#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6f h GLU 10 N 0.00 0.00 -0.13 -0.52 4.81 -2.06 -3.17 114.58 113.51 3h6f h GLU 10 Ca 0.00 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.03 3h6f h GLU 10 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3h6f h GLU 10 CO 0.00 0.18 -0.73 0.37 -0.73 0.00 0.00 179.01 178.10 3h6f h GLN 11 N 0.00 0.62 -0.55 1.92 5.75 -2.05 -2.99 115.11 117.81 3h6f h GLN 11 Ca -0.00 -0.49 -0.06 0.00 -0.15 0.00 0.00 58.65 57.95 3h6f h GLN 11 Cb 1.03 0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.66 3h6f h GLN 11 CO 0.02 1.11 0.10 0.00 -2.65 0.00 0.00 178.83 177.41 3h6f h ALA 12 N 0.75 0.73 -0.64 3.38 0.00 -1.99 -1.95 119.26 119.54 3h6f h ALA 12 Ca -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3h6f h ALA 12 Cb 1.33 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 3h6f h ALA 12 CO 0.14 0.46 0.30 0.52 0.00 0.00 0.00 179.25 180.67 3h6f h MET 13 N 0.79 0.91 0.10 0.00 2.86 -1.57 -1.86 114.93 116.15 3h6f h MET 13 Ca 0.17 -0.12 -0.29 0.00 -2.06 0.00 0.00 59.70 57.39 3h6f h MET 13 Cb 0.40 -0.17 0.03 0.00 0.06 0.00 0.00 31.60 31.91 3h6f h MET 13 CO 0.01 0.71 -1.21 -0.09 1.06 0.00 0.00 176.91 177.39 3h6f h ARG 14 N 0.91 0.64 -0.08 1.72 2.43 -1.36 -2.76 114.38 115.87 3h6f h ARG 14 Ca 0.22 -0.82 -0.13 0.00 -0.81 0.00 0.00 59.98 58.45 3h6f h ARG 14 Cb 0.11 0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 3h6f h ARG 14 CO -0.03 1.37 -0.52 0.93 -1.51 0.00 0.00 179.97 180.21 3h6f h GLU 15 N 0.30 0.22 -0.14 0.20 5.08 -1.26 -0.98 114.58 118.00 3h6f h GLU 15 Ca -0.18 -0.13 -0.16 0.00 -1.00 0.00 0.00 59.36 57.89 3h6f h GLU 15 Cb 1.88 0.01 0.01 0.00 0.50 0.00 0.00 28.75 31.15 3h6f h GLU 15 CO 0.23 0.69 -0.53 0.00 -1.00 0.00 0.00 179.01 178.40 3h6f h ARG 16 N 0.18 0.61 -0.24 2.33 3.08 -1.44 -1.83 114.38 117.07 3h6f h ARG 16 Ca 0.00 -0.47 -0.05 0.00 0.07 0.00 0.00 59.98 59.53 3h6f h ARG 16 Cb 0.98 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.10 3h6f h ARG 16 CO 0.08 1.09 -0.08 1.03 -1.07 0.00 0.00 179.97 181.02 3h6f h SER 17 N 0.26 0.36 0.01 7.04 0.87 -1.38 -2.14 113.55 118.57 3h6f h SER 17 Ca -0.03 -0.07 -0.25 0.00 -1.23 0.00 0.00 61.79 60.21 3h6f h SER 17 Cb 1.16 -0.10 0.02 0.00 -0.44 0.00 0.00 62.40 63.05 3h6f h SER 17 CO 0.11 0.49 -0.97 -0.08 -0.53 0.00 0.00 176.83 175.85 3h6f h GLU 18 N 0.37 0.64 -0.87 2.24 4.57 -1.12 -2.04 114.58 118.36 3h6f h GLU 18 Ca 0.08 -0.70 0.01 0.00 -1.18 0.00 0.00 59.36 57.57 3h6f h GLU 18 Cb 0.37 0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 29.12 3h6f h GLU 18 CO 0.02 1.29 0.58 1.25 -1.18 0.00 0.00 179.01 180.97 3h6f h LEU 19 N 0.28 0.99 -0.06 1.64 6.46 -1.06 -1.55 115.31 122.03 3h6f h LEU 19 Ca -0.12 -0.02 -0.08 0.00 -0.12 0.00 0.00 57.88 57.53 3h6f h LEU 19 Cb 1.64 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 41.33 3h6f h LEU 19 CO 0.19 0.71 -0.28 0.00 -0.62 0.00 0.00 178.44 178.44 3h6f h ALA 20 N 1.33 0.11 -0.51 1.25 0.00 -1.43 -2.98 119.26 117.02 3h6f h ALA 20 Ca 0.33 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3h6f h ALA 20 Cb -0.11 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3h6f h ALA 20 CO -0.08 0.14 0.30 -0.09 0.00 0.00 0.00 179.25 179.53 3h6f h ARG 21 N -0.23 0.68 -0.06 0.00 2.43 -1.18 -2.08 114.38 113.94 3h6f h ARG 21 Ca -0.02 -0.05 -0.17 0.00 -0.81 0.00 0.00 59.98 58.93 3h6f h ARG 21 Cb 0.94 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 3h6f h ARG 21 CO 0.06 0.48 -0.70 0.87 -1.51 0.00 0.00 179.97 179.17 3h6f h LYS 22 N 0.69 0.28 -0.09 0.20 1.57 -1.35 -1.71 116.57 116.16 3h6f h LYS 22 Ca 0.18 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.59 3h6f h LYS 22 Cb -0.03 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 3h6f h LYS 22 CO -0.03 0.87 -0.57 0.78 -0.57 0.00 0.00 179.45 179.92 3h6f h GLY 23 N 1.50 0.33 1.42 3.86 0.00 -1.24 -2.40 103.07 106.54 3h6f h GLY 23 Ca -0.02 -0.39 -0.25 0.00 0.00 0.00 0.00 47.33 46.68 3h6f h GLY 23 CO 0.11 0.35 -1.00 -2.22 0.00 0.00 0.00 176.54 173.77 3h6f h ILE 24 N 0.23 1.36 0.00 2.60 2.04 -1.35 -3.19 117.51 119.20 3h6f h ILE 24 Ca -0.00 -2.40 -0.05 0.00 1.00 0.00 0.00 64.86 63.41 3h6f h ILE 24 Cb 1.07 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 39.59 3h6f h ILE 24 CO 0.09 0.73 -0.23 0.00 0.00 0.00 0.00 178.15 178.74 3h6f h ALA 25 N 0.60 1.25 0.00 1.87 0.00 -1.20 -1.37 119.26 120.40 3h6f h ALA 25 Ca -0.10 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3h6f h ALA 25 Cb 1.65 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.40 3h6f h ALA 25 CO 0.18 0.29 -0.39 0.54 0.00 0.00 0.00 179.25 179.87 3h6f n ARG 26 N -3.72 0.18 -3.05 0.00 1.74 -0.91 -3.97 116.66 106.92 3h6f n ARG 26 Ca -0.01 0.08 -0.23 0.00 -0.77 0.00 0.00 57.85 56.91 3h6f n ARG 26 Cb 0.34 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 3h6f n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h6f s ALA 27 N -3.09 3.71 0.84 7.54 0.00 -1.05 -4.96 121.76 124.75 3h6f s ALA 27 Ca 0.09 -0.98 -0.11 0.00 0.00 0.00 0.00 51.96 50.97 3h6f s ALA 27 Cb 0.15 -2.17 0.10 0.00 0.00 0.00 0.00 23.12 21.20 3h6f s ALA 27 CO 0.67 -0.29 1.10 0.15 0.00 0.00 0.00 175.76 177.39 3h6f s LYS 28 N -4.51 1.64 0.20 0.00 1.02 -1.26 -2.00 119.74 114.83 3h6f s LYS 28 Ca 0.46 1.21 -0.06 0.00 0.02 0.00 0.00 55.97 57.60 3h6f s LYS 28 Cb -0.10 -1.82 -0.06 0.00 -0.52 0.00 0.00 37.83 35.33 3h6f s LYS 28 CO 0.38 -2.09 0.47 -1.12 -0.92 0.00 0.00 175.35 172.07 3h6f s SER 29 N -3.16 6.53 -0.02 2.83 0.01 -1.26 -4.19 113.70 114.44 3h6f s SER 29 Ca 0.63 0.72 0.01 0.00 1.31 0.00 0.00 55.95 58.63 3h6f s SER 29 Cb -0.19 -2.14 0.01 0.00 0.21 0.00 0.00 66.02 63.90 3h6f s SER 29 CO 0.57 -0.03 -0.05 -0.69 0.41 0.00 0.00 173.24 173.45 3h6f s VAL 30 N -1.79 0.47 -0.02 3.43 1.01 -0.31 -1.97 120.40 121.23 3h6f s VAL 30 Ca 0.44 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.26 3h6f s VAL 30 Cb -0.12 -0.44 0.00 0.00 0.00 0.00 0.00 36.38 35.82 3h6f s VAL 30 CO 0.24 0.16 -0.08 0.68 0.00 0.00 0.00 175.10 176.10 3h6f s VAL 31 N 0.30 0.71 -0.07 2.92 -7.23 0.18 -1.21 120.40 116.00 3h6f s VAL 31 Ca -0.03 -0.34 0.03 0.00 -1.81 0.00 0.00 61.98 59.82 3h6f s VAL 31 Cb -0.07 -0.62 0.01 0.00 0.56 0.00 0.00 36.38 36.26 3h6f s VAL 31 CO -0.00 0.22 -0.14 0.00 -0.31 0.00 0.00 175.10 174.86 3h6f s ALA 32 N 0.06 1.42 0.01 1.32 0.00 -0.85 -0.65 121.76 123.07 3h6f s ALA 32 Ca -0.01 -0.51 0.02 0.00 0.00 0.00 0.00 51.96 51.47 3h6f s ALA 32 Cb -0.06 -0.61 -0.01 0.00 0.00 0.00 0.00 23.12 22.43 3h6f s ALA 32 CO 0.00 0.14 -0.07 -0.48 0.00 0.00 0.00 175.76 175.34 3h6f s LEU 33 N 0.62 2.10 0.50 0.00 0.05 -0.44 -1.72 118.68 119.79 3h6f s LEU 33 Ca -0.15 -0.27 -0.22 0.00 0.05 0.00 0.00 54.13 53.54 3h6f s LEU 33 Cb -0.16 -0.30 -0.06 0.00 -2.05 0.00 0.00 46.19 43.61 3h6f s LEU 33 CO 0.04 -0.01 1.18 0.00 -0.55 0.00 0.00 176.35 177.01 3h6f s ALA 34 N -0.57 2.85 0.31 1.48 0.00 -0.95 -1.01 121.76 123.87 3h6f s ALA 34 Ca -0.01 0.95 -0.03 0.00 0.00 0.00 0.00 51.96 52.87 3h6f s ALA 34 Cb -0.05 -3.40 -0.00 0.00 0.00 0.00 0.00 23.12 19.66 3h6f s ALA 34 CO 0.00 -0.80 0.43 1.52 0.00 0.00 0.00 175.76 176.91 3h6f s TYR 35 N -1.58 1.00 0.27 0.00 -0.85 0.27 -4.87 117.35 111.58 3h6f s TYR 35 Ca 0.68 -1.24 -0.04 0.00 -0.52 0.00 0.00 57.07 55.95 3h6f s TYR 35 Cb -0.29 -0.12 0.34 0.00 0.38 0.00 0.00 41.96 42.27 3h6f s TYR 35 CO 0.34 -1.05 1.93 0.00 -1.52 0.00 0.00 175.55 175.25 3h6f h ALA 36 N 2.18 1.34 -0.01 9.51 0.00 -1.60 -2.63 