#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hrc s LYS 77 N 0.00 3.39 0.11 1.64 1.02 -1.26 -5.10 119.74 119.54 3hrc s LYS 77 Ca 0.00 0.84 0.00 0.00 0.02 0.00 0.00 55.97 56.83 3hrc s LYS 77 Cb 0.00 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 35.22 3hrc s LYS 77 CO 0.00 -0.74 -0.02 -0.98 -0.92 0.00 0.00 175.35 172.69 3hrc s ARG 78 N -5.05 0.84 0.28 1.68 1.70 -1.26 -4.77 118.95 112.36 3hrc s ARG 78 Ca 0.56 -1.36 0.00 0.00 -0.47 0.00 0.00 55.73 54.47 3hrc s ARG 78 Cb -0.12 -0.02 0.53 0.00 -0.57 0.00 0.00 34.95 34.78 3hrc s ARG 78 CO 0.53 -0.11 1.83 -1.35 -1.08 0.00 0.00 175.30 175.12 3hrc h PRO 79 N 2.95 0.94 0.00 3.89 0.11 -1.96 0.11 132.00 138.04 3hrc h PRO 79 Ca -0.35 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3hrc h PRO 79 Cb 1.17 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.07 3hrc h PRO 79 CO 0.64 0.62 0.30 0.93 -0.21 0.00 0.00 178.00 180.27 3hrc h GLU 80 N 0.96 0.00 0.00 1.05 3.07 -2.03 -2.15 114.58 115.48 3hrc h GLU 80 Ca 0.48 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.34 3hrc h GLU 80 Cb 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 3hrc h GLU 80 CO -0.27 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.09 3hrc n ASP 81 N -2.78 0.00 -4.23 1.42 8.00 0.40 -4.86 116.55 114.51 3hrc n ASP 81 Ca -0.02 0.01 -0.20 0.00 0.71 0.00 0.00 54.79 55.29 3hrc n ASP 81 Cb 0.34 -0.32 -0.12 0.00 -0.02 0.00 0.00 41.12 41.01 3hrc n ASP 81 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3hrc s PHE 82 N -2.64 1.43 -0.30 1.24 0.08 -0.81 -1.07 117.98 115.91 3hrc s PHE 82 Ca 0.23 -0.49 -0.10 0.00 0.12 0.00 0.00 56.93 56.69 3hrc s PHE 82 Cb 0.17 -0.78 -0.02 0.00 -0.57 0.00 0.00 43.02 41.83 3hrc s PHE 82 CO 0.41 0.13 0.16 0.21 -0.10 0.00 0.00 175.22 176.03 3hrc s LYS 83 N -2.17 3.52 0.10 0.44 2.20 0.72 -4.91 119.74 119.65 3hrc s LYS 83 Ca 0.05 -0.60 -0.26 0.00 -0.36 0.00 0.00 55.97 54.80 3hrc s LYS 83 Cb -0.08 -3.57 -0.07 0.00 -1.51 0.00 0.00 37.83 32.60 3hrc s LYS 83 CO 0.03 -0.34 0.81 -0.06 -0.36 0.00 0.00 175.35 175.43 3hrc s PHE 84 N 1.65 3.82 0.00 4.03 0.40 -1.26 -0.82 117.98 125.81 3hrc s PHE 84 Ca 0.06 1.60 0.00 0.00 -0.60 0.00 0.00 56.93 57.99 3hrc s PHE 84 Cb -0.17 -2.85 0.00 0.00 0.51 0.00 0.00 43.02 40.52 3hrc s PHE 84 CO 0.07 0.35 0.00 0.41 0.70 0.00 0.00 175.22 176.75 3hrc n GLY 85 N 2.06 3.38 3.77 4.36 0.00 0.31 -4.97 105.19 114.10 3hrc n GLY 85 Ca -0.03 -1.12 -0.36 0.00 0.00 0.00 0.00 46.02 44.51 3hrc n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hrc s LYS 86 N 4.68 3.59 0.10 1.61 -2.85 -1.26 -4.61 119.74 121.01 3hrc s LYS 86 Ca 0.00 1.75 -0.31 0.00 -1.00 0.00 0.00 55.97 56.41 3hrc s LYS 86 Cb 0.00 -2.27 -0.07 0.00 -2.06 0.00 0.00 37.83 33.43 3hrc s LYS 86 CO 0.00 -0.69 1.34 0.42 0.10 0.00 0.00 175.35 176.52 3hrc s ILE 87 N -1.60 3.48 -0.03 3.79 1.01 -1.26 -1.43 121.20 125.15 3hrc s ILE 87 Ca 0.67 1.07 -0.05 0.00 0.00 0.00 0.00 60.65 62.34 3hrc s ILE 87 Cb -0.28 -3.68 -0.28 0.00 0.01 0.00 0.00 42.46 38.23 3hrc s ILE 87 CO 0.33 0.09 0.72 -0.07 0.00 0.00 0.00 174.94 176.00 3hrc h LEU 88 N 6.75 0.43 -7.77 2.97 3.38 -0.35 -3.47 115.31 117.26 3hrc h LEU 88 Ca -0.42 -0.68 0.39 0.00 0.09 0.00 0.00 57.88 57.27 3hrc h LEU 88 Cb 1.21 -0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.73 3hrc h LEU 88 CO 0.85 1.57 0.99 -0.83 0.09 0.00 0.00 178.44 181.11 3hrc s GLY 89 N -5.10 -0.26 -0.01 0.83 0.00 -1.06 -4.99 107.32 96.73 3hrc s GLY 89 Ca -0.13 0.30 0.02 0.00 0.00 0.00 0.00 44.72 44.92 3hrc s GLY 89 CO 0.84 5.22 -0.08 -0.54 0.00 0.00 0.00 173.10 178.54 3hrc s GLU 90 N -2.03 0.71 0.51 2.90 2.02 -1.26 -0.41 118.70 121.14 3hrc s GLU 90 Ca 0.28 -0.28 0.05 0.00 0.02 0.00 0.00 54.97 55.05 3hrc s GLU 90 Cb 0.02 -0.68 0.05 0.00 0.10 0.00 0.00 34.13 33.62 3hrc s GLU 90 CO -0.03 0.15 0.44 0.41 0.02 0.00 0.00 175.26 176.25 3hrc n GLY 91 N 3.02 2.63 0.27 -1.39 0.00 0.23 -4.98 105.19 104.96 3hrc n GLY 91 Ca -0.15 -2.28 -0.01 0.00 0.00 0.00 0.00 46.02 43.58 3hrc n GLY 91 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hrc h SER 92 N 0.52 0.53 0.00 1.61 4.64 -2.03 -3.26 113.55 115.56 3hrc h SER 92 Ca -0.31 -0.12 -0.07 0.00 -0.47 0.00 0.00 61.79 60.83 3hrc h SER 92 Cb 1.17 -0.14 -0.14 0.00 -0.31 0.00 0.00 62.40 62.98 3hrc h SER 92 CO 0.48 0.63 -0.64 2.22 -0.87 0.00 0.00 176.83 178.65 3hrc n PHE 93 N -4.24 0.00 -3.44 4.77 1.16 -1.26 -5.08 117.46 109.37 3hrc n PHE 93 Ca 0.01 -0.94 -0.12 0.00 -1.87 0.00 0.00 57.45 54.53 3hrc n PHE 93 Cb 0.28 -0.18 -0.02 0.00 -1.61 0.00 0.00 39.48 37.94 3hrc n PHE 93 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3hrc s SER 94 N -2.54 -0.57 -0.04 5.98 1.04 -1.23 -4.35 113.70 111.99 3hrc s SER 94 Ca 0.32 0.08 0.02 0.00 0.48 0.00 0.00 55.95 56.85 3hrc s SER 94 Cb 0.33 0.58 0.01 0.00 0.10 0.00 0.00 66.02 67.04 3hrc s SER 94 CO -0.09 -0.91 -0.10 -0.89 0.98 0.00 0.00 173.24 172.22 3hrc s THR 95 N -3.45 0.94 -0.22 2.02 2.01 -0.90 0.74 115.64 116.78 3hrc s THR 95 Ca -0.00 -0.41 -0.07 0.00 0.31 0.00 0.00 61.69 61.52 3hrc s THR 95 Cb -0.01 -0.85 -0.03 0.00 0.01 0.00 0.00 72.50 71.62 3hrc s THR 95 CO -0.10 0.30 0.05 -0.69 -0.69 0.00 0.00 174.62 173.48 3hrc s VAL 96 N 0.42 4.31 -0.03 3.82 1.01 0.45 -0.76 120.40 129.61 3hrc s VAL 96 Ca -0.08 -0.18 0.06 0.00 0.00 0.00 0.00 61.98 61.77 3hrc s VAL 96 Cb -0.12 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 3hrc s VAL 96 CO 0.02 0.39 -0.21 -0.69 0.00 0.00 0.00 175.10 174.61 3hrc s VAL 97 N 1.18 1.67 0.03 2.92 1.01 0.32 0.44 120.40 127.97 3hrc s VAL 97 Ca 0.04 -0.88 -0.30 0.00 0.00 0.00 0.00 61.98 60.84 3hrc s VAL 97 Cb -0.14 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.79 3hrc s VAL 97 CO 0.03 0.47 1.13 -0.22 0.00 0.00 0.00 175.10 176.51 3hrc s LEU 98 N -0.27 4.36 0.02 3.92 2.96 -0.52 0.01 118.68 129.17 3hrc s LEU 98 Ca 0.02 1.88 0.02 0.00 -0.22 0.00 0.00 54.13 55.83 3hrc s LEU 98 Cb -0.10 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 3hrc s LEU 98 CO 0.01 -0.41 -0.06 0.00 -1.32 0.00 0.00 176.35 174.56 3hrc s ALA 99 N 1.14 0.48 -0.19 5.97 0.00 -0.41 0.11 121.76 128.86 3hrc s ALA 99 Ca 0.56 -0.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.93 3hrc s ALA 99 Cb -0.26 0.00 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 3hrc s ALA 99 CO 0.28 0.01 -0.06 0.50 0.00 0.00 0.00 175.76 176.49 3hrc s ARG 100 N -1.07 3.42 -0.10 0.00 3.00 0.00 -0.90 118.95 123.31 3hrc s ARG 100 Ca -0.06 -0.62 -0.30 0.00 -1.00 0.00 0.00 55.73 53.75 3hrc s ARG 100 Cb -0.07 -2.92 -0.03 0.00 0.00 0.00 0.00 34.95 31.93 3hrc s ARG 100 CO 0.00 -0.05 1.37 -2.00 0.00 0.00 0.00 175.30 174.62 3hrc s GLU 101 N 1.09 4.24 0.23 5.12 2.12 0.26 -0.20 118.70 131.57 3hrc s GLU 101 Ca 0.01 1.83 -0.08 0.00 0.36 0.00 0.00 54.97 57.09 3hrc s GLU 101 Cb -0.15 -3.76 0.21 0.00 0.26 0.00 0.00 34.13 30.70 3hrc s GLU 101 CO -0.01 -0.69 1.90 -0.07 -0.54 0.00 0.00 175.26 175.86 3hrc h LEU 102 N 9.43 1.03 -1.03 2.70 3.38 -1.43 0.43 115.31 129.82 3hrc h LEU 102 Ca -0.32 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.59 3hrc h LEU 102 Cb 1.14 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 3hrc h LEU 102 CO 0.94 0.76 -0.11 0.00 0.09 0.00 0.00 178.44 180.12 3hrc h ALA 103 N 1.32 0.99 0.00 1.53 0.00 -1.92 -3.33 119.26 117.85 3hrc h ALA 103 Ca 0.32 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3hrc h ALA 103 Cb -0.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3hrc h ALA 103 CO -0.07 0.14 -0.70 0.25 0.00 0.00 0.00 179.25 178.87 3hrc n THR 104 N -3.22 0.00 -1.02 0.00 -2.24 -1.12 -5.01 114.28 101.68 3hrc n THR 104 Ca 0.01 -0.05 -0.01 0.00 -2.27 0.00 0.00 64.05 61.73 3hrc n THR 104 Cb 0.41 0.48 -0.00 0.00 -2.10 0.00 0.00 70.33 69.12 3hrc n THR 104 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3hrc n SER 105 N -1.15 -4.69 -4.78 3.42 7.64 0.15 -5.01 113.62 109.19 3hrc n SER 105 Ca 0.00 0.01 -0.36 0.00 1.01 0.00 0.00 58.87 59.53 3hrc n SER 105 Cb 0.00 -2.24 -0.04 0.00 -1.01 0.00 0.00 64.21 60.93 3hrc n SER 105 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3hrc s ARG 106 N -1.22 4.07 -0.15 1.43 0.52 -1.24 -4.75 118.95 117.61 3hrc s ARG 106 Ca 0.00 1.53 -0.12 0.00 -0.52 0.00 0.00 55.73 56.62 3hrc s ARG 106 Cb 0.00 -2.48 -0.05 0.00 0.52 0.00 0.00 34.95 32.95 3hrc s ARG 106 CO 0.00 -0.23 0.24 -1.21 0.02 0.00 0.00 175.30 174.12 3hrc s GLU 107 N -2.60 4.08 0.08 3.54 2.02 -1.26 -0.57 118.70 123.99 3hrc s GLU 107 Ca 0.60 0.02 0.05 0.00 0.02 0.00 0.00 54.97 55.66 3hrc s GLU 107 Cb -0.22 -3.37 -0.03 0.00 0.10 0.00 0.00 34.13 30.61 3hrc s GLU 107 CO 0.28 0.38 -0.14 0.71 0.02 0.00 0.00 175.26 176.50 3hrc s TYR 108 N 0.07 1.25 -0.33 1.61 2.02 -0.08 -4.53 117.35 117.37 3hrc s TYR 108 Ca 0.15 -0.47 -0.20 0.00 -0.37 0.00 0.00 57.07 56.18 3hrc s TYR 108 Cb -0.13 -0.70 -0.01 0.00 -0.40 0.00 0.00 41.96 40.73 3hrc s TYR 108 CO 0.03 0.07 0.60 0.00 -1.57 0.00 0.00 175.55 174.68 3hrc s ALA 109 N -1.39 3.50 -0.25 3.71 0.00 0.06 -1.29 121.76 126.09 3hrc s ALA 109 Ca -0.00 -0.79 -0.08 0.00 0.00 0.00 0.00 51.96 51.09 3hrc s ALA 109 Cb -0.09 -3.09 -0.03 0.00 0.00 0.00 0.00 23.12 19.90 3hrc s ALA 109 CO 0.02 -1.17 0.10 0.42 0.00 0.00 0.00 175.76 175.13 3hrc s ILE 110 N 2.58 4.59 -0.19 0.00 1.01 0.10 -0.43 121.20 128.85 3hrc s ILE 110 Ca 0.23 -0.08 -0.16 0.00 0.00 0.00 0.00 60.65 60.64 3hrc s ILE 110 Cb -0.15 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 3hrc s ILE 110 CO 0.13 0.33 0.42 -0.75 0.00 0.00 0.00 174.94 175.06 3hrc s LYS 111 N 1.56 4.19 -0.15 2.79 2.20 0.08 -0.52 119.74 129.89 3hrc s LYS 111 Ca 0.06 0.24 0.02 0.00 -0.36 0.00 0.00 55.97 55.93 3hrc s LYS 111 Cb -0.15 -3.53 0.01 0.00 -1.51 0.00 0.00 37.83 32.65 3hrc s LYS 111 CO 0.05 -0.03 -0.20 0.42 -0.36 0.00 0.00 175.35 175.23 3hrc s ILE 112 N 1.27 1.98 -0.08 5.43 1.01 0.06 -0.40 121.20 130.47 3hrc s ILE 112 Ca 0.20 -0.92 0.05 0.00 0.00 0.00 0.00 60.65 59.98 3hrc s ILE 112 Cb -0.15 -1.77 -0.01 0.00 0.01 0.00 0.00 42.46 40.54 3hrc s ILE 112 CO 0.08 0.53 -0.23 -0.76 0.00 0.00 0.00 174.94 174.56 3hrc s LEU 113 N 0.98 2.15 -0.18 2.97 1.02 -0.15 -2.13 118.68 123.35 3hrc s LEU 113 Ca -0.03 -0.50 -0.29 0.00 0.02 0.00 0.00 54.13 53.32 3hrc s LEU 113 Cb -0.15 -1.41 -0.00 0.00 0.02 0.00 0.00 46.19 44.65 3hrc s LEU 113 CO -0.05 0.22 1.08 -0.70 0.02 0.00 0.00 176.35 176.91 3hrc s GLU 114 N 0.01 4.30 0.20 1.70 -6.30 -1.26 -1.21 118.70 116.14 3hrc s GLU 114 Ca -0.08 1.43 -0.08 0.00 -2.50 0.00 0.00 54.97 53.74 3hrc s GLU 114 Cb -0.15 -3.63 0.13 0.00 0.00 0.00 0.00 34.13 30.48 3hrc s GLU 114 CO 0.05 -0.56 1.74 0.87 0.02 0.00 0.00 175.26 177.38 3hrc h LYS 115 N 7.48 1.17 -0.62 4.30 1.57 -1.01 -1.51 116.57 127.94 3hrc h LYS 115 Ca -0.24 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.19 3hrc h LYS 115 Cb 1.09 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.22 3hrc h LYS 115 CO 0.94 1.00 0.02 0.00 -0.57 0.00 0.00 179.45 180.84 3hrc h ARG 116 N 1.12 1.08 -0.31 3.15 2.47 -1.93 -2.14 114.38 117.81 3hrc h ARG 116 Ca 0.24 -0.33 -0.10 0.00 -1.26 0.00 0.00 59.98 58.53 3hrc h ARG 116 Cb 0.32 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.53 3hrc h ARG 116 CO -0.01 1.04 -0.18 1.25 0.56 0.00 0.00 179.97 182.63 3hrc h HIS 117 N 0.99 0.78 -0.20 3.04 -0.00 -1.87 -1.22 115.15 116.66 3hrc h HIS 117 Ca 0.18 -0.20 -0.16 0.00 -0.00 0.00 0.00 60.37 60.19 3hrc h HIS 117 Cb 0.54 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.76 3hrc h HIS 117 CO 0.04 0.90 -0.52 -0.84 -0.00 0.00 0.00 177.93 177.51 3hrc h ILE 118 N 0.42 1.31 0.13 6.26 3.07 -1.29 -0.83 117.51 126.58 3hrc h ILE 118 Ca 0.07 -1.75 -0.01 0.00 1.55 0.00 0.00 64.86 64.72 3hrc h ILE 118 Cb 0.72 1.72 0.00 0.00 -0.27 0.00 0.00 36.82 38.99 3hrc h ILE 118 CO 0.05 0.55 -0.06 0.40 -1.05 0.00 0.00 178.15 178.04 3hrc h ILE 119 N 0.45 0.98 -0.65 0.16 2.04 -1.42 0.37 117.51 119.44 3hrc h ILE 119 Ca 0.02 -0.43 -0.08 0.00 1.00 0.00 0.00 64.86 65.37 3hrc h ILE 119 Cb 1.06 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.36 3hrc h ILE 119 CO 0.10 0.10 0.09 0.11 0.00 0.00 0.00 178.15 178.55 3hrc h LYS 120 N -0.37 1.08 -0.54 2.37 1.57 -1.23 -2.95 116.57 116.50 3hrc h LYS 120 Ca -0.02 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 3hrc h LYS 120 Cb 0.30 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3hrc h LYS 120 CO 0.03 1.00 0.00 0.39 -0.57 0.00 0.00 179.45 180.30 3hrc n GLU 121 N -4.21 2.45 -3.18 3.15 -0.58 -0.32 -4.94 120.64 113.02 3hrc n GLU 121 Ca 0.04 -1.74 -0.23 0.00 -0.42 0.00 0.00 57.16 54.81 3hrc n GLU 121 Cb 0.30 -1.54 0.05 0.00 -0.57 0.00 0.00 31.44 29.68 3hrc n GLU 121 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3hrc n ASN 122 N 0.71 -6.20 -0.20 1.62 4.13 -0.96 -4.93 115.26 109.44 3hrc n ASN 122 Ca 0.16 -0.36 0.12 0.00 1.68 0.00 0.00 54.58 56.18 3hrc n ASN 122 Cb 0.52 -4.97 0.15 0.00 -1.54 0.00 0.00 39.78 33.94 3hrc n ASN 122 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3hrc n LYS 123 N -4.30 0.55 -0.32 3.52 4.76 0.13 -4.48 118.16 118.02 3hrc n LYS 123 Ca -0.08 -0.40 0.05 0.00 -2.87 0.00 0.00 58.31 55.02 3hrc n LYS 123 Cb 0.60 -1.49 0.21 0.00 -1.84 0.00 0.00 35.03 32.51 3hrc n LYS 123 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3hrc h VAL 124 N 0.97 0.89 -0.89 -0.18 2.07 -1.90 0.18 116.25 117.38 3hrc h VAL 124 Ca 0.00 -0.29 0.11 0.00 0.82 0.00 0.00 66.70 67.34 3hrc h VAL 124 Cb 0.56 -0.04 -0.07 0.00 -1.52 0.00 0.00 31.29 30.23 3hrc h VAL 124 CO 0.00 0.16 0.58 -0.65 0.02 0.00 0.00 177.57 177.67 3hrc h PRO 125 N 0.85 0.81 -0.23 1.57 0.11 -1.93 0.01 132.00 133.19 3hrc h PRO 125 Ca 0.45 -0.05 -0.20 0.00 0.11 0.00 0.00 66.00 66.31 3hrc h PRO 125 Cb 0.46 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.39 3hrc h PRO 125 CO -0.27 0.54 -0.64 1.88 -0.21 0.00 0.00 178.00 179.29 3hrc h TYR 126 N 0.84 1.07 -0.01 0.65 0.05 -1.25 -0.83 116.97 117.49 3hrc h TYR 126 Ca 0.43 -0.42 -0.00 0.00 0.05 0.00 0.00 58.73 58.79 3hrc h TYR 126 Cb 0.49 -0.19 -0.00 0.00 1.01 0.00 0.00 36.73 38.05 3hrc h TYR 126 CO -0.00 1.25 0.00 0.28 -1.05 0.00 0.00 178.16 178.64 3hrc h VAL 127 N 0.61 1.11 -0.46 -2.88 2.07 -0.95 -0.20 116.25 115.55 3hrc h VAL 127 Ca -0.01 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.17 3hrc h VAL 127 Cb 1.26 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.34 3hrc h VAL 127 CO 0.14 0.09 0.29 0.74 0.02 0.00 0.00 177.57 178.85 3hrc h THR 128 N -0.13 1.13 -0.31 2.57 2.02 -1.04 -2.24 112.91 114.91 3hrc h THR 128 Ca 0.00 -0.25 0.03 0.00 0.77 0.00 0.00 66.41 66.96 3hrc h THR 128 Cb 0.14 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 3hrc h THR 128 CO -0.00 0.12 0.13 -0.09 0.37 0.00 0.00 175.52 176.06 3hrc h ARG 129 N 0.62 0.28 -0.60 6.66 9.65 -1.08 -0.35 114.38 129.55 3hrc h ARG 129 Ca 0.17 -0.02 0.06 0.00 -1.10 0.00 0.00 59.98 59.09 3hrc h ARG 129 Cb -0.05 -0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.41 3hrc h ARG 129 CO -0.03 0.18 0.30 1.49 2.80 0.00 0.00 179.97 184.71 3hrc h GLU 130 N 0.28 0.55 -0.19 0.20 4.81 -0.81 0.07 114.58 119.49 3hrc h GLU 130 Ca 0.13 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.29 3hrc h GLU 130 Cb 0.07 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3hrc h GLU 130 CO -0.11 0.36 -0.01 -0.09 -0.73 0.00 0.00 179.01 178.43 3hrc h ARG 131 N 0.57 0.35 0.01 1.92 2.43 -1.16 -1.31 114.38 117.19 3hrc h ARG 131 Ca 0.27 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3hrc h ARG 131 Cb 0.21 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 3hrc h ARG 131 CO -0.20 0.57 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.38 3hrc h ASP 132 N 0.10 -0.02 0.04 -3.80 3.32 -0.88 -1.33 116.42 113.85 3hrc h ASP 132 Ca 0.05 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hrc h ASP 132 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 3hrc h ASP 132 CO 0.01 0.04 -0.02 0.58 -1.72 0.00 0.00 179.24 178.13 3hrc h VAL 133 N -0.07 1.04 -0.26 -1.35 2.07 -1.02 -3.18 116.25 113.48 3hrc h VAL 133 Ca -0.00 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 3hrc h VAL 133 Cb 0.06 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 3hrc h VAL 133 CO 0.00 0.06 0.01 0.24 0.02 0.00 0.00 177.57 177.91 3hrc h MET 134 N -0.17 0.38 0.00 1.57 2.86 -1.21 -1.84 114.93 116.53 3hrc h MET 134 Ca -0.01 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3hrc h MET 134 Cb 0.15 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.74 3hrc h MET 134 CO 0.01 0.40 -0.06 0.77 1.06 0.00 0.00 176.91 179.09 3hrc h SER 135 N 0.37 0.00 1.60 1.22 0.02 -1.22 -2.32 113.55 113.22 3hrc h SER 135 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3hrc h SER 135 Cb 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 3hrc h SER 135 CO 0.00 0.06 -0.01 0.03 -1.14 0.00 0.00 176.83 175.78 3hrc h ARG 136 N 0.00 0.00 -5.91 3.45 3.08 -1.34 -3.47 114.38 110.19 3hrc h ARG 136 Ca -0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 3hrc h ARG 136 Cb 0.13 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.12 3hrc h ARG 136 CO 0.01 0.00 -0.19 -0.51 -1.07 0.00 0.00 179.97 178.21 3hrc s LEU 137 N -4.93 4.41 -0.46 3.04 1.43 -0.87 -5.01 118.68 116.29 3hrc s LEU 137 Ca 0.10 0.90 0.06 0.00 -1.03 0.00 0.00 54.13 54.16 3hrc s LEU 137 Cb 0.11 -2.60 0.22 0.00 0.03 0.00 0.00 46.19 43.94 3hrc s LEU 137 CO 0.62 0.23 0.69 -0.67 0.23 0.00 0.00 176.35 177.45 3hrc n ASP 138 N 2.37 -2.05 -3.78 2.29 2.03 -1.26 -4.88 116.55 111.28 3hrc n ASP 138 Ca -0.12 -2.94 -0.13 0.00 0.52 0.00 0.00 54.79 52.12 3hrc n ASP 138 Cb 0.52 0.94 -0.11 0.00 -0.72 0.00 0.00 41.12 41.76 3hrc n ASP 138 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 3hrc s HIS 139 N 0.25 -0.28 -0.59 -0.67 2.46 -1.26 -5.06 115.29 110.14 3hrc s HIS 139 Ca 0.32 0.67 0.15 0.00 0.47 0.00 0.00 55.06 56.67 3hrc s HIS 139 Cb 0.13 0.10 0.73 0.00 -0.13 0.00 0.00 32.58 33.41 3hrc s HIS 139 CO -0.16 -0.19 1.46 -0.35 -2.47 0.00 0.00 174.74 173.03 3hrc n PRO 140 N 2.63 0.09 -0.68 2.88 -0.04 -1.26 -2.65 135.00 135.97 3hrc n PRO 140 Ca -0.14 0.50 0.08 0.00 -0.04 0.00 0.00 63.50 63.90 3hrc n PRO 140 Cb 0.58 -1.75 0.36 0.00 -0.04 0.00 0.00 33.50 32.64 3hrc n PRO 140 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3hrc n PHE 141 N -1.94 1.61 -4.48 0.54 3.72 -1.26 -4.81 117.46 110.84 3hrc n PHE 141 Ca 0.00 -0.60 -0.22 0.00 -0.05 0.00 0.00 57.45 56.58 3hrc n PHE 141 Cb 0.08 -0.32 -0.14 0.00 -0.94 0.00 0.00 39.48 38.16 3hrc n PHE 141 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3hrc s PHE 142 N -2.11 1.37 0.29 1.38 0.08 -1.09 -0.64 117.98 117.25 3hrc s PHE 142 Ca 0.49 -0.34 -0.30 0.00 0.12 0.00 0.00 56.93 56.91 3hrc s PHE 142 Cb 0.34 -0.83 -0.11 0.00 -0.57 0.00 0.00 43.02 41.85 3hrc s PHE 142 CO 0.21 0.04 1.53 0.08 -0.10 0.00 0.00 175.22 176.97 3hrc s VAL 143 N -0.74 2.26 -0.09 -0.44 1.01 -0.13 -4.73 120.40 117.53 3hrc s VAL 143 Ca 0.04 0.22 -0.11 0.00 0.00 0.00 0.00 61.98 62.13 3hrc s VAL 143 Cb -0.08 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.11 3hrc s VAL 143 CO 0.01 0.04 0.26 -0.75 0.00 0.00 0.00 175.10 174.66 3hrc s LYS 144 N -0.65 3.80 -0.42 2.72 2.20 -1.26 -4.92 119.74 121.20 3hrc s LYS 144 Ca 0.61 0.09 -0.21 0.00 -0.36 0.00 0.00 55.97 56.10 3hrc s LYS 144 Cb -0.46 -3.26 0.02 0.00 -1.51 0.00 0.00 37.83 32.62 3hrc s LYS 144 CO 0.48 0.62 0.65 -1.17 -0.36 0.00 0.00 175.35 175.58 3hrc s LEU 145 N -0.69 4.42 -0.05 5.43 2.96 -1.26 -1.52 118.68 127.97 3hrc s LEU 145 Ca 0.18 -0.21 