 2bea s ILE 151 N -0.73 4.32 0.00 2.71 1.09 -0.39 -3.33 121.20 124.87 2bea s ILE 151 Ca 0.10 1.62 0.00 0.00 -1.10 0.00 0.00 60.65 61.27 2bea s ILE 151 Cb -0.09 -3.79 0.00 0.00 -1.06 0.00 0.00 42.46 37.52 2bea s ILE 151 CO 0.01 -0.10 0.00 0.61 -0.10 0.00 0.00 174.94 175.37 2bea n GLY 152 N -0.06 3.60 3.54 6.18 0.00 0.18 -0.96 105.19 117.66 2bea n GLY 152 Ca 0.04 -1.36 -0.30 0.00 0.00 0.00 0.00 46.02 44.41 2bea n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bea s ILE 153 N -2.19 3.16 -0.25 -0.61 -1.09 -1.20 -1.70 121.20 117.34 2bea s ILE 153 Ca 0.00 -1.26 -0.02 0.00 -2.23 0.00 0.00 60.65 57.14 2bea s ILE 153 Cb 0.00 -2.44 0.12 0.00 -1.58 0.00 0.00 42.46 38.56 2bea s ILE 153 CO 0.00 0.18 0.28 -2.28 -1.23 0.00 0.00 174.94 171.89 2bea s HIS 154 N -1.12 -0.44 -0.22 3.97 5.65 -0.95 -4.93 115.29 117.25 2bea s HIS 154 Ca 0.19 0.14 -0.29 0.00 0.25 0.00 0.00 55.06 55.35 2bea s HIS 154 Cb -0.11 -0.35 0.00 0.00 -1.18 0.00 0.00 32.58 30.95 2bea s HIS 154 CO 0.11 -0.76 1.15 1.03 -0.65 0.00 0.00 174.74 175.61 2bea s ARG 155 N 2.38 4.20 0.88 2.88 0.52 -1.25 -2.92 118.95 125.63 2bea s ARG 155 Ca 0.09 1.43 -0.15 0.00 -0.52 0.00 0.00 55.73 56.58 2bea s ARG 155 Cb -0.15 -3.72 0.20 0.00 0.52 0.00 0.00 34.95 31.81 2bea s ARG 155 CO -0.22 -0.73 1.15 -0.40 0.02 0.00 0.00 175.30 175.13 2bea n ASP 156 N 6.59 -0.08 -0.20 0.23 5.68 -0.40 -4.84 116.55 123.53 2bea n ASP 156 Ca 0.13 -1.39 0.19 0.00 -0.50 0.00 0.00 54.79 53.21 2bea n ASP 156 Cb 0.46 -0.89 0.53 0.00 -1.14 0.00 0.00 41.12 40.08 2bea n ASP 156 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 2bea h ARG 157 N 0.00 0.35 -0.01 0.11 2.43 -1.95 0.13 114.38 115.43 2bea h ARG 157 Ca -0.38 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 2bea h ARG 157 Cb 1.04 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.52 2bea h ARG 157 CO 0.26 0.23 -0.10 0.09 -1.51 0.00 0.00 179.97 178.95 2bea n ASN 158 N -4.47 1.05 0.00 -3.80 4.13 -1.26 -4.94 115.26 105.96 2bea n ASN 158 Ca 0.17 -1.11 0.00 0.00 1.68 0.00 0.00 54.58 55.32 2bea n ASN 158 Cb 0.66 0.03 0.00 0.00 -1.54 0.00 0.00 39.78 38.93 2bea n ASN 158 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2bea n GLY 159 N 1.23 2.50 3.20 7.41 0.00 0.45 -5.05 105.19 114.92 2bea n GLY 159 Ca 0.17 -0.33 -0.56 0.00 0.00 0.00 0.00 46.02 45.29 2bea n GLY 159 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bea n ASN 160 N 0.24 0.56 -3.71 1.61 3.02 -1.26 -4.27 115.26 111.45 2bea n ASN 160 Ca 0.00 1.04 -0.41 0.00 -0.03 0.00 0.00 54.58 55.17 2bea n ASN 160 Cb 0.00 -0.79 0.00 0.00 -0.61 0.00 