#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6i s SER 8 N 0.00 5.44 0.08 7.28 1.04 -1.26 -4.90 113.70 121.38 3h6i s SER 8 Ca 0.00 1.35 -0.16 0.00 0.48 0.00 0.00 55.95 57.62 3h6i s SER 8 Cb 0.00 -2.21 -0.12 0.00 0.10 0.00 0.00 66.02 63.78 3h6i s SER 8 CO 0.00 -1.37 1.35 -0.65 0.98 0.00 0.00 173.24 173.55 3h6i h PRO 9 N -0.67 0.63 -0.92 4.02 0.11 -2.06 -1.09 132.00 132.03 3h6i h PRO 9 Ca -0.45 -0.40 0.08 0.00 0.11 0.00 0.00 66.00 65.34 3h6i h PRO 9 Cb 1.23 0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.32 3h6i h PRO 9 CO 0.61 1.01 0.57 0.93 -0.21 0.00 0.00 178.00 180.91 3h6i h GLU 10 N 0.33 0.97 0.85 1.05 4.39 -2.01 -2.75 114.58 117.40 3h6i h GLU 10 Ca 0.01 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 3h6i h GLU 10 Cb 0.98 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 29.42 3h6i h GLU 10 CO 0.09 0.64 -0.41 1.96 -1.16 0.00 0.00 179.01 180.13 3h6i h GLN 11 N 0.99 -1.10 -0.87 2.33 1.08 -1.94 -3.00 115.11 112.60 3h6i h GLN 11 Ca 0.42 0.07 0.10 0.00 -1.45 0.00 0.00 58.65 57.79 3h6i h GLN 11 Cb 0.27 0.25 -0.12 0.00 -0.05 0.00 0.00 27.48 27.83 3h6i h GLN 11 CO -0.21 -0.72 -0.45 0.00 -0.95 0.00 0.00 178.83 176.50 3h6i n ALA 12 N -2.63 -0.40 0.05 3.87 0.00 -0.42 0.20 120.51 121.18 3h6i n ALA 12 Ca -0.15 0.79 0.20 0.00 0.00 0.00 0.00 53.44 54.28 3h6i n ALA 12 Cb 0.46 -0.22 0.73 0.00 0.00 0.00 0.00 19.45 20.42 3h6i n ALA 12 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3h6i h MET 13 N 0.00 0.00 0.20 0.00 2.86 -1.48 -0.14 114.93 116.38 3h6i h MET 13 Ca 0.20 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.52 3h6i h MET 13 Cb 0.42 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.10 3h6i h MET 13 CO -0.84 0.00 -1.39 -0.09 1.06 0.00 0.00 176.91 175.66 3h6i h ARG 14 N 0.00 0.44 -0.38 1.72 2.43 0.24 -2.18 114.38 116.65 3h6i h ARG 14 Ca 0.22 -0.75 -0.04 0.00 -0.81 0.00 0.00 59.98 58.60 3h6i h ARG 14 Cb 0.96 0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.77 3h6i h ARG 14 CO -0.00 1.36 0.07 1.49 -1.51 0.00 0.00 179.97 181.38 3h6i h GLU 15 N 0.12 0.56 -0.06 0.20 4.81 0.89 -2.25 114.58 118.85 3h6i h GLU 15 Ca -0.21 -0.10 -0.15 0.00 -0.13 0.00 0.00 59.36 58.78 3h6i h GLU 15 Cb 2.09 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 31.39 3h6i h GLU 15 CO 0.25 0.53 -0.53 0.00 -0.73 0.00 0.00 179.01 178.53 3h6i h ARG 16 N 0.55 0.47 -0.43 1.92 3.08 -1.16 -1.22 114.38 117.59 3h6i h ARG 16 Ca 0.13 -0.42 0.07 0.00 0.07 0.00 0.00 59.98 59.82 3h6i h ARG 16 Cb 0.24 0.10 -0.06 0.00 0.08 0.00 0.00 29.97 30.33 3h6i h ARG 16 CO -0.00 1.06 0.06 0.77 -1.07 0.00 0.00 179.97 180.80 3h6i h SER 17 N 0.03 -0.05 0.02 7.04 0.02 -1.10 0.27 113.55 119.79 3h6i h SER 17 Ca -0.05 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3h6i h SER 17 Cb 1.20 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.86 3h6i h SER 17 CO 0.11 0.01 -0.01 -0.33 -1.14 0.00 0.00 176.83 175.47 3h6i h GLU 18 N 0.19 -0.03 -0.94 3.45 4.39 -1.39 0.73 114.58 120.97 3h6i h GLU 18 Ca 0.21 0.00 0.24 0.00 0.34 0.00 0.00 59.36 60.15 3h6i h GLU 18 Cb 0.28 0.01 -0.13 0.00 -0.10 0.00 0.00 28.75 28.81 3h6i h GLU 18 CO -0.30 0.17 0.47 1.25 -1.16 0.00 0.00 179.01 179.44 3h6i h LEU 19 N -0.22 0.46 0.01 1.33 6.46 -0.73 0.69 115.31 123.31 3h6i h LEU 19 Ca -0.00 0.15 -0.02 0.00 -0.12 0.00 0.00 57.88 57.89 3h6i h LEU 19 Cb 0.21 0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.24 3h6i h LEU 19 CO 0.00 0.02 -0.08 0.00 -0.62 0.00 0.00 178.44 177.77 3h6i h ALA 20 N 1.73 -0.00 -0.67 1.25 0.00 -0.39 -3.14 119.26 118.03 3h6i h ALA 20 Ca 0.60 -0.48 0.05 0.00 0.00 0.00 0.00 54.91 55.07 3h6i h ALA 20 Cb 1.16 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 3h6i h ALA 20 CO -0.52 0.01 0.44 -0.09 0.00 0.00 0.00 179.25 179.09 3h6i h ARG 21 N -0.86 0.72 -0.30 0.00 2.43 0.97 -1.81 114.38 115.54 3h6i h ARG 21 Ca -0.01 -0.04 -0.17 0.00 -0.81 0.00 0.00 59.98 58.94 3h6i h ARG 21 Cb 0.99 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.38 3h6i h ARG 21 CO 0.01 0.48 -0.49 0.87 -1.51 0.00 0.00 179.97 179.33 3h6i h LYS 22 N 0.75 0.84 -0.28 0.20 1.57 -0.99 -0.45 116.57 118.20 3h6i h LYS 22 Ca 0.28 -0.50 -0.11 0.00 -1.87 0.00 0.00 60.65 58.44 3h6i h LYS 22 Cb 0.15 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 3h6i h LYS 22 CO -0.08 1.14 -0.30 0.78 -0.57 0.00 0.00 179.45 180.41 3h6i h GLY 23 N 0.79 0.63 1.20 3.86 0.00 -1.38 -1.59 103.07 106.57 3h6i h GLY 23 Ca 0.03 -0.56 -0.22 0.00 0.00 0.00 0.00 47.33 46.58 3h6i h GLY 23 CO 0.11 0.51 -0.73 -2.22 0.00 0.00 0.00 176.54 174.21 3h6i h ILE 24 N 0.50 1.28 0.00 2.60 2.04 -1.22 -3.05 117.51 119.66 3h6i h ILE 24 Ca 0.06 -1.93 -0.05 0.00 1.00 0.00 0.00 64.86 63.94 3h6i h ILE 24 Cb 0.77 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.76 3h6i h ILE 24 CO 0.06 0.62 -0.24 0.00 0.00 0.00 0.00 178.15 178.58 3h6i h ALA 25 N 0.60 1.51 0.00 1.87 0.00 -0.90 -1.16 119.26 121.18 3h6i h ALA 25 Ca -0.04 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 3h6i h ALA 25 Cb 1.36 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 3h6i h ALA 25 CO 0.15 0.30 -0.41 -0.09 0.00 0.00 0.00 179.25 179.21 3h6i h ARG 26 N 0.00 0.00 -7.08 0.00 2.43 -1.23 -3.33 114.38 105.17 3h6i h ARG 26 Ca -0.00 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 58.68 3h6i h ARG 26 Cb 0.45 0.00 0.05 0.00 -0.42 0.00 0.00 29.97 30.05 3h6i h ARG 26 CO 0.03 0.41 0.17 0.00 -1.51 0.00 0.00 179.97 179.07 3h6i s ALA 27 N -3.26 3.32 0.97 2.80 0.00 -0.96 -4.93 121.76 119.70 3h6i s ALA 27 Ca 0.02 -0.59 -0.11 0.00 0.00 0.00 0.00 51.96 51.28 3h6i s ALA 27 Cb 0.09 -2.63 0.18 0.00 0.00 0.00 0.00 23.12 20.75 3h6i s ALA 27 CO 0.71 -0.65 1.11 0.15 0.00 0.00 0.00 175.76 177.07 3h6i s LYS 28 N -4.93 0.56 0.09 0.00 -0.14 -1.26 -1.71 119.74 112.35 3h6i s LYS 28 Ca 0.52 1.28 0.01 0.00 -1.36 0.00 0.00 55.97 56.42 3h6i s LYS 28 Cb -0.10 -1.69 -0.04 0.00 -1.68 0.00 0.00 37.83 34.31 3h6i s LYS 28 CO 0.46 -2.86 0.23 -1.12 -0.76 0.00 0.00 175.35 171.30 3h6i s SER 29 N -2.72 6.31 0.00 2.83 0.01 -1.26 -4.00 113.70 114.86 3h6i s SER 29 Ca 0.67 0.22 0.03 0.00 1.31 0.00 0.00 55.95 58.18 3h6i s SER 29 Cb -0.23 -1.92 -0.01 0.00 0.21 0.00 0.00 66.02 64.08 3h6i s SER 29 CO 0.60 0.13 -0.10 -0.69 0.41 0.00 0.00 173.24 173.59 3h6i s VAL 30 N -1.59 0.75 -0.04 3.43 1.01 0.11 -2.05 120.40 122.03 3h6i s VAL 30 Ca 0.35 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.85 3h6i s VAL 30 Cb -0.12 -0.65 -0.00 0.00 0.00 0.00 0.00 36.38 35.61 3h6i s VAL 30 CO 0.28 0.13 -0.14 -0.69 0.00 0.00 0.00 175.10 174.68 3h6i s VAL 31 N -0.38 1.19 -0.10 2.92 1.01 0.04 -0.21 120.40 124.86 3h6i s VAL 31 Ca 0.02 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.43 3h6i s VAL 31 Cb -0.05 -1.03 0.02 0.00 0.00 0.00 0.00 36.38 35.32 3h6i s VAL 31 CO -0.00 0.35 -0.10 0.00 0.00 0.00 0.00 175.10 175.35 3h6i s ALA 32 N 0.12 1.39 0.02 5.51 0.00 -0.35 -0.48 121.76 127.97 3h6i s ALA 32 Ca -0.04 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.36 3h6i s ALA 32 Cb -0.11 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 22.17 3h6i s ALA 32 CO 0.02 -0.25 -0.03 -0.48 0.00 0.00 0.00 175.76 175.02 3h6i s LEU 33 N 1.36 2.23 0.11 0.00 0.05 -0.05 -0.45 118.68 121.92 3h6i s LEU 33 Ca -0.01 -0.48 -0.30 0.00 0.05 0.00 0.00 54.13 53.39 3h6i s LEU 33 Cb -0.14 0.08 -0.06 0.00 -2.05 0.00 0.00 46.19 44.03 