119.26 128.06 3h6f h ALA 36 Ca -0.28 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3h6f h ALA 36 Cb 1.24 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3h6f h ALA 36 CO 0.39 0.59 -0.09 0.41 0.00 0.00 0.00 179.25 180.55 3h6f n GLY 37 N -1.39 -0.27 0.00 0.00 0.00 -1.26 -5.03 105.19 97.24 3h6f n GLY 37 Ca 0.12 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3h6f n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6f n GLY 38 N 1.23 0.50 3.86 -0.02 0.00 -0.99 -2.02 105.19 107.75 3h6f n GLY 38 Ca 0.17 -1.42 -0.34 0.00 0.00 0.00 0.00 46.02 44.43 3h6f n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h6f s VAL 39 N -4.00 5.22 -0.08 1.61 1.01 -1.09 0.93 120.40 124.00 3h6f s VAL 39 Ca 0.00 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 61.85 3h6f s VAL 39 Cb 0.00 -3.39 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 3h6f s VAL 39 CO 0.00 0.38 -0.22 -0.22 0.00 0.00 0.00 175.10 175.04 3h6f s LEU 40 N -1.72 2.22 -0.15 3.92 2.96 -0.18 -1.65 118.68 124.08 3h6f s LEU 40 Ca 0.24 -0.48 -0.01 0.00 -0.22 0.00 0.00 54.13 53.66 3h6f s LEU 40 Cb -0.12 -1.43 -0.01 0.00 0.50 0.00 0.00 46.19 45.12 3h6f s LEU 40 CO 0.15 0.22 -0.12 -0.36 -1.32 0.00 0.00 176.35 174.92 3h6f s PHE 41 N 0.01 2.84 -0.05 5.38 0.08 0.99 -1.33 117.98 125.90 3h6f s PHE 41 Ca -0.08 -0.71 0.00 0.00 0.12 0.00 0.00 56.93 56.26 3h6f s PHE 41 Cb -0.15 -1.89 0.02 0.00 -0.57 0.00 0.00 43.02 40.43 3h6f s PHE 41 CO 0.05 -0.28 -0.03 0.08 -0.10 0.00 0.00 175.22 174.95 3h6f s VAL 42 N 0.56 0.47 0.04 -0.44 1.01 0.17 -2.05 120.40 120.16 3h6f s VAL 42 Ca -0.08 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 61.91 3h6f s VAL 42 Cb -0.15 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 3h6f s VAL 42 CO 0.03 0.24 -0.10 0.00 0.00 0.00 0.00 175.10 175.27 3h6f s ALA 43 N 1.31 0.77 -0.58 5.51 0.00 -0.49 -0.64 121.76 127.64 3h6f s ALA 43 Ca -0.05 -0.70 -0.24 0.00 0.00 0.00 0.00 51.96 50.97 3h6f s ALA 43 Cb -0.13 -0.06 0.05 0.00 0.00 0.00 0.00 23.12 22.97 3h6f s ALA 43 CO -0.02 0.09 0.97 -2.00 0.00 0.00 0.00 175.76 174.80 3h6f s GLU 44 N -1.19 3.29 -0.23 0.00 2.12 -0.83 -1.75 118.70 120.11 3h6f s GLU 44 Ca -0.04 -0.34 -0.03 0.00 0.36 0.00 0.00 54.97 54.92 3h6f s GLU 44 Cb -0.08 -4.09 0.11 0.00 0.26 0.00 0.00 34.13 30.33 3h6f s GLU 44 CO 0.01 -1.57 0.25 1.21 -0.54 0.00 0.00 175.26 174.61 3h6f s ASN 45 N 3.02 1.44 0.41 -1.70 2.47 -0.69 -4.66 114.94 115.23 3h6f s ASN 45 Ca 0.30 -0.36 0.21 0.00 0.42 0.00 0.00 52.86 53.43 3h6f s ASN 45 Cb -0.13 0.45 0.79 0.00 -1.45 0.00 0.00 41.25 40.91 3h6f s ASN 45 CO 0.18 -0.34 1.78 1.55 -3.72 0.00 0.00 177.10 176.54 3h6f h PRO 46 N 8.29 0.00 -6.90 0.43 0.13 -1.83 -3.25 132.00 128.88 3h6f h PRO 46 Ca -0.17 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.46 3h6f h PRO 46 Cb 1.13 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.30 3h6f h PRO 46 CO 0.30 0.29 0.49 0.45 -0.23 0.00 0.00 178.00 179.31 3h6f s SER 47 N -6.31 6.80 -0.00 1.44 0.15 -1.26 -4.78 113.70 109.74 3h6f s SER 47 Ca 0.00 2.31 0.21 0.00 0.70 0.00 0.00 55.95 59.18 3h6f s SER 47 Cb 0.10 -2.62 -0.17 0.00 -1.71 0.00 0.00 66.02 61.62 3h6f s SER 47 CO 0.66 -0.48 0.91 -1.14 1.20 0.00 0.00 173.24 174.39 3h6f n ARG 48 N 0.44 0.05 -0.08 5.44 0.63 -1.26 -4.59 116.66 117.29 3h6f n ARG 48 Ca 0.02 -0.01 -0.15 0.00 -0.92 0.00 0.00 57.85 56.79 3h6f n ARG 48 Cb 0.46 -1.50 -0.07 0.00 0.45 0.00 0.00 32.46 31.80 3h6f n ARG 48 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 3h6f n SER 49 N -1.57 1.92 -4.55 6.15 7.64 -1.26 -4.93 113.62 117.02 3h6f n SER 49 Ca 0.03 0.07 -0.42 0.00 1.01 0.00 0.00 58.87 59.57 3h6f n SER 49 Cb 0.35 -0.39 -0.03 0.00 -1.01 0.00 0.00 64.21 63.13 3h6f n SER 49 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3h6f s LEU 50 N -6.48 3.54 0.15 -3.43 1.43 -1.26 -5.02 118.68 107.61 3h6f s LEU 50 Ca -0.23 -0.23 -0.27 0.00 -1.03 0.00 0.00 54.13 52.37 3h6f s LEU 50 Cb 0.08 -2.86 -0.07 0.00 0.03 0.00 0.00 46.19 43.36 3h6f s LEU 50 CO 0.33 -1.55 0.84 0.00 0.23 0.00 0.00 176.35 176.20 3h6f s GLN 51 N 4.96 4.64 -0.01 1.70 -2.07 -1.26 -4.84 119.66 122.77 3h6f s GLN 51 Ca 0.37 1.25 0.12 0.00 -1.82 0.00 0.00 55.36 55.28 3h6f s GLN 51 Cb -0.09 -3.30 -0.17 0.00 -1.09 0.00 0.00 33.01 28.36 3h6f s GLN 51 CO 0.20 0.45 0.36 1.63 -1.32 0.00 0.00 175.29 176.61 3h6f n LYS 52 N 1.99 1.34 -5.26 9.60 5.02 -1.26 -4.97 118.16 124.61 3h6f n LYS 52 Ca -0.03 -0.07 -0.30 0.00 -2.02 0.00 0.00 58.31 55.88 3h6f n LYS 52 Cb 0.49 -1.21 -0.16 0.00 -0.02 0.00 0.00 35.03 34.13 3h6f n LYS 52 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3h6f s ILE 53 N -2.60 1.98 0.19 -0.18 1.01 -1.26 -1.34 121.20 119.00 3h6f s ILE 53 Ca -0.01 -1.07 -0.20 0.00 0.00 0.00 0.00 60.65 59.36 3h6f s ILE 53 Cb 0.08 -1.65 0.05 0.00 0.01 0.00 0.00 42.46 40.95 3h6f s ILE 53 CO 0.51 0.56 0.58 -0.55 0.00 0.00 0.00 174.94 176.04 3h6f s SER 54 N -0.57 -0.40 0.17 3.58 0.15 0.07 -4.99 113.70 111.71 3h6f s SER 54 Ca 0.09 -0.27 -0.28 0.00 0.70 0.00 0.00 55.95 56.19 3h6f s SER 54 Cb -0.10 0.60 -0.08 0.00 -1.71 0.00 0.00 66.02 64.74 3h6f s SER 54 CO -0.01 -1.05 0.89 -0.70 1.20 0.00 0.00 173.24 173.57 3h6f s GLU 55 N -3.82 4.71 -0.18 5.44 2.12 -1.26 -0.24 118.70 125.48 3h6f s GLU 55 Ca 0.05 1.36 -0.09 0.00 0.36 0.00 0.00 54.97 56.65 3h6f s GLU 55 Cb -0.02 -3.31 -0.08 0.00 0.26 0.00 0.00 34.13 30.99 3h6f s GLU 55 CO -0.07 0.44 -0.23 1.28 -0.54 0.00 0.00 175.26 176.14 3h6f n LEU 56 N 1.96 1.30 0.00 2.70 4.77 -0.57 -4.84 117.00 122.31 3h6f n LEU 56 Ca -0.02 0.21 -0.04 0.00 -0.03 0.00 0.00 56.01 56.14 3h6f n LEU 56 Cb 0.48 -0.53 -0.00 0.00 -2.33 0.00 0.00 43.42 41.04 3h6f n LEU 56 CO 0.49 0.38 0.10 0.00 -1.33 0.00 0.00 177.39 177.03 3h6f n TYR 57 N -3.79 -1.03 -0.32 -1.77 9.36 -1.04 -4.70 117.16 113.86 3h6f n TYR 57 Ca -0.35 -0.68 -0.08 0.00 3.32 0.00 0.00 57.90 60.11 3h6f n TYR 57 Cb 0.75 0.22 -0.08 0.00 -0.63 0.00 0.00 39.34 39.61 3h6f n TYR 57 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 3h6f n ASP 58 N -1.64 -0.81 -0.60 2.98 8.00 -1.26 -2.65 116.55 120.57 3h6f n ASP 58 Ca -0.01 1.58 0.05 0.00 0.71 0.00 0.00 54.79 57.13 3h6f n ASP 58 Cb 0.19 -0.29 0.14 0.00 -0.02 0.00 0.00 41.12 41.14 3h6f n ASP 58 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3h6f n ARG 59 N -4.71 2.87 -4.62 -1.24 5.12 -1.26 -1.08 116.66 111.74 3h6f n ARG 59 Ca 0.02 -2.02 -0.33 0.00 -1.93 0.00 0.00 57.85 53.58 3h6f n ARG 59 Cb 0.20 -1.25 -0.13 0.00 -1.16 0.00 0.00 32.46 30.12 3h6f n ARG 59 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3h6f s VAL 60 N -1.00 3.52 0.29 1.55 1.01 -1.09 -2.05 120.40 122.64 3h6f s VAL 60 Ca 0.22 -0.51 0.11 0.00 0.00 0.00 0.00 61.98 61.79 3h6f s VAL 60 Cb 0.11 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 3h6f s VAL 60 CO 0.15 0.54 -0.11 -0.83 0.00 0.00 0.00 175.10 174.85 3h6f s GLY 61 N -0.03 1.89 0.04 4.51 0.00 0.47 -1.52 107.32 112.68 3h6f s GLY 61 Ca -0.01 -1.86 0.04 0.00 0.00 0.00 0.00 44.72 42.90 3h6f s GLY 61 CO 0.03 -1.90 -0.13 -0.12 0.00 0.00 0.00 173.10 170.98 3h6f s PHE 62 N -2.48 1.11 -0.18 1.90 5.36 0.67 -1.70 117.98 122.67 3h6f s PHE 62 Ca 0.31 -0.36 -0.15 0.00 -0.96 0.00 0.00 56.93 55.77 3h6f s PHE 62 Cb -0.04 -0.66 0.05 0.00 -0.34 0.00 0.00 43.02 42.03 3h6f s PHE 62 CO 0.17 0.02 0.46 0.00 -1.46 0.00 0.00 175.22 174.41 3h6f s ALA 63 N -0.89 -1.15 0.07 11.12 0.00 -0.55 -0.75 121.76 129.61 3h6f s ALA 63 Ca -0.00 1.36 -0.09 0.00 0.00 0.00 0.00 