#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6f h PRO 9 N 0.00 0.38 0.00 4.33 0.11 -2.06 -2.01 132.00 132.76 3h6f h PRO 9 Ca 0.00 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 65.86 3h6f h PRO 9 Cb 0.00 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 30.99 3h6f h PRO 9 CO 0.00 0.25 -1.31 1.49 -0.21 0.00 0.00 178.00 178.22 3h6f h GLU 10 N 0.39 0.00 -0.15 1.05 4.81 -2.06 -3.13 114.58 115.49 3h6f h GLU 10 Ca 0.57 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.59 3h6f h GLU 10 Cb 1.44 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.83 3h6f h GLU 10 CO -0.26 0.61 -0.74 0.37 -0.73 0.00 0.00 179.01 178.26 3h6f h GLN 11 N 0.00 0.70 -0.61 1.92 5.75 -1.91 -2.93 115.11 118.03 3h6f h GLN 11 Ca -0.15 -0.56 -0.05 0.00 -0.15 0.00 0.00 58.65 57.74 3h6f h GLN 11 Cb 1.80 0.11 -0.03 0.00 1.07 0.00 0.00 27.48 30.43 3h6f h GLN 11 CO 0.09 1.18 0.19 0.00 -2.65 0.00 0.00 178.83 177.63 3h6f h ALA 12 N 0.67 0.80 -0.62 3.38 0.00 -1.48 -1.67 119.26 120.34 3h6f h ALA 12 Ca -0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 3h6f h ALA 12 Cb 1.35 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 3h6f h ALA 12 CO 0.15 0.47 0.26 0.52 0.00 0.00 0.00 179.25 180.64 3h6f h MET 13 N 0.87 0.90 0.08 0.00 2.86 -1.55 -1.84 114.93 116.25 3h6f h MET 13 Ca 0.20 -0.14 -0.28 0.00 -2.06 0.00 0.00 59.70 57.42 3h6f h MET 13 Cb 0.29 -0.16 0.03 0.00 0.06 0.00 0.00 31.60 31.81 3h6f h MET 13 CO -0.01 0.73 -1.14 -0.09 1.06 0.00 0.00 176.91 177.46 3h6f h ARG 14 N 0.89 0.64 -0.05 1.72 2.43 -1.31 -2.81 114.38 115.89 3h6f h ARG 14 Ca 0.21 -0.79 -0.12 0.00 -0.81 0.00 0.00 59.98 58.47 3h6f h ARG 14 Cb 0.16 0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 3h6f h ARG 14 CO -0.02 1.35 -0.51 0.93 -1.51 0.00 0.00 179.97 180.21 3h6f h GLU 15 N 0.28 0.14 -0.10 0.20 5.08 -1.21 -1.38 114.58 117.59 3h6f h GLU 15 Ca -0.16 -0.08 -0.17 0.00 -1.00 0.00 0.00 59.36 57.95 3h6f h GLU 15 Cb 1.81 0.01 0.01 0.00 0.50 0.00 0.00 28.75 31.07 3h6f h GLU 15 CO 0.22 0.62 -0.59 0.00 -1.00 0.00 0.00 179.01 178.26 3h6f h ARG 16 N 0.11 0.58 -0.10 2.33 3.08 -1.44 -1.93 114.38 117.02 3h6f h ARG 16 Ca 0.00 -0.49 -0.05 0.00 0.07 0.00 0.00 59.98 59.51 3h6f h ARG 16 Cb 0.94 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 3h6f h ARG 16 CO 0.07 1.11 -0.17 1.03 -1.07 0.00 0.00 179.97 180.95 3h6f h SER 17 N 0.21 0.15 0.13 7.04 0.87 -1.38 -2.15 113.55 118.42 3h6f h SER 17 Ca -0.04 -0.03 -0.29 0.00 -1.23 0.00 0.00 61.79 60.19 3h6f h SER 17 Cb 1.24 -0.04 0.03 0.00 -0.44 0.00 0.00 62.40 63.19 3h6f h SER 17 CO 0.12 0.33 -1.21 -0.08 -0.53 0.00 0.00 176.83 175.46 3h6f h GLU 18 N 0.15 0.60 -0.86 2.24 4.57 -1.20 -2.08 114.58 117.99 3h6f h GLU 18 Ca 0.03 -0.81 -0.00 0.00 -1.18 0.00 0.00 59.36 57.39 3h6f h GLU 18 Cb 0.39 0.27 -0.04 0.00 -0.16 0.00 0.00 28.75 29.21 3h6f h GLU 18 CO 0.03 1.37 0.52 1.25 -1.18 0.00 0.00 179.01 180.99 3h6f h LEU 19 N 0.21 1.03 0.01 1.64 6.46 -1.05 -1.28 115.31 122.33 3h6f h LEU 19 Ca -0.19 -0.06 -0.14 0.00 -0.12 0.00 0.00 57.88 57.37 3h6f h LEU 19 Cb 1.90 -0.26 0.01 0.00 -0.73 0.00 0.00 40.66 41.58 3h6f h LEU 19 CO 0.23 0.79 -0.56 0.00 -0.62 0.00 0.00 178.44 178.28 3h6f h ALA 20 N 1.39 0.06 -0.49 1.25 0.00 -1.45 -3.03 119.26 116.99 3h6f h ALA 20 Ca 0.31 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 3h6f h ALA 20 Cb -0.05 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3h6f h ALA 20 CO -0.06 0.31 0.22 -0.09 0.00 0.00 0.00 179.25 179.63 3h6f h ARG 21 N -0.19 0.69 -0.06 0.00 2.43 -1.16 -2.20 114.38 113.90 3h6f h ARG 21 Ca -0.07 -0.09 -0.17 0.00 -0.81 0.00 0.00 59.98 58.84 3h6f h ARG 21 Cb 1.29 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 3h6f h ARG 21 CO 0.11 0.56 -0.69 0.87 -1.51 0.00 0.00 179.97 179.30 3h6f h LYS 22 N 0.69 0.27 -0.06 0.20 1.57 -1.32 -1.74 116.57 116.18 3h6f h LYS 22 Ca 0.17 -0.21 -0.15 0.00 -1.87 0.00 0.00 60.65 58.59 3h6f h LYS 22 Cb 0.10 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 3h6f h LYS 22 CO -0.02 0.85 -0.62 0.78 -0.57 0.00 0.00 179.45 179.87 3h6f h GLY 23 N 1.52 0.25 1.49 3.86 0.00 -1.31 -2.46 103.07 106.41 3h6f h GLY 23 Ca -0.02 -0.31 -0.24 0.00 0.00 0.00 0.00 47.33 46.76 3h6f h GLY 23 CO 0.11 0.28 -1.00 -2.22 0.00 0.00 0.00 176.54 173.71 3h6f h ILE 24 N 0.17 1.39 0.00 2.60 2.04 -1.37 -3.20 117.51 119.13 3h6f h ILE 24 Ca -0.01 -2.47 -0.06 0.00 1.00 0.00 0.00 64.86 63.32 3h6f h ILE 24 Cb 1.13 2.48 -0.01 0.00 -0.74 0.00 0.00 36.82 39.67 3h6f h ILE 24 CO 0.09 0.74 -0.28 0.00 0.00 0.00 0.00 178.15 178.70 3h6f h ALA 25 N 0.65 1.34 0.00 1.87 0.00 -1.21 -1.21 119.26 120.70 3h6f h ALA 25 Ca -0.10 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3h6f h ALA 25 Cb 1.65 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.39 3h6f h ALA 25 CO 0.18 0.35 -0.28 0.54 0.00 0.00 0.00 179.25 180.04 3h6f n ARG 26 N -3.92 0.10 -3.08 0.00 1.74 -0.94 -3.90 116.66 106.66 3h6f n ARG 26 Ca -0.02 0.05 -0.23 0.00 -0.77 0.00 0.00 57.85 56.89 3h6f n ARG 26 Cb 0.36 -1.58 0.01 0.00 -1.02 0.00 0.00 32.46 30.22 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 -3.05 3.79 0.76 7.54 0.00 -1.05 -4.96 121.76 124.79 3h6f s ALA 27 Ca 0.11 -1.07 -0.12 0.00 0.00 0.00 0.00 51.96 50.89 3h6f s ALA 27 Cb 0.16 -2.10 0.05 0.00 0.00 0.00 0.00 23.12 21.24 3h6f s ALA 27 CO 0.63 -0.29 1.10 0.15 0.00 0.00 0.00 175.76 177.35 3h6f s LYS 28 N -4.49 2.23 0.25 0.00 1.02 -1.26 -1.96 119.74 115.53 3h6f s LYS 28 Ca 0.47 1.27 -0.09 0.00 0.02 0.00 0.00 55.97 57.64 3h6f s LYS 28 Cb -0.10 -1.89 -0.07 0.00 -0.52 0.00 0.00 37.83 35.26 3h6f s LYS 28 CO 0.37 -1.67 0.56 -1.12 -0.92 0.00 0.00 175.35 172.57 3h6f s SER 29 N -3.11 6.58 -0.02 2.83 0.01 -1.26 -4.25 113.70 114.48 3h6f s SER 29 Ca 0.63 0.89 0.01 0.00 1.31 0.00 0.00 55.95 58.80 3h6f s SER 29 Cb -0.19 -2.21 0.01 0.00 0.21 0.00 0.00 66.02 63.84 3h6f s SER 29 CO 0.53 -0.11 -0.05 -0.69 0.41 0.00 0.00 173.24 173.33 3h6f s VAL 30 N -1.89 0.43 0.03 3.43 1.01 -0.22 -2.03 120.40 121.16 3h6f s VAL 30 Ca 0.47 -0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.36 3h6f s VAL 30 Cb -0.11 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.83 3h6f s VAL 30 CO 0.23 0.16 -0.21 0.68 0.00 0.00 0.00 175.10 175.96 3h6f s VAL 31 N 0.33 1.72 -0.06 2.92 -7.23 -0.07 -1.07 120.40 116.93 3h6f s VAL 31 Ca -0.04 -1.16 0.01 0.00 -1.81 0.00 0.00 61.98 58.99 3h6f s VAL 31 Cb -0.07 -1.48 0.02 0.00 0.56 0.00 0.00 36.38 35.41 3h6f s VAL 31 CO -0.00 0.28 -0.06 0.00 -0.31 0.00 0.00 175.10 175.00 3h6f s ALA 32 N -0.73 0.90 0.00 1.32 0.00 -0.33 -1.29 121.76 121.63 3h6f s ALA 32 Ca 0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 51.96 51.80 3h6f s ALA 32 Cb -0.09 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 3h6f s ALA 32 CO 0.01 -0.07 0.06 -0.48 0.00 0.00 0.00 175.76 175.29 3h6f s LEU 33 N 1.04 1.84 0.57 0.00 2.34 -0.66 -0.63 118.68 123.18 3h6f s LEU 33 Ca -0.09 -0.27 -0.18 0.00 0.06 0.00 0.00 54.13 53.65 3h6f s LEU 33 Cb -0.14 0.40 -0.04 0.00 -0.56 0.00 0.00 46.19 45.84 3h6f s LEU 33 CO -0.00 -0.30 1.11 0.00 -1.06 0.00 0.00 176.35 176.10 3h6f s ALA 34 N -1.23 2.66 0.33 1.48 0.00 -0.70 -1.37 121.76 122.94 3h6f s ALA 34 Ca -0.13 0.69 -0.17 0.00 0.00 0.00 0.00 51.96 