#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o6c s GLU 30 N 0.00 2.57 -0.06 -1.24 2.02 -1.26 -4.64 118.70 116.09 2o6c s GLU 30 Ca 0.00 -0.71 0.03 0.00 0.02 0.00 0.00 54.97 54.32 2o6c s GLU 30 Cb 0.00 -2.51 0.00 0.00 0.10 0.00 0.00 34.13 31.72 2o6c s GLU 30 CO 0.00 0.61 -0.16 -0.06 0.02 0.00 0.00 175.26 175.67 2o6c s PHE 31 N -0.99 1.65 0.48 1.61 0.40 -0.06 -4.97 117.98 116.10 2o6c s PHE 31 Ca 0.17 -0.54 -0.22 0.00 -0.60 0.00 0.00 56.93 55.74 2o6c s PHE 31 Cb -0.11 -1.15 -0.07 0.00 0.51 0.00 0.00 43.02 42.20 2o6c s PHE 31 CO 0.07 -0.22 1.11 -1.25 0.70 0.00 0.00 175.22 175.63 2o6c s PRO 32 N 0.29 3.73 0.08 0.24 0.04 -1.26 0.04 135.00 138.17 2o6c s PRO 32 Ca -0.09 1.62 0.10 0.00 0.04 0.00 0.00 61.00 62.67 2o6c s PRO 32 Cb -0.13 -2.27 -0.18 0.00 0.04 0.00 0.00 34.50 31.96 2o6c s PRO 32 CO 0.03 -0.54 1.08 0.82 0.04 0.00 0.00 177.00 178.43 2o6c h ILE 33 N 1.69 1.28 0.00 0.56 2.04 -1.41 -3.45 117.51 118.22 2o6c h ILE 33 Ca -0.49 -2.98 0.00 0.00 1.00 0.00 0.00 64.86 62.39 2o6c h ILE 33 Cb 1.24 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 39.94 2o6c h ILE 33 CO 0.59 0.73 0.00 0.61 0.00 0.00 0.00 178.15 180.08 2o6c n GLY 34 N 1.40 -1.18 3.79 5.37 0.00 -1.26 -4.66 105.19 108.65 2o6c n GLY 34 Ca -0.05 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.72 2o6c n GLY 34 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o6c s GLU 35 N -0.59 3.69 0.67 1.61 2.56 -1.26 -4.71 118.70 120.67 2o6c s GLU 35 Ca 0.00 1.43 -0.17 0.00 0.00 0.00 0.00 54.97 56.22 2o6c s GLU 35 Cb 0.00 -2.07 0.00 0.00 2.00 0.00 0.00 34.13 34.06 2o6c s GLU 35 CO 0.00 -0.54 1.28 -0.51 -0.56 0.00 0.00 175.26 174.93 2o6c s ASP 36 N -1.92 4.48 0.15 -1.70 1.11 -1.26 -4.87 116.67 112.66 2o6c s ASP 36 Ca 0.69 2.58 0.10 0.00 0.18 0.00 0.00 52.55 56.09 2o6c s ASP 36 Cb -0.18 -2.61 -0.04 0.00 1.07 0.00 0.00 42.92 41.15 2o6c s ASP 36 CO 0.22 -2.08 -0.23 -0.13 1.18 0.00 0.00 175.17 174.13 2o6c s ARG 37 N -3.49 1.34 -0.22 8.23 1.81 0.69 -4.98 118.95 122.34 2o6c s ARG 37 Ca 0.81 -1.37 0.01 0.00 -1.72 0.00 0.00 55.73 53.46 2o6c s ARG 37 Cb -0.36 -1.64 0.03 0.00 -0.45 0.00 0.00 34.95 32.53 2o6c s ARG 37 CO 0.41 0.37 -0.14 -0.51 -0.68 0.00 0.00 175.30 174.75 2o6c s ASP 38 N -2.32 3.83 -0.22 0.23 1.01 -1.26 -0.28 116.67 117.66 2o6c s ASP 38 Ca 0.14 -0.92 -0.01 0.00 0.71 0.00 0.00 52.55 52.47 2o6c s ASP 38 Cb -0.09 -1.55 0.06 0.00 1.01 0.00 0.00 42.92 42.36 2o6c s ASP 38 CO 0.07 -0.09 0.00 -0.69 0.21 0.00 0.00 175.17 174.67 2o6c s VAL 39 N 1.24 1.00 0.00 -1.27 1.01 -0.17 -5.00 120.40 117.21 2o6c s VAL 39 Ca -0.00 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.05 2o6c s VAL 39 Cb -0.16 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 34.79 2o6c s VAL 39 CO -0.08 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.42 2o6c n GLY 40 N 4.86 3.30 0.63 4.51 0.00 -1.26 -1.54 105.19 115.68 2o6c n GLY 40 Ca -0.10 -0.18 0.04 0.00 0.00 0.00 0.00 46.02 45.79 2o6c n GLY 40 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2o6c n PRO 41 N 13.84 1.83 -4.94 1.61 -0.04 -1.26 -4.76 135.00 141.28 2o6c n PRO 41 Ca 0.00 -1.05 -0.33 0.00 -0.04 0.00 0.00 63.50 62.09 2o6c n PRO 41 Cb 0.00 -1.34 -0.14 0.00 -0.04 0.00 0.00 33.50 31.98 2o6c n PRO 41 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2o6c s LEU 42 N -1.01 2.63 -0.31 1.53 1.43 -0.59 -1.85 118.68 120.51 2o6c s LEU 42 Ca 0.19 -0.26 -0.10 0.00 -1.03 0.00 0.00 54.13 52.94 2o6c s LEU 42 Cb 0.11 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.79 2o6c s LEU 42 CO 0.11 0.31 0.16 -2.28 0.23 0.00 0.00 176.35 174.88 2o6c s HIS 43 N -0.54 3.18 -0.15 0.29 5.65 0.82 -1.00 115.29 123.54 2o6c s HIS 43 Ca 0.07 -0.51 0.01 0.00 0.25 0.00 0.00 55.06 54.88 2o6c s HIS 43 Cb -0.11 -2.36 0.00 0.00 -1.18 0.00 0.00 32.58 28.92 2o6c s HIS 43 CO 0.01 -0.43 -0.17 0.08 -0.65 0.00 0.00 174.74 173.58 2o6c s VAL 44 N 1.63 2.53 0.15 0.89 1.01 0.62 -1.38 120.40 125.85 2o6c s VAL 44 Ca 0.05 -0.82 0.11 0.00 0.00 0.00 0.00 61.98 61.32 2o6c s VAL 44 Cb -0.17 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2o6c s VAL 44 CO 0.07 0.52 -0.25 -0.83 0.00 0.00 0.00 175.10 174.61 2o6c s GLY 45 N 0.83 1.59 -0.05 4.51 0.00 0.14 -0.22 107.32 114.12 2o6c s GLY 45 Ca -0.05 -1.52 0.02 0.00 0.00 0.00 0.00 44.72 43.17 2o6c s GLY 45 CO -0.01 -1.52 -0.07 -0.32 0.00 0.00 0.00 173.10 171.18 2o6c s GLY 46 N -2.31 0.54 0.10 0.20 0.00 -1.26 -0.38 107.32 104.21 2o6c s GLY 46 Ca 0.16 -0.17 -0.00 0.00 0.00 0.00 0.00 44.72 44.71 2o6c s GLY 46 CO 0.07 0.27 -0.01 -1.34 0.00 0.00 0.00 173.10 172.10 2o6c s VAL 47 N 0.73 0.32 0.07 1.40 -7.23 -0.81 -1.04 120.40 113.84 2o6c s VAL 47 Ca -0.11 -1.88 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 2o6c s VAL 47 Cb -0.14 -1.78 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 2o6c s VAL 47 CO 0.01 -0.76 -0.05 -0.72 -0.31 0.00 0.00 175.10 173.27 2o6c s TYR 48 N -3.88 0.70 0.00 2.82 1.13 0.11 -1.24 117.35 116.98 2o6c s TYR 48 Ca 0.15 -0.89 -0.00 0.00 -1.41 0.00 0.00 57.07 54.91 2o6c s TYR 48 Cb 0.07 -0.44 0.00 0.00 -1.10 0.00 0.00 41.96 40.50 2o6c s TYR 48 CO -0.04 -0.22 0.02 1.97 -2.51 0.00 0.00 175.55 174.77 2o6c n PHE 49 N 0.29 -0.63 -1.56 -3.49 1.16 -0.64 -0.88 117.46 111.72 2o6c n PHE 49 Ca -0.15 -0.02 -0.37 0.00 -1.87 0.00 0.00 57.45 55.04 2o6c n PHE 49 Cb 0.60 0.01 0.07 0.00 -1.61 0.00 0.00 39.48 38.55 2o6c n PHE 49 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2o6c n GLN 50 N -0.01 0.81 -1.41 3.97 10.64 -1.26 -0.91 117.38 129.21 2o6c n GLN 50 Ca -0.00 0.33 -0.36 0.00 -1.83 0.00 0.00 57.00 55.14 2o6c n GLN 50 Cb 0.01 -2.33 0.09 0.00 -0.86 0.00 0.00 30.24 27.15 2o6c n GLN 50 CO 0.00 0.00 0.00 -2.30 -1.83 0.00 0.00 177.06 172.93 2o6c n PRO 51 N -1.71 0.61 -4.53 2.61 -0.02 -1.26 -3.75 135.00 126.95 2o6c n PRO 51 Ca 0.14 0.27 -0.25 0.00 -2.02 0.00 0.00 63.50 61.64 2o6c n PRO 51 Cb 0.48 -2.34 -0.11 0.00 -0.02 0.00 0.00 33.50 31.52 2o6c n PRO 51 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2o6c s VAL 52 N -1.75 1.78 0.51 -1.45 -7.23 -1.26 -4.91 120.40 106.09 2o6c s VAL 52 Ca 0.76 -2.06 0.07 0.00 -1.81 0.00 0.00 61.98 58.95 2o6c s VAL 52 Cb -0.35 -2.80 0.03 0.00 0.56 0.00 0.00 36.38 33.83 2o6c s VAL 52 CO 0.48 -0.08 0.51 -0.70 -0.31 0.00 0.00 175.10 175.00 2o6c s GLU 53 N -3.74 2.38 -0.30 4.82 2.12 -1.26 -3.84 118.70 118.87 2o6c s GLU 53 Ca 0.34 -1.74 -0.17 0.00 0.36 0.00 0.00 54.97 53.76 2o6c s GLU 53 Cb 0.07 -2.37 0.19 0.00 0.26 0.00 0.00 34.13 32.29 2o6c s GLU 53 CO 0.16 -0.55 1.23 -1.58 -0.54 0.00 0.00 175.26 173.98 2o6c s HIS 55 N -2.64 -0.17 0.84 5.30 2.46 -1.26 -5.10 115.29 114.72 2o6c s HIS 55 Ca 0.47 0.31 -0.10 0.00 0.47 0.00 0.00 55.06 56.21 2o6c s HIS 55 Cb -0.04 0.10 0.10 0.00 -0.13 0.00 0.00 32.58 32.61 2o6c s HIS 55 CO 0.29 -0.08 1.12 -2.14 -2.47 0.00 0.00 174.74 171.45 2o6c s PRO 56 N 1.67 1.63 -0.18 2.88 0.02 -1.26 -5.07 135.00 134.69 2o6c s PRO 56 Ca -0.04 1.37 -0.29 0.00 0.02 0.00 0.00 61.00 62.07 2o6c s PRO 56 Cb -0.02 -1.81 -0.00 0.00 0.02 0.00 0.00 34.50 32.69 2o6c s PRO 56 CO -0.14 -2.15 1.13 0.00 -0.33 0.00 0.00 177.00 175.51 2o6c s ALA 57 N -2.76 3.63 0.49 -1.55 0.00 -1.26 -4.99 121.76 115.33 2o6c s ALA 57 Ca 0.64 0.34 -0.20 0.00 0.00 0.00 0.00 51.96 52.74 2o6c s ALA 57 Cb -0.20 -3.56 -0.08 0.00 0.00 0.00 0.00 23.12 19.28 2o6c s ALA 57 CO 0.57 -1.02 1.03 -2.14 0.00 0.00 0.00 175.76 174.20 2o6c s PRO 58 N 3.09 3.79 0.00 0.00 0.02 -1.26 -4.92 135.00 135.72 2o6c s PRO 58 Ca 0.49 1.31 0.00 0.00 0.02 0.00 0.00 61.00 62.82 2o6c s PRO 58 Cb -0.18 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.24 2o6c s PRO 58 CO 0.12 -0.43 0.00 0.41 -0.33 0.00 0.00 177.00 176.76 2o6c n GLY 59 N -0.40 0.59 1.13 0.52 0.00 -1.26 -2.09 105.19 103.69 2o6c n GLY 59 Ca 0.09 0.10 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 2o6c n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o6c n ALA 60 N 2.82 4.19 -1.77 4.61 0.00 -1.26 -5.04 120.51 124.06 2o6c n ALA 60 Ca 0.00 -3.07 -0.39 0.00 0.00 0.00 0.00 53.44 49.98 2o6c n ALA 60 Cb 0.00 -0.74 -0.02 0.00 0.00 0.00 0.00 19.45 18.69 2o6c n ALA 60 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2o6c s GLN 61 N -3.21 4.23 0.64 0.00 -0.21 -0.89 -4.99 119.66 115.23 2o6c s GLN 61 Ca 0.44 1.99 -0.17 0.00 0.02 0.00 0.00 55.36 57.64 2o6c s GLN 61 Cb 0.40 -2.89 -0.01 0.00 1.00 0.00 0.00 33.01 31.51 2o6c s GLN 61 CO 0.00 -0.21 1.17 -1.25 -2.12 0.00 0.00 175.29 172.88 2o6c s PRO 62 N -1.99 2.75 1.08 2.91 0.04 -1.26 -4.92 135.00 133.61 2o6c s PRO 62 Ca 0.52 1.66 -0.13 0.00 0.04 0.00 0.00 61.00 63.09 2o6c s PRO 62 Cb -0.35 -1.92 0.24 0.00 0.04 0.00 0.00 34.50 32.51 2o6c s PRO 62 CO 0.45 -1.34 1.06 -1.54 0.04 0.00 0.00 177.00 175.67 2o6c s SER 63 N -2.01 1.81 0.27 6.66 1.04 -1.26 -4.67 113.70 115.54 2o6c s SER 63 Ca 0.73 1.26 -0.03 0.00 0.48 0.00 0.00 55.95 58.40 2o6c s SER 63 Cb -0.26 -1.97 0.40 0.00 0.10 0.00 0.00 66.02 64.29 2o6c s SER 63 CO 0.38 -3.65 1.90 0.50 0.98 0.00 0.00 173.24 173.35 2o6c h LYS 64 N -2.25 1.16 -0.11 4.02 3.64 -1.94 -0.97 116.57 120.12 2o6c h LYS 64 Ca -0.58 -0.07 -0.20 0.00 -1.27 0.00 0.00 60.65 58.54 2o6c h LYS 64 Cb 1.34 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2o6c h LYS 64 CO 0.55 0.77 -0.73 0.93 -2.27 0.00 0.00 179.45 178.69 2o6c h GLU 65 N 1.19 0.55 0.00 1.90 4.39 -1.91 -3.30 114.58 117.40 2o6c h GLU 65 Ca 0.41 -0.44 -0.16 0.00 0.34 0.00 0.00 59.36 59.51 2o6c h GLU 65 Cb 0.11 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 2o6c h GLU 65 CO -0.15 1.07 -0.77 0.93 -1.16 0.00 0.00 179.01 178.93 2o6c h GLU 66 N 0.38 0.00 -7.18 2.33 5.08 -1.81 -3.47 114.58 109.91 2o6c h GLU 66 Ca -0.03 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.83 2o6c h GLU 66 Cb 1.32 0.00 0.07 0.00 0.50 0.00 0.00 28.75 30.64 2o6c h GLU 66 CO 0.14 0.77 0.38 0.00 -1.00 0.00 0.00 179.01 179.29 2o6c s ALA 67 N -3.07 2.68 -0.05 3.43 0.00 -0.40 -4.88 121.76 119.47 2o6c s ALA 67 Ca 0.01 0.49 -0.16 0.00 0.00 0.00 0.00 51.96 52.29 2o6c s ALA 67 Cb 0.10 -3.27 -0.31 0.00 0.00 0.00 0.00 23.12 19.65 2o6c s ALA 67 CO 0.78 -0.88 0.76 -0.44 0.00 0.00 0.00 175.76 175.98 2o6c h ASP 68 N 0.51 0.57 -2.16 0.00 3.32 -0.25 -3.46 116.42 114.95 2o6c h ASP 68 Ca -0.47 -0.91 0.01 0.00 0.02 0.00 0.00 57.03 55.67 2o6c h ASP 68 Cb 1.23 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2o6c h ASP 68 CO 0.57 1.63 0.22 0.00 -1.72 0.00 0.00 179.24 179.94 2o6c s HIS 70 