51.96 53.23 3h6f s ALA 63 Cb -0.08 -0.80 0.00 0.00 0.00 0.00 0.00 23.12 22.25 3h6f s ALA 63 CO 0.01 -0.23 0.19 0.00 0.00 0.00 0.00 175.76 175.74 3h6f s ALA 64 N 0.43 -0.28 0.00 0.00 0.00 -0.45 -0.27 121.76 121.20 3h6f s ALA 64 Ca -0.02 -0.49 0.02 0.00 0.00 0.00 0.00 51.96 51.47 3h6f s ALA 64 Cb -0.04 0.41 -0.01 0.00 0.00 0.00 0.00 23.12 23.49 3h6f s ALA 64 CO -0.02 -0.46 -0.05 0.00 0.00 0.00 0.00 175.76 175.23 3h6f s ALA 65 N -3.40 0.44 0.00 0.00 0.00 -0.50 -4.84 121.76 113.46 3h6f s ALA 65 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.67 3h6f s ALA 65 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.07 3h6f s ALA 65 CO -0.08 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.17 3h6f n GLY 66 N 2.71 0.55 3.66 0.00 0.00 -1.26 -1.26 105.19 109.60 3h6f n GLY 66 Ca -0.14 -1.74 -0.43 0.00 0.00 0.00 0.00 46.02 43.71 3h6f n GLY 66 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h6f s LYS 67 N -1.30 4.25 0.12 1.61 2.20 -0.41 -4.91 119.74 121.29 3h6f s LYS 67 Ca 0.00 1.61 -0.31 0.00 -0.36 0.00 0.00 55.97 56.92 3h6f s LYS 67 Cb 0.00 -3.73 -0.08 0.00 -1.51 0.00 0.00 37.83 32.51 3h6f s LYS 67 CO 0.00 -0.67 1.58 0.35 -0.36 0.00 0.00 175.35 176.25 3h6f h PHE 68 N 8.02 -1.28 -0.57 4.03 3.57 -1.96 -2.46 116.94 126.28 3h6f h PHE 68 Ca -0.26 0.05 0.17 0.00 3.53 0.00 0.00 57.97 61.45 3h6f h PHE 68 Cb 1.10 0.57 -0.02 0.00 2.79 0.00 0.00 35.95 40.39 3h6f h PHE 68 CO 0.79 -0.51 0.49 -2.95 -2.23 0.00 0.00 178.31 173.90 3h6f h ASN 69 N -0.56 0.00 0.11 0.41 7.08 -1.99 -0.53 115.58 120.10 3h6f h ASN 69 Ca 0.05 0.00 -0.19 0.00 -3.08 0.00 0.00 56.30 53.09 3h6f h ASN 69 Cb 0.66 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 36.91 3h6f h ASN 69 CO -0.36 0.00 -0.87 -0.33 -2.08 0.00 0.00 177.43 173.79 3h6f h GLU 70 N 0.00 0.24 0.00 4.14 5.08 -1.87 -3.11 114.58 119.06 3h6f h GLU 70 Ca 0.27 -0.41 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 3h6f h GLU 70 Cb 1.25 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 3h6f h GLU 70 CO -0.00 1.20 -0.19 0.27 -1.00 0.00 0.00 179.01 179.28 3h6f h PHE 71 N -0.46 0.00 -0.06 4.33 -5.15 -0.97 -2.90 116.94 111.73 3h6f h PHE 71 Ca -0.17 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.44 3h6f h PHE 71 Cb 1.58 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.74 3h6f h PHE 71 CO 0.19 0.19 -0.66 0.22 -2.00 0.00 0.00 178.31 176.25 3h6f h ASP 72 N 0.00 0.31 -0.23 -0.68 3.58 -1.25 -0.35 116.42 117.80 3h6f h ASP 72 Ca -0.00 -0.19 -0.08 0.00 0.42 0.00 0.00 57.03 57.18 3h6f h ASP 72 Cb 1.10 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 42.04 3h6f h ASP 72 CO 0.02 0.88 -0.10 -1.13 -2.88 0.00 0.00 179.24 176.03 3h6f h ASN 73 N 0.19 0.59 0.68 2.28 -1.24 -1.45 -1.12 115.58 115.51 3h6f h ASN 73 Ca -0.01 -0.16 -0.21 0.00 0.71 0.00 0.00 56.30 56.63 3h6f h ASN 73 Cb 1.19 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 40.07 3h6f h ASN 73 CO 0.10 0.73 -0.94 -0.07 -1.29 0.00 0.00 177.43 175.96 3h6f h LEU 74 N 0.56 0.21 -0.38 0.34 3.38 -1.30 -2.10 115.31 116.03 3h6f h LEU 74 Ca 0.10 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 3h6f h LEU 74 Cb 0.51 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 3h6f h LEU 74 CO 0.03 1.04 0.08 -0.09 0.09 0.00 0.00 178.44 179.59 3h6f h ARG 75 N 0.07 0.61 -0.52 1.13 2.43 -0.61 -1.37 114.38 116.12 3h6f h ARG 75 Ca -0.05 -0.15 -0.08 0.00 -0.81 0.00 0.00 59.98 58.89 3h6f h ARG 75 Cb 1.61 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 31.06 3h6f h ARG 75 CO 0.14 0.65 0.01 0.00 -1.51 0.00 0.00 179.97 179.27 3h6f h ARG 76 N 0.46 0.91 0.00 0.20 3.08 -1.22 -1.81 114.38 116.00 3h6f h ARG 76 Ca 0.12 -0.29 -0.08 0.00 0.07 0.00 0.00 59.98 59.80 3h6f h ARG 76 Cb 0.33 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 3h6f h ARG 76 CO 0.00 0.93 -0.39 0.78 -1.07 0.00 0.00 179.97 180.23 3h6f h GLY 77 N 0.79 0.00 1.25 0.04 0.00 -1.30 -1.37 103.07 102.48 3h6f h GLY 77 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.23 3h6f h GLY 77 CO 0.02 0.00 -0.93 -1.33 0.00 0.00 0.00 176.54 174.30 3h6f h GLY 78 N 1.21 0.77 1.41 4.60 0.00 -0.93 -1.88 103.07 108.26 3h6f h GLY 78 Ca -0.00 -1.25 -0.09 0.00 0.00 0.00 0.00 47.33 45.98 3h6f h GLY 78 CO 0.05 1.11 -0.15 -2.22 0.00 0.00 0.00 176.54 175.33 3h6f h ILE 79 N 0.43 1.26 -0.26 2.60 2.04 -1.13 -0.24 117.51 122.19 3h6f h ILE 79 Ca -0.10 -1.18 -0.02 0.00 1.00 0.00 0.00 64.86 64.56 3h6f h ILE 79 Cb 1.57 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.76 3h6f h ILE 79 CO 0.18 0.40 0.09 -0.61 0.00 0.00 0.00 178.15 178.21 3h6f h GLN 80 N 0.63 0.40 -0.02 2.37 5.75 -1.17 -1.40 115.11 121.67 3h6f h GLN 80 Ca 0.10 -0.08 -0.00 0.00 -0.15 0.00 0.00 58.65 58.52 3h6f h GLN 80 Cb 0.61 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 29.09 3h6f h GLN 80 CO 0.04 0.46 0.00 0.35 -2.65 0.00 0.00 178.83 177.03 3h6f h PHE 81 N 0.26 0.03 -0.73 3.99 3.57 -1.17 -2.58 116.94 120.31 3h6f h PHE 81 Ca 0.09 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.62 3h6f h PHE 81 Cb 0.22 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.90 3h6f h PHE 81 CO 0.00 0.30 0.45 0.00 -2.23 0.00 0.00 178.31 176.83 3h6f h ALA 82 N 0.73 0.97 -0.13 2.41 0.00 -0.92 -1.62 119.26 120.70 3h6f h ALA 82 Ca 0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 3h6f h ALA 82 Cb 0.29 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3h6f h ALA 82 CO 0.00 0.20 -0.52 -0.44 0.00 0.00 0.00 179.25 178.49 3h6f h ASP 83 N 0.85 0.40 -0.32 0.00 3.32 -1.25 -1.63 116.42 117.79 3h6f h ASP 83 Ca 0.31 -0.20 -0.11 0.00 0.02 0.00 0.00 57.03 57.04 3h6f h ASP 83 Cb 0.08 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3h6f h ASP 83 CO -0.14 0.85 -0.23 0.74 -1.72 0.00 0.00 179.24 178.74 3h6f h THR 84 N 0.28 1.29 -0.33 0.35 2.02 -1.22 -2.47 112.91 112.84 3h6f h THR 84 Ca 0.01 -1.38 -0.07 0.00 0.77 0.00 0.00 66.41 65.74 3h6f h THR 84 Cb 1.01 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 3h6f h THR 84 CO 0.09 0.45 -0.06 0.03 0.37 0.00 0.00 175.52 176.39 3h6f h ARG 85 N 0.48 0.62 -0.01 6.66 2.47 -1.22 -0.49 114.38 122.89 3h6f h ARG 85 Ca 0.06 -0.23 -0.06 0.00 -1.26 0.00 0.00 59.98 58.49 3h6f h ARG 85 Cb 0.79 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.06 3h6f h ARG 85 CO 0.06 0.79 -0.28 0.78 0.56 0.00 0.00 179.97 181.87 3h6f h GLY 86 N 0.41 0.02 1.25 0.04 0.00 -1.31 -0.37 103.07 103.11 3h6f h GLY 86 Ca 0.09 -0.01 -0.33 0.00 0.00 0.00 0.00 47.33 47.08 3h6f h GLY 86 CO 0.03 0.01 -1.51 -1.82 0.00 0.00 0.00 176.54 173.25 3h6f h TYR 87 N 0.02 0.77 0.00 5.60 3.20 -1.26 -3.19 116.97 122.10 3h6f h TYR 87 Ca 0.00 -0.56 -0.10 0.00 3.14 0.00 0.00 58.73 61.21 3h6f h TYR 87 Cb 0.51 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 3h6f h TYR 87 CO 0.00 1.51 -0.47 0.00 -1.64 0.00 0.00 178.16 177.57 3h6f h ALA 88 N 0.27 0.76 -3.00 1.82 0.00 -0.87 -3.45 119.26 114.79 3h6f h ALA 88 Ca -0.25 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3h6f h ALA 88 Cb 2.10 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.82 3h6f h ALA 88 CO 0.23 0.59 0.00 0.66 0.00 0.00 0.00 179.25 180.72 3h6f n TYR 89 N -3.31 0.00 -3.93 0.00 4.01 -0.17 -5.08 117.16 108.69 3h6f n TYR 89 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.66 3h6f n TYR 89 Cb 0.67 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.64 3h6f n TYR 89 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 3h6f s ASP 90 N 1.00 -0.03 0.47 7.72 1.47 -1.21 -4.98 116.67 121.11 3h6f s ASP 90 Ca 0.00 -0.82 0.24 0.00 1.18 0.00 0.00 52.55 53.15 3h6f s ASP 90 Cb 0.00 0.49 1.18 0.00 -0.34 0.00 0.00 42.92 44.24 3h6f s ASP 90 CO 0.00 -0.96 1.96 0.03 0.68 0.00 0.00 175.17 176.88 3h6f h ARG 91 N 2.43 0.00 0.00 2.11 3.08 -1.90 -2.53 114.38 117.57 3h6f h ARG 91 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.75 3h6f h ARG 91 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 3h6f h ARG 91 CO 0.44 0.19 0.00 -2.13 -1.07 0.00 0.00 179.97 177.41 3h6f n ARG 92 N -3.64 0.07 0.08 0.04 0.63 -1.26 -3.09 116.66 109.50 3h6f n ARG 92 Ca -0.01 0.07 -0.04 0.00 -0.92 0.00 0.00 57.85 56.94 3h6f n ARG 92 Cb 0.32 -1.50 0.16 0.00 0.45 0.00 0.00 32.46 31.89 3h6f n ARG 92 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 3h6f h ASP 93 N 0.00 0.30 -3.64 6.15 3.58 -1.82 -3.40 116.42 117.59 3h6f h ASP 93 Ca 0.00 -0.15 -0.56 0.00 0.42 0.00 0.00 57.03 56.74 3h6f h ASP 93 Cb 0.39 -0.08 -0.07 0.00 1.72 0.00 0.00 39.33 41.29 3h6f h ASP 93 CO 0.00 0.75 0.93 -0.69 -2.88 0.00 0.00 179.24 177.36 3h6f s VAL 94 N -3.97 4.20 0.37 2.25 1.01 -1.18 -4.92 120.40 118.17 3h6f s VAL 94 Ca -0.05 1.24 0.06 0.00 0.00 0.00 0.00 61.98 63.24 3h6f s VAL 94 Cb 0.13 -4.55 -0.07 0.00 0.00 0.00 0.00 36.38 31.88 3h6f s VAL 94 CO 0.79 -0.94 0.02 0.42 0.00 0.00 0.00 175.10 175.39 3h6f s THR 95 N 4.47 1.72 0.17 3.92 -4.23 -1.26 -4.94 115.64 115.48 3h6f s THR 95 Ca 0.49 -2.02 -0.10 0.00 -1.18 0.00 0.00 61.69 58.88 3h6f s THR 95 Cb -0.08 -2.88 0.04 0.00 1.34 0.00 0.00 72.50 70.91 3h6f s THR 95 CO 0.30 -0.03 1.61 1.23 -0.54 0.00 0.00 174.62 177.19 3h6f h GLY 96 N 1.93 1.09 0.91 3.99 0.00 -1.94 -2.56 103.07 106.49 3h6f h GLY 96 Ca -0.43 -0.84 0.03 0.00 0.00 0.00 0.00 47.33 46.09 3h6f h GLY 96 CO 0.76 0.77 0.55 -0.09 0.00 0.00 0.00 176.54 178.53 3h6f h ARG 97 N 0.89 1.05 -0.20 4.80 2.43 -1.96 -0.22 114.38 121.16 3h6f h ARG 97 Ca 0.15 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 3h6f h ARG 97 Cb 0.61 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 3h6f h ARG 97 CO 0.04 0.69 0.03 0.37 -1.51 0.00 0.00 179.97 179.59 3h6f h GLN 98 N 1.08 0.33 -0.30 0.20 4.15 -1.87 -1.46 115.11 117.23 3h6f h GLN 98 Ca 0.33 -0.09 -0.12 0.00 0.77 0.00 0.00 58.65 59.55 3h6f h GLN 98 Cb -0.03 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 3h6f h GLN 98 CO -0.10 0.48 -0.29 -0.07 -1.93 0.00 0.00 178.83 176.92 3h6f h LEU 99 N 0.12 0.64 -0.70 -2.39 3.38 -1.10 -2.26 115.31 113.01 3h6f h LEU 99 Ca 0.06 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 3h6f h LEU 99 Cb 0.32 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3h6f h LEU 99 CO 0.00 0.90 -0.03 0.00 0.09 0.00 0.00 178.44 179.41 3h6f h ALA 100 N 1.14 0.90 -0.65 1.53 0.00 -0.98 -1.11 119.26 120.09 3h6f h ALA 100 Ca 0.07 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 3h6f h ALA 100 Cb 0.78 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3h6f h ALA 100 CO 0.06 0.65 0.09 -0.97 0.00 0.00 0.00 179.25 179.07 3h6f h ASN 101 N 0.89 1.03 -0.17 0.00 -0.73 -1.05 -1.25 115.58 114.31 3h6f h ASN 101 Ca 0.16 -0.25 -0.14 0.00 1.87 0.00 0.00 56.30 57.93 3h6f h ASN 101 Cb 0.56 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.86 3h6f h ASN 101 CO 0.03 1.03 -0.40 0.58 -0.37 0.00 0.00 177.43 178.31 3h6f h VAL 102 N 1.00 1.29 -0.23 2.57 2.07 -1.06 -1.42 116.25 120.47 3h6f h VAL 102 Ca 0.20 -1.57 -0.14 0.00 0.82 0.00 0.00 66.70 66.00 3h6f h VAL 102 Cb 0.45 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3h6f h VAL 102 CO 0.02 0.51 -0.44 1.88 0.02 0.00 0.00 177.57 179.55 3h6f h TYR 103 N 0.58 0.69 -0.52 1.57 0.05 -0.96 -0.89 116.97 117.48 3h6f h TYR 103 Ca 0.05 -0.21 -0.09 0.00 0.05 0.00 0.00 58.73 58.52 3h6f h TYR 103 Cb 0.94 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 38.51 3h6f h TYR 103 CO 0.05 0.91 -0.05 0.00 -1.05 0.00 0.00 178.16 178.02 3h6f h ALA 104 N 1.05 0.95 -0.29 3.88 0.00 -1.04 0.40 119.26 124.21 3h6f h ALA 104 Ca 0.03 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 3h6f h ALA 104 Cb 0.96 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3h6f h ALA 104 CO 0.09 0.63 -0.14 0.37 0.00 0.00 0.00 179.25 180.19 3h6f h GLN 105 N 0.83 0.61 0.03 0.00 5.75 -1.05 -1.77 115.11 119.52 3h6f h GLN 105 Ca 0.15 -0.27 -0.00 0.00 -0.15 0.00 0.00 58.65 58.38 3h6f h GLN 105 Cb 0.56 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.09 3h6f h GLN 105 CO 0.03 0.84 -0.01 1.15 -2.65 0.00 0.00 178.83 178.19 3h6f h THR 106 N 0.36 1.24 -0.47 2.39 2.02 -0.89 -2.41 112.91 115.16 3h6f h THR 106 Ca 0.07 -0.86 -0.05 0.00 0.77 0.00 0.00 66.41 66.33 3h6f h THR 106 Cb 0.66 1.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.86 3h6f h THR 106 CO 0.04 0.22 0.09 -0.07 0.37 0.00 0.00 175.52 176.17 3h6f h LEU 107 N -0.42 0.66 -0.94 2.58 3.38 -0.98 -1.56 115.31 118.04 3h6f h LEU 107 Ca -0.00 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3h6f h LEU 107 Cb 0.39 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 3h6f h LEU 107 CO 0.01 0.67 -0.09 1.23 0.09 0.00 0.00 178.44 180.35 3h6f h GLY 108 N 0.91 0.72 1.49 0.83 0.00 -1.31 -0.76 103.07 104.95 3h6f h GLY 108 Ca 0.15 -0.51 -0.20 0.00 0.00 0.00 0.00 47.33 46.77 3h6f h GLY 108 CO 0.00 0.47 -0.78 -0.84 0.00 0.00 0.00 176.54 175.40 3h6f h THR 109 N 0.62 1.36 -0.27 4.70 2.02 -1.03 -2.89 112.91 117.41 3h6f h THR 109 Ca 0.11 -2.15 -0.06 0.00 0.77 0.00 0.00 66.41 65.08 3h6f h THR 109 Cb 0.52 2.14 -0.01 0.00 -1.74 0.00 0.00 68.15 69.06 3h6f h THR 109 CO 0.03 0.65 -0.06 0.40 0.37 0.00 0.00 175.52 176.92 3h6f h ILE 110 N 0.33 1.28 -0.29 3.11 2.04 -0.97 0.16 117.51 123.16 3h6f h ILE 110 Ca -0.04 -1.07 0.02 0.00 1.00 0.00 0.00 64.86 64.76 3h6f h ILE 110 Cb 1.38 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 38.86 3h6f h ILE 110 CO 0.14 0.34 0.20 0.15 0.00 0.00 0.00 178.15 178.98 3h6f h PHE 111 N 0.28 0.32 0.00 1.37 3.57 -1.17 -1.91 116.94 119.41 3h6f h PHE 111 Ca 0.07 0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.36 3h6f h PHE 111 Cb 0.53 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 3h6f h PHE 111 CO 0.05 0.20 -1.32 2.41 -2.23 0.00 0.00 178.31 177.41 3h6f n THR 112 N -4.49 1.51 0.06 4.41 -1.04 -1.09 -4.77 114.28 108.86 3h6f n THR 112 Ca 0.02 -0.03 -0.23 0.00 -2.04 0.00 0.00 64.05 61.77 3h6f n THR 112 Cb 0.11 -2.10 -0.15 0.00 -1.82 0.00 0.00 70.33 66.37 3h6f n THR 112 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3h6f h GLU 113 N -1.00 0.36 -7.03 -2.82 3.07 -0.73 -3.48 114.58 102.95 3h6f h GLU 113 Ca -0.32 -0.62 -0.47 0.00 -0.50 0.00 0.00 59.36 57.45 3h6f h GLU 113 Cb 1.18 0.23 0.01 0.00 -0.84 0.00 0.00 28.75 29.33 3h6f h GLU 113 CO -0.20 1.30 0.38 -0.65 -1.40 0.00 0.00 179.01 178.44 3h6f s GLN 114 N -2.56 4.00 0.14 2.33 -0.21 -0.72 -4.99 119.66 117.65 3h6f s GLN 114 Ca -0.17 1.35 -0.19 0.00 0.02 0.00 0.00 55.36 56.37 3h6f s GLN 114 Cb 0.05 -2.25 0.00 0.00 1.00 0.00 0.00 33.01 31.82 3h6f s GLN 114 CO 0.83 -0.25 1.72 0.00 -2.12 0.00 0.00 175.29 175.46 3h6f h ALA 115 N 1.93 0.23 -3.20 6.09 0.00 -1.93 -3.40 119.26 118.97 3h6f h ALA 115 Ca -0.49 0.07 -0.66 0.00 0.00 0.00 0.00 54.91 53.83 3h6f h ALA 115 Cb 1.21 0.11 -0.30 0.00 0.00 0.00 0.00 17.79 18.82 3h6f h ALA 115 CO 0.60 -0.41 -0.80 0.21 0.00 0.00 0.00 179.25 178.85 3h6f s LYS 116 N -6.19 3.24 0.95 0.00 2.20 -1.26 -5.12 119.74 113.56 3h6f s LYS 116 Ca -0.13 -0.74 -0.12 0.00 -0.36 0.00 0.00 55.97 54.62 3h6f s LYS 116 Cb 0.11 -2.64 