#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 1.85 0.60 4.38 1.04 -1.26 -5.00 113.70 115.32 3h6f s SER 8 Ca 0.00 -1.15 0.28 0.00 0.48 0.00 0.00 55.95 55.56 3h6f s SER 8 Cb 0.00 -0.00 1.36 0.00 0.10 0.00 0.00 66.02 67.47 3h6f s SER 8 CO 0.00 -0.44 1.77 -0.65 0.98 0.00 0.00 173.24 174.90 3h6f h PRO 9 N 2.57 0.00 0.00 4.02 0.11 -2.06 0.34 132.00 136.98 3h6f h PRO 9 Ca -0.38 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.63 3h6f h PRO 9 Cb 1.21 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3h6f h PRO 9 CO 0.64 0.00 -1.89 -1.91 -0.21 0.00 0.00 178.00 174.63 3h6f n GLU 10 N -3.49 0.65 0.05 1.05 2.13 -1.26 -3.88 120.64 115.89 3h6f n GLU 10 Ca 0.10 -0.06 -0.14 0.00 0.66 0.00 0.00 57.16 57.71 3h6f n GLU 10 Cb 0.81 -1.60 -0.04 0.00 0.27 0.00 0.00 31.44 30.88 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 0.51 -0.64 5.31 5.75 -1.54 -3.03 115.11 121.47 3h6f h GLN 11 Ca -0.15 -0.50 -0.09 0.00 -0.15 0.00 0.00 58.65 57.76 3h6f h GLN 11 Cb 1.36 0.13 -0.02 0.00 1.07 0.00 0.00 27.48 30.02 3h6f h GLN 11 CO 0.01 1.14 0.05 0.00 -2.65 0.00 0.00 178.83 177.38 3h6f h ALA 12 N 0.70 0.86 -0.46 3.38 0.00 -1.17 -1.88 119.26 120.69 3h6f h ALA 12 Ca -0.08 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 3h6f h ALA 12 Cb 1.53 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 3h6f h ALA 12 CO 0.16 0.67 0.06 0.52 0.00 0.00 0.00 179.25 180.66 3h6f h MET 13 N 1.01 0.71 0.19 0.00 2.86 -1.67 -1.81 114.93 116.22 3h6f h MET 13 Ca 0.19 -0.15 -0.32 0.00 -2.06 0.00 0.00 59.70 57.36 3h6f h MET 13 Cb 0.51 -0.10 0.03 0.00 0.06 0.00 0.00 31.60 32.10 3h6f h MET 13 CO 0.02 0.68 -1.36 -0.09 1.06 0.00 0.00 176.91 177.23 3h6f h ARG 14 N 0.68 0.55 -0.08 1.72 2.43 -1.40 -2.81 114.38 115.48 3h6f h ARG 14 Ca 0.15 -0.84 -0.13 0.00 -0.81 0.00 0.00 59.98 58.35 3h6f h ARG 14 Cb 0.33 0.30 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 3h6f h ARG 14 CO 0.01 1.39 -0.52 0.93 -1.51 0.00 0.00 179.97 180.26 3h6f h GLU 15 N 0.20 0.21 -0.14 0.20 5.08 -1.24 -1.17 114.58 117.72 3h6f h GLU 15 Ca -0.22 -0.12 -0.16 0.00 -1.00 0.00 0.00 59.36 57.86 3h6f h GLU 15 Cb 2.04 0.01 0.01 0.00 0.50 0.00 0.00 28.75 31.31 3h6f h GLU 15 CO 0.25 0.68 -0.53 0.00 -1.00 0.00 0.00 179.01 178.42 3h6f h ARG 16 N 0.16 0.60 -0.14 2.33 3.08 -1.43 -1.94 114.38 117.05 3h6f h ARG 16 Ca 0.00 -0.46 -0.06 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 31.11 3h6f h ARG 16 CO 0.08 1.09 -0.17 1.03 -1.07 0.00 0.00 179.97 180.92 3h6f h SER 17 N 0.25 0.21 0.05 7.04 0.87 -1.41 -2.20 113.55 118.37 3h6f h SER 17 Ca -0.03 -0.05 -0.28 0.00 -1.23 0.00 0.00 61.79 60.20 3h6f h SER 17 Cb 1.16 -0.06 0.03 0.00 -0.44 0.00 0.00 62.40 63.09 3h6f h SER 17 CO 0.11 0.40 -1.13 -0.08 -0.53 0.00 0.00 176.83 175.61 3h6f h GLU 18 N 0.21 0.67 -0.94 2.24 4.57 -1.15 -2.21 114.58 117.96 3h6f h GLU 18 Ca 0.04 -0.79 0.00 0.00 -1.18 0.00 0.00 59.36 57.43 3h6f h GLU 18 Cb 0.43 0.24 -0.05 0.00 -0.16 0.00 0.00 28.75 29.22 3h6f h GLU 18 CO 0.03 1.35 0.59 1.25 -1.18 0.00 0.00 179.01 181.05 3h6f h LEU 19 N 0.33 1.11 -0.03 1.64 6.46 -1.12 -1.55 115.31 122.15 3h6f h LEU 19 Ca -0.16 -0.05 -0.09 0.00 -0.12 0.00 0.00 57.88 57.46 3h6f h LEU 19 Cb 1.79 -0.28 0.01 0.00 -0.73 0.00 0.00 40.66 41.45 3h6f h LEU 19 CO 0.22 0.84 -0.34 0.00 -0.62 0.00 0.00 178.44 178.54 3h6f h ALA 20 N 1.32 0.09 -0.49 1.25 0.00 -1.45 -3.01 119.26 116.98 3h6f h ALA 20 Ca 0.34 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3h6f h ALA 20 Cb -0.09 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3h6f h ALA 20 CO -0.07 0.18 0.25 -0.09 0.00 0.00 0.00 179.25 179.51 3h6f h ARG 21 N -0.26 0.68 -0.09 0.00 2.43 -1.23 -2.03 114.38 113.88 3h6f h ARG 21 Ca -0.03 -0.07 -0.17 0.00 -0.81 0.00 0.00 59.98 58.89 3h6f h ARG 21 Cb 1.03 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 3h6f h ARG 21 CO 0.07 0.52 -0.67 0.87 -1.51 0.00 0.00 179.97 179.25 3h6f h LYS 22 N 0.68 0.38 -0.14 0.20 1.57 -1.37 -1.65 116.57 116.24 3h6f h LYS 22 Ca 0.17 -0.29 -0.14 0.00 -1.87 0.00 0.00 60.65 58.53 3h6f h LYS 22 Cb 0.06 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 3h6f h LYS 22 CO -0.03 0.92 -0.50 0.78 -0.57 0.00 0.00 179.45 180.05 3h6f h GLY 23 N 1.30 0.42 1.46 3.86 0.00 -1.26 -2.36 103.07 106.49 3h6f h GLY 23 Ca -0.02 -0.45 -0.22 0.00 0.00 0.00 0.00 47.33 46.63 3h6f h GLY 23 CO 0.11 0.41 -0.89 -2.22 0.00 0.00 0.00 176.54 173.95 3h6f h ILE 24 N 0.30 1.36 0.00 2.60 2.04 -1.33 -3.19 117.51 119.29 3h6f h ILE 24 Ca 0.01 -2.30 -0.05 0.00 1.00 0.00 0.00 64.86 63.52 3h6f h ILE 24 Cb 0.98 2.29 -0.01 0.00 -0.74 0.00 0.00 36.82 39.35 3h6f h ILE 24 CO 0.08 0.69 -0.25 0.00 0.00 0.00 0.00 178.15 178.68 3h6f h ALA 25 N 0.71 1.20 0.00 1.87 0.00 -1.15 -1.05 119.26 120.83 3h6f h ALA 25 Ca -0.07 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3h6f h ALA 25 Cb 1.52 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3h6f h ALA 25 CO 0.16 0.31 -0.35 0.54 0.00 0.00 0.00 179.25 179.91 3h6f n ARG 26 N -3.68 0.11 -3.04 0.00 1.74 -0.90 -3.94 116.66 106.95 3h6f n ARG 26 Ca -0.01 0.05 -0.22 0.00 -0.77 0.00 0.00 57.85 56.90 3h6f n ARG 26 Cb 0.37 -1.59 0.01 0.00 -1.02 0.00 0.00 32.46 30.23 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 -3.06 3.83 0.75 7.54 0.00 -1.08 -4.96 121.76 124.79 3h6f s ALA 27 Ca 0.10 -1.13 -0.11 0.00 0.00 0.00 0.00 51.96 50.82 3h6f s ALA 27 Cb 0.16 -2.07 0.05 0.00 0.00 0.00 0.00 23.12 21.26 3h6f s ALA 27 CO 0.65 -0.35 1.09 0.15 0.00 0.00 0.00 175.76 177.31 3h6f s LYS 28 N -4.51 2.34 0.25 0.00 1.02 -1.26 -2.00 119.74 115.58 3h6f s LYS 28 Ca 0.48 1.21 -0.07 0.00 0.02 0.00 0.00 55.97 57.61 3h6f s LYS 28 Cb -0.10 -1.90 -0.06 0.00 -0.52 0.00 0.00 37.83 35.24 3h6f s LYS 28 CO 0.37 -1.58 0.54 -1.12 -0.92 0.00 0.00 175.35 172.64 3h6f s SER 29 N -3.25 6.53 -0.01 2.83 0.01 -1.26 -4.23 113.70 114.31 3h6f s SER 29 Ca 0.62 0.81 0.01 0.00 1.31 0.00 0.00 55.95 58.70 3h6f s SER 29 Cb -0.18 -2.18 0.01 0.00 0.21 0.00 0.00 66.02 63.88 3h6f s SER 29 CO 0.54 -0.13 -0.03 -0.69 0.41 0.00 0.00 173.24 173.34 3h6f s VAL 30 N -1.94 0.31 0.04 3.43 1.01 -0.30 -1.92 120.40 121.04 3h6f s VAL 30 Ca 0.45 -0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.40 3h6f s VAL 30 Cb -0.11 -0.31 -0.03 0.00 0.00 0.00 0.00 36.38 35.94 3h6f s VAL 30 CO 0.26 0.12 -0.20 0.68 0.00 0.00 0.00 175.10 175.95 3h6f s VAL 31 N 0.27 1.64 -0.07 2.92 -7.23 0.08 -1.30 120.40 116.71 3h6f s VAL 31 Ca -0.03 -1.20 0.01 0.00 -1.81 0.00 0.00 61.98 58.95 3h6f s VAL 31 Cb -0.06 -1.43 0.02 0.00 0.56 0.00 0.00 36.38 35.47 3h6f s VAL 31 CO -0.00 0.19 -0.09 0.00 -0.31 0.00 0.00 175.10 174.89 3h6f s ALA 32 N -0.81 1.12 0.01 1.32 0.00 -0.41 -1.28 121.76 121.70 3h6f s ALA 32 Ca 0.07 -0.35 0.02 0.00 0.00 0.00 0.00 51.96 51.69 3h6f s ALA 32 Cb -0.09 -0.63 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 3h6f s ALA 32 CO 0.02 -0.07 -0.05 -0.48 0.00 0.00 0.00 175.76 175.17 3h6f s LEU 33 N 1.04 2.07 0.59 0.00 0.05 -0.31 -1.61 118.68 120.51 3h6f s LEU 33 Ca -0.08 -0.19 -0.15 0.00 0.05 0.00 0.00 54.13 53.76 3h6f s LEU 33 Cb -0.15 -0.21 -0.04 0.00 -2.05 0.00 0.00 46.19 43.74 3h6f s LEU 33 CO -0.00 -0.01 1.05 0.00 -0.55 0.00 0.00 176.35 176.84 3h6f s ALA 34 N -0.41 2.79 0.18 1.48 0.00 -1.11 -0.47 