52.35 3h6f s ALA 34 Cb -0.08 -3.33 0.03 0.00 0.00 0.00 0.00 23.12 19.75 3h6f s ALA 34 CO 0.00 -0.85 0.72 1.52 0.00 0.00 0.00 175.76 177.15 3h6f s TYR 35 N -2.00 0.06 0.31 0.00 -0.85 -0.15 -4.88 117.35 109.84 3h6f s TYR 35 Ca 0.70 -0.59 0.00 0.00 -0.52 0.00 0.00 57.07 56.66 3h6f s TYR 35 Cb -0.21 0.68 0.53 0.00 0.38 0.00 0.00 41.96 43.34 3h6f s TYR 35 CO 0.31 -1.36 1.95 0.00 -1.52 0.00 0.00 175.55 174.92 3h6f h ALA 36 N 2.03 1.50 -0.01 9.51 0.00 -1.43 -2.57 119.26 128.28 3h6f h ALA 36 Ca -0.26 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3h6f h ALA 36 Cb 1.25 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3h6f h ALA 36 CO 0.33 0.41 -0.01 0.41 0.00 0.00 0.00 179.25 180.39 3h6f n GLY 37 N -1.41 -0.16 0.00 0.00 0.00 -1.26 -5.02 105.19 97.34 3h6f n GLY 37 Ca 0.11 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3h6f n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6f n GLY 38 N 1.16 0.51 3.48 -0.02 0.00 -0.97 -1.89 105.19 107.46 3h6f n GLY 38 Ca 0.19 -1.18 -0.30 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.66 2.84 -0.06 1.61 1.01 -1.08 -0.97 120.40 121.08 3h6f s VAL 39 Ca 0.00 -1.40 0.05 0.00 0.00 0.00 0.00 61.98 60.63 3h6f s VAL 39 Cb 0.00 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 3h6f s VAL 39 CO 0.00 0.18 -0.23 -0.22 0.00 0.00 0.00 175.10 174.83 3h6f s LEU 40 N -1.92 2.02 -0.15 3.92 2.96 -0.47 -1.44 118.68 123.61 3h6f s LEU 40 Ca 0.17 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 3h6f s LEU 40 Cb -0.11 -1.27 0.00 0.00 0.50 0.00 0.00 46.19 45.32 3h6f s LEU 40 CO 0.09 0.20 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.77 3h6f s PHE 41 N 0.02 2.72 -0.07 5.38 0.08 0.45 -1.66 117.98 124.90 3h6f s PHE 41 Ca -0.07 -1.21 0.01 0.00 0.12 0.00 0.00 56.93 55.78 3h6f s PHE 41 Cb -0.14 -1.85 0.02 0.00 -0.57 0.00 0.00 43.02 40.48 3h6f s PHE 41 CO 0.04 -0.55 -0.07 0.08 -0.10 0.00 0.00 175.22 174.62 3h6f s VAL 42 N 0.83 0.86 0.03 -0.44 1.01 -0.41 -1.62 120.40 120.66 3h6f s VAL 42 Ca -0.06 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.69 3h6f s VAL 42 Cb -0.15 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 3h6f s VAL 42 CO -0.01 0.31 -0.09 0.00 0.00 0.00 0.00 175.10 175.31 3h6f s ALA 43 N 1.17 0.70 -0.61 5.51 0.00 -0.68 -0.89 121.76 126.96 3h6f s ALA 43 Ca -0.06 -0.67 -0.24 0.00 0.00 0.00 0.00 51.96 50.98 3h6f s ALA 43 Cb -0.14 -0.05 0.05 0.00 0.00 0.00 0.00 23.12 22.98 3h6f s ALA 43 CO -0.02 0.07 1.01 -2.00 0.00 0.00 0.00 175.76 174.82 3h6f s GLU 44 N -1.17 3.27 -0.22 0.00 2.12 -0.86 -1.54 118.70 120.29 3h6f s GLU 44 Ca -0.04 -0.38 -0.04 0.00 0.36 0.00 0.00 54.97 54.87 3h6f s GLU 44 Cb -0.08 -4.11 0.10 0.00 0.26 0.00 0.00 34.13 30.29 3h6f s GLU 44 CO 0.01 -1.67 0.21 1.21 -0.54 0.00 0.00 175.26 174.47 3h6f s ASN 45 N 3.19 1.77 0.42 -1.70 2.47 0.19 -4.65 114.94 116.62 3h6f s ASN 45 Ca 0.29 -0.46 0.22 0.00 0.42 0.00 0.00 52.86 53.33 3h6f s ASN 45 Cb -0.13 0.24 0.82 0.00 -1.45 0.00 0.00 41.25 40.74 3h6f s ASN 45 CO 0.17 -0.35 1.79 1.55 -3.72 0.00 0.00 177.10 176.53 3h6f h PRO 46 N 8.33 0.00 -6.88 0.43 0.13 -1.79 -3.32 132.00 128.89 3h6f h PRO 46 Ca -0.17 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.46 3h6f h PRO 46 Cb 1.13 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.29 3h6f h PRO 46 CO 0.31 0.27 0.51 0.45 -0.23 0.00 0.00 178.00 179.30 3h6f s SER 47 N -6.27 6.86 -0.00 1.44 0.15 -1.26 -4.82 113.70 109.80 3h6f s SER 47 Ca 0.01 2.34 0.22 0.00 0.70 0.00 0.00 55.95 59.22 3h6f s SER 47 Cb 0.10 -2.62 -0.16 0.00 -1.71 0.00 0.00 66.02 61.63 3h6f s SER 47 CO 0.65 -0.44 0.91 -1.14 1.20 0.00 0.00 173.24 174.42 3h6f n ARG 48 N 0.59 0.09 -0.09 5.44 0.63 -1.26 -4.62 116.66 117.44 3h6f n ARG 48 Ca 0.02 -0.02 -0.18 0.00 -0.92 0.00 0.00 57.85 56.74 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 -1.61 1.71 -4.57 6.15 7.64 -1.26 -4.93 113.62 116.75 3h6f n SER 49 Ca 0.03 0.14 -0.42 0.00 1.01 0.00 0.00 58.87 59.63 3h6f n SER 49 Cb 0.36 -0.48 -0.03 0.00 -1.01 0.00 0.00 64.21 63.05 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 -6.75 3.44 0.16 -3.43 1.43 -1.26 -5.02 118.68 107.24 3h6f s LEU 50 Ca -0.26 -0.09 -0.27 0.00 -1.03 0.00 0.00 54.13 52.48 3h6f s LEU 50 Cb 0.09 -2.97 -0.08 0.00 0.03 0.00 0.00 46.19 43.26 3h6f s LEU 50 CO 0.36 -1.56 0.84 -1.10 0.23 0.00 0.00 176.35 175.13 3h6f s GLN 51 N 5.07 4.65 -0.01 1.70 -1.52 -1.26 -4.85 119.66 123.44 3h6f s GLN 51 Ca 0.40 1.27 0.13 0.00 -1.95 0.00 0.00 55.36 55.20 3h6f s GLN 51 Cb -0.08 -3.30 -0.18 0.00 -0.22 0.00 0.00 33.01 29.23 3h6f s GLN 51 CO 0.22 0.46 0.32 1.63 -0.25 0.00 0.00 175.29 177.68 3h6f n LYS 52 N 1.92 0.88 -5.25 2.91 5.02 -1.26 -4.97 118.16 117.40 3h6f n LYS 52 Ca -0.03 -0.09 -0.31 0.00 -2.02 0.00 0.00 58.31 55.85 3h6f n LYS 52 Cb 0.49 -1.26 -0.16 0.00 -0.02 0.00 0.00 35.03 34.08 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 -2.74 2.18 0.18 -0.18 1.01 -1.26 -1.51 121.20 118.87 3h6f s ILE 53 Ca -0.03 -1.06 -0.20 0.00 0.00 0.00 0.00 60.65 59.36 3h6f s ILE 53 Cb 0.08 -1.77 0.05 0.00 0.01 0.00 0.00 42.46 40.84 3h6f s ILE 53 CO 0.52 0.58 0.56 -0.55 0.00 0.00 0.00 174.94 176.05 3h6f s SER 54 N -0.60 -0.40 0.22 3.58 0.15 0.13 -4.99 113.70 111.78 3h6f s SER 54 Ca 0.10 -0.24 -0.29 0.00 0.70 0.00 0.00 55.95 56.21 3h6f s SER 54 Cb -0.10 0.59 -0.09 0.00 -1.71 0.00 0.00 66.02 64.71 3h6f s SER 54 CO -0.01 -1.01 0.92 -0.70 1.20 0.00 0.00 173.24 173.64 3h6f s GLU 55 N -3.81 4.81 -0.14 5.44 2.12 -1.26 -0.24 118.70 125.62 3h6f s GLU 55 Ca 0.04 1.44 -0.08 0.00 0.36 0.00 0.00 54.97 56.74 3h6f s GLU 55 Cb -0.01 -3.28 -0.06 0.00 0.26 0.00 0.00 34.13 31.04 3h6f s GLU 55 CO -0.08 0.51 -0.19 1.28 -0.54 0.00 0.00 175.26 176.24 3h6f n LEU 56 N 1.56 1.11 0.00 2.70 4.77 -0.63 -4.83 117.00 121.67 3h6f n LEU 56 Ca -0.02 0.19 -0.03 0.00 -0.03 0.00 0.00 56.01 56.11 3h6f n LEU 56 Cb 0.47 -0.45 -0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3h6f n LEU 56 CO 0.49 0.22 0.05 0.00 -1.33 0.00 0.00 177.39 176.82 3h6f n TYR 57 N -3.71 -0.78 -0.26 -1.77 9.36 -1.07 -4.73 117.16 114.19 3h6f n TYR 57 Ca -0.27 -0.52 -0.07 0.00 3.32 0.00 0.00 57.90 60.36 3h6f n TYR 57 Cb 0.66 0.14 -0.06 0.00 -0.63 0.00 0.00 39.34 39.45 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 -1.86 -0.66 -0.73 2.98 8.00 -1.26 -2.53 116.55 120.49 3h6f n ASP 58 Ca -0.00 1.47 0.07 0.00 0.71 0.00 0.00 54.79 57.04 3h6f n ASP 58 Cb 0.13 -0.33 0.19 0.00 -0.02 0.00 0.00 41.12 41.10 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 -4.41 2.91 -4.87 -1.24 5.12 -1.26 -1.19 116.66 111.72 3h6f n ARG 59 Ca 0.01 -2.33 -0.33 0.00 -1.93 0.00 0.00 57.85 53.28 3h6f n ARG 59 Cb 0.16 -1.47 -0.14 0.00 -1.16 0.00 0.00 32.46 29.85 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 -1.64 2.95 0.29 1.55 1.01 -1.05 -2.08 120.40 121.43 3h6f s VAL 60 Ca 0.30 -0.72 0.11 0.00 0.00 0.00 0.00 61.98 61.66 3h6f s VAL 60 Cb 0.20 -2.