#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d3w s LEU 2 N 0.00 2.87 -0.09 -0.89 2.96 0.04 0.04 118.68 123.61 2d3w s LEU 2 Ca 0.00 -0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 53.59 2d3w s LEU 2 Cb 0.00 -1.68 0.03 0.00 0.50 0.00 0.00 46.19 45.03 2d3w s LEU 2 CO 0.00 0.11 -0.03 -0.55 -1.32 0.00 0.00 176.35 174.56 2d3w s SER 3 N 0.69 1.91 -0.25 3.68 0.15 -0.47 -0.06 113.70 119.35 2d3w s SER 3 Ca -0.04 -0.21 -0.01 0.00 0.70 0.00 0.00 55.95 56.39 2d3w s SER 3 Cb -0.15 -0.63 0.03 0.00 -1.71 0.00 0.00 66.02 63.56 2d3w s SER 3 CO 0.02 -0.16 -0.06 -0.63 1.20 0.00 0.00 173.24 173.60 2d3w s ILE 4 N 1.85 2.79 -0.19 6.45 1.01 0.11 -1.82 121.20 131.39 2d3w s ILE 4 Ca 0.05 -1.12 -0.01 0.00 0.00 0.00 0.00 60.65 59.56 2d3w s ILE 4 Cb -0.13 -2.45 -0.00 0.00 0.01 0.00 0.00 42.46 39.90 2d3w s ILE 4 CO -0.07 0.16 -0.11 -0.54 0.00 0.00 0.00 174.94 174.38 2d3w s LYS 5 N 1.29 3.25 -1.02 2.79 1.02 -0.91 0.82 119.74 126.98 2d3w s LYS 5 Ca -0.01 -0.71 -0.17 0.00 0.02 0.00 0.00 55.97 55.10 2d3w s LYS 5 Cb -0.17 -2.78 0.02 0.00 -0.52 0.00 0.00 37.83 34.37 2d3w s LYS 5 CO -0.04 -0.12 0.67 -0.25 -0.92 0.00 0.00 175.35 174.69 2d3w n ASP 6 N 4.48 -4.84 -4.70 2.83 9.92 -1.16 -1.90 116.55 121.19 2d3w n ASP 6 Ca -0.19 -1.05 -0.39 0.00 -0.53 0.00 0.00 54.79 52.62 2d3w n ASP 6 Cb 0.51 -2.16 -0.06 0.00 -0.64 0.00 0.00 41.12 38.77 2d3w n ASP 6 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2d3w s LEU 7 N -6.13 4.24 -0.12 0.64 2.96 0.34 -2.25 118.68 118.36 2d3w s LEU 7 Ca 0.27 0.90 0.02 0.00 -0.22 0.00 0.00 54.13 55.10 2d3w s LEU 7 Cb -0.13 -2.85 -0.00 0.00 0.50 0.00 0.00 46.19 43.70 2d3w s LEU 7 CO 0.91 -0.12 -0.19 -1.00 -1.32 0.00 0.00 176.35 174.63 2d3w s HIS 8 N 1.14 2.69 -0.02 5.38 3.76 0.22 0.13 115.29 128.59 2d3w s HIS 8 Ca 0.29 -0.95 0.01 0.00 -0.15 0.00 0.00 55.06 54.26 2d3w s HIS 8 Cb -0.16 -1.80 0.01 0.00 1.11 0.00 0.00 32.58 31.74 2d3w s HIS 8 CO 0.12 -0.39 -0.03 0.08 -0.85 0.00 0.00 174.74 173.68 2d3w s VAL 9 N 0.49 0.29 0.14 -0.90 1.01 -0.40 -0.58 120.40 120.45 2d3w s VAL 9 Ca -0.12 -0.08 0.10 0.00 0.00 0.00 0.00 61.98 61.87 2d3w s VAL 9 Cb -0.17 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.88 2d3w s VAL 9 CO 0.05 0.12 -0.19 -0.44 0.00 0.00 0.00 175.10 174.64 2d3w s SER 10 N 0.35 3.79 0.00 3.32 0.01 0.39 -0.36 113.70 121.20 2d3w s SER 10 Ca -0.04 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.58 2d3w s SER 10 Cb -0.07 -0.47 0.00 0.00 0.21 0.00 0.00 66.02 65.69 2d3w s SER 10 CO -0.01 0.16 0.00 0.52 0.41 0.00 0.00 173.24 174.32 2d3w n VAL 11 N 0.59 0.00 -1.95 3.43 0.31 0.61 -0.69 118.33 120.62 2d3w n VAL 11 Ca -0.15 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.78 2d3w n VAL 11 Cb 0.54 -0.06 -0.01 0.00 -0.91 0.00 0.00 33.84 33.40 2d3w n VAL 11 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2d3w n GLU 12 N 0.00 3.97 -1.11 5.55 -0.58 -1.26 -4.42 120.64 122.78 2d3w n GLU 12 Ca 0.00 -3.17 -0.08 0.00 -0.42 0.00 0.00 