#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6i n GLU 10 N 0.00 0.56 -0.24 -0.52 -0.58 -1.26 -4.22 120.64 114.39 3h6i n GLU 10 Ca 0.00 0.08 -0.08 0.00 -0.42 0.00 0.00 57.16 56.75 3h6i n GLU 10 Cb 0.00 -1.32 0.04 0.00 -0.57 0.00 0.00 31.44 29.59 3h6i n GLU 10 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 3h6i h GLN 11 N 0.00 1.04 -0.35 3.49 4.20 -2.05 -1.37 115.11 120.08 3h6i h GLN 11 Ca -0.35 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.11 3h6i h GLN 11 Cb 1.58 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 29.20 3h6i h GLN 11 CO -0.05 0.92 0.19 0.00 -0.67 0.00 0.00 178.83 179.22 3h6i h ALA 12 N 1.07 0.45 -0.58 3.87 0.00 -2.00 0.52 119.26 122.59 3h6i h ALA 12 Ca 0.21 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3h6i h ALA 12 Cb 0.33 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3h6i h ALA 12 CO -0.00 -0.02 0.27 1.98 0.00 0.00 0.00 179.25 181.47 3h6i h MET 13 N 0.44 0.85 -0.43 0.00 1.85 -1.68 -0.30 114.93 115.65 3h6i h MET 13 Ca 0.12 -0.13 -0.01 0.00 -0.61 0.00 0.00 59.70 59.07 3h6i h MET 13 Cb 0.07 -0.15 -0.02 0.00 0.43 0.00 0.00 31.60 31.93 3h6i h MET 13 CO -0.02 0.70 0.23 -0.09 -0.40 0.00 0.00 176.91 177.33 3h6i h ARG 14 N 0.80 0.61 -0.57 0.39 2.43 -0.82 -0.47 114.38 116.75 3h6i h ARG 14 Ca 0.20 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 3h6i h ARG 14 Cb 0.15 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 3h6i h ARG 14 CO -0.02 0.50 0.30 0.93 -1.51 0.00 0.00 179.97 180.16 3h6i h GLU 15 N 0.56 0.81 -0.57 0.20 3.07 -0.52 -0.64 114.58 117.49 3h6i h GLU 15 Ca 0.15 -0.10 -0.06 0.00 -0.50 0.00 0.00 59.36 58.85 3h6i h GLU 15 Cb 0.07 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 27.80 3h6i h GLU 15 CO -0.02 0.63 0.12 0.00 -1.40 0.00 0.00 179.01 178.34 3h6i h ARG 16 N 0.77 0.93 -0.69 2.33 3.08 -0.75 -0.35 114.38 119.69 3h6i h ARG 16 Ca 0.20 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 3h6i h ARG 16 Cb 0.08 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 3h6i h ARG 16 CO -0.03 0.87 0.30 0.77 -1.07 0.00 0.00 179.97 180.81 3h6i h SER 17 N 0.83 0.94 -0.65 7.04 0.02 -0.73 -0.84 113.55 120.15 3h6i h SER 17 Ca 0.18 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 3h6i h SER 17 Cb 0.38 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.65 3h6i h SER 17 CO 0.01 0.84 0.26 -0.33 -1.14 0.00 0.00 176.83 176.46 3h6i h GLU 18 N 0.98 0.98 -0.68 3.45 4.39 -0.72 -0.70 114.58 122.28 3h6i h GLU 18 Ca 0.23 -0.18 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 3h6i h GLU 18 Cb 0.17 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 3h6i h GLU 18 CO -0.02 0.82 0.37 1.25 -1.16 0.00 0.00 179.01 180.27 3h6i h LEU 19 N 0.92 0.85 -0.54 1.33 6.46 -0.54 -2.33 115.31 121.46 3h6i h LEU 19 Ca 0.22 -0.10 -0.05 0.00 -0.12 0.00 0.00 57.88 57.83 3h6i h LEU 19 Cb 0.21 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 39.90 3h6i h LEU 19 CO -0.02 0.70 0.16 0.00 -0.62 0.00 0.00 178.44 178.66 3h6i h ALA 20 N 1.18 0.71 -0.88 1.25 0.00 -0.71 -3.07 119.26 117.75 3h6i h ALA 20 Ca 0.24 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3h6i h ALA 20 Cb 0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 3h6i h ALA 20 CO -0.04 0.39 0.49 -0.09 0.00 0.00 0.00 179.25 180.00 3h6i h ARG 21 N 0.76 1.23 -0.00 0.00 2.43 -0.71 -3.01 114.38 115.07 3h6i h ARG 21 Ca 0.17 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3h6i h ARG 21 Cb 0.30 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 3h6i h ARG 21 CO -0.00 0.89 -0.04 0.87 -1.51 0.00 0.00 179.97 180.18 3h6i h LYS 22 N 1.23 -0.07 -0.83 0.20 1.57 -1.34 -1.08 116.57 116.26 3h6i h LYS 22 Ca 0.31 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.08 3h6i h LYS 22 Cb 0.01 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 3h6i h LYS 22 CO -0.05 -0.05 0.45 0.78 -0.57 0.00 0.00 179.45 180.01 3h6i h GLY 23 N -0.07 1.24 1.08 3.86 0.00 -1.49 -1.42 103.07 106.27 3h6i h GLY 23 Ca 0.02 -0.56 -0.11 0.00 0.00 0.00 0.00 47.33 46.67 3h6i h GLY 23 CO -0.05 0.54 -0.11 -2.22 0.00 0.00 0.00 176.54 174.71 3h6i h ILE 24 N 1.16 1.27 -0.03 2.60 2.04 -1.39 -2.73 117.51 120.44 3h6i h ILE 24 Ca 0.29 -1.26 -0.04 0.00 1.00 0.00 0.00 64.86 64.85 3h6i h ILE 24 Cb 0.04 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 3h6i h ILE 24 CO -0.05 0.44 -0.19 0.00 0.00 0.00 0.00 178.15 178.36 3h6i h ALA 25 N 0.92 1.63 0.00 1.87 0.00 -0.65 -1.37 119.26 121.67 3h6i h ALA 25 Ca 0.14 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 3h6i h ALA 25 Cb 0.67 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3h6i h ALA 25 CO 0.05 0.27 -0.35 -0.09 0.00 0.00 0.00 179.25 179.14 3h6i h ARG 26 N 0.05 0.00 -7.16 0.00 2.43 -0.99 -3.33 114.38 105.37 3h6i h ARG 26 Ca 0.01 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 58.70 3h6i h ARG 26 Cb 0.36 0.00 0.06 0.00 -0.42 0.00 0.00 29.97 29.97 3h6i h ARG 26 CO 0.03 0.35 0.22 0.00 -1.51 0.00 0.00 179.97 179.05 3h6i s ALA 27 N -3.27 3.24 0.89 2.80 0.00 -0.92 -4.93 121.76 119.57 3h6i s ALA 27 Ca 0.03 -0.59 -0.11 0.00 0.00 0.00 0.00 51.96 51.29 3h6i s ALA 27 Cb 0.08 -2.69 0.13 0.00 0.00 0.00 0.00 23.12 20.64 3h6i s ALA 27 CO 0.69 -0.80 1.11 0.15 0.00 0.00 0.00 175.76 176.92 3h6i s LYS 28 N -5.03 1.27 0.08 0.00 -0.14 -1.26 -1.78 119.74 112.88 3h6i s LYS 28 Ca 0.54 1.24 -0.02 0.00 -1.36 0.00 0.00 55.97 56.36 3h6i s LYS 28 Cb -0.11 -1.78 -0.05 0.00 -1.68 0.00 0.00 37.83 34.22 3h6i s LYS 28 CO 0.47 -2.35 0.27 -1.12 -0.76 0.00 0.00 175.35 171.85 3h6i s SER 29 N -3.02 6.41 0.02 2.83 0.01 -1.26 -4.02 113.70 114.67 3h6i s SER 29 Ca 0.64 0.40 0.04 0.00 1.31 0.00 0.00 55.95 58.35 3h6i s SER 29 Cb -0.20 -2.02 -0.02 0.00 0.21 0.00 0.00 66.02 64.00 3h6i s SER 29 CO 0.58 0.14 -0.12 -0.69 0.41 0.00 0.00 173.24 173.56 3h6i s VAL 30 N -1.53 0.93 -0.03 3.43 1.01 0.95 -2.03 120.40 123.14 3h6i s VAL 30 Ca 0.36 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.63 3h6i s VAL 30 Cb -0.13 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.43 3h6i s VAL 30 CO 0.25 0.09 -0.10 -0.69 0.00 0.00 0.00 175.10 174.65 3h6i s VAL 31 N -0.59 0.89 -0.10 2.92 1.01 -0.05 -0.02 120.40 124.46 3h6i s VAL 31 Ca 0.02 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.59 3h6i s VAL 31 Cb -0.06 -0.78 0.02 0.00 0.00 0.00 0.00 36.38 35.55 3h6i s VAL 31 CO 0.00 0.27 -0.10 0.00 0.00 0.00 0.00 175.10 175.28 3h6i s ALA 32 N 0.18 1.31 0.03 5.51 0.00 -0.03 -0.74 121.76 128.02 3h6i s ALA 32 Ca -0.03 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.43 3h6i s ALA 32 Cb -0.09 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.23 3h6i s ALA 32 CO 0.01 -0.21 -0.04 -0.48 0.00 0.00 0.00 175.76 175.04 3h6i s LEU 33 N 1.29 2.29 0.09 0.00 0.05 -0.04 -0.45 118.68 121.90 3h6i s LEU 33 Ca -0.03 -0.59 -0.29 0.00 0.05 0.00 0.00 54.13 53.27 3h6i s LEU 33 Cb -0.14 0.06 -0.05 0.00 -2.05 0.00 0.00 46.19 44.01 3h6i s LEU 33 CO -0.04 -0.33 0.94 0.00 -0.55 0.00 0.00 176.35 176.37 3h6i s ALA 34 N -1.85 3.25 0.08 1.48 0.00 -0.56 -0.89 121.76 123.27 3h6i s ALA 34 Ca -0.11 0.54 0.01 0.00 0.00 0.00 0.00 51.96 52.40 3h6i s ALA 34 Cb -0.07 -3.25 -0.00 0.00 0.00 0.00 0.00 23.12 19.79 3h6i s ALA 34 CO -0.02 -0.04 0.04 2.48 0.00 0.00 0.00 175.76 178.22 3h6i n TYR 