#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a15 s SER -8 N 0.00 4.26 0.99 6.43 0.01 -1.26 -5.05 113.70 119.08 3a15 s SER -8 Ca 0.00 2.01 -0.01 0.00 1.31 0.00 0.00 55.95 59.26 3a15 s SER -8 Cb 0.00 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.70 3a15 s SER -8 CO 0.00 -2.21 0.09 0.61 0.41 0.00 0.00 173.24 172.14 3a15 n GLY -7 N -0.53 -1.13 0.37 3.44 0.00 -1.26 -4.95 105.19 101.13 3a15 n GLY -7 Ca 0.11 -1.68 -0.01 0.00 0.00 0.00 0.00 46.02 44.44 3a15 n GLY -7 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3a15 h LEU -6 N 0.00 1.10 -7.53 0.99 5.85 -2.06 -3.32 115.31 110.34 3a15 h LEU -6 Ca -0.03 -0.02 -0.68 0.00 0.84 0.00 0.00 57.88 57.99 3a15 h LEU -6 Cb 0.08 -0.27 -0.37 0.00 0.37 0.00 0.00 40.66 40.47 3a15 h LEU -6 CO 0.02 0.78 -0.45 -0.69 -0.34 0.00 0.00 178.44 177.76 3a15 s VAL -5 N -6.07 3.37 0.37 1.05 1.01 -1.26 -5.09 120.40 113.79 3a15 s VAL -5 Ca -0.13 -2.99 -0.27 0.00 0.00 0.00 0.00 61.98 58.59 3a15 s VAL -5 Cb 0.18 -3.24 -0.11 0.00 0.00 0.00 0.00 36.38 33.21 3a15 s VAL -5 CO 0.81 -0.84 1.29 -2.65 0.00 0.00 0.00 175.10 173.71 3a15 n PRO -4 N 3.46 2.08 -4.30 2.72 -0.02 -1.25 -5.01 135.00 132.69 3a15 n PRO -4 Ca 0.07 0.73 -0.17 0.00 -2.02 0.00 0.00 63.50 62.11 3a15 n PRO -4 Cb 0.37 -2.37 -0.09 0.00 -0.02 0.00 0.00 33.50 31.39 3a15 n PRO -4 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 3a15 s ARG -3 N -2.01 1.49 3.49 -0.52 1.70 -1.26 -4.72 118.95 117.12 3a15 s ARG -3 Ca 0.57 -1.83 0.00 0.00 -0.47 0.00 0.00 55.73 54.00 3a15 s ARG -3 Cb -0.54 0.01 0.00 0.00 -0.57 0.00 0.00 34.95 33.85 3a15 s ARG -3 CO 0.61 -0.43 0.00 0.41 -1.08 0.00 0.00 175.30 174.80 3a15 n GLY -2 N -0.49 2.55 0.00 3.88 0.00 -1.23 -1.78 105.19 108.12 3a15 n GLY -2 Ca 0.02 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.89 3a15 n GLY -2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3a15 n SER -1 N 1.07 0.00 0.05 1.61 3.41 -1.16 -2.03 113.62 116.57 3a15 n SER -1 Ca 0.00 0.34 0.13 0.00 -0.26 0.00 0.00 58.87 59.07 3a15 n SER -1 Cb 0.00 -0.41 0.31 0.00 -0.26 0.00 0.00 64.21 63.86 3a15 n SER -1 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3a15 n HIS 0 N -1.41 0.48 -1.52 7.33 8.25 -0.73 -4.89 115.22 122.73 3a15 n HIS 0 Ca 0.04 0.14 -0.32 0.00 -0.26 0.00 0.00 57.72 57.32 3a15 n HIS 0 Cb 0.12 -0.64 0.06 0.00 1.12 0.00 0.00 29.99 30.65 3a15 n HIS 0 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3a15 s MET 1 N -3.10 2.64 0.69 -0.41 -1.94 -0.86 -4.79 119.30 111.53 3a15 s MET 1 Ca 0.09 1.16 -0.15 0.00 -1.71 0.00 0.00 55.69 55.09 3a15 s MET 1 Cb 0.15 -1.94 0.01 0.00 2.01 0.00 0.00 34.83 35.06 3a15 s MET 1 CO 0.66 -1.35 1.16 -1.21 -0.01 0.00 0.00 175.02 174.27 3a15 s GLU 2 N -4.69 2.52 0.02 2.03 2.02 -1.23 -4.80 118.70 114.57 3a15 s GLU 2 Ca 0.62 1.58 -0.02 0.00 0.02 0.00 0.00 54.97 57.17 3a15 s GLU 2 Cb -0.17 -1.90 -0.04 0.00 0.10 0.00 0.00 34.13 32.12 3a15 s GLU 2 CO 0.51 -1.50 0.19 0.45 0.02 0.00 0.00 175.26 174.93 3a15 s SER 3 N -2.27 6.37 0.48 -0.19 0.15 -1.26 -1.05 113.70 115.93 3a15 s SER 3 Ca 0.71 0.32 0.18 0.00 0.70 0.00 0.00 55.95 57.86 3a15 s SER 3 Cb -0.25 -1.99 1.16 0.00 -1.71 0.00 0.00 66.02 63.24 3a15 s SER 3 CO 0.42 0.23 2.04 0.00 1.20 0.00 0.00 173.24 177.13 3a15 h ALA 4 N 3.54 1.65 -2.29 5.45 0.00 -1.93 -3.42 119.26 122.26 3a15 h ALA 4 Ca -0.47 -0.13 -0.58 0.00 0.00 0.00 0.00 54.91 53.73 3a15 h ALA 4 Cb 1.18 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 3a15 h ALA 4 CO 0.72 0.17 0.50 0.42 0.00 0.00 0.00 179.25 181.06 3a15 s ILE 5 N -4.62 4.82 0.51 0.00 1.01 -1.26 -4.98 121.20 116.69 3a15 s ILE 5 Ca -0.04 1.71 -0.22 0.00 0.00 0.00 0.00 60.65 62.10 3a15 s ILE 5 Cb 0.15 -4.17 -0.07 0.00 0.01 0.00 0.00 42.46 38.38 3a15 s ILE 5 CO 0.67 -0.04 1.22 0.61 0.00 0.00 0.00 174.94 177.39 3a15 n GLY 6 N 3.50 0.39 0.34 6.18 0.00 -1.26 -4.78 105.19 109.55 3a15 n GLY 6 Ca 0.06 0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.19 3a15 n GLY 6 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3a15 h GLU 7 N 1.43 0.85 0.00 1.61 4.81 -1.94 -0.68 114.58 120.67 3a15 h GLU 7 Ca -0.49 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3a15 h GLU 7 Cb 1.32 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.50 3a15 h GLU 7 CO 0.57 0.57 0.00 1.12 -0.73 0.00 0.00 179.01 180.53 3a15 h HIS 8 N 0.88 0.00 -0.02 0.92 2.07 -1.94 -2.82 115.15 114.25 3a15 h HIS 8 Ca 0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.98 3a15 h HIS 8 Cb 0.47 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.45 3a15 h HIS 8 CO -0.03 0.00 -0.20 1.28 -3.07 0.00 0.00 177.93 175.90 3a15 n LEU 9 N -2.66 2.48 -4.76 6.12 4.77 -0.30 -4.97 117.00 117.68 3a15 n LEU 9 Ca 0.02 -0.89 -0.40 0.00 -0.03 0.00 0.00 56.01 54.71 3a15 n LEU 9 Cb 0.31 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 3a15 n LEU 9 CO 0.25 0.43 0.77 -1.10 -1.33 0.00 0.00 177.39 176.42 3a15 s GLN 10 N -2.12 4.56 0.24 3.23 -0.21 -0.99 -4.94 119.66 119.44 3a15 s GLN 10 Ca 0.23 1.73 -0.17 0.00 0.02 0.00 0.00 55.36 57.17 3a15 s GLN 10 Cb 0.18 -3.07 0.01 0.00 1.00 0.00 0.00 33.01 31.14 3a15 s GLN 10 CO 0.40 0.16 0.57 0.00 -2.12 0.00 0.00 175.29 174.30 3a15 n PRO 12 N -0.39 1.56 -2.39 0.00 -0.04 -1.26 -4.91 135.00 127.57 3a15 n PRO 12 Ca -0.05 0.56 -0.43 0.00 -0.04 0.00 0.00 63.50 63.54 3a15 n PRO 12 Cb 0.61 -2.38 -0.02 0.00 -0.04 0.00 0.00 33.50 31.67 3a15 n PRO 12 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3a15 s ARG 13 N 4.17 3.66 0.09 0.54 0.52 -1.26 -4.77 118.95 121.89 3a15 s ARG 13 Ca 0.98 0.96 0.25 0.00 -0.52 0.00 0.00 55.73 57.40 3a15 s ARG 13 Cb -0.89 -3.98 0.49 0.00 0.52 0.00 0.00 34.95 31.09 3a15 s ARG 13 CO 0.58 -1.46 1.43 0.25 0.02 0.00 0.00 175.30 176.12 3a15 n THR 14 N 6.88 0.25 -3.96 0.02 -2.24 0.31 -4.59 114.28 110.96 3a15 n THR 14 Ca 0.16 -0.18 -0.32 0.00 -2.27 0.00 0.00 64.05 61.43 3a15 n THR 14 Cb 0.48 -0.10 -0.14 0.00 -2.10 0.00 0.00 70.33 68.47 3a15 n THR 14 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3a15 s LEU 15 N -3.84 4.87 0.73 3.22 1.43 -1.00 -5.00 118.68 119.10 3a15 s LEU 15 Ca 0.08 -2.16 -0.11 0.00 -1.03 0.00 0.00 54.13 50.91 3a15 s LEU 15 Cb 0.15 -1.68 0.03 0.00 0.03 0.00 0.00 46.19 44.72 3a15 s LEU 15 CO 0.69 -0.41 1.07 0.42 0.23 0.00 0.00 176.35 178.35 3a15 s THR 16 N 0.91 3.69 0.85 5.49 -4.23 -1.26 -4.75 115.64 116.34 3a15 s THR 16 Ca 0.11 0.55 -0.12 0.00 -1.18 0.00 0.00 61.69 61.05 3a15 s THR 16 Cb -0.20 -3.23 0.10 0.00 1.34 0.00 0.00 72.50 70.52 3a15 s THR 16 CO -0.07 -0.72 1.10 -0.13 -0.54 0.00 0.00 174.62 174.26 3a15 s ARG 17 N -5.03 1.60 0.00 3.99 0.52 -1.26 -4.99 118.95 113.78 3a15 s ARG 17 Ca 0.59 0.73 0.23 0.00 -0.52 0.00 0.00 55.73 56.76 3a15 s ARG 17 Cb -0.15 -1.86 0.39 0.00 0.52 0.00 0.00 34.95 33.86 3a15 s ARG 17 CO 0.55 -1.98 1.37 2.89 0.02 0.00 0.00 175.30 178.15 3a15 n ARG 18 N -3.69 2.45 -4.85 3.54 1.85 -1.26 -4.95 116.66 109.75 3a15 n ARG 18 Ca 0.07 -2.23 -0.30 0.00 -1.00 0.00 0.00 57.85 54.38 3a15 n ARG 18 Cb 0.56 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.33 3a15 n ARG 18 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 3a15 s VAL 19 N -1.50 2.29 1.12 8.89 -7.23 -1.26 -5.13 120.40 117.57 3a15 s VAL 19 Ca 0.37 -1.34 -0.12 0.00 -1.81 0.00 0.00 61.98 59.07 3a15 s VAL 19 Cb 0.22 -1.91 0.26 0.00 0.56 0.00 0.00 36.38 35.51 3a15 s VAL 19 CO 0.31 0.36 1.05 -2.84 -0.31 0.00 0.00 175.10 173.67 3a15 s PRO 20 N -1.28 -0.53 0.49 4.82 0.02 -1.26 -4.88 135.00 132.38 3a15 s PRO 20 Ca 0.12 0.83 0.17 0.00 0.02 0.00 0.00 61.00 62.15 3a15 s PRO 20 Cb -0.10 -1.60 1.22 0.00 0.02 0.00 0.00 34.50 34.04 3a15 s PRO 20 CO 0.03 -3.46 2.09 0.22 -0.33 0.00 0.00 177.00 175.54 3a15 h ASP 21 N -2.44 0.00 0.76 2.53 3.58 -2.01 -2.19 116.42 116.66 3a15 h ASP 21 Ca -0.59 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.86 3a15 h ASP 21 Cb 1.33 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.38 3a15 h ASP 21 CO 0.51 0.09 0.00 0.35 -2.88 0.00 0.00 179.24 177.31 3a15 n THR 22 N -4.32 0.80 -1.61 2.25 -2.24 -1.26 -3.01 114.28 104.89 3a15 n THR 22 Ca -0.03 0.16 -0.53 0.00 -2.27 0.00 0.00 64.05 61.39 3a15 n THR 22 Cb 0.17 -1.01 -0.06 0.00 -2.10 0.00 0.00 70.33 67.33 3a15 n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3a15 n TYR 23 N -1.97 1.61 -3.73 4.78 9.36 -0.83 -4.15 117.16 122.22 3a15 n TYR 23 Ca 0.03 0.62 -0.23 0.00 3.32 0.00 0.00 57.90 61.65 3a15 n TYR 23 Cb 0.24 -2.35 -0.18 0.00 -0.63 0.00 0.00 39.34 36.42 3a15 n TYR 23 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 3a15 s THR 24 N 1.06 0.25 0.60 2.97 2.01 -1.26 -3.54 115.64 117.73 3a15 s THR 24 Ca 0.87 0.12 -0.18 0.00 0.31 0.00 0.00 61.69 62.80 3a15 s THR 24 Cb -0.98 -0.49 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 3a15 s THR 24 CO 0.51 0.17 1.18 -2.16 -0.69 0.00 0.00 174.62 173.62 3a15 s PRO 25 N 2.02 2.98 0.38 4.92 0.04 -1.26 -4.95 135.00 139.12 3a15 s PRO 25 Ca 0.04 1.74 0.26 0.00 0.04 0.00 0.00 61.00 63.08 3a15 s PRO 25 Cb -0.13 -1.94 0.70 0.00 0.04 0.00 0.00 34.50 33.17 3a15 s PRO 25 CO -0.05 -1.18 1.73 -1.00 0.04 0.00 0.00 177.00 176.54 3a15 h PRO 26 N 0.80 0.00 -4.01 0.56 0.13 -1.95 -3.46 132.00 124.07 3a15 h PRO 26 Ca -0.50 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.51 3a15 h PRO 26 Cb 1.29 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.25 3a15 h PRO 26 CO 0.55 0.00 -0.60 -0.59 -0.23 0.00 0.00 178.00 177.13 3a15 s PHE 27 N -3.26 0.34 0.28 1.56 -0.12 -1.26 -4.98 117.98 110.52 3a15 s PHE 27 Ca 0.07 -0.75 -0.27 0.00 -0.05 0.00 0.00 56.93 55.93 3a15 s PHE 27 Cb 0.08 -0.24 -0.09 0.00 -0.63 0.00 0.00 43.02 42.14 3a15 s PHE 27 CO 0.60 -0.37 0.91 -1.25 -0.05 0.00 0.00 175.22 175.07 3a15 s PRO 28 N -3.12 4.64 0.04 1.99 0.04 -1.26 -5.02 135.00 132.30 3a15 s PRO 28 Ca -0.01 1.32 -0.01 0.00 0.04 0.00 0.00 61.00 62.35 3a15 s PRO 28 Cb 0.02 -2.99 -0.03 0.00 0.04 0.00 0.00 34.50 31.54 3a15 s PRO 28 CO -0.07 0.38 -0.02 -1.64 0.04 0.00 0.00 177.00 175.70 3a15 s MET 29 N -1.72 0.49 0.18 4.56 -1.94 -1.26 -4.81 119.30 114.80 3a15 s MET 29 Ca 0.46 -0.94 0.04 0.00 -1.71 0.00 0.00 55.69 53.53 3a15 s MET 29 Cb -0.21 0.17 -0.05 0.00 2.01 0.00 0.00 34.83 36.76 3a15 s MET 29 CO 0.26 -0.09 -0.04 -1.58 -0.01 0.00 0.00 175.02 173.56 3a15 s TRP 30 N -2.86 1.36 0.19 -0.03 0.51 -0.18 -2.15 118.94 115.79 3a15 s TRP 30 Ca -0.03 -0.87 0.04 0.00 -2.12 0.00 0.00 56.10 53.12 3a15 s TRP 30 Cb 0.00 -0.75 -0.05 0.00 -0.81 0.00 0.00 33.47 31.87 3a15 s TRP 30 CO -0.06 -0.02 -0.06 0.14 -0.51 0.00 0.00 176.95 176.44 3a15 s VAL 31 N -3.43 1.15 0.30 4.03 -7.23 -1.26 -0.57 120.40 113.39 3a15 s VAL 31 Ca 0.22 -2.06 -0.29 0.00 -1.81 0.00 0.00 61.98 58.04 3a15 s VAL 31 Cb 0.04 -2.12 -0.10 0.00 0.56 0.00 0.00 36.38 34.77 3a15 s VAL 31 CO 0.04 -0.52 1.27 -0.83 -0.31 0.00 0.00 175.10 174.74 3a15 s GLY 32 N -3.25 2.92 -0.00 2.32 0.00 -1.26 -1.14 107.32 106.90 3a15 s GLY 32 Ca 0.23 1.16 0.05 0.00 0.00 0.00 0.00 44.72 46.17 3a15 s GLY 32 CO 0.05 1.86 -0.16 0.50 0.00 0.00 0.00 173.10 175.35 3a15 s ARG 33 N -1.43 2.29 -0.11 2.90 1.81 0.22 -4.82 118.95 119.80 3a15 s ARG 33 Ca 0.49 -0.84 -0.19 0.00 -1.72 0.00 0.00 55.73 53.47 3a15 s ARG 33 Cb -0.38 -2.28 0.05 0.00 -0.45 0.00 0.00 34.95 31.89 3a15 s ARG 33 CO 0.48 0.58 0.49 0.00 -0.68 0.00 0.00 175.30 176.16 3a15 s ALA 34 N -0.84 -1.22 1.00 2.13 0.00 -1.26 -0.34 121.76 121.23 3a15 s ALA 34 Ca 0.13 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.20 3a15 s ALA 34 Cb -0.11 -0.42 0.00 0.00 0.00 0.00 0.00 23.12 22.59 3a15 s ALA 34 CO 0.03 -0.27 0.00 -0.40 0.00 0.00 0.00 175.76 175.12 3a15 n ASP 35 N 2.02 -0.04 0.01 0.00 5.68 -1.26 -4.92 116.55 118.04 3a15 n ASP 35 Ca -0.17 -0.96 0.06 0.00 -0.50 0.00 0.00 54.79 53.22 3a15 n ASP 35 Cb 0.56 0.00 0.27 0.00 -1.14 0.00 0.00 41.12 40.81 3a15 n ASP 35 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3a15 n ASP 36 N -2.93 0.03 0.07 -1.12 5.68 -1.26 -2.60 116.55 114.42 3a15 n ASP 36 Ca 0.00 0.51 -0.03 0.00 -0.50 0.00 0.00 54.79 54.77 3a15 n ASP 36 Cb 0.00 -0.52 0.19 0.00 -1.14 0.00 0.00 41.12 39.66 3a15 n ASP 36 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3a15 h ALA 37 N 2.40 1.04 -1.44 2.12 0.00 -2.01 -3.36 119.26 118.01 3a15 h ALA 37 Ca 0.00 -0.43 -0.56 0.00 0.00 0.00 0.00 54.91 53.92 3a15 h ALA 37 Cb 0.21 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 17.81 3a15 h ALA 37 CO 0.00 0.61 0.92 -1.17 0.00 0.00 0.00 179.25 179.61 3a15 s LEU 38 N -8.27 3.50 -0.24 0.00 2.96 -1.07 -4.82 118.68 110.74 3a15 s LEU 38 Ca -0.05 -0.60 0.03 0.00 -0.22 0.00 0.00 54.13 53.29 3a15 s LEU 38 Cb 0.13 -2.52 -0.16 0.00 0.50 0.00 0.00 46.19 44.13 3a15 s LEU 38 CO 0.78 -1.73 -0.20 0.00 -1.32 0.00 0.00 176.35 173.88 3a15 n GLN 39 N 8.92 0.63 -3.65 1.98 6.02 -1.26 -4.67 117.38 125.35 3a15 n GLN 39 Ca 0.01 0.13 -0.04 0.00 -0.01 0.00 0.00 57.00 57.09 3a15 n GLN 39 Cb 0.48 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.19 3a15 n GLN 39 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 3a15 s GLN 40 N -2.49 0.52 0.40 -1.09 0.74 -1.26 -0.65 119.66 115.83 3a15 s GLN 40 Ca -0.31 1.30 0.01 0.00 0.05 0.00 0.00 55.36 56.40 3a15 s GLN 40 Cb 0.08 0.62 -0.02 0.00 1.10 0.00 0.00 33.01 34.80 3a15 s GLN 40 CO 0.58 -0.21 0.61 0.14 -0.55 0.00 0.00 175.29 175.86 3a15 s VAL 41 N 2.63 4.43 -0.12 1.34 -7.23 -0.82 -3.70 120.40 116.93 3a15 s VAL 41 Ca -0.05 -0.53 0.03 0.00 -1.81 0.00 0.00 61.98 59.61 3a15 s VAL 41 Cb -0.11 -3.62 0.01 0.00 0.56 0.00 0.00 36.38 33.22 3a15 s VAL 41 CO -0.17 -0.40 -0.20 -0.69 -0.31 0.00 0.00 175.10 173.32 3a15 s VAL 42 N -2.43 1.88 -0.40 1.32 1.01 -0.72 -3.34 120.40 117.72 3a15 s VAL 42 Ca 0.45 -0.88 -0.08 0.00 0.00 0.00 0.00 61.98 61.47 3a15 s VAL 42 Cb -0.10 -1.66 0.08 0.00 0.00 0.00 0.00 36.38 34.70 3a15 s VAL 42 CO 0.37 0.52 0.22 -0.04 0.00 0.00 0.00 175.10 176.16 3a15 s MET 43 N 0.72 2.52 -0.38 2.72 -1.94 0.43 -1.05 119.30 122.32 3a15 s MET 43 Ca -0.11 -1.46 -0.06 0.00 -1.71 0.00 0.00 55.69 52.35 3a15 s MET 43 Cb -0.16 -3.68 0.07 0.00 2.01 0.00 0.00 34.83 33.06 3a15 s MET 43 CO 0.01 -0.91 0.17 0.20 -0.01 0.00 0.00 175.02 174.48 3a15 s GLY 44 N 1.94 1.91 -0.39 -0.03 0.00 0.25 -1.52 107.32 109.49 3a15 s GLY 44 Ca 0.03 -2.03 -0.17 0.00 0.00 0.00 0.00 44.72 42.54 3a15 s GLY 44 CO 0.01 0.88 0.44 -0.19 0.00 0.00 0.00 173.10 174.25 3a15 s TYR 45 N 1.36 3.17 -0.20 1.90 1.51 -0.29 -0.97 117.35 123.84 3a15 s TYR 45 Ca 0.01 -0.18 -0.04 0.00 -1.01 0.00 0.00 57.07 55.86 3a15 s TYR 45 Cb -0.21 -2.87 -0.02 0.00 -0.11 0.00 0.00 41.96 38.75 3a15 s TYR 45 CO 0.01 -0.62 -0.04 -0.51 -1.11 0.00 0.00 175.55 173.28 3a15 s LEU 46 N 2.19 3.03 0.15 -1.29 1.02 0.59 -0.66 118.68 123.70 3a15 s LEU 46 Ca 0.14 -0.29 0.11 0.00 0.02 0.00 0.00 54.13 54.10 3a15 s LEU 46 Cb -0.16 -1.76 -0.04 0.00 0.02 0.00 0.00 46.19 44.25 3a15 s LEU 46 CO 0.13 0.05 -0.26 -0.83 0.02 0.00 0.00 176.35 175.47 3a15 s GLY 47 N 1.07 1.58 -0.08 -3.19 0.00 0.35 -0.60 107.32 106.45 3a15 s GLY 47 Ca 0.01 -1.50 0.03 0.00 0.00 0.00 0.00 44.72 43.26 3a15 s GLY 47 CO 0.00 -1.49 -0.17 0.14 0.00 0.00 0.00 173.10 171.58 3a15 s VAL 48 N -1.25 1.49 -0.03 1.40 1.01 0.55 -1.64 120.40 121.93 3a15 s VAL 48 Ca 0.15 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.52 3a15 s VAL 48 Cb -0.09 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 3a15 s VAL 48 CO 0.07 0.43 -0.24 -1.58 0.00 0.00 0.00 175.10 173.78 3a15 s GLN 49 N 0.59 2.26 0.12 2.72 0.74 0.21 -0.59 119.66 125.70 3a15 s GLN 49 Ca -0.15 -0.88 -0.14 0.00 0.05 0.00 0.00 55.36 54.24 3a15 s GLN 49 Cb -0.16 -2.12 0.02 0.00 1.10 0.00 0.00 33.01 31.85 3a15 s GLN 49 CO 0.05 0.54 0.34 -0.59 -0.55 0.00 0.00 175.29 175.08 3a15 s PHE 50 N -0.54 -0.08 -0.07 1.67 -0.71 -0.29 -0.15 117.98 117.81 3a15 s PHE 50 Ca 0.08 -0.28 0.01 0.00 -1.04 0.00 0.00 56.93 55.70 3a15 s PHE 50 Cb -0.11 0.16 -0.05 0.00 -1.21 0.00 0.00 43.02 41.81 3a15 s PHE 50 CO 0.00 -0.66 -0.05 -2.13 -1.34 0.00 0.00 175.22 171.03 3a15 n ARG 51 N -0.18 0.45 -3.68 1.99 3.00 -1.26 0.14 116.66 117.12 3a15 n ARG 51 Ca -0.15 0.04 -0.32 0.00 -0.00 0.00 0.00 57.85 57.41 3a15 n ARG 51 Cb 0.63 -1.14 -0.05 0.00 0.00 0.00 0.00 32.46 31.90 3a15 n ARG 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 3a15 s ASP 52 N -4.59 6.51 0.34 6.15 1.01 -1.26 -4.82 116.67 120.00 3a15 s ASP 52 Ca -0.09 0.60 0.05 0.00 0.71 0.00 0.00 52.55 53.82 3a15 s ASP 52 Cb 0.02 -2.10 0.70 0.00 1.01 0.00 0.00 42.92 42.56 3a15 s ASP 52 CO 0.17 0.10 1.90 -0.08 0.21 0.00 0.00 175.17 177.46 3a15 h GLU 53 N 3.10 0.80 0.00 8.23 4.57 -2.02 -1.60 114.58 127.67 3a15 h GLU 53 Ca -0.47 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 3a15 h GLU 53 Cb 1.17 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.58 3a15 h GLU 53 CO 0.71 0.53 0.00 -0.40 -1.18 0.00 0.00 179.01 178.67 3a15 n ASP 54 N -4.53 0.00 0.00 1.04 5.75 -1.26 -1.92 116.55 115.64 3a15 n ASP 54 Ca 0.15 0.12 0.11 0.00 -0.01 0.00 0.00 54.79 55.16 3a15 n ASP 54 Cb 0.34 -0.34 0.13 0.00 -1.03 0.00 0.00 41.12 40.22 3a15 n ASP 54 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3a15 n GLN 55 N -1.34 0.03 0.13 0.11 6.02 -0.60 -4.48 117.38 117.24 3a15 n GLN 55 Ca 0.09 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.95 3a15 n GLN 55 Cb 0.18 -1.51 -0.06 0.00 1.02 0.00 0.00 30.24 29.87 3a15 n GLN 55 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 3a15 h ARG 56 N 0.00 -0.39 -0.79 -1.09 2.43 -1.43 0.21 114.38 113.31 3a15 h ARG 56 Ca 0.00 0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.31 3a15 h ARG 56 Cb 0.52 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.08 3a15 h ARG 56 CO 0.00 -0.26 0.41 -1.35 -1.51 0.00 0.00 179.97 177.26 3a15 h PRO 57 N -0.41 0.64 -0.20 0.20 0.11 -1.79 0.48 132.00 131.03 3a15 h PRO 57 Ca 0.01 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.96 3a15 h PRO 57 Cb 0.40 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 3a15 h PRO 57 CO -0.08 0.42 -0.39 0.00 -0.21 0.00 0.00 178.00 177.75 3a15 h ALA 58 N 1.49 0.96 -0.22 -0.75 0.00 -1.74 -2.26 119.26 116.74 3a15 h ALA 58 Ca 0.41 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3a15 h ALA 58 Cb 0.48 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3a15 h ALA 58 CO -0.30 0.62 -0.09 0.00 0.00 0.00 0.00 179.25 179.47 3a15 h ALA 59 N 1.21 0.31 -0.77 0.00 0.00 0.42 -1.57 119.26 118.86 3a15 h ALA 59 Ca 0.04 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 3a15 h ALA 59 Cb 0.85 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3a15 h ALA 59 CO 0.07 0.14 0.27 -0.07 0.00 0.00 0.00 179.25 179.66 3a15 h LEU 60 N 0.16 1.09 -0.19 0.00 3.38 -0.91 -1.59 115.31 117.25 3a15 h LEU 60 Ca 0.05 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 3a15 h LEU 60 Cb 0.58 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3a15 h LEU 60 CO 0.03 0.99 0.04 -0.61 0.09 0.00 0.00 178.44 178.98 3a15 h GLN 61 N 1.13 0.31 -1.00 1.13 5.75 -1.40 0.13 115.11 121.15 3a15 h GLN 61 Ca 0.25 -0.07 0.14 0.00 -0.15 0.00 0.00 58.65 58.82 3a15 h GLN 61 Cb 0.27 -0.04 -0.09 0.00 1.07 0.00 0.00 27.48 28.69 3a15 h GLN 61 CO -0.01 0.44 0.63 0.00 -2.65 0.00 0.00 178.83 177.23 3a15 h ALA 62 N 0.85 1.57 -0.12 3.38 0.00 -1.10 -0.69 119.26 123.16 3a15 h ALA 62 Ca 0.06 0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.79 3a15 h ALA 62 Cb 0.27 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.90 3a15 h ALA 62 CO 0.00 0.14 -0.80 1.98 0.00 0.00 0.00 179.25 180.58 3a15 h MET 63 N 0.93 0.69 -0.80 0.00 1.85 -1.02 -2.95 114.93 113.62 3a15 h MET 63 Ca 0.52 -0.58 0.11 0.00 -0.61 0.00 0.00 59.70 59.13 3a15 h MET 63 Cb 0.61 0.13 -0.08 0.00 0.43 0.00 0.00 31.60 32.69 3a15 h MET 63 CO -0.29 1.20 0.43 0.00 -0.40 0.00 0.00 176.91 177.85 3a15 h ARG 64 N 0.46 0.68 -0.51 0.39 3.08 0.19 -1.36 114.38 117.31 3a15 h ARG 64 Ca -0.06 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 3a15 h ARG 64 Cb 1.42 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 3a15 h ARG 64 CO 0.16 0.45 0.28 -0.44 -1.07 0.00 0.00 179.97 179.34 3a15 h ASP 65 N 0.70 0.64 0.29 7.04 3.32 -1.13 0.24 116.42 127.52 3a15 h ASP 65 Ca 0.40 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 3a15 h ASP 65 Cb 0.44 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 3a15 h ASP 65 CO -0.28 0.55 -0.16 0.40 -1.72 0.00 0.00 179.24 178.03 3a15 h ILE 66 N 0.68 0.68 -0.81 0.35 2.04 -1.27 -0.56 117.51 118.62 3a15 h ILE 66 Ca 0.18 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.12 3a15 h ILE 66 Cb 0.05 0.68 -0.07 0.00 -0.74 0.00 0.00 36.82 36.74 3a15 h ILE 66 CO -0.03 0.00 0.47 0.58 0.00 0.00 0.00 178.15 179.17 3a15 h VAL 67 N -0.41 0.95 -0.77 1.67 2.07 -1.13 -1.37 116.25 117.25 3a15 h VAL 67 Ca -0.03 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 3a15 h VAL 67 Cb 0.33 0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 3a15 h VAL 67 CO 0.05 0.15 0.35 0.00 0.02 0.00 0.00 177.57 178.14 3a15 h ALA 68 N 1.43 1.16 -0.01 1.67 0.00 -0.71 -1.81 119.26 120.99 3a15 h ALA 68 Ca 0.38 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3a15 h ALA 68 Cb 0.29 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3a15 h ALA 68 CO -0.22 0.62 0.05 0.78 0.00 0.00 0.00 179.25 180.48 3a15 h GLY 69 N 1.14 0.00 2.00 0.00 0.00 0.05 -1.40 103.07 104.86 3a15 h GLY 69 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 3a15 h GLY 69 CO -0.03 0.00 0.00 0.74 0.00 0.00 0.00 176.54 177.25 3a15 h PHE 70 N 0.00 0.00 0.00 5.60 0.04 -1.08 -2.90 116.94 118.60 3a15 h PHE 70 Ca 0.00 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 3a15 h PHE 70 Cb 0.10 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.24 3a15 h PHE 70 CO 0.00 0.00 -0.24 -0.44 -0.60 0.00 0.00 178.31 177.03 3a15 h ASP 71 N 0.00 0.00 -4.24 2.17 3.32 -1.37 -3.39 116.42 112.91 3a15 h ASP 71 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 3a15 h ASP 71 Cb 0.52 0.00 0.18 0.00 0.22 0.00 0.00 39.33 40.25 3a15 h ASP 71 CO 0.00 0.24 0.29 -0.76 -1.72 0.00 0.00 179.24 177.29 3a15 s LEU 72 N -7.13 3.01 0.37 1.55 1.43 -1.10 -4.86 118.68 111.95 3a15 s LEU 72 Ca -0.01 2.23 -0.26 0.00 -1.03 0.00 0.00 54.13 55.06 3a15 s LEU 72 Cb 0.12 -4.57 -0.12 0.00 0.03 0.00 0.00 46.19 41.65 3a15 s LEU 72 CO 0.64 -2.78 1.05 -2.65 0.23 0.00 0.00 176.35 172.84 3a15 n PRO 73 N -3.71 1.47 -0.95 1.29 -0.02 -1.26 -1.52 135.00 130.30 3a15 n PRO 73 Ca 0.12 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 3a15 n PRO 73 Cb 0.51 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 3a15 n PRO 73 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3a15 n ASP 74 N 0.74 -3.41 -4.49 2.55 8.00 -1.26 -4.59 116.55 114.08 3a15 n ASP 74 Ca 0.09 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.29 3a15 n ASP 74 Cb 0.37 -1.67 0.21 0.00 -0.02 0.00 0.00 41.12 40.01 3a15 n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a15 n GLY 75 N -1.40 -1.65 3.75 0.44 0.00 -0.57 -4.42 105.19 101.34 3a15 n GLY 75 Ca 0.00 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.70 3a15 n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a15 s PRO 76 N -4.26 2.81 0.42 1.61 0.04 -1.26 -4.92 135.00 129.43 3a15 s PRO 76 Ca 0.65 1.80 0.25 0.00 0.04 0.00 0.00 61.00 63.75 3a15 s PRO 76 Cb -0.23 -1.91 0.60 0.00 0.04 0.00 0.00 34.50 33.00 3a15 s PRO 76 CO 0.64 -1.33 1.70 0.00 0.04 0.00 0.00 177.00 178.05 3a15 h ALA 77 N 0.63 1.00 -2.42 8.56 0.00 -1.25 -3.46 119.26 122.32 3a15 h ALA 77 Ca -0.50 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 3a15 h ALA 77 Cb 1.30 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.88 3a15 h ALA 77 CO 0.54 0.00 -0.17 -1.58 0.00 0.00 0.00 179.25 178.04 3a15 s HIS 78 N -3.27 -0.31 0.10 0.00 5.65 -1.21 -4.96 115.29 111.29 3a15 s HIS 78 Ca 0.06 0.55 -0.19 0.00 0.25 0.00 0.00 55.06 55.73 3a15 s HIS 78 Cb 0.07 0.17 0.05 0.00 -1.18 0.00 0.00 32.58 31.68 3a15 s HIS 78 CO 0.63 -0.42 0.47 -3.38 -0.65 0.00 0.00 174.74 171.39 3a15 s HIS 79 N -1.13 -0.33 0.10 3.88 -0.00 -1.26 -0.84 115.29 115.72 3a15 s HIS 79 Ca -0.12 0.15 -0.07 0.00 -0.00 0.00 0.00 55.06 55.02 3a15 s HIS 79 Cb -0.04 0.33 -0.01 0.00 -0.00 0.00 0.00 32.58 32.86 3a15 s HIS 79 CO 0.05 -0.70 0.18 0.16 -0.00 0.00 0.00 174.74 174.43 3a15 s ASP 80 N -2.50 0.16 -0.03 7.38 1.47 -0.82 -4.99 116.67 117.33 3a15 s ASP 80 Ca -0.00 -0.77 0.07 0.00 1.18 0.00 0.00 52.55 53.03 3a15 s ASP 80 Cb 0.00 0.34 -0.02 0.00 -0.34 0.00 0.00 42.92 42.91 3a15 s ASP 80 CO -0.09 -0.75 -0.24 -0.22 0.68 0.00 0.00 175.17 174.55 3a15 s LEU 81 N -2.90 2.05 0.07 2.11 2.96 -1.26 -0.90 118.68 120.81 3a15 s LEU 81 Ca 0.09 -0.46 -0.01 0.00 -0.22 0.00 0.00 54.13 53.53 3a15 s LEU 81 Cb 0.05 -1.28 -0.04 0.00 0.50 0.00 0.00 46.19 45.42 3a15 s LEU 81 CO -0.08 0.28 0.00 0.42 -1.32 0.00 0.00 176.35 175.65 3a15 s THR 82 N -0.43 0.19 0.01 3.68 -4.23 -0.03 -1.15 115.64 113.68 3a15 s THR 82 Ca 0.05 -1.79 0.03 0.00 -1.18 0.00 0.00 61.69 58.81 3a15 s THR 82 Cb -0.11 -1.61 -0.01 0.00 1.34 0.00 0.00 72.50 72.11 3a15 s THR 82 CO 0.00 -0.88 -0.10 -2.28 -0.54 0.00 0.00 174.62 170.82 3a15 s HIS 83 N -3.94 0.92 0.13 3.99 2.46 0.74 -1.06 115.29 