121.76 124.22 3h6f s ALA 34 Ca -0.01 0.32 -0.05 0.00 0.00 0.00 0.00 51.96 52.22 3h6f s ALA 34 Cb -0.04 -3.21 0.02 0.00 0.00 0.00 0.00 23.12 19.90 3h6f s ALA 34 CO -0.00 -0.77 0.33 2.48 0.00 0.00 0.00 175.76 177.79 3h6f n TYR 35 N -2.11 -1.40 -0.33 0.00 0.18 0.11 -4.87 117.16 108.74 3h6f n TYR 35 Ca 0.08 -0.97 -0.03 0.00 1.88 0.00 0.00 57.90 58.86 3h6f n TYR 35 Cb 0.53 0.38 0.11 0.00 -0.38 0.00 0.00 39.34 39.98 3h6f n TYR 35 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3h6f h ALA 36 N 1.90 1.21 -0.01 -3.48 0.00 -1.50 -2.94 119.26 114.44 3h6f h ALA 36 Ca -0.15 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3h6f h ALA 36 Cb 0.58 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3h6f h ALA 36 CO 0.19 0.66 -0.11 0.41 0.00 0.00 0.00 179.25 180.40 3h6f n GLY 37 N -1.20 -0.14 0.00 0.00 0.00 -1.26 -5.01 105.19 97.58 3h6f n GLY 37 Ca 0.10 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 1.26 0.47 3.46 -0.02 0.00 -1.11 -1.10 105.19 108.15 3h6f n GLY 38 Ca 0.16 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.83 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 -1.63 2.74 -0.05 1.61 1.01 -0.91 0.07 120.40 123.23 3h6f s VAL 39 Ca 0.00 -1.42 0.06 0.00 0.00 0.00 0.00 61.98 60.62 3h6f s VAL 39 Cb 0.00 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 3h6f s VAL 39 CO 0.00 0.19 -0.23 -0.22 0.00 0.00 0.00 175.10 174.84 3h6f s LEU 40 N -1.86 2.03 -0.16 3.92 2.96 0.38 -0.84 118.68 125.11 3h6f s LEU 40 Ca 0.16 -0.47 0.00 0.00 -0.22 0.00 0.00 54.13 53.60 3h6f s LEU 40 Cb -0.10 -1.27 -0.00 0.00 0.50 0.00 0.00 46.19 45.32 3h6f s LEU 40 CO 0.08 0.22 -0.16 -0.36 -1.32 0.00 0.00 176.35 174.82 3h6f s PHE 41 N -0.13 2.78 -0.07 5.38 0.08 0.14 -1.16 117.98 125.00 3h6f s PHE 41 Ca -0.03 -1.09 0.01 0.00 0.12 0.00 0.00 56.93 55.94 3h6f s PHE 41 Cb -0.13 -1.89 0.02 0.00 -0.57 0.00 0.00 43.02 40.45 3h6f s PHE 41 CO 0.03 -0.50 -0.08 0.08 -0.10 0.00 0.00 175.22 174.65 3h6f s VAL 42 N 0.86 0.88 0.05 -0.44 1.01 -0.41 -1.68 120.40 120.67 3h6f s VAL 42 Ca -0.05 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 61.70 3h6f s VAL 42 Cb -0.15 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 3h6f s VAL 42 CO -0.01 0.32 -0.12 0.00 0.00 0.00 0.00 175.10 175.29 3h6f s ALA 43 N 1.17 0.94 -0.56 5.51 0.00 -0.31 -0.74 121.76 127.76 3h6f s ALA 43 Ca -0.06 -0.82 -0.24 0.00 0.00 0.00 0.00 51.96 50.85 3h6f s ALA 43 Cb -0.14 -0.08 0.04 0.00 0.00 0.00 0.00 23.12 22.94 3h6f s ALA 43 CO -0.02 0.12 0.93 -2.00 0.00 0.00 0.00 175.76 174.80 3h6f s GLU 44 N -1.38 3.30 -0.24 0.00 2.12 -0.81 -1.61 118.70 120.09 3h6f s GLU 44 Ca -0.03 -0.34 -0.03 0.00 0.36 0.00 0.00 54.97 54.93 3h6f s GLU 44 Cb -0.09 -4.07 0.11 0.00 0.26 0.00 0.00 34.13 30.34 3h6f s GLU 44 CO 0.01 -1.50 0.24 1.21 -0.54 0.00 0.00 175.26 174.68 3h6f s ASN 45 N 2.91 1.64 0.42 -1.70 2.47 -0.64 -4.66 114.94 115.38 3h6f s ASN 45 Ca 0.29 -0.47 0.21 0.00 0.42 0.00 0.00 52.86 53.31 3h6f s ASN 45 Cb -0.13 0.37 0.86 0.00 -1.45 0.00 0.00 41.25 40.90 3h6f s ASN 45 CO 0.18 -0.36 1.81 1.55 -3.72 0.00 0.00 177.10 176.57 3h6f h PRO 46 N 8.30 0.00 -6.89 0.43 0.13 -1.82 -3.29 132.00 128.87 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 0.05 0.00 0.13 0.00 0.00 31.00 32.29 3h6f h PRO 46 CO 0.31 0.29 0.53 0.45 -0.23 0.00 0.00 178.00 179.36 3h6f s SER 47 N -6.34 6.79 -0.00 1.44 0.15 -1.26 -4.80 113.70 109.68 3h6f s SER 47 Ca -0.00 2.42 0.22 0.00 0.70 0.00 0.00 55.95 59.28 3h6f s SER 47 Cb 0.11 -2.63 -0.18 0.00 -1.71 0.00 0.00 66.02 61.61 3h6f s SER 47 CO 0.66 -0.49 0.88 -1.14 1.20 0.00 0.00 173.24 174.34 3h6f n ARG 48 N 0.57 0.12 -0.09 5.44 0.63 -1.26 -4.62 116.66 117.45 3h6f n ARG 48 Ca 0.02 -0.03 -0.17 0.00 -0.92 0.00 0.00 57.85 56.75 3h6f n ARG 48 Cb 0.45 -1.51 -0.07 0.00 0.45 0.00 0.00 32.46 31.78 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 -1.64 1.67 -4.57 6.15 7.64 -1.26 -4.93 113.62 116.68 3h6f n SER 49 Ca 0.03 0.13 -0.41 0.00 1.01 0.00 0.00 58.87 59.62 3h6f n SER 49 Cb 0.37 -0.45 -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 -6.68 3.31 0.16 -3.43 1.43 -1.26 -5.02 118.68 107.19 3h6f s LEU 50 Ca -0.24 -0.12 -0.27 0.00 -1.03 0.00 0.00 54.13 52.46 3h6f s LEU 50 Cb 0.08 -2.86 -0.08 0.00 0.03 0.00 0.00 46.19 43.37 3h6f s LEU 50 CO 0.33 -1.70 0.85 -1.10 0.23 0.00 0.00 176.35 174.97 3h6f s GLN 51 N 5.43 4.66 -0.01 1.70 -1.52 -1.26 -4.86 119.66 123.81 3h6f s GLN 51 Ca 0.41 1.29 0.12 0.00 -1.95 0.00 0.00 55.36 55.23 3h6f s GLN 51 Cb -0.08 -3.30 -0.17 0.00 -0.22 0.00 0.00 33.01 29.24 3h6f s GLN 51 CO 0.20 0.46 0.35 1.63 -0.25 0.00 0.00 175.29 177.69 3h6f n LYS 52 N 1.91 1.30 -5.14 2.91 5.02 -1.26 -4.97 118.16 117.93 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 0.48 -1.21 -0.15 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 -2.61 2.06 0.17 -0.18 1.01 -1.26 -1.45 121.20 118.93 3h6f s ILE 53 Ca -0.01 -1.20 -0.23 0.00 0.00 0.00 0.00 60.65 59.20 3h6f s ILE 53 Cb 0.08 -1.73 0.06 0.00 0.01 0.00 0.00 42.46 40.89 3h6f s ILE 53 CO 0.51 0.49 0.64 -0.55 0.00 0.00 0.00 174.94 176.03 3h6f s SER 54 N -0.84 -0.51 0.22 3.58 0.15 0.17 -4.99 113.70 111.49 3h6f s SER 54 Ca 0.10 -0.10 -0.29 0.00 0.70 0.00 0.00 55.95 56.37 3h6f s SER 54 Cb -0.10 0.60 -0.09 0.00 -1.71 0.00 0.00 66.02 64.73 3h6f s SER 54 CO 0.00 -1.00 0.92 -0.70 1.20 0.00 0.00 173.24 173.66 3h6f s GLU 55 N -3.73 4.81 -0.15 5.44 2.12 -1.26 -0.13 118.70 125.80 3h6f s GLU 55 Ca 0.03 1.44 -0.08 0.00 0.36 0.00 0.00 54.97 56.72 3h6f s GLU 55 Cb -0.02 -3.29 -0.06 0.00 0.26 0.00 0.00 34.13 31.02 3h6f s GLU 55 CO -0.10 0.50 -0.20 1.28 -0.54 0.00 0.00 175.26 176.20 3h6f n LEU 56 N 1.60 1.16 0.00 2.70 4.77 -0.60 -4.83 117.00 121.80 3h6f n LEU 56 Ca -0.02 0.20 -0.04 0.00 -0.03 0.00 0.00 56.01 56.12 3h6f n LEU 56 Cb 0.47 -0.47 -0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3h6f n LEU 56 CO 0.50 0.25 0.10 0.00 -1.33 0.00 0.00 177.39 176.91 3h6f n TYR 57 N -3.74 -1.02 -0.22 -1.77 9.36 -1.03 -4.72 117.16 114.01 3h6f n TYR 57 Ca -0.29 -0.70 -0.06 0.00 3.32 0.00 0.00 57.90 60.17 3h6f n TYR 57 Cb 0.68 0.22 -0.05 0.00 -0.63 0.00 0.00 39.34 39.56 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 -1.67 -0.57 -0.74 2.98 8.00 -1.26 -2.56 116.55 120.74 3h6f n ASP 58 Ca -0.01 1.33 0.07 0.00 0.71 0.00 0.00 54.79 56.88 3h6f n ASP 58 Cb 0.19 -0.31 0.19 0.00 -0.02 0.00 0.00 41.12 41.17 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 -4.21 2.91 -4.88 -1.24 5.12 -1.26 -1.24 116.66 111.86 3h6f n ARG 59 Ca 0.01 -2.31 -0.33 0.00 -1.93 0.00 0.00 57.85 53.29 3h6f n ARG 59 Cb 0.14 -1.46 -0.14 0.00 -1.16 0.00 0.00 32.46 29.84 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 -1.58 2.90 0.33 1.55 1.01 -1.06 -2.04 120.40 121.51 3h6f s VAL 60 Ca 0.30 -0.74 0.10 0.00 0.00 0.00 0.00 61.98 61.64 3h6f s VAL 60 Cb 0.19 -2.18 -0.06 0.00 0.00 0.00 0.00 36.38 34.34 3h6f s VAL 60 CO 0.14 0.55 -0.09 -0.83 0.00 0.00 0.00 175.10 174.87 3h6f s GLY 61 N -0.02 2.08 0.03 4.51 0.00 0.32 -1.56 107.32 112.68 3h6f s GLY 61 Ca -0.04 -2.00 0.03 0.00 0.00 0.00 0.00 44.72 42.72 3h6f s GLY 61 CO 0.04 -1.98 -0.10 -0.12 0.00 0.00 0.00 173.10 170.94 3h6f s PHE 62 N -2.55 0.91 -0.16 1.90 5.36 0.82 -1.68 117.98 122.57 3h6f s PHE 62 Ca 0.32 -0.32 -0.14 0.00 -0.96 0.00 0.00 56.93 55.84 3h6f s PHE 62 Cb -0.00 -0.55 0.04 0.00 -0.34 0.00 0.00 43.02 42.17 3h6f s PHE 62 CO 0.17 -0.01 0.41 0.00 -1.46 0.00 0.00 175.22 174.33 3h6f s ALA 63 N -0.78 -1.02 0.07 11.12 0.00 -0.48 -0.65 121.76 130.02 3h6f s ALA 63 Ca -0.01 1.20 -0.10 0.00 0.00 0.00 0.00 51.96 53.06 3h6f s ALA 63 Cb -0.07 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.35 3h6f s ALA 63 CO 0.01 -0.20 0.21 0.00 0.00 0.00 0.00 175.76 175.77 3h6f s ALA 64 N 0.35 -0.33 0.01 0.00 0.00 -0.53 -0.18 121.76 121.09 3h6f s ALA 64 Ca -0.01 -0.46 0.01 0.00 0.00 0.00 0.00 51.96 51.51 3h6f s ALA 64 Cb -0.04 0.43 -0.01 0.00 0.00 0.00 0.00 23.12 23.51 3h6f s ALA 64 CO -0.01 -0.47 -0.05 0.00 0.00 0.00 0.00 175.76 175.24 3h6f s ALA 65 N -3.42 0.35 0.00 0.00 0.00 -0.57 -4.83 121.76 113.29 3h6f s ALA 65 Ca 0.01 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.65 3h6f s ALA 65 Cb 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.11 3h6f s ALA 65 CO -0.09 0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.12 3h6f n GLY 66 N 2.56 0.58 3.66 0.00 0.00 -1.26 -1.19 105.19 109.54 3h6f n GLY 66 Ca -0.16 -1.72 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.40 4.26 0.13 1.61 2.20 -0.53 -4.91 119.74 121.09 3h6f s LYS 67 Ca 0.00 1.58 -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 32.55 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 -1.22 -0.68 4.03 3.57 -1.96 -2.26 116.94 126.33 3h6f h PHE 68 Ca -0.26 0.05 0.20 0.00 3.53 0.00 0.00 57.97 61.49 3h6f h PHE 68 Cb 1.10 0.55 -0.03 0.00 2.79 0.00 0.00 35.95 40.36 3h6f h PHE 68 CO 0.78 -0.49 0.50 -2.95 -2.23 0.00 0.00 178.31 173.92 3h6f h ASN 69 N -0.52 0.00 0.17 0.41 7.08 -1.99 0.15 115.58 120.87 3h6f h ASN 69 Ca 0.06 0.00 -0.23 0.00 -3.08 0.00 0.00 56.30 53.05 3h6f h ASN 69 Cb 0.64 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 36.90 3h6f h ASN 69 CO -0.38 0.00 -1.05 -0.33 -2.08 0.00 0.00 177.43 173.60 3h6f h GLU 70 N 0.00 0.35 0.00 4.14 5.08 -1.88 -3.04 114.58 119.23 3h6f h GLU 70 Ca 0.32 -0.60 -0.04 0.00 -1.00 0.00 0.00 59.36 58.04 3h6f h GLU 70 Cb 1.32 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.79 3h6f h GLU 70 CO -0.00 1.29 -0.23 0.27 -1.00 0.00 0.00 179.01 179.34 3h6f h PHE 71 N -0.24 0.00 -0.17 4.33 -5.15 -0.82 -2.96 116.94 111.93 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 1.79 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.95 3h6f h PHE 71 CO 0.17 0.17 -0.57 0.22 -2.00 0.00 0.00 178.31 176.30 3h6f h ASP 72 N 0.00 0.62 -0.60 -0.68 3.58 -1.10 -0.38 116.42 117.85 3h6f h ASP 72 Ca -0.00 -0.34 -0.03 0.00 0.42 0.00 0.00 57.03 57.08 3h6f h ASP 72 Cb 1.14 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.98 3h6f h ASP 72 CO 0.02 1.06 0.28 -1.13 -2.88 0.00 0.00 179.24 176.59 3h6f h ASN 73 N 0.42 0.82 0.87 2.28 -1.24 -1.50 -0.72 115.58 116.50 3h6f h ASN 73 Ca 0.00 -0.09 -0.17 0.00 0.71 0.00 0.00 56.30 56.75 3h6f h ASN 73 Cb 1.12 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.94 3h6f h ASN 73 CO 0.11 0.71 -0.79 -0.07 -1.29 0.00 0.00 177.43 176.09 3h6f h LEU 74 N 0.90 0.00 -0.29 0.34 3.38 -1.30 -2.11 115.31 116.23 3h6f h LEU 74 Ca 0.22 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 3h6f h LEU 74 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3h6f h LEU 74 CO -0.03 0.79 -0.16 -0.09 0.09 0.00 0.00 178.44 179.05 3h6f h ARG 75 N 0.00 0.62 -0.27 1.13 2.43 -0.23 -1.82 114.38 116.24 3h6f h ARG 75 Ca -0.01 -0.28 -0.03 0.00 -0.81 0.00 0.00 59.98 58.86 3h6f h ARG 75 Cb 1.44 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.97 3h6f h ARG 75 CO 0.10 0.86 0.06 0.00 -1.51 0.00 0.00 179.97 179.48 3h6f h ARG 76 N 0.36 0.43 0.00 0.20 3.08 -1.14 -1.72 114.38 115.59 3h6f h ARG 76 Ca 0.06 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 3h6f h ARG 76 Cb 0.68 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 3h6f h ARG 76 CO 0.05 0.53 -0.19 0.78 -1.07 0.00 0.00 179.97 180.07 3h6f h GLY 77 N 0.26 0.00 1.46 0.04 0.00 -1.38 -0.56 103.07 102.89 3h6f h GLY 77 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.15 3h6f h GLY 77 CO 0.00 0.00 -1.11 -1.33 0.00 0.00 0.00 176.54 174.10 3h6f h GLY 78 N 0.86 0.51 1.19 4.60 0.00 -1.01 -2.04 103.07 107.19 3h6f h GLY 78 Ca -0.00 -1.03 -0.14 0.00 0.00 0.00 0.00 47.33 46.16 3h6f h GLY 78 CO 0.02 0.91 -0.30 -2.22 0.00 0.00 0.00 176.54 174.95 3h6f h ILE 79 N 0.22 1.27 -0.49 2.60 2.04 -0.88 -1.02 117.51 121.25 3h6f h ILE 79 Ca -0.13 -1.46 -0.00 0.00 1.00 0.00 0.00 64.86 64.27 3h6f h ILE 79 Cb 1.78 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 39.10 3h6f h ILE 79 CO 0.20 0.49 0.30 -0.61 0.00 0.00 0.00 178.15 178.53 3h6f h GLN 80 N 0.76 0.66 -0.08 2.37 5.75 -1.12 -1.53 115.11 121.92 3h6f h GLN 80 Ca 0.08 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 3h6f h GLN 80 Cb 0.87 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.28 3h6f h GLN 80 CO 0.08 0.47 -0.02 0.35 -2.65 0.00 0.00 178.83 177.06 3h6f h PHE 81 N 0.65 0.18 -0.90 3.99 3.57 -1.25 -2.73 116.94 120.46 3h6f h PHE 81 Ca 0.18 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.66 3h6f h PHE 81 Cb -0.02 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.63 3h6f h PHE 81 CO -0.03 0.50 0.59 0.00 -2.23 0.00 0.00 178.31 177.14 3h6f h ALA 82 N 0.66 1.18 -0.06 2.41 0.00 -1.04 -1.53 119.26 120.88 3h6f h ALA 82 Ca 0.02 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 3h6f h ALA 82 Cb 0.44 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3h6f h ALA 82 CO 0.01 0.48 -0.63 -0.44 0.00 0.00 0.00 179.25 178.67 3h6f h ASP 83 N 1.17 0.27 -0.27 0.00 3.32 -1.31 -1.74 116.42 117.87 3h6f h ASP 83 Ca 0.35 -0.16 -0.15 0.00 0.02 0.00 0.00 57.03 57.08 3h6f h ASP 83 Cb -0.05 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.42 3h6f h ASP 83 CO -0.10 0.84 -0.43 0.74 -1.72 0.00 0.00 179.24 178.57 3h6f h THR 84 N 0.17 1.30 -0.38 0.35 2.02 -1.24 -2.49 112.91 112.64 3h6f h THR 84 Ca -0.01 -1.62 -0.10 0.00 0.77 0.00 0.00 66.41 65.45 3h6f h THR 84 Cb 1.15 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 3h6f h THR 84 CO 0.10 0.52 -0.17 0.03 0.37 0.00 0.00 175.52 176.37 3h6f h ARG 85 N 0.51 0.78 0.00 6.66 2.47 -1.23 -0.25 114.38 123.32 3h6f h ARG 85 Ca 0.02 -0.34 -0.07 0.00 -1.26 0.00 0.00 59.98 58.34 3h6f h ARG 85 Cb 1.02 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.31 3h6f h ARG 85 CO 0.10 0.96 -0.31 0.78 0.56 0.00 0.00 179.97 182.05 3h6f h GLY 86 N 0.58 0.00 1.15 0.04 0.00 -1.33 -0.16 103.07 103.35 3h6f h GLY 86 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.08 3h6f h GLY 86 CO 0.05 0.00 -1.52 -1.82 0.00 0.00 0.00 176.54 173.26 3h6f h TYR 87 N 0.00 0.91 0.00 5.60 3.20 -1.22 -3.20 116.97 122.27 3h6f h TYR 87 Ca -0.00 -0.67 -0.10 0.00 3.14 0.00 0.00 58.73 61.10 3h6f h TYR 87 Cb 0.57 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 3h6f h TYR 87 CO 0.00 1.58 -0.50 0.00 -1.64 0.00 0.00 178.16 177.61 3h6f h ALA 88 N 0.14 0.83 -3.00 1.82 0.00 -0.86 -3.44 119.26 114.74 3h6f h ALA 88 Ca -0.27 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.18 3h6f h ALA 88 Cb 2.