0.02 0.00 -0.22 0.00 0.00 54.13 53.91 3hrc s LEU 145 Cb -0.14 -2.76 -0.25 0.00 0.50 0.00 0.00 46.19 43.54 3hrc s LEU 145 CO 0.07 -0.75 0.64 1.88 -1.32 0.00 0.00 176.35 176.87 3hrc h TYR 146 N 8.79 0.27 -2.16 5.38 -1.99 -0.95 -3.46 116.97 122.84 3hrc h TYR 146 Ca -0.26 -0.19 0.14 0.00 2.00 0.00 0.00 58.73 60.42 3hrc h TYR 146 Cb 1.10 -0.01 -0.15 0.00 2.00 0.00 0.00 36.73 39.67 3hrc h TYR 146 CO 0.74 1.34 0.54 -0.59 -0.00 0.00 0.00 178.16 180.19 3hrc s PHE 147 N -2.59 -0.29 0.02 4.88 -0.12 -1.22 -5.01 117.98 113.65 3hrc s PHE 147 Ca -0.11 0.15 0.01 0.00 -0.05 0.00 0.00 56.93 56.93 3hrc s PHE 147 Cb 0.07 0.55 -0.01 0.00 -0.63 0.00 0.00 43.02 42.99 3hrc s PHE 147 CO 0.81 -0.52 -0.05 0.95 -0.05 0.00 0.00 175.22 176.37 3hrc s THR 148 N -3.03 0.31 0.31 -4.49 -4.23 -1.26 -0.57 115.64 102.68 3hrc s THR 148 Ca 0.06 -0.64 0.04 0.00 -1.18 0.00 0.00 61.69 59.97 3hrc s THR 148 Cb -0.01 -0.36 -0.03 0.00 1.34 0.00 0.00 72.50 73.45 3hrc s THR 148 CO -0.07 -0.22 0.29 0.72 -0.54 0.00 0.00 174.62 174.79 3hrc s PHE 149 N -0.84 1.51 0.07 3.99 -0.12 -0.55 -4.48 117.98 117.55 3hrc s PHE 149 Ca -0.07 -1.53 -0.15 0.00 -0.05 0.00 0.00 56.93 55.13 3hrc s PHE 149 Cb -0.06 -0.57 0.03 0.00 -0.63 0.00 0.00 43.02 41.78 3hrc s PHE 149 CO -0.00 -0.87 0.34 1.14 -0.05 0.00 0.00 175.22 175.78 3hrc s GLN 150 N -3.53 0.91 0.00 1.99 -2.07 -1.26 -0.66 119.66 115.04 3hrc s GLN 150 Ca 0.38 -0.58 0.00 0.00 -1.82 0.00 0.00 55.36 53.34 3hrc s GLN 150 Cb 0.03 0.40 0.00 0.00 -1.09 0.00 0.00 33.01 32.34 3hrc s GLN 150 CO 0.23 -0.32 0.00 -0.40 -1.32 0.00 0.00 175.29 173.49 3hrc n ASP 151 N 0.26 0.84 0.12 12.60 5.68 -0.24 -5.00 116.55 130.81 3hrc n ASP 151 Ca -0.17 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.12 3hrc n ASP 151 Cb 0.61 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 40.89 3hrc n ASP 151 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3hrc h ASP 152 N 0.00 0.19 0.00 -1.12 3.32 -2.03 -3.33 116.42 113.45 3hrc h ASP 152 Ca 0.00 -0.06 -0.13 0.00 0.02 0.00 0.00 57.03 56.85 3hrc h ASP 152 Cb 0.00 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 3hrc h ASP 152 CO 0.00 0.51 -1.75 -0.62 -1.72 0.00 0.00 179.24 175.66 3hrc n GLU 153 N -4.11 1.32 -4.00 3.56 4.71 -1.26 -4.93 120.64 115.93 3hrc n GLU 153 Ca -0.01 -0.05 -0.10 0.00 -0.01 0.00 0.00 57.16 56.98 3hrc n GLU 153 Cb 0.40 -1.32 -0.11 0.00 -1.01 0.00 0.00 31.44 29.40 3hrc n GLU 153 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 3hrc s LYS 154 N -2.56 0.37 -0.08 3.49 1.02 -1.25 -0.31 119.74 120.42 3hrc s LYS 154 Ca -0.06 -0.66 -0.05 0.00 0.02 0.00 0.00 55.97 55.22 3hrc s LYS 154 Cb 0.06 0.02 -0.04 0.00 -0.52 0.00 0.00 37.83 37.35 3hrc s LYS 154 CO 0.53 -0.03 0.15 -0.51 -0.92 0.00 0.00 175.35 174.57 3hrc s LEU 155 N -1.53 4.37 -0.07 3.17 1.43 -0.35 -1.08 118.68 124.63 3hrc s LEU 155 Ca -0.14 0.42 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 3hrc s LEU 155 Cb -0.10 -2.27 0.01 0.00 0.03 0.00 0.00 46.19 43.86 3hrc s LEU 155 CO -0.01 0.35 -0.14 -0.31 0.23 0.00 0.00 176.35 176.47 3hrc s TYR 156 N -1.14 1.64 -0.23 0.29 1.51 0.17 -0.98 117.35 118.61 3hrc s TYR 156 Ca 0.20 -0.60 -0.03 0.00 -1.01 0.00 0.00 57.07 55.63 3hrc s TYR 156 Cb -0.12 -1.16 0.00 0.00 -0.11 0.00 0.00 41.96 40.57 3hrc s TYR 156 CO 0.10 -0.28 -0.05 -0.06 -1.11 0.00 0.00 175.55 174.14 3hrc s PHE 157 N 0.53 2.97 -0.34 2.71 0.08 0.46 -1.49 117.98 122.91 3hrc s PHE 157 Ca -0.14 -1.14 -0.22 0.00 0.12 0.00 0.00 56.93 55.55 3hrc s PHE 157 Cb -0.15 -2.09 0.00 0.00 -0.57 0.00 0.00 43.02 40.21 3hrc s PHE 157 CO 0.04 -0.62 0.73 0.20 -0.10 0.00 0.00 175.22 175.48 3hrc s GLY 158 N 1.43 1.71 0.20 4.36 0.00 0.27 -0.74 107.32 114.54 3hrc s GLY 158 Ca 0.04 -0.62 0.10 0.00 0.00 0.00 0.00 44.72 44.24 3hrc s GLY 158 CO -0.04 1.66 -0.14 1.08 0.00 0.00 0.00 173.10 175.66 3hrc s LEU 159 N 2.91 2.81 0.37 0.66 1.43 0.42 -0.20 118.68 127.08 3hrc s LEU 159 Ca 0.29 -0.70 -0.28 0.00 -1.03 0.00 0.00 54.13 52.41 3hrc s LEU 159 Cb -0.14 -1.48 -0.11 0.00 0.03 0.00 0.00 46.19 44.50 3hrc s LEU 159 CO 0.14 0.09 1.43 -0.94 0.23 0.00 0.00 176.35 177.31 3hrc s SER 160 N -2.91 6.44 -0.34 2.29 1.04 -0.57 -0.76 113.70 118.88 3hrc s SER 160 Ca 0.25 2.93 -0.25 0.00 0.48 0.00 0.00 55.95 59.36 3hrc s SER 160 Cb -0.08 -2.66 0.01 0.00 0.10 0.00 0.00 66.02 63.39 3hrc s SER 160 CO 0.14 -0.79 0.88 -0.47 0.98 0.00 0.00 173.24 173.97 3hrc s TYR 161 N -1.14 3.13 -0.72 5.02 5.04 -1.26 -4.42 117.35 123.00 3hrc s TYR 161 Ca 0.52 0.79 -0.17 0.00 -2.44 0.00 0.00 57.07 55.76 3hrc s TYR 161 Cb -0.44 -3.48 0.14 0.00 0.35 0.00 0.00 41.96 38.53 3hrc s TYR 161 CO 0.60 -0.73 0.80 0.00 -1.34 0.00 0.00 175.55 174.87 3hrc s ALA 162 N 3.28 3.60 0.49 3.97 0.00 -1.26 -4.75 121.76 127.08 3hrc s ALA 162 Ca 0.36 -2.65 0.14 0.00 0.00 0.00 0.00 51.96 49.80 3hrc s ALA 162 Cb -0.13 -3.62 1.16 0.00 0.00 0.00 0.00 23.12 20.53 3hrc s ALA 162 CO 0.16 -2.45 2.12 -0.22 0.00 0.00 0.00 175.76 175.38 3hrc h LYS 163 N 8.72 0.13 -0.34 0.00 3.64 -1.81 -2.80 116.57 124.11 3hrc h LYS 163 Ca -0.09 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 3hrc h LYS 163 Cb 1.06 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 3hrc h LYS 163 CO 1.01 0.09 0.00 0.09 -2.27 0.00 0.00 179.45 178.37 3hrc n ASN 164 N -4.52 2.77 0.00 4.20 3.02 -0.12 -4.95 115.26 115.66 3hrc n ASN 164 Ca -0.02 -1.90 0.00 0.00 -0.03 0.00 0.00 54.58 52.63 3hrc n ASN 164 Cb 0.09 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 3hrc n ASN 164 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hrc n GLY 165 N 1.36 -0.17 3.81 7.41 0.00 -1.06 -4.70 105.19 111.84 3hrc n GLY 165 Ca 0.18 -1.02 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 3hrc n GLY 165 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hrc s GLU 166 N 0.00 4.28 0.42 1.61 2.02 -1.26 -0.80 118.70 124.97 3hrc s GLU 166 Ca 0.00 0.89 0.12 0.00 0.02 0.00 0.00 54.97 56.01 3hrc s GLU 166 Cb 0.00 -2.92 0.98 0.00 0.10 0.00 0.00 34.13 32.30 3hrc s GLU 166 CO 0.00 0.41 1.98 1.25 0.02 0.00 0.00 175.26 178.93 3hrc h LEU 167 N 3.51 0.41 -1.13 1.80 5.85 -0.45 -2.33 115.31 122.98 3hrc h LEU 167 Ca -0.48 0.01 0.13 0.00 0.84 0.00 0.00 57.88 58.38 3hrc h LEU 167 Cb 1.19 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 42.07 3hrc h LEU 167 CO 0.65 0.25 0.61 0.25 -0.34 0.00 0.00 178.44 179.86 3hrc h LEU 168 N 0.46 0.81 -0.95 2.25 5.85 -1.77 -1.70 115.31 120.26 3hrc h LEU 168 Ca 0.27 0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.07 3hrc h LEU 168 Cb 0.46 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.32 3hrc h LEU 168 CO -0.08 0.42 0.62 0.50 -0.34 0.00 0.00 178.44 179.57 3hrc h LYS 169 N 0.87 1.17 -0.20 1.25 3.64 -1.75 -1.61 116.57 119.93 3hrc h LYS 169 Ca 0.48 -0.07 -0.18 0.00 -1.27 0.00 0.00 60.65 59.60 3hrc h LYS 169 Cb 0.59 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 3hrc h LYS 169 CO -0.24 0.77 -0.61 1.88 -2.27 0.00 0.00 179.45 178.98 3hrc h TYR 170 N 1.20 0.87 -0.82 1.91 0.05 -1.44 -1.58 116.97 117.17 3hrc h TYR 170 Ca 0.38 -0.33 0.01 0.00 0.05 0.00 0.00 58.73 58.83 3hrc h TYR 170 Cb -0.00 -0.16 -0.04 0.00 1.01 0.00 0.00 36.73 37.54 3hrc h TYR 170 CO -0.01 1.12 0.54 0.82 -1.05 0.00 0.00 178.16 179.58 3hrc h ILE 171 N 0.51 1.21 -0.42 -2.88 2.04 -1.03 -2.14 117.51 114.79 3hrc h ILE 171 Ca -0.01 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.37 3hrc h ILE 171 Cb 1.20 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 3hrc h ILE 171 CO 0.12 0.20 -0.14 0.03 0.00 0.00 0.00 178.15 178.37 3hrc h ARG 172 N 1.11 0.84 0.32 2.37 3.08 -1.16 0.17 114.38 121.10 3hrc h ARG 172 Ca 0.30 -0.34 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 3hrc h ARG 172 Cb -0.13 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 29.89 3hrc h ARG 172 CO -0.07 0.97 -0.15 -0.22 -1.07 0.00 0.00 179.97 179.43 3hrc h LYS 173 N 0.66 -0.41 0.00 0.04 3.64 -1.19 -3.32 116.57 115.99 3hrc h LYS 173 Ca 0.10 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 3hrc h LYS 173 Cb 0.68 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.59 3hrc h LYS 173 CO 0.05 -0.08 -0.83 -0.84 -2.27 0.00 0.00 179.45 175.48 3hrc h ILE 174 N -0.82 0.05 0.00 2.00 3.07 -1.48 -3.49 117.51 116.84 3hrc h ILE 174 Ca -0.04 -1.09 0.00 0.00 1.55 0.00 0.00 64.86 65.28 3hrc h ILE 174 Cb 0.52 1.65 0.00 0.00 -0.27 0.00 0.00 36.82 38.71 3hrc h ILE 174 CO 0.07 0.03 0.00 0.61 -1.05 0.00 0.00 178.15 177.81 3hrc n GLY 175 N 1.18 2.88 3.48 0.16 0.00 0.59 -4.90 105.19 108.57 3hrc n GLY 175 Ca 0.00 -0.75 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 3hrc n GLY 175 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hrc s SER 176 N 0.00 -0.48 0.12 1.61 1.04 -1.26 -3.86 113.70 110.88 3hrc s SER 176 Ca 0.00 0.10 -0.12 0.00 0.48 0.00 0.00 55.95 56.41 3hrc s SER 176 Cb 0.00 0.48 -0.06 0.00 0.10 0.00 0.00 66.02 66.54 3hrc s SER 176 CO 0.00 -0.74 0.47 -0.36 0.98 0.00 0.00 173.24 173.59 3hrc s PHE 177 N -3.03 3.59 1.27 5.02 0.40 0.55 -5.02 117.98 120.76 3hrc s PHE 177 Ca 0.01 0.91 -0.21 0.00 -0.60 0.00 0.00 56.93 57.04 3hrc s PHE 177 Cb -0.01 -2.26 0.32 0.00 0.51 0.00 0.00 43.02 41.58 3hrc s PHE 177 CO -0.08 0.47 1.08 0.16 0.70 0.00 0.00 175.22 177.55 3hrc s ASP 178 N -1.77 0.31 0.12 1.36 1.47 -1.26 -4.63 116.67 112.26 3hrc s ASP 178 Ca 0.36 0.56 -0.16 0.00 1.18 0.00 0.00 52.55 54.49 3hrc s ASP 178 Cb -0.14 -0.74 -0.02 0.00 -0.34 0.00 0.00 42.92 41.68 3hrc s ASP 178 CO 0.19 -4.49 1.60 -0.08 0.68 0.00 0.00 175.17 173.07 3hrc h GLU 179 N -2.84 0.63 -0.10 2.11 4.81 -1.99 -0.21 114.58 117.00 3hrc h GLU 179 Ca -0.42 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 58.65 3hrc h GLU 179 Cb 1.29 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 