35 N 2.91 -0.04 -0.01 0.00 0.18 -0.88 -4.71 117.16 114.61 3h6i n TYR 35 Ca 0.02 -0.58 -0.12 0.00 1.88 0.00 0.00 57.90 59.10 3h6i n TYR 35 Cb 0.49 0.02 -0.06 0.00 -0.38 0.00 0.00 39.34 39.41 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 1.18 0.12 -0.23 -3.48 0.00 -1.14 -3.23 119.26 112.48 3h6i h ALA 36 Ca -0.06 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3h6i h ALA 36 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3h6i h ALA 36 CO 0.10 -0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.46 3h6i n GLY 37 N -0.67 0.23 0.00 0.00 0.00 -1.26 -5.02 105.19 98.47 3h6i n GLY 37 Ca -0.06 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 0.99 0.50 3.23 -0.02 0.00 -1.22 -1.18 105.19 107.48 3h6i n GLY 38 Ca 0.12 -0.70 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 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 1.54 -0.07 1.61 1.01 -0.77 -2.06 120.40 121.65 3h6i s VAL 39 Ca 0.00 -1.19 0.05 0.00 0.00 0.00 0.00 61.98 60.84 3h6i s VAL 39 Cb 0.00 -1.35 -0.00 0.00 0.00 0.00 0.00 36.38 35.02 3h6i s VAL 39 CO 0.00 0.13 -0.21 -0.22 0.00 0.00 0.00 175.10 174.80 3h6i s LEU 40 N -1.25 1.97 -0.13 3.92 2.96 -0.07 -0.88 118.68 125.20 3h6i s LEU 40 Ca 0.06 -0.45 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 3h6i s LEU 40 Cb -0.09 -1.19 -0.00 0.00 0.50 0.00 0.00 46.19 45.40 3h6i s LEU 40 CO 0.02 0.17 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.68 3h6i s PHE 41 N 0.14 2.72 -0.06 5.38 0.08 0.64 -0.86 117.98 126.02 3h6i s PHE 41 Ca -0.09 -0.97 -0.00 0.00 0.12 0.00 0.00 56.93 55.98 3h6i s PHE 41 Cb -0.15 -1.82 0.02 0.00 -0.57 0.00 0.00 43.02 40.51 3h6i s PHE 41 CO 0.05 -0.41 -0.03 0.08 -0.10 0.00 0.00 175.22 174.82 3h6i s VAL 42 N 0.57 0.49 0.04 -0.44 1.01 0.08 -1.75 120.40 120.39 3h6i s VAL 42 Ca -0.11 -0.02 0.03 0.00 0.00 0.00 0.00 61.98 61.88 3h6i s VAL 42 Cb -0.16 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 3h6i s VAL 42 CO 0.04 0.25 -0.09 0.00 0.00 0.00 0.00 175.10 175.30 3h6i s ALA 43 N 1.43 0.66 -0.48 5.51 0.00 -0.13 -0.87 121.76 127.89 3h6i s ALA 43 Ca -0.03 -0.73 -0.29 0.00 0.00 0.00 0.00 51.96 50.91 3h6i s ALA 43 Cb -0.13 -0.01 0.03 0.00 0.00 0.00 0.00 23.12 23.01 3h6i s ALA 43 CO -0.03 0.03 1.18 -1.21 0.00 0.00 0.00 175.76 175.73 3h6i s GLU 44 N -1.39 3.69 -0.27 0.00 2.02 -0.86 -0.29 118.70 121.60 3h6i s GLU 44 Ca -0.07 0.59 -0.01 0.00 0.02 0.00 0.00 54.97 55.50 3h6i s GLU 44 Cb -0.09 -3.93 0.13 0.00 0.10 0.00 0.00 34.13 30.34 3h6i s GLU 44 CO 0.01 -1.42 0.29 1.21 0.02 0.00 0.00 175.26 175.36 3h6i s ASN 45 N 2.68 1.46 0.43 -0.19 2.47 -1.07 -4.69 114.94 116.04 3h6i s ASN 45 Ca 0.49 -0.57 0.22 0.00 0.42 0.00 0.00 52.86 53.43 3h6i s ASN 45 Cb -0.08 0.56 0.94 0.00 -1.45 0.00 0.00 41.25 41.22 3h6i s ASN 45 CO 0.32 -0.37 1.85 1.55 -3.72 0.00 0.00 177.10 176.73 3h6i h PRO 46 N 8.26 0.00 -6.97 0.43 0.13 -1.82 -3.23 132.00 128.80 3h6i h PRO 46 Ca -0.14 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.49 3h6i h PRO 46 Cb 1.10 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.27 3h6i h PRO 46 CO 0.32 0.27 0.47 0.45 -0.23 0.00 0.00 178.00 179.28 3h6i s SER 47 N -6.33 6.45 0.05 1.44 0.15 -1.26 -4.86 113.70 109.33 3h6i s SER 47 Ca -0.01 2.26 0.22 0.00 0.70 0.00 0.00 55.95 59.12 3h6i s SER 47 Cb 0.11 -2.60 -0.19 0.00 -1.71 0.00 0.00 66.02 61.63 3h6i s SER 47 CO 0.65 -0.72 0.73 -2.11 1.20 0.00 0.00 173.24 172.99 3h6i n ARG 48 N -0.17 0.56 -0.00 5.44 1.85 -1.26 -4.62 116.66 118.47 3h6i n ARG 48 Ca 0.06 -0.07 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 3h6i n ARG 48 Cb 0.48 -1.61 -0.00 0.00 -1.05 0.00 0.00 32.46 30.27 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 -2.30 4.81 -4.37 2.89 3.41 -1.26 -4.93 113.62 111.87 3h6i n SER 49 Ca -0.02 -0.02 -0.46 0.00 -0.26 0.00 0.00 58.87 58.12 3h6i n SER 49 Cb 0.54 1.00 -0.03 0.00 -0.26 0.00 0.00 64.21 65.46 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 -2.97 5.96 0.16 1.04 1.43 -1.26 -5.04 118.68 118.00 3h6i s LEU 50 Ca -0.00 -2.14 -0.29 0.00 -1.03 0.00 0.00 54.13 50.67 3h6i s LEU 50 Cb 0.00 -2.28 -0.07 0.00 0.03 0.00 0.00 46.19 43.87 3h6i s LEU 50 CO 0.00 -0.85 0.91 -1.10 0.23 0.00 0.00 176.35 175.54 3h6i s GLN 51 N 1.53 4.73 0.00 1.70 -0.21 -1.26 -4.85 119.66 121.30 3h6i s GLN 51 Ca 0.19 1.39 0.15 0.00 0.02 0.00 0.00 55.36 57.11 3h6i s GLN 51 Cb -0.14 -3.32 -0.14 0.00 1.00 0.00 0.00 33.01 30.41 3h6i s GLN 51 CO -0.04 0.39 0.66 1.63 -2.12 0.00 0.00 175.29 175.80 3h6i n LYS 52 N 2.13 2.07 -4.78 2.91 5.02 -1.26 -4.95 118.16 119.29 3h6i n LYS 52 Ca -0.01 -0.11 -0.26 0.00 -2.02 0.00 0.00 58.31 55.91 3h6i n LYS 52 Cb 0.48 -1.20 -0.16 0.00 -0.02 0.00 0.00 35.03 34.13 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 -2.32 1.37 0.19 -0.18 1.01 -1.26 -0.98 121.20 119.03 3h6i s ILE 53 Ca 0.07 -0.66 -0.10 0.00 0.00 0.00 0.00 60.65 59.96 3h6i s ILE 53 Cb 0.11 -1.19 -0.01 0.00 0.01 0.00 0.00 42.46 41.38 3h6i s ILE 53 CO 0.58 0.40 0.33 -0.44 0.00 0.00 0.00 174.94 175.80 3h6i s SER 54 N 0.22 0.00 0.20 3.58 0.01 0.15 -4.99 113.70 112.87 3h6i s SER 54 Ca -0.07 -0.90 -0.18 0.00 1.31 0.00 0.00 55.95 56.11 3h6i s SER 54 Cb -0.13 0.47 -0.08 0.00 0.21 0.00 0.00 66.02 66.50 3h6i s SER 54 CO 0.03 -0.95 0.67 -0.70 0.41 0.00 0.00 173.24 172.70 3h6i s GLU 55 N -3.99 4.15 -0.05 12.44 2.12 -1.26 -0.31 118.70 131.80 3h6i s GLU 55 Ca 0.19 0.73 -0.04 0.00 0.36 0.00 0.00 54.97 56.22 3h6i s GLU 55 Cb 0.02 -2.87 -0.03 0.00 0.26 0.00 0.00 34.13 31.52 3h6i s GLU 55 CO 0.03 0.41 -0.10 1.28 -0.54 0.00 0.00 175.26 176.34 3h6i n LEU 56 N 0.69 0.76 0.00 2.70 4.77 -0.81 -4.81 117.00 120.29 3h6i n LEU 56 Ca -0.03 0.12 -0.01 0.00 -0.03 0.00 0.00 56.01 56.06 3h6i n LEU 56 Cb 0.51 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3h6i n LEU 56 CO 0.43 -0.07 0.02 0.00 -1.33 0.00 0.00 177.39 176.44 3h6i n TYR 57 N -3.46 -0.58 -0.22 -1.77 9.36 -1.04 -4.74 117.16 114.71 3h6i n TYR 57 Ca -0.12 -0.17 -0.04 0.00 3.32 0.00 0.00 57.90 60.88 3h6i n TYR 57 Cb 0.47 0.05 0.06 0.00 -0.63 0.00 0.00 39.34 39.29 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 0.15 0.65 -0.05 2.98 3.32 -1.94 -2.95 116.42 118.58 3h6i h ASP 58 Ca -0.02 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3h6i h ASP 58 Cb 0.09 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.50 3h6i h ASP 58 CO 0.03 0.46 0.00 0.54 -1.72 0.00 0.00 179.24 178.54 3h6i n ARG 59 N -4.70 1.79 -4.71 3.56 5.12 -1.26 -0.80 116.66 115.66 3h6i n ARG 59 Ca 0.06 -1.30 -0.33 0.00 -1.93 0.00 0.00 57.85 54.35 3h6i n ARG 59 Cb 0.07 -1.05 -0.13 0.00 -1.16 0.00 0.00 32.46 30.20 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 -0.74 3.40 0.27 1.55 1.01 -1.12 -2.18 120.40 122.60 3h6i s VAL 60 Ca 0.04 -0.57 0.10 0.00 0.00 0.00 0.00 61.98 61.55 3h6i s VAL 60 Cb 0.02 -2.40 -0.05 0.00 0.00 0.00 0.00 36.38 33.95 3h6i s VAL 60 CO 0.03 0.57 -0.16 -0.83 0.00 0.00 0.00 175.10 174.71 3h6i s GLY 61 N -0.40 1.82 -0.03 4.51 0.00 0.47 -1.92 107.32 111.76 3h6i s GLY 61 Ca 0.05 -1.86 0.02 0.00 0.00 0.00 0.00 44.72 42.93 3h6i s GLY 61 CO 0.02 -1.92 -0.09 -0.12 0.00 0.00 0.00 173.10 171.00 3h6i s PHE 62 N -2.67 0.97 -0.02 1.90 2.19 0.58 -1.91 117.98 119.02 3h6i s PHE 62 Ca 0.29 -0.27 -0.03 0.00 0.33 0.00 0.00 56.93 57.26 