#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdr n LYS 2 N 0.00 1.91 -3.82 0.03 0.00 -1.26 -4.98 118.16 110.05 2wdr n LYS 2 Ca 0.00 -2.85 -0.13 0.00 0.00 0.00 0.00 58.31 55.33 2wdr n LYS 2 Cb 0.00 -1.67 -0.14 0.00 0.00 0.00 0.00 35.03 33.21 2wdr n LYS 2 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2wdr s LEU 3 N -2.97 1.46 0.35 3.14 2.96 -1.26 -5.12 118.68 117.23 2wdr s LEU 3 Ca 0.38 0.11 -0.28 0.00 -0.22 0.00 0.00 54.13 54.12 2wdr s LEU 3 Cb 0.33 0.12 -0.12 0.00 0.50 0.00 0.00 46.19 47.02 2wdr s LEU 3 CO 0.03 -0.07 1.32 -2.65 -1.32 0.00 0.00 176.35 173.67 2wdr n PRO 4 N 3.53 2.21 -4.14 0.98 -0.02 -1.26 -4.80 135.00 131.49 2wdr n PRO 4 Ca -0.18 0.78 -0.34 0.00 -2.02 0.00 0.00 63.50 61.73 2wdr n PRO 4 Cb 0.56 -2.38 -0.14 0.00 -0.02 0.00 0.00 33.50 31.52 2wdr n PRO 4 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wdr s VAL 5 N -1.08 3.18 -0.28 -1.45 1.01 -1.26 -1.53 120.40 118.99 2wdr s VAL 5 Ca 0.55 -0.57 -0.04 0.00 0.00 0.00 0.00 61.98 61.92 2wdr s VAL 5 Cb -0.56 -2.41 0.03 0.00 0.00 0.00 0.00 36.38 33.44 2wdr s VAL 5 CO 0.62 0.46 0.01 -0.13 0.00 0.00 0.00 175.10 176.07 2wdr s ARG 6 N 1.16 2.83 -0.12 2.72 0.52 -0.05 -4.98 118.95 121.03 2wdr s ARG 6 Ca 0.02 -1.00 -0.06 0.00 -0.52 0.00 0.00 55.73 54.17 2wdr s ARG 6 Cb -0.14 -3.19 -0.04 0.00 0.52 0.00 0.00 34.95 32.10 2wdr s ARG 6 CO -0.02 -0.48 0.09 -2.00 0.02 0.00 0.00 175.30 172.91 2wdr s GLU 7 N 1.38 3.43 0.15 3.54 2.12 -1.26 -0.39 118.70 127.66 2wdr s GLU 7 Ca -0.00 -0.25 -0.07 0.00 0.36 0.00 0.00 54.97 55.01 2wdr s GLU 7 Cb -0.18 -3.09 -0.02 0.00 0.26 0.00 0.00 34.13 31.11 2wdr s GLU 7 CO -0.01 0.66 0.22 -0.06 -0.54 0.00 0.00 175.26 175.52 2wdr s PHE 8 N -0.70 0.50 -0.02 5.30 0.08 0.41 -4.93 117.98 118.62 2wdr s PHE 8 Ca 0.12 -0.87 -0.25 0.00 0.12 0.00 0.00 56.93 56.05 2wdr s PHE 8 Cb -0.12 -0.17 -0.18 0.00 -0.57 0.00 0.00 43.02 41.98 2wdr s PHE 8 CO 0.03 -0.65 1.20 -0.44 -0.10 0.00 0.00 175.22 175.25 2wdr h ASP 9 N 2.65 -0.14 -4.31 1.36 3.32 -1.83 -3.25 116.42 114.22 2wdr h ASP 9 Ca -0.33 -0.35 -0.56 0.00 0.02 0.00 0.00 57.03 55.81 2wdr h ASP 9 Cb 1.22 0.04 -0.27 0.00 0.22 0.00 0.00 39.33 40.54 2wdr h ASP 9 CO 0.52 0.31 -0.84 0.00 -1.72 0.00 0.00 179.24 177.51 2wdr s ALA 10 N -4.37 1.64 -0.18 3.45 0.00 -0.86 -1.85 121.76 119.60 2wdr s ALA 10 Ca -0.15 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 50.85 2wdr s ALA 10 Cb 0.02 -0.34 0.01 0.00 0.00 0.00 0.00 23.12 22.81 2wdr s ALA 10 CO 0.60 0.37 -0.18 0.08 0.00 0.00 0.00 175.76 176.63 2wdr s VAL 11 N -0.71 2.27 -0.40 0.00 1.01 -0.64 -1.34 120.40 120.60 2wdr s VAL 11 Ca 0.07 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 2wdr s VAL 11 Cb -0.08 -1.96 0.04 0.00 0.00 0.00 0.00 36.38 34.38 2wdr s VAL 11 CO 0.01 0.53 0.25 -0.69 0.00 0.00 0.00 175.10 175.19 2wdr s VAL 12 N 1.19 4.64 -0.74 2.92 1.01 0.17 -1.41 120.40 128.17 2wdr s VAL 12 Ca 0.02 -0.98 -0.24 0.00 0.00 0.00 0.00 61.98 60.78 2wdr s VAL 12 Cb -0.14 -3.66 0.06 0.00 0.00 0.00 0.00 36.38 32.64 2wdr s VAL 12 CO -0.09 -0.34 1.14 -0.63 0.00 0.00 0.00 175.10 175.18 2wdr s ILE 13 N 1.55 4.07 0.00 2.22 1.01 -0.38 -0.78 121.20 128.89 2wdr s ILE 13 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.53 2wdr s ILE 13 Cb -0.21 -4.82 0.00 0.00 0.01 0.00 0.00 42.46 37.45 2wdr s ILE 13 CO 0.06 -1.66 0.00 0.61 0.00 0.00 0.00 174.94 173.95 2wdr n GLY 14 N 5.48 3.96 2.30 6.18 0.00 0.58 -0.77 105.19 122.91 2wdr n GLY 14 Ca 0.03 -1.27 -0.16 0.00 0.00 0.00 0.00 46.02 44.62 2wdr n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdr n ALA 15 N -0.19 4.20 -1.59 4.61 0.00 -1.24 -4.33 120.51 121.97 2wdr n ALA 15 Ca 0.00 -3.44 0.00 0.00 0.00 0.00 0.00 53.44 50.00 2wdr n ALA 15 Cb 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 18.94 2wdr n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdr n GLY 16 N -0.67 1.06 0.31 0.00 0.00 -1.26 -4.58 105.19 100.05 2wdr n GLY 16 Ca 0.31 -1.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.41 2wdr n GLY 16 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wdr h GLY 17 N 0.00 -1.28 0.77 -0.02 0.00 -1.95 -0.67 103.07 99.92 2wdr h GLY 17 Ca 0.00 0.72 -0.00 0.00 0.00 0.00 0.00 47.33 48.04 2wdr h GLY 17 CO 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 176.54 176.22 2wdr h ALA 18 N -0.58 0.02 -0.66 3.60 0.00 -1.91 -2.35 119.26 117.38 2wdr h ALA 18 Ca 0.03 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.88 2wdr h ALA 18 Cb 0.43 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2wdr h ALA 18 CO -0.34 -0.36 0.37 0.78 0.00 0.00 0.00 179.25 179.70 2wdr h GLY 19 N -0.21 0.97 1.73 0.00 0.00 -1.74 -0.98 103.07 102.83 2wdr h GLY 19 Ca 0.00 -0.26 -0.11 0.00 0.00 0.00 0.00 47.33 46.96 2wdr h GLY 19 CO 0.00 0.17 -0.40 -0.33 0.00 0.00 0.00 176.54 175.98 2wdr h MET 20 N 0.70 0.30 -0.27 4.80 2.86 -1.04 0.75 114.93 123.02 2wdr h MET 20 Ca 0.29 -0.14 -0.11 0.00 -2.06 0.00 0.00 59.70 57.68 2wdr h MET 20 Cb 0.16 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 2wdr h MET 20 CO -0.17 0.66 -0.28 -0.09 1.06 0.00 0.00 176.91 178.09 2wdr h ARG 21 N 0.25 0.67 -0.39 1.72 9.65 -1.15 -1.65 114.38 123.47 2wdr h ARG 21 Ca 0.02 -0.35 -0.05 0.00 -1.10 0.00 0.00 59.98 58.50 2wdr h ARG 21 Cb 0.82 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.40 2wdr h ARG 21 CO 0.07 0.96 0.05 0.00 2.80 0.00 0.00 179.97 183.85 2wdr h ALA 22 N 0.69 0.53 0.04 2.80 0.00 -1.04 -0.71 119.26 121.56 2wdr h ALA 22 Ca 0.04 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.75 2wdr h ALA 22 Cb 0.84 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2wdr h ALA 22 CO 0.07 0.25 -0.16 0.00 0.00 0.00 0.00 179.25 179.41 2wdr h ALA 23 N 0.91 -0.22 -0.61 0.00 0.00 -0.84 0.17 119.26 118.68 2wdr h ALA 23 Ca 0.12 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.12 2wdr h ALA 23 Cb 0.39 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 2wdr h ALA 23 CO 0.01 -0.66 0.21 1.25 0.00 0.00 0.00 179.25 180.06 2wdr h LEU 24 N -0.28 0.19 0.33 0.00 5.85 -1.06 -1.76 115.31 118.57 2wdr h LEU 24 Ca 0.04 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 2wdr h LEU 24 Cb 0.33 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2wdr h LEU 24 CO -0.13 0.11 -0.16 -0.61 -0.34 0.00 0.00 178.44 177.31 2wdr h GLN 25 N 0.38 -0.43 -0.94 1.25 5.75 -0.70 -2.57 115.11 117.85 2wdr h GLN 25 Ca 0.31 0.03 0.25 0.00 -0.15 0.00 0.00 58.65 59.09 2wdr h GLN 25 Cb 0.41 0.10 -0.13 0.00 1.07 0.00 0.00 27.48 28.92 2wdr h GLN 25 CO -0.33 -0.10 0.46 0.82 -2.65 0.00 0.00 178.83 177.03 2wdr h ILE 26 N -0.85 0.43 0.14 2.39 2.04 -0.78 -2.20 117.51 118.68 2wdr h ILE 26 Ca -0.05 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2wdr h ILE 26 Cb 0.53 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2wdr h ILE 26 CO 0.07 0.07 -0.07 -1.28 0.00 0.00 0.00 178.15 176.95 2wdr h SER 27 N 0.40 -0.16 0.02 1.72 0.87 -1.29 -2.28 113.55 112.82 2wdr h SER 27 Ca 0.61 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 2wdr h SER 27 Cb 1.23 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 2wdr h SER 27 CO -0.55 0.25 0.00 0.00 -0.53 0.00 0.00 176.83 176.00 2wdr n GLN 28 N -4.99 0.03 -0.44 2.24 6.02 -0.93 -1.42 117.38 117.89 2wdr n GLN 28 Ca -0.09 0.52 0.06 0.00 -0.01 0.00 0.00 57.00 57.49 2wdr n GLN 28 Cb 0.24 -1.60 0.25 0.00 1.02 0.00 0.00 30.24 30.15 2wdr n GLN 28 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2wdr n SER 29 N -1.66 3.46 0.00 1.08 7.64 -0.86 -4.91 113.62 118.37 2wdr n SER 29 Ca -0.00 -2.34 0.00 0.00 1.01 0.00 0.00 58.87 57.54 2wdr n SER 29 Cb 0.01 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.72 2wdr n SER 29 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wdr n GLY 30 N 0.80 3.02 3.86 0.23 0.00 -0.50 -5.04 105.19 107.55 2wdr n GLY 30 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2wdr n GLY 30 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wdr s GLN 31 N -0.13 3.83 0.59 1.61 -0.21 -1.20 -5.03 119.66 119.11 2wdr s GLN 31 Ca 0.00 0.80 -0.15 0.00 0.02 0.00 0.00 55.36 56.03 2wdr s GLN 31 Cb 0.00 -2.18 -0.04 0.00 1.00 0.00 0.00 33.01 31.79 2wdr s GLN 31 CO 0.00 -0.29 1.04 0.95 -2.12 0.00 0.00 175.29 174.87 2wdr s THR 32 N -2.70 4.05 -0.28 -0.19 -4.23 -1.26 -4.37 115.64 106.65 2wdr s THR 32 Ca 0.56 0.93 -0.17 0.00 -1.18 0.00 0.00 61.69 61.83 2wdr s THR 32 Cb -0.10 -3.49 0.09 0.00 1.34 0.00 0.00 72.50 70.34 2wdr s THR 32 CO 0.37 -0.62 0.74 0.00 -0.54 0.00 0.00 174.62 174.57 2wdr s ALA 34 N 1.51 2.99 -0.44 0.00 0.00 -0.45 -4.10 121.76 121.28 2wdr s ALA 34 Ca -0.09 -1.02 -0.15 0.00 0.00 0.00 0.00 51.96 50.70 2wdr s ALA 34 Cb -0.05 -1.76 0.05 0.00 0.00 0.00 0.00 23.12 21.36 2wdr s ALA 34 CO -0.18 -0.20 0.34 -1.17 0.00 0.00 0.00 175.76 174.55 2wdr s LEU 35 N 1.08 5.32 0.19 0.00 2.96 0.27 0.42 118.68 128.92 2wdr s LEU 35 Ca 0.02 -1.13 -0.10 0.00 -0.22 0.00 0.00 54.13 52.70 2wdr s LEU 35 Cb -0.14 -2.15 -0.07 0.00 0.50 0.00 0.00 46.19 44.32 2wdr s LEU 35 CO 0.01 -0.54 0.52 -0.76 -1.32 0.00 0.00 176.35 174.26 2wdr s LEU 36 N 1.64 4.23 -0.28 -0.68 1.02 0.04 -0.04 118.68 124.61 2wdr s LEU 36 Ca 0.04 0.90 -0.18 0.00 0.02 0.00 0.00 54.13 54.91 2wdr s LEU 36 Cb -0.22 -3.49 0.08 0.00 0.02 0.00 0.00 46.19 42.58 2wdr s LEU 36 CO 0.08 -0.00 0.71 -0.55 0.02 0.00 0.00 176.35 176.61 2wdr s SER 37 N -2.19 -0.89 0.00 2.29 0.15 -1.07 -0.31 113.70 111.69 2wdr s SER 37 Ca 0.43 1.48 0.28 0.00 0.70 0.00 0.00 55.95 58.84 2wdr s SER 37 Cb -0.12 1.40 1.31 0.00 -1.71 0.00 0.00 66.02 66.90 2wdr s SER 37 CO 0.21 -0.24 1.93 2.29 1.20 0.00 0.00 173.24 178.63 2wdr n LYS 38 N 3.91 0.22 -4.40 5.44 2.85 -1.17 0.68 118.16 125.69 2wdr n LYS 38 Ca -0.19 0.02 -0.20 0.00 -1.05 0.00 0.00 58.31 56.90 2wdr n LYS 38 Cb 0.58 -1.50 -0.10 0.00 -0.65 0.00 0.00 35.03 33.36 2wdr n LYS 38 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 2wdr s VAL 39 N -2.76 0.99 0.23 0.58 -7.23 -1.26 -4.51 120.40 106.42 2wdr s VAL 39 Ca 0.21 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 58.06 2wdr s VAL 39 Cb 0.19 -2.71 -0.12 0.00 0.56 0.00 0.00 36.38 34.30 2wdr s VAL 39 CO 0.46 -0.03 1.70 0.33 -0.31 0.00 0.00 175.10 177.25 2wdr n PHE 40 N -0.59 2.78 -0.29 2.82 7.35 -1.26 -4.02 117.46 124.24 2wdr n PHE 40 Ca -0.02 0.08 0.18 0.00 -0.76 0.00 0.00 57.45 56.93 2wdr n PHE 40 Cb 0.66 -2.66 0.34 0.00 0.35 0.00 0.00 39.48 38.17 2wdr n PHE 40 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2wdr n PRO 41 N 3.59 -0.06 0.00 -7.13 -0.02 -1.26 0.37 135.00 130.48 2wdr n PRO 41 Ca 0.14 1.26 0.09 0.00 -2.02 0.00 0.00 63.50 62.98 2wdr n PRO 41 Cb 0.35 -2.08 0.54 0.00 -0.02 0.00 0.00 33.50 32.29 2wdr n PRO 41 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2wdr n THR 42 N -5.15 0.00 0.92 3.45 -2.24 -1.26 -2.58 114.28 107.41 2wdr n THR 42 Ca 0.24 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.15 2wdr n THR 42 Cb 0.81 -0.29 0.18 0.00 -2.10 0.00 0.00 70.33 68.93 2wdr n THR 42 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2wdr n ARG 43 N -0.79 2.27 -0.90 -0.78 5.12 0.16 -4.78 116.66 116.97 2wdr n ARG 43 Ca 0.14 -1.87 -0.31 0.00 -1.93 0.00 0.00 57.85 53.88 2wdr n ARG 43 Cb 0.06 -1.47 0.14 0.00 -1.16 0.00 0.00 32.46 30.03 2wdr n ARG 43 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2wdr s SER 44 N -1.88 3.43 0.53 0.55 0.01 -1.07 -4.86 113.70 110.41 2wdr s SER 44 Ca 0.32 2.11 0.20 0.00 1.31 0.00 0.00 55.95 59.88 2wdr s SER 44 Cb 0.21 -2.56 1.33 0.00 0.21 0.00 0.00 66.02 65.21 2wdr s SER 44 CO 0.31 -2.76 2.09 -0.74 0.41 0.00 0.00 173.24 172.55 2wdr h HIS 45 N -1.56 0.00 -1.01 2.43 2.76 -1.94 -1.78 115.15 114.06 2wdr h HIS 45 Ca -0.43 0.00 0.29 0.00 -2.20 0.00 0.00 60.37 58.03 2wdr h HIS 45 Cb 1.26 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.18 2wdr h HIS 45 CO 0.52 0.00 0.74 1.15 -1.30 0.00 0.00 177.93 179.04 2wdr h THR 46 N 0.00 0.46 0.00 6.26 2.02 -1.92 0.30 112.91 120.03 2wdr h THR 46 Ca 0.10 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 2wdr h THR 46 Cb 0.38 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2wdr h THR 46 CO -0.00 0.00 -0.05 1.62 0.37 0.00 0.00 175.52 177.46 2wdr h VAL 47 N 0.00 0.82 -0.01 3.16 3.04 -1.50 -2.22 116.25 119.54 2wdr h VAL 47 Ca 0.48 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.98 2wdr h VAL 47 Cb 1.96 1.11 0.00 0.00 -2.01 0.00 0.00 31.29 32.35 2wdr h VAL 47 CO -0.01 0.05 -0.09 -1.20 -1.01 0.00 0.00 177.57 175.31 2wdr n SER 48 N -4.17 0.96 -4.77 3.17 7.64 0.10 -1.77 113.62 114.80 2wdr n SER 48 Ca -0.03 -1.07 -0.40 0.00 1.01 0.00 0.00 58.87 58.39 2wdr n SER 48 Cb 0.14 0.02 -0.00 0.00 -1.01 0.00 0.00 64.21 63.35 2wdr n SER 48 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wdr s ALA 49 N -2.24 3.27 0.06 -0.43 0.00 -0.84 -4.92 121.76 116.67 2wdr s ALA 49 Ca 0.33 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.55 2wdr s ALA 49 Cb 0.20 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.83 2wdr s ALA 49 CO 0.42 -0.84 0.00 1.04 0.00 0.00 0.00 175.76 176.38 2wdr n GLN 50 N 0.14 0.00 -0.41 0.00 6.02 -1.26 -0.84 117.38 121.03 2wdr n GLN 50 Ca 0.04 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.93 2wdr n GLN 50 Cb 0.43 -0.25 -0.08 0.00 1.02 0.00 0.00 30.24 31.37 2wdr n GLN 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wdr n GLY 51 N 3.37 -2.46 0.00 1.08 0.00 -1.26 -2.78 105.19 103.14 2wdr n GLY 51 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 46.02 47.17 2wdr n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdr n GLY 52 N -1.28 0.92 3.32 -0.02 0.00 -1.26 -4.63 105.19 102.23 2wdr n GLY 52 Ca 0.03 -1.87 -0.34 0.00 0.00 0.00 0.00 46.02 43.84 2wdr n GLY 52 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wdr s ILE 53 N -2.58 3.15 -0.12 -0.61 1.01 0.13 -4.31 121.20 117.88 2wdr s ILE 53 Ca 0.00 -0.59 -0.28 0.00 0.00 0.00 0.00 60.65 59.78 2wdr s ILE 53 Cb 0.00 -2.39 -0.01 0.00 0.01 0.00 0.00 42.46 40.07 2wdr s ILE 53 CO 0.00 0.47 0.94 -0.89 0.00 0.00 0.00 174.94 175.47 2wdr s THR 54 N 1.06 4.83 -0.28 2.92 2.01 -0.51 -0.15 115.64 125.51 2wdr s THR 54 Ca 0.00 1.91 -0.22 0.00 0.31 0.00 0.00 61.69 63.69 2wdr s THR 54 Cb -0.15 -4.25 0.13 0.00 0.01 0.00 0.00 72.50 68.24 2wdr s THR 54 CO -0.01 0.03 0.99 0.54 -0.69 0.00 0.00 174.62 175.48 2wdr s VAL 55 N 1.95 0.00 -1.11 3.82 0.11 -0.73 -4.75 120.40 119.69 2wdr s VAL 55 Ca 0.45 0.00 -0.20 0.00 -2.93 0.00 0.00 61.98 59.30 2wdr s VAL 55 Cb -0.18 -1.00 -0.06 0.00 -1.53 0.00 0.00 36.38 33.61 2wdr s VAL 55 CO 0.17 0.00 1.94 0.00 -3.33 0.00 0.00 175.10 173.88 2wdr n ALA 56 N 2.78 3.23 0.06 1.54 0.00 -1.26 -4.54 120.51 122.31 2wdr n ALA 56 Ca -0.15 -3.41 -0.06 0.00 0.00 0.00 0.00 53.44 49.82 2wdr n ALA 56 Cb 0.57 -3.57 -0.11 0.00 0.00 0.00 0.00 19.45 16.34 2wdr n ALA 56 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2wdr h LEU 57 N 14.25 0.00 1.53 0.00 3.38 -1.96 -3.44 115.31 129.07 2wdr h LEU 57 Ca 0.39 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.11 2wdr h LEU 57 Cb 0.79 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 2wdr h LEU 57 CO 1.62 0.94 -0.30 0.61 0.09 0.00 0.00 178.44 181.41 2wdr n GLY 58 N 1.36 0.11 0.14 0.83 0.00 -1.26 -4.92 105.19 101.46 2wdr n GLY 58 Ca -0.02 -0.39 -0.22 0.00 0.00 0.00 0.00 46.02 45.39 2wdr n GLY 58 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2wdr h ASN 59 N 0.00 0.70 0.59 1.61 2.35 -1.92 -3.38 115.58 115.53 2wdr h ASN 59 Ca -0.28 -0.88 -0.26 0.00 -0.55 0.00 0.00 56.30 54.32 2wdr h ASN 59 Cb 1.14 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.29 2wdr h ASN 59 CO 0.34 1.53 -1.17 0.74 -1.65 0.00 0.00 177.43 177.21 2wdr h THR 60 N -0.01 1.49 -3.20 2.81 2.02 -1.86 -3.46 112.91 110.69 2wdr h THR 60 Ca -0.18 -2.95 -0.03 0.00 0.77 0.00 0.00 66.41 64.02 2wdr h THR 60 Cb 1.83 2.84 -0.12 0.00 -1.74 0.00 0.00 68.15 70.96 2wdr h THR 60 CO 0.21 0.86 0.07 -1.38 0.37 0.00 0.00 175.52 175.65 2wdr s HIS 61 N -2.78 -0.34 0.18 3.16 -3.43 -1.26 -5.08 115.29 105.74 2wdr s HIS 61 Ca -0.04 0.06 -0.32 0.00 -0.80 0.00 0.00 55.06 53.96 2wdr s HIS 61 Cb 0.07 0.42 -0.11 0.00 -1.43 0.00 0.00 32.58 31.54 2wdr s HIS 61 CO 0.88 -0.81 1.64 -2.00 -2.00 0.00 0.00 174.74 172.45 2wdr s GLU 62 N -3.79 4.17 0.18 -0.38 2.12 -1.26 -4.37 118.70 115.36 2wdr s GLU 62 Ca 0.03 2.47 0.01 0.00 0.36 0.00 0.00 54.97 57.85 2wdr s GLU 62 Cb -0.00 -3.14 -0.00 0.00 0.26 0.00 0.00 34.13 31.25 2wdr s GLU 62 CO -0.11 -0.68 0.04 -3.47 -0.54 0.00 0.00 175.26 170.50 2wdr n ASP 63 N 4.06 1.63 -3.64 -1.70 -0.08 -1.26 -5.01 116.55 110.55 2wdr n ASP 63 Ca 0.15 -1.86 -0.08 0.00 -1.51 0.00 0.00 54.79 51.49 2wdr n ASP 63 Cb 0.37 0.31 -0.07 0.00 2.34 0.00 0.00 41.12 44.07 2wdr n ASP 63 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 2wdr s ASN 64 N -2.03 -0.89 0.55 1.67 3.84 -1.26 -4.93 114.94 111.89 2wdr s ASN 64 Ca 0.05 1.46 0.24 0.00 0.21 0.00 0.00 52.86 54.83 2wdr s ASN 64 Cb 0.00 1.39 1.50 0.00 -0.55 0.00 0.00 41.25 43.58 2wdr s ASN 64 CO 0.04 -0.23 2.10 4.11 -2.79 0.00 0.00 177.10 180.32 2wdr h TRP 65 N 6.62 0.00 -0.14 0.43 5.08 -1.88 0.35 115.95 126.41 2wdr h TRP 65 Ca -0.30 0.00 -0.13 0.00 1.08 0.00 0.00 58.89 59.54 2wdr h TRP 65 Cb 1.22 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.37 2wdr h TRP 65 CO 0.11 0.00 -0.49 0.93 -1.28 0.00 0.00 178.44 177.71 2wdr h GLU 66 N 0.00 0.37 -0.65 0.12 5.08 -1.96 -0.43 114.58 117.11 2wdr h GLU 66 Ca 0.10 -0.21 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2wdr h GLU 66 Cb 0.46 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 2wdr h GLU 66 CO -0.00 0.78 0.42 -1.49 -1.00 0.00 0.00 179.01 177.72 2wdr h TRP 67 N 0.29 0.79 -0.42 4.33 6.55 -1.27 0.16 115.95 126.38 2wdr h TRP 67 Ca 0.01 0.02 -0.08 0.00 0.95 0.00 0.00 58.89 59.79 2wdr h TRP 67 Cb 0.97 -0.27 -0.02 0.00 -0.86 0.00 0.00 29.16 28.99 2wdr h TRP 67 CO 0.03 0.48 -0.07 1.25 -1.05 0.00 0.00 178.44 179.08 2wdr h HIS 68 N 0.85 0.79 -0.58 0.49 2.76 -1.28 -2.00 115.15 116.17 2wdr h HIS 68 Ca 0.25 -0.13 -0.06 0.00 -2.20 0.00 0.00 60.37 58.23 2wdr h HIS 68 Cb -0.06 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 28.67 2wdr h HIS 68 CO -0.04 0.78 0.13 1.98 -1.30 0.00 0.00 177.93 179.48 2wdr h MET 69 N 0.67 0.94 0.07 5.26 1.85 -0.56 -2.18 114.93 120.97 2wdr h MET 69 Ca 0.12 -0.23 -0.00 0.00 -0.61 0.00 0.00 59.70 58.98 2wdr h MET 69 Cb 0.52 -0.12 -0.00 0.00 0.43 0.00 0.00 31.60 32.43 2wdr h MET 69 CO 0.03 0.88 -0.04 -0.92 -0.40 0.00 0.00 176.91 176.45 2wdr h TYR 70 N 0.84 -0.11 -0.98 1.39 3.20 -0.80 -1.29 116.97 119.21 2wdr h TYR 70 Ca 0.18 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.18 2wdr h TYR 70 Cb 0.37 0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.60 2wdr h TYR 70 CO 0.03 -0.07 0.62 -0.44 -1.64 0.00 0.00 178.16 176.65 2wdr h ASP 71 N -0.11 0.85 0.03 -2.11 3.32 -1.21 -0.38 116.42 116.81 2wdr h ASP 71 Ca -0.00 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2wdr h ASP 71 Cb 0.10 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2wdr h ASP 71 CO 0.00 0.43 -0.01 0.74 -1.72 0.00 0.00 179.24 178.68 2wdr h THR 72 N 0.90 1.41 -0.82 0.35 2.02 -1.16 0.96 112.91 116.58 2wdr h THR 72 Ca 0.50 -1.54 0.06 0.00 0.77 0.00 0.00 66.41 66.19 2wdr h THR 72 Cb 0.59 2.41 -0.06 0.00 -1.74 0.00 0.00 68.15 69.35 2wdr h THR 72 CO -0.27 0.38 0.50 0.58 0.37 0.00 0.00 175.52 177.09 2wdr h VAL 73 N -0.73 1.03 -0.02 3.16 2.07 -0.99 0.11 116.25 120.88 2wdr h VAL 73 Ca -0.00 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2wdr h VAL 73 Cb 0.66 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2wdr h VAL 73 CO 0.01 0.17 -0.01 0.50 0.02 0.00 0.00 177.57 178.25 2wdr h LYS 74 N 0.92 0.04 -0.62 1.57 3.64 -1.10 -2.85 116.57 118.17 2wdr h LYS 74 Ca 0.35 -0.02 0.18 0.00 -1.27 0.00 0.00 60.65 59.89 2wdr h LYS 74 Cb 0.16 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 2wdr h LYS 74 CO -0.17 0.47 0.44 0.78 -2.27 0.00 0.00 179.45 178.70 2wdr h GLY 75 N -0.38 0.01 1.28 5.01 0.00 -0.31 0.11 103.07 108.79 2wdr h GLY 75 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wdr h GLY 75 CO 0.00 0.00 -0.02 -1.14 0.00 0.00 0.00 176.54 175.39 2wdr n SER 76 N -4.35 0.09 -2.90 0.19 3.41 0.32 -4.03 113.62 106.35 2wdr n SER 76 