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.84 3h6f h ALA 88 CO 0.25 0.62 0.00 0.66 0.00 0.00 0.00 179.25 180.78 3h6f n TYR 89 N -3.44 0.00 -4.09 0.00 4.01 -0.09 -5.08 117.16 108.47 3h6f n TYR 89 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 3h6f n TYR 89 Cb 0.63 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.58 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 0.10 0.44 7.72 1.47 -1.21 -4.97 116.67 121.22 3h6f s ASP 90 Ca 0.00 -1.14 0.22 0.00 1.18 0.00 0.00 52.55 52.82 3h6f s ASP 90 Cb 0.00 0.42 1.01 0.00 -0.34 0.00 0.00 42.92 44.02 3h6f s ASP 90 CO 0.00 -0.90 1.89 0.03 0.68 0.00 0.00 175.17 176.87 3h6f h ARG 91 N 2.57 0.00 0.00 2.11 3.08 -1.90 -2.67 114.38 117.57 3h6f h ARG 91 Ca -0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.72 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 0.49 0.25 0.00 -2.13 -1.07 0.00 0.00 179.97 177.51 3h6f n ARG 92 N -3.60 0.10 0.07 0.04 0.63 -1.26 -3.15 116.66 109.48 3h6f n ARG 92 Ca -0.01 0.19 -0.01 0.00 -0.92 0.00 0.00 57.85 57.10 3h6f n ARG 92 Cb 0.38 -1.64 0.26 0.00 0.45 0.00 0.00 32.46 31.90 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 0.34 -3.40 6.15 3.58 -1.84 -3.40 116.42 117.84 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 -0.09 -0.07 0.00 1.72 0.00 0.00 39.33 41.37 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 -4.44 4.06 0.39 2.25 1.01 -1.19 -4.91 120.40 117.57 3h6f s VAL 94 Ca -0.06 1.02 0.07 0.00 0.00 0.00 0.00 61.98 63.02 3h6f s VAL 94 Cb 0.14 -4.59 -0.08 0.00 0.00 0.00 0.00 36.38 31.86 3h6f s VAL 94 CO 0.77 -1.11 0.00 0.42 0.00 0.00 0.00 175.10 175.18 3h6f s THR 95 N 4.91 1.90 0.18 3.92 -4.23 -1.26 -4.93 115.64 116.12 3h6f s THR 95 Ca 0.48 -2.03 -0.07 0.00 -1.18 0.00 0.00 61.69 58.89 3h6f s THR 95 Cb -0.08 -2.91 0.01 0.00 1.34 0.00 0.00 72.50 70.86 3h6f s THR 95 CO 0.29 -0.03 1.58 1.23 -0.54 0.00 0.00 174.62 177.14 3h6f h GLY 96 N 1.87 0.95 0.91 3.99 0.00 -1.93 -2.61 103.07 106.24 3h6f h GLY 96 Ca -0.43 -0.85 0.03 0.00 0.00 0.00 0.00 47.33 46.07 3h6f h GLY 96 CO 0.78 0.77 0.54 -0.09 0.00 0.00 0.00 176.54 178.54 3h6f h ARG 97 N 0.75 1.03 0.01 4.80 2.43 -1.96 -0.86 114.38 120.58 3h6f h ARG 97 Ca 0.09 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3h6f h ARG 97 Cb 0.80 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 3h6f h ARG 97 CO 0.07 0.68 -0.01 0.37 -1.51 0.00 0.00 179.97 179.57 3h6f h GLN 98 N 1.06 -0.02 -0.27 0.20 4.15 -1.87 -1.41 115.11 116.95 3h6f h GLN 98 Ca 0.32 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.67 3h6f h GLN 98 Cb -0.03 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 3h6f h GLN 98 CO -0.10 0.23 -0.16 -0.07 -1.93 0.00 0.00 178.83 176.80 3h6f h LEU 99 N -0.27 0.46 -0.47 -2.39 3.38 -1.27 -2.24 115.31 112.50 3h6f h LEU 99 Ca -0.00 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 3h6f h LEU 99 Cb 0.26 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3h6f h LEU 99 CO 0.00 0.64 -0.09 0.00 0.09 0.00 0.00 178.44 179.09 3h6f h ALA 100 N 1.41 0.65 -0.76 1.53 0.00 -1.06 -1.38 119.26 119.65 3h6f h ALA 100 Ca 0.08 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 3h6f h ALA 100 Cb 0.53 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3h6f h ALA 100 CO 0.03 0.53 0.32 -0.97 0.00 0.00 0.00 179.25 179.16 3h6f h ASN 101 N 0.74 1.02 -0.07 0.00 -0.73 -1.03 -0.96 115.58 114.56 3h6f h ASN 101 Ca 0.12 -0.14 -0.16 0.00 1.87 0.00 0.00 56.30 57.99 3h6f h ASN 101 Cb 0.63 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.95 3h6f h ASN 101 CO 0.04 0.89 -0.52 0.58 -0.37 0.00 0.00 177.43 178.05 3h6f h VAL 102 N 1.09 1.31 -0.15 2.57 2.07 -1.17 -1.73 116.25 120.24 3h6f h VAL 102 Ca 0.26 -1.75 -0.15 0.00 0.82 0.00 0.00 66.70 65.88 3h6f h VAL 102 Cb 0.18 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 3h6f h VAL 102 CO -0.02 0.55 -0.53 1.88 0.02 0.00 0.00 177.57 179.46 3h6f h TYR 103 N 0.50 0.55 -0.62 1.57 0.05 -0.93 -1.31 116.97 116.78 3h6f h TYR 103 Ca 0.02 -0.19 -0.09 0.00 0.05 0.00 0.00 58.73 58.51 3h6f h TYR 103 Cb 1.08 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 38.69 3h6f h TYR 103 CO 0.05 0.88 0.03 0.00 -1.05 0.00 0.00 178.16 178.07 3h6f h ALA 104 N 1.08 0.87 -0.29 3.88 0.00 -1.05 0.30 119.26 124.06 3h6f h ALA 104 Ca 0.01 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 3h6f h ALA 104 Cb 1.05 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3h6f h ALA 104 CO 0.09 0.67 -0.05 0.37 0.00 0.00 0.00 179.25 180.33 3h6f h GLN 105 N 0.99 0.54 -0.12 0.00 5.75 -1.17 -1.81 115.11 119.28 3h6f h GLN 105 Ca 0.18 -0.20 -0.03 0.00 -0.15 0.00 0.00 58.65 58.45 3h6f h GLN 105 Cb 0.53 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 29.04 3h6f h GLN 105 CO 0.03 0.73 -0.05 1.15 -2.65 0.00 0.00 178.83 178.03 3h6f h THR 106 N 0.31 1.31 -0.27 2.39 2.02 -1.00 -2.32 112.91 115.34 3h6f h THR 106 Ca 0.07 -1.05 -0.09 0.00 0.77 0.00 0.00 66.41 66.11 3h6f h THR 106 Cb 0.52 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.66 3h6f h THR 106 CO 0.02 0.30 -0.21 -0.07 0.37 0.00 0.00 175.52 175.93 3h6f h LEU 107 N -0.09 0.50 -0.76 2.58 3.38 -0.98 -1.81 115.31 118.13 3h6f h LEU 107 Ca 0.03 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 3h6f h LEU 107 Cb 0.50 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3h6f h LEU 107 CO 0.02 0.72 -0.01 1.23 0.09 0.00 0.00 178.44 180.48 3h6f h GLY 108 N 0.99 1.00 1.63 0.83 0.00 -1.31 -0.78 103.07 105.44 3h6f h GLY 108 Ca 0.07 -0.71 -0.15 0.00 0.00 0.00 0.00 47.33 46.54 3h6f h GLY 108 CO 0.04 0.66 -0.58 -0.84 0.00 0.00 0.00 176.54 175.81 3h6f h THR 109 N 0.85 1.36 -0.08 4.70 2.02 -1.12 -2.89 112.91 117.74 3h6f h THR 109 Ca 0.16 -1.90 -0.24 0.00 0.77 0.00 0.00 66.41 65.19 3h6f h THR 109 Cb 0.52 1.90 0.02 0.00 -1.74 0.00 0.00 68.15 68.85 3h6f h THR 109 CO 0.03 0.57 -0.90 0.40 0.37 0.00 0.00 175.52 175.99 3h6f h ILE 110 N 0.29 1.28 -0.28 3.11 2.04 -1.02 -0.75 117.51 122.18 3h6f h ILE 110 Ca -0.00 -2.10 0.06 0.00 1.00 0.00 0.00 64.86 63.82 3h6f h ILE 110 Cb 1.11 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 39.34 3h6f h ILE 110 CO 0.10 0.66 0.19 0.15 0.00 0.00 0.00 178.15 179.25 3h6f h PHE 111 N 0.47 0.11 0.00 1.37 3.57 -1.11 -2.82 116.94 118.53 3h6f h PHE 111 Ca -0.09 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.19 3h6f h PHE 111 Cb 1.54 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 40.21 3h6f h PHE 111 CO 0.10 0.06 -1.53 2.41 -2.23 0.00 0.00 178.31 177.12 3h6f n THR 112 N -4.48 1.50 0.10 4.41 -1.04 -1.10 -4.77 114.28 108.91 3h6f n THR 112 Ca 0.03 -0.07 -0.18 0.00 -2.04 0.00 0.00 64.05 61.78 3h6f n THR 112 Cb 0.27 -2.12 -0.14 0.00 -1.82 0.00 0.00 70.33 66.52 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 0.33 -7.10 -2.82 3.07 -1.23 -3.48 114.58 102.35 3h6f h GLU 113 Ca -0.34 -0.56 -0.50 0.00 -0.50 0.00 0.00 59.36 57.47 3h6f h GLU 113 Cb 1.21 0.21 0.04 0.00 -0.84 0.00 0.00 28.75 29.37 3h6f h GLU 113 CO -0.20 1.25 0.23 -0.65 -1.40 0.00 0.00 179.01 178.23 3h6f s GLN 114 N -2.63 3.56 0.07 2.33 -0.21 -1.06 -5.03 119.66 116.69 3h6f s GLN 114 Ca -0.06 0.41 -0.25 0.00 0.02 0.00 0.00 55.36 55.48 3h6f s GLN 114 Cb 0.06 -2.26 -0.16 0.00 1.00 0.00 0.00 33.01 31.65 3h6f s GLN 114 CO 0.89 -0.34 1.64 0.00 -2.12 0.00 0.00 175.29 175.35 3h6f h ALA 115 N 0.02 -0.16 -3.53 6.09 0.00 -1.92 -3.43 119.26 116.32 3h6f h ALA 115 Ca -0.46 -0.07 -0.67 0.00 0.00 0.00 0.00 54.91 53.71 3h6f h ALA 115 Cb 1.20 0.06 -0.27 0.00 0.00 0.00 0.00 17.79 18.78 3h6f h ALA 115 CO 0.62 -0.55 -0.79 0.21 0.00 0.00 0.00 179.25 178.73 3h6f s LYS 116 N -5.85 3.08 0.78 0.00 2.20 -1.26 -5.12 119.74 113.58 3h6f s LYS 116 Ca -0.14 -0.74 -0.11 0.00 -0.36 0.00 0.00 55.97 54.62 3h6f s LYS 116 Cb 0.05 -2.49 0.06 0.00 -1.51 0.00 0.00 37.83 33.94 3h6f s LYS 116 CO 0.65 0.31 1.09 -1.25 -0.36 0.00 0.00 175.35 175.78 3h6f s PRO 117 N 0.09 2.19 -0.26 4.03 0.04 -1.26 -4.88 135.00 134.95 3h6f s PRO 117 Ca -0.07 1.03 -0.27 0.00 0.04 0.00 0.00 61.00 61.73 3h6f s PRO 117 Cb -0.15 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.49 3h6f s PRO 117 CO 0.05 -1.65 0.93 0.71 0.04 0.00 0.00 177.00 177.08 3h6f s TYR 118 N -2.95 3.28 -1.51 0.56 1.51 -1.26 -4.93 117.35 112.05 3h6f s TYR 118 Ca 0.61 1.21 -0.11 0.00 -1.01 0.00 0.00 57.07 57.77 3h6f s TYR 118 Cb -0.16 -3.24 0.00 0.00 -0.11 0.00 0.00 41.96 38.45 3h6f s TYR 118 CO 0.56 -0.50 2.54 0.39 -1.11 0.00 0.00 175.55 177.42 3h6f n GLU 119 N 6.27 3.46 -4.06 -0.62 1.02 -1.26 -4.69 120.64 120.76 3h6f n GLU 119 Ca 0.08 -2.59 -0.07 0.00 -0.02 0.00 0.00 57.16 54.56 3h6f n GLU 119 Cb 0.47 -2.98 -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 2.09 0.20 -0.03 2.62 -7.23 -1.26 -1.46 120.40 115.34 3h6f s VAL 120 Ca 0.57 -1.65 -0.01 0.00 -1.81 0.00 0.00 61.98 59.09 3h6f s VAL 120 Cb 0.16 -1.34 0.03 0.00 0.56 0.00 0.00 36.38 35.79 3h6f s VAL 120 CO -0.07 -0.91 0.04 -0.70 -0.31 0.00 0.00 175.10 173.15 3h6f s GLU 121 N -3.58 -0.04 0.17 4.82 2.12 -0.33 -3.30 118.70 118.55 3h6f s GLU 121 Ca 0.04 0.24 0.10 0.00 0.36 0.00 0.00 54.97 55.71 3h6f s GLU 121 Cb 0.05 -0.33 -0.04 0.00 0.26 0.00 0.00 34.13 34.07 3h6f s GLU 121 CO -0.09 -0.22 -0.19 -0.51 -0.54 0.00 0.00 175.26 173.72 3h6f s LEU 122 N 1.40 2.63 -0.07 2.70 1.43 -0.25 -1.51 118.68 125.00 3h6f s LEU 122 Ca -0.05 -0.71 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 3h6f s LEU 122 Cb -0.13 -1.39 0.02 0.00 0.03 0.00 0.00 46.19 44.72 3h6f s LEU 122 CO -0.03 0.13 -0.06 0.00 0.23 0.00 0.00 176.35 176.63 3h6f s VAL 124 N 1.34 3.17 0.06 0.00 1.01 -0.77 -1.38 120.40 123.82 3h6f s VAL 124 Ca -0.03 -0.60 0.07 0.00 0.00 0.00 0.00 61.98 61.42 3h6f s VAL 124 Cb -0.14 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 3h6f s VAL 124 CO -0.03 0.49 -0.20 0.00 0.00 0.00 0.00 175.10 175.36 3h6f s ALA 125 N 0.75 1.74 -0.01 5.51 0.00 -0.68 -0.78 121.76 128.29 3h6f s ALA 125 Ca -0.04 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 50.84 3h6f s ALA 125 Cb -0.15 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.66 3h6f s ALA 125 CO 0.02 0.38 -0.06 -2.00 0.00 0.00 0.00 175.76 174.10 3h6f s GLU 126 N -1.36 0.56 0.44 0.00 2.12 -0.41 -0.52 118.70 119.53 3h6f s GLU 126 Ca 0.07 -0.18 0.07 0.00 0.36 0.00 0.00 54.97 55.28 3h6f s GLU 126 Cb -0.09 -0.56 -0.03 0.00 0.26 0.00 0.00 34.13 33.72 3h6f s GLU 126 CO 0.02 0.08 0.24 0.14 -0.54 0.00 0.00 175.26 175.20 3h6f s VAL 127 N 0.13 2.17 0.76 3.70 -7.23 -0.86 -1.64 120.40 117.43 3h6f s VAL 127 Ca -0.01 -1.62 -0.11 0.00 -1.81 0.00 0.00 61.98 58.43 3h6f s VAL 127 Cb -0.06 -2.79 0.05 0.00 0.56 0.00 0.00 36.38 34.15 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 -2.63 2.31 0.71 1.32 0.00 -1.26 -4.87 121.76 117.34 3h6f s ALA 128 Ca 0.39 0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.48 3h6f s ALA 128 Cb 0.01 -3.26 0.02 0.00 0.00 0.00 0.00 23.12 19.89 3h6f s ALA 128 CO 0.22 -1.70 1.07 -1.01 0.00 0.00 0.00 175.76 174.34 3h6f s HIS 129 N -2.92 3.16 0.13 0.00 3.76 -1.26 -4.81 115.29 113.35 3h6f s HIS 129 Ca 0.61 1.25 -0.34 0.00 -0.15 0.00 0.00 55.06 56.43 3h6f s HIS 129 Cb -0.17 -2.96 -0.13 0.00 1.11 0.00 0.00 32.58 30.43 3h6f s HIS 129 CO 0.56 -1.28 1.63 0.98 -0.85 0.00 0.00 174.74 175.77 3h6f n TYR 130 N -3.13 2.31 -1.03 1.40 9.36 -1.26 -2.04 117.16 122.77 3h6f n TYR 130 Ca 0.07 0.21 -0.01 0.00 3.32 0.00 0.00 57.90 61.49 3h6f n TYR 130 Cb 0.55 -2.57 -0.00 0.00 -0.63 0.00 0.00 39.34 36.69 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 3.58 0.48 3.62 2.98 0.00 -1.26 -5.03 105.19 109.56 3h6f n GLY 131 Ca 0.18 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.87 2.25 -0.34 1.61 2.02 -0.86 -5.11 118.70 117.40 3h6f s GLU 132 Ca 0.00 -1.17 -0.08 0.00 0.02 0.00 0.00 54.97 53.74 3h6f s GLU 132 Cb 0.00 -2.27 0.03 0.00 0.10 0.00 0.00 34.13 31.98 3h6f s GLU 132 CO 0.00 0.45 0.14 0.99 0.02 0.00 0.00 175.26 176.86 3h6f s THR 133 N -1.70 4.13 -0.25 3.63 2.01 -1.26 -4.75 115.64 117.44 3h6f s THR 133 Ca 0.26 -0.93 -0.18 0.00 0.31 0.00 0.00 61.69 61.15 3h6f s THR 133 Cb -0.09 -3.28 0.07 0.00 0.01 0.00 0.00 72.50 69.21 3h6f s THR 133 CO 0.17 -0.14 0.65 -0.75 -0.69 0.00 0.00 174.62 173.85 3h6f s LYS 134 N 1.48 0.70 0.11 4.92 2.20 -1.26 -5.10 119.74 122.79 3h6f s LYS 134 Ca 0.01 1.06 -0.31 0.00 -0.36 0.00 0.00 55.97 56.37 3h6f s LYS 134 Cb -0.19 0.21 -0.07 0.00 -1.51 0.00 0.00 37.83 36.27 3h6f s LYS 134 CO 0.04 -0.13 1.26 0.50 -0.36 0.00 0.00 175.35 176.66 3h6f s ARG 135 N 1.11 4.41 0.35 4.03 6.06 -1.26 -4.46 118.95 129.20 3h6f s ARG 135 Ca -0.06 1.90 -0.28 0.00 -2.50 0.00 0.00 55.73 54.79 3h6f s ARG 135 Cb -0.05 -3.29 -0.12 0.00 0.06 0.00 0.00 34.95 31.55 3h6f s ARG 135 CO -0.11 -0.27 1.26 -2.30 -2.50 0.00 0.00 175.30 171.38 3h6f n PRO 136 N 3.55 2.04 -4.52 5.12 -0.02 -1.26 -4.89 135.00 135.01 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 -2.30 -0.12 0.00 -0.02 0.00 0.00 33.50 31.51 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 -1.91 3.30 -0.06 -0.52 2.02 -0.65 -4.98 118.70 115.89 3h6f s GLU 137 Ca 0.57 -0.54 0.03 0.00 0.02 0.00 0.00 54.97 55.04 3h6f s GLU 137 Cb -0.57 -2.76 0.01 0.00 0.10 0.00 0.00 34.13 30.91 3h6f s GLU 137 CO 0.61 0.40 -0.15 -0.51 0.02 0.00 0.00 175.26 175.64 3h6f s LEU 138 N -0.10 1.79 -0.04 1.80 1.02 -1.24 -1.29 118.68 120.64 3h6f s LEU 138 Ca 0.01 -0.34 0.06 0.00 0.02 0.00 0.00 54.13 53.88 3h6f s LEU 138 Cb -0.13 -0.94 -0.01 0.00 0.02 0.00 0.00 46.19 45.13 3h6f s LEU 138 CO 0.03 0.09 -0.22 -0.31 0.02 0.00 0.00 176.35 175.96 3h6f s TYR 139 N 0.41 2.05 -0.18 0.29 2.02 0.04 -1.94 117.35 120.04 3h6f s TYR 139 Ca -0.11 -0.52 -0.04 0.00 -0.37 0.00 0.00 57.07 56.03 3h6f s TYR 139 Cb -0.14 -1.34 -0.02 0.00 -0.40 0.00 0.00 41.96 40.05 3h6f s TYR 139 CO 0.04 -0.13 -0.03 0.50 -1.57 0.00 0.00 175.55 174.36 3h6f s ARG 140 N -0.25 3.60 -0.13 -0.62 3.52 -0.68 -1.84 118.95 122.54 3h6f s ARG 140 Ca 0.01 -0.54 0.03 0.00 -0.13 0.00 0.00 55.73 55.10 3h6f s ARG 140 Cb -0.11 -2.98 0.01 0.00 -1.56 0.00 0.00 34.95 30.31 3h6f s ARG 140 CO 0.01 0.09 -0.21 0.42 -0.81 0.00 0.00 175.30 174.80 3h6f s ILE 141 N 0.76 1.97 0.39 4.11 1.09 0.10 -1.34 121.20 128.28 3h6f s ILE 141 Ca -0.01 -0.93 0.08 0.00 -1.10 0.00 0.00 60.65 58.68 3h6f s ILE 141 Cb -0.14 -1.74 -0.01 0.00 -1.06 0.00 0.00 42.46 39.50 3h6f s ILE 141 CO 0.02 0.53 0.42 0.42 -0.10 0.00 0.00 174.94 176.24 3h6f s THR 142 N 0.75 3.16 0.64 2.92 -4.23 -0.43 -1.09 115.64 117.35 3h6f s THR 142 Ca -0.09 -1.20 0.31 0.00 -1.18 0.00 0.00 61.69 59.53 3h6f s THR 142 Cb -0.16 -3.10 0.34 0.00 1.34 0.00 0.00 72.50 70.92 3h6f s THR 142 CO 0.00 -0.06 2.00 0.10 -0.54 0.00 0.00 174.62 176.11 3h6f h TYR 143 