3h6i s LEU 33 CO -0.05 -0.28 0.98 0.00 -0.55 0.00 0.00 176.35 176.45 3h6i s ALA 34 N -1.38 3.25 0.00 1.48 0.00 -0.81 -0.87 121.76 123.43 3h6i s ALA 34 Ca -0.15 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.41 3h6i s ALA 34 Cb -0.09 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.73 3h6i s ALA 34 CO -0.01 -0.06 0.00 2.48 0.00 0.00 0.00 175.76 178.17 3h6i n TYR 35 N 2.85 0.00 0.02 0.00 0.18 -0.65 -4.66 117.16 114.90 3h6i n TYR 35 Ca 0.03 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.68 3h6i n TYR 35 Cb 0.49 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.36 3h6i n TYR 35 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3h6i h ALA 36 N 1.00 -0.04 -0.23 -3.48 0.00 -1.75 -3.25 119.26 111.51 3h6i h ALA 36 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3h6i h ALA 36 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3h6i h ALA 36 CO 0.00 -0.37 0.00 0.41 0.00 0.00 0.00 179.25 179.29 3h6i n GLY 37 N -0.31 0.17 0.00 0.00 0.00 -1.26 -5.01 105.19 98.78 3h6i n GLY 37 Ca -0.08 -0.30 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 0.96 0.48 3.27 -0.02 0.00 -1.23 -1.00 105.19 107.65 3h6i n GLY 38 Ca 0.11 -0.80 -0.25 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.07 1.61 1.01 -0.69 -1.63 120.40 122.35 3h6i s VAL 39 Ca 0.00 -1.38 0.04 0.00 0.00 0.00 0.00 61.98 60.64 3h6i s VAL 39 Cb 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.86 3h6i s VAL 39 CO 0.00 0.08 -0.18 -0.22 0.00 0.00 0.00 175.10 174.78 3h6i s LEU 40 N -1.54 1.88 -0.11 3.92 2.96 -0.05 -1.18 118.68 124.55 3h6i s LEU 40 Ca 0.07 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.60 3h6i s LEU 40 Cb -0.09 -1.07 -0.01 0.00 0.50 0.00 0.00 46.19 45.52 3h6i s LEU 40 CO 0.03 0.12 -0.16 -0.36 -1.32 0.00 0.00 176.35 174.66 3h6i s PHE 41 N 0.31 2.73 -0.04 5.38 0.08 0.80 -0.87 117.98 126.37 3h6i s PHE 41 Ca -0.11 -0.68 0.00 0.00 0.12 0.00 0.00 56.93 56.25 3h6i s PHE 41 Cb -0.15 -1.78 0.03 0.00 -0.57 0.00 0.00 43.02 40.54 3h6i s PHE 41 CO 0.05 -0.21 -0.01 0.08 -0.10 0.00 0.00 175.22 175.02 3h6i s VAL 42 N 0.22 0.30 0.04 -0.44 1.01 0.37 -1.87 120.40 120.03 3h6i s VAL 42 Ca -0.10 0.06 0.03 0.00 0.00 0.00 0.00 61.98 61.96 3h6i s VAL 42 Cb -0.16 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.80 3h6i s VAL 42 CO 0.06 0.20 -0.08 0.00 0.00 0.00 0.00 175.10 175.27 3h6i s ALA 43 N 1.28 0.65 -0.47 5.51 0.00 -0.22 -0.78 121.76 127.72 3h6i s ALA 43 Ca -0.06 -0.71 -0.29 0.00 0.00 0.00 0.00 51.96 50.90 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 -0.02 0.03 1.13 -1.21 0.00 0.00 0.00 175.76 175.69 3h6i s GLU 44 N -1.35 3.72 -0.28 0.00 2.02 -0.87 -2.02 118.70 119.93 3h6i s GLU 44 Ca -0.07 0.56 -0.00 0.00 0.02 0.00 0.00 54.97 55.48 3h6i s GLU 44 Cb -0.09 -3.91 0.14 0.00 0.10 0.00 0.00 34.13 30.38 3h6i s GLU 44 CO 0.01 -1.37 0.33 1.21 0.02 0.00 0.00 175.26 175.45 3h6i s ASN 45 N 2.44 1.15 0.46 -0.19 2.47 -0.74 -4.68 114.94 115.85 3h6i s ASN 45 Ca 0.48 -0.49 0.25 0.00 0.42 0.00 0.00 52.86 53.52 3h6i s ASN 45 Cb -0.07 0.72 1.06 0.00 -1.45 0.00 0.00 41.25 41.51 3h6i s ASN 45 CO 0.31 -0.36 1.89 1.55 -3.72 0.00 0.00 177.10 176.77 3h6i h PRO 46 N 8.23 0.00 -6.92 0.43 0.13 -1.82 -3.22 132.00 128.84 3h6i h PRO 46 Ca -0.13 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.50 3h6i h PRO 46 Cb 1.10 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.27 3h6i h PRO 46 CO 0.30 0.20 0.47 0.45 -0.23 0.00 0.00 178.00 179.19 3h6i s SER 47 N -6.17 6.76 0.06 1.44 0.15 -1.26 -4.77 113.70 109.90 3h6i s SER 47 Ca -0.00 2.23 0.23 0.00 0.70 0.00 0.00 55.95 59.10 3h6i s SER 47 Cb 0.11 -2.61 -0.06 0.00 -1.71 0.00 0.00 66.02 61.75 3h6i s SER 47 CO 0.62 -0.50 0.90 -2.11 1.20 0.00 0.00 173.24 173.35 3h6i n ARG 48 N 0.27 0.41 0.00 5.44 1.85 -1.26 -4.58 116.66 118.79 3h6i n ARG 48 Ca 0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 57.85 56.86 3h6i n ARG 48 Cb 0.47 -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 -2.13 4.63 -4.38 2.89 3.41 -1.26 -4.94 113.62 111.84 3h6i n SER 49 Ca 0.00 0.00 -0.45 0.00 -0.26 0.00 0.00 58.87 58.16 3h6i n SER 49 Cb 0.48 0.75 -0.03 0.00 -0.26 0.00 0.00 64.21 65.15 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 -3.15 5.74 0.20 1.04 1.43 -1.26 -5.03 118.68 117.64 3h6i s LEU 50 Ca 0.00 -1.94 -0.28 0.00 -1.03 0.00 0.00 54.13 50.88 3h6i s LEU 50 Cb 0.00 -2.29 -0.08 0.00 0.03 0.00 0.00 46.19 43.84 3h6i s LEU 50 CO 0.00 -0.94 0.87 -1.10 0.23 0.00 0.00 176.35 175.41 3h6i s GLN 51 N 1.94 4.73 -0.01 1.70 -0.21 -1.26 -4.84 119.66 121.71 3h6i s GLN 51 Ca 0.18 1.35 0.12 0.00 0.02 0.00 0.00 55.36 57.03 3h6i s GLN 51 Cb -0.16 -3.28 -0.15 0.00 1.00 0.00 0.00 33.01 30.42 3h6i s GLN 51 CO -0.02 0.53 0.44 1.63 -2.12 0.00 0.00 175.29 175.75 3h6i n LYS 52 N 1.59 2.19 -5.27 2.91 5.02 -1.26 -4.96 118.16 118.38 3h6i n LYS 52 Ca -0.03 -0.04 -0.31 0.00 -2.02 0.00 0.00 58.31 55.91 3h6i n LYS 52 Cb 0.48 -1.14 -0.16 0.00 -0.02 0.00 0.00 35.03 34.18 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 -2.37 2.03 0.06 -0.18 1.01 -1.26 -1.10 121.20 119.40 3h6i s ILE 53 Ca 0.02 -1.07 -0.23 0.00 0.00 0.00 0.00 60.65 59.36 3h6i s ILE 53 Cb 0.09 -1.71 0.06 0.00 0.01 0.00 0.00 42.46 40.91 3h6i s ILE 53 CO 0.51 0.57 0.55 -0.55 0.00 0.00 0.00 174.94 176.01 3h6i s SER 54 N -0.32 -0.48 0.36 3.58 0.15 0.86 -4.99 113.70 112.86 3h6i s SER 54 Ca 0.01 0.18 -0.27 0.00 0.70 0.00 0.00 55.95 56.58 3h6i s SER 54 Cb -0.12 0.52 -0.09 0.00 -1.71 0.00 0.00 66.02 64.61 3h6i s SER 54 CO 0.02 -0.76 1.15 -0.70 1.20 0.00 0.00 173.24 174.15 3h6i s GLU 55 N -2.61 4.26 -0.06 5.44 2.12 -1.26 0.20 118.70 126.78 3h6i s GLU 55 Ca -0.04 1.83 -0.05 0.00 0.36 0.00 0.00 54.97 57.07 3h6i s GLU 55 Cb -0.01 -2.84 -0.03 0.00 0.26 0.00 0.00 34.13 31.51 3h6i s GLU 55 CO -0.03 -0.14 -0.11 1.28 -0.54 0.00 0.00 175.26 175.71 3h6i n LEU 56 N 0.43 0.82 0.00 2.70 4.77 -0.53 -4.79 117.00 120.41 3h6i n LEU 56 Ca 0.02 0.13 -0.01 0.00 -0.03 0.00 0.00 56.01 56.13 3h6i n LEU 56 Cb 0.46 -0.32 -0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3h6i n LEU 56 CO 0.52 -0.02 0.01 0.00 -1.33 0.00 0.00 177.39 176.57 3h6i n TYR 57 N -3.51 -0.51 -0.15 -1.77 9.36 -0.94 -4.74 117.16 114.90 3h6i n TYR 57 Ca -0.14 -0.14 -0.06 0.00 3.32 0.00 0.00 57.90 60.87 3h6i n TYR 57 Cb 0.50 0.03 0.03 0.00 -0.63 0.00 0.00 39.34 39.28 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 0.12 0.45 -0.06 2.98 3.32 -1.94 -3.04 116.42 118.25 3h6i h ASP 58 Ca -0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3h6i h ASP 58 Cb 0.07 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3h6i h ASP 58 CO 0.02 0.32 0.00 0.54 -1.72 0.00 0.00 179.24 178.41 3h6i n ARG 59 N -4.82 0.73 -4.44 3.56 5.12 -1.26 -1.15 116.66 114.40 3h6i n ARG 59 Ca 0.03 -1.19 -0.34 0.00 -1.93 0.00 0.00 57.85 54.42 3h6i n ARG 59 Cb 0.07 -1.17 -0.11 0.00 -1.16 0.00 0.00 32.46 30.09 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 -0.75 3.94 0.35 1.55 1.01 -1.15 -2.24 120.40 123.11 3h6i s VAL 60 Ca 0.11 -0.36 0.09 0.00 0.00 0.00 0.00 61.98 61.83 3h6i s VAL 60 Cb 0.07 -2.69 -0.06 0.00 0.00 0.00 0.00 36.38 33.69 3h6i s VAL 60 CO 0.11 0.53 -0.08 -0.83 0.00 0.00 0.00 175.10 174.83 3h6i s GLY 61 N -0.08 2.21 0.03 4.51 0.00 0.35 -1.46 107.32 112.88 3h6i s GLY 61 Ca 0.02 -2.10 0.03 0.00 0.00 0.00 0.00 44.72 42.67 3h6i s GLY 61 CO 0.02 -2.03 -0.09 -0.12 0.00 0.00 0.00 173.10 170.89 3h6i s PHE 62 N -2.61 0.80 -0.13 1.90 2.19 0.13 -1.83 117.98 118.43 3h6i s PHE 62 Ca 0.33 -0.35 -0.16 0.00 0.33 0.00 0.00 56.93 57.08 3h6i s PHE 62 Cb 0.03 -0.48 0.04 0.00 -1.31 0.00 0.00 43.02 41.30 3h6i s PHE 62 CO 0.17 -0.03 0.43 0.00 1.83 0.00 0.00 175.22 177.62 3h6i s ALA 63 N -0.91 -1.07 0.11 11.12 0.00 -0.54 -0.10 121.76 130.37 3h6i s ALA 63 Ca -0.03 1.08 -0.11 0.00 0.00 0.00 0.00 51.96 52.89 3h6i s ALA 63 Cb -0.07 -0.53 0.01 0.00 0.00 0.00 0.00 23.12 22.52 3h6i s ALA 63 CO 0.01 -0.23 0.26 0.00 0.00 0.00 0.00 175.76 175.80 3h6i s ALA 64 N -0.13 -0.42 0.02 0.00 0.00 -0.26 -0.32 121.76 120.66 3h6i s ALA 64 Ca -0.03 -0.47 0.02 0.00 0.00 0.00 0.00 51.96 51.48 3h6i s ALA 64 Cb -0.03 0.58 -0.02 0.00 0.00 0.00 0.00 23.12 23.65 3h6i s ALA 64 CO 0.02 -0.56 -0.07 0.00 0.00 0.00 0.00 175.76 175.15 3h6i s ALA 65 N -3.85 0.53 0.00 0.00 0.00 -0.57 -4.85 121.76 113.01 3h6i s ALA 65 Ca 0.05 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.46 3h6i s ALA 65 Cb 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.14 3h6i s ALA 65 CO -0.10 0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.10 3h6i n GLY 66 N 2.06 0.41 3.64 0.00 0.00 -1.26 -1.23 105.19 108.81 3h6i n GLY 66 Ca -0.19 -1.77 -0.43 0.00 0.00 0.00 0.00 46.02 43.63 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 -0.94 4.04 0.16 1.61 2.20 -0.30 -4.90 119.74 121.61 3h6i s LYS 67 Ca 0.00 1.17 -0.26 0.00 -0.36 0.00 0.00 55.97 56.52 3h6i s LYS 67 Cb 0.00 -3.78 0.03 0.00 -1.51 0.00 0.00 37.83 32.57 3h6i s LYS 67 CO 0.00 -0.95 1.57 0.35 -0.36 0.00 0.00 175.35 175.97 3h6i h PHE 68 N 8.42 -1.22 -0.63 4.03 3.57 -1.96 -1.61 116.94 127.54 3h6i h PHE 68 Ca -0.22 0.07 0.17 0.00 3.53 0.00 0.00 57.97 61.52 3h6i h PHE 68 Cb 1.07 0.61 -0.03 0.00 2.79 0.00 0.00 35.95 40.39 3h6i h PHE 68 CO 0.84 -0.43 0.45 -2.95 -2.23 0.00 0.00 178.31 174.00 3h6i h ASN 69 N -0.27 0.06 0.13 0.41 -0.00 -1.99 -0.03 115.58 113.90 3h6i h ASN 69 Ca 0.16 0.00 -0.20 0.00 -0.00 0.00 0.00 56.30 56.26 3h6i h ASN 69 Cb 0.57 -0.01 0.02 0.00 -0.00 0.00 0.00 38.32 38.90 3h6i h ASN 69 CO -0.63 0.03 -0.94 -0.33 -0.00 0.00 0.00 177.43 175.56 3h6i h GLU 70 N 0.06 0.28 0.00 4.14 5.08 -1.73 -3.04 114.58 119.38 3h6i h GLU 70 Ca 0.30 -0.48 -0.14 0.00 -1.00 0.00 0.00 59.36 58.04 3h6i h GLU 70 Cb 1.12 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 3h6i h GLU 70 CO -0.02 1.23 -0.66 0.27 -1.00 0.00 0.00 179.01 178.83 3h6i h PHE 71 N -0.37 0.00 -0.28 4.33 -5.15 -0.83 -2.82 116.94 111.82 3h6i h PHE 71 Ca -0.18 0.00 -0.10 0.00 -0.20 0.00 0.00 57.97 57.49 3h6i h PHE 71 Cb 1.66 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.82 3h6i h PHE 71 CO 0.18 0.66 -0.26 0.22 -2.00 0.00 0.00 178.31 177.11 3h6i h ASP 72 N 0.00 0.55 -0.26 -0.68 3.58 -1.15 0.38 116.42 118.85 3h6i h ASP 72 Ca -0.01 -0.19 -0.06 0.00 0.42 0.00 0.00 57.03 57.19 3h6i h ASP 72 Cb 1.38 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 42.26 3h6i h ASP 72 CO 0.09 0.80 -0.04 -1.13 -2.88 0.00 0.00 179.24 176.07 3h6i h ASN 73 N 0.48 0.58 0.35 2.28 -1.24 -1.39 -0.96 115.58 115.68 3h6i h ASN 73 Ca 0.07 -0.13 -0.22 0.00 0.71 0.00 0.00 56.30 56.72 3h6i h ASN 73 Cb 0.70 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.60 3h6i h ASN 73 CO 0.05 0.68 -0.94 -0.07 -1.29 0.00 0.00 177.43 175.86 3h6i h LEU 74 N 0.57 0.52 -0.27 0.34 3.38 -1.21 -1.42 115.31 117.22 3h6i h LEU 74 Ca 0.11 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3h6i h LEU 74 Cb 0.42 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3h6i h LEU 74 CO 0.02 1.22 0.18 -0.09 0.09 0.00 0.00 178.44 179.85 3h6i h ARG 75 N 0.22 0.35 -0.43 1.13 2.43 -0.39 0.80 114.38 118.49 3h6i h ARG 75 Ca -0.08 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 3h6i h ARG 75 Cb 1.58 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 31.03 3h6i h ARG 75 CO 0.16 0.23 0.16 0.00 -1.51 0.00 0.00 179.97 179.02 3h6i h ARG 76 N 0.36 0.65 -0.71 0.20 3.08 -1.16 -1.22 114.38 115.59 3h6i h ARG 76 Ca 0.10 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3h6i h ARG 76 Cb -0.04 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.87 3h6i h ARG 76 CO -0.02 0.61 0.42 0.78 -1.07 0.00 0.00 179.97 180.69 3h6i h GLY 77 N 0.56 1.03 1.10 0.04 0.00 -0.98 -0.99 103.07 103.84 3h6i h GLY 77 Ca 0.14 -0.43 -0.15 0.00 0.00 0.00 0.00 47.33 46.89 3h6i h GLY 77 CO -0.01 0.42 -0.36 -1.33 0.00 0.00 0.00 176.54 175.25 3h6i h GLY 78 N 1.02 0.99 1.11 4.60 0.00 -0.29 -1.44 103.07 109.04 3h6i h GLY 78 Ca 0.26 -1.01 -0.07 0.00 0.00 0.00 0.00 47.33 46.51 3h6i h GLY 78 CO -0.05 0.91 0.15 -2.22 0.00 0.00 0.00 176.54 175.34 3h6i h ILE 79 N 0.72 1.26 -0.51 2.60 2.04 -0.64 -0.08 117.51 122.90 3h6i h ILE 79 Ca 0.06 -0.98 -0.05 0.00 1.00 0.00 0.00 64.86 64.89 3h6i h ILE 79 Cb 0.96 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 3h6i h ILE 79 CO 0.09 0.37 0.12 -0.61 0.00 0.00 0.00 178.15 178.12 3h6i h GLN 80 N 1.04 0.83 -0.02 2.37 5.75 -1.07 -0.75 115.11 123.26 3h6i h GLN 80 Ca 0.22 -0.20 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 3h6i h GLN 80 Cb 0.38 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.83 3h6i h GLN 80 CO 0.00 0.80 -0.00 0.35 -2.65 0.00 0.00 178.83 177.33 3h6i h PHE 81 N 0.72 0.05 -0.63 3.99 3.57 -1.01 -2.31 116.94 121.32 3h6i h PHE 81 Ca 0.16 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.65 3h6i h PHE 81 Cb 0.35 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 3h6i h PHE 81 CO 0.02 0.37 0.41 0.00 -2.23 0.00 0.00 178.31 176.88 3h6i h ALA 82 N 0.67 0.80 -0.52 2.41 0.00 -0.83 -1.42 119.26 120.37 3h6i h ALA 82 Ca 0.01 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 3h6i h ALA 82 Cb 0.36 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3h6i h ALA 82 CO 0.00 0.24 -0.13 -0.44 0.00 0.00 0.00 179.25 178.92 3h6i h ASP 83 N 0.85 1.01 -0.37 0.00 3.32 -1.14 -0.78 116.42 119.32 3h6i h ASP 83 Ca 0.23 -0.34 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 3h6i h ASP 83 Cb -0.08 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.18 3h6i h ASP 83 CO -0.05 1.13 0.08 0.74 -1.72 0.00 0.00 179.24 179.42 3h6i h THR 84 N 0.88 1.23 -0.48 0.35 2.02 -1.30 -2.00 112.91 113.62 3h6i h THR 84 Ca 0.13 -0.80 -0.05 0.00 0.77 0.00 0.00 66.41 66.46 3h6i h THR 84 Cb 0.70 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 68.14 3h6i h THR 84 CO 0.05 0.27 0.12 0.03 0.37 0.00 0.00 175.52 176.36 3h6i h ARG 85 N 0.45 0.77 0.00 6.66 2.47 -1.10 -1.05 114.38 122.58 3h6i h ARG 85 Ca 0.11 -0.18 -0.10 0.00 -1.26 0.00 0.00 59.98 58.55 3h6i h ARG 85 Cb 0.33 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 3h6i h ARG 85 CO 0.00 0.75 -0.46 0.78 0.56 0.00 0.00 179.97 181.61 3h6i h GLY 86 N 0.65 0.00 1.26 0.04 0.00 -1.07 -0.47 103.07 103.47 3h6i h GLY 86 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.15 3h6i h GLY 86 CO 0.00 0.00 -1.42 -1.82 0.00 0.00 0.00 176.54 173.30 3h6i h TYR 87 N 0.00 1.00 0.00 5.60 3.20 -1.01 -3.15 116.97 122.61 3h6i h TYR 87 Ca -0.00 -0.70 -0.11 0.00 3.14 0.00 0.00 58.73 61.05 3h6i h TYR 87 Cb 0.82 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.02 3h6i h TYR 87 CO 0.00 1.54 -0.54 0.00 -1.64 0.00 0.00 178.16 177.52 3h6i h ALA 88 N 0.19 0.79 -3.00 1.82 0.00 -1.03 -3.45 119.26 114.58 3h6i h ALA 88 Ca -0.24 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.18 