3h6i s PHE 62 Cb -0.02 -0.72 0.00 0.00 -1.31 0.00 0.00 43.02 40.97 3h6i s PHE 62 CO 0.13 -0.14 0.06 0.00 1.83 0.00 0.00 175.22 177.11 3h6i s ALA 63 N 0.37 -0.15 0.08 11.12 0.00 -0.41 0.30 121.76 133.07 3h6i s ALA 63 Ca -0.06 0.07 -0.09 0.00 0.00 0.00 0.00 51.96 51.88 3h6i s ALA 63 Cb -0.10 -0.06 -0.00 0.00 0.00 0.00 0.00 23.12 22.95 3h6i s ALA 63 CO 0.01 -0.06 0.18 0.00 0.00 0.00 0.00 175.76 175.89 3h6i s ALA 64 N -0.27 -0.23 0.02 0.00 0.00 -0.15 -0.57 121.76 120.56 3h6i s ALA 64 Ca -0.03 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.38 3h6i s ALA 64 Cb -0.02 0.45 -0.01 0.00 0.00 0.00 0.00 23.12 23.53 3h6i s ALA 64 CO 0.00 -0.48 -0.09 0.00 0.00 0.00 0.00 175.76 175.19 3h6i s ALA 65 N -3.64 0.77 0.00 0.00 0.00 -0.51 -4.86 121.76 113.52 3h6i s ALA 65 Ca 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.43 3h6i s ALA 65 Cb 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.04 3h6i s ALA 65 CO -0.10 0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.21 3h6i n GLY 66 N 2.28 0.53 3.64 0.00 0.00 -1.26 -1.30 105.19 109.09 3h6i n GLY 66 Ca -0.17 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 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 -0.88 3.93 0.15 1.61 2.20 -0.37 -4.91 119.74 121.47 3h6i s LYS 67 Ca 0.00 1.61 -0.28 0.00 -0.36 0.00 0.00 55.97 56.95 3h6i s LYS 67 Cb 0.00 -3.95 -0.02 0.00 -1.51 0.00 0.00 37.83 32.35 3h6i s LYS 67 CO 0.00 -1.11 1.57 0.35 -0.36 0.00 0.00 175.35 175.80 3h6i h PHE 68 N 9.86 -1.29 -0.74 4.03 3.57 -1.96 -2.02 116.94 128.40 3h6i h PHE 68 Ca -0.31 0.07 0.21 0.00 3.53 0.00 0.00 57.97 61.47 3h6i h PHE 68 Cb 1.13 0.62 -0.03 0.00 2.79 0.00 0.00 35.95 40.46 3h6i h PHE 68 CO 0.88 -0.45 0.54 -2.95 -2.23 0.00 0.00 178.31 174.10 3h6i h ASN 69 N -0.36 0.00 0.16 0.41 7.08 -1.99 -0.26 115.58 120.62 3h6i h ASN 69 Ca 0.12 0.00 -0.25 0.00 -3.08 0.00 0.00 56.30 53.09 3h6i h ASN 69 Cb 0.59 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 36.85 3h6i h ASN 69 CO -0.55 0.00 -1.17 -0.33 -2.08 0.00 0.00 177.43 173.29 3h6i h GLU 70 N 0.00 0.33 0.00 4.14 5.08 -1.79 -3.07 114.58 119.27 3h6i h GLU 70 Ca 0.35 -0.56 -0.12 0.00 -1.00 0.00 0.00 59.36 58.02 3h6i h GLU 70 Cb 1.42 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.86 3h6i h GLU 70 CO -0.00 1.27 -0.59 0.27 -1.00 0.00 0.00 179.01 178.96 3h6i h PHE 71 N -0.23 0.00 -0.31 4.33 -5.15 -0.99 -2.87 116.94 111.72 3h6i h PHE 71 Ca -0.23 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.42 3h6i h PHE 71 Cb 1.80 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.96 3h6i h PHE 71 CO 0.16 0.59 -0.32 0.22 -2.00 0.00 0.00 178.31 176.96 3h6i h ASP 72 N 0.00 0.69 -0.69 -0.68 3.58 -1.19 0.98 116.42 119.11 3h6i h ASP 72 Ca -0.01 -0.28 -0.02 0.00 0.42 0.00 0.00 57.03 57.15 3h6i h ASP 72 Cb 1.40 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 42.23 3h6i h ASP 72 CO 0.08 0.96 0.37 -1.13 -2.88 0.00 0.00 179.24 176.63 3h6i h ASN 73 N 0.56 0.89 0.51 2.28 -1.24 -1.46 -1.10 115.58 116.02 3h6i h ASN 73 Ca 0.06 -0.08 -0.19 0.00 0.71 0.00 0.00 56.30 56.80 3h6i h ASN 73 Cb 0.82 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 39.63 3h6i h ASN 73 CO 0.07 0.73 -0.84 -0.07 -1.29 0.00 0.00 177.43 176.03 3h6i h LEU 74 N 1.00 0.30 -0.00 0.34 3.38 -1.18 -1.62 115.31 117.52 3h6i h LEU 74 Ca 0.25 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3h6i h LEU 74 Cb 0.06 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3h6i h LEU 74 CO -0.04 1.01 0.00 -0.09 0.09 0.00 0.00 178.44 179.42 3h6i h ARG 75 N 0.14 0.01 -0.73 1.13 2.43 -0.33 -0.03 114.38 117.00 3h6i h ARG 75 Ca -0.04 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3h6i h ARG 75 Cb 1.45 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.97 3h6i h ARG 75 CO 0.13 0.11 0.48 0.00 -1.51 0.00 0.00 179.97 179.19 3h6i h ARG 76 N -0.10 0.96 -0.38 0.20 3.08 -1.16 -1.34 114.38 115.64 3h6i h ARG 76 Ca 0.00 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 3h6i h ARG 76 Cb 0.11 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 3h6i h ARG 76 CO -0.00 0.64 0.01 0.78 -1.07 0.00 0.00 179.97 180.32 3h6i h GLY 77 N 0.99 0.64 1.14 0.04 0.00 -1.09 -1.70 103.07 103.08 3h6i h GLY 77 Ca 0.27 -0.39 -0.19 0.00 0.00 0.00 0.00 47.33 47.02 3h6i h GLY 77 CO -0.06 0.36 -0.55 -1.33 0.00 0.00 0.00 176.54 174.96 3h6i h GLY 78 N 0.88 0.95 1.24 4.60 0.00 -0.25 -1.49 103.07 109.00 3h6i h GLY 78 Ca 0.12 -1.12 -0.06 0.00 0.00 0.00 0.00 47.33 46.26 3h6i h GLY 78 CO 0.01 1.01 0.13 -2.22 0.00 0.00 0.00 176.54 175.47 3h6i h ILE 79 N 0.65 1.24 -0.32 2.60 2.04 -0.88 0.59 117.51 123.44 3h6i h ILE 79 Ca 0.01 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 64.95 3h6i h ILE 79 Cb 1.16 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 3h6i h ILE 79 CO 0.12 0.34 0.12 -0.61 0.00 0.00 0.00 178.15 178.12 3h6i h GLN 80 N 0.90 0.48 0.15 2.37 4.15 -1.18 -0.72 115.11 121.26 3h6i h GLN 80 Ca 0.19 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 3h6i h GLN 80 Cb 0.35 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.96 3h6i h GLN 80 CO 0.00 0.50 -0.07 0.35 -1.93 0.00 0.00 178.83 177.68 3h6i h PHE 81 N 0.36 -0.19 -0.54 3.99 3.57 -0.94 -1.89 116.94 121.30 3h6i h PHE 81 Ca 0.10 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 3h6i h PHE 81 Cb 0.21 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 3h6i h PHE 81 CO -0.00 -0.02 0.33 0.00 -2.23 0.00 0.00 178.31 176.39 3h6i h ALA 82 N 0.50 0.68 -0.39 2.41 0.00 -0.77 -1.11 119.26 120.59 3h6i h ALA 82 Ca -0.02 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3h6i h ALA 82 Cb 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3h6i h ALA 82 CO 0.03 0.16 -0.05 -0.44 0.00 0.00 0.00 179.25 178.96 3h6i h ASP 83 N 0.72 0.61 -0.26 0.00 3.32 -1.10 -0.73 116.42 118.98 3h6i h ASP 83 Ca 0.19 -0.15 -0.13 0.00 0.02 0.00 0.00 57.03 56.96 3h6i h ASP 83 Cb -0.02 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 3h6i h ASP 83 CO -0.04 0.72 -0.36 0.74 -1.72 0.00 0.00 179.24 178.58 3h6i h THR 84 N 0.60 1.31 -0.43 0.35 2.02 -1.09 -2.34 112.91 113.32 3h6i h THR 84 Ca 0.12 -1.55 -0.09 0.00 0.77 0.00 0.00 66.41 65.66 3h6i h THR 84 Cb 0.45 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 3h6i h THR 84 CO 0.02 0.49 -0.07 0.03 0.37 0.00 0.00 175.52 176.37 3h6i h ARG 85 N 0.44 0.81 -0.09 6.66 2.47 -0.94 -0.92 114.38 122.81 3h6i h ARG 85 Ca 0.03 -0.29 -0.09 0.00 -1.26 0.00 0.00 59.98 58.36 3h6i h ARG 85 Cb 0.94 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.20 3h6i h ARG 85 CO 0.08 0.91 -0.37 0.78 0.56 0.00 0.00 179.97 181.94 3h6i h GLY 86 N 0.64 0.19 1.16 0.04 0.00 -1.13 -0.91 103.07 103.07 3h6i h GLY 86 Ca 0.11 -0.17 -0.27 0.00 0.00 0.00 0.00 47.33 47.01 3h6i h GLY 86 CO 0.04 0.15 -1.06 -1.82 0.00 0.00 0.00 176.54 173.85 3h6i h TYR 87 N 0.15 0.99 0.00 5.60 3.20 -1.14 -3.13 116.97 122.65 3h6i h TYR 87 Ca 0.02 -0.57 -0.06 0.00 3.14 0.00 0.00 58.73 61.26 3h6i h TYR 87 Cb 0.72 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 3h6i h TYR 87 CO 0.01 1.41 -0.30 0.00 -1.64 0.00 0.00 178.16 177.64 3h6i h ALA 88 N 0.35 0.89 -3.00 1.82 0.00 -0.99 -3.44 119.26 114.88 3h6i h ALA 88 Ca -0.14 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3h6i h ALA 88 Cb 1.73 