#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6i h PRO 9 N 0.00 0.12 -0.42 -1.46 0.11 -2.06 -0.44 132.00 127.86 3h6i h PRO 9 Ca 0.00 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.96 3h6i h PRO 9 Cb 0.00 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 3h6i h PRO 9 CO 0.00 0.08 -0.29 0.93 -0.21 0.00 0.00 178.00 178.51 3h6i h GLU 10 N 0.12 0.90 0.03 1.05 4.39 -2.05 -2.64 114.58 116.37 3h6i h GLU 10 Ca 0.62 -0.42 -0.21 0.00 0.34 0.00 0.00 59.36 59.69 3h6i h GLU 10 Cb 1.34 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.97 3h6i h GLU 10 CO -0.75 1.07 -0.96 0.37 -1.16 0.00 0.00 179.01 177.57 3h6i h GLN 11 N 0.77 0.18 0.50 2.33 4.15 -1.74 -3.00 115.11 118.29 3h6i h GLN 11 Ca 0.09 -0.23 -0.02 0.00 0.77 0.00 0.00 58.65 59.25 3h6i h GLN 11 Cb 0.85 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.62 3h6i h GLN 11 CO 0.08 1.01 -0.24 0.00 -1.93 0.00 0.00 178.83 177.74 3h6i h ALA 12 N 0.91 -0.67 -0.26 3.38 0.00 -1.07 0.82 119.26 122.36 3h6i h ALA 12 Ca -0.06 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.77 3h6i h ALA 12 Cb 1.63 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.67 3h6i h ALA 12 CO 0.15 -0.84 0.26 1.98 0.00 0.00 0.00 179.25 180.79 3h6i h MET 13 N -0.73 0.00 0.23 0.00 4.05 -1.53 0.56 114.93 117.51 3h6i h MET 13 Ca -0.07 0.00 -0.34 0.00 -0.28 0.00 0.00 59.70 59.02 3h6i h MET 13 Cb 0.54 0.00 0.03 0.00 -0.80 0.00 0.00 31.60 31.37 3h6i h MET 13 CO 0.11 0.00 -1.51 -0.09 0.23 0.00 0.00 176.91 175.65 3h6i h ARG 14 N 0.00 0.50 -0.22 0.39 2.43 -1.29 -2.82 114.38 113.37 3h6i h ARG 14 Ca 0.12 -0.85 -0.00 0.00 -0.81 0.00 0.00 59.98 58.44 3h6i h ARG 14 Cb 0.64 0.32 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 3h6i h ARG 14 CO -0.00 1.40 0.12 0.93 -1.51 0.00 0.00 179.97 180.91 3h6i h GLU 15 N 0.14 0.31 -0.45 0.20 4.39 0.56 -2.25 114.58 117.48 3h6i h GLU 15 Ca -0.26 -0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.28 3h6i h GLU 15 Cb 2.15 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 30.72 3h6i h GLU 15 CO 0.26 0.29 -0.19 0.00 -1.16 0.00 0.00 179.01 178.20 3h6i h ARG 16 N 0.25 0.92 -0.25 2.33 3.08 -0.82 -2.78 114.38 117.12 3h6i h ARG 16 Ca 0.08 -0.39 0.05 0.00 0.07 0.00 0.00 59.98 59.78 3h6i h ARG 16 Cb 0.07 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 3h6i h ARG 16 CO -0.01 1.05 -0.02 0.77 -1.07 0.00 0.00 179.97 180.68 3h6i h SER 17 N 0.76 -0.15 -0.21 7.04 0.02 -1.36 -1.72 113.55 117.94 3h6i h SER 17 Ca 0.10 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 3h6i h SER 17 Cb 0.76 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 3h6i h SER 17 CO 0.06 -0.04 0.01 -0.33 -1.14 0.00 0.00 176.83 175.39 3h6i h GLU 18 N 0.05 0.36 -0.71 3.45 4.39 -1.42 0.58 114.58 121.27 3h6i h GLU 18 Ca 0.12 -0.11 0.16 0.00 0.34 0.00 0.00 59.36 59.87 3h6i h GLU 18 Cb 0.17 -0.04 -0.11 0.00 -0.10 0.00 0.00 28.75 28.67 3h6i h GLU 18 CO -0.22 0.54 0.09 1.25 -1.16 0.00 0.00 179.01 179.51 3h6i h LEU 19 N 0.13 -0.15 -0.13 1.33 6.46 -1.23 0.15 115.31 121.87 3h6i h LEU 19 Ca 0.06 0.16 -0.19 0.00 -0.12 0.00 0.00 57.88 57.79 3h6i h LEU 19 Cb 0.37 0.25 0.01 0.00 -0.73 0.00 0.00 40.66 40.56 3h6i h LEU 19 CO 0.01 -0.10 -0.65 0.00 -0.62 0.00 0.00 178.44 177.08 3h6i h ALA 20 N 1.62 0.25 -0.99 1.25 0.00 -1.22 -2.77 119.26 117.40 3h6i h ALA 20 Ca 0.39 -0.56 0.08 0.00 0.00 0.00 0.00 54.91 54.82 3h6i h ALA 20 Cb 0.67 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.38 3h6i h ALA 20 CO -0.55 0.54 0.64 -0.09 0.00 0.00 0.00 179.25 179.78 3h6i h ARG 21 N 0.34 1.07 0.05 0.00 1.12 0.49 -1.90 114.38 115.55 3h6i h ARG 21 Ca -0.05 -0.06 -0.23 0.00 -1.11 0.00 0.00 59.98 58.53 3h6i h ARG 21 Cb 1.29 -0.24 0.02 0.00 -0.01 0.00 0.00 29.97 31.03 3h6i h ARG 21 CO 0.13 0.71 -0.94 0.87 -3.11 0.00 0.00 179.97 177.63 3h6i h LYS 22 N 1.10 0.54 -0.54 0.20 1.57 -0.81 -2.41 116.57 116.22 3h6i h LYS 22 Ca 0.44 -0.66 0.10 0.00 -1.87 0.00 0.00 60.65 58.67 3h6i h LYS 22 Cb 0.27 0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 3h6i h LYS 22 CO -0.19 1.27 0.37 0.78 -0.57 0.00 0.00 179.45 181.10 3h6i h GLY 23 N 0.11 0.42 1.75 3.86 0.00 -1.22 -0.22 103.07 107.78 3h6i h GLY 23 Ca -0.13 -0.12 -0.23 0.00 0.00 0.00 0.00 47.33 46.85 3h6i h GLY 23 CO 0.18 0.07 -1.02 -2.22 0.00 0.00 0.00 176.54 173.55 3h6i h ILE 24 N 0.30 1.53 0.00 2.60 2.04 -1.34 -3.16 117.51 119.48 3h6i h ILE 24 Ca 0.25 -2.90 -0.06 0.00 1.00 0.00 0.00 64.86 63.16 3h6i h ILE 24 Cb 0.60 2.69 -0.01 0.00 -0.74 0.00 0.00 36.82 39.36 3h6i h ILE 24 CO -0.06 0.84 -0.29 0.00 0.00 0.00 0.00 178.15 178.65 3h6i h ALA 25 N 0.83 1.13 0.00 1.87 0.00 -0.57 -1.76 119.26 120.76 3h6i h ALA 25 Ca -0.07 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 3h6i h ALA 25 Cb 1.71 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 3h6i h ALA 25 CO 0.16 0.36 -0.18 -0.09 0.00 0.00 0.00 179.25 179.50 3h6i h ARG 26 N 0.00 0.00 -7.02 0.00 2.43 -1.14 -3.34 114.38 105.31 3h6i h ARG 26 Ca -0.00 0.00 -0.47 0.00 -0.81 0.00 0.00 59.98 58.70 3h6i h ARG 26 Cb 0.69 0.00 0.05 0.00 -0.42 0.00 0.00 29.97 30.30 3h6i h ARG 26 CO 0.04 0.18 0.11 0.00 -1.51 0.00 0.00 179.97 178.79 3h6i s ALA 27 N -3.29 3.42 0.87 2.80 0.00 -1.12 -4.93 121.76 119.51 3h6i s ALA 27 Ca 0.04 -0.82 -0.10 0.00 0.00 0.00 0.00 51.96 51.08 3h6i s ALA 27 Cb 0.07 -2.48 0.12 0.00 0.00 0.00 0.00 23.12 20.83 3h6i s ALA 27 CO 0.67 -0.74 1.12 0.15 0.00 0.00 0.00 175.76 176.95 3h6i s LYS 28 N -4.90 1.41 0.10 0.00 -0.14 -1.26 -1.83 119.74 113.12 3h6i s LYS 28 Ca 0.53 1.31 -0.03 0.00 -1.36 0.00 0.00 55.97 56.43 3h6i s LYS 28 Cb -0.10 -1.79 -0.05 0.00 -1.68 0.00 0.00 37.83 34.21 3h6i s LYS 28 CO 0.43 -2.28 0.30 -1.12 -0.76 0.00 0.00 175.35 171.92 3h6i s SER 29 N -3.00 6.43 0.00 2.83 0.01 -1.26 -4.08 113.70 114.63 3h6i s SER 29 Ca 0.64 0.44 0.03 0.00 1.31 0.00 0.00 55.95 58.37 3h6i s SER 29 Cb -0.20 -2.03 -0.01 0.00 0.21 0.00 0.00 66.02 63.99 3h6i s SER 29 CO 0.57 0.11 -0.10 -0.69 0.41 0.00 0.00 173.24 173.55 3h6i s VAL 30 N -1.58 0.75 -0.03 3.43 1.01 0.89 -2.09 120.40 122.78 3h6i s VAL 30 Ca 0.38 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.89 3h6i s VAL 30 Cb -0.13 -0.65 -0.00 0.00 0.00 0.00 0.00 36.38 35.60 3h6i s VAL 30 CO 0.26 0.13 -0.14 -0.69 0.00 0.00 0.00 175.10 174.67 3h6i s VAL 31 N -0.38 1.15 -0.08 2.92 1.01 0.10 -0.24 120.40 124.89 3h6i s VAL 31 Ca 0.02 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.44 3h6i s VAL 31 Cb -0.04 -0.99 0.02 0.00 0.00 0.00 0.00 36.38 35.36 3h6i s VAL 31 CO -0.00 0.34 -0.10 0.00 0.00 0.00 0.00 175.10 175.33 3h6i s ALA 32 N -0.02 1.23 0.01 5.51 0.00 -0.31 -0.69 121.76 127.49 3h6i s ALA 32 Ca -0.01 -0.42 -0.05 0.00 0.00 0.00 0.00 51.96 51.48 3h6i s ALA 32 Cb -0.09 -0.66 -0.01 0.00 0.00 0.00 0.00 23.12 22.37 3h6i s ALA 32 CO 0.01 -0.05 0.09 -0.48 0.00 0.00 0.00 175.76 175.32 3h6i s LEU 33 N 0.99 1.77 0.06 0.00 0.05 -0.06 -0.31 118.68 121.17 3h6i s LEU 33 Ca -0.09 -0.32 -0.29 0.00 0.05 0.00 0.00 54.13 53.49 3h6i s LEU 33 Cb -0.15 0.51 -0.05 0.00 -2.05 0.00 0.00 46.19 44.45 3h6i s LEU 33 CO -0.00 -0.36 0.93 0.00 -0.55 0.00 0.00 176.35 176.37 3h6i s ALA 34 N -1.51 3.23 0.01 1.48 0.00 -0.78 -0.47 121.76 123.73 3h6i s ALA 34 Ca -0.14 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.33 3h6i s ALA 34 Cb -0.08 -3.25 -0.00 0.00 0.00 0.00 0.00 23.12 19.79 