3h6i h ALA 88 Cb 2.11 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.81 3h6i h ALA 88 CO 0.27 0.68 0.00 0.66 0.00 0.00 0.00 179.25 180.85 3h6i n TYR 89 N -3.44 0.00 -3.86 0.00 4.01 -0.20 -5.08 117.16 108.59 3h6i n TYR 89 Ca 0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.65 3h6i n TYR 89 Cb 0.66 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.64 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 0.77 -0.10 0.44 7.72 1.47 -1.19 -4.98 116.67 120.79 3h6i s ASP 90 Ca 0.00 -0.70 0.13 0.00 1.18 0.00 0.00 52.55 53.16 3h6i s ASP 90 Cb 0.00 0.51 0.96 0.00 -0.34 0.00 0.00 42.92 44.05 3h6i s ASP 90 CO 0.00 -0.98 2.00 0.03 0.68 0.00 0.00 175.17 176.89 3h6i h ARG 91 N 2.37 0.11 0.00 2.11 3.08 -1.90 -2.56 114.38 117.59 3h6i h ARG 91 Ca -0.30 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.73 3h6i h ARG 91 Cb 1.24 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.28 3h6i h ARG 91 CO 0.42 0.23 0.00 -2.13 -1.07 0.00 0.00 179.97 177.42 3h6i n ARG 92 N -4.35 0.03 0.16 0.04 0.63 -1.26 -2.53 116.66 109.38 3h6i n ARG 92 Ca -0.02 0.31 0.02 0.00 -0.92 0.00 0.00 57.85 57.24 3h6i n ARG 92 Cb 0.22 -1.55 0.25 0.00 0.45 0.00 0.00 32.46 31.82 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 -3.15 6.15 3.58 -1.83 -3.42 116.42 117.76 3h6i h ASP 93 Ca 0.00 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 56.88 3h6i h ASP 93 Cb 0.23 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.22 3h6i h ASP 93 CO 0.00 0.50 0.71 -0.69 -2.88 0.00 0.00 179.24 176.88 3h6i s VAL 94 N -3.60 4.72 0.19 2.25 1.01 -1.05 -4.94 120.40 118.98 3h6i s VAL 94 Ca -0.01 2.00 0.00 0.00 0.00 0.00 0.00 61.98 63.98 3h6i s VAL 94 Cb 0.12 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 3h6i s VAL 94 CO 0.73 -0.12 0.08 0.42 0.00 0.00 0.00 175.10 176.21 3h6i s THR 95 N 2.81 0.30 0.04 3.92 -4.23 -1.26 -4.95 115.64 112.27 3h6i s THR 95 Ca 0.45 -1.97 -0.24 0.00 -1.18 0.00 0.00 61.69 58.74 3h6i s THR 95 Cb -0.16 -2.35 -0.17 0.00 1.34 0.00 0.00 72.50 71.16 3h6i s THR 95 CO 0.10 -0.21 1.51 1.23 -0.54 0.00 0.00 174.62 176.71 3h6i h GLY 96 N 2.63 0.02 1.01 3.99 0.00 -1.94 -2.20 103.07 106.58 3h6i h GLY 96 Ca -0.36 -0.01 0.01 0.00 0.00 0.00 0.00 47.33 46.96 3h6i h GLY 96 CO 0.58 0.01 0.63 -0.09 0.00 0.00 0.00 176.54 177.68 3h6i h ARG 97 N -0.22 1.31 -0.01 4.80 2.43 -1.97 0.37 114.38 121.09 3h6i h ARG 97 Ca 0.00 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 3h6i h ARG 97 Cb 0.24 -0.29 -0.00 0.00 -0.42 0.00 0.00 29.97 29.51 3h6i h ARG 97 CO 0.00 0.88 0.01 0.37 -1.51 0.00 0.00 179.97 179.72 3h6i h GLN 98 N 1.34 0.01 -0.35 0.20 4.15 -1.90 -0.93 115.11 117.63 3h6i h GLN 98 Ca 0.36 -0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.69 3h6i h GLN 98 Cb -0.13 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 3h6i h GLN 98 CO -0.07 0.03 -0.16 -0.07 -1.93 0.00 0.00 178.83 176.63 3h6i h LEU 99 N -0.01 0.62 -1.73 -2.39 3.38 -0.77 -1.90 115.31 112.52 3h6i h LEU 99 Ca 0.00 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 3h6i h LEU 99 Cb 0.02 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3h6i h LEU 99 CO -0.00 0.79 -0.08 0.00 0.09 0.00 0.00 178.44 179.24 3h6i h ALA 100 N 1.27 1.07 0.16 1.53 0.00 -0.00 -1.93 119.26 121.36 3h6i h ALA 100 Ca 0.09 -0.07 -0.33 0.00 0.00 0.00 0.00 54.91 54.61 3h6i h ALA 100 Cb 0.59 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.37 3h6i h ALA 100 CO 0.04 0.10 -1.61 -0.97 0.00 0.00 0.00 179.25 176.80 3h6i h ASN 101 N 0.00 0.54 -0.91 0.00 -1.24 -0.49 -3.09 115.58 110.40 3h6i h ASN 101 Ca -0.00 -0.75 0.01 0.00 0.71 0.00 0.00 56.30 56.27 3h6i h ASN 101 Cb 0.44 -0.18 -0.04 0.00 0.73 0.00 0.00 38.32 39.27 3h6i h ASN 101 CO 0.01 1.62 0.59 0.58 -1.29 0.00 0.00 177.43 178.94 3h6i h VAL 102 N 0.09 1.24 -0.34 2.57 2.07 -1.00 -1.24 116.25 119.65 3h6i h VAL 102 Ca -0.29 -0.46 -0.11 0.00 0.82 0.00 0.00 66.70 66.67 3h6i h VAL 102 Cb 2.07 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 3h6i h VAL 102 CO 0.18 0.24 -0.23 1.88 0.02 0.00 0.00 177.57 179.65 3h6i h TYR 103 N 1.24 0.76 -0.50 1.57 0.05 -1.47 -0.97 116.97 117.65 3h6i h TYR 103 Ca 0.33 -0.17 -0.07 0.00 0.05 0.00 0.00 58.73 58.88 3h6i h TYR 103 Cb -0.12 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.42 3h6i h TYR 103 CO 0.00 0.84 0.05 0.00 -1.05 0.00 0.00 178.16 178.01 3h6i h ALA 104 N 1.16 0.67 -0.31 3.88 0.00 -1.32 0.19 119.26 123.54 3h6i h ALA 104 Ca 0.08 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3h6i h ALA 104 Cb 0.71 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3h6i h ALA 104 CO 0.05 0.44 0.01 1.96 0.00 0.00 0.00 179.25 181.71 3h6i h GLN 105 N 0.73 0.54 0.03 0.00 1.08 -1.08 -0.45 115.11 115.95 3h6i h GLN 105 Ca 0.15 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 3h6i h GLN 105 Cb 0.44 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 3h6i h GLN 105 CO 0.02 0.67 -0.02 1.15 -0.95 0.00 0.00 178.83 179.70 3h6i h THR 106 N 0.34 1.12 -0.69 -0.54 2.02 -0.89 -1.33 112.91 112.94 3h6i h THR 106 Ca 0.09 -0.48 -0.06 0.00 0.77 0.00 0.00 66.41 66.72 3h6i h THR 106 Cb 0.42 1.44 -0.03 0.00 -1.74 0.00 0.00 68.15 68.25 3h6i h THR 106 CO 0.01 0.12 0.19 -0.07 0.37 0.00 0.00 175.52 176.14 3h6i h LEU 107 N -0.25 1.01 -0.71 2.58 3.38 -0.64 -1.71 115.31 118.97 3h6i h LEU 107 Ca -0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 3h6i h LEU 107 Cb 0.24 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3h6i h LEU 107 CO 0.01 0.96 0.40 1.23 0.09 0.00 0.00 178.44 181.13 3h6i h GLY 108 N 1.08 1.05 1.27 0.83 0.00 -1.02 0.11 103.07 106.38 3h6i h GLY 108 Ca 0.22 -0.46 -0.13 0.00 0.00 0.00 0.00 47.33 46.96 3h6i h GLY 108 CO -0.00 0.45 -0.25 -0.84 0.00 0.00 0.00 176.54 175.89 3h6i h THR 109 N 0.97 1.27 -0.19 4.70 2.02 -1.04 -2.68 112.91 117.97 3h6i h THR 109 Ca 0.25 -1.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.02 3h6i h THR 109 Cb 0.01 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 3h6i h THR 109 CO -0.04 0.47 0.04 0.40 0.37 0.00 0.00 175.52 176.75 3h6i h ILE 110 N 0.72 1.22 -0.27 3.11 2.04 -0.78 0.20 117.51 123.76 3h6i h ILE 110 Ca 0.09 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.31 3h6i h ILE 110 Cb 0.79 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 3h6i h ILE 110 CO 0.07 0.21 0.19 0.15 0.00 0.00 0.00 178.15 178.77 3h6i h PHE 111 N 0.10 0.08 0.00 1.37 3.57 -0.93 -1.57 116.94 119.56 3h6i h PHE 111 Ca 0.06 0.00 -0.43 0.00 3.53 0.00 0.00 57.97 61.12 3h6i h PHE 111 Cb 0.29 -0.02 -0.07 0.00 2.79 0.00 0.00 35.95 38.94 3h6i h PHE 111 CO 0.02 0.04 -2.47 2.41 -2.23 0.00 0.00 178.31 176.08 3h6i n THR 112 N -4.47 1.52 0.75 4.41 -1.04 -1.02 -4.70 114.28 109.73 3h6i n THR 112 Ca 0.03 -0.43 0.11 0.00 -2.04 0.00 0.00 64.05 61.72 3h6i n THR 112 Cb 0.29 -1.75 -0.00 0.00 -1.82 0.00 0.00 70.33 67.05 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 -3.96 0.17 -4.02 -2.82 4.71 0.70 -4.95 120.64 110.47 3h6i n GLU 113 Ca -0.51 -0.02 -0.31 0.00 -0.01 0.00 0.00 57.16 56.31 3h6i n GLU 113 Cb 0.91 -1.54 -0.06 0.00 -1.01 0.00 0.00 31.44 29.75 3h6i n GLU 113 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 3h6i s GLN 114 N -3.12 3.12 0.38 3.49 -0.21 -0.59 -5.02 119.66 117.70 3h6i s GLN 114 Ca 0.06 -0.54 0.11 0.00 0.02 0.00 0.00 55.36 55.00 3h6i s GLN 114 Cb 0.15 -2.87 0.89 0.00 1.00 0.00 