#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f1s s GLU 88 N 0.00 3.70 -0.34 -3.83 2.02 -1.26 -2.95 118.70 116.04 3f1s s GLU 88 Ca 0.00 0.08 -0.26 0.00 0.02 0.00 0.00 54.97 54.81 3f1s s GLU 88 Cb 0.00 -2.73 0.01 0.00 0.10 0.00 0.00 34.13 31.51 3f1s s GLU 88 CO 0.00 0.37 0.91 0.00 0.02 0.00 0.00 175.26 176.55 3f1s s HIS 90 N 3.34 2.93 0.19 0.00 0.09 -1.26 -4.91 115.29 115.67 3f1s s HIS 90 Ca 0.37 -0.17 0.13 0.00 -0.00 0.00 0.00 55.06 55.39 3f1s s HIS 90 Cb -0.13 -3.78 0.37 0.00 -0.00 0.00 0.00 32.58 29.04 3f1s s HIS 90 CO 0.16 -1.16 1.60 -1.00 -0.00 0.00 0.00 174.74 174.34 3f1s h PRO 91 N 9.13 0.00 0.00 8.40 0.13 -1.98 -3.20 132.00 144.48 3f1s h PRO 91 Ca -0.26 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 3f1s h PRO 91 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3f1s h PRO 91 CO 1.01 0.58 -0.23 1.05 -0.23 0.00 0.00 178.00 180.18 3f1s h GLU 92 N 0.00 0.00 -6.31 0.86 4.11 -1.98 -3.46 114.58 107.80 3f1s h GLU 92 Ca -0.01 0.00 -0.45 0.00 0.07 0.00 0.00 59.36 58.97 3f1s h GLU 92 Cb 1.14 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 3f1s h GLU 92 CO 0.07 0.23 -0.34 1.03 0.07 0.00 0.00 179.01 180.08 3f1s s ARG 93 N -4.22 2.82 0.00 1.06 0.52 -1.21 -5.05 118.95 112.87 3f1s s ARG 93 Ca -0.03 -1.26 0.07 0.00 -0.52 0.00 0.00 55.73 53.99 3f1s s ARG 93 Cb 0.14 -2.64 0.07 0.00 0.52 0.00 0.00 34.95 33.04 3f1s s ARG 93 CO 0.66 -0.10 0.78 0.25 0.02 0.00 0.00 175.30 176.91 3f1s n THR 94 N -1.64 0.14 0.96 0.02 -2.24 -1.26 -4.71 114.28 105.54 3f1s n THR 94 Ca 0.03 -0.57 0.10 0.00 -2.27 0.00 0.00 64.05 61.35 3f1s n THR 94 Cb 0.60 1.05 0.32 0.00 -2.10 0.00 0.00 70.33 70.20 3f1s n THR 94 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3f1s n ASP 95 N 0.36 2.15 0.00 3.42 5.75 -1.26 -4.88 116.55 122.09 3f1s n ASP 95 Ca 0.05 -1.81 0.00 0.00 -0.01 0.00 0.00 54.79 53.02 3f1s n ASP 95 Cb 0.20 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 3f1s n ASP 95 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3f1s n GLY 96 N 1.22 1.39 3.75 6.12 0.00 -1.26 -5.06 105.19 111.35 3f1s n GLY 96 Ca 0.17 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 3f1s n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f1s h GLN 98 N 0.51 -0.00 0.00 0.00 4.20 -1.59 -3.47 115.11 114.75 3f1s h GLN 98 Ca -0.49 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.22 3f1s h GLN 98 Cb 1.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.06 3f1s h GLN 98 CO 0.54 0.96 0.00 0.72 -0.67 0.00 0.00 178.83 180.38 3f1s n HIS 99 N -4.62 0.00 -3.38 2.96 8.25 -1.26 -4.83 115.22 112.34 3f1s n HIS 99 Ca -0.10 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.09 3f1s n HIS 99 Cb 0.46 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.54 3f1s n HIS 99 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3f1s s PHE 100 N 1.55 3.49 0.12 4.41 0.08 -0.41 -4.98 117.98 122.23 3f1s s PHE 100 Ca 0.00 0.54 0.03 0.00 0.12 0.00 0.00 56.93 57.63 3f1s s PHE 100 Cb 0.00 -2.03 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 3f1s s PHE 100 CO 0.00 0.18 -0.09 0.00 -0.10 0.00 0.00 175.22 175.21 3f1s s LEU 102 N -2.92 -0.47 0.85 0.00 2.96 -0.92 -4.95 118.68 113.22 3f1s s LEU 102 Ca 0.12 0.26 -0.11 0.00 -0.22 0.00 0.00 54.13 54.17 3f1s s LEU 102 Cb 0.02 0.92 0.14 0.00 0.50 0.00 0.00 46.19 47.77 3f1s s LEU 102 CO -0.01 -0.29 1.19 -2.16 -1.32 0.00 0.00 176.35 173.76 3f1s s PRO 103 N 2.49 1.34 0.00 0.98 0.04 -1.26 -1.60 135.00 136.99 3f1s s PRO 103 Ca 0.08 -0.38 0.00 0.00 0.04 0.00 0.00 61.00 60.74 3f1s s PRO 103 Cb -0.15 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.39 3f1s s PRO 103 CO -0.14 -1.89 0.00 0.41 0.04 0.00 0.00 177.00 175.42 3f1s n GLY 104 N -3.38 1.52 7.00 0.56 0.00 -1.15 -4.89 105.19 104.84 3f1s n GLY 104 Ca 0.12 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.22 3f1s n GLY 104 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3f1s n GLN 105 N -1.93 0.00 -2.57 1.61 6.02 -1.26 -2.09 117.38 117.16 3f1s n GLN 105 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.83 3f1s n GLN 105 Cb 0.00 0.00 0.02 0.00 1.02 0.00 0.00 30.24 31.28 3f1s n GLN 105 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 3f1s n GLU 106 N 14.00 2.18 -3.87 -1.09 0.28 -1.26 -4.97 120.64 125.91 3f1s n GLU 106 Ca 0.00 -3.79 -0.03 0.00 -0.16 0.00 0.00 57.16 53.18 3f1s n GLU 106 Cb 0.00 -1.71 0.02 0.00 1.43 0.00 0.00 31.44 31.18 3f1s n GLU 106 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 3f1s s SER 107 N -3.37 -0.01 -0.02 -1.84 1.04 -0.89 -4.49 113.70 104.12 3f1s s SER 107 Ca 0.36 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 56.12 3f1s s SER 107 Cb 0.42 0.51 0.02 0.00 0.10 0.00 0.00 66.02 67.08 3f1s s SER 107 CO -0.05 -1.01 0.01 -0.72 0.98 0.00 0.00 173.24 172.46 3f1s s TYR 108 N -2.26 0.12 -0.28 5.02 1.13 -1.26 -3.22 117.35 116.60 3f1s s TYR 108 Ca 0.21 0.07 -0.18 0.00 -1.41 0.00 0.00 57.07 55.75 3f1s s TYR 108 Cb -0.03 -0.26 -0.02 0.00 -1.10 0.00 0.00 41.96 40.56 3f1s s TYR 108 CO 0.05 -0.09 0.53 0.99 -2.51 0.00 0.00 175.55 174.52 3f1s s THR 109 N 0.87 5.05 0.33 -3.49 2.01 -0.63 -4.88 115.64 114.90 3f1s s THR 109 Ca -0.08 0.81 -0.18 0.00 0.31 0.00 0.00 61.69 62.55 3f1s s THR 109 Cb -0.11 -3.86 -0.09 0.00 0.01 0.00 0.00 72.50 68.45 3f1s s THR 109 CO -0.02 0.02 0.79 0.00 -0.69 0.00 0.00 174.62 174.72 3f1s s SER 111 N -2.11 0.65 0.35 0.00 1.04 -0.84 -5.00 113.70 107.79 3f1s s SER 111 Ca 0.54 -1.11 0.09 0.00 0.48 0.00 0.00 55.95 55.94 3f1s s SER 111 Cb -0.11 0.20 -0.05 0.00 0.10 0.00 0.00 66.02 66.16 3f1s s SER 111 CO 0.17 -0.62 0.06 0.00 0.98 0.00 0.00 173.24 173.83 3f1s n ALA 113 N -1.03 -1.91 -2.08 0.00 0.00 -1.26 -4.91 120.51 109.31 3f1s n ALA 113 Ca -0.04 -1.26 -0.43 0.00 0.00 0.00 0.00 53.44 51.72 3f1s n ALA 113 Cb 0.62 -0.08 -0.03 0.00 0.00 0.00 0.00 19.45 19.97 3f1s n ALA 113 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3f1s s GLN 114 N -5.01 3.64 0.00 0.00 1.11 -1.26 -2.66 119.66 115.48 3f1s s GLN 114 Ca 0.55 1.56 0.00 0.00 0.01 0.00 0.00 55.36 57.48 3f1s s GLN 114 Cb -0.03 -4.09 0.00 0.00 -1.01 0.00 0.00 33.01 27.88 3f1s s GLN 114 CO 0.40 -1.48 0.00 0.41 0.01 0.00 0.00 175.29 174.63 3f1s n GLY 115 N 4.93 1.01 3.28 3.09 0.00 -1.26 -2.39 105.19 113.86 3f1s n GLY 115 Ca 0.20 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 3f1s n GLY 115 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f1s s TYR 116 N -2.00 2.33 0.03 1.61 1.51 -1.09 -2.03 117.35 117.71 3f1s s TYR 116 Ca 0.00 -0.56 -0.19 0.00 -1.01 0.00 0.00 57.07 55.32 3f1s s TYR 116 Cb 0.00 -1.52 -0.06 0.00 -0.11 0.00 0.00 41.96 40.27 3f1s s TYR 116 CO 0.00 -0.12 0.54 0.50 -1.11 0.00 0.00 175.55 175.36 3f1s s ARG 117 N -0.40 4.19 0.08 -0.62 3.52 0.16 -4.79 118.95 121.08 3f1s s ARG 117 Ca 0.04 0.66 -0.31 0.00 -0.13 0.00 0.00 55.73 55.99 3f1s s ARG 117 Cb -0.12 -3.27 -0.06 0.00 -1.56 0.00 0.00 34.95 29.94 3f1s s ARG 117 CO 0.01 0.55 1.27 -1.17 -0.81 0.00 0.00 175.30 175.15 3f1s s LEU 118 N -0.77 4.37 0.00 -0.88 2.96 -1.26 -1.11 118.68 121.98 3f1s s LEU 118 Ca 0.28 2.12 -0.15 0.00 -0.22 0.00 0.00 54.13 56.16 3f1s s LEU 118 Cb -0.18 -3.58 0.22 0.00 0.50 0.00 0.00 46.19 43.14 3f1s s LEU 118 CO 0.17 -0.54 0.91 0.61 -1.32 0.00 0.00 176.35 176.18 3f1s n GLY 119 N 3.32 -2.30 0.17 7.98 0.00 -0.38 -4.91 105.19 109.07 3f1s n GLY 119 Ca 0.10 -1.55 0.04 0.00 0.00 0.00 0.00 46.02 44.61 3f1s n GLY 119 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3f1s h GLU 120 N 0.00 0.00 -0.09 1.61 5.08 -1.95 -2.84 114.58 116.39 3f1s h GLU 120 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 3f1s h GLU 120 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 3f1s h GLU 120 CO 0.22 0.44 0.00 -0.40 -1.00 0.00 0.00 179.01 178.27 3f1s n ASP 121 N -3.52 1.10 -1.33 1.42 5.68 -1.26 -4.94 116.55 113.70 3f1s n ASP 121 Ca -0.00 -1.56 -0.17 0.00 -0.50 0.00 0.00 54.79 52.56 3f1s n ASP 121 Cb 0.56 -0.06 -0.07 0.00 -1.14 0.00 0.00 41.12 40.41 3f1s n ASP 121 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3f1s n HIS 122 N -0.07 0.00 0.00 2.11 8.25 -1.07 -4.73 115.22 119.71 3f1s n HIS 122 Ca 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 3f1s n HIS 122 Cb 0.25 -3.03 0.00 0.00 1.12 0.00 0.00 29.99 28.33 3f1s n HIS 122 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3f1s n LYS 123 N -2.33 0.00 -2.39 -0.41 5.02 -1.26 -4.34 118.16 112.46 3f1s n LYS 123 Ca -0.17 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.74 3f1s n LYS 123 Cb 0.59 -0.27 -0.03 0.00 -0.02 0.00 0.00 35.03 