118.53 3a15 s HIS 83 Ca 0.10 -0.25 -0.18 0.00 0.47 0.00 0.00 55.06 55.21 3a15 s HIS 83 Cb 0.08 -0.57 0.04 0.00 -0.13 0.00 0.00 32.58 32.00 3a15 s HIS 83 CO -0.08 -0.01 0.45 -3.38 -2.47 0.00 0.00 174.74 169.25 3a15 s HIS 84 N -0.51 -0.29 -0.24 3.88 -3.43 -0.76 -1.34 115.29 112.60 3a15 s HIS 84 Ca 0.02 0.02 -0.07 0.00 -0.80 0.00 0.00 55.06 54.22 3a15 s HIS 84 Cb -0.05 0.33 -0.03 0.00 -1.43 0.00 0.00 32.58 31.39 3a15 s HIS 84 CO 0.00 -0.73 0.07 0.42 -2.00 0.00 0.00 174.74 172.50 3a15 s ILE 85 N -3.70 4.34 0.98 -5.38 1.01 -1.26 -0.59 121.20 116.59 3a15 s ILE 85 Ca 0.02 -0.17 -0.16 0.00 0.00 0.00 0.00 60.65 60.34 3a15 s ILE 85 Cb 0.01 -3.02 0.20 0.00 0.01 0.00 0.00 42.46 39.67 3a15 s ILE 85 CO -0.12 0.35 1.30 1.51 0.00 0.00 0.00 174.94 177.98 3a15 s ASP 86 N 1.48 2.95 0.00 3.58 1.47 -0.08 -4.90 116.67 121.18 3a15 s ASP 86 Ca 0.06 0.33 0.21 0.00 1.18 0.00 0.00 52.55 54.32 3a15 s ASP 86 Cb -0.15 -0.41 1.25 0.00 -0.34 0.00 0.00 42.92 43.27 3a15 s ASP 86 CO 0.03 -2.84 1.66 -0.46 0.68 0.00 0.00 175.17 174.25 3a15 n ASN 87 N -3.85 0.00 -0.89 2.11 0.23 -1.26 -1.44 115.26 110.16 3a15 n ASN 87 Ca 0.15 -0.84 0.10 0.00 -0.53 0.00 0.00 54.58 53.45 3a15 n ASN 87 Cb 0.59 0.00 0.13 0.00 -2.08 0.00 0.00 39.78 38.42 3a15 n ASN 87 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3a15 n GLN 88 N -0.94 2.03 -0.73 -3.83 1.13 -1.26 -4.97 117.38 108.80 3a15 n GLN 88 Ca 0.16 -1.88 0.00 0.00 -1.94 0.00 0.00 57.00 53.33 3a15 n GLN 88 Cb 0.07 -1.41 0.00 0.00 0.11 0.00 0.00 30.24 29.01 3a15 n GLN 88 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3a15 n GLY 89 N 1.19 0.76 3.76 1.08 0.00 -0.52 -5.04 105.19 106.41 3a15 n GLY 89 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3a15 n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a15 s TYR 90 N -2.80 3.83 0.03 1.61 1.51 -1.26 -4.81 117.35 115.45 3a15 s TYR 90 Ca 0.00 1.59 -0.20 0.00 -1.01 0.00 0.00 57.07 57.46 3a15 s TYR 90 Cb 0.00 -2.83 -0.06 0.00 -0.11 0.00 0.00 41.96 38.96 3a15 s TYR 90 CO 0.00 0.37 0.57 -1.21 -1.11 0.00 0.00 175.55 174.17 3a15 s GLU 91 N -0.55 4.25 -0.10 -0.62 2.02 0.12 -0.90 118.70 122.93 3a15 s GLU 91 Ca 0.38 0.71 -0.01 0.00 0.02 0.00 0.00 54.97 56.08 3a15 s GLU 91 Cb -0.22 -3.29 0.02 0.00 0.10 0.00 0.00 34.13 30.74 3a15 s GLU 91 CO 0.25 0.50 -0.06 -0.80 0.02 0.00 0.00 175.26 175.17 3a15 s ASN 92 N -0.61 1.98 -0.22 -0.19 0.01 0.24 -1.14 114.94 115.00 3a15 s ASN 92 Ca 0.30 -0.24 -0.12 0.00 -0.71 0.00 0.00 52.86 52.08 3a15 s ASN 92 Cb -0.19 -0.73 -0.05 0.00 0.41 0.00 0.00 41.25 40.70 3a15 s ASN 92 CO 0.18 -0.13 0.24 -0.76 -1.51 0.00 0.00 177.10 175.11 3a15 s LEU 93 N 1.71 4.13 -0.12 0.60 1.43 0.24 -1.84 118.68 124.84 3a15 s LEU 93 Ca 0.04 0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.40 3a15 s LEU 93 Cb -0.13 -2.24 0.02 0.00 0.03 0.00 0.00 46.19 43.87 3a15 s LEU 93 CO -0.07 0.02 -0.13 -0.63 0.23 0.00 0.00 176.35 175.78 3a15 s ILE 94 N 1.11 1.37 -0.17 -0.59 1.01 -0.22 -0.33 121.20 123.38 3a15 s ILE 94 Ca 0.11 -0.53 -0.09 0.00 0.00 0.00 0.00 60.65 60.14 3a15 s ILE 94 Cb -0.14 -1.29 -0.05 0.00 0.01 0.00 0.00 42.46 40.99 3a15 s ILE 94 CO 0.05 0.42 0.13 0.54 0.00 0.00 0.00 174.94 176.09 3a15 s VAL 95 N 1.32 5.44 -0.17 2.92 0.11 0.23 -0.85 120.40 129.40 3a15 s VAL 95 Ca -0.00 0.19 -0.01 0.00 -2.93 0.00 0.00 61.98 59.23 3a15 s VAL 95 Cb -0.14 -3.44 -0.00 0.00 -1.53 0.00 0.00 36.38 31.27 3a15 s VAL 95 CO -0.06 0.51 -0.12 0.54 -3.33 0.00 0.00 175.10 172.64 3a15 s VAL 96 N -0.20 2.88 0.01 2.04 0.11 -0.07 -0.30 120.40 124.86 3a15 s VAL 96 Ca 0.11 -0.68 0.02 0.00 -2.93 0.00 0.00 61.98 58.50 3a15 s VAL 96 Cb -0.11 -2.25 -0.04 0.00 -1.53 0.00 0.00 36.38 32.45 3a15 s VAL 96 CO 0.00 0.49 -0.03 -0.83 -3.33 0.00 0.00 175.10 171.41 3a15 s GLY 97 N 1.01 1.83 -0.11 6.54 0.00 -0.14 -1.95 107.32 114.50 3a15 s GLY 97 Ca -0.01 -0.99 0.03 0.00 0.00 0.00 0.00 44.72 43.75 3a15 s GLY 97 CO -0.02 -0.87 -0.23 -0.19 0.00 0.00 0.00 173.10 171.79 3a15 s TYR 98 N -1.07 2.55 0.02 1.90 1.51 -0.02 -0.58 117.35 121.66 3a15 s TYR 98 Ca 0.19 -1.12 0.06 0.00 -1.01 0.00 0.00 57.07 55.19 3a15 s TYR 98 Cb -0.11 -1.71 -0.03 0.00 -0.11 0.00 0.00 41.96 39.99 3a15 s TYR 98 CO 0.10 -0.47 -0.15 -1.58 -1.11 0.00 0.00 175.55 172.33 3a15 s TRP 99 N 0.50 2.64 -1.31 2.71 0.51 -0.22 -0.65 118.94 123.12 3a15 s TRP 99 Ca -0.15 -0.20 0.29 0.00 -2.12 0.00 0.00 56.10 53.92 3a15 s TRP 99 Cb -0.17 -1.52 1.35 0.00 -0.81 0.00 0.00 33.47 32.32 3a15 s TRP 99 CO 0.06 0.25 1.96 1.63 -0.51 0.00 0.00 176.95 180.34 3a15 n LYS 100 N 1.70 0.32 -3.49 4.98 5.02 -1.26 -1.75 118.16 123.68 3a15 n LYS 100 Ca -0.16 -0.03 -0.16 0.00 -2.02 0.00 0.00 58.31 55.94 3a15 n LYS 100 Cb 0.52 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.99 3a15 n LYS 100 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 3a15 s ASP 101 N -2.71 -0.61 0.28 4.39 -4.77 -1.24 -4.56 116.67 107.45 3a15 s ASP 101 Ca 0.23 0.47 0.02 0.00 -3.30 0.00 0.00 52.55 49.97 3a15 s ASP 101 Cb 0.20 0.55 0.42 0.00 -1.09 0.00 0.00 42.92 42.99 3a15 s ASP 101 CO 0.50 -0.71 1.73 1.62 0.70 0.00 0.00 175.17 179.01 3a15 h VAL 102 N 2.65 1.26 -0.30 2.11 3.04 -1.89 -3.17 116.25 119.93 3a15 h VAL 102 Ca -0.29 -1.21 -0.08 0.00 -1.01 0.00 0.00 66.70 64.11 3a15 h VAL 102 Cb 1.20 1.29 -0.02 0.00 -2.01 0.00 0.00 31.29 31.75 3a15 h VAL 102 CO 0.38 0.39 -0.15 0.77 -1.01 0.00 0.00 177.57 177.95 3a15 h SER 103 N 0.46 0.52 -0.14 3.17 4.64 -1.97 -0.58 113.55 119.65 3a15 h SER 103 Ca 0.07 -0.15 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3a15 h SER 103 Cb 0.63 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 3a15 h SER 103 CO 0.04 0.70 0.08 0.28 -0.87 0.00 0.00 176.83 177.06 3a15 h SER 104 N 0.49 0.18 -0.93 4.97 0.02 -1.89 -1.41 113.55 114.98 3a15 h SER 104 Ca 0.09 -0.08 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 3a15 h SER 104 Cb 0.55 -0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.00 3a15 h SER 104 CO 0.04 0.20 0.60 -0.61 -1.14 0.00 0.00 176.83 175.92 3a15 h GLN 105 N 0.14 1.23 -0.20 3.45 -0.00 -1.41 -0.17 115.11 118.14 3a15 h GLN 105 Ca 0.05 -0.08 -0.04 0.00 -0.00 0.00 0.00 58.65 58.58 3a15 h GLN 105 Cb 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 27.48 27.27 3a15 h GLN 105 CO -0.01 0.82 -0.04 0.45 0.00 0.00 0.00 178.83 180.06 3a15 h HIS 106 N 1.26 0.43 -0.96 3.99 3.86 -1.03 -0.00 115.15 122.70 3a15 h HIS 106 Ca 0.34 -0.09 0.02 0.00 -1.16 0.00 0.00 60.37 59.47 3a15 h HIS 106 Cb -0.13 -0.11 -0.05 0.00 1.06 0.00 0.00 27.41 28.19 3a15 h HIS 106 CO 0.00 0.62 0.63 0.00 0.86 0.00 0.00 177.93 180.05 3a15 h ARG 107 N 0.12 1.24 0.09 2.45 3.08 -1.02 0.27 114.38 120.62 3a15 h ARG 107 Ca 0.05 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 3a15 h ARG 107 Cb 0.48 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.25 3a15 h ARG 107 CO 0.02 0.82 -0.05 2.35 -1.07 0.00 0.00 179.97 182.04 3a15 h TRP 108 N 1.28 -0.12 0.18 3.04 7.01 -0.97 -3.25 115.95 123.12 3a15 h TRP 108 Ca 0.36 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.35 3a15 h TRP 108 Cb -0.11 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 26.99 3a15 h TRP 108 CO -0.00 0.04 -0.09 1.03 -2.79 0.00 0.00 178.44 176.63 3a15 h SER 109 N -0.25 -0.21 -4.17 2.65 0.87 -0.49 -2.50 113.55 109.45 3a15 h SER 109 Ca -0.01 0.01 -0.67 0.00 -1.23 0.00 0.00 61.79 59.88 3a15 h SER 109 Cb 0.21 0.05 -0.38 0.00 -0.44 0.00 0.00 62.40 61.85 3a15 h SER 109 CO 0.02 -0.05 -0.50 -0.89 -0.53 0.00 0.00 176.83 174.88 3a15 s THR 110 N -2.59 3.16 0.02 2.23 2.01 0.91 -3.11 115.64 118.28 3a15 s THR 110 Ca -0.04 -3.02 0.01 0.00 0.31 0.00 0.00 61.69 58.95 3a15 s THR 110 Cb 0.00 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 3a15 s THR 110 CO 0.11 -0.82 -0.04 -0.44 -0.69 0.00 0.00 174.62 172.74 3a15 s SER 111 N 0.37 0.40 0.00 3.53 0.01 -1.23 -4.41 113.70 112.38 3a15 s SER 111 Ca 0.16 -0.34 0.00 0.00 1.31 0.00 0.00 55.95 57.08 3a15 s SER 111 Cb -0.23 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.04 3a15 s SER 111 CO -0.02 -0.15 0.00 0.35 0.41 0.00 0.00 173.24 173.82 3a15 n THR 112 N 2.10 0.00 0.00 1.44 -2.24 -0.94 -4.77 114.28 109.87 3a15 n THR 112 Ca -0.19 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3a15 n THR 112 Cb 0.56 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 3a15 n THR 112 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3a15 n PRO 113 N 0.00 0.00 0.02 -0.78 -0.02 -1.26 -2.18 135.00 130.78 3a15 n PRO 113 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.26 3a15 n PRO 113 Cb 0.00 -0.97 -0.14 0.00 -0.02 0.00 0.00 33.50 32.37 3a15 n PRO 113 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3a15 h ILE 114 N 0.00 0.81 0.15 4.25 1.08 -1.85 -3.25 117.51 118.71 3a15 h ILE 114 Ca 0.00 -2.39 -0.01 0.00 -0.39 0.00 0.00 64.86 62.07 3a15 h ILE 114 Cb 0.00 2.61 0.00 0.00 -3.07 0.00 0.00 36.82 36.36 3a15 h ILE 114 CO 0.00 0.82 -0.07 0.00 -0.69 0.00 0.00 178.15 178.21 3a15 h ALA 115 N 0.03 -0.20 0.00 1.87 0.00 -1.50 0.69 119.26 120.14 3a15 h ALA 115 Ca -0.37 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 3a15 h ALA 115 Cb 1.96 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.83 3a15 h ALA 115 CO 0.09 -0.56 -0.09 0.66 0.00 0.00 0.00 179.25 179.36 3a15 h SER 116 N -0.31 0.00 0.00 0.00 4.64 -1.76 -1.54 113.55 114.58 3a15 h SER 116 Ca -0.02 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3a15 h SER 116 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3a15 h SER 116 CO 0.03 0.09 -0.00 -0.25 -0.87 0.00 0.00 176.83 175.83 3a15 h TRP 117 N 0.00 -0.00 -0.61 4.77 7.01 -1.55 -3.30 115.95 122.27 3a15 h TRP 117 Ca -0.00 -0.00 -0.05 0.00 2.11 0.00 0.00 58.89 60.95 3a15 h TRP 117 Cb 0.19 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 27.23 3a15 h TRP 117 CO 0.00 0.92 0.18 2.35 -2.79 0.00 0.00 178.44 179.10 3a15 h TRP 118 N -0.93 0.95 -0.50 2.65 2.91 -0.58 -2.88 115.95 117.57 3a15 h TRP 118 Ca -0.00 -0.08 0.00 0.00 1.13 0.00 0.00 58.89 59.94 3a15 h TRP 118 Cb 0.92 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 29.29 3a15 h TRP 118 CO 0.25 0.77 0.00 0.39 -1.03 0.00 0.00 178.44 178.82 3a15 n GLU 119 N -4.27 3.23 -2.42 2.65 1.02 -0.60 -4.94 120.64 115.30 3a15 n GLU 119 Ca 0.05 -2.25 -0.37 0.00 -0.02 0.00 0.00 57.16 54.56 3a15 n GLU 119 Cb 0.22 -1.79 -0.03 0.00 -0.02 0.00 0.00 31.44 29.82 3a15 n GLU 119 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3a15 s SER 120 N -0.78 6.57 0.51 1.62 0.15 -1.09 -4.94 113.70 115.74 3a15 s SER 120 Ca 0.40 2.17 0.30 0.00 0.70 0.00 0.00 55.95 59.52 3a15 s SER 120 Cb 0.26 -2.60 1.25 0.00 -1.71 0.00 0.00 66.02 63.22 3a15 s SER 120 CO 0.19 -0.63 1.95 1.05 1.20 0.00 0.00 173.24 177.00 3a15 h GLU 121 N 2.44 0.00 0.00 5.44 9.09 -1.92 -2.84 114.58 126.79 3a15 h GLU 121 Ca -0.49 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 58.91 3a15 h GLU 121 Cb 1.23 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.32 3a15 h GLU 121 CO 0.62 0.10 -0.07 -0.44 0.05 0.00 0.00 179.01 179.26 3a15 h ASP 122 N 0.00 0.00 0.24 3.06 3.32 -1.94 -2.08 116.42 119.02 3a15 h ASP 122 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3a15 h ASP 122 Cb 0.56 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 3a15 h ASP 122 CO 0.01 0.07 -0.05 0.03 -1.72 0.00 0.00 179.24 177.58 3a15 h ARG 123 N 0.00 0.00 0.00 3.56 2.47 -1.82 -1.73 114.38 116.86 3a15 h ARG 123 Ca -0.00 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.51 3a15 h ARG 123 Cb 0.23 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.52 3a15 h ARG 123 CO 0.01 0.05 -1.29 -0.07 0.56 0.00 0.00 179.97 179.23 3a15 h LEU 124 N 0.00 0.00 -2.29 3.04 3.38 -1.57 -3.36 115.31 114.50 3a15 h LEU 124 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3a15 h LEU 124 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3a15 h LEU 124 CO 0.01 0.82 0.00 -1.54 0.09 0.00 0.00 178.44 177.82 3a15 n SER 125 N -3.10 3.43 0.16 -0.43 3.41 -0.87 -4.44 113.62 111.77 3a15 n SER 125 Ca -0.08 -2.00 0.02 0.00 -0.26 0.00 0.00 58.87 56.55 3a15 n SER 125 Cb 0.93 -0.23 0.23 0.00 -0.26 0.00 0.00 64.21 64.88 3a15 n SER 125 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3a15 h ASP 126 N 4.53 0.00 0.00 4.04 3.32 -1.49 -3.47 116.42 123.34 3a15 h ASP 126 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3a15 h ASP 126 Cb 0.99 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.54 3a15 h ASP 126 CO 0.00 0.52 0.00 0.61 -1.72 0.00 0.00 179.24 178.65 3a15 n GLY 127 N 0.26 2.37 3.80 2.75 0.00 -1.26 -5.02 105.19 108.08 