3h6i s ALA 34 CO 0.00 -0.09 0.01 2.48 0.00 0.00 0.00 175.76 178.16 3h6i n TYR 35 N 3.23 -0.00 0.02 0.00 0.18 -0.64 -4.78 117.16 115.17 3h6i n TYR 35 Ca 0.03 -0.09 -0.12 0.00 1.88 0.00 0.00 57.90 59.59 3h6i n TYR 35 Cb 0.50 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.38 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 1.03 -0.00 -0.28 -3.48 0.00 -1.57 -3.22 119.26 111.73 3h6i h ALA 36 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3h6i h ALA 36 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3h6i h ALA 36 CO 0.02 -0.40 0.00 0.41 0.00 0.00 0.00 179.25 179.27 3h6i n GLY 37 N -0.56 0.67 0.00 0.00 0.00 -1.26 -5.01 105.19 99.03 3h6i n GLY 37 Ca -0.08 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.83 0.58 3.26 -0.02 0.00 -1.22 -1.00 105.19 107.62 3h6i n GLY 38 Ca 0.10 -0.94 -0.26 0.00 0.00 0.00 0.00 46.02 44.91 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 1.71 -0.06 1.61 1.01 -0.79 -1.62 120.40 122.26 3h6i s VAL 39 Ca 0.00 -1.17 0.06 0.00 0.00 0.00 0.00 61.98 60.87 3h6i s VAL 39 Cb 0.00 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 3h6i s VAL 39 CO 0.00 0.26 -0.24 -0.22 0.00 0.00 0.00 175.10 174.90 3h6i s LEU 40 N -1.08 2.05 -0.11 3.92 2.96 0.38 -0.76 118.68 126.04 3h6i s LEU 40 Ca 0.08 -0.50 0.03 0.00 -0.22 0.00 0.00 54.13 53.52 3h6i s LEU 40 Cb -0.09 -1.33 -0.00 0.00 0.50 0.00 0.00 46.19 45.27 3h6i s LEU 40 CO 0.01 0.23 -0.21 -0.36 -1.32 0.00 0.00 176.35 174.71 3h6i s PHE 41 N -0.12 2.64 -0.05 5.38 0.08 0.60 -0.88 117.98 125.63 3h6i s PHE 41 Ca -0.04 -0.99 -0.00 0.00 0.12 0.00 0.00 56.93 56.01 3h6i s PHE 41 Cb -0.14 -1.76 0.03 0.00 -0.57 0.00 0.00 43.02 40.57 3h6i s PHE 41 CO 0.04 -0.40 -0.01 0.08 -0.10 0.00 0.00 175.22 174.83 3h6i s VAL 42 N 0.43 0.38 0.04 -0.44 1.01 0.14 -1.82 120.40 120.14 3h6i s VAL 42 Ca -0.15 0.05 0.03 0.00 0.00 0.00 0.00 61.98 61.91 3h6i s VAL 42 Cb -0.17 -0.49 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 3h6i s VAL 42 CO 0.06 0.23 -0.10 0.00 0.00 0.00 0.00 175.10 175.29 3h6i s ALA 43 N 1.48 0.79 -0.49 5.51 0.00 -0.13 -0.72 121.76 128.20 3h6i s ALA 43 Ca -0.03 -0.76 -0.29 0.00 0.00 0.00 0.00 51.96 50.89 3h6i s ALA 43 Cb -0.13 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 22.97 3h6i s ALA 43 CO -0.03 0.08 1.18 -1.21 0.00 0.00 0.00 175.76 175.78 3h6i s GLU 44 N -1.35 3.67 -0.27 0.00 2.02 -0.89 -1.01 118.70 120.87 3h6i s GLU 44 Ca -0.05 0.56 -0.01 0.00 0.02 0.00 0.00 54.97 55.49 3h6i s GLU 44 Cb -0.09 -3.94 0.13 0.00 0.10 0.00 0.00 34.13 30.33 3h6i s GLU 44 CO 0.01 -1.46 0.29 1.21 0.02 0.00 0.00 175.26 175.33 3h6i s ASN 45 N 2.74 1.50 0.46 -0.19 2.47 -0.76 -4.69 114.94 116.47 3h6i s ASN 45 Ca 0.49 -0.59 0.24 0.00 0.42 0.00 0.00 52.86 53.41 3h6i s ASN 45 Cb -0.08 0.55 1.08 0.00 -1.45 0.00 0.00 41.25 41.35 3h6i s ASN 45 CO 0.31 -0.37 1.91 1.55 -3.72 0.00 0.00 177.10 176.78 3h6i h PRO 46 N 8.26 0.00 -6.95 0.43 0.13 -1.81 -3.31 132.00 128.76 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 1.09 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.27 3h6i h PRO 46 CO 0.32 0.22 0.48 0.45 -0.23 0.00 0.00 178.00 179.24 3h6i s SER 47 N -6.28 6.56 0.05 1.44 0.15 -1.26 -4.87 113.70 109.50 3h6i s SER 47 Ca -0.01 2.28 0.22 0.00 0.70 0.00 0.00 55.95 59.14 3h6i s SER 47 Cb 0.12 -2.61 -0.12 0.00 -1.71 0.00 0.00 66.02 61.70 3h6i s SER 47 CO 0.63 -0.64 0.83 -2.11 1.20 0.00 0.00 173.24 173.15 3h6i n ARG 48 N 0.04 0.45 0.00 5.44 1.85 -1.26 -4.62 116.66 118.55 3h6i n ARG 48 Ca 0.04 -0.05 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 3h6i n ARG 48 Cb 0.47 -1.60 0.00 0.00 -1.05 0.00 0.00 32.46 30.28 3h6i n ARG 48 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 3h6i n SER 49 N -2.15 4.86 -4.43 2.89 3.41 -1.26 -4.93 113.62 112.01 3h6i n SER 49 Ca -0.00 0.00 -0.44 0.00 -0.26 0.00 0.00 58.87 58.16 3h6i n SER 49 Cb 0.49 0.67 -0.03 0.00 -0.26 0.00 0.00 64.21 65.08 3h6i n SER 49 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h6i s LEU 50 N -3.55 5.30 0.24 1.04 1.43 -1.26 -5.04 118.68 116.84 3h6i s LEU 50 Ca 0.00 -2.09 -0.30 0.00 -1.03 0.00 0.00 54.13 50.72 3h6i s LEU 50 Cb 0.00 -2.37 -0.09 0.00 0.03 0.00 0.00 46.19 43.76 3h6i s LEU 50 CO 0.00 -1.00 1.01 -1.10 0.23 0.00 0.00 176.35 175.48 3h6i s GLN 51 N 2.35 4.75 -0.01 1.70 -0.21 -1.26 -4.86 119.66 122.13 3h6i s GLN 51 Ca 0.29 1.61 0.13 0.00 0.02 0.00 0.00 55.36 57.41 3h6i s GLN 51 Cb -0.07 -3.26 -0.16 0.00 1.00 0.00 0.00 33.01 30.52 3h6i s GLN 51 CO -0.08 0.36 0.45 1.63 -2.12 0.00 0.00 175.29 175.53 3h6i n LYS 52 N 1.58 1.97 -5.16 2.91 5.02 -1.26 -4.97 118.16 118.26 3h6i n LYS 52 Ca -0.01 -0.04 -0.30 0.00 -2.02 0.00 0.00 58.31 55.94 3h6i n LYS 52 Cb 0.46 -1.17 -0.16 0.00 -0.02 0.00 0.00 35.03 34.14 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 -2.44 1.89 0.10 -0.18 1.01 -1.26 -1.18 121.20 119.13 3h6i s ILE 53 Ca 0.01 -0.99 -0.20 0.00 0.00 0.00 0.00 60.65 59.48 3h6i s ILE 53 Cb 0.09 -1.59 0.05 0.00 0.01 0.00 0.00 42.46 41.01 3h6i s ILE 53 CO 0.53 0.53 0.48 -0.55 0.00 0.00 0.00 174.94 175.93 3h6i s SER 54 N -0.22 -0.37 0.33 3.58 0.15 0.64 -4.98 113.70 112.83 3h6i s SER 54 Ca -0.01 -0.06 -0.27 0.00 0.70 0.00 0.00 55.95 56.31 3h6i s SER 54 Cb -0.12 0.50 -0.09 0.00 -1.71 0.00 0.00 66.02 64.59 3h6i s SER 54 CO 0.02 -0.81 1.06 -0.70 1.20 0.00 0.00 173.24 174.01 3h6i s GLU 55 N -3.21 4.44 -0.06 5.44 2.12 -1.26 0.02 118.70 126.20 3h6i s GLU 55 Ca -0.01 1.63 -0.06 0.00 0.36 0.00 0.00 54.97 56.89 3h6i s GLU 55 Cb 0.00 -2.89 -0.03 0.00 0.26 0.00 0.00 34.13 31.47 3h6i s GLU 55 CO -0.08 0.08 -0.13 1.28 -0.54 0.00 0.00 175.26 175.87 3h6i n LEU 56 N 0.62 1.00 0.00 2.70 4.77 -0.53 -4.78 117.00 120.79 3h6i n LEU 56 Ca 0.02 0.16 -0.12 0.00 -0.03 0.00 0.00 56.01 56.04 3h6i n LEU 56 Cb 0.47 -0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 3h6i n LEU 56 CO 0.49 -0.12 0.17 0.00 -1.33 0.00 0.00 177.39 176.61 3h6i n TYR 57 N -3.62 -1.37 -0.22 -1.77 9.36 -1.02 -4.74 117.16 113.79 3h6i n TYR 57 Ca -0.14 -1.94 0.02 0.00 3.32 0.00 0.00 57.90 59.16 3h6i n TYR 57 Cb 0.46 0.49 0.13 0.00 -0.63 0.00 0.00 39.34 39.79 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 1.66 0.16 -0.16 2.98 5.19 -1.94 -2.36 116.42 121.95 3h6i h ASP 58 Ca -0.23 0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.28 3h6i h ASP 58 Cb 1.00 0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.62 3h6i h ASP 58 CO 0.32 0.08 0.00 0.54 -3.12 0.00 0.00 179.24 177.06 3h6i n ARG 59 N -5.05 2.25 -4.91 3.56 5.12 -1.26 -1.04 116.66 115.33 3h6i n ARG 59 Ca 0.10 -1.62 -0.33 0.00 -1.93 0.00 0.00 57.85 54.08 3h6i n ARG 59 Cb 0.33 -1.15 -0.14 0.00 -1.16 0.00 0.00 32.46 30.34 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 -0.90 2.90 0.32 1.55 1.01 -0.89 -2.00 120.40 122.39 3h6i s VAL 60 Ca 0.13 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.44 3h6i s VAL 60 Cb 0.07 -2.