3hrc h GLU 179 CO 0.29 0.68 0.03 1.15 -0.73 0.00 0.00 179.01 180.43 3hrc h THR 180 N 0.47 0.98 -0.39 0.32 2.02 -1.99 0.93 112.91 115.26 3hrc h THR 180 Ca 0.12 -0.03 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 3hrc h THR 180 Cb 0.36 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 3hrc h THR 180 CO 0.01 0.02 0.15 0.00 0.37 0.00 0.00 175.52 176.07 3hrc h THR 182 N 0.48 0.70 -0.34 0.00 2.02 -0.87 -0.73 112.91 114.16 3hrc h THR 182 Ca 0.13 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 3hrc h THR 182 Cb 0.19 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 3hrc h THR 182 CO -0.01 0.00 0.19 -0.09 0.37 0.00 0.00 175.52 175.98 3hrc h ARG 183 N -0.03 0.48 -0.06 6.66 2.43 -0.69 0.52 114.38 123.69 3hrc h ARG 183 Ca 0.13 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3hrc h ARG 183 Cb 0.23 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3hrc h ARG 183 CO -0.29 0.39 0.02 0.35 -1.51 0.00 0.00 179.97 178.94 3hrc h PHE 184 N 0.43 0.09 -0.19 2.20 3.57 -0.83 -0.18 116.94 122.03 3hrc h PHE 184 Ca 0.12 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.48 3hrc h PHE 184 Cb 0.05 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 3hrc h PHE 184 CO -0.03 0.21 -0.47 1.88 -2.23 0.00 0.00 178.31 177.67 3hrc h TYR 185 N -0.06 0.59 -0.54 0.41 0.05 -1.09 -2.05 116.97 114.28 3hrc h TYR 185 Ca 0.02 -0.19 -0.03 0.00 0.05 0.00 0.00 58.73 58.58 3hrc h TYR 185 Cb 0.16 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 37.75 3hrc h TYR 185 CO -0.02 0.86 0.22 1.15 -1.05 0.00 0.00 178.16 179.32 3hrc h THR 186 N 0.39 1.22 -0.24 -2.88 2.02 -0.80 -1.77 112.91 110.84 3hrc h THR 186 Ca 0.02 -0.67 0.03 0.00 0.77 0.00 0.00 66.41 66.55 3hrc h THR 186 Cb 0.97 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 3hrc h THR 186 CO 0.09 0.26 0.08 0.00 0.37 0.00 0.00 175.52 176.31 3hrc h ALA 187 N 1.06 0.27 -1.01 6.16 0.00 -0.81 0.14 119.26 125.07 3hrc h ALA 187 Ca 0.18 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.19 3hrc h ALA 187 Cb 0.19 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.93 3hrc h ALA 187 CO -0.02 -0.34 0.65 0.93 0.00 0.00 0.00 179.25 180.48 3hrc h GLU 188 N 0.18 1.14 -0.27 0.00 5.08 -1.22 0.16 114.58 119.66 3hrc h GLU 188 Ca 0.11 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 3hrc h GLU 188 Cb 0.08 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 3hrc h GLU 188 CO -0.12 0.75 -0.14 0.82 -1.00 0.00 0.00 179.01 179.33 3hrc h ILE 189 N 1.17 1.30 -0.34 3.13 2.04 -0.58 -0.11 117.51 124.12 3hrc h ILE 189 Ca 0.44 -1.23 0.04 0.00 1.00 0.00 0.00 64.86 65.10 3hrc h ILE 189 Cb 0.18 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 3hrc h ILE 189 CO -0.18 0.39 0.11 0.58 0.00 0.00 0.00 178.15 179.05 3hrc h VAL 190 N 0.30 0.90 -0.50 1.67 2.07 -0.46 0.11 116.25 120.35 3hrc h VAL 190 Ca 0.06 -0.09 0.05 0.00 0.82 0.00 0.00 66.70 67.54 3hrc h VAL 190 Cb 0.66 0.62 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 3hrc h VAL 190 CO 0.04 0.05 0.23 0.28 0.02 0.00 0.00 177.57 178.18 3hrc h SER 191 N 0.25 0.30 0.01 0.57 0.02 -0.53 0.46 113.55 114.63 3hrc h SER 191 Ca 0.15 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.15 3hrc h SER 191 Cb 0.13 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 3hrc h SER 191 CO -0.16 0.21 -0.09 0.00 -1.14 0.00 0.00 176.83 175.65 3hrc h ALA 192 N 1.29 -0.11 -0.44 3.77 0.00 -0.52 -2.32 119.26 120.92 3hrc h ALA 192 Ca 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 3hrc h ALA 192 Cb 0.17 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3hrc h ALA 192 CO -0.18 -0.59 0.11 -0.07 0.00 0.00 0.00 179.25 178.51 3hrc h LEU 193 N -0.17 0.61 -0.42 0.00 3.38 -0.51 -0.41 115.31 117.80 3hrc h LEU 193 Ca 0.03 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.93 3hrc h LEU 193 Cb 0.21 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 3hrc h LEU 193 CO -0.08 0.61 0.24 -0.08 0.09 0.00 0.00 178.44 179.22 3hrc h GLU 194 N 0.65 0.47 -0.09 1.13 4.81 -0.71 0.43 114.58 121.26 3hrc h GLU 194 Ca 0.15 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3hrc h GLU 194 Cb 0.25 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 3hrc h GLU 194 CO -0.00 0.31 0.01 -0.92 -0.73 0.00 0.00 179.01 177.68 3hrc h TYR 195 N 0.49 0.01 -0.05 0.92 3.20 -0.94 -1.35 116.97 119.24 3hrc h TYR 195 Ca 0.17 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 3hrc h TYR 195 Cb 0.02 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.30 3hrc h TYR 195 CO -0.07 -0.00 0.01 1.25 -1.64 0.00 0.00 178.16 177.71 3hrc h LEU 196 N 0.04 0.08 -1.43 2.82 5.85 -0.70 -2.57 115.31 119.40 3hrc h LEU 196 Ca 0.04 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.49 3hrc h LEU 196 Cb 0.05 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3hrc h LEU 196 CO -0.07 0.27 -0.29 0.45 -0.34 0.00 0.00 178.44 178.47 3hrc h HIS 197 N -0.12 0.00 0.00 1.25 3.86 -0.96 -1.98 115.15 117.20 3hrc h HIS 197 Ca 0.02 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 3hrc h HIS 197 Cb 0.22 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.69 3hrc h HIS 197 CO -0.00 0.29 -0.12 0.78 0.86 0.00 0.00 177.93 179.74 3hrc h GLY 198 N 1.04 0.00 -1.06 2.45 0.00 -0.89 -0.77 103.07 103.84 3hrc h GLY 198 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hrc h GLY 198 CO 0.04 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.86 3hrc n LYS 199 N -4.07 1.86 -2.50 4.80 5.02 -0.80 -4.94 118.16 117.54 3hrc n LYS 199 Ca -0.02 -1.29 -0.09 0.00 -2.02 0.00 0.00 58.31 54.89 3hrc n LYS 199 Cb 0.20 -1.42 0.01 0.00 -0.02 0.00 0.00 35.03 33.81 3hrc n LYS 199 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hrc n GLY 200 N 1.19 0.18 3.30 0.72 0.00 -0.30 -4.87 105.19 105.42 3hrc n GLY 200 Ca 0.17 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 3hrc n GLY 200 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hrc s ILE 201 N -2.72 2.41 -0.10 -0.61 1.01 -0.86 -0.04 121.20 120.29 3hrc s ILE 201 Ca 0.10 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 59.79 3hrc s ILE 201 Cb -0.04 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 3hrc s ILE 201 CO 0.12 0.56 0.07 -0.63 0.00 0.00 0.00 174.94 175.07 3hrc s ILE 202 N 0.03 4.94 -0.09 2.92 1.01 -0.01 -3.75 121.20 126.24 3hrc s ILE 202 Ca -0.08 -0.01 -0.17 0.00 0.00 0.00 0.00 60.65 60.39 3hrc s ILE 202 Cb -0.15 -3.12 -0.14 0.00 0.01 0.00 0.00 42.46 39.06 3hrc s ILE 202 CO 0.05 0.61 0.56 -0.74 0.00 0.00 0.00 174.94 175.43 3hrc h HIS 203 N 5.04 -0.09 0.00 3.97 -0.00 -1.90 -1.10 115.15 121.08 3hrc h HIS 203 Ca -0.53 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.84 3hrc h HIS 203 Cb 1.21 0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.65 3hrc h HIS 203 CO 0.70 0.38 0.00 0.54 -0.00 0.00 0.00 177.93 179.55 3hrc n ARG 204 N -4.79 0.00 -2.62 5.26 1.74 -1.26 -3.22 116.66 111.78 3hrc n ARG 204 Ca -0.06 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.91 3hrc n ARG 204 Cb 0.25 -1.81 0.03 0.00 -1.02 0.00 0.00 32.46 29.91 3hrc n ARG 204 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3hrc n ASP 205 N 0.00 2.35 -4.71 0.55 2.03 -1.26 -4.10 116.55 111.42 3hrc n ASP 205 Ca 0.00 -2.77 -0.42 0.00 0.52 0.00 0.00 54.79 52.12 3hrc n ASP 205 Cb 0.00 -0.48 -0.03 0.00 -0.72 0.00 0.00 41.12 39.89 3hrc n ASP 205 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3hrc s LEU 206 N -3.45 4.36 -0.06 -2.67 2.96 -1.26 -4.82 118.68 113.74 3hrc s LEU 206 Ca 0.33 1.88 -0.31 0.00 -0.22 0.00 0.00 54.13 55.81 3hrc s LEU 206 Cb 0.40 -3.57 0.11 0.00 0.50 0.00 0.00 46.19 43.63 3hrc s LEU 206 CO -0.02 -0.42 1.06 -1.59 -1.32 0.00 0.00 176.35 174.06 3hrc s LYS 207 N 1.16 0.61 0.50 1.98 -2.85 -1.26 -4.88 119.74 115.00 3hrc s LYS 207 Ca 0.56 -0.25 0.22 0.00 -1.00 0.00 0.00 55.97 55.50 3hrc s LYS 207 Cb -0.26 0.26 1.32 0.00 -2.06 0.00 0.00 37.83 37.09 3hrc s LYS 207 CO 0.28 -0.27 2.07 -1.35 0.10 0.00 0.00 175.35 176.18 3hrc h PRO 208 N 2.00 0.00 0.00 1.78 0.11 -1.94 -0.88 132.00 133.08 3hrc h PRO 208 Ca -0.18 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.90 3hrc h PRO 208 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 3hrc h PRO 208 CO 0.27 0.12 -0.14 0.93 -0.21 0.00 0.00 178.00 178.97 3hrc h GLU 209 N 0.00 0.00 -0.56 1.05 3.07 -1.95 -2.75 114.58 113.44 3hrc h GLU 209 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3hrc h GLU 209 Cb 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 3hrc h GLU 209 CO 0.02 0.14 0.00 0.09 -1.40 0.00 0.00 179.01 177.86 3hrc n ASN 210 N -4.08 3.33 -4.12 1.42 3.02 -0.35 -4.72 115.26 109.77 3hrc n ASN 210 Ca -0.02 -1.98 -0.34 0.00 -0.03 0.00 0.00 54.58 52.20 3hrc n ASN 210 Cb 0.22 -0.37 -0.13 0.00 -0.61 0.00 0.00 39.78 38.89 3hrc n ASN 210 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hrc s ILE 211 N -1.26 2.90 0.56 2.41 1.01 -1.05 -1.25 121.20 124.53 3hrc s ILE 211 Ca 0.41 -1.81 0.04 0.00 0.00 0.00 0.00 60.65 59.29 3hrc s ILE 211 Cb 0.22 -2.86 0.06 0.00 0.01 0.00 0.00 42.46 39.88 3hrc s ILE 211 CO 0.30 -0.39 0.78 -0.76 0.00 0.00 0.00 174.94 174.86 3hrc s LEU 212 N 1.14 3.27 -0.05 2.97 1.43 -0.27 -0.19 118.68 126.97 3hrc s LEU 212 Ca 0.02 -0.30 0.02 0.00 -1.03 0.00 0.00 54.13 52.84 3hrc s LEU 212 Cb -0.21 -2.45 0.02 0.00 0.03 0.00 0.00 46.19 43.58 3hrc s LEU 212 CO -0.04 -1.25 -0.08 -0.76 0.23 0.00 0.00 176.35 174.46 3hrc s LEU 213 N -4.74 1.46 0.00 1.79 1.43 0.02 0.22 118.68 118.85 3hrc s LEU 213 Ca 0.59 -0.20 -0.10 0.00 -1.03 0.00 0.00 54.13 53.39 3hrc s LEU 213 Cb -0.09 -0.60 0.15 0.00 0.03 0.00 0.00 46.19 45.68 3hrc s LEU 213 CO 0.39 -0.02 0.88 -0.46 0.23 0.00 0.00 176.35 177.36 3hrc n ASN 214 N 3.96 0.12 0.05 2.29 0.23 -0.01 -0.95 115.26 