35.31 3f1s n LYS 123 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 3f1s s GLN 124 N -1.98 4.15 -0.25 1.97 0.74 -1.26 -1.41 119.66 121.61 3f1s s GLN 124 Ca 0.00 1.73 -0.06 0.00 0.05 0.00 0.00 55.36 57.09 3f1s s GLN 124 Cb 0.00 -2.69 -0.01 0.00 1.10 0.00 0.00 33.01 31.42 3f1s s GLN 124 CO 0.00 -0.21 0.02 0.00 -0.55 0.00 0.00 175.29 174.55 3f1s s VAL 126 N 1.51 4.44 0.14 0.00 1.01 -0.27 -4.91 120.40 122.31 3f1s s VAL 126 Ca 0.05 -0.18 -0.33 0.00 0.00 0.00 0.00 61.98 61.52 3f1s s VAL 126 Cb -0.16 -2.93 -0.13 0.00 0.00 0.00 0.00 36.38 33.17 3f1s s VAL 126 CO 0.00 0.54 1.69 -2.65 0.00 0.00 0.00 175.10 174.68 3f1s n PRO 127 N 2.84 2.40 0.02 2.72 -0.02 -1.26 0.38 135.00 142.08 3f1s n PRO 127 Ca -0.18 0.87 -0.02 0.00 -2.02 0.00 0.00 63.50 62.15 3f1s n PRO 127 Cb 0.53 -2.69 -0.01 0.00 -0.02 0.00 0.00 33.50 31.32 3f1s n PRO 127 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 3f1s n HIS 128 N 4.30 0.00 -1.65 6.00 -0.00 -0.86 -4.78 115.22 118.23 3f1s n HIS 128 Ca 0.18 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 58.06 3f1s n HIS 128 Cb 0.32 -0.10 0.08 0.00 -0.12 0.00 0.00 29.99 30.17 3f1s n HIS 128 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 3f1s s ASP 129 N -5.97 4.62 0.38 0.26 1.01 -1.12 -4.97 116.67 110.88 3f1s s ASP 129 Ca -0.06 1.20 0.12 0.00 0.71 0.00 0.00 52.55 54.52 3f1s s ASP 129 Cb 0.01 -1.91 0.74 0.00 1.01 0.00 0.00 42.92 42.76 3f1s s ASP 129 CO 0.08 -1.87 1.85 1.56 0.21 0.00 0.00 175.17 177.00 3f1s h GLN 130 N -1.02 0.05 -1.37 8.23 7.50 -1.90 -3.09 115.11 123.50 3f1s h GLN 130 Ca -0.47 -0.02 -0.60 0.00 0.50 0.00 0.00 58.65 58.06 3f1s h GLN 130 Cb 1.27 -0.00 -0.24 0.00 0.05 0.00 0.00 27.48 28.56 3f1s h GLN 130 CO 0.61 0.37 0.77 0.00 -1.50 0.00 0.00 178.83 179.08 3f1s n ALA 132 N -0.43 1.99 -1.70 0.00 0.00 -1.17 -4.70 120.51 114.50 3f1s n ALA 132 Ca 0.53 0.27 -0.33 0.00 0.00 0.00 0.00 53.44 53.92 3f1s n ALA 132 Cb 0.56 -2.63 0.00 0.00 0.00 0.00 0.00 19.45 17.38 3f1s n ALA 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3f1s n GLY 134 N -1.14 0.43 3.66 0.00 0.00 -0.56 -4.69 105.19 102.90 3f1s n GLY 134 Ca 0.08 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 3f1s n GLY 134 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f1s s VAL 135 N -2.71 5.23 0.35 1.61 1.01 -1.26 -0.72 120.40 123.91 3f1s s VAL 135 Ca 0.00 0.59 0.08 0.00 0.00 0.00 0.00 61.98 62.65 3f1s s VAL 135 Cb 0.00 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 3f1s s VAL 135 CO 0.00 0.26 0.11 -0.76 0.00 0.00 0.00 175.10 174.72 3f1s s LEU 136 N 1.31 3.17 0.22 3.92 1.43 -1.26 -4.88 118.68 122.59 3f1s s LEU 136 Ca 0.16 -0.87 -0.19 0.00 -1.03 0.00 0.00 54.13 52.21 3f1s s LEU 136 Cb -0.15 -1.60 0.03 0.00 0.03 0.00 0.00 46.19 44.50 3f1s s LEU 136 CO 0.07 -0.31 0.59 0.28 0.23 0.00 0.00 176.35 177.20 3f1s s THR 137 N -2.47 0.01 -0.24 5.49 -1.32 -1.26 -5.15 115.64 110.70 3f1s s THR 137 Ca 0.37 -0.81 -0.02 0.00 -1.21 0.00 0.00 61.69 60.02 3f1s s THR 137 Cb -0.01 -1.69 0.13 0.00 -1.51 0.00 0.00 72.50 69.42 3f1s s THR 137 CO 0.22 -0.06 0.36 -0.55 -2.21 0.00 0.00 174.62 172.38 3f1s s SER 138 N -2.89 0.45 -0.04 8.08 0.15 -1.26 -5.13 113.70 113.07 3f1s s SER 138 Ca 0.10 0.09 -0.02 0.00 0.70 0.00 0.00 55.95 56.82 3f1s s SER 138 Cb -0.02 1.00 -0.01 0.00 -1.71 0.00 0.00 66.02 65.28 3f1s s SER 138 CO -0.00 -0.31 -0.04 -0.78 1.20 0.00 0.00 173.24 173.31 3f1s h ASP 147 N 8.20 0.00 -3.34 5.45 -0.00 -1.93 -3.58 116.42 121.22 3f1s h ASP 147 Ca -0.18 0.00 -0.65 0.00 -0.00 0.00 0.00 57.03 56.20 3f1s h ASP 147 Cb 1.15 0.00 -0.25 0.00 -0.00 0.00 0.00 39.33 40.23 3f1s h ASP 147 CO 0.28 0.22 -0.71 -0.76 -0.00 0.00 0.00 179.24 178.26 3f1s s LEU 148 N -5.64 2.99 0.60 2.28 1.02 -1.26 -5.03 118.68 113.64 3f1s s LEU 148 Ca -0.03 -0.26 0.31 0.00 0.02 0.00 0.00 54.13 54.17 3f1s s LEU 148 Cb 0.00 -1.72 1.86 0.00 0.02 0.00 0.00 46.19 46.36 3f1s s LEU 148 CO 0.05 0.12 2.24 -0.65 0.02 0.00 0.00 176.35 178.13 3f1s h PRO 149 N 7.08 0.00 0.00 1.29 0.11 -1.90 -2.95 132.00 135.64 3f1s h PRO 149 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3f1s h PRO 149 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3f1s h PRO 149 CO 0.60 0.00 -1.83 -2.67 -0.21 0.00 0.00 178.00 173.88 3f1s n TRP 150 N -3.75 0.08 -2.21 0.65 2.14 -1.12 -2.23 117.44 110.99 3f1s n TRP 150 Ca -0.02 0.02 -0.41 0.00 2.07 0.00 0.00 57.50 59.16 3f1s n TRP 150 Cb 0.12 -0.50 -0.03 0.00 -0.81 0.00 0.00 31.31 30.09 3f1s n TRP 150 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 3f1s s GLN 151 N -3.46 4.40 0.03 -2.67 -1.52 -1.12 -0.58 119.66 114.74 3f1s s GLN 151 Ca -0.06 2.08 -0.07 0.00 -1.95 0.00 0.00 55.36 55.37 3f1s s GLN 151 Cb 0.14 -3.15 -0.00 0.00 -0.22 0.00 0.00 33.01 29.77 3f1s s GLN 151 CO 0.90 -0.19 0.12 0.14 -0.25 0.00 0.00 175.29 176.01 3f1s s VAL 152 N -0.41 0.11 0.06 1.09 -7.23 -0.03 -4.79 120.40 109.20 3f1s s VAL 152 Ca 0.53 -0.93 -0.01 0.00 -1.81 0.00 0.00 61.98 59.76 3f1s s VAL 152 Cb -0.37 -0.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.78 3f1s s VAL 152 CO 0.43 -0.51 0.22 -0.54 -0.31 0.00 0.00 175.10 174.39 3f1s s LYS 153 N -2.21 3.45 -0.25 4.82 1.02 0.02 -0.76 119.74 125.83 3f1s s LYS 153 Ca -0.08 -0.40 -0.11 0.00 0.02 0.00 0.00 55.97 55.40 3f1s s LYS 153 Cb -0.03 -3.03 -0.05 0.00 -0.52 0.00 0.00 37.83 34.20 3f1s s LYS 153 CO -0.02 0.61 0.17 -0.51 -0.92 0.00 0.00 175.35 174.67 3f1s s LEU 154 N -2.47 4.07 -0.03 3.17 1.43 0.44 -1.24 118.68 124.05 3f1s s LEU 154 Ca 0.35 0.07 0.07 0.00 -1.03 0.00 0.00 54.13 53.58 3f1s s LEU 154 Cb -0.13 -2.10 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 3f1s s LEU 154 CO 0.27 0.03 -0.24 -0.89 0.23 0.00 0.00 176.35 175.75 3f1s s THR 155 N 1.27 2.24 0.64 5.49 2.01 0.13 -1.70 115.64 125.71 3f1s s THR 155 Ca 0.07 -1.04 0.04 0.00 0.31 0.00 0.00 61.69 61.08 3f1s s THR 155 Cb -0.14 -1.79 0.10 0.00 0.01 0.00 0.00 72.50 70.67 3f1s s THR 155 CO 0.06 0.58 0.88 0.54 -0.69 0.00 0.00 174.62 176.00 3f1s s ASN 156 N -0.59 4.75 0.46 3.53 2.20 -0.60 -0.24 114.94 124.45 3f1s s ASN 156 Ca 0.09 -0.55 0.14 0.00 -0.94 0.00 0.00 52.86 51.60 3f1s s ASN 156 Cb -0.10 0.05 1.03 0.00 -2.00 0.00 0.00 41.25 40.22 3f1s s ASN 156 CO -0.00 -1.57 2.02 0.77 -2.94 0.00 0.00 177.10 175.37 3f1s h SER 157 N -0.16 0.03 0.98 3.54 4.64 -1.90 -0.90 113.55 119.78 3f1s h SER 157 Ca -0.34 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3f1s h SER 157 Cb 1.28 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3f1s h SER 157 CO 0.41 0.17 0.00 1.21 -0.87 0.00 0.00 176.83 177.75 3f1s n GLU 158 N -4.37 0.13 -0.04 4.77 4.07 -1.26 -4.89 120.64 119.04 3f1s n GLU 158 Ca -0.02 0.21 0.00 0.00 -0.06 0.00 0.00 57.16 57.29 3f1s n GLU 158 Cb 0.21 -1.68 0.00 0.00 -0.06 0.00 0.00 31.44 29.91 3f1s n GLU 158 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3f1s n GLY 159 N 0.79 0.73 3.69 8.31 0.00 -0.34 -5.07 105.19 113.29 3f1s n GLY 159 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3f1s n GLY 159 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f1s s LYS 160 N -0.96 4.34 0.04 1.61 1.02 -1.26 -4.77 119.74 119.77 3f1s s LYS 160 Ca 0.00 0.79 -0.30 0.00 0.02 0.00 0.00 55.97 56.48 3f1s s LYS 160 Cb 0.00 -3.50 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 3f1s s LYS 160 CO 0.00 -0.07 1.01 -0.51 -0.92 0.00 0.00 175.35 174.86 3f1s s ASP 161 N 0.95 7.36 0.00 2.83 1.01 -1.26 -1.56 116.67 126.00 3f1s s ASP 161 Ca 0.34 1.76 0.00 0.00 0.71 0.00 0.00 52.55 55.36 3f1s s ASP 161 Cb -0.17 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.19 3f1s s ASP 161 CO 0.14 -0.24 0.00 2.22 0.21 0.00 0.00 175.17 177.50 3f1s n PHE 162 N 3.55 0.00 -4.18 4.23 1.16 -0.69 -5.00 117.46 116.53 3f1s n PHE 162 Ca 0.05 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.52 3f1s n PHE 162 Cb 0.50 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.27 3f1s n PHE 162 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3f1s s GLY 164 N -3.13 2.15 0.09 0.00 0.00 -0.24 -0.42 107.32 105.76 3f1s s GLY 164 Ca 0.35 -1.91 -0.26 0.00 0.00 0.00 0.00 44.72 42.90 3f1s s GLY 164 CO 0.10 -1.74 0.77 -0.32 0.00 0.00 0.00 173.10 171.91 3f1s s GLY 165 N -4.06 -0.49 -0.04 0.20 0.00 0.06 -4.32 107.32 98.67 3f1s s GLY 165 Ca 0.46 0.67 0.05 0.00 0.00 0.00 0.00 44.72 45.89 3f1s s GLY 165 CO 0.26 0.22 -0.18 0.54 0.00 0.00 0.00 173.10 173.94 3f1s s VAL 166 N -3.43 1.50 0.07 1.40 0.11 -0.71 -0.85 120.40 118.49 3f1s s VAL 166 Ca 0.04 -0.77 -0.31 0.00 -2.93 0.00 0.00 61.98 58.01 3f1s s VAL 166 Cb -0.01 -1.28 -0.06 