#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6i n SER 8 N 0.00 3.47 -0.17 9.51 2.88 -1.26 -4.92 113.62 123.14 3h6i n SER 8 Ca 0.00 0.50 -0.10 0.00 -1.33 0.00 0.00 58.87 57.95 3h6i n SER 8 Cb 0.00 -1.51 0.03 0.00 -0.75 0.00 0.00 64.21 61.98 3h6i n SER 8 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3h6i h PRO 9 N 12.97 0.99 -0.59 -1.46 0.13 -2.05 -2.16 132.00 139.84 3h6i h PRO 9 Ca -0.43 -0.38 -0.08 0.00 -0.87 0.00 0.00 66.00 64.24 3h6i h PRO 9 Cb 1.25 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 3h6i h PRO 9 CO 0.96 1.05 0.04 0.93 -0.23 0.00 0.00 178.00 180.75 3h6i h GLU 10 N 0.88 0.99 0.15 0.86 4.39 -1.99 -2.52 114.58 117.34 3h6i h GLU 10 Ca 0.13 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.54 3h6i h GLU 10 Cb 0.69 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 3h6i h GLU 10 CO 0.05 0.95 -0.07 0.37 -1.16 0.00 0.00 179.01 179.15 3h6i h GLN 11 N 0.92 -0.20 -1.00 2.33 4.15 -1.95 -2.98 115.11 116.38 3h6i h GLN 11 Ca 0.17 0.01 0.15 0.00 0.77 0.00 0.00 58.65 59.76 3h6i h GLN 11 Cb 0.49 0.04 -0.09 0.00 0.21 0.00 0.00 27.48 28.13 3h6i h GLN 11 CO 0.02 0.24 0.62 0.00 -1.93 0.00 0.00 178.83 177.79 3h6i h ALA 12 N -0.17 1.61 0.00 3.38 0.00 -1.46 -0.96 119.26 121.65 3h6i h ALA 12 Ca -0.02 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3h6i h ALA 12 Cb 0.53 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3h6i h ALA 12 CO 0.03 0.09 -0.42 1.98 0.00 0.00 0.00 179.25 180.93 3h6i h MET 13 N 0.88 0.00 0.23 0.00 4.05 -1.49 -2.23 114.93 116.37 3h6i h MET 13 Ca 0.53 0.00 -0.33 0.00 -0.28 0.00 0.00 59.70 59.63 3h6i h MET 13 Cb 0.69 0.00 0.03 0.00 -0.80 0.00 0.00 31.60 31.52 3h6i h MET 13 CO -0.31 0.42 -1.46 -0.09 0.23 0.00 0.00 176.91 175.69 3h6i h ARG 14 N 0.00 0.49 -0.27 0.39 2.43 -1.04 -2.74 114.38 113.63 3h6i h ARG 14 Ca -0.00 -0.83 -0.13 0.00 -0.81 0.00 0.00 59.98 58.21 3h6i h ARG 14 Cb 0.82 0.31 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 3h6i h ARG 14 CO 0.05 1.39 -0.37 0.93 -1.51 0.00 0.00 179.97 180.47 3h6i h GLU 15 N 0.13 0.62 -0.39 0.20 5.08 -1.32 -1.65 114.58 117.27 3h6i h GLU 15 Ca -0.24 -0.30 -0.16 0.00 -1.00 0.00 0.00 59.36 57.66 3h6i h GLU 15 Cb 2.13 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.38 3h6i h GLU 15 CO 0.26 0.89 -0.38 0.00 -1.00 0.00 0.00 179.01 178.78 3h6i h ARG 16 N 0.52 0.93 -0.83 2.33 3.08 -1.51 -1.72 114.38 117.18 3h6i h ARG 16 Ca 0.05 -0.48 -0.00 0.00 0.07 0.00 0.00 59.98 59.61 3h6i h ARG 16 Cb 0.87 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.90 3h6i h ARG 16 CO 0.08 1.14 0.51 0.77 -1.07 0.00 0.00 179.97 181.39 3h6i h SER 17 N 0.76 0.99 -0.38 7.04 0.02 -1.30 -2.34 113.55 118.33 3h6i h SER 17 Ca 0.06 -0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 3h6i h SER 17 Cb 0.97 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 3h6i h SER 17 CO 0.09 0.76 -0.27 -0.33 -1.14 0.00 0.00 176.83 175.94 3h6i h GLU 18 N 1.13 0.85 -0.76 3.45 5.08 -1.12 -0.69 114.58 122.52 3h6i h GLU 18 Ca 0.30 -0.41 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3h6i h GLU 18 Cb -0.06 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.14 3h6i h GLU 18 CO -0.06 1.05 0.48 1.25 -1.00 0.00 0.00 179.01 180.73 3h6i h LEU 19 N 0.65 0.79 -0.01 1.33 6.46 -1.09 -0.54 115.31 122.90 3h6i h LEU 19 Ca 0.07 -0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.82 3h6i h LEU 19 Cb 0.84 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 40.60 3h6i h LEU 19 CO 0.07 0.55 -0.02 0.00 -0.62 0.00 0.00 178.44 178.41 3h6i h ALA 20 N 1.32 0.02 -0.87 1.25 0.00 -1.32 -2.84 119.26 116.83 3h6i h ALA 20 Ca 0.31 -0.29 0.09 0.00 0.00 0.00 0.00 54.91 55.02 3h6i h ALA 20 Cb 0.02 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.73 3h6i h ALA 20 CO -0.11 -0.18 0.51 -0.09 0.00 0.00 0.00 179.25 179.38 3h6i h ARG 21 N -0.51 0.84 -0.34 0.00 2.43 -0.86 -1.76 114.38 114.18 3h6i h ARG 21 Ca 0.00 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.00 3h6i h ARG 21 Cb 0.59 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 3h6i h ARG 21 CO 0.01 0.55 -0.28 0.87 -1.51 0.00 0.00 179.97 179.61 3h6i h LYS 22 N 0.86 0.71 -0.25 0.20 1.57 -1.14 -0.70 116.57 117.84 3h6i h LYS 22 Ca 0.41 -0.31 -0.13 0.00 -1.87 0.00 0.00 60.65 58.76 3h6i h LYS 22 Cb 0.36 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 3h6i h LYS 22 CO -0.24 0.91 -0.37 0.78 -0.57 0.00 0.00 179.45 179.96 3h6i h GLY 23 N 0.97 0.61 1.16 3.86 0.00 -1.17 -1.98 103.07 106.52 3h6i h GLY 23 Ca 0.08 -0.58 -0.21 0.00 0.00 0.00 0.00 47.33 46.61 3h6i h GLY 23 CO 0.06 0.53 -0.69 -2.22 0.00 0.00 0.00 176.54 174.22 3h6i h ILE 24 N 0.47 1.27 0.00 2.60 2.04 -1.19 -3.03 117.51 119.68 3h6i h ILE 24 Ca 0.05 -1.88 -0.04 0.00 1.00 0.00 0.00 64.86 63.98 3h6i h ILE 24 Cb 0.86 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 3h6i h ILE 24 CO 0.07 0.60 -0.20 0.00 0.00 0.00 0.00 178.15 178.63 3h6i h ALA 25 N 0.60 1.61 0.00 1.87 0.00 -0.99 -0.87 119.26 121.48 3h6i h ALA 25 Ca -0.03 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 3h6i h ALA 25 Cb 1.32 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 3h6i h ALA 25 CO 0.15 0.25 -0.29 -0.09 0.00 0.00 0.00 179.25 179.26 3h6i h ARG 26 N 0.00 0.00 -7.13 0.00 2.43 -1.31 -3.32 114.38 105.05 3h6i h ARG 26 Ca -0.00 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 58.68 3h6i h ARG 26 Cb 0.36 0.00 0.05 0.00 -0.42 0.00 0.00 29.97 29.96 3h6i h ARG 26 CO 0.03 0.29 0.21 0.00 -1.51 0.00 0.00 179.97 178.98 3h6i s ALA 27 N -3.19 3.27 0.88 2.80 0.00 -0.91 -4.92 121.76 119.68 3h6i s ALA 27 Ca 0.04 -0.55 -0.11 0.00 0.00 0.00 0.00 51.96 51.34 3h6i s ALA 27 Cb 0.07 -2.69 0.12 0.00 0.00 0.00 0.00 23.12 20.63 3h6i s ALA 27 CO 0.70 -0.71 1.11 0.15 0.00 0.00 0.00 175.76 177.01 3h6i s LYS 28 N -4.98 1.32 0.17 0.00 -0.14 -1.26 -1.88 119.74 112.97 3h6i s LYS 28 Ca 0.53 1.30 -0.03 0.00 -1.36 0.00 0.00 55.97 56.40 3h6i s LYS 28 Cb -0.11 -1.78 -0.05 0.00 -1.68 0.00 0.00 37.83 34.21 3h6i s LYS 28 CO 0.47 -2.34 0.38 -1.12 -0.76 0.00 0.00 175.35 171.98 3h6i s SER 29 N -2.98 6.44 0.01 2.83 0.01 -1.26 -4.14 113.70 114.60 3h6i s SER 29 Ca 0.65 0.51 0.03 0.00 1.31 0.00 0.00 55.95 58.44 3h6i s SER 29 Cb -0.20 -2.06 -0.01 0.00 0.21 0.00 0.00 66.02 63.96 3h6i s SER 29 CO 0.58 0.01 -0.08 -0.69 0.41 0.00 0.00 173.24 173.46 3h6i s VAL 30 N -1.75 0.64 -0.03 3.43 1.01 0.12 -2.15 120.40 121.67 3h6i s VAL 30 Ca 0.40 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.91 3h6i s VAL 30 Cb -0.12 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.69 3h6i s VAL 30 CO 0.27 0.08 -0.11 -0.69 0.00 0.00 0.00 175.10 174.64 3h6i s VAL 31 N -0.41 0.95 -0.08 2.92 1.01 0.18 -0.24 120.40 124.72 3h6i s VAL 31 Ca 0.01 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3h6i s VAL 31 Cb -0.04 -0.83 0.02 0.00 0.00 0.00 0.00 36.38 35.52 3h6i s VAL 31 CO -0.00 0.29 -0.09 0.00 0.00 0.00 0.00 175.10 175.29 3h6i s ALA 32 N 0.12 1.23 0.02 5.51 0.00 -0.28 -0.94 121.76 127.42 3h6i s ALA 32 Ca -0.03 -0.44 -0.03 0.00 0.00 0.00 0.00 51.96 51.47 3h6i s ALA 32 Cb -0.09 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 3h6i s ALA 32 CO 0.01 -0.14 0.03 -0.48 0.00 0.00 0.00 175.76 175.17 3h6i s LEU 33 N 1.17 2.04 0.07 0.00 0.05 0.07 -0.50 118.68 121.60 3h6i s LEU 33 Ca -0.05 -0.50 -0.28 0.00 0.05 0.00 0.00 54.13 53.35 3h6i s LEU 33 Cb -0.14 0.32 -0.05 0.00 -2.05 0.00 0.00 46.19 44.27 3h6i s LEU 33 CO -0.02 -0.39 0.87 0.00 -0.55 0.00 0.00 176.35 176.26 3h6i s ALA 34 N -1.93 3.30 0.00 1.48 0.00 -0.79 -0.72 121.76 123.09 3h6i s ALA 34 Ca -0.11 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.28 3h6i s ALA 34 Cb -0.06 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.91 3h6i s ALA 34 CO -0.02 0.00 0.00 2.48 0.00 0.00 0.00 175.76 178.22 3h6i n TYR 35 N 2.87 0.00 0.01 0.00 0.18 -0.66 -4.78 117.16 114.78 3h6i n TYR 35 Ca 0.00 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.66 3h6i n TYR 35 Cb 0.50 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.37 3h6i n TYR 35 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3h6i h ALA 36 N 1.00 -0.01 -0.14 -3.48 0.00 -1.38 -3.24 119.26 112.01 3h6i h ALA 36 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3h6i h ALA 36 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3h6i h ALA 36 CO 0.00 -0.35 0.00 0.41 0.00 0.00 0.00 179.25 179.31 3h6i n GLY 37 N -0.23 -0.14 0.00 0.00 0.00 -1.26 -5.01 105.19 98.55 3h6i n GLY 37 Ca -0.08 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3h6i n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6i n GLY 38 N 0.94 0.33 3.26 -0.02 0.00 -1.22 -0.86 105.19 107.62 3h6i n GLY 38 Ca 0.12 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.22 3h6i n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h6i s VAL 39 N 0.00 1.70 -0.07 1.61 1.01 -0.87 -1.66 120.40 122.12 3h6i s VAL 39 Ca 0.00 -1.28 0.04 0.00 0.00 0.00 0.00 61.98 60.75 3h6i s VAL 39 Cb 0.00 -1.49 -0.00 0.00 0.00 0.00 0.00 36.38 34.89 3h6i s VAL 39 CO 0.00 0.16 -0.21 -0.22 0.00 0.00 0.00 175.10 174.83 3h6i s LEU 40 N -1.33 1.98 -0.11 3.92 2.96 0.10 -1.05 118.68 125.15 3h6i s LEU 40 Ca 0.07 -0.47 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 3h6i s LEU 40 Cb -0.09 -1.22 -0.01 0.00 0.50 0.00 0.00 46.19 45.37 3h6i s LEU 40 CO 0.02 0.16 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.67 3h6i s PHE 41 N 0.20 2.68 -0.05 5.38 0.08 0.10 -0.75 117.98 125.63 3h6i s PHE 41 Ca -0.11 -0.82 -0.01 0.00 0.12 0.00 0.00 56.93 56.11 3h6i s PHE 41 Cb -0.15 -1.77 0.03 0.00 -0.57 0.00 0.00 43.02 40.56 3h6i s PHE 41 CO 0.05 -0.30 0.02 0.08 -0.10 0.00 0.00 175.22 174.98 3h6i s VAL 42 N 0.30 0.17 0.04 -0.44 1.01 -0.12 -1.59 120.40 119.77 3h6i s VAL 42 Ca -0.14 0.19 0.03 0.00 0.00 0.00 0.00 61.98 62.06 3h6i s VAL 42 Cb -0.17 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.86 3h6i s VAL 42 CO 0.07 0.19 -0.10 0.00 0.00 0.00 0.00 175.10 175.26 3h6i s ALA 43 N 1.64 0.80 -0.46 5.51 0.00 -0.48 -0.65 121.76 128.13 3h6i s ALA 43 Ca -0.01 -0.77 -0.29 0.00 0.00 0.00 0.00 51.96 50.89 3h6i s ALA 43 Cb -0.13 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 22.97 3h6i s ALA 43 CO -0.03 0.08 1.24 -1.21 0.00 0.00 0.00 175.76 175.84 3h6i s GLU 44 N -1.37 3.66 -0.26 0.00 2.02 -0.91 -1.33 118.70 120.50 3h6i s GLU 44 Ca -0.05 0.68 -0.02 0.00 0.02 0.00 0.00 54.97 55.61 3h6i s GLU 44 Cb -0.09 -3.95 0.12 0.00 0.10 0.00 0.00 34.13 30.31 3h6i s GLU 44 CO 0.01 -1.46 0.28 1.21 0.02 0.00 0.00 175.26 175.31 3h6i s ASN 45 N 3.02 1.49 0.43 -0.19 2.47 0.11 -4.69 114.94 117.56 3h6i s ASN 45 Ca 0.53 -0.51 0.22 0.00 0.42 0.00 0.00 52.86 53.52 3h6i s ASN 45 Cb -0.09 0.52 0.91 0.00 -1.45 0.00 0.00 41.25 41.13 3h6i s ASN 45 CO 0.32 -0.36 1.83 1.55 -3.72 0.00 0.00 177.10 176.72 3h6i h PRO 46 N 8.27 0.00 -6.94 0.43 0.13 -1.79 -3.30 132.00 128.79 3h6i h PRO 46 Ca -0.15 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.47 3h6i h PRO 46 Cb 1.10 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.28 3h6i h PRO 46 CO 0.32 0.27 0.49 0.45 -0.23 0.00 0.00 178.00 179.30 3h6i s SER 47 N -6.31 6.56 0.05 1.44 0.15 -1.26 -4.82 113.70 109.50 3h6i s SER 47 Ca -0.00 2.31 0.22 0.00 0.70 0.00 0.00 55.95 59.18 3h6i s SER 47 Cb 0.11 -2.61 -0.09 0.00 -1.71 0.00 0.00 66.02 61.72 3h6i s SER 47 CO 0.65 -0.65 0.87 -2.11 1.20 0.00 0.00 173.24 173.20 3h6i n ARG 48 N 0.08 0.41 0.00 5.44 1.85 -1.26 -4.59 116.66 118.59 3h6i n ARG 48 Ca 0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 57.85 56.86 3h6i n ARG 48 Cb 0.47 -1.60 0.00 0.00 -1.05 0.00 0.00 32.46 30.28 3h6i n ARG 48 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 3h6i n SER 49 N -2.11 4.78 -4.41 2.89 3.41 -1.26 -4.94 113.62 111.98 3h6i n SER 49 Ca 0.00 0.00 -0.45 0.00 -0.26 0.00 0.00 58.87 58.17 3h6i n SER 49 Cb 0.48 0.69 -0.03 0.00 -0.26 0.00 0.00 64.21 65.09 3h6i n SER 49 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h6i s LEU 50 N -3.42 5.37 0.20 1.04 1.43 -1.26 -5.03 118.68 117.01 3h6i s LEU 50 Ca 0.00 -1.85 -0.29 0.00 -1.03 0.00 0.00 54.13 50.97 3h6i s LEU 50 Cb 0.00 -2.34 -0.08 0.00 0.03 0.00 0.00 46.19 43.80 3h6i s LEU 50 CO 0.00 -1.04 0.90 -1.10 0.23 0.00 0.00 176.35 175.34 3h6i s GLN 51 N 2.42 4.77 -0.01 1.70 -0.21 -1.26 -4.84 119.66 122.22 3h6i s GLN 51 Ca 0.22 1.40 0.13 0.00 0.02 0.00 0.00 55.36 57.14 3h6i s GLN 51 Cb -0.13 -3.29 -0.18 0.00 1.00 0.00 0.00 33.01 30.41 3h6i s GLN 51 CO -0.02 0.49 0.44 1.63 -2.12 0.00 0.00 175.29 175.70 3h6i n LYS 52 N 1.71 1.60 -5.14 2.91 5.02 -1.26 -4.97 118.16 118.03 3h6i n LYS 52 Ca -0.02 -0.06 -0.31 0.00 -2.02 0.00 0.00 58.31 55.90 3h6i n LYS 52 Cb 0.48 -1.22 -0.15 0.00 -0.02 0.00 0.00 35.03 34.12 3h6i n LYS 52 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3h6i s ILE 53 N -2.57 2.09 0.04 -0.18 1.01 -1.26 -1.02 121.20 119.30 3h6i s ILE 53 Ca 0.00 -1.23 -0.27 0.00 0.00 0.00 0.00 60.65 59.16 3h6i s ILE 53 Cb 0.09 -1.75 0.08 0.00 0.01 0.00 0.00 42.46 40.89 3h6i s ILE 53 CO 0.55 0.49 0.70 -0.55 0.00 0.00 0.00 174.94 176.13 3h6i s SER 54 N -0.87 -0.55 0.31 3.58 0.15 0.89 -4.99 113.70 112.22 3h6i s SER 54 Ca 0.11 0.27 -0.29 0.00 0.70 0.00 0.00 55.95 56.74 3h6i s SER 54 Cb -0.10 0.53 -0.10 0.00 -1.71 0.00 0.00 66.02 64.64 3h6i s SER 54 CO 0.00 -0.75 1.14 -0.70 1.20 0.00 0.00 173.24 174.13 3h6i s GLU 55 N -2.62 4.52 -0.09 5.44 2.12 -1.26 0.17 118.70 126.98 3h6i s GLU 55 Ca -0.03 1.87 -0.08 0.00 0.36 0.00 0.00 54.97 57.09 3h6i s GLU 55 Cb -0.01 -3.09 -0.04 0.00 0.26 0.00 0.00 34.13 31.25 3h6i s GLU 55 CO -0.04 0.08 -0.18 1.28 -0.54 0.00 0.00 175.26 175.87 3h6i n LEU 56 N 0.96 1.26 0.00 2.70 4.77 -0.45 -4.80 117.00 121.44 3h6i n LEU 56 Ca -0.00 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 3h6i n LEU 56 Cb 0.45 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 3h6i n LEU 56 CO 0.54 -0.13 0.00 0.00 -1.33 0.00 0.00 177.39 176.47 3h6i n TYR 57 N -3.80 -0.28 -0.07 -1.77 9.36 -0.99 -4.76 117.16 114.85 3h6i n TYR 57 Ca -0.17 0.00 -0.08 0.00 3.32 0.00 0.00 57.90 60.97 3h6i n TYR 57 Cb 0.47 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 39.17 3h6i n TYR 57 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 3h6i h ASP 58 N 0.00 0.18 -0.04 2.98 3.32 -1.94 -3.04 116.42 117.87 3h6i h ASP 58 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3h6i h ASP 58 Cb 0.00 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3h6i h ASP 58 CO 0.00 0.14 0.00 0.54 -1.72 0.00 0.00 179.24 178.20 3h6i n ARG 59 N -4.99 0.98 -4.33 3.56 5.12 -1.26 -0.75 116.66 114.99 3h6i n ARG 59 Ca -0.01 -1.35 -0.34 0.00 -1.93 0.00 0.00 57.85 54.21 3h6i n ARG 59 Cb 0.07 -1.26 -0.11 0.00 -1.16 0.00 0.00 32.46 30.00 3h6i n ARG 59 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3h6i s VAL 60 N -1.12 4.15 0.34 1.55 1.01 -1.15 -2.51 120.40 122.68 3h6i s VAL 60 Ca 0.16 -0.28 0.09 0.00 0.00 0.00 0.00 61.98 61.96 3h6i s VAL 60 Cb 0.11 -2.81 -0.06 0.00 0.00 0.00 0.00 36.38 33.63 3h6i s VAL 60 CO 0.17 0.52 -0.02 -0.83 0.00 0.00 0.00 175.10 174.94 3h6i s GLY 61 N -0.01 2.08 0.02 4.51 0.00 