120.95 3hrc n ASN 214 Ca -0.24 -1.35 0.19 0.00 -0.53 0.00 0.00 54.58 52.65 3hrc n ASN 214 Cb 0.51 -0.67 0.70 0.00 -2.08 0.00 0.00 39.78 38.25 3hrc n ASN 214 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3hrc h GLU 215 N 0.00 0.00 -0.03 -3.83 4.81 -1.89 -0.24 114.58 113.40 3hrc h GLU 215 Ca -0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3hrc h GLU 215 Cb 0.80 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.18 3hrc h GLU 215 CO 0.21 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 178.24 3hrc n ASP 216 N -4.29 2.26 -0.37 1.04 8.00 -1.26 -4.94 116.55 116.98 3hrc n ASP 216 Ca 0.08 -1.75 -0.04 0.00 0.71 0.00 0.00 54.79 53.78 3hrc n ASP 216 Cb 0.54 -0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.62 3hrc n ASP 216 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3hrc n MET 217 N 0.77 -0.32 -3.17 -1.24 2.81 -0.10 -4.64 117.12 111.23 3hrc n MET 217 Ca 0.16 0.57 -0.32 0.00 -1.81 0.00 0.00 57.70 56.31 3hrc n MET 217 Cb 0.48 -4.27 -0.05 0.00 -0.71 0.00 0.00 33.22 28.66 3hrc n MET 217 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 3hrc s HIS 218 N -2.18 3.40 0.59 2.03 3.76 -1.26 -4.82 115.29 116.82 3hrc s HIS 218 Ca 0.00 1.10 -0.18 0.00 -0.15 0.00 0.00 55.06 55.83 3hrc s HIS 218 Cb 0.00 -2.45 -0.03 0.00 1.11 0.00 0.00 32.58 31.21 3hrc s HIS 218 CO 0.00 0.11 1.13 0.96 -0.85 0.00 0.00 174.74 176.09 3hrc s ILE 219 N -2.00 3.12 -0.31 0.60 -4.36 -1.26 -0.83 121.20 116.16 3hrc s ILE 219 Ca 0.52 0.63 -0.01 0.00 -0.26 0.00 0.00 60.65 61.52 3hrc s ILE 219 Cb -0.10 -3.19 0.12 0.00 1.25 0.00 0.00 42.46 40.54 3hrc s ILE 219 CO 0.20 -0.22 0.21 -1.10 0.24 0.00 0.00 174.94 174.28 3hrc s GLN 220 N -3.60 0.35 0.29 0.37 -1.52 0.13 -4.38 119.66 111.30 3hrc s GLN 220 Ca 0.71 -0.66 -0.29 0.00 -1.95 0.00 0.00 55.36 53.16 3hrc s GLN 220 Cb -0.23 -1.03 -0.10 0.00 -0.22 0.00 0.00 33.01 31.43 3hrc s GLN 220 CO 0.33 -1.09 1.19 0.42 -0.25 0.00 0.00 175.29 175.90 3hrc s ILE 221 N 1.85 3.21 0.30 1.08 1.01 0.18 -1.11 121.20 127.72 3hrc s ILE 221 Ca 0.12 1.19 0.06 0.00 0.00 0.00 0.00 60.65 62.01 3hrc s ILE 221 Cb -0.17 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 3hrc s ILE 221 CO -0.24 0.27 0.20 1.07 0.00 0.00 0.00 174.94 176.25 3hrc n THR 222 N 1.24 0.00 -2.10 2.92 5.66 -0.38 -0.96 114.28 120.67 3hrc n THR 222 Ca 0.00 -2.04 -0.01 0.00 -3.05 0.00 0.00 64.05 58.94 3hrc n THR 222 Cb 0.44 0.93 0.00 0.00 -1.55 0.00 0.00 70.33 70.14 3hrc n THR 222 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3hrc n ASP 223 N -1.80 -4.41 -0.97 1.09 2.03 -1.26 -4.86 116.55 106.38 3hrc n ASP 223 Ca 0.03 0.08 0.09 0.00 0.52 0.00 0.00 54.79 55.52 3hrc n ASP 223 Cb 0.51 -2.79 0.20 0.00 -0.72 0.00 0.00 41.12 38.33 3hrc n ASP 223 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3hrc n PHE 224 N -0.91 0.54 0.26 -0.67 3.72 -1.26 -4.46 117.46 114.68 3hrc n PHE 224 Ca 0.02 -0.35 0.13 0.00 -0.05 0.00 0.00 57.45 57.20 3hrc n PHE 224 Cb 0.36 -0.01 0.72 0.00 -0.94 0.00 0.00 39.48 39.61 3hrc n PHE 224 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3hrc h GLY 225 N 3.46 0.00 -1.64 1.37 0.00 -1.86 -2.23 103.07 102.17 3hrc h GLY 225 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hrc h GLY 225 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 3hrc n THR 226 N -3.58 1.52 -1.68 4.70 -2.24 -1.26 -4.54 114.28 107.19 3hrc n THR 226 Ca -0.02 -1.31 -0.30 0.00 -2.27 0.00 0.00 64.05 60.16 3hrc n THR 226 Cb 0.25 0.21 0.08 0.00 -2.10 0.00 0.00 70.33 68.77 3hrc n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hrc s ALA 227 N -1.69 2.48 -0.03 6.98 0.00 -0.84 -4.57 121.76 124.09 3hrc s ALA 227 Ca 0.33 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.02 3hrc s ALA 227 Cb 0.22 -3.07 0.03 0.00 0.00 0.00 0.00 23.12 20.30 3hrc s ALA 227 CO 0.15 -1.53 0.01 0.21 0.00 0.00 0.00 175.76 174.60 3hrc s LYS 228 N -5.25 0.28 -0.35 0.00 2.47 -0.42 -4.99 119.74 111.49 3hrc s LYS 228 Ca 0.60 0.11 -0.24 0.00 -1.56 0.00 0.00 55.97 54.88 3hrc s LYS 228 Cb -0.13 -0.52 0.01 0.00 -1.46 0.00 0.00 37.83 35.73 3hrc s LYS 228 CO 0.53 -0.17 0.80 0.08 0.16 0.00 0.00 175.35 176.75 3hrc s VAL 229 N 1.21 4.73 0.25 4.02 1.01 -1.26 -0.83 120.40 129.53 3hrc s VAL 229 Ca -0.07 1.00 -0.30 0.00 0.00 0.00 0.00 61.98 62.61 3hrc s VAL 229 Cb -0.13 -4.21 -0.09 0.00 0.00 0.00 0.00 36.38 31.95 3hrc s VAL 229 CO -0.02 -0.39 1.02 -0.76 0.00 0.00 0.00 175.10 174.95 3hrc s LEU 230 N 3.10 4.60 -0.15 3.92 1.43 0.94 -5.00 118.68 127.51 3hrc s LEU 230 Ca 0.32 2.10 -0.27 0.00 -1.03 0.00 0.00 54.13 55.25 3hrc s LEU 230 Cb -0.13 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 3hrc s LEU 230 CO 0.16 -0.00 0.91 -0.55 0.23 0.00 0.00 176.35 177.10 3hrc s SER 231 N -0.97 7.08 -1.19 2.29 0.15 -1.26 -4.85 113.70 114.95 3hrc s SER 231 Ca 0.43 1.32 -0.20 0.00 0.70 0.00 0.00 55.95 58.21 3hrc s SER 231 Cb -0.29 -2.50 -0.03 0.00 -1.71 0.00 0.00 66.02 61.49 3hrc s SER 231 CO 0.36 -0.43 1.90 -0.81 1.20 0.00 0.00 173.24 175.46 3hrc n PRO 232 N 5.19 2.25 0.00 5.44 -0.04 -1.26 -5.15 135.00 141.43 3hrc n PRO 232 Ca 0.06 -2.65 0.00 0.00 -0.04 0.00 0.00 63.50 60.87 3hrc n PRO 232 Cb 0.49 -3.48 0.00 0.00 -0.04 0.00 0.00 33.50 30.47 3hrc n PRO 232 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hrc n ALA 237 N 10.40 1.90 -2.49 0.55 0.00 -1.26 -5.28 120.51 124.34 3hrc n ALA 237 Ca 0.48 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.61 3hrc n ALA 237 Cb 0.45 0.24 -0.12 0.00 0.00 0.00 0.00 19.45 20.02 3hrc n ALA 237 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hrc s ARG 238 N -1.89 2.11 -0.02 0.00 3.00 -1.26 -4.30 118.95 116.59 3hrc s ARG 238 Ca 0.00 -0.97 0.06 0.00 0.00 0.00 0.00 55.73 54.83 3hrc s ARG 238 Cb 0.00 -2.23 -0.01 0.00 0.00 0.00 0.00 34.95 32.70 3hrc s ARG 238 CO 0.00 0.54 -0.22 0.00 0.00 0.00 0.00 175.30 175.62 3hrc s ALA 239 N -0.97 1.83 -1.09 2.13 0.00 0.13 -4.95 121.76 118.85 3hrc s ALA 239 Ca 0.16 -0.93 -0.08 0.00 0.00 0.00 0.00 51.96 51.11 3hrc s ALA 239 Cb -0.11 -0.49 0.27 0.00 0.00 0.00 0.00 23.12 22.80 3hrc s ALA 239 CO 0.06 0.43 1.08 0.09 0.00 0.00 0.00 175.76 177.42 3hrc n ASN 240 N 2.64 5.36 -3.68 0.00 3.02 -1.26 -0.83 115.26 120.51 3hrc n ASN 240 Ca -0.16 -3.07 -0.28 0.00 -0.03 0.00 0.00 54.58 51.05 3hrc n ASN 240 Cb 0.52 -1.33 -0.16 0.00 -0.61 0.00 0.00 39.78 38.21 3hrc n ASN 240 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3hrc s PHE 242 N -1.36 0.86 0.09 3.10 5.36 -1.26 -4.80 117.98 119.97 3hrc s PHE 242 Ca 0.31 -0.90 -0.03 0.00 -0.96 0.00 0.00 56.93 55.34 3hrc s PHE 242 Cb -0.09 -1.05 -0.03 0.00 -0.34 0.00 0.00 43.02 41.51 3hrc s PHE 242 CO -0.08 -0.67 0.07 0.14 -1.46 0.00 0.00 175.22 173.22 3hrc s VAL 243 N 1.91 0.16 -2.66 3.12 -7.23 -1.26 -5.14 120.40 109.30 3hrc s VAL 243 Ca 0.03 -1.66 0.00 0.00 -1.81 0.00 0.00 61.98 58.54 3hrc s VAL 243 Cb -0.17 -1.66 0.00 0.00 0.56 0.00 0.00 36.38 35.11 3hrc s VAL 243 CO -0.16 -0.71 0.00 0.61 -0.31 0.00 0.00 175.10 174.53 3hrc n GLY 244 N -0.01 0.68 3.10 2.32 0.00 -1.26 -4.91 105.19 105.12 3hrc n GLY 244 Ca -0.11 -2.10 -0.28 0.00 0.00 0.00 0.00 46.02 43.53 3hrc n GLY 244 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hrc s THR 245 N -1.05 1.53 0.24 2.61 2.01 -1.26 -5.04 115.64 114.68 3hrc s THR 245 Ca 0.00 -0.71 -0.09 0.00 0.31 0.00 0.00 61.69 61.21 3hrc s THR 245 Cb 0.00 -1.36 0.30 0.00 0.01 0.00 0.00 72.50 71.46 3hrc s THR 245 CO 0.00 0.44 1.62 0.00 -0.69 0.00 0.00 174.62 175.99 3hrc h ALA 246 N 6.90 0.67 -0.06 7.40 0.00 -1.97 0.44 119.26 132.64 3hrc h ALA 246 Ca -0.26 0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3hrc h ALA 246 Cb 1.21 0.50 -0.00 0.00 0.00 0.00 0.00 17.79 19.50 3hrc h ALA 246 CO 0.47 -0.43 0.07 1.96 0.00 0.00 0.00 179.25 181.32 3hrc h GLN 247 N 0.05 0.00 -0.01 0.00 7.50 -1.96 -2.88 115.11 117.80 3hrc h GLN 247 Ca 0.40 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.55 3hrc h GLN 247 Cb 0.67 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.20 3hrc h GLN 247 CO -0.73 0.00 -0.01 0.66 -1.50 0.00 0.00 178.83 177.25 3hrc n TYR 248 N -3.82 0.00 -2.13 2.96 4.01 0.09 -4.68 117.16 113.60 3hrc n TYR 248 Ca -0.02 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.32 3hrc n TYR 248 Cb 0.16 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.17 3hrc n TYR 248 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3hrc s VAL 249 N -0.60 2.75 0.44 -0.72 1.01 -0.89 -4.24 120.40 118.14 3hrc s VAL 249 Ca 0.08 0.72 -0.10 0.00 0.00 0.00 0.00 61.98 62.68 3hrc s VAL 249 Cb 0.06 -3.45 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 3hrc s VAL 249 CO 0.09 0.15 0.80 -0.94 0.00 0.00 0.00 175.10 175.20 3hrc s SER 250 N -0.61 6.47 0.33 3.32 1.04 -1.26 -4.98 113.70 118.00 3hrc s SER 250 Ca 0.51 1.14 0.01 0.00 0.48 0.00 0.00 55.95 58.09 3hrc s SER 250 Cb -0.38 -2.33 0.57 0.00 0.10 0.00 0.00 66.02 63.98 3hrc s SER 250 CO 0.50 -0.47 1.99 1.55 0.98 0.00 0.00 173.24 177.80 3hrc h PRO 251 N 0.97 0.91 -0.34 4.02 0.13 -1.89 -2.53 132.00 133.27 3hrc h PRO 251 Ca -0.47 -0.06 -0.03 0.00 -0.87 0.00 0.00 66.00 64.57 3hrc h PRO 251 Cb 1.19 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 32.10 3hrc h PRO 251 CO 0.63 0.61 0.06 1.05 -0.23 0.00 0.00 178.00 180.12 3hrc h GLU 252 N 0.94 0.50 -0.51 0.86 9.09 -1.84 0.31 114.58 123.93 3hrc h GLU 252 Ca 0.25 -0.08 -0.10 0.00 0.05 0.00 0.00 59.36 59.47 3hrc h GLU 252 Cb -0.10 -0.08 -0.02 0.00 -1.65 0.00 0.00 28.75 26.90 3hrc h GLU 252 CO -0.05 0.48 -0.09 1.25 0.05 0.00 0.00 179.01 180.64 3hrc h LEU 253 N 0.49 0.93 -0.55 3.06 5.85 -1.19 0.22 115.31 124.12 3hrc h LEU 253 Ca 0.11 -0.29 -0.10 0.00 0.84 0.00 0.00 57.88 58.44 3hrc h LEU 253 Cb 0.23 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3hrc