Ca 0.12 -0.47 -0.22 0.00 -0.26 0.00 0.00 58.87 58.04 2wdr n SER 76 Cb 0.69 -0.17 0.03 0.00 -0.26 0.00 0.00 64.21 64.50 2wdr n SER 76 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2wdr n ASP 77 N -1.14 -6.14 -0.25 4.04 2.03 0.38 -1.63 116.55 113.85 2wdr n ASP 77 Ca 0.17 -0.24 -0.03 0.00 0.52 0.00 0.00 54.79 55.21 2wdr n ASP 77 Cb 0.21 -4.98 -0.01 0.00 -0.72 0.00 0.00 41.12 35.61 2wdr n ASP 77 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2wdr n TYR 78 N -4.43 0.00 0.01 -0.67 4.01 -1.09 -4.83 117.16 110.17 2wdr n TYR 78 Ca -0.14 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.66 2wdr n TYR 78 Cb 0.64 -1.12 0.14 0.00 -0.31 0.00 0.00 39.34 38.69 2wdr n TYR 78 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84 2wdr n ILE 79 N -2.68 0.71 -2.33 -0.72 -5.35 -1.23 -4.88 119.36 102.87 2wdr n ILE 79 Ca -0.03 -0.85 -0.41 0.00 -0.27 0.00 0.00 62.75 61.19 2wdr n ILE 79 Cb 0.22 0.72 -0.03 0.00 -1.74 0.00 0.00 39.64 38.81 2wdr n ILE 79 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2wdr s GLY 80 N -1.02 2.82 -0.19 3.28 0.00 -1.26 -4.50 107.32 106.44 2wdr s GLY 80 Ca 0.23 1.01 -0.29 0.00 0.00 0.00 0.00 44.72 45.68 2wdr s GLY 80 CO 0.18 1.79 1.33 0.99 0.00 0.00 0.00 173.10 177.38 2wdr s ASP 81 N -0.26 6.82 0.32 1.64 1.01 -0.13 -4.72 116.67 121.33 2wdr s ASP 81 Ca 0.50 1.61 0.07 0.00 0.71 0.00 0.00 52.55 55.45 2wdr s ASP 81 Cb -0.34 -2.54 0.53 0.00 1.01 0.00 0.00 42.92 41.58 2wdr s ASP 81 CO 0.41 -0.89 1.75 1.56 0.21 0.00 0.00 175.17 178.21 2wdr h GLN 82 N 8.76 0.23 -0.60 8.23 4.20 -1.48 -2.12 115.11 132.33 2wdr h GLN 82 Ca -0.28 -0.10 -0.08 0.00 0.06 0.00 0.00 58.65 58.26 2wdr h GLN 82 Cb 1.11 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 2wdr h GLN 82 CO 0.99 0.56 0.07 0.38 -0.67 0.00 0.00 178.83 180.16 2wdr h ASP 83 N 0.20 0.97 -0.33 1.46 2.03 -1.78 0.56 116.42 119.53 2wdr h ASP 83 Ca 0.02 -0.27 -0.17 0.00 -0.73 0.00 0.00 57.03 55.88 2wdr h ASP 83 Cb 0.72 -0.26 -0.00 0.00 -0.83 0.00 0.00 39.33 38.95 2wdr h ASP 83 CO 0.05 1.00 -0.47 0.00 -1.03 0.00 0.00 179.24 178.79 2wdr h ALA 84 N 1.01 0.50 -0.30 4.15 0.00 -1.88 -1.83 119.26 120.91 2wdr h ALA 84 Ca 0.18 -0.49 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 2wdr h ALA 84 Cb 0.46 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2wdr h ALA 84 CO 0.02 0.66 -0.15 0.82 0.00 0.00 0.00 179.25 180.60 2wdr h ILE 85 N 0.70 1.24 -0.37 0.00 2.04 -1.19 0.07 117.51 120.01 2wdr h ILE 85 Ca 0.03 -1.10 -0.03 0.00 1.00 0.00 0.00 64.86 64.77 2wdr h ILE 85 Cb 1.08 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.33 2wdr h ILE 85 CO 0.11 0.36 0.13 -0.08 0.00 0.00 0.00 178.15 178.67 2wdr h GLU 86 N 0.47 0.57 -1.00 2.37 4.81 -0.81 -1.59 114.58 119.41 2wdr h GLU 86 Ca 0.08 -0.11 0.07 0.00 -0.13 0.00 0.00 59.36 59.27 2wdr h GLU 86 Cb 0.55 -0.09 -0.07 0.00 0.63 0.00 0.00 28.75 29.77 2wdr h GLU 86 CO 0.04 0.57 0.64 -0.92 -0.73 0.00 0.00 179.01 178.61 2wdr h TYR 87 N 0.45 1.19 0.32 0.92 3.20 -0.39 -2.36 116.97 120.31 2wdr h TYR 87 Ca 0.12 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 2wdr h TYR 87 Cb 0.23 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 38.11 2wdr h TYR 87 CO 0.00 0.61 -0.16 1.98 -1.64 0.00 0.00 178.16 178.96 2wdr h MET 88 N 1.17 -0.42 -0.63 1.82 4.05 -0.68 -1.73 114.93 118.51 2wdr h MET 88 Ca 0.43 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.88 2wdr h MET 88 Cb 0.17 0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.04 2wdr h MET 88 CO -0.18 -0.16 0.40 0.00 0.23 0.00 0.00 176.91 177.21 2wdr h LYS 90 N 0.86 -0.07 -0.35 0.00 1.63 -1.50 -3.26 116.57 113.88 2wdr h LYS 90 Ca 0.23 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 60.01 2wdr h LYS 90 Cb -0.07 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 2wdr h LYS 90 CO -0.05 0.42 0.14 1.15 -3.45 0.00 0.00 179.45 177.67 2wdr h THR 91 N -0.59 1.19 0.00 1.00 2.02 -1.12 -3.39 112.91 112.01 2wdr h THR 91 Ca -0.01 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.59 2wdr h THR 91 Cb 0.52 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2wdr h THR 91 CO 0.01 0.21 0.00 0.61 0.37 0.00 0.00 175.52 176.72 2wdr n GLY 92 N -0.75 0.00 0.35 2.16 0.00 0.98 -1.66 105.19 106.28 2wdr n GLY 92 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 2wdr n GLY 92 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wdr h PRO 93 N 0.00 -0.07 -0.46 1.61 0.11 -1.77 0.11 132.00 131.53 2wdr h PRO 93 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 2wdr h PRO 93 Cb 0.00 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.10 2wdr h PRO 93 CO 0.00 -0.05 0.22 1.49 -0.21 0.00 0.00 178.00 179.45 2wdr h GLU 94 N -0.07 0.67 0.00 1.05 4.81 -1.61 -0.51 114.58 118.91 2wdr h GLU 94 Ca 0.31 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 2wdr h GLU 94 Cb 0.58 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 2wdr h GLU 94 CO -0.83 0.57 -0.04 0.00 -0.73 0.00 0.00 179.01 177.98 2wdr h ALA 95 N 1.06 1.56 0.10 2.92 0.00 -0.79 -1.80 119.26 122.31 2wdr h ALA 95 Ca 0.16 -0.03 -0.36 0.00 0.00 0.00 0.00 54.91 54.68 2wdr h ALA 95 Cb 0.13 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2wdr h ALA 95 CO -0.02 0.05 -2.01 -0.89 0.00 0.00 0.00 179.25 176.38 2wdr n ILE 96 N -3.95 1.74 -0.21 0.00 2.08 -0.18 -3.61 119.36 115.24 2wdr n ILE 96 Ca -0.03 -0.67 0.05 0.00 0.56 0.00 0.00 62.75 62.66 2wdr n ILE 96 Cb 0.12 -1.60 0.32 0.00 -0.75 0.00 0.00 39.64 37.73 2wdr n ILE 96 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2wdr h LEU 97 N 0.06 0.74 -1.16 1.39 3.38 -0.95 -0.71 115.31 118.05 2wdr h LEU 97 Ca -0.42 0.00 0.16 0.00 0.09 0.00 0.00 57.88 57.71 2wdr h LEU 97 Cb 2.03 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 42.53 2wdr h LEU 97 CO 0.07 0.48 0.61 -0.08 0.09 0.00 0.00 178.44 179.61 2wdr h GLU 98 N 0.84 0.72 -0.41 1.13 4.81 -1.39 -0.85 114.58 119.44 2wdr h GLU 98 Ca 0.32 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.38 2wdr h GLU 98 Cb 0.19 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2wdr h GLU 98 CO -0.11 0.48 -0.23 -0.07 -0.73 0.00 0.00 179.01 178.35 2wdr h LEU 99 N 0.74 0.91 -1.41 1.64 3.38 -1.19 -2.54 115.31 116.84 2wdr h LEU 99 Ca 0.51 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 58.08 2wdr h LEU 99 Cb 0.81 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2wdr h LEU 99 CO -0.28 1.13 0.41 -0.08 0.09 0.00 0.00 178.44 179.71 2wdr h GLU 100 N 0.69 0.78 0.00 1.13 4.22 -0.94 0.32 114.58 120.79 2wdr h GLU 100 Ca 0.09 -0.05 -0.02 0.00 0.08 0.00 0.00 59.36 59.46 2wdr h GLU 100 Cb 0.80 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 2wdr h GLU 100 CO 0.07 0.52 -0.11 0.45 -2.18 0.00 0.00 179.01 177.75 2wdr h HIS 101 N 0.80 0.00 -0.00 0.92 3.86 -1.01 -0.98 115.15 118.75 2wdr h HIS 101 Ca 0.23 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 2wdr h HIS 101 Cb -0.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.42 2wdr h HIS 101 CO -0.00 0.11 -0.03 -1.33 0.86 0.00 0.00 177.93 177.54 2wdr n MET 102 N -3.25 0.31 0.00 2.45 2.81 0.07 -4.90 117.12 114.61 2wdr n MET 102 Ca 0.00 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 2wdr n MET 102 Cb 0.38 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.39 2wdr n MET 102 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wdr n GLY 103 N 1.36 0.81 3.67 3.03 0.00 -0.37 -4.94 105.19 108.75 2wdr n GLY 103 Ca 0.12 0.00 -0.61 0.00 0.00 0.00 0.00 46.02 45.53 2wdr n GLY 103 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2wdr n LEU 104 N 0.00 1.48 -3.53 0.99 0.00 -1.07 -4.77 117.00 110.09 2wdr n LEU 104 Ca 0.00 1.14 -0.41 0.00 0.00 0.00 0.00 56.01 56.74 2wdr n LEU 104 Cb 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 43.42 42.39 2wdr n LEU 104 CO 0.00 -0.90 3.01 -0.81 0.00 0.00 0.00 177.39 178.69 2wdr n PRO 105 N 3.86 3.33 -1.75 1.96 -0.04 -1.26 -4.71 135.00 136.38 2wdr n PRO 105 Ca 0.26 -2.46 -0.37 0.00 -0.04 0.00 0.00 63.50 60.89 2wdr n PRO 105 Cb 0.06 -3.03 0.07 0.00 -0.04 0.00 0.00 33.50 30.56 2wdr n PRO 105 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2wdr s PHE 106 N 2.51 2.10 0.92 0.54 0.08 -1.26 -4.72 117.98 118.15 2wdr s PHE 106 Ca 0.58 1.49 -0.11 0.00 0.12 0.00 0.00 56.93 59.00 2wdr s PHE 106 Cb 0.16 -3.67 0.14 0.00 -0.57 0.00 0.00 43.02 39.08 2wdr s PHE 106 CO -0.07 -2.87 1.09 -1.12 -0.10 0.00 0.00 175.22 172.15 2wdr s SER 107 N -1.43 3.20 0.04 1.36 0.01 -0.73 -4.91 113.70 111.24 2wdr s SER 107 Ca 0.82 1.58 0.04 0.00 1.31 0.00 0.00 55.95 59.70 2wdr s SER 107 Cb -0.37 -2.24 -0.02 0.00 0.21 0.00 0.00 66.02 63.60 2wdr s SER 107 CO 0.39 -2.82 -0.12 -0.13 0.41 0.00 0.00 173.24 170.97 2wdr s ARG 108 N -4.85 0.77 0.80 12.44 1.81 -1.26 -1.09 118.95 127.56 2wdr s ARG 108 Ca 0.64 -0.75 -0.11 0.00 -1.72 0.00 0.00 55.73 53.79 2wdr s ARG 108 Cb -0.19 -0.73 0.09 0.00 -0.45 0.00 0.00 34.95 33.67 2wdr s ARG 108 CO 0.58 0.17 1.15 -0.51 -0.68 0.00 0.00 175.30 176.01 2wdr s LEU 109 N -1.27 2.61 0.37 2.53 1.43 0.24 -4.70 118.68 119.89 2wdr s LEU 109 Ca -0.02 0.62 0.04 0.00 -1.03 0.00 0.00 54.13 53.74 2wdr s LEU 109 Cb -0.08 -3.09 0.70 0.00 0.03 0.00 0.00 46.19 43.75 2wdr s LEU 109 CO 0.01 -1.93 2.02 0.44 0.23 0.00 0.00 176.35 177.12 2wdr h ASP 110 N -1.01 0.65 0.70 2.29 5.19 -2.01 -1.01 116.42 121.22 2wdr h ASP 110 Ca -0.45 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 2wdr h ASP 110 Cb 1.31 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.66 2wdr h ASP 110 CO 0.61 0.47 0.00 -0.90 -3.12 0.00 0.00 179.24 176.30 2wdr n ASP 111 N -4.45 0.00 0.00 6.45 5.68 -1.26 -4.90 116.55 118.07 2wdr n ASP 111 Ca 0.05 0.26 0.00 0.00 -0.50 0.00 0.00 54.79 54.60 2wdr n ASP 111 Cb 0.05 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 39.62 2wdr n ASP 111 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wdr n GLY 112 N 0.98 1.03 3.97 6.12 0.00 -0.38 -5.10 105.19 111.81 2wdr n GLY 112 Ca 0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 2wdr n GLY 112 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdr s ARG 113 N -0.55 3.35 0.04 1.61 0.52 -1.26 -4.81 118.95 117.85 2wdr s ARG 113 Ca 0.00 -0.70 -0.32 0.00 -0.52 0.00 0.00 55.73 54.19 2wdr s ARG 113 Cb 0.00 -2.80 -0.11 0.00 0.52 0.00 0.00 34.95 32.56 2wdr s ARG 113 CO 0.00 0.24 1.84 -0.89 0.02 0.00 0.00 175.30 176.51 2wdr n ILE 114 N -1.59 0.46 -1.84 1.52 5.41 -1.26 -0.59 119.36 121.46 2wdr n ILE 114 Ca -0.05 -0.08 -0.41 0.00 1.00 0.00 0.00 62.75 63.20 2wdr n ILE 114 Cb 0.57 -1.99 -0.01 0.00 -0.71 0.00 0.00 39.64 37.50 2wdr n ILE 114 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 2wdr s TYR 115 N 3.25 2.77 0.00 1.39 5.04 -0.25 -4.70 117.35 124.85 2wdr s TYR 115 Ca 0.87 0.96 0.05 0.00 -2.44 0.00 0.00 57.07 56.50 2wdr s TYR 115 Cb -0.57 -3.99 -0.01 0.00 0.35 0.00 0.00 41.96 37.73 2wdr s TYR 115 CO 0.43 -3.18 -0.15 -0.65 -1.34 0.00 0.00 175.55 170.66 2wdr s GLN 116 N -0.98 1.16 0.15 4.97 -0.21 -1.26 -2.54 119.66 120.94 2wdr s GLN 116 Ca 0.59 -0.61 0.10 0.00 0.02 0.00 0.00 55.36 55.46 2wdr s GLN 116 Cb -0.46 -1.14 -0.04 0.00 1.00 0.00 0.00 33.01 32.37 2wdr s GLN 116 CO 0.51 0.31 -0.22 -0.98 -2.12 0.00 0.00 175.29 172.79 2wdr s ARG 117 N -0.58 1.31 0.73 2.91 1.70 0.21 -4.81 118.95 120.42 2wdr s ARG 117 Ca 0.05 -1.36 -0.15 0.00 -0.47 0.00 0.00 55.73 53.80 2wdr s ARG 117 Cb -0.06 -1.57 0.04 0.00 -0.57 0.00 0.00 34.95 32.78 2wdr s ARG 117 CO -0.00 0.35 1.25 -2.14 -1.08 0.00 0.00 175.30 173.67 2wdr s PRO 118 N -2.38 2.06 0.28 3.89 0.02 -1.26 -1.71 135.00 135.90 2wdr s PRO 118 Ca 0.14 1.90 -0.17 0.00 0.02 0.00 0.00 61.00 62.89 2wdr s PRO 118 Cb -0.08 -1.81 0.01 0.00 0.02 0.00 0.00 34.50 32.64 2wdr s PRO 118 CO 0.07 -1.93 0.62 0.12 -0.33 0.00 0.00 177.00 175.54 2wdr s PHE 119 N -1.80 0.10 0.20 6.54 5.36 -1.26 -4.28 117.98 122.84 2wdr s PHE 119 Ca 0.78 -0.53 -0.32 0.00 -0.96 0.00 0.00 56.93 55.90 2wdr s PHE 119 Cb -0.33 0.48 -0.12 0.00 -0.34 0.00 0.00 43.02 42.71 2wdr s PHE 119 CO 0.45 -1.16 1.73 0.20 -1.46 0.00 0.00 175.22 174.99 2wdr s GLY 120 N -2.98 1.22 -0.40 13.12 0.00 -1.26 -3.82 107.32 113.20 2wdr s GLY 120 Ca 0.17 1.57 -0.01 0.00 0.00 0.00 0.00 44.72 46.45 2wdr s GLY 120 CO 0.09 2.90 0.34 0.61 0.00 0.00 0.00 173.10 177.04 2wdr n GLY 121 N 4.00 0.17 2.66 0.20 0.00 -0.30 -4.11 105.19 107.80 2wdr n GLY 121 Ca 0.16 -0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 2wdr n GLY 121 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wdr s GLN 122 N -4.00 0.30 0.13 1.61 -0.21 -1.25 -4.82 119.66 111.43 2wdr s GLN 122 Ca 0.08 -0.23 0.08 0.00 0.02 0.00 0.00 55.36 55.31 2wdr s GLN 122 Cb -0.01 -1.93 -0.04 0.00 1.00 0.00 0.00 33.01 32.03 2wdr s GLN 122 CO 0.26 -0.67 -0.18 -1.54 -2.12 0.00 0.00 175.29 171.04 2wdr s SER 123 N 2.02 2.49 0.27 5.90 1.04 -1.26 -0.18 113.70 123.98 2wdr s SER 123 Ca 0.01 -0.79 -0.04 0.00 0.48 0.00 0.00 55.95 55.61 2wdr s SER 123 Cb -0.16 -0.13 -0.05 0.00 0.10 0.00 0.00 66.02 65.77 2wdr s SER 123 CO -0.09 -0.02 0.52 -0.54 0.98 0.00 0.00 173.24 174.08 2wdr s LYS 124 N -2.44 3.60 -1.22 4.02 1.02 0.66 -4.61 119.74 120.77 2wdr s LYS 124 Ca 0.11 -0.08 -0.09 0.00 0.02 0.00 0.00 55.97 55.93 2wdr s LYS 124 Cb -0.07 -2.69 -0.01 0.00 -0.52 0.00 0.00 37.83 34.54 2wdr s LYS 124 CO 0.05 0.25 0.73 0.09 -0.92 0.00 0.00 175.35 175.55 2wdr n ASN 125 N -0.91 -3.47 -3.58 2.83 4.13 -1.26 0.18 115.26 113.18 2wdr n ASN 125 Ca -0.02 -0.91 -0.19 0.00 1.68 0.00 0.00 54.58 55.14 2wdr n ASN 125 Cb 0.54 -3.79 0.00 0.00 -1.54 0.00 0.00 39.78 34.99 2wdr n ASN 125 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2wdr n PHE 126 N -4.12 -2.28 -0.29 3.10 3.72 -1.26 -3.13 117.46 113.19 2wdr n PHE 126 Ca -0.19 0.87 0.00 0.00 -0.05 0.00 0.00 57.45 58.08 2wdr n PHE 126 Cb 0.64 -3.22 0.00 0.00 -0.94 0.00 0.00 39.48 35.96 2wdr n PHE 126 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wdr n GLY 127 N -1.71 0.84 0.00 1.37 0.00 -1.24 -5.07 105.19 99.38 2wdr n GLY 127 Ca -0.20 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2wdr n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdr n GLY 128 N -2.29 1.03 3.72 -0.02 0.00 0.13 -4.95 105.19 102.79 2wdr n GLY 128 Ca 0.00 -0.97 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 2wdr n GLY 128 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wdr s GLU 129 N 1.20 1.92 0.26 1.61 2.12 -1.24 -4.51 118.70 120.06 2wdr s GLU 129 Ca 0.00 1.67 -0.30 0.00 0.36 0.00 0.00 54.97 56.71 2wdr s GLU 129 Cb 0.00 -1.82 -0.10 0.00 0.26 0.00 0.00 34.13 32.47 2wdr s GLU 129 CO 0.00 -1.98 1.36 -1.14 -0.54 0.00 0.00 175.26 172.96 2wdr s GLN 130 N -4.13 4.33 0.43 4.30 2.00 -1.26 -0.24 119.66 125.08 2wdr s GLN 130 Ca 0.72 2.21 0.07 0.00 -2.00 0.00 0.00 55.36 56.36 2wdr s GLN 130 Cb -0.27 -3.12 -0.03 0.00 0.80 0.00 0.00 33.01 30.39 2wdr s GLN 130 CO 0.49 -0.30 0.29 0.00 -0.50 0.00 0.00 175.29 175.27 2wdr s ALA 131 N -0.35 3.89 -0.36 1.58 0.00 0.75 -4.73 121.76 122.53 2wdr s ALA 131 Ca 0.55 -1.93 -0.00 0.00 0.00 0.00 0.00 51.96 50.59 2wdr s ALA 131 Cb -0.40 -0.70 0.13 0.00 0.00 0.00 0.00 23.12 22.15 2wdr s ALA 131 CO 0.45 -0.22 0.19 0.00 0.00 0.00 0.00 175.76 176.19 2wdr s ALA 132 N -2.56 1.29 -0.09 0.00 0.00 -1.26 -4.30 121.76 114.84 2wdr s ALA 132 Ca 0.44 -1.94 0.13 0.00 0.00 0.00 0.00 51.96 50.58 2wdr s ALA 132 Cb 0.00 -1.66 0.23 0.00 0.00 0.00 0.00 23.12 21.69 2wdr s ALA 132 CO 0.25 -1.99 1.12 2.89 0.00 0.00 0.00 175.76 178.03 2wdr n ARG 133 N 4.15 0.84 -3.27 0.00 1.85 -1.15 -4.35 116.66 114.74 2wdr n ARG 133 Ca 0.07 -2.16 -0.44 0.00 -1.00 0.00 0.00 57.85 54.32 2wdr n ARG 133 Cb 0.37 -1.10 -0.07 0.00 -1.05 0.00 0.00 32.46 30.62 2wdr n ARG 133 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2wdr s THR 134 N -1.84 5.06 0.17 8.89 2.01 -0.69 -1.77 115.64 127.46 2wdr s THR 134 Ca 0.23 -0.87 -0.30 0.00 0.31 0.00 0.00 61.69 61.06 2wdr s THR 134 Cb 0.22 -4.24 -0.08 0.00 0.01 0.00 0.00 72.50 68.41 2wdr s THR 134 CO -0.01 -0.74 1.14 0.00 -0.69 0.00 0.00 174.62 174.33 2wdr s ALA 135 N 2.11 3.39 0.05 7.40 0.00 0.79 -0.62 121.76 134.89 2wdr s ALA 135 Ca 0.09 0.87 -0.08 0.00 0.00 0.00 0.00 51.96 52.83 2wdr s ALA 135 Cb -0.23 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.51 2wdr s ALA 135 CO 0.08 -0.29 0.17 0.00 0.00 0.00 0.00 175.76 175.72 2wdr s ALA 136 N -0.03 -0.23 -0.41 0.00 0.00 -1.05 0.21 121.76 120.24 2wdr s ALA 136 Ca 0.52 -0.47 -0.06 0.00 0.00 0.00 0.00 51.96 51.95 2wdr s ALA 136 Cb -0.30 0.34 0.09 0.00 0.00 0.00 0.00 23.12 23.24 2wdr s ALA 136 CO 0.35 -0.40 0.22 0.00 0.00 0.00 0.00 175.76 175.93 2wdr s ALA 137 N -3.02 3.19 0.00 0.00 0.00 -1.26 -1.78 121.76 118.90 2wdr s ALA 137 Ca -0.02 -2.31 0.00 0.00 0.00 0.00 0.00 51.96 49.64 2wdr s ALA 137 Cb 0.01 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.64 2wdr s ALA 137 CO -0.06 -1.70 0.00 0.00 0.00 0.00 0.00 175.76 174.00 2wdr n ALA 138 N 4.75 0.00 -1.81 0.00 0.00 -1.26 -1.00 120.51 121.19 2wdr n ALA 138 Ca -0.07 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.20 2wdr n ALA 138 Cb 0.42 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.95 2wdr n ALA 138 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2wdr n ASP 139 N 1.50 4.30 -0.34 0.00 5.75 -1.20 -4.66 116.55 121.90 2wdr n ASP 139 Ca 0.00 -3.79 0.08 0.00 -0.01 0.00 0.00 54.79 51.07 2wdr n ASP 139 Cb 0.00 -0.48 0.15 0.00 -1.03 0.00 0.00 41.12 39.76 2wdr n ASP 139 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2wdr n ARG 140 N -0.86 1.22 -0.07 0.11 1.74 -0.17 -4.34 116.66 114.29 2wdr n ARG 140 Ca 0.40 -2.67 -0.07 0.00 -0.77 0.00 0.00 57.85 54.74 2wdr n ARG 140 Cb 0.90 -1.39 -0.01 0.00 -1.02 0.00 0.00 32.46 30.94 2wdr n ARG 140 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 2wdr h THR 141 N 1.19 0.76 -0.62 0.55 2.02 -1.42 -1.24 112.91 114.14 2wdr h THR 141 Ca -0.01 -0.01 0.13 0.00 0.77 0.00 0.00 66.41 67.28 2wdr h THR 141 Cb 1.07 0.71 -0.10 0.00 -1.74 0.00 0.00 68.15 68.10 2wdr h THR 141 CO 0.00 0.01 0.08 1.23 0.37 0.00 0.00 175.52 177.21 2wdr h GLY 142 N 0.04 0.75 0.61 2.16 0.00 -1.18 0.28 103.07 105.73 2wdr h GLY 142 Ca 0.13 0.02 0.05 0.00 0.00 0.00 0.00 47.33 47.53 2wdr h GLY 142 CO -0.26 -0.16 0.13 0.84 0.00 0.00 0.00 176.54 177.09 2wdr h HIS 143 N 0.20 0.23 -0.39 5.60 6.17 -0.46 0.03 115.15 126.54 2wdr h HIS 143 Ca 0.33 0.02 -0.03 0.00 0.71 0.00 0.00 60.37 61.41 2wdr h HIS 143 Cb 0.53 -0.04 -0.02 0.00 2.52 0.00 0.00 27.41 30.39 2wdr h HIS 143 CO -0.30 0.08 0.14 0.00 0.71 0.00 0.00 177.93 178.57 2wdr h ALA 144 N 1.27 0.50 0.18 5.26 0.00 0.01 -2.17 119.26 124.30 2wdr h ALA 144 Ca 0.19 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2wdr h ALA 144 Cb 0.19 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2wdr h ALA 144 CO -0.20 0.12 -0.09 1.25 0.00 0.00 0.00 179.25 180.32 2wdr h LEU 145 N 0.48 -0.23 -0.10 0.00 5.85 -0.32 -1.99 115.31 119.00 2wdr h LEU 145 Ca 0.13 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 2wdr h LEU 145 Cb 0.22 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 2wdr h LEU 145 CO -0.01 -0.16 0.03 0.25 -0.34 0.00 0.00 178.44 178.21 2wdr h LEU 146 N -0.25 0.14 -1.56 2.25 5.85 -0.95 -0.94 115.31 119.85 2wdr h LEU 146 Ca -0.02 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.48 2wdr h LEU 146 Cb 0.20 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2wdr h LEU 146 CO 0.03 0.31 0.07 0.45 -0.34 0.00 0.00 178.44 178.96 2wdr h HIS 147 N -0.03 0.35 -0.26 1.25 3.86 -1.41 -0.58 115.15 118.33 2wdr h HIS 147 Ca 0.03 -0.01 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 2wdr h HIS 147 Cb 0.22 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 2wdr h HIS 147 CO -0.00 0.31 -0.08 1.15 0.86 0.00 0.00 177.93 180.17 2wdr h THR 148 N 0.36 1.29 0.00 2.45 2.02 -1.02 -2.07 112.91 115.93 2wdr h THR 148 Ca 0.09 -1.11 -0.06 0.00 0.77 0.00 0.00 66.41 66.09 2wdr h THR 148 Cb 0.12 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 2wdr h THR 148 CO -0.01 0.35 -0.31 -0.07 0.37 0.00 0.00 175.52 175.86 2wdr h LEU 149 N 0.26 0.00 -0.04 2.58 3.38 -0.35 -0.22 115.31 120.92 2wdr h LEU 149 Ca 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2wdr h LEU 149 Cb 0.56 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 