0.00 -1.53 0.00 0.00 36.38 33.49 3f1s s VAL 166 CO -0.09 0.43 1.27 -0.63 -3.33 0.00 0.00 175.10 172.75 3f1s s ILE 167 N -0.10 3.79 0.00 7.04 1.01 0.25 -0.69 121.20 132.51 3f1s s ILE 167 Ca -0.01 1.28 0.00 0.00 0.00 0.00 0.00 60.65 61.92 3f1s s ILE 167 Cb -0.11 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.54 3f1s s ILE 167 CO 0.02 0.09 0.00 2.30 0.00 0.00 0.00 174.94 177.35 3f1s n ILE 168 N 3.99 0.00 -3.91 2.92 -5.35 -0.73 -0.86 119.36 115.42 3f1s n ILE 168 Ca 0.10 -0.14 -0.09 0.00 -0.27 0.00 0.00 62.75 62.34 3f1s n ILE 168 Cb 0.45 0.62 -0.09 0.00 -1.74 0.00 0.00 39.64 38.88 3f1s n ILE 168 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 3f1s s ARG 169 N -1.43 0.62 0.15 6.28 3.52 -1.00 -4.73 118.95 122.36 3f1s s ARG 169 Ca 0.00 -0.75 0.06 0.00 -0.13 0.00 0.00 55.73 54.91 3f1s s ARG 169 Cb 0.00 0.24 0.50 0.00 -1.56 0.00 0.00 34.95 34.14 3f1s s ARG 169 CO 0.00 -0.16 0.68 -1.91 -0.81 0.00 0.00 175.30 173.10 3f1s n GLU 170 N 0.71 -0.03 -0.42 5.12 2.13 -1.26 -0.91 120.64 125.97 3f1s n GLU 170 Ca -0.19 0.62 0.07 0.00 0.66 0.00 0.00 57.16 58.32 3f1s n GLU 170 Cb 0.59 -1.06 0.12 0.00 0.27 0.00 0.00 31.44 31.36 3f1s n GLU 170 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 3f1s n ASN 171 N -4.14 1.63 -3.77 4.31 6.94 -1.26 -1.28 115.26 117.69 3f1s n ASN 171 Ca 0.14 -2.99 -0.13 0.00 -0.02 0.00 0.00 54.58 51.58 3f1s n ASN 171 Cb 0.49 -0.40 -0.14 0.00 -2.36 0.00 0.00 39.78 37.37 3f1s n ASN 171 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3f1s s PHE 172 N -2.16 -0.16 -0.04 -2.53 0.08 -0.09 -1.22 117.98 111.86 3f1s s PHE 172 Ca 0.28 0.45 0.05 0.00 0.12 0.00 0.00 56.93 57.82 3f1s s PHE 172 Cb 0.26 -0.04 -0.03 0.00 -0.57 0.00 0.00 43.02 42.65 3f1s s PHE 172 CO -0.02 -0.14 -0.16 0.08 -0.10 0.00 0.00 175.22 174.88 3f1s s VAL 173 N 0.82 2.88 -0.13 -0.44 1.01 -0.64 -1.77 120.40 122.14 3f1s s VAL 173 Ca -0.06 -0.81 -0.06 0.00 0.00 0.00 0.00 61.98 61.05 3f1s s VAL 173 Cb -0.08 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 3f1s s VAL 173 CO -0.04 0.58 0.08 -0.22 0.00 0.00 0.00 175.10 175.50 3f1s s LEU 174 N -0.74 4.02 0.00 3.92 2.96 0.13 -0.79 118.68 128.19 3f1s s LEU 174 Ca 0.11 0.28 -0.01 0.00 -0.22 0.00 0.00 54.13 54.29 3f1s s LEU 174 Cb -0.10 -1.98 0.00 0.00 0.50 0.00 0.00 46.19 44.61 3f1s s LEU 174 CO 0.00 0.34 0.24 1.07 -1.32 0.00 0.00 176.35 176.68 3f1s n THR 175 N 2.44 0.00 -1.86 3.68 5.66 -0.86 -1.75 114.28 121.61 3f1s n THR 175 Ca -0.19 -0.84 -0.31 0.00 -3.05 0.00 0.00 64.05 59.67 3f1s n THR 175 Cb 0.54 0.52 0.03 0.00 -1.55 0.00 0.00 70.33 69.87 3f1s n THR 175 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3f1s s THR 176 N -2.61 4.10 0.05 1.09 -4.23 -1.26 -1.11 115.64 111.67 3f1s s THR 176 Ca 0.14 0.68 -0.21 0.00 -1.18 0.00 0.00 61.69 61.12 3f1s s THR 176 Cb -0.01 -3.66 -0.13 0.00 1.34 0.00 0.00 72.50 70.04 3f1s s THR 176 CO 0.10 -0.89 1.41 0.00 -0.54 0.00 0.00 174.62 174.69 3f1s h ALA 177 N -0.50 0.20 -0.70 3.99 0.00 -1.70 -2.72 119.26 117.83 3f1s h ALA 177 Ca -0.44 -0.26 0.15 0.00 0.00 0.00 0.00 54.91 54.36 3f1s h ALA 177 Cb 1.22 -0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.84 3f1s h ALA 177 CO 0.63 -0.01 -0.01 0.87 0.00 0.00 0.00 179.25 180.73 3f1s h LYS 178 N -0.03 0.10 -0.16 0.00 6.56 -1.93 -1.47 116.57 119.65 3f1s h LYS 178 Ca 0.03 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.62 3f1s h LYS 178 Cb 0.52 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.15 3f1s h LYS 178 CO 0.02 0.07 0.09 0.00 -2.06 0.00 0.00 179.45 177.57 3f1s h SER 180 N 0.19 0.00 -0.07 0.00 4.64 -0.98 -2.87 113.55 114.46 3f1s h SER 180 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3f1s h SER 180 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3f1s h SER 180 CO -0.03 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.11 3f1s n LEU 181 N -2.97 2.95 -0.06 5.97 4.77 -0.66 -4.46 117.00 122.53 3f1s n LEU 181 Ca 0.00 -1.06 -0.14 0.00 -0.03 0.00 0.00 56.01 54.78 3f1s n LEU 181 Cb 0.26 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.30 3f1s n LEU 181 CO 0.25 0.52 0.45 -0.07 -1.33 0.00 0.00 177.39 177.20 3f1s h LEU 182 N 4.42 0.90 -8.38 2.23 3.38 -1.26 -3.45 115.31 113.15 3f1s h LEU 182 Ca 0.00 -0.48 -0.36 0.00 0.09 0.00 0.00 57.88 57.13 3f1s h LEU 182 Cb 0.94 -0.26 -0.20 0.00 0.09 0.00 0.00 40.66 41.23 3f1s h LEU 182 CO 0.00 1.26 -0.76 -1.00 0.09 0.00 0.00 178.44 178.04 3f1s s HIS 183 N -4.11 1.07 -0.01 1.13 3.76 -1.26 -5.07 115.29 110.80 3f1s s HIS 183 Ca -0.10 -0.51 -0.20 0.00 -0.15 0.00 0.00 55.06 54.10 3f1s s HIS 183 Cb 0.10 -0.60 -0.27 0.00 1.11 0.00 0.00 32.58 32.92 3f1s s HIS 183 CO 0.88 0.02 1.03 -0.09 -0.85 0.00 0.00 174.74 175.73 3f1s h ARG 184 N 4.14 0.40 -4.57 1.40 2.43 -1.89 -3.41 114.38 112.88 3f1s h ARG 184 Ca -0.39 -0.52 -0.70 0.00 -0.81 0.00 0.00 59.98 57.56 3f1s h ARG 184 Cb 1.19 0.17 -0.29 0.00 -0.42 0.00 0.00 29.97 30.62 3f1s h ARG 184 CO 0.43 1.19 -0.55 1.21 -1.51 0.00 0.00 179.97 180.75 3f1s s ASN 185 N -6.91 5.43 -0.07 -3.80 3.84 -1.26 -5.08 114.94 107.09 3f1s s ASN 185 Ca -0.13 -1.38 0.01 0.00 0.21 0.00 0.00 52.86 51.57 3f1s s ASN 185 Cb 0.03 -1.91 -0.03 0.00 -0.55 0.00 0.00 41.25 38.79 3f1s s ASN 185 CO 0.84 -0.43 -0.08 0.27 -2.79 0.00 0.00 177.10 174.91 3f1s s ILE 186 N 1.38 3.61 -0.11 -5.21 -4.36 -1.26 -3.87 121.20 111.38 3f1s s ILE 186 Ca 0.01 -0.51 0.03 0.00 -0.26 0.00 0.00 60.65 59.92 3f1s s ILE 186 Cb -0.21 -2.47 0.00 0.00 1.25 0.00 0.00 42.46 41.03 3f1s s ILE 186 CO 0.02 0.59 -0.23 -0.89 0.24 0.00 0.00 174.94 174.68 3f1s s THR 187 N -0.75 2.01 0.17 8.37 2.01 0.67 -3.02 115.64 125.10 3f1s s THR 187 Ca 0.11 -0.97 -0.27 0.00 0.31 0.00 0.00 61.69 60.87 3f1s s THR 187 Cb -0.11 -1.75 -0.08 0.00 0.01 0.00 0.00 72.50 70.57 3f1s s THR 187 CO 0.01 0.54 0.85 -0.69 -0.69 0.00 0.00 174.62 174.65 3f1s s VAL 188 N 0.54 4.33 0.03 3.82 1.01 -0.10 0.18 120.40 130.20 3f1s s VAL 188 Ca -0.14 1.87 0.01 0.00 0.00 0.00 0.00 61.98 63.72 3f1s s VAL 188 Cb -0.17 -4.23 -0.02 0.00 0.00 0.00 0.00 36.38 31.96 3f1s s VAL 188 CO 0.05 0.47 -0.05 -1.59 0.00 0.00 0.00 175.10 173.98 3f1s s LYS 189 N -0.88 0.38 0.01 2.72 -2.85 -0.37 -0.60 119.74 118.15 3f1s s LYS 189 Ca 0.39 -0.64 0.00 0.00 -1.00 0.00 0.00 55.97 54.73 3f1s s LYS 189 Cb -0.24 -0.04 -0.01 0.00 -2.06 0.00 0.00 37.83 35.48 3f1s s LYS 189 CO 0.28 -0.01 -0.02 -0.08 0.10 0.00 0.00 175.35 175.62 3f1s s THR 190 N -1.37 0.12 -0.91 3.79 -1.32 -0.92 -0.80 115.64 114.24 3f1s s THR 190 Ca -0.13 -0.58 0.21 0.00 -1.21 0.00 0.00 61.69 59.98 3f1s s THR 190 Cb -0.10 -0.21 -0.24 0.00 -1.51 0.00 0.00 72.50 70.45 3f1s s THR 190 CO -0.00 -0.29 0.87 -1.22 -2.21 0.00 0.00 174.62 171.77 3f1s n TYR 191 N 2.17 0.00 -1.70 9.09 4.01 -1.26 -1.70 117.16 127.77 3f1s n TYR 191 Ca -0.19 0.00 -0.53 0.00 -0.16 0.00 0.00 57.90 57.02 3f1s n TYR 191 Cb 0.57 -0.05 -0.06 0.00 -0.31 0.00 0.00 39.34 39.49 3f1s n TYR 191 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3f1s n PHE 192 N -1.57 2.20 -3.45 -0.72 -0.00 -1.26 -2.06 117.46 110.60 3f1s n PHE 192 Ca 0.03 0.26 -0.18 0.00 -0.00 0.00 0.00 57.45 57.56 3f1s n PHE 192 Cb 0.35 -2.57 0.07 0.00 -0.00 0.00 0.00 39.48 37.34 3f1s n PHE 192 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 3f1s n ASN 193 N 6.07 -3.54 0.00 -2.13 5.15 -1.26 -4.83 115.26 114.72 3f1s n ASN 193 Ca 0.25 -0.72 0.00 0.00 -0.60 0.00 0.00 54.58 53.51 3f1s n ASN 193 Cb 0.21 -4.82 0.00 0.00 -0.53 0.00 0.00 39.78 34.65 3f1s n ASN 193 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3f1s n ARG 194 N -3.88 0.00 0.00 1.20 5.12 -0.88 -4.96 116.66 113.27 3f1s n ARG 194 Ca -0.21 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.71 3f1s n ARG 194 Cb 0.65 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.95 3f1s n ARG 194 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 3f1s n SER 196 N 0.00 0.00 -1.82 0.55 3.41 -1.26 -4.73 113.62 109.76 3f1s n SER 196 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 3f1s n SER 196 Cb 0.00 0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.11 3f1s n SER 196 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f1s n GLN 197 N -2.16 2.21 -2.92 4.33 6.02 -1.26 -4.49 117.38 119.12 3f1s n GLN 197 Ca 0.00 -2.18 -0.14 0.00 -0.01 0.00 0.00 57.00 54.67 3f1s n GLN 197 Cb 0.00 -1.88 0.02 0.00 1.02 0.00 0.00 30.24 29.40 3f1s n GLN 197 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3f1s n ASP 198 N -0.50 -1.47 -4.82 1.08 4.64 -1.26 -5.14 116.55 109.07 3f1s n ASP 198 Ca 0.39 -3.21 -0.33 0.00 -1.38 0.00 