57.16 53.48 2d3w n GLU 12 Cb 0.00 -2.82 -0.04 0.00 -0.57 0.00 0.00 31.44 28.02 2d3w n GLU 12 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2d3w n ASP 13 N 3.14 -4.00 -4.61 1.62 9.92 -1.26 -4.91 116.55 116.46 2d3w n ASP 13 Ca 0.57 0.21 -0.34 0.00 -0.53 0.00 0.00 54.79 54.70 2d3w n ASP 13 Cb 0.29 -3.14 -0.10 0.00 -0.64 0.00 0.00 41.12 37.53 2d3w n ASP 13 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2d3w s LYS 14 N -2.45 3.62 0.01 -1.24 1.02 -1.26 -5.07 119.74 114.37 2d3w s LYS 14 Ca 0.00 -0.41 -0.30 0.00 0.02 0.00 0.00 55.97 55.28 2d3w s LYS 14 Cb 0.00 -3.01 -0.05 0.00 -0.52 0.00 0.00 37.83 34.25 2d3w s LYS 14 CO 0.00 0.39 1.21 0.00 -0.92 0.00 0.00 175.35 176.03 2d3w s ALA 15 N 0.01 3.44 0.07 5.17 0.00 -1.26 -0.29 121.76 128.91 2d3w s ALA 15 Ca 0.03 0.76 0.00 0.00 0.00 0.00 0.00 51.96 52.75 2d3w s ALA 15 Cb -0.13 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2d3w s ALA 15 CO 0.02 -0.59 0.00 -0.89 0.00 0.00 0.00 175.76 174.29 2d3w n ILE 16 N 4.25 0.52 -3.44 0.00 5.41 0.51 -4.95 119.36 121.66 2d3w n ILE 16 Ca 0.10 0.17 -0.38 0.00 1.00 0.00 0.00 62.75 63.64 2d3w n ILE 16 Cb 0.46 -1.34 -0.06 0.00 -0.71 0.00 0.00 39.64 37.99 2d3w n ILE 16 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2d3w s LEU 17 N -6.42 4.38 -0.54 1.39 1.43 -0.90 -2.46 118.68 115.56 2d3w s LEU 17 Ca 0.00 0.86 0.07 0.00 -1.03 0.00 0.00 54.13 54.03 2d3w s LEU 17 Cb 0.00 -2.60 0.24 0.00 0.03 0.00 0.00 46.19 43.86 2d3w s LEU 17 CO 0.00 0.19 0.62 0.54 0.23 0.00 0.00 176.35 177.93 2d3w n ARG 18 N 2.65 1.67 -2.20 1.70 1.74 0.19 -1.27 116.66 121.14 2d3w n ARG 18 Ca -0.11 -4.04 -0.00 0.00 -0.77 0.00 0.00 57.85 52.93 2d3w n ARG 18 Cb 0.52 -1.84 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 2d3w n ARG 18 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2d3w n GLY 19 N 1.25 0.64 3.72 -0.13 0.00 0.34 -4.66 105.19 106.34 2d3w n GLY 19 Ca 0.26 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 2d3w n GLY 19 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2d3w s LEU 20 N -1.63 4.37 -0.02 0.99 0.20 -0.64 -4.34 118.68 117.61 2d3w s LEU 20 Ca 0.00 1.48 0.06 0.00 0.69 0.00 0.00 54.13 56.37 2d3w s LEU 20 Cb -0.00 -3.37 -0.02 0.00 -0.43 0.00 0.00 46.19 42.38 2d3w s LEU 20 CO 0.00 -0.17 -0.21 -0.44 -0.29 0.00 0.00 176.35 175.24 2d3w s SER 21 N 0.77 2.51 -0.29 3.68 0.01 -1.26 -0.50 113.70 118.62 2d3w s SER 21 Ca 0.45 -0.39 -0.17 0.00 1.31 0.00 0.00 55.95 57.15 2d3w s SER 21 Cb -0.20 -0.31 0.15 0.00 0.21 0.00 0.00 66.02 65.87 2d3w s SER 21 CO 0.24 0.26 1.03 -0.22 0.41 0.00 0.00 173.24 174.96 2d3w s LEU 22 N -0.47 -0.43 -0.05 2.44 2.96 0.24 -4.91 118.68 118.46 2d3w s LEU 22 Ca 0.07 0.71 0.04 0.00 -0.22 0.00 0.00 54.13 54.74 2d3w s LEU 22 Cb -0.09 1.66 -0.02 0.00 0.50 0.00 0.00 46.19 48.24 2d3w s LEU 22 CO -0.01 -0.11 -0.16 -1.81 -1.32 0.00 0.00 176.35 172.94 2d3w s ASP 23 N 1.16 3.84 -0.07 3.68 1.11 -1.26 0.08 116.67 125.22 2d3w s ASP 23 Ca -0.07 -0.26 0.00 0.00 