0.37 -1.34 107.32 112.96 3h6i s GLY 61 Ca 0.02 -1.98 0.03 0.00 0.00 0.00 0.00 44.72 42.79 3h6i s GLY 61 CO 0.02 -1.93 -0.09 -0.12 0.00 0.00 0.00 173.10 170.98 3h6i s PHE 62 N -2.53 0.80 -0.16 1.90 2.19 0.13 -1.71 117.98 118.59 3h6i s PHE 62 Ca 0.34 -0.29 -0.13 0.00 0.33 0.00 0.00 56.93 57.18 3h6i s PHE 62 Cb 0.00 -0.49 0.05 0.00 -1.31 0.00 0.00 43.02 41.27 3h6i s PHE 62 CO 0.18 -0.02 0.42 0.00 1.83 0.00 0.00 175.22 177.64 3h6i s ALA 63 N -0.70 -1.05 0.11 11.12 0.00 -0.55 -0.07 121.76 130.61 3h6i s ALA 63 Ca -0.01 1.29 -0.02 0.00 0.00 0.00 0.00 51.96 53.22 3h6i s ALA 63 Cb -0.06 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 22.26 3h6i s ALA 63 CO 0.00 -0.22 0.05 0.00 0.00 0.00 0.00 175.76 175.59 3h6i s ALA 64 N 0.54 0.67 -0.00 0.00 0.00 -0.19 -0.35 121.76 122.42 3h6i s ALA 64 Ca -0.03 -1.33 0.01 0.00 0.00 0.00 0.00 51.96 50.62 3h6i s ALA 64 Cb -0.04 0.67 -0.00 0.00 0.00 0.00 0.00 23.12 23.75 3h6i s ALA 64 CO -0.03 -0.46 -0.04 0.00 0.00 0.00 0.00 175.76 175.22 3h6i s ALA 65 N -4.00 0.36 0.00 0.00 0.00 -0.35 -4.85 121.76 112.92 3h6i s ALA 65 Ca 0.18 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.94 3h6i s ALA 65 Cb 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.11 3h6i s ALA 65 CO -0.02 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.23 3h6i n GLY 66 N 2.93 0.59 3.64 0.00 0.00 -1.26 -0.93 105.19 110.16 3h6i n GLY 66 Ca -0.13 -1.62 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 3h6i n GLY 66 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h6i s LYS 67 N -1.64 4.04 0.12 1.61 2.20 -0.30 -4.90 119.74 120.87 3h6i s LYS 67 Ca 0.00 1.24 -0.29 0.00 -0.36 0.00 0.00 55.97 56.56 3h6i s LYS 67 Cb 0.00 -3.79 -0.10 0.00 -1.51 0.00 0.00 37.83 32.44 3h6i s LYS 67 CO 0.00 -0.94 1.48 0.35 -0.36 0.00 0.00 175.35 175.88 3h6i h PHE 68 N 8.52 -1.53 -1.15 4.03 3.57 -1.96 -1.75 116.94 126.68 3h6i h PHE 68 Ca -0.23 0.08 0.32 0.00 3.53 0.00 0.00 57.97 61.67 3h6i h PHE 68 Cb 1.08 0.72 -0.08 0.00 2.79 0.00 0.00 35.95 40.46 3h6i h PHE 68 CO 0.84 -0.43 0.78 -2.95 -2.23 0.00 0.00 178.31 174.33 3h6i h ASN 69 N -0.33 0.23 0.13 0.41 7.08 -1.99 0.12 115.58 121.24 3h6i h ASN 69 Ca 0.07 0.05 -0.19 0.00 -3.08 0.00 0.00 56.30 53.16 3h6i h ASN 69 Cb 0.51 0.02 0.02 0.00 -2.08 0.00 0.00 38.32 36.80 3h6i h ASN 69 CO -0.55 0.02 -0.81 -0.33 -2.08 0.00 0.00 177.43 173.68 3h6i h GLU 70 N 0.19 0.32 0.00 4.14 5.08 -1.75 -2.95 114.58 119.60 3h6i h GLU 70 Ca 0.61 -0.52 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 3h6i h GLU 70 Cb 1.98 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 31.41 3h6i h GLU 70 CO -0.19 1.24 -0.26 0.27 -1.00 0.00 0.00 179.01 179.08 3h6i h PHE 71 N -0.34 0.00 -0.26 4.33 -5.15 -0.60 -2.78 116.94 112.14 3h6i h PHE 71 Ca -0.14 0.00 -0.17 0.00 -0.20 0.00 0.00 57.97 57.46 3h6i h PHE 71 Cb 1.63 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.80 3h6i h PHE 71 CO 0.19 0.26 -0.52 0.22 -2.00 0.00 0.00 178.31 176.46 3h6i h ASP 72 N 0.00 0.83 -0.96 -0.68 3.58 -0.90 -0.21 116.42 118.08 3h6i h ASP 72 Ca -0.00 -0.43 0.02 0.00 0.42 0.00 0.00 57.03 57.03 3h6i h ASP 72 Cb 1.15 -0.24 -0.05 0.00 1.72 0.00 0.00 39.33 41.92 3h6i h ASP 72 CO 0.03 1.20 0.63 -1.13 -2.88 0.00 0.00 179.24 177.09 3h6i h ASN 73 N 0.59 1.07 0.61 2.28 -1.24 -1.41 -0.45 115.58 117.03 3h6i h ASN 73 Ca 0.02 -0.02 -0.16 0.00 0.71 0.00 0.00 56.30 56.84 3h6i h ASN 73 Cb 1.10 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 39.87 3h6i h ASN 73 CO 0.11 0.76 -0.75 -0.07 -1.29 0.00 0.00 177.43 176.19 3h6i h LEU 74 N 1.26 0.13 -0.37 0.34 3.38 -1.23 -1.39 115.31 117.43 3h6i h LEU 74 Ca 0.36 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 58.17 3h6i h LEU 74 Cb -0.08 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3h6i h LEU 74 CO -0.10 0.83 -0.03 -0.09 0.09 0.00 0.00 178.44 179.15 3h6i h ARG 75 N 0.07 0.67 -0.50 1.13 2.43 -0.00 -0.44 114.38 117.73 3h6i h ARG 75 Ca -0.02 -0.23 -0.07 0.00 -0.81 0.00 0.00 59.98 58.86 3h6i h ARG 75 Cb 1.32 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.79 3h6i h ARG 75 CO 0.11 0.79 0.06 0.00 -1.51 0.00 0.00 179.97 179.41 3h6i h ARG 76 N 0.48 0.84 -0.41 0.20 3.08 -1.07 -1.42 114.38 116.08 3h6i h ARG 76 Ca 0.10 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 59.83 3h6i h ARG 76 Cb 0.51 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 3h6i h ARG 76 CO 0.02 0.85 -0.06 0.78 -1.07 0.00 0.00 179.97 180.49 3h6i h GLY 77 N 0.71 0.75 1.30 0.04 0.00 -1.15 -0.66 103.07 104.06 3h6i h GLY 77 Ca 0.15 -0.52 -0.17 0.00 0.00 0.00 0.00 47.33 46.79 3h6i h GLY 77 CO 0.01 0.48 -0.51 -1.33 0.00 0.00 0.00 176.54 175.19 3h6i h GLY 78 N 0.96 0.81 0.99 4.60 0.00 -0.80 -1.22 103.07 108.40 3h6i h GLY 78 Ca 0.12 -0.92 -0.06 0.00 0.00 0.00 0.00 47.33 46.48 3h6i h GLY 78 CO 0.03 0.82 0.10 -2.22 0.00 0.00 0.00 176.54 175.27 3h6i h ILE 79 N 0.58 1.25 -0.43 2.60 2.04 -0.78 -0.72 117.51 122.05 3h6i h ILE 79 Ca 0.02 -0.90 0.01 0.00 1.00 0.00 0.00 64.86 64.99 3h6i h ILE 79 Cb 1.08 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 3h6i h ILE 79 CO 0.11 0.32 0.28 -0.61 0.00 0.00 0.00 178.15 178.25 3h6i h GLN 80 N 0.73 0.54 -0.00 2.37 5.75 -1.00 -1.71 115.11 121.80 3h6i h GLN 80 Ca 0.16 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.63 3h6i h GLN 80 Cb 0.37 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 28.80 3h6i h GLN 80 CO 0.01 0.36 0.00 0.35 -2.65 0.00 0.00 178.83 176.90 3h6i h PHE 81 N 0.56 0.00 -0.67 3.99 3.57 -1.02 -1.86 116.94 121.51 3h6i h PHE 81 Ca 0.16 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 3h6i h PHE 81 Cb -0.04 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 3h6i h PHE 81 CO -0.05 0.17 0.38 0.00 -2.23 0.00 0.00 178.31 176.58 3h6i h ALA 82 N 0.84 0.86 -0.43 2.41 0.00 -1.01 -0.58 119.26 121.35 3h6i h ALA 82 Ca 0.00 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 3h6i h ALA 82 Cb 0.16 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3h6i h ALA 82 CO -0.00 0.36 -0.22 -0.44 0.00 0.00 0.00 179.25 178.95 3h6i h ASP 83 N 0.92 0.88 -0.44 0.00 3.32 -1.23 -0.26 116.42 119.61 3h6i h ASP 83 Ca 0.24 -0.32 -0.09 0.00 0.02 0.00 0.00 57.03 56.87 3h6i h ASP 83 Cb 0.01 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 3h6i h ASP 83 CO -0.04 1.07 -0.09 0.74 -1.72 0.00 0.00 179.24 179.20 3h6i h THR 84 N 0.75 1.27 -0.27 0.35 2.02 -1.15 -1.76 112.91 114.13 3h6i h THR 84 Ca 0.10 -1.19 -0.06 0.00 0.77 0.00 0.00 66.41 66.03 3h6i h THR 84 Cb 0.75 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 3h6i h THR 84 CO 0.06 0.41 -0.07 0.03 0.37 0.00 0.00 175.52 176.32 3h6i h ARG 85 N 0.68 0.53 -0.05 6.66 2.47 -0.87 -1.39 114.38 122.40 3h6i h ARG 85 Ca 0.11 -0.20 -0.07 0.00 -1.26 0.00 0.00 59.98 58.57 3h6i h ARG 85 Cb 0.62 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.90 3h6i h ARG 85 CO 0.04 0.74 -0.27 0.78 0.56 0.00 0.00 179.97 181.81 3h6i h GLY 86 N 0.28 0.10 0.93 0.04 0.00 -0.97 0.15 103.07 103.60 3h6i h GLY 86 Ca 0.07 -0.07 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 3h6i h GLY 86 CO 0.03 0.06 -0.76 -1.82 0.00 0.00 0.00 176.54 174.05 3h6i h TYR 87 N 0.08 0.76 0.00 5.60 3.20 -1.11 -3.03 116.97 122.47 3h6i h TYR 87 Ca 0.01 -0.42 -0.09 0.00 3.14 0.00 0.00 58.73 61.38 3h6i h TYR 87 Cb 0.53 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 3h6i h TYR 87 CO 0.00 1.24 -0.43 0.00 -1.64 0.00 0.00 178.16 177.33 3h6i h ALA 88 N 0.35 0.88 -3.00 1.82 0.00 -1.05 -3.44 119.26 114.82 3h6i h ALA 88 Ca -0.09 