#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6f s SER 8 N 0.00 6.92 0.06 4.38 0.15 -1.26 -4.92 113.70 119.03 3h6f s SER 8 Ca 0.00 1.98 0.14 0.00 0.70 0.00 0.00 55.95 58.77 3h6f s SER 8 Cb 0.00 -2.56 0.62 0.00 -1.71 0.00 0.00 66.02 62.37 3h6f s SER 8 CO 0.00 -0.68 1.45 -2.65 1.20 0.00 0.00 173.24 172.56 3h6f n PRO 9 N 5.47 0.04 -0.11 5.44 -0.02 -1.26 -2.87 135.00 141.69 3h6f n PRO 9 Ca 0.13 0.33 -0.12 0.00 -2.02 0.00 0.00 63.50 61.82 3h6f n PRO 9 Cb 0.45 -1.59 -0.15 0.00 -0.02 0.00 0.00 33.50 32.19 3h6f n PRO 9 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3h6f n GLU 10 N -1.66 0.69 0.01 -0.52 2.13 -1.26 -3.65 120.64 116.38 3h6f n GLU 10 Ca 0.03 0.02 -0.15 0.00 0.66 0.00 0.00 57.16 57.72 3h6f n GLU 10 Cb 0.15 -1.52 -0.04 0.00 0.27 0.00 0.00 31.44 30.31 3h6f n GLU 10 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 3h6f h GLN 11 N 0.00 0.65 -0.54 5.31 5.75 -1.98 -2.95 115.11 121.35 3h6f h GLN 11 Ca -0.55 -0.54 -0.07 0.00 -0.15 0.00 0.00 58.65 57.34 3h6f h GLN 11 Cb 2.17 0.11 -0.02 0.00 1.07 0.00 0.00 27.48 30.82 3h6f h GLN 11 CO 0.01 1.15 0.06 0.00 -2.65 0.00 0.00 178.83 177.40 3h6f h ALA 12 N 0.69 0.72 -0.54 3.38 0.00 -1.72 -1.75 119.26 120.04 3h6f h ALA 12 Ca -0.05 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 3h6f h ALA 12 Cb 1.38 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 3h6f h ALA 12 CO 0.15 0.48 0.22 0.52 0.00 0.00 0.00 179.25 180.63 3h6f h MET 13 N 0.79 0.78 0.16 0.00 2.86 -1.62 -1.64 114.93 116.26 3h6f h MET 13 Ca 0.16 -0.11 -0.31 0.00 -2.06 0.00 0.00 59.70 57.38 3h6f h MET 13 Cb 0.44 -0.14 0.03 0.00 0.06 0.00 0.00 31.60 32.00 3h6f h MET 13 CO 0.02 0.64 -1.32 -0.09 1.06 0.00 0.00 176.91 177.22 3h6f h ARG 14 N 0.77 0.61 -0.09 1.72 2.43 -1.33 -2.83 114.38 115.66 3h6f h ARG 14 Ca 0.19 -0.87 -0.12 0.00 -0.81 0.00 0.00 59.98 58.36 3h6f h ARG 14 Cb 0.14 0.30 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 3h6f h ARG 14 CO -0.02 1.40 -0.50 0.93 -1.51 0.00 0.00 179.97 180.27 3h6f h GLU 15 N 0.24 0.23 -0.14 0.20 5.08 -1.20 -1.21 114.58 117.79 3h6f h GLU 15 Ca -0.21 -0.13 -0.14 0.00 -1.00 0.00 0.00 59.36 57.88 3h6f h GLU 15 Cb 1.99 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.26 3h6f h GLU 15 CO 0.25 0.69 -0.46 0.00 -1.00 0.00 0.00 179.01 178.48 3h6f h ARG 16 N 0.19 0.56 -0.30 2.33 3.08 -1.41 -1.88 114.38 116.94 3h6f h ARG 16 Ca 0.01 -0.42 -0.04 0.00 0.07 0.00 0.00 59.98 59.61 3h6f h ARG 16 Cb 0.95 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.06 3h6f h ARG 16 CO 0.08 1.04 0.03 1.03 -1.07 0.00 0.00 179.97 181.07 3h6f h SER 17 N 0.19 0.41 -0.01 7.04 0.87 -1.39 -2.06 113.55 118.59 3h6f h SER 17 Ca -0.02 -0.06 -0.24 0.00 -1.23 0.00 0.00 61.79 60.24 3h6f h SER 17 Cb 1.09 -0.10 0.02 0.00 -0.44 0.00 0.00 62.40 62.96 3h6f h SER 17 CO 0.10 0.45 -0.93 -0.08 -0.53 0.00 0.00 176.83 175.84 3h6f h GLU 18 N 0.43 0.65 -0.89 2.24 4.57 -1.17 -1.78 114.58 118.64 3h6f h GLU 18 Ca 0.10 -0.69 0.01 0.00 -1.18 0.00 0.00 59.36 57.60 3h6f h GLU 18 Cb 0.24 0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 28.98 3h6f h GLU 18 CO 0.00 1.28 0.59 1.25 -1.18 0.00 0.00 179.01 180.95 3h6f h LEU 19 N 0.30 1.01 -0.05 1.64 6.46 -1.03 -1.47 115.31 122.18 3h6f h LEU 19 Ca -0.11 -0.02 -0.14 0.00 -0.12 0.00 0.00 57.88 57.48 3h6f h LEU 19 Cb 1.59 -0.25 0.01 0.00 -0.73 0.00 0.00 40.66 41.28 3h6f h LEU 19 CO 0.18 0.73 -0.52 0.00 -0.62 0.00 0.00 178.44 178.21 3h6f h ALA 20 N 1.33 0.13 -0.43 1.25 0.00 -1.40 -2.98 119.26 117.15 3h6f h ALA 20 Ca 0.33 -0.53 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3h6f h ALA 20 Cb -0.13 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3h6f h ALA 20 CO -0.07 0.34 0.14 -0.09 0.00 0.00 0.00 179.25 179.56 3h6f h ARG 21 N -0.04 0.63 -0.08 0.00 2.43 -1.12 -2.20 114.38 114.01 3h6f h ARG 21 Ca -0.05 -0.10 -0.17 0.00 -0.81 0.00 0.00 59.98 58.85 3h6f h ARG 21 Cb 1.20 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 3h6f h ARG 21 CO 0.11 0.55 -0.68 0.87 -1.51 0.00 0.00 179.97 179.30 3h6f h LYS 22 N 0.62 0.35 -0.11 0.20 1.57 -1.34 -1.76 116.57 116.09 3h6f h LYS 22 Ca 0.15 -0.27 -0.13 0.00 -1.87 0.00 0.00 60.65 58.53 3h6f h LYS 22 Cb 0.18 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3h6f h LYS 22 CO -0.01 0.90 -0.49 0.78 -0.57 0.00 0.00 179.45 180.06 3h6f h GLY 23 N 1.37 0.32 1.47 3.86 0.00 -1.28 -2.37 103.07 106.44 3h6f h GLY 23 Ca -0.02 -0.35 -0.24 0.00 0.00 0.00 0.00 47.33 46.72 3h6f h GLY 23 CO 0.11 0.31 -0.98 -2.22 0.00 0.00 0.00 176.54 173.76 3h6f h ILE 24 N 0.24 1.38 0.00 2.60 2.04 -1.35 -3.19 117.51 119.22 3h6f h ILE 24 Ca 0.01 -2.43 -0.05 0.00 1.00 0.00 0.00 64.86 63.38 3h6f h ILE 24 Cb 0.95 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 39.47 3h6f h ILE 24 CO 0.08 0.73 -0.26 0.00 0.00 0.00 0.00 178.15 178.70 3h6f h ALA 25 N 0.65 1.23 0.00 1.87 0.00 -1.18 -1.16 119.26 120.67 3h6f h ALA 25 Ca -0.10 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3h6f h ALA 25 Cb 1.63 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.38 3h6f h ALA 25 CO 0.18 0.32 -0.39 0.54 0.00 0.00 0.00 179.25 179.90 3h6f n ARG 26 N -3.74 0.16 -2.97 0.00 1.74 -0.91 -3.98 116.66 106.97 3h6f n ARG 26 Ca -0.01 0.07 -0.23 0.00 -0.77 0.00 0.00 57.85 56.90 3h6f n ARG 26 Cb 0.36 -1.63 0.01 0.00 -1.02 0.00 0.00 32.46 30.18 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 3.70 0.77 7.54 0.00 -1.06 -4.96 121.76 124.68 3h6f s ALA 27 Ca 0.09 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 50.95 3h6f s ALA 27 Cb 0.15 -2.19 0.06 0.00 0.00 0.00 0.00 23.12 21.14 3h6f s ALA 27 CO 0.66 -0.36 1.10 0.15 0.00 0.00 0.00 175.76 177.31 3h6f s LYS 28 N -4.57 2.18 0.22 0.00 1.02 -1.26 -2.01 119.74 115.33 3h6f s LYS 28 Ca 0.48 1.25 -0.09 0.00 0.02 0.00 0.00 55.97 57.63 3h6f s LYS 28 Cb -0.10 -1.88 -0.07 0.00 -0.52 0.00 0.00 37.83 35.26 3h6f s LYS 28 CO 0.38 -1.71 0.52 -1.12 -0.92 0.00 0.00 175.35 172.50 3h6f s SER 29 N -3.19 6.60 -0.02 2.83 0.01 -1.26 -4.24 113.70 114.42 3h6f s SER 29 Ca 0.63 0.85 0.02 0.00 1.31 0.00 0.00 55.95 58.76 3h6f s SER 29 Cb -0.18 -2.20 0.01 0.00 0.21 0.00 0.00 66.02 63.85 3h6f s SER 29 CO 0.54 -0.05 -0.05 -0.69 0.41 0.00 0.00 173.24 173.40 3h6f s VAL 30 N -1.80 0.48 0.02 3.43 1.01 -0.33 -1.96 120.40 121.26 3h6f s VAL 30 Ca 0.46 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 62.32 3h6f s VAL 30 Cb -0.11 -0.45 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 3h6f s VAL 30 CO 0.22 0.17 -0.20 0.68 0.00 0.00 0.00 175.10 175.97 3h6f s VAL 31 N 0.30 1.56 -0.08 2.92 -7.23 0.07 -1.18 120.40 116.77 3h6f s VAL 31 Ca -0.03 -1.04 -0.00 0.00 -1.81 0.00 0.00 61.98 59.09 3h6f s VAL 31 Cb -0.07 -1.34 0.02 0.00 0.56 0.00 0.00 36.38 35.55 3h6f s VAL 31 CO -0.00 0.27 -0.04 0.00 -0.31 0.00 0.00 175.10 175.02 3h6f s ALA 32 N -0.68 0.92 0.02 1.32 0.00 -0.33 0.20 121.76 123.22 3h6f s ALA 32 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.78 3h6f s ALA 32 Cb -0.08 -0.70 -0.02 0.00 0.00 0.00 0.00 23.12 22.32 3h6f s ALA 32 CO 0.01 -0.29 -0.03 -0.48 0.00 0.00 0.00 175.76 174.97 3h6f s LEU 33 N 1.52 2.21 0.52 0.00 0.05 -0.54 -0.44 118.68 122.01 3h6f s LEU 33 Ca -0.01 -0.44 -0.19 0.00 0.05 0.00 0.00 54.13 53.54 3h6f s LEU 33 Cb -0.13 0.06 -0.07 0.00 -2.05 0.00 0.00 46.19 44.00 3h6f s LEU 33 CO -0.04 -0.25 1.04 0.00 -0.55 0.00 0.00 176.35 176.55 3h6f