0.00 54.79 50.27 3f1s n ASP 198 Cb 1.28 0.90 -0.05 0.00 -1.04 0.00 0.00 41.12 42.21 3f1s n ASP 198 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 3f1s s PRO 199 N -0.33 4.07 -0.10 -0.67 0.04 -1.26 -4.86 135.00 131.89 3f1s s PRO 199 Ca 0.32 1.09 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 3f1s s PRO 199 Cb 0.25 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 3f1s s PRO 199 CO -0.14 -0.17 1.12 -1.17 0.04 0.00 0.00 177.00 176.67 3f1s s LEU 200 N -3.53 4.24 -0.14 -3.56 2.96 -0.69 -4.89 118.68 113.08 3f1s s LEU 200 Ca 0.62 1.66 -0.06 0.00 -0.22 0.00 0.00 54.13 56.13 3f1s s LEU 200 Cb -0.10 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 3f1s s LEU 200 CO 0.20 -0.55 0.06 -0.04 -1.32 0.00 0.00 176.35 174.70 3f1s s MET 201 N 2.30 3.55 -0.04 1.98 -1.94 -1.26 -2.15 119.30 121.73 3f1s s MET 201 Ca 0.52 -0.32 0.00 0.00 -1.71 0.00 0.00 55.69 54.19 3f1s s MET 201 Cb -0.21 -3.07 0.02 0.00 2.01 0.00 0.00 34.83 33.58 3f1s s MET 201 CO 0.19 0.52 -0.02 0.42 -0.01 0.00 0.00 175.02 176.12 3f1s s ILE 202 N -0.34 0.34 0.37 2.53 1.01 0.23 -5.01 121.20 120.34 3f1s s ILE 202 Ca 0.09 0.01 -0.25 0.00 0.00 0.00 0.00 60.65 60.50 3f1s s ILE 202 Cb -0.12 -0.42 -0.09 0.00 0.01 0.00 0.00 42.46 41.84 3f1s s ILE 202 CO 0.02 0.19 1.03 -0.75 0.00 0.00 0.00 174.94 175.43 3f1s s LYS 203 N 1.10 4.30 -0.35 2.79 2.20 -1.26 -0.92 119.74 127.60 3f1s s LYS 203 Ca -0.08 1.49 -0.15 0.00 -0.36 0.00 0.00 55.97 56.86 3f1s s LYS 203 Cb -0.14 -2.65 -0.01 0.00 -1.51 0.00 0.00 37.83 33.53 3f1s s LYS 203 CO -0.01 -0.02 0.37 0.42 -0.36 0.00 0.00 175.35 175.75 3f1s s ILE 204 N -1.62 5.16 0.09 5.43 -1.09 -1.17 -0.81 121.20 127.19 3f1s s ILE 204 Ca 0.55 0.02 -0.01 0.00 -2.23 0.00 0.00 60.65 58.98 3f1s s ILE 204 Cb -0.22 -3.84 -0.26 0.00 -1.58 0.00 0.00 42.46 36.56 3f1s s ILE 204 CO 0.28 -0.12 1.18 0.71 -1.23 0.00 0.00 174.94 175.76 3f1s h THR 205 N 5.55 1.57 -3.79 2.92 1.35 -1.63 -3.46 112.91 115.41 3f1s h THR 205 Ca -0.30 -3.18 -0.17 0.00 -0.55 0.00 0.00 66.41 62.21 3f1s h THR 205 Cb 1.14 2.92 -0.22 0.00 -1.73 0.00 0.00 68.15 70.25 3f1s h THR 205 CO 0.70 0.92 -0.64 -1.00 -0.25 0.00 0.00 175.52 175.25 3f1s s HIS 206 N -2.67 0.14 -0.12 4.73 3.76 -1.24 -5.03 115.29 114.87 3f1s s HIS 206 Ca -0.02 -0.30 0.02 0.00 -0.15 0.00 0.00 55.06 54.61 3f1s s HIS 206 Cb 0.08 -0.11 0.01 0.00 1.11 0.00 0.00 32.58 33.67 3f1s s HIS 206 CO 0.86 -0.18 -0.20 0.08 -0.85 0.00 0.00 174.74 174.46 3f1s s VAL 207 N -1.13 1.85 -0.52 -0.90 1.01 -1.26 -1.64 120.40 117.81 3f1s s VAL 207 Ca -0.12 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.02 3f1s s VAL 207 Cb -0.07 -1.65 0.13 0.00 0.00 0.00 0.00 36.38 34.79 3f1s s VAL 207 CO -0.00 0.51 0.28 -1.00 0.00 0.00 0.00 175.10 174.89 3f1s s HIS 208 N 0.80 3.32 0.35 5.22 3.76 0.02 -4.98 115.29 123.77 3f1s s HIS 208 Ca -0.09 -3.02 -0.27 0.00 -0.15 0.00 0.00 55.06 51.53 3f1s s HIS 208 Cb -0.16 -2.94 -0.09 0.00 1.11 0.00 0.00 32.58 30.50 3f1s s HIS 208 CO -0.00 -0.80 1.13 0.08 -0.85 0.00 0.00 174.74 174.31 3f1s s VAL 209 N -0.05 3.34 0.28 -0.90 1.01 -1.26 -0.87 120.40 121.95 3f1s s VAL 209 Ca 0.16 1.21 -0.30 0.00 0.00 0.00 0.00 61.98 63.05 3f1s s VAL 209 Cb -0.24 -3.71 -0.13 0.00 0.00 0.00 0.00 36.38 32.30 3f1s s VAL 209 CO -0.02 0.18 1.32 1.57 0.00 0.00 0.00 175.10 178.15 3f1s n HIS 210 N 0.52 2.12 0.26 5.22 -0.00 -0.62 -4.85 115.22 117.87 3f1s n HIS 210 Ca 0.02 0.51 0.15 0.00 0.46 0.00 0.00 57.72 58.86 3f1s n HIS 210 Cb 0.46 -2.42 0.78 0.00 -0.12 0.00 0.00 29.99 28.69 3f1s n HIS 210 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3f1s h MET 211 N 3.31 0.00 0.00 1.57 -0.00 -1.92 -1.87 114.93 116.03 3f1s h MET 211 Ca -0.45 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.25 3f1s h MET 211 Cb 1.29 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.89 3f1s h MET 211 CO 0.69 0.00 -0.04 0.54 -0.00 0.00 0.00 176.91 178.10 3f1s n ARG 212 N -2.58 1.30 -1.77 -0.10 5.12 -1.26 -5.04 116.66 112.32 3f1s n ARG 212 Ca -0.01 -2.63 -0.42 0.00 -1.93 0.00 0.00 57.85 52.87 3f1s n ARG 212 Cb 0.10 -1.51 -0.02 0.00 -1.16 0.00 0.00 32.46 29.88 3f1s n ARG 212 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 3f1s s TYR 213 N -2.90 2.77 -0.13 -1.55 5.04 -0.70 -4.56 117.35 115.32 3f1s s TYR 213 Ca 0.32 0.73 -0.02 0.00 -2.44 0.00 0.00 57.07 55.66 3f1s s TYR 213 Cb 0.29 -4.08 0.04 0.00 0.35 0.00 0.00 41.96 38.56 3f1s s TYR 213 CO 0.02 -3.68 0.01 0.34 -1.34 0.00 0.00 175.55 170.90 3f1s s ASP 214 N 0.58 2.20 0.15 4.32 2.15 -0.87 -5.01 116.67 120.19 3f1s s ASP 214 Ca 0.65 -0.42 -0.13 0.00 0.43 0.00 0.00 52.55 53.07 3f1s s ASP 214 Cb -0.48 -0.52 0.03 0.00 -0.30 0.00 0.00 42.92 41.65 3f1s s ASP 214 CO 0.46 -0.24 1.67 0.00 -0.17 0.00 0.00 175.17 176.89 3f1s h ALA 215 N 8.29 0.66 0.38 3.66 0.00 -1.95 0.11 119.26 130.40 3f1s h ALA 215 Ca -0.19 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3f1s h ALA 215 Cb 1.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3f1s h ALA 215 CO 0.30 0.32 -0.28 0.22 0.00 0.00 0.00 179.25 179.81 3f1s h ASP 216 N 0.68 -0.73 0.64 0.00 -0.00 -1.98 -3.02 116.42 112.02 3f1s h ASP 216 Ca 0.16 0.05 -0.06 0.00 -0.00 0.00 0.00 57.03 57.18 3f1s h ASP 216 Cb 0.28 0.22 -0.01 0.00 -0.00 0.00 0.00 39.33 39.82 3f1s h ASP 216 CO -0.00 -0.40 -0.27 0.00 -0.00 0.00 0.00 179.24 178.56 3f1s h ALA 217 N -1.41 1.15 -0.00 -0.78 0.00 -2.01 -3.47 119.26 112.74 3f1s h ALA 217 Ca -0.05 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3f1s h ALA 217 Cb 0.52 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 3f1s h ALA 217 CO 0.02 0.34 -0.00 0.41 0.00 0.00 0.00 179.25 180.02 3f1s n GLY 218 N -0.16 0.38 3.80 0.00 0.00 0.37 -5.05 105.19 104.53 3f1s n GLY 218 Ca -0.01 -1.06 -0.37 0.00 0.00 0.00 0.00 46.02 44.59 3f1s n GLY 218 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3f1s s GLU 219 N -2.38 4.42 -1.36 1.61 2.02 -1.12 -4.23 118.70 117.67 3f1s s GLU 219 Ca 0.00 1.10 -0.03 0.00 0.02 0.00 0.00 54.97 56.06 3f1s s GLU 219 Cb 0.00 -2.85 0.02 0.00 0.10 0.00 0.00 34.13 31.40 3f1s s GLU 219 CO 0.00 0.35 0.78 0.09 0.02 0.00 0.00 175.26 176.49 3f1s n ASN 220 N 0.67 -2.08 -3.94 -0.19 3.02 -1.26 -2.06 115.26 109.43 3f1s n ASN 220 Ca -0.00 -0.80 -0.42 0.00 -0.03 0.00 0.00 54.58 53.32 3f1s n ASN 220 Cb 0.50 -4.05 0.00 0.00 -0.61 0.00 0.00 39.78 35.62 3f1s n ASN 220 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3f1s n ASP 221 N -3.01 4.63 -4.06 6.41 2.03 -1.26 -4.16 116.55 117.13 3f1s n ASP 221 Ca -0.22 -2.98 -0.08 0.00 0.52 0.00 0.00 54.79 52.04 3f1s n ASP 221 Cb 0.64 -1.58 -0.10 0.00 -0.72 0.00 0.00 41.12 39.36 3f1s n ASP 221 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3f1s s LEU 222 N 1.30 2.42 -0.04 -2.67 1.43 -1.26 -3.27 118.68 116.59 3f1s s LEU 222 Ca 0.44 -0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 52.55 3f1s s LEU 222 Cb 0.10 0.18 0.02 0.00 0.03 0.00 0.00 46.19 46.51 3f1s s LEU 222 CO -0.02 -0.52 0.28 -0.94 0.23 0.00 0.00 176.35 175.38 3f1s s SER 223 N -2.53 -0.20 -0.17 2.29 1.04 -0.26 -1.59 113.70 112.27 3f1s s SER 223 Ca 0.01 0.20 -0.06 0.00 0.48 0.00 0.00 55.95 56.58 3f1s s SER 223 Cb 0.03 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.51 3f1s s SER 223 CO -0.08 -0.33 0.04 -0.76 0.98 0.00 0.00 173.24 173.09 3f1s s LEU 224 N -0.88 3.71 -0.26 2.42 1.43 -0.05 -2.02 118.68 123.02 3f1s s LEU 224 Ca -0.10 0.05 -0.06 0.00 -1.03 0.00 0.00 54.13 53.00 3f1s s LEU 224 Cb -0.05 -1.92 -0.00 0.00 0.03 0.00 0.00 46.19 44.25 3f1s s LEU 224 CO 0.03 0.19 0.04 -0.76 0.23 0.00 0.00 176.35 176.08 3f1s s LEU 225 N 0.26 3.49 0.07 1.79 1.43 0.03 -0.80 118.68 124.95 3f1s s LEU 225 Ca 0.02 -0.52 -0.29 0.00 -1.03 0.00 0.00 54.13 52.31 3f1s s LEU 225 Cb -0.13 -1.