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 3h6f s VAL 60 CO 0.13 0.55 -0.14 -0.83 0.00 0.00 0.00 175.10 174.82 3h6f s GLY 61 N -0.07 1.92 0.03 4.51 0.00 0.44 -1.61 107.32 112.55 3h6f s GLY 61 Ca -0.03 -1.89 0.04 0.00 0.00 0.00 0.00 44.72 42.85 3h6f s GLY 61 CO 0.04 -1.94 -0.13 -0.12 0.00 0.00 0.00 173.10 170.95 3h6f s PHE 62 N -2.50 1.15 -0.17 1.90 5.36 0.67 -1.61 117.98 122.77 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 -0.04 -0.69 0.05 0.00 -0.34 0.00 0.00 43.02 42.00 3h6f s PHE 62 CO 0.16 0.02 0.45 0.00 -1.46 0.00 0.00 175.22 174.39 3h6f s ALA 63 N -0.82 -1.12 0.07 11.12 0.00 -0.48 -0.69 121.76 129.84 3h6f s ALA 63 Ca 0.01 1.36 -0.06 0.00 0.00 0.00 0.00 51.96 53.27 3h6f s ALA 63 Cb -0.08 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.23 3h6f s ALA 63 CO 0.01 -0.23 0.12 0.00 0.00 0.00 0.00 175.76 175.66 3h6f s ALA 64 N 0.54 -0.00 -0.00 0.00 0.00 -0.57 -0.05 121.76 121.67 3h6f s ALA 64 Ca -0.02 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.17 3h6f s ALA 64 Cb -0.04 0.40 -0.00 0.00 0.00 0.00 0.00 23.12 23.48 3h6f s ALA 64 CO -0.03 -0.45 -0.04 0.00 0.00 0.00 0.00 175.76 175.23 3h6f s ALA 65 N -3.78 0.34 0.00 0.00 0.00 -0.59 -4.84 121.76 112.89 3h6f s ALA 65 Ca 0.05 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 51.84 3h6f s ALA 65 Cb 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.08 3h6f s ALA 65 CO -0.10 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.15 3h6f n GLY 66 N 3.01 0.62 3.67 0.00 0.00 -1.26 -1.27 105.19 109.95 3h6f n GLY 66 Ca -0.13 -1.60 -0.43 0.00 0.00 0.00 0.00 46.02 43.87 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 -1.74 4.29 0.12 1.61 2.20 -0.59 -4.90 119.74 120.72 3h6f s LYS 67 Ca 0.00 1.46 -0.32 0.00 -0.36 0.00 0.00 55.97 56.76 3h6f s LYS 67 Cb 0.00 -3.65 -0.10 0.00 -1.51 0.00 0.00 37.83 32.57 3h6f s LYS 67 CO 0.00 -0.58 1.57 0.35 -0.36 0.00 0.00 175.35 176.33 3h6f h PHE 68 N 7.58 -1.34 -0.67 4.03 3.57 -1.96 -2.49 116.94 125.65 3h6f h PHE 68 Ca -0.24 0.04 0.19 0.00 3.53 0.00 0.00 57.97 61.50 3h6f h PHE 68 Cb 1.09 0.59 -0.03 0.00 2.79 0.00 0.00 35.95 40.39 3h6f h PHE 68 CO 0.75 -0.53 0.52 -2.95 -2.23 0.00 0.00 178.31 173.88 3h6f h ASN 69 N -0.62 0.00 0.13 0.41 7.08 -1.99 -0.30 115.58 120.28 3h6f h ASN 69 Ca 0.03 0.00 -0.18 0.00 -3.08 0.00 0.00 56.30 53.08 3h6f h ASN 69 Cb 0.69 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 36.95 3h6f h ASN 69 CO -0.33 0.00 -0.79 -0.33 -2.08 0.00 0.00 177.43 173.89 3h6f h GLU 70 N 0.00 0.27 0.00 4.14 5.08 -1.88 -3.09 114.58 119.11 3h6f h GLU 70 Ca 0.32 -0.47 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 3h6f h GLU 70 Cb 1.36 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.78 3h6f h GLU 70 CO -0.00 1.22 -0.15 0.27 -1.00 0.00 0.00 179.01 179.35 3h6f h PHE 71 N -0.42 0.00 -0.11 4.33 -5.15 -0.97 -2.99 116.94 111.63 3h6f h PHE 71 Ca -0.14 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.46 3h6f h PHE 71 Cb 1.60 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.76 3h6f h PHE 71 CO 0.20 0.15 -0.62 0.22 -2.00 0.00 0.00 178.31 176.25 3h6f h ASP 72 N 0.00 0.47 -0.42 -0.68 3.58 -1.20 -0.76 116.42 117.41 3h6f h ASP 72 Ca -0.00 -0.27 -0.05 0.00 0.42 0.00 0.00 57.03 57.13 3h6f h ASP 72 Cb 1.11 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 42.00 3h6f h ASP 72 CO 0.02 0.97 0.11 -1.13 -2.88 0.00 0.00 179.24 176.33 3h6f h ASN 73 N 0.30 0.68 0.81 2.28 -1.24 -1.48 -0.63 115.58 116.30 3h6f h ASN 73 Ca -0.01 -0.12 -0.19 0.00 0.71 0.00 0.00 56.30 56.70 3h6f h ASN 73 Cb 1.16 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 40.01 3h6f h ASN 73 CO 0.11 0.69 -0.87 -0.07 -1.29 0.00 0.00 177.43 175.99 3h6f h LEU 74 N 0.71 0.05 -0.26 0.34 3.38 -1.36 -1.69 115.31 116.48 3h6f h LEU 74 Ca 0.16 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 3h6f h LEU 74 Cb 0.28 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3h6f h LEU 74 CO -0.00 0.90 -0.09 -0.09 0.09 0.00 0.00 178.44 179.24 3h6f h ARG 75 N 0.02 0.53 -0.32 1.13 2.43 -0.55 -1.35 114.38 116.27 3h6f h ARG 75 Ca -0.02 -0.22 -0.02 0.00 -0.81 0.00 0.00 59.98 58.92 3h6f h ARG 75 Cb 1.53 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 31.04 3h6f h ARG 75 CO 0.12 0.76 0.14 0.00 -1.51 0.00 0.00 179.97 179.48 3h6f h ARG 76 N 0.27 0.47 -0.02 0.20 3.08 -1.11 -1.56 114.38 115.71 3h6f h ARG 76 Ca 0.06 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 59.98 3h6f h ARG 76 Cb 0.59 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 3h6f h ARG 76 CO 0.03 0.46 -0.26 0.78 -1.07 0.00 0.00 179.97 179.91 3h6f h GLY 77 N 0.38 0.04 1.38 0.04 0.00 -1.30 -1.06 103.07 102.55 3h6f h GLY 77 Ca 0.11 -0.03 -0.22 0.00 0.00 0.00 0.00 47.33 47.19 3h6f h GLY 77 CO -0.01 0.03 -0.83 -1.33 0.00 0.00 0.00 176.54 174.40 3h6f h GLY 78 N 0.83 0.66 1.53 4.60 0.00 -0.86 -1.79 103.07 108.04 3h6f h GLY 78 Ca 0.00 -0.99 -0.12 0.00 0.00 0.00 0.00 47.33 46.22 3h6f h GLY 78 CO 0.03 0.88 -0.35 -2.22 0.00 0.00 0.00 176.54 174.88 3h6f h ILE 79 N 0.38 1.29 -0.13 2.60 2.04 -0.91 -0.78 117.51 122.01 3h6f h ILE 79 Ca -0.06 -1.48 -0.00 0.00 1.00 0.00 0.00 64.86 64.32 3h6f h ILE 79 Cb 1.44 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 39.01 3h6f h ILE 79 CO 0.16 0.47 0.07 -0.61 0.00 0.00 0.00 178.15 178.23 3h6f h GLN 80 N 0.44 0.17 0.05 2.37 5.75 -1.11 -1.56 115.11 121.24 3h6f h GLN 80 Ca 0.05 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 3h6f h GLN 80 Cb 0.83 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.34 3h6f h GLN 80 CO 0.07 0.17 -0.03 0.35 -2.65 0.00 0.00 178.83 176.75 3h6f h PHE 81 N 0.13 -0.07 -0.99 3.99 3.57 -1.16 -2.68 116.94 119.73 3h6f h PHE 81 Ca 0.05 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.60 3h6f h PHE 81 Cb 0.05 0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.75 3h6f h PHE 81 CO -0.05 0.23 0.64 0.00 -2.23 0.00 0.00 178.31 176.90 3h6f h ALA 82 N 0.57 1.35 -0.09 2.41 0.00 -1.02 -1.37 119.26 121.09 3h6f h ALA 82 Ca -0.01 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 3h6f h ALA 82 Cb 0.32 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3h6f h ALA 82 CO 0.01 0.48 -0.64 -0.44 0.00 0.00 0.00 179.25 178.66 3h6f h ASP 83 N 1.20 0.40 -0.34 0.00 3.32 -1.26 -1.81 116.42 117.93 3h6f h ASP 83 Ca 0.41 -0.24 -0.14 0.00 0.02 0.00 0.00 57.03 57.08 3h6f h ASP 83 Cb 0.09 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 3h6f h ASP 83 CO -0.15 0.94 -0.32 0.74 -1.72 0.00 0.00 179.24 178.72 3h6f h THR 84 N 0.25 1.29 -0.33 0.35 2.02 -1.20 -2.30 112.91 112.99 3h6f h THR 84 Ca -0.01 -1.49 -0.10 0.00 0.77 0.00 0.00 66.41 65.58 3h6f h THR 84 Cb 1.18 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 69.06 3h6f h THR 84 CO 0.11 0.49 -0.17 0.03 0.37 0.00 0.00 175.52 176.35 3h6f h ARG 85 N 0.60 0.70 -0.05 6.66 2.47 -1.20 -0.26 114.38 123.30 3h6f h ARG 85 Ca 0.06 -0.31 -0.07 0.00 -1.26 0.00 0.00 59.98 58.40 3h6f h ARG 85 Cb 0.91 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.20 3h6f h ARG 85 CO 0.08 0.91 -0.28 0.78 0.56 0.00 0.00 179.97 182.02 3h6f h GLY 86 N 0.47 0.09 1.10 0.04 0.00 -1.32 0.40 103.07 103.85 3h6f h GLY 86 Ca 0.07 -0.07 -0.29 0.00 0.00 0.00 0.00 47.33 47.05 3h6f h GLY 86 CO 0.05 0.06 -1.25 -1.82 0.00 0.00 0.00 176.54 173.58 3h6f h TYR 87 N 0.08 0.88 0.00 5.60 3.20 -1.20 -3.22 116.97 122.30 3h6f h TYR 87 Ca 0.01 -0.62 -0.09 0.00 3.14 0.00 0.00 58.73 61.17 3h6f h TYR 87 Cb 0.54 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 3h6f h TYR 87 CO 0.00 1.48 -0.43 0.00 -1.64 