s ALA 34 N -1.27 2.84 0.31 1.48 0.00 -1.00 -0.53 121.76 123.59 3h6f s ALA 34 Ca -0.13 0.53 -0.08 0.00 0.00 0.00 0.00 51.96 52.27 3h6f s ALA 34 Cb -0.09 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.80 3h6f s ALA 34 CO -0.01 -0.46 0.52 1.52 0.00 0.00 0.00 175.76 177.33 3h6f s TYR 35 N -2.14 0.66 0.30 0.00 -0.85 -0.35 -4.72 117.35 110.25 3h6f s TYR 35 Ca 0.66 -1.01 -0.01 0.00 -0.52 0.00 0.00 57.07 56.20 3h6f s TYR 35 Cb -0.16 0.15 0.49 0.00 0.38 0.00 0.00 41.96 42.82 3h6f s TYR 35 CO 0.25 -1.14 1.95 0.00 -1.52 0.00 0.00 175.55 175.09 3h6f h ALA 36 N 2.16 1.46 -0.02 9.51 0.00 -1.29 -2.84 119.26 128.24 3h6f h ALA 36 Ca -0.28 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3h6f h ALA 36 Cb 1.25 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3h6f h ALA 36 CO 0.38 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.51 3h6f n GLY 37 N -1.41 0.08 0.00 0.00 0.00 -1.26 -5.03 105.19 97.56 3h6f n GLY 37 Ca 0.11 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.67 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 1.18 0.05 3.32 -0.02 0.00 -1.07 -1.49 105.19 107.16 3h6f n GLY 38 Ca 0.19 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.39 2.02 -0.08 1.61 1.01 -0.89 -1.21 120.40 120.48 3h6f s VAL 39 Ca 0.00 -1.38 0.04 0.00 0.00 0.00 0.00 61.98 60.65 3h6f s VAL 39 Cb 0.00 -1.74 -0.00 0.00 0.00 0.00 0.00 36.38 34.63 3h6f s VAL 39 CO 0.00 0.29 -0.23 -0.22 0.00 0.00 0.00 175.10 174.95 3h6f s LEU 40 N -1.31 2.03 -0.16 3.92 2.96 0.31 -1.16 118.68 125.27 3h6f s LEU 40 Ca 0.11 -0.50 -0.03 0.00 -0.22 0.00 0.00 54.13 53.49 3h6f s LEU 40 Cb -0.10 -1.31 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 3h6f s LEU 40 CO 0.02 0.17 -0.06 -0.36 -1.32 0.00 0.00 176.35 174.80 3h6f s PHE 41 N 0.21 2.96 -0.10 5.38 0.08 0.21 -1.47 117.98 125.24 3h6f s PHE 41 Ca -0.13 -0.47 0.01 0.00 0.12 0.00 0.00 56.93 56.46 3h6f s PHE 41 Cb -0.16 -1.95 0.02 0.00 -0.57 0.00 0.00 43.02 40.36 3h6f s PHE 41 CO 0.06 -0.15 -0.13 0.08 -0.10 0.00 0.00 175.22 174.98 3h6f s VAL 42 N 0.51 1.32 0.04 -0.44 1.01 0.13 -2.63 120.40 120.34 3h6f s VAL 42 Ca -0.05 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.43 3h6f s VAL 42 Cb -0.15 -1.23 -0.02 0.00 0.00 0.00 0.00 36.38 34.98 3h6f s VAL 42 CO 0.03 0.41 -0.09 0.00 0.00 0.00 0.00 175.10 175.45 3h6f s ALA 43 N 1.09 0.69 -0.56 5.51 0.00 0.02 -0.75 121.76 127.77 3h6f s ALA 43 Ca -0.05 -0.75 -0.23 0.00 0.00 0.00 0.00 51.96 50.93 3h6f s ALA 43 Cb -0.14 -0.01 0.05 0.00 0.00 0.00 0.00 23.12 23.01 3h6f s ALA 43 CO -0.02 0.04 0.89 -2.00 0.00 0.00 0.00 175.76 174.67 3h6f s GLU 44 N -1.41 3.25 -0.23 0.00 2.12 -0.83 -0.56 118.70 121.04 3h6f s GLU 44 Ca -0.07 -0.49 -0.03 0.00 0.36 0.00 0.00 54.97 54.75 3h6f s GLU 44 Cb -0.09 -4.10 0.11 0.00 0.26 0.00 0.00 34.13 30.31 3h6f s GLU 44 CO 0.01 -1.50 0.24 1.21 -0.54 0.00 0.00 175.26 174.67 3h6f s ASN 45 N 2.98 1.54 0.41 -1.70 2.47 -0.17 -4.66 114.94 115.81 3h6f s ASN 45 Ca 0.26 -0.40 0.22 0.00 0.42 0.00 0.00 52.86 53.36 3h6f s ASN 45 Cb -0.15 0.40 0.81 0.00 -1.45 0.00 0.00 41.25 40.86 3h6f s ASN 45 CO 0.16 -0.35 1.79 1.55 -3.72 0.00 0.00 177.10 176.53 3h6f h PRO 46 N 8.30 0.00 -6.90 0.43 0.13 -1.80 -3.25 132.00 128.91 3h6f h PRO 46 Ca -0.16 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.46 3h6f h PRO 46 Cb 1.12 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 0.50 0.45 -0.23 0.00 0.00 178.00 179.32 3h6f s SER 47 N -6.31 6.78 -0.00 1.44 0.15 -1.26 -4.82 113.70 109.68 3h6f s SER 47 Ca 0.00 2.34 0.21 0.00 0.70 0.00 0.00 55.95 59.21 3h6f s SER 47 Cb 0.11 -2.62 -0.21 0.00 -1.71 0.00 0.00 66.02 61.59 3h6f s SER 47 CO 0.66 -0.49 0.88 -1.14 1.20 0.00 0.00 173.24 174.35 3h6f n ARG 48 N 0.46 0.07 -0.09 5.44 0.63 -1.26 -4.61 116.66 117.30 3h6f n ARG 48 Ca 0.02 -0.02 -0.17 0.00 -0.92 0.00 0.00 57.85 56.77 3h6f n ARG 48 Cb 0.46 -1.50 -0.07 0.00 0.45 0.00 0.00 32.46 31.79 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 -1.58 1.94 -4.56 6.15 7.64 -1.26 -4.93 113.62 117.03 3h6f n SER 49 Ca 0.03 0.08 -0.42 0.00 1.01 0.00 0.00 58.87 59.57 3h6f n SER 49 Cb 0.36 -0.43 -0.03 0.00 -1.01 0.00 0.00 64.21 63.10 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 -6.56 3.56 0.12 -3.43 1.43 -1.26 -5.03 118.68 107.52 3h6f s LEU 50 Ca -0.25 -0.17 -0.27 0.00 -1.03 0.00 0.00 54.13 52.42 3h6f s LEU 50 Cb 0.08 -2.92 -0.07 0.00 0.03 0.00 0.00 46.19 43.31 3h6f s LEU 50 CO 0.37 -1.51 0.83 -1.10 0.23 0.00 0.00 176.35 175.17 3h6f s GLN 51 N 4.88 4.60 -0.01 1.70 -1.52 -1.26 -4.85 119.66 123.21 3h6f s GLN 51 Ca 0.38 1.22 0.14 0.00 -1.95 0.00 0.00 55.36 55.15 3h6f s GLN 51 Cb -0.09 -3.32 -0.20 0.00 -0.22 0.00 0.00 33.01 29.18 3h6f s GLN 51 CO 0.21 0.40 0.37 1.63 -0.25 0.00 0.00 175.29 177.65 3h6f n LYS 52 N 2.23 0.98 -5.28 2.91 5.02 -1.26 -4.97 118.16 117.79 3h6f n LYS 52 Ca -0.03 -0.09 -0.31 0.00 -2.02 0.00 0.00 58.31 55.86 3h6f n LYS 52 Cb 0.49 -1.28 -0.16 0.00 -0.02 0.00 0.00 35.03 34.07 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 -2.78 2.11 0.19 -0.18 1.01 -1.26 -1.30 121.20 118.99 3h6f s ILE 53 Ca -0.02 -1.09 -0.20 0.00 0.00 0.00 0.00 60.65 59.34 3h6f s ILE 53 Cb 0.09 -1.73 0.04 0.00 0.01 0.00 0.00 42.46 40.88 3h6f s ILE 53 CO 0.57 0.58 0.58 -0.55 0.00 0.00 0.00 174.94 176.12 3h6f s SER 54 N -0.60 -0.38 0.21 3.58 0.15 0.09 -4.99 113.70 111.76 3h6f s SER 54 Ca 0.10 -0.30 -0.28 0.00 0.70 0.00 0.00 55.95 56.17 3h6f s SER 54 Cb -0.10 0.61 -0.09 0.00 -1.71 0.00 0.00 66.02 64.73 3h6f s SER 54 CO -0.01 -1.06 0.87 -0.70 1.20 0.00 0.00 173.24 173.55 3h6f s GLU 55 N -3.83 4.74 -0.14 5.44 2.12 -1.26 -0.17 118.70 125.61 3h6f s GLU 55 Ca 0.06 1.36 -0.08 0.00 0.36 0.00 0.00 54.97 56.67 3h6f s GLU 55 Cb -0.02 -3.27 -0.06 0.00 0.26 0.00 0.00 34.13 31.04 3h6f s GLU 55 CO -0.06 0.54 -0.19 1.28 -0.54 0.00 0.00 175.26 176.29 3h6f n LEU 56 N 1.54 1.12 0.00 2.70 4.77 -0.58 -4.82 117.00 121.72 3h6f n LEU 56 Ca -0.03 0.19 -0.03 0.00 -0.03 0.00 0.00 56.01 56.10 3h6f n LEU 56 Cb 0.48 -0.46 -0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3h6f n LEU 56 CO 0.48 0.23 0.06 0.00 -1.33 0.00 0.00 177.39 176.84 3h6f n TYR 57 N -3.71 -0.85 -0.28 -1.77 9.36 -1.06 -4.71 117.16 114.13 3h6f n TYR 57 Ca -0.27 -0.53 -0.07 0.00 3.32 0.00 0.00 57.90 60.34 3h6f n TYR 57 Cb 0.67 0.16 -0.07 0.00 -0.63 0.00 0.00 39.34 39.46 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 -1.77 -0.72 -0.57 2.98 8.00 -1.26 -2.65 116.55 120.56 3h6f n ASP 58 Ca -0.00 1.47 0.05 0.00 0.71 0.00 0.00 54.79 57.02 3h6f n ASP 58 Cb 0.14 -0.29 0.14 0.00 -0.02 0.00 0.00 41.12 41.09 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 -4.54 2.89 -4.71 -1.24 5.12 -1.26 -1.18 116.66 111.74 3h6f n ARG 59 Ca 0.01 -2.02 -0.33 0.00 -1.93 0.00 0.00 57.85 53.59 3h6f n ARG 59 Cb 0.18 -1.26 -0.13 0.00 -1.16 0.00 0.00 32.46 30.09 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 -1.07 3.36 0.31 1.55 1.01 -1.08 -2.08 120.40 122.40 3h6f s VAL 60 Ca 0.21 -0.58 0.10 0.00 0.00 0.00 0.00 61.98 61.71 3h6f s VAL 60 Cb 0.11 -2.39 -0.06 0.00 0.00 0.00 0.00 36.38 34.05 3h6f s VAL 60 CO 0.14 0.56 -0.14 -0.83 0.00 0.00 0.00 175.10 174.82 3h6f s GLY 61 N -0.22 2.02 0.03 4.51 0.00 0.27 -1.53 107.32 112.40 3h6f s GLY 61 Ca 0.02 -1.97 0.04 0.00 0.00 0.00 0.00 44.72 42.81 3h6f s GLY 61 CO 0.03 -1.99 -0.12 -0.12 0.00 0.00 0.00 173.10 170.90 