2wdr h LEU 149 CO 0.03 0.31 -0.03 0.22 0.09 0.00 0.00 178.44 179.06 2wdr h TYR 150 N 0.00 0.10 -0.91 1.13 3.20 -1.01 -1.83 116.97 117.66 2wdr h TYR 150 Ca -0.00 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.87 2wdr h TYR 150 Cb 0.56 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.75 2wdr h TYR 150 CO 0.00 0.53 0.59 1.96 -1.64 0.00 0.00 178.16 179.60 2wdr h GLN 151 N -0.35 1.11 -0.58 1.82 4.20 -0.95 0.37 115.11 120.72 2wdr h GLN 151 Ca 0.01 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2wdr h GLN 151 Cb 0.51 -0.25 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 2wdr h GLN 151 CO 0.01 0.74 0.38 1.96 -0.67 0.00 0.00 178.83 181.25 2wdr h GLN 152 N 1.14 0.77 -0.06 1.46 1.08 -0.99 0.28 115.11 118.81 2wdr h GLN 152 Ca 0.36 -0.05 -0.18 0.00 -1.45 0.00 0.00 58.65 57.34 2wdr h GLN 152 Cb -0.00 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 2wdr h GLN 152 CO -0.12 0.51 -0.73 -0.91 -0.95 0.00 0.00 178.83 176.63 2wdr h ASN 153 N 0.79 0.37 0.46 1.46 2.35 0.00 -2.31 115.58 118.71 2wdr h ASN 153 Ca 0.21 -0.25 -0.02 0.00 -0.55 0.00 0.00 56.30 55.69 2wdr h ASN 153 Cb -0.09 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.18 2wdr h ASN 153 CO -0.05 0.98 -0.22 -0.07 -1.65 0.00 0.00 177.43 176.42 2wdr h LEU 154 N 0.21 -0.52 -1.31 1.61 3.38 0.49 -1.74 115.31 117.43 2wdr h LEU 154 Ca -0.03 -0.05 0.22 0.00 0.09 0.00 0.00 57.88 58.11 2wdr h LEU 154 Cb 1.30 0.13 -0.09 0.00 0.09 0.00 0.00 40.66 42.10 2wdr h LEU 154 CO 0.12 -0.26 0.63 0.50 0.09 0.00 0.00 178.44 179.52 2wdr h LYS 155 N -0.77 0.50 -0.31 1.13 3.64 -0.49 -0.64 116.57 119.63 2wdr h LYS 155 Ca -0.06 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2wdr h LYS 155 Cb 0.54 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2wdr h LYS 155 CO 0.10 0.33 0.00 -1.71 -2.27 0.00 0.00 179.45 175.90 2wdr n ASN 156 N -4.62 2.29 -3.25 4.20 2.85 -0.87 -4.92 115.26 110.93 2wdr n ASN 156 Ca 0.22 -1.87 -0.23 0.00 -0.11 0.00 0.00 54.58 52.59 2wdr n ASN 156 Cb 0.72 -0.20 0.02 0.00 1.24 0.00 0.00 39.78 41.56 2wdr n ASN 156 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 2wdr n HIS 157 N 0.74 -1.97 -1.84 1.20 8.25 -0.25 -4.93 115.22 116.42 2wdr n HIS 157 Ca 0.16 0.55 -0.40 0.00 -0.26 0.00 0.00 57.72 57.78 2wdr n HIS 157 Cb 0.40 -3.86 0.01 0.00 1.12 0.00 0.00 29.99 27.66 2wdr n HIS 157 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2wdr s THR 158 N -3.09 2.15 -0.51 1.59 2.01 -0.71 -4.95 115.64 112.13 2wdr s THR 158 Ca 0.38 0.14 -0.29 0.00 0.31 0.00 0.00 61.69 62.24 2wdr s THR 158 Cb -0.19 -3.09 0.03 0.00 0.01 0.00 0.00 72.50 69.27 2wdr s THR 158 CO 0.47 0.03 1.19 -0.89 -0.69 0.00 0.00 174.62 174.73 2wdr s THR 159 N -1.18 4.10 -0.21 -0.82 2.01 -1.26 -4.94 115.64 113.35 2wdr s THR 159 Ca 0.57 1.08 -0.01 0.00 0.31 0.00 0.00 61.69 63.64 2wdr s THR 159 Cb -0.44 -4.60 0.02 0.00 0.01 0.00 0.00 72.50 67.49 2wdr s THR 159 CO 0.58 -1.10 -0.12 -0.63 -0.69 0.00 0.00 174.62 172.66 2wdr s ILE 160 N 4.77 2.59 -0.95 1.82 1.01 -1.26 -0.57 121.20 128.61 2wdr s ILE 160 Ca 0.48 -0.90 -0.16 0.00 0.00 0.00 0.00 60.65 60.07 2wdr s ILE 160 Cb -0.08 -2.20 0.18 0.00 0.01 0.00 0.00 42.46 40.37 2wdr s ILE 160 CO 0.30 0.39 1.04 -0.36 0.00 0.00 0.00 174.94 176.30 2wdr s PHE 161 N 1.33 3.50 0.41 3.97 0.08 0.94 -4.94 117.98 123.27 2wdr s PHE 161 Ca 0.03 -1.82 -0.23 0.00 0.12 0.00 0.00 56.93 55.03 2wdr s PHE 161 Cb -0.15 -4.08 -0.09 0.00 -0.57 0.00 0.00 43.02 38.13 2wdr s PHE 161 CO -0.08 -1.25 1.04 0.45 -0.10 0.00 0.00 175.22 175.28 2wdr s SER 162 N 2.80 6.74 -1.25 1.36 0.15 -1.26 -2.61 113.70 119.63 2wdr s SER 162 Ca 0.29 1.99 -0.11 0.00 0.70 0.00 0.00 55.95 58.81 2wdr s SER 162 Cb -0.07 -2.58 -0.00 0.00 -1.71 0.00 0.00 66.02 61.66 2wdr s SER 162 CO -0.08 -0.50 0.65 -0.62 1.20 0.00 0.00 173.24 173.88 2wdr n GLU 163 N -0.20 -2.35 -5.13 5.44 1.02 0.21 -4.90 120.64 114.74 2wdr n GLU 163 Ca 0.06 0.45 -0.30 0.00 -0.02 0.00 0.00 57.16 57.34 2wdr n GLU 163 Cb 0.50 -4.36 -0.17 0.00 -0.02 0.00 0.00 31.44 27.40 2wdr n GLU 163 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2wdr s TRP 164 N -3.67 2.27 -0.31 -0.32 0.52 -0.69 -2.08 118.94 114.66 2wdr s TRP 164 Ca 0.26 -0.74 -0.09 0.00 0.02 0.00 0.00 56.10 55.54 2wdr s TRP 164 Cb -0.09 -1.51 -0.00 0.00 -1.15 0.00 0.00 33.47 30.72 2wdr s TRP 164 CO 0.87 -0.26 0.14 -0.47 0.02 0.00 0.00 176.95 177.25 2wdr s TYR 165 N 0.04 3.18 0.11 -1.98 5.04 0.73 -3.04 117.35 121.43 2wdr s TYR 165 Ca -0.08 -0.69 -0.31 0.00 -2.44 0.00 0.00 57.07 53.55 2wdr s TYR 165 Cb -0.14 -2.34 -0.09 0.00 0.35 0.00 0.00 41.96 39.74 2wdr s TYR 165 CO 0.05 -0.50 1.59 0.00 -1.34 0.00 0.00 175.55 175.35 2wdr s ALA 166 N 1.58 3.71 0.00 3.97 0.00 -1.26 0.55 121.76 130.31 2wdr s ALA 166 Ca 0.04 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.26 2wdr s ALA 166 Cb -0.17 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2wdr s ALA 166 CO 0.05 -0.93 0.00 1.28 0.00 0.00 0.00 175.76 176.16 2wdr n LEU 167 N 4.81 0.13 -3.69 0.00 4.77 0.44 -4.91 117.00 118.55 2wdr n LEU 167 Ca 0.15 0.30 -0.13 0.00 -0.03 0.00 0.00 56.01 56.30 2wdr n LEU 167 Cb 0.40 -0.47 -0.07 0.00 -2.33 0.00 0.00 43.42 40.95 2wdr n LEU 167 CO 0.62 -0.47 0.12 -1.81 -1.33 0.00 0.00 177.39 174.52 2wdr s ASP 168 N -3.20 -0.25 0.78 -1.43 1.01 -1.24 -4.84 116.67 107.51 2wdr s ASP 168 Ca 0.00 -0.01 -0.13 0.00 0.71 0.00 0.00 52.55 53.11 2wdr s ASP 168 Cb 0.00 0.40 0.07 0.00 1.01 0.00 0.00 42.92 44.39 2wdr s ASP 168 CO 0.00 -0.62 1.18 -0.76 0.21 0.00 0.00 175.17 175.17 2wdr s LEU 169 N -1.91 3.17 -0.12 1.23 1.43 -1.26 -2.27 118.68 118.95 2wdr s LEU 169 Ca -0.06 2.25 0.02 0.00 -1.03 0.00 0.00 54.13 55.31 2wdr s LEU 169 Cb -0.01 -4.58 -0.01 0.00 0.03 0.00 0.00 46.19 41.63 2wdr s LEU 169 CO -0.01 -2.44 -0.19 -0.69 0.23 0.00 0.00 176.35 173.25 2wdr s VAL 170 N -2.25 2.50 -0.12 -1.59 1.01 -0.44 -4.68 120.40 114.83 2wdr s VAL 170 Ca 0.71 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 2wdr s VAL 170 Cb -0.26 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 2wdr s VAL 170 CO 0.49 0.54 -0.08 -0.54 0.00 0.00 0.00 175.10 175.52 2wdr s LYS 171 N 0.42 3.26 0.86 2.72 1.02 -1.26 -0.76 119.74 126.01 2wdr s LYS 171 Ca -0.14 -0.58 -0.12 0.00 0.02 0.00 0.00 55.97 55.15 2wdr s LYS 171 Cb -0.17 -2.71 0.11 0.00 -0.52 0.00 0.00 37.83 34.54 2wdr s LYS 171 CO 0.06 0.38 1.15 0.54 -0.92 0.00 0.00 175.35 176.56 2wdr s ASN 172 N -0.04 3.99 0.00 2.83 4.22 -0.10 -4.83 114.94 121.01 2wdr s ASN 172 Ca -0.00 0.94 0.03 0.00 -2.14 0.00 0.00 52.86 51.69 2wdr s ASN 172 Cb -0.14 -1.52 0.20 0.00 1.28 0.00 0.00 41.25 41.08 2wdr s ASN 172 CO 0.03 -2.24 0.55 0.00 -2.04 0.00 0.00 177.10 173.40 2wdr n GLN 173 N -3.56 0.31 0.00 3.55 10.64 -1.26 -0.96 117.38 126.09 2wdr n GLN 173 Ca 0.07 0.00 0.07 0.00 -1.83 0.00 0.00 57.00 55.31 2wdr n GLN 173 Cb 0.59 -1.17 0.02 0.00 -0.86 0.00 0.00 30.24 28.83 2wdr n GLN 173 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2wdr n ASP 174 N -0.67 1.81 0.00 2.61 8.00 -1.26 -4.97 116.55 122.07 2wdr n ASP 174 Ca 0.03 -1.41 0.00 0.00 0.71 0.00 0.00 54.79 54.12 2wdr n ASP 174 Cb 0.01 0.28 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 2wdr n ASP 174 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wdr n GLY 175 N 0.99 0.75 3.83 0.44 0.00 -0.14 -5.05 105.19 106.01 2wdr n GLY 175 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 2wdr n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdr s ALA 176 N -2.68 3.35 -0.32 4.61 0.00 -1.26 -4.79 121.76 120.68 2wdr s ALA 176 Ca 0.00 0.11 -0.22 0.00 0.00 0.00 0.00 51.96 51.85 2wdr s ALA 176 Cb 0.00 -2.81 -0.00 0.00 0.00 0.00 0.00 23.12 20.31 2wdr s ALA 176 CO 0.00 0.32 0.72 0.08 0.00 0.00 0.00 175.76 176.88 2wdr s VAL 177 N -1.79 4.84 -0.38 0.00 1.01 0.39 -0.92 120.40 123.55 2wdr s VAL 177 Ca 0.50 0.97 0.05 0.00 0.00 0.00 0.00 61.98 63.49 2wdr s VAL 177 Cb -0.13 -4.10 0.46 0.00 0.00 0.00 0.00 36.38 32.61 2wdr s VAL 177 CO 0.19 -0.25 1.40 1.33 0.00 0.00 0.00 175.10 177.76 2wdr n VAL 178 N 5.54 2.78 0.00 2.92 0.24 0.06 -4.27 118.33 125.60 2wdr n VAL 178 Ca 0.02 -3.86 0.00 0.00 -2.04 0.00 0.00 64.34 58.46 2wdr n VAL 178 Cb 0.48 -1.10 0.00 0.00 -1.47 0.00 0.00 33.84 31.75 2wdr n VAL 178 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wdr n GLY 179 N -0.78 0.38 3.56 7.63 0.00 -1.25 -3.20 105.19 111.54 2wdr n GLY 179 Ca 0.48 -2.28 -0.10 0.00 0.00 0.00 0.00 46.02 44.12 2wdr n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdr s THR 181 N -3.84 5.11 0.00 0.00 -4.23 -0.96 -0.87 115.64 110.85 2wdr s THR 181 Ca 0.07 0.19 -0.07 0.00 -1.18 0.00 0.00 61.69 60.69 2wdr s THR 181 Cb -0.02 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.20 2wdr s THR 181 CO -0.04 0.07 0.14 0.00 -0.54 0.00 0.00 174.62 174.25 2wdr s ALA 182 N -1.63 -0.34 -0.24 3.99 0.00 -0.38 -0.42 121.76 122.74 2wdr s ALA 182 Ca 0.40 -0.12 -0.06 0.00 0.00 0.00 0.00 51.96 52.18 2wdr s ALA 182 Cb -0.12 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 2wdr s ALA 182 CO 0.23 -0.21 0.04 -1.17 0.00 0.00 0.00 175.76 174.65 2wdr s LEU 183 N -1.37 3.30 -0.33 0.00 2.96 0.19 -1.17 118.68 122.26 2wdr s LEU 183 Ca -0.15 -0.25 -0.29 0.00 -0.22 0.00 0.00 54.13 53.23 2wdr s LEU 183 Cb -0.07 -1.87 -0.00 0.00 0.50 0.00 0.00 46.19 44.74 2wdr s LEU 183 CO 0.02 -0.02 1.49 0.00 -1.32 0.00 0.00 176.35 176.52 2wdr h ILE 185 N 6.34 1.25 0.36 0.00 2.04 -1.74 0.33 117.51 126.09 2wdr h ILE 185 Ca -0.30 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 2wdr h ILE 185 Cb 1.12 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2wdr h ILE 185 CO 1.05 0.27 -0.17 -0.08 0.00 0.00 0.00 178.15 179.22 2wdr h GLU 186 N 1.26 -0.46 0.00 2.37 4.81 -1.89 -2.09 114.58 118.58 2wdr h GLU 186 Ca 0.32 0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.54 2wdr h GLU 186 Cb -0.03 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2wdr h GLU 186 CO -0.06 -0.21 -1.70 0.25 -0.73 0.00 0.00 179.01 176.57 2wdr n THR 187 N -5.23 0.40 -0.31 0.32 -2.24 -1.18 -1.37 114.28 104.67 2wdr n THR 187 Ca -0.10 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 2wdr n THR 187 Cb 0.25 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 2wdr n THR 187 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wdr n GLY 188 N 1.29 1.22 3.76 3.38 0.00 0.12 -4.56 105.19 110.40 2wdr n GLY 188 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 2wdr n GLY 188 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wdr s GLU 189 N -0.42 3.44 -0.10 1.61 2.12 -1.25 -4.67 118.70 119.44 2wdr s GLU 189 Ca 0.00 2.32 0.03 0.00 0.36 0.00 0.00 54.97 57.68 2wdr s GLU 189 Cb 0.00 -2.47 -0.01 0.00 0.26 0.00 0.00 34.13 31.91 2wdr s GLU 189 CO 0.00 -0.98 -0.18 0.08 -0.54 0.00 0.00 175.26 173.64 2wdr s VAL 190 N -1.25 2.66 0.13 3.70 1.01 -1.26 -0.35 120.40 125.04 2wdr s VAL 190 Ca 0.66 -0.82 0.04 0.00 0.00 0.00 0.00 61.98 61.85 2wdr s VAL 190 Cb -0.42 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 2wdr s VAL 190 CO 0.52 0.55 -0.09 -0.69 0.00 0.00 0.00 175.10 175.39 2wdr s VAL 191 N 0.05 1.02 -0.33 2.92 1.01 -0.32 -4.47 120.40 120.29 2wdr s VAL 191 Ca -0.07 -2.02 -0.08 0.00 0.00 0.00 0.00 61.98 59.81 2wdr s VAL 191 Cb -0.15 -1.81 0.02 0.00 0.00 0.00 0.00 36.38 34.44 2wdr s VAL 191 CO 0.05 -0.78 0.12 -0.47 0.00 0.00 0.00 175.10 174.02 2wdr s TYR 192 N -3.42 3.20 -0.34 5.22 5.04 -0.58 -1.25 117.35 125.22 2wdr s TYR 192 Ca 0.15 -1.05 -0.24 0.00 -2.44 0.00 0.00 57.07 53.49 2wdr s TYR 192 Cb 0.03 -2.31 0.01 0.00 0.35 0.00 0.00 41.96 40.04 2wdr s TYR 192 CO -0.01 -0.62 0.83 -0.06 -1.34 0.00 0.00 175.55 174.35 2wdr s PHE 193 N 1.50 3.14 -0.28 4.97 0.08 -0.05 -0.87 117.98 126.47 2wdr s PHE 193 Ca 0.01 0.73 -0.10 0.00 0.12 0.00 0.00 56.93 57.70 2wdr s PHE 193 Cb -0.18 -3.40 -0.04 0.00 -0.57 0.00 0.00 43.02 38.83 2wdr s PHE 193 CO 0.04 -0.69 0.14 0.21 -0.10 0.00 0.00 175.22 174.82 2wdr s LYS 194 N 3.16 3.75 0.02 0.44 2.20 0.47 -1.50 119.74 128.27 2wdr s LYS 194 Ca 0.34 -0.44 -0.00 0.00 -0.36 0.00 0.00 55.97 55.51 2wdr s LYS 194 Cb -0.13 -3.53 -0.02 0.00 -1.51 0.00 0.00 37.83 32.64 2wdr s LYS 194 CO 0.16 -0.22 -0.02 0.00 -0.36 0.00 0.00 175.35 174.90 2wdr s ALA 195 N 1.69 0.10 -0.79 3.13 0.00 -1.19 -0.45 121.76 124.24 2wdr s ALA 195 Ca 0.06 -0.47 0.25 0.00 0.00 0.00 0.00 51.96 51.81 2wdr s ALA 195 Cb -0.16 0.12 0.94 0.00 0.00 0.00 0.00 23.12 24.02 2wdr s ALA 195 CO 0.08 -0.13 1.77 0.54 0.00 0.00 0.00 175.76 178.02 2wdr n ARG 196 N 1.91 0.15 -3.34 0.00 1.74 -0.77 -3.87 116.66 112.48 2wdr n ARG 196 Ca -0.22 0.20 -0.09 0.00 -0.77 0.00 0.00 57.85 56.97 2wdr n ARG 196 Cb 0.56 -1.70 -0.08 0.00 -1.02 0.00 0.00 32.46 30.22 2wdr n ARG 196 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wdr s ALA 197 N -3.10 -1.10 -0.35 7.54 0.00 -0.94 -4.45 121.76 119.34 2wdr s ALA 197 Ca 0.10 0.75 -0.14 0.00 0.00 0.00 0.00 51.96 52.67 2wdr s ALA 197 Cb 0.13 -1.76 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 2wdr s ALA 197 CO 0.51 -1.37 0.29 0.99 0.00 0.00 0.00 175.76 176.18 2wdr s THR 198 N 2.54 5.24 -0.41 0.00 2.01 0.78 -1.61 115.64 124.19 2wdr s THR 198 Ca 0.12 -0.21 -0.14 0.00 0.31 0.00 0.00 61.69 61.77 2wdr s THR 198 Cb -0.15 -3.79 0.02 0.00 0.01 0.00 0.00 72.50 68.59 2wdr s THR 198 CO -0.19 -0.10 0.29 -0.69 -0.69 0.00 0.00 174.62 173.24 2wdr s VAL 199 N 1.82 5.16 -0.09 3.82 1.01 -0.50 -0.63 120.40 131.00 2wdr s VAL 199 Ca 0.08 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 61.07 2wdr s VAL 199 Cb -0.17 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 2wdr s VAL 199 CO 0.11 -0.30 1.06 -0.76 0.00 0.00 0.00 175.10 175.20 2wdr s LEU 200 N 1.66 4.26 -0.41 3.92 1.43 0.22 -1.25 118.68 128.52 2wdr s LEU 200 Ca 0.05 1.62 0.09 0.00 -1.03 0.00 0.00 54.13 54.86 2wdr s LEU 200 Cb -0.19 -3.56 0.33 0.00 0.03 0.00 0.00 46.19 42.80 2wdr s LEU 200 CO 0.09 -0.47 0.87 0.00 0.23 0.00 0.00 176.35 177.07 2wdr n ALA 201 N 4.99 0.85 0.32 4.21 0.00 0.05 -1.61 120.51 129.33 2wdr n ALA 201 Ca 0.09 -2.60 0.11 0.00 0.00 0.00 0.00 53.44 51.04 2wdr n ALA 201 Cb 0.48 -1.03 0.18 0.00 0.00 0.00 0.00 19.45 19.09 2wdr n ALA 201 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wdr n THR 202 N 0.42 0.46 -4.30 0.00 -2.24 -1.23 -4.13 114.28 103.25 2wdr n THR 202 Ca 0.17 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2wdr n THR 202 Cb 0.67 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.91 2wdr n THR 202 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wdr n GLY 203 N 1.32 -0.66 0.00 3.38 0.00 -1.26 -4.82 105.19 103.15 2wdr n GLY 203 Ca 0.17 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2wdr n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdr n GLY 204 N 0.00 -0.21 1.47 -0.02 0.00 -1.26 -3.64 105.19 101.52 2wdr n GLY 204 Ca 0.00 -1.81 -0.01 0.00 0.00 0.00 0.00 46.02 44.21 2wdr n GLY 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdr n ALA 205 N -3.00 2.93 0.00 4.61 0.00 -1.25 -2.48 120.51 121.31 2wdr n ALA 205 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 53.44 51.75 2wdr n ALA 205 Cb 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 18.85 2wdr n ALA 205 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdr n GLY 206 N 0.13 -0.18 0.37 0.00 0.00 -1.23 -1.64 105.19 102.64 2wdr n GLY 206 Ca -0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.08 2wdr n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wdr n ARG 207 N -1.15 1.46 0.00 1.61 5.12 -1.12 -2.75 116.66 119.83 2wdr n ARG 207 Ca 0.00 -0.74 0.10 0.00 -1.93 0.00 0.00 57.85 55.28 2wdr n ARG 207 Cb 0.02 -1.48 0.48 0.00 -1.16 0.00 0.00 32.46 30.31 2wdr n ARG 207 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 2wdr n ILE 208 N -0.12 0.47 -3.26 0.55 -5.35 -0.65 -4.80 119.36 106.19 2wdr n ILE 208 Ca 0.19 0.12 -0.20 0.00 -0.27 0.00 0.00 62.75 62.59 2wdr n ILE 208 Cb 0.31 -0.78 0.05 0.00 -1.74 0.00 0.00 39.64 37.47 2wdr n ILE 208 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2wdr n TYR 209 N -1.36 -1.89 -0.06 4.28 4.01 -1.11 -4.16 117.16 116.88 2wdr n TYR 209 Ca 0.08 -2.01 -0.07 0.00 -0.16 0.00 0.00 57.90 55.73 2wdr n TYR 209 Cb 0.19 -0.48 -0.15 0.00 -0.31 0.00 0.00 39.34 38.58 2wdr n TYR 209 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2wdr n GLN 210 N -2.04 0.67 -4.10 -0.72 7.27 -1.25 -4.77 117.38 112.44 2wdr n GLN 210 Ca 0.11 0.08 -0.22 0.00 0.07 0.00 0.00 57.00 57.04 2wdr n GLN 210 Cb 0.56 -1.62 -0.17 0.00 2.41 0.00 0.00 30.24 31.42 2wdr n GLN 210 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2wdr s SER 211 N -5.62 1.39 0.04 1.69 0.15 -1.26 -5.06 113.70 105.03 2wdr s SER 211 Ca -0.08 -0.17 -0.13 0.00 0.70 0.00 0.00 55.95 56.27 2wdr s SER 211 Cb 0.07 -0.56 0.02 0.00 -1.71 0.00 0.00 66.02 63.84 2wdr s SER 211 CO 0.83 -0.08 0.29 0.28 1.20 0.00 0.00 173.24 175.76 2wdr s THR 212 N 1.23 0.08 -0.94 6.45 -1.32 -1.26 -3.46 115.64 116.42 2wdr s THR 212 Ca -0.06 -0.69 0.28 0.00 -1.21 0.00 0.00 61.69 60.01 2wdr s THR 212 Cb -0.14 -0.91 0.25 0.00 -1.51 0.00 0.00 72.50 70.19 2wdr s THR 212 CO -0.02 -0.38 1.89 0.35 -2.21 0.00 0.00 174.62 174.25 2wdr n THR 213 N 0.64 0.14 -2.41 5.08 -2.24 -0.25 -4.52 114.28 110.73 2wdr n THR 213 Ca -0.19 -0.05 -0.35 0.00 -2.27 0.00 0.00 64.05 61.19 2wdr n THR 213 Cb 0.59 -0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 68.27 2wdr n THR 213 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2wdr s ASN 214 N -3.31 6.14 0.96 3.42 0.02 -1.26 -4.73 114.94 116.18 2wdr s ASN 214 Ca 0.13 2.07 -0.11 0.00 -1.02 0.00 0.00 52.86 53.93 2wdr s ASN 214 Cb 0.17 -2.58 0.17 0.00 0.02 0.00 0.00 41.25 39.04 2wdr s ASN 214 CO 0.54 -0.92 1.09 0.00 0.02 0.00 0.00 177.10 177.83 2wdr s ALA 215 N -1.82 1.06 0.55 0.60 0.00 -1.26 -4.88 121.76 116.00 2wdr s ALA 215 Ca 0.68 0.16 0.30 0.00 0.00 0.00 0.00 51.96 53.11 2wdr s ALA 215 Cb -0.21 -3.30 1.78 0.00 0.00 0.00 0.00 23.12 21.39 2wdr s ALA 215 CO 0.25 -2.83 2.22 0.45 0.00 0.00 0.00 175.76 175.86 2wdr h HIS 216 N -1.90 0.00 -0.09 0.00 3.86 -2.00 -2.03 115.15 112.99 2wdr h HIS 216 Ca -0.50 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.71 2wdr h HIS 216 Cb 1.29 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.76 2wdr h HIS 216 CO 0.42 0.03 0.00 0.44 0.86 0.00 0.00 177.93 179.68 2wdr n ILE 217 N -3.73 0.11 -2.81 2.45 -5.35 -1.26 -4.60 119.36 104.16 2wdr n ILE 217 Ca -0.03 -0.23 -0.44 0.00 -0.27 0.00 0.00 62.75 61.78 2wdr n ILE 217 Cb 0.12 0.20 0.00 0.00 -1.74 0.00 0.00 39.64 38.22 2wdr n ILE 217 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2wdr n ASN 218 N -0.03 5.13 -1.36 7.28 4.13 -0.76 -4.77 115.26 124.87 2wdr n ASN 218 Ca 0.17 -2.96 -0.10 0.00 1.68 0.00 0.00 54.58 53.36 2wdr n ASN 218 Cb 0.26 -1.62 0.14 0.00 -1.54 0.00 0.00 39.78 37.02 2wdr n ASN 218 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 2wdr n THR 219 N 5.07 2.54 -2.96 3.41 -2.24 -1.23 -2.79 114.28 116.08 2wdr n THR 219 Ca 0.41 -3.35 -0.11 0.00 -2.27 0.00 0.00 64.05 58.72 2wdr n THR 219 Cb 0.43 -0.61 -0.02 0.00 -2.10 0.00 0.00 70.33 68.04 2wdr n THR 219 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wdr n GLY 220 N -0.99 -0.48 0.44 3.38 0.00 -1.04 -3.35 105.19 103.15 2wdr n GLY 220 Ca 0.35 0.02 0.27 0.00 0.00 0.00 0.00 46.02 46.67 2wdr n GLY 220 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wdr h ASP 221 N -0.26 0.34 -0.08 1.61 3.32 -1.86 -0.02 116.42 119.47 2wdr h ASP 221 Ca -0.18 0.08 -0.17 0.00 0.02 0.00 0.00 57.03 56.78 2wdr h ASP 221 Cb 1.12 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 2wdr h ASP 221 CO 0.25 0.02 -0.54 1.23 -1.72 0.00 0.00 179.24 178.48 2wdr h GLY 222 N 0.28 0.73 0.90 2.75 0.00 -1.87 -1.32 103.07 104.54 2wdr h GLY 222 Ca 0.64 -0.84 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 2wdr h GLY 222 CO -0.28 0.75 -0.06 -2.08 0.00 0.00 0.00 176.54 174.87 2wdr h VAL 223 N 0.51 1.28 0.27 4.60 2.07 -1.39 -1.41 116.25 122.17 2wdr h VAL 223 Ca 0.01 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.43 2wdr h VAL 223 Cb 1.11 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 2wdr h VAL 223 CO 0.11 0.35 -0.13 1.23 0.02 0.00 0.00 177.57 179.15 2wdr h GLY 224 N 0.38 -0.37 