0.00 0.00 178.16 177.57 3h6f h ALA 88 N 0.16 0.87 -3.00 1.82 0.00 -0.83 -3.44 119.26 114.85 3h6f h ALA 88 Ca -0.21 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.31 3h6f h ALA 88 Cb 1.97 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.70 3h6f h ALA 88 CO 0.24 0.53 0.00 0.66 0.00 0.00 0.00 179.25 180.68 3h6f n TYR 89 N -3.42 0.00 -4.10 0.00 4.01 0.11 -5.08 117.16 108.68 3h6f n TYR 89 Ca 0.00 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 -0.09 0.00 -0.31 0.00 0.00 39.34 39.53 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 0.22 0.47 7.72 1.47 -1.22 -4.96 116.67 121.37 3h6f s ASP 90 Ca 0.00 -1.14 0.22 0.00 1.18 0.00 0.00 52.55 52.81 3h6f s ASP 90 Cb 0.00 0.34 1.19 0.00 -0.34 0.00 0.00 42.92 44.12 3h6f s ASP 90 CO 0.00 -0.79 2.00 0.03 0.68 0.00 0.00 175.17 177.09 3h6f h ARG 91 N 2.75 0.00 0.00 2.11 3.08 -1.90 -2.56 114.38 117.87 3h6f h ARG 91 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.71 3h6f h ARG 91 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3h6f h ARG 91 CO 0.55 0.18 0.00 -2.13 -1.07 0.00 0.00 179.97 177.51 3h6f n ARG 92 N -3.85 0.04 0.06 0.04 0.63 -1.26 -3.05 116.66 109.27 3h6f n ARG 92 Ca -0.02 0.15 -0.03 0.00 -0.92 0.00 0.00 57.85 57.04 3h6f n ARG 92 Cb 0.28 -1.56 0.22 0.00 0.45 0.00 0.00 32.46 31.85 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 0.35 -3.42 6.15 3.58 -1.82 -3.40 116.42 117.86 3h6f h ASP 93 Ca 0.00 -0.13 -0.56 0.00 0.42 0.00 0.00 57.03 56.76 3h6f h ASP 93 Cb 0.41 -0.10 -0.07 0.00 1.72 0.00 0.00 39.33 41.30 3h6f h ASP 93 CO 0.00 0.67 0.98 -0.69 -2.88 0.00 0.00 179.24 177.32 3h6f s VAL 94 N -4.32 4.06 0.35 2.25 1.01 -1.17 -4.91 120.40 117.67 3h6f s VAL 94 Ca -0.06 1.04 0.07 0.00 0.00 0.00 0.00 61.98 63.03 3h6f s VAL 94 Cb 0.14 -4.57 -0.07 0.00 0.00 0.00 0.00 36.38 31.88 3h6f s VAL 94 CO 0.78 -1.09 -0.02 0.42 0.00 0.00 0.00 175.10 175.19 3h6f s THR 95 N 4.90 1.79 0.18 3.92 -4.23 -1.26 -4.93 115.64 116.01 3h6f s THR 95 Ca 0.49 -2.07 -0.09 0.00 -1.18 0.00 0.00 61.69 58.83 3h6f s THR 95 Cb -0.08 -2.76 0.07 0.00 1.34 0.00 0.00 72.50 71.07 3h6f s THR 95 CO 0.30 -0.11 1.65 1.23 -0.54 0.00 0.00 174.62 177.15 3h6f h GLY 96 N 2.01 1.15 0.89 3.99 0.00 -1.93 -2.51 103.07 106.67 3h6f h GLY 96 Ca -0.42 -0.82 0.03 0.00 0.00 0.00 0.00 47.33 46.13 3h6f h GLY 96 CO 0.73 0.75 0.58 -0.09 0.00 0.00 0.00 176.54 178.52 3h6f h ARG 97 N 0.97 1.10 -0.13 4.80 2.43 -1.96 -0.55 114.38 121.04 3h6f h ARG 97 Ca 0.18 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 3h6f h ARG 97 Cb 0.51 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 3h6f h ARG 97 CO 0.02 0.73 0.02 0.37 -1.51 0.00 0.00 179.97 179.60 3h6f h GLN 98 N 1.14 0.22 -0.20 0.20 4.15 -1.86 -1.58 115.11 117.18 3h6f h GLN 98 Ca 0.36 -0.06 -0.10 0.00 0.77 0.00 0.00 58.65 59.61 3h6f h GLN 98 Cb -0.01 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 3h6f h GLN 98 CO -0.11 0.43 -0.32 -0.07 -1.93 0.00 0.00 178.83 176.82 3h6f h LEU 99 N -0.01 0.41 -0.48 -2.39 3.38 -1.20 -2.33 115.31 112.69 3h6f h LEU 99 Ca 0.04 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 3h6f h LEU 99 Cb 0.32 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3h6f h LEU 99 CO 0.00 0.72 -0.17 0.00 0.09 0.00 0.00 178.44 179.09 3h6f h ALA 100 N 1.31 0.67 -0.72 1.53 0.00 -1.02 -1.54 119.26 119.48 3h6f h ALA 100 Ca 0.04 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 3h6f h ALA 100 Cb 0.74 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3h6f h ALA 100 CO 0.06 0.62 0.29 -0.97 0.00 0.00 0.00 179.25 179.25 3h6f h ASN 101 N 0.81 0.99 -0.12 0.00 -0.73 -1.10 -0.84 115.58 114.59 3h6f h ASN 101 Ca 0.12 -0.17 -0.13 0.00 1.87 0.00 0.00 56.30 57.99 3h6f h ASN 101 Cb 0.74 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 39.06 3h6f h ASN 101 CO 0.06 0.89 -0.36 0.58 -0.37 0.00 0.00 177.43 178.23 3h6f h VAL 102 N 1.03 1.29 -0.19 2.57 2.07 -1.23 -1.49 116.25 120.29 3h6f h VAL 102 Ca 0.24 -1.51 -0.16 0.00 0.82 0.00 0.00 66.70 66.09 3h6f h VAL 102 Cb 0.21 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3h6f h VAL 102 CO -0.02 0.48 -0.55 1.88 0.02 0.00 0.00 177.57 179.39 3h6f h TYR 103 N 0.53 0.72 -0.73 1.57 0.05 -0.99 -1.37 116.97 116.74 3h6f h TYR 103 Ca 0.05 -0.25 -0.06 0.00 0.05 0.00 0.00 58.73 58.52 3h6f h TYR 103 Cb 0.87 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 38.44 3h6f h TYR 103 CO 0.04 0.99 0.22 0.00 -1.05 0.00 0.00 178.16 178.36 3h6f h ALA 104 N 0.96 0.96 -0.32 3.88 0.00 -0.98 0.26 119.26 124.02 3h6f h ALA 104 Ca 0.01 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 3h6f h ALA 104 Cb 1.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3h6f h ALA 104 CO 0.10 0.65 -0.04 0.37 0.00 0.00 0.00 179.25 180.34 3h6f h GLN 105 N 1.09 0.58 -0.10 0.00 5.75 -1.15 -1.69 115.11 119.59 3h6f h GLN 105 Ca 0.23 -0.21 -0.03 0.00 -0.15 0.00 0.00 58.65 58.50 3h6f h GLN 105 Cb 0.32 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 28.83 3h6f h GLN 105 CO -0.01 0.74 -0.04 1.15 -2.65 0.00 0.00 178.83 178.03 3h6f h THR 106 N 0.37 1.31 -0.48 2.39 2.02 -0.94 -2.38 112.91 115.20 3h6f h THR 106 Ca 0.09 -1.03 -0.09 0.00 0.77 0.00 0.00 66.41 66.15 3h6f h THR 106 Cb 0.50 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 3h6f h THR 106 CO 0.02 0.29 -0.05 -0.07 0.37 0.00 0.00 175.52 176.08 3h6f h LEU 107 N -0.15 0.80 -1.00 2.58 3.38 -1.00 -1.72 115.31 118.21 3h6f h LEU 107 Ca 0.02 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 3h6f h LEU 107 Cb 0.48 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3h6f h LEU 107 CO 0.01 0.90 0.28 1.23 0.09 0.00 0.00 178.44 180.96 3h6f h GLY 108 N 0.98 1.07 1.39 0.83 0.00 -1.29 -0.29 103.07 105.76 3h6f h GLY 108 Ca 0.14 -0.55 -0.19 0.00 0.00 0.00 0.00 47.33 46.73 3h6f h GLY 108 CO 0.03 0.52 -0.66 -0.84 0.00 0.00 0.00 176.54 175.60 3h6f h THR 109 N 0.98 1.32 -0.32 4.70 2.02 -1.20 -2.75 112.91 117.66 3h6f h THR 109 Ca 0.23 -1.93 -0.07 0.00 0.77 0.00 0.00 66.41 65.42 3h6f h THR 109 Cb 0.17 1.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 3h6f h THR 109 CO -0.02 0.60 -0.06 0.40 0.37 0.00 0.00 175.52 176.80 3h6f h ILE 110 N 0.45 1.28 -0.92 3.11 2.04 -0.90 0.10 117.51 122.66 3h6f h ILE 110 Ca -0.02 -1.09 0.01 0.00 1.00 0.00 0.00 64.86 64.76 3h6f h ILE 110 Cb 1.24 1.34 -0.05 0.00 -0.74 0.00 0.00 36.82 38.61 3h6f h ILE 110 CO 0.13 0.35 0.61 0.15 0.00 0.00 0.00 178.15 179.39 3h6f h PHE 111 N 0.38 1.17 0.00 1.37 3.57 -1.07 -1.82 116.94 120.54 3h6f h PHE 111 Ca 0.08 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.47 3h6f h PHE 111 Cb 0.55 -0.39 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 3h6f h PHE 111 CO 0.05 0.74 -0.81 1.15 -2.23 0.00 0.00 178.31 177.20 3h6f h THR 112 N 1.26 0.96 0.19 4.41 2.02 -1.45 -3.44 112.91 116.86 3h6f h THR 112 Ca 0.34 -2.01 -0.35 0.00 0.77 0.00 0.00 66.41 65.15 3h6f h THR 112 Cb -0.14 2.10 0.01 0.00 -1.74 0.00 0.00 68.15 68.39 3h6f h THR 112 CO -0.07 0.32 -1.74 -0.33 0.37 0.00 0.00 175.52 174.07 3h6f h GLU 113 N -1.00 0.40 -7.12 6.66 3.07 -0.84 -3.48 114.58 112.27 3h6f h GLU 113 Ca -0.21 -0.69 -0.46 0.00 -0.50 0.00 0.00 59.36 57.50 3h6f h GLU 113 Cb 1.07 0.26 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 