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 3f1s s LEU 225 CO 0.01 -0.11 0.93 -0.70 0.23 0.00 0.00 176.35 176.71 3f1s s GLU 226 N 1.51 4.63 0.11 1.70 2.12 -0.65 -1.62 118.70 126.51 3f1s s GLU 226 Ca 0.04 1.38 -0.22 0.00 0.36 0.00 0.00 54.97 56.53 3f1s s GLU 226 Cb -0.16 -3.40 -0.07 0.00 0.26 0.00 0.00 34.13 30.76 3f1s s GLU 226 CO 0.01 0.16 0.67 -0.51 -0.54 0.00 0.00 175.26 175.04 3f1s s LEU 227 N 0.25 4.56 0.22 2.70 2.01 -0.36 -1.73 118.68 126.33 3f1s s LEU 227 Ca 0.47 1.44 -0.08 0.00 0.01 0.00 0.00 54.13 55.97 3f1s s LEU 227 Cb -0.22 -3.08 0.28 0.00 0.01 0.00 0.00 46.19 43.18 3f1s s LEU 227 CO 0.28 0.24 1.82 -0.08 1.01 0.00 0.00 176.35 179.62 3f1s h GLU 228 N 4.49 0.76 -4.78 1.70 4.81 -1.32 -3.41 114.58 116.83 3f1s h GLU 228 Ca -0.48 -0.05 -0.54 0.00 -0.13 0.00 0.00 59.36 58.16 3f1s h GLU 228 Cb 1.21 -0.17 -0.33 0.00 0.63 0.00 0.00 28.75 30.09 3f1s h GLU 228 CO 0.65 0.51 -0.83 -1.58 -0.73 0.00 0.00 179.01 177.03 3f1s s TRP 229 N -6.08 1.62 0.61 0.92 0.52 -1.26 -5.04 118.94 110.22 3f1s s TRP 229 Ca -0.13 -0.58 -0.18 0.00 0.02 0.00 0.00 56.10 55.23 3f1s s TRP 229 Cb 0.17 -1.15 -0.06 0.00 -1.15 0.00 0.00 33.47 31.28 3f1s s TRP 229 CO 0.77 -0.27 0.77 -2.30 0.02 0.00 0.00 176.95 175.94 3f1s n PRO 230 N 3.64 0.68 -2.58 4.98 -0.02 -1.26 -4.96 135.00 135.48 3f1s n PRO 230 Ca -0.21 0.27 -0.40 0.00 -2.02 0.00 0.00 63.50 61.13 3f1s n PRO 230 Cb 0.52 -1.98 -0.05 0.00 -0.02 0.00 0.00 33.50 31.98 3f1s n PRO 230 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3f1s s ILE 231 N -1.63 3.82 -0.75 4.25 -1.09 -0.40 -4.99 121.20 120.40 3f1s s ILE 231 Ca 0.73 1.73 -0.25 0.00 -2.23 0.00 0.00 60.65 60.63 3f1s s ILE 231 Cb -0.42 -4.10 0.05 0.00 -1.58 0.00 0.00 42.46 36.41 3f1s s ILE 231 CO 0.50 0.37 1.21 -1.10 -1.23 0.00 0.00 174.94 174.69 3f1s s GLN 232 N -0.97 3.22 0.27 2.79 -1.52 -1.26 -4.92 119.66 117.27 3f1s s GLN 232 Ca 0.45 -0.53 -0.29 0.00 -1.95 0.00 0.00 55.36 53.04 3f1s s GLN 232 Cb -0.29 -4.33 -0.09 0.00 -0.22 0.00 0.00 33.01 28.08 3f1s s GLN 232 CO 0.36 -2.05 0.96 0.00 -0.25 0.00 0.00 175.29 174.31 3f1s n PRO 234 N 1.16 0.06 -0.08 0.00 -0.04 -1.25 -4.75 135.00 130.10 3f1s n PRO 234 Ca -0.01 -0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.35 3f1s n PRO 234 Cb 0.48 -1.52 -0.03 0.00 -0.04 0.00 0.00 33.50 32.39 3f1s n PRO 234 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3f1s h GLY 235 N 4.90 0.39 1.71 0.55 0.00 -1.92 -3.07 103.07 105.63 3f1s h GLY 235 Ca 0.00 -0.19 -0.22 0.00 0.00 0.00 0.00 47.33 46.92 3f1s h GLY 235 CO 0.00 0.18 -0.98 0.00 0.00 0.00 0.00 176.54 175.75 3f1s h ALA 236 N 0.99 0.38 0.00 3.60 0.00 -1.10 -3.43 119.26 119.70 3f1s h ALA 236 Ca 0.09 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3f1s h ALA 236 Cb 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3f1s h ALA 236 CO -0.01 0.93 0.00 0.41 0.00 0.00 0.00 179.25 180.57 3f1s n GLY 237 N 1.06 -1.45 3.27 0.00 0.00 -1.16 -4.77 105.19 102.14 3f1s n GLY 237 Ca -0.05 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.81 3f1s n GLY 237 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f1s s LEU 238 N 0.00 0.60 0.53 0.99 1.43 -0.95 -4.08 118.68 117.20 3f1s s LEU 238 Ca 0.00 0.58 -0.18 0.00 -1.03 0.00 0.00 54.13 53.50 3f1s s LEU 238 Cb 0.00 1.32 -0.06 0.00 0.03 0.00 0.00 46.19 47.48 3f1s s LEU 238 CO 0.00 -0.23 1.05 -2.16 0.23 0.00 0.00 176.35 175.24 3f1s s PRO 239 N -0.25 3.59 0.38 1.29 0.04 -1.26 -2.80 135.00 135.99 3f1s s PRO 239 Ca -0.04 1.29 -0.21 0.00 0.04 0.00 0.00 61.00 62.08 3f1s s PRO 239 Cb -0.03 -2.07 -0.10 0.00 0.04 0.00 0.00 34.50 32.34 3f1s s PRO 239 CO 0.02 -0.60 0.90 0.54 0.04 0.00 0.00 177.00 177.90 3f1s s VAL 240 N -2.19 4.40 0.43 -0.36 0.11 -0.04 -1.50 120.40 121.26 3f1s s VAL 240 Ca 0.66 1.48 -0.25 0.00 -2.93 0.00 0.00 61.98 60.94 3f1s s VAL 240 Cb -0.16 -3.71 -0.08 0.00 -1.53 0.00 0.00 36.38 30.90 3f1s s VAL 240 CO 0.28 -0.17 1.26 0.00 -3.33 0.00 0.00 175.10 173.14 3f1s s THR 242 N -1.36 3.94 0.44 0.00 -4.23 -1.26 -0.87 115.64 112.30 3f1s s THR 242 Ca 0.60 -0.31 -0.13 0.00 -1.18 0.00 0.00 61.69 60.67 3f1s s THR 242 Cb -0.35 -2.79 -0.07 0.00 1.34 0.00 0.00 72.50 70.63 3f1s s THR 242 CO 0.44 0.42 0.84 -2.16 -0.54 0.00 0.00 174.62 173.61 3f1s s PRO 243 N 1.11 3.85 0.67 3.99 0.04 -1.26 -4.85 135.00 138.55 3f1s s PRO 243 Ca 0.03 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.58 3f1s s PRO 243 Cb -0.14 -2.31 -0.00 0.00 0.04 0.00 0.00 34.50 32.08 3f1s s PRO 243 CO 0.01 -0.10 1.06 -1.83 0.04 0.00 0.00 177.00 176.18 3f1s s GLU 244 N -3.87 3.02 0.10 4.56 4.04 -1.26 -4.78 118.70 120.50 3f1s s GLU 244 Ca 0.54 1.05 -0.33 0.00 0.04 0.00 0.00 54.97 56.27 3f1s s GLU 244 Cb -0.10 -2.00 -0.13 0.00 0.02 0.00 0.00 34.13 31.92 3f1s s GLU 244 CO 0.30 -1.04 1.58 -0.22 -1.84 0.00 0.00 175.26 174.04 3f1s h LYS 245 N -0.36 -0.76 -0.61 -4.83 3.64 -1.98 -2.28 116.57 109.39 3f1s h LYS 245 Ca -0.45 0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 58.89 3f1s h LYS 245 Cb 1.21 0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 33.18 3f1s h LYS 245 CO 0.57 -0.50 0.02 -0.44 -2.27 0.00 0.00 179.45 176.82 3f1s h ASP 246 N -0.78 1.04 -0.20 4.20 3.32 -1.93 -2.18 116.42 119.88 3f1s h ASP 246 Ca -0.01 -0.30 0.06 0.00 0.02 0.00 0.00 57.03 56.80 3f1s h ASP 246 Cb 0.75 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 39.96 3f1s h ASP 246 CO -0.19 1.08 -0.23 0.15 -1.72 0.00 0.00 179.24 178.33 3f1s h PHE 247 N 0.96 -0.60 -0.41 4.55 3.04 -1.92 -0.55 116.94 122.01 3f1s h PHE 247 Ca 0.18 0.03 0.01 0.00 3.98 0.00 0.00 57.97 62.17 3f1s h PHE 247 Cb 0.54 0.30 -0.02 0.00 2.56 0.00 0.00 35.95 39.32 3f1s h PHE 247 CO 0.04 -0.31 0.26 0.00 -2.02 0.00 0.00 178.31 176.28 3f1s h ALA 248 N 0.77 0.52 -0.00 2.41 0.00 -1.13 -0.12 119.26 121.72 3f1s h ALA 248 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3f1s h ALA 248 Cb 0.44 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3f1s h ALA 248 CO -0.35 -0.06 -0.30 0.39 0.00 0.00 0.00 179.25 178.94 3f1s n GLU 249 N -4.83 0.23 0.00 0.00 1.02 -0.84 -1.40 120.64 114.82 3f1s n GLU 249 Ca 0.01 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 3f1s n GLU 249 Cb 0.04 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 3f1s n GLU 249 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3f1s n HIS 250 N -1.29 0.00 -0.08 -0.32 8.25 -0.24 -4.61 115.22 116.93 3f1s n HIS 250 Ca 0.08 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.39 3f1s n HIS 250 Cb 0.33 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.38 3f1s n HIS 250 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3f1s n LEU 251 N -1.52 1.65 -0.00 2.41 4.32 -0.08 -4.72 117.00 119.06 3f1s n LEU 251 Ca 0.00 0.12 -0.00 0.00 -0.02 0.00 0.00 56.01 56.11 3f1s n LEU 251 Cb 0.19 -0.49 -0.00 0.00 -1.62 0.00 0.00 43.42 41.50 3f1s n LEU 251 CO 0.00 0.45 0.04 -0.07 -1.22 0.00 0.00 177.39 176.59 3f1s h LEU 252 N -0.42 -0.01 0.14 2.23 3.38 -1.40 -3.37 115.31 115.87 3f1s h LEU 252 Ca -0.39 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 3f1s h LEU 252 Cb 1.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3f1s h LEU 252 CO -0.19 0.05 -0.07 0.40 0.09 0.00 0.00 178.44 178.71 3f1s h ILE 253 N -0.12 0.96 0.00 1.22 2.04 -1.51 -0.17 117.51 119.93 3f1s h ILE 253 Ca -0.00 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.44 3f1s h ILE 253 Cb 0.01 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 3f1s h ILE 253 CO 0.00 0.10 0.00 -0.65 0.00 0.00 0.00 178.15 177.60 3f1s h PRO 254 N -0.39 0.00 0.00 2.37 0.11 -1.81 -3.37 132.00 128.91 3f1s h PRO 254 Ca -0.02 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.93 3f1s h PRO 254 Cb 0.31 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.39 3f1s h PRO 254 CO 0.03 0.00 -1.61 0.54 -0.21 0.00 0.00 178.00 176.76 3f1s n ARG 255 N -2.52 0.94 -4.11 1.05 1.74 -1.16 -5.00 116.66 107.60 3f1s n ARG 255 Ca 0.03 0.04 -0.33 0.00 -0.77 0.00 0.00 57.85 56.83 3f1s n ARG 255 Cb 0.35 -1.22 -0.07 0.00 -1.02 0.00 0.00 32.46 30.51 3f1s n ARG 255 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3f1s s THR 256 N -2.21 4.70 0.42 0.55 2.01 -0.09 -5.08 115.64 115.95 3f1s s THR 256 Ca -0.12 -0.43 -0.23 0.00 0.31 0.00 0.00 61.69 61.22 3f1s s THR 256 Cb 0.03 -3.15 -0.09 0.00 0.01 0.00 0.00 72.50 69.31 3f1s s THR 256 CO 0.28 0.34 1.07 -0.60 -0.69 0.00 0.00 174.62 175.02 3f1s s ARG 257 N -1.75 4.04 0.38 4.92 3.52 -1.26 -4.68 118.95 124.11 3f1s s ARG 257 Ca 0.23 1.55 0.08 0.00 -0.13 0.00 0.00 55.73 57.45 3f1s s ARG 257 Cb -0.12 -2.46 -0.04 0.00 -1.56 0.00 0.00 34.95 30.77 3f1s s ARG 257 CO 0.14 -0.26 0.22 0.20 -0.81 0.00 0.00 175.30 174.79 3f1s s GLY 258 N -1.57 2.12 -0.18 8.12 0.00 0.14 -4.69 107.32 111.26 3f1s s GLY 258 Ca 0.60 -1.93 0.01 0.00 0.00 0.00 0.00 44.72 43.40 3f1s s GLY 258 CO 0.28 -1.79 -0.15 1.08 0.00 0.00 0.00 173.10 172.52 3f1s s LEU 259 N -3.94 2.10 -0.44 0.66 1.43 0.16 -0.36 118.68 118.29 3f1s s LEU 259 Ca 0.41 -0.69 -0.18 0.00 -1.03 0.00 0.00 54.13 52.64 3f1s s LEU 259 Cb -0.01 -1.33 0.03 0.00 0.03 0.00 0.00 46.19 44.91 3f1s s LEU 259 CO 0.24 -0.06 0.51 -0.22 0.23 0.00 0.00 176.35 177.05 3f1s s LEU 260 N 1.36 4.87 0.03 1.79 2.96 0.57 -0.60 118.68 129.66 3f1s s LEU 260 Ca 0.03 -0.71 0.08 0.00 -0.22 0.00 0.00 54.13 53.31 3f1s s LEU 260 Cb -0.14 -2.44 -0.02 0.00 0.50 0.00 0.00 