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.23 3h6i s VAL 60 CO 0.09 0.56 -0.11 -0.83 0.00 0.00 0.00 175.10 174.82 3h6i s GLY 61 N -0.24 2.06 0.05 4.51 0.00 0.02 -1.45 107.32 112.26 3h6i s GLY 61 Ca 0.01 -2.01 0.04 0.00 0.00 0.00 0.00 44.72 42.76 3h6i s GLY 61 CO 0.03 -1.98 -0.13 -0.12 0.00 0.00 0.00 173.10 170.90 3h6i s PHE 62 N -2.68 1.12 -0.21 1.90 2.19 0.10 -1.46 117.98 118.94 3h6i s PHE 62 Ca 0.31 -0.39 -0.19 0.00 0.33 0.00 0.00 56.93 56.99 3h6i s PHE 62 Cb 0.01 -0.65 0.05 0.00 -1.31 0.00 0.00 43.02 41.12 3h6i s PHE 62 CO 0.15 0.03 0.56 0.00 1.83 0.00 0.00 175.22 177.78 3h6i s ALA 63 N -1.02 -1.38 0.13 11.12 0.00 -0.40 -0.26 121.76 129.96 3h6i s ALA 63 Ca -0.01 1.58 -0.09 0.00 0.00 0.00 0.00 51.96 53.44 3h6i s ALA 63 Cb -0.09 -0.92 -0.00 0.00 0.00 0.00 0.00 23.12 22.11 3h6i s ALA 63 CO 0.01 -0.26 0.24 0.00 0.00 0.00 0.00 175.76 175.75 3h6i s ALA 64 N 0.30 -0.12 0.02 0.00 0.00 -0.33 -0.00 121.76 121.63 3h6i s ALA 64 Ca -0.00 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.23 3h6i s ALA 64 Cb -0.04 0.68 -0.01 0.00 0.00 0.00 0.00 23.12 23.75 3h6i s ALA 64 CO 0.01 -0.58 -0.04 0.00 0.00 0.00 0.00 175.76 175.14 3h6i s ALA 65 N -3.91 0.32 0.00 0.00 0.00 -0.58 -4.85 121.76 112.74 3h6i s ALA 65 Ca 0.11 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.65 3h6i s ALA 65 Cb 0.04 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.18 3h6i s ALA 65 CO -0.05 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.10 3h6i n GLY 66 N 2.23 0.43 3.63 0.00 0.00 -1.26 -1.41 105.19 108.81 3h6i n GLY 66 Ca -0.18 -1.76 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.00 3.96 0.16 1.61 2.20 -0.55 -4.90 119.74 121.22 3h6i s LYS 67 Ca 0.00 1.08 -0.26 0.00 -0.36 0.00 0.00 55.97 56.43 3h6i s LYS 67 Cb 0.00 -3.82 0.02 0.00 -1.51 0.00 0.00 37.83 32.52 3h6i s LYS 67 CO 0.00 -1.06 1.57 0.35 -0.36 0.00 0.00 175.35 175.85 3h6i h PHE 68 N 8.76 -1.25 -0.77 4.03 3.57 -1.96 -1.77 116.94 127.56 3h6i h PHE 68 Ca -0.23 0.07 0.20 0.00 3.53 0.00 0.00 57.97 61.54 3h6i h PHE 68 Cb 1.08 0.62 -0.04 0.00 2.79 0.00 0.00 35.95 40.39 3h6i h PHE 68 CO 0.87 -0.43 0.53 -2.95 -2.23 0.00 0.00 178.31 174.11 3h6i h ASN 69 N -0.28 0.18 0.04 0.41 -0.00 -1.99 0.46 115.58 114.41 3h6i h ASN 69 Ca 0.16 0.02 -0.07 0.00 -0.00 0.00 0.00 56.30 56.40 3h6i h ASN 69 Cb 0.57 -0.02 0.01 0.00 -0.00 0.00 0.00 38.32 38.88 3h6i h ASN 69 CO -0.63 0.08 -0.31 -0.33 -0.00 0.00 0.00 177.43 176.25 3h6i h GLU 70 N 0.19 0.13 0.00 4.14 5.08 -1.76 -2.98 114.58 119.38 3h6i h GLU 70 Ca 0.38 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.47 3h6i h GLU 70 Cb 1.22 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 3h6i h GLU 70 CO -0.07 1.06 -0.33 0.27 -1.00 0.00 0.00 179.01 178.93 3h6i h PHE 71 N -0.70 0.00 -0.23 4.33 -5.15 -0.92 -2.75 116.94 111.52 3h6i h PHE 71 Ca -0.05 0.00 -0.15 0.00 -0.20 0.00 0.00 57.97 57.56 3h6i h PHE 71 Cb 1.20 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.37 3h6i h PHE 71 CO 0.23 0.33 -0.49 0.22 -2.00 0.00 0.00 178.31 176.60 3h6i h ASP 72 N 0.00 0.67 -0.65 -0.68 3.58 -1.04 -0.72 116.42 117.58 3h6i h ASP 72 Ca -0.00 -0.34 -0.03 0.00 0.42 0.00 0.00 57.03 57.08 3h6i h ASP 72 Cb 1.06 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.88 3h6i h ASP 72 CO 0.04 1.05 0.31 -1.13 -2.88 0.00 0.00 179.24 176.64 3h6i h ASN 73 N 0.49 0.88 0.47 2.28 -1.24 -1.34 -0.97 115.58 116.15 3h6i h ASN 73 Ca 0.02 -0.10 -0.18 0.00 0.71 0.00 0.00 56.30 56.75 3h6i h ASN 73 Cb 1.04 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 39.85 3h6i h ASN 73 CO 0.10 0.76 -0.77 -0.07 -1.29 0.00 0.00 177.43 176.16 3h6i h LEU 74 N 0.97 0.29 -0.44 0.34 3.38 -1.30 -1.56 115.31 116.98 3h6i h LEU 74 Ca 0.23 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3h6i h LEU 74 Cb 0.12 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3h6i h LEU 74 CO -0.03 0.95 0.15 -0.09 0.09 0.00 0.00 178.44 179.51 3h6i h ARG 75 N 0.15 0.68 -0.40 1.13 2.43 -0.47 0.41 114.38 118.30 3h6i h ARG 75 Ca -0.03 -0.14 -0.07 0.00 -0.81 0.00 0.00 59.98 58.93 3h6i h ARG 75 Cb 1.35 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 3h6i h ARG 75 CO 0.12 0.65 -0.02 0.00 -1.51 0.00 0.00 179.97 179.21 3h6i h ARG 76 N 0.58 0.73 -0.21 0.20 3.08 -1.11 -1.89 114.38 115.75 3h6i h ARG 76 Ca 0.14 -0.24 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 3h6i h ARG 76 Cb 0.25 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3h6i h ARG 76 CO -0.01 0.82 -0.12 0.78 -1.07 0.00 0.00 179.97 180.38 3h6i h GLY 77 N 0.55 0.36 1.23 0.04 0.00 -1.00 -1.08 103.07 103.17 3h6i h GLY 77 Ca 0.11 -0.23 -0.19 0.00 0.00 0.00 0.00 47.33 47.02 3h6i h GLY 77 CO 0.02 0.21 -0.61 -1.33 0.00 0.00 0.00 176.54 174.84 3h6i h GLY 78 N 0.82 0.87 1.06 4.60 0.00 -0.63 -1.41 103.07 108.37 3h6i h GLY 78 Ca 0.06 -1.07 -0.09 0.00 0.00 0.00 0.00 47.33 46.24 3h6i h GLY 78 CO 0.02 0.96 0.05 -2.22 0.00 0.00 0.00 176.54 175.35 3h6i h ILE 79 N 0.59 1.26 -0.32 2.60 2.04 -0.77 0.59 117.51 123.51 3h6i h ILE 79 Ca -0.00 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 64.76 3h6i h ILE 79 Cb 1.21 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 3h6i h ILE 79 CO 0.13 0.40 0.14 -0.61 0.00 0.00 0.00 178.15 178.21 3h6i h GLN 80 N 0.95 0.46 -0.01 2.37 5.75 -1.16 -1.17 115.11 122.30 3h6i h GLN 80 Ca 0.18 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.61 3h6i h GLN 80 Cb 0.50 -0.08 -0.00 0.00 1.07 0.00 0.00 27.48 28.97 3h6i h GLN 80 CO 0.02 0.45 0.01 0.35 -2.65 0.00 0.00 178.83 177.00 3h6i h PHE 81 N 0.37 0.02 -0.75 3.99 3.57 -1.02 -1.69 116.94 121.44 3h6i h PHE 81 Ca 0.11 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 3h6i h PHE 81 Cb 0.14 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 3h6i h PHE 81 CO -0.01 0.15 0.42 0.00 -2.23 0.00 0.00 178.31 176.63 3h6i h ALA 82 N 0.87 0.96 -0.29 2.41 0.00 -0.75 -0.89 119.26 121.56 3h6i h ALA 82 Ca 0.00 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 3h6i h ALA 82 Cb 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3h6i h ALA 82 CO -0.00 0.46 -0.37 -0.44 0.00 0.00 0.00 179.25 178.90 3h6i h ASP 83 N 1.03 0.71 -0.32 0.00 3.32 -1.14 -0.32 116.42 119.70 3h6i h ASP 83 Ca 0.26 -0.31 -0.11 0.00 0.02 0.00 0.00 57.03 56.90 3h6i h ASP 83 Cb 0.02 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3h6i h ASP 83 CO -0.04 1.01 -0.24 0.74 -1.72 0.00 0.00 179.24 178.98 3h6i h THR 84 N 0.56 1.29 -0.19 0.35 2.02 -1.09 -2.10 112.91 113.74 3h6i h THR 84 Ca 0.05 -1.39 -0.03 0.00 0.77 0.00 0.00 66.41 65.82 3h6i h THR 84 Cb 0.89 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.77 3h6i h THR 84 CO 0.08 0.45 0.01 0.03 0.37 0.00 0.00 175.52 176.46 3h6i h ARG 85 N 0.49 0.32 -0.89 6.66 2.47 -0.96 -0.51 114.38 121.97 3h6i h ARG 85 Ca 0.06 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 3h6i h ARG 85 Cb 0.80 -0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 29.04 3h6i h ARG 85 CO 0.06 0.51 0.56 0.78 0.56 0.00 0.00 179.97 182.44 3h6i h GLY 86 N 0.09 1.28 0.94 0.04 0.00 -1.05 -0.28 103.07 104.08 3h6i h GLY 86 Ca 0.05 -0.51 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 3h6i h GLY 86 CO 0.01 0.50 -0.11 -1.82 0.00 0.00 0.00 176.54 175.11 3h6i h TYR 87 N 1.22 0.76 -0.46 5.60 3.20 -1.20 -3.12 116.97 122.97 3h6i h TYR 87 Ca 0.32 -0.17 -0.12 0.00 3.14 0.00 0.00 58.73 61.90 3h6i h TYR 87 Cb -0.09 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 3h6i h TYR 87 CO 0.00 0.86 -0.19 0.00 -1.64 0.00 0.00 178.16 177.18 3h6i h ALA 88 N 0.80 0.78 -3.00 1.82 0.00 -0.76 -3.44 119.26 115.45 3h6i h ALA 88 Ca 0.08 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3h6i h ALA 88 Cb 0.63 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3h6i h ALA 88 CO 0.04 0.66 0.00 0.66 0.00 0.00 0.00 179.25 180.61 