0.00 33.01 32.18 3h6i s GLN 114 CO 0.81 0.61 1.89 0.00 -2.12 0.00 0.00 175.29 176.48 3h6i h ALA 115 N 3.49 1.92 -3.30 6.09 0.00 -1.93 -3.40 119.26 122.14 3h6i h ALA 115 Ca -0.47 0.01 -0.52 0.00 0.00 0.00 0.00 54.91 53.93 3h6i h ALA 115 Cb 1.17 -0.10 -0.35 0.00 0.00 0.00 0.00 17.79 18.50 3h6i h ALA 115 CO 0.68 -0.15 -0.81 0.21 0.00 0.00 0.00 179.25 179.18 3h6i s LYS 116 N -5.59 1.60 0.87 0.00 2.20 -1.26 -5.12 119.74 112.43 3h6i s LYS 116 Ca -0.09 -0.33 -0.11 0.00 -0.36 0.00 0.00 55.97 55.08 3h6i s LYS 116 Cb 0.22 -1.49 0.11 0.00 -1.51 0.00 0.00 37.83 35.16 3h6i s LYS 116 CO 0.78 -0.12 1.11 -1.25 -0.36 0.00 0.00 175.35 175.51 3h6i s PRO 117 N 1.19 1.45 -0.01 4.03 0.04 -1.26 -4.87 135.00 135.57 3h6i s PRO 117 Ca -0.05 1.28 -0.28 0.00 0.04 0.00 0.00 61.00 62.00 3h6i s PRO 117 Cb -0.14 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 3h6i s PRO 117 CO -0.02 -2.25 0.88 0.71 0.04 0.00 0.00 177.00 176.36 3h6i s TYR 118 N -2.77 3.65 -1.40 0.56 1.51 -1.26 -4.92 117.35 112.72 3h6i s TYR 118 Ca 0.64 1.55 -0.10 0.00 -1.01 0.00 0.00 57.07 58.15 3h6i s TYR 118 Cb -0.20 -3.00 0.08 0.00 -0.11 0.00 0.00 41.96 38.73 3h6i s TYR 118 CO 0.57 0.06 2.23 0.39 -1.11 0.00 0.00 175.55 177.69 3h6i n GLU 119 N 3.70 3.55 -4.08 -0.62 1.02 -1.26 -4.73 120.64 118.22 3h6i n GLU 119 Ca 0.03 -3.03 -0.07 0.00 -0.02 0.00 0.00 57.16 54.07 3h6i n GLU 119 Cb 0.51 -2.97 -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 1.28 0.21 -0.02 2.62 -7.23 -1.26 -1.15 120.40 114.86 3h6i s VAL 120 Ca 0.49 -1.77 0.00 0.00 -1.81 0.00 0.00 61.98 58.89 3h6i s VAL 120 Cb 0.14 -1.49 0.03 0.00 0.56 0.00 0.00 36.38 35.62 3h6i s VAL 120 CO -0.05 -0.98 0.01 -0.70 -0.31 0.00 0.00 175.10 173.07 3h6i s GLU 121 N -3.86 0.17 0.08 4.82 2.12 -0.37 -3.18 118.70 118.49 3h6i s GLU 121 Ca 0.06 0.11 0.10 0.00 0.36 0.00 0.00 54.97 55.60 3h6i s GLU 121 Cb 0.07 -0.38 -0.03 0.00 0.26 0.00 0.00 34.13 34.05 3h6i s GLU 121 CO -0.10 -0.14 -0.27 -0.51 -0.54 0.00 0.00 175.26 173.71 3h6i s LEU 122 N 0.98 2.23 -0.10 2.70 1.02 0.41 -1.51 118.68 124.41 3h6i s LEU 122 Ca -0.09 -0.66 0.02 0.00 0.02 0.00 0.00 54.13 53.42 3h6i s LEU 122 Cb -0.13 -1.25 0.01 0.00 0.02 0.00 0.00 46.19 44.84 3h6i s LEU 122 CO -0.02 0.22 -0.15 0.00 0.02 0.00 0.00 176.35 176.42 3h6i s VAL 124 N 0.94 2.70 0.12 0.00 1.01 -0.86 -1.46 120.40 122.85 3h6i s VAL 124 Ca -0.08 -0.74 0.11 0.00 0.00 0.00 0.00 61.98 61.27 3h6i s VAL 124 Cb -0.15 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 3h6i s VAL 124 CO -0.01 0.49 -0.27 0.00 0.00 0.00 0.00 175.10 175.32 3h6i s ALA 125 N 1.16 2.38 -0.02 5.51 0.00 -0.76 -1.10 121.76 128.93 3h6i s ALA 125 Ca 0.01 -1.45 0.01 0.00 0.00 0.00 0.00 51.96 50.53 3h6i s ALA 125 Cb -0.14 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.59 3h6i s ALA 125 CO -0.05 0.54 -0.02 -2.00 0.00 0.00 0.00 175.76 174.23 3h6i s GLU 126 N -1.99 0.31 0.42 0.00 2.12 -0.30 -0.50 118.70 118.77 3h6i s GLU 126 Ca 0.14 -0.03 0.07 0.00 0.36 0.00 0.00 54.97 55.51 3h6i s GLU 126 Cb -0.10 -0.39 -0.04 0.00 0.26 0.00 0.00 34.13 33.86 3h6i s GLU 126 CO 0.06 -0.03 0.23 0.14 -0.54 0.00 0.00 175.26 175.11 3h6i s VAL 127 N 0.48 2.33 0.72 3.70 -7.23 -0.95 -1.06 120.40 118.39 3h6i s VAL 127 Ca -0.05 -1.62 -0.13 0.00 -1.81 0.00 0.00 61.98 58.37 3h6i s VAL 127 Cb -0.08 -2.95 0.03 0.00 0.56 0.00 0.00 36.38 33.94 3h6i s VAL 127 CO -0.01 0.00 1.10 0.00 -0.31 0.00 0.00 175.10 175.88 3h6i s ALA 128 N -2.59 2.35 0.68 1.32 0.00 -1.26 -4.85 121.76 117.41 3h6i s ALA 128 Ca 0.42 0.42 -0.13 0.00 0.00 0.00 0.00 51.96 52.66 3h6i s ALA 128 Cb 0.02 -3.30 0.01 0.00 0.00 0.00 0.00 23.12 19.85 3h6i s ALA 128 CO 0.23 -1.54 1.08 -1.01 0.00 0.00 0.00 175.76 174.52 3h6i s HIS 129 N -2.61 2.84 0.20 0.00 3.76 -1.26 -4.81 115.29 113.41 3h6i s HIS 129 Ca 0.64 1.51 -0.33 0.00 -0.15 0.00 0.00 55.06 56.73 3h6i s HIS 129 Cb -0.19 -3.02 -0.14 0.00 1.11 0.00 0.00 32.58 30.34 3h6i s HIS 129 CO 0.49 -1.44 1.42 0.98 -0.85 0.00 0.00 174.74 175.35 3h6i n TYR 130 N -2.78 2.05 -1.00 1.40 9.36 -1.26 -2.00 117.16 122.93 3h6i n TYR 130 Ca 0.09 0.43 -0.00 0.00 3.32 0.00 0.00 57.90 61.74 3h6i n TYR 130 Cb 0.53 -2.45 -0.00 0.00 -0.63 0.00 0.00 39.34 36.78 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 2.53 0.37 3.66 2.98 0.00 -1.26 -5.02 105.19 108.45 3h6i n GLY 131 Ca 0.14 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.53 2.34 -0.30 1.61 2.02 -0.85 -5.11 118.70 117.88 3h6i s GLU 132 Ca 0.00 -1.37 0.03 0.00 0.02 0.00 0.00 54.97 53.64 3h6i s GLU 132 Cb 0.00 -2.20 0.09 0.00 0.10 0.00 0.00 34.13 32.12 3h6i s GLU 132 CO 0.00 0.37 0.01 0.95 0.02 0.00 0.00 175.26 176.62 3h6i s THR 133 N -2.27 1.91 -0.05 3.63 -4.23 -1.26 -4.79 115.64 108.59 3h6i s THR 133 Ca 0.31 -1.89 -0.04 0.00 -1.18 0.00 0.00 61.69 58.90 3h6i s THR 133 Cb -0.07 -2.31 0.01 0.00 1.34 0.00 0.00 72.50 71.48 3h6i s THR 133 CO 0.20 -0.43 0.12 -0.75 -0.54 0.00 0.00 174.62 173.22 3h6i s LYS 134 N 1.13 0.13 0.22 3.99 2.20 -1.26 -5.11 119.74 121.04 3h6i s LYS 134 Ca 0.05 0.19 -0.30 0.00 -0.36 0.00 0.00 55.97 55.55 3h6i s LYS 134 Cb -0.19 0.04 -0.09 0.00 -1.51 0.00 0.00 37.83 36.08 3h6i s LYS 134 CO -0.10 -0.04 1.16 1.03 -0.36 0.00 0.00 175.35 177.05 3h6i s ARG 135 N 0.20 4.54 0.35 4.03 0.52 -1.26 -4.40 118.95 122.94 3h6i s ARG 135 Ca -0.01 1.85 -0.27 0.00 -0.52 0.00 0.00 55.73 56.78 3h6i s ARG 135 Cb -0.02 -3.22 -0.12 0.00 0.52 0.00 0.00 34.95 32.11 3h6i s ARG 135 CO -0.01 0.02 1.21 -2.30 0.02 0.00 0.00 175.30 174.25 3h6i n PRO 136 N 1.96 1.89 -4.69 3.54 -0.02 -1.26 -4.86 135.00 131.56 3h6i n PRO 136 Ca 0.02 0.67 -0.33 0.00 -2.02 0.00 0.00 63.50 61.83 3h6i n PRO 136 Cb 0.45 -2.23 -0.13 0.00 -0.02 0.00 0.00 33.50 31.57 3h6i n PRO 136 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3h6i s GLU 137 N -1.90 3.17 -0.07 -0.52 2.02 -0.22 -4.98 118.70 116.20 3h6i s GLU 137 Ca 0.58 -0.62 0.03 0.00 0.02 0.00 0.00 54.97 54.97 3h6i s GLU 137 Cb -0.58 -2.64 0.01 0.00 0.10 0.00 0.00 34.13 31.02 3h6i s GLU 137 CO 0.61 0.38 -0.14 -0.51 0.02 0.00 0.00 175.26 175.62 3h6i s LEU 138 N -0.06 1.72 0.07 1.80 1.02 -1.23 -1.15 118.68 120.86 3h6i s LEU 138 Ca -0.01 -0.33 0.08 0.00 0.02 0.00 0.00 54.13 53.88 3h6i s LEU 138 Cb -0.14 -0.90 -0.03 0.00 0.02 0.00 0.00 46.19 45.14 3h6i s LEU 138 CO 0.03 0.06 -0.21 -0.31 0.02 0.00 0.00 176.35 175.94 3h6i s TYR 139 N 0.57 1.80 -0.16 0.29 1.51 -0.26 -1.70 117.35 119.39 3h6i s TYR 139 Ca -0.14 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.54 3h6i s TYR 139 Cb -0.16 -1.03 0.01 0.00 -0.11 0.00 0.00 41.96 40.67 3h6i s TYR 139 CO 0.04 0.15 -0.19 0.50 -1.11 0.00 0.00 175.55 174.93 3h6i s ARG 140 N -1.53 3.07 -0.15 -0.62 3.52 -0.46 -2.02 118.95 120.75 3h6i s ARG 140 Ca 0.07 -0.82 0.01 0.00 -0.13 0.00 0.00 55.73 54.86 3h6i s ARG 140 Cb -0.09 -2.53 0.00 0.00 -1.56 0.00 0.00 34.95 30.77 3h6i s ARG 140 CO 0.03 -0.06 -0.17 0.42 -0.81 0.00 0.00 175.30 174.70 3h6i s ILE 141 N 0.95 2.47 0.37 4.11 1.09 0.10 -1.20 121.20 129.09 3h6i s ILE 141 Ca -0.03 -0.84 0.07 0.00 -1.10 0.00 0.00 60.65 58.75 3h6i s ILE 141 Cb -0.15 -2.03 -0.01 0.00 -1.06 0.00 0.00 42.46 39.21 3h6i s ILE 141 CO -0.04 0.53 0.43 0.42 -0.10 0.00 0.00 174.94 176.18 3h6i s THR 142 N 0.84 3.48 0.59 2.92 -4.23 -0.57 -0.44 115.64 118.22 3h6i s THR 142 Ca -0.05 -1.14 0.30 0.00 -1.18 0.00 0.00 61.69 59.61 3h6i s THR 142 Cb -0.15 -3.20 