0.00 39.78 38.38 2bea n ASN 160 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2bea n ARG 161 N 2.50 4.16 -1.72 3.52 1.74 -1.26 -1.28 116.66 124.30 2bea n ARG 161 Ca 0.23 -3.62 -0.40 0.00 -0.77 0.00 0.00 57.85 53.29 2bea n ARG 161 Cb 0.00 -2.76 0.02 0.00 -1.02 0.00 0.00 32.46 28.71 2bea n ARG 161 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2bea n ARG 162 N 2.65 2.01 -2.93 5.56 1.74 -1.15 -2.54 116.66 122.00 2bea n ARG 162 Ca 0.48 0.72 -0.41 0.00 -0.77 0.00 0.00 57.85 57.87 2bea n ARG 162 Cb 0.31 -2.48 -0.04 0.00 -1.02 0.00 0.00 32.46 29.23 2bea n ARG 162 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2bea s LEU 163 N -2.14 4.11 0.25 0.55 1.02 0.27 -2.23 118.68 120.51 2bea s LEU 163 Ca 0.62 1.02 -0.07 0.00 0.02 0.00 0.00 54.13 55.73 2bea s LEU 163 Cb -0.48 -3.15 -0.01 0.00 0.02 0.00 0.00 46.19 42.57 2bea s LEU 163 CO 0.57 -0.46 0.37 0.68 0.02 0.00 0.00 176.35 177.53 2bea s VAL 164 N 2.57 0.00 -0.56 -1.59 -7.23 -0.69 -1.22 120.40 111.68 2bea s VAL 164 Ca 0.34 -1.64 -0.22 0.00 -1.81 0.00 0.00 61.98 58.66 2bea s VAL 164 Cb -0.16 -2.39 0.06 0.00 0.56 0.00 0.00 36.38 34.45 2bea s VAL 164 CO 0.09 0.00 0.84 -0.69 -0.31 0.00 0.00 175.10 175.03 2bea s VAL 165 N -3.86 4.55 0.15 1.32 1.01 -0.51 0.49 120.40 123.55 2bea s VAL 165 Ca 0.29 -0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.19 2bea s VAL 165 Cb 0.02 -4.49 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 2bea s VAL 165 CO 0.13 -1.09 -0.05 0.28 0.00 0.00 0.00 175.10 174.36 2bea s THR 166 N 3.50 3.53 -1.20 3.92 -1.32 -1.21 -4.66 115.64 118.20 2bea s THR 166 Ca 0.23 -1.40 0.10 0.00 -1.21 0.00 0.00 61.69 59.41 2bea s THR 166 Cb -0.16 -2.73 0.43 0.00 -1.51 0.00 0.00 72.50 68.53 2bea s THR 166 CO 0.14 -0.03 1.26 -1.84 -2.21 0.00 0.00 174.62 171.94 2bea n GLU 167 N 0.20 2.69 -1.34 7.08 0.28 -1.26 -4.54 120.64 123.74 2bea n GLU 167 Ca -0.11 -1.69 -0.00 0.00 -0.16 0.00 0.00 57.16 55.20 2bea n GLU 167 Cb 0.54 -1.67 0.00 0.00 1.43 0.00 0.00 31.44 31.74 2bea n GLU 167 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2bea n GLU 168 N 0.53 0.06 -3.69 3.44 4.07 -1.26 -4.99 120.64 118.79 2bea n GLU 168 Ca 0.15 -0.11 -0.25 0.00 -0.06 0.00 0.00 57.16 56.89 2bea n GLU 168 Cb 0.60 0.15 0.06 0.00 -0.06 0.00 0.00 31.44 32.19 2bea n GLU 168 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2bea n ASN 169 N -0.85 -5.11 -4.74 4.31 5.03 -1.26 -4.82 115.26 107.82 2bea n ASN 169 Ca -0.00 -0.65 -0.41 0.00 0.87 0.00 0.00 54.58 54.39 2bea n ASN 169 Cb 0.04 -4.60 -0.04 0.00 -1.02 0.00 0.00 39.78 34.15 2bea n ASN 169 