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.47 3h6i h ALA 88 CO 0.21 0.37 0.00 0.66 0.00 0.00 0.00 179.25 180.49 3h6i n TYR 89 N -3.29 0.00 -3.86 0.00 4.01 -0.36 -5.08 117.16 108.57 3h6i n TYR 89 Ca 0.01 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.66 3h6i n TYR 89 Cb 0.55 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.53 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 1.00 -0.10 0.55 7.72 1.47 -1.18 -4.99 116.67 121.14 3h6i s ASP 90 Ca 0.00 -0.69 0.22 0.00 1.18 0.00 0.00 52.55 53.26 3h6i s ASP 90 Cb 0.00 0.51 1.51 0.00 -0.34 0.00 0.00 42.92 44.60 3h6i s ASP 90 CO 0.00 -0.98 2.20 0.03 0.68 0.00 0.00 175.17 177.10 3h6i h ARG 91 N 2.38 0.00 0.00 2.11 3.08 -1.91 -2.54 114.38 117.50 3h6i h ARG 91 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.75 3h6i h ARG 91 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 3h6i h ARG 91 CO 0.43 0.00 0.00 -0.09 -1.07 0.00 0.00 179.97 179.24 3h6i h ARG 92 N 0.00 0.00 -0.01 0.04 2.43 -1.96 -2.94 114.38 111.94 3h6i h ARG 92 Ca -0.00 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 3h6i h ARG 92 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3h6i h ARG 92 CO 0.00 0.00 -0.37 0.22 -1.51 0.00 0.00 179.97 178.31 3h6i h ASP 93 N 0.00 0.02 -3.10 -3.80 3.58 -1.82 -3.41 116.42 107.89 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 0.44 -0.01 -0.05 0.00 1.72 0.00 0.00 39.33 41.44 3h6i h ASP 93 CO 0.00 0.39 0.75 -0.69 -2.88 0.00 0.00 179.24 176.82 3h6i s VAL 94 N -4.19 4.63 0.19 2.25 1.01 -1.11 -4.93 120.40 118.24 3h6i s VAL 94 Ca -0.03 1.94 -0.01 0.00 0.00 0.00 0.00 61.98 63.88 3h6i s VAL 94 Cb 0.14 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 3h6i s VAL 94 CO 0.73 -0.12 0.13 0.42 0.00 0.00 0.00 175.10 176.27 3h6i s THR 95 N 2.89 0.01 0.17 3.92 -4.23 -1.26 -4.95 115.64 112.19 3h6i s THR 95 Ca 0.47 -1.97 -0.11 0.00 -1.18 0.00 0.00 61.69 58.90 3h6i s THR 95 Cb -0.17 -2.44 0.06 0.00 1.34 0.00 0.00 72.50 71.29 3h6i s THR 95 CO 0.11 -0.05 1.67 1.23 -0.54 0.00 0.00 174.62 177.04 3h6i h GLY 96 N 2.63 1.00 0.58 3.99 0.00 -1.93 -2.49 103.07 106.85 3h6i h GLY 96 Ca -0.36 -0.64 0.05 0.00 0.00 0.00 0.00 47.33 46.39 3h6i h GLY 96 CO 0.53 0.59 0.04 -0.09 0.00 0.00 0.00 176.54 177.61 3h6i h ARG 97 N 0.84 0.14 -0.40 4.80 2.43 -1.97 0.11 114.38 120.33 3h6i h ARG 97 Ca 0.18 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.39 3h6i h ARG 97 Cb 0.36 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.83 3h6i h ARG 97 CO 0.00 0.09 0.13 0.37 -1.51 0.00 0.00 179.97 179.05 3h6i h GLN 98 N 0.14 0.28 -0.21 0.20 4.15 -1.88 0.62 115.11 118.40 3h6i h GLN 98 Ca 0.15 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.40 3h6i h GLN 98 Cb 0.18 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 3h6i h GLN 98 CO -0.22 0.18 -0.50 -0.07 -1.93 0.00 0.00 178.83 176.30 3h6i h LEU 99 N 0.29 0.65 -0.26 -2.39 3.38 -1.01 -1.06 115.31 114.90 3h6i h LEU 99 Ca 0.18 -0.33 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 3h6i h LEU 99 Cb 0.17 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3h6i h LEU 99 CO -0.20 1.04 -0.10 0.00 0.09 0.00 0.00 178.44 179.27 3h6i h ALA 100 N 0.98 0.36 -0.63 1.53 0.00 -0.37 -0.26 119.26 120.89 3h6i h ALA 100 Ca 0.02 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.69 3h6i h ALA 100 Cb 1.04 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 3h6i h ALA 100 CO 0.10 0.21 0.33 -0.97 0.00 0.00 0.00 179.25 178.92 3h6i h ASN 101 N 0.27 0.46 -0.44 0.00 -0.73 0.36 0.17 115.58 115.67 3h6i h ASN 101 Ca 0.06 0.04 -0.07 0.00 1.87 0.00 0.00 56.30 58.20 3h6i h ASN 101 Cb 0.60 -0.05 -0.02 0.00 0.27 0.00 0.00 38.32 39.12 3h6i h ASN 101 CO 0.03 0.30 0.02 0.58 -0.37 0.00 0.00 177.43 177.99 3h6i h VAL 102 N 0.60 1.24 -0.34 2.57 2.07 -0.96 -1.84 116.25 119.60 3h6i h VAL 102 Ca 0.29 -1.00 -0.12 0.00 0.82 0.00 0.00 66.70 66.69 3h6i h VAL 102 Cb 0.21 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 3h6i h VAL 102 CO -0.20 0.36 -0.27 1.88 0.02 0.00 0.00 177.57 179.36 3h6i h TYR 103 N 0.78 0.81 -0.28 1.57 0.05 -0.19 -1.78 116.97 117.94 3h6i h TYR 103 Ca 0.15 -0.20 -0.00 0.00 0.05 0.00 0.00 58.73 58.73 3h6i h TYR 103 Cb 0.45 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 3h6i h TYR 103 CO 0.02 0.90 0.16 0.00 -1.05 0.00 0.00 178.16 178.19 3h6i h ALA 104 N 1.09 0.35 -0.63 3.88 0.00 -0.33 0.21 119.26 123.83 3h6i h ALA 104 Ca 0.08 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3h6i h ALA 104 Cb 0.77 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 3h6i h ALA 104 CO 0.06 -0.13 0.24 1.96 0.00 0.00 0.00 179.25 181.39 3h6i h GLN 105 N 0.34 0.95 -0.14 0.00 1.08 -1.30 0.12 115.11 116.16 3h6i h GLN 105 Ca 0.10 -0.18 -0.04 0.00 -1.45 0.00 0.00 58.65 57.08 3h6i h GLN 105 Cb 0.04 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.32 3h6i h GLN 105 CO -0.02 0.81 -0.08 1.15 -0.95 0.00 0.00 178.83 179.74 3h6i h THR 106 N 0.89 1.32 -0.45 -0.54 2.02 -0.95 -1.57 112.91 113.63 3h6i h THR 106 Ca 0.21 -1.14 -0.12 0.00 0.77 0.00 0.00 66.41 66.13 3h6i h THR 106 Cb 0.22 1.79 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 3h6i h THR 106 CO -0.02 0.33 -0.20 -0.07 0.37 0.00 0.00 175.52 175.94 3h6i h LEU 107 N -0.06 0.91 -0.97 2.58 3.38 -0.48 -1.73 115.31 118.94 3h6i h LEU 107 Ca 0.03 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.69 3h6i h LEU 107 Cb 0.56 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 3h6i h LEU 107 CO 0.02 1.08 0.64 1.23 0.09 0.00 0.00 178.44 181.50 3h6i h GLY 108 N 0.93 1.37 1.36 0.83 0.00 -0.71 0.12 103.07 106.97 3h6i h GLY 108 Ca 0.11 -0.51 -0.17 0.00 0.00 0.00 0.00 47.33 46.76 3h6i h GLY 108 CO 0.06 0.49 -0.55 -0.84 0.00 0.00 0.00 176.54 175.70 3h6i h THR 109 N 1.31 1.30 -0.25 4.70 2.02 -1.11 -2.58 112.91 118.31 3h6i h THR 109 Ca 0.36 -1.78 -0.03 0.00 0.77 0.00 0.00 66.41 65.73 3h6i h THR 109 Cb -0.14 1.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3h6i h THR 109 CO -0.08 0.56 0.03 0.40 0.37 0.00 0.00 175.52 176.80 3h6i h ILE 110 N 0.52 1.24 -0.13 3.11 2.04 -0.53 0.25 117.51 124.01 3h6i h ILE 110 Ca 0.01 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.09 3h6i h ILE 110 Cb 1.12 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 3h6i h ILE 110 CO 0.11 0.26 0.12 0.15 0.00 0.00 0.00 178.15 178.79 3h6i h PHE 111 N 0.22 0.00 0.00 1.37 3.57 -0.68 -1.76 116.94 119.65 3h6i h PHE 111 Ca 0.07 0.00 -0.33 0.00 3.53 0.00 0.00 57.97 61.24 3h6i h PHE 111 Cb 0.36 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.03 3h6i h PHE 111 CO 0.03 0.00 -2.29 2.41 -2.23 0.00 0.00 178.31 176.22 3h6i n THR 112 N -4.05 1.25 0.25 4.41 -1.04 -0.98 -4.73 114.28 109.39 3h6i n THR 112 Ca 0.00 -0.79 0.04 0.00 -2.04 0.00 0.00 64.05 61.26 3h6i n THR 112 Cb 0.24 -0.47 -0.06 0.00 -1.82 0.00 0.00 70.33 68.22 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 -2.68 2.59 -3.31 -2.82 4.71 0.87 -5.03 120.64 114.96 3h6i n GLU 113 Ca -0.30 -0.03 -0.19 0.00 -0.01 0.00 0.00 57.16 56.63 3h6i n GLU 113 Cb 1.10 -1.04 0.00 0.00 -1.01 0.00 0.00 31.44 30.49 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 -2.15 3.03 0.12 3.49 -0.21 -0.68 -5.03 119.66 118.22 3h6i s GLN 114 Ca 0.01 -1.03 -0.14 0.00 0.02 0.00 0.00 55.36 54.22 3h6i s GLN 