3a15 n GLY 127 Ca -0.01 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 3a15 n GLY 127 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a15 s LEU 128 N 0.00 3.98 0.07 0.99 1.43 -1.26 -4.95 118.68 118.94 3a15 s LEU 128 Ca 0.00 1.90 -0.08 0.00 -1.03 0.00 0.00 54.13 54.92 3a15 s LEU 128 Cb 0.00 -4.42 -0.05 0.00 0.03 0.00 0.00 46.19 41.75 3a15 s LEU 128 CO 0.00 -0.56 0.36 -0.83 0.23 0.00 0.00 176.35 175.55 3a15 s GLY 129 N -1.89 2.30 0.06 -3.19 0.00 0.79 -4.83 107.32 100.57 3a15 s GLY 129 Ca 0.62 -0.46 0.06 0.00 0.00 0.00 0.00 44.72 44.94 3a15 s GLY 129 CO 0.21 -0.28 -0.16 -1.36 0.00 0.00 0.00 173.10 171.51 3a15 s PHE 130 N -1.42 1.37 0.09 1.90 0.08 0.10 0.64 117.98 120.74 3a15 s PHE 130 Ca 0.33 -0.41 -0.09 0.00 0.12 0.00 0.00 56.93 56.89 3a15 s PHE 130 Cb -0.13 -0.78 -0.00 0.00 -0.57 0.00 0.00 43.02 41.53 3a15 s PHE 130 CO 0.19 0.08 0.19 -0.59 -0.10 0.00 0.00 175.22 174.99 3a15 s PHE 131 N -1.07 0.16 -0.05 0.36 -0.71 -0.65 0.35 117.98 116.37 3a15 s PHE 131 Ca 0.01 -0.59 0.00 0.00 -1.04 0.00 0.00 56.93 55.32 3a15 s PHE 131 Cb -0.09 -0.06 0.02 0.00 -1.21 0.00 0.00 43.02 41.68 3a15 s PHE 131 CO 0.02 -0.55 -0.03 1.03 -1.34 0.00 0.00 175.22 174.36 3a15 s ARG 132 N -3.87 0.70 -0.32 1.99 0.52 0.15 -0.49 118.95 117.62 3a15 s ARG 132 Ca 0.05 -0.03 0.02 0.00 -0.52 0.00 0.00 55.73 55.26 3a15 s ARG 132 Cb 0.05 -0.83 0.10 0.00 0.52 0.00 0.00 34.95 34.79 3a15 s ARG 132 CO -0.11 -0.15 0.07 -1.21 0.02 0.00 0.00 175.30 173.92 3a15 s GLU 133 N 1.21 1.14 -0.20 3.54 2.02 0.17 -0.89 118.70 125.68 3a15 s GLU 133 Ca -0.07 -1.49 0.01 0.00 0.02 0.00 0.00 54.97 53.45 3a15 s GLU 133 Cb -0.14 -2.64 0.03 0.00 0.10 0.00 0.00 34.13 31.49 3a15 s GLU 133 CO -0.02 -0.95 -0.17 0.42 0.02 0.00 0.00 175.26 174.56 3a15 s ILE 134 N 1.24 2.13 0.05 -1.63 1.01 0.12 -1.13 121.20 122.99 3a15 s ILE 134 Ca 0.10 -1.13 0.06 0.00 0.00 0.00 0.00 60.65 59.68 3a15 s ILE 134 Cb -0.18 -2.00 -0.03 0.00 0.01 0.00 0.00 42.46 40.26 3a15 s ILE 134 CO -0.16 0.37 -0.17 0.68 0.00 0.00 0.00 174.94 175.66 3a15 s VAL 135 N 1.24 1.39 -0.44 2.92 -7.23 -0.57 -0.66 120.40 117.05 3a15 s VAL 135 Ca 0.01 -1.17 0.03 0.00 -1.81 0.00 0.00 61.98 59.04 3a15 s VAL 135 Cb -0.15 -1.24 0.16 0.00 0.56 0.00 0.00 36.38 35.70 3a15 s VAL 135 CO -0.10 0.05 0.31 0.00 -0.31 0.00 0.00 175.10 175.04 3a15 s ALA 136 N -0.91 1.70 0.26 1.32 0.00 0.09 -0.43 121.76 123.78 3a15 s ALA 136 Ca 0.04 -2.49 -0.30 0.00 0.00 0.00 0.00 51.96 49.21 3a15 s ALA 136 Cb -0.09 -1.72 -0.09 0.00 0.00 0.00 0.00 23.12 21.23 3a15 s ALA 136 CO 0.02 -2.04 1.08 -1.25 0.00 0.00 0.00 175.76 173.57 3a15 s PRO 137 N 0.19 4.66 0.89 0.00 0.04 -1.21 -4.84 135.00 134.73 3a15 s PRO 137 Ca 0.25 1.75 -0.11 0.00 0.04 0.00 0.00 61.00 62.93 3a15 s PRO 137 Cb -0.09 -3.22 0.12 0.00 0.04 0.00 0.00 34.50 31.36 3a15 s PRO 137 CO -0.11 0.23 1.09 1.03 0.04 0.00 0.00 177.00 179.29 3a15 s ARG 138 N -1.22 1.31 0.41 4.56 0.52 -1.26 -1.94 118.95 121.32 3a15 s ARG 138 Ca 0.45 0.99 0.14 0.00 -0.52 0.00 0.00 55.73 56.78 3a15 s ARG 138 Cb -0.31 -1.80 0.99 0.00 0.52 0.00 0.00 34.95 34.35 3a15 s ARG 138 CO 0.39 -2.25 1.90 0.00 0.02 0.00 0.00 175.30 175.36 3a15 h ALA 139 N -1.56 2.05 0.00 2.13 0.00 -1.16 0.17 119.26 120.88 3a15 h ALA 139 Ca -0.48 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3a15 h ALA 139 Cb 1.27 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3a15 h ALA 139 CO 0.52 -0.27 0.00 -0.85 0.00 0.00 0.00 179.25 178.66 3a15 n GLU 140 N -4.50 0.13 -0.40 0.00 0.28 -1.26 -3.78 120.64 111.11 3a15 n GLU 140 Ca 0.16 0.09 0.08 0.00 -0.16 0.00 0.00 57.16 57.33 3a15 n GLU 140 Cb 0.53 -1.50 0.25 0.00 1.43 0.00 0.00 31.44 32.15 3a15 n GLU 140 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3a15 n GLN 141 N -1.41 3.16 -3.89 3.44 6.02 0.58 -1.49 117.38 123.78 3a15 n GLN 141 Ca 0.08 -2.57 -0.09 0.00 -0.01 0.00 0.00 57.00 54.40 3a15 n GLN 141 Cb 0.23 -1.65 -0.08 0.00 1.02 0.00 0.00 30.24 29.76 3a15 n GLN 141 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 3a15 s PHE 142 N -1.89 0.16 0.04 1.08 -0.71 -1.24 -0.91 117.98 114.52 3a15 s PHE 142 Ca 0.38 -0.50 0.01 0.00 -1.04 0.00 0.00 56.93 55.78 3a15 s PHE 142 Cb 0.26 -0.10 -0.03 0.00 -1.21 0.00 0.00 43.02 41.94 3a15 s PHE 142 CO 0.16 -0.44 -0.06 -1.83 -1.34 0.00 0.00 175.22 171.70 3a15 s GLU 143 N -3.10 0.51 0.19 1.99 4.04 -0.33 -4.57 118.70 117.43 3a15 s GLU 143 Ca -0.01 -0.81 0.08 0.00 0.04 0.00 0.00 54.97 54.26 3a15 s GLU 143 Cb 0.02 -0.15 -0.05 0.00 0.02 0.00 0.00 34.13 33.97 3a15 s GLU 143 CO -0.07 0.01 -0.15 0.95 -1.84 0.00 0.00 175.26 174.16 3a15 s THR 144 N -1.81 1.73 -0.19 1.83 -4.23 -1.26 -1.55 115.64 110.16 3a15 s THR 144 Ca -0.08 -2.13 -0.08 0.00 -1.18 0.00 0.00 61.69 58.22 3a15 s THR 144 Cb -0.07 -1.98 0.08 0.00 1.34 0.00 0.00 72.50 71.87 3a15 s THR 144 CO -0.01 -0.54 0.41 -0.22 -0.54 0.00 0.00 174.62 173.72 3a15 s LEU 145 N -3.15 -0.45 -0.06 4.79 2.96 -0.19 -4.68 118.68 117.90 3a15 s LEU 145 Ca 0.20 0.94 0.05 0.00 -0.22 0.00 0.00 54.13 55.11 3a15 s LEU 145 Cb -0.02 1.32 -0.00 0.00 0.50 0.00 0.00 46.19 47.99 3a15 s LEU 145 CO 0.07 -0.22 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.36 3a15 s TYR 146 N 2.21 2.09 -0.48 5.38 2.02 0.26 -0.79 117.35 128.04 3a15 s TYR 146 Ca -0.04 -0.66 0.05 0.00 -0.37 0.00 0.00 57.07 56.05 3a15 s TYR 146 Cb -0.11 -1.40 0.35 0.00 -0.40 0.00 0.00 41.96 40.40 3a15 s TYR 146 CO -0.13 -0.23 1.20 0.00 -1.57 0.00 0.00 175.55 174.83 3a15 n ALA 147 N 3.15 3.44 -3.32 3.71 0.00 -0.54 -1.01 120.51 125.94 3a15 n ALA 147 Ca -0.18 -1.04 -0.09 0.00 0.00 0.00 0.00 53.44 52.13 3a15 n ALA 147 Cb 0.52 -1.12 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 3a15 n ALA 147 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3a15 s PHE 148 N -1.68 0.26 -0.34 0.00 -0.12 -1.26 -4.82 117.98 110.02 3a15 s PHE 148 Ca 0.25 -0.65 0.07 0.00 -0.05 0.00 0.00 56.93 56.56 3a15 s PHE 148 Cb 0.20 0.30 -0.08 0.00 -0.63 0.00 0.00 43.02 42.82 3a15 s PHE 148 CO 0.06 -1.06 0.30 1.04 -0.05 0.00 0.00 175.22 175.52 3a15 n GLN 149 N -0.40 4.63 -4.21 1.99 6.02 -1.26 -4.67 117.38 119.48 3a15 n GLN 149 Ca -0.02 -0.01 -0.14 0.00 -0.01 0.00 0.00 57.00 56.82 3a15 n GLN 149 Cb 0.61 -0.84 -0.10 0.00 1.02 0.00 0.00 30.24 30.93 3a15 n GLN 149 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 3a15 s GLU 150 N -1.66 0.94 -1.08 -1.09 1.03 -1.26 -4.90 118.70 110.69 3a15 s GLU 150 Ca 0.03 -1.28 -0.14 0.00 0.03 0.00 0.00 54.97 53.60 3a15 s GLU 150 Cb 0.05 -0.58 -0.03 0.00 -0.80 0.00 0.00 34.13 32.77 3a15 s GLU 150 CO 0.29 0.08 0.83 -0.25 -1.33 0.00 0.00 175.26 174.88 3a15 n ASP 151 N 0.25 -5.92 -4.74 0.83 8.00 -1.26 -4.87 116.55 108.84 3a15 n ASP 151 Ca -0.14 -0.86 -0.42 0.00 0.71 0.00 0.00 54.79 54.09 3a15 n ASP 151 Cb 0.59 -4.05 -0.03 0.00 -0.02 0.00 0.00 41.12 37.61 3a15 n ASP 151 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3a15 s LEU 152 N -5.93 4.38 0.67 0.64 1.43 -1.26 -5.03 118.68 113.59 3a15 s LEU 152 Ca 0.43 2.62 -0.03 0.00 -1.03 0.00 0.00 54.13 56.12 3a15 s LEU 152 Cb -0.12 -3.61 0.08 0.00 0.03 0.00 0.00 46.19 42.57 3a15 s LEU 152 CO 0.82 -0.71 0.94 -2.16 0.23 0.00 0.00 176.35 175.47 3a15 s PRO 153 N -0.01 2.06 5.61 1.29 0.04 -1.26 -3.51 135.00 139.23 3a15 s PRO 153 Ca 0.61 -0.71 0.00 0.00 0.04 0.00 0.00 61.00 60.94 3a15 s PRO 153 Cb -0.41 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 31.81 3a15 s PRO 153 CO 0.40 -1.19 0.00 0.41 0.04 0.00 0.00 177.00 176.66 3a15 n GLY 154 N -2.74 2.71 0.25 0.56 0.00 -1.26 -2.84 105.19 101.87 3a15 n GLY 154 Ca 0.11 -0.39 0.11 0.00 0.00 0.00 0.00 46.02 45.84 3a15 n GLY 154 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3a15 h VAL 155 N 0.00 0.64 -0.14 1.61 3.04 -1.99 -1.94 116.25 117.47 3a15 h VAL 155 Ca 0.00 -0.72 0.04 0.00 -1.01 0.00 0.00 66.70 65.01 3a15 h VAL 155 Cb 0.00 1.46 -0.01 0.00 -2.01 0.00 0.00 31.29 30.73 3a15 h VAL 155 CO 0.00 0.16 0.14 1.23 -1.01 0.00 0.00 177.57 178.09 3a15 h GLY 156 N 1.10 0.00 2.00 3.17 0.00 -1.83 -1.84 103.07 105.68 3a15 h GLY 156 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3a15 h GLY 156 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.56 3a15 h ALA 157 N 1.85 1.00 -0.13 3.60 0.00 -1.39 -2.81 119.26 121.39 3a15 h ALA 157 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3a15 h ALA 157 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3a15 h ALA 157 CO -0.00 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.58 3a15 n VAL 158 N -2.78 0.22 -2.02 0.00 0.24 -0.70 -4.91 118.33 108.37 3a15 n VAL 158 Ca 0.01 -0.61 -0.29 0.00 -2.04 0.00 0.00 64.34 61.41 3a15 n VAL 158 Cb 0.28 1.17 0.18 0.00 -1.47 0.00 0.00 33.84 33.99 3a15 n VAL 158 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3a15 s MET 159 N -1.31 0.79 0.06 7.34 -1.94 -1.06 -4.93 119.30 118.25 3a15 s MET 159 Ca 0.23 -0.51 -0.13 0.00 -1.71 0.00 0.00 55.69 53.56 3a15 s MET 159 Cb 0.15 -1.91 -0.27 0.00 2.01 0.00 0.00 34.83 34.81 3a15 s MET 159 CO 0.21 -2.28 1.13 -0.44 -0.01 0.00 0.00 175.02 173.64 3a15 h ASP 160 N -1.49 0.85 0.00 3.03 3.32 -0.98 -3.49 116.42 117.66 3a15 h ASP 160 Ca -0.43 -0.76 0.00 0.00 0.02 0.00 0.00 57.03 55.86 3a15 h ASP 160 Cb 1.24 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.52 3a15 h ASP 160 CO 0.38 1.57 0.00 0.61 -1.72 0.00 0.00 179.24 180.08 3a15 n GLY 161 N 1.30 1.10 3.52 2.75 0.00 -0.85 -5.01 105.19 107.99 3a15 n GLY 161 Ca -0.13 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 3a15 n GLY 161 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3a15 s ILE 162 N -2.02 3.08 0.97 -0.61 1.10 -1.26 -0.61 121.20 121.86 3a15 s ILE 162 Ca 0.00 -1.23 -0.16 0.00 -0.51 0.00 0.00 60.65 58.75 3a15 s ILE 162 Cb 0.00 -2.38 0.20 0.00 0.15 0.00 0.00 42.46 40.43 3a15 s ILE 162 CO 0.00 0.22 1.29 -0.94 -2.11 0.00 0.00 174.94 173.40 3a15 s SER 163 N -1.83 3.00 0.97 4.50 1.04 -0.29 -4.79 113.70 116.29 3a15 s SER 163 Ca 0.18 0.34 -0.09 0.00 0.48 0.00 0.00 55.95 56.86 3a15 s SER 163 Cb -0.11 -0.43 0.13 0.00 0.10 0.00 0.00 66.02 65.71 3a15 s SER 163 CO 0.09 -2.81 0.76 0.61 0.98 0.00 0.00 173.24 172.87 3a15 n GLY 164 N -3.47 -1.21 3.69 7.32 0.00 -1.26 -4.73 105.19 105.53 3a15 n GLY 164 Ca 0.14 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 3a15 n GLY 164 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3a15 s GLU 165 N -4.63 4.15 0.25 1.61 2.02 -1.26 -4.55 118.70 116.28 3a15 s GLU 165 Ca 0.43 2.55 -0.02 0.00 0.02 0.00 0.00 54.97 57.96 3a15 s GLU 165 Cb -0.01 -3.56 -0.04 0.00 0.10 0.00 0.00 34.13 30.61 3a15 s GLU 165 CO 0.30 -0.82 0.46 0.96 0.02 0.00 0.00 175.26 176.18 3a15 s ILE 166 N 2.62 5.14 0.05 -1.63 -4.36 -0.91 -3.52 121.20 118.59 3a15 s ILE 166 Ca 0.79 -0.27 -0.11 0.00 -0.26 0.00 0.00 60.65 60.80 3a15 s ILE 166 Cb -0.45 -3.75 -0.33 0.00 1.25 0.00 0.00 42.46 39.18 3a15 s ILE 166 CO 0.35 -0.27 1.06 -1.13 0.24 0.00 0.00 174.94 175.19 3a15 h ASN 167 N 1.72 0.66 -0.68 4.36 -0.73 -1.40 -3.42 115.58 116.09 3a15 h ASN 167 Ca -0.48 -0.71 -0.72 0.00 1.87 0.00 0.00 56.30 56.25 3a15 h ASN 167 Cb 1.20 -0.22 -0.07 0.00 0.27 0.00 0.00 38.32 39.49 3a15 h ASN 167 CO 0.66 1.56 2.85 -0.62 -0.37 0.00 0.00 177.43 181.51 3a15 n GLU 168 N -3.64 3.79 -3.80 6.67 4.71 -1.26 -4.67 120.64 122.45 3a15 n GLU 168 Ca -0.13 -2.98 -0.09 0.00 -0.01 0.00 0.00 57.16 53.95 3a15 n GLU 168 Cb 1.07 -2.87 -0.04 0.00 -1.01 0.00 0.00 31.44 28.59 3a15 n GLU 168 CO 0.00 0.00 0.00 -3.38 0.09 0.00 0.00 177.13 173.84 3a15 s HIS 169 N 0.92 -0.04 0.00 -0.32 -3.43 -1.26 -4.67 115.29 106.49 3a15 s HIS 169 Ca 0.53 -0.32 0.00 0.00 -0.80 0.00 0.00 55.06 54.47 3a15 s HIS 169 Cb 0.15 0.40 0.00 0.00 -1.43 0.00 0.00 32.58 31.70 3a15 s HIS 169 CO -0.06 -0.97 0.00 0.41 -2.00 0.00 0.00 174.74 172.12 3a15 n GLY 170 N -0.36 0.82 3.15 -1.38 0.00 -1.26 -4.69 105.19 101.46 3a15 n GLY 170 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 3a15 n GLY 170 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3a15 s TYR 171 N -2.04 0.01 0.22 1.61 1.13 -1.26 -5.02 117.35 111.99 3a15 s TYR 171 Ca 0.00 -0.12 -0.30 0.00 -1.41 0.00 0.00 57.07 55.24 3a15 s TYR 171 Cb 0.00 -0.02 -0.10 0.00 -1.10 0.00 0.00 41.96 40.74 3a15 s TYR 171 CO 0.00 -0.35 1.46 -1.58 -2.51 0.00 0.00 175.55 172.57 3a15 s TRP 172 N -1.76 3.05 0.00 -3.49 0.52 -1.26 -1.65 118.94 114.35 3a15 s TRP 172 Ca -0.11 0.94 0.00 0.00 0.02 0.00 0.00 56.10 56.94 3a15 s TRP 172 Cb -0.05 -3.83 0.00 0.00 -1.15 0.00 0.00 33.47 28.44 3a15 s TRP 172 CO 0.00 -2.79 0.00 0.41 0.02 0.00 0.00 176.95 174.59 3a15 