0.16 0.00 -1.51 0.00 0.00 37.83 33.95 3h6f s LYS 116 CO 0.69 0.03 1.09 -1.25 -0.36 0.00 0.00 175.35 175.55 3h6f s PRO 117 N 0.80 0.83 -0.13 4.03 0.04 -1.26 -4.91 135.00 134.40 3h6f s PRO 117 Ca -0.05 0.76 -0.25 0.00 0.04 0.00 0.00 61.00 61.49 3h6f s PRO 117 Cb -0.15 -1.76 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 3h6f s PRO 117 CO 0.00 -2.52 0.81 0.71 0.04 0.00 0.00 177.00 176.04 3h6f s TYR 118 N -2.90 3.48 -1.42 0.56 1.51 -1.26 -4.95 117.35 112.37 3h6f s TYR 118 Ca 0.64 1.28 -0.11 0.00 -1.01 0.00 0.00 57.07 57.88 3h6f s TYR 118 Cb -0.19 -2.96 0.06 0.00 -0.11 0.00 0.00 41.96 38.76 3h6f s TYR 118 CO 0.58 -0.13 2.29 0.39 -1.11 0.00 0.00 175.55 177.56 3h6f n GLU 119 N 4.74 3.45 -4.02 -0.62 1.02 -1.26 -4.71 120.64 119.23 3h6f n GLU 119 Ca 0.03 -2.90 -0.08 0.00 -0.02 0.00 0.00 57.16 54.19 3h6f n GLU 119 Cb 0.50 -3.01 -0.10 0.00 -0.02 0.00 0.00 31.44 28.81 3h6f n GLU 119 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3h6f s VAL 120 N 1.65 0.19 -0.03 2.62 -7.23 -1.26 -1.29 120.40 115.05 3h6f s VAL 120 Ca 0.50 -1.55 -0.01 0.00 -1.81 0.00 0.00 61.98 59.11 3h6f s VAL 120 Cb 0.14 -1.31 0.03 0.00 0.56 0.00 0.00 36.38 35.80 3h6f s VAL 120 CO -0.06 -0.85 0.04 -0.70 -0.31 0.00 0.00 175.10 173.22 3h6f s GLU 121 N -3.55 0.01 0.17 4.82 2.12 -0.39 -3.25 118.70 118.64 3h6f s GLU 121 Ca 0.03 0.28 0.08 0.00 0.36 0.00 0.00 54.97 55.72 3h6f s GLU 121 Cb 0.05 -0.46 -0.04 0.00 0.26 0.00 0.00 34.13 33.94 3h6f s GLU 121 CO -0.09 -0.26 -0.07 -0.51 -0.54 0.00 0.00 175.26 173.79 3h6f s LEU 122 N 1.72 3.07 -0.07 2.70 1.43 -0.13 -1.41 118.68 125.98 3h6f s LEU 122 Ca -0.01 -0.51 -0.00 0.00 -1.03 0.00 0.00 54.13 52.59 3h6f s LEU 122 Cb -0.12 -1.76 0.02 0.00 0.03 0.00 0.00 46.19 44.36 3h6f s LEU 122 CO -0.03 0.11 -0.04 0.00 0.23 0.00 0.00 176.35 176.62 3h6f s VAL 124 N 1.54 3.25 0.04 0.00 1.01 -0.80 -1.48 120.40 123.95 3h6f s VAL 124 Ca -0.01 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 61.51 3h6f s VAL 124 Cb -0.13 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 3h6f s VAL 124 CO -0.04 0.46 -0.24 0.00 0.00 0.00 0.00 175.10 175.28 3h6f s ALA 125 N 1.13 2.04 -0.03 5.51 0.00 -0.69 -0.97 121.76 128.76 3h6f s ALA 125 Ca 0.01 -1.17 0.02 0.00 0.00 0.00 0.00 51.96 50.83 3h6f s ALA 125 Cb -0.14 -0.43 0.01 0.00 0.00 0.00 0.00 23.12 22.55 3h6f s ALA 125 CO -0.02 0.48 -0.07 -2.00 0.00 0.00 0.00 175.76 174.15 3h6f s GLU 126 N -1.15 0.83 0.46 0.00 2.12 -0.28 -0.39 118.70 120.28 3h6f s GLU 126 Ca 0.10 -0.23 0.07 0.00 0.36 0.00 0.00 54.97 55.27 3h6f s GLU 126 Cb -0.09 -0.79 -0.01 0.00 0.26 0.00 0.00 34.13 33.50 3h6f s GLU 126 CO 0.02 0.06 0.33 0.14 -0.54 0.00 0.00 175.26 175.27 3h6f s VAL 127 N 0.32 2.20 0.69 3.70 -7.23 -0.87 -1.61 120.40 117.61 3h6f s VAL 127 Ca -0.05 -1.49 -0.13 0.00 -1.81 0.00 0.00 61.98 58.50 3h6f s VAL 127 Cb -0.09 -2.70 0.01 0.00 0.56 0.00 0.00 36.38 34.17 3h6f s VAL 127 CO 0.00 0.00 1.08 0.00 -0.31 0.00 0.00 175.10 175.88 3h6f s ALA 128 N -2.61 2.51 0.71 1.32 0.00 -1.26 -4.88 121.76 117.54 3h6f s ALA 128 Ca 0.41 0.33 -0.11 0.00 0.00 0.00 0.00 51.96 52.60 3h6f s ALA 128 Cb -0.01 -3.26 0.02 0.00 0.00 0.00 0.00 23.12 19.87 3h6f s ALA 128 CO 0.24 -1.31 1.07 -1.01 0.00 0.00 0.00 175.76 174.75 3h6f s HIS 129 N -2.68 3.05 0.09 0.00 3.76 -1.26 -4.81 115.29 113.45 3h6f s HIS 129 Ca 0.63 1.41 -0.35 0.00 -0.15 0.00 0.00 55.06 56.59 3h6f s HIS 129 Cb -0.17 -2.91 -0.14 0.00 1.11 0.00 0.00 32.58 30.47 3h6f s HIS 129 CO 0.48 -1.32 1.59 0.98 -0.85 0.00 0.00 174.74 175.62 3h6f n TYR 130 N -3.18 2.14 -1.03 1.40 9.36 -1.26 -1.98 117.16 122.61 3h6f n TYR 130 Ca 0.08 0.30 -0.01 0.00 3.32 0.00 0.00 57.90 61.58 3h6f n TYR 130 Cb 0.54 -2.52 -0.00 0.00 -0.63 0.00 0.00 39.34 36.72 3h6f n TYR 130 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3h6f n GLY 131 N 3.45 0.47 3.63 2.98 0.00 -1.26 -5.03 105.19 109.43 3h6f n GLY 131 Ca 0.18 -0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 3h6f n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h6f s GLU 132 N -0.88 2.29 -0.35 1.61 2.02 -0.84 -5.11 118.70 117.45 3h6f s GLU 132 Ca 0.00 -1.09 -0.09 0.00 0.02 0.00 0.00 54.97 53.81 3h6f s GLU 132 Cb 0.00 -2.33 0.02 0.00 0.10 0.00 0.00 34.13 31.93 3h6f s GLU 132 CO 0.00 0.47 0.16 0.99 0.02 0.00 0.00 175.26 176.90 3h6f s THR 133 N -1.57 4.29 -0.26 3.63 2.01 -1.26 -4.74 115.64 117.74 3h6f s THR 133 Ca 0.25 -0.85 -0.19 0.00 0.31 0.00 0.00 61.69 61.22 3h6f s THR 133 Cb -0.10 -3.35 0.07 0.00 0.01 0.00 0.00 72.50 69.13 3h6f s THR 133 CO 0.17 -0.14 0.67 -0.75 -0.69 0.00 0.00 174.62 173.88 3h6f s LYS 134 N 1.52 0.73 0.08 4.92 2.20 -1.26 -5.10 119.74 122.82 3h6f s LYS 134 Ca 0.01 1.08 -0.31 0.00 -0.36 0.00 0.00 55.97 56.40 3h6f s LYS 134 Cb -0.19 0.24 -0.06 0.00 -1.51 0.00 0.00 37.83 36.31 3h6f s LYS 134 CO 0.05 -0.13 1.26 0.50 -0.36 0.00 0.00 175.35 176.68 3h6f s ARG 135 N 1.06 4.39 0.33 4.03 6.06 -1.26 -4.45 118.95 129.11 3h6f s ARG 135 Ca -0.06 1.87 -0.28 0.00 -2.50 0.00 0.00 55.73 54.76 3h6f s ARG 135 Cb -0.05 -3.32 -0.13 0.00 0.06 0.00 0.00 34.95 31.51 3h6f s ARG 135 CO -0.10 -0.32 1.22 -2.30 -2.50 0.00 0.00 175.30 171.30 3h6f n PRO 136 N 3.97 1.94 -4.56 5.12 -0.02 -1.26 -4.90 135.00 135.28 3h6f n PRO 136 Ca 0.10 0.68 -0.34 0.00 -2.02 0.00 0.00 63.50 61.92 3h6f n PRO 136 Cb 0.45 -2.21 -0.12 0.00 -0.02 0.00 0.00 33.50 31.60 3h6f n PRO 136 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3h6f s GLU 137 N -1.81 3.30 -0.08 -0.52 2.02 -0.63 -4.99 118.70 116.00 3h6f s GLU 137 Ca 0.56 -0.57 0.03 0.00 0.02 0.00 0.00 54.97 55.01 3h6f s GLU 137 Cb -0.60 -2.74 0.01 0.00 0.10 0.00 0.00 34.13 30.90 3h6f s GLU 137 CO 0.62 0.38 -0.15 -0.51 0.02 0.00 0.00 175.26 175.61 3h6f s LEU 138 N -0.03 1.76 -0.03 1.80 1.02 -1.24 -1.12 118.68 120.84 3h6f s LEU 138 Ca -0.00 -0.37 0.07 0.00 0.02 0.00 0.00 54.13 53.85 3h6f s LEU 138 Cb -0.13 -0.98 -0.02 0.00 0.02 0.00 0.00 46.19 45.08 3h6f s LEU 138 CO 0.03 0.06 -0.24 -0.31 0.02 0.00 0.00 176.35 175.92 3h6f s TYR 139 N 0.60 2.17 -0.20 0.29 2.02 -0.14 -1.84 117.35 120.24 3h6f s TYR 139 Ca -0.15 -0.48 -0.03 0.00 -0.37 0.00 0.00 57.07 56.04 3h6f s TYR 139 Cb -0.16 -1.40 -0.01 0.00 -0.40 0.00 0.00 41.96 39.98 3h6f s TYR 139 CO 0.05 -0.08 -0.06 0.50 -1.57 0.00 0.00 175.55 174.39 3h6f s ARG 140 N -0.43 3.42 -0.15 -0.62 3.52 -0.66 -1.91 118.95 122.11 3h6f s ARG 140 Ca 0.05 -0.62 0.01 0.00 -0.13 0.00 0.00 55.73 55.04 3h6f s ARG 140 Cb -0.10 -2.93 -0.00 0.00 -1.56 0.00 0.00 34.95 30.36 3h6f s ARG 140 CO 0.00 -0.07 -0.16 0.42 -0.81 0.00 0.00 175.30 174.68 3h6f s ILE 141 N 1.13 2.58 0.38 4.11 1.09 -0.05 -1.50 121.20 128.93 3h6f s ILE 141 Ca 0.01 -0.80 0.07 0.00 -1.10 0.00 0.00 60.65 58.84 3h6f s ILE 141 Cb -0.15 -2.08 -0.01 0.00 -1.06 0.00 0.00 42.46 39.16 3h6f s ILE 141 CO -0.01 0.52 0.41 0.42 -0.10 0.00 0.00 174.94 176.18 3h6f s THR 142 N 0.80 3.24 0.58 2.92 -4.23 -0.63 -0.96 115.64 117.36 3h6f s THR 142 Ca -0.06 -1.21 0.35 0.00 -1.18 0.00 0.00 61.69 59.59 3h6f s THR 142 Cb -0.15 -3.13 0.51 0.00 1.34 0.00 0.00 72.50 71.07 3h6f s THR 142 CO -0.00 -0.08 1.64 0.10 -0.54 0.00 0.00 174.62 175.74 3h6f h TYR 143 N 0.98 0.00 -0.01 3.99 -0.00 -1.83 0.24 116.97 120.34 3h6f h TYR 143 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.30 3h6f h TYR 143 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.99 3h6f h TYR 143 CO 0.48 0.00 -0.58 -0.40 -0.00 0.00 0.00 178.16 177.66 3h6f n ASP 144 N -3.76 1.31 