#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6i h GLU 10 N 0.00 0.82 -0.60 0.54 4.57 -2.05 -2.32 114.58 115.53 3h6i h GLU 10 Ca 0.00 -0.17 -0.01 0.00 -1.18 0.00 0.00 59.36 57.99 3h6i h GLU 10 Cb 0.00 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.44 3h6i h GLU 10 CO 0.00 0.75 0.32 0.37 -1.18 0.00 0.00 179.01 179.27 3h6i h GLN 11 N 0.79 0.83 -0.76 1.92 4.15 -2.05 0.24 115.11 120.23 3h6i h GLN 11 Ca 0.17 -0.09 -0.02 0.00 0.77 0.00 0.00 58.65 59.48 3h6i h GLN 11 Cb 0.31 -0.17 -0.03 0.00 0.21 0.00 0.00 27.48 27.80 3h6i h GLN 11 CO 0.00 0.62 0.38 0.00 -1.93 0.00 0.00 178.83 177.90 3h6i h ALA 12 N 1.51 0.97 -0.65 3.38 0.00 -1.86 -1.06 119.26 121.55 3h6i h ALA 12 Ca 0.21 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3h6i h ALA 12 Cb 0.04 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 3h6i h ALA 12 CO -0.03 0.52 0.30 1.98 0.00 0.00 0.00 179.25 182.01 3h6i h MET 13 N 1.06 0.93 -0.23 0.00 1.85 -0.89 0.30 114.93 117.94 3h6i h MET 13 Ca 0.26 -0.13 0.04 0.00 -0.61 0.00 0.00 59.70 59.26 3h6i h MET 13 Cb 0.09 -0.17 -0.01 0.00 0.43 0.00 0.00 31.60 31.94 3h6i h MET 13 CO -0.04 0.73 0.16 -0.09 -0.40 0.00 0.00 176.91 177.27 3h6i h ARG 14 N 0.92 0.14 -0.44 0.39 2.43 0.13 -0.16 114.38 117.80 3h6i h ARG 14 Ca 0.22 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.32 3h6i h ARG 14 Cb 0.12 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 3h6i h ARG 14 CO -0.03 0.09 -0.00 0.93 -1.51 0.00 0.00 179.97 179.45 3h6i h GLU 15 N 0.14 0.77 -0.81 0.20 5.08 0.76 -0.53 114.58 120.19 3h6i h GLU 15 Ca 0.10 -0.25 0.05 0.00 -1.00 0.00 0.00 59.36 58.27 3h6i h GLU 15 Cb 0.22 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.35 3h6i h GLU 15 CO -0.01 0.84 0.50 0.00 -1.00 0.00 0.00 179.01 179.34 3h6i h ARG 16 N 0.61 0.90 -0.73 2.33 3.08 -0.54 0.39 114.38 120.43 3h6i h ARG 16 Ca 0.12 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 3h6i h ARG 16 Cb 0.50 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 3h6i h ARG 16 CO 0.02 0.60 0.37 0.77 -1.07 0.00 0.00 179.97 180.66 3h6i h SER 17 N 0.93 0.93 -0.67 7.04 0.02 -1.07 -1.47 113.55 119.26 3h6i h SER 17 Ca 0.35 -0.12 -0.06 0.00 -0.84 0.00 0.00 61.79 61.12 3h6i h SER 17 Cb 0.13 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 3h6i h SER 17 CO -0.16 0.79 0.21 -0.33 -1.14 0.00 0.00 176.83 176.19 3h6i h GLU 18 N 1.01 1.06 -0.53 3.45 4.39 0.42 -0.36 114.58 124.03 3h6i h GLU 18 Ca 0.25 -0.22 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 3h6i h GLU 18 Cb 0.08 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 3h6i h GLU 18 CO -0.04 0.91 0.33 1.25 -1.16 0.00 0.00 179.01 180.31 3h6i h LEU 19 N 1.02 0.63 -0.24 1.33 6.46 0.19 0.18 115.31 124.88 3h6i h LEU 19 Ca 0.22 -0.04 -0.07 0.00 -0.12 0.00 0.00 57.88 57.87 3h6i h LEU 19 Cb 0.30 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 3h6i h LEU 19 CO -0.01 0.48 -0.13 0.00 -0.62 0.00 0.00 178.44 178.17 3h6i h ALA 20 N 1.17 0.34 0.14 1.25 0.00 -0.76 -3.13 119.26 118.27 3h6i h ALA 20 Ca 0.19 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.80 3h6i h ALA 20 Cb -0.04 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3h6i h ALA 20 CO -0.04 0.21 -0.26 -0.09 0.00 0.00 0.00 179.25 179.07 3h6i h ARG 21 N 0.23 -0.47 -0.98 0.00 2.43 -0.59 -2.61 114.38 112.40 3h6i h ARG 21 Ca 0.05 0.03 0.17 0.00 -0.81 0.00 0.00 59.98 59.43 3h6i h ARG 21 Cb 0.64 0.11 -0.09 0.00 -0.42 0.00 0.00 29.97 30.20 3h6i h ARG 21 CO 0.04 -0.31 0.61 0.87 -1.51 0.00 0.00 179.97 179.67 3h6i h LYS 22 N -0.49 0.72 -0.22 0.20 1.57 -0.77 0.21 116.57 117.79 3h6i h LYS 22 Ca 0.02 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 3h6i h LYS 22 Cb 0.50 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3h6i h LYS 22 CO -0.13 0.47 -0.37 0.78 -0.57 0.00 0.00 179.45 179.63 3h6i h GLY 23 N 0.74 0.53 1.18 3.86 0.00 -1.41 -1.90 103.07 106.06 3h6i h GLY 23 Ca 0.53 -0.50 -0.22 0.00 0.00 0.00 0.00 47.33 47.14 3h6i h GLY 23 CO -0.30 0.45 -0.78 -2.22 0.00 0.00 0.00 176.54 173.70 3h6i h ILE 24 N 0.41 1.27 0.00 2.60 2.04 -0.86 -3.07 117.51 119.91 3h6i h ILE 24 Ca 0.04 -1.96 -0.04 0.00 1.00 0.00 0.00 64.86 63.90 3h6i h ILE 24 Cb 0.83 1.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.88 3h6i h ILE 24 CO 0.07 0.62 -0.19 0.00 0.00 0.00 0.00 178.15 178.66 3h6i h ALA 25 N 0.55 1.60 0.00 1.87 0.00 -0.87 -0.99 119.26 121.43 3h6i h ALA 25 Ca -0.05 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 3h6i h ALA 25 Cb 1.41 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 3h6i h ALA 25 CO 0.16 0.23 -0.42 -0.09 0.00 0.00 0.00 179.25 179.13 3h6i h ARG 26 N 0.00 0.00 -7.21 0.00 2.43 -1.29 -3.32 114.38 104.98 3h6i h ARG 26 Ca -0.00 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 58.69 3h6i h ARG 26 Cb 0.35 0.00 0.06 0.00 -0.42 0.00 0.00 29.97 29.96 3h6i h ARG 26 CO 0.02 0.42 0.25 0.00 -1.51 0.00 0.00 179.97 179.16 3h6i s ALA 27 N -3.24 3.19 0.87 2.80 0.00 -0.89 -4.92 121.76 119.56 3h6i s ALA 27 Ca 0.02 -0.55 -0.10 0.00 0.00 0.00 0.00 51.96 51.33 3h6i s ALA 27 Cb 0.09 -2.74 0.11 0.00 0.00 0.00 0.00 23.12 20.58 3h6i s ALA 27 CO 0.71 -0.85 1.11 0.15 0.00 0.00 0.00 175.76 176.88 3h6i s LYS 28 N -5.08 1.45 0.10 0.00 -0.14 -1.26 -1.87 119.74 112.94 3h6i s LYS 28 Ca 0.55 1.31 -0.00 0.00 -1.36 0.00 0.00 55.97 56.46 3h6i s LYS 28 Cb -0.11 -1.79 -0.04 0.00 -1.68 0.00 0.00 37.83 34.21 3h6i s LYS 28 CO 0.47 -2.25 0.26 -1.12 -0.76 0.00 0.00 175.35 171.96 3h6i s SER 29 N -3.02 6.38 0.01 2.83 0.01 -1.26 -4.11 113.70 114.54 3h6i s SER 29 Ca 0.64 0.30 0.03 0.00 1.31 0.00 0.00 55.95 58.24 3h6i s SER 29 Cb -0.20 -1.97 -0.01 0.00 0.21 0.00 0.00 66.02 64.04 3h6i s SER 29 CO 0.57 0.11 -0.10 -0.69 0.41 0.00 0.00 173.24 173.54 3h6i s VAL 30 N -1.61 0.80 -0.04 3.43 1.01 0.50 -1.85 120.40 122.64 3h6i s VAL 30 Ca 0.36 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.75 3h6i s VAL 30 Cb -0.12 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.56 3h6i s VAL 30 CO 0.28 0.09 -0.12 -0.69 0.00 0.00 0.00 175.10 174.65 3h6i s VAL 31 N -0.50 1.09 -0.11 2.92 1.01 0.58 -0.46 120.40 124.93 3h6i s VAL 31 Ca 0.01 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.50 3h6i s VAL 31 Cb -0.05 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.38 3h6i s VAL 31 CO 0.00 0.33 -0.13 0.00 0.00 0.00 0.00 175.10 175.30 3h6i s ALA 32 N 0.32 1.61 0.02 5.51 0.00 -0.06 -0.75 121.76 128.41 3h6i s ALA 32 Ca -0.07 -0.70 -0.00 0.00 0.00 0.00 0.00 51.96 51.19 3h6i s ALA 32 Cb -0.12 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.12 3h6i s ALA 32 CO 0.02 -0.17 -0.03 -0.48 0.00 0.00 0.00 175.76 175.10 3h6i s LEU 33 N 1.16 2.26 0.03 0.00 0.05 -0.15 -0.30 118.68 121.74 3h6i s LEU 33 Ca -0.03 -0.55 -0.28 0.00 0.05 0.00 0.00 54.13 53.32 3h6i s LEU 33 Cb -0.14 0.11 -0.04 0.00 -2.05 0.00 0.00 46.19 44.06 3h6i s LEU 33 CO -0.04 -0.33 0.90 0.00 -0.55 0.00 0.00 176.35 176.33 3h6i s ALA 34 N -1.68 3.25 0.04 1.48 0.00 -0.75 -0.67 121.76 123.42 3h6i s ALA 34 Ca -0.14 0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.27 3h6i s ALA 34 Cb -0.08 -3.21 -0.00 0.00 0.00 0.00 0.00 23.12 19.83 3h6i s ALA 34 CO -0.02 -0.10 0.02 2.48 0.00 0.00 0.00 175.76 178.14 3h6i n TYR 35 N 3.35 -0.01 0.09 0.00 0.18 -0.79 -4.74 