h LEU 253 CO -0.00 1.04 -0.05 -0.07 -0.34 0.00 0.00 178.44 179.02 3hrc h LEU 254 N 0.84 1.00 0.00 2.25 3.38 -1.25 -2.89 115.31 118.64 3hrc h LEU 254 Ca 0.14 -0.33 -0.27 0.00 0.09 0.00 0.00 57.88 57.51 3hrc h LEU 254 Cb 0.63 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 3hrc h LEU 254 CO 0.04 1.09 -2.06 0.35 0.09 0.00 0.00 178.44 177.95 3hrc n THR 255 N -4.20 1.03 0.46 0.22 -2.24 0.03 -4.52 114.28 105.06 3hrc n THR 255 Ca 0.02 -0.65 0.05 0.00 -2.27 0.00 0.00 64.05 61.19 3hrc n THR 255 Cb 0.37 -0.56 -0.04 0.00 -2.10 0.00 0.00 70.33 68.00 3hrc n THR 255 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hrc n GLU 256 N -2.56 3.36 -2.17 -0.78 1.02 0.70 -5.00 120.64 115.22 3hrc n GLU 256 Ca -0.25 -0.15 -0.14 0.00 -0.02 0.00 0.00 57.16 56.60 3hrc n GLU 256 Cb 0.99 -0.99 -0.01 0.00 -0.02 0.00 0.00 31.44 31.40 3hrc n GLU 256 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3hrc n LYS 257 N -1.00 -1.13 -3.87 3.49 4.76 -0.68 -4.97 118.16 114.76 3hrc n LYS 257 Ca 0.02 0.73 -0.09 0.00 -2.87 0.00 0.00 58.31 56.11 3hrc n LYS 257 Cb 0.17 -5.01 -0.07 0.00 -1.84 0.00 0.00 35.03 28.28 3hrc n LYS 257 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3hrc s SER 258 N -2.41 0.06 0.20 4.39 1.04 -1.22 -4.65 113.70 111.11 3hrc s SER 258 Ca 0.00 -0.70 0.06 0.00 0.48 0.00 0.00 55.95 55.79 3hrc s SER 258 Cb 0.00 0.39 -0.05 0.00 0.10 0.00 0.00 66.02 66.46 3hrc s SER 258 CO 0.00 -0.80 -0.09 0.00 0.98 0.00 0.00 173.24 173.33 3hrc s ALA 259 N -3.89 1.84 0.24 5.32 0.00 -0.01 -2.59 121.76 122.66 3hrc s ALA 259 Ca 0.09 -1.66 0.02 0.00 0.00 0.00 0.00 51.96 50.41 3hrc s ALA 259 Cb 0.04 0.12 -0.01 0.00 0.00 0.00 0.00 23.12 23.27 3hrc s ALA 259 CO -0.07 -0.07 0.28 0.00 0.00 0.00 0.00 175.76 175.89 3hrc h LYS 261 N 0.00 0.76 0.00 0.00 1.57 -1.95 -1.10 116.57 115.86 3hrc h LYS 261 Ca -0.18 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 3hrc h LYS 261 Cb 0.84 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.98 3hrc h LYS 261 CO 0.25 0.50 -0.03 1.03 -0.57 0.00 0.00 179.45 180.64 3hrc h SER 262 N 0.78 0.00 -0.90 0.86 0.87 -1.94 -2.25 113.55 110.97 3hrc h SER 262 Ca 0.47 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 61.07 3hrc h SER 262 Cb 0.65 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.56 3hrc h SER 262 CO -0.23 0.03 0.59 0.28 -0.53 0.00 0.00 176.83 176.97 3hrc h SER 263 N 0.00 0.95 -0.25 6.23 0.02 -1.56 -0.88 113.55 118.07 3hrc h SER 263 Ca -0.00 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 3hrc h SER 263 Cb 0.06 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 3hrc h SER 263 CO 0.00 0.64 0.10 0.44 -1.14 0.00 0.00 176.83 176.88 3hrc h ASP 264 N 1.10 0.38 0.38 3.07 3.32 -1.53 -2.36 116.42 120.78 3hrc h ASP 264 Ca 0.36 -0.04 -0.15 0.00 0.02 0.00 0.00 57.03 57.22 3hrc h ASP 264 Cb 0.06 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3hrc h ASP 264 CO -0.12 0.37 -0.64 -0.07 -1.72 0.00 0.00 179.24 177.06 3hrc h LEU 265 N 0.43 0.28 -0.07 1.55 3.38 -1.24 -0.08 115.31 119.55 3hrc h LEU 265 Ca 0.11 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3hrc h LEU 265 Cb 0.12 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 3hrc h LEU 265 CO -0.01 0.84 0.04 -0.25 0.09 0.00 0.00 178.44 179.16 3hrc h TRP 266 N 0.17 0.10 -0.96 1.13 2.91 -1.05 -1.77 115.95 116.48 3hrc h TRP 266 Ca -0.01 -0.00 0.03 0.00 1.13 0.00 0.00 58.89 60.04 3hrc h TRP 266 Cb 1.16 -0.03 -0.05 0.00 -0.51 0.00 0.00 29.16 29.73 3hrc h TRP 266 CO 0.02 0.10 0.63 0.00 -1.03 0.00 0.00 178.44 178.16 3hrc h ALA 267 N 0.99 1.26 -0.70 2.65 0.00 -1.22 -1.66 119.26 120.58 3hrc h ALA 267 Ca 0.03 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.97 3hrc h ALA 267 Cb 0.03 -0.35 -0.06 0.00 0.00 0.00 0.00 17.79 17.41 3hrc h ALA 267 CO -0.00 0.53 0.37 1.25 0.00 0.00 0.00 179.25 181.40 3hrc h LEU 268 N 1.23 0.53 -0.18 0.00 5.85 -0.84 -0.53 115.31 121.37 3hrc h LEU 268 Ca 0.38 0.05 0.01 0.00 0.84 0.00 0.00 57.88 59.15 3hrc h LEU 268 Cb -0.03 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 3hrc h LEU 268 CO -0.11 0.32 0.09 1.23 -0.34 0.00 0.00 178.44 179.62 3hrc h GLY 269 N 0.66 0.24 0.37 3.75 0.00 -0.41 -0.26 103.07 107.43 3hrc h GLY 269 Ca 0.33 -0.07 0.10 0.00 0.00 0.00 0.00 47.33 47.69 3hrc h GLY 269 CO -0.23 0.06 0.23 0.00 0.00 0.00 0.00 176.54 176.59 3hrc h ILE 271 N 0.40 1.27 -0.19 0.00 2.04 -0.75 0.21 117.51 120.49 3hrc h ILE 271 Ca 0.31 -0.99 0.04 0.00 1.00 0.00 0.00 64.86 65.23 3hrc h ILE 271 Cb 0.39 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 3hrc h ILE 271 CO -0.31 0.31 -0.07 0.40 0.00 0.00 0.00 178.15 178.48 3hrc h ILE 272 N 0.20 0.76 -0.53 -0.67 2.04 -0.95 0.25 117.51 118.61 3hrc h ILE 272 Ca 0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.99 3hrc h ILE 272 Cb 0.47 0.76 -0.06 0.00 -0.74 0.00 0.00 36.82 37.25 3hrc h ILE 272 CO 0.02 0.00 0.22 0.22 0.00 0.00 0.00 178.15 178.61 3hrc h TYR 273 N -0.03 0.39 -0.81 1.37 5.03 -1.18 -2.43 116.97 119.31 3hrc h TYR 273 Ca 0.10 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.42 3hrc h TYR 273 Cb 0.18 -0.10 -0.04 0.00 1.55 0.00 0.00 36.73 38.32 3hrc h TYR 273 CO -0.23 0.15 0.47 0.37 -1.32 0.00 0.00 178.16 177.60 3hrc h GLN 274 N 0.42 1.12 -0.94 1.82 4.15 -0.20 0.24 115.11 121.72 3hrc h GLN 274 Ca 0.25 -0.11 0.07 0.00 0.77 0.00 0.00 58.65 59.62 3hrc h GLN 274 Cb 0.24 -0.23 -0.07 0.00 0.21 0.00 0.00 27.48 27.64 3hrc h GLN 274 CO -0.23 0.80 0.59 -0.07 -1.93 0.00 0.00 178.83 178.00 3hrc h LEU 275 N 1.12 0.94 0.14 -2.39 3.38 -0.51 0.40 115.31 118.39 3hrc h LEU 275 Ca 0.29 0.02 -0.30 0.00 0.09 0.00 0.00 57.88 57.97 3hrc h LEU 275 Cb -0.01 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3hrc h LEU 275 CO -0.05 0.59 -1.53 0.58 0.09 0.00 0.00 178.44 178.12 3hrc h VAL 276 N 1.07 1.00 0.00 1.22 2.07 -1.08 0.16 116.25 120.69 3hrc h VAL 276 Ca 0.41 -2.44 -0.16 0.00 0.82 0.00 0.00 66.70 65.34 3hrc h VAL 276 Cb 0.19 2.74 -0.03 0.00 -1.52 0.00 0.00 31.29 32.67 3hrc h VAL 276 CO -0.18 0.76 -1.34 0.00 0.02 0.00 0.00 177.57 176.83 3hrc h ALA 277 N 0.01 0.65 0.00 1.67 0.00 -0.51 -3.43 119.26 117.65 3hrc h ALA 277 Ca -0.32 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 53.81 3hrc h ALA 277 Cb 1.88 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.92 3hrc h ALA 277 CO 0.10 0.85 0.00 0.41 0.00 0.00 0.00 179.25 180.62 3hrc n GLY 278 N 1.38 2.76 3.01 0.00 0.00 0.14 -4.94 105.19 107.53 3hrc n GLY 278 Ca -0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 3hrc n GLY 278 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hrc s LEU 279 N 0.00 2.15 0.83 0.99 1.43 -1.23 -4.92 118.68 117.93 3hrc s LEU 279 Ca 0.00 -0.51 -0.11 0.00 -1.03 0.00 0.00 54.13 52.49 3hrc s LEU 279 Cb 0.00 0.20 0.09 0.00 0.03 0.00 0.00 46.19 46.52 3hrc s LEU 279 CO 0.00 -0.34 1.10 -2.16 0.23 0.00 0.00 176.35 175.17 3hrc s PRO 280 N -1.70 1.76 0.28 1.29 0.04 -1.26 -3.88 135.00 131.52 3hrc s PRO 280 Ca -0.13 1.09 0.14 0.00 0.04 0.00 0.00 61.00 62.13 3hrc s PRO 280 Cb -0.08 -1.85 0.27 0.00 0.04 0.00 0.00 34.50 32.88 3hrc s PRO 280 CO -0.02 -1.97 1.54 -1.00 0.04 0.00 0.00 177.00 175.60 3hrc h PRO 281 N -1.36 0.00 -4.66 0.56 0.13 -1.89 -3.40 132.00 121.38 3hrc h PRO 281 Ca -0.46 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 63.98 3hrc h PRO 281 Cb 1.25 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.11 3hrc h PRO 281 CO 0.51 0.59 -0.59 -0.06 -0.23 0.00 0.00 178.00 178.23 3hrc s PHE 282 N -3.25 3.25 -0.01 1.56 0.08 -1.26 -4.76 117.98 113.59 3hrc s PHE 282 Ca 0.01 -1.30 0.02 0.00 0.12 0.00 0.00 56.93 55.77 3hrc s PHE 282 Cb 0.10 -2.31 0.00 0.00 -0.57 0.00 0.00 43.02 40.24 3hrc s PHE 282 CO 0.75 -0.71 -0.05 1.03 -0.10 0.00 0.00 175.22 176.14 3hrc s ARG 283 N 1.44 0.54 -0.04 0.44 0.52 -1.26 -4.74 118.95 115.85 3hrc s ARG 283 Ca -0.01 -0.17 -0.31 0.00 -0.52 0.00 0.00 55.73 54.72 3hrc s ARG 283 Cb -0.19 -0.54 0.11 0.00 0.52 0.00 0.00 34.95 34.84 3hrc s ARG 283 CO 0.04 0.07 1.12 0.00 0.02 0.00 0.00 175.30 176.54 3hrc s ALA 284 N 0.15 -1.99 -2.11 2.13 0.00 -1.26 -4.85 121.76 113.83 3hrc s ALA 284 Ca -0.01 0.96 0.15 0.00 0.00 0.00 0.00 51.96 53.05 3hrc s ALA 284 Cb -0.06 0.27 0.60 0.00 0.00 0.00 0.00 23.12 23.93 3hrc s ALA 284 CO -0.00 -0.82 1.43 0.41 0.00 0.00 0.00 175.76 176.77 3hrc n GLY 285 N -0.30 -0.05 3.31 0.00 0.00 -1.26 -4.80 105.19 102.08 3hrc n GLY 285 Ca -0.05 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.55 3hrc n GLY 285 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hrc s ASN 286 N -1.34 -0.25 0.15 1.61 2.20 -1.26 -5.08 114.94 110.98 3hrc s ASN 286 Ca 0.25 -0.05 -0.15 0.00 -0.94 0.00 0.00 52.86 51.96 3hrc s ASN 286 Cb 0.13 0.41 0.02 0.00 -2.00 0.00 0.00 41.25 39.81 3hrc s ASN 286 CO 0.19 -0.66 1.77 -0.33 -2.94 0.00 0.00 177.10 175.13 3hrc h GLU 287 N 3.04 0.60 -0.80 3.55 5.08 -2.00 -2.67 114.58 121.38 3hrc h GLU 287 Ca -0.31 -0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.06 3hrc h GLU 287 Cb 1.21 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 30.27 3hrc h GLU 287 CO 0.44 0.46 0.47 0.78 -1.00 0.00 0.00 179.01 180.16 3hrc h GLY 288 N 0.58 1.22 1.48 -3.84 0.00 -1.99 0.17 103.07 100.69 3hrc h GLY 288 Ca 0.16 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 47.08 3hrc h GLY 288 CO -0.03 0.18 -0.10 1.41 0.00 0.00 0.00 176.54 178.00 3hrc h LEU 289 N 0.83 0.60 -0.14 3.11 3.38 -1.90 -2.04 115.31 119.15 3hrc h LEU 289 Ca 0.37 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 3hrc h LEU 289 Cb 0.26 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3hrc h LEU 289 CO -0.21 0.74 0.00 0.40 0.09 0.00 0.00 178.44 179.47 3hrc h ILE 290 N 0.57 1.25 -0.73 1.22 2.04 -0.92 -2.85 117.51 118.09 3hrc h ILE 290 Ca 0.10 -0.81 0.12 0.00 1.00 0.00 0.00 64.86 65.28 3hrc h ILE 290 Cb 0.52 1.52 -0.09 0.00 -0.74 0.00 0.00 36.82 38.03 3hrc h ILE 290 CO 0.03 0.24 0.30 -0.26 0.00 0.00 0.00 178.15 178.46 3hrc h PHE 291 N -0.02 0.52 -0.65 1.37 0.04 -0.38 -0.69 116.94 117.13 3hrc h PHE 291 Ca 0.04 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.76 3hrc h PHE 291 Cb 0.36 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.36 3hrc h PHE 291 CO 0.03 0.10 0.10 0.00 -0.60 0.00 0.00 178.31 177.95 3hrc h ALA 292 N 1.50 0.87 -0.57 2.45 0.00 -1.32 -2.08 119.26 120.11 3hrc h ALA 292 Ca 0.39 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3hrc h ALA 292 Cb 0.54 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3hrc h ALA 292 CO -0.36 0.64 0.19 0.87 0.00 0.00 0.00 179.25 180.59 3hrc h LYS 293 N 1.00 0.87 -0.35 0.00 1.57 -1.15 -2.83 116.57 115.69 3hrc h LYS 293 Ca 0.20 -0.18 0.03 0.00 -1.87 0.00 0.00 60.65 58.83 3hrc h LYS 293 Cb 0.45 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 3hrc h LYS 293 CO 0.01 0.78 0.15 0.82 -0.57 0.00 0.00 179.45 180.64 3hrc h ILE 294 N 0.79 0.94 0.00 1.86 2.04 -0.79 0.15 117.51 122.51 3hrc h ILE 294 Ca 0.19 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.89 3hrc h ILE 294 Cb 0.26 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 3hrc h ILE 294 CO -0.01 0.06 -0.22 0.16 0.00 0.00 0.00 178.15 178.14 3hrc h ILE 295 N 0.32 0.54 -0.15 -0.67 3.07 -1.34 -1.50 117.51 117.77 3hrc h ILE 295 Ca 0.15 -1.10 0.00 0.00 1.55 0.00 0.00 64.86 65.46 3hrc h ILE 295 Cb 0.09 1.75 0.00 0.00 -0.27 0.00 0.00 36.82 38.40 3hrc h ILE 295 CO -0.13 0.21 0.00 0.29 -1.05 0.00 0.00 178.15 177.47 3hrc n LYS 296 N -3.39 1.94 -4.11 0.16 5.02 -1.07 -4.95 118.16 111.76 3hrc n LYS 296 Ca 0.00 -1.40 -0.30 0.00 -2.02 0.00 0.00 58.31 54.60 3hrc n LYS 296 Cb 0.42 -1.45 -0.04 0.00 -0.02 0.00 0.00 35.03 33.95 3hrc n LYS 296 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3hrc n LEU 297 N 0.64 -1.82 -4.38 -0.35 7.94 -0.56 -4.89 117.00 113.58 3hrc n LEU 297 Ca 0.17 -1.07 -0.45 0.00 -1.11 0.00 0.00 56.01 53.56 3hrc n LEU 297 Cb 0.42 -2.05 -0.04 0.00 0.53 0.00 0.00 43.42 42.28 3hrc n LEU 297 CO 0.15 0.39 0.45 -0.70 -1.11 0.00 0.00 177.39 176.57 3hrc s GLU 298 N -6.83 3.05 0.13 1.96 2.12 0.43 -4.97 118.70 114.60 3hrc s GLU 298 Ca 0.22 -1.27 -0.24 0.00 0.36 0.00 0.00 54.97 54.04 3hrc s GLU 298 Cb -0.12 -4.26 0.07 0.00 0.26 0.00 0.00 34.13 30.08 3hrc s GLU 298 CO 0.92 -1.57 0.69 1.52 -0.54 0.00 0.00 175.26 176.28 3hrc s TYR 299 N 2.83 -0.45 0.08 5.30 1.13 -1.26 -4.78 117.35 120.21 3hrc s TYR 299 Ca 0.13 0.23 0.02 0.00 -1.41 0.00 0.00 57.07 56.03 3hrc s TYR 299 Cb -0.23 0.57 -0.04 0.00 -1.10 0.00 0.00 41.96 41.16 3hrc s TYR 299 CO 0.07 -0.82 -0.08 -0.51 -2.51 0.00 0.00 175.55 171.70 3hrc s ASP 300 N -2.71 1.14 0.09 -0.18 1.11 -1.26 -5.15 116.67 109.70 3hrc s ASP 300 Ca 0.03 -0.85 -0.16 0.00 0.18 0.00 0.00 52.55 51.75 3hrc s ASP 300 Cb -0.02 0.06 -0.07 0.00 1.07 0.00 0.00 42.92 43.97 3hrc s ASP 300 CO -0.10 -0.35 0.53 -0.36 1.18 0.00 0.00 175.17 176.07 3hrc s PHE 301 N -2.79 3.72 0.61 4.23 0.40 -1.26 -5.05 117.98 117.84 3hrc s PHE 301 Ca 0.05 1.14 -0.18 0.00 -0.60 0.00 0.00 56.93 57.33 3hrc s PHE 301 Cb -0.00 -2.41 -0.03 0.00 0.51 0.00 0.00 43.02 41.09 3hrc s PHE 301 CO -0.02 0.54 1.22 -1.25 0.70 0.00 0.00 175.22 176.41 3hrc s PRO 302 N -1.42 2.85 0.23 0.24 0.04 -1.26 -4.93 135.00 130.74 3hrc s PRO 302 Ca 0.31 1.86 -0.14 0.00 0.04 0.00 0.00 61.00 63.07 3hrc s PRO 302 Cb -0.17 -1.91 0.27 0.00 0.04 0.00 0.00 34.50 32.73 3hrc s PRO 302 CO 0.18 -1.31 1.59 0.93 0.04 0.00 0.00 177.00 178.43 3hrc h GLU 303 N 0.75 -0.04 -4.98 4.56 5.08 -2.04 -3.29 114.58 114.61 3hrc h GLU 303 Ca -0.50 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.22 3hrc h GLU 303 Cb 1.30 0.01 -0.18 0.00 0.50 0.00 0.00 28.75 30.38 3hrc h GLU 303 CO 0.54 -0.03 -0.55 0.15 -1.00 0.00 0.00 179.01 178.13 3hrc s LYS 304 N -6.14 3.89 -0.25 2.33 1.02 -1.26 -5.03 119.74 114.29 3hrc s LYS 304 Ca -0.14 -0.36 -0.12 0.00 0.02 0.00 0.00 55.97 55.37 3hrc s LYS 304 Cb 0.21 -3.50 0.09 0.00 -0.52 0.00 0.00 37.83 34.11 3hrc s LYS 304 CO 0.73 -0.10 0.59 0.12 -0.92 0.00 0.00 175.35 175.77 3hrc s PHE 305 N 1.46 -1.02 -0.10 3.18 2.19 -1.24 -5.00 117.98 117.44 3hrc s PHE 305 Ca 0.06 1.95 -0.38 0.00 0.33 0.00 0.00 56.93 58.89 3hrc s PHE 305 Cb -0.15 0.57 -0.15 0.00 -1.31 0.00 0.00 43.02 41.97 3hrc s PHE 305 CO 0.07 -0.53 1.61 1.19 1.83 0.00 0.00 175.22 179.39 3hrc n PHE 306 N 4.80 1.92 -0.34 10.12 3.72 -1.26 -4.73 117.46 131.68 3hrc n PHE 306 Ca -0.17 0.49 0.01 0.00 -0.05 0.00 0.00 57.45 57.73 3hrc n PHE 306 Cb 0.54 -2.45 0.14 0.00 -0.94 0.00 0.00 39.48 36.78 3hrc n PHE 306 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3hrc h PRO 307 N 6.43 1.09 -0.02 -1.08 0.11 -2.00 0.11 132.00 136.64 3hrc h PRO 307 Ca -0.47 -0.07 -0.13 0.00 0.11 0.00 0.00 66.00 65.44 3hrc h PRO 307 Cb 1.31 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3hrc h PRO 307 CO 0.89 0.72 -0.61 0.87 -0.21 0.00 0.00 178.00 179.66 3hrc h LYS 308 N 1.12 0.07 -0.42 1.05 1.57 -1.98 -0.88 116.57 117.10 3hrc h LYS 308 Ca 0.39 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 59.07 3hrc h LYS 308 Cb 0.09 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 3hrc h LYS 308 CO -0.15 0.66 0.09 0.00 -0.57 0.00 0.00 179.45 179.49 3hrc h ALA 309 N 1.32 0.55 -0.40 3.86 0.00 -1.69 -1.96 119.26 120.94 3hrc h ALA 309 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3hrc h ALA 309 Cb 1.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3hrc h ALA 309 CO 0.08 0.24 0.26 -0.09 0.00 0.00 0.00 179.25 179.75 3hrc h ARG 310 N 0.54 0.53 -0.78 0.00 2.43 -0.47 0.91 114.38 117.55 3hrc h ARG 310 Ca 0.13 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.33 3hrc h ARG 310 Cb 0.33 -0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 29.71 3hrc h ARG 310 CO 0.00 0.36 0.46 0.22 -1.51 0.00 0.00 179.97 179.50 3hrc h ASP 311 N 0.53 0.71 -0.32 -3.80 1.82 -1.12 -0.29 116.42 113.95 3hrc h ASP 311 Ca 0.14 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.79 3hrc h ASP 311 Cb -0.05 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 39.83 3hrc h ASP 311 CO -0.03 0.45 0.12 0.25 -1.61 0.00 0.00 179.24 178.42 3hrc h LEU 312 N 0.84 0.45 -0.89 2.28 5.85 -0.80 -2.62 115.31 120.42 3hrc h LEU 312 Ca 0.34 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.92 3hrc h LEU 312 Cb 0.19 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 3hrc h LEU 312 CO -0.18 0.50 0.58 0.58 -0.34 0.00 0.00 178.44 179.58 3hrc h VAL 313 N 0.36 1.14 0.00 1.05 2.07 -0.25 -1.34 116.25 119.28 3hrc h VAL 313 Ca 0.11 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 3hrc h VAL 313 Cb 0.20 -0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 29.90 3hrc h VAL 313 CO -0.01 0.20 -0.02 -0.33 0.02 0.00 0.00 177.57 177.43 3hrc h GLU 314 N 1.11 0.00 -0.00 1.57 5.08 -0.88 0.11 114.58 121.57 3hrc h GLU 314 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 3hrc h GLU 314 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3hrc h GLU 314 CO -0.12 0.02 -0.45 1.63 -1.00 0.00 0.00 179.01 179.09 3hrc n LYS 315 N -3.21 0.44 -0.07 2.33 5.02 -0.54 -4.26 118.16 117.87 3hrc n LYS 315 Ca -0.02 -0.28 -0.11 0.00 -2.02 0.00 0.00 58.31 55.88 3hrc n LYS 315 Cb 0.18 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.64 3hrc n LYS 315 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3hrc n LEU 316 N -1.04 2.43 -4.00 -0.35 4.77 -0.73 -1.37 117.00 116.71 3hrc n LEU 316 Ca 0.08 -0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.64 3hrc n LEU 316 Cb 0.35 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 3hrc n LEU 316 CO 0.31 0.61 2.35 0.18 -1.33 0.00 0.00 177.39 179.51 3hrc n LEU 317 N -3.12 6.27 -4.14 2.23 4.77 -0.05 -4.39 117.00 118.56 3hrc n LEU 317 Ca -0.26 -4.17 -0.28 0.00 -0.03 0.00 0.00 56.01 51.27 3hrc n LEU 317 Cb 0.74 -1.66 -0.17 0.00 -2.33 0.00 0.00 43.42 40.01 3hrc n LEU 317 CO 0.10 0.88 -0.52 -0.69 -1.33 0.00 0.00 177.39 175.84 3hrc s VAL 318 N 3.01 1.62 0.21 4.08 1.01 -1.26 -4.87 120.40 124.19 3hrc s VAL 318 Ca 0.48 -0.78 -0.09 0.00 0.00 0.00 0.00 61.98 61.59 3hrc s VAL 318 Cb 0.10 -1.41 0.15 0.00 0.00 0.00 0.00 36.38 35.22 3hrc s VAL 318 CO -0.03 0.46 1.80 -0.07 0.00 0.00 0.00 175.10 177.26 3hrc h LEU 319 N 6.65 0.99 -8.68 3.92 3.38 -1.96 -3.38 115.31 116.23 3hrc h LEU 319 Ca -0.27 -0.13 -0.55 0.00 0.09 0.00 0.00 57.88 57.02 3hrc h LEU 319 Cb 1.20 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 41.64 3hrc h LEU 319 CO 0.47 0.83 1.09 -0.62 0.09 0.00 0.00 178.44 180.31 3hrc s ASP 320 N -6.16 6.21 0.62 -0.43 -1.08 -1.26 -4.73 116.67 109.84 3hrc s ASP 320 Ca -0.13 0.54 0.34 0.00 -0.52 0.00 0.00 52.55 52.78 3hrc s ASP 320 Cb 0.15 -2.54 1.97 0.00 -1.46 0.00 0.00 42.92 41.03 3hrc s ASP 320 CO 0.81 -1.59 2.24 0.00 0.52 0.00 0.00 175.17 177.15 3hrc h ALA 321 N 10.98 1.41 -0.00 3.66 0.00 -1.98 -0.08 119.26 133.26 3hrc h ALA 321 Ca -0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3hrc h ALA 321 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3hrc h ALA 321 CO 1.14 -0.08 -0.03 0.25 0.00 0.00 0.00 179.25 180.53 3hrc n THR 322 N -3.55 0.00 -0.44 0.00 -2.24 -1.26 -3.73 114.28 103.06 3hrc n THR 322 Ca -0.02 -0.01 0.06 0.00 -2.27 0.00 0.00 64.05 61.81 3hrc n THR 322 Cb 0.15 -0.42 0.15 0.00 -2.10 0.00 0.00 70.33 68.11 3hrc n THR 322 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3hrc n LYS 323 N -1.24 2.76 -3.09 -0.78 5.02 -0.04 -4.13 118.16 116.66 3hrc n LYS 323 Ca 0.14 -2.21 -0.39 0.00 -2.02 0.00 0.00 58.31 53.83 3hrc n LYS 323 Cb 0.25 -1.39 -0.05 