3h6f s PHE 62 N -2.60 1.08 -0.17 1.90 5.36 0.77 -1.69 117.98 122.62 3h6f s PHE 62 Ca 0.31 -0.34 -0.14 0.00 -0.96 0.00 0.00 56.93 55.80 3h6f s PHE 62 Cb -0.01 -0.65 0.05 0.00 -0.34 0.00 0.00 43.02 42.07 3h6f s PHE 62 CO 0.15 0.01 0.45 0.00 -1.46 0.00 0.00 175.22 174.37 3h6f s ALA 63 N -0.82 -1.12 0.07 11.12 0.00 -0.57 -0.73 121.76 129.70 3h6f s ALA 63 Ca 0.00 1.37 -0.07 0.00 0.00 0.00 0.00 51.96 53.26 3h6f s ALA 63 Cb -0.07 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.23 3h6f s ALA 63 CO 0.01 -0.23 0.14 0.00 0.00 0.00 0.00 175.76 175.68 3h6f s ALA 64 N 0.56 -0.11 -0.00 0.00 0.00 -0.42 -0.47 121.76 121.32 3h6f s ALA 64 Ca -0.03 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.31 3h6f s ALA 64 Cb -0.04 0.38 -0.00 0.00 0.00 0.00 0.00 23.12 23.45 3h6f s ALA 64 CO -0.03 -0.43 -0.05 0.00 0.00 0.00 0.00 175.76 175.25 3h6f s ALA 65 N -3.43 0.39 0.00 0.00 0.00 -0.62 -4.84 121.76 113.26 3h6f s ALA 65 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.76 3h6f s ALA 65 Cb 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.06 3h6f s ALA 65 CO -0.09 0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.17 3h6f n GLY 66 N 2.90 0.60 3.66 0.00 0.00 -1.26 -1.23 105.19 109.86 3h6f n GLY 66 Ca -0.13 -1.71 -0.43 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.47 4.26 0.13 1.61 2.20 -0.56 -4.92 119.74 120.99 3h6f s LYS 67 Ca 0.00 1.59 -0.30 0.00 -0.36 0.00 0.00 55.97 56.90 3h6f s LYS 67 Cb 0.00 -3.71 -0.07 0.00 -1.51 0.00 0.00 37.83 32.54 3h6f s LYS 67 CO 0.00 -0.65 1.58 0.35 -0.36 0.00 0.00 175.35 176.27 3h6f h PHE 68 N 7.91 -1.27 -0.63 4.03 3.57 -1.96 -2.50 116.94 126.09 3h6f h PHE 68 Ca -0.26 0.05 0.18 0.00 3.53 0.00 0.00 57.97 61.47 3h6f h PHE 68 Cb 1.10 0.57 -0.03 0.00 2.79 0.00 0.00 35.95 40.39 3h6f h PHE 68 CO 0.78 -0.49 0.48 -2.95 -2.23 0.00 0.00 178.31 173.90 3h6f h ASN 69 N -0.52 0.00 0.19 0.41 7.08 -1.99 -0.51 115.58 120.23 3h6f h ASN 69 Ca 0.06 0.00 -0.25 0.00 -3.08 0.00 0.00 56.30 53.04 3h6f h ASN 69 Cb 0.64 0.00 0.03 0.00 -2.08 0.00 0.00 38.32 36.91 3h6f h ASN 69 CO -0.39 0.00 -1.08 -0.33 -2.08 0.00 0.00 177.43 173.55 3h6f h GLU 70 N 0.00 0.40 0.00 4.14 5.08 -1.87 -3.08 114.58 119.25 3h6f h GLU 70 Ca 0.30 -0.68 -0.04 0.00 -1.00 0.00 0.00 59.36 57.94 3h6f h GLU 70 Cb 1.26 0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.76 3h6f h GLU 70 CO -0.00 1.32 -0.37 0.27 -1.00 0.00 0.00 179.01 179.23 3h6f h PHE 71 N -0.17 0.00 -0.08 4.33 -5.15 -1.01 -2.97 116.94 111.89 3h6f h PHE 71 Ca -0.19 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.42 3h6f h PHE 71 Cb 1.85 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 38.01 3h6f h PHE 71 CO 0.17 0.20 -0.64 0.22 -2.00 0.00 0.00 178.31 176.25 3h6f h ASP 72 N 0.00 0.37 -0.52 -0.68 3.58 -1.24 -0.20 116.42 117.74 3h6f h ASP 72 Ca -0.01 -0.22 -0.06 0.00 0.42 0.00 0.00 57.03 57.15 3h6f h ASP 72 Cb 1.16 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 42.08 3h6f h ASP 72 CO 0.02 0.92 0.11 -1.13 -2.88 0.00 0.00 179.24 176.28 3h6f h ASN 73 N 0.23 0.84 0.58 2.28 -1.24 -1.50 -1.18 115.58 115.59 3h6f h ASN 73 Ca -0.01 -0.17 -0.18 0.00 0.71 0.00 0.00 56.30 56.65 3h6f h ASN 73 Cb 1.18 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 40.00 3h6f h ASN 73 CO 0.11 0.84 -0.81 -0.07 -1.29 0.00 0.00 177.43 176.20 3h6f h LEU 74 N 0.85 0.21 -0.34 0.34 3.38 -1.33 -2.09 115.31 116.32 3h6f h LEU 74 Ca 0.18 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 3h6f h LEU 74 Cb 0.35 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 3h6f h LEU 74 CO 0.00 0.93 -0.02 -0.09 0.09 0.00 0.00 178.44 179.36 3h6f h ARG 75 N 0.10 0.62 -0.42 1.13 2.43 -0.63 -1.47 114.38 116.13 3h6f h ARG 75 Ca -0.03 -0.21 -0.06 0.00 -0.81 0.00 0.00 59.98 58.88 3h6f h ARG 75 Cb 1.41 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.89 3h6f h ARG 75 CO 0.12 0.75 0.04 0.00 -1.51 0.00 0.00 179.97 179.37 3h6f h ARG 76 N 0.42 0.72 -0.00 0.20 3.08 -1.21 -1.78 114.38 115.81 3h6f h ARG 76 Ca 0.10 -0.21 -0.06 0.00 0.07 0.00 0.00 59.98 59.88 3h6f h ARG 76 Cb 0.48 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3h6f h ARG 76 CO 0.02 0.77 -0.30 0.78 -1.07 0.00 0.00 179.97 180.17 3h6f h GLY 77 N 0.56 0.01 1.27 0.04 0.00 -1.33 -1.31 103.07 102.31 3h6f h GLY 77 Ca 0.12 -0.01 -0.23 0.00 0.00 0.00 0.00 47.33 47.22 3h6f h GLY 77 CO 0.01 0.01 -0.82 -1.33 0.00 0.00 0.00 176.54 174.41 3h6f h GLY 78 N 0.91 0.77 1.39 4.60 0.00 -0.97 -1.74 103.07 108.03 3h6f h GLY 78 Ca -0.00 -1.15 -0.12 0.00 0.00 0.00 0.00 47.33 46.07 3h6f h GLY 78 CO 0.04 1.02 -0.26 -2.22 0.00 0.00 0.00 176.54 175.12 3h6f h ILE 79 N 0.46 1.27 -0.42 2.60 2.04 -1.00 -0.73 117.51 121.75 3h6f h ILE 79 Ca -0.06 -1.36 -0.10 0.00 1.00 0.00 0.00 64.86 64.34 3h6f h ILE 79 Cb 1.45 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 38.80 3h6f h ILE 79 CO 0.16 0.45 -0.14 -0.61 0.00 0.00 0.00 178.15 178.01 3h6f h GLN 80 N 0.61 0.77 -0.02 2.37 5.75 -1.19 -1.81 115.11 121.58 3h6f h GLN 80 Ca 0.08 -0.27 -0.02 0.00 -0.15 0.00 0.00 58.65 58.30 3h6f h GLN 80 Cb 0.75 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.24 3h6f h GLN 80 CO 0.06 0.87 -0.05 0.35 -2.65 0.00 0.00 178.83 177.40 3h6f h PHE 81 N 0.69 0.09 -0.50 3.99 3.57 -1.13 -2.99 116.94 120.66 3h6f h PHE 81 Ca 0.11 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.63 3h6f h PHE 81 Cb 0.62 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.30 3h6f h PHE 81 CO 0.03 0.69 0.22 0.00 -2.23 0.00 0.00 178.31 177.02 3h6f h ALA 82 N 0.38 0.63 -0.12 2.41 0.00 -1.07 -1.58 119.26 119.91 3h6f h ALA 82 Ca -0.00 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 3h6f h ALA 82 Cb 0.69 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3h6f h ALA 82 CO 0.01 -0.15 -0.42 -0.44 0.00 0.00 0.00 179.25 178.25 3h6f h ASP 83 N 0.43 0.28 -0.22 0.00 3.32 -1.43 -1.52 116.42 117.28 3h6f h ASP 83 Ca 0.23 -0.12 -0.12 0.00 0.02 0.00 0.00 57.03 57.04 3h6f h ASP 83 Cb 0.19 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 3h6f h ASP 83 CO -0.19 0.67 -0.33 0.74 -1.72 0.00 0.00 179.24 178.41 3h6f h THR 84 N 0.22 1.32 -0.29 0.35 2.02 -1.34 -2.45 112.91 112.75 3h6f h THR 84 Ca 0.02 -1.53 -0.04 0.00 0.77 0.00 0.00 66.41 65.63 3h6f h THR 84 Cb 0.84 1.77 -0.01 0.00 -1.74 0.00 0.00 68.15 69.01 3h6f h THR 84 CO 0.07 0.48 0.01 0.03 0.37 0.00 0.00 175.52 176.48 3h6f h ARG 85 N 0.31 0.50 0.00 6.66 2.47 -1.18 -0.20 114.38 122.94 3h6f h ARG 85 Ca 0.02 -0.15 -0.04 0.00 -1.26 0.00 0.00 59.98 58.55 3h6f h ARG 85 Cb 0.91 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.18 3h6f h ARG 85 CO 0.08 0.64 -0.19 0.78 0.56 0.00 0.00 179.97 181.84 3h6f h GLY 86 N 0.29 0.00 1.05 0.04 0.00 -1.30 0.44 103.07 103.59 3h6f h GLY 86 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.07 3h6f h GLY 86 CO 0.01 0.00 -1.66 -1.82 0.00 0.00 0.00 176.54 173.07 3h6f h TYR 87 N 0.00 0.80 0.00 5.60 3.20 -1.19 -3.24 116.97 122.14 3h6f h TYR 87 Ca -0.00 -0.59 -0.09 0.00 3.14 0.00 0.00 58.73 61.20 3h6f h TYR 87 Cb 0.42 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 3h6f h TYR 87 CO 0.00 1.63 -0.41 0.00 -1.64 0.00 0.00 178.16 177.74 3h6f h ALA 88 N 0.14 0.86 -3.00 1.82 0.00 -0.75 -3.44 119.26 114.89 3h6f h ALA 88 Ca -0.31 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.22 3h6f h ALA 88 Cb 2.