114 Cb 0.06 -2.78 -0.05 0.00 1.00 0.00 0.00 33.01 31.24 3h6i s GLN 114 CO 0.37 -0.06 1.49 0.00 -2.12 0.00 0.00 175.29 174.98 3h6i h ALA 115 N 0.78 0.50 -4.53 6.09 0.00 -1.96 -3.44 119.26 116.71 3h6i h ALA 115 Ca -0.44 -0.34 -0.67 0.00 0.00 0.00 0.00 54.91 53.45 3h6i h ALA 115 Cb 1.26 -0.12 -0.30 0.00 0.00 0.00 0.00 17.79 18.63 3h6i h ALA 115 CO 0.51 0.42 -0.88 0.21 0.00 0.00 0.00 179.25 179.51 3h6i s LYS 116 N -4.65 2.03 0.55 0.00 2.20 -1.26 -5.12 119.74 113.49 3h6i s LYS 116 Ca -0.12 -0.88 -0.14 0.00 -0.36 0.00 0.00 55.97 54.46 3h6i s LYS 116 Cb 0.10 -1.94 -0.06 0.00 -1.51 0.00 0.00 37.83 34.41 3h6i s LYS 116 CO 0.82 0.52 1.00 -1.25 -0.36 0.00 0.00 175.35 176.08 3h6i s PRO 117 N -0.55 3.82 0.10 4.03 0.04 -1.26 -4.85 135.00 136.33 3h6i s PRO 117 Ca 0.09 0.87 -0.31 0.00 0.04 0.00 0.00 61.00 61.69 3h6i s PRO 117 Cb -0.10 -2.12 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 3h6i s PRO 117 CO -0.01 -0.38 1.42 0.71 0.04 0.00 0.00 177.00 178.79 3h6i s TYR 118 N -2.83 3.11 -1.36 0.56 1.51 -1.26 -4.87 117.35 112.21 3h6i s TYR 118 Ca 0.57 0.86 -0.09 0.00 -1.01 0.00 0.00 57.07 57.41 3h6i s TYR 118 Cb -0.10 -3.72 0.11 0.00 -0.11 0.00 0.00 41.96 38.14 3h6i s TYR 118 CO 0.40 -2.57 2.18 0.39 -1.11 0.00 0.00 175.55 174.84 3h6i n GLU 119 N 4.31 3.78 -4.12 -0.62 1.02 -1.26 -4.71 120.64 119.03 3h6i n GLU 119 Ca 0.12 -3.23 -0.08 0.00 -0.02 0.00 0.00 57.16 53.94 3h6i n GLU 119 Cb 0.42 -2.89 -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 0.57 0.35 -0.05 2.62 -7.23 -1.26 -1.24 120.40 114.15 3h6i s VAL 120 Ca 0.48 -1.86 -0.02 0.00 -1.81 0.00 0.00 61.98 58.77 3h6i s VAL 120 Cb 0.14 -1.64 0.04 0.00 0.56 0.00 0.00 36.38 35.47 3h6i s VAL 120 CO -0.04 -0.89 0.10 -0.70 -0.31 0.00 0.00 175.10 173.25 3h6i s GLU 121 N -3.91 0.02 0.09 4.82 2.12 -0.42 -3.14 118.70 118.28 3h6i s GLU 121 Ca 0.11 0.33 0.09 0.00 0.36 0.00 0.00 54.97 55.86 3h6i s GLU 121 Cb 0.07 -0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.17 3h6i s GLU 121 CO -0.07 -0.20 -0.22 -0.51 -0.54 0.00 0.00 175.26 173.72 3h6i s LEU 122 N 1.39 2.47 -0.09 2.70 1.02 0.09 -1.43 118.68 124.84 3h6i s LEU 122 Ca -0.06 -0.59 0.01 0.00 0.02 0.00 0.00 54.13 53.51 3h6i s LEU 122 Cb -0.12 -1.40 0.02 0.00 0.02 0.00 0.00 46.19 44.71 3h6i s LEU 122 CO -0.05 0.21 -0.10 0.00 0.02 0.00 0.00 176.35 176.43 3h6i s VAL 124 N 1.23 2.91 0.15 0.00 1.01 -0.65 -1.29 120.40 123.75 3h6i s VAL 124 Ca -0.04 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.35 3h6i s VAL 124 Cb -0.14 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 3h6i s VAL 124 CO -0.03 0.50 -0.21 0.00 0.00 0.00 0.00 175.10 175.36 3h6i s ALA 125 N 0.81 2.08 -0.01 5.51 0.00 -0.80 -0.93 121.76 128.42 3h6i s ALA 125 Ca -0.04 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.48 3h6i s ALA 125 Cb -0.15 -0.25 0.01 0.00 0.00 0.00 0.00 23.12 22.73 3h6i s ALA 125 CO 0.00 0.35 0.01 -2.00 0.00 0.00 0.00 175.76 174.12 3h6i s GLU 126 N -2.41 0.02 0.46 0.00 2.12 -0.44 -0.40 118.70 118.05 3h6i s GLU 126 Ca 0.13 0.05 0.06 0.00 0.36 0.00 0.00 54.97 55.58 3h6i s GLU 126 Cb -0.08 -0.11 -0.02 0.00 0.26 0.00 0.00 34.13 34.19 3h6i s GLU 126 CO 0.06 -0.05 0.27 0.14 -0.54 0.00 0.00 175.26 175.15 3h6i s VAL 127 N 0.35 2.08 0.79 3.70 -7.23 -0.93 -0.74 120.40 118.43 3h6i s VAL 127 Ca -0.03 -1.59 -0.11 0.00 -1.81 0.00 0.00 61.98 58.44 3h6i s VAL 127 Cb -0.04 -2.67 0.06 0.00 0.56 0.00 0.00 36.38 34.29 3h6i s VAL 127 CO -0.01 0.00 1.09 0.00 -0.31 0.00 0.00 175.10 175.87 3h6i s ALA 128 N -2.65 2.18 0.70 1.32 0.00 -1.26 -4.87 121.76 117.17 3h6i s ALA 128 Ca 0.37 0.16 -0.11 0.00 0.00 0.00 0.00 51.96 52.38 3h6i s ALA 128 Cb 0.01 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.90 3h6i s ALA 128 CO 0.22 -1.81 1.06 -1.01 0.00 0.00 0.00 175.76 174.22 3h6i s HIS 129 N -2.94 3.18 0.21 0.00 3.76 -1.26 -4.82 115.29 113.42 3h6i s HIS 129 Ca 0.61 1.32 -0.32 0.00 -0.15 0.00 0.00 55.06 56.52 3h6i s HIS 129 Cb -0.17 -2.91 -0.13 0.00 1.11 0.00 0.00 32.58 30.48 3h6i s HIS 129 CO 0.56 -1.22 1.52 0.98 -0.85 0.00 0.00 174.74 175.73 3h6i n TYR 130 N -3.10 2.33 -1.01 1.40 9.36 -1.26 -2.11 117.16 122.77 3h6i n TYR 130 Ca 0.07 0.31 -0.00 0.00 3.32 0.00 0.00 57.90 61.60 3h6i n TYR 130 Cb 0.54 -2.53 -0.00 0.00 -0.63 0.00 0.00 39.34 36.72 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 2.83 0.42 3.61 2.98 0.00 -1.26 -5.02 105.19 108.75 3h6i n GLY 131 Ca 0.14 -0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.62 2.17 -0.31 1.61 2.02 -0.90 -5.11 118.70 117.57 3h6i s GLU 132 Ca 0.00 -1.41 0.03 0.00 0.02 0.00 0.00 54.97 53.60 3h6i s GLU 132 Cb 0.00 -2.12 0.09 0.00 0.10 0.00 0.00 34.13 32.20 3h6i s GLU 132 CO 0.00 0.38 0.02 0.95 0.02 0.00 0.00 175.26 176.63 3h6i s THR 133 N -2.18 1.99 -0.03 3.63 -4.23 -1.26 -4.77 115.64 108.79 3h6i s THR 133 Ca 0.30 -1.99 -0.02 0.00 -1.18 0.00 0.00 61.69 58.80 3h6i s THR 133 Cb -0.07 -2.39 0.02 0.00 1.34 0.00 0.00 72.50 71.40 3h6i s THR 133 CO 0.18 -0.47 0.08 -0.75 -0.54 0.00 0.00 174.62 173.12 3h6i s LYS 134 N 1.08 0.06 0.24 3.99 2.20 -1.26 -5.11 119.74 120.93 3h6i s LYS 134 Ca 0.06 0.17 -0.30 0.00 -0.36 0.00 0.00 55.97 55.54 3h6i s LYS 134 Cb -0.19 -0.06 -0.09 0.00 -1.51 0.00 0.00 37.83 35.98 3h6i s LYS 134 CO -0.10 -0.07 1.23 1.03 -0.36 0.00 0.00 175.35 177.08 3h6i s ARG 135 N 0.47 4.47 0.43 4.03 0.52 -1.26 -4.41 118.95 123.19 3h6i s ARG 135 Ca -0.04 1.97 -0.25 0.00 -0.52 0.00 0.00 55.73 56.90 3h6i s ARG 135 Cb -0.05 -3.19 -0.10 0.00 0.52 0.00 0.00 34.95 32.14 3h6i s ARG 135 CO -0.02 -0.09 1.16 -2.30 0.02 0.00 0.00 175.30 174.08 3h6i n PRO 136 N 1.95 1.66 -4.61 3.54 -0.02 -1.26 -4.86 135.00 131.40 3h6i n PRO 136 Ca 0.03 0.59 -0.34 0.00 -2.02 0.00 0.00 63.50 61.76 3h6i n PRO 136 Cb 0.44 -2.24 -0.12 0.00 -0.02 0.00 0.00 33.50 31.56 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 -2.16 2.96 -0.06 -0.52 2.02 0.09 -4.99 118.70 116.04 3h6i s GLU 137 Ca 0.63 -0.56 0.01 0.00 0.02 0.00 0.00 54.97 55.07 3h6i s GLU 137 Cb -0.53 -2.64 0.02 0.00 0.10 0.00 0.00 34.13 31.08 3h6i s GLU 137 CO 0.57 0.55 -0.08 -0.51 0.02 0.00 0.00 175.26 175.80 3h6i s LEU 138 N -0.49 1.45 -0.04 1.80 1.02 -1.23 -1.33 118.68 119.85 3h6i s LEU 138 Ca 0.07 -0.23 0.06 0.00 0.02 0.00 0.00 54.13 54.05 3h6i s LEU 138 Cb -0.12 -0.67 -0.01 0.00 0.02 0.00 0.00 46.19 45.41 3h6i s LEU 138 CO 0.02 -0.02 -0.22 -0.31 0.02 0.00 0.00 176.35 175.84 3h6i s TYR 139 N 0.89 2.13 -0.19 0.29 1.51 -0.11 -1.62 117.35 120.26 3h6i s TYR 139 Ca -0.11 -0.58 -0.03 0.00 -1.01 0.00 0.00 57.07 55.35 3h6i s TYR 139 Cb -0.15 -1.40 -0.01 0.00 -0.11 0.00 0.00 41.96 40.29 3h6i s TYR 139 CO 0.01 -0.16 -0.07 0.50 -1.11 0.00 0.00 175.55 174.72 3h6i s ARG 140 N -0.19 3.41 -0.15 -0.62 3.52 -0.43 -1.64 118.95 122.85 3h6i s ARG 140 Ca -0.01 -0.63 0.02 0.00 -0.13 0.00 0.00 55.73 54.98 3h6i s ARG 140 Cb -0.12 -2.89 0.01 0.00 -1.56 0.00 0.00 34.95 30.39 3h6i s ARG 140 CO 0.02 -0.03 -0.19 0.42 -0.81 0.00 0.00 175.30 174.71 3h6i s ILE 141 N 1.02 2.26 0.36 4.11 1.09 0.89 -0.96 121.20 129.96 3h6i s ILE 141 Ca -0.00 -0.91 0.07 0.00 -1.10 0.00 0.00 60.65 58.72 3h6i s ILE 141 Cb -0.15 -1.93 -0.01 0.00 -1.06 0.00 0.00 42.46 39.32 3h6i s ILE 141 CO -0.00 0.54 0.45 0.42 -0.10 0.00 0.00 174.94 176.24 3h6i s THR 142 