117.16 115.25 3h6i n TYR 35 Ca 0.02 -0.25 -0.13 0.00 1.88 0.00 0.00 57.90 59.42 3h6i n TYR 35 Cb 0.50 0.01 -0.08 0.00 -0.38 0.00 0.00 39.34 39.39 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 1.07 -0.19 -0.22 -3.48 0.00 -1.57 -3.21 119.26 111.66 3h6i h ALA 36 Ca -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3h6i h ALA 36 Cb 0.11 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3h6i h ALA 36 CO 0.04 -0.54 0.00 0.41 0.00 0.00 0.00 179.25 179.16 3h6i n GLY 37 N -0.81 0.09 0.00 0.00 0.00 -1.26 -5.02 105.19 98.20 3h6i n GLY 37 Ca -0.09 -0.27 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 0.91 0.47 3.21 -0.02 0.00 -1.21 -1.12 105.19 107.42 3h6i n GLY 38 Ca 0.09 -0.76 -0.24 0.00 0.00 0.00 0.00 46.02 45.11 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 1.51 -0.06 1.61 1.01 -0.85 -1.88 120.40 121.74 3h6i s VAL 39 Ca 0.00 -1.05 0.05 0.00 0.00 0.00 0.00 61.98 60.98 3h6i s VAL 39 Cb 0.00 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.07 3h6i s VAL 39 CO 0.00 0.22 -0.22 -0.22 0.00 0.00 0.00 175.10 174.88 3h6i s LEU 40 N -0.97 2.02 -0.15 3.92 2.96 0.15 -1.03 118.68 125.58 3h6i s LEU 40 Ca 0.06 -0.48 0.00 0.00 -0.22 0.00 0.00 54.13 53.50 3h6i s LEU 40 Cb -0.08 -1.27 -0.00 0.00 0.50 0.00 0.00 46.19 45.34 3h6i s LEU 40 CO 0.01 0.19 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.72 3h6i s PHE 41 N 0.04 2.78 -0.06 5.38 0.08 0.73 -0.97 117.98 125.94 3h6i s PHE 41 Ca -0.08 -0.99 0.00 0.00 0.12 0.00 0.00 56.93 55.99 3h6i s PHE 41 Cb -0.14 -1.88 0.02 0.00 -0.57 0.00 0.00 43.02 40.45 3h6i s PHE 41 CO 0.05 -0.44 -0.04 0.08 -0.10 0.00 0.00 175.22 174.76 3h6i s VAL 42 N 0.75 0.62 0.03 -0.44 1.01 0.07 -1.85 120.40 120.59 3h6i s VAL 42 Ca -0.06 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 61.83 3h6i s VAL 42 Cb -0.15 -0.67 -0.02 0.00 0.00 0.00 0.00 36.38 35.54 3h6i s VAL 42 CO 0.01 0.27 -0.09 0.00 0.00 0.00 0.00 175.10 175.29 3h6i s ALA 43 N 1.31 0.69 -0.48 5.51 0.00 -0.56 -0.30 121.76 127.93 3h6i s ALA 43 Ca -0.04 -0.65 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 3h6i s ALA 43 Cb -0.14 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 22.95 3h6i s ALA 43 CO -0.02 0.07 1.34 -1.21 0.00 0.00 0.00 175.76 175.94 3h6i s GLU 44 N -1.13 3.53 -0.30 0.00 2.02 -0.77 -1.85 118.70 120.20 3h6i s GLU 44 Ca -0.04 0.69 0.01 0.00 0.02 0.00 0.00 54.97 55.64 3h6i s GLU 44 Cb -0.08 -4.02 0.14 0.00 0.10 0.00 0.00 34.13 30.27 3h6i s GLU 44 CO 0.01 -1.63 0.34 1.21 0.02 0.00 0.00 175.26 175.20 3h6i s ASN 45 N 3.68 1.25 0.24 -0.19 2.47 0.13 -4.69 114.94 117.84 3h6i s ASN 45 Ca 0.55 -0.72 -0.03 0.00 0.42 0.00 0.00 52.86 53.09 3h6i s ASN 45 Cb -0.11 0.69 0.28 0.00 -1.45 0.00 0.00 41.25 40.66 3h6i s ASN 45 CO 0.30 -0.37 1.70 1.55 -3.72 0.00 0.00 177.10 176.56 3h6i h PRO 46 N 8.14 0.75 -6.61 0.43 0.13 -1.80 -3.30 132.00 129.73 3h6i h PRO 46 Ca -0.10 -0.25 -0.57 0.00 -0.87 0.00 0.00 66.00 64.21 3h6i h PRO 46 Cb 1.09 -0.06 0.07 0.00 0.13 0.00 0.00 31.00 32.23 3h6i h PRO 46 CO 0.30 0.84 0.76 0.45 -0.23 0.00 0.00 178.00 180.13 3h6i n SER 47 N -4.16 3.20 -0.04 1.44 2.88 -1.26 -4.84 113.62 110.85 3h6i n SER 47 Ca 0.01 1.12 -0.05 0.00 -1.33 0.00 0.00 58.87 58.62 3h6i n SER 47 Cb 0.37 -1.48 0.15 0.00 -0.75 0.00 0.00 64.21 62.51 3h6i n SER 47 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 3h6i h ARG 48 N 5.09 0.62 0.00 -1.46 0.11 -1.95 -3.39 114.38 113.40 3h6i h ARG 48 Ca -0.45 -0.23 0.00 0.00 0.10 0.00 0.00 59.98 59.40 3h6i h ARG 48 Cb 1.25 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.29 3h6i h ARG 48 CO 0.82 0.79 -0.27 0.45 0.10 0.00 0.00 179.97 181.86 3h6i n SER 49 N -4.13 1.36 -4.45 0.08 2.88 -1.26 -4.96 113.62 103.15 3h6i n SER 49 Ca 0.00 -0.29 -0.44 0.00 -1.33 0.00 0.00 58.87 56.81 3h6i n SER 49 Cb 0.41 0.85 -0.02 0.00 -0.75 0.00 0.00 64.21 64.70 3h6i n SER 49 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3h6i s LEU 50 N -1.98 5.11 0.28 2.46 1.43 -1.26 -5.02 118.68 119.71 3h6i s LEU 50 Ca 0.00 -2.39 -0.29 0.00 -1.03 0.00 0.00 54.13 50.42 3h6i s LEU 50 Cb 0.00 -2.39 -0.10 0.00 0.03 0.00 0.00 46.19 43.73 3h6i s LEU 50 CO 0.00 -0.94 1.26 -1.10 0.23 0.00 0.00 176.35 175.80 3h6i s GLN 51 N 2.22 4.43 -0.01 1.70 -0.21 -1.26 -4.90 119.66 121.63 3h6i s GLN 51 Ca 0.36 2.08 0.13 0.00 0.02 0.00 0.00 55.36 57.94 3h6i s GLN 51 Cb -0.04 -3.13 -0.16 0.00 1.00 0.00 0.00 33.01 30.68 3h6i s GLN 51 CO -0.06 -0.11 0.45 1.63 -2.12 0.00 0.00 175.29 175.07 3h6i n LYS 52 N 1.38 2.00 -5.17 2.91 5.02 -1.26 -4.97 118.16 118.07 3h6i n LYS 52 Ca 0.01 -0.04 -0.30 0.00 -2.02 0.00 0.00 58.31 55.97 3h6i n LYS 52 Cb 0.43 -1.17 -0.16 0.00 -0.02 0.00 0.00 35.03 34.11 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 -2.43 1.87 0.11 -0.18 1.01 -1.26 -1.09 121.20 119.23 3h6i s ILE 53 Ca 0.02 -1.00 -0.22 0.00 0.00 0.00 0.00 60.65 59.45 3h6i s ILE 53 Cb 0.09 -1.57 0.06 0.00 0.01 0.00 0.00 42.46 41.05 3h6i s ILE 53 CO 0.53 0.53 0.54 -0.55 0.00 0.00 0.00 174.94 175.98 3h6i s SER 54 N -0.40 -0.46 0.34 3.58 0.15 0.10 -4.98 113.70 112.03 3h6i s SER 54 Ca 0.05 -0.00 -0.28 0.00 0.70 0.00 0.00 55.95 56.42 3h6i s SER 54 Cb -0.11 0.54 -0.09 0.00 -1.71 0.00 0.00 66.02 64.65 3h6i s SER 54 CO 0.01 -0.86 1.16 -0.70 1.20 0.00 0.00 173.24 174.04 3h6i s GLU 55 N -3.32 4.36 -0.09 5.44 2.12 -1.26 0.32 118.70 126.27 3h6i s GLU 55 Ca -0.01 1.88 -0.05 0.00 0.36 0.00 0.00 54.97 57.15 3h6i s GLU 55 Cb -0.00 -2.95 -0.04 0.00 0.26 0.00 0.00 34.13 31.40 3h6i s GLU 55 CO -0.09 -0.06 -0.13 1.28 -0.54 0.00 0.00 175.26 175.72 3h6i n LEU 56 N 0.66 0.84 0.00 2.70 4.77 -0.57 -4.78 117.00 120.62 3h6i n LEU 56 Ca 0.01 0.14 -0.07 0.00 -0.03 0.00 0.00 56.01 56.06 3h6i n LEU 56 Cb 0.45 -0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 3h6i n LEU 56 CO 0.53 0.08 0.12 0.00 -1.33 0.00 0.00 177.39 176.79 3h6i n TYR 57 N -3.53 -1.10 -0.14 -1.77 9.36 -1.04 -4.72 117.16 114.23 3h6i n TYR 57 Ca -0.18 -1.15 -0.04 0.00 3.32 0.00 0.00 57.90 59.85 3h6i n TYR 57 Cb 0.57 0.32 0.05 0.00 -0.63 0.00 0.00 39.34 39.64 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 1.00 0.18 -0.07 2.98 3.32 -1.94 -2.82 116.42 119.08 3h6i h ASP 58 Ca -0.14 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.96 3h6i h ASP 58 Cb 0.61 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.19 3h6i h ASP 58 CO 0.19 0.14 0.00 0.54 -1.72 0.00 0.00 179.24 178.39 3h6i n ARG 59 N -5.00 0.94 -4.28 3.56 5.12 -1.26 -1.25 116.66 114.49 3h6i n ARG 59 Ca 0.04 -1.32 -0.34 0.00 -1.93 0.00 0.00 57.85 54.29 3h6i n ARG 59 Cb 0.17 -1.23 -0.10 0.00 -1.16 0.00 0.00 32.46 30.14 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 -0.97 4.33 0.28 1.55 1.01 -1.07 -2.31 120.40 123.22 3h6i s VAL 60 Ca 0.15 -0.22 0.11 0.00 0.00 0.00 0.00 61.98 62.02 3h6i s VAL 60 Cb 0.10 -2.88 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 3h6i s VAL 60 CO 0.15 0.53 -0.17 -0.83 0.00 0.00 0.00 175.10 174.78 3h6i s GLY 61 N -0.16 1.90 0.05 4.51 0.00 0.33 -1.51 107.32 112.44 3h6i s GLY 61 Ca 0.05 -1.90 0.05 0.00 0.00 0.00 0.00 44.72 42.92 3h6i s GLY 61 CO 0.02 -1.95 -0.13 -0.12 0.00 0.00 0.00 173.10 170.91 3h6i s PHE 62 N -2.60 1.16 -0.17 1.90 2.19 0.15 -1.50 117.98 119.11 3h6i s PHE 62 Ca 0.30 -0.41 -0.21 0.00 0.33 0.00 