N -4.40 2.51 -0.06 0.00 2.46 -0.09 -0.17 115.29 115.54 2o6c s HIS 70 Ca 0.11 -0.90 0.04 0.00 0.47 0.00 0.00 55.06 54.78 2o6c s HIS 70 Cb -0.03 -1.66 -0.02 0.00 -0.13 0.00 0.00 32.58 30.74 2o6c s HIS 70 CO 0.07 -0.33 -0.19 0.42 -2.47 0.00 0.00 174.74 172.24 2o6c s ILE 71 N 0.12 2.62 -0.01 0.89 1.01 0.24 -1.62 121.20 124.44 2o6c s ILE 71 Ca -0.12 -0.87 0.07 0.00 0.00 0.00 0.00 60.65 59.73 2o6c s ILE 71 Cb -0.16 -2.00 -0.02 0.00 0.01 0.00 0.00 42.46 40.29 2o6c s ILE 71 CO 0.07 0.57 -0.22 -1.61 0.00 0.00 0.00 174.94 173.74 2o6c s GLU 72 N -0.36 1.80 -0.27 2.79 2.02 -0.38 -1.18 118.70 123.12 2o6c s GLU 72 Ca 0.03 -0.82 -0.07 0.00 0.02 0.00 0.00 54.97 54.13 2o6c s GLU 72 Cb -0.12 -1.75 -0.01 0.00 0.10 0.00 0.00 34.13 32.35 2o6c s GLU 72 CO 0.02 0.48 0.06 0.00 0.02 0.00 0.00 175.26 175.84 2o6c s ALA 73 N -0.55 3.07 -0.34 5.21 0.00 0.57 -1.92 121.76 127.80 2o6c s ALA 73 Ca 0.09 -1.31 -0.12 0.00 0.00 0.00 0.00 51.96 50.62 2o6c s ALA 73 Cb -0.09 -2.07 -0.01 0.00 0.00 0.00 0.00 23.12 20.95 2o6c s ALA 73 CO -0.01 -0.71 0.23 -0.51 0.00 0.00 0.00 175.76 174.76 2o6c s ASP 74 N 1.54 5.98 -0.18 0.00 1.01 0.49 -2.36 116.67 123.16 2o6c s ASP 74 Ca 0.04 -0.48 0.01 0.00 0.71 0.00 0.00 52.55 52.83 2o6c s ASP 74 Cb -0.16 -2.12 0.02 0.00 1.01 0.00 0.00 42.92 41.67 2o6c s ASP 74 CO 0.02 -0.25 -0.19 -0.63 0.21 0.00 0.00 175.17 174.34 2o6c s ILE 75 N 1.70 2.17 0.05 0.77 1.01 -1.26 -0.69 121.20 124.95 2o6c s ILE 75 Ca 0.06 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.83 2o6c s ILE 75 Cb -0.17 -1.92 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 2o6c s ILE 75 CO 0.10 0.53 -0.08 -1.00 0.00 0.00 0.00 174.94 174.49 2o6c s HIS 76 N 1.30 0.73 0.34 3.97 3.76 -0.48 -2.63 115.29 122.28 2o6c s HIS 76 Ca 0.05 -0.52 -0.28 0.00 -0.15 0.00 0.00 55.06 54.16 2o6c s HIS 76 Cb -0.13 -0.43 -0.10 0.00 1.11 0.00 0.00 32.58 33.03 2o6c s HIS 76 CO -0.12 -0.08 1.22 0.00 -0.85 0.00 0.00 174.74 174.92 2o6c s ALA 77 N -1.51 3.38 0.00 -1.40 0.00 -0.07 -0.13 121.76 122.03 2o6c s ALA 77 Ca -0.08 1.10 0.00 0.00 0.00 0.00 0.00 51.96 52.98 2o6c s ALA 77 Cb -0.09 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.61 2o6c s ALA 77 CO 0.00 -0.51 0.00 0.27 0.00 0.00 0.00 175.76 175.52 2o6c n ASN 78 N 0.67 0.24 -0.17 0.00 0.23 -0.77 -0.86 115.26 114.60 2o6c n ASN 78 Ca 0.01 -0.86 0.12 0.00 -0.53 0.00 0.00 54.58 53.32 2o6c n ASN 78 Cb 0.44 0.00 0.44 0.00 -2.08 0.00 0.00 39.78 38.58 2o6c n ASN 78 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2o6c h GLU 79 N 0.00 0.53 0.00 -3.83 4.39 -1.94 -3.26 114.58 110.48 2o6c h GLU 79 Ca 0.00 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 2o6c h GLU 79 Cb 0.00 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 2o6c h GLU 79 CO 0.00 0.35 -0.01 0.00 -1.16 0.00 0.00 179.01 178.19 2o6c h ALA 80 N 1.64 1.00 -0.13 3.43 0.00 -1.85 -1.98 119.26 121.36 2o6c h ALA 80 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2o6c h ALA 80 Cb 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2o6c h ALA 80 CO -0.12 0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.55 2o6c n GLY 81 N 0.81 1.74 0.30 0.00 0.00 -1.23 -3.21 105.19 103.59 2o6c n GLY 81 Ca 0.03 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.08 2o6c n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o6c h LYS 82 N 0.00 0.00 -0.09 1.61 1.57 -1.41 -2.69 116.57 115.57 2o6c h LYS 82 Ca 0.00 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2o6c h LYS 82 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 2o6c h LYS 82 CO 0.00 0.00 0.08 0.22 -0.57 0.00 0.00 179.45 179.18 2o6c h ASP 83 N 0.00 0.00 -0.09 0.86 1.82 -1.76 -0.40 116.42 116.85 2o6c h ASP 83 Ca 0.03 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 2o6c h ASP 83 Cb 0.15 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.16 2o6c h ASP 83 CO -0.00 0.00 0.00 0.18 -1.61 0.00 0.00 179.24 177.81 2o6c n LEU 84 N -4.15 2.87 0.00 2.28 4.77 -1.02 -0.76 117.00 120.99 2o6c n LEU 84 Ca -0.01 -1.01 0.00 0.00 -0.03 0.00 0.00 56.01 54.96 2o6c n LEU 84 Cb 0.19 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2o6c n LEU 84 CO 0.31 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 2o6c n GLY 85 N 1.35 0.34 3.87 -0.72 0.00 -0.16 -5.00 105.19 104.87 2o6c n GLY 85 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 2o6c n GLY 85 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2o6c s TYR 86 N -2.10 3.34 0.05 1.61 2.02 -1.18 -4.96 117.35 116.13 2o6c s TYR 86 Ca 0.00 1.11 -0.04 0.00 -0.37 0.00 0.00 57.07 57.77 2o6c s TYR 86 Cb 0.00 -3.00 -0.05 0.00 -0.40 0.00 0.00 41.96 38.51 2o6c s TYR 86 CO 0.00 -1.13 0.26 0.20 -1.57 0.00 0.00 175.55 173.31 2o6c s GLY 87 N -4.27 2.22 0.26 0.71 0.00 -1.26 -3.58 107.32 101.40 2o6c s GLY 87 Ca 0.58 -0.66 -0.31 0.00 0.00 0.00 0.00 44.72 44.32 2o6c s GLY 87 CO 0.52 -0.55 1.64 -0.62 0.00 0.00 0.00 173.10 174.10 2o6c n VAL 88 N 0.68 0.66 0.00 1.40 0.31 -1.26 -1.69 118.33 118.43 2o6c n VAL 88 Ca -0.08 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 2o6c n VAL 88 Cb 0.52 -1.