N 0.89 3.68 0.60 2.92 -4.23 -0.59 -0.73 115.64 118.17 3h6i s THR 142 Ca -0.05 -1.09 0.28 0.00 -1.18 0.00 0.00 61.69 59.65 3h6i s THR 142 Cb -0.15 -3.26 0.39 0.00 1.34 0.00 0.00 72.50 70.81 3h6i s THR 142 CO -0.03 -0.12 1.53 0.10 -0.54 0.00 0.00 174.62 175.56 3h6i h TYR 143 N 0.92 0.00 -0.01 3.99 -0.00 -1.83 0.87 116.97 120.91 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 0.45 0.00 -0.48 -0.40 -0.00 0.00 0.00 178.16 177.73 3h6i n ASP 144 N -3.40 1.92 0.00 0.10 5.75 -1.26 -4.55 116.55 115.11 3h6i n ASP 144 Ca 0.17 -1.45 0.00 0.00 -0.01 0.00 0.00 54.79 53.50 3h6i n ASP 144 Cb 1.20 0.47 0.00 0.00 -1.03 0.00 0.00 41.12 41.76 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 0.97 3.74 6.12 0.00 0.30 -4.10 105.19 113.63 3h6i n GLY 145 Ca 0.09 0.00 -0.41 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 -2.05 7.48 -0.08 1.61 0.01 -1.25 -4.73 113.70 114.68 3h6i s SER 146 Ca 0.00 1.95 0.05 0.00 1.31 0.00 0.00 55.95 59.26 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 -0.04 -0.23 -0.51 0.41 0.00 0.00 173.24 172.88 3h6i s ILE 147 N -0.53 1.92 -0.06 1.44 2.07 -1.26 -1.55 121.20 123.23 3h6i s ILE 147 Ca 0.45 -0.96 0.03 0.00 -1.41 0.00 0.00 60.65 58.76 3h6i s ILE 147 Cb -0.26 -1.65 0.01 0.00 0.13 0.00 0.00 42.46 40.68 3h6i s ILE 147 CO 0.33 0.53 -0.15 0.00 -1.91 0.00 0.00 174.94 173.73 3h6i s ALA 148 N 0.16 1.46 -0.50 1.50 0.00 -0.13 -4.99 121.76 119.27 3h6i s ALA 148 Ca -0.12 -0.58 -0.19 0.00 0.00 0.00 0.00 51.96 51.07 3h6i s ALA 148 Cb -0.16 -0.57 0.05 0.00 0.00 0.00 0.00 23.12 22.44 3h6i s ALA 148 CO 0.06 0.19 0.63 0.34 0.00 0.00 0.00 175.76 176.99 3h6i s ASP 149 N 0.40 6.24 -0.20 0.00 -1.08 -1.26 -1.31 116.67 119.45 3h6i s ASP 149 Ca -0.11 -0.80 -0.10 0.00 -0.52 0.00 0.00 52.55 51.02 3h6i s ASP 149 Cb -0.14 -2.30 -0.05 0.00 -1.46 0.00 0.00 42.92 38.97 3h6i s ASP 149 CO 0.04 -0.88 0.13 -1.61 0.52 0.00 0.00 175.17 173.37 3h6i s GLU 150 N 2.69 4.17 0.31 4.34 0.41 -0.64 -5.03 118.70 124.96 3h6i s GLU 150 Ca 0.17 -0.23 0.23 0.00 -0.41 0.00 0.00 54.97 54.72 3h6i s GLU 150 Cb -0.18 -3.42 0.15 0.00 -1.78 0.00 0.00 34.13 28.90 3h6i s GLU 150 CO 0.13 0.28 1.30 -1.00 -0.49 0.00 0.00 175.26 175.48 3h6i h PRO 151 N 6.74 0.00 0.00 0.39 0.13 -1.95 -3.27 132.00 134.04 3h6i h PRO 151 Ca -0.41 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.67 3h6i h PRO 151 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 3h6i h PRO 151 CO 0.75 0.01 -1.17 0.72 -0.23 0.00 0.00 178.00 178.07 3h6i n HIS 152 N -2.87 0.00 -3.72 1.56 8.25 -1.26 -4.88 115.22 112.29 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 -0.11 -0.05 0.00 1.12 0.00 0.00 29.99 31.49 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 -2.06 -0.07 -0.02 4.41 -0.12 -1.26 -1.50 117.98 117.37 3h6i s PHE 153 Ca -0.04 -0.27 0.01 0.00 -0.05 0.00 0.00 56.93 56.58 3h6i s PHE 153 Cb 0.02 0.21 0.01 0.00 -0.63 0.00 0.00 43.02 42.63 3h6i s PHE 153 CO 0.05 -0.73 -0.04 0.08 -0.05 0.00 0.00 175.22 174.53 3h6i s VAL 154 N -3.85 0.40 -0.09 -2.49 1.01 0.40 -4.88 120.40 110.89 3h6i s VAL 154 Ca 0.06 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.93 3h6i s VAL 154 Cb 0.02 -0.38 0.01 0.00 0.00 0.00 0.00 36.38 36.02 3h6i s VAL 154 CO -0.08 0.15 -0.16 -0.69 0.00 0.00 0.00 175.10 174.31 3h6i s VAL 155 N 0.34 1.50 0.04 2.92 1.01 -1.26 -0.85 120.40 124.09 3h6i s VAL 155 Ca -0.04 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.31 3h6i s VAL 155 Cb -0.07 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 3h6i s VAL 155 CO -0.00 0.44 -0.09 -0.04 0.00 0.00 0.00 175.10 175.40 3h6i s MET 156 N 0.76 0.61 0.08 2.72 -1.94 0.97 -5.00 119.30 117.51 3h6i s MET 156 Ca -0.12 -0.71 0.00 0.00 -1.71 0.00 0.00 55.69 53.15 3h6i s MET 156 Cb -0.16 -0.48 0.00 0.00 2.01 0.00 0.00 34.83 36.20 3h6i s MET 156 CO 0.02 0.10 0.00 0.41 -0.01 0.00 0.00 175.02 175.55 3h6i n GLY 157 N 1.69 -2.87 7.00 -0.03 0.00 -1.26 -0.03 105.19 109.68 3h6i n GLY 157 Ca -0.21 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.51 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 -1.94 1.78 3.32 -0.02 0.00 -0.56 -4.16 105.19 103.61 3h6i n GLY 158 Ca -0.01 -0.61 -0.46 0.00 0.00 0.00 0.00 46.02 44.94 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 5.20 0.16 2.61 -4.23 -1.26 -4.32 115.64 113.79 3h6i s THR 159 Ca 0.00 -1.53 -0.08 0.00 -1.18 0.00 0.00 61.69 58.90 3h6i s THR 159 Cb 0.00 -4.37 -0.07 0.00 1.34 0.00 0.00 72.50 69.41 3h6i s THR 159 CO 0.00 -0.91 1.46 0.71 -0.54 0.00 0.00 174.62 175.34 3h6i h THR 160 N 5.81 1.29 -0.47 3.99 1.35 -1.95 -3.39 112.91 119.53 3h6i h THR 160 Ca -0.27 -1.72 0.09 0.00 -0.55 0.00 0.00 66.41 63.96 3h6i h THR 160 Cb 1.09 1.64 -0.08 0.00 -1.73 0.00 0.00 68.15 69.07 3h6i h THR 160 CO 1.02 0.55 -0.04 -0.33 -0.25 0.00 0.00 175.52 176.48 3h6i h GLU 161 N 0.59 0.07 0.00 4.72 3.07 -1.96 0.60 114.58 121.68 3h6i h GLU 161 Ca 0.02 -0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.80 3h6i h GLU 161 Cb 1.10 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.99 3h6i h GLU 161 CO 0.11 0.05 -0.34 -1.00 -1.40 0.00 0.00 179.01 176.43 3h6i h PRO 162 N 0.08 0.00 0.01 2.33 0.13 -1.86 -1.27 132.00 131.42 3h6i h PRO 162 Ca 0.23 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 65.11 3h6i h PRO 162 Cb 0.36 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.50 3h6i h PRO 162 CO -0.42 0.34 -1.04 0.82 -0.23 0.00 0.00 178.00 177.47 3h6i h ILE 163 N 0.00 1.32 -0.43 -3.56 2.04 -1.61 -2.30 117.51 112.97 3h6i h ILE 163 Ca -0.00 -2.33 -0.13 0.00 1.00 0.00 0.00 64.86 63.39 3h6i h ILE 163 Cb 0.66 2.42 -0.01 0.00 -0.74 0.00 0.00 36.82 39.16 3h6i h ILE 163 CO 0.04 0.71 -0.26 0.00 0.00 0.00 0.00 178.15 178.65 3h6i h ALA 164 N 0.49 0.61 -0.19 1.87 0.00 -0.74 -2.53 119.26 118.76 3h6i h ALA 164 Ca -0.12 -0.40 -0.16 0.00 0.00 0.00 0.00 54.91 54.23 3h6i h ALA 164 Cb 1.69 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 3h6i h ALA 164 CO 0.20 0.62 -0.53 -0.91 0.00 0.00 0.00 179.25 178.63 3h6i h ASN 165 N 0.76 0.62 0.28 0.00 -0.26 -1.29 -1.80 115.58 113.88 3h6i h ASN 165 Ca 0.09 -0.32 -0.07 0.00 -0.56 0.00 0.00 56.30 55.44 3h6i h ASN 165 Cb 0.83 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.91 3h6i h ASN 165 CO 0.07 1.03 -0.30 0.00 -1.06 0.00 0.00 177.43 177.17 3h6i h ALA 166 N 0.98 1.47 0.22 -0.83 0.00 -1.34 -2.96 119.26 116.80 3h6i h ALA 166 Ca 0.01 -0.28 -0.29 0.00 0.00 0.00 0.00 54.91 54.35 3h6i h ALA 166 Cb 1.07 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.84 3h6i h ALA 166 CO 0.10 0.40 -1.31 -0.07 0.00 0.00 0.00 179.25 178.37 3h6i h LEU 167 N 0.03 0.72 -1.43 0.00 3.38 -1.32 -3.20 115.31 113.50 3h6i h LEU 167 Ca 0.00 -0.93 0.23 0.00 0.09 0.00 0.00 57.88 57.28 3h6i h LEU 167 Cb 0.55 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.98 3h6i h LEU 167 CO 0.04 1.63 0.64 0.11 0.09 0.00 0.00 178.44 180.94 3h6i h LYS 168 N -0.01 0.41 0.00 1.13 1.57 -1.16 0.17 116.57 118.67 3h6i h LYS 168 Ca -0.23 -0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.37 3h6i h LYS 168 Cb 2.01 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 34.21 3h6i h LYS 168 CO 0.23 0.27 -0.90 0.93 -0.57 0.00 0.00 179.45 179.41 3h6i h GLU 169 N 0.42 0.00 0.00 3.15 5.08 -1.69 -3.38 114.58 118.17 3h6i