0.00 56.93 56.94 3h6i s PHE 62 Cb -0.03 -0.67 0.05 0.00 -1.31 0.00 0.00 43.02 41.06 3h6i s PHE 62 CO 0.14 0.04 0.56 0.00 1.83 0.00 0.00 175.22 177.79 3h6i s ALA 63 N -1.08 -1.40 0.14 11.12 0.00 -0.60 0.03 121.76 129.97 3h6i s ALA 63 Ca -0.01 1.46 -0.10 0.00 0.00 0.00 0.00 51.96 53.31 3h6i s ALA 63 Cb -0.09 -0.72 0.00 0.00 0.00 0.00 0.00 23.12 22.31 3h6i s ALA 63 CO 0.02 -0.28 0.28 0.00 0.00 0.00 0.00 175.76 175.77 3h6i s ALA 64 N -0.04 -0.22 0.02 0.00 0.00 -0.25 -0.43 121.76 120.84 3h6i s ALA 64 Ca -0.03 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.26 3h6i s ALA 64 Cb -0.04 0.72 -0.01 0.00 0.00 0.00 0.00 23.12 23.79 3h6i s ALA 64 CO 0.02 -0.61 -0.04 0.00 0.00 0.00 0.00 175.76 175.13 3h6i s ALA 65 N -3.91 0.25 0.00 0.00 0.00 -0.61 -4.84 121.76 112.65 3h6i s ALA 65 Ca 0.11 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.66 3h6i s ALA 65 Cb 0.03 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.19 3h6i s ALA 65 CO -0.05 -0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.08 3h6i n GLY 66 N 2.19 0.51 3.63 0.00 0.00 -1.26 -0.83 105.19 109.43 3h6i n GLY 66 Ca -0.19 -1.74 -0.43 0.00 0.00 0.00 0.00 46.02 43.66 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 -1.21 3.94 0.20 1.61 2.20 -0.52 -4.91 119.74 121.04 3h6i s LYS 67 Ca 0.00 0.94 -0.21 0.00 -0.36 0.00 0.00 55.97 56.34 3h6i s LYS 67 Cb 0.00 -3.81 0.14 0.00 -1.51 0.00 0.00 37.83 32.65 3h6i s LYS 67 CO 0.00 -1.08 1.57 0.35 -0.36 0.00 0.00 175.35 175.83 3h6i h PHE 68 N 8.61 -1.08 -0.48 4.03 3.57 -1.96 -1.61 116.94 128.02 3h6i h PHE 68 Ca -0.22 0.09 0.13 0.00 3.53 0.00 0.00 57.97 61.50 3h6i h PHE 68 Cb 1.07 0.58 -0.02 0.00 2.79 0.00 0.00 35.95 40.36 3h6i h PHE 68 CO 0.88 -0.40 0.34 -2.95 -2.23 0.00 0.00 178.31 173.96 3h6i h ASN 69 N -0.12 0.06 0.19 0.41 -0.00 -1.99 0.96 115.58 115.09 3h6i h ASN 69 Ca 0.26 0.00 -0.27 0.00 -0.00 0.00 0.00 56.30 56.28 3h6i h ASN 69 Cb 0.56 -0.01 0.02 0.00 -0.00 0.00 0.00 38.32 38.90 3h6i h ASN 69 CO -0.79 0.03 -1.26 -0.33 -0.00 0.00 0.00 177.43 175.09 3h6i h GLU 70 N 0.06 0.40 0.00 4.14 5.08 -1.72 -2.99 114.58 119.55 3h6i h GLU 70 Ca 0.23 -0.68 -0.10 0.00 -1.00 0.00 0.00 59.36 57.81 3h6i h GLU 70 Cb 0.83 0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 3h6i h GLU 70 CO -0.02 1.33 -0.48 0.27 -1.00 0.00 0.00 179.01 179.10 3h6i h PHE 71 N -0.11 0.00 -0.32 4.33 -5.15 -0.98 -2.81 116.94 111.89 3h6i h PHE 71 Ca -0.23 0.00 -0.14 0.00 -0.20 0.00 0.00 57.97 57.40 3h6i h PHE 71 Cb 1.91 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 38.07 3h6i h PHE 71 CO 0.15 0.48 -0.36 0.22 -2.00 0.00 0.00 178.31 176.80 3h6i h ASP 72 N 0.00 0.77 -0.67 -0.68 3.58 -0.94 -0.55 116.42 117.94 3h6i h ASP 72 Ca -0.01 -0.33 -0.02 0.00 0.42 0.00 0.00 57.03 57.09 3h6i h ASP 72 Cb 1.37 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 42.17 3h6i h ASP 72 CO 0.06 1.06 0.36 -1.13 -2.88 0.00 0.00 179.24 176.71 3h6i h ASN 73 N 0.61 0.86 0.94 2.28 -1.24 -1.45 -0.62 115.58 116.96 3h6i h ASN 73 Ca 0.06 -0.07 -0.16 0.00 0.71 0.00 0.00 56.30 56.84 3h6i h ASN 73 Cb 0.89 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.70 3h6i h ASN 73 CO 0.08 0.70 -0.74 -0.07 -1.29 0.00 0.00 177.43 176.11 3h6i h LEU 74 N 0.96 0.00 -0.23 0.34 3.38 -1.23 -1.79 115.31 116.73 3h6i h LEU 74 Ca 0.24 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 3h6i h LEU 74 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3h6i h LEU 74 CO -0.04 0.74 -0.04 -0.09 0.09 0.00 0.00 178.44 179.10 3h6i h ARG 75 N 0.00 0.44 -0.30 1.13 2.43 -0.16 -1.23 114.38 116.69 3h6i h ARG 75 Ca -0.01 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 58.98 3h6i h ARG 75 Cb 1.41 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.92 3h6i h ARG 75 CO 0.10 0.66 0.12 0.00 -1.51 0.00 0.00 179.97 179.33 3h6i h ARG 76 N 0.19 0.45 -0.34 0.20 3.08 -1.11 -1.80 114.38 115.05 3h6i h ARG 76 Ca 0.06 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 3h6i h ARG 76 Cb 0.48 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 3h6i h ARG 76 CO 0.02 0.47 0.07 0.78 -1.07 0.00 0.00 179.97 180.24 3h6i h GLY 77 N 0.33 0.53 1.07 0.04 0.00 -1.29 -0.42 103.07 103.33 3h6i h GLY 77 Ca 0.10 -0.28 -0.17 0.00 0.00 0.00 0.00 47.33 46.98 3h6i h GLY 77 CO -0.01 0.26 -0.54 -1.33 0.00 0.00 0.00 176.54 174.92 3h6i h GLY 78 N 0.74 0.83 1.18 4.60 0.00 -0.94 -1.24 103.07 108.24 3h6i h GLY 78 Ca 0.11 -1.03 -0.08 0.00 0.00 0.00 0.00 47.33 46.34 3h6i h GLY 78 CO -0.00 0.92 0.06 -2.22 0.00 0.00 0.00 176.54 175.30 3h6i h ILE 79 N 0.49 1.26 -0.29 2.60 2.04 -0.86 -0.32 117.51 122.43 3h6i h ILE 79 Ca -0.01 -1.04 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 3h6i h ILE 79 Cb 1.16 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 3h6i h ILE 79 CO 0.12 0.38 0.14 -0.61 0.00 0.00 0.00 178.15 178.18 3h6i h GLN 80 N 0.93 0.41 0.10 2.37 5.75 -1.02 -0.78 115.11 122.88 3h6i h GLN 80 Ca 0.18 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.62 3h6i h GLN 80 Cb 0.46 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.93 3h6i h GLN 80 CO 0.02 0.39 -0.05 0.35 -2.65 0.00 0.00 178.83 176.88 3h6i h PHE 81 N 0.34 -0.13 -0.52 3.99 3.57 -1.02 -2.33 116.94 120.84 3h6i h PHE 81 Ca 0.10 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.62 3h6i h PHE 81 Cb 0.11 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 3h6i h PHE 81 CO -0.02 0.12 0.32 0.00 -2.23 0.00 0.00 178.31 176.49 3h6i h ALA 82 N 0.51 0.66 -0.69 2.41 0.00 -0.93 -1.13 119.26 120.10 3h6i h ALA 82 Ca -0.01 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3h6i h ALA 82 Cb 0.30 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3h6i h ALA 82 CO 0.02 0.04 0.17 -0.44 0.00 0.00 0.00 179.25 179.04 3h6i h ASP 83 N 0.64 1.04 -0.23 0.00 3.32 -1.14 -0.54 116.42 119.51 3h6i h ASP 83 Ca 0.20 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 3h6i h ASP 83 Cb -0.00 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 3h6i h ASP 83 CO -0.08 0.99 0.03 0.74 -1.72 0.00 0.00 179.24 179.20 3h6i h THR 84 N 1.04 1.23 -0.04 0.35 2.02 -1.20 -2.40 112.91 113.92 3h6i h THR 84 Ca 0.22 -0.77 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 3h6i h THR 84 Cb 0.36 1.30 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 3h6i h THR 84 CO 0.00 0.24 0.02 0.03 0.37 0.00 0.00 175.52 176.18 3h6i h ARG 85 N 0.18 0.06 0.00 6.66 2.47 -1.00 -0.82 114.38 121.93 3h6i h ARG 85 Ca 0.07 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.77 3h6i h ARG 85 Cb 0.33 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.64 3h6i h ARG 85 CO 0.01 0.15 -0.05 0.78 0.56 0.00 0.00 179.97 181.42 3h6i h GLY 86 N -0.04 0.00 0.96 0.04 0.00 -1.09 0.28 103.07 103.21 3h6i h GLY 86 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.02 3h6i h GLY 86 CO -0.00 0.00 -1.74 -1.82 0.00 0.00 0.00 176.54 172.98 3h6i h TYR 87 N 0.00 0.34 0.00 5.60 3.20 -0.94 -3.25 116.97 121.92 3h6i h TYR 87 Ca -0.00 -0.25 -0.14 0.00 3.14 0.00 0.00 58.73 61.48 3h6i h TYR 87 Cb 0.21 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 3h6i h TYR 87 CO 0.00 1.42 -0.68 0.00 -1.64 0.00 0.00 178.16 177.25 3h6i h ALA 88 N 0.49 0.61 -3.00 1.82 0.00 -0.78 -3.45 119.26 114.96 3h6i h ALA 88 Ca -0.32 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 