0.18 0.00 0.00 52.55 52.40 2d3w s ASP 23 Cb -0.04 -0.81 0.02 0.00 1.07 0.00 0.00 42.92 43.17 2d3w s ASP 23 CO -0.13 0.33 -0.05 -0.69 1.18 0.00 0.00 175.17 175.81 2d3w s VAL 24 N -0.63 0.66 0.33 -1.27 1.01 0.92 -4.99 120.40 116.42 2d3w s VAL 24 Ca 0.09 -0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.02 2d3w s VAL 24 Cb -0.11 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 2d3w s VAL 24 CO 0.01 0.28 0.20 -1.00 0.00 0.00 0.00 175.10 174.59 2d3w s HIS 25 N 1.31 2.83 0.17 5.22 3.76 -1.26 -0.78 115.29 126.54 2d3w s HIS 25 Ca -0.04 -0.31 -0.32 0.00 -0.15 0.00 0.00 55.06 54.23 2d3w s HIS 25 Cb -0.14 -1.66 -0.16 0.00 1.11 0.00 0.00 32.58 31.73 2d3w s HIS 25 CO -0.02 0.30 1.04 -2.30 -0.85 0.00 0.00 174.74 172.91 2d3w n PRO 26 N -1.24 0.91 0.00 8.40 -0.02 -1.26 -2.15 135.00 139.64 2d3w n PRO 26 Ca -0.03 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 2d3w n PRO 26 Cb 0.60 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 2d3w n PRO 26 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2d3w n GLY 27 N 1.86 2.92 3.84 -1.23 0.00 -0.99 -4.85 105.19 106.74 2d3w n GLY 27 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2d3w n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2d3w s GLU 28 N -0.30 4.00 -0.19 1.61 2.02 -0.92 -4.81 118.70 120.11 2d3w s GLU 28 Ca 0.00 0.96 0.00 0.00 0.02 0.00 0.00 54.97 55.95 2d3w s GLU 28 Cb 0.00 -2.16 0.05 0.00 0.10 0.00 0.00 34.13 32.12 2d3w s GLU 28 CO 0.00 -0.21 -0.06 0.08 0.02 0.00 0.00 175.26 175.09 2d3w s VAL 29 N -2.52 1.33 0.05 2.63 1.01 -1.26 -0.65 120.40 120.98 2d3w s VAL 29 Ca 0.59 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.73 2d3w s VAL 29 Cb -0.10 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 2d3w s VAL 29 CO 0.28 0.06 -0.02 -1.00 0.00 0.00 0.00 175.10 174.42 2d3w s HIS 30 N 1.52 2.97 -0.00 5.22 3.76 0.20 -1.60 115.29 127.36 2d3w s HIS 30 Ca -0.02 -0.01 0.08 0.00 -0.15 0.00 0.00 55.06 54.97 2d3w s HIS 30 Cb -0.17 -1.58 -0.02 0.00 1.11 0.00 0.00 32.58 31.92 2d3w s HIS 30 CO -0.07 0.45 -0.26 0.00 -0.85 0.00 0.00 174.74 174.01 2d3w s ALA 31 N -1.18 2.17 -0.08 -1.40 0.00 -0.84 0.10 121.76 120.53 2d3w s ALA 31 Ca 0.22 -1.15 0.03 0.00 0.00 0.00 0.00 51.96 51.05 2d3w s ALA 31 Cb -0.11 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.49 2d3w s ALA 31 CO 0.14 0.53 -0.16 0.42 0.00 0.00 0.00 175.76 176.68 2d3w s ILE 32 N -0.66 1.47 0.17 0.00 -1.09 0.17 -1.13 121.20 120.14 2d3w s ILE 32 Ca 0.10 -0.66 -0.07 0.00 -2.23 0.00 0.00 60.65 57.79 2d3w s ILE 32 Cb -0.10 -1.32 -0.02 0.00 -1.58 0.00 0.00 42.46 39.45 2d3w s ILE 32 CO -0.00 0.43 0.24 0.00 -1.23 0.00 0.00 174.94 174.38 2d3w s MET 33 N 0.64 1.16 0.00 2.79 0.23 -0.19 -2.09 119.30 121.84 2d3w s MET 33 Ca -0.14 -1.30 0.00 0.00 -1.03 0.00 0.00 55.69 53.22 2d3w s MET 33 Cb -0.16 0.35 0.00 0.00 -1.53 0.00 0.00 34.83 33.48 2d3w s MET 33 CO 0.04 -0.41 0.00 0.41 -2.03 0.00 0.00 175.02 173.03 2d3w n GLY 34 N -0.22 1.39 3.30 3.16 