0.39 2.17 0.00 -1.33 -0.25 103.07 104.07 2wdr h GLY 224 Ca 0.08 0.14 0.12 0.00 0.00 0.00 0.00 47.33 47.67 2wdr h GLY 224 CO 0.03 -0.14 0.50 -0.33 0.00 0.00 0.00 176.54 176.61 2wdr h MET 225 N -0.46 0.76 -0.01 4.80 2.86 -1.19 -0.33 114.93 121.36 2wdr h MET 225 Ca -0.04 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2wdr h MET 225 Cb 0.34 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 2wdr h MET 225 CO 0.06 0.50 -0.00 0.00 1.06 0.00 0.00 176.91 178.53 2wdr h ALA 226 N 1.52 0.02 -0.32 6.32 0.00 -1.03 -2.26 119.26 123.50 2wdr h ALA 226 Ca 0.45 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.23 2wdr h ALA 226 Cb 0.51 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2wdr h ALA 226 CO -0.30 -0.29 0.01 0.82 0.00 0.00 0.00 179.25 179.49 2wdr h ILE 227 N -0.34 0.78 0.00 0.00 2.04 -0.47 0.90 117.51 120.41 2wdr h ILE 227 Ca 0.00 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2wdr h ILE 227 Cb 0.38 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2wdr h ILE 227 CO 0.00 0.02 0.00 0.03 0.00 0.00 0.00 178.15 178.20 2wdr h ARG 228 N 0.10 0.00 -0.00 2.37 3.08 -1.04 -0.30 114.38 118.59 2wdr h ARG 228 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2wdr h ARG 228 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2wdr h ARG 228 CO -0.25 0.00 -0.41 0.00 -1.07 0.00 0.00 179.97 178.24 2wdr n ALA 229 N -1.96 3.39 -0.22 0.04 0.00 0.15 -4.91 120.51 117.00 2wdr n ALA 229 Ca -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2wdr n ALA 229 Cb 0.15 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.50 2wdr n ALA 229 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdr n GLY 230 N 1.43 0.89 3.68 0.00 0.00 -0.12 -5.06 105.19 106.01 2wdr n GLY 230 Ca 0.09 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 2wdr n GLY 230 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wdr s VAL 231 N -2.00 5.25 0.69 1.61 1.01 -0.29 -4.73 120.40 121.94 2wdr s VAL 231 Ca 0.00 0.58 -0.16 0.00 0.00 0.00 0.00 61.98 62.40 2wdr s VAL 231 Cb 0.00 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.73 2wdr s VAL 231 CO 0.00 0.30 1.19 -2.16 0.00 0.00 0.00 175.10 174.43 2wdr s PRO 232 N 1.07 2.41 0.28 2.72 0.04 -1.26 -3.72 135.00 136.54 2wdr s PRO 232 Ca 0.16 1.71 0.11 0.00 0.04 0.00 0.00 61.00 63.03 2wdr s PRO 232 Cb -0.14 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 2wdr s PRO 232 CO 0.06 -1.62 -0.14 0.14 0.04 0.00 0.00 177.00 175.48 2wdr s VAL 233 N -1.96 2.76 0.02 -0.36 -7.23 -1.18 -4.44 120.40 108.01 2wdr s VAL 233 Ca 0.74 -2.27 0.03 0.00 -1.81 0.00 0.00 61.98 58.67 2wdr s VAL 233 Cb -0.28 -2.46 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 2wdr s VAL 233 CO 0.42 -0.39 -0.09 -1.58 -0.31 0.00 0.00 175.10 173.14 2wdr s GLN 234 N -3.56 0.67 -1.37 4.82 0.74 -0.31 -0.84 119.66 119.82 2wdr s GLN 234 Ca 0.30 -0.55 -0.09 0.00 0.05 0.00 0.00 55.36 55.07 2wdr s GLN 234 Cb -0.05 -0.60 0.06 0.00 1.10 0.00 0.00 33.01 33.51 2wdr s GLN 234 CO 0.16 0.15 0.56 -0.25 -0.55 0.00 0.00 175.29 175.37 2wdr n ASP 235 N 2.18 -4.26 0.00 6.67 8.00 0.31 -2.05 116.55 127.40 2wdr n ASP 235 Ca -0.17 -0.42 0.05 0.00 0.71 0.00 0.00 54.79 54.95 2wdr n ASP 235 Cb 0.56 -3.49 0.24 0.00 -0.02 0.00 0.00 41.12 38.41 2wdr n ASP 235 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2wdr n MET 236 N -3.89 0.14 0.01 -1.24 2.81 -1.26 -1.99 117.12 111.70 2wdr n MET 236 Ca -0.03 0.19 0.11 0.00 -1.81 0.00 0.00 57.70 56.17 2wdr n MET 236 Cb 0.55 -1.50 0.09 0.00 -0.71 0.00 0.00 33.22 31.65 2wdr n MET 236 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 2wdr n GLU 237 N -1.28 0.11 -2.67 0.03 0.00 -1.26 -4.51 120.64 111.06 2wdr n GLU 237 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 57.16 56.79 2wdr n GLU 237 Cb 0.08 -1.54 -0.03 0.00 0.00 0.00 0.00 31.44 29.95 2wdr n GLU 237 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.13 175.49 2wdr s MET 238 N -3.08 3.46 -0.18 3.44 -1.94 -0.84 -4.62 119.30 115.54 2wdr s MET 238 Ca 0.08 -1.04 -0.03 0.00 -1.71 0.00 0.00 55.69 52.99 2wdr s MET 238 Cb 0.16 -4.90 -0.02 0.00 2.01 0.00 0.00 34.83 32.08 2wdr s MET 238 CO 0.77 -2.06 -0.06 -1.58 -0.01 0.00 0.00 175.02 172.08 2wdr s TRP 239 N 4.55 2.94 -0.22 -0.03 0.52 -1.26 -2.40 118.94 123.04 2wdr s TRP 239 Ca 0.38 -0.65 -0.21 0.00 0.02 0.00 0.00 56.10 55.65 2wdr s TRP 239 Cb -0.05 -1.99 -0.02 0.00 -1.15 0.00 0.00 33.47 30.26 2wdr s TRP 239 CO -0.03 -0.29 0.63 -1.14 0.02 0.00 0.00 176.95 176.14 2wdr s GLN 240 N 0.82 4.17 -0.38 4.98 0.74 -0.61 -4.82 119.66 124.57 2wdr s GLN 240 Ca -0.02 0.59 -0.14 0.00 0.05 0.00 0.00 55.36 55.84 2wdr s GLN 240 Cb -0.15 -3.61 0.00 0.00 1.10 0.00 0.00 33.01 30.36 2wdr s GLN 240 CO 0.01 -0.32 0.30 -0.06 -0.55 0.00 0.00 175.29 174.67 2wdr s PHE 241 N 2.17 3.23 0.22 1.67 0.08 -1.26 -1.62 117.98 122.47 2wdr s PHE 241 Ca 0.28 -0.37 -0.32 0.00 0.12 0.00 0.00 56.93 56.64 2wdr s PHE 241 Cb -0.16 -2.58 -0.12 0.00 -0.57 0.00 0.00 43.02 39.59 2wdr s PHE 241 CO 0.09 -0.50 1.70 1.58 -0.10 0.00 0.00 175.22 177.99 2wdr n HIS 242 N 5.20 2.74 -0.29 0.36 -0.00 -0.05 -4.59 115.22 118.59 2wdr n HIS 242 Ca -0.11 0.09 0.04 0.00 -0.00 0.00 0.00 57.72 57.73 2wdr n HIS 242 Cb 0.48 -2.65 0.18 0.00 -0.00 0.00 0.00 29.99 28.00 2wdr n HIS 242 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2wdr h PRO 243 N 6.41 0.71 -3.02 1.57 0.13 -1.87 -0.41 132.00 135.52 2wdr h PRO 243 Ca -0.44 -0.04 -0.66 0.00 -0.87 0.00 0.00 66.00 63.99 2wdr h PRO 243 Cb 1.21 -0.16 -0.39 0.00 0.13 0.00 0.00 31.00 31.79 2wdr h PRO 243 CO 0.93 0.47 -0.34 0.25 -0.23 0.00 0.00 178.00 179.07 2wdr n THR 244 N -4.79 2.41 -3.21 1.56 -2.24 -1.26 -2.11 114.28 104.64 2wdr n THR 244 Ca 0.14 -5.06 -0.27 0.00 -2.27 0.00 0.00 64.05 56.59 2wdr n THR 244 Cb 0.31 -2.24 -0.02 0.00 -2.10 0.00 0.00 70.33 66.28 2wdr n THR 244 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2wdr s GLY 245 N -1.19 1.64 -0.02 3.38 0.00 -0.96 -2.37 107.32 107.81 2wdr s GLY 245 Ca 0.29 -0.64 -0.30 0.00 0.00 0.00 0.00 44.72 44.06 2wdr s GLY 245 CO -0.12 -0.54 1.36 -0.42 0.00 0.00 0.00 173.10 173.39 2wdr s ILE 246 N -2.28 3.82 0.23 0.90 1.01 0.11 -1.22 121.20 123.78 2wdr s ILE 246 Ca 0.44 1.19 -0.32 0.00 0.00 0.00 0.00 60.65 61.96 2wdr s ILE 246 Cb -0.10 -3.77 -0.13 0.00 0.01 0.00 0.00 42.46 38.47 2wdr s ILE 246 CO 0.34 -0.01 1.51 0.00 0.00 0.00 0.00 174.94 176.79 2wdr n ALA 247 N 5.40 1.59 -1.66 9.38 0.00 0.64 -1.21 120.51 134.64 2wdr n ALA 247 Ca 0.13 0.41 -0.16 0.00 0.00 0.00 0.00 53.44 53.81 2wdr n ALA 247 Cb 0.44 -2.35 -0.06 0.00 0.00 0.00 0.00 19.45 17.49 2wdr n ALA 247 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdr n GLY 248 N 2.58 1.21 0.41 0.00 0.00 -1.11 -4.74 105.19 103.54 2wdr n GLY 248 Ca 0.13 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2wdr n GLY 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdr n ALA 249 N 0.61 1.89 0.00 4.61 0.00 -0.75 -5.04 120.51 121.83 2wdr n ALA 249 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2wdr n ALA 249 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2wdr n ALA 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdr n GLY 250 N 1.07 3.12 3.69 0.00 0.00 -0.35 -4.90 105.19 107.82 2wdr n GLY 250 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2wdr n GLY 250 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wdr s VAL 251 N -2.04 3.13 0.31 1.61 1.01 -1.26 -3.44 120.40 119.73 2wdr s VAL 251 Ca 0.00 0.57 -0.29 0.00 0.00 0.00 0.00 61.98 62.26 2wdr s VAL 251 Cb 0.00 -3.36 -0.10 0.00 0.00 0.00 0.00 36.38 32.92 2wdr s VAL 251 CO 0.00 -0.00 1.22 -0.22 0.00 0.00 0.00 175.10 176.10 2wdr s LEU 252 N 2.64 4.47 -0.09 3.92 2.96 -1.26 -0.71 118.68 130.61 2wdr s LEU 252 Ca 0.73 2.52 0.02 0.00 -0.22 0.00 0.00 54.13 57.18 2wdr s LEU 252 Cb -0.39 -3.65 -0.02 0.00 0.50 0.00 0.00 46.19 42.63 2wdr s LEU 252 CO 0.31 -0.39 -0.13 0.68 -1.32 0.00 0.00 176.35 175.50 2wdr s VAL 253 N -1.16 3.08 0.61 1.68 -7.23 -1.00 -4.86 120.40 111.53 2wdr s VAL 253 Ca 0.47 -0.68 -0.19 0.00 -1.81 0.00 0.00 61.98 59.77 2wdr s VAL 253 Cb -0.37 -2.25 -0.02 0.00 0.56 0.00 0.00 36.38 34.30 2wdr s VAL 253 CO 0.48 0.56 1.31 0.28 -0.31 0.00 0.00 175.10 177.42 2wdr s THR 254 N -0.22 2.06 -0.82 5.32 -1.32 -1.26 -4.74 115.64 114.66 2wdr s THR 254 Ca 0.01 0.04 0.15 0.00 -1.21 0.00 0.00 61.69 60.68 2wdr s THR 254 Cb -0.13 -3.02 0.14 0.00 -1.51 0.00 0.00 72.50 67.98 2wdr s THR 254 CO 0.03 -0.01 1.47 1.21 -2.21 0.00 0.00 174.62 175.12 2wdr n GLU 255 N -1.61 0.06 0.31 7.08 2.13 -1.26 -1.71 120.64 125.64 2wdr n GLU 255 Ca 0.14 0.35 0.18 0.00 0.66 0.00 0.00 57.16 58.49 2wdr n GLU 255 Cb 0.47 -1.62 0.98 0.00 0.27 0.00 0.00 31.44 31.54 2wdr n GLU 255 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2wdr h GLY 256 N 1.93 0.00 1.32 8.31 0.00 -1.89 -1.47 103.07 111.27 2wdr h GLY 256 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2wdr h GLY 256 CO 0.00 0.00 0.26 0.00 0.00 0.00 0.00 176.54 176.80 2wdr h ARG 258 N 0.87 0.00 0.00 0.00 3.08 -1.56 -0.51 114.38 116.27 2wdr h ARG 258 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2wdr h ARG 258 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2wdr h ARG 258 CO -0.02 0.55 0.00 0.78 -1.07 0.00 0.00 179.97 180.21 2wdr h GLY 259 N 3.45 0.00 -0.30 0.04 0.00 -1.09 -2.58 103.07 102.59 2wdr h GLY 259 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2wdr h GLY 259 CO 0.08 0.00 -0.54 1.18 0.00 0.00 0.00 176.54 177.26 2wdr n GLU 260 N -2.99 0.75 0.00 4.80 -0.58 -0.58 -4.06 120.64 117.98 2wdr n GLU 260 Ca 0.00 -0.57 0.00 0.00 -0.42 0.00 0.00 57.16 56.17 2wdr n GLU 260 Cb 0.25 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 2wdr n GLU 260 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wdr n GLY 261 N 1.43 0.49 3.84 0.62 0.00 -0.97 -5.03 105.19 105.56 2wdr n GLY 261 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 2wdr n GLY 261 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wdr s GLY 262 N -0.70 2.10 0.14 -0.02 0.00 -0.20 -4.98 107.32 103.66 2wdr s GLY 262 Ca 0.00 0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.90 2wdr s GLY 262 CO 0.00 0.43 -0.02 -2.52 0.00 0.00 0.00 173.10 170.99 2wdr s TYR 263 N -2.52 1.04 -0.10 1.90 -0.85 -1.18 -4.39 117.35 111.26 2wdr s TYR 263 Ca 0.58 -1.01 -0.16 0.00 -0.52 0.00 0.00 57.07 55.96 2wdr s TYR 263 Cb -0.10 -0.60 -0.05 0.00 0.38 0.00 0.00 41.96 41.60 2wdr s TYR 263 CO 0.28 -0.23 0.40 -0.51 -1.52 0.00 0.00 175.55 173.98 2wdr s LEU 264 N -3.11 4.33 0.09 -3.49 1.43 -1.26 -1.67 118.68 114.99 2wdr s LEU 264 Ca 0.19 0.77 0.10 0.00 -1.03 0.00 0.00 54.13 54.16 2wdr s LEU 264 Cb 0.06 -2.57 -0.03 0.00 0.03 0.00 0.00 46.19 43.68 2wdr s LEU 264 CO 0.00 0.13 -0.24 -0.76 0.23 0.00 0.00 176.35 175.70 2wdr s LEU 265 N 0.08 2.35 0.00 1.79 1.43 0.45 -3.61 118.68 121.17 2wdr s LEU 265 Ca 0.23 -0.63 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2wdr s LEU 265 Cb -0.15 -1.32 0.02 0.00 0.03 0.00 0.00 46.19 44.77 2wdr s LEU 265 CO 0.09 0.22 0.15 -0.46 0.23 0.00 0.00 176.35 176.58 2wdr n ASN 266 N 1.29 0.30 0.29 2.29 0.23 -1.02 -1.28 115.26 117.37 2wdr n ASN 266 Ca -0.17 -1.23 0.20 0.00 -0.53 0.00 0.00 54.58 52.84 2wdr n ASN 266 Cb 0.52 -0.08 1.00 0.00 -2.08 0.00 0.00 39.78 39.14 2wdr n ASN 266 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 2wdr h LYS 267 N 0.00 0.00 -0.02 -3.83 2.10 -0.93 0.75 116.57 114.64 2wdr h LYS 267 Ca -0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 2wdr h LYS 267 Cb 0.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.54 2wdr h LYS 267 CO 0.06 0.00 -0.23 0.72 -2.00 0.00 0.00 179.45 178.01 2wdr n HIS 268 N -2.92 0.00 -0.82 0.07 8.25 -1.26 -4.95 115.22 113.59 2wdr n HIS 268 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2wdr n HIS 268 Cb 0.12 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.21 2wdr n HIS 268 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wdr n GLY 269 N 1.36 0.52 3.71 -1.41 0.00 0.26 -5.03 105.19 104.60 2wdr n GLY 269 Ca 0.12 -0.62 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 2wdr n GLY 269 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wdr s GLU 270 N -1.18 4.47 -1.07 1.61 2.12 -1.26 -4.82 118.70 118.57 2wdr s GLU 270 Ca 0.00 1.12 -0.21 0.00 0.36 0.00 0.00 54.97 56.24 2wdr s GLU 270 Cb 0.00 -3.47 -0.08 0.00 0.26 0.00 0.00 34.13 30.84 2wdr s GLU 270 CO 0.00 -0.03 1.93 -2.13 -0.54 0.00 0.00 175.26 174.50 2wdr n ARG 271 N 4.00 1.91 0.00 4.30 0.63 -1.26 -2.44 116.66 123.79 2wdr n ARG 271 Ca 0.02 -2.36 0.04 0.00 -0.92 0.00 0.00 57.85 54.63 2wdr n ARG 271 Cb 0.51 -3.35 0.17 0.00 0.45 0.00 0.00 32.46 30.24 2wdr n ARG 271 CO 0.00 0.00 0.00 1.97 -2.51 0.00 0.00 177.63 177.09 2wdr n PHE 272 N 10.17 0.00 0.18 -0.14 1.16 -1.24 -2.42 117.46 125.17 2wdr n PHE 272 Ca 0.48 0.00 0.06 0.00 -1.87 0.00 0.00 57.45 56.12 2wdr n PHE 272 Cb 0.43 -0.38 0.20 0.00 -1.61 0.00 0.00 39.48 38.13 2wdr n PHE 272 CO 0.00 0.00 0.00 0.52 -1.87 0.00 0.00 176.76 175.41 2wdr h MET 273 N 0.00 0.00 0.00 3.97 2.86 -1.86 -2.87 114.93 117.03 2wdr h MET 273 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2wdr h MET 273 Cb 0.09 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 2wdr h MET 273 CO 0.00 0.36 -0.08 0.93 1.06 0.00 0.00 176.91 179.18 2wdr h GLU 274 N 0.00 0.00 0.00 1.72 5.08 -1.69 0.12 114.58 119.81 2wdr h GLU 274 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2wdr h GLU 274 Cb 1.11 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 2wdr h GLU 274 CO 0.05 0.08 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.01 2wdr h ARG 275 N 0.00 0.00 0.00 2.33 2.43 -1.71 -3.25 114.38 114.18 2wdr h ARG 275 Ca -0.00 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 2wdr h ARG 275 Cb 0.31 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2wdr h ARG 275 CO 0.01 0.72 -0.44 1.88 -1.51 0.00 0.00 179.97 180.63 2wdr h TYR 276 N -1.00 0.00 -2.15 2.20 0.05 -1.42 -3.38 116.97 111.27 2wdr h TYR 276 Ca -0.01 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.31 2wdr h TYR 276 Cb 0.73 0.00 -0.34 0.00 1.01 0.00 0.00 36.73 38.13 2wdr h TYR 276 CO 0.19 0.44 -0.78 0.00 -1.05 0.00 0.00 178.16 176.96 2wdr s ALA 277 N -4.01 0.19 0.20 3.88 0.00 0.41 -4.80 121.76 117.63 2wdr s ALA 277 Ca -0.02 -1.48 -0.11 0.00 0.00 0.00 0.00 51.96 50.35 2wdr s ALA 277 Cb 0.14 -1.88 0.25 0.00 0.00 0.00 0.00 23.12 21.62 2wdr s ALA 277 CO 0.73 -2.11 1.73 -1.35 0.00 0.00 0.00 175.76 174.76 2wdr h PRO 278 N 6.65 0.31 0.04 0.00 0.11 -1.68 0.18 132.00 137.60 2wdr h PRO 278 Ca 0.10 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.19 2wdr h PRO 278 Cb 1.01 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.05 2wdr h PRO 278 CO 0.23 0.21 -0.02 -0.91 -0.21 0.00 0.00 178.00 177.30 2wdr h ASN 279 N 0.32 -0.04 1.45 -2.05 2.35 -1.85 -3.38 115.58 112.38 2wdr h ASN 279 Ca 0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 2wdr h ASN 279 Cb 0.37 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.76 2wdr h ASN 279 CO -0.33 0.32 0.00 0.00 -1.65 0.00 0.00 177.43 175.77 2wdr h ALA 280 N -1.28 1.00 -0.67 -0.83 0.00 -1.20 -3.48 119.26 112.80 2wdr h ALA 280 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wdr h ALA 280 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2wdr h ALA 280 CO 0.01 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.89 2wdr n LYS 281 N -3.02 0.00 0.00 0.00 5.02 0.61 -0.83 118.16 119.94 2wdr n LYS 281 Ca 0.02 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.43 2wdr n LYS 281 Cb 0.40 0.00 0.68 0.00 -0.02 0.00 0.00 35.03 36.09 2wdr n LYS 281 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2wdr n ASP 282 N 5.55 0.00 -0.93 4.39 8.00 -1.26 -2.76 116.55 129.55 2wdr n ASP 282 Ca 0.00 -1.11 0.02 0.00 0.71 0.00 0.00 54.79 54.41 2wdr n ASP 282 Cb 0.00 0.00 0.21 0.00 -0.02 0.00 0.00 41.12 41.31 2wdr n ASP 282 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2wdr n LEU 283 N -0.89 3.76 -4.64 0.64 4.77 -0.01 -4.94 117.00 115.70 2wdr n LEU 283 Ca 0.17 -3.51 -0.30 0.00 -0.03 0.00 0.00 56.01 52.35 2wdr n LEU 283 Cb 0.08 -0.58 0.22 0.00 -2.33 0.00 0.00 43.42 40.81 2wdr n LEU 283 CO 0.13 1.05 0.65 0.00 -1.33 0.00 0.00 177.39 177.89 2wdr s ALA 284 N -3.09 0.83 0.79 -1.18 0.00 -1.11 -1.15 121.76 116.83 2wdr s ALA 284 Ca 0.42 -0.82 -0.16 0.00 0.00 0.00 0.00 51.96 51.40 2wdr s ALA 284 Cb 0.37 -2.93 -0.06 0.00 0.00 0.00 0.00 23.12 20.50 2wdr s ALA 284 CO 0.02 -3.30 0.18 0.41 0.00 0.00 0.00 175.76 173.07 2wdr n GLY 285 N -1.22 -2.42 0.19 0.00 0.00 -1.26 -4.21 105.19 96.27 2wdr n GLY 285 Ca 0.11 -0.50 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 2wdr n GLY 285 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wdr h ARG 286 N -0.66 0.63 -0.72 1.61 3.08 -1.94 -2.07 114.38 114.30 2wdr h ARG 286 Ca -0.44 -0.46 0.06 0.00 0.07 0.00 0.00 59.98 59.21 2wdr h ARG 286 Cb 1.34 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 31.43 2wdr h ARG 286 CO 0.37 1.08 0.48 0.38 -1.07 0.00 0.00 179.97 181.21 2wdr h ASP 287 N 0.30 0.68 0.08 7.04 2.03 -1.91 -0.70 116.42 123.93 2wdr h ASP 287 Ca -0.02 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.28 2wdr h ASP 287 Cb 1.13 -0.14 0.00 0.00 -0.83 0.00 0.00 39.33 39.49 2wdr h ASP 287 CO 0.11 0.44 -0.04 0.58 -1.03 0.00 0.00 179.24 179.30 2wdr h VAL 288 N 0.77 1.16 -0.71 4.15 2.07 -1.88 -2.45 116.25 119.36 2wdr h VAL 288 Ca 0.31 -1.34 0.08 0.00 0.82 0.00 0.00 66.70 66.56 2wdr h VAL 288 Cb 0.24 1.