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.85 3h6f h ALA 88 CO 0.21 0.51 0.00 0.66 0.00 0.00 0.00 179.25 180.64 3h6f n TYR 89 N -3.38 0.00 -3.98 0.00 4.01 0.12 -5.07 117.16 108.86 3h6f n TYR 89 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.65 3h6f n TYR 89 Cb 0.59 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.55 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 0.06 0.48 7.72 1.47 -1.22 -4.97 116.67 121.20 3h6f s ASP 90 Ca 0.00 -0.91 0.21 0.00 1.18 0.00 0.00 52.55 53.03 3h6f s ASP 90 Cb 0.00 0.43 1.21 0.00 -0.34 0.00 0.00 42.92 44.22 3h6f s ASP 90 CO 0.00 -0.89 2.02 0.03 0.68 0.00 0.00 175.17 177.01 3h6f h ARG 91 N 2.56 0.00 0.00 2.11 3.08 -1.90 -2.34 114.38 117.88 3h6f h ARG 91 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.73 3h6f h ARG 91 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 3h6f h ARG 91 CO 0.49 0.17 0.00 -2.13 -1.07 0.00 0.00 179.97 177.42 3h6f n ARG 92 N -3.94 0.13 0.05 0.04 0.63 -1.26 -3.12 116.66 109.20 3h6f n ARG 92 Ca -0.02 0.24 -0.01 0.00 -0.92 0.00 0.00 57.85 57.13 3h6f n ARG 92 Cb 0.26 -1.70 0.26 0.00 0.45 0.00 0.00 32.46 31.73 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 0.38 -3.48 6.15 3.58 -1.79 -3.40 116.42 117.87 3h6f h ASP 93 Ca 0.00 -0.11 -0.56 0.00 0.42 0.00 0.00 57.03 56.78 3h6f h ASP 93 Cb 0.48 -0.10 -0.07 0.00 1.72 0.00 0.00 39.33 41.36 3h6f h ASP 93 CO 0.00 0.61 0.98 -0.69 -2.88 0.00 0.00 179.24 177.26 3h6f s VAL 94 N -4.55 4.08 0.36 2.25 1.01 -1.18 -4.91 120.40 117.46 3h6f s VAL 94 Ca -0.06 1.06 0.06 0.00 0.00 0.00 0.00 61.98 63.04 3h6f s VAL 94 Cb 0.14 -4.54 -0.07 0.00 0.00 0.00 0.00 36.38 31.91 3h6f s VAL 94 CO 0.77 -1.04 0.01 0.42 0.00 0.00 0.00 175.10 175.26 3h6f s THR 95 N 4.86 1.73 0.18 3.92 -4.23 -1.26 -4.93 115.64 115.91 3h6f s THR 95 Ca 0.50 -2.03 -0.08 0.00 -1.18 0.00 0.00 61.69 58.89 3h6f s THR 95 Cb -0.09 -2.85 0.04 0.00 1.34 0.00 0.00 72.50 70.94 3h6f s THR 95 CO 0.30 -0.05 1.60 1.23 -0.54 0.00 0.00 174.62 177.17 3h6f h GLY 96 N 1.95 1.07 0.97 3.99 0.00 -1.94 -2.47 103.07 106.65 3h6f h GLY 96 Ca -0.42 -0.87 0.02 0.00 0.00 0.00 0.00 47.33 46.05 3h6f h GLY 96 CO 0.75 0.80 0.65 -0.09 0.00 0.00 0.00 176.54 178.65 3h6f h ARG 97 N 0.88 1.27 -0.13 4.80 2.43 -1.96 -0.46 114.38 121.20 3h6f h ARG 97 Ca 0.13 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 3h6f h ARG 97 Cb 0.69 -0.29 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 3h6f h ARG 97 CO 0.05 0.84 -0.00 0.37 -1.51 0.00 0.00 179.97 179.72 3h6f h GLN 98 N 1.31 0.24 -0.32 0.20 4.15 -1.86 -1.81 115.11 117.03 3h6f h GLN 98 Ca 0.37 -0.08 -0.10 0.00 0.77 0.00 0.00 58.65 59.61 3h6f h GLN 98 Cb -0.11 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 3h6f h GLN 98 CO -0.09 0.48 -0.22 -0.07 -1.93 0.00 0.00 178.83 176.99 3h6f h LEU 99 N -0.03 0.60 -0.55 -2.39 3.38 -1.17 -2.24 115.31 112.92 3h6f h LEU 99 Ca 0.04 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 3h6f h LEU 99 Cb 0.37 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3h6f h LEU 99 CO 0.01 0.82 -0.03 0.00 0.09 0.00 0.00 178.44 179.33 3h6f h ALA 100 N 1.23 0.75 -0.78 1.53 0.00 -1.06 -0.82 119.26 120.11 3h6f h ALA 100 Ca 0.08 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 3h6f h ALA 100 Cb 0.67 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3h6f h ALA 100 CO 0.05 0.60 0.31 -0.97 0.00 0.00 0.00 179.25 179.24 3h6f h ASN 101 N 0.88 1.07 -0.15 0.00 -0.73 -1.16 -0.46 115.58 115.03 3h6f h ASN 101 Ca 0.15 -0.17 -0.16 0.00 1.87 0.00 0.00 56.30 58.00 3h6f h ASN 101 Cb 0.57 -0.28 -0.01 0.00 0.27 0.00 0.00 38.32 38.88 3h6f h ASN 101 CO 0.03 0.95 -0.46 0.58 -0.37 0.00 0.00 177.43 178.17 3h6f h VAL 102 N 1.13 1.29 -0.27 2.57 2.07 -1.11 -1.66 116.25 120.27 3h6f h VAL 102 Ca 0.26 -1.65 -0.13 0.00 0.82 0.00 0.00 66.70 65.99 3h6f h VAL 102 Cb 0.21 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3h6f h VAL 102 CO -0.02 0.53 -0.38 1.88 0.02 0.00 0.00 177.57 179.60 3h6f h TYR 103 N 0.56 0.75 -0.52 1.57 0.05 -0.83 -1.47 116.97 117.08 3h6f h TYR 103 Ca 0.03 -0.21 -0.07 0.00 0.05 0.00 0.00 58.73 58.53 3h6f h TYR 103 Cb 1.01 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 38.57 3h6f h TYR 103 CO 0.05 0.92 0.03 0.00 -1.05 0.00 0.00 178.16 178.11 3h6f h ALA 104 N 1.05 1.08 -0.31 3.88 0.00 -0.92 0.07 119.26 124.11 3h6f h ALA 104 Ca 0.05 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 3h6f h ALA 104 Cb 0.89 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3h6f h ALA 104 CO 0.08 0.59 -0.27 0.37 0.00 0.00 0.00 179.25 180.01 3h6f h GLN 105 N 0.80 0.74 0.07 0.00 5.75 -1.10 -1.71 115.11 119.65 3h6f h GLN 105 Ca 0.16 -0.38 -0.00 0.00 -0.15 0.00 0.00 58.65 58.28 3h6f h GLN 105 Cb 0.44 0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.99 3h6f h GLN 105 CO 0.02 0.99 -0.03 1.15 -2.65 0.00 0.00 178.83 178.31 3h6f h THR 106 N 0.50 1.17 -0.57 2.39 2.02 -0.99 -2.47 112.91 114.97 3h6f h THR 106 Ca 0.05 -0.92 -0.04 0.00 0.77 0.00 0.00 66.41 66.27 3h6f h THR 106 Cb 0.84 1.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.99 3h6f h THR 106 CO 0.07 0.23 0.18 -0.07 0.37 0.00 0.00 175.52 176.30 3h6f h LEU 107 N -0.52 0.78 -0.99 2.58 3.38 -1.03 -1.41 115.31 118.09 3h6f h LEU 107 Ca -0.01 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 3h6f h LEU 107 Cb 0.45 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 3h6f h LEU 107 CO 0.02 0.73 -0.04 1.23 0.09 0.00 0.00 178.44 180.47 3h6f h GLY 108 N 0.96 0.74 1.47 0.83 0.00 -1.32 -0.78 103.07 104.98 3h6f h GLY 108 Ca 0.19 -0.50 -0.20 0.00 0.00 0.00 0.00 47.33 46.82 3h6f h GLY 108 CO -0.01 0.46 -0.78 -0.84 0.00 0.00 0.00 176.54 175.37 3h6f h THR 109 N 0.64 1.35 -0.29 4.70 2.02 -0.97 -2.89 112.91 117.48 3h6f h THR 109 Ca 0.12 -2.14 -0.06 0.00 0.77 0.00 0.00 66.41 65.11 3h6f h THR 109 Cb 0.45 2.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.98 3h6f h THR 109 CO 0.02 0.65 -0.04 0.40 0.37 0.00 0.00 175.52 176.93 3h6f h ILE 110 N 0.34 1.27 -0.00 3.11 2.04 -0.92 0.23 117.51 123.57 3h6f h ILE 110 Ca -0.05 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.79 3h6f h ILE 110 Cb 1.38 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 38.80 3h6f h ILE 110 CO 0.14 0.33 0.00 0.15 0.00 0.00 0.00 178.15 178.77 3h6f h PHE 111 N 0.32 0.00 0.00 1.37 3.57 -1.16 -2.23 116.94 118.80 3h6f h PHE 111 Ca 0.08 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 3h6f h PHE 111 Cb 0.49 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 3h6f h PHE 111 CO 0.04 0.00 -0.78 2.41 -2.23 0.00 0.00 178.31 177.75 3h6f n THR 112 N -4.45 1.45 0.11 4.41 -1.04 -1.09 -4.79 114.28 108.89 3h6f n THR 112 Ca -0.03 0.14 -0.23 0.00 -2.04 0.00 0.00 64.05 61.89 3h6f n THR 112 Cb 0.09 -2.31 -0.15 0.00 -1.82 0.00 0.00 70.33 66.14 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 0.45 -7.49 -2.82 3.07 -0.57 -3.48 114.58 102.74 3h6f h GLU 113 Ca -0.09 -0.76 -0.47 0.00 -0.50 0.00 0.00 59.36 57.53 3h6f h GLU 113 Cb 0.75 0.28 0.11 0.00 -0.84 0.00 0.00 28.75 29.06 3h6f h GLU 113 CO -0.05 1.36 0.34 -0.65 -1.40 0.00 0.00 179.01 178.60 3h6f s GLN 114 N -2.60 1.72 -0.02 2.33 -0.21 -0.84 -5.03 119.66 115.02 3h6f s GLN 114 Ca -0.11 0.38 -0.24 0.00 0.02 0.00 0.00 55.36 55.41 3h6f s GLN 114 Cb 0.05 -1.90 -0.17 0.00 1.00 0.00 0.00 33.01 31.99 3h6f s GLN 114 CO 0.90 -1.82 1.12 0.00 -2.12 0.00 0.00 175.29 173.38 3h6f h ALA 115 