0.00 -1.26 0.13 105.19 111.68 2d3w n GLY 34 Ca -0.05 -1.66 -0.31 0.00 0.00 0.00 0.00 46.02 44.00 2d3w n GLY 34 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2d3w n PRO 35 N -1.68 -1.94 0.00 1.61 -0.02 -1.26 -4.85 135.00 126.87 2d3w n PRO 35 Ca 0.00 -0.55 0.01 0.00 -2.02 0.00 0.00 63.50 60.95 2d3w n PRO 35 Cb 0.00 -1.78 0.08 0.00 -0.02 0.00 0.00 33.50 31.78 2d3w n PRO 35 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2d3w n ASN 36 N -2.41 0.00 -0.10 2.55 6.94 -1.26 -3.14 115.26 117.83 2d3w n ASN 36 Ca 0.01 -1.57 -0.11 0.00 -0.02 0.00 0.00 54.58 52.89 2d3w n ASN 36 Cb 0.60 0.00 -0.15 0.00 -2.36 0.00 0.00 39.78 37.87 2d3w n ASN 36 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2d3w n GLY 37 N 0.36 -0.89 0.00 4.83 0.00 -1.26 -4.32 105.19 103.91 2d3w n GLY 37 Ca 0.02 -0.30 0.03 0.00 0.00 0.00 0.00 46.02 45.76 2d3w n GLY 37 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2d3w n SER 38 N -2.85 0.00 -3.80 1.61 3.41 -1.19 -4.58 113.62 106.23 2d3w n SER 38 Ca -0.35 -1.06 -0.31 0.00 -0.26 0.00 0.00 58.87 56.89 2d3w n SER 38 Cb 1.13 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 65.09 2d3w n SER 38 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d3w n GLY 39 N 0.14 -1.11 0.27 5.00 0.00 -1.26 -3.69 105.19 104.54 2d3w n GLY 39 Ca 0.04 0.49 -0.11 0.00 0.00 0.00 0.00 46.02 46.44 2d3w n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d3w h LYS 40 N -1.22 0.92 -0.47 1.61 6.56 -1.90 -2.91 116.57 119.16 2d3w h LYS 40 Ca -0.61 -0.42 -0.08 0.00 -1.06 0.00 0.00 60.65 58.48 2d3w h LYS 40 Cb 1.36 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.98 2d3w h LYS 40 CO 0.43 1.08 -0.05 1.03 -2.06 0.00 0.00 179.45 179.88 2d3w h SER 41 N 0.78 0.80 1.35 0.86 0.87 -1.95 -2.59 113.55 113.65 2d3w h SER 41 Ca 0.09 -0.22 -0.01 0.00 -1.23 0.00 0.00 61.79 60.42 2d3w h SER 41 Cb 0.85 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 62.59 2d3w h SER 41 CO 0.07 0.89 -0.05 0.71 -0.53 0.00 0.00 176.83 177.92 2d3w h THR 42 N 0.75 0.11 -0.22 2.23 1.35 -1.87 -0.02 112.91 115.23 2d3w h THR 42 Ca 0.14 -0.82 -0.06 0.00 -0.55 0.00 0.00 66.41 65.11 2d3w h THR 42 Cb 0.52 1.74 -0.01 0.00 -1.73 0.00 0.00 68.15 68.68 2d3w h THR 42 CO 0.03 0.05 -0.10 0.25 -0.25 0.00 0.00 175.52 175.50 2d3w h LEU 43 N 0.00 0.47 -0.70 3.87 7.12 -1.27 -0.57 115.31 124.23 2d3w h LEU 43 Ca -0.00 -0.41 -0.13 0.00 0.13 0.00 0.00 57.88 57.47 2d3w h LEU 43 Cb 0.74 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 40.72 2d3w h LEU 43 CO 0.01 0.77 -0.64 0.77 -0.13 0.00 0.00 178.44 179.23 2d3w h SER 44 N 0.17 0.00 0.20 1.25 4.64 -1.32 -2.05 113.55 116.44 2d3w h SER 44 Ca 0.05 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.21 2d3w h SER 44 Cb 0.59 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.68 2d3w h SER 44 CO 0.03 0.64 -0.61 0.00 -0.87 0.00 0.00 176.83 176.02 2d3w h ALA 45 N 1.36 0.74 -0.34 5.18 0.00 -0.92 -2.60 119.26 122.68 2d3w h ALA 45 Ca -0.01 -0.54 -0.13 0.00 0.00 0.00 0.00 54.91 54.23 2d3w h ALA 45 Cb 1.15 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2d3w h ALA 45 CO 0.08 0.72 -0.30 1.15 0.00 0.00 0.00 179.25 180.90 2d3w h THR 46 N 0.30 1.29 -0.67 0.00 2.02 -0.93 0.28 112.91 115.19 2d3w h THR 46 Ca -0.01 -1.47 -0.07 0.00 0.77 0.00 0.00 66.41 65.63 2d3w h THR 46 Cb 1.14 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.97 2d3w h THR 46 CO 0.10 0.48 0.12 -0.07 0.37 0.00 0.00 175.52 176.53 2d3w h LEU 47 N 0.60 1.04 -0.67 2.58 3.38 -1.36 -2.46 115.31 118.42 2d3w h LEU 47 Ca 0.06 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 2d3w h LEU 47 Cb 0.88 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 2d3w h LEU 47 CO 0.08 1.03 -0.10 0.00 0.09 0.00 0.00 178.44 179.53 2d3w h ALA 48 N 1.05 0.96 -0.15 1.53 0.00 -1.44 -3.48 119.26 117.74 2d3w h ALA 48 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2d3w h ALA 48 Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2d3w h ALA 48 CO 0.01 0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.80 2d3w n GLY 49 N 0.60 1.11 3.65 0.00 0.00 -0.32 -4.57 105.19 105.66 2d3w n GLY 49 Ca 0.02 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 2d3w n GLY 49 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d3w s ARG 50 N -2.53 4.08 -0.96 1.61 1.81 -0.06 -4.59 118.95 118.30 2d3w s ARG 50 Ca 0.00 2.30 -0.26 0.00 -1.72 0.00 0.00 55.73 56.05 2d3w s ARG 50 Cb 0.00 -4.08 -0.21 0.00 -0.45 0.00 0.00 34.95 30.21 2d3w s ARG 50 CO 0.00 -0.99 1.99 -0.85 -0.68 0.00 0.00 175.30 174.77 2d3w n GLU 51 N 7.42 0.56 0.00 3.54 0.28 -1.26 -3.19 120.64 127.99 2d3w n GLU 51 Ca 0.19 -1.83 0.00 0.00 -0.16 0.00 0.00 57.16 55.36 2d3w n GLU 51 Cb 0.42 -3.65 0.00 0.00 1.43 0.00 0.00 31.44 29.64 2d3w n GLU 51 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2d3w n ASP 52 N 16.49 0.00 -4.23 -1.84 2.03 -1.26 -5.14 116.55 122.60 2d3w n ASP 52 Ca 0.43 -0.11 -0.32 0.00 0.52 0.00 0.00 54.79 55.30 2d3w n ASP 52 Cb 0.46 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.70 2d3w n ASP 52 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2d3w s TYR 53 N 0.00 2.66 -0.28 -0.67 1.51 -1.19 -4.75 117.35 114.62 2d3w s TYR 53 Ca 0.00 -1.09 -0.13 0.00 -1.01 0.00 0.00 57.07 54.84 2d3w s TYR 53 Cb 0.00 -1.78 -0.04 0.00 -0.11 0.00 0.00 41.96 40.03 2d3w s TYR 53 CO 0.00 -0.46 0.30 -2.00 -1.11 0.00 0.00 175.55 172.27 2d3w s GLU 54 N 0.56 3.92 -0.13 -0.62 2.12 0.13 -4.95 118.70 119.73 2d3w s GLU 54 Ca -0.12 -0.17 -0.28 0.00 0.36 0.00 0.00 54.97 54.76 2d3w s GLU 54 Cb -0.17 -3.68 -0.01 0.00 0.26 0.00 0.00 34.13 30.53 2d3w s GLU 54 CO 0.04 -0.27 0.92 0.08 -0.54 0.00 0.00 175.26 175.49 2d3w s VAL 55 N 1.93 4.83 -0.18 3.70 1.01 -1.26 -0.46 120.40 129.97 2d3w s VAL 55 Ca 0.11 1.85 0.11 0.00 0.00 0.00 0.00 61.98 64.06 2d3w s VAL 55 Cb -0.16 -4.23 -0.15 0.00 0.00 0.00 0.00 36.38 31.84 2d3w s VAL 55 CO 0.11 0.02 0.31 0.35 0.00 0.00 0.00 175.10 175.89 2d3w n THR 56 N 4.60 0.00 -3.57 