N 0.95 0.00 -0.01 3.99 -0.00 -1.83 0.70 116.97 120.78 3h6f h TYR 143 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.31 3h6f h TYR 143 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.00 3h6f h TYR 143 CO 0.47 0.00 -0.43 -0.40 -0.00 0.00 0.00 178.16 177.81 3h6f n ASP 144 N -3.21 1.10 0.00 0.10 3.85 -1.26 -4.56 116.55 112.56 3h6f n ASP 144 Ca 0.00 -0.88 0.00 0.00 -0.71 0.00 0.00 54.79 53.21 3h6f n ASP 144 Cb 0.39 0.31 0.00 0.00 -1.35 0.00 0.00 41.12 40.47 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 1.41 1.00 3.73 6.12 0.00 0.24 -4.08 105.19 113.60 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 7.50 -0.10 1.61 0.01 -1.25 -4.76 113.70 114.70 3h6f s SER 146 Ca 0.00 1.79 0.04 0.00 1.31 0.00 0.00 55.95 59.09 3h6f s SER 146 Cb 0.00 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.65 3h6f s SER 146 CO 0.00 -0.03 -0.24 -0.51 0.41 0.00 0.00 173.24 172.87 3h6f s ILE 147 N -0.14 2.05 -0.06 1.44 2.07 -1.26 -1.32 121.20 123.98 3h6f s ILE 147 Ca 0.46 -1.01 0.03 0.00 -1.41 0.00 0.00 60.65 58.71 3h6f s ILE 147 Cb -0.23 -1.77 0.01 0.00 0.13 0.00 0.00 42.46 40.59 3h6f s ILE 147 CO 0.30 0.56 -0.14 0.00 -1.91 0.00 0.00 174.94 173.74 3h6f s ALA 148 N 0.37 1.40 -0.59 1.50 0.00 -0.45 -4.99 121.76 119.00 3h6f s ALA 148 Ca -0.18 -0.53 -0.22 0.00 0.00 0.00 0.00 51.96 51.03 3h6f s ALA 148 Cb -0.18 -0.57 0.06 0.00 0.00 0.00 0.00 23.12 22.43 3h6f s ALA 148 CO 0.08 0.17 0.88 0.34 0.00 0.00 0.00 175.76 177.24 3h6f s ASP 149 N 0.48 6.24 -0.20 0.00 -1.08 -1.26 -1.69 116.67 119.16 3h6f s ASP 149 Ca -0.13 -0.78 -0.17 0.00 -0.52 0.00 0.00 52.55 50.96 3h6f s ASP 149 Cb -0.15 -2.40 -0.04 0.00 -1.46 0.00 0.00 42.92 38.88 3h6f s ASP 149 CO 0.04 -1.26 0.43 -1.61 0.52 0.00 0.00 175.17 173.29 3h6f s GLU 150 N 3.71 4.18 0.20 4.34 0.41 -0.82 -5.00 118.70 125.71 3h6f s GLU 150 Ca 0.23 0.26 0.11 0.00 -0.41 0.00 0.00 54.97 55.16 3h6f s GLU 150 Cb -0.16 -3.54 -0.05 0.00 -1.78 0.00 0.00 34.13 28.60 3h6f s GLU 150 CO 0.13 -0.07 1.37 -1.35 -0.49 0.00 0.00 175.26 174.86 3h6f h PRO 151 N 7.39 0.00 0.00 0.39 0.11 -1.94 -3.28 132.00 134.67 3h6f h PRO 151 Ca -0.35 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.64 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 0.72 0.77 -1.40 0.72 -0.21 0.00 0.00 178.00 178.60 3h6f n HIS 152 N -3.32 0.00 -3.68 0.65 8.25 -1.26 -4.90 115.22 110.96 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 0.83 -0.26 -0.05 0.00 1.12 0.00 0.00 29.99 31.63 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 -2.13 -0.15 -0.02 4.41 -0.12 -1.26 -2.75 117.98 115.96 3h6f s PHE 153 Ca -0.10 -0.16 0.02 0.00 -0.05 0.00 0.00 56.93 56.64 3h6f s PHE 153 Cb 0.04 0.19 0.00 0.00 -0.63 0.00 0.00 43.02 42.62 3h6f s PHE 153 CO 0.13 -0.65 -0.07 0.08 -0.05 0.00 0.00 175.22 174.65 3h6f s VAL 154 N -3.64 0.65 -0.09 -2.49 1.01 -0.63 -4.88 120.40 110.33 3h6f s VAL 154 Ca 0.02 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.72 3h6f s VAL 154 Cb 0.02 -0.58 0.02 0.00 0.00 0.00 0.00 36.38 35.84 3h6f s VAL 154 CO -0.11 0.21 -0.12 -0.69 0.00 0.00 0.00 175.10 174.39 3h6f s VAL 155 N 0.18 1.20 0.04 2.92 1.01 -1.26 -1.29 120.40 123.20 3h6f s VAL 155 Ca -0.02 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.52 3h6f s VAL 155 Cb -0.07 -1.12 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 3h6f s VAL 155 CO 0.00 0.38 -0.11 -0.04 0.00 0.00 0.00 175.10 175.33 3h6f s MET 156 N 1.02 0.70 0.09 2.72 -1.94 -0.42 -5.00 119.30 116.47 3h6f s MET 156 Ca -0.07 -0.71 0.00 0.00 -1.71 0.00 0.00 55.69 53.19 3h6f s MET 156 Cb -0.15 -0.63 0.00 0.00 2.01 0.00 0.00 34.83 36.07 3h6f s MET 156 CO -0.01 0.14 0.00 0.41 -0.01 0.00 0.00 175.02 175.56 3h6f n GLY 157 N 1.78 -2.95 7.00 -0.03 0.00 -1.26 -1.15 105.19 108.58 3h6f n GLY 157 Ca -0.19 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 -1.73 1.89 3.33 -0.02 0.00 -0.42 -4.34 105.19 103.90 3h6f n GLY 158 Ca -0.00 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.01 2.61 2.01 -1.26 -4.35 115.64 119.18 3h6f s THR 159 Ca 0.00 -1.16 -0.25 0.00 0.31 0.00 0.00 61.69 60.60 3h6f s THR 159 Cb 0.00 -3.68 -0.17 0.00 0.01 0.00 0.00 72.50 68.65 3h6f s THR 159 CO 0.00 -0.43 1.21 0.74 -0.69 0.00 0.00 174.62 175.45 3h6f h THR 160 N 5.95 0.92 -0.69 -0.82 2.02 -1.95 -3.37 112.91 114.97 3h6f h THR 160 Ca -0.25 -0.80 0.15 0.00 0.77 0.00 0.00 66.41 66.28 3h6f h THR 160 Cb 1.09 1.38 -0.11 0.00 -1.74 0.00 0.00 68.15 68.78 3h6f h THR 160 CO 0.75 0.17 0.10 -0.33 0.37 0.00 0.00 175.52 176.59 3h6f h GLU 161 N -0.66 0.20 -0.17 6.66 3.07 -1.97 0.08 114.58 121.78 3h6f h GLU 161 Ca -0.03 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 58.74 3h6f h GLU 161 Cb 0.48 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 3h6f h GLU 161 CO 0.04 0.13 -0.27 -1.35 -1.40 0.00 0.00 179.01 176.16 3h6f h PRO 162 N 0.20 0.32 0.14 2.33 0.11 -1.84 -1.69 132.00 131.57 3h6f h PRO 162 Ca 0.38 -0.12 -0.28 0.00 0.11 0.00 0.00 66.00 66.09 3h6f h PRO 162 Cb 0.63 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 31.73 3h6f h PRO 162 CO -0.52 0.57 -1.25 0.82 -0.21 0.00 0.00 178.00 177.41 3h6f h ILE 163 N 0.29 1.45 -0.25 4.15 2.04 -1.61 -2.77 117.51 120.80 3h6f h ILE 163 Ca 0.04 -2.91 -0.13 0.00 1.00 0.00 0.00 64.86 62.86 3h6f h ILE 163 Cb 0.64 2.89 -0.01 0.00 -0.74 0.00 0.00 36.82 39.60 3h6f h ILE 163 CO 0.05 0.86 -0.37 0.00 0.00 0.00 0.00 178.15 178.68 3h6f h ALA 164 N 0.52 0.89 0.02 1.87 0.00 -0.88 -2.53 119.26 119.14 3h6f h ALA 164 Ca -0.15 -0.42 -0.24 0.00 0.00 0.00 0.00 54.91 54.09 3h6f h ALA 164 Cb 1.96 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.64 3h6f h ALA 164 CO 0.21 0.63 -1.00 -0.91 0.00 0.00 0.00 179.25 178.18 3h6f h ASN 165 N 0.47 0.62 0.87 0.00 2.35 -1.38 -1.98 115.58 116.52 3h6f h ASN 165 Ca 0.05 -0.51 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 3h6f h ASN 165 Cb 0.86 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.04 3h6f h ASN 165 CO 0.07 1.32 0.00 0.00 -1.65 0.00 0.00 177.43 177.17 3h6f n ALA 166 N -2.57 1.82 -0.09 -0.83 0.00 -1.04 -2.67 120.51 115.13 3h6f n ALA 166 Ca -0.08 0.04 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 3h6f n ALA 166 Cb 0.87 -1.39 -0.16 0.00 0.00 0.00 0.00 19.45 18.77 3h6f n ALA 166 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3h6f n LEU 167 N -2.11 0.02 0.22 0.00 7.94 -0.96 -3.89 117.00 118.21 3h6f n LEU 167 Ca 0.03 0.01 0.05 0.00 -1.11 0.00 0.00 56.01 54.99 3h6f n LEU 167 Cb 0.27 0.47 0.49 0.00 0.53 0.00 0.00 43.42 45.18 3h6f n LEU 167 CO 0.22 0.48 0.87 0.11 -1.11 0.00 0.00 177.39 177.95 3h6f h LYS 168 N 0.00 0.00 -0.01 1.96 1.57 -1.13 -2.14 116.57 116.82 3h6f h LYS 168 Ca -0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 3h6f h LYS 168 Cb 2.