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 2o6c n VAL 88 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2o6c n GLY 89 N 2.80 1.75 3.77 2.92 0.00 -0.04 -4.97 105.19 111.42 2o6c n GLY 89 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2o6c n GLY 89 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2o6c s ASP 90 N -2.36 6.80 0.42 1.61 1.11 -0.68 -4.62 116.67 118.95 2o6c s ASP 90 Ca 0.00 2.65 -0.26 0.00 0.18 0.00 0.00 52.55 55.13 2o6c s ASP 90 Cb 0.00 -2.65 -0.09 0.00 1.07 0.00 0.00 42.92 41.26 2o6c s ASP 90 CO 0.00 -0.51 1.35 0.12 1.18 0.00 0.00 175.17 177.31 2o6c s PHE 91 N -1.15 2.68 -0.45 4.23 5.36 -1.26 -0.89 117.98 126.49 2o6c s PHE 91 Ca 0.49 1.35 -0.09 0.00 -0.96 0.00 0.00 56.93 57.72 2o6c s PHE 91 Cb -0.39 -3.76 0.11 0.00 -0.34 0.00 0.00 43.02 38.63 2o6c s PHE 91 CO 0.52 -2.41 0.31 0.08 -1.46 0.00 0.00 175.22 172.25 2o6c s VAL 92 N -1.24 4.13 0.75 3.12 1.01 -1.08 -4.83 120.40 122.27 2o6c s VAL 92 Ca 0.58 -1.70 -0.09 0.00 0.00 0.00 0.00 61.98 60.77 2o6c s VAL 92 Cb -0.40 -3.68 0.08 0.00 0.00 0.00 0.00 36.38 32.38 2o6c s VAL 92 CO 0.52 -0.69 1.09 -2.16 0.00 0.00 0.00 175.10 173.85 2o6c s PRO 93 N 1.36 2.02 -0.12 2.72 0.04 -1.26 -4.39 135.00 135.37 2o6c s PRO 93 Ca 0.05 -0.15 0.00 0.00 0.04 0.00 0.00 61.00 60.94 2o6c s PRO 93 Cb -0.25 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.21 2o6c s PRO 93 CO -0.00 -1.43 0.00 0.66 0.04 0.00 0.00 177.00 176.27 2o6c n TYR 94 N -3.10 0.00 -2.18 0.56 4.01 -1.26 -4.91 117.16 110.28 2o6c n TYR 94 Ca 0.09 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.53 2o6c n TYR 94 Cb 0.61 -0.93 0.02 0.00 -0.31 0.00 0.00 39.34 38.72 2o6c n TYR 94 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2o6c s LEU 95 N -0.25 3.29 -0.27 7.72 1.43 -1.26 -3.73 118.68 125.60 2o6c s LEU 95 Ca 0.00 1.12 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 2o6c s LEU 95 Cb 0.00 -4.06 0.05 0.00 0.03 0.00 0.00 46.19 42.21 2o6c s LEU 95 CO 0.00 -0.90 -0.07 -0.13 0.23 0.00 0.00 176.35 175.48 2o6c s ARG 96 N -5.05 2.38 -0.12 1.70 3.00 -0.64 -4.97 118.95 115.25 2o6c s ARG 96 Ca 0.53 -1.27 0.01 0.00 0.00 0.00 0.00 55.73 55.00 2o6c s ARG 96 Cb -0.11 -2.98 -0.02 0.00 0.00 0.00 0.00 34.95 31.85 2o6c s ARG 96 CO 0.50 -0.56 -0.14 0.08 0.00 0.00 0.00 175.30 175.18 2o6c s VAL 97 N 1.18 3.00 0.03 3.52 1.01 -1.26 -0.85 120.40 127.03 2o6c s VAL 97 Ca -0.06 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.26 2o6c s VAL 97 Cb -0.19 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 2o6c s VAL 97 CO -0.04 0.54 -0.11 -0.69 0.00 0.00 0.00 175.10 174.80 2o6c s VAL 98 N 0.18 0.81 0.01 2.92 1.01 -0.68 -1.32 120.40 123.32 2o6c s VAL 98 Ca -0.08 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.11 2o6c s VAL 98 Cb -0.15 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 2o6c s VAL 98 CO 0.05 -0.07 -0.20 0.00 0.00 0.00 0.00 175.10 174.88 2o6c s ALA 99 N -0.84 2.48 -0.11 5.51 0.00 0.84 -0.08 121.76 129.56 2o6c s ALA 99 Ca -0.01 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.83 2o6c s ALA 99 Cb -0.07 -0.72 -0.00 0.00 0.00 0.00 0.00 23.12 22.33 2o6c s ALA 99 CO 0.01 0.56 -0.21 -0.06 0.00 0.00 0.00 175.76 176.05 2o6c s PHE 100 N -0.80 2.63 -0.13 0.00 0.40 0.11 0.02 117.98 120.20 2o6c s PHE 100 Ca 0.13 -1.02 0.01 0.00 -0.60 0.00 0.00 56.93 55.45 2o6c s PHE 100 Cb -0.10 -1.76 -0.01 0.00 0.51 0.00 0.00 43.02 41.66 2o6c s PHE 100 CO 0.02 -0.41 -0.16 -0.51 0.70 0.00 0.00 175.22 174.86 2o6c s LEU 101 N 0.43 2.52 -0.13 -0.37 1.43 0.10 -1.46 118.68 121.20 2o6c s LEU 101 Ca -0.15 -0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 52.51 2o6c s LEU 101 Cb -0.17 -1.56 0.04 0.00 0.03 0.00 0.00 46.19 44.53 2o6c s LEU 101 CO 0.07 0.14 0.03 -1.58 0.23 0.00 0.00 176.35 175.23 2o6c s GLN 102 N 0.47 0.55 0.18 1.70 0.74 -0.66 -1.04 119.66 121.60 2o6c s GLN 102 Ca -0.11 -0.11 -0.30 0.00 0.05 0.00 0.00 55.36 54.88 2o6c s GLN 102 Cb -0.16 -1.50 -0.08 0.00 1.10 0.00 0.00 33.01 32.37 2o6c s GLN 102 CO 0.05 -0.47 1.24 0.21 -0.55 0.00 0.00 175.29 175.76 2o6c s LYS 103 N 1.95 4.45 0.12 1.67 2.20 -1.26 -0.59 119.74 128.29 2o6c s LYS 103 Ca 0.02 1.93 -0.32 0.00 -0.36 0.00 0.00 55.97 57.24 2o6c s LYS 103 Cb -0.15 -3.23 -0.11 0.00 -1.51 0.00 0.00 37.83 32.83 2o6c s LYS 103 CO -0.07 -0.17 1.79 0.72 -0.36 0.00 0.00 175.35 177.27 2o6c n HIS 104 N 2.71 2.57 0.00 4.03 8.25 0.13 -1.20 115.22 131.70 2o6c n HIS 104 Ca 0.05 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2o6c n HIS 104 Cb 0.44 -2.69 0.00 0.00 1.12 0.00 0.00 29.99 28.86 2o6c n HIS 104 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2o6c n GLY 105 N 4.09 0.17 3.53 -1.41 0.00 -1.26 -4.86 105.19 105.46 2o6c n GLY 105 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2o6c n GLY 105 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2o6c s SER 106 N -2.23 4.16 0.07 1.61 0.15 -0.34 -5.02 113.70 112.09 2o6c s SER 106 Ca 0.00 -0.46 0.23 0.00 0.70 0.00 0.00 55.95 56.43 2o6c s SER 106 Cb 0.00 -0.71 0.11 0.00 -1.71 0.00 0.00 66.02 63.71 2o6c s SER 106 CO 0.00 0.18 1.08 -0.62 1.20 0.00 0.00 173.24 175.09 2o6c n GLU 107 N 0.80 0.31 -2.39 5.44 -0.58 -1.26 -4.70 120.64 118.26 2o6c n GLU 107 Ca -0.14 0.02 -0.39 0.00 -0.42 0.00 0.00 57.16 56.22 2o6c n GLU 107 Cb 0.52 -1.62 -0.03 0.00 -0.57 0.00 0.00 31.44 29.74 2o6c n GLU 107 