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3h6i h ALA 88 Cb 1.45 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3h6i h ALA 88 CO 0.15 0.54 0.00 0.66 0.00 0.00 0.00 179.25 180.60 3h6i n TYR 89 N -3.44 0.00 -3.84 0.00 4.01 0.02 -5.09 117.16 108.83 3h6i n TYR 89 Ca 0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.65 3h6i n TYR 89 Cb 0.58 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.55 3h6i n TYR 89 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 3h6i s ASP 90 N 0.74 -0.03 0.53 7.72 1.47 -1.14 -4.97 116.67 120.99 3h6i s ASP 90 Ca 0.00 -0.65 0.20 0.00 1.18 0.00 0.00 52.55 53.28 3h6i s ASP 90 Cb 0.00 0.43 1.38 0.00 -0.34 0.00 0.00 42.92 44.39 3h6i s ASP 90 CO 0.00 -0.86 2.14 0.03 0.68 0.00 0.00 175.17 177.16 3h6i h ARG 91 N 2.52 0.00 0.00 2.11 3.08 -1.91 -2.48 114.38 117.71 3h6i h ARG 91 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.73 3h6i h ARG 91 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 3h6i h ARG 91 CO 0.49 0.00 0.00 -0.09 -1.07 0.00 0.00 179.97 179.30 3h6i h ARG 92 N 0.00 0.00 0.00 0.04 2.43 -1.96 -2.74 114.38 112.15 3h6i h ARG 92 Ca 0.04 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 3h6i h ARG 92 Cb 0.16 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 3h6i h ARG 92 CO -0.00 0.00 -0.23 0.22 -1.51 0.00 0.00 179.97 178.45 3h6i h ASP 93 N 0.00 0.00 -3.34 -3.80 3.58 -1.82 -3.40 116.42 107.64 3h6i h ASP 93 Ca 0.00 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 56.88 3h6i h ASP 93 Cb 0.47 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.46 3h6i h ASP 93 CO 0.00 0.23 0.89 -0.69 -2.88 0.00 0.00 179.24 176.79 3h6i s VAL 94 N -4.42 4.37 0.26 2.25 1.01 -1.03 -4.92 120.40 117.92 3h6i s VAL 94 Ca -0.03 1.55 0.04 0.00 0.00 0.00 0.00 61.98 63.54 3h6i s VAL 94 Cb 0.15 -4.39 -0.06 0.00 0.00 0.00 0.00 36.38 32.09 3h6i s VAL 94 CO 0.69 -0.57 0.00 0.42 0.00 0.00 0.00 175.10 175.65 3h6i s THR 95 N 3.95 1.17 0.22 3.92 -4.23 -1.26 -4.96 115.64 114.45 3h6i s THR 95 Ca 0.48 -2.04 -0.04 0.00 -1.18 0.00 0.00 61.69 58.91 3h6i s THR 95 Cb -0.12 -2.48 0.04 0.00 1.34 0.00 0.00 72.50 71.28 3h6i s THR 95 CO 0.20 -0.23 1.64 1.23 -0.54 0.00 0.00 174.62 176.92 3h6i h GLY 96 N 2.35 0.85 0.83 3.99 0.00 -1.94 -1.97 103.07 107.18 3h6i h GLY 96 Ca -0.39 -0.70 0.03 0.00 0.00 0.00 0.00 47.33 46.26 3h6i h GLY 96 CO 0.66 0.64 0.24 -0.09 0.00 0.00 0.00 176.54 177.99 3h6i h ARG 97 N 0.69 0.47 -0.10 4.80 2.43 -1.96 0.11 114.38 120.82 3h6i h ARG 97 Ca 0.10 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3h6i h ARG 97 Cb 0.70 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.14 3h6i h ARG 97 CO 0.05 0.31 0.04 0.37 -1.51 0.00 0.00 179.97 179.23 3h6i h GLN 98 N 0.48 0.14 -0.54 0.20 4.15 -1.86 -0.23 115.11 117.47 3h6i h GLN 98 Ca 0.18 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.49 3h6i h GLN 98 Cb 0.06 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 3h6i h GLN 98 CO -0.11 0.24 -0.01 -0.07 -1.93 0.00 0.00 178.83 176.95 3h6i h LEU 99 N 0.01 0.90 -0.56 -2.39 3.38 -1.05 -0.89 115.31 114.71 3h6i h LEU 99 Ca 0.03 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.70 3h6i h LEU 99 Cb 0.15 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3h6i h LEU 99 CO -0.00 0.96 0.11 0.00 0.09 0.00 0.00 178.44 179.60 3h6i h ALA 100 N 1.13 0.74 -0.45 1.53 0.00 -0.64 -0.61 119.26 120.97 3h6i h ALA 100 Ca 0.16 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3h6i h ALA 100 Cb 0.52 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3h6i h ALA 100 CO 0.03 0.47 0.25 -0.97 0.00 0.00 0.00 179.25 179.03 3h6i h ASN 101 N 0.81 0.56 -0.33 0.00 -0.73 -0.75 0.19 115.58 115.33 3h6i h ASN 101 Ca 0.17 -0.08 -0.08 0.00 1.87 0.00 0.00 56.30 58.19 3h6i h ASN 101 Cb 0.38 -0.14 -0.02 0.00 0.27 0.00 0.00 38.32 38.81 3h6i h ASN 101 CO 0.01 0.48 -0.05 0.58 -0.37 0.00 0.00 177.43 178.08 3h6i h VAL 102 N 0.59 1.24 -0.31 2.57 2.07 -0.84 -1.97 116.25 119.61 3h6i h VAL 102 Ca 0.16 -1.03 -0.14 0.00 0.82 0.00 0.00 66.70 66.50 3h6i h VAL 102 Cb 0.04 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 3h6i h VAL 102 CO -0.03 0.36 -0.38 1.88 0.02 0.00 0.00 177.57 179.42 3h6i h TYR 103 N 0.67 0.86 -0.53 1.57 0.05 -0.66 -1.72 116.97 117.21 3h6i h TYR 103 Ca 0.13 -0.25 -0.01 0.00 0.05 0.00 0.00 58.73 58.65 3h6i h TYR 103 Cb 0.48 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 38.01 3h6i h TYR 103 CO 0.02 0.99 0.30 0.00 -1.05 0.00 0.00 178.16 178.42 3h6i h ALA 104 N 0.98 0.68 -0.47 3.88 0.00 -0.51 0.20 119.26 124.02 3h6i h ALA 104 Ca 0.05 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3h6i h ALA 104 Cb 0.91 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3h6i h ALA 104 CO 0.08 0.20 -0.01 1.96 0.00 0.00 0.00 179.25 181.48 3h6i h GLN 105 N 0.71 0.84 -0.13 0.00 1.08 -1.35 -0.29 115.11 115.98 3h6i h GLN 105 Ca 0.19 -0.27 -0.02 0.00 -1.45 0.00 0.00 58.65 57.10 3h6i h GLN 105 Cb 0.04 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.39 3h6i h GLN 105 CO -0.03 0.89 -0.01 1.15 -0.95 0.00 0.00 178.83 179.88 3h6i h THR 106 N 0.69 1.26 -0.44 -0.54 2.02 -0.84 -1.64 112.91 113.41 3h6i h THR 106 Ca 0.13 -0.85 -0.12 0.00 0.77 0.00 0.00 66.41 66.34 3h6i h THR 106 Cb 0.52 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 3h6i h THR 106 CO 0.03 0.25 -0.21 -0.07 0.37 0.00 0.00 175.52 175.88 3h6i h LEU 107 N -0.05 0.91 -0.96 2.58 3.38 -0.58 -1.29 115.31 119.30 3h6i h LEU 107 Ca 0.03 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 3h6i h LEU 107 Cb 0.38 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 3h6i h LEU 107 CO 0.01 1.09 0.49 1.23 0.09 0.00 0.00 178.44 181.35 3h6i h GLY 108 N 0.93 1.30 1.36 0.83 0.00 -1.01 0.12 103.07 106.59 3h6i h GLY 108 Ca 0.11 -0.58 -0.18 0.00 0.00 0.00 0.00 47.33 46.68 3h6i h GLY 108 CO 0.06 0.56 -0.59 -0.84 0.00 0.00 0.00 176.54 175.73 3h6i h THR 109 N 1.22 1.31 -0.41 4.70 2.02 -1.00 -2.82 112.91 117.93 3h6i h THR 109 Ca 0.31 -1.82 -0.04 0.00 0.77 0.00 0.00 66.41 65.62 3h6i h THR 109 Cb 0.01 1.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 3h6i h THR 109 CO -0.05 0.57 0.09 0.40 0.37 0.00 0.00 175.52 176.90 3h6i h ILE 110 N 0.50 1.23 -0.00 3.11 2.04 -0.23 0.12 117.51 124.27 3h6i h ILE 110 Ca 0.00 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.04 3h6i h ILE 110 Cb 1.16 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 38.23 3h6i h ILE 110 CO 0.12 0.29 0.00 0.15 0.00 0.00 0.00 178.15 178.71 3h6i h PHE 111 N 0.52 0.00 0.00 1.37 3.57 -0.70 -1.34 116.94 120.36 3h6i h PHE 111 Ca 0.13 0.00 -0.36 0.00 3.53 0.00 0.00 57.97 61.27 3h6i h PHE 111 Cb 0.34 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 3h6i h PHE 111 CO 0.02 0.00 -1.96 2.41 -2.23 0.00 0.00 178.31 176.55 3h6i n THR 112 N -3.98 1.53 0.03 4.41 -1.04 -1.03 -4.76 114.28 109.44 3h6i n THR 112 Ca -0.03 -0.22 0.09 0.00 -2.04 0.00 0.00 64.05 61.85 3h6i n THR 112 Cb 0.09 -1.96 -0.10 0.00 -1.82 0.00 0.00 70.33 66.54 3h6i n THR 112 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3h6i n GLU 113 N -4.33 0.64 -3.12 -2.82 4.71 0.37 -4.97 120.64 111.12 3h6i n GLU 113 Ca -0.44 -0.04 -0.25 0.00 -0.01 0.00 0.00 57.16 56.41 3h6i n GLU 113 Cb 0.79 -1.65 -0.01 0.00 -1.01 0.00 0.00 31.44 29.56 3h6i n GLU 113 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 3h6i s GLN 114 N -3.36 3.51 0.16 3.49 -0.21 -0.52 -5.00 119.66 117.73 3h6i s GLN 114 Ca -0.05 -0.13 -0.16 0.00 0.02 0.00 0.00 55.36 55.04 3h6i s GLN 114 Cb 0.12 -2.56 0.04 0.00 1.00 0.00 0.00 33.01 31.60 3h6i s GLN 114 CO 0.85 