46.19 44.08 3f1s s LEU 260 CO -0.11 -0.68 -0.23 -0.94 -1.32 0.00 0.00 176.35 173.07 3f1s s SER 261 N 2.07 2.79 0.00 3.68 1.04 0.00 -1.58 113.70 121.70 3f1s s SER 261 Ca 0.14 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 56.05 3f1s s SER 261 Cb -0.17 -0.26 0.00 0.00 0.10 0.00 0.00 66.02 65.69 3f1s s SER 261 CO 0.14 0.23 0.00 0.61 0.98 0.00 0.00 173.24 175.19 3f1s n GLY 262 N 1.98 -1.26 3.85 7.32 0.00 -0.97 -1.86 105.19 114.26 3f1s n GLY 262 Ca -0.17 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 3f1s n GLY 262 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3f1s s TRP 263 N -2.71 3.64 0.20 1.61 0.52 -1.26 0.02 118.94 120.95 3f1s s TRP 263 Ca 0.00 0.90 -0.33 0.00 0.02 0.00 0.00 56.10 56.70 3f1s s TRP 263 Cb 0.00 -2.24 -0.13 0.00 -1.15 0.00 0.00 33.47 29.96 3f1s s TRP 263 CO 0.00 0.55 1.68 0.00 0.02 0.00 0.00 176.95 179.20 3f1s n ALA 264 N 1.19 2.43 0.19 0.98 0.00 -1.26 -1.43 120.51 122.60 3f1s n ALA 264 Ca -0.09 0.41 0.03 0.00 0.00 0.00 0.00 53.44 53.79 3f1s n ALA 264 Cb 0.52 -2.48 0.38 0.00 0.00 0.00 0.00 19.45 17.88 3f1s n ALA 264 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3f1s h ARG 265 N 6.51 0.00 -0.08 0.00 2.43 -1.60 -3.44 114.38 118.21 3f1s h ARG 265 Ca -0.44 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 58.55 3f1s h ARG 265 Cb 1.22 0.00 -0.20 0.00 -0.42 0.00 0.00 29.97 30.57 3f1s h ARG 265 CO 0.94 0.35 -0.45 0.27 -1.51 0.00 0.00 179.97 179.57 3f1s n ASN 266 N -4.04 -0.81 -4.72 -3.80 6.94 -1.26 -4.94 115.26 102.64 3f1s n ASN 266 Ca -0.02 -2.16 -0.42 0.00 -0.02 0.00 0.00 54.58 51.96 3f1s n ASN 266 Cb 0.40 0.42 -0.03 0.00 -2.36 0.00 0.00 39.78 38.20 3f1s n ASN 266 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3f1s s LEU 274 N -3.62 4.38 -0.13 -4.53 2.96 -1.26 -5.18 118.68 111.30 3f1s s LEU 274 Ca 0.12 2.17 0.01 0.00 -0.22 0.00 0.00 54.13 56.21 3f1s s LEU 274 Cb 0.39 -3.59 0.02 0.00 0.50 0.00 0.00 46.19 43.51 3f1s s LEU 274 CO -0.10 -0.54 -0.14 0.28 -1.32 0.00 0.00 176.35 174.53 3f1s s THR 275 N 0.95 1.51 -0.04 3.68 -1.32 0.10 -4.96 115.64 115.57 3f1s s THR 275 Ca 0.61 -0.61 0.07 0.00 -1.21 0.00 0.00 61.69 60.54 3f1s s THR 275 Cb -0.33 -1.41 -0.01 0.00 -1.51 0.00 0.00 72.50 69.24 3f1s s THR 275 CO 0.30 0.45 -0.24 -0.89 -2.21 0.00 0.00 174.62 172.03 3f1s s THR 276 N 1.31 1.94 -0.00 5.08 2.01 -1.26 -2.29 115.64 122.43 3f1s s THR 276 Ca 0.01 -1.03 -0.01 0.00 0.31 0.00 0.00 61.69 60.97 3f1s s THR 276 Cb -0.14 -1.63 -0.00 0.00 0.01 0.00 0.00 72.50 70.74 3f1s s THR 276 CO -0.07 0.55 0.02 -0.13 -0.69 0.00 0.00 174.62 174.30 3f1s s ARG 277 N -0.35 0.14 0.59 4.92 1.81 -0.62 -4.99 118.95 120.45 3f1s s ARG 277 Ca 0.03 -0.15 -0.19 0.00 -1.72 0.00 0.00 55.73 53.69 3f1s s ARG 277 Cb -0.11 0.05 -0.03 0.00 -0.45 0.00 0.00 34.95 34.40 3f1s s ARG 277 CO 0.01 -0.02 1.25 -2.14 -0.68 0.00 0.00 175.30 173.72 3f1s s PRO 278 N -0.45 2.94 0.06 3.54 0.02 -1.26 -0.32 135.00 139.54 3f1s s PRO 278 Ca -0.05 1.96 -0.06 0.00 0.02 0.00 0.00 61.00 62.87 3f1s s PRO 278 Cb -0.03 -1.99 -0.02 0.00 0.02 0.00 0.00 34.50 32.48 3f1s s PRO 278 CO -0.00 -1.26 0.10 0.14 -0.33 0.00 0.00 177.00 175.65 3f1s s VAL 279 N -1.48 0.16 0.08 3.83 -7.23 0.52 -4.62 120.40 111.66 3f1s s VAL 279 Ca 0.77 -1.33 0.01 0.00 -1.81 0.00 0.00 61.98 59.63 3f1s s VAL 279 Cb -0.34 -1.25 -0.04 0.00 0.56 0.00 0.00 36.38 35.31 3f1s s VAL 279 CO 0.37 -0.73 -0.06 0.42 -0.31 0.00 0.00 175.10 174.79 3f1s s THR 280 N -3.48 0.60 0.26 5.32 -4.23 -1.12 -0.68 115.64 112.32 3f1s s THR 280 Ca 0.02 -1.81 -0.30 0.00 -1.18 0.00 0.00 61.69 58.42 3f1s s THR 280 Cb 0.04 -1.53 -0.09 0.00 1.34 0.00 0.00 72.50 72.26 3f1s s THR 280 CO -0.09 -0.84 1.05 -0.22 -0.54 0.00 0.00 174.62 173.98 3f1s s LEU 281 N -2.85 4.58 -0.05 4.79 2.96 -1.26 0.69 118.68 127.54 3f1s s LEU 281 Ca 0.08 2.16 0.04 0.00 -0.22 0.00 0.00 54.13 56.20 3f1s s LEU 281 Cb 0.04 -3.62 -0.00 0.00 0.50 0.00 0.00 46.19 43.11 3f1s s LEU 281 CO -0.05 -0.05 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.07 3f1s s VAL 282 N -1.14 1.48 0.64 1.68 1.01 -1.01 -4.76 120.40 118.31 3f1s s VAL 282 Ca 0.43 -0.74 -0.14 0.00 0.00 0.00 0.00 61.98 61.54 3f1s s VAL 282 Cb -0.30 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 3f1s s VAL 282 CO 0.38 0.43 1.07 -1.61 0.00 0.00 0.00 175.10 175.37 3f1s s GLU 283 N 0.09 3.04 0.34 2.72 0.41 -1.26 -4.12 118.70 119.93 3f1s s GLU 283 Ca -0.05 1.18 0.02 0.00 -0.41 0.00 0.00 54.97 55.71 3f1s s GLU 283 Cb -0.12 -2.00 0.62 0.00 -1.78 0.00 0.00 34.13 30.85 3f1s s GLU 283 CO 0.03 -1.03 2.00 0.78 -0.49 0.00 0.00 175.26 176.55 3f1s h GLY 284 N -0.03 0.94 0.94 -1.39 0.00 -1.97 -1.76 103.07 99.80 3f1s h GLY 284 Ca -0.46 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 46.52 3f1s h GLY 284 CO 0.56 0.33 -0.04 -2.09 0.00 0.00 0.00 176.54 175.29 3f1s h GLU 285 N 0.88 -0.12 -0.02 4.80 4.81 -1.97 0.49 114.58 123.46 3f1s h GLU 285 Ca 0.25 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.49 3f1s h GLU 285 Cb -0.06 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.35 3f1s h GLU 285 CO -0.06 -0.02 0.00 1.49 -0.73 0.00 0.00 179.01 179.69 3f1s h GLU 286 N -0.19 0.03 -0.72 1.92 4.81 -1.90 -3.12 114.58 115.41 3f1s h GLU 286 Ca -0.01 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 3f1s h GLU 286 Cb 0.15 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 3f1s h GLU 286 CO 0.02 0.29 0.40 0.00 -0.73 0.00 0.00 179.01 178.99 3f1s h GLY 288 N 1.00 1.22 1.57 0.00 0.00 -0.94 0.51 103.07 106.43 3f1s h GLY 288 Ca 0.26 -0.21 -0.20 0.00 0.00 0.00 0.00 47.33 47.18 3f1s h GLY 288 CO -0.04 -0.04 -0.80 1.46 0.00 0.00 0.00 176.54 177.12 3f1s h GLN 289 N 0.55 0.41 -0.18 4.80 4.20 -1.30 0.55 115.11 124.14 3f1s h GLN 289 Ca 0.42 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 3f1s h GLN 289 Cb 0.58 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 3f1s h GLN 289 CO -0.36 1.02 -0.00 0.28 -0.67 0.00 0.00 178.83 179.10 3f1s h VAL 290 N 0.27 1.25 -0.01 -0.54 2.07 -0.86 -3.16 116.25 115.27 3f1s h VAL 290 Ca -0.05 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.61 3f1s h VAL 290 Cb 1.40 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 3f1s h VAL 290 CO 0.14 0.26 -0.16 0.18 0.02 0.00 0.00 177.57 178.01 3f1s n LEU 291 N -4.71 0.87 -3.67 2.57 4.77 0.14 -4.96 117.00 112.00 3f1s n LEU 291 Ca -0.05 -0.20 -0.23 0.00 -0.03 0.00 0.00 56.01 55.50 3f1s n LEU 291 Cb 0.22 -0.12 0.06 0.00 -2.33 0.00 0.00 43.42 41.25 3f1s n LEU 291 CO 0.37 0.16 0.10 -3.20 -1.33 0.00 0.00 177.39 173.48 3f1s n ASN 292 N -0.64 -3.67 -3.88 -1.43 5.15 0.17 -4.61 115.26 106.35 3f1s n ASN 292 Ca 0.14 -0.69 -0.15 0.00 -0.60 0.00 0.00 54.58 53.28 3f1s n ASN 292 Cb 0.32 -4.50 -0.09 0.00 -0.53 0.00 0.00 39.78 34.98 3f1s n ASN 292 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3f1s s VAL 293 N -3.42 0.00 -0.32 3.44 -7.23 0.16 -5.02 120.40 108.02 3f1s s VAL 293 Ca 0.33 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.42 3f1s s VAL 293 Cb -0.16 -2.50 0.01 0.00 0.56 0.00 0.00 36.38 34.30 3f1s s VAL 293 CO 0.78 0.00 0.12 0.42 -0.31 0.00 0.00 175.10 176.11 3f1s s THR 294 N -3.89 4.22 -0.02 5.32 -4.23 -1.26 -4.33 115.64 111.44 3f1s s THR 294 Ca 0.40 -0.69 -0.30 0.00 -1.18 0.00 0.00 61.69 59.92 3f1s s THR 294 Cb 0.05 -3.22 -0.04 0.00 1.34 0.00 0.00 72.50 70.64 3f1s s THR 294 CO 0.18 0.00 1.18 -0.69 -0.54 0.00 0.00 174.62 174.75 3f1s s VAL 295 N 1.53 4.26 0.65 2.29 1.01 -1.26 -5.03 120.40 123.84 3f1s s VAL 295 Ca 0.03 1.59 -0.04 0.00 0.00 0.00 0.00 61.98 63.57 3f1s s VAL 295 Cb -0.18 -4.02 0.05 0.00 0.00 0.00 0.00 36.38 32.23 3f1s s VAL 295 CO 0.04 0.04 0.93 0.42 0.00 0.00 0.00 175.10 176.53 3f1s s THR 296 N 1.83 2.41 -0.17 3.92 -4.23 -1.26 -4.99 115.64 113.15 3f1s s THR 296 Ca 0.56 -0.43 0.28 0.00 -1.18 0.00 0.00 61.69 60.92 3f1s s THR 296 Cb -0.25 -2.98 0.30 0.00 1.34 0.00 0.00 72.50 70.90 3f1s s THR 296 CO 0.24 0.00 1.84 0.71 -0.54 0.00 0.00 174.62 176.87 3f1s h THR 297 N -0.36 0.00 -0.38 3.99 1.35 -2.03 -2.76 112.91 112.72 3f1s h THR 297 Ca -0.43 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 3f1s h THR 297 Cb 1.31 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 3f1s h THR 297 CO 0.56 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 176.37 3f1s n ARG 298 N -2.56 3.18 -4.25 4.72 1.74 -1.26 -4.94 116.66 113.29 3f1s n ARG 298 Ca 0.01 -2.61 -0.14 0.00 -0.77 0.00 0.00 57.85 54.33 3f1s n ARG 298 Cb 0.21 -1.69 -0.10 0.00 -1.02 0.00 0.00 32.46 29.86 3f1s n ARG 298 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3f1s