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2o6c s LYS 108 N -3.20 4.30 -0.07 3.49 1.02 -1.26 -5.06 119.74 118.96 2o6c s LYS 108 Ca 0.04 1.80 0.03 0.00 0.02 0.00 0.00 55.97 57.86 2o6c s LYS 108 Cb 0.14 -2.86 0.00 0.00 -0.52 0.00 0.00 37.83 34.59 2o6c s LYS 108 CO 0.78 -0.09 -0.17 0.08 -0.92 0.00 0.00 175.35 175.04 2o6c s VAL 109 N -1.35 1.47 -0.15 3.17 1.01 -1.26 -4.34 120.40 118.94 2o6c s VAL 109 Ca 0.52 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 2o6c s VAL 109 Cb -0.30 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 2o6c s VAL 109 CO 0.39 0.43 0.04 -1.58 0.00 0.00 0.00 175.10 174.37 2o6c s GLN 110 N 0.38 3.66 -0.17 2.72 0.74 -0.20 -4.92 119.66 121.87 2o6c s GLN 110 Ca -0.12 -0.37 -0.08 0.00 0.05 0.00 0.00 55.36 54.84 2o6c s GLN 110 Cb -0.15 -3.07 -0.05 0.00 1.10 0.00 0.00 33.01 30.85 2o6c s GLN 110 CO 0.05 0.41 0.12 0.21 -0.55 0.00 0.00 175.29 175.52 2o6c s LYS 111 N -0.04 3.91 0.00 1.67 2.20 -1.26 -0.72 119.74 125.50 2o6c s LYS 111 Ca 0.05 -0.22 0.00 0.00 -0.36 0.00 0.00 55.97 55.44 2o6c s LYS 111 Cb -0.12 -3.30 0.00 0.00 -1.51 0.00 0.00 37.83 32.90 2o6c s LYS 111 CO 0.01 0.44 0.00 0.28 -0.36 0.00 0.00 175.35 175.73 2o6c n VAL 112 N 3.05 0.00 -4.11 4.02 0.31 0.10 -4.98 118.33 116.72 2o6c n VAL 112 Ca -0.17 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.05 2o6c n VAL 112 Cb 0.53 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.38 2o6c n VAL 112 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2o6c s PHE 114 N 0.39 0.81 0.02 3.52 0.08 -0.44 -0.11 117.98 122.24 2o6c s PHE 114 Ca 0.00 -1.10 0.00 0.00 0.12 0.00 0.00 56.93 55.95 2o6c s PHE 114 Cb 0.00 -0.25 -0.02 0.00 -0.57 0.00 0.00 43.02 42.18 2o6c s PHE 114 CO 0.00 -0.77 -0.03 0.00 -0.10 0.00 0.00 175.22 174.32 2o6c s ALA 115 N -4.09 0.12 0.55 5.36 0.00 -0.49 -4.73 121.76 118.48 2o6c s ALA 115 Ca 0.31 -0.50 -0.17 0.00 0.00 0.00 0.00 51.96 51.60 2o6c s ALA 115 Cb 0.04 0.12 -0.06 0.00 0.00 0.00 0.00 23.12 23.22 2o6c s ALA 115 CO 0.10 -0.13 1.03 -1.25 0.00 0.00 0.00 175.76 175.52 2o6c s PRO 116 N -1.23 3.57 0.00 0.00 0.04 -1.26 -0.49 135.00 135.64 2o6c s PRO 116 Ca -0.13 1.17 0.08 0.00 0.04 0.00 0.00 61.00 62.16 2o6c s PRO 116 Cb -0.08 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 2o6c s PRO 116 CO -0.01 -0.60 -0.25 -0.80 0.04 0.00 0.00 177.00 175.38 2o6c s ASN 118 N -2.70 2.99 0.35 6.66 0.01 -1.26 -4.95 114.94 116.04 2o6c s ASN 118 Ca 0.63 -0.50 0.02 0.00 -0.71 0.00 0.00 52.86 52.30 2o6c s ASN 118 Cb -0.14 -0.31 0.02 0.00 0.41 0.00 0.00 41.25 41.22 2o6c s ASN 118 CO 0.32 0.29 0.15 0.00 -1.51 0.00 0.00 177.10 176.35 2o6c n ALA 119 N 2.24 0.43 0.31 0.60 0.00 -0.45 -4.97 120.51 118.68 2o6c n ALA 119 Ca -0.16 -1.47 0.18 0.00 0.00 0.00 0.00 53.44 51.98 2o6c n ALA 119 Cb 0.52 0.70 0.99 0.00 0.00 0.00 0.00 19.45 21.65 2o6c n ALA 119 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2o6c h GLY 120 N 0.60 0.00 -3.31 0.00 0.00 -2.04 -2.13 103.07 96.18 2o6c h GLY 120 Ca -0.25 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 46.94 2o6c h GLY 120 CO 0.40 0.00 0.16 2.09 0.00 0.00 0.00 176.54 179.19 2o6c n ASP 121 N -3.45 4.83 0.00 0.19 5.75 -1.26 -5.07 116.55 117.54 2o6c n ASP 121 Ca -0.02 -3.16 0.00 0.00 -0.01 0.00 0.00 54.79 51.59 2o6c n ASP 121 Cb 0.12 -0.70 0.00 0.00 -1.03 0.00 0.00 41.12 39.51 2o6c n ASP 121 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2o6c n GLY 122 N -0.07 -2.78 3.78 6.12 0.00 -0.80 -5.03 105.19 106.40 2o6c n GLY 122 Ca 0.35 -2.13 -0.36 0.00 0.00 0.00 0.00 46.02 43.89 2o6c n GLY 122 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2o6c s PRO 123 N -0.59 3.63 0.26 1.61 0.04 -1.26 -1.34 135.00 137.35 2o6c s PRO 123 Ca 0.00 1.64 -0.16 0.00 0.04 0.00 0.00 61.00 62.53 2o6c s PRO 123 Cb 0.00 -2.22 0.01 0.00 0.04 0.00 0.00 34.50 32.33 2o6c s PRO 123 CO 0.00 -0.63 0.57 -1.01 0.04 0.00 0.00 177.00 175.97 2o6c s HIS 124 N -1.69 0.17 -0.24 0.56 3.76 -1.26 -4.94 115.29 111.65 2o6c s HIS 124 Ca 0.67 -0.57 -0.07 0.00 -0.15 0.00 0.00 55.06 54.95 2o6c s HIS 124 Cb -0.25 0.38 -0.03 0.00 1.11 0.00 0.00 32.58 33.80 2o6c s HIS 124 CO 0.29 -1.09 0.05 0.71 -0.85 0.00 0.00 174.74 173.85 2o6c s TYR 125 N -3.95 3.07 0.19 1.40 2.02 -0.99 -4.32 117.35 114.76 2o6c s TYR 125 Ca 0.18 -0.47 -0.06 0.00 -0.37 0.00 0.00 57.07 56.36 2o6c s TYR 125 Cb -0.03 -2.20 -0.02 0.00 -0.40 0.00 0.00 41.96 39.31 2o6c s TYR 125 CO 0.08 -0.35 0.23 0.20 -1.57 0.00 0.00 175.55 174.15 2o6c s GLY 126 N 1.47 0.88 -0.26 0.71 0.00 0.36 -0.32 107.32 110.17 2o6c s GLY 126 Ca 0.06 -1.25 -0.25 0.00 0.00 0.00 0.00 44.72 43.28 2o6c s GLY 126 CO 0.03 -1.07 0.75 0.00 0.00 0.00 0.00 173.10 172.81 2o6c s ALA 127 N -4.05 -1.80 0.39 3.20 0.00 -0.32 -1.40 121.76 117.78 2o6c s ALA 127 Ca 0.26 1.99 -0.24 0.00 0.00 0.00 0.00 51.96 53.97 2o6c s ALA 127 Cb 0.04 -1.16 -0.09 0.00 0.00 0.00 0.00 23.12 21.91 2o6c s ALA 127 CO 0.06 -0.33 1.01 -0.80 0.00 0.00 0.00 175.76 175.70 2o6c s ASN 128 N 0.30 6.89 0.06 0.00 -0.87 -1.26 -0.59 114.94 119.47 2o6c s ASN 128 Ca -0.00 1.93 -0.04 0.00 -1.57 0.00 0.00 52.86 53.17 2o6c s ASN 128 Cb -0.05 -2.57 -0.02 0.00 -0.02 0.00 0.00 41.25 38.59 2o6c s ASN 128 CO 0.01 -0.39 0.07 0.68 -2.57 