h GLU 169 Ca 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.89 3h6i h GLU 169 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 3h6i h GLU 169 CO -0.24 0.83 0.00 -1.13 -1.00 0.00 0.00 179.01 177.48 3h6i n SER 170 N -4.50 0.00 -4.65 1.42 3.41 -1.11 -4.83 113.62 103.37 3h6i n SER 170 Ca -0.24 -1.30 -0.43 0.00 -0.26 0.00 0.00 58.87 56.64 3h6i n SER 170 Cb 0.57 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.50 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 3.11 -0.14 7.33 5.04 0.03 -5.01 117.35 125.70 3h6i s TYR 171 Ca 0.22 1.21 0.00 0.00 -2.44 0.00 0.00 57.07 56.06 3h6i s TYR 171 Cb 0.10 -3.59 -0.01 0.00 0.35 0.00 0.00 41.96 38.82 3h6i s TYR 171 CO 0.17 -0.91 -0.15 0.00 -1.34 0.00 0.00 175.55 173.32 3h6i s ALA 172 N 3.60 2.52 0.21 3.97 0.00 -1.26 -5.04 121.76 125.76 3h6i s ALA 172 Ca 0.47 -0.99 -0.28 0.00 0.00 0.00 0.00 51.96 51.17 3h6i s ALA 172 Cb -0.14 -1.20 -0.09 0.00 0.00 0.00 0.00 23.12 21.69 3h6i s ALA 172 CO 0.14 0.08 0.87 -2.00 0.00 0.00 0.00 175.76 174.84 3h6i s GLU 173 N 0.63 4.71 -0.12 0.00 2.12 -1.26 -3.70 118.70 121.09 3h6i s GLU 173 Ca -0.08 1.33 0.00 0.00 0.36 0.00 0.00 54.97 56.58 3h6i s GLU 173 Cb -0.16 -3.24 0.00 0.00 0.26 0.00 0.00 34.13 30.99 3h6i s GLU 173 CO 0.03 0.53 0.00 0.09 -0.54 0.00 0.00 175.26 175.36 3h6i n ASN 174 N 1.47 -3.20 -4.73 -1.70 4.13 -1.26 -5.04 115.26 104.93 3h6i n ASN 174 Ca -0.03 0.03 -0.35 0.00 1.68 0.00 0.00 54.58 55.91 3h6i n ASN 174 Cb 0.48 -0.80 0.08 0.00 -1.54 0.00 0.00 39.78 38.00 3h6i n ASN 174 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3h6i s ALA 175 N -2.02 2.24 0.89 5.41 0.00 -1.24 -4.27 121.76 122.76 3h6i s ALA 175 Ca 0.00 0.94 -0.11 0.00 0.00 0.00 0.00 51.96 52.80 3h6i s ALA 175 Cb 0.00 -3.47 0.18 0.00 0.00 0.00 0.00 23.12 19.83 3h6i s ALA 175 CO 0.00 -1.70 1.22 -1.54 0.00 0.00 0.00 175.76 173.74 3h6i s SER 176 N -1.88 3.45 0.08 0.00 1.04 -1.26 -0.78 113.70 114.34 3h6i s SER 176 Ca 0.76 -0.03 -0.33 0.00 0.48 0.00 0.00 55.95 56.83 3h6i s SER 176 Cb -0.30 -0.09 -0.17 0.00 0.10 0.00 0.00 66.02 65.56 3h6i s SER 176 CO 0.42 -2.49 1.61 0.25 0.98 0.00 0.00 173.24 174.01 3h6i h LEU 177 N -1.28 -0.91 -0.77 2.42 5.85 -1.99 -0.38 115.31 118.25 3h6i h LEU 177 Ca -0.41 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.41 3h6i h LEU 177 Cb 1.24 0.27 -0.05 0.00 0.37 0.00 0.00 40.66 42.48 3h6i h LEU 177 CO 0.36 -0.57 0.47 0.74 -0.34 0.00 0.00 178.44 179.11 3h6i h THR 178 N -0.90 1.06 -0.19 1.05 2.02 -1.96 -1.17 112.91 112.81 3h6i h THR 178 Ca -0.07 -0.31 -0.06 0.00 0.77 0.00 0.00 66.41 66.75 3h6i h THR 178 Cb 0.73 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.23 3h6i h THR 178 CO 0.08 0.16 -0.10 0.44 0.37 0.00 0.00 175.52 176.47 3h6i h ASP 179 N 0.89 0.41 -0.62 4.18 3.32 -1.87 -2.83 116.42 119.90 3h6i h ASP 179 Ca 0.32 -0.42 -0.03 0.00 0.02 0.00 0.00 57.03 56.92 3h6i h ASP 179 Cb 0.10 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 3h6i h ASP 179 CO -0.15 0.74 0.28 0.00 -1.72 0.00 0.00 179.24 178.39 3h6i h ALA 180 N 0.69 1.26 -0.14 3.45 0.00 -0.74 -1.91 119.26 121.87 3h6i h ALA 180 Ca 0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3h6i h ALA 180 Cb 0.59 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3h6i h ALA 180 CO 0.03 0.55 0.04 1.25 0.00 0.00 0.00 179.25 181.13 3h6i h LEU 181 N 0.93 0.20 -0.71 0.00 5.85 -1.21 -2.01 115.31 118.36 3h6i h LEU 181 Ca 0.22 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 3h6i h LEU 181 Cb 0.16 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3h6i h LEU 181 CO -0.02 0.34 0.29 0.03 -0.34 0.00 0.00 178.44 178.74 3h6i h ARG 182 N 0.04 1.05 -0.19 1.25 3.08 -1.24 0.16 114.38 118.53 3h6i h ARG 182 Ca 0.04 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 59.87 3h6i h ARG 182 Cb 0.22 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 3h6i h ARG 182 CO -0.00 0.86 -0.07 0.82 -1.07 0.00 0.00 179.97 180.51 3h6i h ILE 183 N 1.00 1.16 0.11 2.04 2.04 -1.31 0.96 117.51 123.51 3h6i h ILE 183 Ca 0.24 -0.67 -0.17 0.00 1.00 0.00 0.00 64.86 65.25 3h6i h ILE 183 Cb 0.19 1.10 0.02 0.00 -0.74 0.00 0.00 36.82 37.39 3h6i h ILE 183 CO -0.02 0.22 -0.74 0.00 0.00 0.00 0.00 178.15 177.61 3h6i h ALA 184 N 1.66 -0.05 -0.45 1.87 0.00 -0.58 -2.66 119.26 119.05 3h6i h ALA 184 Ca 0.06 -0.66 -0.08 0.00 0.00 0.00 0.00 54.91 54.23 3h6i h ALA 184 Cb 0.30 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3h6i h ALA 184 CO 0.01 0.35 -0.04 0.28 0.00 0.00 0.00 179.25 179.86 3h6i h VAL 185 N -0.34 1.24 0.00 0.00 2.07 -0.46 -2.65 116.25 116.12 3h6i h VAL 185 Ca -0.12 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.36 3h6i h VAL 185 Cb 1.55 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 3h6i h VAL 185 CO 0.14 0.36 0.00 0.00 0.02 0.00 0.00 177.57 178.09 3h6i h ALA 186 N 1.26 1.00 0.00 1.67 0.00 -0.89 -3.15 119.26 119.14 3h6i h ALA 186 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3h6i h ALA 186 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3h6i h ALA 186 CO 0.02 0.00 -1.37 0.00 0.00 0.00 0.00 179.25 177.90 3h6i n ALA 187 N -2.05 2.37 0.08 0.00 0.00 -1.00 -4.15 120.51 115.75 3h6i n ALA 187 Ca 0.02 -0.42 -0.14 0.00 0.00 0.00 0.00 53.44 52.90 3h6i n ALA 187 Cb 0.38 -0.95 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 3h6i n ALA 187 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3h6i h LEU 188 N 0.00 0.48 -0.91 0.00 3.38 -1.47 -3.26 115.31 113.54 3h6i h LEU 188 Ca -0.07 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.46 3h6i h LEU 188 Cb 1.22 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.78 3h6i h LEU 188 CO 0.01 1.24 0.47 0.03 0.09 0.00 0.00 178.44 180.29 3h6i h ARG 189 N 0.18 1.24 0.00 1.13 3.08 -1.74 -3.48 114.38 114.80 3h6i h ARG 189 Ca -0.09 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.80 3h6i h ARG 189 Cb 1.68 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 31.49 3h6i h ARG 189 CO 0.17 0.92 0.00 0.00 -1.07 0.00 0.00 179.97 179.99 3h6i n ALA 190 N -2.41 0.97 -2.27 0.04 0.00 -1.23 -5.09 120.51 110.52 3h6i n ALA 190 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.29 3h6i n ALA 190 Cb 0.11 -0.67 0.02 0.00 0.00 0.00 0.00 19.45 18.91 3h6i n ALA 190 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h6i s GLY 204 N -1.27 2.14 0.59 0.00 0.00 -1.26 -4.22 107.32 103.30 3h6i s GLY 204 Ca 0.00 -1.57 0.39 0.00 0.00 0.00 0.00 44.72 43.55 3h6i s GLY 204 CO 0.00 -1.86 2.20 -2.08 0.00 0.00 0.00 173.10 171.36 3h6i h VAL 205 N 0.52 0.00 -0.00 1.40 2.07 -1.98 -0.21 116.25 118.04 3h6i h VAL 205 Ca -0.34 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.15 3h6i h VAL 205 Cb 1.30 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 3h6i h VAL 205 CO 0.51 0.00 -0.61 0.00 0.02 0.00 0.00 177.57 177.49 3h6i n ALA 206 N -2.01 3.85 -1.16 1.67 0.00 -1.26 -4.05 120.51 117.56 3h6i n ALA 206 Ca -0.02 -0.50 0.09 0.00 0.00 0.00 0.00 53.44 53.01 3h6i n ALA 206 Cb 0.08 -0.95 0.12 0.00 0.00 0.00 0.00 19.45 18.70 3h6i n ALA 206 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h6i n SER 207 N -1.06 2.11 -3.85 0.00 2.88 -0.14 -4.25 113.62 109.31 3h6i n SER 207 Ca 0.07 -2.97 -0.12 0.00 -1.33 0.00 0.00 58.87 54.52 3h6i n SER 207 Cb 0.36 -0.40 -0.11 0.00 -0.75 