3h6i n TYR 89 N -4.12 0.00 -3.92 0.00 4.01 -0.14 -5.09 117.16 107.90 3h6i n TYR 89 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.65 3h6i n TYR 89 Cb 0.44 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.41 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 0.40 -0.03 0.46 7.72 1.47 -1.18 -4.98 116.67 120.53 3h6i s ASP 90 Ca 0.00 -0.80 0.14 0.00 1.18 0.00 0.00 52.55 53.06 3h6i s ASP 90 Cb 0.00 0.48 1.06 0.00 -0.34 0.00 0.00 42.92 44.12 3h6i s ASP 90 CO 0.00 -0.95 2.05 0.03 0.68 0.00 0.00 175.17 176.97 3h6i h ARG 91 N 2.44 0.08 0.00 2.11 3.08 -1.90 -2.44 114.38 117.75 3h6i h ARG 91 Ca -0.30 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.73 3h6i h ARG 91 Cb 1.24 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.27 3h6i h ARG 91 CO 0.45 0.15 0.00 -2.13 -1.07 0.00 0.00 179.97 177.37 3h6i n ARG 92 N -4.41 0.20 0.20 0.04 0.63 -1.26 -2.58 116.66 109.48 3h6i n ARG 92 Ca -0.02 0.41 0.06 0.00 -0.92 0.00 0.00 57.85 57.38 3h6i n ARG 92 Cb 0.17 -1.87 0.44 0.00 0.45 0.00 0.00 32.46 31.65 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 0.00 -3.17 6.15 3.58 -1.80 -3.40 116.42 117.77 3h6i h ASP 93 Ca 0.00 0.00 -0.58 0.00 0.42 0.00 0.00 57.03 56.87 3h6i h ASP 93 Cb 0.38 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.37 3h6i h ASP 93 CO 0.00 0.31 0.77 -0.69 -2.88 0.00 0.00 179.24 176.76 3h6i s VAL 94 N -4.06 4.65 0.19 2.25 1.01 -1.06 -4.93 120.40 118.45 3h6i s VAL 94 Ca -0.02 1.89 0.02 0.00 0.00 0.00 0.00 61.98 63.87 3h6i s VAL 94 Cb 0.13 -4.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 3h6i s VAL 94 CO 0.68 -0.25 0.01 0.42 0.00 0.00 0.00 175.10 175.96 3h6i s THR 95 N 3.28 0.72 0.20 3.92 -4.23 -1.26 -4.95 115.64 113.31 3h6i s THR 95 Ca 0.43 -1.99 -0.09 0.00 -1.18 0.00 0.00 61.69 58.86 3h6i s THR 95 Cb -0.14 -2.19 0.12 0.00 1.34 0.00 0.00 72.50 71.63 3h6i s THR 95 CO 0.09 -0.42 1.73 1.23 -0.54 0.00 0.00 174.62 176.71 3h6i h GLY 96 N 2.64 1.18 1.00 3.99 0.00 -1.93 -1.95 103.07 108.00 3h6i h GLY 96 Ca -0.37 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.27 3h6i h GLY 96 CO 0.63 0.65 0.43 -0.09 0.00 0.00 0.00 176.54 178.16 3h6i h ARG 97 N 1.04 0.90 0.03 4.80 2.43 -1.97 0.16 114.38 121.77 3h6i h ARG 97 Ca 0.23 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3h6i h ARG 97 Cb 0.30 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 3h6i h ARG 97 CO -0.01 0.62 -0.01 0.37 -1.51 0.00 0.00 179.97 179.43 3h6i h GLN 98 N 0.92 -0.04 -0.54 0.20 4.15 -1.87 -1.49 115.11 116.44 3h6i h GLN 98 Ca 0.25 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.62 3h6i h GLN 98 Cb -0.07 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.60 3h6i h GLN 98 CO -0.05 0.11 0.14 -0.07 -1.93 0.00 0.00 178.83 177.03 3h6i h LEU 99 N -0.18 0.76 -0.67 -2.39 3.38 -1.02 -0.84 115.31 114.35 3h6i h LEU 99 Ca -0.00 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 3h6i h LEU 99 Cb 0.17 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 3h6i h LEU 99 CO 0.01 0.73 0.04 0.00 0.09 0.00 0.00 178.44 179.31 3h6i h ALA 100 N 1.37 0.88 -0.41 1.53 0.00 -0.62 -0.85 119.26 121.16 3h6i h ALA 100 Ca 0.18 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3h6i h ALA 100 Cb 0.27 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3h6i h ALA 100 CO -0.00 0.67 0.17 -0.97 0.00 0.00 0.00 179.25 179.11 3h6i h ASN 101 N 1.00 0.57 -0.59 0.00 -0.73 -0.63 -0.27 115.58 114.92 3h6i h ASN 101 Ca 0.19 -0.16 -0.08 0.00 1.87 0.00 0.00 56.30 58.11 3h6i h ASN 101 Cb 0.51 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 38.93 3h6i h ASN 101 CO 0.02 0.57 0.05 0.58 -0.37 0.00 0.00 177.43 178.29 3h6i h VAL 102 N 0.52 1.26 -0.63 2.57 2.07 -0.90 -1.76 116.25 119.38 3h6i h VAL 102 Ca 0.14 -1.07 -0.08 0.00 0.82 0.00 0.00 66.70 66.51 3h6i h VAL 102 Cb 0.18 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 3h6i h VAL 102 CO -0.01 0.39 0.08 1.88 0.02 0.00 0.00 177.57 179.93 3h6i h TYR 103 N 0.96 1.13 -0.81 1.57 0.05 -0.70 -0.97 116.97 118.21 3h6i h TYR 103 Ca 0.18 -0.17 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 3h6i h TYR 103 Cb 0.48 -0.31 -0.04 0.00 1.01 0.00 0.00 36.73 37.87 3h6i h TYR 103 CO 0.03 0.97 0.48 0.00 -1.05 0.00 0.00 178.16 178.60 3h6i h ALA 104 N 1.02 1.03 -0.34 3.88 0.00 -0.67 0.54 119.26 124.72 3h6i h ALA 104 Ca 0.19 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 3h6i h ALA 104 Cb 0.46 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3h6i h ALA 104 CO 0.02 0.50 -0.16 1.96 0.00 0.00 0.00 179.25 181.57 3h6i h GLN 105 N 1.11 0.71 -0.18 0.00 1.08 -1.10 -0.02 115.11 116.72 3h6i h GLN 105 Ca 0.29 -0.31 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 3h6i h GLN 105 Cb -0.03 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 3h6i h GLN 105 CO -0.05 0.91 -0.02 1.15 -0.95 0.00 0.00 178.83 179.86 3h6i h THR 106 N 0.49 1.27 -0.44 -0.54 2.02 -0.52 -1.32 112.91 113.88 3h6i h THR 106 Ca 0.08 -0.94 -0.10 0.00 0.77 0.00 0.00 66.41 66.21 3h6i h THR 106 Cb 0.69 1.54 -0.02 0.00 -1.74 0.00 0.00 68.15 68.63 3h6i h THR 106 CO 0.05 0.28 -0.15 -0.07 0.37 0.00 0.00 175.52 176.00 3h6i h LEU 107 N 0.05 0.82 -0.98 2.58 3.38 0.11 -1.54 115.31 119.73 3h6i h LEU 107 Ca 0.05 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.69 3h6i h LEU 107 Cb 0.44 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3h6i h LEU 107 CO 0.01 0.97 0.05 1.23 0.09 0.00 0.00 178.44 180.80 3h6i h GLY 108 N 0.97 0.85 1.51 0.83 0.00 -0.92 0.46 103.07 106.77 3h6i h GLY 108 Ca 0.12 -0.53 -0.18 0.00 0.00 0.00 0.00 47.33 46.73 3h6i h GLY 108 CO 0.05 0.50 -0.67 -0.84 0.00 0.00 0.00 176.54 175.57 3h6i h THR 109 N 0.75 1.35 -0.12 4.70 2.02 -0.98 -2.88 112.91 117.76 3h6i h THR 109 Ca 0.16 -2.00 -0.02 0.00 0.77 0.00 0.00 66.41 65.31 3h6i h THR 109 Cb 0.38 1.98 -0.00 0.00 -1.74 0.00 0.00 68.15 68.76 3h6i h THR 109 CO 0.01 0.61 -0.02 0.40 0.37 0.00 0.00 175.52 176.89 3h6i h ILE 110 N 0.35 1.28 -0.57 3.11 2.04 -0.58 0.54 117.51 123.68 3h6i h ILE 110 Ca -0.02 -0.91 0.15 0.00 1.00 0.00 0.00 64.86 65.08 3h6i h ILE 110 Cb 1.24 1.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.94 3h6i h ILE 110 CO 0.12 0.26 0.40 0.15 0.00 0.00 0.00 178.15 179.08 3h6i h PHE 111 N -0.08 0.12 0.00 1.37 3.57 -0.93 -1.28 116.94 119.71 3h6i h PHE 111 Ca 0.03 0.00 -0.43 0.00 3.53 0.00 0.00 57.97 61.11 3h6i h PHE 111 Cb 0.41 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.05 3h6i h PHE 111 CO 0.05 0.05 -2.42 2.41 -2.23 0.00 0.00 178.31 176.17 3h6i n THR 112 N -4.41 1.51 -0.07 4.41 -1.04 -1.09 -4.75 114.28 108.84 3h6i n THR 112 Ca 0.10 -0.34 -0.12 0.00 -2.04 0.00 0.00 64.05 61.65 3h6i n THR 112 Cb 0.57 -1.91 0.00 0.00 -1.82 0.00 0.00 70.33 67.17 3h6i n THR 112 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3h6i h GLU 113 N -0.99 0.81 -7.16 -2.82 3.07 -0.93 -3.48 114.58 103.08 3h6i h GLU 113 Ca -0.64 -0.46 -0.46 0.00 -0.50 0.00 0.00 59.36 57.29 3h6i h GLU 113 Cb 1.56 0.03 0.06 0.00 -0.84 0.00 0.00 28.75 29.57 3h6i h GLU 113 CO -0.39 1.09 0.17 -0.65 -1.40 0.00 0.00 179.01 177.84 3h6i s GLN 114 N -4.24 2.54 0.16 2.33 -0.21 -0.49 -5.01 119.66 114.75 3h6i s GLN 114 Ca -0.10 -0.22 -0.08 0.00 0.02 0.00 0.00 55.36 54.98 3h6i s GLN 114 Cb 0.11 -2.25 0.02 0.00 1.00 0.00 0.00 33.01 31.89 3h6i s GLN 114 CO 0.87 -0.95 1.50 0.00 -2.12 0.00 0.00 175.29 