0.00 0.00 177.10 174.89 2o6c s VAL 129 N -1.75 0.17 -0.10 1.60 -7.23 0.76 -4.30 120.40 109.54 2o6c s VAL 129 Ca 0.57 -1.42 -0.01 0.00 -1.81 0.00 0.00 61.98 59.31 2o6c s VAL 129 Cb -0.19 -1.29 0.03 0.00 0.56 0.00 0.00 36.38 35.49 2o6c s VAL 129 CO 0.24 -0.79 -0.05 -0.75 -0.31 0.00 0.00 175.10 173.44 2o6c s LYS 130 N -3.55 1.24 -0.55 4.82 2.20 -1.26 0.54 119.74 123.17 2o6c s LYS 130 Ca 0.03 -0.16 -0.28 0.00 -0.36 0.00 0.00 55.97 55.21 2o6c s LYS 130 Cb 0.05 -1.43 0.00 0.00 -1.51 0.00 0.00 37.83 34.94 2o6c s LYS 130 CO -0.09 -0.29 1.56 -0.06 -0.36 0.00 0.00 175.35 176.11 2o6c s PHE 131 N 1.79 2.08 0.28 4.03 0.08 -1.26 -4.89 117.98 120.10 2o6c s PHE 131 Ca 0.05 0.53 0.01 0.00 0.12 0.00 0.00 56.93 57.64 2o6c s PHE 131 Cb -0.13 -4.30 0.55 0.00 -0.57 0.00 0.00 43.02 38.57 2o6c s PHE 131 CO -0.07 -2.17 1.84 0.93 -0.10 0.00 0.00 175.22 175.64 2o6c h GLU 132 N 12.12 0.97 -0.27 0.44 5.08 -1.99 -1.62 114.58 129.31 2o6c h GLU 132 Ca -0.27 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 2o6c h GLU 132 Cb 1.11 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2o6c h GLU 132 CO 1.17 0.64 0.00 0.39 -1.00 0.00 0.00 179.01 180.22 2o6c n GLU 133 N -4.61 1.89 0.00 2.33 -0.58 -1.26 -5.05 120.64 113.36 2o6c n GLU 133 Ca 0.19 -1.36 0.00 0.00 -0.42 0.00 0.00 57.16 55.57 2o6c n GLU 133 Cb 0.35 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 2o6c n GLU 133 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2o6c n GLY 134 N 1.18 -0.11 3.76 0.62 0.00 -0.61 -4.88 105.19 105.16 2o6c n GLY 134 Ca 0.16 -1.00 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 2o6c n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2o6c s LEU 135 N 0.00 3.89 0.00 0.99 1.43 -1.26 -4.94 118.68 118.79 2o6c s LEU 135 Ca 0.00 2.49 0.00 0.00 -1.03 0.00 0.00 54.13 55.59 2o6c s LEU 135 Cb 0.00 -4.31 0.00 0.00 0.03 0.00 0.00 46.19 41.91 2o6c s LEU 135 CO 0.00 -1.27 0.00 0.61 0.23 0.00 0.00 176.35 175.92 2o6c n GLY 136 N 0.56 -0.19 3.79 -3.19 0.00 -0.37 -5.02 105.19 100.76 2o6c n GLY 136 Ca 0.09 -1.66 -0.36 0.00 0.00 0.00 0.00 46.02 44.10 2o6c n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2o6c s THR 137 N -2.05 5.41 0.13 2.61 2.01 -1.26 -0.87 115.64 121.62 2o6c s THR 137 Ca 0.00 0.29 0.10 0.00 0.31 0.00 0.00 61.69 62.39 2o6c s THR 137 Cb 0.00 -3.49 -0.04 0.00 0.01 0.00 0.00 72.50 68.99 2o6c s THR 137 CO 0.00 0.50 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.88 2o6c s TYR 138 N -0.17 2.11 -0.11 4.92 1.51 0.29 0.17 117.35 126.07 2o6c s TYR 138 Ca 0.13 -0.40 -0.19 0.00 -1.01 0.00 0.00 57.07 55.60 2o6c s TYR 138 Cb -0.12 -1.13 -0.04 0.00 -0.11 0.00 0.00 41.96 40.56 2o6c s TYR 138 CO 0.02 0.31 0.52 0.15 -1.11 0.00 0.00 175.55 175.44 2o6c s LYS 139 N -2.09 4.35 -0.14 -0.62 1.02 0.25 -0.36 119.74 122.14 2o6c s LYS 139 Ca 0.12 0.53 0.00 0.00 0.02 0.00 0.00 55.97 56.65 2o6c s LYS 139 Cb -0.10 -3.45 0.02 0.00 -0.52 0.00 0.00 37.83 33.79 2o6c s LYS 139 CO 0.06 0.12 -0.14 0.08 -0.92 0.00 0.00 175.35 174.55 2o6c s VAL 140 N 0.74 1.51 -0.13 3.17 1.01 0.12 -1.65 120.40 125.17 2o6c s VAL 140 Ca 0.28 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.67 2o6c s VAL 140 Cb -0.16 -1.43 0.02 0.00 0.00 0.00 0.00 36.38 34.82 2o6c s VAL 140 CO 0.12 0.45 -0.14 -0.60 0.00 0.00 0.00 175.10 174.93 2o6c s ARG 141 N 1.49 2.20 -0.20 2.72 3.52 -0.53 -0.66 118.95 127.48 2o6c s ARG 141 Ca 0.04 -0.53 -0.11 0.00 -0.13 0.00 0.00 55.73 55.00 2o6c s ARG 141 Cb -0.13 -1.98 -0.05 0.00 -1.56 0.00 0.00 34.95 31.23 2o6c s ARG 141 CO -0.10 -0.17 0.18 -0.06 -0.81 0.00 0.00 175.30 174.33 2o6c s PHE 142 N 1.32 3.41 -0.18 5.12 0.08 0.11 0.04 117.98 127.88 2o6c s PHE 142 Ca 0.01 0.38 -0.03 0.00 0.12 0.00 0.00 56.93 57.40 2o6c s PHE 142 Cb -0.14 -2.22 -0.02 0.00 -0.57 0.00 0.00 43.02 40.07 2o6c s PHE 142 CO -0.07 0.24 -0.05 -1.21 -0.10 0.00 0.00 175.22 174.04 2o6c s GLU 143 N 0.50 3.52 -0.24 0.44 2.02 0.89 -1.72 118.70 124.11 2o6c s GLU 143 Ca 0.10 -0.58 0.02 0.00 0.02 0.00 0.00 54.97 54.53 2o6c s GLU 143 Cb -0.12 -2.93 0.05 0.00 0.10 0.00 0.00 34.13 31.23 2o6c s GLU 143 CO 0.00 0.06 -0.12 0.42 0.02 0.00 0.00 175.26 175.64 2o6c s ILE 144 N 0.84 2.04 0.04 -1.63 1.01 0.79 -1.69 121.20 122.60 2o6c s ILE 144 Ca -0.01 -1.40 -0.06 0.00 0.00 0.00 0.00 60.65 59.17 2o6c s ILE 144 Cb -0.15 -2.10 -0.05 0.00 0.01 0.00 0.00 42.46 40.17 2o6c s ILE 144 CO 0.02 0.10 0.30 0.00 0.00 0.00 0.00 174.94 175.35 2o6c s ALA 145 N 1.19 3.84 1.01 9.38 0.00 -0.03 -0.44 121.76 136.71 2o6c s ALA 145 Ca -0.05 -0.57 -0.12 0.00 0.00 0.00 0.00 51.96 51.22 2o6c s ALA 145 Cb -0.18 -2.08 0.20 0.00 0.00 0.00 0.00 23.12 21.05 2o6c s ALA 145 CO -0.07 0.66 1.08 0.00 0.00 0.00 0.00 175.76 177.42 2o6c s ALA 146 N -1.39 0.73 0.70 0.00 0.00 -1.26 -1.63 121.76 118.91 2o6c s ALA 146 Ca 0.31 -0.09 -0.16 0.00 0.00 0.00 0.00 51.96 52.02 2o6c s ALA 146 Cb -0.13 -3.22 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 2o6c s ALA 146 CO 0.19 -3.01 0.94 -2.30 0.00 0.00 0.00 175.76 171.59 2o6c n PRO 147 N -4.33 0.58 -1.65 0.00 -0.02 -1.24 -4.48 135.00 123.86 2o6c n PRO 147 Ca 0.06 0.25 -0.35 0.00 -2.02 0.00 0.00 63.50 61.44 2o6c n PRO 147 Cb 0.55 -2.19 0.07 0.00 -0.02 0.00 0.00 33.50 31.91 