0.00 0.10 3.85 -1.26 -4.56 116.55 112.22 3h6f n ASP 144 Ca 0.25 -1.05 0.00 0.00 -0.71 0.00 0.00 54.79 53.28 3h6f n ASP 144 Cb 1.37 0.52 0.00 0.00 -1.35 0.00 0.00 41.12 41.65 3h6f n ASP 144 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3h6f n GLY 145 N 1.44 1.04 3.73 6.12 0.00 0.07 -4.08 105.19 113.51 3h6f n GLY 145 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 3h6f n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6f s SER 146 N -2.00 7.42 -0.10 1.61 0.01 -1.25 -4.76 113.70 114.63 3h6f s SER 146 Ca 0.00 1.70 0.04 0.00 1.31 0.00 0.00 55.95 59.00 3h6f s SER 146 Cb 0.00 -2.56 -0.00 0.00 0.21 0.00 0.00 66.02 63.67 3h6f s SER 146 CO 0.00 -0.05 -0.23 -0.51 0.41 0.00 0.00 173.24 172.85 3h6f s ILE 147 N 0.03 2.11 -0.07 1.44 2.07 -1.26 -1.60 121.20 123.93 3h6f s ILE 147 Ca 0.45 -1.00 0.02 0.00 -1.41 0.00 0.00 60.65 58.72 3h6f s ILE 147 Cb -0.23 -1.81 0.01 0.00 0.13 0.00 0.00 42.46 40.57 3h6f s ILE 147 CO 0.28 0.56 -0.13 0.00 -1.91 0.00 0.00 174.94 173.74 3h6f s ALA 148 N 0.36 1.32 -0.58 1.50 0.00 -0.56 -4.99 121.76 118.80 3h6f s ALA 148 Ca -0.18 -0.45 -0.23 0.00 0.00 0.00 0.00 51.96 51.10 3h6f s ALA 148 Cb -0.18 -0.58 0.06 0.00 0.00 0.00 0.00 23.12 22.42 3h6f s ALA 148 CO 0.08 0.13 0.89 0.34 0.00 0.00 0.00 175.76 177.20 3h6f s ASP 149 N 0.63 6.25 -0.20 0.00 -1.08 -1.26 -1.66 116.67 119.34 3h6f s ASP 149 Ca -0.15 -0.72 -0.16 0.00 -0.52 0.00 0.00 52.55 51.01 3h6f s ASP 149 Cb -0.16 -2.40 -0.04 0.00 -1.46 0.00 0.00 42.92 38.86 3h6f s ASP 149 CO 0.04 -1.25 0.39 -1.61 0.52 0.00 0.00 175.17 173.27 3h6f s GLU 150 N 3.73 4.17 0.17 4.34 0.41 -0.77 -5.00 118.70 125.75 3h6f s GLU 150 Ca 0.24 0.19 0.09 0.00 -0.41 0.00 0.00 54.97 55.09 3h6f s GLU 150 Cb -0.16 -3.54 -0.13 0.00 -1.78 0.00 0.00 34.13 28.53 3h6f s GLU 150 CO 0.14 -0.04 1.33 -1.35 -0.49 0.00 0.00 175.26 174.85 3h6f h PRO 151 N 7.38 0.00 0.00 0.39 0.11 -1.94 -3.28 132.00 134.66 3h6f h PRO 151 Ca -0.36 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.60 3h6f h PRO 151 Cb 1.16 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 3h6f h PRO 151 CO 0.71 0.85 -1.50 0.72 -0.21 0.00 0.00 178.00 178.58 3h6f n HIS 152 N -3.32 0.00 -3.70 0.65 8.25 -1.26 -4.89 115.22 110.96 3h6f n HIS 152 Ca 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 3h6f n HIS 152 Cb 0.88 -0.32 -0.06 0.00 1.12 0.00 0.00 29.99 31.61 3h6f n HIS 152 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 3h6f s PHE 153 N -2.16 -0.12 -0.03 4.41 -0.12 -1.26 -2.24 117.98 116.46 3h6f s PHE 153 Ca -0.12 -0.19 0.02 0.00 -0.05 0.00 0.00 56.93 56.59 3h6f s PHE 153 Cb 0.05 0.16 0.00 0.00 -0.63 0.00 0.00 43.02 42.61 3h6f s PHE 153 CO 0.16 -0.63 -0.09 0.08 -0.05 0.00 0.00 175.22 174.69 3h6f s VAL 154 N -3.58 0.76 -0.10 -2.49 1.01 -0.70 -4.88 120.40 110.43 3h6f s VAL 154 Ca 0.02 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.66 3h6f s VAL 154 Cb 0.02 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.73 3h6f s VAL 154 CO -0.10 0.24 -0.11 -0.69 0.00 0.00 0.00 175.10 174.44 3h6f s VAL 155 N 0.23 1.19 0.03 2.92 1.01 -1.26 -2.00 120.40 122.52 3h6f s VAL 155 Ca -0.04 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.54 3h6f s VAL 155 Cb -0.09 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.14 3h6f s VAL 155 CO 0.00 0.38 -0.12 -0.04 0.00 0.00 0.00 175.10 175.33 3h6f s MET 156 N 1.20 0.85 0.05 2.72 -1.94 -0.35 -4.99 119.30 116.84 3h6f s MET 156 Ca -0.04 -0.65 0.00 0.00 -1.71 0.00 0.00 55.69 53.29 3h6f s MET 156 Cb -0.14 -0.82 0.00 0.00 2.01 0.00 0.00 34.83 35.87 3h6f s MET 156 CO -0.03 0.21 0.00 0.41 -0.01 0.00 0.00 175.02 175.59 3h6f n GLY 157 N 2.09 -2.86 7.00 -0.03 0.00 -1.26 -1.16 105.19 108.97 3h6f n GLY 157 Ca -0.17 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3h6f n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6f n GLY 158 N -1.69 1.96 3.32 -0.02 0.00 -0.54 -4.34 105.19 103.87 3h6f n GLY 158 Ca -0.00 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 3h6f n GLY 158 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h6f s THR 159 N 0.00 4.54 0.04 2.61 2.01 -1.26 -4.36 115.64 119.22 3h6f s THR 159 Ca 0.00 -1.23 -0.22 0.00 0.31 0.00 0.00 61.69 60.55 3h6f s THR 159 Cb 0.00 -3.72 -0.15 0.00 0.01 0.00 0.00 72.50 68.64 3h6f s THR 159 CO 0.00 -0.48 1.44 0.74 -0.69 0.00 0.00 174.62 175.63 3h6f h THR 160 N 5.96 1.27 -0.63 -0.82 2.02 -1.95 -3.37 112.91 115.39 3h6f h THR 160 Ca -0.25 -0.87 0.04 0.00 0.77 0.00 0.00 66.41 66.10 3h6f h THR 160 Cb 1.09 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 69.12 3h6f h THR 160 CO 0.77 0.25 0.37 -0.08 0.37 0.00 0.00 175.52 177.21 3h6f h GLU 161 N -0.13 0.70 -0.14 6.66 4.81 -1.97 -0.32 114.58 124.20 3h6f h GLU 161 Ca 0.03 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.12 3h6f h GLU 161 Cb 0.39 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 3h6f h GLU 161 CO 0.01 0.47 -0.31 -1.35 -0.73 0.00 0.00 179.01 177.09 3h6f h PRO 162 N 0.72 0.28 0.12 0.92 0.11 -1.91 -1.91 132.00 130.33 3h6f h PRO 162 Ca 0.26 -0.11 -0.27 0.00 0.11 0.00 0.00 66.00 65.99 3h6f h PRO 162 Cb 0.07 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 31.17 3h6f h PRO 162 CO -0.13 0.57 -1.22 0.82 -0.21 0.00 0.00 178.00 177.84 3h6f h ILE 163 N 0.25 1.45 -0.25 4.15 2.04 -1.64 -2.83 117.51 120.68 3h6f h ILE 163 Ca 0.03 -2.89 -0.13 0.00 1.00 0.00 0.00 64.86 62.87 3h6f h ILE 163 Cb 0.68 2.86 -0.01 0.00 -0.74 0.00 0.00 36.82 39.60 3h6f h ILE 163 CO 0.05 0.85 -0.40 0.00 0.00 0.00 0.00 178.15 178.65 3h6f h ALA 164 N 0.55 0.84 0.04 1.87 0.00 -0.98 -2.56 119.26 119.02 3h6f h ALA 164 Ca -0.14 -0.44 -0.25 0.00 0.00 0.00 0.00 54.91 54.08 3h6f h ALA 164 Cb 1.92 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.61 3h6f h ALA 164 CO 0.21 0.64 -1.05 -0.91 0.00 0.00 0.00 179.25 178.14 3h6f h ASN 165 N 0.48 0.62 1.03 0.00 2.35 -1.43 -2.17 115.58 116.46 3h6f h ASN 165 Ca 0.04 -0.53 0.00 0.00 -0.55 0.00 0.00 56.30 55.26 3h6f h ASN 165 Cb 0.90 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.08 3h6f h ASN 165 CO 0.08 1.34 0.00 0.00 -1.65 0.00 0.00 177.43 177.20 3h6f h ALA 166 N 0.61 1.00 0.00 -0.83 0.00 -1.48 -2.89 119.26 115.67 3h6f h ALA 166 Ca -0.11 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.47 3h6f h ALA 166 Cb 1.71 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.44 3h6f h ALA 166 CO 0.19 0.00 -2.07 -0.11 0.00 0.00 0.00 179.25 177.26 3h6f n LEU 167 N -3.00 0.44 0.28 0.00 7.94 -0.97 -3.65 117.00 118.04 3h6f n LEU 167 Ca 0.01 0.20 0.14 0.00 -1.11 0.00 0.00 56.01 55.25 3h6f n LEU 167 Cb 0.31 0.33 0.81 0.00 0.53 0.00 0.00 43.42 45.40 3h6f n LEU 167 CO 0.27 0.45 1.03 0.11 -1.11 0.00 0.00 177.39 178.13 3h6f h LYS 168 N 0.00 0.00 0.00 1.96 1.57 -1.17 -3.00 116.57 115.93 3h6f h LYS 168 Ca -0.42 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.16 3h6f h LYS 168 Cb 2.14 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 34.42 3h6f h LYS 168 CO 0.05 0.08 -1.26 0.39 -0.57 0.00 0.00 179.45 178.14 3h6f n GLU 169 N -3.61 0.54 -0.59 3.15 1.02 -1.19 -4.62 120.64 115.34 3h6f n GLU 169 Ca -0.02 0.49 -0.02 0.00 -0.02 0.00 0.00 57.16 57.60 3h6f n GLU 169 Cb 0.19 -1.67 0.20 0.00 -0.02 0.00 0.00 31.44 30.13 3h6f n GLU 169 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3h6f n SER 170 N -4.45 3.67 -4.84 1.62 3.41 -1.22 -4.98 113.62 106.83 3h6f n SER 170 Ca -0.28 -2.67 -0.34 0.00 -0.26 0.00 0.00 58.87 55.32 3h6f n SER 170 Cb 0.60 -0.64 -0.06 0.00 -0.26 0.00 0.00 64.21 63.85 3h6f n SER 170 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3h6f s TYR 171 N -1.99 3.53 -0.11 7.33 5.04 -1.13 -4.96 117.35 125.05 3h6f s TYR 171 Ca 0.32 1.17 0.01 0.00 -2.44 0.00 0.00 57.07 56.13 3h6f s TYR 171 Cb 0.25 -2.47 0.02 0.00 0.35 0.00 0.00 41.96 40.12 3h6f s TYR 171 CO 0.08 0.29 -0.12 0.00 -1.34 0.00 0.00 175.55 174.47 3h6f s ALA 172 N -1.67 1.52 0.53 3.97 0.00 -1.26 -5.04 121.76 119.82 3h6f s ALA 172 Ca 0.45 -0.65 0.28 0.00 0.00 0.00 0.00 51.96 52.04 3h6f s ALA 172 Cb -0.14 -0.87 1.42 0.00 0.00 0.00 0.00 23.12 23.53 3h6f s ALA 172 CO 0.20 -0.24 1.93 0.93 0.00 0.00 0.00 175.76 178.58 3h6f h GLU 173 N 7.77 0.03 -0.54 0.00 4.39 -1.98 -2.97 114.58 121.28 3h6f h GLU 173 Ca -0.32 -0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.11 3h6f h GLU 173 Cb 1.15 -0.01 -0.40 0.00 -0.10 0.00 0.00 28.75 29.39 3h6f h GLU 173 CO 0.47 0.02 -1.13 0.09 -1.16 0.00 0.00 179.01 177.29 3h6f n ASN 174 N -4.33 1.58 -4.72 1.42 4.13 -1.26 -4.60 115.26 107.49 3h6f n ASN 174 Ca 0.15 -2.17 -0.38 0.00 1.68 0.00 0.00 54.58 53.86 3h6f n ASN 174 Cb 0.80 -0.49 0.05 0.00 -1.54 0.00 0.00 39.78 38.59 3h6f n ASN 174 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3h6f n ALA 175 N -0.50 1.28 -1.56 5.41 0.00 -1.12 -4.35 120.51 119.67 3h6f n ALA 175 Ca 0.08 0.10 -0.29 0.00 0.00 0.00 0.00 53.44 53.33 3h6f n ALA 175 Cb 0.80 -2.31 0.17 0.00 0.00 0.00 0.00 19.45 18.12 3h6f n ALA 175 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3h6f s SER 176 N -1.00 2.85 0.09 0.00 1.04 -1.26 -1.99 113.70 113.43 3h6f s SER 176 Ca 0.73 0.69 -0.28 0.00 0.48 0.00 0.00 55.95 57.57 3h6f s SER 176 Cb -0.42 -1.03 -0.14 0.00 0.10 0.00 0.00 66.02 64.53 3h6f s SER 176 CO 0.48 -2.94 1.67 0.25 0.98 0.00 0.00 173.24 173.68 3h6f h LEU 177 N -1.77 -0.50 -1.49 2.42 5.85 -1.99 -1.40 115.31 116.43 3h6f h LEU 177 Ca -0.47 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.34 3h6f h LEU 177 Cb 1.30 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.45 3h6f h LEU 177 CO 0.49 -0.30 0.40 0.71 -0.34 0.00 0.00 178.44 179.40 3h6f h THR 178 N -0.46 1.03 0.04 1.05 1.35 -1.94 -1.15 112.91 112.83 3h6f h THR 178 Ca -0.02 -0.22 -0.00 0.00 -0.55 0.00 0.00 66.41 65.62 3h6f h THR 178 Cb 0.40 0.33 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 3h6f h THR 178 CO -0.00 0.12 -0.02 0.44 -0.25 0.00 0.00 175.52 175.81 3h6f h ASP 179 N 0.64 -0.04 0.19 5.36 3.32 -1.91 -3.03 116.42 120.95 3h6f h ASP 179 Ca 0.26 -0.61 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 3h6f h ASP 179 Cb 0.20 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 3h6f h ASP 179 CO -0.07 0.63 -0.21 0.00 -1.72 0.00 0.00 179.24 177.86 3h6f h ALA 180 N 0.12 1.60 -0.11 3.45 0.00 -1.03 -2.01 119.26 121.27 3h6f h ALA 180 Ca -0.01 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 3h6f h ALA 180 Cb 0.65 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3h6f h ALA 180 CO 0.01 0.30 -0.12 1.25 0.00 0.00 0.00 179.25 180.69 3h6f h LEU 181 N 0.04 0.30 -1.04 0.00 7.12 -1.31 -2.26 115.31 118.16 3h6f h LEU 181 Ca 0.01 -0.48 -0.05 0.00 0.13 0.00 0.00 57.88 57.48 3h6f h LEU 181 Cb 0.40 -0.08 -0.02 0.00 -0.53 0.00 0.00 40.66 40.42 3h6f h LEU 181 CO 0.03 0.72 0.13 -0.09 -0.13 0.00 0.00 178.44 179.10 3h6f h ARG 182 N -0.12 0.82 -0.17 1.25 2.43 -1.37 -1.17 114.38 116.04 3h6f h ARG 182 Ca 0.02 -0.17 -0.12 0.00 -0.81 0.00 0.00 59.98 58.90 3h6f h ARG 182 Cb 0.64 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 3h6f h ARG 182 CO 0.03 0.74 -0.42 0.82 -1.51 0.00 0.00 179.97 179.63 3h6f h ILE 183 N 0.79 1.31 -0.05 1.20 2.04 -1.36 -2.52 117.51 118.92 3h6f h ILE 183 Ca 0.17 -1.58 -0.17 0.00 1.00 0.00 0.00 64.86 64.29 3h6f h ILE 183 Cb 0.29 1.64 0.01 0.00 -0.74 0.00 0.00 36.82 38.02 3h6f h ILE 183 CO -0.00 0.48 -0.62 0.00 0.00 0.00 0.00 178.15 178.01 3h6f h ALA 184 N 1.22 0.14 -0.22 1.87 0.00 -0.94 -3.11 119.26 118.22 3h6f h ALA 184 Ca 0.03 -0.56 -0.07 0.00 0.00 0.00 0.00 54.91 54.31 3h6f h ALA 184 Cb 0.88 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 3h6f h ALA 184 CO 0.07 0.41 -0.16 0.28 0.00 0.00 0.00 179.25 179.85 3h6f h VAL 185 N 0.07 1.22 -0.24 0.00 2.07 -1.23 -2.88 116.25 115.26 3h6f h VAL 185 Ca -0.06 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 3h6f h VAL 185 Cb 1.29 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 3h6f h VAL 185 CO 0.12 0.32 0.08 0.00 0.02 0.00 0.00 177.57 178.11 3h6f h ALA 186 N 1.49 0.32 0.00 1.67 0.00 -1.49 -2.42 119.26 118.83 3h6f h ALA 186 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3h6f h ALA 186 Cb 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3h6f h ALA 186 CO 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.22 3h6f h ALA 187 N 0.91 1.00 0.00 0.00 0.00 -1.46 -2.89 119.26 116.82 3h6f h ALA 187 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.74 3h6f h ALA 187 Cb 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 3h6f h ALA 187 CO -0.00 0.00 -1.50 1.25 0.00 0.00 0.00 179.25 179.00 3h6f h LEU 188 N 0.00 0.00 -0.13 0.00 5.85 -1.34 -3.35 115.31 116.34 3h6f h LEU 188 Ca 0.00 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.49 3h6f h LEU 188 Cb 0.54 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.58 3h6f h LEU 188 CO 0.00 0.89 -0.99 -0.09 -0.34 0.00 0.00 178.44 177.92 3h6f h ARG 189 N 0.00 0.39 -3.07 1.25 2.43 -1.30 -3.34 114.38 110.74 3h6f h ARG 189 Ca -0.21 -0.45 -0.75 0.00 -0.81 0.00 0.00 59.98 57.77 3h6f h ARG 189 Cb 1.87 0.13 -0.13 0.00 -0.42 0.00 0.00 29.97 31.42 3h6f h ARG 189 CO 0.08 1.12 2.30 0.00 -1.51 0.00 0.00 179.97 181.96 3h6f n ALA 190 N -2.54 6.13 0.00 2.80 0.00 -1.10 -5.13 120.51 120.67 3h6f n ALA 190 Ca -0.07 -4.17 0.00 0.00 0.00 0.00 0.00 53.44 49.20 3h6f n ALA 190 Cb 0.86 -2.91 0.00 0.00 0.00 0.00 0.00 19.45 17.41 3h6f n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6f n GLY 191 N 2.34 -0.71 0.00 0.00 0.00 -1.26 -4.46 105.19 101.11 3h6f n GLY 191 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.54 3h6f n GLY 191 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h6f n LEU 203 N 0.00 0.00 0.00 0.99 4.77 -1.26 -4.57 117.00 116.93 3h6f n LEU 203 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3h6f n LEU 203 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3h6f n LEU 203 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 3h6f n GLY 204 N 0.00 5.41 0.33 -0.72 0.00 -1.26 -4.99 105.19 103.95 3h6f n GLY 204 Ca 0.00 -1.28 0.03 0.00 0.00 0.00 0.00 46.02 44.77 3h6f n GLY 204 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h6f h VAL 205 N 0.00 1.13 0.00 1.61 2.07 -1.94 -1.81 116.25 117.31 3h6f h VAL 205 Ca 0.00 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 3h6f h VAL 205 Cb 0.00 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 30.07 3h6f h VAL 205 CO 0.00 0.14 -0.00 0.00 0.02 0.00 0.00 177.57 177.73 3h6f h ALA 206 N 1.64 1.00 0.00 1.67 0.00 -1.96 -3.29 119.26 118.33 3h6f h ALA 206 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3h6f h ALA 206 Cb -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3h6f h ALA 206 CO -0.05 0.00 -0.14 -1.13 0.00 0.00 0.00 179.25 177.93 3h6f n SER 207 N -3.09 1.43 -4.08 0.00 3.41 -0.90 -4.64 113.62 105.75 3h6f n SER 207 Ca 0.01 -2.43 -0.20 0.00 -0.26 0.00 0.00 58.87 55.98 3h6f n SER 207 Cb 0.32 -0.26 -0.14 0.00 -0.26 0.00 0.00 64.21 63.86 3h6f n SER 207 