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.50 3h6f h LYS 168 CO 0.03 0.22 -0.33 -1.91 -0.57 0.00 0.00 179.45 176.89 3h6f n GLU 169 N -4.21 1.25 0.00 3.15 4.07 -1.14 -4.50 120.64 119.26 3h6f n GLU 169 Ca -0.02 -0.94 0.00 0.00 -0.06 0.00 0.00 57.16 56.13 3h6f n GLU 169 Cb 0.28 -1.48 0.00 0.00 -0.06 0.00 0.00 31.44 30.18 3h6f n GLU 169 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 3h6f n SER 170 N -0.05 0.37 -4.74 4.31 3.41 -1.05 -5.08 113.62 110.79 3h6f n SER 170 Ca 0.11 -0.31 -0.42 0.00 -0.26 0.00 0.00 58.87 58.00 3h6f n SER 170 Cb 0.44 0.69 -0.03 0.00 -0.26 0.00 0.00 64.21 65.05 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 -0.76 3.14 0.01 7.33 5.04 -0.83 -5.05 117.35 126.23 3h6f s TYR 171 Ca 0.00 1.05 0.08 0.00 -2.44 0.00 0.00 57.07 55.76 3h6f s TYR 171 Cb 0.00 -3.73 -0.03 0.00 0.35 0.00 0.00 41.96 38.55 3h6f s TYR 171 CO 0.00 -2.41 -0.24 0.00 -1.34 0.00 0.00 175.55 171.55 3h6f s ALA 172 N 0.30 2.30 0.17 3.97 0.00 -1.26 -5.07 121.76 122.18 3h6f s ALA 172 Ca 0.60 -1.17 -0.14 0.00 0.00 0.00 0.00 51.96 51.25 3h6f s ALA 172 Cb -0.39 -0.58 0.10 0.00 0.00 0.00 0.00 23.12 22.24 3h6f s ALA 172 CO 0.38 0.54 1.80 0.93 0.00 0.00 0.00 175.76 179.42 3h6f h GLU 173 N 5.08 0.54 -1.01 0.00 4.39 -1.96 -3.29 114.58 118.34 3h6f h GLU 173 Ca -0.45 -0.03 -0.51 0.00 0.34 0.00 0.00 59.36 58.70 3h6f h GLU 173 Cb 1.14 -0.12 -0.42 0.00 -0.10 0.00 0.00 28.75 29.24 3h6f h GLU 173 CO 0.46 0.36 -0.85 0.09 -1.16 0.00 0.00 179.01 177.91 3h6f n ASN 174 N -4.83 4.18 -4.67 1.42 4.13 -1.26 -4.64 115.26 109.59 3h6f n ASN 174 Ca 0.04 -3.46 -0.41 0.00 1.68 0.00 0.00 54.58 52.43 3h6f n ASN 174 Cb 0.09 -0.41 0.02 0.00 -1.54 0.00 0.00 39.78 37.93 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 -0.56 0.88 -1.53 5.41 0.00 -1.24 -4.30 120.51 119.16 3h6f n ALA 175 Ca 0.35 0.22 -0.17 0.00 0.00 0.00 0.00 53.44 53.84 3h6f n ALA 175 Cb 0.83 -2.20 0.18 0.00 0.00 0.00 0.00 19.45 18.26 3h6f n ALA 175 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3h6f n SER 176 N 0.12 -0.57 0.24 0.00 3.41 -1.26 -1.66 113.62 113.90 3h6f n SER 176 Ca 0.08 -1.29 -0.14 0.00 -0.26 0.00 0.00 58.87 57.27 3h6f n SER 176 Cb 0.40 -0.84 -0.08 0.00 -0.26 0.00 0.00 64.21 63.43 3h6f n SER 176 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3h6f h LEU 177 N 0.00 -0.53 -1.89 1.04 5.85 -1.99 -1.81 115.31 115.99 3h6f h LEU 177 Ca -0.35 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.31 3h6f h LEU 177 Cb 1.00 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 3h6f h LEU 177 CO 0.24 -0.18 0.15 0.71 -0.34 0.00 0.00 178.44 179.02 3h6f h THR 178 N -0.91 0.97 0.05 1.05 1.35 -1.95 -1.59 112.91 111.88 3h6f h THR 178 Ca -0.06 -0.05 -0.00 0.00 -0.55 0.00 0.00 66.41 65.74 3h6f h THR 178 Cb 0.58 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 3h6f h THR 178 CO 0.10 0.03 -0.02 0.44 -0.25 0.00 0.00 175.52 175.82 3h6f h ASP 179 N 0.14 -0.06 -0.10 5.36 3.32 -1.89 -3.17 116.42 120.03 3h6f h ASP 179 Ca 0.09 -0.52 -0.02 0.00 0.02 0.00 0.00 57.03 56.61 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 -0.01 0.66 0.03 0.00 -1.72 0.00 0.00 179.24 178.19 3h6f h ALA 180 N -0.35 1.75 -0.17 3.45 0.00 -1.21 -2.39 119.26 120.35 3h6f h ALA 180 Ca -0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3h6f h ALA 180 Cb 0.57 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3h6f h ALA 180 CO 0.01 0.19 -0.08 1.25 0.00 0.00 0.00 179.25 180.62 3h6f h LEU 181 N 0.22 0.36 -0.99 0.00 7.12 -1.42 -2.25 115.31 118.36 3h6f h LEU 181 Ca 0.06 -0.42 -0.06 0.00 0.13 0.00 0.00 57.88 57.60 3h6f h LEU 181 Cb 0.11 -0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 40.12 3h6f h LEU 181 CO -0.00 0.70 0.11 -0.09 -0.13 0.00 0.00 178.44 179.03 3h6f h ARG 182 N 0.02 0.85 -0.25 1.25 2.43 -1.49 -1.17 114.38 116.02 3h6f h ARG 182 Ca 0.04 -0.18 -0.12 0.00 -0.81 0.00 0.00 59.98 58.91 3h6f h ARG 182 Cb 0.56 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 3h6f h ARG 182 CO 0.02 0.77 -0.34 0.82 -1.51 0.00 0.00 179.97 179.74 3h6f h ILE 183 N 0.81 1.29 -0.10 1.20 2.04 -1.42 -2.08 117.51 119.25 3h6f h ILE 183 Ca 0.17 -1.46 -0.16 0.00 1.00 0.00 0.00 64.86 64.41 3h6f h ILE 183 Cb 0.32 1.47 0.01 0.00 -0.74 0.00 0.00 36.82 37.88 3h6f h ILE 183 CO 0.00 0.46 -0.57 0.00 0.00 0.00 0.00 178.15 178.04 3h6f h ALA 184 N 1.17 0.20 -0.41 1.87 0.00 -0.94 -2.50 119.26 118.64 3h6f h ALA 184 Ca 0.05 -0.53 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 3h6f h ALA 184 Cb 0.82 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3h6f h ALA 184 CO 0.07 0.44 -0.14 0.28 0.00 0.00 0.00 179.25 179.90 3h6f h VAL 185 N 0.17 1.26 -0.36 0.00 2.07 -1.21 -1.04 116.25 117.14 3h6f h VAL 185 Ca -0.04 -1.20 -0.04 0.00 0.82 0.00 0.00 66.70 66.23 3h6f h VAL 185 Cb 1.22 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 3h6f h VAL 185 CO 0.12 0.41 0.07 0.00 0.02 0.00 0.00 177.57 178.19 3h6f h ALA 186 N 1.16 0.48 0.00 1.67 0.00 -1.42 -2.82 119.26 118.34 3h6f h ALA 186 Ca 0.11 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 3h6f h ALA 186 Cb 0.62 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3h6f h ALA 186 CO 0.04 0.17 -0.40 0.00 0.00 0.00 0.00 179.25 179.06 3h6f h ALA 187 N 0.92 1.13 0.00 0.00 0.00 -1.25 -2.90 119.26 117.16 3h6f h ALA 187 Ca 0.11 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3h6f h ALA 187 Cb 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3h6f h ALA 187 CO 0.00 0.50 0.00 1.25 0.00 0.00 0.00 179.25 181.01 3h6f h LEU 188 N 0.00 0.00 -0.54 0.00 5.85 -0.99 -3.17 115.31 116.46 3h6f h LEU 188 Ca -0.00 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 3h6f h LEU 188 Cb 0.81 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 3h6f h LEU 188 CO 0.05 0.00 -0.47 0.03 -0.34 0.00 0.00 178.44 177.72 3h6f h ARG 189 N 0.00 0.00 -2.19 1.25 3.08 -1.28 -3.32 114.38 111.91 3h6f h ARG 189 Ca 0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.81 3h6f h ARG 189 Cb 0.70 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.70 3h6f h ARG 189 CO 0.00 0.47 0.21 0.00 -1.07 0.00 0.00 179.97 179.58 3h6f n ALA 190 N -2.28 6.22 0.00 0.04 0.00 -1.20 -5.15 120.51 118.15 3h6f n ALA 190 Ca 0.01 -1.94 0.00 0.00 0.00 0.00 0.00 53.44 51.51 3h6f n ALA 190 Cb 0.62 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.62 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 2.68 0.00 0.00 0.00 0.00 -1.25 -4.16 105.19 102.45 3h6f n GLY 191 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 3h6f n GLY 191 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3h6f n LEU 203 N 0.00 0.00 0.00 0.99 -0.00 -1.26 -5.05 117.00 111.68 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 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 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 5.40 0.32 -3.96 0.00 -1.26 -4.99 105.19 100.71 3h6f n GLY 204 Ca 0.00 -0.95 0.30 0.00 0.00 0.00 0.00 46.02 45.37 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 0.04 0.00 1.61 2.07 -1.95 0.18 116.25 118.20 3h6f h VAL 205 Ca 0.00 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.46 3h6f h VAL 205 Cb 0.00 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 3h6f h VAL 205 CO 0.00 0.01 -0.20 0.00 0.02 0.00 0.00 177.57 177.39 3h6f h ALA 206 N 1.98 0.91 -0.12 1.67 0.00 -1.96 -3.30 119.26 118.43 3h6f h ALA 206 Ca 0.82 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.54 3h6f h ALA 206 Cb 2.