53.97 3h6i h ALA 88 Cb 2.02 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.70 3h6i h ALA 88 CO 0.11 0.85 0.00 0.66 0.00 0.00 0.00 179.25 180.88 3h6i n TYR 89 N -3.35 0.00 -3.81 0.00 4.01 0.05 -5.08 117.16 108.97 3h6i n TYR 89 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.65 3h6i n TYR 89 Cb 0.78 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.75 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 0.72 -0.05 0.53 7.72 1.47 -1.23 -4.97 116.67 120.87 3h6i s ASP 90 Ca 0.00 -0.61 0.18 0.00 1.18 0.00 0.00 52.55 53.31 3h6i s ASP 90 Cb 0.00 0.44 1.33 0.00 -0.34 0.00 0.00 42.92 44.35 3h6i s ASP 90 CO 0.00 -0.86 2.13 0.03 0.68 0.00 0.00 175.17 177.16 3h6i h ARG 91 N 2.51 0.00 0.00 2.11 3.08 -1.91 -2.16 114.38 118.02 3h6i h ARG 91 Ca -0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.72 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 -2.13 -1.07 0.00 0.00 179.97 177.26 3h6i n ARG 92 N -4.46 0.19 0.19 0.04 0.63 -1.26 -2.95 116.66 109.04 3h6i n ARG 92 Ca -0.01 0.41 0.03 0.00 -0.92 0.00 0.00 57.85 57.36 3h6i n ARG 92 Cb 0.17 -1.85 0.39 0.00 0.45 0.00 0.00 32.46 31.61 3h6i n ARG 92 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 3h6i h ASP 93 N 0.00 0.03 -3.17 6.15 3.58 -1.76 -3.41 116.42 117.83 3h6i h ASP 93 Ca 0.00 -0.01 -0.57 0.00 0.42 0.00 0.00 57.03 56.87 3h6i h ASP 93 Cb 0.37 -0.01 -0.06 0.00 1.72 0.00 0.00 39.33 41.36 3h6i h ASP 93 CO 0.00 0.34 0.87 -0.69 -2.88 0.00 0.00 179.24 176.87 3h6i s VAL 94 N -4.34 4.45 0.20 2.25 1.01 -1.15 -4.93 120.40 117.89 3h6i s VAL 94 Ca -0.03 1.70 0.02 0.00 0.00 0.00 0.00 61.98 63.67 3h6i s VAL 94 Cb 0.15 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 3h6i s VAL 94 CO 0.72 -0.37 0.00 0.42 0.00 0.00 0.00 175.10 175.88 3h6i s THR 95 N 3.66 0.81 0.15 3.92 -4.23 -1.26 -4.96 115.64 113.72 3h6i s THR 95 Ca 0.48 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.84 3h6i s THR 95 Cb -0.15 -2.23 0.02 0.00 1.34 0.00 0.00 72.50 71.48 3h6i s THR 95 CO 0.14 -0.39 1.70 1.23 -0.54 0.00 0.00 174.62 176.77 3h6i h GLY 96 N 2.59 0.74 0.37 3.99 0.00 -1.95 -1.91 103.07 106.90 3h6i h GLY 96 Ca -0.37 -0.40 0.08 0.00 0.00 0.00 0.00 47.33 46.64 3h6i h GLY 96 CO 0.63 0.38 0.07 -0.09 0.00 0.00 0.00 176.54 177.52 3h6i h ARG 97 N 0.61 0.19 0.13 4.80 2.43 -1.96 0.16 114.38 120.73 3h6i h ARG 97 Ca 0.16 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 3h6i h ARG 97 Cb 0.18 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 3h6i h ARG 97 CO -0.01 0.12 -0.06 0.37 -1.51 0.00 0.00 179.97 178.88 3h6i h GLN 98 N 0.19 -0.16 -0.74 0.20 4.15 -1.86 -0.61 115.11 116.28 3h6i h GLN 98 Ca 0.23 0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.62 3h6i h GLN 98 Cb 0.31 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.00 3h6i h GLN 98 CO -0.32 -0.04 0.30 -0.07 -1.93 0.00 0.00 178.83 176.76 3h6i h LEU 99 N -0.24 1.01 -0.62 -2.39 3.38 -0.95 -0.62 115.31 114.88 3h6i h LEU 99 Ca -0.02 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 3h6i h LEU 99 Cb 0.19 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 3h6i h LEU 99 CO 0.03 0.90 0.17 0.00 0.09 0.00 0.00 178.44 179.63 3h6i h ALA 100 N 1.25 0.81 -0.46 1.53 0.00 -0.55 -0.52 119.26 121.32 3h6i h ALA 100 Ca 0.25 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3h6i h ALA 100 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3h6i h ALA 100 CO -0.02 0.50 0.25 -0.97 0.00 0.00 0.00 179.25 179.01 3h6i h ASN 101 N 0.90 0.58 -0.50 0.00 -0.73 -0.70 -0.75 115.58 114.39 3h6i h ASN 101 Ca 0.20 -0.10 -0.06 0.00 1.87 0.00 0.00 56.30 58.21 3h6i h ASN 101 Cb 0.32 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 38.74 3h6i h ASN 101 CO -0.00 0.51 0.11 0.58 -0.37 0.00 0.00 177.43 178.26 3h6i h VAL 102 N 0.60 1.23 -0.28 2.57 2.07 -0.67 -1.60 116.25 120.18 3h6i h VAL 102 Ca 0.16 -0.87 -0.13 0.00 0.82 0.00 0.00 66.70 66.67 3h6i h VAL 102 Cb 0.06 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3h6i h VAL 102 CO -0.02 0.32 -0.37 1.88 0.02 0.00 0.00 177.57 179.40 3h6i h TYR 103 N 0.82 0.76 -0.41 1.57 0.05 -0.65 -1.29 116.97 117.82 3h6i h TYR 103 Ca 0.18 -0.21 -0.02 0.00 0.05 0.00 0.00 58.73 58.72 3h6i h TYR 103 Cb 0.34 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 37.89 3h6i h TYR 103 CO 0.02 0.92 0.18 0.00 -1.05 0.00 0.00 178.16 178.23 3h6i h ALA 104 N 1.05 0.53 -0.48 3.88 0.00 -0.73 0.36 119.26 123.88 3h6i h ALA 104 Ca 0.05 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3h6i h ALA 104 Cb 0.88 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3h6i h ALA 104 CO 0.08 0.12 0.12 1.96 0.00 0.00 0.00 179.25 181.52 3h6i h GLN 105 N 0.52 0.76 -0.05 0.00 1.08 -1.13 0.52 115.11 116.82 3h6i h GLN 105 Ca 0.14 -0.18 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 3h6i h GLN 105 Cb 0.17 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.49 3h6i h GLN 105 CO -0.01 0.75 -0.01 1.15 -0.95 0.00 0.00 178.83 179.76 3h6i h THR 106 N 0.65 1.28 -0.65 -0.54 2.02 -0.78 -1.39 112.91 113.50 3h6i h THR 106 Ca 0.15 -0.86 -0.07 0.00 0.77 0.00 0.00 66.41 66.40 3h6i h THR 106 Cb 0.33 1.76 -0.03 0.00 -1.74 0.00 0.00 68.15 68.47 3h6i h THR 106 CO 0.00 0.23 0.13 -0.07 0.37 0.00 0.00 175.52 176.18 3h6i h LEU 107 N -0.24 0.99 -0.97 2.58 3.38 -0.23 -1.40 115.31 119.41 3h6i h LEU 107 Ca 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 3h6i h LEU 107 Cb 0.38 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 3h6i h LEU 107 CO 0.00 0.97 0.46 1.23 0.09 0.00 0.00 178.44 181.20 3h6i h GLY 108 N 1.05 1.26 1.21 0.83 0.00 -0.81 0.10 103.07 106.71 3h6i h GLY 108 Ca 0.20 -0.57 -0.17 0.00 0.00 0.00 0.00 47.33 46.79 3h6i h GLY 108 CO 0.01 0.55 -0.47 -0.84 0.00 0.00 0.00 176.54 175.79 3h6i h THR 109 N 1.19 1.28 -0.19 4.70 2.02 -0.91 -2.44 112.91 118.55 3h6i h THR 109 Ca 0.30 -1.66 -0.02 0.00 0.77 0.00 0.00 66.41 65.81 3h6i h THR 109 Cb 0.03 1.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 3h6i h THR 109 CO -0.05 0.54 0.06 0.40 0.37 0.00 0.00 175.52 176.84 3h6i h ILE 110 N 0.67 1.19 -0.33 3.11 2.04 -0.38 0.22 117.51 124.04 3h6i h ILE 110 Ca 0.04 -0.61 0.06 0.00 1.00 0.00 0.00 64.86 65.35 3h6i h ILE 110 Cb 1.06 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 3h6i h ILE 110 CO 0.11 0.19 0.22 0.15 0.00 0.00 0.00 178.15 178.82 3h6i h PHE 111 N 0.13 0.18 0.00 1.37 3.57 -0.79 -1.85 116.94 119.56 3h6i h PHE 111 Ca 0.06 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.51 3h6i h PHE 111 Cb 0.24 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 3h6i h PHE 111 CO 0.00 0.10 -0.56 1.15 -2.23 0.00 0.00 178.31 176.78 3h6i h THR 112 N 0.18 0.41 0.11 4.41 2.02 -1.10 -3.44 112.91 115.50 3h6i h THR 112 Ca 0.15 -1.44 -0.15 0.00 0.77 0.00 0.00 66.41 65.74 3h6i h THR 112 Cb 0.35 0.91 0.02 0.00 -1.74 0.00 0.00 68.15 67.68 3h6i h THR 112 CO -0.02 0.14 -0.67 -0.08 0.37 0.00 0.00 175.52 175.26 3h6i h GLU 113 N -1.00 0.26 -7.41 6.66 4.57 -0.58 -3.48 114.58 113.60 3h6i h GLU 113 Ca -0.09 -0.43 -0.49 0.00 -1.18 0.00 0.00 59.36 57.18 3h6i h GLU 113 Cb 0.67 0.15 0.11 0.00 -0.16 0.00 0.00 28.75 29.52 3h6i h GLU 113 CO -0.05 1.19 0.34 -0.65 -1.18 0.00 0.00 179.01 178.65 3h6i s GLN 114 N -2.49 2.10 0.10 1.92 -0.21 -0.70 -5.00 119.66 115.38 3h6i s