0.00 -0.02 0.00 0.00 35.03 33.82 3hrc n LYS 323 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3hrc s ARG 324 N -1.65 4.41 0.12 1.97 0.52 -1.24 -4.92 118.95 118.15 3hrc s ARG 324 Ca 0.25 0.90 -0.31 0.00 -0.52 0.00 0.00 55.73 56.05 3hrc s ARG 324 Cb 0.17 -3.35 -0.11 0.00 0.52 0.00 0.00 34.95 32.18 3hrc s ARG 324 CO 0.10 0.32 1.85 -0.11 0.02 0.00 0.00 175.30 177.48 3hrc n LEU 325 N 2.79 4.06 0.00 2.53 7.94 -0.47 -1.69 117.00 132.16 3hrc n LEU 325 Ca -0.05 0.98 0.00 0.00 -1.11 0.00 0.00 56.01 55.84 3hrc n LEU 325 Cb 0.51 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 42.91 3hrc n LEU 325 CO 0.45 0.18 0.00 0.61 -1.11 0.00 0.00 177.39 177.52 3hrc n GLY 326 N 4.26 1.82 3.85 -3.96 0.00 -1.23 -4.88 105.19 105.05 3hrc n GLY 326 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 3hrc n GLY 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hrc h GLU 328 N -0.63 0.92 0.00 0.00 5.08 -1.92 0.15 114.58 118.17 3hrc h GLU 328 Ca -0.45 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 3hrc h GLU 328 Cb 1.23 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3hrc h GLU 328 CO 0.61 0.74 0.00 0.93 -1.00 0.00 0.00 179.01 180.28 3hrc h GLU 329 N 0.91 0.00 -0.66 2.33 3.07 -1.94 -1.14 114.58 117.15 3hrc h GLU 329 Ca 0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 3hrc h GLU 329 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 3hrc h GLU 329 CO -0.02 0.00 0.00 -1.33 -1.40 0.00 0.00 179.01 176.26 3hrc n MET 330 N -2.35 3.32 -1.79 2.33 2.81 -0.56 -4.96 117.12 115.91 3hrc n MET 330 Ca 0.02 -2.78 -0.10 0.00 -1.81 0.00 0.00 57.70 53.04 3hrc n MET 330 Cb 0.24 -1.75 -0.02 0.00 -0.71 0.00 0.00 33.22 30.98 3hrc n MET 330 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3hrc n GLU 331 N 1.28 -0.73 0.00 0.03 -0.58 -0.43 -4.70 120.64 115.51 3hrc n GLU 331 Ca 0.25 0.64 0.00 0.00 -0.42 0.00 0.00 57.16 57.62 3hrc n GLU 331 Cb 0.77 -4.62 0.00 0.00 -0.57 0.00 0.00 31.44 27.02 3hrc n GLU 331 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hrc n GLY 332 N -1.35 -0.95 0.14 0.62 0.00 -0.07 -4.44 105.19 99.15 3hrc n GLY 332 Ca -0.11 -1.45 0.13 0.00 0.00 0.00 0.00 46.02 44.59 3hrc n GLY 332 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hrc h TYR 333 N 0.00 0.00 0.86 1.61 0.05 -1.88 -3.25 116.97 114.37 3hrc h TYR 333 Ca 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.74 3hrc h TYR 333 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 3hrc h TYR 333 CO 0.00 0.00 -0.46 0.78 -1.05 0.00 0.00 178.16 177.43 3hrc h GLY 334 N 4.33 -1.29 1.91 3.88 0.00 -1.95 -0.62 103.07 109.33 3hrc h GLY 334 Ca 0.00 0.50 -0.01 0.00 0.00 0.00 0.00 47.33 47.82 3hrc h GLY 334 CO 0.00 -0.46 0.01 -2.55 0.00 0.00 0.00 176.54 173.54 3hrc h PRO 335 N -1.21 0.11 0.15 4.80 0.11 -1.82 -1.76 132.00 132.38 3hrc h PRO 335 Ca -0.12 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 3hrc h PRO 335 Cb 0.95 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3hrc h PRO 335 CO 0.17 0.13 -0.07 1.25 -0.21 0.00 0.00 178.00 179.26 3hrc h LEU 336 N 0.12 -0.17 -2.48 2.35 5.85 -1.61 -2.93 115.31 116.44 3hrc h LEU 336 Ca 0.03 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.46 3hrc h LEU 336 Cb 0.08 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 3hrc h LEU 336 CO 0.00 0.22 -0.02 0.11 -0.34 0.00 0.00 178.44 178.41 3hrc h LYS 337 N -0.59 0.00 -0.00 1.25 1.57 -0.96 -0.86 116.57 116.98 3hrc h LYS 337 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3hrc h LYS 337 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 3hrc h LYS 337 CO 0.03 0.02 -0.02 0.00 -0.57 0.00 0.00 179.45 178.91 3hrc n ALA 338 N -2.26 2.63 -1.71 3.86 0.00 -0.68 -4.74 120.51 117.61 3hrc n ALA 338 Ca -0.03 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.78 3hrc n ALA 338 Cb 0.11 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.10 3hrc n ALA 338 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3hrc n HIS 339 N -1.02 2.43 0.04 0.00 -0.00 -0.33 -4.87 115.22 111.48 3hrc n HIS 339 Ca 0.19 0.53 0.21 0.00 -0.00 0.00 0.00 57.72 58.64 3hrc n HIS 339 Cb 0.20 -2.44 0.73 0.00 -0.00 0.00 0.00 29.99 28.48 3hrc n HIS 339 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3hrc h PRO 340 N 2.67 0.00 -0.20 1.57 0.11 -1.91 -0.47 132.00 133.78 3hrc h PRO 340 Ca -0.47 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.69 3hrc h PRO 340 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 3hrc h PRO 340 CO 0.63 0.00 0.14 0.35 -0.21 0.00 0.00 178.00 178.91 3hrc h PHE 341 N 0.00 0.03 -0.57 0.65 3.57 -1.89 -2.37 116.94 116.36 3hrc h PHE 341 Ca 0.23 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.73 3hrc h PHE 341 Cb 1.06 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.78 3hrc h PHE 341 CO 0.00 0.02 0.00 1.19 -2.23 0.00 0.00 178.31 177.29 3hrc n PHE 342 N -4.48 1.06 -0.25 0.41 3.72 -0.19 -4.66 117.46 113.07 3hrc n PHE 342 Ca 0.02 -0.46 0.05 0.00 -0.05 0.00 0.00 57.45 57.01 3hrc n PHE 342 Cb 0.26 -0.12 0.18 0.00 -0.94 0.00 0.00 39.48 38.86 3hrc n PHE 342 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3hrc h GLU 343 N 3.47 0.40 -0.00 -1.08 5.08 -1.51 -0.31 114.58 120.63 3hrc h GLU 343 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3hrc h GLU 343 Cb 1.06 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.22 3hrc h GLU 343 CO 0.11 0.27 -0.01 -1.13 -1.00 0.00 0.00 179.01 177.24 3hrc n SER 344 N -5.02 0.10 -4.71 1.42 3.41 -1.26 -4.88 113.62 102.68 3hrc n SER 344 Ca 0.14 -0.56 -0.42 0.00 -0.26 0.00 0.00 58.87 57.77 3hrc n SER 344 Cb 0.40 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 3hrc n SER 344 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3hrc s VAL 345 N -2.33 3.72 -0.45 -3.33 1.01 -0.13 -5.01 120.40 113.88 3hrc s VAL 345 Ca 0.36 1.20 -0.18 0.00 0.00 0.00 0.00 61.98 63.37 3hrc s VAL 345 Cb 0.21 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.85 3hrc s VAL 345 CO 0.43 0.07 0.49 -0.89 0.00 0.00 0.00 175.10 175.20 3hrc s THR 346 N 1.44 5.03 0.18 3.92 2.01 -1.26 -4.96 115.64 122.00 3hrc s THR 346 Ca 0.62 -0.42 0.03 0.00 0.31 0.00 0.00 61.69 62.22 3hrc s THR 346 Cb -0.32 -4.13 -0.12 0.00 0.01 0.00 0.00 72.50 67.94 3hrc s THR 346 CO 0.28 -0.55 1.42 -0.50 -0.69 0.00 0.00 174.62 174.59 3hrc h TRP 347 N 8.81 0.29 0.00 4.92 4.06 -1.97 -3.39 115.95 128.67 3hrc h TRP 347 Ca -0.27 -0.15 0.00 0.00 2.06 0.00 0.00 58.89 60.54 3hrc h TRP 347 Cb 1.11 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 29.23 3hrc h TRP 347 CO 0.66 0.92 0.00 0.39 -3.56 0.00 0.00 178.44 176.86 3hrc n GLU 348 N -3.71 0.00 -2.59 0.49 1.02 -1.26 -3.41 120.64 111.18 3hrc n GLU 348 Ca -0.03 0.69 -0.32 0.00 -0.02 0.00 0.00 57.16 57.48 3hrc n GLU 348 Cb 0.76 -1.20 -0.00 0.00 -0.02 0.00 0.00 31.44 30.97 3hrc n GLU 348 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 3hrc n ASN 349 N -1.80 5.66 -0.32 1.62 6.94 -1.26 -4.84 115.26 121.27 3hrc n ASN 349 Ca 0.00 -3.72 0.02 0.00 -0.02 0.00 0.00 54.58 50.86 3hrc n ASN 349 Cb 0.00 -0.75 0.17 0.00 -2.36 0.00 0.00 39.78 36.84 3hrc n ASN 349 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 3hrc h LEU 350 N 3.14 0.84 -0.10 -4.53 3.38 -1.75 -2.05 115.31 114.25 3hrc h LEU 350 Ca 0.33 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3hrc h LEU 350 Cb 0.50 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3hrc h LEU 350 CO 1.01 0.51 0.00 0.00 0.09 0.00 0.00 178.44 180.05 3hrc n HIS 351 N -4.63 0.09 0.60 1.13 1.44 -1.26 -2.08 115.22 110.50 3hrc n HIS 351 Ca 0.14 0.04 0.07 0.00 -2.01 0.00 0.00 57.72 55.96 3hrc n HIS 351 Cb 0.22 -0.56 0.03 0.00 0.12 0.00 0.00 29.99 29.81 3hrc n HIS 351 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 3hrc n GLN 352 N -1.59 1.37 -2.92 -1.40 3.00 -0.79 -4.98 117.38 110.09 3hrc n GLN 352 Ca 0.03 -1.07 -0.33 0.00 -0.01 0.00 0.00 57.00 55.62 3hrc n GLN 352 Cb 0.15 -1.24 -0.07 0.00 0.00 0.00 0.00 30.24 29.08 3hrc n GLN 352 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 3hrc s GLN 353 N -1.40 4.18 -0.28 -1.09 -0.21 -0.88 -5.02 119.66 114.96 3hrc s GLN 353 Ca 0.14 0.99 -0.29 0.00 0.02 0.00 0.00 55.36 56.22 3hrc s GLN 353 Cb 0.11 -2.30 0.00 0.00 1.00 0.00 0.00 33.01 31.83 3hrc s GLN 353 CO 0.25 0.05 1.23 0.99 -2.12 0.00 0.00 175.29 175.69 3hrc s THR 354 N -2.08 4.28 0.54 -0.19 2.01 -1.26 -5.01 115.64 113.93 3hrc s THR 354 Ca 0.59 1.48 -0.22 0.00 0.31 0.00 0.00 61.69 63.85 3hrc s THR 354 Cb -0.10 -4.20 -0.05 0.00 0.01 0.00 0.00 72.50 68.16 3hrc s THR 354 CO 0.15 -0.40 1.34 -2.84 -0.69 0.00 0.00 174.62 172.18 3hrc s PRO 355 N 3.87 3.19 0.57 4.92 0.02 -1.26 -4.95 135.00 141.35 3hrc s PRO 355 Ca 0.53 2.19 -0.20 0.00 0.02 0.00 0.00 61.00 63.54 3hrc s PRO 355 Cb -0.16 -2.26 -0.04 0.00 0.02 0.00 0.00 34.50 32.05 3hrc s PRO 355 CO 0.19 -1.14 1.27 -1.25 -0.33 0.00 0.00 177.00 175.74 3hrc s PRO 356 N -2.90 3.06 0.11 5.54 0.04 -1.26 -4.96 135.00 134.63 3hrc s PRO 356 Ca 0.71 2.01 -0.31 0.00 0.04 0.00 0.00 61.00 63.45 3hrc s PRO 356 Cb -0.39 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 31.98 3hrc s PRO 356 CO 0.47 -1.19 1.32 -1.59 0.04 0.00 0.00 177.00 176.04 3hrc s LYS 357 N -3.10 4.37 -0.96 4.56 0.00 -1.26 -4.96 119.74 118.39 3hrc s LYS 357 Ca 0.75 1.97 -0.21 0.00 0.00 0.00 0.00 55.97 58.48 3hrc s LYS 357 Cb -0.35 -3.27 0.09 0.00 0.00 0.00 0.00 37.83 34.30 3hrc s LYS 357 CO 0.40 -0.35 1.28 -0.51 0.00 0.00 0.00 175.35 176.17 3hrc s LEU 358 N 0.90 4.26 0.00 2.77 1.43 -1.26 -4.96 118.68 121.83 3hrc s LEU 358 Ca 0.61 -1.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.02 3hrc s LEU 358 Cb -0.34 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.39 3hrc s LEU 358 CO 0.31 -1.30 0.00 1.07 0.23 0.00 0.00 176.35 176.66