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.93 2wdr h VAL 288 CO -0.10 0.31 0.47 0.58 0.02 0.00 0.00 177.57 178.84 2wdr h VAL 289 N -0.77 0.99 0.05 2.57 2.07 -1.23 -0.52 116.25 119.40 2wdr h VAL 289 Ca -0.01 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 2wdr h VAL 289 Cb 0.59 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2wdr h VAL 289 CO 0.02 0.13 -0.02 0.00 0.02 0.00 0.00 177.57 177.71 2wdr h ALA 290 N 1.62 -0.07 -0.67 1.67 0.00 -1.11 -2.46 119.26 118.25 2wdr h ALA 290 Ca 0.31 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 2wdr h ALA 290 Cb 0.34 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2wdr h ALA 290 CO -0.11 -0.49 0.10 0.00 0.00 0.00 0.00 179.25 178.75 2wdr h ARG 291 N -0.15 1.12 -0.16 0.00 3.08 -0.92 -2.32 114.38 115.02 2wdr h ARG 291 Ca -0.01 -0.31 0.03 0.00 0.07 0.00 0.00 59.98 59.77 2wdr h ARG 291 Cb 0.13 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 2wdr h ARG 291 CO 0.01 1.03 -0.05 0.77 -1.07 0.00 0.00 179.97 180.66 2wdr h SER 292 N 1.04 -0.19 -0.49 7.04 0.02 -1.04 0.35 113.55 120.28 2wdr h SER 292 Ca 0.20 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.18 2wdr h SER 292 Cb 0.46 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.09 2wdr h SER 292 CO 0.02 -0.07 0.23 0.40 -1.14 0.00 0.00 176.83 176.27 2wdr h ILE 293 N -0.02 1.19 -0.08 3.27 2.04 -1.35 -0.84 117.51 121.71 2wdr h ILE 293 Ca 0.08 -0.55 -0.15 0.00 1.00 0.00 0.00 64.86 65.24 2wdr h ILE 293 Cb 0.14 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2wdr h ILE 293 CO -0.18 0.22 -0.60 0.24 0.00 0.00 0.00 178.15 177.83 2wdr h MET 294 N 0.75 0.28 -0.12 2.37 2.86 -0.75 -2.57 114.93 117.76 2wdr h MET 294 Ca 0.18 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2wdr h MET 294 Cb 0.11 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 2wdr h MET 294 CO -0.02 0.80 -0.09 0.82 1.06 0.00 0.00 176.91 179.48 2wdr h ILE 295 N 0.21 1.34 -0.94 -1.22 2.04 0.19 -1.39 117.51 117.74 2wdr h ILE 295 Ca -0.01 -1.19 0.20 0.00 1.00 0.00 0.00 64.86 64.87 2wdr h ILE 295 Cb 1.11 1.87 -0.08 0.00 -0.74 0.00 0.00 36.82 38.98 2wdr h ILE 295 CO 0.10 0.34 0.61 -0.33 0.00 0.00 0.00 178.15 178.87 2wdr h GLU 296 N -0.11 0.50 -0.02 2.37 4.39 -1.12 -0.80 114.58 119.78 2wdr h GLU 296 Ca 0.02 -0.03 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 2wdr h GLU 296 Cb 0.58 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2wdr h GLU 296 CO 0.02 0.33 -0.48 0.82 -1.16 0.00 0.00 179.01 178.54 2wdr h ILE 297 N 0.51 1.44 0.00 3.13 2.04 -1.41 0.37 117.51 123.59 2wdr h ILE 297 Ca 0.51 -1.97 0.00 0.00 1.00 0.00 0.00 64.86 64.40 2wdr h ILE 297 Cb 1.12 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.73 2wdr h ILE 297 CO -0.24 0.57 0.00 0.54 0.00 0.00 0.00 178.15 179.02 2wdr n ARG 298 N -4.31 0.38 -0.84 2.37 1.74 -0.38 -1.43 116.66 114.20 2wdr n ARG 298 Ca -0.10 0.03 0.05 0.00 -0.77 0.00 0.00 57.85 57.07 2wdr n ARG 298 Cb 0.61 -1.50 0.12 0.00 -1.02 0.00 0.00 32.46 30.67 2wdr n ARG 298 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2wdr n GLU 299 N -1.05 0.88 -1.12 5.56 1.02 -0.77 -4.99 120.64 120.18 2wdr n GLU 299 Ca 0.09 -2.59 -0.04 0.00 -0.02 0.00 0.00 57.16 54.60 2wdr n GLU 299 Cb 0.06 -0.96 -0.02 0.00 -0.02 0.00 0.00 31.44 30.50 2wdr n GLU 299 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wdr n GLY 300 N -0.51 0.61 0.91 0.62 0.00 -0.51 -4.84 105.19 101.47 2wdr n GLY 300 Ca 0.13 -0.20 0.11 0.00 0.00 0.00 0.00 46.02 46.05 2wdr n GLY 300 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wdr n ARG 301 N -1.61 2.19 -1.78 1.61 1.74 0.06 -4.95 116.66 113.91 2wdr n ARG 301 Ca -0.04 -1.79 -0.31 0.00 -0.77 0.00 0.00 57.85 54.94 2wdr n ARG 301 Cb 0.29 -1.46 0.03 0.00 -1.02 0.00 0.00 32.46 30.30 2wdr n ARG 301 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2wdr s GLY 302 N -1.52 1.65 0.38 -0.13 0.00 -0.82 -0.36 107.32 106.52 2wdr s GLY 302 Ca 0.36 -0.11 0.04 0.00 0.00 0.00 0.00 44.72 45.01 2wdr s GLY 302 CO 0.29 0.20 0.54 0.00 0.00 0.00 0.00 173.10 174.13 2wdr s ASP 304 N -4.19 0.62 0.00 0.00 -1.08 -1.26 -1.63 116.67 109.13 2wdr s ASP 304 Ca 0.46 -1.28 0.00 0.00 -0.52 0.00 0.00 52.55 51.21 2wdr s ASP 304 Cb -0.10 0.26 0.00 0.00 -1.46 0.00 0.00 42.92 41.62 2wdr s ASP 304 CO 0.34 -0.72 0.00 0.61 0.52 0.00 0.00 175.17 175.91 2wdr n GLY 305 N -0.24 -0.55 0.00 2.66 0.00 -1.26 -4.93 105.19 100.86 2wdr n GLY 305 Ca -0.03 -1.04 0.01 0.00 0.00 0.00 0.00 46.02 44.97 2wdr n GLY 305 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wdr n PRO 306 N 0.00 0.02 0.04 1.61 -0.02 -1.26 -2.16 135.00 133.22 2wdr n PRO 306 Ca 0.00 0.38 0.11 0.00 -2.02 0.00 0.00 63.50 61.97 2wdr n PRO 306 Cb 0.00 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.95 2wdr n PRO 306 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2wdr n TRP 307 N -1.42 0.37 -0.09 6.00 8.01 -1.26 -4.99 117.44 124.05 2wdr n TRP 307 Ca 0.01 0.11 0.00 0.00 -1.31 0.00 0.00 57.50 56.31 2wdr n TRP 307 Cb 0.03 -0.56 0.00 0.00 -2.01 0.00 0.00 31.31 28.77 2wdr n TRP 307 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2wdr n GLY 308 N 1.31 -3.67 3.68 6.99 0.00 -0.92 -2.75 105.19 109.82 2wdr n GLY 308 Ca 0.00 -1.96 -0.45 0.00 0.00 0.00 0.00 46.02 43.62 2wdr n GLY 308 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wdr n PRO 309 N -0.24 2.08 -3.75 1.61 -0.02 -1.26 -4.25 135.00 129.17 2wdr n PRO 309 Ca 0.00 0.74 -0.08 0.00 -2.02 0.00 0.00 63.50 62.14 2wdr n PRO 309 Cb 0.00 -2.41 -0.02 0.00 -0.02 0.00 0.00 33.50 31.05 2wdr n PRO 309 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2wdr s HIS 310 N -0.03 -0.27 0.20 6.00 -3.43 -0.65 -4.87 115.29 112.24 2wdr s HIS 310 Ca 0.68 -0.12 0.06 0.00 -0.80 0.00 0.00 55.06 54.88 2wdr s HIS 310 Cb -0.64 0.67 -0.04 0.00 -1.43 0.00 0.00 32.58 31.14 2wdr s HIS 310 CO 0.49 -1.12 0.15 0.00 -2.00 0.00 0.00 174.74 172.26 2wdr s ALA 311 N -3.84 3.56 -0.15 -1.38 0.00 -0.48 -1.00 121.76 118.47 2wdr s ALA 311 Ca 0.09 -1.29 -0.17 0.00 0.00 0.00 0.00 51.96 50.58 2wdr s ALA 311 Cb -0.05 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 2wdr s ALA 311 CO 0.02 0.42 0.45 0.15 0.00 0.00 0.00 175.76 176.79 2wdr s LYS 312 N -3.35 4.28 -0.37 0.00 -0.14 -0.40 -1.40 119.74 118.36 2wdr s LYS 312 Ca 0.31 0.35 -0.10 0.00 -1.36 0.00 0.00 55.97 55.18 2wdr s LYS 312 Cb -0.09 -3.47 0.03 0.00 -1.68 0.00 0.00 37.83 32.62 2wdr s LYS 312 CO 0.24 0.08 0.18 -1.17 -0.76 0.00 0.00 175.35 173.93 2wdr s LEU 313 N 0.89 4.65 -0.18 3.17 2.96 -0.08 -0.41 118.68 129.67 2wdr s LEU 313 Ca 0.23 -1.06 -0.19 0.00 -0.22 0.00 0.00 54.13 52.89 2wdr s LEU 313 Cb -0.15 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 2wdr s LEU 313 CO 0.09 -0.38 0.53 -0.75 -1.32 0.00 0.00 176.35 174.52 2wdr s LYS 314 N 1.51 4.22 0.00 1.98 2.20 -0.67 -0.59 119.74 128.39 2wdr s LYS 314 Ca 0.01 0.46 0.00 0.00 -0.36 0.00 0.00 55.97 56.08 2wdr s LYS 314 Cb -0.19 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.58 2wdr s LYS 314 CO 0.06 -0.12 0.00 1.28 -0.36 0.00 0.00 175.35 176.21 2wdr n LEU 315 N 4.65 0.00 0.03 5.43 4.77 -1.26 -3.09 117.00 127.52 2wdr n LEU 315 Ca -0.04 0.00 0.22 0.00 -0.03 0.00 0.00 56.01 56.15 2wdr n LEU 315 Cb 0.50 0.00 0.73 0.00 -2.33 0.00 0.00 43.42 42.33 2wdr n LEU 315 CO 0.42 0.00 1.19 -2.24 -1.33 0.00 0.00 177.39 175.44 2wdr h ASP 316 N 0.00 0.00 0.23 -1.43 3.04 -1.81 0.58 116.42 117.03 2wdr h ASP 316 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 2wdr h ASP 316 Cb 0.11 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.40 2wdr h ASP 316 CO 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 177.20 2wdr n HIS 317 N -3.93 0.00 0.29 4.15 1.44 -1.26 -2.19 115.22 113.72 2wdr n HIS 317 Ca 0.10 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.93 2wdr n HIS 317 Cb 0.67 -0.14 0.18 0.00 0.12 0.00 0.00 29.99 30.82 2wdr n HIS 317 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2wdr h LEU 318 N 0.00 0.00 0.00 2.39 3.38 -1.26 -3.50 115.31 116.32 2wdr h LEU 318 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2wdr h LEU 318 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2wdr h LEU 318 CO 0.00 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2wdr n GLY 319 N 1.17 0.00 0.29 0.83 0.00 -0.93 -4.33 105.19 102.23 2wdr n GLY 319 Ca 0.03 -1.43 0.08 0.00 0.00 0.00 0.00 46.02 44.71 2wdr n GLY 319 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2wdr h LYS 320 N 0.00 0.34 -0.05 1.61 3.64 -1.90 -1.96 116.57 118.24 2wdr h LYS 320 Ca 0.00 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2wdr h LYS 320 Cb 0.00 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 2wdr h LYS 320 CO 0.00 0.22 -0.08 1.49 -2.27 0.00 0.00 179.45 178.81 2wdr h GLU 321 N 0.35 -0.12 -0.49 1.90 4.81 -1.99 -0.21 114.58 118.83 2wdr h GLU 321 Ca 0.47 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.62 2wdr h GLU 321 Cb 0.83 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.22 2wdr h GLU 321 CO -0.51 -0.08 -0.06 0.28 -0.73 0.00 0.00 179.01 177.92 2wdr h VAL 322 N -0.12 1.27 0.01 0.32 2.07 -1.65 -1.96 116.25 116.18 2wdr h VAL 322 Ca 0.05 -1.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.40 2wdr h VAL 322 Cb 0.19 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2wdr h VAL 322 CO -0.13 0.41 -0.00 -0.07 0.02 0.00 0.00 177.57 177.80 2wdr h LEU 323 N 0.76 -0.01 -1.68 2.57 3.38 -1.00 0.24 115.31 119.58 2wdr h LEU 323 Ca 0.13 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2wdr h LEU 323 Cb 0.60 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 2wdr h LEU 323 CO 0.04 0.00 -0.15 -0.33 0.09 0.00 0.00 178.44 178.09 2wdr h GLU 324 N -0.02 0.00 0.00 1.13 5.08 -0.99 0.24 114.58 120.02 2wdr h GLU 324 Ca -0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 2wdr h GLU 324 Cb 0.01 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2wdr h GLU 324 CO 0.00 0.15 -0.93 1.03 -1.00 0.00 0.00 179.01 178.26 2wdr h SER 325 N 0.00 0.00 0.91 1.42 0.87 -0.96 -3.36 113.55 112.43 2wdr h SER 325 Ca -0.00 -0.45 -0.08 0.00 -1.23 0.00 0.00 61.79 60.03 2wdr h SER 325 Cb 0.46 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 2wdr h SER 325 CO 0.02 1.26 -1.14 0.03 -0.53 0.00 0.00 176.83 176.47 2wdr h ARG 326 N -1.00 0.00 -0.37 2.24 2.47 -0.56 -3.42 114.38 113.74 2wdr h ARG 326 Ca -0.23 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.24 2wdr h ARG 326 Cb 1.07 0.00 -0.39 0.00 -1.65 0.00 0.00 29.97 29.00 2wdr h ARG 326 CO -0.14 0.15 -1.08 1.28 0.56 0.00 0.00 179.97 180.74 2wdr n LEU 327 N -2.81 1.70 0.30 3.04 4.77 0.81 -3.25 117.00 121.55 2wdr n LEU 327 Ca -0.04 -2.96 0.17 0.00 -0.03 0.00 0.00 56.01 53.15 2wdr n LEU 327 Cb 0.69 0.33 0.93 0.00 -2.33 0.00 0.00 43.42 43.05 2wdr n LEU 327 CO 0.41 1.01 1.08 1.55 -1.33 0.00 0.00 177.39 180.12 2wdr h PRO 328 N 2.28 0.00 -0.12 3.23 0.13 -1.64 -2.87 132.00 133.00 2wdr h PRO 328 Ca -0.12 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.96 2wdr h PRO 328 Cb 1.39 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.52 2wdr h PRO 328 CO 0.20 0.04 -0.10 0.78 -0.23 0.00 0.00 178.00 178.68 2wdr h GLY 329 N 0.52 0.31 2.00 1.56 0.00 -1.89 -2.89 103.07 102.69 2wdr h GLY 329 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2wdr h GLY 329 CO 0.00 0.28 0.00 0.16 0.00 0.00 0.00 176.54 176.98 2wdr h ILE 330 N -0.10 0.00 0.22 2.60 -0.00 -1.84 -2.02 117.51 116.37 2wdr h ILE 330 Ca 0.02 -0.57 -0.01 0.00 -0.00 0.00 0.00 64.86 64.31 2wdr h ILE 330 Cb 0.61 1.53 -0.00 0.00 -0.00 0.00 0.00 36.82 38.96 2wdr h ILE 330 CO 0.03 0.00 -0.11 -0.07 -0.00 0.00 0.00 178.15 177.99 2wdr h LEU 331 N 0.00 -0.28 -0.89 0.16 3.38 -1.37 0.94 115.31 117.24 2wdr h LEU 331 Ca 0.00 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2wdr h LEU 331 Cb 0.60 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2wdr h LEU 331 CO 0.00 -0.19 -0.29 -0.33 0.09 0.00 0.00 178.44 177.72 2wdr h GLU 332 N -0.31 0.47 -0.15 1.13 5.08 -1.31 -2.18 114.58 117.32 2wdr h GLU 332 Ca -0.03 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.11 2wdr h GLU 332 Cb 0.24 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 2wdr h GLU 332 CO 0.04 0.72 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.66 2wdr h LEU 333 N 0.41 0.29 -0.69 1.33 3.38 -1.24 -0.02 115.31 118.78 2wdr h LEU 333 Ca 0.06 -0.37 -0.10 0.00 0.09 0.00 0.00 57.88 57.56 2wdr h LEU 333 Cb 0.72 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 2wdr h LEU 333 CO 0.06 0.60 -0.04 -1.28 0.09 0.00 0.00 178.44 177.86 2wdr h SER 334 N -0.02 0.96 -0.45 -0.43 0.87 -0.81 0.10 113.55 113.77 2wdr h SER 334 Ca 0.04 -0.28 -0.10 0.00 -1.23 0.00 0.00 61.79 60.22 2wdr h SER 334 Cb 0.47 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2wdr h SER 334 CO 0.02 1.03 -0.11 0.03 -0.53 0.00 0.00 176.83 177.27 2wdr h ARG 335 N 0.88 0.87 -0.04 2.24 3.08 -1.13 -1.33 114.38 118.96 2wdr h ARG 335 Ca 0.15 -0.34 -0.13 0.00 0.07 0.00 0.00 59.98 59.74 2wdr h ARG 335 Cb 0.57 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.59 2wdr h ARG 335 CO 0.03 0.98 -0.48 1.15 -1.07 0.00 0.00 179.97 180.58 2wdr h THR 336 N 0.71 1.42 -0.02 2.04 2.02 -0.73 -2.42 112.91 115.94 2wdr h THR 336 Ca 0.11 -1.92 0.00 0.00 0.77 0.00 0.00 66.41 65.37 2wdr h THR 336 Cb 0.66 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.52 2wdr h THR 336 CO 0.05 0.56 -0.07 0.49 0.37 0.00 0.00 175.52 176.92 2wdr n PHE 337 N -4.30 0.00 -0.03 3.16 3.72 0.00 -4.45 117.46 115.56 2wdr n PHE 337 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 2wdr n PHE 337 Cb 0.60 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.14 2wdr n PHE 337 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wdr n ALA 338 N 0.65 0.90 -3.85 4.37 0.00 -0.55 -4.84 120.51 117.18 2wdr n ALA 338 Ca 0.08 -0.01 -0.30 0.00 0.00 0.00 0.00 53.44 53.21 2wdr n ALA 338 Cb 0.37 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.83 2wdr n ALA 338 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2wdr n HIS 339 N -0.42 -2.12 -4.67 0.00 8.25 -0.91 -4.96 115.22 110.40 2wdr n HIS 339 Ca 0.00 0.81 -0.26 0.00 -0.26 0.00 0.00 57.72 58.01 2wdr n HIS 339 Cb 0.01 -3.66 -0.17 0.00 1.12 0.00 0.00 29.99 27.29 2wdr n HIS 339 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2wdr s VAL 340 N -3.23 1.25 -0.58 1.59 1.01 -1.03 -4.98 120.40 114.43 2wdr s VAL 340 Ca 0.63 -0.55 -0.18 0.00 0.00 0.00 0.00 61.98 61.88 2wdr s VAL 340 Cb -0.32 -1.13 0.11 0.00 0.00 0.00 0.00 36.38 35.03 2wdr s VAL 340 CO 0.78 0.38 0.67 -0.62 0.00 0.00 0.00 175.10 176.31 2wdr s ASP 341 N 0.61 6.19 0.43 3.32 2.15 -1.26 -2.60 116.67 125.51 2wdr s ASP 341 Ca -0.15 -1.50 0.20 0.00 0.43 0.00 0.00 52.55 51.53 2wdr s ASP 341 Cb -0.16 -2.29 1.09 0.00 -0.30 0.00 0.00 42.92 41.26 2wdr s ASP 341 CO 0.04 -1.07 1.56 -0.65 -0.17 0.00 0.00 175.17 174.88 2wdr h PRO 342 N 9.13 0.00 0.00 4.34 0.11 -1.89 0.22 132.00 143.91 2wdr h PRO 342 Ca -0.29 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 2wdr h PRO 342 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2wdr h PRO 342 CO 1.09 0.00 -0.43 0.28 -0.21 0.00 0.00 178.00 178.74 2wdr h VAL 343 N 0.00 1.12 0.00 3.15 2.07 -1.93 -3.23 116.25 117.42 2wdr h VAL 343 Ca 0.00 -1.56 -0.26 0.00 0.82 0.00 0.00 66.70 65.70 2wdr h VAL 343 Cb 0.52 1.89 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 2wdr h VAL 343 CO 0.00 0.42 -1.81 0.29 0.02 0.00 0.00 177.57 176.49 2wdr n LYS 344 N -3.76 0.37 -4.35 1.57 4.76 0.69 -4.62 118.16 112.83 2wdr n LYS 344 Ca -0.01 0.16 -0.28 0.00 -2.87 0.00 0.00 58.31 55.31 2wdr n LYS 344 Cb 0.49 -1.13 -0.12 0.00 -1.84 0.00 0.00 35.03 32.44 2wdr n LYS 344 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2wdr s GLU 345 N -2.36 1.66 0.58 1.97 2.12 -0.72 -4.84 118.70 117.10 2wdr s GLU 345 Ca -0.24 -1.31 -0.20 0.00 0.36 0.00 0.00 54.97 53.58 2wdr s GLU 345 Cb 0.09 -2.01 -0.04 0.00 0.26 0.00 0.00 34.13 32.42 2wdr s GLU 345 CO 0.31 0.45 1.18 -2.30 -0.54 0.00 0.00 175.26 174.35 2wdr n PRO 346 N 0.64 1.25 -3.25 4.30 -0.02 -1.26 -3.84 135.00 132.82 2wdr n PRO 346 Ca -0.15 0.47 -0.38 0.00 -2.02 0.00 0.00 63.50 61.42 2wdr n PRO 346 Cb 0.54 -2.38 -0.06 0.00 -0.02 0.00 0.00 33.50 31.58 2wdr n PRO 346 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2wdr s ILE 347 N -1.39 5.14 -0.38 4.25 1.01 0.25 -4.77 121.20 125.31 2wdr s ILE 347 Ca 0.75 1.05 -0.29 0.00 0.00 0.00 0.00 60.65 62.16 2wdr s ILE 347 Cb -0.42 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.19 2wdr s ILE 347 CO 0.47 0.28 1.53 -2.16 0.00 0.00 0.00 174.94 175.06 2wdr s PRO 348 N 0.87 3.52 0.33 2.79 0.04 -1.26 -0.91 135.00 140.39 2wdr s PRO 348 Ca 0.28 1.11 0.08 0.00 0.04 0.00 0.00 61.00 62.51 2wdr s PRO 348 Cb -0.16 -4.07 -0.07 0.00 0.04 0.00 0.00 34.50 30.25 2wdr s PRO 348 CO 0.11 -1.63 -0.05 0.14 0.04 0.00 0.00 177.00 175.61 2wdr s VAL 349 N 5.83 1.90 -0.28 -0.36 -7.23 -0.49 -0.26 120.40 119.51 2wdr s VAL 349 Ca 0.67 -2.12 -0.24 0.00 -1.81 0.00 0.00 61.98 58.48 2wdr s VAL 349 Cb -0.17 -2.66 0.12 0.00 0.56 0.00 0.00 36.38 34.23 2wdr s VAL 349 CO 0.33 -0.18 0.98 -0.51 -0.31 0.00 0.00 175.10 175.41 2wdr s ILE 350 N -2.83 0.00 0.26 -0.62 2.07 -0.35 -1.38 121.20 118.35 2wdr s ILE 350 Ca 0.32 0.00 -0.28 0.00 -1.41 0.00 0.00 60.65 59.28 2wdr s ILE 350 Cb 0.05 -1.00 -0.15 0.00 0.13 0.00 0.00 42.46 41.49 2wdr s ILE 350 CO 0.15 0.00 0.94 -2.65 -1.91 0.00 0.00 174.94 171.47 2wdr n PRO 351 N 2.41 1.11 -3.84 3.50 -0.02 -0.90 -2.27 135.00 135.00 2wdr n PRO 351 Ca -0.13 0.39 -0.12 0.00 -2.02 0.00 0.00 63.50 61.62 2wdr n PRO 351 Cb 0.56 -1.71 -0.13 0.00 -0.02 0.00 0.00 33.50 32.19 2wdr n PRO 351 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2wdr s THR 352 N -0.98 -0.00 0.05 3.45 2.01 -0.16 -4.84 115.64 115.17 2wdr s THR 352 Ca 0.61 0.02 -0.35 0.00 0.31 0.00 0.00 61.69 62.27 2wdr s THR 352 Cb -0.75 -0.11 -0.14 0.00 0.01 0.00 0.00 72.50 71.50 2wdr s THR 352 CO 0.59 0.01 1.61 0.00 -0.69 0.00 0.00 174.62 176.13 2wdr n HIS 354 N 4.11 -0.15 -3.83 0.00 -0.00 -0.64 -1.09 115.22 113.62 2wdr n HIS 354 Ca 0.19 0.03 -0.12 0.00 -0.00 0.00 0.00 57.72 57.82 2wdr n HIS 354 Cb 0.25 0.33 -0.12 0.00 -0.00 0.00 0.00 29.99 30.45 2wdr n HIS 354 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 2wdr s TYR 355 N -2.00 -0.12 -0.64 1.57 5.04 -1.05 -4.72 117.35 115.43 2wdr s TYR 355 Ca 0.00 0.29 -0.17 0.00 -2.44 0.00 0.00 57.07 54.75 2wdr s TYR 355 Cb 0.00 0.04 0.14 0.00 0.35 0.00 0.00 41.96 42.48 2wdr s TYR 355 CO 0.00 -0.09 0.67 1.41 -1.34 0.00 0.00 175.55 176.20 2wdr s MET 356 N -0.09 3.16 0.41 4.97 -2.45 -1.26 -1.57 119.30 122.47 2wdr s MET 356 Ca -0.02 -1.70 0.10 0.00 -1.25 0.00 0.00 55.69 52.82 2wdr s MET 356 Cb -0.02 -4.35 0.92 0.00 1.25 0.00 0.00 34.83 32.63 2wdr s MET 356 CO 0.00 -1.44 1.99 0.52 1.05 0.00 0.00 175.02 177.15 2wdr h MET 357 N 8.80 0.51 0.00 4.11 2.86 -1.80 -3.45 114.93 125.96 2wdr h MET 357 Ca -0.19 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2wdr h MET 357 Cb 1.08 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.62 2wdr h MET 357 CO 1.02 0.34 0.00 0.41 1.06 0.00 0.00 176.91 179.73 2wdr n GLY 358 N -1.49 -1.73 0.00 8.32 0.00 -1.24 -4.70 105.19 104.34 2wdr n GLY 358 Ca 0.08 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.55 2wdr n GLY 358 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdr n GLY 359 N 3.72 0.78 3.67 -0.02 0.00 -0.87 -4.32 105.19 108.14 2wdr n GLY 359 Ca 0.00 -2.03 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 2wdr n GLY 359 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wdr s ILE 360 N -1.52 3.93 0.22 -0.61 1.01 -0.10 -1.16 121.20 122.96 2wdr s ILE 360 Ca 0.00 1.16 -0.31 0.00 0.00 0.00 0.00 60.65 61.50 2wdr s ILE 360 Cb 0.00 -3.75 -0.11 0.00 0.01 0.00 0.00 42.46 38.61 2wdr s ILE 360 CO 0.00 -0.08 1.62 -2.16 0.00 0.00 0.00 174.94 174.32 2wdr s PRO 361 N 3.46 4.16 0.05 2.79 0.04 -1.25 -0.68 135.00 143.56 2wdr s PRO 361 Ca 0.63 2.50 0.00 0.00 0.04 0.00 0.00 61.00 64.17 2wdr s PRO 361 Cb -0.28 -3.09 -0.03 0.00 0.04 0.00 0.00 34.50 31.14 2wdr s PRO 361 CO 0.22 -0.65 -0.04 0.95 0.04 0.00 0.00 177.00 177.52 2wdr s THR 362 N 0.80 0.29 0.89 1.26 -4.23 -0.99 0.30 115.64 113.97 2wdr s THR 362 Ca 0.69 -1.49 -0.14 0.00 -1.18 0.00 0.00 61.69 59.58 2wdr s THR 362 Cb -0.47 -1.08 0.14 0.00 1.34 0.00 0.00 72.50 72.43 2wdr s THR 362 CO 0.36 -0.77 1.21 -0.54 -0.54 0.00 0.00 174.62 174.34 2wdr s LYS 363 N -2.93 1.26 0.39 3.99 1.02 -0.92 -4.56 119.74 117.98 2wdr s LYS 363 Ca -0.01 -0.02 0.08 0.00 0.02 0.00 0.00 55.97 56.04 2wdr s LYS 363 Cb 0.00 -1.88 0.83 0.00 -0.52 0.00 0.00 37.83 36.26 2wdr s LYS 363 CO -0.05 -2.06 1.98 0.28 -0.92 0.00 0.00 175.35 174.58 2wdr h VAL 364 N -1.39 1.00 -0.03 3.17 2.07 -1.91 -1.47 116.25 117.68 2wdr h VAL 364 Ca -0.46 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 66.85 2wdr h VAL 364 Cb 1.30 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 2wdr h VAL 364 CO 0.55 0.12 0.06 0.71 0.02 0.00 0.00 177.57 179.03 2wdr h THR 365 N 0.64 0.28 0.00 2.57 1.35 -1.93 -3.41 112.91 112.41 2wdr h THR 365 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.14 2wdr h THR 365 Cb 0.28 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 67.65 2wdr h THR 365 CO -0.09 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.79 2wdr n GLY 366 N -1.24 0.99 3.69 5.82 0.00 -0.55 -3.77 105.19 110.13 2wdr n GLY 366 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2wdr n GLY 366 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wdr s GLN 367 N -0.70 4.17 0.36 1.61 -0.21 -1.26 -0.35 119.66 123.27 2wdr s GLN 367 Ca 0.00 2.47 -0.27 0.00 0.02 0.00 0.00 55.36 57.59 2wdr s GLN 367 Cb 0.00 -3.59 -0.09 0.00 1.00 0.00 0.00 33.01 30.33 2wdr s GLN 367 CO 0.00 -0.79 1.14 0.00 -2.12 0.00 0.00 175.29 173.52 2wdr s ALA 368 N 2.67 3.25 0.05 6.09 0.00 -0.13 -2.17 121.76 131.52 2wdr s ALA 368 Ca 0.78 0.93 0.04 0.00 0.00 0.00 0.00 51.96 53.71 2wdr s ALA 368 Cb -0.43 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 2wdr s ALA 368 CO 0.34 -0.38 -0.05 -0.51 0.00 0.00 0.00 175.76 175.16 2wdr s LEU 369 N -2.15 3.27 0.27 0.00 1.43 0.15 -0.78 118.68 120.86 2wdr s LEU 369 Ca 0.53 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.45 2wdr s LEU 369 Cb -0.31 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 2wdr s LEU 369 CO 0.39 0.22 0.12 0.28 0.23 0.00 0.00 176.35 177.59 2wdr s THR 370 N -1.16 0.43 0.10 5.49 -1.32 0.58 -4.61 115.64 115.15 2wdr s THR 370 Ca 0.21 -2.00 0.07 0.00 -1.21 0.00 0.00 61.69 58.77 2wdr s THR 370 Cb -0.11 -2.58 -0.04 0.00 -1.51 0.00 0.00 72.50 68.26 2wdr s THR 370 CO 0.13 0.00 -0.13 0.68 -2.21 0.00 0.00 174.62 173.08 2wdr s VAL 371 N -3.72 3.14 0.65 5.08 -7.23 -1.26 0.72 120.40 117.78 2wdr s VAL 371 Ca 0.37 -1.31 -0.02 0.00 -1.81 0.00 0.00 61.98 59.20 2wdr s VAL 371 Cb 0.07 -2.44 0.13 0.00 0.56 0.00 0.00 36.38 34.70 2wdr s VAL 371 CO 0.15 0.15 0.90 -0.46 -0.31 0.00 0.00 175.10 175.52 2wdr n ASN 372 N 0.87 1.01 0.33 4.85 0.23 -0.51 -4.89 115.26 117.16 2wdr n ASN 372 Ca -0.15 -1.90 0.22 0.00 -0.53 0.00 0.00 54.58 52.22 2wdr n ASN 372 Cb 0.52 -0.60 1.16 0.00 -2.08 0.00 0.00 39.78 38.78 2wdr n ASN 372 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2wdr h GLU 373 N 0.00 0.00 -0.00 -3.83 4.11 -2.01 0.25 114.58 113.09 2wdr h GLU 373 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.14 2wdr h GLU 373 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2wdr h GLU 373 CO 0.30 0.00 -0.33 1.63 0.07 0.00 0.00 179.01 180.68 2wdr n LYS 374 N -3.16 0.41 -0.24 1.06 5.02 -1.26 -4.93 118.16 115.06 2wdr n LYS 374 Ca -0.03 -0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.04 2wdr n LYS 374 Cb 0.09 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2wdr n LYS 374 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wdr n GLY 375 N 1.41 0.76 3.82 0.72 0.00 0.87 -5.05 105.19 107.72 2wdr n GLY 375 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 2wdr n GLY 375 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wdr s GLU 376 N -0.67 3.29 0.30 1.61 2.02 -1.26 -4.71 118.70 119.28 2wdr s GLU 376 Ca 0.00 1.02 -0.28 0.00 0.02 0.00 0.00 54.97 55.73 2wdr s GLU 376 Cb 0.00 -2.04 -0.09 0.00 0.10 0.00 0.00 34.13 32.10 2wdr s GLU 376 CO 0.00 -0.82 1.09 -0.51 0.02 0.00 0.00 175.26 175.04 2wdr s ASP 377 N -3.37 7.18 0.02 -0.19 1.11 -1.26 -1.42 116.67 118.73 2wdr s ASP 377 Ca 0.60 2.23 0.02 0.00 0.18 0.00 0.00 52.55 55.57 2wdr s ASP 377 Cb -0.14 -2.62 -0.01 0.00 1.07 0.00 0.00 42.92 41.22 2wdr s ASP 377 CO 0.45 -0.20 -0.07 -0.69 1.18 0.00 0.00 175.17 175.84 2wdr s VAL 378 N -1.25 0.49 0.10 -1.27 1.01 0.22 -4.85 120.40 114.86 2wdr s VAL 378 Ca 0.47 -0.60 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 2wdr s VAL 378 Cb -0.30 -0.48 -0.06 0.00 0.00 0.00 0.00 36.38 35.54 2wdr s VAL 378 CO 0.39 -0.08 0.91 -0.69 0.00 0.00 0.00 175.10 175.62 2wdr s VAL 379 N -0.65 4.54 -0.46 2.92 1.01 -1.26 -0.31 120.40 126.19 2wdr s VAL 379 Ca -0.03 1.96 -0.29 0.00 0.00 0.00 0.00 61.98 63.63 2wdr s VAL 379 Cb -0.05 -4.27 0.03 0.00 0.00 0.00 0.00 36.38 32.08 2wdr s VAL 379 CO 0.00 0.34 1.17 -0.69 0.00 0.00 0.00 175.10 175.91 2wdr s VAL 380 N -0.06 4.18 0.20 2.92 1.01 0.04 -4.87 120.40 123.82 2wdr s VAL 380 Ca 0.45 1.22 -0.32 0.00 0.00 0.00 0.00 61.98 63.32 2wdr s VAL 380 Cb -0.23 -4.55 -0.12 0.00 0.00 0.00 0.00 36.38 31.48 2wdr s VAL 380 CO 0.28 -0.95 1.74 -2.65 0.00 0.00 0.00 175.10 173.52 2wdr n PRO 381 N 7.82 2.79 0.00 2.72 -0.02 -1.26 -2.25 135.00 144.80 2wdr n PRO 381 Ca 0.13 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.61 2wdr n PRO 381 Cb 0.49 -2.