3h6f h GLU 113 CO -0.13 1.33 0.36 -0.65 -1.40 0.00 0.00 179.01 178.52 3h6f s GLN 114 N -2.58 4.04 0.26 2.33 -0.21 -0.68 -4.99 119.66 117.82 3h6f s GLN 114 Ca -0.16 1.07 -0.02 0.00 0.02 0.00 0.00 55.36 56.27 3h6f s GLN 114 Cb 0.05 -2.15 0.47 0.00 1.00 0.00 0.00 33.01 32.39 3h6f s GLN 114 CO 0.86 -0.20 1.79 0.00 -2.12 0.00 0.00 175.29 175.62 3h6f h ALA 115 N 1.40 1.25 -3.33 6.09 0.00 -1.92 -3.40 119.26 119.34 3h6f h ALA 115 Ca -0.48 0.06 -0.54 0.00 0.00 0.00 0.00 54.91 53.95 3h6f h ALA 115 Cb 1.19 -0.08 -0.34 0.00 0.00 0.00 0.00 17.79 18.55 3h6f h ALA 115 CO 0.61 0.02 -0.82 0.21 0.00 0.00 0.00 179.25 179.27 3h6f s LYS 116 N -6.00 1.83 0.97 0.00 2.20 -1.26 -5.14 119.74 112.34 3h6f s LYS 116 Ca -0.12 -0.43 -0.12 0.00 -0.36 0.00 0.00 55.97 54.94 3h6f s LYS 116 Cb 0.21 -1.59 0.17 0.00 -1.51 0.00 0.00 37.83 35.11 3h6f s LYS 116 CO 0.78 -0.05 1.09 -1.25 -0.36 0.00 0.00 175.35 175.56 3h6f s PRO 117 N 0.94 0.67 -0.14 4.03 0.04 -1.26 -4.90 135.00 134.37 3h6f s PRO 117 Ca -0.09 0.72 -0.24 0.00 0.04 0.00 0.00 61.00 61.43 3h6f s PRO 117 Cb -0.15 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 3h6f s PRO 117 CO 0.00 -2.62 0.78 0.71 0.04 0.00 0.00 177.00 175.91 3h6f s TYR 118 N -2.89 3.46 -1.46 0.56 1.51 -1.26 -4.96 117.35 112.31 3h6f s TYR 118 Ca 0.65 1.22 -0.11 0.00 -1.01 0.00 0.00 57.07 57.82 3h6f s TYR 118 Cb -0.19 -2.94 0.03 0.00 -0.11 0.00 0.00 41.96 38.75 3h6f s TYR 118 CO 0.58 -0.15 2.43 0.39 -1.11 0.00 0.00 175.55 177.69 3h6f n GLU 119 N 4.83 3.51 -4.08 -0.62 1.02 -1.26 -4.71 120.64 119.33 3h6f n GLU 119 Ca 0.02 -2.75 -0.07 0.00 -0.02 0.00 0.00 57.16 54.34 3h6f n GLU 119 Cb 0.50 -2.97 -0.10 0.00 -0.02 0.00 0.00 31.44 28.84 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 1.76 0.21 -0.03 2.62 -7.23 -1.26 -1.54 120.40 114.92 3h6f s VAL 120 Ca 0.54 -1.76 -0.01 0.00 -1.81 0.00 0.00 61.98 58.94 3h6f s VAL 120 Cb 0.15 -1.46 0.03 0.00 0.56 0.00 0.00 36.38 35.66 3h6f s VAL 120 CO -0.06 -0.97 0.05 -0.70 -0.31 0.00 0.00 175.10 173.11 3h6f s GLU 121 N -3.81 -0.04 0.19 4.82 2.12 -0.40 -3.30 118.70 118.28 3h6f s GLU 121 Ca 0.06 0.28 0.10 0.00 0.36 0.00 0.00 54.97 55.76 3h6f s GLU 121 Cb 0.07 -0.32 -0.04 0.00 0.26 0.00 0.00 34.13 34.10 3h6f s GLU 121 CO -0.10 -0.22 -0.15 -0.51 -0.54 0.00 0.00 175.26 173.74 3h6f s LEU 122 N 1.46 2.76 -0.06 2.70 1.43 -0.13 -1.54 118.68 125.30 3h6f s LEU 122 Ca -0.04 -0.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.36 3h6f s LEU 122 Cb -0.13 -1.46 0.02 0.00 0.03 0.00 0.00 46.19 44.66 3h6f s LEU 122 CO -0.03 0.11 -0.05 0.00 0.23 0.00 0.00 176.35 176.61 3h6f s VAL 124 N 1.23 2.80 0.06 0.00 1.01 -0.81 -1.38 120.40 123.30 3h6f s VAL 124 Ca -0.06 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 61.28 3h6f s VAL 124 Cb -0.14 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 3h6f s VAL 124 CO -0.02 0.50 -0.23 0.00 0.00 0.00 0.00 175.10 175.36 3h6f s ALA 125 N 0.88 1.94 -0.02 5.51 0.00 -0.64 -0.86 121.76 128.57 3h6f s ALA 125 Ca -0.04 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.77 3h6f s ALA 125 Cb -0.15 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.61 3h6f s ALA 125 CO -0.01 0.43 -0.06 -2.00 0.00 0.00 0.00 175.76 174.13 3h6f s GLU 126 N -1.39 0.59 0.43 0.00 2.12 -0.37 -0.42 118.70 119.67 3h6f s GLU 126 Ca 0.09 -0.19 0.07 0.00 0.36 0.00 0.00 54.97 55.30 3h6f s GLU 126 Cb -0.09 -0.59 -0.04 0.00 0.26 0.00 0.00 34.13 33.67 3h6f s GLU 126 CO 0.03 0.08 0.23 0.14 -0.54 0.00 0.00 175.26 175.19 3h6f s VAL 127 N 0.15 2.26 0.78 3.70 -7.23 -0.89 -1.65 120.40 117.53 3h6f s VAL 127 Ca -0.01 -1.62 -0.11 0.00 -1.81 0.00 0.00 61.98 58.42 3h6f s VAL 127 Cb -0.06 -2.89 0.06 0.00 0.56 0.00 0.00 36.38 34.05 3h6f s VAL 127 CO -0.00 0.00 1.10 0.00 -0.31 0.00 0.00 175.10 175.89 3h6f s ALA 128 N -2.60 2.19 0.70 1.32 0.00 -1.26 -4.87 121.76 117.23 3h6f s ALA 128 Ca 0.40 0.32 -0.11 0.00 0.00 0.00 0.00 51.96 52.57 3h6f s ALA 128 Cb 0.02 -3.30 0.01 0.00 0.00 0.00 0.00 23.12 19.85 3h6f s ALA 128 CO 0.23 -1.84 1.07 -1.01 0.00 0.00 0.00 175.76 174.21 3h6f s HIS 129 N -2.84 3.25 0.10 0.00 3.76 -1.26 -4.81 115.29 113.49 3h6f s HIS 129 Ca 0.62 1.22 -0.34 0.00 -0.15 0.00 0.00 55.06 56.41 3h6f s HIS 129 Cb -0.18 -2.94 -0.13 0.00 1.11 0.00 0.00 32.58 30.43 3h6f s HIS 129 CO 0.55 -1.19 1.65 0.98 -0.85 0.00 0.00 174.74 175.89 3h6f n TYR 130 N -3.06 2.27 -1.02 1.40 9.36 -1.26 -2.00 117.16 122.85 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 3.65 0.47 3.62 2.98 0.00 -1.26 -5.03 105.19 109.61 3h6f n GLY 131 Ca 0.18 -0.22 -0.28 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 -0.80 2.25 -0.34 1.61 2.02 -0.85 -5.11 118.70 117.50 3h6f s GLU 132 Ca 0.00 -1.12 -0.09 0.00 0.02 0.00 0.00 54.97 53.78 3h6f s GLU 132 Cb 0.00 -2.30 0.02 0.00 0.10 0.00 0.00 34.13 31.95 3h6f s GLU 132 CO 0.00 0.47 0.15 0.99 0.02 0.00 0.00 175.26 176.88 3h6f s THR 133 N -1.58 4.27 -0.27 3.63 2.01 -1.26 -4.74 115.64 117.69 3h6f s THR 133 Ca 0.25 -0.79 -0.19 0.00 0.31 0.00 0.00 61.69 61.27 3h6f s THR 133 Cb -0.10 -3.31 0.08 0.00 0.01 0.00 0.00 72.50 69.18 3h6f s THR 133 CO 0.17 -0.09 0.70 -0.75 -0.69 0.00 0.00 174.62 173.95 3h6f s LYS 134 N 1.52 0.75 0.11 4.92 2.20 -1.26 -5.10 119.74 122.88 3h6f s LYS 134 Ca 0.02 1.14 -0.31 0.00 -0.36 0.00 0.00 55.97 56.46 3h6f s LYS 134 Cb -0.18 0.24 -0.07 0.00 -1.51 0.00 0.00 37.83 36.31 3h6f s LYS 134 CO 0.05 -0.13 1.26 0.50 -0.36 0.00 0.00 175.35 176.67 3h6f s ARG 135 N 1.17 4.41 0.37 4.03 6.06 -1.26 -4.44 118.95 129.28 3h6f s ARG 135 Ca -0.06 1.90 -0.27 0.00 -2.50 0.00 0.00 55.73 54.80 3h6f s ARG 135 Cb -0.05 -3.29 -0.12 0.00 0.06 0.00 0.00 34.95 31.56 3h6f s ARG 135 CO -0.12 -0.28 1.26 -2.30 -2.50 0.00 0.00 175.30 171.36 3h6f n PRO 136 N 3.59 2.01 -4.61 5.12 -0.02 -1.26 -4.89 135.00 134.94 3h6f n PRO 136 Ca 0.09 0.71 -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 31.49 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 -1.96 3.14 -0.05 -0.52 2.02 -0.66 -4.99 118.70 115.68 3h6f s GLU 137 Ca 0.57 -0.58 0.03 0.00 0.02 0.00 0.00 54.97 55.01 3h6f s GLU 137 Cb -0.56 -2.68 0.01 0.00 0.10 0.00 0.00 34.13 31.00 3h6f s GLU 137 CO 0.61 0.44 -0.14 -0.51 0.02 0.00 0.00 175.26 175.68 3h6f s LEU 138 N -0.21 1.76 -0.03 1.80 1.02 -1.24 -1.23 118.68 120.55 3h6f s LEU 138 Ca 0.02 -0.31 0.06 0.00 0.02 0.00 0.00 54.13 53.92 3h6f s LEU 138 Cb -0.13 -0.85 -0.01 0.00 0.02 0.00 0.00 46.19 45.22 3h6f s LEU 138 CO 0.03 0.08 -0.21 -0.31 0.02 0.00 0.00 176.35 175.96 3h6f s TYR 139 N 0.40 1.93 -0.19 0.29 2.02 -0.04 -2.03 117.35 119.73 3h6f s TYR 139 Ca -0.10 -0.46 -0.04 0.00 -0.37 0.00 0.00 57.07 56.11 3h6f s TYR 139 Cb -0.14 -1.26 -0.02 0.00 -0.40 0.00 0.00 41.96 40.14 3h6f s TYR 139 CO 0.03 -0.10 -0.04 0.50 -1.57 0.00 0.00 175.55 174.37 3h6f s ARG 140 N -0.28 3.51 -0.14 -0.62 3.52 -0.69 -1.93 118.95 122.32 3h6f s ARG 140 Ca 0.03 -0.58 0.02 0.00 -0.13 0.00 0.00 55.73 55.06 3h6f s ARG 140 Cb -0.10 -2.96 0.00 0.00 -1.56 0.00 0.00 34.95 30.33 3h6f s ARG 140 CO 0.01 0.01 -0.20 0.42 -0.81 0.00 0.00 175.30 174.73 3h6f s ILE 141 N 0.97 2.32 0.40 4.11 1.09 0.03 -1.56 121.20 128.55 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 -1.94 -0.01 0.00 -1.06 0.00 0.00 42.46 