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 2bea s PRO 170 N -6.30 4.56 0.08 3.52 0.04 -1.26 -3.23 135.00 132.39 2bea s PRO 170 Ca 0.52 1.77 -0.31 0.00 0.04 0.00 0.00 61.00 63.02 2bea s PRO 170 Cb -0.24 -3.26 -0.07 0.00 0.04 0.00 0.00 34.50 30.96 2bea s PRO 170 CO 0.77 0.02 1.46 -0.51 0.04 0.00 0.00 177.00 178.77 2bea s LEU 171 N -0.32 4.35 -0.09 -3.56 1.43 -0.14 -4.95 118.68 115.40 2bea s LEU 171 Ca 0.51 2.32 0.03 0.00 -1.03 0.00 0.00 54.13 55.95 2bea s LEU 171 Cb -0.30 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.35 2bea s LEU 171 CO 0.36 -0.73 -0.17 -1.61 0.23 0.00 0.00 176.35 174.42 2bea s GLU 172 N 1.78 2.30 0.17 1.70 2.02 -1.26 -3.64 118.70 121.78 2bea s GLU 172 Ca 0.67 -0.61 0.05 0.00 0.02 0.00 0.00 54.97 55.09 2bea s GLU 172 Cb -0.36 -1.85 -0.05 0.00 0.10 0.00 0.00 34.13 31.97 2bea s GLU 172 CO 0.30 0.05 -0.09 -0.51 0.02 0.00 0.00 175.26 175.02 2bea s LEU 173 N 0.65 2.48 -0.03 1.80 1.43 0.15 -2.37 118.68 122.80 2bea s LEU 173 Ca -0.14 -1.05 0.04 0.00 -1.03 0.00 0.00 54.13 51.95 2bea s LEU 173 Cb -0.16 -0.40 -0.00 0.00 0.03 0.00 0.00 46.19 45.65 2bea s LEU 173 CO 0.04 -0.33 -0.14 0.68 0.23 0.00 0.00 176.35 176.82 2bea s VAL 174 N -3.27 1.19 -0.34 -1.59 -7.23 0.82 -1.26 120.40 108.72 2bea s VAL 174 Ca 0.20 -0.60 -0.10 0.00 -1.81 0.00 0.00 61.98 59.66 2bea s VAL 174 Cb 0.02 -1.01 0.01 0.00 0.56 0.00 0.00 36.38 35.96 2bea s VAL 174 CO 0.03 0.34 0.18 -0.76 -0.31 0.00 0.00 175.10 174.58 2bea s LEU 175 N -0.07 4.41 -0.25 1.32 1.43 -1.26 -0.97 118.68 123.29 2bea s LEU 175 Ca -0.00 -0.78 -0.10 0.00 -1.03 0.00 0.00 54.13 52.22 2bea s LEU 175 Cb -0.09 -2.00 -0.05 0.00 0.03 0.00 0.00 46.19 44.08 2bea s LEU 175 CO 0.01 -0.29 0.15 -0.22 0.23 0.00 0.00 176.35 176.22 2bea s LEU 176 N 1.57 3.99 0.25 1.79 2.96 -0.51 -0.07 118.68 128.67 2bea s LEU 176 Ca 0.03 0.04 -0.30 0.00 -0.22 0.00 0.00 54.13 53.68 2bea s LEU 176 Cb -0.18 -2.08 -0.14 0.00 0.50 0.00 0.00 46.19 44.29 2bea s LEU 176 CO 0.06 0.03 1.26 1.17 -1.32 0.00 0.00 176.35 177.55 2bea n LYS 177 N 4.51 1.73 -3.73 1.98 3.00 -1.26 0.17 118.16 124.56 2bea n LYS 177 Ca -0.15 0.61 -0.21 0.00 -0.00 0.00 0.00 58.31 58.56 2bea n LYS 177 Cb 0.52 -2.17 -0.04 0.00 0.00 0.00 0.00 35.03 33.34 2bea n LYS 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2bea s ALA 178 N -0.45 3.91 -2.00 3.14 0.00 0.38 -4.73 121.76 122.01 2bea s ALA 178 Ca 0.65 -1.82 0.22 0.00 0.00 0.00 0.00 51.96 51.01 2bea s ALA 178 Cb -0.69 -1.00 1.32 0.00 0.00 0.00 0.00 23.12 22.75 2bea s ALA 178 CO 0.54 -0.12 1.69 0.36 0.00 0.00 0.00 175.76 178.23