GLN 114 Ca -0.14 0.63 -0.01 0.00 0.02 0.00 0.00 55.36 55.86 3h6i s GLN 114 Cb 0.01 -1.92 -0.23 0.00 1.00 0.00 0.00 33.01 31.87 3h6i s GLN 114 CO 0.81 -1.60 1.21 0.00 -2.12 0.00 0.00 175.29 173.58 3h6i h ALA 115 N -1.08 0.21 -3.32 6.09 0.00 -1.93 -3.44 119.26 115.79 3h6i h ALA 115 Ca -0.47 -0.86 -0.65 0.00 0.00 0.00 0.00 54.91 52.93 3h6i h ALA 115 Cb 1.27 -0.04 -0.33 0.00 0.00 0.00 0.00 17.79 18.69 3h6i h ALA 115 CO 0.59 1.02 -0.86 0.21 0.00 0.00 0.00 179.25 180.21 3h6i s LYS 116 N -2.76 2.78 0.61 0.00 2.20 -1.26 -5.08 119.74 116.24 3h6i s LYS 116 Ca -0.03 -0.78 -0.14 0.00 -0.36 0.00 0.00 55.97 54.66 3h6i s LYS 116 Cb 0.08 -2.17 -0.03 0.00 -1.51 0.00 0.00 37.83 34.20 3h6i s LYS 116 CO 0.86 0.10 1.04 -1.25 -0.36 0.00 0.00 175.35 175.74 3h6i s PRO 117 N 0.54 3.35 0.10 4.03 0.04 -1.26 -4.88 135.00 136.91 3h6i s PRO 117 Ca -0.15 1.05 -0.31 0.00 0.04 0.00 0.00 61.00 61.63 3h6i s PRO 117 Cb -0.17 -2.04 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 3h6i s PRO 117 CO 0.05 -0.77 1.41 0.71 0.04 0.00 0.00 177.00 178.44 3h6i s TYR 118 N -2.72 3.14 -1.37 0.56 1.51 -1.26 -4.78 117.35 112.43 3h6i s TYR 118 Ca 0.60 0.89 -0.09 0.00 -1.01 0.00 0.00 57.07 57.46 3h6i s TYR 118 Cb -0.14 -3.71 0.10 0.00 -0.11 0.00 0.00 41.96 38.10 3h6i s TYR 118 CO 0.43 -2.52 2.23 0.39 -1.11 0.00 0.00 175.55 174.97 3h6i n GLU 119 N 4.23 3.79 -4.05 -0.62 1.02 -1.26 -4.72 120.64 119.02 3h6i n GLU 119 Ca 0.12 -3.18 -0.08 0.00 -0.02 0.00 0.00 57.16 54.01 3h6i n GLU 119 Cb 0.42 -2.88 -0.10 0.00 -0.02 0.00 0.00 31.44 28.86 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 0.64 0.18 -0.04 2.62 -7.23 -1.26 -1.44 120.40 113.87 3h6i s VAL 120 Ca 0.49 -1.49 0.00 0.00 -1.81 0.00 0.00 61.98 59.18 3h6i s VAL 120 Cb 0.14 -1.08 0.03 0.00 0.56 0.00 0.00 36.38 36.03 3h6i s VAL 120 CO -0.05 -0.82 -0.01 -0.70 -0.31 0.00 0.00 175.10 173.21 3h6i s GLU 121 N -3.05 0.46 0.05 4.82 2.12 -0.01 -3.07 118.70 120.02 3h6i s GLU 121 Ca -0.01 0.04 0.07 0.00 0.36 0.00 0.00 54.97 55.43 3h6i s GLU 121 Cb 0.02 -0.63 -0.03 0.00 0.26 0.00 0.00 34.13 33.74 3h6i s GLU 121 CO -0.07 -0.15 -0.16 -0.51 -0.54 0.00 0.00 175.26 173.84 3h6i s LEU 122 N 1.14 2.73 -0.11 2.70 1.02 0.04 -1.57 118.68 124.63 3h6i s LEU 122 Ca -0.08 -0.41 0.01 0.00 0.02 0.00 0.00 54.13 53.68 3h6i s LEU 122 Cb -0.14 -1.59 0.02 0.00 0.02 0.00 0.00 46.19 44.50 3h6i s LEU 122 CO -0.02 0.24 -0.15 0.00 0.02 0.00 0.00 176.35 176.44 3h6i s VAL 124 N 1.08 2.98 0.14 0.00 1.01 -0.76 -1.55 120.40 123.30 3h6i s VAL 124 Ca -0.05 -0.64 0.11 0.00 0.00 0.00 0.00 61.98 61.40 3h6i s VAL 124 Cb -0.15 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 3h6i s VAL 124 CO -0.03 0.47 -0.23 0.00 0.00 0.00 0.00 175.10 175.31 3h6i s ALA 125 N 1.20 2.51 -0.01 5.51 0.00 -0.56 -0.87 121.76 129.54 3h6i s ALA 125 Ca 0.02 -1.48 0.00 0.00 0.00 0.00 0.00 51.96 50.50 3h6i s ALA 125 Cb -0.14 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.54 3h6i s ALA 125 CO -0.04 0.52 0.01 -2.00 0.00 0.00 0.00 175.76 174.26 3h6i s GLU 126 N -2.25 0.01 0.43 0.00 2.12 -0.31 -0.51 118.70 118.18 3h6i s GLU 126 Ca 0.17 0.09 0.07 0.00 0.36 0.00 0.00 54.97 55.66 3h6i s GLU 126 Cb -0.10 -0.15 -0.03 0.00 0.26 0.00 0.00 34.13 34.11 3h6i s GLU 126 CO 0.08 -0.08 0.29 0.14 -0.54 0.00 0.00 175.26 175.15 3h6i s VAL 127 N 0.55 2.38 0.74 3.70 -7.23 -0.98 -0.97 120.40 118.61 3h6i s VAL 127 Ca -0.05 -1.52 -0.11 0.00 -1.81 0.00 0.00 61.98 58.49 3h6i s VAL 127 Cb -0.07 -2.90 0.04 0.00 0.56 0.00 0.00 36.38 34.01 3h6i s VAL 127 CO -0.01 0.00 1.09 0.00 -0.31 0.00 0.00 175.10 175.86 3h6i s ALA 128 N -2.56 2.35 0.73 1.32 0.00 -1.26 -4.87 121.76 117.46 3h6i s ALA 128 Ca 0.43 0.29 -0.11 0.00 0.00 0.00 0.00 51.96 52.57 3h6i s ALA 128 Cb 0.00 -3.27 0.03 0.00 0.00 0.00 0.00 23.12 19.88 3h6i s ALA 128 CO 0.25 -1.60 1.08 -1.01 0.00 0.00 0.00 175.76 174.47 3h6i s HIS 129 N -2.83 2.83 0.19 0.00 3.76 -1.26 -4.81 115.29 113.16 3h6i s HIS 129 Ca 0.62 1.50 -0.33 0.00 -0.15 0.00 0.00 55.06 56.69 3h6i s HIS 129 Cb -0.17 -2.98 -0.14 0.00 1.11 0.00 0.00 32.58 30.40 3h6i s HIS 129 CO 0.53 -1.52 1.51 0.98 -0.85 0.00 0.00 174.74 175.39 3h6i n TYR 130 N -3.24 2.22 -1.00 1.40 9.36 -1.26 -2.04 117.16 122.61 3h6i n TYR 130 Ca 0.08 0.34 0.00 0.00 3.32 0.00 0.00 57.90 61.64 3h6i n TYR 130 Cb 0.53 -2.51 0.00 0.00 -0.63 0.00 0.00 39.34 36.73 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 2.92 0.39 3.65 2.98 0.00 -1.26 -5.02 105.19 108.85 3h6i n GLY 131 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.47 2.32 -0.31 1.61 2.02 -0.86 -5.11 118.70 117.90 3h6i s GLU 132 Ca 0.00 -1.32 0.03 0.00 0.02 0.00 0.00 54.97 53.70 3h6i s GLU 132 Cb 0.00 -2.22 0.08 0.00 0.10 0.00 0.00 34.13 32.09 3h6i s GLU 132 CO 0.00 0.39 -0.01 0.95 0.02 0.00 0.00 175.26 176.61 3h6i s THR 133 N -2.13 2.14 -0.05 3.63 -4.23 -1.26 -4.77 115.64 108.97 3h6i s THR 133 Ca 0.30 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.76 3h6i s THR 133 Cb -0.07 -2.45 0.02 0.00 1.34 0.00 0.00 72.50 71.33 3h6i s THR 133 CO 0.19 -0.38 0.14 -0.75 -0.54 0.00 0.00 174.62 173.28 3h6i s LYS 134 N 1.03 0.14 0.21 3.99 2.20 -1.26 -5.11 119.74 120.94 3h6i s LYS 134 Ca 0.03 0.23 -0.30 0.00 -0.36 0.00 0.00 55.97 55.58 3h6i s LYS 134 Cb -0.19 0.01 -0.08 0.00 -1.51 0.00 0.00 37.83 36.05 3h6i s LYS 134 CO -0.08 -0.06 1.19 1.03 -0.36 0.00 0.00 175.35 177.08 3h6i s ARG 135 N 0.35 4.50 0.37 4.03 0.52 -1.26 -4.38 118.95 123.09 3h6i s ARG 135 Ca -0.02 1.89 -0.26 0.00 -0.52 0.00 0.00 55.73 56.82 3h6i s ARG 135 Cb -0.04 -3.22 -0.12 0.00 0.52 0.00 0.00 34.95 32.10 3h6i s ARG 135 CO -0.01 -0.05 1.12 -2.30 0.02 0.00 0.00 175.30 174.08 3h6i n PRO 136 N 2.19 1.64 -4.72 3.54 -0.02 -1.26 -4.86 135.00 131.50 3h6i n PRO 136 Ca 0.03 0.58 -0.33 0.00 -2.02 0.00 0.00 63.50 61.76 3h6i n PRO 136 Cb 0.44 -2.12 -0.13 0.00 -0.02 0.00 0.00 33.50 31.67 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 -1.91 2.94 -0.07 -0.52 2.02 -0.14 -4.98 118.70 116.04 3h6i s GLU 137 Ca 0.60 -0.62 0.01 0.00 0.02 0.00 0.00 54.97 54.97 3h6i s GLU 137 Cb -0.58 -2.57 0.02 0.00 0.10 0.00 0.00 34.13 31.09 3h6i s GLU 137 CO 0.59 0.49 -0.07 -0.51 0.02 0.00 0.00 175.26 175.79 3h6i s LEU 138 N -0.37 1.29 0.01 1.80 1.02 -1.23 -1.17 118.68 120.03 3h6i s LEU 138 Ca 0.05 -0.20 0.08 0.00 0.02 0.00 0.00 54.13 54.08 3h6i s LEU 138 Cb -0.12 -0.63 -0.02 0.00 0.02 0.00 0.00 46.19 45.43 3h6i s LEU 138 CO 0.02 -0.06 -0.25 -0.31 0.02 0.00 0.00 176.35 175.77 3h6i s TYR 139 N 1.14 2.35 -0.17 0.29 1.51 -0.05 -1.71 117.35 120.71 3h6i s TYR 139 Ca -0.07 -0.41 -0.01 0.00 -1.01 0.00 0.00 57.07 55.58 3h6i s TYR 139 Cb -0.14 -1.46 0.00 0.00 -0.11 0.00 0.00 41.96 40.25 3h6i s TYR 139 CO -0.01 0.05 -0.14 0.50 -1.11 0.00 0.00 175.55 174.85 3h6i s ARG 140 N -0.92 3.22 -0.14 -0.62 3.52 -0.61 -1.83 118.95 121.56 3h6i s ARG 140 Ca 0.11 -0.73 0.01 0.00 -0.13 0.00 0.00 55.73 54.99 3h6i s ARG 140 Cb -0.10 -2.70 0.00 0.00 -1.56 0.00 0.00 34.95 30.59 3h6i s ARG 140 CO 0.01 -0.07 -0.18 0.42 -0.81 0.00 0.00 175.30 174.67 3h6i s ILE 141 N 1.03 2.42 0.36 4.11 1.09 0.13 -1.27 121.20 129.07 3h6i s ILE 141 Ca -0.01 -0.86 0.07 0.00 -1.10 0.00 0.00 60.65 58.75 3h6i s ILE 141 Cb -0.15 -1.99 -0.01 0.00 -1.06 0.00 0.00 42.46 39.25 3h6i s ILE 141 CO -0.03 