s THR 299 N -2.04 0.55 0.27 0.55 -4.23 -1.04 -0.67 115.64 109.04 3f1s s THR 299 Ca 0.38 -1.98 -0.20 0.00 -1.18 0.00 0.00 61.69 58.71 3f1s s THR 299 Cb 0.27 -2.28 0.05 0.00 1.34 0.00 0.00 72.50 71.88 3f1s s THR 299 CO 0.15 -0.31 0.83 -0.72 -0.54 0.00 0.00 174.62 174.03 3f1s s TYR 300 N -3.75 -0.05 0.09 3.99 -0.85 -0.58 -4.56 117.35 111.65 3f1s s TYR 300 Ca 0.29 -0.44 0.09 0.00 -0.52 0.00 0.00 57.07 56.48 3f1s s TYR 300 Cb 0.07 0.73 -0.04 0.00 0.38 0.00 0.00 41.96 43.11 3f1s s TYR 300 CO 0.07 -1.22 -0.20 0.00 -1.52 0.00 0.00 175.55 172.69 3f1s s GLU 302 N -1.86 2.09 0.17 0.00 0.41 -0.14 -2.42 118.70 116.97 3f1s s GLU 302 Ca 0.16 -0.74 -0.30 0.00 -0.41 0.00 0.00 54.97 53.68 3f1s s GLU 302 Cb -0.10 -1.81 -0.07 0.00 -1.78 0.00 0.00 34.13 30.36 3f1s s GLU 302 CO 0.08 0.32 0.97 0.50 -0.49 0.00 0.00 175.26 176.63 3f1s s ARG 303 N -0.09 4.75 0.01 1.61 3.52 0.22 -0.35 118.95 128.61 3f1s s ARG 303 Ca -0.03 1.50 0.03 0.00 -0.13 0.00 0.00 55.73 57.10 3f1s s ARG 303 Cb -0.12 -3.32 -0.01 0.00 -1.56 0.00 0.00 34.95 29.94 3f1s s ARG 303 CO 0.03 0.32 -0.09 0.45 -0.81 0.00 0.00 175.30 175.20 3f1s s SER 304 N -0.51 1.07 0.00 -2.12 0.15 0.13 -2.78 113.70 109.64 3f1s s SER 304 Ca 0.45 -0.24 0.23 0.00 0.70 0.00 0.00 55.95 57.08 3f1s s SER 304 Cb -0.25 -0.09 1.29 0.00 -1.71 0.00 0.00 66.02 65.25 3f1s s SER 304 CO 0.32 0.06 1.84 -1.54 1.20 0.00 0.00 173.24 175.11 3f1s n SER 305 N 2.58 0.16 -4.03 5.45 3.41 -1.26 -4.57 113.62 115.37 3f1s n SER 305 Ca -0.15 -1.33 -0.08 0.00 -0.26 0.00 0.00 58.87 57.05 3f1s n SER 305 Cb 0.56 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.40 3f1s n SER 305 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3f1s s VAL 306 N -1.99 0.16 0.72 -3.33 1.01 -1.26 -5.09 120.40 110.62 3f1s s VAL 306 Ca 0.34 -1.31 -0.16 0.00 0.00 0.00 0.00 61.98 60.85 3f1s s VAL 306 Cb 0.16 -0.83 0.03 0.00 0.00 0.00 0.00 36.38 35.74 3f1s s VAL 306 CO 0.26 -0.72 1.23 0.00 0.00 0.00 0.00 175.10 175.87 3f1s s ALA 307 N -2.58 2.14 0.38 5.51 0.00 -1.26 -4.62 121.76 121.33 3f1s s ALA 307 Ca -0.06 0.97 0.12 0.00 0.00 0.00 0.00 51.96 52.99 3f1s s ALA 307 Cb -0.02 -3.50 0.75 0.00 0.00 0.00 0.00 23.12 20.36 3f1s s ALA 307 CO -0.05 -1.87 1.85 0.00 0.00 0.00 0.00 175.76 175.69 3f1s h ALA 308 N -0.17 1.43 0.00 0.00 0.00 -1.15 -2.68 119.26 116.69 3f1s h ALA 308 Ca -0.48 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.12 3f1s h ALA 308 Cb 1.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3f1s h ALA 308 CO 0.50 0.42 0.00 0.00 0.00 0.00 0.00 179.25 180.17 3f1s n MET 309 N -4.14 0.10 -0.10 0.00 0.00 0.24 -2.00 117.12 111.22 3f1s n MET 309 Ca -0.02 0.47 0.11 0.00 0.00 0.00 0.00 57.70 58.26 3f1s n MET 309 Cb 0.37 -1.75 0.48 0.00 0.00 0.00 0.00 33.22 32.32 3f1s n MET 309 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 3f1s h HIS 310 N 0.00 0.49 -2.83 3.17 6.17 -1.74 -3.39 115.15 117.02 3f1s h HIS 310 Ca 0.00 0.01 -0.59 0.00 0.71 0.00 0.00 60.37 60.50 3f1s h HIS 310 Cb 0.17 -0.16 -0.05 0.00 2.52 0.00 0.00 27.41 29.89 3f1s h HIS 310 CO 0.00 0.24 -0.52 -1.58 0.71 0.00 0.00 177.93 176.77 3f1s s TRP 311 N -5.44 3.37 0.53 5.26 0.51 -0.85 -1.96 118.94 120.37 3f1s s TRP 311 Ca -0.08 0.13 -0.17 0.00 -2.12 0.00 0.00 56.10 53.86 3f1s s TRP 311 Cb 0.20 -1.66 -0.07 0.00 -0.81 0.00 0.00 33.47 31.13 3f1s s TRP 311 CO 0.75 0.54 1.01 1.41 -0.51 0.00 0.00 176.95 180.15 3f1s s MET 312 N -2.80 3.79 0.31 4.98 1.75 -0.51 -4.55 119.30 122.27 3f1s s MET 312 Ca 0.33 1.04 -0.29 0.00 -1.25 0.00 0.00 55.69 55.52 3f1s s MET 312 Cb -0.12 -2.11 -0.12 0.00 2.84 0.00 0.00 34.83 35.32 3f1s s MET 312 CO 0.26 -0.41 1.46 -0.25 -0.65 0.00 0.00 175.02 175.43 3f1s n ASP 313 N -1.64 3.36 0.00 1.11 9.92 -1.26 -2.49 116.55 125.55 3f1s n ASP 313 Ca 0.07 1.18 0.00 0.00 -0.53 0.00 0.00 54.79 55.51 3f1s n ASP 313 Cb 0.54 -1.54 0.00 0.00 -0.64 0.00 0.00 41.12 39.48 3f1s n ASP 313 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3f1s n GLY 314 N 1.44 0.65 3.75 0.44 0.00 0.55 -1.08 105.19 110.94 3f1s n GLY 314 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 3f1s n GLY 314 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3f1s s SER 315 N -2.82 3.91 0.04 1.61 0.01 -1.04 -3.13 113.70 112.29 3f1s s SER 315 Ca 0.00 1.52 0.01 0.00 1.31 0.00 0.00 55.95 58.79 3f1s s SER 315 Cb 0.00 -2.22 -0.03 0.00 0.21 0.00 0.00 66.02 63.99 3f1s s SER 315 CO 0.00 -2.36 -0.06 0.68 0.41 0.00 0.00 173.24 171.90 3f1s s VAL 316 N -2.97 0.44 -0.17 3.43 -7.23 -0.78 -0.13 120.40 112.99 3f1s s VAL 316 Ca 0.62 -1.17 -0.08 0.00 -1.81 0.00 0.00 61.98 59.55 3f1s s VAL 316 Cb -0.17 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 36.04 3f1s s VAL 316 CO 0.56 -0.49 0.10 -0.69 -0.31 0.00 0.00 175.10 174.27 3f1s s VAL 317 N -1.76 5.14 0.17 1.32 1.01 -0.60 -0.82 120.40 124.86 3f1s s VAL 317 Ca -0.08 0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.05 3f1s s VAL 317 Cb -0.08 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 3f1s s VAL 317 CO -0.01 0.49 -0.14 0.42 0.00 0.00 0.00 175.10 175.86 3f1s s THR 318 N 0.00 1.55 -0.02 3.92 -4.23 0.23 -1.77 115.64 115.33 3f1s s THR 318 Ca 0.08 -2.04 -0.01 0.00 -1.18 0.00 0.00 61.69 58.54 3f1s s THR 318 Cb -0.12 -1.87 0.02 0.00 1.34 0.00 0.00 72.50 71.87 3f1s s THR 318 CO 0.00 -0.55 0.05 -0.13 -0.54 0.00 0.00 174.62 173.45 3f1s s ARG 319 N -3.35 0.02 0.29 3.99 0.52 0.05 -0.67 118.95 119.81 3f1s s ARG 319 Ca 0.18 0.15 -0.14 0.00 -0.52 0.00 0.00 55.73 55.39 3f1s s ARG 319 Cb -0.02 -0.10 -0.09 0.00 0.52 0.00 0.00 34.95 35.27 3f1s s ARG 319 CO 0.05 -0.08 0.69 -2.00 0.02 0.00 0.00 175.30 173.98 3f1s s GLU 320 N 0.54 3.98 -0.30 3.54 -6.30 -1.26 -0.21 118.70 118.70 3f1s s GLU 320 Ca -0.04 0.60 -0.06 0.00 -2.50 0.00 0.00 54.97 52.96 3f1s s GLU 320 Cb -0.06 -2.51 0.15 0.00 0.00 0.00 0.00 34.13 31.71 3f1s s GLU 320 CO -0.02 0.21 0.62 -1.58 0.02 0.00 0.00 175.26 174.51 3f1s s HIS 321 N -1.91 -1.44 -1.42 5.30 2.46 0.14 -4.95 115.29 113.47 3f1s s HIS 321 Ca 0.52 2.06 -0.00 0.00 0.47 0.00 0.00 55.06 58.11 3f1s s HIS 321 Cb -0.11 0.70 0.00 0.00 -0.13 0.00 0.00 32.58 33.04 3f1s s HIS 321 CO 0.18 -0.75 0.41 0.54 -2.47 0.00 0.00 174.74 172.66 3f1s n ARG 322 N 5.44 -3.24 -1.64 2.88 5.12 -1.26 -2.32 116.66 121.64 3f1s n ARG 322 Ca -0.07 0.40 -0.05 0.00 -1.93 0.00 0.00 57.85 56.20 3f1s n ARG 322 Cb 0.50 -4.52 -0.01 0.00 -1.16 0.00 0.00 32.46 27.27 3f1s n ARG 322 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3f1s n GLY 323 N -1.99 0.44 3.12 -0.13 0.00 -1.26 -5.04 105.19 100.33 3f1s n GLY 323 Ca -0.30 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.82 3f1s n GLY 323 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3f1s s SER 324 N -2.87 -0.22 -0.21 1.61 0.01 -0.98 -4.79 113.70 106.24 3f1s s SER 324 Ca 0.00 0.40 -0.12 0.00 1.31 0.00 0.00 55.95 57.54 3f1s s SER 324 Cb 0.00 0.45 -0.05 0.00 0.21 0.00 0.00 66.02 66.63 3f1s s SER 324 CO 0.00 -0.13 0.21 0.26 0.41 0.00 0.00 173.24 174.00 3f1s s TRP 325 N -0.08 3.37 -0.05 2.43 0.52 0.10 -0.68 118.94 124.55 3f1s s TRP 325 Ca -0.02 0.37 0.04 0.00 0.02 0.00 0.00 56.10 56.51 3f1s s TRP 325 Cb -0.02 -2.30 -0.02 0.00 -1.15 0.00 0.00 33.47 29.97 3f1s s TRP 325 CO 0.01 0.13 -0.15 -0.06 0.02 0.00 0.00 176.95 176.90 3f1s s PHE 326 N 0.85 2.69 -0.10 -1.98 0.08 0.71 -2.37 117.98 117.85 3f1s s PHE 326 Ca 0.11 -0.21 -0.29 0.00 0.12 0.00 0.00 56.93 56.66 3f1s s PHE 326 Cb -0.13 -1.64 -0.01 0.00 -0.57 0.00 0.00 43.02 40.67 3f1s s PHE 326 CO 0.03 0.14 0.98 -1.17 -0.10 0.00 0.00 175.22 175.11 3f1s s LEU 327 N -0.64 4.25 -0.00 -0.37 2.96 -0.05 -0.77 118.68 124.06 3f1s s LEU 327 Ca 0.10 1.50 0.00 0.00 -0.22 0.00 0.00 54.13 55.51 3f1s s LEU 327 Cb -0.11 -3.52 -0.01 0.00 0.50 0.00 0.00 46.19 43.05 3f1s s LEU 327 CO 0.01 -0.42 0.01 0.35 -1.32 0.00 0.00 176.35 174.98 3f1s n THR 328 N 4.50 0.00 -3.75 3.68 -2.24 -0.73 -4.38 114.28 111.36 3f1s n THR 328 Ca 0.08 -0.08 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 3f1s n THR 328 Cb 0.49 0.56 -0.09 0.00 -2.10 0.00 0.00 70.33 69.19 3f1s n THR 328 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3f1s s GLY 329 N -1.91 -0.18 -0.06 3.38 0.00 -1.09 -2.91 107.32 104.54 3f1s s GLY 329 Ca -0.00 0.45 0.05 0.00 0.00 0.00 0.00 44.72 45.22 3f1s s GLY 329 CO 0.02 0.25 -0.22 0.14 0.00 0.00 0.00 173.10 173.28 3f1s s VAL 330 N -1.10 1.86 -0.24 1.40 1.01 -0.95 -1.56 120.40 120.83 3f1s s VAL 330 Ca -0.12 -0.95 -0.18 0.00 0.00 0.00 0.00 61.98 60.74 3f1s s VAL 330 Cb -0.05 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 