N -1.22 -0.27 -3.56 6.09 0.00 -1.93 -3.44 119.26 114.93 3h6f h ALA 115 Ca -0.48 -0.21 -0.67 0.00 0.00 0.00 0.00 54.91 53.55 3h6f h ALA 115 Cb 1.31 0.10 -0.25 0.00 0.00 0.00 0.00 17.79 18.95 3h6f h ALA 115 CO 0.62 -0.42 -0.76 0.21 0.00 0.00 0.00 179.25 178.91 3h6f s LYS 116 N -4.19 3.09 0.73 0.00 2.20 -1.26 -5.12 119.74 115.20 3h6f s LYS 116 Ca -0.14 -0.67 -0.11 0.00 -0.36 0.00 0.00 55.97 54.69 3h6f s LYS 116 Cb 0.02 -2.57 0.03 0.00 -1.51 0.00 0.00 37.83 33.80 3h6f s LYS 116 CO 0.55 0.37 1.08 -1.25 -0.36 0.00 0.00 175.35 175.73 3h6f s PRO 117 N -0.05 2.58 -0.07 4.03 0.04 -1.26 -4.90 135.00 135.37 3h6f s PRO 117 Ca -0.02 1.09 -0.30 0.00 0.04 0.00 0.00 61.00 61.81 3h6f s PRO 117 Cb -0.14 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 3h6f s PRO 117 CO 0.04 -1.39 1.22 0.71 0.04 0.00 0.00 177.00 177.62 3h6f s TYR 118 N -2.92 3.12 -1.48 0.56 1.51 -1.26 -4.90 117.35 111.97 3h6f s TYR 118 Ca 0.60 1.16 -0.10 0.00 -1.01 0.00 0.00 57.07 57.73 3h6f s TYR 118 Cb -0.16 -3.44 0.02 0.00 -0.11 0.00 0.00 41.96 38.26 3h6f s TYR 118 CO 0.54 -1.42 2.53 0.39 -1.11 0.00 0.00 175.55 176.49 3h6f n GLU 119 N 5.43 3.66 -4.12 -0.62 1.02 -1.26 -4.69 120.64 120.05 3h6f n GLU 119 Ca 0.11 -2.71 -0.08 0.00 -0.02 0.00 0.00 57.16 54.46 3h6f n GLU 119 Cb 0.46 -2.90 -0.10 0.00 -0.02 0.00 0.00 31.44 28.87 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 1.55 0.34 -0.06 2.62 -7.23 -1.26 -1.50 120.40 114.85 3h6f s VAL 120 Ca 0.57 -1.86 -0.03 0.00 -1.81 0.00 0.00 61.98 58.86 3h6f s VAL 120 Cb 0.16 -1.65 0.04 0.00 0.56 0.00 0.00 36.38 35.50 3h6f s VAL 120 CO -0.07 -0.89 0.12 -0.70 -0.31 0.00 0.00 175.10 173.26 3h6f s GLU 121 N -3.91 0.01 0.21 4.82 2.12 -0.37 -3.19 118.70 118.39 3h6f s GLU 121 Ca 0.11 0.45 0.09 0.00 0.36 0.00 0.00 54.97 55.97 3h6f s GLU 121 Cb 0.07 -0.31 -0.04 0.00 0.26 0.00 0.00 34.13 34.11 3h6f s GLU 121 CO -0.07 -0.27 -0.04 -0.51 -0.54 0.00 0.00 175.26 173.83 3h6f s LEU 122 N 1.94 3.15 -0.06 2.70 1.43 -0.10 -1.58 118.68 126.16 3h6f s LEU 122 Ca 0.00 -0.54 -0.00 0.00 -1.03 0.00 0.00 54.13 52.55 3h6f s LEU 122 Cb -0.12 -1.77 0.03 0.00 0.03 0.00 0.00 46.19 44.36 3h6f s LEU 122 CO -0.05 0.07 -0.02 0.00 0.23 0.00 0.00 176.35 176.58 3h6f s VAL 124 N 1.52 3.02 0.04 0.00 1.01 -0.81 -1.52 120.40 123.66 3h6f s VAL 124 Ca -0.02 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.38 3h6f s VAL 124 Cb -0.13 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 3h6f s VAL 124 CO -0.03 0.50 -0.19 0.00 0.00 0.00 0.00 175.10 175.38 3h6f s ALA 125 N 0.71 1.62 -0.02 5.51 0.00 -0.68 -0.61 121.76 128.29 3h6f s ALA 125 Ca -0.06 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 50.92 3h6f s ALA 125 Cb -0.15 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.67 3h6f s ALA 125 CO 0.02 0.35 -0.06 -2.00 0.00 0.00 0.00 175.76 174.07 3h6f s GLU 126 N -1.18 0.64 0.44 0.00 2.12 -0.36 -0.57 118.70 119.79 3h6f s GLU 126 Ca 0.06 -0.20 0.07 0.00 0.36 0.00 0.00 54.97 55.26 3h6f s GLU 126 Cb -0.09 -0.63 -0.03 0.00 0.26 0.00 0.00 34.13 33.64 3h6f s GLU 126 CO 0.02 0.07 0.25 0.14 -0.54 0.00 0.00 175.26 175.20 3h6f s VAL 127 N 0.20 2.22 0.74 3.70 -7.23 -0.88 -1.79 120.40 117.36 3h6f s VAL 127 Ca -0.02 -1.61 -0.11 0.00 -1.81 0.00 0.00 61.98 58.43 3h6f s VAL 127 Cb -0.07 -2.83 0.04 0.00 0.56 0.00 0.00 36.38 34.09 3h6f s VAL 127 CO -0.00 0.00 1.09 0.00 -0.31 0.00 0.00 175.10 175.88 3h6f s ALA 128 N -2.61 2.33 0.69 1.32 0.00 -1.26 -4.87 121.76 117.35 3h6f s ALA 128 Ca 0.40 0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 3h6f s ALA 128 Cb 0.01 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.86 3h6f s ALA 128 CO 0.22 -1.63 1.06 -1.01 0.00 0.00 0.00 175.76 174.40 3h6f s HIS 129 N -2.80 3.24 0.11 0.00 3.76 -1.26 -4.80 115.29 113.53 3h6f s HIS 129 Ca 0.62 1.32 -0.34 0.00 -0.15 0.00 0.00 55.06 56.51 3h6f s HIS 129 Cb -0.18 -2.88 -0.14 0.00 1.11 0.00 0.00 32.58 30.49 3h6f s HIS 129 CO 0.53 -1.15 1.58 0.98 -0.85 0.00 0.00 174.74 175.83 3h6f n TYR 130 N -3.05 2.17 -1.02 1.40 9.36 -1.26 -2.02 117.16 122.74 3h6f n TYR 130 Ca 0.07 0.29 -0.01 0.00 3.32 0.00 0.00 57.90 61.58 3h6f n TYR 130 Cb 0.54 -2.53 -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 3.42 0.45 3.65 2.98 0.00 -1.26 -5.03 105.19 109.39 3h6f n GLY 131 Ca 0.18 -0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.67 2.36 -0.35 1.61 2.02 -0.86 -5.11 118.70 117.71 3h6f s GLU 132 Ca 0.00 -1.10 -0.09 0.00 0.02 0.00 0.00 54.97 53.81 3h6f s GLU 132 Cb 0.00 -2.35 0.03 0.00 0.10 0.00 0.00 34.13 31.91 3h6f s GLU 132 CO 0.00 0.46 0.15 0.99 0.02 0.00 0.00 175.26 176.88 3h6f s THR 133 N -1.66 4.18 -0.25 3.63 2.01 -1.26 -4.75 115.64 117.54 3h6f s THR 133 Ca 0.27 -0.95 -0.18 0.00 0.31 0.00 0.00 61.69 61.14 3h6f s THR 133 Cb -0.10 -3.33 0.07 0.00 0.01 0.00 0.00 72.50 69.16 3h6f s THR 133 CO 0.18 -0.17 0.63 -0.75 -0.69 0.00 0.00 174.62 173.82 3h6f s LYS 134 N 1.49 0.68 0.11 4.92 2.20 -1.26 -5.10 119.74 122.77 3h6f s LYS 134 Ca 0.01 1.03 -0.30 0.00 -0.36 0.00 0.00 55.97 56.34 3h6f s LYS 134 Cb -0.19 0.21 -0.07 0.00 -1.51 0.00 0.00 37.83 36.28 3h6f s LYS 134 CO 0.05 -0.13 1.23 0.50 -0.36 0.00 0.00 175.35 176.64 3h6f s ARG 135 N 1.06 4.43 0.35 4.03 6.06 -1.26 -4.49 118.95 129.14 3h6f s ARG 135 Ca -0.06 1.85 -0.27 0.00 -2.50 0.00 0.00 55.73 54.74 3h6f s ARG 135 Cb -0.05 -3.30 -0.12 0.00 0.06 0.00 0.00 34.95 31.54 3h6f s ARG 135 CO -0.10 -0.23 1.27 -2.30 -2.50 0.00 0.00 175.30 171.44 3h6f n PRO 136 N 3.50 2.06 -4.56 5.12 -0.02 -1.26 -4.90 135.00 134.93 3h6f n PRO 136 Ca 0.08 0.72 -0.34 0.00 -2.02 0.00 0.00 63.50 61.94 3h6f n PRO 136 Cb 0.45 -2.31 -0.12 0.00 -0.02 0.00 0.00 33.50 31.50 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 -1.93 3.20 -0.07 -0.52 2.02 -0.74 -4.98 118.70 115.69 3h6f s GLU 137 Ca 0.57 -0.55 0.02 0.00 0.02 0.00 0.00 54.97 55.02 3h6f s GLU 137 Cb -0.56 -2.73 0.01 0.00 0.10 0.00 0.00 34.13 30.95 3h6f s GLU 137 CO 0.61 0.44 -0.13 -0.51 0.02 0.00 0.00 175.26 175.69 3h6f s LEU 138 N -0.19 1.67 -0.03 1.80 1.02 -1.24 -1.22 118.68 120.49 3h6f s LEU 138 Ca 0.03 -0.32 0.07 0.00 0.02 0.00 0.00 54.13 53.93 3h6f s LEU 138 Cb -0.13 -0.87 -0.02 0.00 0.02 0.00 0.00 46.19 45.19 3h6f s LEU 138 CO 0.03 0.04 -0.24 -0.31 0.02 0.00 0.00 176.35 175.88 3h6f s TYR 139 N 0.65 2.23 -0.19 0.29 2.02 0.22 -1.95 117.35 120.62 3h6f s TYR 139 Ca -0.15 -0.49 -0.04 0.00 -0.37 0.00 0.00 57.07 56.02 3h6f s TYR 139 Cb -0.16 -1.