174.59 3h6i h ALA 115 N -0.34 0.63 -3.33 6.09 0.00 -1.93 -3.42 119.26 116.97 3h6i h ALA 115 Ca -0.45 -0.47 -0.53 0.00 0.00 0.00 0.00 54.91 53.47 3h6i h ALA 115 Cb 1.29 -0.11 -0.39 0.00 0.00 0.00 0.00 17.79 18.58 3h6i h ALA 115 CO 0.60 0.67 -0.77 0.21 0.00 0.00 0.00 179.25 179.95 3h6i s LYS 116 N -4.29 0.95 0.98 0.00 2.20 -1.26 -5.12 119.74 113.21 3h6i s LYS 116 Ca -0.10 -0.44 -0.14 0.00 -0.36 0.00 0.00 55.97 54.93 3h6i s LYS 116 Cb 0.11 -1.99 0.05 0.00 -1.51 0.00 0.00 37.83 34.48 3h6i s LYS 116 CO 0.87 -0.54 0.33 -0.35 -0.36 0.00 0.00 175.35 175.29 3h6i n PRO 117 N 4.98 -0.51 -2.76 4.03 -0.04 -1.26 -4.89 135.00 134.55 3h6i n PRO 117 Ca -0.10 -0.11 -0.41 0.00 -0.04 0.00 0.00 63.50 62.84 3h6i n PRO 117 Cb 0.47 -1.82 -0.04 0.00 -0.04 0.00 0.00 33.50 32.08 3h6i n PRO 117 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3h6i s TYR 118 N -2.37 3.69 -1.35 0.54 1.51 -1.26 -4.93 117.35 113.19 3h6i s TYR 118 Ca 0.56 1.67 -0.08 0.00 -1.01 0.00 0.00 57.07 58.22 3h6i s TYR 118 Cb -0.20 -3.06 0.11 0.00 -0.11 0.00 0.00 41.96 38.70 3h6i s TYR 118 CO 0.67 0.06 2.22 0.39 -1.11 0.00 0.00 175.55 177.79 3h6i n GLU 119 N 3.59 3.99 -4.18 -0.62 1.02 -1.26 -4.74 120.64 118.43 3h6i n GLU 119 Ca 0.04 -3.30 -0.11 0.00 -0.02 0.00 0.00 57.16 53.77 3h6i n GLU 119 Cb 0.51 -2.81 -0.10 0.00 -0.02 0.00 0.00 31.44 29.01 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 0.11 0.50 -0.08 2.62 -7.23 -1.26 -1.48 120.40 113.58 3h6i s VAL 120 Ca 0.49 -1.93 -0.04 0.00 -1.81 0.00 0.00 61.98 58.69 3h6i s VAL 120 Cb 0.14 -1.91 0.04 0.00 0.56 0.00 0.00 36.38 35.22 3h6i s VAL 120 CO -0.05 -0.65 0.18 -0.70 -0.31 0.00 0.00 175.10 173.57 3h6i s GLU 121 N -3.92 0.10 0.12 4.82 2.12 -0.50 -3.27 118.70 118.17 3h6i s GLU 121 Ca 0.19 0.48 0.10 0.00 0.36 0.00 0.00 54.97 56.10 3h6i s GLU 121 Cb 0.06 -0.18 -0.04 0.00 0.26 0.00 0.00 34.13 34.24 3h6i s GLU 121 CO -0.01 -0.21 -0.22 -0.51 -0.54 0.00 0.00 175.26 173.78 3h6i s LEU 122 N 1.58 2.55 -0.10 2.70 1.02 0.06 -1.53 118.68 124.96 3h6i s LEU 122 Ca -0.05 -0.63 0.00 0.00 0.02 0.00 0.00 54.13 53.47 3h6i s LEU 122 Cb -0.11 -1.42 0.02 0.00 0.02 0.00 0.00 46.19 44.70 3h6i s LEU 122 CO -0.07 0.18 -0.09 0.00 0.02 0.00 0.00 176.35 176.40 3h6i s VAL 124 N 1.40 3.33 0.19 0.00 1.01 -0.69 -1.27 120.40 124.38 3h6i s VAL 124 Ca -0.01 -0.53 0.11 0.00 0.00 0.00 0.00 61.98 61.55 3h6i s VAL 124 Cb -0.13 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 3h6i s VAL 124 CO -0.05 0.47 -0.22 0.00 0.00 0.00 0.00 175.10 175.30 3h6i s ALA 125 N 0.94 2.41 -0.04 5.51 0.00 -0.54 -0.70 121.76 129.34 3h6i s ALA 125 Ca -0.01 -1.62 -0.02 0.00 0.00 0.00 0.00 51.96 50.30 3h6i s ALA 125 Cb -0.15 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.71 3h6i s ALA 125 CO 0.00 0.36 0.09 -2.00 0.00 0.00 0.00 175.76 174.22 3h6i s GLU 126 N -2.79 0.07 0.42 0.00 2.12 -0.48 -0.80 118.70 117.23 3h6i s GLU 126 Ca 0.20 0.22 0.07 0.00 0.36 0.00 0.00 54.97 55.82 3h6i s GLU 126 Cb -0.07 -0.09 -0.05 0.00 0.26 0.00 0.00 34.13 34.18 3h6i s GLU 126 CO 0.09 -0.10 0.21 0.14 -0.54 0.00 0.00 175.26 175.07 3h6i s VAL 127 N 0.64 2.33 0.73 3.70 -7.23 -0.85 -1.04 120.40 118.68 3h6i s VAL 127 Ca -0.05 -1.64 -0.13 0.00 -1.81 0.00 0.00 61.98 58.35 3h6i s VAL 127 Cb -0.07 -2.97 0.04 0.00 0.56 0.00 0.00 36.38 33.94 3h6i s VAL 127 CO -0.03 0.00 1.11 0.00 -0.31 0.00 0.00 175.10 175.88 3h6i s ALA 128 N -2.59 2.29 0.76 1.32 0.00 -1.26 -4.86 121.76 117.42 3h6i s ALA 128 Ca 0.42 0.46 -0.11 0.00 0.00 0.00 0.00 51.96 52.72 3h6i s ALA 128 Cb 0.03 -3.32 0.05 0.00 0.00 0.00 0.00 23.12 19.87 3h6i s ALA 128 CO 0.23 -1.63 1.08 -1.01 0.00 0.00 0.00 175.76 174.43 3h6i s HIS 129 N -2.57 2.76 0.23 0.00 3.76 -1.26 -4.81 115.29 113.39 3h6i s HIS 129 Ca 0.65 1.47 -0.32 0.00 -0.15 0.00 0.00 55.06 56.71 3h6i s HIS 129 Cb -0.20 -3.00 -0.13 0.00 1.11 0.00 0.00 32.58 30.36 3h6i s HIS 129 CO 0.49 -1.65 1.55 0.98 -0.85 0.00 0.00 174.74 175.26 3h6i n TYR 130 N -3.41 2.46 -1.00 1.40 9.36 -1.26 -2.24 117.16 122.47 3h6i n TYR 130 Ca 0.08 0.29 -0.00 0.00 3.32 0.00 0.00 57.90 61.59 3h6i n TYR 130 Cb 0.53 -2.55 -0.00 0.00 -0.63 0.00 0.00 39.34 36.70 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 2.72 0.39 3.62 2.98 0.00 -1.26 -5.02 105.19 108.62 3h6i n GLY 131 Ca 0.13 -0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.48 2.24 -0.30 1.61 2.02 -0.95 -5.11 118.70 117.74 3h6i s GLU 132 Ca 0.00 -1.27 0.03 0.00 0.02 0.00 0.00 54.97 53.75 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 0.42 -0.03 0.95 0.02 0.00 0.00 175.26 176.62 3h6i s THR 133 N -1.91 2.30 -0.08 3.63 -4.23 -1.26 -4.77 115.64 109.32 3h6i s THR 133 Ca 0.28 -1.92 -0.06 0.00 -1.18 0.00 0.00 61.69 58.80 3h6i s THR 133 Cb -0.08 -2.50 0.03 0.00 1.34 0.00 0.00 72.50 71.29 3h6i s THR 133 CO 0.18 -0.28 0.21 -0.75 -0.54 0.00 0.00 174.62 173.43 3h6i s LYS 134 N 1.03 0.21 0.26 3.99 2.20 -1.26 -5.11 119.74 121.06 3h6i s LYS 134 Ca -0.00 0.36 -0.29 0.00 -0.36 0.00 0.00 55.97 55.67 3h6i s LYS 134 Cb -0.20 0.01 -0.09 0.00 -1.51 0.00 0.00 37.83 36.04 3h6i s LYS 134 CO -0.06 -0.08 1.22 1.03 -0.36 0.00 0.00 175.35 177.10 3h6i s ARG 135 N 0.56 4.48 0.44 4.03 0.52 -1.26 -4.40 118.95 123.31 3h6i s ARG 135 Ca -0.04 1.99 -0.25 0.00 -0.52 0.00 0.00 55.73 56.92 3h6i s ARG 135 Cb -0.05 -3.17 -0.09 0.00 0.52 0.00 0.00 34.95 32.16 3h6i s ARG 135 CO -0.03 -0.06 1.21 -2.30 0.02 0.00 0.00 175.30 174.14 3h6i n PRO 136 N 1.65 1.76 -4.76 3.54 -0.02 -1.26 -4.85 135.00 131.06 3h6i n PRO 136 Ca 0.02 0.63 -0.33 0.00 -2.02 0.00 0.00 63.50 61.79 3h6i n PRO 136 Cb 0.43 -2.32 -0.13 0.00 -0.02 0.00 0.00 33.50 31.47 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 -2.23 2.93 -0.07 -0.52 2.02 -0.20 -4.98 118.70 115.64 3h6i s GLU 137 Ca 0.63 -0.64 0.02 0.00 0.02 0.00 0.00 54.97 54.99 3h6i s GLU 137 Cb -0.51 -2.55 0.02 0.00 0.10 0.00 0.00 34.13 31.19 3h6i s GLU 137 CO 0.57 0.48 -0.10 -0.51 0.02 0.00 0.00 175.26 175.71 3h6i s LEU 138 N -0.33 1.53 -0.01 1.80 1.02 -1.23 -1.38 118.68 120.09 3h6i s LEU 138 Ca 0.04 -0.27 0.07 0.00 0.02 0.00 0.00 54.13 53.99 3h6i s LEU 138 Cb -0.13 -0.76 -0.02 0.00 0.02 0.00 0.00 46.19 45.31 3h6i s LEU 138 CO 0.02 -0.00 -0.23 -0.31 0.02 0.00 0.00 176.35 175.85 3h6i s TYR 139 N 0.83 2.06 -0.19 0.29 1.51 0.12 -1.87 117.35 120.11 3h6i s TYR 139 Ca -0.12 -0.39 -0.02 0.00 -1.01 0.00 0.00 57.07 55.53 3h6i s TYR 139 Cb -0.15 -1.31 -0.00 0.00 -0.11 0.00 0.00 41.96 40.38 3h6i s TYR 139 CO 0.02 -0.01 -0.09 0.50 -1.11 0.00 0.00 175.55 174.85 3h6i s ARG 140 N -0.64 3.31 -0.14 -0.62 3.52 -0.50 -1.70 118.95 122.18 3h6i s ARG 140 Ca 0.09 -0.68 0.01 0.00 -0.13 0.00 0.00 55.73 55.02 3h6i s ARG 140 Cb -0.09 -2.84 -0.00 0.00 -1.56 0.00 0.00 34.95 30.46 3h6i s ARG 140 CO -0.00 -0.10 -0.16 0.42 -0.81 0.00 0.00 175.30 174.65 3h6i s ILE 141 N 1.17 2.70 0.37 4.11 1.09 0.63 -1.09 121.20 130.17 3h6i s ILE 141 Ca 0.02 -0.77 0.07 0.00 -1.10 0.00 0.00 60.65 58.87 3h6i s ILE 141 Cb -0.14 -2.13 -0.01 0.00 -1.06 0.00 0.00 42.46 39.12 3h6i s ILE 141 CO -0.03 0.52 0.42 0.42 -0.10 0.00 0.00 174.94 176.17 3h6i s THR 142 N 0.66 3.42 0.60 2.92 -4.23 -0.39 -0.76 115.64 117.86 3h6i s THR 142 Ca -0.08 -1.18 0.29 0.00 -1.18 0.00 0.00 61.69 59.54 3h6i s THR 142 Cb -0.16 -3.18 0.40 0.00 1.34 0.00 0.00 72.50 70.90 3h6i s THR 142 CO 0.02 -0.10 1.66 0.10 -0.54 0.00 0.00 