3f1s s VAL 330 CO 0.04 0.52 0.50 -0.22 0.00 0.00 0.00 175.10 175.94 3f1s s LEU 331 N -0.01 4.09 0.00 3.92 0.20 0.82 -0.08 118.68 127.61 3f1s s LEU 331 Ca -0.06 0.55 0.00 0.00 0.69 0.00 0.00 54.13 55.31 3f1s s LEU 331 Cb -0.14 -2.65 0.00 0.00 -0.43 0.00 0.00 46.19 42.97 3f1s s LEU 331 CO 0.04 -0.23 0.00 0.61 -0.29 0.00 0.00 176.35 176.48 3f1s n GLY 332 N 4.22 5.37 3.65 7.98 0.00 -1.26 -0.33 105.19 124.82 3f1s n GLY 332 Ca -0.05 -1.35 -0.44 0.00 0.00 0.00 0.00 46.02 44.18 3f1s n GLY 332 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3f1s n SER 333 N 0.00 3.77 -4.86 1.61 7.64 -1.26 -4.90 113.62 115.62 3f1s n SER 333 Ca 0.00 0.79 -0.37 0.00 1.01 0.00 0.00 58.87 60.30 3f1s n SER 333 Cb 0.00 -1.48 -0.06 0.00 -1.01 0.00 0.00 64.21 61.66 3f1s n SER 333 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3f1s s GLN 334 N 4.76 3.72 0.94 1.43 -1.52 -1.26 -4.98 119.66 122.75 3f1s s GLN 334 Ca 0.93 0.17 -0.14 0.00 -1.95 0.00 0.00 55.36 54.36 3f1s s GLN 334 Cb -0.50 -3.15 0.16 0.00 -0.22 0.00 0.00 33.01 29.30 3f1s s GLN 334 CO 0.44 0.68 1.19 -1.25 -0.25 0.00 0.00 175.29 176.10 3f1s s PRO 335 N -1.32 0.87 -1.76 2.91 0.04 -1.26 -4.14 135.00 130.33 3f1s s PRO 335 Ca 0.24 0.05 -0.18 0.00 0.04 0.00 0.00 61.00 61.15 3f1s s PRO 335 Cb -0.15 -1.83 0.18 0.00 0.04 0.00 0.00 34.50 32.74 3f1s s PRO 335 CO 0.12 -2.33 0.44 1.33 0.04 0.00 0.00 177.00 176.61 3f1s n VAL 336 N -3.81 -0.23 -0.91 -0.36 0.24 -1.26 -0.83 118.33 111.17 3f1s n VAL 336 Ca 0.10 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 3f1s n VAL 336 Cb 0.60 -0.60 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 3f1s n VAL 336 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3f1s n GLY 337 N -1.41 0.81 2.24 7.63 0.00 -1.26 -3.42 105.19 109.78 3f1s n GLY 337 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 3f1s n GLY 337 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f1s n GLY 338 N -2.00 0.49 0.01 -0.02 0.00 -0.01 -4.75 105.19 98.90 3f1s n GLY 338 Ca 0.00 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.63 3f1s n GLY 338 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f1s n GLN 339 N -2.31 0.15 -2.27 1.61 10.64 -1.22 0.83 117.38 124.81 3f1s n GLN 339 Ca -0.11 -0.03 -0.35 0.00 -1.83 0.00 0.00 57.00 54.67 3f1s n GLN 339 Cb 0.48 -1.52 -0.00 0.00 -0.86 0.00 0.00 30.24 28.34 3f1s n GLN 339 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3f1s s ALA 340 N -3.11 2.72 -2.02 2.61 0.00 -1.26 -4.58 121.76 116.13 3f1s s ALA 340 Ca 0.05 0.82 0.08 0.00 0.00 0.00 0.00 51.96 52.92 3f1s s ALA 340 Cb 0.16 -3.36 0.44 0.00 0.00 0.00 0.00 23.12 20.36 3f1s s ALA 340 CO 0.85 -0.74 1.29 0.72 0.00 0.00 0.00 175.76 177.89 3f1s n HIS 341 N -1.23 0.06 -4.14 0.00 8.25 -1.26 -2.89 115.22 114.01 3f1s n HIS 341 Ca 0.11 -0.03 -0.28 0.00 -0.26 0.00 0.00 57.72 57.27 3f1s n HIS 341 Cb 0.51 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.55 3f1s n HIS 341 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3f1s s MET 342 N -1.94 2.61 -0.10 -0.41 -1.94 -1.26 0.18 119.30 116.43 3f1s s MET 342 Ca 0.13 -0.95 0.03 0.00 -1.71 0.00 0.00 55.69 53.20 3f1s s MET 342 Cb 0.06 -2.51 0.00 0.00 2.01 0.00 0.00 34.83 34.40 3f1s s MET 342 CO 0.10 0.49 -0.22 0.08 -0.01 0.00 0.00 175.02 175.47 3f1s s VAL 343 N -1.62 1.91 -0.34 -6.03 1.01 0.52 -4.65 120.40 111.20 3f1s s VAL 343 Ca 0.28 -0.92 -0.18 0.00 0.00 0.00 0.00 61.98 61.16 3f1s s VAL 343 Cb -0.10 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 3f1s s VAL 343 CO 0.20 0.53 0.52 -0.22 0.00 0.00 0.00 175.10 176.13 3f1s s LEU 344 N 0.53 4.31 0.18 3.92 2.96 -1.26 -0.96 118.68 128.36 3f1s s LEU 344 Ca -0.15 0.04 0.10 0.00 -0.22 0.00 0.00 54.13 53.90 3f1s s LEU 344 Cb -0.17 -2.61 -0.04 0.00 0.50 0.00 0.00 46.19 43.87 3f1s s LEU 344 CO 0.05 -0.47 -0.19 0.68 -1.32 0.00 0.00 176.35 175.10 3f1s s VAL 345 N 2.42 2.68 0.10 1.68 -7.23 -0.26 -4.35 120.40 115.44 3f1s s VAL 345 Ca 0.19 -1.87 -0.30 0.00 -1.81 0.00 0.00 61.98 58.20 3f1s s VAL 345 Cb -0.15 -2.30 -0.06 0.00 0.56 0.00 0.00 36.38 34.43 3f1s s VAL 345 CO 0.13 -0.10 1.06 -0.89 -0.31 0.00 0.00 175.10 174.99 3f1s s THR 346 N -1.65 4.26 -0.93 5.32 2.01 0.88 -1.52 115.64 124.01 3f1s s THR 346 Ca 0.22 1.79 -0.23 0.00 0.31 0.00 0.00 61.69 63.78 3f1s s THR 346 Cb -0.08 -4.14 0.07 0.00 0.01 0.00 0.00 72.50 68.35 3f1s s THR 346 CO 0.12 0.23 1.31 -0.75 -0.69 0.00 0.00 174.62 174.84 3f1s s LYS 347 N 0.29 3.49 0.45 4.92 2.20 0.16 -2.23 119.74 129.01 3f1s s LYS 347 Ca 0.51 -1.09 0.14 0.00 -0.36 0.00 0.00 55.97 55.16 3f1s s LYS 347 Cb -0.26 -4.99 1.05 0.00 -1.51 0.00 0.00 37.83 32.13 3f1s s LYS 347 CO 0.31 -2.08 2.02 0.28 -0.36 0.00 0.00 175.35 175.53 3f1s h VAL 348 N 6.40 0.94 -0.07 4.02 2.07 -1.84 -2.13 116.25 125.65 3f1s h VAL 348 Ca 0.08 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.49 3f1s h VAL 348 Cb 1.02 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 3f1s h VAL 348 CO 1.32 0.06 0.28 0.77 0.02 0.00 0.00 177.57 180.02 3f1s h SER 349 N 0.35 0.00 -0.09 0.57 4.64 -1.86 -1.35 113.55 115.81 3f1s h SER 349 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3f1s h SER 349 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3f1s h SER 349 CO -0.05 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.45 3f1s n ARG 350 N -3.12 1.63 -0.24 4.77 5.12 -0.80 -4.21 116.66 119.82 3f1s n ARG 350 Ca -0.01 -0.94 0.09 0.00 -1.93 0.00 0.00 57.85 55.06 3f1s n ARG 350 Cb 0.35 -1.42 0.17 0.00 -1.16 0.00 0.00 32.46 30.40 3f1s n ARG 350 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 3f1s n TYR 351 N 0.15 0.16 -0.18 -1.55 4.01 -0.51 -4.77 117.16 114.47 3f1s n TYR 351 Ca 0.17 -1.10 -0.05 0.00 -0.16 0.00 0.00 57.90 56.77 3f1s n TYR 351 Cb 0.31 -0.20 0.13 0.00 -0.31 0.00 0.00 39.34 39.27 3f1s n TYR 351 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3f1s h SER 352 N 0.44 0.90 -0.40 7.72 4.64 -1.74 -1.95 113.55 123.15 3f1s h SER 352 Ca 0.01 -0.18 -0.15 0.00 -0.47 0.00 0.00 61.79 61.00 3f1s h SER 352 Cb 1.08 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.93 3f1s h SER 352 CO 0.04 0.88 -0.33 0.25 -0.87 0.00 0.00 176.83 176.81 3f1s h LEU 353 N 0.91 1.00 -0.48 5.97 5.85 -1.94 -2.69 115.31 123.93 3f1s h LEU 353 Ca 0.19 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 3f1s h LEU 353 Cb 0.34 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 3f1s h LEU 353 CO 0.00 1.23 0.22 -0.25 -0.34 0.00 0.00 178.44 179.30 3f1s h TRP 354 N 0.79 0.70 -0.39 1.25 7.01 -1.86 -0.39 115.95 123.05 3f1s h TRP 354 Ca 0.08 -0.04 0.07 0.00 2.11 0.00 0.00 58.89 61.11 3f1s h TRP 354 Cb 0.92 -0.22 -0.07 0.00 -2.10 0.00 0.00 29.16 27.69 3f1s h TRP 354 CO 0.06 0.57 -0.04 0.74 -2.79 0.00 0.00 178.44 176.98 3f1s h PHE 355 N 0.63 -0.09 0.12 2.65 0.04 -1.31 -1.25 116.94 117.74 3f1s h PHE 355 Ca 0.16 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.96 3f1s h PHE 355 Cb 0.14 0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.39 3f1s h PHE 355 CO -0.01 -0.11 -0.06 0.87 -0.60 0.00 0.00 178.31 178.40 3f1s h LYS 356 N 0.06 -0.16 -0.78 1.51 1.57 -1.19 0.48 116.57 118.06 3f1s h LYS 356 Ca 0.19 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 59.09 3f1s h LYS 356 Cb 0.28 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.55 3f1s h LYS 356 CO -0.35 0.06 0.40 1.96 -0.57 0.00 0.00 179.45 180.95 3f1s h GLN 357 N -0.36 0.62 0.11 3.15 1.08 -0.91 -1.58 115.11 117.22 3f1s h GLN 357 Ca -0.02 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 3f1s h GLN 357 Cb 0.29 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 3f1s h GLN 357 CO 0.03 0.41 -0.05 0.82 -0.95 0.00 0.00 178.83 179.09 3f1s h ILE 358 N 0.64 0.50 0.00 2.54 1.08 -1.21 -3.37 117.51 117.69 3f1s h ILE 358 Ca 0.39 -1.19 0.00 0.00 -0.39 0.00 0.00 64.86 63.67 3f1s h ILE 358 Cb 0.46 0.90 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 3f1s h ILE 358 CO -0.30 0.15 0.00 0.23 -0.69 0.00 0.00 178.15 177.55 3f1s n MET 359 N -4.84 0.09 -0.22 2.37 2.81 0.15 -1.45 117.12 116.03 3f1s n MET 359 Ca -0.05 0.20 0.09 0.00 -1.81 0.00 0.00 57.70 56.13 3f1s n MET 359 Cb 0.18 -1.63 0.25 0.00 -0.71 0.00 0.00 33.22 31.31 3f1s n MET 359 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3f1s n ASN 360 N -1.79 2.63 0.00 7.83 4.13 -0.60 -5.05 115.26 122.42 3f1s n ASN 360 Ca 0.05 -1.95 0.00 0.00 1.68 0.00 0.00 54.58 54.36 3f1s n ASN 360 Cb 0.28 -0.29 0.00 0.00 -1.54 0.00 0.00 39.78 38.23 3f1s n ASN 360 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54