0.42 0.00 1.34 0.00 0.00 72.50 70.91 3h6i s THR 142 CO -0.01 -0.10 1.64 0.10 -0.54 0.00 0.00 174.62 175.71 3h6i h TYR 143 N 0.94 0.00 -0.01 3.99 -0.00 -1.83 0.17 116.97 120.22 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 0.46 0.00 -0.51 -0.40 -0.00 0.00 0.00 178.16 177.71 3h6i n ASP 144 N -3.58 1.70 0.00 0.10 5.75 -1.26 -4.55 116.55 114.71 3h6i n ASP 144 Ca 0.17 -1.32 0.00 0.00 -0.01 0.00 0.00 54.79 53.64 3h6i n ASP 144 Cb 1.12 0.48 0.00 0.00 -1.03 0.00 0.00 41.12 41.69 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 0.05 -4.06 105.19 113.42 3h6i n GLY 145 Ca 0.09 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3h6i n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6i s SER 146 N -2.02 7.26 -0.10 1.61 0.01 -1.25 -4.77 113.70 114.43 3h6i s SER 146 Ca 0.00 1.51 0.03 0.00 1.31 0.00 0.00 55.95 58.80 3h6i s SER 146 Cb 0.00 -2.49 -0.01 0.00 0.21 0.00 0.00 66.02 63.73 3h6i s SER 146 CO 0.00 -0.03 -0.20 -0.51 0.41 0.00 0.00 173.24 172.91 3h6i s ILE 147 N 0.08 2.43 -0.08 1.44 2.07 -1.26 -1.51 121.20 124.37 3h6i s ILE 147 Ca 0.41 -0.89 0.03 0.00 -1.41 0.00 0.00 60.65 58.78 3h6i s ILE 147 Cb -0.21 -1.96 0.01 0.00 0.13 0.00 0.00 42.46 40.43 3h6i s ILE 147 CO 0.24 0.55 -0.17 0.00 -1.91 0.00 0.00 174.94 173.65 3h6i s ALA 148 N 0.25 1.65 -0.54 1.50 0.00 -0.34 -4.99 121.76 119.30 3h6i s ALA 148 Ca -0.14 -0.66 -0.20 0.00 0.00 0.00 0.00 51.96 50.97 3h6i s ALA 148 Cb -0.17 -0.68 0.06 0.00 0.00 0.00 0.00 23.12 22.33 3h6i s ALA 148 CO 0.07 0.17 0.72 0.34 0.00 0.00 0.00 175.76 177.06 3h6i s ASP 149 N 0.55 6.24 -0.20 0.00 -1.08 -1.26 -1.36 116.67 119.56 3h6i s ASP 149 Ca -0.16 -0.87 -0.10 0.00 -0.52 0.00 0.00 52.55 50.90 3h6i s ASP 149 Cb -0.17 -2.33 -0.05 0.00 -1.46 0.00 0.00 42.92 38.91 3h6i s ASP 149 CO 0.06 -1.02 0.14 -1.61 0.52 0.00 0.00 175.17 173.25 3h6i s GLU 150 N 3.00 4.18 0.27 4.34 0.41 -0.69 -5.02 118.70 125.18 3h6i s GLU 150 Ca 0.18 -0.21 0.22 0.00 -0.41 0.00 0.00 54.97 54.75 3h6i s GLU 150 Cb -0.18 -3.41 0.10 0.00 -1.78 0.00 0.00 34.13 28.86 3h6i s GLU 150 CO 0.13 0.31 1.24 -1.00 -0.49 0.00 0.00 175.26 175.44 3h6i h PRO 151 N 6.63 0.00 0.00 0.39 0.13 -1.94 -3.25 132.00 133.96 3h6i h PRO 151 Ca -0.41 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.65 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 0.76 0.06 -1.22 0.72 -0.23 0.00 0.00 178.00 178.09 3h6i n HIS 152 N -2.88 0.00 -3.77 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 0.58 -0.14 -0.05 0.00 1.12 0.00 0.00 29.99 31.50 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 -2.07 0.00 -0.02 4.41 -0.12 -1.26 -1.92 117.98 117.00 3h6i s PHE 153 Ca -0.06 -0.35 0.02 0.00 -0.05 0.00 0.00 56.93 56.49 3h6i s PHE 153 Cb 0.02 0.18 0.01 0.00 -0.63 0.00 0.00 43.02 42.60 3h6i s PHE 153 CO 0.07 -0.74 -0.05 0.08 -0.05 0.00 0.00 175.22 174.53 3h6i s VAL 154 N -3.87 0.47 -0.10 -2.49 1.01 0.40 -4.88 120.40 110.95 3h6i s VAL 154 Ca 0.08 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.89 3h6i s VAL 154 Cb 0.02 -0.44 0.01 0.00 0.00 0.00 0.00 36.38 35.97 3h6i s VAL 154 CO -0.07 0.16 -0.15 -0.69 0.00 0.00 0.00 175.10 174.36 3h6i s VAL 155 N 0.27 1.42 0.04 2.92 1.01 -1.26 -1.21 120.40 123.59 3h6i s VAL 155 Ca -0.03 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.37 3h6i s VAL 155 Cb -0.07 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.99 3h6i s VAL 155 CO -0.00 0.42 -0.10 -0.04 0.00 0.00 0.00 175.10 175.38 3h6i s MET 156 N 0.89 0.64 0.12 2.72 -1.94 0.71 -5.00 119.30 117.44 3h6i s MET 156 Ca -0.09 -0.75 0.00 0.00 -1.71 0.00 0.00 55.69 53.14 3h6i s MET 156 Cb -0.15 -0.51 0.00 0.00 2.01 0.00 0.00 34.83 36.18 3h6i s MET 156 CO 0.00 0.11 0.00 0.41 -0.01 0.00 0.00 175.02 175.53 3h6i n GLY 157 N 1.61 -2.99 7.00 -0.03 0.00 -1.26 0.06 105.19 109.59 3h6i n GLY 157 Ca -0.21 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3h6i n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6i n GLY 158 N -1.92 1.70 3.33 -0.02 0.00 -0.48 -4.22 105.19 103.59 3h6i n GLY 158 Ca -0.01 -0.64 -0.46 0.00 0.00 0.00 0.00 46.02 44.92 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 5.21 0.10 2.61 -4.23 -1.26 -4.32 115.64 113.75 3h6i s THR 159 Ca 0.00 -1.62 -0.14 0.00 -1.18 0.00 0.00 61.69 58.75 3h6i s THR 159 Cb 0.00 -4.41 -0.08 0.00 1.34 0.00 0.00 72.50 69.34 3h6i s THR 159 CO 0.00 -0.98 1.42 0.71 -0.54 0.00 0.00 174.62 175.23 3h6i h THR 160 N 5.65 1.30 -0.62 3.99 1.35 -1.95 -3.38 112.91 119.24 3h6i h THR 160 Ca -0.19 -1.50 0.11 0.00 -0.55 0.00 0.00 66.41 64.28 3h6i h THR 160 Cb 1.08 1.58 -0.09 0.00 -1.73 0.00 0.00 68.15 68.99 3h6i h THR 160 CO 0.99 0.48 0.15 -0.33 -0.25 0.00 0.00 175.52 176.56 3h6i h GLU 161 N 0.49 0.28 -0.08 4.72 3.07 -1.96 -2.15 114.58 118.95 3h6i h GLU 161 Ca 0.04 -0.02 -0.12 0.00 -0.50 0.00 0.00 59.36 58.76 3h6i h GLU 161 Cb 0.90 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.74 3h6i h GLU 161 CO 0.08 0.18 -0.51 -1.00 -1.40 0.00 0.00 179.01 176.37 3h6i h PRO 162 N 0.29 0.21 -0.24 2.33 0.13 -1.99 -2.95 132.00 129.77 3h6i h PRO 162 Ca 0.33 -0.12 -0.17 0.00 -0.87 0.00 0.00 66.00 65.17 3h6i h PRO 162 Cb 0.48 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.61 3h6i h PRO 162 CO -0.40 0.67 -0.52 0.82 -0.23 0.00 0.00 178.00 178.34 3h6i h ILE 163 N 0.16 1.30 -0.54 -3.56 2.04 -1.66 -2.76 117.51 112.50 3h6i h ILE 163 Ca 0.01 -1.73 -0.03 0.00 1.00 0.00 0.00 64.86 64.10 3h6i h ILE 163 Cb 0.95 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.67 3h6i h ILE 163 CO 0.08 0.55 0.21 0.00 0.00 0.00 0.00 178.15 178.99 3h6i h ALA 164 N 0.87 0.70 -0.65 1.87 0.00 -1.40 -2.41 119.26 118.24 3h6i h ALA 164 Ca 0.02 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 3h6i h ALA 164 Cb 1.08 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3h6i h ALA 164 CO 0.11 0.32 0.11 -0.91 0.00 0.00 0.00 179.25 178.87 3h6i h ASN 165 N 0.73 1.02 0.51 0.00 -0.26 -1.55 -2.49 115.58 113.55 3h6i h ASN 165 Ca 0.18 -0.24 -0.05 0.00 -0.56 0.00 0.00 56.30 55.64 3h6i h ASN 165 Cb 0.21 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 37.19 3h6i h ASN 165 CO -0.01 1.01 -0.22 0.00 -1.06 0.00 0.00 177.43 177.14 3h6i h ALA 166 N 1.11 1.24 -0.12 -0.83 0.00 -1.25 -2.15 119.26 117.27 3h6i h ALA 166 Ca 0.20 -0.20 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 3h6i h ALA 166 Cb 0.42 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.18 3h6i h ALA 166 CO 0.01 0.28 -0.80 -0.07 0.00 0.00 0.00 179.25 178.67 3h6i h LEU 167 N 0.00 0.82 -0.74 0.00 3.38 -1.20 -2.54 115.31 115.03 3h6i h LEU 167 Ca -0.00 -0.56 0.04 0.00 0.09 0.00 0.00 57.88 57.45 3h6i h LEU 167 Cb 0.54 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 3h6i h LEU 167 CO 0.03 1.34 0.46 0.50 0.09 0.00 0.00 178.44 180.87 3h6i h LYS 168 N 0.46 0.87 -0.57 1.13 1.63 -0.95 2.84 116.57 121.97 3h6i h LYS 168 Ca -0.06 -0.05 -0.11 0.00 -0.85 0.00 0.00 60.65 59.58 3h6i h LYS 168 Cb 1.42 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 32.84 3h6i h LYS 168 CO 0.16 0.57 -0.07 1.49 -3.45 0.00 0.00 179.45 178.15 3h6i h GLU 169 N 0.89 1.06 -0.38 1.90 4.22 -1.48 -3.28 114.58 117.52 3h6i h GLU 169 Ca 0.30 -0.38 0.00 0.00 0.08 0.00 0.00 59.36 59.37 3h6i h GLU 169 Cb 0.05 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3h6i h GLU 169 CO -0.12 1.08 0.00 -1.13 -2.18 0.00 0.00 179.01 176.65 3h6i n SER 170 N -4.15 3.65 -4.69 1.04 3.41 -0.40 -4.97 113.62 107.50 3h6i n SER 170 Ca 0.02 -2.46 -0.40 0.00 -0.26 0.00 0.00 58.87 55.78 3h6i n SER 170 Cb 0.39 -0.41 -0.05 0.00 -0.26 0.00 0.00 64.21 63.87 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 -1.83 3.47 -0.10 7.33 5.04 0.94 -4.86 117.35 127.34 3h6i s TYR 171 Ca 0.36 1.04 0.02 0.00 -2.44 0.00 0.00 57.07 56.05 3h6i s TYR 171 Cb 0.24 -2.76 0.01 0.00 0.35 0.00 0.00 41.96 39.81 3h6i s TYR 171 CO 0.15 -0.02 -0.15 0.00 -1.34 0.00 0.00 175.55 174.19 3h6i s ALA 172 N 1.28 1.67 0.47 3.97 0.00 -1.26 -4.98 121.76 122.91 3h6i s ALA 172 Ca 0.32 -0.71 -0.23 0.00 0.00 0.00 0.00 51.96 51.34 3h6i s ALA 172 Cb -0.16 -0.81 -0.07 0.00 0.00 0.00 0.00 23.12 22.08 3h6i s ALA 172 CO 0.13 -0.05 1.19 -1.21 0.00 0.00 0.00 175.76 175.82 3h6i s GLU 173 N 0.94 3.69 -1.79 0.00 2.02 -1.26 -3.04 118.70 119.26 3h6i s GLU 173 Ca -0.08 1.84 0.00 0.00 0.02 0.00 0.00 54.97 56.75 3h6i s GLU 173 Cb -0.15 -2.40 0.00 0.00 0.10 0.00 0.00 34.13 31.68 3h6i s GLU 173 CO -0.01 -0.62 0.00 0.09 0.02 0.00 0.00 175.26 174.74 3h6i n ASN 174 N -0.54 -5.36 -4.78 -0.19 3.02 -1.26 -4.98 115.26 101.18 3h6i n ASN 174 Ca 0.08 0.20 -0.37 0.00 -0.03 0.00 0.00 54.58 54.45 3h6i n ASN 174 Cb 0.48 -4.46 -0.05 0.00 -0.61 0.00 0.00 39.78 35.13 3h6i n ASN 174 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h6i s ALA 175 N -2.83 3.19 1.09 5.41 0.00 -1.17 -4.48 121.76 122.97 3h6i s ALA 175 Ca 0.00 0.66 -0.12 0.00 0.00 0.00 0.00 51.96 52.50 3h6i s ALA 175 Cb 0.00 -3.24 0.24 0.00 0.00 0.00 0.00 23.12 20.12 3h6i s ALA 175 CO 0.00 -0.03 1.06 -1.54 0.00 0.00 0.00 175.76 175.25 3h6i s SER 176 N -1.47 1.63 0.14 0.00 1.04 -1.26 -2.85 113.70 110.94 3h6i s SER 176 Ca 0.52 1.63 -0.21 0.00 0.48 0.00 0.00 55.95 58.37 3h6i s SER 176 Cb -0.22 -2.32 0.02 0.00 0.10 0.00 0.00 66.02 63.60 3h6i s SER 176 CO 0.28 -3.81 1.66 0.25 0.98 0.00 0.00 173.24 172.60 3h6i h LEU 177 N -2.36 -0.48 -0.64 2.42 5.85 -1.99 0.84 115.31 118.95 3h6i h LEU 177 Ca -0.57 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.28 3h6i h LEU 177 Cb 1.32 0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.56 3h6i h LEU 177 CO 0.49 -0.18 0.40 0.74 -0.34 0.00 0.00 178.44 179.55 3h6i h THR 178 N -0.13 1.10 -0.18 1.05 2.02 -1.92 -1.13 112.91 113.73 3h6i h THR 178 Ca 0.13 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 67.00 3h6i h THR 178 Cb 0.33 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 3h6i h THR 178 CO -0.32 0.15 -0.03 0.44 0.37 0.00 0.00 175.52 176.13 3h6i h ASP 179 N 0.80 0.34 -0.85 4.18 3.32 -1.79 -2.80 116.42 119.62 3h6i h ASP 179 Ca 0.25 -0.35 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 3h6i h ASP 179 Cb -0.01 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 3h6i h ASP 179 CO -0.09 0.61 0.52 0.00 -1.72 0.00 0.00 179.24 178.56 3h6i h ALA 180 N 0.74 1.31 -0.07 3.45 0.00 -0.54 -1.81 119.26 122.34 3h6i h ALA 180 Ca 0.05 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3h6i h ALA 180 Cb 0.45 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3h6i h ALA 180 CO 0.01 0.60 0.03 1.25 0.00 0.00 0.00 179.25 181.15 3h6i h LEU 181 N 1.18 0.09 -0.75 0.00 5.85 -1.17 -1.60 115.31 118.91 3h6i h LEU 181 Ca 0.31 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3h6i h LEU 181 Cb -0.06 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 3h6i h LEU 181 CO -0.06 0.21 0.35 0.03 -0.34 0.00 0.00 178.44 178.63 3h6i h ARG 182 N -0.03 1.09 -0.25 1.25 3.08 -1.21 0.16 114.38 118.47 3h6i h ARG 182 Ca 0.02 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 59.86 3h6i h ARG 182 Cb 0.14 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3h6i h ARG 182 CO -0.00 0.86 -0.02 0.82 -1.07 0.00 0.00 179.97 180.56 3h6i h ILE 183 N 1.06 1.16 0.07 2.04 2.04 -1.22 -0.63 117.51 122.04 3h6i h ILE 183 Ca 0.26 -0.65 -0.13 0.00 1.00 0.00 0.00 64.86 65.34 3h6i h ILE 183 Cb 0.14 1.00 0.01 0.00 -0.74 0.00 0.00 36.82 37.23 3h6i h ILE 183 CO -0.03 0.22 -0.54 0.00 0.00 0.00 0.00 178.15 177.80 3h6i h ALA 184 N 1.63 -0.03 -0.58 1.87 0.00 -0.62 -3.11 119.26 118.42 3h6i h ALA 184 Ca 0.08 -0.60 -0.05 0.00 0.00 0.00 0.00 54.91 54.34 3h6i h ALA 184 Cb 0.27 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3h6i h ALA 184 CO 0.01 0.25 0.16 0.28 0.00 0.00 0.00 179.25 179.95 3h6i h VAL 185 N -0.48 1.23 -0.67 0.00 2.07 -0.52 -2.63 116.25 115.25 3h6i h VAL 185 Ca -0.09 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.59 3h6i h VAL 185 Cb 1.37 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 3h6i h VAL 185 CO 0.10 0.30 0.26 0.00 0.02 0.00 0.00 177.57 178.26 3h6i h ALA 186 N 1.33 0.87 -0.51 1.67 0.00 -1.22 -1.84 119.26 119.56 3h6i h ALA 186 Ca 0.19 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3h6i h ALA 186 Cb 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3h6i h ALA 186 CO -0.01 0.49 -0.06 0.00 0.00 0.00 0.00 179.25 179.68 3h6i h ALA 187 N 1.12 0.70 -0.73 0.00 0.00 -1.42 -0.76 119.26 118.16 3h6i h ALA 187 Ca 0.22 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3h6i h ALA 187 Cb 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3h6i h ALA 187 CO -0.02 0.56 0.20 -0.07 0.00 0.00 0.00 179.25 179.92 3h6i h LEU 188 N 0.81 1.09 -1.12 0.00 3.38 -1.32 -2.39 115.31 115.75 3h6i h LEU 188 Ca 0.14 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 3h6i h LEU 188 Cb 0.60 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 3h6i h LEU 188 CO 0.04 1.03 0.22 0.03 0.09 0.00 0.00 178.44 179.85 3h6i h ARG 189 N 1.10 0.84 -0.88 1.13 2.47 -1.10 -2.88 114.38 115.05 3h6i h ARG 189 Ca 0.23 -0.13 0.03 0.00 -1.26 0.00 0.00 59.98 58.85 3h6i h ARG 189 Cb 0.35 -0.15 -0.05 0.00 -1.65 0.00 0.00 29.97 28.48 3h6i h ARG 189 CO -0.00 0.69 0.58 0.00 0.56 0.00 0.00 179.97 181.80 3h6i h ALA 190 N 1.42 1.44 0.00 0.04 0.00 -0.60 -3.51 119.26 118.05 3h6i h ALA 190 Ca 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3h6i h ALA 190 Cb 0.18 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3h6i h ALA 190 CO -0.02 0.48 -0.00 0.41 0.00 0.00 0.00 179.25 180.11 3h6i n GLY 191 N -1.40 3.45 0.00 0.00 0.00 -1.09 -4.97 105.19 101.18 3h6i n GLY 191 Ca 0.11 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.78 0.00 0.00 0.99 4.77 -1.26 -5.01 117.00 115.71 3h6i n LEU 203 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 3h6i n LEU 203 Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3h6i n LEU 203 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 3h6i n GLY 204 N 0.00 5.41 0.21 -0.72 0.00 -1.26 -4.99 105.19 103.83 3h6i n GLY 204 Ca 0.00 -1.26 0.07 0.00 0.00 0.00 0.00 46.02 44.83 3h6i n GLY 204 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h6i h VAL 205 N 0.00 0.85 -0.01 1.61 2.07 -1.94 -2.43 116.25 116.41 3h6i h VAL 205 Ca 0.00 -1.19 -0.18 0.00 0.82 0.00 0.00 66.70 66.15 3h6i h VAL 205 Cb 0.00 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 3h6i h VAL 205 CO 0.00 0.29 -0.81 0.00 0.02 0.00 0.00 177.57 177.07 3h6i h ALA 206 N 1.70 0.60 -0.18 1.67 0.00 -1.96 -3.34 119.26 117.77 3h6i h ALA 206 Ca -0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 54.91 54.19 3h6i h ALA 206 Cb 0.69 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3h6i h ALA 206 CO 0.04 0.89 -0.05 -1.13 0.00 0.00 0.00 179.25 178.99 3h6i n SER 207 N -3.69 2.98 -4.01 0.00 3.41 -1.16 -4.62 113.62 106.53 