n GLY 173 N 2.65 2.86 0.22 0.98 0.00 -1.26 -4.96 105.19 105.67 3a15 n GLY 173 Ca 0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.04 3a15 n GLY 173 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3a15 h SER 174 N 0.00 0.54 -0.08 1.61 4.64 -1.64 -2.52 113.55 116.11 3a15 h SER 174 Ca 0.00 -0.26 0.04 0.00 -0.47 0.00 0.00 61.79 61.10 3a15 h SER 174 Cb 0.00 -0.15 -0.06 0.00 -0.31 0.00 0.00 62.40 61.88 3a15 h SER 174 CO 0.00 0.92 -0.29 -0.03 -0.87 0.00 0.00 176.83 176.57 3a15 h MET 175 N 0.41 -0.37 -0.50 4.77 -1.53 -1.83 -1.04 114.93 114.83 3a15 h MET 175 Ca 0.03 0.03 0.07 0.00 -3.44 0.00 0.00 59.70 56.38 3a15 h MET 175 Cb 0.96 0.09 -0.06 0.00 -0.55 0.00 0.00 31.60 32.03 3a15 h MET 175 CO 0.08 -0.25 0.16 -0.09 0.14 0.00 0.00 176.91 176.96 3a15 h ARG 176 N -0.39 0.32 0.00 0.39 2.43 -1.94 -1.62 114.38 113.57 3a15 h ARG 176 Ca 0.08 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 3a15 h ARG 176 Cb 0.51 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 3a15 h ARG 176 CO -0.30 0.21 -0.03 0.93 -1.51 0.00 0.00 179.97 179.27 3a15 h GLU 177 N 0.33 0.00 0.00 0.20 5.08 -0.95 -1.78 114.58 117.46 3a15 h GLU 177 Ca 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 3a15 h GLU 177 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3a15 h GLU 177 CO -0.26 0.03 0.00 0.00 -1.00 0.00 0.00 179.01 177.78 3a15 h ARG 178 N 0.00 0.00 -6.26 2.33 3.08 -0.19 -3.43 114.38 109.91 3a15 h ARG 178 Ca -0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 3a15 h ARG 178 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 3a15 h ARG 178 CO 0.00 0.00 1.07 -0.06 -1.07 0.00 0.00 179.97 179.92 3a15 s PHE 179 N -3.29 2.04 0.36 3.04 0.40 -0.67 -4.64 117.98 115.23 3a15 s PHE 179 Ca 0.06 0.25 0.06 0.00 -0.60 0.00 0.00 56.93 56.70 3a15 s PHE 179 Cb 0.07 -3.89 0.75 0.00 0.51 0.00 0.00 43.02 40.46 3a15 s PHE 179 CO 0.63 -3.71 1.95 -1.35 0.70 0.00 0.00 175.22 173.44 3a15 h PRO 180 N 9.44 0.72 0.00 0.24 0.11 -1.80 -1.19 132.00 139.52 3a15 h PRO 180 Ca -0.38 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3a15 h PRO 180 Cb 1.17 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3a15 h PRO 180 CO 0.95 0.48 0.00 0.97 -0.21 0.00 0.00 178.00 180.19 3a15 h ILE 181 N 0.75 0.00 0.00 4.15 2.10 -1.62 -2.56 117.51 120.32 3a15 h ILE 181 Ca 0.32 -0.27 0.00 0.00 1.08 0.00 0.00 64.86 65.98 3a15 h ILE 181 Cb 0.29 1.22 0.00 0.00 -1.09 0.00 0.00 36.82 37.24 3a15 h ILE 181 CO -0.11 0.00 0.00 0.77 -1.08 0.00 0.00 178.15 177.73 3a15 h SER 182 N 0.00 0.00 0.04 2.19 4.64 -1.38 -1.01 113.55 118.03 3a15 h SER 182 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3a15 h SER 182 Cb 0.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3a15 h SER 182 CO 0.00 0.00 -0.01 1.56 -0.87 0.00 0.00 176.83 177.51 3a15 h GLN 183 N 0.00 0.00 0.00 4.77 4.20 -1.61 -3.33 115.11 119.14 3a15 h GLN 183 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3a15 h GLN 183 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 3a15 h GLN 183 CO 0.00 0.01 -0.00 0.25 -0.67 0.00 0.00 178.83 178.42 3a15 n THR 184 N -3.74 0.00 -4.82 -0.54 -2.24 -1.02 -0.53 114.28 101.39 3a15 n THR 184 Ca -0.03 -0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.50 3a15 n THR 184 Cb 0.10 0.86 -0.16 0.00 -2.10 0.00 0.00 70.33 69.02 3a15 n THR 184 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3a15 s ASP 185 N -0.00 2.09 0.00 3.42 -1.08 -0.41 -4.86 116.67 115.83 3a15 s ASP 185 Ca 0.00 -0.33 0.30 0.00 -0.52 0.00 0.00 52.55 52.00 3a15 s ASP 185 Cb 0.00 -0.45 1.50 0.00 -1.46 0.00 0.00 42.92 42.51 3a15 s ASP 185 CO 0.00 0.17 2.03 0.79 0.52 0.00 0.00 175.17 178.68 3a15 n TRP 186 N 2.96 0.00 -4.09 -5.34 7.02 -1.26 -4.22 117.44 112.51 3a15 n TRP 186 Ca -0.17 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 55.98 3a15 n TRP 186 Cb 0.53 -0.22 -0.01 0.00 -2.42 0.00 0.00 31.31 29.19 3a15 n TRP 186 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 3a15 n MET 187 N -1.16 -3.92 -2.60 -0.99 2.81 -1.26 -4.90 117.12 105.09 3a15 n MET 187 Ca 0.16 0.45 -0.40 0.00 -1.81 0.00 0.00 57.70 56.09 3a15 n MET 187 Cb 0.23 -5.14 -0.05 0.00 -0.71 0.00 0.00 33.22 27.55 3a15 n MET 187 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3a15 s GLN 188 N -6.77 4.73 0.36 0.03 -1.52 -1.26 -4.65 119.66 110.57 3a15 s GLN 188 Ca 0.61 1.66 -0.25 0.00 -1.95 0.00 0.00 55.36 55.42 3a15 s GLN 188 Cb -0.32 -3.21 -0.09 0.00 -0.22 0.00 0.00 33.01 29.16 3a15 s GLN 188 CO 0.89 0.34 1.01 0.00 -0.25 0.00 0.00 175.29 177.28 3a15 s ALA 189 N -1.19 3.15 0.04 6.09 0.00 -1.26 -4.67 121.76 123.93 3a15 s ALA 189 Ca 0.43 0.63 -0.10 0.00 0.00 0.00 0.00 51.96 52.92 3a15 s ALA 189 Cb -0.29 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.60 3a15 s ALA 189 CO 0.37 -0.04 0.22 -1.54 0.00 0.00 0.00 175.76 174.76 3a15 s SER 190 N -1.58 0.00 0.00 0.00 1.04 -1.15 -5.04 113.70 106.98 3a15 s SER 190 Ca 0.54 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.64 3a15 s SER 190 Cb -0.21 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.22 3a15 s SER 190 CO 0.26 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.52 3a15 n GLY 191 N 0.67 -2.40 3.08 7.32 0.00 -1.26 -2.88 105.19 109.72 3a15 n GLY 191 Ca -0.19 -1.75 -0.14 0.00 0.00 0.00 0.00 46.02 43.95 3a15 n GLY 191 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3a15 s GLU 192 N -0.37 0.58 -0.26 1.61 2.02 -1.26 -4.95 118.70 116.08 3a15 s GLU 192 Ca 0.00 -0.77 -0.29 0.00 0.02 0.00 0.00 54.97 53.93 3a15 s GLU 192 Cb 0.00 -0.40 -0.01 0.00 0.10 0.00 0.00 34.13 33.82 3a15 s GLU 192 CO 0.00 0.08 1.44 -1.17 0.02 0.00 0.00 175.26 175.63 3a15 s LEU 193 N -1.55 3.91 -0.06 1.80 2.96 -1.26 -4.43 118.68 120.05 3a15 s LEU 193 Ca -0.08 1.42 0.01 0.00 -0.22 0.00 0.00 54.13 55.26 3a15 s LEU 193 Cb -0.10 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.08 3a15 s LEU 193 CO 0.01 -1.14 -0.06 -0.60 -1.32 0.00 0.00 176.35 173.24 3a15 s ARG 194 N 4.36 1.02 0.12 1.98 3.52 -0.87 -0.93 118.95 128.15 3a15 s ARG 194 Ca 0.63 -0.15 -0.31 0.00 -0.13 0.00 0.00 55.73 55.77 3a15 s ARG 194 Cb -0.21 -1.01 -0.09 0.00 -1.56 0.00 0.00 34.95 32.09 3a15 s ARG 194 CO 0.25 -0.10 1.55 0.08 -0.81 0.00 0.00 175.30 176.28 3a15 s VAL 195 N 1.03 2.91 -0.16 7.11 1.01 -0.33 0.15 120.40 132.12 3a15 s VAL 195 Ca -0.09 0.57 0.05 0.00 0.00 0.00 0.00 61.98 62.51 3a15 s VAL 195 Cb -0.14 -3.37 -0.06 0.00 0.00 0.00 0.00 36.38 32.81 3a15 s VAL 195 CO -0.00 0.03 0.18 2.30 0.00 0.00 0.00 175.10 177.60 3a15 n ILE 196 N 4.21 0.00 -3.71 2.22 -5.35 -0.28 -4.41 119.36 112.05 3a15 n ILE 196 Ca 0.14 -0.29 -0.11 0.00 -0.27 0.00 0.00 62.75 62.22 3a15 n ILE 196 Cb 0.40 0.79 -0.11 0.00 -1.74 0.00 0.00 39.64 38.98 3a15 n ILE 196 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3a15 s ALA 197 N -1.78 -0.97 0.00 -1.28 0.00 -1.15 -4.98 121.76 111.60 3a15 s ALA 197 Ca 0.01 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.36 3a15 s ALA 197 Cb 0.04 -0.85 0.00 0.00 0.00 0.00 0.00 23.12 22.31 3a15 s ALA 197 CO 0.21 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.14 3a15 n GLY 198 N 4.04 -2.05 2.85 0.00 0.00 -1.26 -0.94 105.19 107.84 3a15 n GLY 198 Ca -0.22 -1.59 -0.16 0.00 0.00 0.00 0.00 46.02 44.05 3a15 n GLY 198 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3a15 s ASP 199 N -3.86 0.42 0.48 1.61 2.15 -1.26 -4.75 116.67 111.47 3a15 s ASP 199 Ca 0.00 0.29 0.14 0.00 0.43 0.00 0.00 52.55 53.40 3a15 s ASP 199 Cb 0.00 0.19 1.13 0.00 -0.30 0.00 0.00 42.92 43.94 3a15 s ASP 199 CO 0.00 -0.20 2.10 1.55 -0.17 0.00 0.00 175.17 178.44 3a15 h PRO 200 N 7.90 0.12 0.00 4.34 0.13 -1.92 -2.69 132.00 139.88 3a15 h PRO 200 Ca -0.26 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3a15 h PRO 200 Cb 1.13 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3a15 h PRO 200 CO 0.26 0.12 0.00 0.00 -0.23 0.00 0.00 178.00 178.15 3a15 n ALA 201 N -2.52 2.45 0.09 -0.56 0.00 -1.26 -2.92 120.51 115.79 3a15 n ALA 201 Ca -0.02 -0.16 0.01 0.00 0.00 0.00 0.00 53.44 53.27 3a15 n ALA 201 Cb 0.12 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.14 3a15 n ALA 201 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3a15 n VAL 202 N -1.04 0.00 -4.24 0.00 0.31 -1.01 -5.07 118.33 107.28 3a15 n VAL 202 Ca 0.19 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 3a15 n VAL 202 Cb 0.10 1.01 0.00 0.00 -0.91 0.00 0.00 33.84 34.05 3a15 n VAL 202 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3a15 n GLY 203 N 0.81 -0.24 7.00 2.92 0.00 -1.15 -5.04 105.19 109.50 3a15 n GLY 203 Ca 0.01 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.99 3a15 n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a15 n GLY 204 N 0.00 0.29 3.69 -0.02 0.00 -1.26 -4.68 105.19 103.22 3a15 n GLY 204 Ca 0.00 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.74 3a15 n GLY 204 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a15 s ARG 205 N 0.00 4.38 -0.04 1.61 0.52 -1.26 -0.98 118.95 123.18 3a15 s ARG 205 Ca 0.00 1.00 0.02 0.00 -0.52 0.00 0.00 55.73 56.23 3a15 s ARG 205 Cb 0.00 -3.51 0.01 0.00 0.52 0.00 0.00 34.95 31.97 3a15 s ARG 205 CO 0.00 -0.14 -0.09 0.08 0.02 0.00 0.00 175.30 175.17 3a15 s VAL 206 N 1.49 0.85 -0.12 3.52 1.01 0.13 -4.22 120.40 123.05 3a15 s VAL 206 Ca 0.39 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.06 3a15 s VAL 206 Cb -0.18 -0.78 0.00 0.00 0.00 0.00 0.00 36.38 35.42 3a15 s VAL 206 CO 0.16 0.28 -0.22 -0.69 0.00 0.00 0.00 175.10 174.64 3a15 s VAL 207 N 0.52 2.20 -0.13 2.92 1.01 -0.11 -0.62 120.40 126.19 3a15 s VAL 207 Ca -0.09 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 60.92 3a15 s VAL 207 Cb -0.12 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 3a15 s VAL 207 CO 0.01 0.55 -0.08 -0.69 0.00 0.00 0.00 175.10 174.89 3a15 s VAL 208 N 0.57 3.49 -0.14 2.92 1.01 0.71 -1.12 120.40 127.83 3a15 s VAL 208 Ca -0.12 -0.51 -0.19 0.00 0.00 0.00 0.00 61.98 61.15 3a15 s VAL 208 Cb -0.17 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.69 3a15 s VAL 208 CO 0.04 0.52 0.52 -0.60 0.00 0.00 0.00 175.10 175.58 3a15 s ARG 209 N 0.15 4.30 1.03 2.72 3.52 0.12 -3.23 118.95 127.57 3a15 s ARG 209 Ca -0.04 0.49 -0.17 0.00 -0.13 0.00 0.00 55.73 55.88 3a15 s ARG 209 Cb -0.14 -3.48 0.22 0.00 -1.56 0.00 0.00 34.95 29.99 3a15 s ARG 209 CO 0.04 0.04 1.25 0.20 -0.81 0.00 0.00 175.30 176.02 3a15 s GLY 210 N 0.82 1.71 0.26 8.12 0.00 -1.26 -2.05 107.32 114.92 3a15 s GLY 210 Ca 0.27 -1.08 0.04 0.00 0.00 0.00 0.00 44.72 43.95 3a15 s GLY 210 CO 0.11 -0.29 -0.01 -2.38 0.00 0.00 0.00 173.10 170.53 3a15 s HIS 211 N -3.59 1.73 0.19 1.90 -3.43 -1.26 -4.76 115.29 106.08 3a15 s HIS 211 Ca 0.72 -0.87 -0.33 0.00 -0.80 0.00 0.00 55.06 53.79 3a15 s HIS 211 Cb -0.06 -1.03 -0.14 0.00 -1.43 0.00 0.00 32.58 29.93 3a15 s HIS 211 CO 0.54 0.05 1.53 -0.25 -2.00 0.00 0.00 174.74 174.61 3a15 n ASP 212 N -0.51 3.06 -2.43 7.38 8.00 -1.14 -3.05 116.55 127.86 3a15 n ASP 212 Ca -0.05 1.10 -0.20 0.00 0.71 0.00 0.00 54.79 56.36 3a15 n ASP 212 Cb 0.64 -1.44 0.01 0.00 -0.02 0.00 0.00 41.12 40.31 3a15 n ASP 212 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3a15 n ASN 213 N 3.00 -5.65 -4.71 -2.24 3.02 0.57 -2.91 115.26 106.35 3a15 n ASN 213 Ca 0.15 -0.11 -0.42 0.00 -0.03 0.00 0.00 54.58 54.17 3a15 n ASN 213 Cb 0.30 -4.60 0.00 0.00 -0.61 0.00 0.00 39.78 34.87 3a15 n ASN 213 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3a15 n ILE 214 N -4.18 2.18 -4.67 2.41 5.41 -1.17 -4.14 119.36 115.21 3a15 n ILE 214 Ca -0.18 -0.50 -0.32 0.00 1.00 0.00 0.00 62.75 62.75 3a15 n ILE 214 Cb 0.65 -1.60 -0.12 0.00 -0.71 0.00 0.00 39.64 37.86 3a15 n ILE 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3a15 s ALA 215 N -1.13 2.72 -0.12 -1.39 0.00 -0.71 -2.73 121.76 118.41 3a15 s ALA 215 Ca 0.57 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 51.45 3a15 s ALA 215 Cb -0.54 -0.90 0.02 0.00 0.00 0.00 0.00 23.12 21.70 3a15 s ALA 215 CO 0.61 0.58 -0.13 -1.17 0.00 0.00 0.00 175.76 175.65 3a15 s LEU 216 N -1.26 1.61 -0.15 0.00 2.96 0.49 -0.39 118.68 121.94 3a15 s LEU 216 Ca 0.15 -0.42 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 3a15 s LEU 216 Cb -0.11 -1.06 -0.03 0.00 0.50 0.00 0.00 46.19 45.49 3a15 s LEU 216 CO 0.05 -0.03 -0.01 -0.51 -1.32 0.00 0.00 176.35 174.53 3a15 s ILE 217 N 1.25 4.13 -0.26 6.68 2.07 -0.05 -1.01 121.20 134.01 3a15 s ILE 217 Ca -0.01 -0.28 -0.02 0.00 -1.41 0.00 0.00 60.65 58.93 3a15 s ILE 217 Cb -0.14 -2.80 0.03 0.00 0.13 0.00 0.00 42.46 39.68 3a15 s ILE 217 CO -0.05 0.51 -0.04 -0.60 -1.91 0.00 0.00 174.94 172.84 3a15 s ARG 218 N 0.11 2.73 -0.14 3.50 3.52 0.13 -0.94 118.95 127.86 3a15 s ARG 218 Ca 0.01 -1.05 0.02 0.00 -0.13 0.00 0.00 55.73 54.57 3a15 s ARG 218 Cb -0.13 -3.04 0.02 0.00 -1.56 0.00 0.00 34.95 30.23 3a15 s ARG 218 CO 0.02 -0.46 -0.18 0.45 -0.81 0.00 0.00 175.30 174.32 3a15 s SER 219 N 1.31 2.83 0.22 -2.12 0.15 -1.05 -0.56 113.70 114.48 3a15 s SER 219 Ca -0.01 -0.53 0.07 0.00 0.70 0.00 0.00 55.95 56.17 3a15 s SER 219 Cb -0.17 -1.29 -0.05 0.00 -1.71 0.00 0.00 66.02 62.80 3a15 s SER 219 CO -0.03 0.02 -0.10 -0.83 1.20 0.00 0.00 173.24 173.49 3a15 s GLY 220 N 1.10 1.51 -0.02 9.45 0.00 -0.33 -0.33 107.32 118.69 3a15 s GLY 220 Ca -0.02 -1.72 0.01 0.00 0.00 0.00 0.00 44.72 42.99 3a15 s GLY 220 CO -0.06 -1.75 -0.02 1.20 0.00 0.00 0.00 173.10 172.46 3a15 s GLN 221 N -3.70 0.44 -0.17 2.90 1.11 0.49 -2.73 119.66 118.01 3a15 s GLN 221 Ca 0.24 -0.05 -0.03 0.00 0.01 0.00 0.00 55.36 55.54 3a15 s GLN 221 Cb 0.01 -0.52 0.06 0.00 -1.01 0.00 0.00 33.01 31.55 3a15 s GLN 221 CO 0.08 -0.04 0.04 0.34 0.01 0.00 0.00 175.29 175.72 3a15 s ASP 222 N 0.61 2.58 -0.03 5.90 -1.08 0.05 -0.63 116.67 124.06 3a15 s ASP 222 Ca -0.07 -0.66 0.05 0.00 -0.52 0.00 0.00 52.55 51.35 3a15 s ASP 222 Cb -0.10 -0.49 0.08 0.00 -1.46 0.00 0.00 42.92 40.95 3a15 s ASP 222 CO -0.01 -0.30 0.99 -2.67 0.52 0.00 0.00 175.17 173.70 3a15 n TRP 223 N 5.12 0.00 -0.20 -5.34 2.14 -0.77 -1.44 117.44 116.95 3a15 n TRP 223 Ca -0.08 -0.56 -0.05 0.00 2.07 0.00 0.00 57.50 58.88 3a15 n TRP 223 Cb 0.48 -0.07 0.05 0.00 -0.81 0.00 0.00 31.31 30.96 3a15 n TRP 223 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 3a15 h ALA 224 N 0.00 0.74 -0.31 -1.67 0.00 -1.88 -3.05 119.26 113.10 3a15 h ALA 224 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3a15 h ALA 224 Cb 0.72 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3a15 h ALA 224 CO 0.00 0.06 0.00 -0.25 0.00 0.00 0.00 179.25 179.06 3a15 n ASP 225 N -4.77 3.16 -4.77 0.00 8.00 -1.26 -5.01 116.55 111.90 3a15 n ASP 225 Ca 0.05 -1.92 -0.34 0.00 0.71 0.00 0.00 54.79 53.29 3a15 n ASP 225 Cb 0.09 -0.19 0.02 0.00 -0.02 0.00 0.00 41.12 41.02 3a15 n ASP 225 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3a15 s ALA 226 N -1.39 2.60 0.89 2.24 0.00 -1.15 -5.01 121.76 119.94 3a15 s ALA 226 Ca 0.32 0.67 -0.11 0.00 0.00 0.00 0.00 51.96 52.84 3a15 s ALA 226 Cb 0.19 -3.33 0.13 0.00 0.00 0.00 0.00 23.12 20.11 3a15 s ALA 226 CO 0.27 -0.99 1.09 -1.21 0.00 0.00 0.00 175.76 174.92 3a15 s GLU 227 N -3.69 1.30 0.21 0.00 0.41 -1.26 -4.74 118.70 110.94 3a15 s GLU 227 Ca 0.70 0.92 -0.09 0.00 -0.41 0.00 0.00 54.97 56.08 3a15 s GLU 227 Cb -0.22 -1.81 0.28 0.00 -1.78 0.00 0.00 34.13 30.61 3a15 s GLU 227 CO 0.34 -2.24 1.76 0.00 -0.49 0.00 0.00 175.26 174.63 3a15 h ALA 228 N -1.55 0.83 -0.95 5.21 0.00 -1.99 -1.46 119.26 119.35 3a15 h ALA 228 Ca -0.49 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.51 3a15 h ALA 228 Cb 1.28 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.03 3a15 h ALA 228 CO 0.53 -0.14 0.63 0.38 0.00 0.00 0.00 179.25 180.65 3a15 h ASP 229 N 0.48 1.07 0.62 0.00 2.03 -1.99 -0.11 116.42 118.51 3a15 h ASP 229 Ca 0.31 -0.02 -0.19 0.00 -0.73 0.00 0.00 57.03 56.41 3a15 h ASP 229 Cb 0.35 -0.26 -0.01 0.00 -0.83 0.00 0.00 39.33 38.58 3a15 h ASP 229 CO -0.28 0.76 -0.84 -0.33 -1.03 0.00 0.00 179.24 177.52 3a15 h GLU 230 N 1.25 0.15 -0.83 4.15 5.08 -1.81 -0.06 114.58 122.51 3a15 h GLU 230 Ca 0.36 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 3a15 h GLU 230 Cb -0.08 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 3a15 h GLU 230 CO -0.10 0.90 0.45 0.00 -1.00 0.00 0.00 179.01 179.26 3a15 h ARG 231 N 0.09 1.17 -0.39 2.33 3.08 -0.91 -2.06 114.38 117.68 3a15 h ARG 231 Ca -0.03 -0.14 -0.12 0.00 0.07 0.00 0.00 59.98 59.76 3a15 h ARG 231 Cb 1.45 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 3a15 h ARG 231 CO 0.12 0.86 -0.24 0.77 -1.07 0.00 0.00 179.97 180.42 3a15 h SER 232 N 1.16 0.80 -0.70 7.04 0.02 -0.87 0.88 113.55 121.88 3a15 h SER 232 Ca 0.29 -0.30 0.08 0.00 -0.84 0.00 0.00 61.79 61.02 3a15 h SER 232 Cb 0.04 -0.22 -0.06 0.00 0.14 0.00 0.00 62.40 62.30 3a15 h SER 232 CO -0.05 1.01 0.37 0.25 -1.14 0.00 0.00 176.83 177.28 3a15 h LEU 233 N 0.68 0.53 0.24 5.07 5.85 -0.77 0.14 115.31 127.06 3a15 h LEU 233 Ca 0.09 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3a15 h LEU 233 Cb 0.76 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.74 3a15 h LEU 233 CO 0.06 0.32 -0.12 0.22 -0.34 0.00 0.00 178.44 178.59 3a15 h TYR 234 N 0.66 -0.30 -0.05 1.25 3.20 -1.25 -1.85 116.97 118.64 3a15 h TYR 234 Ca 0.33 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.09 3a15 h TYR 234 Cb 0.28 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 3a15 h TYR 234 CO -0.09 0.02 -0.45 -0.07 -1.64 0.00 0.00 178.16 175.93 3a15 h LEU 235 N -0.98 0.13 0.00 2.82 3.38 -0.73 0.44 115.31 120.36 3a15 h LEU 235 Ca -0.03 -0.05 -0.30 0.00 0.09 0.00 0.00 57.88 57.58 3a15 h LEU 235 Cb 0.45 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.11 3a15 h LEU 235 CO 0.05 0.56 -2.12 0.47 0.09 0.00 0.00 178.44 177.49 3a15 n ASP 236 N -4.00 1.61 -0.09 -0.43 8.00 0.49 -4.37 116.55 117.76 3a15 n ASP 236 Ca -0.02 -0.05 -0.09 0.00 0.71 0.00 0.00 54.79 55.35 3a15 n ASP 236 Cb 0.49 0.40 -0.14 0.00 -0.02 0.00 0.00 41.12 41.84 3a15 n ASP 236 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3a15 n GLU 237 N -2.80 1.03 -0.12 -1.24 -0.58 -1.10 -4.60 120.64 111.23 3a15 n GLU 237 Ca -0.30 -0.01 -0.25 0.00 -0.42 0.00 0.00 57.16 56.18 3a15 n GLU 237 Cb 0.96 -1.47 -0.08 0.00 -0.57 0.00 0.00 31.44 30.29 3a15 n GLU 237 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 3a15 n ILE 238 N -2.67 1.33 -0.18 -3.67 5.41 -0.71 -4.72 119.36 114.14 3a15 n ILE 238 Ca -0.30 -0.31 -0.02 0.00 1.00 0.00 0.00 62.75 63.13 3a15 n ILE 238 Cb 1.09 -1.85 0.08 0.00 -0.71 0.00 0.00 39.64 38.25 3a15 n ILE 238 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 3a15 h LEU 239 N -0.86 0.12 -1.16 1.39 5.85 -0.33 -0.85 115.31 119.48 3a15 h LEU 239 Ca -0.58 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.31 3a15 h LEU 239 Cb 1.50 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.55 3a15 h LEU 239 CO -0.35 0.09 0.59 -0.65 -0.34 0.00 0.00 178.44 177.78 3a15 h PRO 240 N 0.33 0.92 -0.03 5.25 0.11 -1.81 0.54 132.00 137.30 3a15 h PRO 240 Ca 0.27 -0.06 -0.21 0.00 0.11 0.00 0.00 66.00 66.12 3a15 h PRO 240 Cb 0.34 -0.21 0.02 0.00 0.11 0.00 0.00 31.00 31.26 3a15 h PRO 240 CO -0.30 0.61 -0.80 1.15 -0.21 0.00 0.00 178.00 178.45 3a15 h THR 241 N 0.95 1.34 -0.47 -1.15 2.02 -1.71 -2.59 112.91 111.30 3a15 h THR 241 Ca 0.42 -2.11 0.02 0.00 0.77 0.00 0.00 66.41 65.51 3a15 h THR 241 Cb 0.35 2.39 -0.03 0.00 -1.74 0.00 0.00 68.15 69.12 3a15 h THR 241 CO -0.18 0.64 0.27 0.25 0.37 0.00 0.00 175.52 176.87 3a15 h LEU 242 N 0.21 0.42 -0.36 2.58 5.85 -0.76 -1.24 115.31 122.00 3a15 h LEU 242 Ca -0.09 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.70 3a15 h LEU 242 Cb 1.47 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 42.37 3a15 h LEU 242 CO 0.16 0.30 0.02 -0.61 -0.34 0.00 0.00 178.44 177.97 3a15 h GLN 243 N 0.53 0.12 -0.66 1.25 5.75 0.04 0.12 115.11 122.26 3a15 h GLN 243 Ca 0.19 -0.01 0.11 0.00 -0.15 0.00 0.00 58.65 58.79 3a15 h GLN 243 Cb 0.04 -0.03 -0.08 0.00 1.07 0.00 0.00 27.48 28.48 3a15 h GLN 243 CO -0.10 0.08 0.25 1.03 -2.65 0.00 0.00 178.83 177.45 3a15 h SER 244 N 0.12 0.25 -0.09 -0.69 0.87 -1.03 -0.34 113.55 112.64 3a15 h SER 244 Ca 0.18 0.09 -0.13 0.00 -1.23 0.00 0.00 61.79 60.69 3a15 h SER 244 Cb 0.24 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 3a15 h SER 244 CO -0.28 0.14 -0.38 1.23 -0.53 0.00 0.00 176.83 177.01 3a15 h GLY 245 N 0.43 0.66 1.03 5.77 0.00 -0.43 -1.71 103.07 108.82 3a15 h GLY 245 Ca 0.34 -0.64 -0.14 0.00 0.00 0.00 0.00 47.33 46.88 3a15 h GLY 245 CO -0.33 0.58 -0.36 -0.33 0.00 0.00 0.00 176.54 176.10 3a15 h MET 246 N 0.50 0.78 -0.86 4.80 2.07 -0.61 -1.87 114.93 119.75 3a15 h MET 246 Ca 0.05 -0.43 -0.00 0.00 -2.07 0.00 0.00 59.70 57.24 3a15 h MET 246 Cb 0.89 0.03 -0.04 0.00 -1.87 0.00 0.00 31.60 30.60 3a15 h MET 246 CO 0.08 1.06 0.54 -0.44 1.07 0.00 0.00 176.91 179.22 3a15 h ASP 247 N 0.55 1.02 0.11 1.22 3.32 -1.02 0.83 116.42 122.45 3a15 h ASP 247 Ca 0.04 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3a15 h ASP 247 Cb 0.95 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.24 3a15 h ASP 247 CO 0.09 0.77 -0.06 0.15 -1.72 0.00 0.00 179.24 178.46 3a15 h PHE 248 N 1.18 -0.16 -0.53 4.55 3.57 -1.07 -1.14 116.94 123.34 3a15 h PHE 248 Ca 0.31 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.75 3a15 h PHE 248 Cb -0.08 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 3a15 h PHE 248 CO 0.00 -0.10 0.07 -0.07 -2.23 0.00 0.00 178.31 175.98 3a15 h LEU 249 N -0.16 0.81 -1.29 0.59 3.38 -1.03 0.28 115.31 117.88 3a15 h LEU 249 Ca -0.01 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 3a15 h LEU 249 Cb 0.13 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3a15 h LEU 249 CO 0.01 0.83 0.06 -0.09 0.09 0.00 0.00 178.44 179.35 3a15 h ARG 250 N 0.81 0.55 0.00 1.13 2.43 -0.62 -2.67 114.38 116.00 3a15 h ARG 250 Ca 0.17 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3a15 h ARG 250 Cb 0.38 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3a15 h ARG 250 CO 0.01 0.53 -0.44 -0.25 -1.51 0.00 0.00 179.97 178.31 3a15 n ASP 251 N -4.32 0.49 -0.64 -3.80 8.00 -0.45 -4.48 116.55 111.36 3a15 n ASP 251 Ca 0.02 -0.68 0.06 0.00 0.71 0.00 0.00 54.79 54.90 3a15 n ASP 251 Cb 0.21 1.01 0.14 0.00 -0.02 0.00 0.00 41.12 42.45 3a15 n ASP 251 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3a15 n ASN 252 N -1.22 1.56 -0.04 -2.24 3.02 0.95 -4.93 115.26 112.35 3a15 n ASN 252 Ca 0.02 -3.15 -0.10 0.00 -0.03 0.00 0.00 54.58 51.31 3a15 n ASN 252 Cb 0.14 -0.43 -0.04 0.00 -0.61 0.00 0.00 39.78 38.84 3a15 n ASN 252 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3a15 h GLY 253 N 0.66 -0.45 0.78 7.41 0.00 -1.65 -2.89 103.07 106.94 3a15 h GLY 253 Ca -0.04 0.44 0.08 0.00 0.00 0.00 0.00 47.33 47.81 3a15 h GLY 253 CO 0.02 -0.21 0.57 -2.55 0.00 0.00 0.00 176.54 174.37 3a15 h PRO 254 N -0.37 0.89 0.00 4.80 0.11 -1.89 0.31 132.00 135.85 3a15 h PRO 254 Ca 0.11 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 3a15 h PRO 254 Cb 0.56 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.47 3a15 h PRO 254 CO -0.42 0.59 -0.11 0.00 -0.21 0.00 0.00 178.00 177.84 3a15 h ALA 255 N 1.54 1.46 -0.00 -0.75 0.00 -1.88 -3.23 119.26 116.39 3a15 h ALA 255 Ca 0.40 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3a15 h ALA 255 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3a15 h ALA 255 CO -0.16 0.14 -0.17 1.33 0.00 0.00 0.00 179.25 180.39 3a15 n VAL 256 N -3.88 0.00 -0.26 0.00 0.24 -0.66 -5.01 118.33 108.76 3a15 n VAL 256 Ca -0.02 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 3a15 n VAL 256 Cb 0.21 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.59 3a15 n VAL 256 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3a15 n GLY 257 N 0.99 1.01 3.36 7.63 0.00 -0.02 -4.77 105.19 113.39 3a15 n GLY 257 Ca 0.01 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 3a15 n GLY 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a15 h TYR 259 N 8.61 0.90 -2.53 0.00 0.05 -0.80 -3.36 116.97 119.85 3a15 h TYR 259 Ca -0.26 -0.14 -0.09 0.00 0.05 0.00 0.00 58.73 58.28 3a15 h TYR 259 Cb 1.10 -0.24 -0.26 0.00 1.01 0.00 0.00 36.73 38.35 3a15 h TYR 259 CO 0.61 0.84 -0.24 0.45 -1.05 0.00 0.00 178.16 178.77 3a15 s SER 260 N -6.64 -0.59 -0.12 3.88 0.15 -1.06 -4.71 113.70 104.60 3a15 s SER 260 Ca -0.10 1.00 -0.00 0.00 0.70 0.00 0.00 55.95 57.55 3a15 s SER 260 Cb 0.14 0.88 0.02 0.00 -1.71 0.00 0.00 66.02 65.36 3a15 s SER 260 CO 0.82 -0.20 -0.09 0.21 1.20 0.00 0.00 173.24 175.18 3a15 s ASN 261 N 1.45 2.23 -0.04 5.45 2.47 -1.26 -0.70 114.94 124.54 3a15 s ASN 261 Ca -0.10 -0.33 0.07 0.00 0.42 0.00 0.00 52.86 52.92 3a15 s ASN 261 Cb -0.08 -0.89 -0.01 0.00 -1.45 0.00 0.00 41.25 38.81 3a15 s ASN 261 CO -0.14 -0.10 -0.24 -0.13 -3.72 0.00 0.00 177.10 172.77 3a15 s ARG 262 N 1.59 2.21 -0.28 0.43 0.52 -0.18 -4.62 118.95 118.62 3a15 s ARG 262 Ca 0.03 -0.86 0.02 0.00 -0.52 0.00 0.00 55.73 54.41 3a15 s ARG 262 Cb -0.13 -1.98 0.07 0.00 0.52 0.00 0.00 34.95 33.43 3a15 s ARG 262 CO -0.08 0.43 -0.03 0.12 0.02 0.00 0.00 175.30 175.77 3a15 s PHE 263 N -0.33 3.04 0.14 -0.53 5.36 -1.26 -0.27 117.98 124.12 3a15 s PHE 263 Ca 0.02 -2.31 0.11 0.00 -0.96 0.00 0.00 56.93 53.79 3a15 s PHE 263 Cb -0.11 -2.10 -0.04 0.00 -0.34 0.00 0.00 43.02 40.42 3a15 s PHE 263 CO 0.01 -0.87 -0.25 0.14 -1.46 0.00 0.00 175.22 172.79 3a15 s VAL 264 N 1.17 2.35 -0.08 3.12 -7.23 -0.08 -4.78 120.40 114.86 3a15 s VAL 264 Ca -0.01 -1.78 0.04 0.00 -1.81 0.00 0.00 61.98 58.43 3a15 s VAL 264 Cb -0.19 -2.06 -0.01 0.00 0.56 0.00 0.00 36.38 34.68 3a15 s VAL 264 CO -0.08 0.05 -0.22 -0.60 -0.31 0.00 0.00 175.10 173.95 3a15 s ARG 265 N -2.18 2.82 0.52 4.82 3.52 -0.45 -1.30 118.95 126.70 3a15 s ARG 265 Ca 0.16 -0.84 -0.22 0.00 -0.13 0.00 0.00 55.73 54.70 3a15 s ARG 265 Cb -0.10 -2.30 -0.05 0.00 -1.56 0.00 0.00 34.95 30.93 3a15 s ARG 265 CO 0.07 0.33 1.30 -0.80 -0.81 0.00 0.00 175.30 175.38 3a15 s ASN 266 N -0.00 5.52 0.09 -2.12 -0.87 -0.14 -0.19 114.94 117.22 3a15 s ASN 266 Ca -0.07 2.62 0.02 0.00 -1.57 0.00 0.00 52.86 53.86 3a15 s ASN 266 Cb -0.15 -2.62 -0.04 0.00 -0.02 0.00 0.00 41.25 38.42 3a15 s ASN 266 CO 0.05 -1.39 -0.08 0.27 -2.57 0.00 0.00 177.10 173.39 3a15 s ILE 267 N -1.39 0.71 0.55 0.60 -4.36 -0.30 -0.50 121.20 116.51 3a15 s ILE 267 Ca 0.70 -1.68 -0.09 0.00 -0.26 0.00 0.00 60.65 59.32 3a15 s ILE 267 Cb -0.37 -1.37 0.13 0.00 1.25 0.00 0.00 42.46 42.10 3a15 s ILE 267 CO 0.43 -0.69 0.74 -0.90 0.24 0.00 0.00 174.94 174.76 3a15 n ASP 268 N 0.43 0.08 0.30 4.36 5.68 -0.12 -4.53 116.55 122.75 3a15 n ASP 268 Ca -0.15 -1.29 0.20 0.00 -0.50 0.00 0.00 54.79 53.05 3a15 n ASP 268 Cb 0.59 -0.57 1.02 0.00 -1.14 0.00 0.00 41.12 41.02 3a15 n ASP 268 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3a15 h ILE 269 N -1.40 0.00 -0.34 2.12 6.09 -1.99 -2.20 117.51 119.79 3a15 h ILE 269 Ca -0.24 -0.11 0.00 0.00 -1.37 0.00 0.00 64.86 63.14 3a15 h ILE 269 Cb 0.67 1.03 0.00 0.00 0.47 0.00 0.00 36.82 38.99 3a15 h ILE 269 CO 0.17 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 175.72 3a15 n ASP 270 N -2.95 3.34 0.00 2.19 8.00 -1.26 -4.88 116.55 120.99 3a15 n ASP 270 Ca -0.02 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.51 3a15 n ASP 270 Cb 0.12 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 3a15 n ASP 270 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a15 n GLY 271 N 1.40 0.75 3.73 0.44 0.00 -0.83 -5.05 105.19 105.63 3a15 n GLY 271 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3a15 n GLY 271 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a15 s ASN 272 N -2.50 7.23 0.28 1.61 0.01 -1.26 -4.79 114.94 115.52 3a15 s ASN 272 Ca 0.00 2.04 -0.29 0.00 -0.71 0.00 0.00 52.86 53.90 3a15 s ASN 272 Cb 0.00 -2.60 -0.10 0.00 0.41 0.00 0.00 41.25 38.97 3a15 s ASN 272 CO 0.00 -0.28 1.30 -0.36 -1.51 0.00 0.00 177.10 176.25 3a15 s PHE 273 N 0.14 3.16 0.28 2.20 0.08 -1.26 -0.94 117.98 121.63 3a15 s PHE 273 Ca 0.52 1.34 0.08 0.00 0.12 0.00 0.00 56.93 58.99 3a15 s PHE 273 Cb -0.29 -3.64 -0.04 0.00 -0.57 0.00 0.00 43.02 38.49 3a15 s PHE 273 CO 0.33 -1.83 0.14 -0.51 -0.10 0.00 0.00 175.22 173.25 3a15 s LEU 274 N -1.12 3.53 -0.98 -0.37 1.43 0.34 -4.87 118.68 116.64 3a15 s LEU 274 Ca 0.52 -0.46 -0.07 0.00 -1.03 0.00 0.00 54.13 53.09 3a15 s LEU 274 Cb -0.38 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.75 3a15 s LEU 274 CO 0.46 -0.09 2.87 0.47 0.23 0.00 0.00 176.35 180.30 3a15 n ASP 275 N -1.11 7.41 -3.93 2.29 8.00 -1.26 -4.43 116.55 123.53 3a15 n ASP 275 Ca -0.06 -2.86 -0.10 0.00 0.71 0.00 0.00 54.79 52.47 3a15 n ASP 275 Cb 0.59 -1.40 -0.11 0.00 -0.02 0.00 0.00 41.12 40.17 3a15 n ASP 275 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3a15 s LEU 276 N -1.06 1.99 0.15 0.64 1.02 -1.26 -1.85 118.68 118.30 3a15 s LEU 276 Ca 0.62 -0.29 -0.13 0.00 0.02 0.00 0.00 54.13 54.35 3a15 s LEU 276 Cb 0.25 0.24 0.01 0.00 0.02 0.00 0.00 46.19 46.71 3a15 s LEU 276 CO -0.09 -0.24 0.36 -0.94 0.02 0.00 0.00 176.35 175.46 3a15 s SER 277 N -1.07 -0.10 0.12 2.29 1.04 0.19 -0.97 113.70 115.20 3a15 s SER 277 Ca -0.12 -0.57 -0.23 0.00 0.48 0.00 0.00 55.95 55.52 3a15 s SER 277 Cb -0.07 0.46 0.06 0.00 0.10 0.00 0.00 66.02 66.58 3a15 s SER 277 CO -0.00 -0.89 0.56 -0.72 0.98 0.00 0.00 173.24 173.17 3a15 s TYR 278 N -3.88 -0.48 0.14 5.02 1.13 -0.42 -0.38 117.35 118.48 3a15 s TYR 278 Ca 0.09 0.36 -0.25 0.00 -1.41 0.00 0.00 57.07 55.86 3a15 s TYR 278 Cb 0.02 0.46 -0.07 0.00 -1.10 0.00 0.00 41.96 41.27 3a15 s TYR 278 CO -0.06 -0.77 0.77 1.21 -2.51 0.00 0.00 175.55 174.19 3a15 s ASN 279 N -2.48 7.35 -0.28 -0.18 3.04 0.55 -0.90 114.94 122.03 3a15 s ASN 279 Ca -0.01 1.60 0.02 0.00 0.04 0.00 0.00 52.86 54.51 3a15 s ASN 279 Cb -0.00 -2.49 0.07 0.00 -1.54 0.00 0.00 41.25 37.28 3a15 s ASN 279 CO -0.09 0.17 -0.05 -0.63 -3.04 0.00 0.00 177.10 173.45 3a15 s ILE 280 N -0.90 2.39 -0.16 -5.21 1.01 0.63 -2.52 121.20 116.44 3a15 s ILE 280 Ca 0.36 -1.70 0.00 0.00 0.00 0.00 0.00 60.65 59.32 3a15 s ILE 280 Cb -0.22 -2.46 0.03 0.00 0.01 0.00 0.00 42.46 39.81 3a15 s ILE 280 CO 0.25 -0.15 -0.13 -0.83 0.00 0.00 0.00 174.94 174.08 3a15 s GLY 281 N 1.13 1.15 -0.23 6.18 0.00 -0.12 -1.01 107.32 114.42 3a15 s GLY 281 Ca -0.05 -0.96 -0.12 0.00 0.00 0.00 0.00 44.72 43.60 3a15 s GLY 281 CO -0.05 0.56 0.22 0.30 0.00 0.00 0.00 173.10 174.13 3a15 s HIS 282 N 1.47 3.33 0.08 1.90 3.76 0.13 -0.87 115.29 125.09 3a15 s HIS 282 Ca 0.04 0.32 0.09 0.00 -0.15 0.00 0.00 55.06 55.36 3a15 s HIS 282 Cb -0.13 -2.33 -0.03 0.00 1.11 0.00 0.00 32.58 31.19 3a15 s HIS 282 CO -0.10 0.05 -0.25 -1.58 -0.85 0.00 0.00 174.74 172.01 3a15 s TRP 283 N 1.11 2.16 0.38 1.40 0.52 0.48 -0.13 118.94 124.87 3a15 s TRP 283 Ca 0.10 -0.40 0.27 0.00 0.02 0.00 0.00 56.10 56.09 3a15 s TRP 283 Cb -0.14 -1.24 1.38 0.00 -1.15 0.00 0.00 33.47 32.32 3a15 s TRP 283 CO 0.05 0.19 2.04 0.00 0.02 0.00 0.00 176.95 179.26 3a15 h ALA 284 N 4.44 1.26 -2.92 0.98 0.00 -0.95 -1.88 119.26 120.19 3a15 h ALA 284 Ca -0.47 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 3a15 h ALA 284 Cb 1.16 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.80 3a15 h ALA 284 CO 0.42 0.17 0.18 -1.54 0.00 0.00 0.00 179.25 178.47 3a15 s SER 285 N -6.18 -0.54 0.33 0.00 1.04 -1.26 -4.51 113.70 102.58 3a15 s SER 285 Ca -0.02 0.00 0.03 0.00 0.48 0.00 0.00 55.95 56.44 3a15 s SER 285 Cb 0.13 0.58 0.59 0.00 0.10 0.00 0.00 66.02 67.42 3a15 s SER 285 CO 0.59 -0.94 1.89 0.25 0.98 0.00 0.00 173.24 176.01 3a15 h LEU 286 N 2.10 0.55 -0.71 2.42 5.85 -1.83 -3.07 115.31 120.61 3a15 h LEU 286 Ca -0.34 -0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.33 3a15 h LEU 286 Cb 1.30 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.13 3a15 h LEU 286 CO 0.39 0.58 0.43 0.44 -0.34 0.00 0.00 178.44 179.94 3a15 h ASP 287 N 0.58 0.69 0.04 1.25 5.19 -1.95 -0.54 116.42 121.69 3a15 h ASP 287 Ca 0.13 0.01 -0.12 0.00 -0.62 0.00 0.00 57.03 56.42 3a15 h ASP 287 Cb 0.27 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.63 3a15 h ASP 287 CO 0.00 0.47 -0.40 1.56 -3.12 0.00 0.00 179.24 177.75 3a15 h GLN 288 N 0.83 0.47 -0.54 3.56 4.20 -1.86 -0.99 115.11 120.77 3a15 h GLN 288 Ca 0.30 -0.23 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 3a15 h GLN 288 Cb 0.08 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 3a15 h GLN 288 CO -0.13 0.80 0.19 1.25 -0.67 0.00 0.00 178.83 180.26 3a15 h LEU 289 N 0.39 0.78 0.10 1.46 5.85 -1.35 -2.25 115.31 120.28 3a15 h LEU 289 Ca 0.03 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.57 3a15 h LEU 289 Cb 0.88 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 3a15 h LEU 289 CO 0.07 0.76 -0.16 -0.33 -0.34 0.00 0.00 178.44 178.44 3a15 h GLU 290 N 0.75 -0.31 -0.80 1.25 5.08 -0.83 -1.95 114.58 117.77 3a15 h GLU 290 Ca 0.18 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.60 3a15 h GLU 290 Cb 0.25 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.52 3a15 h GLU 290 CO -0.01 -0.21 0.50 0.00 -1.00 0.00 0.00 179.01 178.29 3a15 h ARG 291 N -0.32 0.91 0.01 2.33 2.47 -1.09 -2.16 114.38 116.53 3a15 h ARG 291 Ca 0.02 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.69 3a15 h ARG 291 Cb 0.34 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.45 3a15 h ARG 291 CO -0.08 0.60 -0.01 2.35 0.56 0.00 0.00 179.97 183.39 3a15 h TRP 292 N 0.94 -0.02 -0.47 3.04 7.01 -1.31 -2.95 115.95 122.19 3a15 h TRP 292 Ca 0.33 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.34 3a15 h TRP 292 Cb 0.09 0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.13 3a15 h TRP 292 CO -0.04 0.23 0.30 0.66 -2.79 0.00 0.00 178.44 176.81 3a15 h SER 293 N -0.26 0.54 0.03 2.65 4.64 -1.11 -0.40 113.55 119.63 3a15 h SER 293 Ca -0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3a15 h SER 293 Cb 0.26 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3a15 h SER 293 CO 0.00 0.40 -0.07 -1.84 -0.87 0.00 0.00 176.83 174.45 3a15 n GLU 294 N -4.46 1.57 0.00 4.77 0.28 -0.83 -4.33 120.64 117.63 3a15 n GLU 294 Ca 0.04 -0.99 0.00 0.00 -0.16 0.00 0.00 57.16 56.05 3a15 n GLU 294 Cb 0.06 -1.48 0.00 0.00 1.43 0.00 0.00 31.44 31.45 3a15 n GLU 294 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 3a15 n SER 295 N 0.14 1.90 -4.73 -1.84 3.41 -1.04 -4.99 113.62 106.47 3a15 n SER 295 Ca 0.17 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.36 3a15 n SER 295 Cb 0.39 0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 64.54 3a15 n SER 295 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3a15 s HIS 296 N -1.23 3.43 0.50 7.33 2.46 -0.19 -4.90 115.29 122.70 3a15 s HIS 296 Ca 0.00 1.36 0.19 0.00 0.47 0.00 0.00 55.06 57.08 3a15 s HIS 296 Cb 0.00 -3.44 1.26 0.00 -0.13 0.00 0.00 32.58 30.27 3a15 s HIS 296 CO 0.00 -1.27 2.06 -1.35 -2.47 0.00 0.00 174.74 171.70 3a15 h PRO 297 N 5.80 0.09 0.23 2.88 0.11 -1.95 -1.58 132.00 137.58 3a15 h PRO 297 Ca -0.43 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 3a15 h PRO 297 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3a15 h PRO 297 CO 0.77 0.06 -0.11 1.79 -0.21 0.00 0.00 178.00 180.30 3a15 h THR 298 N 0.09 0.84 -0.63 -1.15 1.35 -1.90 -0.68 112.91 110.84 3a15 h THR 298 Ca 0.15 -0.49 -0.09 0.00 -0.55 0.00 0.00 66.41 65.44 3a15 h THR 298 Cb 0.49 1.13 -0.02 0.00 -1.73 0.00 0.00 68.15 68.01 3a15 h THR 298 CO -0.01 0.11 0.06 -0.74 -0.25 0.00 0.00 175.52 174.68 3a15 h HIS 299 N -0.56 1.14 -0.87 4.73 -0.00 -1.78 -2.51 115.15 115.30 3a15 h HIS 299 Ca -0.03 -0.17 0.05 0.00 -0.00 0.00 0.00 60.37 60.21 3a15 h HIS 299 Cb 0.41 -0.31 -0.06 0.00 -0.00 0.00 0.00 27.41 27.46 3a15 h HIS 299 CO 0.01 0.98 0.56 -0.07 -0.00 0.00 0.00 177.93 179.40 3a15 h LEU 300 N 0.98 0.90 -0.08 0.26 3.38 -1.24 0.26 115.31 119.77 3a15 h LEU 300 Ca 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 3a15 h LEU 300 Cb 0.49 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 3a15 h LEU 300 CO 0.02 0.60 0.03 -0.09 0.09 0.00 0.00 178.44 179.09 3a15 h ARG 301 N 1.05 0.13 -0.02 1.13 9.65 -0.87 -2.02 114.38 123.42 3a15 h ARG 301 Ca 0.36 -0.03 -0.13 0.00 -1.10 0.00 0.00 59.98 59.08 3a15 h ARG 301 Cb 0.09 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.63 3a15 h ARG 301 CO -0.14 0.28 -0.61 -0.84 2.80 0.00 0.00 179.97 181.46 3a15 h ILE 302 N -0.04 1.42 -0.06 1.20 3.07 -1.22 -1.73 117.51 120.14 3a15 h ILE 302 Ca 0.03 -2.05 0.03 0.00 1.55 0.00 0.00 64.86 64.41 3a15 h ILE 302 Cb 0.20 2.08 -0.03 0.00 -0.27 0.00 0.00 36.82 38.80 3a15 h ILE 302 CO -0.00 0.59 -0.11 0.15 -1.05 0.00 0.00 178.15 177.73 3a15 h PHE 303 N 0.06 -0.28 -0.38 0.16 3.04 -0.89 -0.82 116.94 117.83 3a15 h PHE 303 Ca -0.01 0.01 -0.11 0.00 3.98 0.00 0.00 57.97 61.85 3a15 h PHE 303 Cb 1.09 0.14 -0.01 0.00 2.56 0.00 0.00 35.95 39.72 3a15 h PHE 303 CO 0.01 -0.17 -0.21 1.79 -2.02 0.00 0.00 178.31 177.71 3a15 h THR 304 N -0.16 1.27 -0.42 4.41 1.35 -1.13 -2.38 112.91 115.83 3a15 h THR 304 Ca 0.06 -1.30 0.07 0.00 -0.55 0.00 0.00 66.41 64.69 3a15 h THR 304 Cb 0.25 1.20 -0.06 0.00 -1.73 0.00 0.00 68.15 67.81 3a15 h THR 304 CO -0.16 0.43 0.06 0.74 -0.25 0.00 0.00 175.52 176.35 3a15 h THR 305 N 0.65 0.75 -0.26 6.82 2.02 -1.07 -1.34 112.91 120.47 3a15 h THR 305 Ca 0.09 -0.06 0.03 0.00 0.77 0.00 0.00 66.41 67.24 3a15 h THR 305 Cb 0.70 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 3a15 h THR 305 CO 0.05 0.03 0.07 0.15 0.37 0.00 0.00 175.52 176.20 3a15 h PHE 306 N 0.18 0.12 -0.90 3.16 3.57 -0.74 -1.41 116.94 120.93 3a15 h PHE 306 Ca 0.21 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.84 3a15 h PHE 306 Cb 0.27 -0.02 -0.07 0.00 2.79 0.00 0.00 35.95 38.92 3a15 h PHE 306 CO -0.23 