0.03 1.80 0.00 -2.12 0.00 0.00 175.29 175.85 3h6i h ALA 115 N 0.62 0.50 -3.69 6.09 0.00 -1.93 -3.42 119.26 117.43 3h6i h ALA 115 Ca -0.49 -0.01 -0.68 0.00 0.00 0.00 0.00 54.91 53.73 3h6i h ALA 115 Cb 1.21 -0.11 -0.31 0.00 0.00 0.00 0.00 17.79 18.58 3h6i h ALA 115 CO 0.62 -0.10 -0.87 0.21 0.00 0.00 0.00 179.25 179.10 3h6i s LYS 116 N -6.16 2.81 0.83 0.00 2.20 -1.26 -5.13 119.74 113.04 3h6i s LYS 116 Ca -0.13 -0.87 -0.11 0.00 -0.36 0.00 0.00 55.97 54.49 3h6i s LYS 116 Cb 0.11 -2.26 0.09 0.00 -1.51 0.00 0.00 37.83 34.26 3h6i s LYS 116 CO 0.72 0.30 1.09 -1.25 -0.36 0.00 0.00 175.35 175.85 3h6i s PRO 117 N 0.06 1.84 0.04 4.03 0.04 -1.26 -4.91 135.00 134.84 3h6i s PRO 117 Ca -0.10 0.77 -0.30 0.00 0.04 0.00 0.00 61.00 61.41 3h6i s PRO 117 Cb -0.16 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 3h6i s PRO 117 CO 0.06 -1.83 1.02 0.71 0.04 0.00 0.00 177.00 177.00 3h6i s TYR 118 N -3.05 3.65 -1.29 0.56 1.51 -1.26 -4.91 117.35 112.56 3h6i s TYR 118 Ca 0.62 1.65 -0.09 0.00 -1.01 0.00 0.00 57.07 58.23 3h6i s TYR 118 Cb -0.16 -3.17 0.15 0.00 -0.11 0.00 0.00 41.96 38.68 3h6i s TYR 118 CO 0.55 -0.22 1.98 0.39 -1.11 0.00 0.00 175.55 177.14 3h6i n GLU 119 N 3.62 3.77 -4.05 -0.62 1.02 -1.26 -4.74 120.64 118.38 3h6i n GLU 119 Ca 0.06 -3.49 -0.08 0.00 -0.02 0.00 0.00 57.16 53.63 3h6i n GLU 119 Cb 0.50 -2.88 -0.09 0.00 -0.02 0.00 0.00 31.44 28.94 3h6i n GLU 119 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3h6i s VAL 120 N 0.19 0.19 -0.03 2.62 -7.23 -1.26 -1.15 120.40 113.73 3h6i s VAL 120 Ca 0.42 -1.69 -0.00 0.00 -1.81 0.00 0.00 61.98 58.90 3h6i s VAL 120 Cb 0.11 -1.56 0.03 0.00 0.56 0.00 0.00 36.38 35.53 3h6i s VAL 120 CO -0.01 -0.85 0.05 -0.70 -0.31 0.00 0.00 175.10 173.27 3h6i s GLU 121 N -3.93 -0.02 0.05 4.82 2.12 -0.11 -3.24 118.70 118.40 3h6i s GLU 121 Ca 0.09 0.21 0.09 0.00 0.36 0.00 0.00 54.97 55.72 3h6i s GLU 121 Cb 0.07 -0.23 -0.03 0.00 0.26 0.00 0.00 34.13 34.20 3h6i s GLU 121 CO -0.09 -0.16 -0.26 -0.51 -0.54 0.00 0.00 175.26 173.70 3h6i s LEU 122 N 1.05 2.21 -0.09 2.70 1.02 -0.07 -1.22 118.68 124.28 3h6i s LEU 122 Ca -0.09 -0.60 0.03 0.00 0.02 0.00 0.00 54.13 53.49 3h6i s LEU 122 Cb -0.12 -1.29 0.01 0.00 0.02 0.00 0.00 46.19 44.81 3h6i s LEU 122 CO -0.03 0.25 -0.16 0.00 0.02 0.00 0.00 176.35 176.42 3h6i s VAL 124 N 0.65 2.35 0.15 0.00 1.01 -0.70 -1.49 120.40 122.37 3h6i s VAL 124 Ca -0.14 -0.90 0.09 0.00 0.00 0.00 0.00 61.98 61.04 3h6i s VAL 124 Cb -0.16 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 3h6i s VAL 124 CO 0.04 0.54 -0.21 0.00 0.00 0.00 0.00 175.10 175.47 3h6i s ALA 125 N 0.59 2.10 -0.05 5.51 0.00 -0.69 -0.71 121.76 128.52 3h6i s ALA 125 Ca -0.11 -1.46 -0.02 0.00 0.00 0.00 0.00 51.96 50.37 3h6i s ALA 125 Cb -0.16 -0.25 0.03 0.00 0.00 0.00 0.00 23.12 22.73 3h6i s ALA 125 CO 0.03 0.34 0.10 -2.00 0.00 0.00 0.00 175.76 174.23 3h6i s GLU 126 N -2.47 0.08 0.43 0.00 2.12 -0.52 -0.48 118.70 117.86 3h6i s GLU 126 Ca 0.14 0.24 0.07 0.00 0.36 0.00 0.00 54.97 55.79 3h6i s GLU 126 Cb -0.08 -0.10 -0.03 0.00 0.26 0.00 0.00 34.13 34.18 3h6i s GLU 126 CO 0.07 -0.11 0.28 0.14 -0.54 0.00 0.00 175.26 175.10 3h6i s VAL 127 N 0.71 2.35 0.77 3.70 -7.23 -1.04 -0.93 120.40 118.72 3h6i s VAL 127 Ca -0.05 -1.54 -0.11 0.00 -1.81 0.00 0.00 61.98 58.47 3h6i s VAL 127 Cb -0.07 -2.89 0.06 0.00 0.56 0.00 0.00 36.38 34.03 3h6i s VAL 127 CO -0.03 0.00 1.09 0.00 -0.31 0.00 0.00 175.10 175.85 3h6i s ALA 128 N -2.57 2.25 0.76 1.32 0.00 -1.26 -4.85 121.76 117.41 3h6i s ALA 128 Ca 0.43 0.28 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 3h6i s ALA 128 Cb 0.00 -3.28 0.05 0.00 0.00 0.00 0.00 23.12 19.89 3h6i s ALA 128 CO 0.24 -1.76 1.08 -1.01 0.00 0.00 0.00 175.76 174.31 3h6i s HIS 129 N -2.88 2.78 0.22 0.00 3.76 -1.26 -4.79 115.29 113.13 3h6i s HIS 129 Ca 0.61 1.41 -0.32 0.00 -0.15 0.00 0.00 55.06 56.61 3h6i s HIS 129 Cb -0.17 -3.01 -0.13 0.00 1.11 0.00 0.00 32.58 30.38 3h6i s HIS 129 CO 0.55 -1.66 1.60 0.98 -0.85 0.00 0.00 174.74 175.36 3h6i n TYR 130 N -3.41 2.55 -1.02 1.40 9.36 -1.26 -2.27 117.16 122.52 3h6i n TYR 130 Ca 0.08 0.23 -0.01 0.00 3.32 0.00 0.00 57.90 61.52 3h6i n TYR 130 Cb 0.54 -2.58 -0.00 0.00 -0.63 0.00 0.00 39.34 36.66 3h6i n TYR 130 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3h6i n GLY 131 N 3.02 0.44 3.58 2.98 0.00 -1.26 -5.02 105.19 108.93 3h6i n GLY 131 Ca 0.13 -0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 3h6i n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h6i s GLU 132 N -0.69 2.09 -0.28 1.61 2.02 -0.96 -5.11 118.70 117.37 3h6i s GLU 132 Ca 0.00 -1.35 0.03 0.00 0.02 0.00 0.00 54.97 53.67 3h6i s GLU 132 Cb 0.00 -2.12 0.07 0.00 0.10 0.00 0.00 34.13 32.18 3h6i s GLU 132 CO 0.00 0.41 -0.06 0.95 0.02 0.00 0.00 175.26 176.58 3h6i s THR 133 N -1.94 2.19 -0.09 3.63 -4.23 -1.26 -4.75 115.64 109.18 3h6i s THR 133 Ca 0.27 -1.86 -0.07 0.00 -1.18 0.00 0.00 61.69 58.86 3h6i s THR 133 Cb -0.08 -2.40 0.03 0.00 1.34 0.00 0.00 72.50 71.40 3h6i s THR 133 CO 0.16 -0.21 0.23 -0.75 -0.54 0.00 0.00 174.62 173.51 3h6i s LYS 134 N 1.04 0.23 0.28 3.99 2.20 -1.26 -5.11 119.74 121.11 3h6i s LYS 134 Ca -0.03 0.42 -0.29 0.00 -0.36 0.00 0.00 55.97 55.71 3h6i s LYS 134 Cb -0.20 0.00 -0.10 0.00 -1.51 0.00 0.00 37.83 36.03 3h6i s LYS 134 CO -0.06 -0.10 1.25 1.03 -0.36 0.00 0.00 175.35 177.11 3h6i s ARG 135 N 0.68 4.45 0.39 4.03 0.52 -1.26 -4.33 118.95 123.43 3h6i s ARG 135 Ca -0.05 2.05 -0.26 0.00 -0.52 0.00 0.00 55.73 56.95 3h6i s ARG 135 Cb -0.06 -3.14 -0.11 0.00 0.52 0.00 0.00 34.95 32.16 3h6i s ARG 135 CO -0.04 -0.09 1.27 -2.30 0.02 0.00 0.00 175.30 174.16 3h6i n PRO 136 N 1.48 2.00 -4.59 3.54 -0.02 -1.26 -4.85 135.00 131.29 3h6i n PRO 136 Ca 0.02 0.71 -0.34 0.00 -2.02 0.00 0.00 63.50 61.86 3h6i n PRO 136 Cb 0.43 -2.35 -0.12 0.00 -0.02 0.00 0.00 33.50 31.44 3h6i n PRO 136 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3h6i s GLU 137 N -2.06 3.04 -0.07 -0.52 2.02 -0.11 -4.98 118.70 116.02 3h6i s GLU 137 Ca 0.59 -0.56 0.01 0.00 0.02 0.00 0.00 54.97 55.03 3h6i s GLU 137 Cb -0.53 -2.67 0.02 0.00 0.10 0.00 0.00 34.13 31.05 3h6i s GLU 137 CO 0.60 0.51 -0.08 -0.51 0.02 0.00 0.00 175.26 175.80 3h6i s LEU 138 N -0.40 1.35 0.02 1.80 1.02 -1.23 -1.43 118.68 119.81 3h6i s LEU 138 Ca 0.06 -0.22 0.09 0.00 0.02 0.00 0.00 54.13 54.07 3h6i s LEU 138 Cb -0.12 -0.66 -0.02 0.00 0.02 0.00 0.00 46.19 45.40 3h6i s LEU 138 CO 0.02 -0.05 -0.26 -0.31 0.02 0.00 0.00 176.35 175.78 3h6i s TYR 139 N 1.07 2.26 -0.18 0.29 1.51 0.12 -1.52 117.35 120.90 3h6i s TYR 139 Ca -0.08 -0.42 -0.01 0.00 -1.01 0.00 0.00 57.07 55.55 3h6i s TYR 139 Cb -0.14 -1.39 -0.00 0.00 -0.11 0.00 0.00 41.96 40.31 3h6i s TYR 139 CO -0.01 0.06 -0.11 0.50 -1.11 0.00 0.00 175.55 174.89 3h6i s ARG 140 N -1.00 3.28 -0.16 -0.62 3.52 -0.41 -1.73 118.95 121.84 3h6i s ARG 140 Ca 0.11 -0.70 0.00 0.00 -0.13 0.00 0.00 55.73 55.01 3h6i s ARG 140 Cb -0.10 -2.78 0.00 0.00 -1.56 0.00 0.00 34.95 30.51 3h6i s ARG 140 CO 0.01 -0.08 -0.16 0.42 -0.81 0.00 0.00 175.30 174.68 3h6i s ILE 141 N 1.09 2.52 0.36 4.11 1.09 0.11 -1.23 121.20 129.26 3h6i s ILE 141 Ca 0.00 -0.81 0.07 0.00 -1.10 0.00 0.00 60.65 58.81 3h6i s ILE 141 Cb -0.15 -2.06 -0.00 0.00 -1.06 0.00 0.00 42.46 39.19 3h6i s ILE 141 CO -0.03 0.52 0.50 0.42 -0.10 0.00 0.00 174.94 176.25 3h6i s THR 142 N 0.92 3.68 0.58 2.92 -4.23 -0.35 -0.89 115.64 118.27 3h6i s THR 142 Ca -0.03 -1.02 0.33 0.00 -1.18 0.00 0.00 61.69 59.79 3h6i s THR 142 Cb -0.15 -3.26 0.48 0.00 1.34 0.00 0.00 72.50 