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.94 3h6f s TYR 139 CO 0.04 -0.09 -0.04 0.50 -1.57 0.00 0.00 175.55 174.40 3h6f s ARG 140 N -0.45 3.51 -0.13 -0.62 3.52 -0.64 -1.93 118.95 122.21 3h6f s ARG 140 Ca 0.06 -0.58 0.02 0.00 -0.13 0.00 0.00 55.73 55.10 3h6f s ARG 140 Cb -0.11 -2.97 0.00 0.00 -1.56 0.00 0.00 34.95 30.32 3h6f s ARG 140 CO 0.00 -0.00 -0.20 0.42 -0.81 0.00 0.00 175.30 174.72 3h6f s ILE 141 N 0.99 2.34 0.38 4.11 1.09 -0.14 -1.51 121.20 128.46 3h6f s ILE 141 Ca 0.00 -0.90 0.08 0.00 -1.10 0.00 0.00 60.65 58.73 3h6f s ILE 141 Cb -0.15 -1.95 -0.02 0.00 -1.06 0.00 0.00 42.46 39.29 3h6f s ILE 141 CO 0.01 0.54 0.38 0.42 -0.10 0.00 0.00 174.94 176.18 3h6f s THR 142 N 0.62 3.19 0.59 2.92 -4.23 -0.53 -0.92 115.64 117.29 3h6f s THR 142 Ca -0.11 -1.28 0.32 0.00 -1.18 0.00 0.00 61.69 59.44 3h6f s THR 142 Cb -0.16 -3.11 0.45 0.00 1.34 0.00 0.00 72.50 71.02 3h6f s THR 142 CO 0.03 -0.09 1.60 0.10 -0.54 0.00 0.00 174.62 175.72 3h6f h TYR 143 N 1.06 0.00 -0.01 3.99 -0.00 -1.82 0.24 116.97 120.42 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 0.50 0.00 -0.54 -0.40 -0.00 0.00 0.00 178.16 177.72 3h6f n ASP 144 N -3.60 1.51 0.00 0.10 3.85 -1.26 -4.58 116.55 112.56 3h6f n ASP 144 Ca 0.21 -1.19 0.00 0.00 -0.71 0.00 0.00 54.79 53.10 3h6f n ASP 144 Cb 1.27 0.50 0.00 0.00 -1.35 0.00 0.00 41.12 41.53 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 1.43 1.02 3.73 6.12 0.00 0.07 -4.08 105.19 113.48 3h6f n GLY 145 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 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 7.48 -0.09 1.61 0.01 -1.25 -4.76 113.70 114.70 3h6f s SER 146 Ca 0.00 1.84 0.04 0.00 1.31 0.00 0.00 55.95 59.14 3h6f s SER 146 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 3h6f s SER 146 CO 0.00 -0.07 -0.22 -0.51 0.41 0.00 0.00 173.24 172.84 3h6f s ILE 147 N -0.09 1.92 -0.05 1.44 2.07 -1.26 -1.45 121.20 123.79 3h6f s ILE 147 Ca 0.47 -0.94 0.03 0.00 -1.41 0.00 0.00 60.65 58.80 3h6f s ILE 147 Cb -0.24 -1.67 0.01 0.00 0.13 0.00 0.00 42.46 40.68 3h6f s ILE 147 CO 0.31 0.53 -0.13 0.00 -1.91 0.00 0.00 174.94 173.73 3h6f s ALA 148 N 0.37 1.27 -0.56 1.50 0.00 -0.57 -4.99 121.76 118.78 3h6f s ALA 148 Ca -0.18 -0.48 -0.22 0.00 0.00 0.00 0.00 51.96 51.09 3h6f s ALA 148 Cb -0.18 -0.51 0.06 0.00 0.00 0.00 0.00 23.12 22.50 3h6f s ALA 148 CO 0.08 0.17 0.81 0.34 0.00 0.00 0.00 175.76 177.16 3h6f s ASP 149 N 0.41 6.25 -0.21 0.00 -1.08 -1.26 -1.62 116.67 119.15 3h6f s ASP 149 Ca -0.10 -0.77 -0.16 0.00 -0.52 0.00 0.00 52.55 51.00 3h6f s ASP 149 Cb -0.13 -2.37 -0.04 0.00 -1.46 0.00 0.00 42.92 38.92 3h6f s ASP 149 CO 0.03 -1.14 0.40 -1.61 0.52 0.00 0.00 175.17 173.38 3h6f s GLU 150 N 3.38 4.16 0.18 4.34 0.41 -0.82 -5.00 118.70 125.34 3h6f s GLU 150 Ca 0.22 0.20 0.10 0.00 -0.41 0.00 0.00 54.97 55.07 3h6f s GLU 150 Cb -0.17 -3.55 -0.06 0.00 -1.78 0.00 0.00 34.13 28.57 3h6f s GLU 150 CO 0.14 -0.07 1.36 -1.35 -0.49 0.00 0.00 175.26 174.85 3h6f h PRO 151 N 7.45 0.00 0.00 0.39 0.11 -1.94 -3.29 132.00 134.72 3h6f h PRO 151 Ca -0.35 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 0.82 -1.50 0.72 -0.21 0.00 0.00 178.00 178.54 3h6f n HIS 152 N -3.36 0.00 -3.72 0.65 8.25 -1.26 -4.90 115.22 110.89 3h6f n HIS 152 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.37 3h6f n HIS 152 Cb 0.85 -0.33 -0.05 0.00 1.12 0.00 0.00 29.99 31.58 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 -2.17 -0.07 -0.03 4.41 -0.12 -1.26 -2.39 117.98 116.36 3h6f s PHE 153 Ca -0.13 -0.29 0.02 0.00 -0.05 0.00 0.00 56.93 56.49 3h6f s PHE 153 Cb 0.05 0.15 0.01 0.00 -0.63 0.00 0.00 43.02 42.59 3h6f s PHE 153 CO 0.16 -0.65 -0.08 0.08 -0.05 0.00 0.00 175.22 174.68 3h6f s VAL 154 N -3.83 0.70 -0.10 -2.49 1.01 0.42 -4.88 120.40 111.23 3h6f s VAL 154 Ca 0.04 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.72 3h6f s VAL 154 Cb 0.03 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.79 3h6f s VAL 154 CO -0.11 0.23 -0.13 -0.69 0.00 0.00 0.00 175.10 174.39 3h6f s VAL 155 N 0.26 1.33 0.04 2.92 1.01 -1.26 -1.18 120.40 123.53 3h6f s VAL 155 Ca -0.04 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.45 3h6f s VAL 155 Cb -0.09 -1.24 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 3h6f s VAL 155 CO 0.00 0.41 -0.13 -0.04 0.00 0.00 0.00 175.10 175.34 3h6f s MET 156 N 1.12 0.84 0.11 2.72 -1.94 -0.32 -4.99 119.30 116.84 3h6f s MET 156 Ca -0.05 -0.77 0.00 0.00 -1.71 0.00 0.00 55.69 53.16 3h6f s MET 156 Cb -0.14 -0.82 0.00 0.00 2.01 0.00 0.00 34.83 35.88 3h6f s MET 156 CO -0.03 0.20 0.00 0.41 -0.01 0.00 0.00 175.02 175.59 3h6f n GLY 157 N 1.76 -2.97 7.00 -0.03 0.00 -1.26 -1.19 105.19 108.50 3h6f n GLY 157 Ca -0.19 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.86 1.97 3.30 -0.02 0.00 -0.46 -4.34 105.19 103.79 3h6f n GLY 158 Ca -0.00 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 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 4.46 0.01 2.61 2.01 -1.26 -4.35 115.64 119.12 3h6f s THR 159 Ca 0.00 -1.27 -0.25 0.00 0.31 0.00 0.00 61.69 60.48 3h6f s THR 159 Cb 0.00 -3.69 -0.17 0.00 0.01 0.00 0.00 72.50 68.65 3h6f s THR 159 CO 0.00 -0.49 1.26 0.74 -0.69 0.00 0.00 174.62 175.44 3h6f h THR 160 N 5.99 0.76 -0.67 -0.82 2.02 -1.95 -3.37 112.91 114.87 3h6f h THR 160 Ca -0.24 -0.62 0.14 0.00 0.77 0.00 0.00 66.41 66.46 3h6f h THR 160 Cb 1.09 1.09 -0.11 0.00 -1.74 0.00 0.00 68.15 68.48 3h6f h THR 160 CO 0.77 0.13 0.06 -0.33 0.37 0.00 0.00 175.52 176.52 3h6f h GLU 161 N -0.71 0.16 -0.09 6.66 3.07 -1.97 -0.02 114.58 121.69 3h6f h GLU 161 Ca -0.04 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 58.73 3h6f h GLU 161 Cb 0.48 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 3h6f h GLU 161 CO 0.06 0.11 -0.34 -1.35 -1.40 0.00 0.00 179.01 176.09 3h6f h PRO 162 N 0.17 0.17 0.14 2.33 0.11 -1.91 -1.72 132.00 131.28 3h6f h PRO 162 Ca 0.36 -0.07 -0.28 0.00 0.11 0.00 0.00 66.00 66.13 3h6f h PRO 162 Cb 0.61 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 31.72 3h6f h PRO 162 CO -0.54 0.50 -1.26 0.82 -0.21 0.00 0.00 178.00 177.31 3h6f h ILE 163 N 0.15 1.48 -0.27 4.15 2.04 -1.63 -2.83 117.51 120.61 3h6f h ILE 163 Ca 0.02 -3.02 -0.14 0.00 1.00 0.00 0.00 64.86 62.72 3h6f h ILE 163 Cb 0.68 2.95 -0.01 0.00 -0.74 0.00 0.00 36.82 39.69 3h6f h ILE 163 CO 0.05 0.89 -0.39 0.00 0.00 0.00 0.00 178.15 178.70 3h6f h ALA 164 N 0.54 0.82 0.01 1.87 0.00 -0.89 -2.51 119.26 119.09 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 1.98 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.67 3h6f h ALA 164 CO 0.21 0.65 -1.01 -0.91 0.00 0.00 0.00 179.25 178.19 3h6f h ASN 165 N 0.52 0.74 0.97 0.00 2.35 -1.41 -1.52 115.58 117.23 3h6f h ASN 165 Ca 0.05 -0.60 0.00 0.00 -0.55 0.00 0.00 56.30 55.20 3h6f h ASN 165 Cb 0.90 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.05 3h6f h ASN 165 CO 0.08 1.40 0.00 0.00 -1.65 0.00 0.00 177.43 177.26 3h6f h ALA 166 N 0.55 1.00 0.02 -0.83 0.00 -1.47 -2.83 119.26 115.71 3h6f h ALA 166 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.45 3h6f h ALA 166 Cb 1.66 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.39 3h6f h ALA 166 CO 0.19 0.00 -2.14 -0.11 0.00 0.00 0.00 179.25 177.18 3h6f n LEU 167 N -2.86 1.31 0.27 0.00 7.94 -0.95 -3.62 117.00 119.09 3h6f n LEU 167 Ca 0.01 0.13 0.13 0.00 -1.11 0.00 0.00 56.01 55.17 3h6f n LEU 167 Cb 0.29 -0.16 0.77 0.00 0.53 0.00 0.00 43.42 44.85 3h6f n LEU 167 CO 0.25 0.62 1.02 0.50 -1.11 0.00 0.00 177.39 178.67 3h6f h LYS 168 N 0.01 0.00 0.00 1.96 3.64 -1.03 -2.45 116.57 118.70 3h6f h LYS 168 Ca -0.46 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.91 3h6f h LYS 168 Cb 2.07 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.89 3h6f h LYS 168 CO 0.03 0.09 -0.24 0.93 -2.27 0.00 0.00 179.45 177.99 3h6f h GLU 169 N 0.00 0.00 -0.32 1.90 5.08 -1.69 -3.39 114.58 116.16 3h6f h GLU 169 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h6f h GLU 169 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3h6f h GLU 169 CO 0.01 0.13 0.00 -1.13 -1.00 0.00 0.00 179.01 177.02 3h6f n SER 170 N -4.69 0.32 -4.81 1.42 3.41 -1.15 -4.92 113.62 103.20 3h6f n SER 170 Ca -0.05 -1.56 -0.36 0.00 -0.26 0.00 0.00 58.87 56.64 3h6f n SER 170 Cb 0.16 -0.16 