2o6c n PRO 147 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2o6c s SER 148 N -1.54 4.54 0.25 2.55 0.01 -1.26 -4.89 113.70 113.35 2o6c s SER 148 Ca 0.74 2.43 -0.08 0.00 1.31 0.00 0.00 55.95 60.35 2o6c s SER 148 Cb -0.36 -2.60 0.43 0.00 0.21 0.00 0.00 66.02 63.70 2o6c s SER 148 CO 0.50 -2.04 1.61 -0.74 0.41 0.00 0.00 173.24 172.98 2o6c h HIS 149 N 0.20 -0.23 -0.25 2.43 2.76 -1.92 -0.79 115.15 117.35 2o6c h HIS 149 Ca -0.49 0.07 0.00 0.00 -2.20 0.00 0.00 60.37 57.74 2o6c h HIS 149 Cb 1.31 0.23 0.00 0.00 1.55 0.00 0.00 27.41 30.49 2o6c h HIS 149 CO 0.46 -0.31 0.00 -0.40 -1.30 0.00 0.00 177.93 176.37 2o6c n ASP 150 N -5.45 1.86 -0.00 3.26 5.75 -1.26 -4.18 116.55 116.53 2o6c n ASP 150 Ca 0.14 -1.82 0.09 0.00 -0.01 0.00 0.00 54.79 53.20 2o6c n ASP 150 Cb 0.48 -0.16 -0.12 0.00 -1.03 0.00 0.00 41.12 40.28 2o6c n ASP 150 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2o6c n GLU 151 N 0.47 0.58 -3.47 0.11 -0.58 -0.30 -5.02 120.64 112.42 2o6c n GLU 151 Ca 0.15 -0.06 -0.14 0.00 -0.42 0.00 0.00 57.16 56.69 2o6c n GLU 151 Cb 0.34 -1.44 -0.04 0.00 -0.57 0.00 0.00 31.44 29.73 2o6c n GLU 151 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 2o6c s TYR 152 N -3.02 -0.57 0.14 -0.32 5.04 -1.23 -4.93 117.35 112.47 2o6c s TYR 152 Ca 0.03 0.63 -0.02 0.00 -2.44 0.00 0.00 57.07 55.27 2o6c s TYR 152 Cb 0.14 0.50 -0.04 0.00 0.35 0.00 0.00 41.96 42.91 2o6c s TYR 152 CO 0.81 -0.72 0.08 -1.12 -1.34 0.00 0.00 175.55 173.26 2o6c s SER 153 N -2.09 0.27 -0.02 4.32 0.01 -1.26 -4.90 113.70 110.04 2o6c s SER 153 Ca -0.03 -1.17 0.06 0.00 1.31 0.00 0.00 55.95 56.11 2o6c s SER 153 Cb -0.01 0.31 -0.01 0.00 0.21 0.00 0.00 66.02 66.53 2o6c s SER 153 CO -0.04 -0.75 -0.19 -0.76 0.41 0.00 0.00 173.24 171.91 2o6c s LEU 154 N -3.04 2.02 0.11 2.44 1.43 -1.26 -5.11 118.68 115.27 2o6c s LEU 154 Ca 0.24 -0.35 -0.30 0.00 -1.03 0.00 0.00 54.13 52.69 2o6c s LEU 154 Cb 0.07 -0.99 -0.06 0.00 0.03 0.00 0.00 46.19 45.24 2o6c s LEU 154 CO 0.02 0.22 1.06 -1.00 0.23 0.00 0.00 176.35 176.88 2o6c s HIS 155 N -0.37 3.63 0.00 0.29 3.76 -1.26 -4.91 115.29 116.43 2o6c s HIS 155 Ca 0.05 1.61 0.00 0.00 -0.15 0.00 0.00 55.06 56.58 2o6c s HIS 155 Cb -0.08 -3.22 0.00 0.00 1.11 0.00 0.00 32.58 30.39 2o6c s HIS 155 CO -0.00 -0.43 0.45 0.44 -0.85 0.00 0.00 174.74 174.35 2o6c n ILE 156 N 3.01 0.06 -1.83 0.60 -5.35 -1.26 -0.91 119.36 113.67 2o6c n ILE 156 Ca 0.04 -0.45 -0.33 0.00 -0.27 0.00 0.00 62.75 61.74 2o6c n ILE 156 Cb 0.48 1.12 0.04 0.00 -1.74 0.00 0.00 39.64 39.54 2o6c n ILE 156 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 2o6c s ASP 157 N -0.06 5.19 0.17 7.28 -4.77 -1.26 -4.75 116.67 118.47 2o6c s ASP 157 Ca 0.00 2.03 -0.14 0.00 -3.30 0.00 0.00 52.55 51.14 2o6c s ASP 157 Cb 0.00 -2.56 0.12 0.00 -1.09 0.00 0.00 42.92 39.40 2o6c s ASP 157 CO 0.00 -1.57 1.75 -0.08 0.70 0.00 0.00 175.17 175.97 2o6c h GLU 158 N 0.21 0.32 -0.45 2.11 4.81 -1.96 -1.68 114.58 117.93 2o6c h GLU 158 Ca -0.47 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 58.75 2o6c h GLU 158 Cb 1.25 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 2o6c h GLU 158 CO 0.54 0.21 0.28 0.37 -0.73 0.00 0.00 179.01 179.68 2o6c h GLN 159 N 0.33 0.55 0.00 1.92 5.75 -2.01 -3.35 115.11 118.29 2o6c h GLN 159 Ca 0.21 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.67 2o6c h GLN 159 Cb 0.20 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.63 2o6c h GLN 159 CO -0.21 0.36 0.00 0.25 -2.65 0.00 0.00 178.83 176.58 2o6c n THR 160 N -4.81 0.25 -3.78 2.39 -2.24 -1.19 -5.07 114.28 99.83 2o6c n THR 160 Ca 0.02 -0.61 -0.20 0.00 -2.27 0.00 0.00 64.05 60.99 2o6c n THR 160 Cb 0.05 0.90 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 2o6c n THR 160 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2o6c n GLY 161 N -0.13 2.79 3.39 3.38 0.00 -0.64 -4.88 105.19 109.11 2o6c n GLY 161 Ca 0.00 -2.27 -0.27 0.00 0.00 0.00 0.00 46.02 43.48 2o6c n GLY 161 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2o6c s VAL 162 N -2.12 2.23 -0.12 1.61 -7.23 -0.09 -4.93 120.40 109.75 2o6c s VAL 162 Ca 0.25 -1.87 0.18 0.00 -1.81 0.00 0.00 61.98 58.72 2o6c s VAL 162 Cb -0.02 -2.01 -0.19 0.00 0.56 0.00 0.00 36.38 34.72 2o6c s VAL 162 CO 0.16 -0.04 0.63 -1.54 -0.31 0.00 0.00 175.10 174.00 2o6c n SER 163 N 0.60 0.58 -4.81 4.85 3.41 -1.21 -4.71 113.62 112.33 2o6c n SER 163 Ca -0.15 0.26 -0.31 0.00 -0.26 0.00 0.00 58.87 58.41 2o6c n SER 163 Cb 0.55 0.56 0.07 0.00 -0.26 0.00 0.00 64.21 65.13 2o6c n SER 163 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2o6c s GLY 164 N -4.90 1.65 0.05 5.00 0.00 0.06 -5.04 107.32 104.14 2o6c s GLY 164 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 44.72 44.69 2o6c s GLY 164 CO 0.83 0.36 -0.06 0.50 0.00 0.00 0.00 173.10 174.72 2o6c s ARG 165 N -5.06 0.53 0.66 2.90 1.81 -1.26 -4.80 118.95 113.73 2o6c s ARG 165 Ca 0.59 -0.84 -0.16 0.00 -1.72 0.00 0.00 55.73 53.61 2o6c s ARG 165 Cb -0.15 -0.17 0.00 0.00 -0.45 0.00 0.00 34.95 34.19 2o6c s ARG 165 CO 0.55 0.01 1.17 -0.06 -0.68 0.00 0.00 175.30 176.29 2o6c s PHE 166 N -1.86 2.35 0.45 -0.53 0.08 -1.26 -4.99 117.98 112.22 2o6c s PHE 166 Ca -0.07 1.56 -0.22 0.00 0.12 0.00 0.00 56.93 58.32 