70.91 3h6i s THR 142 CO -0.02 -0.10 1.66 0.10 -0.54 0.00 0.00 174.62 175.71 3h6i h TYR 143 N 0.82 0.00 -0.01 3.99 -0.00 -1.84 0.27 116.97 120.20 3h6i h TYR 143 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.29 3h6i h TYR 143 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.99 3h6i h TYR 143 CO 0.42 0.00 -0.50 -0.40 -0.00 0.00 0.00 178.16 177.68 3h6i n ASP 144 N -3.74 1.59 0.00 0.10 5.75 -1.26 -4.58 116.55 114.41 3h6i n ASP 144 Ca 0.22 -1.25 0.00 0.00 -0.01 0.00 0.00 54.79 53.76 3h6i n ASP 144 Cb 1.26 0.47 0.00 0.00 -1.03 0.00 0.00 41.12 41.82 3h6i n ASP 144 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h6i n GLY 145 N 1.42 1.04 3.74 6.12 0.00 0.08 -4.10 105.19 113.49 3h6i n GLY 145 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 3h6i n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6i s SER 146 N -2.02 7.57 -0.07 1.61 0.01 -1.25 -4.74 113.70 114.81 3h6i s SER 146 Ca 0.00 1.93 0.04 0.00 1.31 0.00 0.00 55.95 59.23 3h6i s SER 146 Cb 0.00 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.62 3h6i s SER 146 CO 0.00 0.06 -0.21 -0.51 0.41 0.00 0.00 173.24 172.99 3h6i s ILE 147 N -0.80 1.81 -0.06 1.44 2.07 -1.26 -1.21 121.20 123.19 3h6i s ILE 147 Ca 0.43 -0.90 0.02 0.00 -1.41 0.00 0.00 60.65 58.80 3h6i s ILE 147 Cb -0.26 -1.56 0.01 0.00 0.13 0.00 0.00 42.46 40.78 3h6i s ILE 147 CO 0.32 0.51 -0.12 0.00 -1.91 0.00 0.00 174.94 173.73 3h6i s ALA 148 N 0.18 1.23 -0.48 1.50 0.00 -0.36 -4.99 121.76 118.85 3h6i s ALA 148 Ca -0.11 -0.42 -0.21 0.00 0.00 0.00 0.00 51.96 51.22 3h6i s ALA 148 Cb -0.15 -0.53 0.04 0.00 0.00 0.00 0.00 23.12 22.47 3h6i s ALA 148 CO 0.05 0.13 0.69 0.34 0.00 0.00 0.00 175.76 176.98 3h6i s ASP 149 N 0.56 6.30 -0.18 0.00 -1.08 -1.26 -1.28 116.67 119.72 3h6i s ASP 149 Ca -0.12 -0.53 -0.08 0.00 -0.52 0.00 0.00 52.55 51.29 3h6i s ASP 149 Cb -0.15 -2.33 -0.04 0.00 -1.46 0.00 0.00 42.92 38.94 3h6i s ASP 149 CO 0.03 -0.90 0.10 -1.61 0.52 0.00 0.00 175.17 173.31 3h6i s GLU 150 N 2.96 4.01 0.29 4.34 0.41 -0.57 -5.03 118.70 125.11 3h6i s GLU 150 Ca 0.22 -0.27 0.23 0.00 -0.41 0.00 0.00 54.97 54.73 3h6i s GLU 150 Cb -0.15 -3.30 0.16 0.00 -1.78 0.00 0.00 34.13 29.06 3h6i s GLU 150 CO 0.17 0.34 1.29 -1.00 -0.49 0.00 0.00 175.26 175.56 3h6i h PRO 151 N 6.50 0.00 0.00 0.39 0.13 -1.94 -3.26 132.00 133.82 3h6i h PRO 151 Ca -0.41 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.71 3h6i h PRO 151 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 3h6i h PRO 151 CO 0.72 0.00 -1.06 0.72 -0.23 0.00 0.00 178.00 178.15 3h6i n HIS 152 N -2.82 0.00 -3.72 1.56 8.25 -1.26 -4.88 115.22 112.35 3h6i n HIS 152 Ca 0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.38 3h6i n HIS 152 Cb 0.54 -0.04 -0.05 0.00 1.12 0.00 0.00 29.99 31.56 3h6i n HIS 152 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 3h6i s PHE 153 N -2.02 -0.08 -0.01 4.41 -0.12 -1.26 -1.89 117.98 117.01 3h6i s PHE 153 Ca -0.01 -0.26 0.02 0.00 -0.05 0.00 0.00 56.93 56.63 3h6i s PHE 153 Cb 0.01 0.24 0.00 0.00 -0.63 0.00 0.00 43.02 42.64 3h6i s PHE 153 CO 0.02 -0.76 -0.06 0.08 -0.05 0.00 0.00 175.22 174.45 3h6i s VAL 154 N -3.85 0.50 -0.06 -2.49 1.01 0.35 -4.88 120.40 110.98 3h6i s VAL 154 Ca 0.07 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 61.83 3h6i s VAL 154 Cb 0.01 -0.44 0.01 0.00 0.00 0.00 0.00 36.38 35.96 3h6i s VAL 154 CO -0.08 0.16 -0.12 -0.69 0.00 0.00 0.00 175.10 174.37 3h6i s VAL 155 N 0.04 1.10 0.01 2.92 1.01 -1.26 -1.12 120.40 123.10 3h6i s VAL 155 Ca -0.00 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.50 3h6i s VAL 155 Cb -0.05 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.32 3h6i s VAL 155 CO -0.00 0.34 -0.03 -0.04 0.00 0.00 0.00 175.10 175.37 3h6i s MET 156 N 0.53 0.24 0.00 2.72 -1.94 0.66 -5.00 119.30 116.51 3h6i s MET 156 Ca -0.12 -0.33 0.00 0.00 -1.71 0.00 0.00 55.69 53.53 3h6i s MET 156 Cb -0.14 -0.06 0.00 0.00 2.01 0.00 0.00 34.83 36.64 3h6i s MET 156 CO 0.03 0.01 0.00 0.41 -0.01 0.00 0.00 175.02 175.46 3h6i n GLY 157 N 2.35 -2.52 7.00 -0.03 0.00 -1.26 0.11 105.19 110.84 3h6i n GLY 157 Ca -0.18 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.48 3h6i n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6i n GLY 158 N -1.50 1.88 3.34 -0.02 0.00 -0.38 -4.13 105.19 104.38 3h6i n GLY 158 Ca 0.00 -0.59 -0.46 0.00 0.00 0.00 0.00 46.02 44.97 3h6i n GLY 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h6i s THR 159 N 0.00 5.15 0.16 2.61 -4.23 -1.26 -4.34 115.64 113.73 3h6i s THR 159 Ca 0.00 -1.53 -0.08 0.00 -1.18 0.00 0.00 61.69 58.89 3h6i s THR 159 Cb 0.00 -4.42 -0.06 0.00 1.34 0.00 0.00 72.50 69.36 3h6i s THR 159 CO 0.00 -1.00 1.47 0.71 -0.54 0.00 0.00 174.62 175.26 3h6i h THR 160 N 5.70 1.28 -0.40 3.99 1.35 -1.96 -3.38 112.91 119.49 3h6i h THR 160 Ca -0.21 -1.67 0.08 0.00 -0.55 0.00 0.00 66.41 64.06 3h6i h THR 160 Cb 1.08 1.57 -0.08 0.00 -1.73 0.00 0.00 68.15 68.99 3h6i h THR 160 CO 1.01 0.54 -0.12 -0.33 -0.25 0.00 0.00 175.52 176.37 3h6i h GLU 161 N 0.63 -0.02 -0.01 4.72 3.07 -1.95 0.34 114.58 121.36 3h6i h GLU 161 Ca 0.03 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.82 3h6i h GLU 161 Cb 1.06 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.96 3h6i h GLU 161 CO 0.10 -0.01 -0.34 -1.00 -1.40 0.00 0.00 179.01 176.36 3h6i h PRO 162 N -0.02 0.02 -0.10 2.33 0.13 -1.82 -1.02 132.00 131.51 3h6i h PRO 162 Ca 0.20 -0.01 -0.22 0.00 -0.87 0.00 0.00 66.00 65.09 3h6i h PRO 162 Cb 0.32 -0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.46 3h6i h PRO 162 CO -0.43 0.36 -0.81 0.82 -0.23 0.00 0.00 178.00 177.71 3h6i h ILE 163 N 0.02 1.29 -0.46 -3.56 2.04 -1.63 -1.92 117.51 113.29 3h6i h ILE 163 Ca 0.00 -2.03 -0.08 0.00 1.00 0.00 0.00 64.86 63.75 3h6i h ILE 163 Cb 0.61 2.15 -0.02 0.00 -0.74 0.00 0.00 36.82 38.82 3h6i h ILE 163 CO 0.04 0.63 -0.04 0.00 0.00 0.00 0.00 178.15 178.79 3h6i h ALA 164 N 0.49 0.62 -0.26 1.87 0.00 -0.80 -2.45 119.26 118.73 3h6i h ALA 164 Ca -0.07 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.40 3h6i h ALA 164 Cb 1.45 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 3h6i h ALA 164 CO 0.16 0.45 -0.43 -0.91 0.00 0.00 0.00 179.25 178.52 3h6i h ASN 165 N 0.68 0.68 0.06 0.00 -0.26 -1.23 -1.79 115.58 113.72 3h6i h ASN 165 Ca 0.13 -0.32 -0.04 0.00 -0.56 0.00 0.00 56.30 55.50 3h6i h ASN 165 Cb 0.55 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.61 3h6i h ASN 165 CO 0.03 1.02 -0.14 0.00 -1.06 0.00 0.00 177.43 177.28 3h6i h ALA 166 N 1.01 1.57 0.23 -0.83 0.00 -1.22 -2.85 119.26 117.17 3h6i h ALA 166 Ca 0.04 -0.19 -0.32 0.00 0.00 0.00 0.00 54.91 54.44 3h6i h ALA 166 Cb 0.96 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.71 3h6i h ALA 166 CO 0.09 0.31 -1.45 -0.07 0.00 0.00 0.00 179.25 178.13 3h6i h LEU 167 N 0.16 0.76 -1.90 0.00 3.38 -1.30 -2.75 115.31 113.67 3h6i h LEU 167 Ca 0.03 -0.93 0.22 0.00 0.09 0.00 0.00 57.88 57.30 3h6i h LEU 167 Cb 0.35 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3h6i h LEU 167 CO 0.02 1.69 0.57 0.11 0.09 0.00 0.00 178.44 180.93 3h6i h LYS 168 N 0.07 0.08 0.02 1.13 1.57 -1.09 -0.65 116.57 117.70 3h6i h LYS 168 Ca -0.26 -0.01 -0.28 0.00 -1.87 0.00 0.00 60.65 58.23 3h6i h LYS 168 Cb 2.09 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 34.34 3h6i h LYS 168 CO 0.24 0.06 -1.53 0.39 -0.57 0.00 0.00 179.45 178.04 3h6i n GLU 169 N -4.34 0.60 -0.00 3.15 1.02 -1.16 -4.45 120.64 115.45 3h6i n GLU 169 Ca 0.17 0.49 0.11 0.00 -0.02 0.00 0.00 57.16 57.91 3h6i n GLU 169 Cb 