174.62 175.76 3h6i h TYR 143 N 0.97 0.00 -0.02 3.99 -0.00 -1.84 0.14 116.97 120.22 3h6i h TYR 143 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.30 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 0.47 0.00 -0.32 -0.40 -0.00 0.00 0.00 178.16 177.91 3h6i n ASP 144 N -3.53 2.19 0.00 0.10 5.75 -1.26 -4.53 116.55 115.26 3h6i n ASP 144 Ca 0.15 -1.59 0.00 0.00 -0.01 0.00 0.00 54.79 53.34 3h6i n ASP 144 Cb 1.05 0.31 0.00 0.00 -1.03 0.00 0.00 41.12 41.45 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 1.39 0.95 3.75 6.12 0.00 0.04 -4.13 105.19 113.31 3h6i n GLY 145 Ca 0.11 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 3h6i n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6i s SER 146 N -2.01 7.46 -0.09 1.61 0.01 -1.25 -4.76 113.70 114.67 3h6i s SER 146 Ca 0.00 1.74 0.04 0.00 1.31 0.00 0.00 55.95 59.03 3h6i s SER 146 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 3h6i s SER 146 CO 0.00 0.09 -0.22 -0.51 0.41 0.00 0.00 173.24 173.01 3h6i s ILE 147 N -0.65 1.89 -0.07 1.44 2.07 -1.26 -1.26 121.20 123.35 3h6i s ILE 147 Ca 0.41 -0.92 0.03 0.00 -1.41 0.00 0.00 60.65 58.76 3h6i s ILE 147 Cb -0.24 -1.64 0.01 0.00 0.13 0.00 0.00 42.46 40.72 3h6i s ILE 147 CO 0.28 0.52 -0.16 0.00 -1.91 0.00 0.00 174.94 173.67 3h6i s ALA 148 N 0.39 1.56 -0.52 1.50 0.00 -0.25 -4.98 121.76 119.46 3h6i s ALA 148 Ca -0.18 -0.62 -0.21 0.00 0.00 0.00 0.00 51.96 50.96 3h6i s ALA 148 Cb -0.18 -0.63 0.05 0.00 0.00 0.00 0.00 23.12 22.37 3h6i s ALA 148 CO 0.08 0.19 0.71 0.34 0.00 0.00 0.00 175.76 177.08 3h6i s ASP 149 N 0.47 6.26 -0.19 0.00 -1.08 -1.26 -1.41 116.67 119.45 3h6i s ASP 149 Ca -0.14 -0.74 -0.10 0.00 -0.52 0.00 0.00 52.55 51.05 3h6i s ASP 149 Cb -0.16 -2.33 -0.05 0.00 -1.46 0.00 0.00 42.92 38.92 3h6i s ASP 149 CO 0.05 -0.98 0.14 -1.61 0.52 0.00 0.00 175.17 173.29 3h6i s GLU 150 N 2.99 4.09 0.28 4.34 0.41 -0.78 -5.03 118.70 125.01 3h6i s GLU 150 Ca 0.19 -0.19 0.22 0.00 -0.41 0.00 0.00 54.97 54.79 3h6i s GLU 150 Cb -0.17 -3.39 0.11 0.00 -1.78 0.00 0.00 34.13 28.89 3h6i s GLU 150 CO 0.14 0.36 1.22 -1.00 -0.49 0.00 0.00 175.26 175.50 3h6i h PRO 151 N 6.44 0.00 0.00 0.39 0.13 -1.94 -3.26 132.00 133.75 3h6i h PRO 151 Ca -0.43 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.64 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 0.02 -1.08 0.72 -0.23 0.00 0.00 178.00 178.16 3h6i n HIS 152 N -2.83 0.00 -3.81 1.56 8.25 -1.26 -4.88 115.22 112.25 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 0.55 -0.14 -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 -1.87 117.98 117.11 3h6i s PHE 153 Ca -0.05 -0.43 0.01 0.00 -0.05 0.00 0.00 56.93 56.41 3h6i s PHE 153 Cb 0.02 0.17 0.01 0.00 -0.63 0.00 0.00 43.02 42.59 3h6i s PHE 153 CO 0.07 -0.78 -0.04 0.08 -0.05 0.00 0.00 175.22 174.50 3h6i s VAL 154 N -3.89 0.41 -0.09 -2.49 1.01 0.58 -4.87 120.40 111.05 3h6i s VAL 154 Ca 0.10 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.95 3h6i s VAL 154 Cb 0.02 -0.39 0.01 0.00 0.00 0.00 0.00 36.38 36.01 3h6i s VAL 154 CO -0.04 0.15 -0.15 -0.69 0.00 0.00 0.00 175.10 174.36 3h6i s VAL 155 N 0.30 1.42 0.03 2.92 1.01 -1.26 -1.16 120.40 123.66 3h6i s VAL 155 Ca -0.03 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.35 3h6i s VAL 155 Cb -0.07 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 3h6i s VAL 155 CO -0.00 0.42 -0.08 -0.04 0.00 0.00 0.00 175.10 175.40 3h6i s MET 156 N 0.75 0.55 0.08 2.72 -1.94 0.67 -5.00 119.30 117.12 3h6i s MET 156 Ca -0.12 -0.65 0.00 0.00 -1.71 0.00 0.00 55.69 53.21 3h6i s MET 156 Cb -0.16 -0.39 0.00 0.00 2.01 0.00 0.00 34.83 36.30 3h6i s MET 156 CO 0.02 0.08 0.00 0.41 -0.01 0.00 0.00 175.02 175.53 3h6i n GLY 157 N 1.78 -2.85 7.00 -0.03 0.00 -1.26 -0.07 105.19 109.75 3h6i n GLY 157 Ca -0.20 -1.31 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 -1.91 1.75 3.31 -0.02 0.00 -0.68 -4.17 105.19 103.48 3h6i n GLY 158 Ca -0.00 -0.62 -0.46 0.00 0.00 0.00 0.00 46.02 44.93 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 5.22 0.11 2.61 -4.23 -1.26 -4.36 115.64 113.73 3h6i s THR 159 Ca 0.00 -1.52 -0.13 0.00 -1.18 0.00 0.00 61.69 58.86 3h6i s THR 159 Cb 0.00 -4.34 -0.12 0.00 1.34 0.00 0.00 72.50 69.38 3h6i s THR 159 CO 0.00 -0.87 1.36 0.71 -0.54 0.00 0.00 174.62 175.28 3h6i h THR 160 N 5.87 1.28 -0.53 3.99 1.35 -1.96 -3.39 112.91 119.52 3h6i h THR 160 Ca -0.29 -1.79 0.11 0.00 -0.55 0.00 0.00 66.41 63.89 3h6i h THR 160 Cb 1.10 1.77 -0.10 0.00 -1.73 0.00 0.00 68.15 69.19 3h6i h THR 160 CO 1.03 0.58 -0.13 -0.33 -0.25 0.00 0.00 175.52 176.42 3h6i h GLU 161 N 0.58 0.00 0.00 4.72 3.07 -1.96 0.59 114.58 121.58 3h6i h GLU 161 Ca -0.01 -0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.78 3h6i h GLU 161 Cb 1.21 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.11 3h6i h GLU 161 CO 0.13 0.00 -0.32 -1.00 -1.40 0.00 0.00 179.01 176.42 3h6i h PRO 162 N 0.00 0.00 0.03 2.33 0.13 -1.97 -1.36 132.00 131.16 3h6i h PRO 162 Ca 0.26 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 65.12 3h6i h PRO 162 Cb 0.39 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.54 3h6i h PRO 162 CO -0.55 0.32 -1.09 0.82 -0.23 0.00 0.00 178.00 177.28 3h6i h ILE 163 N 0.00 1.30 -0.45 -3.56 2.04 -1.60 -2.43 117.51 112.81 3h6i h ILE 163 Ca -0.00 -2.35 -0.13 0.00 1.00 0.00 0.00 64.86 63.38 3h6i h ILE 163 Cb 0.63 2.48 -0.01 0.00 -0.74 0.00 0.00 36.82 39.18 3h6i h ILE 163 CO 0.04 0.72 -0.21 0.00 0.00 0.00 0.00 178.15 178.70 3h6i h ALA 164 N 0.43 0.63 -0.20 1.87 0.00 -0.77 -2.58 119.26 118.63 3h6i h ALA 164 Ca -0.14 -0.39 -0.15 0.00 0.00 0.00 0.00 54.91 54.23 3h6i h ALA 164 Cb 1.74 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 3h6i h ALA 164 CO 0.21 0.61 -0.51 -0.91 0.00 0.00 0.00 179.25 178.66 3h6i h ASN 165 N 0.78 0.62 0.33 0.00 -0.26 -1.32 -1.71 115.58 114.01 3h6i h ASN 165 Ca 0.10 -0.31 -0.06 0.00 -0.56 0.00 0.00 56.30 55.46 3h6i h ASN 165 Cb 0.79 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.86 3h6i h ASN 165 CO 0.07 1.01 -0.31 0.00 -1.06 0.00 0.00 177.43 177.14 3h6i h ALA 166 N 1.00 1.46 0.21 -0.83 0.00 -1.38 -2.93 119.26 116.81 3h6i h ALA 166 Ca 0.02 -0.28 -0.31 0.00 0.00 0.00 0.00 54.91 54.34 3h6i h ALA 166 Cb 1.04 -0.05 0.03 0.00 0.00 0.00 0.00 17.79 18.81 3h6i h ALA 166 CO 0.10 0.38 -1.40 -0.07 0.00 0.00 0.00 179.25 178.26 3h6i h LEU 167 N 0.00 0.70 -1.67 0.00 3.38 -1.32 -2.91 115.31 113.49 3h6i h LEU 167 Ca -0.00 -0.93 0.22 0.00 0.09 0.00 0.00 57.88 57.26 3h6i h LEU 167 Cb 0.55 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 3h6i h LEU 167 CO 0.04 1.66 0.61 0.11 0.09 0.00 0.00 178.44 180.95 3h6i h LYS 168 N 0.01 0.25 0.00 1.13 1.57 -1.12 -0.15 116.57 118.25 3h6i h LYS 168 Ca -0.26 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 3h6i h LYS 168 Cb 2.03 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 34.28 3h6i h LYS 168 CO 0.22 0.17 -1.04 0.39 -0.57 0.00 0.00 179.45 178.62 3h6i n GLU 169 N -4.44 1.34 -0.37 3.15 1.02 -1.18 -4.37 120.64 115.80 3h6i n GLU 169 Ca 0.19 -0.04 0.08 0.00 -0.02 0.00 0.00 57.16 57.36 3h6i n GLU 169 Cb 0.79 -1.30 0.24 0.00 -0.02 0.00 0.00 31.44 31.15 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 -1.58 3.69 -4.68 1.62 3.41 -0.60 -4.99 113.62 110.49 3h6i n SER 170 Ca 0.01 -2.42 -0.40 0.00 -0.26 0.00 0.00 58.87 55.80 3h6i n SER 170 