2o6c s PHE 166 Cb -0.07 -3.36 -0.09 0.00 -0.57 0.00 0.00 43.02 38.93 2o6c s PHE 166 CO -0.01 -2.15 1.04 1.67 -0.10 0.00 0.00 175.22 175.67 2o6c s TRP 167 N -1.99 3.11 -0.12 0.36 -2.14 -1.26 -5.01 118.94 111.88 2o6c s TRP 167 Ca 0.73 1.60 -0.05 0.00 2.66 0.00 0.00 56.10 61.04 2o6c s TRP 167 Cb -0.26 -3.08 -0.02 0.00 -3.10 0.00 0.00 33.47 27.01 2o6c s TRP 167 CO 0.40 -0.73 -0.09 1.03 -2.66 0.00 0.00 176.95 174.90 2o6c h SER 168 N 1.92 0.00 -3.65 -2.66 0.87 -2.00 -3.40 113.55 104.64 2o6c h SER 168 Ca -0.49 -0.01 -0.51 0.00 -1.23 0.00 0.00 61.79 59.55 2o6c h SER 168 Cb 1.22 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.15 2o6c h SER 168 CO 0.60 0.65 0.31 -1.61 -0.53 0.00 0.00 176.83 176.24 2o6c s GLU 169 N -1.93 4.75 0.31 2.24 0.41 -1.26 -4.80 118.70 118.43 2o6c s GLU 169 Ca -0.08 1.39 -0.28 0.00 -0.41 0.00 0.00 54.97 55.59 2o6c s GLU 169 Cb 0.01 -3.30 -0.13 0.00 -1.78 0.00 0.00 34.13 28.93 2o6c s GLU 169 CO 0.12 0.46 1.15 -2.30 -0.49 0.00 0.00 175.26 174.20 2o6c n PRO 170 N 1.83 1.71 -2.69 0.39 -0.02 -1.26 -4.94 135.00 130.02 2o6c n PRO 170 Ca -0.02 0.60 -0.36 0.00 -2.02 0.00 0.00 63.50 61.70 2o6c n PRO 170 Cb 0.48 -2.07 -0.06 0.00 -0.02 0.00 0.00 33.50 31.83 2o6c n PRO 170 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2o6c s LEU 171 N -0.21 4.23 -0.07 2.45 1.43 0.41 -4.73 118.68 122.20 2o6c s LEU 171 Ca 0.58 1.90 0.05 0.00 -1.03 0.00 0.00 54.13 55.63 2o6c s LEU 171 Cb -0.64 -4.12 -0.01 0.00 0.03 0.00 0.00 46.19 41.44 2o6c s LEU 171 CO 0.61 -0.25 -0.23 -0.69 0.23 0.00 0.00 176.35 176.02 2o6c s VAL 172 N -1.68 2.27 -0.11 -1.59 1.01 -1.26 -0.15 120.40 118.89 2o6c s VAL 172 Ca 0.54 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.54 2o6c s VAL 172 Cb -0.19 -1.84 0.02 0.00 0.00 0.00 0.00 36.38 34.36 2o6c s VAL 172 CO 0.24 0.57 -0.13 0.00 0.00 0.00 0.00 175.10 175.78 2o6c s ALA 173 N -0.16 1.58 0.01 5.51 0.00 -0.70 -4.91 121.76 123.09 2o6c s ALA 173 Ca -0.03 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.26 2o6c s ALA 173 Cb -0.14 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.13 2o6c s ALA 173 CO 0.04 -0.17 -0.04 -2.00 0.00 0.00 0.00 175.76 173.60 2o6c s GLU 174 N 1.17 0.28 -0.08 0.00 2.12 -1.26 0.09 118.70 121.02 2o6c s GLU 174 Ca -0.04 -0.29 0.02 0.00 0.36 0.00 0.00 54.97 55.03 2o6c s GLU 174 Cb -0.14 -0.17 0.01 0.00 0.26 0.00 0.00 34.13 34.09 2o6c s GLU 174 CO -0.04 0.04 -0.13 -1.58 -0.54 0.00 0.00 175.26 173.01 2o6c s TRP 175 N -0.51 1.59 -0.21 5.30 0.51 0.16 -5.00 118.94 120.78 2o6c s TRP 175 Ca -0.04 -0.64 0.22 0.00 -2.12 0.00 0.00 56.10 53.53 2o6c s TRP 175 Cb -0.04 -1.17 -0.07 0.00 -0.81 0.00 0.00 33.47 31.38 2o6c s TRP 175 CO -0.00 -0.34 0.92 -0.25 -0.51 0.00 0.00 176.95 176.77 2o6c n ASP 176 N 3.97 0.65 -2.72 2.95 8.00 -1.26 0.16 116.55 128.30 2o6c n ASP 176 Ca -0.21 0.23 -0.22 0.00 0.71 0.00 0.00 54.79 55.30 2o6c n ASP 176 Cb 0.52 0.81 -0.01 0.00 -0.02 0.00 0.00 41.12 42.42 2o6c n ASP 176 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2o6c n ASP 177 N -2.55 3.39 -4.67 -2.24 8.00 -1.23 -3.95 116.55 113.30 2o6c n ASP 177 Ca -0.01 -3.38 -0.42 0.00 0.71 0.00 0.00 54.79 51.68 2o6c n ASP 177 Cb 0.55 -0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 41.10 2o6c n ASP 177 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2o6c s PHE 178 N -3.28 3.41 -0.41 1.24 5.36 0.51 -4.80 117.98 120.01 2o6c s PHE 178 Ca 0.42 1.45 -0.16 0.00 -0.96 0.00 0.00 56.93 57.68 2o6c s PHE 178 Cb 0.38 -3.19 0.02 0.00 -0.34 0.00 0.00 43.02 39.89 2o6c s PHE 178 CO -0.11 -0.35 0.36 -1.21 -1.46 0.00 0.00 175.22 172.45 2o6c s GLU 179 N 2.61 3.09 -0.41 10.12 2.02 -1.26 0.10 118.70 134.98 2o6c s GLU 179 Ca 0.44 -0.85 -0.15 0.00 0.02 0.00 0.00 54.97 54.43 2o6c s GLU 179 Cb -0.16 -3.95 0.02 0.00 0.10 0.00 0.00 34.13 30.13 2o6c s GLU 179 CO 0.11 -0.76 0.30 -0.46 0.02 0.00 0.00 175.26 174.47 2o6c s TRP 180 N 1.90 3.24 -0.65 1.61 -0.11 -0.05 -4.91 118.94 119.97 2o6c s TRP 180 Ca 0.09 -0.56 0.08 0.00 1.22 0.00 0.00 56.10 56.93 2o6c s TRP 180 Cb -0.18 -2.59 0.22 0.00 -1.50 0.00 0.00 33.47 29.42 2o6c s TRP 180 CO 0.12 -0.58 1.19 1.63 -4.62 0.00 0.00 176.95 174.68 2o6c n LYS 181 N 5.17 2.90 0.00 5.86 4.01 -1.26 -1.24 118.16 133.60 2o6c n LYS 181 Ca -0.11 -1.91 0.00 0.00 -0.51 0.00 0.00 58.31 55.78 2o6c n LYS 181 Cb 0.47 -1.20 0.00 0.00 -0.51 0.00 0.00 35.03 33.79 2o6c n LYS 181 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2o6c n GLY 182 N 0.21 0.85 3.62 0.72 0.00 -1.26 -4.99 105.19 104.33 2o6c n GLY 182 Ca 0.09 -2.08 -0.45 0.00 0.00 0.00 0.00 46.02 43.57 2o6c n GLY 182 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2o6c n PRO 183 N 0.71 1.56 -1.29 1.61 -0.02 -1.26 -4.91 135.00 131.40 2o6c n PRO 183 Ca 0.00 0.55 -0.14 0.00 -2.02 0.00 0.00 63.50 61.89 2o6c n PRO 183 Cb 0.00 -2.05 0.12 0.00 -0.02 0.00 0.00 33.50 31.55 2o6c n PRO 183 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2o6c n GLN 184 N 1.30 2.55 0.00 -0.52 1.13 -1.26 -5.21 117.38 115.38 2o6c n GLN 184 Ca 0.11 -3.57 0.00 0.00 -1.94 0.00 0.00 57.00 51.60 2o6c n GLN 184 Cb 0.30 -2.02 0.00 0.00 0.11 0.00 0.00 30.24 28.63 2o6c n GLN 184 CO 0.00 0.00 0.00 -2.67 -1.44 0.00 0.00 177.06 172.95