0.82 -1.71 0.66 0.00 -0.02 0.00 0.00 31.44 31.20 3h6i n GLU 169 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3h6i n SER 170 N -4.26 0.09 -4.67 1.62 3.41 -0.88 -4.91 113.62 104.01 3h6i n SER 170 Ca -0.35 -1.31 -0.42 0.00 -0.26 0.00 0.00 58.87 56.53 3h6i n SER 170 Cb 0.76 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.68 3h6i n SER 170 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3h6i s TYR 171 N -1.99 3.43 -0.20 7.33 5.04 -0.30 -5.00 117.35 125.66 3h6i s TYR 171 Ca 0.34 1.45 -0.03 0.00 -2.44 0.00 0.00 57.07 56.40 3h6i s TYR 171 Cb 0.16 -3.16 -0.01 0.00 0.35 0.00 0.00 41.96 39.30 3h6i s TYR 171 CO 0.27 -0.31 -0.08 0.00 -1.34 0.00 0.00 175.55 174.09 3h6i s ALA 172 N 2.41 2.72 0.22 3.97 0.00 -1.26 -5.05 121.76 124.77 3h6i s ALA 172 Ca 0.44 -1.12 -0.18 0.00 0.00 0.00 0.00 51.96 51.10 3h6i s ALA 172 Cb -0.17 -1.55 0.22 0.00 0.00 0.00 0.00 23.12 21.62 3h6i s ALA 172 CO 0.13 -0.29 1.57 0.93 0.00 0.00 0.00 175.76 178.10 3h6i h GLU 173 N 7.82 -0.06 -1.00 0.00 4.39 -1.97 -2.79 114.58 120.97 3h6i h GLU 173 Ca -0.39 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 58.71 3h6i h GLU 173 Cb 1.17 0.01 -0.39 0.00 -0.10 0.00 0.00 28.75 29.44 3h6i h GLU 173 CO 0.60 -0.04 -0.29 0.09 -1.16 0.00 0.00 179.01 178.21 3h6i n ASN 174 N -5.47 5.71 -4.64 1.42 3.02 -1.26 -4.57 115.26 109.46 3h6i n ASN 174 Ca 0.08 -3.76 -0.38 0.00 -0.03 0.00 0.00 54.58 50.49 3h6i n ASN 174 Cb 0.39 -0.55 0.05 0.00 -0.61 0.00 0.00 39.78 39.06 3h6i n ASN 174 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h6i n ALA 175 N -0.71 0.48 -1.94 5.41 0.00 -1.06 -4.26 120.51 118.43 3h6i n ALA 175 Ca 0.48 0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.68 3h6i n ALA 175 Cb 0.81 -2.16 0.17 0.00 0.00 0.00 0.00 19.45 18.26 3h6i n ALA 175 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3h6i s SER 176 N -1.16 3.39 0.08 0.00 1.04 -1.26 -1.32 113.70 114.47 3h6i s SER 176 Ca 0.75 0.22 -0.30 0.00 0.48 0.00 0.00 55.95 57.10 3h6i s SER 176 Cb -0.43 -0.35 -0.17 0.00 0.10 0.00 0.00 66.02 65.17 3h6i s SER 176 CO 0.48 -2.55 1.66 0.25 0.98 0.00 0.00 173.24 174.05 3h6i h LEU 177 N -1.45 -0.57 -0.67 2.42 5.85 -1.99 0.50 115.31 119.40 3h6i h LEU 177 Ca -0.43 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.35 3h6i h LEU 177 Cb 1.25 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 42.38 3h6i h LEU 177 CO 0.40 -0.40 0.40 0.74 -0.34 0.00 0.00 178.44 179.25 3h6i h THR 178 N -0.64 1.04 -0.17 1.05 2.02 -1.94 -0.61 112.91 113.65 3h6i h THR 178 Ca -0.06 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 3h6i h THR 178 Cb 0.50 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 3h6i h THR 178 CO 0.09 0.14 -0.04 0.44 0.37 0.00 0.00 175.52 176.53 3h6i h ASP 179 N 0.78 0.33 -0.86 4.18 3.32 -1.90 -2.71 116.42 119.55 3h6i h ASP 179 Ca 0.28 -0.36 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 3h6i h ASP 179 Cb 0.08 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.50 3h6i h ASP 179 CO -0.13 0.61 0.49 0.00 -1.72 0.00 0.00 179.24 178.49 3h6i h ALA 180 N 0.73 1.24 -0.21 3.45 0.00 -0.47 -1.88 119.26 122.11 3h6i h ALA 180 Ca 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3h6i h ALA 180 Cb 0.47 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3h6i h ALA 180 CO 0.02 0.63 0.10 1.25 0.00 0.00 0.00 179.25 181.25 3h6i h LEU 181 N 1.21 0.27 -0.77 0.00 5.85 -1.05 -1.81 115.31 119.01 3h6i h LEU 181 Ca 0.31 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 3h6i h LEU 181 Cb -0.00 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 3h6i h LEU 181 CO -0.05 0.32 0.17 0.03 -0.34 0.00 0.00 178.44 178.57 3h6i h ARG 182 N 0.20 1.09 -0.23 1.25 3.08 -1.17 0.84 114.38 119.45 3h6i h ARG 182 Ca 0.07 -0.26 -0.06 0.00 0.07 0.00 0.00 59.98 59.81 3h6i h ARG 182 Cb 0.12 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3h6i h ARG 182 CO -0.01 0.96 -0.12 0.82 -1.07 0.00 0.00 179.97 180.56 3h6i h ILE 183 N 1.04 1.20 0.06 2.04 2.04 -1.24 0.31 117.51 122.96 3h6i h ILE 183 Ca 0.22 -0.89 -0.14 0.00 1.00 0.00 0.00 64.86 65.05 3h6i h ILE 183 Cb 0.36 1.16 0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3h6i h ILE 183 CO 0.00 0.29 -0.57 0.00 0.00 0.00 0.00 178.15 177.87 3h6i h ALA 184 N 1.54 -0.01 -0.58 1.87 0.00 -0.69 -2.28 119.26 119.11 3h6i h ALA 184 Ca 0.07 -0.60 -0.05 0.00 0.00 0.00 0.00 54.91 54.33 3h6i h ALA 184 Cb 0.42 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3h6i h ALA 184 CO 0.02 0.28 0.16 0.28 0.00 0.00 0.00 179.25 180.00 3h6i h VAL 185 N -0.37 1.24 0.24 0.00 2.07 -0.68 -1.63 116.25 117.12 3h6i h VAL 185 Ca -0.09 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 3h6i h VAL 185 Cb 1.36 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 3h6i h VAL 185 CO 0.11 0.32 -0.11 0.00 0.02 0.00 0.00 177.57 177.90 3h6i h ALA 186 N 1.04 -0.32 -0.17 1.67 0.00 -1.04 -2.47 119.26 117.97 3h6i h ALA 186 Ca 0.18 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.07 3h6i h ALA 186 Cb 0.31 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3h6i h ALA 186 CO -0.00 -0.67 0.17 0.00 0.00 0.00 0.00 179.25 178.74 3h6i h ALA 187 N 0.43 1.88 -0.01 0.00 0.00 -1.17 -1.25 119.26 119.14 3h6i h ALA 187 Ca -0.03 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3h6i h ALA 187 Cb 0.26 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3h6i h ALA 187 CO 0.05 -0.25 -0.20 -0.07 0.00 0.00 0.00 179.25 178.78 3h6i h LEU 188 N 0.00 0.18 -1.65 0.00 3.38 -0.93 -3.27 115.31 113.02 3h6i h LEU 188 Ca 0.08 -0.76 0.13 0.00 0.09 0.00 0.00 57.88 57.42 3h6i h LEU 188 Cb 0.41 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3h6i h LEU 188 CO -0.00 0.92 0.64 0.03 0.09 0.00 0.00 178.44 180.12 3h6i h ARG 189 N -0.53 0.00 -1.00 1.13 3.08 -0.78 0.82 114.38 117.09 3h6i h ARG 189 Ca -0.02 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3h6i h ARG 189 Cb 0.95 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.00 3h6i h ARG 189 CO 0.04 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.94 3h6i n ALA 190 N -2.19 2.50 0.00 0.04 0.00 -1.18 -5.13 120.51 114.56 3h6i n ALA 190 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3h6i n ALA 190 Cb 0.81 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.26 3h6i n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6i n GLY 191 N 0.09 0.00 0.00 0.00 0.00 0.28 -4.21 105.19 101.35 3h6i n GLY 191 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3h6i n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6i n GLY 204 N -0.04 -1.41 0.36 -0.02 0.00 -1.26 -5.04 105.19 97.78 3h6i n GLY 204 Ca 0.00 -1.51 0.11 0.00 0.00 0.00 0.00 46.02 44.62 3h6i n GLY 204 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h6i h VAL 205 N -0.25 0.80 0.00 1.61 2.07 -1.96 -1.87 116.25 116.64 3h6i h VAL 205 Ca 0.00 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.23 3h6i h VAL 205 Cb 0.00 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.64 3h6i h VAL 205 CO 0.00 0.16 0.00 0.00 0.02 0.00 0.00 177.57 177.75 3h6i n ALA 206 N -2.34 2.32 -0.08 1.67 0.00 -1.26 -3.46 120.51 117.36 3h6i n ALA 206 Ca 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.54 3h6i n ALA 206 Cb 0.48 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.48 3h6i n ALA 206 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3h6i n SER 207 N -1.41 1.02 -4.32 0.00 3.41 -0.93 -4.52 113.62 106.87 3h6i n SER 207 Ca 0.10 -1.10 -0.30 0.00 -0.26 0.00 0.00 58.87 57.30 3h6i n SER 207 Cb 0.28 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.08 