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.86 3h6f h ALA 206 CO -0.76 0.26 0.00 -1.13 0.00 0.00 0.00 179.25 177.62 3h6f n SER 207 N -3.21 2.88 -4.17 0.00 3.41 -0.01 -4.61 113.62 107.91 3h6f n SER 207 Ca 0.02 -2.79 -0.23 0.00 -0.26 0.00 0.00 58.87 55.60 3h6f n SER 207 Cb 0.53 -0.39 -0.15 0.00 -0.26 0.00 0.00 64.21 63.95 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 -2.39 2.09 -0.21 1.04 1.43 -0.83 -1.62 118.68 118.20 3h6f s LEU 208 Ca 0.30 -0.38 0.02 0.00 -1.03 0.00 0.00 54.13 53.03 3h6f s LEU 208 Cb 0.24 -0.82 0.03 0.00 0.03 0.00 0.00 46.19 45.68 3h6f s LEU 208 CO 0.06 0.16 -0.17 -0.70 0.23 0.00 0.00 176.35 175.93 3h6f s GLU 209 N -0.73 2.72 -0.02 1.70 2.12 -0.63 -4.86 118.70 119.00 3h6f s GLU 209 Ca 0.06 -1.00 0.05 0.00 0.36 0.00 0.00 54.97 54.44 3h6f s GLU 209 Cb -0.07 -2.67 -0.01 0.00 0.26 0.00 0.00 34.13 31.64 3h6f s GLU 209 CO 0.00 -0.33 -0.18 0.08 -0.54 0.00 0.00 175.26 174.29 3h6f s VAL 210 N 1.23 1.39 0.03 3.70 1.01 -1.26 -1.17 120.40 125.34 3h6f s VAL 210 Ca 0.00 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 61.00 3h6f s VAL 210 Cb -0.15 -1.16 0.05 0.00 0.00 0.00 0.00 36.38 35.12 3h6f s VAL 210 CO -0.10 0.40 0.52 0.00 0.00 0.00 0.00 175.10 175.92 3h6f s ALA 211 N -0.37 -1.34 0.16 5.51 0.00 -0.68 -1.98 121.76 123.07 3h6f s ALA 211 Ca 0.06 0.67 0.07 0.00 0.00 0.00 0.00 51.96 52.76 3h6f s ALA 211 Cb -0.07 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.32 3h6f s ALA 211 CO -0.00 -0.47 -0.16 0.14 0.00 0.00 0.00 175.76 175.27 3h6f s VAL 212 N -2.20 1.63 -0.66 0.00 -7.23 -0.14 0.27 120.40 112.07 3h6f s VAL 212 Ca -0.07 -1.92 -0.05 0.00 -1.81 0.00 0.00 61.98 58.13 3h6f s VAL 212 Cb -0.01 -1.79 0.17 0.00 0.56 0.00 0.00 36.38 35.31 3h6f s VAL 212 CO 0.00 -0.42 0.50 -0.76 -0.31 0.00 0.00 175.10 174.12 3h6f s LEU 213 N -2.76 5.54 -0.54 1.32 1.43 -0.02 -1.36 118.68 122.30 3h6f s LEU 213 Ca 0.15 -2.81 -0.28 0.00 -1.03 0.00 0.00 54.13 50.16 3h6f s LEU 213 Cb -0.04 -1.93 0.03 0.00 0.03 0.00 0.00 46.19 44.28 3h6f s LEU 213 CO 0.05 -0.41 1.14 -0.62 0.23 0.00 0.00 176.35 176.74 3h6f s ASP 214 N 1.01 6.50 0.00 2.29 2.15 0.20 -2.14 116.67 126.68 3h6f s ASP 214 Ca 0.17 0.19 0.12 0.00 0.43 0.00 0.00 52.55 53.46 3h6f s ASP 214 Cb -0.18 -2.54 0.71 0.00 -0.30 0.00 0.00 42.92 40.61 3h6f s ASP 214 CO -0.04 -1.37 1.21 0.00 -0.17 0.00 0.00 175.17 174.80 3h6f n ALA 215 N 8.11 1.90 0.82 3.66 0.00 -0.26 -2.41 120.51 132.34 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 -1.20 0.19 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 -1.08 2.97 -4.83 0.00 2.85 -1.26 -4.51 115.26 109.41 3h6f n ASN 216 Ca 0.08 -1.94 -0.35 0.00 -0.11 0.00 0.00 54.58 52.26 3h6f n ASN 216 Cb 0.06 -0.09 -0.06 0.00 1.24 0.00 0.00 39.78 40.93 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 -1.82 4.13 0.15 1.20 0.52 -1.01 -5.01 118.95 117.11 3h6f s ARG 217 Ca 0.33 0.73 -0.17 0.00 -0.52 0.00 0.00 55.73 56.09 3h6f s ARG 217 Cb 0.21 -2.81 0.06 0.00 0.52 0.00 0.00 34.95 32.93 3h6f s ARG 217 CO 0.31 0.37 1.70 -1.35 0.02 0.00 0.00 175.30 176.35 3h6f h PRO 218 N 3.24 0.07 0.00 3.54 0.11 -1.91 -3.41 132.00 133.64 3h6f h PRO 218 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3h6f h PRO 218 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3h6f h PRO 218 CO 0.65 0.04 0.00 -2.13 -0.21 0.00 0.00 178.00 176.36 3h6f n ARG 219 N -5.20 0.00 -2.63 1.05 0.63 -1.26 -4.40 116.66 104.84 3h6f n ARG 219 Ca 0.01 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.52 3h6f n ARG 219 Cb 0.18 -0.10 -0.03 0.00 0.45 0.00 0.00 32.46 32.95 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 -1.45 3.23 0.32 -0.14 0.52 -1.26 -4.31 118.95 115.85 3h6f s ARG 220 Ca 0.00 -0.29 0.13 0.00 -0.52 0.00 0.00 55.73 55.05 3h6f s ARG 220 Cb 0.00 -4.16 0.50 0.00 0.52 0.00 0.00 34.95 31.81 3h6f s ARG 220 CO 0.00 -1.98 1.67 0.00 0.02 0.00 0.00 175.30 175.01 3h6f h ALA 221 N 9.83 1.02 -2.60 2.13 0.00 -1.41 -3.46 119.26 124.78 3h6f h ALA 221 Ca -0.28 -0.47 -0.53 0.00 0.00 0.00 0.00 54.91 53.64 3h6f h ALA 221 Cb 1.06 -0.08 0.04 0.00 0.00 0.00 0.00 17.79 18.80 3h6f h ALA 221 CO 1.24 0.64 0.79 0.12 0.00 0.00 0.00 179.25 182.04 3h6f s PHE 222 N -3.67 3.15 -0.13 0.00 5.36 -1.26 -0.63 117.98 120.80 3h6f s PHE 222 Ca -0.01 0.84 -0.07 0.00 -0.96 0.00 0.00 56.93 56.72 3h6f s PHE 222 Cb 0.12 -3.80 0.05 0.00 -0.34 0.00 0.00 43.02 39.06 3h6f s PHE 222 CO 0.73 -2.82 0.32 0.50 -1.46 0.00 0.00 175.22 172.49 3h6f s ARG 223 N 0.91 0.30 0.01 10.12 3.52 -0.46 -4.96 118.95 128.38 3h6f s ARG 223 Ca 0.66 0.62 -0.17 0.00 -0.13 0.00 0.00 55.73 56.72 3h6f s ARG 223 Cb -0.40 -0.05 -0.06 0.00 -1.56 0.00 0.00 34.95 32.88 3h6f s ARG 223 CO 0.32 -0.15 0.47 1.03 -0.81 0.00 0.00 175.30 176.16 3h6f s ARG 224 N 1.20 4.05 -0.46 5.12 0.52 -1.26 -0.97 118.95 127.15 3h6f s ARG 224 Ca -0.08 0.52 -0.04 0.00 -0.52 0.00 0.00 55.73 55.61 3h6f s ARG 224 Cb -0.09 -3.25 0.12 0.00 0.52 0.00 0.00 34.95 32.26 3h6f s ARG 224 CO -0.09 0.63 0.27 0.42 0.02 0.00 0.00 175.30 176.54 3h6f s ILE 225 N -0.93 3.49 0.28 1.52 1.01 -0.84 -4.97 121.20 120.76 3h6f s ILE 225 Ca 0.26 -2.17 0.10 0.00 0.00 0.00 0.00 60.65 58.84 3h6f s ILE 225 Cb -0.17 -3.36 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 3h6f s ILE 225 CO 0.15 -0.74 -0.16 0.42 0.00 0.00 0.00 174.94 174.61 3h6f s THR 226 N 0.97 2.25 0.00 2.92 -4.23 -1.26 -4.34 115.64 111.94 3h6f s THR 226 Ca 0.09 -2.32 0.00 0.00 -1.18 0.00 0.00 61.69 58.29 3h6f s THR 226 Cb -0.23 -2.33 0.00 0.00 1.34 0.00 0.00 72.50 71.28 3h6f s THR 226 CO -0.04 -0.39 0.00 0.61 -0.54 0.00 0.00 174.62 174.27 3h6f n GLY 227 N -0.61 2.93 0.32 3.99 0.00 -1.26 -2.89 105.19 107.67 3h6f n GLY 227 Ca -0.06 0.29 0.02 0.00 0.00 0.00 0.00 46.02 46.28 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 0.78 0.56 1.61 0.87 -2.00 -2.37 113.55 112.99 3h6f h SER 228 Ca 0.00 0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.48 3h6f h SER 228 Cb 0.00 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 3h6f h SER 228 CO 0.00 0.47 -0.52 0.00 -0.53 0.00 0.00 176.83 176.25 3h6f h ALA 229 N 1.44 1.11 0.00 6.23 0.00 -1.93 -2.94 119.26 123.17 3h6f h ALA 229 Ca 0.40 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 3h6f h ALA 229 Cb 0.29 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3h6f h ALA 229 CO -0.21 0.65 -0.47 1.25 0.00 0.00 0.00 179.25 180.46 3h6f h LEU 230 N 0.00 0.00 -0.38 0.00 5.85 -1.48 -3.24 115.31 116.05 3h6f h LEU 230 Ca -0.01 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 3h6f h LEU 230 Cb 0.94 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 3h6f h LEU 230 CO 0.07 0.47 0.12 1.56 -0.34 0.00 0.00 178.44 180.32 3h6f h GLN 231 N 0.00 0.60 -0.30 1.25 1.08 -1.27 -2.73 115.11 113.74 3h6f h GLN 231 Ca -0.00 -0.13 0.00 0.00 -1.45 0.00 0.00 58.65 57.07 3h6f h GLN 231 Cb 1.22 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.56 3h6f h GLN 231 CO 0.06 0.60 0.00 0.00 -0.95 0.00 0.00 178.83 178.54 3h6f n ALA 232 N -2.32 2.23 0.13 3.87 0.00 -1.22 -2.38 120.51 120.82 3h6f n ALA 232 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 3h6f n ALA 232 Cb 0.17 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.61 3h6f n ALA 232 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h6f n LEU 233 N -0.27 0.13 0.00 0.00 4.32 -1.03 -5.08 117.00 115.08 3h6f n LEU 233 Ca 0.00 -0.46 0.00 0.00 -0.02 0.00 0.00 56.01 55.53 3h6f n LEU 233 Cb 0.07 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.87 3h6f n LEU 233 CO 0.00 0.03 0.11 0.00 -1.22 0.00 0.00 177.39 176.32