0.53 0.43 0.42 -0.10 0.00 0.00 174.94 176.19 3h6i s THR 142 N 0.76 3.60 0.60 2.92 -4.23 -0.59 -0.78 115.64 117.91 3h6i s THR 142 Ca -0.07 -1.14 0.27 0.00 -1.18 0.00 0.00 61.69 59.57 3h6i s THR 142 Cb -0.16 -3.24 0.37 0.00 1.34 0.00 0.00 72.50 70.82 3h6i s THR 142 CO 0.00 -0.12 1.59 0.10 -0.54 0.00 0.00 174.62 175.65 3h6i h TYR 143 N 0.96 0.00 -0.01 3.99 -0.00 -1.83 -0.32 116.97 119.77 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 0.46 0.00 -0.55 -0.40 -0.00 0.00 0.00 178.16 177.67 3h6i n ASP 144 N -3.41 1.65 0.00 0.10 5.75 -1.26 -4.54 116.55 114.83 3h6i n ASP 144 Ca 0.15 -1.29 0.00 0.00 -0.01 0.00 0.00 54.79 53.64 3h6i n ASP 144 Cb 1.09 0.52 0.00 0.00 -1.03 0.00 0.00 41.12 41.70 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 1.43 1.02 3.74 6.12 0.00 -0.13 -4.10 105.19 113.27 3h6i n GLY 145 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.00 7.54 -0.07 1.61 0.01 -1.25 -4.74 113.70 114.80 3h6i s SER 146 Ca 0.00 1.83 0.05 0.00 1.31 0.00 0.00 55.95 59.15 3h6i s SER 146 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 3h6i s SER 146 CO 0.00 0.02 -0.24 -0.51 0.41 0.00 0.00 173.24 172.92 3h6i s ILE 147 N -0.45 2.00 -0.06 1.44 2.07 -1.26 -1.55 121.20 123.39 3h6i s ILE 147 Ca 0.44 -1.02 0.03 0.00 -1.41 0.00 0.00 60.65 58.70 3h6i s ILE 147 Cb -0.24 -1.71 0.01 0.00 0.13 0.00 0.00 42.46 40.65 3h6i s ILE 147 CO 0.30 0.55 -0.14 0.00 -1.91 0.00 0.00 174.94 173.74 3h6i s ALA 148 N 0.05 1.39 -0.51 1.50 0.00 -0.40 -4.99 121.76 118.80 3h6i s ALA 148 Ca -0.09 -0.53 -0.19 0.00 0.00 0.00 0.00 51.96 51.14 3h6i s ALA 148 Cb -0.15 -0.56 0.06 0.00 0.00 0.00 0.00 23.12 22.46 3h6i s ALA 148 CO 0.05 0.17 0.65 0.34 0.00 0.00 0.00 175.76 176.98 3h6i s ASP 149 N 0.46 6.23 -0.18 0.00 -1.08 -1.26 -1.57 116.67 119.27 3h6i s ASP 149 Ca -0.12 -0.87 -0.11 0.00 -0.52 0.00 0.00 52.55 50.93 3h6i s ASP 149 Cb -0.15 -2.30 -0.05 0.00 -1.46 0.00 0.00 42.92 38.96 3h6i s ASP 149 CO 0.04 -0.92 0.17 -1.61 0.52 0.00 0.00 175.17 173.37 3h6i s GLU 150 N 2.73 4.13 0.27 4.34 0.41 -0.70 -5.02 118.70 124.86 3h6i s GLU 150 Ca 0.16 -0.13 0.22 0.00 -0.41 0.00 0.00 54.97 54.80 3h6i s GLU 150 Cb -0.19 -3.40 0.10 0.00 -1.78 0.00 0.00 34.13 28.87 3h6i s GLU 150 CO 0.12 0.34 1.24 -1.00 -0.49 0.00 0.00 175.26 175.47 3h6i h PRO 151 N 6.49 0.00 0.00 0.39 0.13 -1.94 -3.27 132.00 133.80 3h6i h PRO 151 Ca -0.42 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.63 3h6i h PRO 151 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 3h6i h PRO 151 CO 0.74 0.06 -1.24 0.72 -0.23 0.00 0.00 178.00 178.05 3h6i n HIS 152 N -2.87 0.00 -3.72 1.56 8.25 -1.26 -4.87 115.22 112.30 3h6i n HIS 152 Ca 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.37 3h6i n HIS 152 Cb 0.58 -0.16 -0.05 0.00 1.12 0.00 0.00 29.99 31.48 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 -2.08 -0.07 -0.02 4.41 -0.12 -1.26 -1.81 117.98 117.04 3h6i s PHE 153 Ca -0.06 -0.28 0.02 0.00 -0.05 0.00 0.00 56.93 56.56 3h6i s PHE 153 Cb 0.02 0.20 0.00 0.00 -0.63 0.00 0.00 43.02 42.62 3h6i s PHE 153 CO 0.08 -0.72 -0.06 0.08 -0.05 0.00 0.00 175.22 174.55 3h6i s VAL 154 N -3.84 0.51 -0.08 -2.49 1.01 0.59 -4.88 120.40 111.23 3h6i s VAL 154 Ca 0.06 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.84 3h6i s VAL 154 Cb 0.02 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 35.94 3h6i s VAL 154 CO -0.09 0.17 -0.13 -0.69 0.00 0.00 0.00 175.10 174.36 3h6i s VAL 155 N 0.20 1.22 0.05 2.92 1.01 -1.26 -0.89 120.40 123.65 3h6i s VAL 155 Ca -0.02 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.47 3h6i s VAL 155 Cb -0.07 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 3h6i s VAL 155 CO -0.00 0.38 -0.10 -0.04 0.00 0.00 0.00 175.10 175.34 3h6i s MET 156 N 0.76 0.61 0.16 2.72 -1.94 0.39 -5.01 119.30 116.99 3h6i s MET 156 Ca -0.13 -0.81 0.00 0.00 -1.71 0.00 0.00 55.69 53.04 3h6i s MET 156 Cb -0.16 -0.44 0.00 0.00 2.01 0.00 0.00 34.83 36.25 3h6i s MET 156 CO 0.03 0.09 0.00 0.41 -0.01 0.00 0.00 175.02 175.53 3h6i n GLY 157 N 1.41 -3.03 7.00 -0.03 0.00 -1.26 -0.37 105.19 108.90 3h6i n GLY 157 Ca -0.22 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.08 1.59 3.32 -0.02 0.00 -0.43 -4.19 105.19 103.38 3h6i n GLY 158 Ca -0.01 -0.65 -0.46 0.00 0.00 0.00 0.00 46.02 44.90 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 5.27 0.14 2.61 -4.23 -1.26 -4.31 115.64 113.86 3h6i s THR 159 Ca 0.00 -1.66 -0.11 0.00 -1.18 0.00 0.00 61.69 58.74 3h6i s THR 159 Cb 0.00 -4.37 -0.06 0.00 1.34 0.00 0.00 72.50 69.41 3h6i s THR 159 CO 0.00 -0.91 1.45 0.71 -0.54 0.00 0.00 174.62 175.33 3h6i h THR 160 N 5.69 1.27 -0.45 3.99 1.35 -1.95 -3.38 112.91 119.43 3h6i h THR 160 Ca -0.23 -1.63 0.09 0.00 -0.55 0.00 0.00 66.41 64.09 3h6i h THR 160 Cb 1.09 1.48 -0.09 0.00 -1.73 0.00 0.00 68.15 68.90 3h6i h THR 160 CO 0.99 0.54 -0.13 -0.33 -0.25 0.00 0.00 175.52 176.34 3h6i h GLU 161 N 0.72 -0.03 0.00 4.72 3.07 -1.96 0.13 114.58 121.24 3h6i h GLU 161 Ca 0.04 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.84 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 0.11 -0.02 -0.29 -1.00 -1.40 0.00 0.00 179.01 176.41 3h6i h PRO 162 N -0.03 0.00 0.08 2.33 0.13 -1.82 -0.90 132.00 131.79 3h6i h PRO 162 Ca 0.22 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 65.08 3h6i h PRO 162 Cb 0.36 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.50 3h6i h PRO 162 CO -0.48 0.29 -1.14 0.82 -0.23 0.00 0.00 178.00 177.26 3h6i h ILE 163 N 0.00 1.38 -0.36 -3.56 2.04 -1.57 -2.39 117.51 113.04 3h6i h ILE 163 Ca -0.00 -2.60 -0.16 0.00 1.00 0.00 0.00 64.86 63.10 3h6i h ILE 163 Cb 0.60 2.66 -0.01 0.00 -0.74 0.00 0.00 36.82 39.34 3h6i h ILE 163 CO 0.04 0.78 -0.38 0.00 0.00 0.00 0.00 178.15 178.59 3h6i h ALA 164 N 0.52 0.54 -0.20 1.87 0.00 -0.54 -2.75 119.26 118.70 3h6i h ALA 164 Ca -0.14 -0.45 -0.16 0.00 0.00 0.00 0.00 54.91 54.16 3h6i h ALA 164 Cb 1.81 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 3h6i h ALA 164 CO 0.20 0.64 -0.54 -0.91 0.00 0.00 0.00 179.25 178.64 3h6i h ASN 165 N 0.71 0.64 0.41 0.00 -0.26 -1.23 -1.92 115.58 113.92 3h6i h ASN 165 Ca 0.06 -0.34 -0.06 0.00 -0.56 0.00 0.00 56.30 55.40 3h6i h ASN 165 Cb 0.97 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 38.04 3h6i h ASN 165 CO 0.09 1.05 -0.27 0.00 -1.06 0.00 0.00 177.43 177.24 3h6i h ALA 166 N 0.96 1.35 0.20 -0.83 0.00 -1.41 -2.88 119.26 116.66 3h6i h ALA 166 Ca 0.01 -0.25 -0.33 0.00 0.00 0.00 0.00 54.91 54.34 3h6i h ALA 166 Cb 1.08 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.84 3h6i h ALA 166 CO 0.10 0.34 -1.58 -0.07 0.00 0.00 0.00 179.25 178.04 3h6i h LEU 167 N 0.00 0.65 -1.97 0.00 3.38 -1.35 -2.97 115.31 113.06 3h6i h LEU 167 Ca -0.00 -0.83 0.22 0.00 0.09 0.00 0.00 57.88 57.36 3h6i h LEU 167 Cb 0.55 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 3h6i h LEU 167 CO 0.04 1.68 0.54 0.11 0.09 0.00 0.00 178.44 180.89 3h6i h LYS 168 N 0.11 0.03 0.01 1.13 1.57 -1.12 -0.24 116.57 118.05 3h6i h LYS 168 Ca -0.28 -0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.11 3h6i h LYS 168 Cb 2.11 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 34.35 3h6i h LYS 168 CO 0.21 0.02 -2.16 0.39 -0.57 0.00 0.00 179.45 177.34 3h6i n GLU 169 N -4.32 0.60 0.00 