3h6i n SER 207 Ca -0.03 -3.25 -0.17 0.00 -0.26 0.00 0.00 58.87 55.16 3h6i n SER 207 Cb 0.76 -0.52 -0.14 0.00 -0.26 0.00 0.00 64.21 64.05 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 -2.96 2.04 -0.20 1.04 1.43 -0.92 -1.79 118.68 117.32 3h6i s LEU 208 Ca 0.39 -0.19 -0.01 0.00 -1.03 0.00 0.00 54.13 53.29 3h6i s LEU 208 Cb 0.34 -0.37 0.01 0.00 0.03 0.00 0.00 46.19 46.19 3h6i s LEU 208 CO 0.04 0.06 -0.12 -0.70 0.23 0.00 0.00 176.35 175.86 3h6i s GLU 209 N -0.34 3.19 0.00 1.70 2.12 -0.85 -4.87 118.70 119.65 3h6i s GLU 209 Ca 0.02 -0.72 0.04 0.00 0.36 0.00 0.00 54.97 54.66 3h6i s GLU 209 Cb -0.04 -2.79 -0.01 0.00 0.26 0.00 0.00 34.13 31.55 3h6i s GLU 209 CO -0.00 -0.20 -0.12 0.08 -0.54 0.00 0.00 175.26 174.48 3h6i s VAL 210 N 1.37 0.98 0.02 3.70 1.01 -1.26 -1.06 120.40 125.16 3h6i s VAL 210 Ca 0.05 -0.63 -0.28 0.00 0.00 0.00 0.00 61.98 61.12 3h6i s VAL 210 Cb -0.14 -0.84 0.07 0.00 0.00 0.00 0.00 36.38 35.48 3h6i s VAL 210 CO -0.08 0.20 0.66 0.00 0.00 0.00 0.00 175.10 175.89 3h6i s ALA 211 N -0.42 -1.72 0.17 5.51 0.00 -0.78 -1.98 121.76 122.54 3h6i s ALA 211 Ca 0.04 1.04 0.08 0.00 0.00 0.00 0.00 51.96 53.12 3h6i s ALA 211 Cb -0.05 0.30 -0.04 0.00 0.00 0.00 0.00 23.12 23.32 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 -2.09 1.79 -0.65 0.00 -7.23 -0.26 -0.14 120.40 111.82 3h6i s VAL 212 Ca -0.07 -1.94 -0.08 0.00 -1.81 0.00 0.00 61.98 58.09 3h6i s VAL 212 Cb -0.00 -1.85 0.17 0.00 0.56 0.00 0.00 36.38 35.26 3h6i s VAL 212 CO 0.02 -0.35 0.52 -0.76 -0.31 0.00 0.00 175.10 174.22 3h6i s LEU 213 N -2.72 5.81 -0.60 1.32 1.43 -0.33 -0.98 118.68 122.61 3h6i s LEU 213 Ca 0.16 -2.60 -0.27 0.00 -1.03 0.00 0.00 54.13 50.39 3h6i s LEU 213 Cb -0.05 -2.00 0.03 0.00 0.03 0.00 0.00 46.19 44.20 3h6i s LEU 213 CO 0.06 -0.50 1.15 -0.62 0.23 0.00 0.00 176.35 176.67 3h6i s ASP 214 N 1.58 6.37 0.00 2.29 2.15 0.53 -1.70 116.67 127.90 3h6i s ASP 214 Ca 0.15 -0.11 0.04 0.00 0.43 0.00 0.00 52.55 53.05 3h6i s ASP 214 Cb -0.18 -2.52 0.16 0.00 -0.30 0.00 0.00 42.92 40.07 3h6i s ASP 214 CO -0.05 -1.48 1.10 0.00 -0.17 0.00 0.00 175.17 174.57 3h6i n ALA 215 N 8.35 1.19 1.29 3.66 0.00 -0.17 -1.40 120.51 133.43 3h6i n ALA 215 Ca 0.06 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.62 3h6i n ALA 215 Cb 0.49 -1.06 0.35 0.00 0.00 0.00 0.00 19.45 19.22 3h6i n ALA 215 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h6i n ASN 216 N -1.47 1.82 -4.75 0.00 5.15 -1.26 -4.50 115.26 110.24 3h6i n ASN 216 Ca 0.01 -1.51 -0.40 0.00 -0.60 0.00 0.00 54.58 52.08 3h6i n ASN 216 Cb 0.04 0.07 -0.06 0.00 -0.53 0.00 0.00 39.78 39.30 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 -2.13 4.78 0.15 1.20 1.81 -0.49 -4.98 118.95 119.29 3h6i s ARG 217 Ca 0.31 1.42 -0.16 0.00 -1.72 0.00 0.00 55.73 55.58 3h6i s ARG 217 Cb 0.20 -3.29 0.01 0.00 -0.45 0.00 0.00 34.95 31.42 3h6i s ARG 217 CO 0.38 0.48 1.81 -1.35 -0.68 0.00 0.00 175.30 175.95 3h6i h PRO 218 N 4.41 0.54 0.00 3.54 0.11 -1.90 -3.41 132.00 135.29 3h6i h PRO 218 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3h6i h PRO 218 Cb 1.20 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3h6i h PRO 218 CO 0.68 0.36 -0.29 -2.13 -0.21 0.00 0.00 178.00 176.41 3h6i n ARG 219 N -4.80 0.00 -3.26 1.05 0.63 -1.26 -4.38 116.66 104.64 3h6i n ARG 219 Ca 0.01 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.50 3h6i n ARG 219 Cb 0.02 -0.33 -0.08 0.00 0.45 0.00 0.00 32.46 32.53 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 3.12 0.17 -0.14 0.52 -1.26 -4.39 118.95 114.98 3h6i s ARG 220 Ca 0.00 -0.75 0.08 0.00 -0.52 0.00 0.00 55.73 54.54 3h6i s ARG 220 Cb 0.00 -4.00 -0.03 0.00 0.52 0.00 0.00 34.95 31.45 3h6i s ARG 220 CO 0.00 -0.95 1.39 0.00 0.02 0.00 0.00 175.30 175.75 3h6i h ALA 221 N 8.80 0.55 -2.40 2.13 0.00 -1.38 -3.45 119.26 123.51 3h6i h ALA 221 Ca -0.26 -0.80 -0.54 0.00 0.00 0.00 0.00 54.91 53.31 3h6i h ALA 221 Cb 1.11 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.77 3h6i h ALA 221 CO 0.85 1.09 0.98 0.12 0.00 0.00 0.00 179.25 182.29 3h6i s PHE 222 N -3.01 2.42 -0.03 0.00 5.36 -1.26 -0.34 117.98 121.13 3h6i s PHE 222 Ca 0.00 0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.37 3h6i s PHE 222 Cb 0.11 -3.89 0.03 0.00 -0.34 0.00 0.00 43.02 38.92 3h6i s PHE 222 CO 0.80 -3.57 0.01 0.50 -1.46 0.00 0.00 175.22 171.49 3h6i s ARG 223 N 2.86 0.21 -0.03 10.12 3.52 -0.15 -4.97 118.95 130.51 3h6i s ARG 223 Ca 0.72 0.09 -0.18 0.00 -0.13 0.00 0.00 55.73 56.23 3h6i s ARG 223 Cb -0.37 -0.40 -0.05 0.00 -1.56 0.00 0.00 34.95 32.57 3h6i s ARG 223 CO 0.31 -0.13 0.52 1.03 -0.81 0.00 0.00 175.30 176.21 3h6i s ARG 224 N 0.96 4.23 -0.42 5.12 0.52 -1.26 -1.10 118.95 127.01 3h6i s ARG 224 Ca -0.09 0.57 -0.06 0.00 -0.52 0.00 0.00 55.73 55.63 3h6i s ARG 224 Cb -0.13 -3.34 0.10 0.00 0.52 0.00 0.00 34.95 32.10 3h6i s ARG 224 CO -0.02 0.39 0.23 0.42 0.02 0.00 0.00 175.30 176.35 3h6i s ILE 225 N -0.20 3.77 0.42 1.52 1.01 -0.84 -4.98 121.20 121.90 3h6i s ILE 225 Ca 0.28 -1.72 0.04 0.00 0.00 0.00 0.00 60.65 59.24 3h6i s ILE 225 Cb -0.17 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 3h6i s ILE 225 CO 0.14 -0.60 0.05 0.42 0.00 0.00 0.00 174.94 174.96 3h6i s THR 226 N 1.29 1.20 0.00 2.92 -4.23 -1.26 -4.27 115.64 111.29 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 -0.23 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.07 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 -0.97 2.79 0.28 3.99 0.00 -1.26 -2.78 105.19 107.24 3h6i n GLY 227 Ca -0.09 -0.09 0.04 0.00 0.00 0.00 0.00 46.02 45.89 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 0.84 0.32 0.51 1.61 4.64 -1.99 -2.09 113.55 117.38 3h6i h SER 228 Ca 0.00 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 61.20 3h6i h SER 228 Cb 0.00 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 3h6i h SER 228 CO 0.00 0.28 -0.48 0.00 -0.87 0.00 0.00 176.83 175.76 3h6i h ALA 229 N 1.78 1.18 0.14 5.18 0.00 -1.94 -0.93 119.26 124.68 3h6i h ALA 229 Ca 0.09 -0.43 -0.29 0.00 0.00 0.00 0.00 54.91 54.29 3h6i h ALA 229 Cb 0.04 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.77 3h6i h ALA 229 CO -0.01 0.59 -1.30 1.25 0.00 0.00 0.00 179.25 179.78 3h6i h LEU 230 N 0.00 0.47 -0.40 0.00 5.85 -1.23 -3.21 115.31 116.79 3h6i h LEU 230 Ca -0.00 -0.52 -0.02 0.00 0.84 0.00 0.00 57.88 58.18 3h6i h LEU 230 Cb 0.86 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 3h6i h LEU 230 CO 0.06 1.41 0.17 -0.61 -0.34 0.00 0.00 178.44 179.12 3h6i h GLN 231 N 0.08 0.60 0.00 1.25 5.75 -1.22 -1.43 115.11 120.14 3h6i h GLN 231 Ca -0.16 -0.11 0.00 0.00 -0.15 0.00 0.00 58.65 58.24 3h6i h GLN 231 Cb 2.00 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 30.45 3h6i h GLN 231 CO 0.21 0.56 0.00 0.00 -2.65 0.00 0.00 178.83 176.95 3h6i n ALA 232 N -2.30 1.73 0.02 3.38 0.00 -0.37 -1.12 120.51 121.85 3h6i n ALA 232 Ca -0.00 -0.05 0.01 0.00 0.00 0.00 0.00 53.44 53.40 3h6i n ALA 232 Cb 0.14 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.45 3h6i n ALA 232 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h6i n LEU 233 N -1.07 0.02 -0.66 0.00 4.32 -0.67 -5.07 117.00 113.86 3h6i n LEU 233 Ca 0.05 -0.15 0.13 0.00 -0.02 0.00 0.00 56.01 56.03 3h6i n LEU 233 Cb 0.04 0.00 0.36 0.00 -1.62 0.00 0.00 43.42 42.20 3h6i n LEU 233 CO 0.05 0.00 0.78 -0.11 -1.22 0.00 0.00 177.39 176.89