0.00 0.00 64.21 63.31 3h6i n SER 207 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3h6i s LEU 208 N -2.57 1.45 -0.11 2.46 1.43 -0.88 -2.59 118.68 117.88 3h6i s LEU 208 Ca 0.28 -0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.39 3h6i s LEU 208 Cb 0.25 0.68 0.01 0.00 0.03 0.00 0.00 46.19 47.16 3h6i s LEU 208 CO 0.03 -0.27 -0.17 -0.70 0.23 0.00 0.00 176.35 175.46 3h6i s GLU 209 N -0.91 2.35 0.00 1.70 2.12 0.60 -4.73 118.70 119.84 3h6i s GLU 209 Ca -0.10 -0.62 0.03 0.00 0.36 0.00 0.00 54.97 54.64 3h6i s GLU 209 Cb -0.05 -1.94 -0.01 0.00 0.26 0.00 0.00 34.13 32.38 3h6i s GLU 209 CO 0.01 -0.01 -0.09 0.08 -0.54 0.00 0.00 175.26 174.71 3h6i s VAL 210 N 0.84 0.67 0.05 3.70 1.01 -1.26 -0.95 120.40 124.46 3h6i s VAL 210 Ca -0.09 -0.50 -0.27 0.00 0.00 0.00 0.00 61.98 61.12 3h6i s VAL 210 Cb -0.15 -0.59 0.07 0.00 0.00 0.00 0.00 36.38 35.71 3h6i s VAL 210 CO 0.00 0.09 0.66 0.00 0.00 0.00 0.00 175.10 175.85 3h6i s ALA 211 N -0.40 -1.69 0.16 5.51 0.00 -0.72 -1.85 121.76 122.76 3h6i s ALA 211 Ca 0.01 0.91 0.08 0.00 0.00 0.00 0.00 51.96 52.96 3h6i s ALA 211 Cb -0.04 0.43 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 3h6i s ALA 211 CO -0.00 -0.58 -0.16 0.14 0.00 0.00 0.00 175.76 175.16 3h6i s VAL 212 N -2.51 1.67 -0.65 0.00 -7.23 -0.19 -0.26 120.40 111.23 3h6i s VAL 212 Ca -0.04 -1.91 -0.07 0.00 -1.81 0.00 0.00 61.98 58.15 3h6i s VAL 212 Cb -0.01 -1.79 0.17 0.00 0.56 0.00 0.00 36.38 35.32 3h6i s VAL 212 CO -0.02 -0.39 0.52 -0.76 -0.31 0.00 0.00 175.10 174.14 3h6i s LEU 213 N -2.71 5.77 -0.59 1.32 1.43 -0.06 -1.28 118.68 122.57 3h6i s LEU 213 Ca 0.15 -2.63 -0.28 0.00 -1.03 0.00 0.00 54.13 50.34 3h6i s LEU 213 Cb -0.05 -1.99 0.03 0.00 0.03 0.00 0.00 46.19 44.22 3h6i s LEU 213 CO 0.06 -0.49 1.19 -0.62 0.23 0.00 0.00 176.35 176.72 3h6i s ASP 214 N 1.49 6.44 0.00 2.29 2.15 0.47 -1.85 116.67 127.66 3h6i s ASP 214 Ca 0.15 0.08 0.06 0.00 0.43 0.00 0.00 52.55 53.28 3h6i s ASP 214 Cb -0.18 -2.55 0.27 0.00 -0.30 0.00 0.00 42.92 40.16 3h6i s ASP 214 CO -0.05 -1.49 1.18 0.00 -0.17 0.00 0.00 175.17 174.64 3h6i n ALA 215 N 8.47 1.31 1.17 3.66 0.00 -0.33 -1.37 120.51 133.42 3h6i n ALA 215 Ca 0.08 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.62 3h6i n ALA 215 Cb 0.49 -1.10 0.25 0.00 0.00 0.00 0.00 19.45 19.08 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 -1.48 1.50 -4.76 0.00 5.15 -1.26 -4.46 115.26 109.95 3h6i n ASN 216 Ca 0.02 -1.21 -0.40 0.00 -0.60 0.00 0.00 54.58 52.39 3h6i n ASN 216 Cb 0.07 0.24 -0.04 0.00 -0.53 0.00 0.00 39.78 39.52 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 -2.43 4.59 0.09 1.20 1.81 -0.47 -4.98 118.95 118.76 3h6i s ARG 217 Ca 0.24 1.87 -0.21 0.00 -1.72 0.00 0.00 55.73 55.91 3h6i s ARG 217 Cb 0.19 -3.18 -0.10 0.00 -0.45 0.00 0.00 34.95 31.41 3h6i s ARG 217 CO 0.51 0.13 1.65 -1.35 -0.68 0.00 0.00 175.30 175.56 3h6i h PRO 218 N 3.86 0.22 0.00 3.54 0.11 -1.90 -3.41 132.00 134.42 3h6i h PRO 218 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3h6i h PRO 218 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3h6i h PRO 218 CO 0.67 0.28 0.00 -2.13 -0.21 0.00 0.00 178.00 176.61 3h6i n ARG 219 N -4.89 0.00 -3.05 1.05 0.63 -1.26 -4.56 116.66 104.58 3h6i n ARG 219 Ca -0.05 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.45 3h6i n ARG 219 Cb 0.10 -0.32 -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 -1.92 3.27 0.26 -0.14 0.52 -1.26 -4.43 118.95 115.26 3h6i s ARG 220 Ca 0.00 -0.42 0.10 0.00 -0.52 0.00 0.00 55.73 54.89 3h6i s ARG 220 Cb 0.00 -4.00 0.30 0.00 0.52 0.00 0.00 34.95 31.78 3h6i s ARG 220 CO 0.00 -1.15 1.58 0.00 0.02 0.00 0.00 175.30 175.75 3h6i h ALA 221 N 8.99 0.90 -2.34 2.13 0.00 -1.20 -3.46 119.26 124.29 3h6i h ALA 221 Ca -0.26 -0.59 -0.54 0.00 0.00 0.00 0.00 54.91 53.52 3h6i h ALA 221 Cb 1.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3h6i h ALA 221 CO 0.95 0.81 1.03 0.12 0.00 0.00 0.00 179.25 182.16 3h6i s PHE 222 N -3.50 2.23 -0.03 0.00 5.36 -1.26 -0.39 117.98 120.39 3h6i s PHE 222 Ca -0.01 0.31 -0.00 0.00 -0.96 0.00 0.00 56.93 56.27 3h6i s PHE 222 Cb 0.12 -3.90 0.03 0.00 -0.34 0.00 0.00 43.02 38.93 3h6i s PHE 222 CO 0.77 -3.68 0.03 0.50 -1.46 0.00 0.00 175.22 171.37 3h6i s ARG 223 N 3.38 0.03 -0.02 10.12 3.52 -0.40 -4.97 118.95 130.61 3h6i s ARG 223 Ca 0.72 0.21 -0.20 0.00 -0.13 0.00 0.00 55.73 56.33 3h6i s ARG 223 Cb -0.35 -0.37 -0.05 0.00 -1.56 0.00 0.00 34.95 32.61 3h6i s ARG 223 CO 0.30 -0.20 0.58 1.03 -0.81 0.00 0.00 175.30 176.20 3h6i s ARG 224 N 1.35 4.31 -0.42 5.12 0.52 -1.26 -1.02 118.95 127.55 3h6i s ARG 224 Ca -0.06 0.70 -0.06 0.00 -0.52 0.00 0.00 55.73 55.80 3h6i s ARG 224 Cb -0.13 -3.35 0.10 0.00 0.52 0.00 0.00 34.95 32.09 3h6i s ARG 224 CO -0.03 0.35 0.24 0.42 0.02 0.00 0.00 175.30 176.31 3h6i s ILE 225 N -0.12 3.78 0.42 1.52 1.01 -0.77 -4.98 121.20 122.06 3h6i s ILE 225 Ca 0.31 -1.74 0.04 0.00 0.00 0.00 0.00 60.65 59.26 3h6i s ILE 225 Cb -0.18 -3.45 -0.05 0.00 0.01 0.00 0.00 42.46 38.80 3h6i s ILE 225 CO 0.16 -0.61 0.04 0.42 0.00 0.00 0.00 174.94 174.95 3h6i s THR 226 N 1.29 1.35 0.00 2.92 -4.23 -1.26 -4.30 115.64 111.42 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 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 71.00 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 -0.99 2.78 0.31 3.99 0.00 -1.26 -2.83 105.19 107.20 3h6i n GLY 227 Ca -0.09 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 45.94 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 0.30 0.38 0.43 1.61 4.64 -2.01 -2.26 113.55 116.65 3h6i h SER 228 Ca 0.00 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.21 3h6i h SER 228 Cb 0.00 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 61.98 3h6i h SER 228 CO 0.00 0.27 -0.46 0.00 -0.87 0.00 0.00 176.83 175.77 3h6i h ALA 229 N 1.78 1.21 0.10 5.18 0.00 -1.95 -3.16 119.26 122.42 3h6i h ALA 229 Ca 0.14 -0.42 -0.27 0.00 0.00 0.00 0.00 54.91 54.36 3h6i h ALA 229 Cb 0.04 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.76 3h6i h ALA 229 CO -0.03 0.59 -1.17 1.25 0.00 0.00 0.00 179.25 179.88 3h6i h LEU 230 N 0.03 0.54 -0.94 0.00 5.85 -1.25 -3.33 115.31 116.21 3h6i h LEU 230 Ca -0.00 -0.52 -0.01 0.00 0.84 0.00 0.00 57.88 58.19 3h6i h LEU 230 Cb 0.83 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.64 3h6i h LEU 230 CO 0.06 1.37 0.57 -0.61 -0.34 0.00 0.00 178.44 179.49 3h6i h GLN 231 N 0.15 1.28 -0.45 1.25 5.75 -1.48 -3.15 115.11 118.46 3h6i h GLN 231 Ca -0.13 -0.12 0.09 0.00 -0.15 0.00 0.00 58.65 58.34 3h6i h GLN 231 Cb 1.87 -0.27 -0.09 0.00 1.07 0.00 0.00 27.48 30.05 3h6i h GLN 231 CO 0.20 0.89 -0.21 0.00 -2.65 0.00 0.00 178.83 177.06 3h6i h ALA 232 N 1.31 0.12 0.00 3.38 0.00 -1.66 -2.06 119.26 120.35 3h6i h ALA 232 Ca 0.34 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.40 3h6i h ALA 232 Cb -0.06 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3h6i h ALA 232 CO -0.06 -0.56 0.00 1.28 0.00 0.00 0.00 179.25 179.91 3h6i n LEU 233 N -5.39 0.00 -0.52 0.00 4.32 -1.19 -5.17 117.00 109.05 3h6i n LEU 233 Ca 0.03 0.17 0.14 0.00 -0.02 0.00 0.00 56.01 56.33 3h6i n LEU 233 Cb 0.30 -0.17 0.49 0.00 -1.62 0.00 0.00 43.42 42.42 3h6i n LEU 233 CO 0.09 -0.03 0.85 0.18 -1.22 0.00 0.00 177.39 177.27