3.92 -2.24 0.25 -4.98 114.28 112.26 2d3w n THR 56 Ca 0.07 -0.25 -0.06 0.00 -2.27 0.00 0.00 64.05 61.54 2d3w n THR 56 Cb 0.49 0.51 -0.02 0.00 -2.10 0.00 0.00 70.33 69.21 2d3w n THR 56 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2d3w s GLY 57 N -2.84 -0.38 0.00 3.38 0.00 -1.20 -4.95 107.32 101.33 2d3w s GLY 57 Ca -0.01 1.02 0.00 0.00 0.00 0.00 0.00 44.72 45.73 2d3w s GLY 57 CO 0.45 0.33 0.00 0.61 0.00 0.00 0.00 173.10 174.49 2d3w n GLY 58 N -0.25 -2.38 3.35 0.20 0.00 -0.95 -0.61 105.19 104.54 2d3w n GLY 58 Ca -0.06 -2.08 -0.15 0.00 0.00 0.00 0.00 46.02 43.74 2d3w n GLY 58 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2d3w s THR 59 N -0.27 0.03 -0.15 2.61 -1.32 -0.80 -4.96 115.64 110.78 2d3w s THR 59 Ca 0.00 -0.24 -0.02 0.00 -1.21 0.00 0.00 61.69 60.22 2d3w s THR 59 Cb 0.00 -0.73 0.05 0.00 -1.51 0.00 0.00 72.50 70.30 2d3w s THR 59 CO 0.00 -0.13 0.00 -0.69 -2.21 0.00 0.00 174.62 171.59 2d3w s VAL 60 N -0.96 0.66 -0.05 5.08 1.01 -1.26 -2.13 120.40 122.76 2d3w s VAL 60 Ca -0.10 -0.41 0.06 0.00 0.00 0.00 0.00 61.98 61.53 2d3w s VAL 60 Cb -0.03 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 2d3w s VAL 60 CO 0.05 0.01 -0.25 -1.83 0.00 0.00 0.00 175.10 173.08 2d3w s GLU 61 N 1.82 2.42 -0.12 2.72 1.03 -0.76 -0.25 118.70 125.56 2d3w s GLU 61 Ca 0.01 -0.90 0.02 0.00 0.03 0.00 0.00 54.97 54.13 2d3w s GLU 61 Cb -0.15 -2.11 0.02 0.00 -0.80 0.00 0.00 34.13 31.08 2d3w s GLU 61 CO -0.07 0.42 -0.16 0.12 -1.33 0.00 0.00 175.26 174.23 2d3w s PHE 62 N -0.26 2.12 -1.09 4.83 2.19 -0.14 -1.36 117.98 124.27 2d3w s PHE 62 Ca -0.01 -1.05 -0.07 0.00 0.33 0.00 0.00 56.93 56.14 2d3w s PHE 62 Cb -0.13 -1.52 0.06 0.00 -1.31 0.00 0.00 43.02 40.13 2d3w s PHE 62 CO 0.03 -0.53 0.33 1.63 1.83 0.00 0.00 175.22 178.51 2d3w n LYS 63 N 4.28 -2.91 -0.37 10.12 5.02 0.11 -1.06 118.16 133.35 2d3w n LYS 63 Ca -0.19 0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2d3w n LYS 63 Cb 0.51 -5.04 0.00 0.00 -0.02 0.00 0.00 35.03 30.48 2d3w n LYS 63 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2d3w n GLY 64 N -0.99 1.04 3.85 0.72 0.00 -1.26 -5.07 105.19 103.47 2d3w n GLY 64 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 2d3w n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d3w s LYS 65 N -0.46 3.07 -0.66 1.61 1.02 -0.23 -5.03 119.74 119.06 2d3w s LYS 65 Ca 0.00 -0.85 -0.27 0.00 0.02 0.00 0.00 55.97 54.87 2d3w s LYS 65 Cb 0.00 -2.72 0.02 0.00 -0.52 0.00 0.00 37.83 34.61 2d3w s LYS 65 CO 0.00 0.47 1.40 0.34 -0.92 0.00 0.00 175.35 176.64 2d3w s ASP 66 N -3.39 6.03 0.43 2.83 3.68 -1.26 -0.97 116.67 124.01 2d3w s ASP 66 Ca 0.32 -0.10 0.12 0.00 2.13 0.00 0.00 52.55 55.03 2d3w s ASP 66 Cb -0.10 -2.55 0.92 0.00 -1.45 0.00 0.00 42.92 39.74 2d3w s ASP 66 CO 0.25 -1.87 1.97 0.25 0.13 0.00 0.00 175.17 175.90 2d3w h LEU 67 N 13.53 0.11 -2.14 -1.34 5.85 -0.96 -2.91 115.31 127.44 2d3w h LEU 67 Ca -0.27 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.42 2d3w h