3.15 1.02 -1.20 -4.47 120.64 115.41 3h6i n GLU 169 Ca 0.15 0.34 0.09 0.00 -0.02 0.00 0.00 57.16 57.72 3h6i n GLU 169 Cb 0.81 -1.58 0.53 0.00 -0.02 0.00 0.00 31.44 31.19 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 -4.16 0.00 -4.77 1.62 3.41 -1.09 -4.90 113.62 103.74 3h6i n SER 170 Ca -0.47 -1.39 -0.39 0.00 -0.26 0.00 0.00 58.87 56.36 3h6i n SER 170 Cb 0.85 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.76 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 -2.00 3.42 -0.06 7.33 5.04 -0.12 -4.98 117.35 125.97 3h6i s TYR 171 Ca 0.27 1.66 -0.03 0.00 -2.44 0.00 0.00 57.07 56.53 3h6i s TYR 171 Cb 0.12 -3.27 0.04 0.00 0.35 0.00 0.00 41.96 39.20 3h6i s TYR 171 CO 0.21 -0.71 0.11 0.00 -1.34 0.00 0.00 175.55 173.82 3h6i s ALA 172 N -1.31 0.05 0.13 3.97 0.00 -1.26 -5.07 121.76 118.27 3h6i s ALA 172 Ca 0.49 0.36 -0.30 0.00 0.00 0.00 0.00 51.96 52.51 3h6i s ALA 172 Cb -0.30 -0.72 -0.07 0.00 0.00 0.00 0.00 23.12 22.03 3h6i s ALA 172 CO 0.38 -0.53 1.23 -1.21 0.00 0.00 0.00 175.76 175.63 3h6i s GLU 173 N 2.23 4.44 -0.00 0.00 2.02 -1.26 -3.08 118.70 123.04 3h6i s GLU 173 Ca 0.04 1.88 0.00 0.00 0.02 0.00 0.00 54.97 56.91 3h6i s GLU 173 Cb -0.12 -3.28 0.00 0.00 0.10 0.00 0.00 34.13 30.83 3h6i s GLU 173 CO -0.04 -0.21 0.00 0.09 0.02 0.00 0.00 175.26 175.11 3h6i n ASN 174 N 3.25 -3.02 -4.75 -0.19 3.02 -1.26 -5.02 115.26 107.30 3h6i n ASN 174 Ca 0.07 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.24 3h6i n ASN 174 Cb 0.45 -0.52 0.05 0.00 -0.61 0.00 0.00 39.78 39.14 3h6i n ASN 174 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h6i s ALA 175 N -1.99 2.70 0.98 5.41 0.00 -1.18 -4.25 121.76 123.43 3h6i s ALA 175 Ca 0.00 1.28 -0.14 0.00 0.00 0.00 0.00 51.96 53.11 3h6i s ALA 175 Cb 0.00 -3.56 0.18 0.00 0.00 0.00 0.00 23.12 19.74 3h6i s ALA 175 CO 0.00 -1.41 1.14 -1.54 0.00 0.00 0.00 175.76 173.95 3h6i s SER 176 N -1.10 2.87 0.14 0.00 1.04 -1.26 -1.97 113.70 113.41 3h6i s SER 176 Ca 0.75 0.90 -0.18 0.00 0.48 0.00 0.00 55.95 57.90 3h6i s SER 176 Cb -0.39 -1.40 -0.03 0.00 0.10 0.00 0.00 66.02 64.30 3h6i s SER 176 CO 0.45 -2.95 1.78 0.25 0.98 0.00 0.00 173.24 173.75 3h6i h LEU 177 N -1.77 0.36 -0.79 2.42 5.85 -1.99 -0.46 115.31 118.93 3h6i h LEU 177 Ca -0.50 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.15 3h6i h LEU 177 Cb 1.32 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.22 3h6i h LEU 177 CO 0.55 0.29 0.35 0.74 -0.34 0.00 0.00 178.44 180.03 3h6i h THR 178 N 0.41 1.26 -0.38 1.05 2.02 -1.94 -1.43 112.91 113.90 3h6i h THR 178 Ca 0.11 -0.75 -0.05 0.00 0.77 0.00 0.00 66.41 66.49 3h6i h THR 178 Cb -0.02 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 3h6i h THR 178 CO -0.02 0.31 0.03 0.44 0.37 0.00 0.00 175.52 176.66 3h6i h ASP 179 N 1.13 0.62 -0.78 4.18 3.32 -1.87 -2.71 116.42 120.31 3h6i h ASP 179 Ca 0.27 -0.28 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 3h6i h ASP 179 Cb 0.16 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3h6i h ASP 179 CO -0.03 0.75 0.32 0.00 -1.72 0.00 0.00 179.24 178.56 3h6i h ALA 180 N 0.89 1.08 0.15 3.45 0.00 -0.91 -2.08 119.26 121.85 3h6i h ALA 180 Ca 0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3h6i h ALA 180 Cb 0.41 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3h6i h ALA 180 CO 0.01 0.66 -0.07 1.25 0.00 0.00 0.00 179.25 181.10 3h6i h LEU 181 N 1.14 -0.17 -0.83 0.00 5.85 -1.21 -1.62 115.31 118.48 3h6i h LEU 181 Ca 0.26 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.95 3h6i h LEU 181 Cb 0.20 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 3h6i h LEU 181 CO -0.02 -0.07 0.54 0.03 -0.34 0.00 0.00 178.44 178.59 3h6i h ARG 182 N -0.26 1.07 -0.17 1.25 3.08 -1.31 0.37 114.38 118.42 3h6i h ARG 182 Ca -0.02 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.92 3h6i h ARG 182 Cb 0.20 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 3h6i h ARG 182 CO 0.03 0.71 -0.10 0.82 -1.07 0.00 0.00 179.97 180.36 3h6i h ILE 183 N 1.10 1.17 0.16 2.04 2.04 -1.26 0.37 117.51 123.13 3h6i h ILE 183 Ca 0.31 -0.74 -0.22 0.00 1.00 0.00 0.00 64.86 65.21 3h6i h ILE 183 Cb -0.10 1.16 0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3h6i h ILE 183 CO -0.08 0.23 -1.01 0.00 0.00 0.00 0.00 178.15 177.30 3h6i h ALA 184 N 1.65 -0.07 -0.74 1.87 0.00 -0.20 -2.91 119.26 118.86 3h6i h ALA 184 Ca 0.05 -0.77 -0.06 0.00 0.00 0.00 0.00 54.91 54.13 3h6i h ALA 184 Cb 0.34 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3h6i h ALA 184 CO 0.02 0.49 0.22 0.28 0.00 0.00 0.00 179.25 180.25 3h6i h VAL 185 N -0.27 1.26 0.00 0.00 2.07 0.02 -1.96 116.25 117.37 3h6i h VAL 185 Ca -0.18 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.40 3h6i h VAL 185 Cb 1.75 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 3h6i h VAL 185 CO 0.16 0.37 0.00 0.00 0.02 0.00 0.00 177.57 178.12 3h6i h ALA 186 N 1.12 1.00 0.06 1.67 0.00 -1.04 -2.79 119.26 119.28 3h6i h ALA 186 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.89 3h6i h ALA 186 Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3h6i h ALA 186 CO -0.00 0.00 -1.27 0.00 0.00 0.00 0.00 179.25 177.98 3h6i h ALA 187 N 2.21 0.32 0.10 0.00 0.00 -1.15 -3.30 119.26 117.43 3h6i h ALA 187 Ca 0.00 -1.02 -0.26 0.00 0.00 0.00 0.00 54.91 53.63 3h6i h ALA 187 Cb 0.46 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3h6i h ALA 187 CO 0.00 1.20 -1.18 -0.07 0.00 0.00 0.00 179.25 179.20 3h6i h LEU 188 N 0.03 0.34 -1.29 0.00 3.38 -1.23 -3.24 115.31 113.30 3h6i h LEU 188 Ca -0.13 -0.36 0.07 0.00 0.09 0.00 0.00 57.88 57.55 3h6i h LEU 188 Cb 1.90 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 42.49 3h6i h LEU 188 CO 0.15 1.27 0.52 0.03 0.09 0.00 0.00 178.44 180.50 3h6i h ARG 189 N 0.06 0.83 -0.03 1.13 2.47 -1.62 -3.49 114.38 113.73 3h6i h ARG 189 Ca -0.11 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 3h6i h ARG 189 Cb 1.91 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 30.04 3h6i h ARG 189 CO 0.19 0.55 0.00 0.00 0.56 0.00 0.00 179.97 181.27 3h6i n ALA 190 N -2.43 2.51 0.00 0.04 0.00 -1.22 -5.13 120.51 114.28 3h6i n ALA 190 Ca 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3h6i n ALA 190 Cb 0.23 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 204 N 0.60 3.22 0.33 0.00 0.00 -1.26 -4.08 105.19 103.98 3h6i n GLY 204 Ca 0.03 -1.96 -0.06 0.00 0.00 0.00 0.00 46.02 44.03 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 0.00 1.25 -0.47 1.61 2.07 -1.97 -2.41 116.25 116.33 3h6i h VAL 205 Ca 0.00 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 3h6i h VAL 205 Cb 0.00 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 3h6i h VAL 205 CO 0.00 0.31 0.25 0.00 0.02 0.00 0.00 177.57 178.15 3h6i h ALA 206 N 1.18 1.55 -0.63 1.67 0.00 -1.97 -2.39 119.26 118.66 3h6i h ALA 206 Ca 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3h6i h ALA 206 Cb 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3h6i h ALA 206 CO -0.03 0.38 0.00 0.43 0.00 0.00 0.00 179.25 180.03 3h6i n SER 207 N -4.41 3.56 -4.26 0.00 7.64 -1.03 -4.54 113.62 110.58 3h6i n SER 207 Ca 0.04 -2.06 -0.25 0.00 1.01 0.00 0.00 58.87 57.61 3h6i n SER 207 Cb 0.11 -0.45 -0.14 0.00 -1.01 0.00 0.00 64.21 62.72 3h6i n SER 207 