39.31 3h6f s ILE 141 CO 0.01 0.54 0.45 0.42 -0.10 0.00 0.00 174.94 176.26 3h6f s THR 142 N 0.69 3.08 0.58 2.92 -4.23 -0.44 -0.96 115.64 117.27 3h6f s THR 142 Ca -0.09 -1.17 0.33 0.00 -1.18 0.00 0.00 61.69 59.59 3h6f s THR 142 Cb -0.16 -3.07 0.48 0.00 1.34 0.00 0.00 72.50 71.09 3h6f s THR 142 CO 0.01 -0.04 1.68 0.10 -0.54 0.00 0.00 174.62 175.84 3h6f h TYR 143 N 0.89 0.00 -0.01 3.99 -0.00 -1.83 -0.02 116.97 119.99 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 0.46 0.00 -0.59 -0.40 -0.00 0.00 0.00 178.16 177.63 3h6f n ASP 144 N -3.78 1.28 0.00 0.10 3.85 -1.26 -4.57 116.55 112.17 3h6f n ASP 144 Ca 0.22 -1.04 0.00 0.00 -0.71 0.00 0.00 54.79 53.26 3h6f n ASP 144 Cb 1.23 0.53 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 1.44 1.06 3.73 6.12 0.00 -0.02 -4.06 105.19 113.46 3h6f n GLY 145 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 3h6f n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6f s SER 146 N -2.00 7.47 -0.09 1.61 0.01 -1.25 -4.75 113.70 114.69 3h6f s SER 146 Ca 0.00 1.86 0.04 0.00 1.31 0.00 0.00 55.95 59.16 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 -0.08 -0.23 -0.51 0.41 0.00 0.00 173.24 172.83 3h6f s ILE 147 N -0.11 1.98 -0.06 1.44 2.07 -1.26 -1.33 121.20 123.93 3h6f s ILE 147 Ca 0.47 -0.98 0.03 0.00 -1.41 0.00 0.00 60.65 58.76 3h6f s ILE 147 Cb -0.25 -1.72 0.01 0.00 0.13 0.00 0.00 42.46 40.64 3h6f s ILE 147 CO 0.31 0.54 -0.13 0.00 -1.91 0.00 0.00 174.94 173.76 3h6f s ALA 148 N 0.33 1.25 -0.55 1.50 0.00 -0.60 -4.99 121.76 118.70 3h6f s ALA 148 Ca -0.18 -0.45 -0.22 0.00 0.00 0.00 0.00 51.96 51.12 3h6f s ALA 148 Cb -0.18 -0.52 0.06 0.00 0.00 0.00 0.00 23.12 22.48 3h6f s ALA 148 CO 0.08 0.15 0.80 0.34 0.00 0.00 0.00 175.76 177.13 3h6f s ASP 149 N 0.48 6.26 -0.20 0.00 -1.08 -1.26 -1.71 116.67 119.16 3h6f s ASP 149 Ca -0.11 -0.72 -0.15 0.00 -0.52 0.00 0.00 52.55 51.05 3h6f s ASP 149 Cb -0.14 -2.37 -0.04 0.00 -1.46 0.00 0.00 42.92 38.91 3h6f s ASP 149 CO 0.03 -1.11 0.36 -1.61 0.52 0.00 0.00 175.17 173.36 3h6f s GLU 150 N 3.36 4.17 0.19 4.34 0.41 -0.86 -5.00 118.70 125.29 3h6f s GLU 150 Ca 0.22 0.14 0.10 0.00 -0.41 0.00 0.00 54.97 55.02 3h6f s GLU 150 Cb -0.16 -3.53 -0.10 0.00 -1.78 0.00 0.00 34.13 28.56 3h6f s GLU 150 CO 0.14 -0.01 1.35 -1.35 -0.49 0.00 0.00 175.26 174.90 3h6f h PRO 151 N 7.35 0.00 0.00 0.39 0.11 -1.94 -3.29 132.00 134.62 3h6f h PRO 151 Ca -0.37 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.61 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 0.80 -1.45 0.72 -0.21 0.00 0.00 178.00 178.56 3h6f n HIS 152 N -3.30 0.00 -3.69 0.65 8.25 -1.26 -4.86 115.22 111.01 3h6f n HIS 152 Ca 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.37 3h6f n HIS 152 Cb 0.86 -0.29 -0.05 0.00 1.12 0.00 0.00 29.99 31.62 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 -2.15 -0.11 -0.03 4.41 -0.12 -1.26 -1.72 117.98 117.01 3h6f s PHE 153 Ca -0.11 -0.24 0.02 0.00 -0.05 0.00 0.00 56.93 56.55 3h6f s PHE 153 Cb 0.04 0.18 0.01 0.00 -0.63 0.00 0.00 43.02 42.62 3h6f s PHE 153 CO 0.15 -0.67 -0.08 0.08 -0.05 0.00 0.00 175.22 174.65 3h6f s VAL 154 N -3.82 0.69 -0.10 -2.49 1.01 0.19 -4.88 120.40 111.00 3h6f s VAL 154 Ca 0.04 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.73 3h6f s VAL 154 Cb 0.02 -0.63 0.02 0.00 0.00 0.00 0.00 36.38 35.79 3h6f s VAL 154 CO -0.11 0.22 -0.13 -0.69 0.00 0.00 0.00 175.10 174.39 3h6f s VAL 155 N 0.27 1.35 0.04 2.92 1.01 -1.26 -1.18 120.40 123.54 3h6f s VAL 155 Ca -0.04 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.43 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 -0.12 -0.04 0.00 0.00 0.00 175.10 175.35 3h6f s MET 156 N 1.00 0.79 0.11 2.72 -1.94 -0.24 -4.99 119.30 116.74 3h6f s MET 156 Ca -0.07 -0.71 0.00 0.00 -1.71 0.00 0.00 55.69 53.20 3h6f s MET 156 Cb -0.15 -0.75 0.00 0.00 2.01 0.00 0.00 34.83 35.95 3h6f s MET 156 CO -0.01 0.18 0.00 0.41 -0.01 0.00 0.00 175.02 175.59 3h6f n GLY 157 N 1.89 -2.96 7.00 -0.03 0.00 -1.26 -1.05 105.19 108.77 3h6f n GLY 157 Ca -0.19 -1.26 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 -1.85 2.01 3.32 -0.02 0.00 -0.48 -4.34 105.19 103.82 3h6f n GLY 158 Ca -0.00 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 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 4.59 0.01 2.61 2.01 -1.26 -4.38 115.64 119.22 3h6f s THR 159 Ca 0.00 -1.22 -0.25 0.00 0.31 0.00 0.00 61.69 60.53 3h6f s THR 159 Cb 0.00 -3.75 -0.19 0.00 0.01 0.00 0.00 72.50 68.57 3h6f s THR 159 CO 0.00 -0.49 1.39 0.74 -0.69 0.00 0.00 174.62 175.57 3h6f h THR 160 N 5.95 1.28 -0.42 -0.82 2.02 -1.95 -3.37 112.91 115.60 3h6f h THR 160 Ca -0.25 -0.84 0.01 0.00 0.77 0.00 0.00 66.41 66.11 3h6f h THR 160 Cb 1.09 1.85 -0.03 0.00 -1.74 0.00 0.00 68.15 69.33 3h6f h THR 160 CO 0.78 0.22 0.26 -0.33 0.37 0.00 0.00 175.52 176.81 3h6f h GLU 161 N -0.36 0.50 -0.21 6.66 3.07 -1.97 -0.09 114.58 122.18 3h6f h GLU 161 Ca -0.00 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.80 3h6f h GLU 161 Cb 0.36 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 3h6f h GLU 161 CO 0.00 0.33 0.02 -1.35 -1.40 0.00 0.00 179.01 176.62 3h6f h PRO 162 N 0.52 0.31 0.11 2.33 0.11 -1.96 -0.51 132.00 132.90 3h6f h PRO 162 Ca 0.16 -0.04 -0.27 0.00 0.11 0.00 0.00 66.00 65.96 3h6f h PRO 162 Cb -0.01 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 31.05 3h6f h PRO 162 CO -0.06 0.32 -1.20 0.82 -0.21 0.00 0.00 178.00 177.67 3h6f h ILE 163 N 0.31 1.46 -0.21 4.15 2.04 -1.63 -2.76 117.51 120.86 3h6f h ILE 163 Ca 0.07 -2.90 -0.14 0.00 1.00 0.00 0.00 64.86 62.89 3h6f h ILE 163 Cb 0.17 2.84 -0.01 0.00 -0.74 0.00 0.00 36.82 39.09 3h6f h ILE 163 CO 0.00 0.85 -0.46 0.00 0.00 0.00 0.00 178.15 178.54 3h6f h ALA 164 N 0.58 0.80 0.03 1.87 0.00 -0.57 -2.56 119.26 119.40 3h6f h ALA 164 Ca -0.13 -0.47 -0.25 0.00 0.00 0.00 0.00 54.91 54.06 3h6f h ALA 164 Cb 1.90 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.60 3h6f h ALA 164 CO 0.20 0.66 -1.03 -0.91 0.00 0.00 0.00 179.25 178.17 3h6f h ASN 165 N 0.44 0.62 1.01 0.00 2.35 -1.19 -1.61 115.58 117.21 3h6f h ASN 165 Ca 0.03 -0.52 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 3h6f h ASN 165 Cb 0.98 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.16 3h6f h ASN 165 CO 0.09 1.34 0.00 0.00 -1.65 0.00 0.00 177.43 177.20 3h6f h ALA 166 N 0.61 1.00 0.03 -0.83 0.00 -1.47 -2.65 119.26 115.95 3h6f h ALA 166 Ca -0.11 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.45 3h6f h ALA 166 Cb 1.69 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 3h6f h ALA 166 CO 0.18 0.00 -2.16 -0.11 0.00 0.00 0.00 179.25 177.16 3h6f n LEU 167 N -2.89 1.58 0.21 0.00 7.94 -0.97 -3.58 117.00 119.29 3h6f n LEU 167 Ca 0.01 0.11 0.05 0.00 -1.11 0.00 0.00 56.01 55.07 3h6f n LEU 167 Cb 0.30 -0.31 0.48 0.00 0.53 0.00 0.00 43.42 44.42 3h6f n LEU 167 CO 0.26 0.67 0.89 0.50 -1.11 0.00 0.00 177.39 178.60 3h6f h LYS 168 N 0.02 0.03 0.15 1.96 3.64 -1.11 -1.87 116.57 119.38 3h6f h LYS 168 Ca -0.47 -0.01 -0.32 0.00 -1.27 0.00 0.00 60.65 58.59 3h6f h LYS 168 Cb 2.05 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.87 3h6f h LYS 168 CO 0.02 0.21 -1.54 1.49 -2.27 0.00 0.00 179.45 177.36 3h6f h GLU 169 N 0.03 0.32 -0.29 1.90 4.57 -1.65 -3.40 114.58 116.07 3h6f h GLU 169 Ca 0.00 -0.55 -0.08 0.00 -1.18 0.00 0.00 59.36 57.55 3h6f h GLU 169 Cb 0.34 0.21 -0.05 0.00 -0.16 0.00 0.00 28.75 29.09 3h6f h GLU 169 CO 0.02 1.21 -0.02 -1.13 -1.18 0.00 0.00 179.01 177.92 3h6f n SER 170 N -3.53 3.21 -4.70 1.04 3.41 -1.07 -5.03 113.62 106.95 3h6f n SER 170 Ca -0.17 -3.33 -0.40 0.00 -0.26 0.00 0.00 58.87 54.70 3h6f n SER 170 Cb 1.06 -0.58 -0.04 0.00 -0.26 0.00 0.00 64.21 64.39 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 -3.01 3.53 -0.19 7.33 5.04 -0.73 -5.01 117.35 124.32 3h6f s TYR 171 Ca 0.43 1.28 -0.04 0.00 -2.44 0.00 0.00 57.07 56.30 3h6f s TYR 171 Cb 0.36 -2.89 -0.02 0.00 0.35 0.00 0.00 41.96 39.76 3h6f s TYR 171 CO 0.05 -0.02 -0.03 0.00 -1.34 0.00 0.00 175.55 174.21 3h6f s ALA 172 N 1.23 2.93 0.11 3.97 0.00 -1.26 -5.07 121.76 123.67 3h6f s ALA 172 Ca 0.39 -1.01 -0.32 0.00 0.00 0.00 0.00 51.96 51.02 3h6f s ALA 172 Cb -0.18 -1.67 -0.11 0.00 0.00 0.00 0.00 23.12 21.15 3h6f s ALA 172 CO 0.17 -0.15 1.58 0.93 0.00 0.00 0.00 175.76 178.30 3h6f h GLU 173 N 7.49 -0.68 -0.67 0.00 4.39 -1.97 -3.26 114.58 119.89 3h6f h GLU 173 Ca -0.36 0.05 -0.35 0.00 0.34 0.00 0.00 59.36 59.04 3h6f h GLU 173 Cb 1.18 0.15 -0.21 0.00 -0.10 0.00 0.00 28.75 29.77 3h6f h GLU 173 CO 0.60 -0.45 0.27 0.09 -1.16 0.00 0.00 179.01 178.36 3h6f n ASN 174 N -5.48 3.16 -4.45 1.42 4.13 -1.26 -4.50 115.26 108.29 3h6f n ASN 174 Ca -0.08 -3.71 -0.34 0.00 1.68 0.00 0.00 54.58 52.13 3h6f n ASN 174 Cb 0.39 -0.74 0.10 0.00 -1.54 0.00 0.00 39.78 38.00 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 -1.13 -2.11 -2.18 5.41 0.00 -1.23 -4.21 120.51 115.05 3h6f n ALA 175 Ca 0.46 -0.48 -0.16 0.00 0.00 0.00 0.00 53.44 53.27 3h6f n ALA 175 Cb 1.33 -1.84 0.11 0.00 0.00 0.00 0.00 19.45 19.05 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 -1.09 0.63 0.13 0.00 3.41 -1.26 -1.49 113.62 113.95 3h6f n SER 176 Ca 0.08 -1.64 -0.12 0.00 -0.26 0.00 0.00 58.87 56.93 3h6f n SER 176 Cb 0.52 -0.57 -0.08 0.00 -0.26 0.00 0.00 64.21 63.83 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 -0.31 -1.58 1.04 5.85 -1.99 -2.19 115.31 116.14 3h6f h LEU 177 Ca -0.26 -0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.30 3h6f h LEU 177 Cb 0.87 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 3h6f h LEU 177 CO 0.24 0.11 0.37 0.71 -0.34 0.00 0.00 178.44 179.53 3h6f h THR 178 N -0.79 0.99 -0.00 1.05 1.35 -1.96 -0.84 112.91 112.70 3h6f h THR 178 Ca -0.04 -0.18 -0.01 0.00 -0.55 0.00 0.00 66.41 65.64 3h6f h THR 178 Cb 0.51 0.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.35 3h6f h THR 178 CO 0.06 0.10 -0.02 0.44 -0.25 0.00 0.00 175.52 175.85 3h6f h ASP 179 N 0.52 0.02 0.15 5.36 3.32 -1.92 -3.06 116.42 120.81 3h6f h ASP 179 Ca 0.24 -0.75 -0.07 0.00 0.02 0.00 0.00 57.03 56.48 3h6f h ASP 179 Cb 0.29 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3h6f h ASP 179 CO -0.07 0.76 -0.24 0.00 -1.72 0.00 0.00 179.24 177.98 3h6f h ALA 180 N 0.26 1.42 -0.15 3.45 0.00 -1.14 -2.17 119.26 120.93 3h6f h ALA 180 Ca -0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 3h6f h ALA 180 Cb 0.77 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 3h6f h ALA 180 CO 0.00 0.41 -0.07 1.25 0.00 0.00 0.00 179.25 180.84 3h6f h LEU 181 N 0.15 0.32 -0.96 0.00 7.12 -1.26 -2.19 115.31 118.50 3h6f h LEU 181 Ca 0.03 -0.41 -0.05 0.00 0.13 0.00 0.00 57.88 57.58 3h6f h LEU 181 Cb 0.51 -0.09 -0.03 0.00 -0.53 0.00 0.00 40.66 40.53 3h6f h LEU 181 CO 0.04 0.66 0.18 -0.09 -0.13 0.00 0.00 178.44 179.10 3h6f h ARG 182 N -0.02 0.94 -0.23 1.25 2.43 -1.41 -1.05 114.38 116.30 3h6f h ARG 182 Ca 0.03 -0.19 -0.11 0.00 -0.81 0.00 0.00 59.98 58.91 3h6f h ARG 182 Cb 0.53 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 3h6f h ARG 182 CO 0.02 0.82 -0.32 0.82 -1.51 0.00 0.00 179.97 179.80 3h6f h ILE 183 N 0.91 1.28 -0.02 1.20 2.04 -1.37 -2.05 117.51 119.50 3h6f h ILE 183 Ca 0.20 -1.39 -0.20 0.00 1.00 0.00 0.00 64.86 64.48 3h6f h ILE 183 Cb 0.28 1.45 0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3h6f h ILE 183 CO -0.01 0.44 -0.76 0.00 0.00 0.00 0.00 178.15 177.82 3h6f h ALA 184 N 1.26 0.12 0.00 1.87 0.00 -0.94 -1.90 119.26 119.67 3h6f h ALA 184 Ca 0.05 -0.61 -0.05 0.00 0.00 0.00 0.00 54.91 54.30 3h6f h ALA 184 Cb 0.75 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 3h6f h ALA 184 CO 0.06 0.49 -0.26 0.28 0.00 0.00 0.00 179.25 179.82 3h6f h VAL 185 N 0.14 1.01 -0.04 0.00 2.07 -1.18 -0.66 116.25 117.60 3h6f h VAL 185 Ca -0.09 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.46 3h6f h VAL 185 Cb 1.43 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.74 3h6f h VAL 185 CO 0.15 0.25 -0.06 0.00 0.02 0.00 0.00 177.57 177.93 3h6f h ALA 186 N 1.74 0.06 0.00 1.67 0.00 -1.33 -2.83 119.26 118.56 3h6f h ALA 186 Ca -0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 3h6f h ALA 186 Cb 0.52 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3h6f h ALA 186 CO 0.03 -0.12 -0.33 0.00 0.00 0.00 0.00 179.25 178.84 3h6f h ALA 187 N 0.48 1.29 0.00 0.00 0.00 -1.02 -2.88 119.26 117.12 3h6f h ALA 187 Ca 0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 3h6f h ALA 187 Cb 0.62 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3h6f h ALA 187 CO 0.01 0.41 -0.30 1.25 0.00 0.00 0.00 179.25 180.62 3h6f h LEU 188 N 0.00 0.00 -2.31 0.00 5.85 -1.07 -3.23 115.31 114.55 3h6f h LEU 188 Ca -0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3h6f h LEU 188 Cb 0.65 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 3h6f h LEU 188 CO 0.04 0.30 -0.03 0.03 -0.34 0.00 0.00 178.44 178.45 3h6f h ARG 189 N 0.00 0.00 0.00 1.25 2.47 -1.27 -3.50 114.38 113.33 3h6f h ARG 189 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3h6f h ARG 189 Cb 0.95 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.27 3h6f h ARG 189 CO 0.04 0.03 0.00 0.00 0.56 0.00 0.00 179.97 180.59 3h6f n ALA 190 N -2.34 1.26 0.00 0.04 0.00 -1.22 -5.15 120.51 113.09 3h6f n ALA 190 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3h6f n ALA 190 Cb 0.11 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.68 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 204 N -0.31 2.16 0.31 0.00 0.00 -1.26 -4.84 105.19 101.25 3h6f n GLY 204 Ca 0.00 -1.86 0.02 0.00 0.00 0.00 0.00 46.02 44.18 3h6f n GLY 204 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h6f h VAL 205 N 0.00 1.14 0.00 1.61 2.07 -1.98 -1.97 116.25 117.13 3h6f h VAL 205 Ca 0.00 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3h6f h VAL 205 Cb 0.00 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 3h6f h VAL 205 CO 0.00 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.74 3h6f n ALA 206 N -2.46 2.25 0.20 1.67 0.00 -1.26 -3.43 120.51 117.48 3h6f n ALA 206 Ca 0.04 -0.10 0.02 0.00 0.00 0.00 0.00 53.44 53.40 3h6f n ALA 206 Cb 0.09 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.11 3h6f n ALA 206 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3h6f n SER 207 N -1.42 0.94 -4.52 0.00 3.41 -0.78 -4.52 113.62 106.74 3h6f n SER 207 Ca 0.09 -0.97 -0.28 0.00 -0.26 0.00 0.00 58.87 57.45 3h6f n SER 207 Cb 0.27 0.38 -0.10 0.00 -0.26 0.00 0.00 64.21 64.50 