Cb 0.30 -0.42 -0.05 0.00 -0.26 0.00 0.00 64.21 63.78 3h6i n SER 170 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3h6i s TYR 171 N -1.76 3.45 -0.09 7.33 5.04 -0.17 -4.98 117.35 126.17 3h6i s TYR 171 Ca 0.36 1.07 0.03 0.00 -2.44 0.00 0.00 57.07 56.09 3h6i s TYR 171 Cb 0.24 -2.82 -0.01 0.00 0.35 0.00 0.00 41.96 39.72 3h6i s TYR 171 CO 0.16 -0.09 -0.19 0.00 -1.34 0.00 0.00 175.55 174.10 3h6i s ALA 172 N 1.56 2.42 0.18 3.97 0.00 -1.26 -5.07 121.76 123.55 3h6i s ALA 172 Ca 0.33 -0.97 -0.12 0.00 0.00 0.00 0.00 51.96 51.20 3h6i s ALA 172 Cb -0.16 -0.93 0.08 0.00 0.00 0.00 0.00 23.12 22.11 3h6i s ALA 172 CO 0.13 0.37 1.75 0.93 0.00 0.00 0.00 175.76 178.94 3h6i h GLU 173 N 6.22 0.89 -0.64 0.00 4.39 -1.97 -3.31 114.58 120.16 3h6i h GLU 173 Ca -0.31 -0.14 -0.47 0.00 0.34 0.00 0.00 59.36 58.78 3h6i h GLU 173 Cb 1.19 -0.15 -0.36 0.00 -0.10 0.00 0.00 28.75 29.33 3h6i h GLU 173 CO 0.51 0.74 -0.71 0.09 -1.16 0.00 0.00 179.01 178.47 3h6i n ASN 174 N -4.49 4.50 -4.72 1.42 4.13 -1.26 -4.58 115.26 110.26 3h6i n ASN 174 Ca 0.04 -3.78 -0.42 0.00 1.68 0.00 0.00 54.58 52.10 3h6i n ASN 174 Cb 0.14 -0.39 -0.01 0.00 -1.54 0.00 0.00 39.78 37.98 3h6i n ASN 174 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3h6i n ALA 175 N -0.78 1.63 -0.71 5.41 0.00 -1.25 -4.15 120.51 120.66 3h6i n ALA 175 Ca 0.41 0.36 -0.31 0.00 0.00 0.00 0.00 53.44 53.90 3h6i n ALA 175 Cb 0.92 -2.31 0.27 0.00 0.00 0.00 0.00 19.45 18.33 3h6i n ALA 175 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3h6i s SER 176 N -0.17 -0.30 0.03 0.00 1.04 -1.26 -2.05 113.70 110.99 3h6i s SER 176 Ca 0.56 0.68 -0.26 0.00 0.48 0.00 0.00 55.95 57.42 3h6i s SER 176 Cb -0.55 -0.93 -0.17 0.00 0.10 0.00 0.00 66.02 64.47 3h6i s SER 176 CO 0.61 -4.88 1.45 0.25 0.98 0.00 0.00 173.24 171.65 3h6i h LEU 177 N -3.09 -0.23 -0.91 2.42 5.85 -1.99 -1.33 115.31 116.03 3h6i h LEU 177 Ca -0.43 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.16 3h6i h LEU 177 Cb 1.31 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.35 3h6i h LEU 177 CO 0.28 0.03 0.59 0.74 -0.34 0.00 0.00 178.44 179.75 3h6i h THR 178 N -0.50 1.17 -0.21 1.05 2.02 -1.93 -0.90 112.91 113.62 3h6i h THR 178 Ca -0.03 -0.40 -0.10 0.00 0.77 0.00 0.00 66.41 66.65 3h6i h THR 178 Cb 0.37 -0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.69 3h6i h THR 178 CO 0.05 0.21 -0.25 0.44 0.37 0.00 0.00 175.52 176.34 3h6i h ASP 179 N 1.17 0.59 -0.42 4.18 3.32 -1.89 -2.86 116.42 120.51 3h6i h ASP 179 Ca 0.35 -0.49 -0.07 0.00 0.02 0.00 0.00 57.03 56.85 3h6i h ASP 179 Cb -0.04 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3h6i h ASP 179 CO -0.11 0.97 0.04 0.00 -1.72 0.00 0.00 179.24 178.42 3h6i h ALA 180 N 0.64 1.15 -0.11 3.45 0.00 -0.92 -1.97 119.26 121.50 3h6i h ALA 180 Ca 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3h6i h ALA 180 Cb 0.81 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3h6i h ALA 180 CO 0.06 0.56 0.04 1.25 0.00 0.00 0.00 179.25 181.15 3h6i h LEU 181 N 0.75 0.15 -0.70 0.00 5.85 -1.16 -1.87 115.31 118.34 3h6i h LEU 181 Ca 0.15 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 3h6i h LEU 181 Cb 0.40 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 3h6i h LEU 181 CO 0.01 0.30 0.28 0.03 -0.34 0.00 0.00 178.44 178.72 3h6i h ARG 182 N -0.00 1.05 -0.37 1.25 3.08 -1.34 0.90 114.38 118.94 3h6i h ARG 182 Ca 0.04 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 3h6i h ARG 182 Cb 0.20 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 3h6i h ARG 182 CO -0.00 0.87 0.13 0.82 -1.07 0.00 0.00 179.97 180.71 3h6i h ILE 183 N 1.00 1.15 0.11 2.04 2.04 -1.30 -0.95 117.51 121.61 3h6i h ILE 183 Ca 0.23 -0.49 -0.20 0.00 1.00 0.00 0.00 64.86 65.40 3h6i h ILE 183 Cb 0.21 0.73 0.02 0.00 -0.74 0.00 0.00 36.82 37.05 3h6i h ILE 183 CO -0.02 0.19 -0.86 0.00 0.00 0.00 0.00 178.15 177.46 3h6i h ALA 184 N 1.63 -0.05 -0.62 1.87 0.00 -0.70 -2.98 119.26 118.40 3h6i h ALA 184 Ca 0.13 -0.69 -0.06 0.00 0.00 0.00 0.00 54.91 54.30 3h6i h ALA 184 Cb 0.14 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3h6i h ALA 184 CO -0.01 0.42 0.16 0.28 0.00 0.00 0.00 179.25 180.10 3h6i h VAL 185 N -0.20 1.24 -0.49 0.00 2.07 -0.62 -2.56 116.25 115.69 3h6i h VAL 185 Ca -0.14 -0.88 -0.07 0.00 0.82 0.00 0.00 66.70 66.43 3h6i h VAL 185 Cb 1.63 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 3h6i h VAL 185 CO 0.16 0.33 0.00 0.00 0.02 0.00 0.00 177.57 178.09 3h6i h ALA 186 N 1.24 1.09 -0.22 1.67 0.00 -1.27 -2.11 119.26 119.67 3h6i h ALA 186 Ca 0.20 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 3h6i h ALA 186 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3h6i h ALA 186 CO -0.00 0.58 -0.34 0.00 0.00 0.00 0.00 179.25 179.49 3h6i h ALA 187 N 1.25 1.01 0.00 0.00 0.00 -1.32 -2.72 119.26 117.47 3h6i h ALA 187 Ca 0.15 -0.39 -0.17 0.00 0.00 0.00 0.00 54.91 54.49 3h6i h ALA 187 Cb 0.45 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3h6i h ALA 187 CO 0.02 0.60 -0.81 -0.07 0.00 0.00 0.00 179.25 178.98 3h6i h LEU 188 N 0.40 0.00 -1.36 0.00 3.38 -1.25 -3.03 115.31 113.44 3h6i h LEU 188 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3h6i h LEU 188 Cb 0.78 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 3h6i h LEU 188 CO 0.06 0.81 -0.09 -0.09 0.09 0.00 0.00 178.44 179.23 3h6i h ARG 189 N 0.00 0.00 0.03 1.13 9.65 -1.21 -3.29 114.38 120.69 3h6i h ARG 189 Ca -0.01 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3h6i h ARG 189 Cb 1.54 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.12 3h6i h ARG 189 CO 0.11 0.09 -0.01 0.00 2.80 0.00 0.00 179.97 182.95 3h6i h ALA 190 N 1.91 -0.70 0.00 2.80 0.00 -1.36 -3.52 119.26 118.40 3h6i h ALA 190 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h6i h ALA 190 Cb 0.59 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3h6i h ALA 190 CO 0.01 -0.70 0.00 0.41 0.00 0.00 0.00 179.25 178.98 3h6i n GLY 191 N -0.09 -1.14 0.00 0.00 0.00 -1.24 -4.99 105.19 97.73 3h6i n GLY 191 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3h6i n GLY 191 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h6i n LEU 203 N -1.18 0.00 0.00 0.99 4.77 -1.26 -4.73 117.00 115.59 3h6i n LEU 203 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 3h6i n LEU 203 Cb 0.18 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3h6i n LEU 203 CO 0.20 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 3h6i n GLY 204 N 0.00 1.38 0.36 -0.72 0.00 -1.26 -4.96 105.19 99.99 3h6i n GLY 204 Ca 0.00 -2.03 0.13 0.00 0.00 0.00 0.00 46.02 44.12 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 -0.15 0.86 0.00 1.61 2.07 -1.96 -2.52 116.25 116.17 3h6i h VAL 205 Ca 0.00 -0.15 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 3h6i h VAL 205 Cb 0.00 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 3h6i h VAL 205 CO 0.00 0.08 -0.34 0.00 0.02 0.00 0.00 177.57 177.33 3h6i h ALA 206 N 1.67 1.24 -0.22 1.67 0.00 -1.95 -3.25 119.26 118.42 3h6i h ALA 206 Ca 0.32 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3h6i h ALA 206 Cb 0.65 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3h6i h ALA 206 CO -0.10 0.43 0.00 -1.13 0.00 0.00 0.00 179.25 178.45 3h6i n SER 207 N -3.85 3.53 -4.01 0.00 3.41 -0.96 -4.57 113.62 107.17 3h6i n SER 207 Ca -0.01 -2.93 -0.16 0.00 -0.26 0.00 0.00 