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 2wdr n PRO 381 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wdr n GLY 382 N 4.01 1.94 3.61 -1.23 0.00 -1.26 -0.46 105.19 111.81 2wdr n GLY 382 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 2wdr n GLY 382 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wdr s LEU 383 N 0.00 3.50 0.08 0.99 2.96 -0.96 -0.16 118.68 125.10 2wdr s LEU 383 Ca 0.00 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.96 2wdr s LEU 383 Cb 0.00 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 2wdr s LEU 383 CO 0.00 0.27 -0.06 -0.36 -1.32 0.00 0.00 176.35 174.88 2wdr s PHE 384 N -0.22 0.78 -0.04 5.38 0.08 0.20 -0.95 117.98 123.21 2wdr s PHE 384 Ca 0.05 -0.86 -0.05 0.00 0.12 0.00 0.00 56.93 56.19 2wdr s PHE 384 Cb -0.12 -0.47 0.01 0.00 -0.57 0.00 0.00 43.02 41.87 2wdr s PHE 384 CO 0.02 -0.18 0.13 0.00 -0.10 0.00 0.00 175.22 175.09 2wdr s ALA 385 N -3.25 -0.31 0.00 5.36 0.00 0.52 0.71 121.76 124.79 2wdr s ALA 385 Ca 0.07 0.25 -0.07 0.00 0.00 0.00 0.00 51.96 52.21 2wdr s ALA 385 Cb 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.00 2wdr s ALA 385 CO -0.05 -0.09 0.13 0.14 0.00 0.00 0.00 175.76 175.89 2wdr s VAL 386 N -0.25 0.08 0.00 0.00 -7.23 -0.64 -4.65 120.40 107.72 2wdr s VAL 386 Ca -0.03 -0.68 0.00 0.00 -1.81 0.00 0.00 61.98 59.46 2wdr s VAL 386 Cb -0.02 -0.42 0.00 0.00 0.56 0.00 0.00 36.38 36.50 2wdr s VAL 386 CO 0.00 -0.37 0.00 0.61 -0.31 0.00 0.00 175.10 175.03 2wdr n GLY 387 N 1.51 -1.39 0.29 2.32 0.00 -1.26 -4.30 105.19 102.36 2wdr n GLY 387 Ca -0.22 -1.50 0.10 0.00 0.00 0.00 0.00 46.02 44.39 2wdr n GLY 387 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2wdr h GLU 388 N 0.00 0.10 0.00 1.61 4.81 -1.93 0.66 114.58 119.83 2wdr h GLU 388 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2wdr h GLU 388 Cb 0.00 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.36 2wdr h GLU 388 CO 0.00 0.06 0.00 0.97 -0.73 0.00 0.00 179.01 179.31 2wdr h ILE 389 N 0.10 0.00 -2.94 2.32 6.09 -1.75 -3.44 117.51 117.89 2wdr h ILE 389 Ca 0.08 -0.23 -0.62 0.00 -1.37 0.00 0.00 64.86 62.72 2wdr h ILE 389 Cb 0.20 1.14 -0.05 0.00 0.47 0.00 0.00 36.82 38.59 2wdr h ILE 389 CO -0.01 0.00 -0.41 0.00 -3.07 0.00 0.00 178.15 174.66 2wdr s ALA 390 N -3.79 3.88 -0.32 0.18 0.00 0.22 -0.93 121.76 121.01 2wdr s ALA 390 Ca -0.01 -0.65 0.04 0.00 0.00 0.00 0.00 51.96 51.33 2wdr s ALA 390 Cb 0.10 -2.01 0.09 0.00 0.00 0.00 0.00 23.12 21.31 2wdr s ALA 390 CO 0.44 0.70 0.01 0.00 0.00 0.00 0.00 175.76 176.91 2wdr h VAL 392 N 6.64 1.44 -3.31 0.00 2.07 -1.82 -2.63 116.25 118.65 2wdr h VAL 392 Ca -0.08 -1.83 -0.66 0.00 0.82 0.00 0.00 66.70 64.95 2wdr h VAL 392 Cb 1.03 2.44 -0.29 0.00 -1.52 0.00 0.00 31.29 32.94 2wdr h VAL 392 CO 0.51 0.53 -0.79 -0.55 0.02 0.00 0.00 177.57 177.29 2wdr s SER 393 N -6.47 3.82 0.00 0.57 0.15 -1.26 -4.40 113.70 106.12 2wdr s SER 393 Ca -0.14 -0.41 0.24 0.00 0.70 0.00 0.00 55.95 56.34 2wdr s SER 393 Cb 0.03 -1.59 0.21 0.00 -1.71 0.00 0.00 66.02 62.97 2wdr s SER 393 CO 0.78 0.12 1.25 1.33 1.20 0.00 0.00 173.24 177.92 2wdr n VAL 394 N 3.84 0.00 0.08 4.45 0.24 -1.26 -0.96 118.33 124.72 2wdr n VAL 394 Ca -0.19 -0.38 0.01 0.00 -2.04 0.00 0.00 64.34 61.74 2wdr n VAL 394 Cb 0.52 1.29 -0.02 0.00 -1.47 0.00 0.00 33.84 34.17 2wdr n VAL 394 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2wdr n HIS 395 N 0.70 0.00 0.00 6.34 -0.00 -1.26 -4.90 115.22 116.10 2wdr n HIS 395 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.85 2wdr n HIS 395 Cb 0.53 -0.02 0.00 0.00 -0.00 0.00 0.00 29.99 30.50 2wdr n HIS 395 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2wdr n GLY 396 N 1.46 3.62 0.86 -1.41 0.00 -1.26 -1.61 105.19 106.84 2wdr n GLY 396 Ca 0.00 0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.30 2wdr n GLY 396 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdr n ALA 397 N 11.82 2.45 -3.47 4.61 0.00 -0.65 -4.87 120.51 130.41 2wdr n ALA 397 Ca 0.00 -0.73 0.01 0.00 0.00 0.00 0.00 53.44 52.72 2wdr n ALA 397 Cb 0.00 -0.70 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 2wdr n ALA 397 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2wdr s ASN 398 N -1.62 -1.04 0.35 0.00 2.47 -0.64 -1.31 114.94 113.17 2wdr s ASN 398 Ca 0.26 1.20 -0.21 0.00 0.42 0.00 0.00 52.86 54.52 2wdr s ASN 398 Cb 0.18 2.09 -0.10 0.00 -1.45 0.00 0.00 41.25 41.97 2wdr s ASN 398 CO 0.26 -0.20 0.89 -0.60 -3.72 0.00 0.00 177.10 173.73 2wdr s ARG 399 N 2.80 4.31 0.20 0.43 3.52 -1.25 -3.57 118.95 125.40 2wdr s ARG 399 Ca 0.01 1.08 -0.09 0.00 -0.13 0.00 0.00 55.73 56.60 2wdr s ARG 399 Cb -0.11 -2.50 -0.07 0.00 -1.56 0.00 0.00 34.95 30.71 2wdr s ARG 399 CO -0.19 0.15 0.51 -0.51 -0.81 0.00 0.00 175.30 174.46 2wdr s LEU 400 N -2.64 4.21 0.28 -0.88 1.43 -1.26 -4.73 118.68 115.08 2wdr s LEU 400 Ca 0.55 0.87 -0.30 0.00 -1.03 0.00 0.00 54.13 54.22 2wdr s LEU 400 Cb -0.13 -3.56 -0.12 0.00 0.03 0.00 0.00 46.19 42.41 2wdr s LEU 400 CO 0.18 -0.03 1.48 0.61 0.23 0.00 0.00 176.35 178.82 2wdr n GLY 401 N 0.02 1.01 3.02 -3.19 0.00 -1.26 -1.35 105.19 103.44 2wdr n GLY 401 Ca -0.01 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.46 2wdr n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdr n GLY 402 N 1.92 2.85 0.07 -0.02 0.00 -1.26 -4.55 105.19 104.19 2wdr n GLY 402 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.24 2wdr n GLY 402 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wdr n ASN 403 N 0.00 0.51 -0.04 1.61 4.13 -0.46 -1.43 115.26 119.58 2wdr n ASN 403 Ca 0.00 0.55 -0.14 0.00 1.68 0.00 0.00 54.58 56.67 2wdr n ASN 403 Cb 0.00 -0.69 -0.12 0.00 -1.54 0.00 0.00 39.78 37.43 2wdr n ASN 403 CO 0.00 0.00 0.00 -1.28 0.28 0.00 0.00 177.26 176.26 2wdr h SER 404 N 0.00 0.06 -0.76 6.41 0.87 -1.90 -2.33 113.55 115.90 2wdr h SER 404 Ca 0.00 -0.84 0.04 0.00 -1.23 0.00 0.00 61.79 59.77 2wdr h SER 404 Cb 0.64 -0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.53 2wdr h SER 404 CO 0.00 0.89 0.47 -0.07 -0.53 0.00 0.00 176.83 177.59 2wdr h LEU 405 N -0.76 0.75 0.08 2.23 3.38 -1.87 0.12 115.31 119.24 2wdr h LEU 405 Ca -0.01 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2wdr h LEU 405 Cb 0.90 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 2wdr h LEU 405 CO 0.01 0.50 -0.26 0.25 0.09 0.00 0.00 178.44 179.04 2wdr h LEU 406 N 0.89 -0.74 -0.38 1.67 5.85 -1.62 -2.11 115.31 118.87 2wdr h LEU 406 Ca 0.32 0.09 0.04 0.00 0.84 0.00 0.00 57.88 59.17 2wdr h LEU 406 Cb 0.09 0.29 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 2wdr h LEU 406 CO -0.14 -0.34 -0.38 -0.78 -0.34 0.00 0.00 178.44 176.45 2wdr h ASP 407 N -0.44 -1.32 -0.93 1.25 1.82 -0.77 0.15 116.42 116.19 2wdr h ASP 407 Ca 0.04 0.18 0.11 0.00 -0.39 0.00 0.00 57.03 56.97 2wdr h ASP 407 Cb 0.49 0.55 -0.13 0.00 0.68 0.00 0.00 39.33 40.92 2wdr h ASP 407 CO -0.18 -0.24 -0.50 -0.07 -1.61 0.00 0.00 179.24 176.64 2wdr h LEU 408 N -0.20 -1.81 -0.09 2.28 3.38 -0.47 0.65 115.31 119.04 2wdr h LEU 408 Ca 0.06 0.31 -0.02 0.00 0.09 0.00 0.00 57.88 58.33 2wdr h LEU 408 Cb 0.37 0.85 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 2wdr h LEU 408 CO -0.46 -0.27 -0.01 0.58 0.09 0.00 0.00 178.44 178.36 2wdr h VAL 409 N -0.04 1.28 -0.43 1.22 2.07 -1.01 -0.67 116.25 118.67 2wdr h VAL 409 Ca 0.23 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 2wdr h VAL 409 Cb 0.50 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 2wdr h VAL 409 CO -0.92 0.25 0.16 0.58 0.02 0.00 0.00 177.57 177.67 2wdr h VAL 410 N -0.13 1.21 0.00 2.57 2.07 0.04 -1.36 116.25 120.64 2wdr h VAL 410 Ca 0.02 -0.64 -0.14 0.00 0.82 0.00 0.00 66.70 66.76 2wdr h VAL 410 Cb 0.40 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2wdr h VAL 410 CO 0.01 0.23 -1.18 -0.26 0.02 0.00 0.00 177.57 176.39 2wdr h PHE 411 N 0.55 0.00 -0.29 1.57 0.04 -0.96 -0.31 116.94 117.54 2wdr h PHE 411 Ca 0.14 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.89 2wdr h PHE 411 Cb 0.21 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 2wdr h PHE 411 CO 0.00 0.52 0.09 0.78 -0.60 0.00 0.00 178.31 179.10 2wdr h GLY 412 N 3.68 0.49 0.99 -1.45 0.00 -1.13 -1.38 103.07 104.26 2wdr h GLY 412 Ca -0.11 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 2wdr h GLY 412 CO 0.05 0.27 -0.21 -0.09 0.00 0.00 0.00 176.54 176.56 2wdr h ARG 413 N 0.31 -0.56 -0.86 4.80 2.43 -1.22 -2.99 114.38 116.28 2wdr h ARG 413 Ca 0.09 0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.43 2wdr h ARG 413 Cb 0.24 0.13 -0.09 0.00 -0.42 0.00 0.00 29.97 29.83 2wdr h ARG 413 CO -0.00 -0.36 0.47 0.00 -1.51 0.00 0.00 179.97 178.56 2wdr h ALA 414 N -0.05 1.28 -0.64 2.80 0.00 -1.02 0.26 119.26 121.90 2wdr h ALA 414 Ca -0.06 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2wdr h ALA 414 Cb 0.46 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2wdr h ALA 414 CO 0.10 -0.01 0.42 0.00 0.00 0.00 0.00 179.25 179.76 2wdr h ALA 415 N 1.53 0.81 -0.11 0.00 0.00 -1.14 0.40 119.26 120.75 2wdr h ALA 415 Ca 0.45 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.26 2wdr h ALA 415 Cb 0.57 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2wdr h ALA 415 CO -0.32 0.22 -0.18 0.78 0.00 0.00 0.00 179.25 179.75 2wdr h GLY 416 N 0.85 0.35 -0.25 0.00 0.00 -1.16 -2.32 103.07 100.54 2wdr h GLY 416 Ca 0.24 -0.40 0.28 0.00 0.00 0.00 0.00 47.33 47.45 2wdr h GLY 416 CO -0.06 0.36 0.67 1.41 0.00 0.00 0.00 176.54 178.92 2wdr h LEU 417 N -0.10 0.46 -3.05 3.11 3.38 0.09 -1.92 115.31 117.29 2wdr h LEU 417 Ca 0.01 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2wdr h LEU 417 Cb 0.75 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2wdr h LEU 417 CO 0.04 0.05 0.00 1.41 0.09 0.00 0.00 178.44 180.03 2wdr n HIS 418 N -4.69 0.92 -0.10 1.13 8.25 0.07 -4.65 115.22 116.15 2wdr n HIS 418 Ca 0.27 -0.63 -0.09 0.00 -0.26 0.00 0.00 57.72 57.01 2wdr n HIS 418 Cb 0.92 -0.16 0.06 0.00 1.12 0.00 0.00 29.99 31.92 2wdr n HIS 418 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2wdr h LEU 419 N 2.70 0.84 0.14 2.41 5.85 -0.77 -1.37 115.31 125.11 2wdr h LEU 419 Ca 0.00 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 2wdr h LEU 419 Cb 1.14 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.94 2wdr h LEU 419 CO 0.13 1.06 -0.07 1.56 -0.34 0.00 0.00 178.44 180.78 2wdr h GLN 420 N 0.70 -0.18 -0.65 1.25 4.20 -1.83 -0.74 115.11 117.87 2wdr h GLN 420 Ca 0.09 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 2wdr h GLN 420 Cb 0.81 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.60 2wdr h GLN 420 CO 0.07 -0.04 0.28 0.93 -0.67 0.00 0.00 178.83 179.40 2wdr h GLU 421 N -0.29 0.93 -0.37 1.46 5.08 -1.88 -1.38 114.58 118.14 2wdr h GLU 421 Ca -0.02 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.21 2wdr h GLU 421 Cb 0.23 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2wdr h GLU 421 CO 0.03 0.75 0.24 0.77 -1.00 0.00 0.00 179.01 179.80 2wdr h SER 422 N 0.92 0.40 -0.23 1.42 0.02 -1.01 0.20 113.55 115.27 2wdr h SER 422 Ca 0.22 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.12 2wdr h SER 422 Cb 0.15 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 2wdr h SER 422 CO -0.02 0.29 -0.02 0.40 -1.14 0.00 0.00 176.83 176.34 2wdr h ILE 423 N 0.48 1.27 -0.68 3.27 2.04 -0.85 -1.99 117.51 121.06 2wdr h ILE 423 Ca 0.14 -0.96 0.03 0.00 1.00 0.00 0.00 64.86 65.07 2wdr h ILE 423 Cb -0.04 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 2wdr h ILE 423 CO -0.04 0.30 0.43 0.00 0.00 0.00 0.00 178.15 178.83 2wdr h ALA 424 N 0.78 0.89 -0.16 1.87 0.00 -1.17 -2.46 119.26 119.02 2wdr h ALA 424 Ca 0.06 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2wdr h ALA 424 Cb 0.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2wdr h ALA 424 CO 0.02 0.20 -0.09 1.49 0.00 0.00 0.00 179.25 180.86 2wdr h GLU 425 N 0.84 0.25 0.00 0.00 4.81 -0.34 -2.78 114.58 117.36 2wdr h GLU 425 Ca 0.27 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 2wdr h GLU 425 Cb 0.01 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2wdr h GLU 425 CO -0.10 0.36 -0.57 -0.56 -0.73 0.00 0.00 179.01 177.40 2wdr h GLN 426 N 0.24 0.00 -0.59 1.92 3.07 -0.99 -3.51 115.11 115.25 2wdr h GLN 426 Ca 0.05 0.00 0.06 0.00 0.09 0.00 0.00 58.65 58.85 2wdr h GLN 426 Cb 0.32 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.85 2wdr h GLN 426 CO 0.02 0.00 -0.19 0.41 0.09 0.00 0.00 178.83 179.16 2wdr n GLY 427 N 1.17 -2.43 3.74 0.06 0.00 -0.96 -4.87 105.19 101.90 2wdr n GLY 427 Ca 0.02 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 2wdr n GLY 427 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdr n ALA 428 N -2.52 2.63 -2.74 4.61 0.00 -1.26 -4.96 120.51 116.26 2wdr n ALA 428 Ca -0.01 0.37 -0.37 0.00 0.00 0.00 0.00 53.44 53.43 2wdr n ALA 428 Cb 0.12 -2.48 -0.07 0.00 0.00 0.00 0.00 19.45 17.03 2wdr n ALA 428 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wdr s LEU 429 N -0.32 4.35 0.72 0.00 1.43 -1.26 -5.08 118.68 118.53 2wdr s LEU 429 Ca 0.65 0.55 -0.14 0.00 -1.03 0.00 0.00 54.13 54.16 2wdr s LEU 429 Cb -0.49 -2.25 0.04 0.00 0.03 0.00 0.00 46.19 43.51 2wdr s LEU 429 CO 0.47 0.29 1.17 -0.60 0.23 0.00 0.00 176.35 177.91 2wdr s ARG 430 N -0.52 2.25 0.64 1.70 3.52 -1.26 -4.97 118.95 120.31 2wdr s ARG 430 Ca 0.16 1.61 -0.16 0.00 -0.13 0.00 0.00 55.73 57.21 2wdr s ARG 430 Cb -0.13 -1.86 -0.01 0.00 -1.56 0.00 0.00 34.95 31.39 2wdr s ARG 430 CO 0.05 -1.72 1.11 -0.51 -0.81 0.00 0.00 175.30 173.43 2wdr s ASP 431 N -2.30 5.22 0.15 -2.12 1.01 -1.26 -4.80 116.67 112.56 2wdr s ASP 431 Ca 0.71 2.02 -0.29 0.00 0.71 0.00 0.00 52.55 55.70 2wdr s ASP 431 Cb -0.26 -2.55 -0.07 0.00 1.01 0.00 0.00 42.92 41.05 2wdr s ASP 431 CO 0.45 -1.56 0.91 0.00 0.21 0.00 0.00 175.17 175.19 2wdr s ALA 432 N -2.26 3.31 0.85 5.23 0.00 -1.26 -4.61 121.76 123.01 2wdr s ALA 432 Ca 0.68 0.54 -0.12 0.00 0.00 0.00 0.00 51.96 53.05 2wdr s ALA 432 Cb -0.21 -3.19 0.10 0.00 0.00 0.00 0.00 23.12 19.82 2wdr s ALA 432 CO 0.39 0.10 1.18 -1.54 0.00 0.00 0.00 175.76 175.89 2wdr s SER 433 N -0.52 4.16 0.37 0.00 1.04 -1.26 -4.92 113.70 112.57 2wdr s SER 433 Ca 0.43 0.78 0.11 0.00 0.48 0.00 0.00 55.95 57.75 2wdr s SER 433 Cb -0.24 -1.26 0.71 0.00 0.10 0.00 0.00 66.02 65.33 2wdr s SER 433 CO 0.29 -2.12 1.84 -0.08 0.98 0.00 0.00 173.24 174.15 2wdr h GLU 434 N -1.21 0.10 0.00 4.02 4.81 -2.00 -2.07 114.58 118.23 2wdr h GLU 434 Ca -0.47 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.70 2wdr h GLU 434 Cb 1.32 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.69 2wdr h GLU 434 CO 0.63 0.40 -0.11 0.66 -0.73 0.00 0.00 179.01 179.86 2wdr h SER 435 N 0.09 0.00 -0.56 1.04 4.64 -1.98 -1.36 113.55 115.43 2wdr h SER 435 Ca 0.01 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.27 2wdr h SER 435 Cb 0.59 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.66 2wdr h SER 435 CO 0.04 0.11 0.09 0.44 -0.87 0.00 0.00 176.83 176.64 2wdr h ASP 436 N 0.00 0.89 -0.14 4.97 3.32 -1.70 -1.88 116.42 121.88 2wdr h ASP 436 Ca -0.00 -0.26 -0.20 0.00 0.02 0.00 0.00 57.03 56.59 2wdr h ASP 436 Cb 1.00 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 40.32 2wdr h ASP 436 CO 0.01 0.93 -0.68 0.58 -1.72 0.00 0.00 179.24 178.36 2wdr h VAL 437 N 0.82 1.31 -0.57 -1.35 2.07 -1.36 -3.12 116.25 114.04 2wdr h VAL 437 Ca 0.17 -1.92 0.10 0.00 0.82 0.00 0.00 66.70 65.87 2wdr h VAL 437 Cb 0.42 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 2wdr h VAL 437 CO 0.01 0.60 0.39 -0.08 0.02 0.00 0.00 177.57 178.51 2wdr h GLU 438 N 0.40 0.35 -0.77 1.57 4.57 -1.15 -1.84 114.58 117.72 2wdr h GLU 438 Ca -0.05 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.06 2wdr h GLU 438 Cb 1.32 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.79 2wdr h GLU 438 CO 0.14 0.23 0.28 0.00 -1.18 0.00 0.00 179.01 178.48 2wdr h ALA 439 N 1.71 1.00 -0.48 2.92 0.00 -1.27 -2.58 119.26 120.55 2wdr h ALA 439 Ca 0.26 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 55.02 2wdr h ALA 439 Cb 0.56 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2wdr h ALA 439 CO -0.07 0.65 0.32 0.77 0.00 0.00 0.00 179.25 180.92 2wdr h SER 440 N 1.12 0.41 1.19 0.00 0.02 -1.40 -1.83 113.55 113.06 2wdr h SER 440 Ca 0.25 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2wdr h SER 440 Cb 0.25 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.70 2wdr h SER 440 CO -0.02 0.27 0.00 0.18 -1.14 0.00 0.00 176.83 176.13 2wdr n LEU 441 N -4.48 0.49 -0.10 5.07 4.77 -0.98 -4.13 117.00 117.65 2wdr n LEU 441 Ca 0.06 0.56 -0.07 0.00 -0.03 0.00 0.00 56.01 56.53 2wdr n LEU 441 Cb 0.20 -0.41 -0.00 0.00 -2.33 0.00 0.00 43.42 40.88 2wdr n LEU 441 CO 0.35 -0.17 0.69 0.44 -1.33 0.00 0.00 177.39 177.37 2wdr h ASP 442 N 0.00 -0.82 -0.64 -1.43 3.32 -1.31 0.64 116.42 116.19 2wdr h ASP 442 Ca 0.00 0.16 0.11 0.00 0.02 0.00 0.00 57.03 57.32 2wdr h ASP 442 Cb 0.60 0.41 -0.08 0.00 0.22 0.00 0.00 39.33 40.47 2wdr h ASP 442 CO 0.00 -0.27 0.20 -0.09 -1.72 0.00 0.00 179.24 177.36 2wdr h ARG 443 N -0.20 0.35 -0.29 3.56 2.43 -1.79 -1.22 114.38 117.22 2wdr h ARG 443 Ca 0.17 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 2wdr h ARG 443 Cb 0.47 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 2wdr h ARG 443 CO -0.47 0.23 -0.04 1.25 -1.51 0.00 0.00 179.97 179.43 2wdr h LEU 444 N 0.36 0.53 -1.59 3.80 5.85 -1.62 -3.19 115.31 119.44 2wdr h LEU 444 Ca 0.33 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.72 