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 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 -1.59 3.66 0.03 7.33 5.04 -0.93 -5.02 117.35 125.87 3h6f s TYR 171 Ca 0.00 1.48 0.03 0.00 -2.44 0.00 0.00 57.07 56.15 3h6f s TYR 171 Cb 0.00 -2.69 -0.02 0.00 0.35 0.00 0.00 41.96 39.60 3h6f s TYR 171 CO 0.00 0.31 -0.11 0.00 -1.34 0.00 0.00 175.55 174.42 3h6f s ALA 172 N -1.53 0.86 0.19 3.97 0.00 -1.26 -5.07 121.76 118.92 3h6f s ALA 172 Ca 0.44 -0.67 -0.11 0.00 0.00 0.00 0.00 51.96 51.62 3h6f s ALA 172 Cb -0.17 -0.11 0.12 0.00 0.00 0.00 0.00 23.12 22.95 3h6f s ALA 172 CO 0.22 0.14 1.83 0.93 0.00 0.00 0.00 175.76 178.88 3h6f h GLU 173 N 5.09 0.93 -2.11 0.00 4.39 -1.98 -3.34 114.58 117.56 3h6f h GLU 173 Ca -0.35 -0.09 -0.56 0.00 0.34 0.00 0.00 59.36 58.70 3h6f h GLU 173 Cb 1.19 -0.19 -0.41 0.00 -0.10 0.00 0.00 28.75 29.24 3h6f h GLU 173 CO 0.45 0.67 -0.88 0.09 -1.16 0.00 0.00 179.01 178.18 3h6f n ASN 174 N -4.55 2.23 -4.76 1.42 4.13 -1.26 -4.69 115.26 107.78 3h6f n ASN 174 Ca 0.06 -3.17 -0.39 0.00 1.68 0.00 0.00 54.58 52.76 3h6f n ASN 174 Cb 0.06 -0.63 0.02 0.00 -1.54 0.00 0.00 39.78 37.69 3h6f n ASN 174 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3h6f s ALA 175 N -2.24 3.00 0.71 5.41 0.00 -1.26 -4.30 121.76 123.08 3h6f s ALA 175 Ca 0.40 1.31 -0.11 0.00 0.00 0.00 0.00 51.96 53.55 3h6f s ALA 175 Cb 0.22 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.81 3h6f s ALA 175 CO -0.08 -1.17 1.10 0.45 0.00 0.00 0.00 175.76 176.06 3h6f s SER 176 N -0.87 5.38 0.10 0.00 0.15 -1.26 -1.08 113.70 116.13 3h6f s SER 176 Ca 0.66 1.11 -0.21 0.00 0.70 0.00 0.00 55.95 58.21 3h6f s SER 176 Cb -0.39 -1.88 -0.10 0.00 -1.71 0.00 0.00 66.02 61.93 3h6f s SER 176 CO 0.48 -1.38 1.71 0.25 1.20 0.00 0.00 173.24 175.50 3h6f h LEU 177 N -0.68 0.17 -1.81 3.45 5.85 -1.99 0.23 115.31 120.53 3h6f h LEU 177 Ca -0.45 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.22 3h6f h LEU 177 Cb 1.26 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 3h6f h LEU 177 CO 0.64 0.19 0.16 0.71 -0.34 0.00 0.00 178.44 179.79 3h6f h THR 178 N 0.14 1.03 0.05 1.05 1.35 -1.94 -2.03 112.91 112.56 3h6f h THR 178 Ca 0.05 -0.09 -0.00 0.00 -0.55 0.00 0.00 66.41 65.82 3h6f h THR 178 Cb 0.05 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 67.22 3h6f h THR 178 CO -0.01 0.05 -0.03 0.44 -0.25 0.00 0.00 175.52 175.72 3h6f h ASP 179 N 0.26 -0.06 -0.16 5.36 3.32 -1.80 -3.16 116.42 120.18 3h6f h ASP 179 Ca 0.09 -0.54 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 3h6f h ASP 179 Cb 0.05 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3h6f h ASP 179 CO -0.02 0.66 0.08 0.00 -1.72 0.00 0.00 179.24 178.24 3h6f h ALA 180 N -0.30 1.77 -0.15 3.45 0.00 -0.94 -2.47 119.26 120.61 3h6f h ALA 180 Ca -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3h6f h ALA 180 Cb 0.60 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 3h6f h ALA 180 CO 0.01 0.19 -0.06 1.25 0.00 0.00 0.00 179.25 180.64 3h6f h LEU 181 N 0.27 0.32 -1.05 0.00 7.12 -1.49 -2.11 115.31 118.37 3h6f h LEU 181 Ca 0.07 -0.40 -0.05 0.00 0.13 0.00 0.00 57.88 57.62 3h6f h LEU 181 Cb 0.06 -0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.08 3h6f h LEU 181 CO -0.01 0.65 0.08 -0.09 -0.13 0.00 0.00 178.44 178.94 3h6f h ARG 182 N -0.02 0.76 -0.21 1.25 2.43 -1.49 -1.11 114.38 115.99 3h6f h ARG 182 Ca 0.03 -0.16 -0.13 0.00 -0.81 0.00 0.00 59.98 58.91 3h6f h ARG 182 Cb 0.52 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 3h6f h ARG 182 CO 0.02 0.72 -0.40 0.82 -1.51 0.00 0.00 179.97 179.62 3h6f h ILE 183 N 0.73 1.30 -0.06 1.20 2.04 -1.40 -1.92 117.51 119.39 3h6f h ILE 183 Ca 0.16 -1.55 -0.18 0.00 1.00 0.00 0.00 64.86 64.28 3h6f h ILE 183 Cb 0.33 1.57 0.01 0.00 -0.74 0.00 0.00 36.82 37.99 3h6f h ILE 183 CO 0.00 0.48 -0.67 0.00 0.00 0.00 0.00 178.15 177.97 3h6f h ALA 184 N 1.16 0.17 -0.25 1.87 0.00 -0.92 -1.72 119.26 119.57 3h6f h ALA 184 Ca 0.04 -0.57 -0.09 0.00 0.00 0.00 0.00 54.91 54.28 3h6f h ALA 184 Cb 0.88 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3h6f h ALA 184 CO 0.07 0.47 -0.23 0.28 0.00 0.00 0.00 179.25 179.84 3h6f h VAL 185 N 0.17 1.26 -0.10 0.00 2.07 -1.20 -2.18 116.25 116.27 3h6f h VAL 185 Ca -0.07 -1.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.19 3h6f h VAL 185 Cb 1.34 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 32.43 3h6f h VAL 185 CO 0.14 0.39 -0.10 0.00 0.02 0.00 0.00 177.57 178.01 3h6f h ALA 186 N 1.34 0.14 0.00 1.67 0.00 -1.37 -2.88 119.26 118.17 3h6f h ALA 186 Ca 0.06 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3h6f h ALA 186 Cb 0.63 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3h6f h ALA 186 CO 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.27 3h6f h ALA 187 N 0.57 1.00 0.00 0.00 0.00 -1.24 -2.18 119.26 117.41 3h6f h ALA 187 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3h6f h ALA 187 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3h6f h ALA 187 CO 0.02 0.00 -0.31 1.25 0.00 0.00 0.00 179.25 180.21 3h6f h LEU 188 N 0.00 0.00 -0.52 0.00 5.85 -1.33 -3.22 115.31 116.09 3h6f h LEU 188 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3h6f h LEU 188 Cb 0.49 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.52 3h6f h LEU 188 CO 0.00 0.01 0.00 -1.14 -0.34 0.00 0.00 178.44 176.97 3h6f n ARG 189 N -2.84 1.35 0.08 1.25 0.63 -0.82 -3.59 116.66 112.72 3h6f n ARG 189 Ca 0.03 -0.52 0.05 0.00 -0.92 0.00 0.00 57.85 56.49 3h6f n ARG 189 Cb 0.52 -1.42 -0.03 0.00 0.45 0.00 0.00 32.46 31.98 3h6f n ARG 189 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3h6f h ALA 190 N 3.99 0.62 0.00 5.13 0.00 -1.64 -3.52 119.26 123.85 3h6f h ALA 190 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3h6f h ALA 190 Cb 0.25 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3h6f h ALA 190 CO 0.00 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.18 3h6f n GLY 191 N 1.29 -0.37 0.00 0.00 0.00 -1.24 -4.81 105.19 100.05 3h6f n GLY 191 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3h6f n GLY 191 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3h6f n LEU 203 N -0.25 0.00 0.00 0.99 -0.00 -1.26 -5.06 117.00 111.42 3h6f n LEU 203 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 3h6f n LEU 203 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.45 3h6f n LEU 203 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.00 3h6f n GLY 204 N 0.00 4.23 0.40 1.47 0.00 -1.26 -5.00 105.19 105.03 3h6f n GLY 204 Ca 0.00 -0.80 0.20 0.00 0.00 0.00 0.00 46.02 45.43 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 0.61 0.00 1.61 2.07 -1.96 -0.63 116.25 117.95 3h6f h VAL 205 Ca 0.00 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.37 3h6f h VAL 205 Cb 0.00 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.90 3h6f h VAL 205 CO 0.00 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.67 3h6f h ALA 206 N 1.61 1.00 0.00 1.67 0.00 -1.96 -3.30 119.26 118.28 3h6f h ALA 206 Ca 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.45 3h6f h ALA 206 Cb 1.31 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 3h6f h ALA 206 CO -0.25 0.00 -0.33 -1.13 0.00 0.00 0.00 179.25 177.54 3h6f n SER 207 N -2.74 0.98 -4.22 0.00 3.41 -0.33 -4.56 113.62 106.15 3h6f n SER 207 Ca 0.02 -2.47 -0.23 0.00 -0.26 0.00 0.00 58.87 55.94 3h6f n SER 