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3h6i s LEU 208 N -1.10 2.19 -0.22 -3.43 1.43 -0.90 -0.69 118.68 115.95 3h6i s LEU 208 Ca 0.43 -0.56 0.02 0.00 -1.03 0.00 0.00 54.13 52.99 3h6i s LEU 208 Cb 0.23 -0.97 0.04 0.00 0.03 0.00 0.00 46.19 45.52 3h6i s LEU 208 CO 0.28 0.15 -0.15 -0.70 0.23 0.00 0.00 176.35 176.16 3h6i s GLU 209 N -1.32 2.61 -0.02 1.70 2.12 -0.77 -4.83 118.70 118.19 3h6i s GLU 209 Ca 0.07 -1.09 0.04 0.00 0.36 0.00 0.00 54.97 54.36 3h6i s GLU 209 Cb -0.09 -2.75 -0.01 0.00 0.26 0.00 0.00 34.13 31.54 3h6i s GLU 209 CO 0.02 -0.40 -0.15 0.08 -0.54 0.00 0.00 175.26 174.27 3h6i s VAL 210 N 1.20 1.24 0.06 3.70 1.01 -1.26 -1.50 120.40 124.85 3h6i s VAL 210 Ca -0.02 -0.65 -0.24 0.00 0.00 0.00 0.00 61.98 61.07 3h6i s VAL 210 Cb -0.17 -1.04 0.06 0.00 0.00 0.00 0.00 36.38 35.23 3h6i s VAL 210 CO -0.09 0.35 0.56 0.00 0.00 0.00 0.00 175.10 175.93 3h6i s ALA 211 N -0.23 -1.46 0.17 5.51 0.00 -0.77 -1.24 121.76 123.75 3h6i s ALA 211 Ca 0.03 0.67 0.08 0.00 0.00 0.00 0.00 51.96 52.75 3h6i s ALA 211 Cb -0.07 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 3h6i s ALA 211 CO 0.00 -0.55 -0.18 0.14 0.00 0.00 0.00 175.76 175.17 3h6i s VAL 212 N -2.60 1.80 -0.67 0.00 -7.23 -0.21 -0.20 120.40 111.29 3h6i s VAL 212 Ca -0.04 -1.96 -0.07 0.00 -1.81 0.00 0.00 61.98 58.10 3h6i s VAL 212 Cb -0.01 -1.86 0.17 0.00 0.56 0.00 0.00 36.38 35.25 3h6i s VAL 212 CO -0.03 -0.36 0.54 -0.76 -0.31 0.00 0.00 175.10 174.18 3h6i s LEU 213 N -2.76 5.81 -0.64 1.32 1.43 -0.20 -1.48 118.68 122.17 3h6i s LEU 213 Ca 0.17 -2.68 -0.28 0.00 -1.03 0.00 0.00 54.13 50.31 3h6i s LEU 213 Cb -0.05 -1.99 0.02 0.00 0.03 0.00 0.00 46.19 44.20 3h6i s LEU 213 CO 0.07 -0.48 1.31 -0.62 0.23 0.00 0.00 176.35 176.85 3h6i s ASP 214 N 1.45 6.22 0.00 2.29 2.15 0.52 -2.01 116.67 127.28 3h6i s ASP 214 Ca 0.16 -0.05 0.04 0.00 0.43 0.00 0.00 52.55 53.12 3h6i s ASP 214 Cb -0.18 -2.55 0.19 0.00 -0.30 0.00 0.00 42.92 40.08 3h6i s ASP 214 CO -0.05 -1.71 1.05 0.00 -0.17 0.00 0.00 175.17 174.30 3h6i n ALA 215 N 9.24 1.27 1.18 3.66 0.00 -0.28 -1.29 120.51 134.30 3h6i n ALA 215 Ca 0.08 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.63 3h6i n ALA 215 Cb 0.49 -1.07 0.34 0.00 0.00 0.00 0.00 19.45 19.22 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 -1.41 2.18 -4.80 0.00 5.15 -1.26 -4.51 115.26 110.61 3h6i n ASN 216 Ca 0.01 -1.74 -0.37 0.00 -0.60 0.00 0.00 54.58 51.88 3h6i n ASN 216 Cb 0.04 -0.05 -0.06 0.00 -0.53 0.00 0.00 39.78 39.19 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 -1.91 4.35 0.13 1.20 1.81 -0.41 -4.99 118.95 119.12 3h6i s ARG 217 Ca 0.34 0.94 -0.17 0.00 -1.72 0.00 0.00 55.73 55.12 3h6i s ARG 217 Cb 0.20 -3.05 -0.02 0.00 -0.45 0.00 0.00 34.95 31.63 3h6i s ARG 217 CO 0.31 0.48 1.73 -1.35 -0.68 0.00 0.00 175.30 175.80 3h6i h PRO 218 N 3.86 0.48 0.00 3.54 0.11 -1.90 -3.41 132.00 134.68 3h6i h PRO 218 Ca -0.48 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.57 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 0.65 0.41 -0.07 -2.13 -0.21 0.00 0.00 178.00 176.64 3h6i n ARG 219 N -4.77 0.00 -3.05 1.05 0.63 -1.26 -4.36 116.66 104.90 3h6i n ARG 219 Ca -0.01 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.49 3h6i n ARG 219 Cb 0.08 -0.31 -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 3.29 0.16 -0.14 0.52 -1.26 -4.25 118.95 115.26 3h6i s ARG 220 Ca 0.00 -0.38 0.08 0.00 -0.52 0.00 0.00 55.73 54.91 3h6i s ARG 220 Cb 0.00 -3.99 -0.09 0.00 0.52 0.00 0.00 34.95 31.39 3h6i s ARG 220 CO 0.00 -1.13 1.35 0.00 0.02 0.00 0.00 175.30 175.54 3h6i h ALA 221 N 8.98 0.48 -2.43 2.13 0.00 -1.42 -3.45 119.26 123.54 3h6i h ALA 221 Ca -0.26 -0.82 -0.54 0.00 0.00 0.00 0.00 54.91 53.29 3h6i h ALA 221 Cb 1.09 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.75 3h6i h ALA 221 CO 0.94 1.13 0.91 0.12 0.00 0.00 0.00 179.25 182.35 3h6i s PHE 222 N -2.88 2.68 -0.04 0.00 5.36 -1.26 -0.36 117.98 121.49 3h6i s PHE 222 Ca 0.01 0.58 -0.01 0.00 -0.96 0.00 0.00 56.93 56.54 3h6i s PHE 222 Cb 0.10 -3.82 0.03 0.00 -0.34 0.00 0.00 43.02 38.99 3h6i s PHE 222 CO 0.81 -3.17 0.08 0.50 -1.46 0.00 0.00 175.22 171.98 3h6i s ARG 223 N 2.37 0.03 -0.04 10.12 3.52 -0.55 -4.96 118.95 129.43 3h6i s ARG 223 Ca 0.69 0.26 -0.18 0.00 -0.13 0.00 0.00 55.73 56.37 3h6i s ARG 223 Cb -0.36 -0.19 -0.05 0.00 -1.56 0.00 0.00 34.95 32.78 3h6i s ARG 223 CO 0.30 -0.15 0.51 1.03 -0.81 0.00 0.00 175.30 176.17 3h6i s ARG 224 N 1.02 4.24 -0.43 5.12 0.52 -1.26 -1.04 118.95 127.11 3h6i s ARG 224 Ca -0.08 0.56 -0.07 0.00 -0.52 0.00 0.00 55.73 55.61 3h6i s ARG 224 Cb -0.11 -3.35 0.10 0.00 0.52 0.00 0.00 34.95 32.11 3h6i s ARG 224 CO -0.04 0.37 0.27 0.42 0.02 0.00 0.00 175.30 176.34 3h6i s ILE 225 N -0.10 3.96 0.42 1.52 1.01 -0.37 -4.98 121.20 122.66 3h6i s ILE 225 Ca 0.27 -1.71 0.04 0.00 0.00 0.00 0.00 60.65 59.25 3h6i s ILE 225 Cb -0.17 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 3h6i s ILE 225 CO 0.14 -0.64 0.04 0.42 0.00 0.00 0.00 174.94 174.90 3h6i s THR 226 N 1.33 1.26 0.00 2.92 -4.23 -1.26 -4.23 115.64 111.42 3h6i s THR 226 Ca 0.05 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 3h6i s THR 226 Cb -0.24 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.04 3h6i s THR 226 CO -0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 3h6i n GLY 227 N -0.98 2.83 0.30 3.99 0.00 -1.26 -2.79 105.19 107.28 3h6i n GLY 227 Ca -0.09 -0.03 0.05 0.00 0.00 0.00 0.00 46.02 45.96 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 0.11 0.37 0.43 1.61 4.64 -1.99 -2.17 113.55 116.55 3h6i h SER 228 Ca 0.00 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 3h6i h SER 228 Cb 0.00 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3h6i h SER 228 CO 0.00 0.26 -0.49 0.00 -0.87 0.00 0.00 176.83 175.74 3h6i h ALA 229 N 1.80 1.14 0.00 5.18 0.00 -1.94 -2.34 119.26 123.10 3h6i h ALA 229 Ca 0.12 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 3h6i h ALA 229 Cb -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3h6i h ALA 229 CO -0.03 0.62 -0.43 1.25 0.00 0.00 0.00 179.25 180.66 3h6i h LEU 230 N 0.05 0.00 -0.52 0.00 5.85 -1.22 -3.10 115.31 116.37 3h6i h LEU 230 Ca -0.00 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.56 3h6i h LEU 230 Cb 0.88 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 3h6i h LEU 230 CO 0.07 0.43 -0.72 1.56 -0.34 0.00 0.00 178.44 179.43 3h6i h GLN 231 N 0.00 0.15 -0.38 1.25 1.08 -1.17 -3.01 115.11 113.03 3h6i h GLN 231 Ca -0.00 -0.13 -0.03 0.00 -1.45 0.00 0.00 58.65 57.04 3h6i h GLN 231 Cb 1.22 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.66 3h6i h GLN 231 CO 0.06 0.80 0.09 0.00 -0.95 0.00 0.00 178.83 178.83 3h6i h ALA 232 N 1.16 1.46 -0.36 3.87 0.00 -1.35 -1.94 119.26 122.09 3h6i h ALA 232 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h6i h ALA 232 Cb 1.28 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3h6i h ALA 232 CO 0.11 0.40 0.00 1.28 0.00 0.00 0.00 179.25 181.04 3h6i n LEU 233 N -4.34 2.04 0.00 0.00 4.77 -1.14 -5.13 117.00 113.20 3h6i n LEU 233 Ca 0.02 -1.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.00 3h6i n LEU 233 Cb 0.19 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 3h6i n LEU 233 CO 0.38 0.50 0.06 0.18 -1.33 0.00 0.00 177.39 177.18