2wdr h LEU 444 Cb 0.47 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 2wdr h LEU 444 CO -0.36 0.75 0.29 0.78 -0.34 0.00 0.00 178.44 179.55 2wdr h ASN 445 N 0.30 0.47 0.33 1.25 2.35 -0.26 -2.14 115.58 117.89 2wdr h ASN 445 Ca 0.08 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 2wdr h ASN 445 Cb 0.50 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 2wdr h ASN 445 CO 0.02 0.34 -0.25 -0.09 -1.65 0.00 0.00 177.43 175.80 2wdr h ARG 446 N 0.56 -0.56 -0.99 0.81 2.43 -1.23 -2.76 114.38 112.64 2wdr h ARG 446 Ca 0.16 0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.41 2wdr h ARG 446 Cb -0.02 0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 29.60 2wdr h ARG 446 CO -0.04 -0.37 0.65 -1.49 -1.51 0.00 0.00 179.97 177.21 2wdr h TRP 447 N -0.58 1.22 0.00 2.20 4.06 -1.47 -0.45 115.95 120.94 2wdr h TRP 447 Ca -0.03 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2wdr h TRP 447 Cb 0.50 -0.41 0.00 0.00 -1.00 0.00 0.00 29.16 28.25 2wdr h TRP 447 CO -0.13 0.71 0.00 -0.91 -3.56 0.00 0.00 178.44 174.55 2wdr h ASN 448 N 1.26 0.00 0.00 -3.49 2.35 -1.21 -2.85 115.58 111.64 2wdr h ASN 448 Ca 0.39 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.14 2wdr h ASN 448 Cb -0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.36 2wdr h ASN 448 CO -0.12 0.00 -1.36 0.59 -1.65 0.00 0.00 177.43 174.90 2wdr n ASN 449 N -2.85 1.35 -4.54 5.81 5.03 -0.29 -4.92 115.26 114.85 2wdr n ASN 449 Ca -0.00 -0.26 -0.43 0.00 0.87 0.00 0.00 54.58 54.76 2wdr n ASN 449 Cb 0.20 1.46 -0.04 0.00 -1.02 0.00 0.00 39.78 40.38 2wdr n ASN 449 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 2wdr s ASN 450 N -3.26 6.41 -0.14 6.41 3.84 -0.53 -4.86 114.94 122.81 2wdr s ASN 450 Ca -0.02 -0.15 0.09 0.00 0.21 0.00 0.00 52.86 52.99 2wdr s ASN 450 Cb 0.10 -2.44 -0.15 0.00 -0.55 0.00 0.00 41.25 38.21 2wdr s ASN 450 CO 0.60 -1.13 -0.00 0.54 -2.79 0.00 0.00 177.10 174.31 2wdr n ARG 451 N 7.29 1.49 -0.19 0.43 5.12 -1.26 -1.80 116.66 127.74 2wdr n ARG 451 Ca 0.03 0.02 0.05 0.00 -1.93 0.00 0.00 57.85 56.03 2wdr n ARG 451 Cb 0.48 -1.34 0.15 0.00 -1.16 0.00 0.00 32.46 30.59 2wdr n ARG 451 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2wdr n ASN 452 N -2.62 2.93 -3.36 0.55 3.02 -1.26 -4.83 115.26 109.70 2wdr n ASN 452 Ca -0.24 -2.18 0.00 0.00 -0.03 0.00 0.00 54.58 52.14 2wdr n ASN 452 Cb 0.90 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.82 2wdr n ASN 452 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wdr n GLY 453 N 0.18 -1.67 3.84 7.41 0.00 -1.26 -4.99 105.19 108.70 2wdr n GLY 453 Ca 0.12 -1.46 -0.32 0.00 0.00 0.00 0.00 46.02 44.36 2wdr n GLY 453 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wdr s GLU 454 N 0.00 3.55 -0.33 1.61 2.02 0.72 -4.49 118.70 121.77 2wdr s GLU 454 Ca 0.00 0.90 -0.29 0.00 0.02 0.00 0.00 54.97 55.60 2wdr s GLU 454 Cb 0.00 -2.07 0.01 0.00 0.10 0.00 0.00 34.13 32.17 2wdr s GLU 454 CO 0.00 -0.61 1.21 0.34 0.02 0.00 0.00 175.26 176.23 2wdr s ASP 455 N -3.62 6.74 0.44 -0.19 2.15 -1.26 -0.93 116.67 119.99 2wdr s ASP 455 Ca 0.58 1.05 0.11 0.00 0.43 0.00 0.00 52.55 54.72 2wdr s ASP 455 Cb -0.12 -2.54 0.97 0.00 -0.30 0.00 0.00 42.92 40.93 2wdr s ASP 455 CO 0.46 -1.05 2.03 1.55 -0.17 0.00 0.00 175.17 177.98 2wdr h PRO 456 N 8.96 0.22 -0.25 4.34 0.13 -1.95 -2.78 132.00 140.66 2wdr h PRO 456 Ca -0.24 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 64.92 2wdr h PRO 456 Cb 1.08 -0.04 -0.07 0.00 0.13 0.00 0.00 31.00 32.10 2wdr h PRO 456 CO 1.05 0.24 -0.19 0.28 -0.23 0.00 0.00 178.00 179.15 2wdr h VAL 457 N 0.22 0.48 -0.71 1.56 2.07 -1.96 -0.93 116.25 116.97 2wdr h VAL 457 Ca 0.05 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.52 2wdr h VAL 457 Cb 0.15 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 2wdr h VAL 457 CO 0.00 0.00 0.24 0.00 0.02 0.00 0.00 177.57 177.83 2wdr h ALA 458 N 0.94 1.09 -0.45 1.67 0.00 -1.92 -2.24 119.26 118.34 2wdr h ALA 458 Ca 0.14 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2wdr h ALA 458 Cb 0.40 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2wdr h ALA 458 CO -0.36 0.63 0.20 0.82 0.00 0.00 0.00 179.25 180.54 2wdr h ILE 459 N 1.04 1.20 -0.40 0.00 2.04 -1.28 -0.59 117.51 119.51 2wdr h ILE 459 Ca 0.23 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 2wdr h ILE 459 Cb 0.26 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2wdr h ILE 459 CO -0.01 0.22 0.18 -0.09 0.00 0.00 0.00 178.15 178.45 2wdr h ARG 460 N 0.59 0.59 -0.72 2.37 2.43 -1.01 -1.26 114.38 117.36 2wdr h ARG 460 Ca 0.15 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2wdr h ARG 460 Cb 0.16 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 2wdr h ARG 460 CO -0.02 0.53 0.42 0.87 -1.51 0.00 0.00 179.97 180.26 2wdr h LYS 461 N 0.51 1.00 -0.45 0.20 1.57 -1.21 -0.61 116.57 117.57 2wdr h LYS 461 Ca 0.14 -0.10 0.02 0.00 -1.87 0.00 0.00 60.65 58.84 2wdr h LYS 461 Cb 0.15 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 2wdr h LYS 461 CO -0.01 0.73 0.25 0.00 -0.57 0.00 0.00 179.45 179.85 2wdr h ALA 462 N 1.21 0.57 0.33 3.86 0.00 -0.93 -1.28 119.26 123.02 2wdr h ALA 462 Ca 0.26 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2wdr h ALA 462 Cb 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2wdr h ALA 462 CO -0.04 -0.07 -0.19 1.25 0.00 0.00 0.00 179.25 180.19 2wdr h LEU 463 N 0.51 -0.46 -0.23 0.00 6.46 -0.59 -1.67 115.31 119.33 2wdr h LEU 463 Ca 0.18 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.96 2wdr h LEU 463 Cb 0.04 0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.09 2wdr h LEU 463 CO -0.10 -0.31 0.11 1.56 -0.62 0.00 0.00 178.44 179.08 2wdr h GLN 464 N -0.49 0.34 -0.97 1.25 4.20 -0.99 -1.80 115.11 116.64 2wdr h GLN 464 Ca -0.04 -0.05 0.10 0.00 0.06 0.00 0.00 58.65 58.72 2wdr h GLN 464 Cb 0.40 -0.06 -0.07 0.00 0.30 0.00 0.00 27.48 28.04 2wdr h GLN 464 CO 0.05 0.36 0.62 1.49 -0.67 0.00 0.00 178.83 180.68 2wdr h GLU 465 N 0.24 0.98 0.37 1.46 4.81 -1.22 -1.42 114.58 119.80 2wdr h GLU 465 Ca 0.08 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2wdr h GLU 465 Cb 0.14 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.30 2wdr h GLU 465 CO -0.01 0.65 -0.18 0.00 -0.73 0.00 0.00 179.01 178.74 2wdr h MET 467 N -0.55 0.74 -0.42 0.00 2.86 -1.17 -1.94 114.93 114.45 2wdr h MET 467 Ca -0.05 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 2wdr h MET 467 Cb 0.42 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 2wdr h MET 467 CO 0.08 0.49 0.14 0.37 1.06 0.00 0.00 176.91 179.06 2wdr h GLN 468 N 0.76 0.64 0.00 1.72 5.75 -0.99 -1.36 115.11 121.64 2wdr h GLN 468 Ca 0.25 -0.13 0.00 0.00 -0.15 0.00 0.00 58.65 58.62 2wdr h GLN 468 Cb 0.06 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 28.51 2wdr h GLN 468 CO -0.07 0.62 -0.46 0.45 -2.65 0.00 0.00 178.83 176.72 2wdr h HIS 469 N 0.53 0.00 0.00 3.99 3.86 -1.17 -3.35 115.15 119.01 2wdr h HIS 469 Ca 0.14 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.34 2wdr h HIS 469 Cb 0.24 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.70 2wdr h HIS 469 CO 0.01 0.00 -1.12 0.09 0.86 0.00 0.00 177.93 177.76 2wdr n ASN 470 N -2.40 4.42 -1.81 2.45 3.02 -0.75 -4.76 115.26 115.44 2wdr n ASN 470 Ca 0.03 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.56 2wdr n ASN 470 Cb 0.47 1.01 0.07 0.00 -0.61 0.00 0.00 39.78 40.72 2wdr n ASN 470 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2wdr n PHE 471 N -1.68 0.90 -0.19 3.10 3.72 -0.52 -4.49 117.46 118.30 2wdr n PHE 471 Ca -0.01 -1.52 0.00 0.00 -0.05 0.00 0.00 57.45 55.87 2wdr n PHE 471 Cb 0.16 -0.23 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 2wdr n PHE 471 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2wdr n SER 472 N -0.39 0.00 -0.08 4.37 2.88 -1.23 -4.90 113.62 114.27 2wdr n SER 472 Ca 0.16 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.63 2wdr n SER 472 Cb 0.92 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.38 2wdr n SER 472 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2wdr h VAL 473 N 0.00 0.97 -3.36 2.46 2.07 -1.92 -3.41 116.25 113.06 2wdr h VAL 473 Ca 0.00 -0.10 -0.65 0.00 0.82 0.00 0.00 66.70 66.77 2wdr h VAL 473 Cb 0.00 0.65 -0.20 0.00 -1.52 0.00 0.00 31.29 30.22 2wdr h VAL 473 CO 0.00 0.05 -0.66 -0.36 0.02 0.00 0.00 177.57 176.62 2wdr s PHE 474 N -6.17 3.04 0.07 1.57 0.08 -1.26 -4.24 117.98 111.07 2wdr s PHE 474 Ca -0.13 -0.16 0.08 0.00 0.12 0.00 0.00 56.93 56.84 2wdr s PHE 474 Cb 0.11 -1.90 -0.03 0.00 -0.57 0.00 0.00 43.02 40.62 2wdr s PHE 474 CO 0.70 0.10 -0.21 1.03 -0.10 0.00 0.00 175.22 176.75 2wdr s ARG 475 N 0.00 1.28 0.10 0.44 0.52 0.55 -4.81 118.95 117.04 2wdr s ARG 475 Ca 0.01 -1.03 0.06 0.00 -0.52 0.00 0.00 55.73 54.25 2wdr s ARG 475 Cb -0.13 -1.46 -0.03 0.00 0.52 0.00 0.00 34.95 33.85 2wdr s ARG 475 CO 0.02 0.36 -0.16 -1.83 0.02 0.00 0.00 175.30 173.72 2wdr s GLU 476 N -1.48 0.99 0.28 3.54 -1.05 -1.26 -1.31 118.70 118.40 2wdr s GLU 476 Ca 0.07 -1.14 -0.00 0.00 -0.15 0.00 0.00 54.97 53.75 2wdr s GLU 476 Cb -0.09 -0.99 0.49 0.00 -0.44 0.00 0.00 34.13 33.09 2wdr s GLU 476 CO 0.03 0.21 1.86 0.78 0.95 0.00 0.00 175.26 179.09 2wdr h GLY 477 N 3.87 1.57 0.79 -3.83 0.00 -1.98 -2.19 103.07 101.30 2wdr h GLY 477 Ca -0.41 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.45 2wdr h GLY 477 CO 0.45 0.25 -0.15 -0.55 0.00 0.00 0.00 176.54 176.54 2wdr h ASP 478 N 1.08 -0.35 -0.46 0.19 5.19 -2.00 -2.57 116.42 117.50 2wdr h ASP 478 Ca 0.46 -0.12 0.07 0.00 -0.62 0.00 0.00 57.03 56.83 2wdr h ASP 478 Cb 0.33 0.09 -0.06 0.00 0.18 0.00 0.00 39.33 39.87 2wdr h ASP 478 CO -0.21 -0.08 0.11 0.00 -3.12 0.00 0.00 179.24 175.93 2wdr h ALA 479 N -0.02 0.52 -0.30 3.45 0.00 -1.88 -2.04 119.26 119.00 2wdr h ALA 479 Ca -0.04 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2wdr h ALA 479 Cb 0.45 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2wdr h ALA 479 CO 0.07 -0.29 0.02 0.52 0.00 0.00 0.00 179.25 179.57 2wdr h MET 480 N 0.25 0.44 -0.08 0.00 2.86 -1.39 0.49 114.93 117.51 2wdr h MET 480 Ca 0.23 -0.08 -0.14 0.00 -2.06 0.00 0.00 59.70 57.65 2wdr h MET 480 Cb 0.28 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 2wdr h MET 480 CO -0.28 0.46 -0.55 0.00 1.06 0.00 0.00 176.91 177.60 2wdr h ALA 481 N 1.59 0.91 0.22 6.32 0.00 -0.98 -2.08 119.26 125.23 2wdr h ALA 481 Ca 0.10 -0.51 -0.33 0.00 0.00 0.00 0.00 54.91 54.17 2wdr h ALA 481 Cb 0.26 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.99 2wdr h ALA 481 CO 0.01 0.69 -1.53 0.87 0.00 0.00 0.00 179.25 179.29 2wdr h LYS 482 N 0.19 0.46 -0.41 0.00 1.57 -0.60 -2.90 116.57 114.89 2wdr h LYS 482 Ca 0.00 -0.78 0.02 0.00 -1.87 0.00 0.00 60.65 58.02 2wdr h LYS 482 Cb 1.03 0.29 -0.03 0.00 0.08 0.00 0.00 32.23 33.61 2wdr h LYS 482 CO 0.09 1.37 0.24 0.78 -0.57 0.00 0.00 179.45 181.36 2wdr h GLY 483 N 0.56 0.57 1.09 3.86 0.00 -0.10 -0.89 103.07 108.16 2wdr h GLY 483 Ca -0.26 -0.18 0.04 0.00 0.00 0.00 0.00 47.33 46.92 2wdr h GLY 483 CO 0.24 0.16 0.53 -2.00 0.00 0.00 0.00 176.54 175.47 2wdr h LEU 484 N 0.49 0.85 -0.34 3.11 5.85 -1.44 0.17 115.31 123.99 2wdr h LEU 484 Ca 0.16 -0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.72 2wdr h LEU 484 Cb 0.00 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.83 2wdr h LEU 484 CO -0.07 0.58 -0.37 -0.33 -0.34 0.00 0.00 178.44 177.92 2wdr h GLU 485 N 0.99 0.86 -0.06 1.25 4.39 -1.16 -2.35 114.58 118.50 2wdr h GLU 485 Ca 0.32 -0.46 -0.06 0.00 0.34 0.00 0.00 59.36 59.50 2wdr h GLU 485 Cb 0.04 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2wdr h GLU 485 CO -0.09 1.10 -0.24 1.96 -1.16 0.00 0.00 179.01 180.58 2wdr h GLN 486 N 0.65 0.09 -0.13 2.33 4.20 -0.56 -2.56 115.11 119.13 2wdr h GLN 486 Ca 0.05 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 2wdr h GLN 486 Cb 0.96 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.72 2wdr h GLN 486 CO 0.09 0.33 -0.02 -0.07 -0.67 0.00 0.00 178.83 178.49 2wdr h LEU 487 N 0.09 0.23 -0.85 1.46 3.38 -0.73 0.18 115.31 119.07 2wdr h LEU 487 Ca 0.01 -0.34 0.19 0.00 0.09 0.00 0.00 57.88 57.83 2wdr h LEU 487 Cb 0.47 -0.06 -0.11 0.00 0.09 0.00 0.00 40.66 41.04 2wdr h LEU 487 CO 0.03 0.52 0.36 0.11 0.09 0.00 0.00 178.44 179.55 2wdr h LYS 488 N -0.06 0.42 0.32 1.13 1.57 -1.11 0.47 116.57 119.31 2wdr h LYS 488 Ca 0.03 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 2wdr h LYS 488 Cb 0.41 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2wdr h LYS 488 CO 0.01 0.28 -0.15 0.28 -0.57 0.00 0.00 179.45 179.30 2wdr h VAL 489 N 0.43 0.71 -0.97 0.50 2.07 -1.17 -2.16 116.25 115.66 2wdr h VAL 489 Ca 0.50 -0.42 0.10 0.00 0.82 0.00 0.00 66.70 67.71 2wdr h VAL 489 Cb 0.87 0.93 -0.08 0.00 -1.52 0.00 0.00 31.29 31.49 2wdr h VAL 489 CO -0.48 0.08 0.60 0.40 0.02 0.00 0.00 177.57 178.20 2wdr h ILE 490 N -0.66 0.95 0.00 4.57 2.04 0.36 -1.12 117.51 123.65 2wdr h ILE 490 Ca -0.04 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.42 2wdr h ILE 490 Cb 0.46 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 2wdr h ILE 490 CO 0.07 0.18 -0.29 -0.09 0.00 0.00 0.00 178.15 178.03 2wdr h ARG 491 N 0.99 0.00 -0.15 2.37 2.43 -0.01 -2.36 114.38 117.66 2wdr h ARG 491 Ca 0.47 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.55 2wdr h ARG 491 Cb 0.40 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2wdr h ARG 491 CO -0.24 0.29 -0.24 0.93 -1.51 0.00 0.00 179.97 179.19 2wdr h GLU 492 N 0.00 0.42 -0.67 0.20 4.39 -0.55 -3.11 114.58 115.26 2wdr h GLU 492 Ca -0.00 -0.26 0.12 0.00 0.34 0.00 0.00 59.36 59.56 2wdr h GLU 492 Cb 0.73 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.37 2wdr h GLU 492 CO 0.04 0.85 0.45 0.00 -1.16 0.00 0.00 179.01 179.18 2wdr h ARG 493 N 0.03 0.38 0.00 2.33 3.08 -0.98 -1.91 114.38 117.32 2wdr h ARG 493 Ca 0.01 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 59.87 2wdr h ARG 493 Cb 0.82 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.76 2wdr h ARG 493 CO 0.05 0.25 -0.80 1.25 -1.07 0.00 0.00 179.97 179.66 2wdr h LEU 494 N 0.39 0.00 0.00 3.04 5.85 -1.38 -2.70 115.31 120.52 2wdr h LEU 494 Ca 0.32 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.04 2wdr h LEU 494 Cb 0.70 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2wdr h LEU 494 CO -0.09 0.80 0.00 0.29 -0.34 0.00 0.00 178.44 179.10 2wdr n LYS 495 N -3.57 0.13 -0.82 1.25 5.02 -0.72 -1.77 118.16 117.68 2wdr n LYS 495 Ca -0.01 0.19 0.05 0.00 -2.02 0.00 0.00 58.31 56.52 2wdr n LYS 495 Cb 0.77 -1.50 0.09 0.00 -0.02 0.00 0.00 35.03 34.37 2wdr n LYS 495 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2wdr n ASN 496 N -1.25 1.19 -4.89 4.39 5.15 -1.02 -5.08 115.26 113.75 2wdr n ASN 496 Ca 0.04 -2.69 -0.29 0.00 -0.60 0.00 0.00 54.58 51.05 2wdr n ASN 496 Cb 0.06 -0.36 -0.00 0.00 -0.53 0.00 0.00 39.78 38.94 2wdr n ASN 496 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2wdr s ALA 497 N -1.33 3.31 0.01 5.20 0.00 -0.73 -0.20 121.76 128.03 2wdr s ALA 497 Ca 0.28 -0.35 0.04 0.00 0.00 0.00 0.00 51.96 51.93 2wdr s ALA 497 Cb 0.28 -2.74 -0.03 0.00 0.00 0.00 0.00 23.12 20.63 2wdr s ALA 497 CO -0.08 -0.40 -0.10 -0.98 0.00 0.00 0.00 175.76 174.21 2wdr s ARG 498 N -4.74 2.41 -0.58 0.00 1.70 -0.11 -4.59 118.95 113.05 2wdr s ARG 498 Ca 0.50 -0.79 -0.19 0.00 -0.47 0.00 0.00 55.73 54.78 2wdr s ARG 498 Cb -0.10 -2.40 0.10 0.00 -0.57 0.00 0.00 34.95 31.97 2wdr s ARG 498 CO 0.45 0.59 0.69 -1.17 -1.08 0.00 0.00 175.30 174.78 2wdr s LEU 499 N -1.38 5.37 0.45 -1.89 2.96 -0.75 -4.64 118.68 118.81 2wdr s LEU 499 Ca 0.16 -1.39 0.30 0.00 -0.22 0.00 0.00 54.13 52.98 2wdr s LEU 499 Cb -0.11 -2.31 1.17 0.00 0.50 0.00 0.00 46.19 45.44 2wdr s LEU 499 CO 0.06 -1.08 1.88 0.44 -1.32 0.00 0.00 176.35 176.34 2wdr h ASP 500 N 9.15 0.00 -3.30 3.68 3.32 -1.91 -3.42 116.42 123.95 2wdr h ASP 500 Ca -0.29 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.10 2wdr h ASP 500 Cb 1.09 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.34 2wdr h ASP 500 CO 1.08 0.00 -0.76 -0.62 -1.72 0.00 0.00 179.24 177.22 2wdr s ASP 501 N -5.31 3.95 -0.01 6.45 -1.08 -1.26 -5.00 116.67 114.42 2wdr s ASP 501 Ca 0.03 -0.45 0.21 0.00 -0.52 0.00 0.00 52.55 51.82 2wdr s ASP 501 Cb 0.09 -1.65 -0.25 0.00 -1.46 0.00 0.00 42.92 39.65 2wdr s ASP 501 CO 0.51 0.01 0.83 1.07 0.52 0.00 0.00 175.17 178.11 2wdr n THR 502 N 4.56 0.00 -0.85 1.71 5.66 -1.26 -4.69 114.28 119.41 2wdr n THR 502 Ca -0.19 -0.09 -0.29 0.00 -3.05 0.00 0.00 64.05 60.43 2wdr n THR 502 Cb 0.51 0.83 0.24 0.00 -1.55 0.00 0.00 70.33 70.36 2wdr n THR 502 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2wdr s SER 503 N -3.26 0.86 0.00 1.09 1.04 -1.26 -5.02 113.70 107.15 2wdr s SER 503 Ca 0.05 0.96 0.00 0.00 0.48 0.00 0.00 55.95 57.44 2wdr s SER 503 Cb 0.16 -1.43 0.00 0.00 0.10 0.00 0.00 66.02 64.85 2wdr s SER 503 CO 0.88 -4.20 0.00 -1.54 0.98 0.00 0.00 173.24 169.36 2wdr n SER 504 N -4.85 0.78 -4.42 7.02 3.41 -1.26 -4.75 113.62 109.54 2wdr n SER 504 Ca 0.09 -0.25 -0.44 0.00 -0.26 0.00 0.00 58.87 58.01 2wdr n SER 504 Cb 0.58 0.66 -0.03 0.00 -0.26 0.00 0.00 64.21 65.16 2wdr n SER 504 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2wdr s GLU 505 N -0.82 3.33 -1.00 4.33 2.56 -1.26 -2.72 118.70 123.12 2wdr s GLU 505 Ca 0.00 -1.46 -0.09 0.00 0.00 0.00 0.00 54.97 53.42 2wdr s GLU 505 Cb 0.00 -4.53 -0.03 0.00 2.00 0.00 0.00 34.13 31.57 2wdr s GLU 505 CO 0.00 -1.69 0.81 0.34 -0.56 0.00 0.00 175.26 174.16 2wdr n PHE 506 N 6.60 -2.36 -3.10 5.30 7.35 -0.47 -4.92 117.46 125.85 2wdr n PHE 506 Ca 0.07 0.78 -0.45 0.00 -0.76 0.00 0.00 57.45 57.09 2wdr n PHE 506 Cb 0.46 -3.81 -0.02 0.00 0.35 0.00 0.00 39.48 36.47 2wdr n PHE 506 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 2wdr s ASN 507 N -3.31 6.72 0.54 -2.13 3.84 -1.25 -4.89 114.94 114.47 2wdr s ASN 507 Ca 0.34 -2.39 0.30 0.00 0.21 0.00 0.00 52.86 51.32 2wdr s ASN 507 Cb -0.08 -2.32 1.56 0.00 -0.55 0.00 0.00 41.25 39.86 2wdr s ASN 507 CO 0.79 -0.83 2.11 0.71 -2.79 0.00 0.00 177.10 177.09 2wdr h THR 508 N 5.30 0.47 -0.57 -5.21 1.35 -1.92 -2.95 112.91 109.38 2wdr h THR 508 Ca 0.15 -0.44 -0.03 0.00 -0.55 0.00 0.00 66.41 65.54 2wdr h THR 508 Cb 1.02 1.30 -0.03 0.00 -1.73 0.00 0.00 68.15 68.71 2wdr h THR 508 CO 0.97 0.09 0.26 -0.61 -0.25 0.00 0.00 175.52 175.97 2wdr h GLN 509 N 0.00 0.84 -0.59 4.72 5.75 -1.93 -1.99 115.11 121.90 2wdr h GLN 509 Ca -0.00 -0.13 -0.05 0.00 -0.15 0.00 0.00 58.65 58.31 2wdr h GLN 509 Cb 0.29 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.67 2wdr h GLN 509 CO 0.01 0.70 0.16 -0.09 -2.65 0.00 0.00 178.83 176.96 2wdr h ARG 510 N 0.78 0.90 -0.30 1.69 2.43 -1.79 -1.77 114.38 116.32 2wdr h ARG 510 Ca 0.19 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 2wdr h ARG 510 Cb 0.15 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2wdr h ARG 510 CO -0.02 0.80 0.12 0.28 -1.51 0.00 0.00 179.97 179.64 2wdr h VAL 511 N 0.87 1.18 0.00 0.20 2.07 -1.52 -0.87 116.25 118.17 2wdr h VAL 511 Ca 0.19 -0.54 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 2wdr h VAL 511 Cb 0.29 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2wdr h VAL 511 CO -0.00 0.19 -0.25 -0.33 0.02 0.00 0.00 177.57 177.19 2wdr h GLU 512 N 0.34 0.00 -0.02 1.57 5.08 -0.98 0.19 114.58 120.76 2wdr h GLU 512 Ca 0.10 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.22 2wdr h GLU 512 Cb 0.18 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.45 2wdr h GLU 512 CO -0.01 0.25 -0.94 0.00 -1.00 0.00 0.00 179.01 177.31 2wdr h LEU 514 N 0.32 0.68 -0.44 0.00 3.38 -0.19 -2.47 115.31 116.59 2wdr h LEU 514 Ca -0.11 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 2wdr h LEU 514 Cb 1.60 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 2wdr h LEU 514 CO 0.19 0.57 -0.06 -0.33 0.09 0.00 0.00 178.44 178.90 2wdr h GLU 515 N 0.77 0.82 -0.87 1.13 5.08 -0.59 -3.01 114.58 117.91 2wdr h GLU 515 Ca 0.19 -0.29 0.14 0.00 -1.00 0.00 0.00 59.36 58.40 2wdr h GLU 515 Cb 0.06 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.18 2wdr h GLU 515 CO -0.03 0.91 0.57 1.25 -1.00 0.00 0.00 179.01 180.71 2wdr h LEU 516 N 0.65 0.64 -1.36 1.33 5.85 -0.86 0.29 115.31 