207 Cb 0.35 -0.30 -0.13 0.00 -0.26 0.00 0.00 64.21 63.87 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 -1.19 2.23 -0.18 1.04 1.43 -0.66 -1.00 118.68 120.35 3h6f s LEU 208 Ca 0.14 -0.57 0.01 0.00 -1.03 0.00 0.00 54.13 52.68 3h6f s LEU 208 Cb 0.13 -0.78 0.03 0.00 0.03 0.00 0.00 46.19 45.59 3h6f s LEU 208 CO 0.00 0.06 -0.17 -0.70 0.23 0.00 0.00 176.35 175.78 3h6f s GLU 209 N -1.49 2.66 -0.03 1.70 2.12 0.28 -4.78 118.70 119.16 3h6f s GLU 209 Ca 0.04 -0.82 0.04 0.00 0.36 0.00 0.00 54.97 54.60 3h6f s GLU 209 Cb -0.09 -2.47 -0.01 0.00 0.26 0.00 0.00 34.13 31.82 3h6f s GLU 209 CO 0.02 -0.27 -0.16 0.08 -0.54 0.00 0.00 175.26 174.39 3h6f s VAL 210 N 1.33 1.33 -0.01 3.70 1.01 -1.26 -0.80 120.40 125.70 3h6f s VAL 210 Ca 0.03 -0.68 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 3h6f s VAL 210 Cb -0.14 -1.13 0.05 0.00 0.00 0.00 0.00 36.38 35.16 3h6f s VAL 210 CO -0.11 0.38 0.51 0.00 0.00 0.00 0.00 175.10 175.88 3h6f s ALA 211 N -0.12 -1.32 0.13 5.51 0.00 -1.08 -1.92 121.76 122.97 3h6f s ALA 211 Ca 0.00 0.77 0.08 0.00 0.00 0.00 0.00 51.96 52.81 3h6f s ALA 211 Cb -0.09 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 3h6f s ALA 211 CO 0.01 -0.38 -0.18 0.14 0.00 0.00 0.00 175.76 175.34 3h6f s VAL 212 N -1.67 1.68 -0.71 0.00 -7.23 -0.13 -0.62 120.40 111.70 3h6f s VAL 212 Ca -0.10 -1.74 -0.08 0.00 -1.81 0.00 0.00 61.98 58.26 3h6f s VAL 212 Cb -0.02 -1.67 0.19 0.00 0.56 0.00 0.00 36.38 35.44 3h6f s VAL 212 CO 0.04 -0.24 0.58 -0.76 -0.31 0.00 0.00 175.10 174.41 3h6f s LEU 213 N -2.35 5.92 -0.56 1.32 1.43 -0.31 -1.33 118.68 122.80 3h6f s LEU 213 Ca 0.11 -2.77 -0.28 0.00 -1.03 0.00 0.00 54.13 50.16 3h6f s LEU 213 Cb -0.07 -2.02 0.03 0.00 0.03 0.00 0.00 46.19 44.16 3h6f s LEU 213 CO 0.05 -0.47 1.17 -0.62 0.23 0.00 0.00 176.35 176.71 3h6f s ASP 214 N 1.38 6.48 0.00 2.29 2.15 0.46 -2.09 116.67 127.33 3h6f s ASP 214 Ca 0.17 0.15 0.12 0.00 0.43 0.00 0.00 52.55 53.42 3h6f s ASP 214 Cb -0.16 -2.55 0.70 0.00 -0.30 0.00 0.00 42.92 40.62 3h6f s ASP 214 CO -0.06 -1.43 1.16 0.00 -0.17 0.00 0.00 175.17 174.68 3h6f n ALA 215 N 8.28 1.92 0.90 3.66 0.00 -0.55 -2.35 120.51 132.37 3h6f n ALA 215 Ca 0.09 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.58 3h6f n ALA 215 Cb 0.49 -1.19 0.13 0.00 0.00 0.00 0.00 19.45 18.88 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 -1.03 3.03 -4.76 0.00 2.85 -1.26 -4.50 115.26 109.58 3h6f n ASN 216 Ca 0.09 -1.98 -0.39 0.00 -0.11 0.00 0.00 54.58 52.18 3h6f n ASN 216 Cb 0.05 -0.04 -0.06 0.00 1.24 0.00 0.00 39.78 40.97 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 -1.92 4.32 0.24 1.20 0.52 -0.99 -5.01 118.95 117.31 3h6f s ARG 217 Ca 0.30 0.75 -0.12 0.00 -0.52 0.00 0.00 55.73 56.14 3h6f s ARG 217 Cb 0.20 -3.34 0.32 0.00 0.52 0.00 0.00 34.95 32.66 3h6f s ARG 217 CO 0.30 0.38 1.60 -1.35 0.02 0.00 0.00 175.30 176.25 3h6f h PRO 218 N 5.59 -0.01 0.00 3.54 0.11 -1.91 -3.42 132.00 135.91 3h6f h PRO 218 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3h6f h PRO 218 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3h6f h PRO 218 CO 0.69 -0.00 0.00 -2.13 -0.21 0.00 0.00 178.00 176.35 3h6f n ARG 219 N -5.51 0.00 -2.71 1.05 0.63 -1.26 -4.40 116.66 104.46 3h6f n ARG 219 Ca 0.11 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.62 3h6f n ARG 219 Cb 0.40 -0.11 -0.03 0.00 0.45 0.00 0.00 32.46 33.17 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 -1.56 3.30 0.30 -0.14 0.52 -1.26 -4.34 118.95 115.77 3h6f s ARG 220 Ca 0.00 -0.24 0.12 0.00 -0.52 0.00 0.00 55.73 55.10 3h6f s ARG 220 Cb 0.00 -4.10 0.43 0.00 0.52 0.00 0.00 34.95 31.80 3h6f s ARG 220 CO 0.00 -1.74 1.64 0.00 0.02 0.00 0.00 175.30 175.22 3h6f h ALA 221 N 9.58 0.99 -2.57 2.13 0.00 -1.38 -3.46 119.26 124.55 3h6f h ALA 221 Ca -0.27 -0.51 -0.53 0.00 0.00 0.00 0.00 54.91 53.60 3h6f h ALA 221 Cb 1.06 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.79 3h6f h ALA 221 CO 1.17 0.70 0.76 0.12 0.00 0.00 0.00 179.25 182.00 3h6f s PHE 222 N -3.62 3.20 -0.13 0.00 5.36 -1.26 -0.41 117.98 121.13 3h6f s PHE 222 Ca -0.01 0.88 -0.07 0.00 -0.96 0.00 0.00 56.93 56.78 3h6f s PHE 222 Cb 0.12 -3.74 0.05 0.00 -0.34 0.00 0.00 43.02 39.11 3h6f s PHE 222 CO 0.75 -2.62 0.30 0.50 -1.46 0.00 0.00 175.22 172.69 3h6f s ARG 223 N 1.04 0.28 -0.01 10.12 3.52 -0.44 -4.96 118.95 128.49 3h6f s ARG 223 Ca 0.65 0.60 -0.16 0.00 -0.13 0.00 0.00 55.73 56.70 3h6f s ARG 223 Cb -0.39 -0.07 -0.06 0.00 -1.56 0.00 0.00 34.95 32.88 3h6f s ARG 223 CO 0.31 -0.15 0.44 1.03 -0.81 0.00 0.00 175.30 176.11 3h6f s ARG 224 N 1.22 4.02 -0.45 5.12 0.52 -1.26 -0.96 118.95 127.16 3h6f s ARG 224 Ca -0.09 0.46 -0.05 0.00 -0.52 0.00 0.00 55.73 55.53 3h6f s ARG 224 Cb -0.09 -3.26 0.12 0.00 0.52 0.00 0.00 34.95 32.24 3h6f s ARG 224 CO -0.09 0.61 0.27 0.42 0.02 0.00 0.00 175.30 176.52 3h6f s ILE 225 N -0.83 3.59 0.27 1.52 1.01 -0.81 -4.98 121.20 120.98 3h6f s ILE 225 Ca 0.25 -2.07 0.10 0.00 0.00 0.00 0.00 60.65 58.92 3h6f s ILE 225 Cb -0.17 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 38.83 3h6f s ILE 225 CO 0.14 -0.74 -0.15 0.42 0.00 0.00 0.00 174.94 174.61 3h6f s THR 226 N 1.08 2.17 0.00 2.92 -4.23 -1.26 -4.34 115.64 111.98 3h6f s THR 226 Ca 0.08 -2.30 0.00 0.00 -1.18 0.00 0.00 61.69 58.30 3h6f s THR 226 Cb -0.23 -2.31 0.00 0.00 1.34 0.00 0.00 72.50 71.30 3h6f s THR 226 CO -0.03 -0.40 0.00 0.61 -0.54 0.00 0.00 174.62 174.25 3h6f n GLY 227 N -0.59 2.89 0.34 3.99 0.00 -1.26 -2.87 105.19 107.69 3h6f n GLY 227 Ca -0.06 0.30 0.02 0.00 0.00 0.00 0.00 46.02 46.29 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 0.90 0.58 1.61 0.87 -2.00 -2.00 113.55 113.51 3h6f h SER 228 Ca 0.00 0.02 -0.12 0.00 -1.23 0.00 0.00 61.79 60.47 3h6f h SER 228 Cb 0.00 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 3h6f h SER 228 CO 0.00 0.56 -0.55 0.00 -0.53 0.00 0.00 176.83 176.31 3h6f h ALA 229 N 1.45 1.07 0.09 6.23 0.00 -1.93 -3.13 119.26 123.03 3h6f h ALA 229 Ca 0.41 -0.50 -0.26 0.00 0.00 0.00 0.00 54.91 54.57 3h6f h ALA 229 Cb 0.23 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3h6f h ALA 229 CO -0.19 0.69 -1.17 1.25 0.00 0.00 0.00 179.25 179.83 3h6f h LEU 230 N 0.00 0.34 -0.08 0.00 5.85 -1.49 -3.26 115.31 116.67 3h6f h LEU 230 Ca -0.01 -0.35 -0.00 0.00 0.84 0.00 0.00 57.88 58.36 3h6f h LEU 230 Cb 0.99 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.90 3h6f h LEU 230 CO 0.07 1.26 0.05 -0.61 -0.34 0.00 0.00 178.44 178.87 3h6f h GLN 231 N 0.07 0.11 0.00 1.25 5.75 -1.33 -2.66 115.11 118.29 3h6f h GLN 231 Ca -0.10 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.38 3h6f h GLN 231 Cb 1.90 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 30.42 3h6f h GLN 231 CO 0.18 0.12 -0.04 0.00 -2.65 0.00 0.00 178.83 176.44 3h6f h ALA 232 N 0.99 1.09 0.00 3.38 0.00 -1.66 -1.97 119.26 121.09 3h6f h ALA 232 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h6f h ALA 232 Cb 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3h6f h ALA 232 CO -0.01 0.05 -0.55 1.25 0.00 0.00 0.00 179.25 179.99 3h6f h LEU 233 N 0.00 0.00 -1.28 0.00 5.85 -1.52 -3.53 115.31 114.84 3h6f h LEU 233 Ca -0.00 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3h6f h LEU 233 Cb 0.27 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3h6f h LEU 233 CO 0.00 0.03 0.00 -0.11 -0.34 0.00 0.00 178.44 178.03