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 -1.09 2.78 -0.22 1.04 1.43 -0.95 -0.64 118.68 121.03 3h6f s LEU 208 Ca 0.04 -0.62 -0.02 0.00 -1.03 0.00 0.00 54.13 52.50 3h6f s LEU 208 Cb 0.04 -1.53 0.07 0.00 0.03 0.00 0.00 46.19 44.79 3h6f s LEU 208 CO 0.10 0.13 0.03 -0.70 0.23 0.00 0.00 176.35 176.15 3h6f s GLU 209 N -2.57 0.83 -0.00 1.70 2.12 -0.59 -4.81 118.70 115.38 3h6f s GLU 209 Ca 0.22 -0.65 0.07 0.00 0.36 0.00 0.00 54.97 54.97 3h6f s GLU 209 Cb -0.09 -2.16 -0.03 0.00 0.26 0.00 0.00 34.13 32.11 3h6f s GLU 209 CO 0.12 -0.70 -0.21 0.08 -0.54 0.00 0.00 175.26 174.01 3h6f s VAL 210 N 1.74 2.50 0.01 3.70 1.01 -1.26 -1.69 120.40 126.41 3h6f s VAL 210 Ca 0.00 -1.08 -0.24 0.00 0.00 0.00 0.00 61.98 60.66 3h6f s VAL 210 Cb -0.17 -1.96 0.05 0.00 0.00 0.00 0.00 36.38 34.30 3h6f s VAL 210 CO -0.11 0.48 0.55 0.00 0.00 0.00 0.00 175.10 176.02 3h6f s ALA 211 N -0.75 -1.40 0.16 5.51 0.00 -0.64 -2.05 121.76 122.58 3h6f s ALA 211 Ca 0.12 0.79 0.07 0.00 0.00 0.00 0.00 51.96 52.94 3h6f s ALA 211 Cb -0.10 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 3h6f s ALA 211 CO 0.01 -0.44 -0.16 0.14 0.00 0.00 0.00 175.76 175.31 3h6f s VAL 212 N -1.94 1.64 -0.73 0.00 -7.23 -0.12 -0.41 120.40 111.60 3h6f s VAL 212 Ca -0.08 -1.89 -0.06 0.00 -1.81 0.00 0.00 61.98 58.14 3h6f s VAL 212 Cb -0.01 -1.77 0.19 0.00 0.56 0.00 0.00 36.38 35.35 3h6f s VAL 212 CO 0.02 -0.39 0.59 -0.76 -0.31 0.00 0.00 175.10 174.26 3h6f s LEU 213 N -2.69 5.69 -0.55 1.32 1.43 -0.52 -1.29 118.68 122.07 3h6f s LEU 213 Ca 0.14 -2.97 -0.28 0.00 -1.03 0.00 0.00 54.13 49.99 3h6f s LEU 213 Cb -0.05 -1.96 0.03 0.00 0.03 0.00 0.00 46.19 44.24 3h6f s LEU 213 CO 0.05 -0.39 1.23 -0.62 0.23 0.00 0.00 176.35 176.85 3h6f s ASP 214 N 0.93 6.43 0.00 2.29 2.15 0.42 -2.63 116.67 126.26 3h6f s ASP 214 Ca 0.19 0.23 0.12 0.00 0.43 0.00 0.00 52.55 53.53 3h6f s ASP 214 Cb -0.16 -2.55 0.69 0.00 -0.30 0.00 0.00 42.92 40.60 3h6f s ASP 214 CO -0.06 -1.47 1.22 0.00 -0.17 0.00 0.00 175.17 174.69 3h6f n ALA 215 N 8.51 1.87 1.09 3.66 0.00 -0.79 -2.20 120.51 132.65 3h6f n ALA 215 Ca 0.10 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.59 3h6f n ALA 215 Cb 0.49 -1.20 0.15 0.00 0.00 0.00 0.00 19.45 18.89 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 -1.11 2.31 -4.82 0.00 2.85 -1.26 -4.50 115.26 108.73 3h6f n ASN 216 Ca 0.08 -1.68 -0.34 0.00 -0.11 0.00 0.00 54.58 52.53 3h6f n ASN 216 Cb 0.06 0.17 -0.06 0.00 1.24 0.00 0.00 39.78 41.18 3h6f n ASN 216 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 3h6f s ARG 217 N -2.20 4.20 0.07 1.20 0.52 -0.94 -5.02 118.95 116.79 3h6f s ARG 217 Ca 0.26 0.90 -0.22 0.00 -0.52 0.00 0.00 55.73 56.15 3h6f s ARG 217 Cb 0.19 -2.60 -0.13 0.00 0.52 0.00 0.00 34.95 32.94 3h6f s ARG 217 CO 0.41 0.23 1.61 -1.35 0.02 0.00 0.00 175.30 176.21 3h6f h PRO 218 N 2.72 0.12 0.00 3.54 0.11 -1.91 -3.41 132.00 133.18 3h6f h PRO 218 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3h6f h PRO 218 Cb 1.18 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3h6f h PRO 218 CO 0.65 0.24 -0.40 -2.13 -0.21 0.00 0.00 178.00 176.14 3h6f n ARG 219 N -4.94 0.00 -3.45 1.05 0.63 -1.26 -4.48 116.66 104.21 3h6f n ARG 219 Ca -0.06 0.00 -0.40 0.00 -0.92 0.00 0.00 57.85 56.47 3h6f n ARG 219 Cb 0.11 -0.42 -0.10 0.00 0.45 0.00 0.00 32.46 32.51 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 -2.00 3.75 0.12 -0.14 0.52 -1.26 -4.40 118.95 115.53 3h6f s ARG 220 Ca 0.00 -0.31 0.10 0.00 -0.52 0.00 0.00 55.73 55.01 3h6f s ARG 220 Cb 0.00 -3.74 -0.15 0.00 0.52 0.00 0.00 34.95 31.58 3h6f s ARG 220 CO 0.00 -0.39 1.16 0.00 0.02 0.00 0.00 175.30 176.10 3h6f h ALA 221 N 8.38 0.52 -2.51 2.13 0.00 -1.39 -3.45 119.26 122.93 3h6f h ALA 221 Ca -0.31 -0.92 -0.53 0.00 0.00 0.00 0.00 54.91 53.15 3h6f h ALA 221 Cb 1.16 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.98 3h6f h ALA 221 CO 0.65 1.16 0.79 0.12 0.00 0.00 0.00 179.25 181.97 3h6f s PHE 222 N -2.76 3.08 -0.10 0.00 5.36 -1.26 -0.44 117.98 121.86 3h6f s PHE 222 Ca 0.00 0.83 -0.05 0.00 -0.96 0.00 0.00 56.93 56.75 3h6f s PHE 222 Cb 0.09 -3.73 0.04 0.00 -0.34 0.00 0.00 43.02 39.08 3h6f s PHE 222 CO 0.81 -2.66 0.25 0.50 -1.46 0.00 0.00 175.22 172.65 3h6f s ARG 223 N 1.48 0.21 0.00 10.12 3.52 -0.41 -4.97 118.95 128.90 3h6f s ARG 223 Ca 0.66 0.52 -0.18 0.00 -0.13 0.00 0.00 55.73 56.60 3h6f s ARG 223 Cb -0.37 -0.10 -0.06 0.00 -1.56 0.00 0.00 34.95 32.86 3h6f s ARG 223 CO 0.30 -0.15 0.49 1.03 -0.81 0.00 0.00 175.30 176.16 3h6f s ARG 224 N 1.19 4.14 -0.46 5.12 0.52 -1.26 -0.95 118.95 127.25 3h6f s ARG 224 Ca -0.09 0.56 -0.06 0.00 -0.52 0.00 0.00 55.73 55.63 3h6f s ARG 224 Cb -0.10 -3.28 0.12 0.00 0.52 0.00 0.00 34.95 32.21 3h6f s ARG 224 CO -0.08 0.54 0.29 0.42 0.02 0.00 0.00 175.30 176.49 3h6f s ILE 225 N -0.66 3.76 0.28 1.52 1.01 -0.87 -4.98 121.20 121.26 3h6f s ILE 225 Ca 0.27 -2.00 0.10 0.00 0.00 0.00 0.00 60.65 59.01 3h6f s ILE 225 Cb -0.17 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 3h6f s ILE 225 CO 0.15 -0.75 -0.13 0.42 0.00 0.00 0.00 174.94 174.63 3h6f s THR 226 N 1.15 2.12 0.00 2.92 -4.23 -1.26 -4.30 115.64 112.04 3h6f s THR 226 Ca 0.08 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.32 3h6f s THR 226 Cb -0.24 -2.38 0.00 0.00 1.34 0.00 0.00 72.50 71.22 3h6f s THR 226 CO -0.03 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.30 3h6f n GLY 227 N -0.62 2.72 0.34 3.99 0.00 -1.26 -2.89 105.19 107.48 3h6f n GLY 227 Ca -0.06 0.32 0.02 0.00 0.00 0.00 0.00 46.02 46.30 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 0.91 0.55 1.61 0.87 -1.99 -2.10 113.55 113.40 3h6f h SER 228 Ca 0.00 0.02 -0.12 0.00 -1.23 0.00 0.00 61.79 60.46 3h6f h SER 228 Cb 0.00 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.77 3h6f h SER 228 CO 0.00 0.58 -0.56 0.00 -0.53 0.00 0.00 176.83 176.32 3h6f h ALA 229 N 1.43 1.07 0.01 6.23 0.00 -1.93 -1.80 119.26 124.27 3h6f h ALA 229 Ca 0.40 -0.51 -0.20 0.00 0.00 0.00 0.00 54.91 54.60 3h6f h ALA 229 Cb 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3h6f h ALA 229 CO -0.18 0.70 -0.92 1.25 0.00 0.00 0.00 179.25 180.10 3h6f h LEU 230 N 0.01 0.07 -0.13 0.00 5.85 -1.50 -3.06 115.31 116.54 3h6f h LEU 230 Ca -0.01 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.57 3h6f h LEU 230 Cb 0.99 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.00 3h6f h LEU 230 CO 0.07 0.95 -0.23 -0.61 -0.34 0.00 0.00 178.44 178.29 3h6f h GLN 231 N 0.02 0.39 0.00 1.25 5.75 -1.29 -3.08 115.11 118.15 3h6f h GLN 231 Ca -0.02 -0.24 0.00 0.00 -0.15 0.00 0.00 58.65 58.24 3h6f h GLN 231 Cb 1.61 0.03 0.00 0.00 1.07 0.00 0.00 27.48 30.19 3h6f h GLN 231 CO 0.13 0.83 0.00 0.00 -2.65 0.00 0.00 178.83 177.14 3h6f n ALA 232 N -2.46 1.82 -0.18 3.38 0.00 -0.68 -2.00 120.51 120.39 3h6f n ALA 232 Ca -0.07 -0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.41 3h6f n ALA 232 Cb 0.43 -1.19 0.25 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.14 3.52 0.00 0.00 4.32 -1.16 -5.06 117.00 117.48 3h6f n LEU 233 Ca 0.07 -1.88 0.00 0.00 -0.02 0.00 0.00 56.01 54.18 3h6f n LEU 233 Cb 0.06 -0.36 0.00 0.00 -1.62 0.00 0.00 43.42 41.50 3h6f n LEU 233 CO 0.08 0.86 0.00 -0.11 -1.22 0.00 0.00 177.39 176.99