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h6f s LEU 208 N -1.53 2.06 -0.24 1.04 1.43 -0.73 -1.70 118.68 119.00 3h6f s LEU 208 Ca 0.15 -0.27 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 3h6f s LEU 208 Cb 0.13 -0.59 0.03 0.00 0.03 0.00 0.00 46.19 45.80 3h6f s LEU 208 CO 0.01 0.11 -0.08 -0.70 0.23 0.00 0.00 176.35 175.93 3h6f s GLU 209 N -0.48 2.78 -0.02 1.70 2.12 -0.72 -4.86 118.70 119.22 3h6f s GLU 209 Ca 0.04 -1.01 0.06 0.00 0.36 0.00 0.00 54.97 54.42 3h6f s GLU 209 Cb -0.05 -2.93 -0.01 0.00 0.26 0.00 0.00 34.13 31.39 3h6f s GLU 209 CO -0.00 -0.40 -0.21 0.08 -0.54 0.00 0.00 175.26 174.19 3h6f s VAL 210 N 1.29 1.63 -0.02 3.70 1.01 -1.26 -1.40 120.40 125.35 3h6f s VAL 210 Ca -0.00 -0.87 -0.24 0.00 0.00 0.00 0.00 61.98 60.86 3h6f s VAL 210 Cb -0.17 -1.36 0.05 0.00 0.00 0.00 0.00 36.38 34.90 3h6f s VAL 210 CO -0.05 0.46 0.52 0.00 0.00 0.00 0.00 175.10 176.03 3h6f s ALA 211 N -0.40 -1.35 0.14 5.51 0.00 -0.87 -2.02 121.76 122.77 3h6f s ALA 211 Ca 0.06 0.86 0.09 0.00 0.00 0.00 0.00 51.96 52.96 3h6f s ALA 211 Cb -0.09 0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 3h6f s ALA 211 CO -0.00 -0.35 -0.20 0.14 0.00 0.00 0.00 175.76 175.35 3h6f s VAL 212 N -1.40 1.82 -0.74 0.00 -7.23 -0.11 -0.01 120.40 112.74 3h6f s VAL 212 Ca -0.11 -1.76 -0.08 0.00 -1.81 0.00 0.00 61.98 58.22 3h6f s VAL 212 Cb -0.02 -1.75 0.19 0.00 0.56 0.00 0.00 36.38 35.37 3h6f s VAL 212 CO 0.06 -0.18 0.61 -0.76 -0.31 0.00 0.00 175.10 174.53 3h6f s LEU 213 N -2.32 5.93 -0.56 1.32 1.43 -0.66 -1.27 118.68 122.55 3h6f s LEU 213 Ca 0.12 -2.86 -0.28 0.00 -1.03 0.00 0.00 54.13 50.08 3h6f s LEU 213 Cb -0.08 -2.02 0.03 0.00 0.03 0.00 0.00 46.19 44.15 3h6f s LEU 213 CO 0.06 -0.44 1.18 -0.62 0.23 0.00 0.00 176.35 176.75 3h6f s ASP 214 N 1.27 6.48 0.00 2.29 2.15 0.32 -2.66 116.67 126.52 3h6f s ASP 214 Ca 0.18 0.16 0.10 0.00 0.43 0.00 0.00 52.55 53.42 3h6f s ASP 214 Cb -0.15 -2.55 0.57 0.00 -0.30 0.00 0.00 42.92 40.49 3h6f s ASP 214 CO -0.06 -1.44 1.15 0.00 -0.17 0.00 0.00 175.17 174.65 3h6f n ALA 215 N 8.31 1.76 1.08 3.66 0.00 -0.86 -2.17 120.51 132.29 3h6f n ALA 215 Ca 0.09 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.59 3h6f n ALA 215 Cb 0.49 -1.17 0.16 0.00 0.00 0.00 0.00 19.45 18.93 3h6f n ALA 215 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h6f n ASN 216 N -1.15 2.68 -4.79 0.00 2.85 -1.26 -4.51 115.26 109.09 3h6f n ASN 216 Ca 0.06 -1.87 -0.39 0.00 -0.11 0.00 0.00 54.58 52.27 3h6f n ASN 216 Cb 0.06 0.04 -0.06 0.00 1.24 0.00 0.00 39.78 41.06 3h6f n ASN 216 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 3h6f s ARG 217 N -2.04 4.48 0.21 1.20 1.81 -0.92 -5.00 118.95 118.67 3h6f s ARG 217 Ca 0.29 1.06 -0.12 0.00 -1.72 0.00 0.00 55.73 55.24 3h6f s ARG 217 Cb 0.20 -3.24 0.26 0.00 -0.45 0.00 0.00 34.95 31.72 3h6f s ARG 217 CO 0.33 0.58 1.67 -1.35 -0.68 0.00 0.00 175.30 175.85 3h6f h PRO 218 N 4.33 0.13 0.00 3.54 0.11 -1.91 -3.41 132.00 134.78 3h6f h PRO 218 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3h6f h PRO 218 Cb 1.21 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3h6f h PRO 218 CO 0.65 0.08 0.00 -2.13 -0.21 0.00 0.00 178.00 176.40 3h6f n ARG 219 N -5.25 0.00 -2.72 1.05 0.63 -1.26 -4.40 116.66 104.70 3h6f n ARG 219 Ca 0.08 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.59 3h6f n ARG 219 Cb 0.33 -0.09 -0.03 0.00 0.45 0.00 0.00 32.46 33.11 3h6f n ARG 219 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3h6f s ARG 220 N -1.48 3.32 0.27 -0.14 0.52 -1.26 -4.33 118.95 115.85 3h6f s ARG 220 Ca 0.00 -0.21 0.12 0.00 -0.52 0.00 0.00 55.73 55.12 3h6f s ARG 220 Cb 0.00 -4.09 0.33 0.00 0.52 0.00 0.00 34.95 31.71 3h6f s ARG 220 CO 0.00 -1.70 1.58 0.00 0.02 0.00 0.00 175.30 175.20 3h6f h ALA 221 N 9.53 0.88 -2.53 2.13 0.00 -1.34 -3.46 119.26 124.47 3h6f h ALA 221 Ca -0.27 -0.56 -0.53 0.00 0.00 0.00 0.00 54.91 53.56 3h6f h ALA 221 Cb 1.06 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.78 3h6f h ALA 221 CO 1.16 0.77 0.82 0.12 0.00 0.00 0.00 179.25 182.12 3h6f s PHE 222 N -3.45 3.03 -0.09 0.00 5.36 -1.26 -0.53 117.98 121.05 3h6f s PHE 222 Ca -0.00 0.76 -0.06 0.00 -0.96 0.00 0.00 56.93 56.67 3h6f s PHE 222 Cb 0.12 -3.79 0.04 0.00 -0.34 0.00 0.00 43.02 39.05 3h6f s PHE 222 CO 0.75 -2.88 0.22 0.50 -1.46 0.00 0.00 175.22 172.35 3h6f s ARG 223 N 1.48 0.20 -0.04 10.12 3.52 -0.40 -4.97 118.95 128.87 3h6f s ARG 223 Ca 0.67 0.43 -0.15 0.00 -0.13 0.00 0.00 55.73 56.55 3h6f s ARG 223 Cb -0.38 -0.05 -0.05 0.00 -1.56 0.00 0.00 34.95 32.90 3h6f s ARG 223 CO 0.30 -0.12 0.39 1.03 -0.81 0.00 0.00 175.30 176.10 3h6f s ARG 224 N 0.86 3.98 -0.46 5.12 0.52 -1.26 -0.94 118.95 126.77 3h6f s ARG 224 Ca -0.06 0.36 -0.05 0.00 -0.52 0.00 0.00 55.73 55.47 3h6f s ARG 224 Cb -0.08 -3.27 0.12 0.00 0.52 0.00 0.00 34.95 32.25 3h6f s ARG 224 CO -0.05 0.58 0.28 0.42 0.02 0.00 0.00 175.30 176.55 3h6f s ILE 225 N -0.70 3.60 0.28 1.52 1.01 -0.85 -4.98 121.20 121.07 3h6f s ILE 225 Ca 0.23 -2.12 0.10 0.00 0.00 0.00 0.00 60.65 58.86 3h6f s ILE 225 Cb -0.16 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 38.84 3h6f s ILE 225 CO 0.12 -0.74 -0.14 0.42 0.00 0.00 0.00 174.94 174.59 3h6f s THR 226 N 1.02 2.13 0.00 2.92 -4.23 -1.26 -4.31 115.64 111.92 3h6f s THR 226 Ca 0.09 -2.28 0.00 0.00 -1.18 0.00 0.00 61.69 58.32 3h6f s THR 226 Cb -0.23 -2.34 0.00 0.00 1.34 0.00 0.00 72.50 71.27 3h6f s THR 226 CO -0.03 -0.39 0.00 0.61 -0.54 0.00 0.00 174.62 174.27 3h6f n GLY 227 N -0.60 2.93 0.34 3.99 0.00 -1.26 -2.86 105.19 107.74 3h6f n GLY 227 Ca -0.06 0.30 0.01 0.00 0.00 0.00 0.00 46.02 46.27 3h6f n GLY 227 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3h6f h SER 228 N 0.00 0.93 0.59 1.61 0.87 -1.99 -1.40 113.55 114.16 3h6f h SER 228 Ca 0.00 0.01 -0.11 0.00 -1.23 0.00 0.00 61.79 60.46 3h6f h SER 228 Cb 0.00 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.76 3h6f h SER 228 CO 0.00 0.60 -0.52 0.00 -0.53 0.00 0.00 176.83 176.38 3h6f h ALA 229 N 1.42 1.08 0.21 6.23 0.00 -1.93 -2.69 119.26 123.59 3h6f h ALA 229 Ca 0.39 -0.47 -0.32 0.00 0.00 0.00 0.00 54.91 54.51 3h6f h ALA 229 Cb 0.14 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 17.88 3h6f h ALA 229 CO -0.16 0.65 -1.46 1.25 0.00 0.00 0.00 179.25 179.52 3h6f h LEU 230 N 0.00 0.71 -1.58 0.00 5.85 -1.50 -2.98 115.31 115.81 3h6f h LEU 230 Ca -0.01 -0.79 -0.04 0.00 0.84 0.00 0.00 57.88 57.88 3h6f h LEU 230 Cb 0.96 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 3h6f h LEU 230 CO 0.07 1.63 -0.20 -0.61 -0.34 0.00 0.00 178.44 178.98 3h6f h GLN 231 N 0.12 0.01 -0.21 1.25 5.75 -1.25 -0.87 115.11 119.92 3h6f h GLN 231 Ca -0.24 -0.00 -0.18 0.00 -0.15 0.00 0.00 58.65 58.08 3h6f h GLN 231 Cb 2.12 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 30.66 3h6f h GLN 231 CO 0.25 0.21 -0.59 0.00 -2.65 0.00 0.00 178.83 176.05 3h6f h ALA 232 N 1.79 0.57 0.00 3.38 0.00 -1.52 -3.16 119.26 120.32 3h6f h ALA 232 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3h6f h ALA 232 Cb 0.37 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3h6f h ALA 232 CO 0.03 0.69 0.00 -0.07 0.00 0.00 0.00 179.25 179.90 3h6f h LEU 233 N 0.51 0.00 0.00 0.00 4.07 -1.12 -3.52 115.31 115.25 3h6f h LEU 233 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3h6f h LEU 233 Cb 1.17 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.91 3h6f h LEU 233 CO 0.12 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 177.66