LEU 67 Cb 1.08 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 2d3w h LEU 67 CO 1.24 0.26 -0.03 -0.07 -0.34 0.00 0.00 178.44 179.50 2d3w h LEU 68 N 0.11 0.00 -2.43 2.25 3.38 -1.89 -1.79 115.31 114.94 2d3w h LEU 68 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2d3w h LEU 68 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2d3w h LEU 68 CO 0.02 0.03 0.02 0.00 0.09 0.00 0.00 178.44 178.60 2d3w n ALA 69 N -2.13 3.31 -2.47 1.53 0.00 -1.10 -4.88 120.51 114.77 2d3w n ALA 69 Ca -0.01 -1.07 -0.26 0.00 0.00 0.00 0.00 53.44 52.09 2d3w n ALA 69 Cb 0.20 -1.08 -0.15 0.00 0.00 0.00 0.00 19.45 18.43 2d3w n ALA 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2d3w s LEU 70 N -1.52 2.12 0.48 0.00 1.43 -0.67 -5.09 118.68 115.42 2d3w s LEU 70 Ca 0.30 -0.46 -0.22 0.00 -1.03 0.00 0.00 54.13 52.72 2d3w s LEU 70 Cb 0.23 -0.99 -0.07 0.00 0.03 0.00 0.00 46.19 45.39 2d3w s LEU 70 CO 0.09 0.19 1.12 -0.94 0.23 0.00 0.00 176.35 177.04 2d3w s SER 71 N -0.92 6.15 0.27 2.29 1.04 -1.26 -4.79 113.70 116.48 2d3w s SER 71 Ca 0.07 2.18 -0.08 0.00 0.48 0.00 0.00 55.95 58.60 2d3w s SER 71 Cb -0.08 -2.59 0.45 0.00 0.10 0.00 0.00 66.02 63.90 2d3w s SER 71 CO 0.01 -0.93 1.52 -2.65 0.98 0.00 0.00 173.24 172.18 2d3w n PRO 72 N -0.73 -0.09 0.00 4.02 -0.02 -1.26 0.14 135.00 137.06 2d3w n PRO 72 Ca 0.08 1.52 -0.03 0.00 -2.02 0.00 0.00 63.50 63.06 2d3w n PRO 72 Cb 0.50 -2.28 0.22 0.00 -0.02 0.00 0.00 33.50 31.92 2d3w n PRO 72 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2d3w h GLU 73 N 0.00 0.52 0.00 -0.52 9.09 -1.91 -2.45 114.58 119.30 2d3w h GLU 73 Ca 0.47 -0.17 -0.08 0.00 0.05 0.00 0.00 59.36 59.63 2d3w h GLU 73 Cb 0.71 -0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 27.76 2d3w h GLU 73 CO -1.01 0.67 -0.36 -0.44 0.05 0.00 0.00 179.01 177.93 2d3w h ASP 74 N 0.47 0.00 -0.20 3.06 3.45 -0.66 -2.22 116.42 120.32 2d3w h ASP 74 Ca 0.08 0.00 -0.05 0.00 0.43 0.00 0.00 57.03 57.49 2d3w h ASP 74 Cb 0.57 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.34 2d3w h ASP 74 CO 0.04 0.36 -0.06 0.03 -1.57 0.00 0.00 179.24 178.03 2d3w h ARG 75 N 0.00 0.41 -0.72 3.56 3.08 -0.58 -0.11 114.38 120.02 2d3w h ARG 75 Ca -0.00 -0.16 0.04 0.00 0.07 0.00 0.00 59.98 59.92 2d3w h ARG 75 Cb 1.07 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 31.06 2d3w h ARG 75 CO 0.05 0.67 0.48 0.00 -1.07 0.00 0.00 179.97 180.09 2d3w h ALA 76 N 0.73 1.60 -0.76 0.04 0.00 -1.11 0.11 119.26 119.87 2d3w h ALA 76 Ca 0.05 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2d3w h ALA 76 Cb 0.53 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2d3w h ALA 76 CO 0.02 0.33 0.46 0.78 0.00 0.00 0.00 179.25 180.83 2d3w h GLY 77 N 0.86 1.09 1.31 0.00 0.00 -0.72 -0.54 103.07 105.07 2d3w h GLY 77 Ca 0.29 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.17 2d3w h GLY 77 CO -0.08 0.43 0.00 1.18 0.00 0.00 0.00 176.54 178.07 2d3w n GLU 78 N -4.39 0.65 0.00 4.80 -0.58 0.25 -4.78 120.64 116.60 2d3w