3h6i n SER 207 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h6i s LEU 208 N -0.10 2.12 -0.21 1.04 1.43 -0.75 0.04 118.68 122.26 3h6i s LEU 208 Ca 0.00 -0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 52.55 3h6i s LEU 208 Cb 0.00 -1.28 0.01 0.00 0.03 0.00 0.00 46.19 44.94 3h6i s LEU 208 CO 0.00 0.28 -0.12 -0.70 0.23 0.00 0.00 176.35 176.04 3h6i s GLU 209 N -0.97 3.15 0.00 1.70 2.12 -0.44 -4.83 118.70 119.42 3h6i s GLU 209 Ca 0.11 -0.75 0.05 0.00 0.36 0.00 0.00 54.97 54.73 3h6i s GLU 209 Cb -0.10 -2.81 -0.01 0.00 0.26 0.00 0.00 34.13 31.47 3h6i s GLU 209 CO 0.01 -0.22 -0.14 0.08 -0.54 0.00 0.00 175.26 174.44 3h6i s VAL 210 N 1.38 1.13 0.03 3.70 1.01 -1.26 -1.38 120.40 125.01 3h6i s VAL 210 Ca 0.05 -0.70 -0.27 0.00 0.00 0.00 0.00 61.98 61.06 3h6i s VAL 210 Cb -0.14 -0.96 0.08 0.00 0.00 0.00 0.00 36.38 35.36 3h6i s VAL 210 CO -0.08 0.25 0.69 0.00 0.00 0.00 0.00 175.10 175.97 3h6i s ALA 211 N -0.44 -1.72 0.21 5.51 0.00 -0.62 -1.55 121.76 123.14 3h6i s ALA 211 Ca 0.05 0.97 0.08 0.00 0.00 0.00 0.00 51.96 53.06 3h6i s ALA 211 Cb -0.06 0.35 -0.05 0.00 0.00 0.00 0.00 23.12 23.37 3h6i s ALA 211 CO -0.00 -0.56 -0.15 0.14 0.00 0.00 0.00 175.76 175.18 3h6i s VAL 212 N -2.43 1.81 -0.60 0.00 -7.23 -0.16 0.01 120.40 111.80 3h6i s VAL 212 Ca -0.04 -2.18 -0.06 0.00 -1.81 0.00 0.00 61.98 57.89 3h6i s VAL 212 Cb -0.01 -2.03 0.16 0.00 0.56 0.00 0.00 36.38 35.06 3h6i s VAL 212 CO -0.02 -0.54 0.44 -0.76 -0.31 0.00 0.00 175.10 173.91 3h6i s LEU 213 N -3.23 5.59 -0.58 1.32 1.43 -0.22 -1.07 118.68 121.93 3h6i s LEU 213 Ca 0.22 -2.52 -0.27 0.00 -1.03 0.00 0.00 54.13 50.53 3h6i s LEU 213 Cb -0.02 -1.94 0.03 0.00 0.03 0.00 0.00 46.19 44.29 3h6i s LEU 213 CO 0.08 -0.49 1.12 -0.62 0.23 0.00 0.00 176.35 176.66 3h6i s ASP 214 N 1.50 6.41 0.01 2.29 2.15 0.67 -2.04 116.67 127.66 3h6i s ASP 214 Ca 0.14 -0.05 0.05 0.00 0.43 0.00 0.00 52.55 53.12 3h6i s ASP 214 Cb -0.20 -2.52 0.23 0.00 -0.30 0.00 0.00 42.92 40.13 3h6i s ASP 214 CO -0.04 -1.42 1.17 0.00 -0.17 0.00 0.00 175.17 174.71 3h6i n ALA 215 N 8.19 1.20 1.20 3.66 0.00 -0.04 -1.55 120.51 133.18 3h6i n ALA 215 Ca 0.06 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.62 3h6i n ALA 215 Cb 0.49 -1.08 0.29 0.00 0.00 0.00 0.00 19.45 19.14 3h6i n ALA 215 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h6i n ASN 216 N -1.53 1.41 -4.75 0.00 5.15 -1.26 -4.46 115.26 109.81 3h6i n ASN 216 Ca 0.01 -1.16 -0.40 0.00 -0.60 0.00 0.00 54.58 52.43 3h6i n ASN 216 Cb 0.05 0.20 -0.06 0.00 -0.53 0.00 0.00 39.78 39.44 3h6i n ASN 216 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3h6i s ARG 217 N -2.42 4.82 0.14 1.20 1.81 -0.59 -4.98 118.95 118.93 3h6i s ARG 217 Ca 0.25 1.49 -0.17 0.00 -1.72 0.00 0.00 55.73 55.57 3h6i s ARG 217 Cb 0.19 -3.23 -0.00 0.00 -0.45 0.00 0.00 34.95 31.46 3h6i s ARG 217 CO 0.50 0.48 1.79 -1.35 -0.68 0.00 0.00 175.30 176.04 3h6i h PRO 218 N 4.03 0.39 0.00 3.54 0.11 -1.89 -3.41 132.00 134.76 3h6i h PRO 218 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3h6i h PRO 218 Cb 1.20 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3h6i h PRO 218 CO 0.68 0.26 -0.25 -2.13 -0.21 0.00 0.00 178.00 176.34 3h6i n ARG 219 N -4.90 0.00 -3.08 1.05 0.63 -1.26 -4.40 116.66 104.71 3h6i n ARG 219 Ca -0.00 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.49 3h6i n ARG 219 Cb 0.05 -0.27 -0.06 0.00 0.45 0.00 0.00 32.46 32.63 3h6i n ARG 219 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3h6i s ARG 220 N -2.00 3.26 0.19 -0.14 0.52 -1.26 -4.31 118.95 115.20 3h6i s ARG 220 Ca 0.00 -0.46 0.09 0.00 -0.52 0.00 0.00 55.73 54.83 3h6i s ARG 220 Cb 0.00 -4.00 0.06 0.00 0.52 0.00 0.00 34.95 31.53 3h6i s ARG 220 CO 0.00 -1.12 1.44 0.00 0.02 0.00 0.00 175.30 175.64 3h6i h ALA 221 N 8.96 0.65 -2.49 2.13 0.00 -1.18 -3.45 119.26 123.88 3h6i h ALA 221 Ca -0.26 -0.74 -0.53 0.00 0.00 0.00 0.00 54.91 53.38 3h6i h ALA 221 Cb 1.09 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.78 3h6i h ALA 221 CO 0.94 1.02 0.92 0.12 0.00 0.00 0.00 179.25 182.25 3h6i s PHE 222 N -3.14 2.71 -0.07 0.00 5.36 -1.26 -0.24 117.98 121.34 3h6i s PHE 222 Ca -0.00 0.52 -0.03 0.00 -0.96 0.00 0.00 56.93 56.46 3h6i s PHE 222 Cb 0.11 -3.89 0.04 0.00 -0.34 0.00 0.00 43.02 38.95 3h6i s PHE 222 CO 0.79 -3.43 0.15 0.50 -1.46 0.00 0.00 175.22 171.78 3h6i s ARG 223 N 2.10 0.07 -0.01 10.12 3.52 -0.23 -4.96 118.95 129.56 3h6i s ARG 223 Ca 0.71 0.45 -0.22 0.00 -0.13 0.00 0.00 55.73 56.54 3h6i s ARG 223 Cb -0.39 -0.21 -0.05 0.00 -1.56 0.00 0.00 34.95 32.74 3h6i s ARG 223 CO 0.31 -0.22 0.65 1.03 -0.81 0.00 0.00 175.30 176.26 3h6i s ARG 224 N 1.62 4.38 -0.49 5.12 0.52 -1.26 -0.99 118.95 127.85 3h6i s ARG 224 Ca -0.04 0.82 -0.07 0.00 -0.52 0.00 0.00 55.73 55.92 3h6i s ARG 224 Cb -0.12 -3.38 0.13 0.00 0.52 0.00 0.00 34.95 32.10 3h6i s ARG 224 CO -0.06 0.27 0.34 0.42 0.02 0.00 0.00 175.30 176.29 3h6i s ILE 225 N 0.10 3.98 0.45 1.52 1.01 -0.59 -4.98 121.20 122.69 3h6i s ILE 225 Ca 0.34 -2.01 0.04 0.00 0.00 0.00 0.00 60.65 59.03 3h6i s ILE 225 Cb -0.18 -3.63 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 3h6i s ILE 225 CO 0.18 -0.78 0.01 0.42 0.00 0.00 0.00 174.94 174.77 3h6i s THR 226 N 1.11 1.64 0.00 2.92 -4.23 -1.26 -4.28 115.64 111.53 3h6i s THR 226 Ca 0.08 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 3h6i s THR 226 Cb -0.24 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 70.96 3h6i s THR 226 CO -0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 3h6i n GLY 227 N -1.10 2.78 0.33 3.99 0.00 -1.26 -2.80 105.19 107.14 3h6i n GLY 227 Ca -0.11 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 45.92 3h6i n GLY 227 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h6i h SER 228 N 0.31 0.55 0.23 1.61 4.64 -2.00 -2.16 113.55 116.73 3h6i h SER 228 Ca 0.00 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.22 3h6i h SER 228 Cb 0.00 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 3h6i h SER 228 CO 0.00 0.38 -0.37 0.00 -0.87 0.00 0.00 176.83 175.97 3h6i h ALA 229 N 1.68 1.20 0.10 5.18 0.00 -1.94 -2.69 119.26 122.79 3h6i h ALA 229 Ca 0.23 -0.37 -0.26 0.00 0.00 0.00 0.00 54.91 54.50 3h6i h ALA 229 Cb 0.12 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.83 3h6i h ALA 229 CO -0.06 0.54 -1.17 1.25 0.00 0.00 0.00 179.25 179.81 3h6i h LEU 230 N 0.17 0.48 -0.82 0.00 5.85 -1.23 -3.25 115.31 116.51 3h6i h LEU 230 Ca 0.02 -0.47 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 3h6i h LEU 230 Cb 0.73 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 3h6i h LEU 230 CO 0.06 1.34 0.45 -0.61 -0.34 0.00 0.00 178.44 179.33 3h6i h GLN 231 N 0.12 1.15 0.00 1.25 4.15 -1.34 -1.62 115.11 118.82 3h6i h GLN 231 Ca -0.13 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.16 3h6i h GLN 231 Cb 1.87 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 29.34 3h6i h GLN 231 CO 0.20 0.85 0.00 0.00 -1.93 0.00 0.00 178.83 177.94 3h6i h ALA 232 N 1.24 1.00 -0.00 3.38 0.00 -1.51 0.17 119.26 123.53 3h6i h ALA 232 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3h6i h ALA 232 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3h6i h ALA 232 CO -0.05 0.00 -0.55 1.28 0.00 0.00 0.00 179.25 179.93 3h6i n LEU 233 N -2.31 0.81 -0.88 0.00 4.32 -0.65 -5.11 117.00 113.19 3h6i n LEU 233 Ca -0.01 -0.56 0.11 0.00 -0.02 0.00 0.00 56.01 55.53 3h6i n LEU 233 Cb 0.07 0.00 0.09 0.00 -1.62 0.00 0.00 43.42 41.96 3h6i n LEU 233 CO 0.12 0.19 0.60 0.18 -1.22 0.00 0.00 177.39 177.25