121.86 2wdr h LEU 516 Ca 0.12 0.04 0.13 0.00 0.84 0.00 0.00 57.88 59.00 2wdr h LEU 516 Cb 0.58 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 2wdr h LEU 516 CO 0.03 0.33 0.54 0.44 -0.34 0.00 0.00 178.44 179.45 2wdr h ASP 517 N 0.68 0.61 0.37 1.25 3.32 -1.45 -0.87 116.42 120.33 2wdr h ASP 517 Ca 0.44 0.03 -0.32 0.00 0.02 0.00 0.00 57.03 57.20 2wdr h ASP 517 Cb 0.70 -0.09 0.02 0.00 0.22 0.00 0.00 39.33 40.18 2wdr h ASP 517 CO -0.19 0.33 -1.48 0.78 -1.72 0.00 0.00 179.24 176.95 2wdr h ASN 518 N 0.65 0.64 -0.89 6.45 2.35 -0.55 -2.23 115.58 122.01 2wdr h ASN 518 Ca 0.41 -0.75 0.18 0.00 -0.55 0.00 0.00 56.30 55.59 2wdr h ASN 518 Cb 0.66 -0.21 -0.11 0.00 0.05 0.00 0.00 38.32 38.72 2wdr h ASN 518 CO -0.17 1.60 0.45 -0.07 -1.65 0.00 0.00 177.43 177.59 2wdr h LEU 519 N 0.11 0.50 0.45 1.61 3.38 -0.70 -1.47 115.31 119.20 2wdr h LEU 519 Ca -0.24 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 2wdr h LEU 519 Cb 2.09 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.89 2wdr h LEU 519 CO 0.23 0.16 -0.22 -0.03 0.09 0.00 0.00 178.44 178.66 2wdr h MET 520 N 0.57 -0.58 -0.86 1.13 4.05 -1.07 -0.34 114.93 117.82 2wdr h MET 520 Ca 0.51 0.04 0.22 0.00 -0.28 0.00 0.00 59.70 60.19 2wdr h MET 520 Cb 0.82 0.13 -0.14 0.00 -0.80 0.00 0.00 31.60 31.62 2wdr h MET 520 CO -0.42 -0.39 0.23 0.93 0.23 0.00 0.00 176.91 177.50 2wdr h GLU 521 N -0.74 0.22 0.22 0.39 4.39 -1.32 0.33 114.58 118.06 2wdr h GLU 521 Ca -0.06 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 2wdr h GLU 521 Cb 0.46 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2wdr h GLU 521 CO 0.10 0.15 -0.11 1.15 -1.16 0.00 0.00 179.01 179.14 2wdr h THR 522 N 0.23 0.85 -0.93 1.13 2.02 -1.25 -1.00 112.91 113.96 2wdr h THR 522 Ca 0.53 -0.39 0.10 0.00 0.77 0.00 0.00 66.41 67.43 2wdr h THR 522 Cb 1.04 1.07 -0.07 0.00 -1.74 0.00 0.00 68.15 68.46 2wdr h THR 522 CO -0.63 0.09 0.59 0.00 0.37 0.00 0.00 175.52 175.94 2wdr h ALA 523 N 0.24 1.60 0.16 6.16 0.00 0.02 -0.58 119.26 126.87 2wdr h ALA 523 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2wdr h ALA 523 Cb 0.37 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2wdr h ALA 523 CO 0.05 0.20 -0.07 -0.92 0.00 0.00 0.00 179.25 178.50 2wdr h TYR 524 N 0.92 -0.19 -0.17 0.00 3.20 -0.83 -2.00 116.97 117.90 2wdr h TYR 524 Ca 0.43 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.30 2wdr h TYR 524 Cb 0.42 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 2wdr h TYR 524 CO -0.00 0.22 0.11 0.00 -1.64 0.00 0.00 178.16 176.85 2wdr h ALA 525 N 0.02 1.88 -0.10 1.82 0.00 -0.78 -0.14 119.26 121.97 2wdr h ALA 525 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2wdr h ALA 525 Cb 0.50 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2wdr h ALA 525 CO 0.04 0.11 0.02 1.15 0.00 0.00 0.00 179.25 180.57 2wdr h THR 526 N 0.23 1.19 -0.13 0.00 2.02 -1.03 -2.68 112.91 112.51 2wdr h THR 526 Ca 0.06 -0.60 -0.02 0.00 0.77 0.00 0.00 66.41 66.63 2wdr h THR 526 Cb -0.02 1.40 -0.00 0.00 -1.74 0.00 0.00 68.15 67.79 2wdr h THR 526 CO -0.01 0.17 0.02 0.00 0.37 0.00 0.00 175.52 176.07 2wdr h ALA 527 N 0.82 0.17 -0.80 6.16 0.00 -0.38 0.28 119.26 125.50 2wdr h ALA 527 Ca 0.03 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.88 2wdr h ALA 527 Cb 0.25 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2wdr h ALA 527 CO 0.00 -0.17 0.52 0.28 0.00 0.00 0.00 179.25 179.89 2wdr h VAL 528 N -0.02 0.94 -0.01 0.00 2.07 -1.17 -2.37 116.25 115.69 2wdr h VAL 528 Ca 0.04 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2wdr h VAL 528 Cb 0.31 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 2wdr h VAL 528 CO 0.00 0.13 -0.08 0.28 0.02 0.00 0.00 177.57 177.92 2wdr h SER 529 N 0.73 0.09 -0.78 0.57 0.02 -1.12 -2.96 113.55 110.10 2wdr h SER 529 Ca 0.37 -0.71 0.10 0.00 -0.84 0.00 0.00 61.79 60.72 2wdr h SER 529 Cb 0.47 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.93 2wdr h SER 529 CO -0.15 0.79 0.51 0.00 -1.14 0.00 0.00 176.83 176.84 2wdr h ALA 530 N 0.30 1.82 -0.00 3.77 0.00 -0.74 -0.79 119.26 123.62 2wdr h ALA 530 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wdr h ALA 530 Cb 0.79 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2wdr h ALA 530 CO 0.02 0.01 0.00 -0.91 0.00 0.00 0.00 179.25 178.37 2wdr h ASN 531 N 0.67 0.00 -0.54 0.00 4.21 -1.50 -3.29 115.58 115.14 2wdr h ASN 531 Ca 0.36 -0.15 0.09 0.00 1.21 0.00 0.00 56.30 57.82 2wdr h ASN 531 Cb 0.51 -0.00 -0.08 0.00 -1.12 0.00 0.00 38.32 37.63 2wdr h ASN 531 CO -0.14 0.15 0.12 0.15 -1.29 0.00 0.00 177.43 176.42 2wdr h PHE 532 N -0.14 0.19 -2.53 1.19 3.57 -0.99 -3.38 116.94 114.85 2wdr h PHE 532 Ca 0.00 0.03 -0.54 0.00 3.53 0.00 0.00 57.97 61.00 2wdr h PHE 532 Cb 0.15 -0.00 -0.06 0.00 2.79 0.00 0.00 35.95 38.83 2wdr h PHE 532 CO -0.03 -0.01 1.16 0.50 -2.23 0.00 0.00 178.31 177.70 2wdr s ARG 533 N -6.13 3.13 -1.09 1.11 3.52 -0.87 -4.88 118.95 113.74 2wdr s ARG 533 Ca -0.13 0.39 -0.03 0.00 -0.13 0.00 0.00 55.73 55.82 2wdr s ARG 533 Cb 0.16 -4.20 0.20 0.00 -1.56 0.00 0.00 34.95 29.55 2wdr s ARG 533 CO 0.73 -2.16 2.21 0.25 -0.81 0.00 0.00 175.30 175.52 2wdr n THR 534 N 6.86 5.22 -3.10 4.11 -2.24 -1.26 -4.87 114.28 119.00 2wdr n THR 534 Ca 0.13 -4.75 0.00 0.00 -2.27 0.00 0.00 64.05 57.15 2wdr n THR 534 Cb 0.50 -1.78 0.00 0.00 -2.10 0.00 0.00 70.33 66.95 2wdr n THR 534 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2wdr n GLU 535 N 0.84 0.00 -3.72 -0.78 0.28 -1.26 -4.91 120.64 111.08 2wdr n GLU 535 Ca 0.55 0.00 -0.25 0.00 -0.16 0.00 0.00 57.16 57.30 2wdr n GLU 535 Cb 0.28 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 32.98 2wdr n GLU 535 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2wdr s SER 536 N -0.76 2.10 -0.09 -1.84 0.01 -0.81 -4.25 113.70 108.06 2wdr s SER 536 Ca 0.00 -0.40 -0.05 0.00 1.31 0.00 0.00 55.95 56.81 2wdr s SER 536 Cb 0.00 -0.42 0.04 0.00 0.21 0.00 0.00 66.02 65.84 2wdr s SER 536 CO 0.00 -0.26 0.22 -0.60 0.41 0.00 0.00 173.24 173.00 2wdr s ARG 537 N 1.99 0.20 6.30 12.44 3.52 -0.62 -3.41 118.95 139.36 2wdr s ARG 537 Ca 0.03 0.43 0.00 0.00 -0.13 0.00 0.00 55.73 56.06 2wdr s ARG 537 Cb -0.14 -0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.18 2wdr s ARG 537 CO -0.07 -0.12 0.00 0.41 -0.81 0.00 0.00 175.30 174.71 2wdr n GLY 538 N 3.85 3.55 0.19 8.12 0.00 -1.26 -2.08 105.19 117.56 2wdr n GLY 538 Ca -0.22 0.01 -0.07 0.00 0.00 0.00 0.00 46.02 45.74 2wdr n GLY 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdr h ALA 539 N -0.79 0.77 -2.14 4.61 0.00 -1.51 -3.43 119.26 116.77 2wdr h ALA 539 Ca 0.00 -0.53 -0.56 0.00 0.00 0.00 0.00 54.91 53.82 2wdr h ALA 539 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2wdr h ALA 539 CO 0.00 0.71 1.11 -1.58 0.00 0.00 0.00 179.25 179.49 2wdr s HIS 540 N -3.84 2.05 -0.23 0.00 5.04 -0.88 -4.92 115.29 112.51 2wdr s HIS 540 Ca -0.05 0.42 -0.03 0.00 -1.54 0.00 0.00 55.06 53.86 2wdr s HIS 540 Cb 0.12 -3.93 0.07 0.00 0.04 0.00 0.00 32.58 28.88 2wdr s HIS 540 CO 0.82 -3.31 0.06 0.45 -2.34 0.00 0.00 174.74 170.42 2wdr s SER 541 N 3.89 3.20 -0.12 9.88 0.15 -1.26 -1.59 113.70 127.85 2wdr s SER 541 Ca 0.72 -1.04 -0.05 0.00 0.70 0.00 0.00 55.95 56.29 2wdr s SER 541 Cb -0.29 -0.62 -0.04 0.00 -1.71 0.00 0.00 66.02 63.37 2wdr s SER 541 CO 0.29 -0.34 0.05 -0.13 1.20 0.00 0.00 173.24 174.31 2wdr s ARG 542 N 1.84 3.35 0.20 5.44 0.52 -1.26 -0.33 118.95 128.72 2wdr s ARG 542 Ca 0.02 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 54.93 2wdr s ARG 542 Cb -0.17 -3.00 0.13 0.00 0.52 0.00 0.00 34.95 32.43 2wdr s ARG 542 CO -0.14 0.62 1.48 0.74 0.02 0.00 0.00 175.30 178.02 2wdr h PHE 543 N 5.48 0.43 -0.00 -0.53 0.04 -1.60 -3.13 116.94 117.63 2wdr h PHE 543 Ca -0.48 -0.18 0.00 0.00 2.80 0.00 0.00 57.97 60.10 2wdr h PHE 543 Cb 1.20 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 39.28 2wdr h PHE 543 CO 0.65 0.90 -0.01 -0.40 -0.60 0.00 0.00 178.31 178.86 2wdr n ASP 544 N -3.84 0.11 -2.92 2.17 5.75 -1.26 -4.04 116.55 112.52 2wdr n ASP 544 Ca -0.03 -0.84 -0.14 0.00 -0.01 0.00 0.00 54.79 53.77 2wdr n ASP 544 Cb 0.67 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 2wdr n ASP 544 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2wdr n PHE 545 N -0.99 -2.24 0.89 2.11 3.72 -1.19 -5.01 117.46 114.75 2wdr n PHE 545 Ca 0.21 -2.43 0.12 0.00 -0.05 0.00 0.00 57.45 55.30 2wdr n PHE 545 Cb 0.16 0.85 0.54 0.00 -0.94 0.00 0.00 39.48 40.08 2wdr n PHE 545 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 2wdr n PRO 546 N 1.60 0.04 -3.73 -1.08 -0.02 -1.19 -2.66 135.00 127.97 2wdr n PRO 546 Ca 0.14 0.07 -0.32 0.00 -2.02 0.00 0.00 63.50 61.37 2wdr n PRO 546 Cb 0.59 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.52 2wdr n PRO 546 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2wdr s ASP 547 N -2.95 6.48 -0.25 2.55 1.01 -1.26 -4.62 116.67 117.63 2wdr s ASP 547 Ca 0.13 0.54 -0.28 0.00 0.71 0.00 0.00 52.55 53.66 2wdr s ASP 547 Cb 0.16 -2.07 0.01 0.00 1.01 0.00 0.00 42.92 42.03 2wdr s ASP 547 CO 0.44 0.13 0.99 -0.60 0.21 0.00 0.00 175.17 176.34 2wdr s ARG 548 N -2.37 4.20 -0.84 8.23 3.52 -1.22 -1.92 118.95 128.55 2wdr s ARG 548 Ca 0.36 1.19 -0.12 0.00 -0.13 0.00 0.00 55.73 57.04 2wdr s ARG 548 Cb -0.13 -3.66 0.22 0.00 -1.56 0.00 0.00 34.95 29.82 2wdr s ARG 548 CO 0.23 -0.65 0.77 0.34 -0.81 0.00 0.00 175.30 175.18 2wdr s ASP 549 N 1.32 6.62 0.00 -2.12 2.15 -1.26 -4.88 116.67 118.49 2wdr s ASP 549 Ca 0.42 -2.87 0.22 0.00 0.43 0.00 0.00 52.55 50.74 2wdr s ASP 549 Cb -0.15 -2.15 1.11 0.00 -0.30 0.00 0.00 42.92 41.43 2wdr s ASP 549 CO 0.08 -0.49 1.70 0.47 -0.17 0.00 0.00 175.17 176.75 2wdr n ASP 550 N 3.68 0.00 -0.00 -0.34 9.92 -1.26 -0.95 116.55 127.60 2wdr n ASP 550 Ca 0.15 -0.08 -0.07 0.00 -0.53 0.00 0.00 54.79 54.26 2wdr n ASP 550 Cb 0.44 -0.26 -0.13 0.00 -0.64 0.00 0.00 41.12 40.54 2wdr n ASP 550 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2wdr h GLU 551 N 0.00 0.00 0.00 -1.24 5.08 -1.98 -3.36 114.58 113.08 2wdr h GLU 551 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wdr h GLU 551 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2wdr h GLU 551 CO 0.00 0.50 -0.55 0.09 -1.00 0.00 0.00 179.01 178.05 2wdr n ASN 552 N -3.05 2.76 -0.27 1.42 3.02 -1.13 -4.80 115.26 113.22 2wdr n ASN 552 Ca -0.14 -0.22 0.05 0.00 -0.03 0.00 0.00 54.58 54.23 2wdr n ASN 552 Cb 1.00 1.00 0.07 0.00 -0.61 0.00 0.00 39.78 41.24 2wdr n ASN 552 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2wdr n TRP 553 N -1.27 0.00 -1.96 3.10 7.02 -0.12 -4.85 117.44 119.35 2wdr n TRP 553 Ca 0.00 -0.49 -0.42 0.00 -1.02 0.00 0.00 57.50 55.57 2wdr n TRP 553 Cb 0.00 -0.10 -0.00 0.00 -2.42 0.00 0.00 31.31 28.79 2wdr n TRP 553 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2wdr n LEU 554 N -0.69 6.11 -3.84 -0.99 7.94 -1.25 -4.79 117.00 119.49 2wdr n LEU 554 Ca 0.08 -4.00 -0.01 0.00 -1.11 0.00 0.00 56.01 50.97 2wdr n LEU 554 Cb 0.65 -1.66 0.01 0.00 0.53 0.00 0.00 43.42 42.94 2wdr n LEU 554 CO 0.00 0.71 0.94 0.00 -1.11 0.00 0.00 177.39 177.93 2wdr s HIS 556 N -2.32 3.46 -0.05 0.00 3.76 -0.41 -4.90 115.29 114.84 2wdr s HIS 556 Ca 0.21 0.66 -0.09 0.00 -0.15 0.00 0.00 55.06 55.69 2wdr s HIS 556 Cb -0.00 -2.10 -0.05 0.00 1.11 0.00 0.00 32.58 31.54 2wdr s HIS 556 CO 0.01 0.27 0.25 -1.54 -0.85 0.00 0.00 174.74 172.89 2wdr s SER 557 N -2.79 6.54 -0.10 1.40 1.04 -1.26 -1.77 113.70 116.76 2wdr s SER 557 Ca 0.44 0.63 0.02 0.00 0.48 0.00 0.00 55.95 57.52 2wdr s SER 557 Cb -0.11 -2.13 0.01 0.00 0.10 0.00 0.00 66.02 63.89 2wdr s SER 557 CO 0.26 0.34 -0.16 -0.22 0.98 0.00 0.00 173.24 174.44 2wdr s LEU 558 N -1.28 1.76 -0.49 2.42 2.96 -0.37 -0.53 118.68 123.15 2wdr s LEU 558 Ca 0.21 -0.42 -0.18 0.00 -0.22 0.00 0.00 54.13 53.53 2wdr s LEU 558 Cb -0.14 -1.07 0.06 0.00 0.50 0.00 0.00 46.19 45.54 2wdr s LEU 558 CO 0.10 0.04 0.52 -0.47 -1.32 0.00 0.00 176.35 175.23 2wdr s TYR 559 N 0.81 3.13 -0.39 5.38 5.04 -0.02 -0.68 117.35 130.62 2wdr s TYR 559 Ca -0.10 -0.67 -0.29 0.00 -2.44 0.00 0.00 57.07 53.57 2wdr s TYR 559 Cb -0.16 -3.34 0.02 0.00 0.35 0.00 0.00 41.96 38.83 2wdr s TYR 559 CO 0.01 -0.91 1.20 -0.51 -1.34 0.00 0.00 175.55 174.01 2wdr s LEU 560 N 2.21 3.75 0.19 6.97 1.43 -0.21 -3.08 118.68 129.94 2wdr s LEU 560 Ca 0.11 0.83 -0.06 0.00 -1.03 0.00 0.00 54.13 53.98 2wdr s LEU 560 Cb -0.21 -3.54 0.11 0.00 0.03 0.00 0.00 46.19 42.57 2wdr s LEU 560 CO 0.10 -1.16 1.56 -0.65 0.23 0.00 0.00 176.35 176.43 2wdr h PRO 561 N 9.21 0.77 -0.43 1.29 0.11 -1.85 -0.42 132.00 140.69 2wdr h PRO 561 Ca -0.24 -0.37 -0.10 0.00 0.11 0.00 0.00 66.00 65.40 2wdr h PRO 561 Cb 1.08 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 2wdr h PRO 561 CO 1.08 1.00 -0.14 0.93 -0.21 0.00 0.00 178.00 180.66 2wdr h GLU 562 N 0.64 0.78 -0.15 1.05 5.08 -1.89 -2.89 114.58 117.20 2wdr h GLU 562 Ca 0.06 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2wdr h GLU 562 Cb 0.89 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2wdr h GLU 562 CO 0.08 0.88 0.00 -1.13 -1.00 0.00 0.00 179.01 177.84 2wdr n SER 563 N -4.15 2.86 -3.93 1.42 3.41 -1.21 -4.97 113.62 107.05 2wdr n SER 563 Ca 0.01 -1.86 -0.32 0.00 -0.26 0.00 0.00 58.87 56.44 2wdr n SER 563 Cb 0.38 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.23 2wdr n SER 563 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wdr n GLU 564 N 1.15 -3.24 -4.61 4.33 1.02 -0.19 -4.95 120.64 114.15 2wdr n GLU 564 Ca 0.13 0.39 -0.28 0.00 -0.02 0.00 0.00 57.16 57.39 2wdr n GLU 564 Cb 0.51 -5.11 -0.10 0.00 -0.02 0.00 0.00 31.44 26.72 2wdr n GLU 564 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2wdr s SER 565 N -3.08 3.51 0.32 1.62 1.04 -1.06 -4.97 113.70 111.08 2wdr s SER 565 Ca 0.63 -1.48 0.08 0.00 0.48 0.00 0.00 55.95 55.66 2wdr s SER 565 Cb -0.34 -0.00 -0.03 0.00 0.10 0.00 0.00 66.02 65.74 2wdr s SER 565 CO 0.78 -0.64 0.24 -0.04 0.98 0.00 0.00 173.24 174.56 2wdr s MET 566 N -3.79 2.67 0.00 4.02 -1.94 -1.26 -1.05 119.30 117.94 2wdr s MET 566 Ca 0.27 -1.31 0.00 0.00 -1.71 0.00 0.00 55.69 52.93 2wdr s MET 566 Cb 0.07 -2.42 0.00 0.00 2.01 0.00 0.00 34.83 34.49 2wdr s MET 566 CO 0.13 0.16 0.00 -2.37 -0.01 0.00 0.00 175.02 172.93 2wdr n THR 567 N -1.28 0.00 -4.05 2.05 5.66 0.14 -4.90 114.28 111.90 2wdr n THR 567 Ca -0.03 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.88 2wdr n THR 567 Cb 0.60 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.27 2wdr n THR 567 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2wdr s ARG 568 N 0.31 0.51 0.04 1.09 0.52 -1.26 -1.24 118.95 118.92 2wdr s ARG 568 Ca 0.00 -0.95 0.04 0.00 -0.52 0.00 0.00 55.73 54.30 2wdr s ARG 568 Cb 0.00 0.08 -0.02 0.00 0.52 0.00 0.00 34.95 35.53 2wdr s ARG 568 CO 0.00 -0.06 -0.13 1.03 0.02 0.00 0.00 175.30 176.16 2wdr s ARG 569 N -2.73 0.84 0.48 3.54 0.52 -0.73 -4.85 118.95 116.02 2wdr s ARG 569 Ca -0.03 -0.72 -0.24 0.00 -0.52 0.00 0.00 55.73 54.23 2wdr s ARG 569 Cb -0.01 -0.82 -0.08 0.00 0.52 0.00 0.00 34.95 34.56 2wdr s ARG 569 CO -0.05 0.20 1.30 0.43 0.02 0.00 0.00 175.30 177.20 2wdr n SER 570 N 1.92 2.59 -4.71 0.23 7.64 -1.26 -1.29 113.62 118.74 2wdr n SER 570 Ca -0.18 1.05 -0.40 0.00 1.01 0.00 0.00 58.87 60.35 2wdr n SER 570 Cb 0.55 -1.53 -0.05 0.00 -1.01 0.00 0.00 64.21 62.17 2wdr n SER 570 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2wdr s VAL 571 N -1.25 5.04 0.17 0.44 1.01 -1.26 -4.65 120.40 119.91 2wdr s VAL 571 Ca 0.65 1.42 -0.30 0.00 0.00 0.00 0.00 61.98 63.75 2wdr s VAL 571 Cb -0.46 -4.03 -0.08 0.00 0.00 0.00 0.00 36.38 31.81 2wdr s VAL 571 CO 0.54 0.23 1.22 0.21 0.00 0.00 0.00 175.10 177.30 2wdr s ASN 572 N 0.85 7.05 -0.28 3.32 3.84 -1.26 -4.93 114.94 123.52 2wdr s ASN 572 Ca 0.36 2.24 0.18 0.00 0.21 0.00 0.00 52.86 55.85 2wdr s ASN 572 Cb -0.17 -2.60 0.49 0.00 -0.55 0.00 0.00 41.25 38.41 2wdr s ASN 572 CO 0.17 -0.41 1.10 0.23 -2.79 0.00 0.00 177.10 175.40 2wdr n MET 573 N 2.69 2.12 -3.52 0.43 2.81 -1.26 -1.22 117.12 119.17 2wdr n MET 573 Ca 0.05 -3.66 -0.28 0.00 -1.81 0.00 0.00 57.70 52.00 2wdr n MET 573 Cb 0.44 -1.72 -0.11 0.00 -0.71 0.00 0.00 33.22 31.12 2wdr n MET 573 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2wdr s GLU 574 N -3.65 1.01 1.04 0.03 2.02 -1.26 -4.60 118.70 113.30 2wdr s GLU 574 Ca 0.33 -1.96 -0.17 0.00 0.02 0.00 0.00 54.97 53.19 2wdr s GLU 574 Cb 0.36 -1.74 0.27 0.00 0.10 0.00 0.00 34.13 33.12 2wdr s GLU 574 CO -0.02 -1.28 0.73 -2.30 0.02 0.00 0.00 175.26 172.41 2wdr n PRO 575 N 3.27 -3.57 0.00 0.39 -0.02 -1.26 -4.47 135.00 129.34 2wdr n PRO 575 Ca 0.19 -1.19 0.00 0.00 -2.02 0.00 0.00 63.50 60.48 2wdr n PRO 575 Cb 0.41 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 2wdr n PRO 575 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2wdr n LYS 576 N -4.55 1.02 0.00 -0.52 4.76 -1.26 -4.78 118.16 112.84 2wdr n LYS 576 Ca 0.11 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.57 2wdr n LYS 576 Cb 0.45 -0.94 -0.02 0.00 -1.84 0.00 0.00 35.03 32.68 2wdr n LYS 576 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2wdr n LEU 577 N -1.38 0.46 -3.73 -0.35 4.77 -1.26 -5.01 117.00 110.50 2wdr n LEU 577 Ca 0.00 -0.59 -0.10 0.00 -0.03 0.00 0.00 56.01 55.30 2wdr n LEU 577 Cb 0.05 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.10 2wdr n LEU 577 CO 0.00 0.10 0.24 0.00 -1.33 0.00 0.00 177.39 176.41 2wdr s ARG 578 N -1.31 1.33 0.59 3.23 1.70 -1.26 -5.16 118.95 118.06 2wdr s ARG 578 Ca 0.03 -0.85 -0.16 0.00 -0.47 0.00 0.00 55.73 54.27 2wdr s ARG 578 Cb 0.04 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.89 2wdr s ARG 578 CO 0.19 -0.55 1.06 -2.14 -1.08 0.00 0.00 175.30 172.77 2wdr s PRO 579 N -3.87 3.34 0.68 3.89 0.02 -1.26 -4.43 135.00 133.36 2wdr s PRO 579 Ca 0.09 1.24 -0.16 0.00 0.02 0.00 0.00 61.00 62.18 2wdr s PRO 579 Cb -0.00 -2.03 0.01 0.00 0.02 0.00 0.00 34.50 32.49 2wdr s PRO 579 CO -0.04 -0.80 1.22 0.00 -0.33 0.00 0.00 177.00 177.05 2wdr s ALA 580 N -2.39 2.29 -0.25 -1.55 0.00 -1.26 -4.93 121.76 113.67 2wdr s ALA 580 Ca 0.64 0.95 -0.23 0.00 0.00 0.00 0.00 51.96 53.33 2wdr s ALA 580 Cb -0.16 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 2wdr s ALA 580 CO 0.35 -1.61 0.74 -0.06 0.00 0.00 0.00 175.76 175.18 2wdr s PHE 581 N -1.80 3.29 0.49 0.00 0.08 -1.26 -5.04 117.98 113.74 2wdr s PHE 581 Ca 0.76 0.96 -0.21 0.00 0.12 0.00 0.00 56.93 58.57 2wdr s PHE 581 Cb -0.30 -2.97 -0.07 0.00 -0.57 0.00 0.00 43.02 39.10 2wdr s PHE 581 CO 0.41 -0.38 1.09 -2.14 -0.10 0.00 0.00 175.22 174.09 2wdr s PRO 582 N 2.70 3.68 0.08 0.24 0.02 -1.26 -4.95 135.00 135.51 2wdr s PRO 582 Ca 0.31 1.52 -0.31 0.00 0.02 0.00 0.00 61.00 62.54 2wdr s PRO 582 Cb -0.15 -2.15 -0.08 0.00 0.02 0.00 0.00 34.50 32.13 2wdr s PRO 582 CO 0.08 -0.56 1.53 -2.14 -0.33 0.00 0.00 177.00 175.59 2wdr s PRO 583 N -3.10 4.24 0.28 5.54 0.02 -1.26 -5.00 135.00 135.73 2wdr s PRO 583 Ca 0.68 2.21 0.04 0.00 0.02 0.00 0.00 61.00 63.95 2wdr s PRO 583 Cb -0.21 -3.45 -0.02 0.00 0.02 0.00 0.00 34.50 30.85 2wdr s PRO 583 CO 0.25 -0.62 0.15 0.36 -0.33 0.00 0.00 177.00 176.81 2wdr n LYS 584 N 4.94 0.51 -2.20 5.54 2.85 -1.26 -5.12 118.16 123.41 2wdr n LYS 584 Ca 0.14 -2.52 -0.41 0.00 -1.05 0.00 0.00 58.31 54.47 2wdr n LYS 584 Cb 0.41 1.67 -0.03 0.00 -0.65 0.00 0.00 35.03 36.43 2wdr n LYS 584 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2wdr s ILE 585 N -2.83 3.06 -0.48 0.58 1.01 -1.26 -4.98 121.20 116.30 2wdr s ILE 585 Ca 0.22 0.94 -0.06 0.00 0.00 0.00 0.00 60.65 61.74 2wdr s ILE 585 Cb 0.01 -3.60 0.12 0.00 0.01 0.00 0.00 42.46 39.00 2wdr s ILE 585 CO 0.15 0.18 0.32 -0.60 0.00 0.00 0.00 174.94 174.99 2wdr s ARG 586 N -0.76 2.36 0.04 2.79 3.52 -1.26 -5.06 118.95 120.58 2wdr s ARG 586 Ca 0.53 -1.90 0.02 0.00 -0.13 0.00 0.00 55.73 54.25 2wdr s ARG 586 Cb -0.37 -3.81 -0.02 0.00 -1.56 0.00 0.00 34.95 29.19 2wdr s ARG 586 CO 0.43 -1.16 -0.08 0.95 -0.81 0.00 0.00 175.30 174.64 2wdr s THR 587 N 1.08 0.53 -1.26 4.11 -4.23 -1.26 -5.16 115.64 109.44 2wdr s THR 587 Ca 0.08 -1.06 0.10 0.00 -1.18 0.00 0.00 61.69 59.63 2wdr s THR 587 Cb -0.24 -0.59 0.08 0.00 1.34 0.00 0.00 72.50 73.09 2wdr s THR 587 CO -0.03 -0.38 0.82 -1.22 -0.54 0.00 0.00 174.62 173.28