0.05 0.58 0.74 -2.23 0.00 0.00 178.31 177.22 3a15 h PHE 307 N 0.18 0.91 -0.40 0.41 -1.00 -1.03 0.15 116.94 116.16 3a15 h PHE 307 Ca 0.12 0.03 -0.14 0.00 2.81 0.00 0.00 57.97 60.78 3a15 h PHE 307 Cb 0.10 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.36 3a15 h PHE 307 CO -0.14 0.38 -0.31 -0.09 -1.61 0.00 0.00 178.31 176.53 3a15 h ARG 308 N 0.81 0.89 0.00 1.51 2.43 -0.43 -3.29 114.38 116.30 3a15 h ARG 308 Ca 0.44 -0.42 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3a15 h ARG 308 Cb 0.55 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3a15 h ARG 308 CO -0.20 1.07 -0.95 1.33 -1.51 0.00 0.00 179.97 179.71 3a15 n VAL 309 N -4.08 0.05 -0.32 0.20 0.24 -0.61 -4.45 118.33 109.37 3a15 n VAL 309 Ca -0.01 -0.10 0.13 0.00 -2.04 0.00 0.00 64.34 62.31 3a15 n VAL 309 Cb 0.50 0.53 0.27 0.00 -1.47 0.00 0.00 33.84 33.67 3a15 n VAL 309 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3a15 h ALA 310 N 2.80 1.12 -0.39 2.33 0.00 -0.79 -1.33 119.26 123.01 3a15 h ALA 310 Ca 0.00 0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3a15 h ALA 310 Cb 0.60 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3a15 h ALA 310 CO 0.00 -0.53 0.22 0.00 0.00 0.00 0.00 179.25 178.94 3a15 h ALA 311 N 1.89 0.49 -0.02 0.00 0.00 -1.81 -3.05 119.26 116.76 3a15 h ALA 311 Ca 0.56 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.39 3a15 h ALA 311 Cb 1.12 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3a15 h ALA 311 CO -0.82 0.01 0.00 0.41 0.00 0.00 0.00 179.25 178.85 3a15 n GLY 312 N -1.02 -0.06 3.72 0.00 0.00 -0.58 -4.96 105.19 102.29 3a15 n GLY 312 Ca -0.00 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 3a15 n GLY 312 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3a15 s LEU 313 N -1.97 4.39 0.00 0.99 2.96 -0.74 -4.93 118.68 119.39 3a15 s LEU 313 Ca 0.38 2.29 0.00 0.00 -0.22 0.00 0.00 54.13 56.59 3a15 s LEU 313 Cb 0.21 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.30 3a15 s LEU 313 CO 0.33 -0.56 0.00 -1.54 -1.32 0.00 0.00 176.35 173.27 3a15 n SER 314 N 3.37 2.28 0.00 3.68 3.41 -1.26 -4.98 113.62 120.12 3a15 n SER 314 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 3a15 n SER 314 Cb 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 3a15 n SER 314 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3a15 n LYS 315 N -2.13 2.29 -1.97 4.33 5.02 -1.26 -5.04 118.16 119.40 3a15 n LYS 315 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 3a15 n LYS 315 Cb 0.30 -0.85 -0.02 0.00 -0.02 0.00 0.00 35.03 34.44 3a15 n LYS 315 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3a15 s LEU 316 N -2.59 4.38 -0.22 -0.35 2.96 -1.26 -4.61 118.68 116.98 3a15 s LEU 316 Ca 0.00 2.75 0.01 0.00 -0.22 0.00 0.00 54.13 56.67 3a15 s LEU 316 Cb 0.00 -3.63 0.04 0.00 0.50 0.00 0.00 46.19 43.09 3a15 s LEU 316 CO 0.00 -0.72 -0.15 -0.13 -1.32 0.00 0.00 176.35 174.03 3a15 s ARG 317 N -0.75 2.70 0.01 1.98 0.52 -0.52 -4.96 118.95 117.92 3a15 s ARG 317 Ca 0.58 -1.04 0.06 0.00 -0.52 0.00 0.00 55.73 54.81 3a15 s ARG 317 Cb -0.43 -2.74 -0.02 0.00 0.52 0.00 0.00 34.95 32.28 3a15 s ARG 317 CO 0.47 -0.37 -0.19 -0.51 0.02 0.00 0.00 175.30 174.72 3a15 s LEU 318 N 1.23 2.10 0.14 2.53 1.43 -1.26 -0.77 118.68 124.07 3a15 s LEU 318 Ca -0.01 -0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 52.42 3a15 s LEU 318 Cb -0.16 -0.94 0.07 0.00 0.03 0.00 0.00 46.19 45.18 3a15 s LEU 318 CO -0.09 0.19 0.80 -0.72 0.23 0.00 0.00 176.35 176.76 3a15 s TYR 319 N -0.62 -0.30 0.15 0.29 1.13 -1.10 -1.46 117.35 115.43 3a15 s TYR 319 Ca 0.07 0.04 -0.07 0.00 -1.41 0.00 0.00 57.07 55.70 3a15 s TYR 319 Cb -0.08 0.61 -0.02 0.00 -1.10 0.00 0.00 41.96 41.37 3a15 s TYR 319 CO 0.00 -0.84 0.22 -3.38 -2.51 0.00 0.00 175.55 169.05 3a15 s HIS 320 N -3.48 0.50 -0.02 -3.49 -3.43 0.03 -1.19 115.29 104.21 3a15 s HIS 320 Ca 0.07 -0.87 0.02 0.00 -0.80 0.00 0.00 55.06 53.48 3a15 s HIS 320 Cb -0.02 -0.16 0.00 0.00 -1.43 0.00 0.00 32.58 30.97 3a15 s HIS 320 CO -0.04 -0.66 -0.06 -1.83 -2.00 0.00 0.00 174.74 170.15 3a15 s GLU 321 N -3.98 0.60 -0.01 -0.38 -1.05 0.28 -1.02 118.70 113.13 3a15 s GLU 321 Ca 0.18 -0.18 0.02 0.00 -0.15 0.00 0.00 54.97 54.84 3a15 s GLU 321 Cb 0.04 -0.59 -0.00 0.00 -0.44 0.00 0.00 34.13 33.14 3a15 s GLU 321 CO -0.00 0.07 -0.08 0.08 0.95 0.00 0.00 175.26 176.28 3a15 s VAL 322 N 0.18 0.62 0.04 1.83 1.01 -0.60 -0.69 120.40 122.80 3a15 s VAL 322 Ca -0.02 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.67 3a15 s VAL 322 Cb -0.06 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 3a15 s VAL 322 CO -0.00 0.19 -0.08 -0.44 0.00 0.00 0.00 175.10 174.77 3a15 s SER 323 N -0.04 0.87 0.22 3.32 0.01 -0.18 -1.19 113.70 116.71 3a15 s SER 323 Ca 0.01 -0.55 0.11 0.00 1.31 0.00 0.00 55.95 56.83 3a15 s SER 323 Cb -0.05 0.03 -0.05 0.00 0.21 0.00 0.00 66.02 66.17 3a15 s SER 323 CO -0.00 -0.20 -0.20 0.68 0.41 0.00 0.00 173.24 173.93 3a15 s VAL 324 N -1.36 2.24 -0.01 3.43 -7.23 -0.09 -0.38 120.40 117.00 3a15 s VAL 324 Ca -0.10 -2.18 -0.06 0.00 -1.81 0.00 0.00 61.98 57.84 3a15 s VAL 324 Cb -0.10 -2.13 0.00 0.00 0.56 0.00 0.00 36.38 34.71 3a15 s VAL 324 CO 0.00 -0.31 0.11 -0.36 -0.31 0.00 0.00 175.10 174.23 3a15 s PHE 325 N -2.20 0.04 0.65 2.82 0.08 -1.10 -4.53 117.98 113.72 3a15 s PHE 325 Ca 0.24 -0.09 -0.17 0.00 0.12 0.00 0.00 56.93 57.03 3a15 s PHE 325 Cb -0.06 -0.05 -0.01 0.00 -0.57 0.00 0.00 43.02 42.34 3a15 s PHE 325 CO 0.11 -0.23 1.16 -0.51 -0.10 0.00 0.00 175.22 175.65 3a15 s ASP 326 N -1.09 4.97 0.24 1.36 1.01 -1.26 -0.31 116.67 121.59 3a15 s ASP 326 Ca -0.12 2.22 -0.09 0.00 0.71 0.00 0.00 52.55 55.27 3a15 s ASP 326 Cb -0.07 -2.58 0.38 0.00 1.01 0.00 0.00 42.92 41.67 3a15 s ASP 326 CO 0.01 -1.73 1.61 0.00 0.21 0.00 0.00 175.17 175.27 3a15 h ALA 327 N 0.32 0.63 0.00 5.23 0.00 -1.86 -1.59 119.26 121.99 3a15 h ALA 327 Ca -0.48 0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3a15 h ALA 327 Cb 1.27 0.52 0.00 0.00 0.00 0.00 0.00 17.79 19.59 3a15 h ALA 327 CO 0.54 -0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.36 3a15 n ALA 328 N -3.14 2.03 -0.57 0.00 0.00 -1.26 -3.01 120.51 114.56 3a15 n ALA 328 Ca 0.12 -0.08 -0.05 0.00 0.00 0.00 0.00 53.44 53.43 3a15 n ALA 328 Cb 0.44 -1.36 0.24 0.00 0.00 0.00 0.00 19.45 18.76 3a15 n ALA 328 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3a15 n ASP 329 N -1.48 4.19 -3.99 0.00 8.00 -0.60 -4.84 116.55 117.82 3a15 n ASP 329 Ca 0.06 -2.94 -0.17 0.00 0.71 0.00 0.00 54.79 52.45 3a15 n ASP 329 Cb 0.25 -0.70 -0.14 0.00 -0.02 0.00 0.00 41.12 40.52 3a15 n ASP 329 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3a15 s GLN 330 N -2.43 0.55 -0.06 -1.24 -0.21 -1.16 -0.74 119.66 114.37 3a15 s GLN 330 Ca 0.43 -0.29 -0.01 0.00 0.02 0.00 0.00 55.36 55.51 3a15 s GLN 330 Cb 0.34 -0.52 0.03 0.00 1.00 0.00 0.00 33.01 33.86 3a15 s GLN 330 CO 0.11 0.14 0.01 -1.17 -2.12 0.00 0.00 175.29 172.26 3a15 s LEU 331 N -0.28 0.52 -0.26 2.90 2.96 0.16 -4.64 118.68 120.04 3a15 s LEU 331 Ca 0.02 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.90 3a15 s LEU 331 Cb -0.03 -0.36 0.07 0.00 0.50 0.00 0.00 46.19 46.37 3a15 s LEU 331 CO -0.00 -0.20 -0.04 -0.31 -1.32 0.00 0.00 176.35 174.48 3a15 s TYR 332 N 1.95 2.77 -0.06 5.38 2.02 -1.20 -0.70 117.35 127.52 3a15 s TYR 332 Ca 0.04 -2.10 0.04 0.00 -0.37 0.00 0.00 57.07 54.68 3a15 s TYR 332 Cb -0.12 -1.90 0.00 0.00 -0.40 0.00 0.00 41.96 39.54 3a15 s TYR 332 CO -0.04 -0.84 -0.17 -2.00 -1.57 0.00 0.00 175.55 170.92 3a15 s GLU 333 N 1.26 1.98 -0.02 -0.62 2.12 -0.07 -0.21 118.70 123.15 3a15 s GLU 333 Ca -0.02 -0.62 0.03 0.00 0.36 0.00 0.00 54.97 54.72 3a15 s GLU 333 Cb -0.19 -1.66 -0.00 0.00 0.26 0.00 0.00 34.13 32.54 3a15 s GLU 333 CO -0.08 0.20 -0.11 0.71 -0.54 0.00 0.00 175.26 175.44 3a15 s TYR 334 N 0.20 1.11 -0.16 5.30 1.51 0.21 -0.68 117.35 124.84 3a15 s TYR 334 Ca -0.08 -0.27 0.00 0.00 -1.01 0.00 0.00 57.07 55.72 3a15 s TYR 334 Cb -0.13 -0.76 0.03 0.00 -0.11 0.00 0.00 41.96 40.98 3a15 s TYR 334 CO 0.04 -0.09 -0.13 0.42 -1.11 0.00 0.00 175.55 174.68 3a15 s ILE 335 N 0.02 1.61 -1.62 2.71 1.01 0.16 -0.69 121.20 124.40 3a15 s ILE 335 Ca -0.01 -0.74 -0.11 0.00 0.00 0.00 0.00 60.65 59.80 3a15 s ILE 335 Cb -0.08 -1.55 0.10 0.00 0.01 0.00 0.00 42.46 40.94 3a15 s ILE 335 CO 0.00 0.39 0.51 0.59 0.00 0.00 0.00 174.94 176.43 3a15 n ASN 336 N 4.74 -1.43 -4.91 3.58 3.02 -0.15 -0.73 115.26 119.38 3a15 n ASN 336 Ca -0.16 -1.10 -0.32 0.00 -0.03 0.00 0.00 54.58 52.97 3a15 n ASN 336 Cb 0.49 -2.45 -0.04 0.00 -0.61 0.00 0.00 39.78 37.17 3a15 n ASN 336 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a15 s HIS 338 N -1.43 2.28 -0.79 0.00 -3.43 -1.26 -4.76 115.29 105.90 3a15 s HIS 338 Ca 0.32 1.51 0.01 0.00 -0.80 0.00 0.00 55.06 56.11 3a15 s HIS 338 Cb -0.13 -3.53 0.07 0.00 -1.43 0.00 0.00 32.58 27.56 3a15 s HIS 338 CO 0.24 -2.43 0.97 -2.30 -2.00 0.00 0.00 174.74 169.22 3a15 n PRO 339 N -1.79 0.01 -0.12 -0.38 -0.02 -1.26 -1.51 135.00 129.92 3a15 n PRO 339 Ca 0.14 0.44 0.11 0.00 -2.02 0.00 0.00 63.50 62.17 3a15 n PRO 339 Cb 0.49 -1.61 0.17 0.00 -0.02 0.00 0.00 33.50 32.53 3a15 n PRO 339 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3a15 n GLY 340 N -1.41 1.41 3.68 -1.23 0.00 -1.26 -3.09 105.19 103.29 3a15 n GLY 340 Ca -0.00 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 3a15 n GLY 340 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a15 s THR 341 N -1.58 3.97 0.00 2.61 2.01 -0.57 -4.36 115.64 117.72 3a15 s THR 341 Ca 0.33 1.31 0.00 0.00 0.31 0.00 0.00 61.69 63.64 3a15 s THR 341 Cb 0.21 -3.84 0.00 0.00 0.01 0.00 0.00 72.50 68.87 3a15 s THR 341 CO 0.29 -0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.82 3a15 n GLY 342 N 3.55 3.18 0.00 4.40 0.00 -1.26 -1.26 105.19 113.79 3a15 n GLY 342 Ca 0.12 0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.36 3a15 n GLY 342 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3a15 n MET 343 N 14.00 0.31 -0.12 1.61 2.81 -1.26 -3.39 117.12 131.07 3a15 n MET 343 Ca 0.00 0.03 -0.01 0.00 -1.81 0.00 0.00 57.70 55.92 3a15 n MET 343 Cb 0.00 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.26 3a15 n MET 343 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3a15 h LEU 344 N 0.00 0.73 0.13 4.03 3.38 -1.46 -2.86 115.31 119.26 3a15 h LEU 344 Ca 0.00 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 3a15 h LEU 344 Cb 0.30 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3a15 h LEU 344 CO 0.00 0.65 -0.08 -0.09 0.09 0.00 0.00 178.44 179.01 3a15 h ARG 345 N 0.80 -0.19 -0.00 1.13 2.43 -1.55 -3.24 114.38 113.75 3a15 h ARG 345 Ca 0.19 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 3a15 h ARG 345 Cb 0.14 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 3a15 h ARG 345 CO -0.02 -0.13 -0.82 -0.25 -1.51 0.00 0.00 179.97 177.25 3a15 n ASP 346 N -5.18 1.05 -4.74 -3.80 8.00 -1.24 -4.95 116.55 105.69 3a15 n ASP 346 Ca -0.08 -0.93 -0.42 0.00 0.71 0.00 0.00 54.79 54.07 3a15 n ASP 346 Cb 0.11 0.77 -0.02 0.00 -0.02 0.00 0.00 41.12 41.96 3a15 n ASP 346 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3a15 s ALA 347 N -2.91 3.69 -0.02 2.24 0.00 -1.08 -4.89 121.76 118.79 3a15 s ALA 347 Ca 0.10 1.37 -0.30 0.00 0.00 0.00 0.00 51.96 53.14 3a15 s ALA 347 Cb 0.17 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 3a15 s ALA 347 CO 0.79 -0.78 1.26 0.14 0.00 0.00 0.00 175.76 177.16 3a15 s VAL 348 N 0.39 4.05 0.72 0.00 -7.23 -0.10 -4.76 120.40 113.46 3a15 s VAL 348 Ca 0.63 1.41 -0.12 0.00 -1.81 0.00 0.00 61.98 62.10 3a15 s VAL 348 Cb -0.43 -3.91 0.02 0.00 0.56 0.00 0.00 36.38 32.62 3a15 s VAL 348 CO 0.40 0.02 1.08 0.42 -0.31 0.00 0.00 175.10 176.71 3a15 s THR 349 N 2.04 3.61 0.33 5.32 -4.23 -1.24 -1.19 115.64 120.28 3a15 s THR 349 Ca 0.59 0.57 0.07 0.00 -1.18 0.00 0.00 61.69 61.73 3a15 s THR 349 Cb -0.28 -3.15 0.40 0.00 1.34 0.00 0.00 72.50 70.81 3a15 s THR 349 CO 0.25 -0.64 1.57 0.40 -0.54 0.00 0.00 174.62 175.66 3a15 h ILE 350 N -0.72 0.02 -2.91 2.99 1.08 -1.86 -2.07 117.51 114.04 3a15 h ILE 350 Ca -0.44 -0.00 -0.79 0.00 -0.39 0.00 0.00 64.86 63.24 3a15 h ILE 350 Cb 1.22 0.00 -0.25 0.00 -3.07 0.00 0.00 36.82 34.73 3a15 h ILE 350 CO 0.54 0.00 0.87 0.00 -0.69 0.00 0.00 178.15 178.87 3a15 n ALA 351 N -2.89 4.59 0.00 1.87 0.00 -1.26 -5.12 120.51 117.70 3a15 n ALA 351 Ca 0.27 -4.61 0.00 0.00 0.00 0.00 0.00 53.44 49.11 3a15 n ALA 351 Cb 0.91 -2.58 0.00 0.00 0.00 0.00 0.00 19.45 17.78 3a15 n ALA 351 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59