58.87 55.50 3h6i n SER 207 Cb 0.41 -0.49 -0.14 0.00 -0.26 0.00 0.00 64.21 63.74 3h6i n SER 207 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h6i s LEU 208 N -2.66 2.08 -0.19 1.04 1.43 -1.18 -1.84 118.68 117.36 3h6i s LEU 208 Ca 0.38 -0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 53.23 3h6i s LEU 208 Cb 0.31 -0.33 -0.00 0.00 0.03 0.00 0.00 46.19 46.20 3h6i s LEU 208 CO 0.08 0.02 -0.10 -0.70 0.23 0.00 0.00 176.35 175.88 3h6i s GLU 209 N -0.53 3.28 -0.01 1.70 2.12 -0.18 -4.82 118.70 120.27 3h6i s GLU 209 Ca -0.00 -0.69 0.03 0.00 0.36 0.00 0.00 54.97 54.68 3h6i s GLU 209 Cb -0.04 -2.83 -0.01 0.00 0.26 0.00 0.00 34.13 31.51 3h6i s GLU 209 CO 0.00 -0.13 -0.11 0.08 -0.54 0.00 0.00 175.26 174.56 3h6i s VAL 210 N 1.23 0.90 0.03 3.70 1.01 -1.26 -0.96 120.40 125.04 3h6i s VAL 210 Ca 0.02 -0.48 -0.27 0.00 0.00 0.00 0.00 61.98 61.26 3h6i s VAL 210 Cb -0.14 -0.76 0.07 0.00 0.00 0.00 0.00 36.38 35.55 3h6i s VAL 210 CO -0.04 0.26 0.63 0.00 0.00 0.00 0.00 175.10 175.94 3h6i s ALA 211 N -0.20 -1.64 0.17 5.51 0.00 -0.75 -1.81 121.76 123.05 3h6i s ALA 211 Ca 0.03 0.94 0.08 0.00 0.00 0.00 0.00 51.96 53.02 3h6i s ALA 211 Cb -0.05 0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.36 3h6i s ALA 211 CO -0.00 -0.51 -0.18 0.14 0.00 0.00 0.00 175.76 175.21 3h6i s VAL 212 N -2.17 1.81 -0.66 0.00 -7.23 -0.17 -0.29 120.40 111.69 3h6i s VAL 212 Ca -0.06 -1.97 -0.09 0.00 -1.81 0.00 0.00 61.98 58.04 3h6i s VAL 212 Cb -0.00 -1.88 0.17 0.00 0.56 0.00 0.00 36.38 35.23 3h6i s VAL 212 CO 0.01 -0.36 0.55 -0.76 -0.31 0.00 0.00 175.10 174.23 3h6i s LEU 213 N -2.78 5.99 -0.59 1.32 1.43 0.06 -1.26 118.68 122.85 3h6i s LEU 213 Ca 0.17 -2.51 -0.27 0.00 -1.03 0.00 0.00 54.13 50.49 3h6i s LEU 213 Cb -0.05 -2.05 0.03 0.00 0.03 0.00 0.00 46.19 44.16 3h6i s LEU 213 CO 0.07 -0.55 1.12 -0.62 0.23 0.00 0.00 176.35 176.59 3h6i s ASP 214 N 1.90 6.37 0.00 2.29 2.15 0.89 -1.89 116.67 128.38 3h6i s ASP 214 Ca 0.14 -0.14 0.05 0.00 0.43 0.00 0.00 52.55 53.03 3h6i s ASP 214 Cb -0.18 -2.51 0.26 0.00 -0.30 0.00 0.00 42.92 40.18 3h6i s ASP 214 CO -0.04 -1.44 1.07 0.00 -0.17 0.00 0.00 175.17 174.58 3h6i n ALA 215 N 8.22 1.37 1.24 3.66 0.00 -0.17 -1.48 120.51 133.34 3h6i n ALA 215 Ca 0.05 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.60 3h6i n ALA 215 Cb 0.48 -1.09 0.30 0.00 0.00 0.00 0.00 19.45 19.14 3h6i n ALA 215 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h6i n ASN 216 N -1.36 2.04 -4.76 0.00 5.15 -1.26 -4.50 115.26 110.56 3h6i n ASN 216 Ca 0.02 -1.61 -0.40 0.00 -0.60 0.00 0.00 54.58 52.00 3h6i n ASN 216 Cb 0.05 0.07 -0.06 0.00 -0.53 0.00 0.00 39.78 39.31 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 -2.11 4.74 0.14 1.20 1.81 -0.55 -4.99 118.95 119.20 3h6i s ARG 217 Ca 0.31 1.36 -0.15 0.00 -1.72 0.00 0.00 55.73 55.52 3h6i s ARG 217 Cb 0.20 -3.26 0.01 0.00 -0.45 0.00 0.00 34.95 31.45 3h6i s ARG 217 CO 0.37 0.54 1.72 -1.35 -0.68 0.00 0.00 175.30 175.90 3h6i h PRO 218 N 4.19 0.64 0.00 3.54 0.11 -1.90 -3.41 132.00 135.17 3h6i h PRO 218 Ca -0.46 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 65.56 3h6i h PRO 218 Cb 1.20 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3h6i h PRO 218 CO 0.67 0.55 -0.08 -2.13 -0.21 0.00 0.00 178.00 176.80 3h6i n ARG 219 N -4.65 0.00 -3.13 1.05 0.63 -1.26 -4.45 116.66 104.85 3h6i n ARG 219 Ca 0.01 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.52 3h6i n ARG 219 Cb 0.12 -0.35 -0.07 0.00 0.45 0.00 0.00 32.46 32.61 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 3.68 0.11 -0.14 0.52 -1.26 -4.37 118.95 115.49 3h6i s ARG 220 Ca 0.00 0.03 0.06 0.00 -0.52 0.00 0.00 55.73 55.30 3h6i s ARG 220 Cb 0.00 -3.80 -0.22 0.00 0.52 0.00 0.00 34.95 31.45 3h6i s ARG 220 CO 0.00 -0.71 1.23 0.00 0.02 0.00 0.00 175.30 175.84 3h6i h ALA 221 N 8.44 0.34 -2.42 2.13 0.00 -1.33 -3.45 119.26 122.98 3h6i h ALA 221 Ca -0.27 -0.93 -0.54 0.00 0.00 0.00 0.00 54.91 53.17 3h6i h ALA 221 Cb 1.11 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.81 3h6i h ALA 221 CO 0.82 1.23 0.95 0.12 0.00 0.00 0.00 179.25 182.37 3h6i s PHE 222 N -2.70 2.56 -0.04 0.00 5.36 -1.26 -0.08 117.98 121.83 3h6i s PHE 222 Ca 0.00 0.48 -0.01 0.00 -0.96 0.00 0.00 56.93 56.44 3h6i s PHE 222 Cb 0.10 -3.87 0.03 0.00 -0.34 0.00 0.00 43.02 38.94 3h6i s PHE 222 CO 0.83 -3.41 0.07 0.50 -1.46 0.00 0.00 175.22 171.74 3h6i s ARG 223 N 2.57 0.00 -0.04 10.12 3.52 -0.39 -4.96 118.95 129.78 3h6i s ARG 223 Ca 0.71 0.25 -0.19 0.00 -0.13 0.00 0.00 55.73 56.37 3h6i s ARG 223 Cb -0.37 -0.23 -0.05 0.00 -1.56 0.00 0.00 34.95 32.74 3h6i s ARG 223 CO 0.30 -0.17 0.54 1.03 -0.81 0.00 0.00 175.30 176.19 3h6i s ARG 224 N 1.12 4.28 -0.43 5.12 0.52 -1.26 -1.00 118.95 127.30 3h6i s ARG 224 Ca -0.09 0.62 -0.07 0.00 -0.52 0.00 0.00 55.73 55.67 3h6i s ARG 224 Cb -0.13 -3.36 0.10 0.00 0.52 0.00 0.00 34.95 32.09 3h6i s ARG 224 CO -0.04 0.34 0.26 0.42 0.02 0.00 0.00 175.30 176.30 3h6i s ILE 225 N -0.05 3.87 0.40 1.52 1.01 -0.75 -4.98 121.20 122.22 3h6i s ILE 225 Ca 0.29 -1.73 0.04 0.00 0.00 0.00 0.00 60.65 59.25 3h6i s ILE 225 Cb -0.17 -3.50 -0.05 0.00 0.01 0.00 0.00 42.46 38.75 3h6i s ILE 225 CO 0.15 -0.63 0.05 0.42 0.00 0.00 0.00 174.94 174.93 3h6i s THR 226 N 1.31 1.24 0.00 2.92 -4.23 -1.26 -4.31 115.64 111.30 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 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 70.99 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 -0.92 2.95 0.30 3.99 0.00 -1.26 -2.88 105.19 107.37 3h6i n GLY 227 Ca -0.07 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 45.95 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 0.43 0.35 1.61 4.64 -2.00 -2.41 113.55 116.28 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 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 3h6i h SER 228 CO 0.00 0.32 -0.45 0.00 -0.87 0.00 0.00 176.83 175.83 3h6i h ALA 229 N 1.75 1.15 0.01 5.18 0.00 -1.94 -2.87 119.26 122.54 3h6i h ALA 229 Ca 0.14 -0.43 -0.20 0.00 0.00 0.00 0.00 54.91 54.42 3h6i h ALA 229 Cb -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3h6i h ALA 229 CO -0.03 0.60 -0.92 1.25 0.00 0.00 0.00 179.25 180.15 3h6i h LEU 230 N 0.11 0.16 -0.65 0.00 5.85 -1.30 -3.25 115.31 116.23 3h6i h LEU 230 Ca 0.01 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.63 3h6i h LEU 230 Cb 0.84 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.78 3h6i h LEU 230 CO 0.06 0.99 0.38 1.56 -0.34 0.00 0.00 178.44 181.09 3h6i h GLN 231 N 0.06 0.71 -0.93 1.25 1.08 -1.25 -2.69 115.11 113.33 3h6i h GLN 231 Ca -0.04 -0.04 0.06 0.00 -1.45 0.00 0.00 58.65 57.18 3h6i h GLN 231 Cb 1.58 -0.16 -0.06 0.00 -0.05 0.00 0.00 27.48 28.78 3h6i h GLN 231 CO 0.13 0.47 0.59 0.00 -0.95 0.00 0.00 178.83 179.07 3h6i h ALA 232 N 1.30 1.28 -0.00 3.87 0.00 -1.57 -2.82 119.26 121.33 3h6i h ALA 232 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3h6i h ALA 232 Cb 0.09 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3h6i h ALA 232 CO -0.14 0.35 -0.11 1.28 0.00 0.00 0.00 179.25 180.64 3h6i n LEU 233 N -4.57 0.11 -0.27 0.00 7.99 -1.02 -5.14 117.00 114.10 3h6i n LEU 233 Ca 0.14 0.39 0.15 0.00 -0.01 0.00 0.00 56.01 56.67 3h6i n LEU 233 Cb 0.18 -0.44 0.71 0.00 -0.11 0.00 0.00 43.42 43.76 3h6i n LEU 233 CO 0.31 0.03 0.97 0.18 -1.51 0.00 0.00 177.39 177.38