n GLU 78 Ca 0.08 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 2d3w n GLU 78 Cb 0.07 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 2d3w n GLU 78 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2d3w n GLY 79 N 1.00 1.02 3.59 0.62 0.00 -0.21 -4.88 105.19 106.34 2d3w n GLY 79 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 2d3w n GLY 79 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d3w s ILE 80 N -2.00 5.25 0.02 -0.61 -1.09 -0.35 -0.96 121.20 121.46 2d3w s ILE 80 Ca 0.00 0.32 0.01 0.00 -2.23 0.00 0.00 60.65 58.75 2d3w s ILE 80 Cb 0.00 -3.61 -0.01 0.00 -1.58 0.00 0.00 42.46 37.26 2d3w s ILE 80 CO 0.00 0.20 -0.04 0.12 -1.23 0.00 0.00 174.94 173.99 2d3w s PHE 81 N 1.89 0.32 -0.01 3.97 5.36 -0.86 -2.43 117.98 126.22 2d3w s PHE 81 Ca 0.10 -0.31 0.00 0.00 -0.96 0.00 0.00 56.93 55.77 2d3w s PHE 81 Cb -0.16 -0.21 0.02 0.00 -0.34 0.00 0.00 43.02 42.33 2d3w s PHE 81 CO 0.11 -0.08 0.01 1.41 -1.46 0.00 0.00 175.22 175.20 2d3w s MET 82 N -0.88 0.05 0.51 10.12 -2.45 -1.26 -1.06 119.30 124.34 2d3w s MET 82 Ca -0.07 0.08 -0.21 0.00 -1.25 0.00 0.00 55.69 54.23 2d3w s MET 82 Cb -0.06 -0.20 -0.08 0.00 1.25 0.00 0.00 34.83 35.74 2d3w s MET 82 CO -0.00 -0.08 0.87 0.00 1.05 0.00 0.00 175.02 176.86 2d3w n ALA 83 N 3.68 -0.16 -2.40 4.11 0.00 -1.26 -5.02 120.51 119.46 2d3w n ALA 83 Ca -0.21 0.10 -0.21 0.00 0.00 0.00 0.00 53.44 53.12 2d3w n ALA 83 Cb 0.54 -2.03 -0.10 0.00 0.00 0.00 0.00 19.45 17.87 2d3w n ALA 83 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2d3w s PHE 84 N -1.46 1.94 0.08 0.00 -0.71 -1.26 -5.12 117.98 111.45 2d3w s PHE 84 Ca 0.69 -0.47 -0.22 0.00 -1.04 0.00 0.00 56.93 55.89 2d3w s PHE 84 Cb -0.49 -0.89 -0.07 0.00 -1.21 0.00 0.00 43.02 40.37 2d3w s PHE 84 CO 0.53 0.48 0.66 -0.65 -1.34 0.00 0.00 175.22 174.90 2d3w s GLN 85 N -3.46 4.36 0.67 1.99 -1.52 -1.26 -4.95 119.66 115.49 2d3w s GLN 85 Ca 0.24 0.89 -0.16 0.00 -1.95 0.00 0.00 55.36 54.39 2d3w s GLN 85 Cb -0.03 -3.28 0.00 0.00 -0.22 0.00 0.00 33.01 29.49 2d3w s GLN 85 CO 0.10 0.53 1.16 0.71 -0.25 0.00 0.00 175.29 177.53 2d3w s TYR 86 N -0.83 2.40 1.12 0.91 1.51 -1.26 -4.99 117.35 116.20 2d3w s TYR 86 Ca 0.32 1.56 -0.12 0.00 -1.01 0.00 0.00 57.07 57.82 2d3w s TYR 86 Cb -0.20 -3.32 0.26 0.00 -0.11 0.00 0.00 41.96 38.58 2d3w s TYR 86 CO 0.21 -2.06 1.05 -2.14 -1.11 0.00 0.00 175.55 171.50 2d3w s PRO 87 N -3.86 -0.55 0.88 -1.71 0.02 -1.26 -4.96 135.00 123.55 2d3w s PRO 87 Ca 0.71 0.85 -0.13 0.00 0.02 0.00 0.00 61.00 62.46 2d3w s PRO 87 Cb -0.25 -1.60 0.07 0.00 0.02 0.00 0.00 34.50 32.74 2d3w s PRO 87 CO 0.40 -3.48 0.83 0.28 -0.33 0.00 0.00 177.00 174.70 2d3w n VAL 88 N -4.75 0.73 -2.63 3.83 0.31 -1.26 -4.91 118.33 109.67 2d3w n VAL 88 Ca 0.04 -0.17 -0.42 0.00 -0.01 0.00 0.00 64.34 63.79 2d3w n VAL 88 Cb 0.54 -0.89 -0.04 0.00 -0.91 0.00 0.00 33.84 32.55 2d3w n VAL 88 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2d3w s GLU 89 N -3.92 4.59 -0.03 5.55 8.01 -1.26 -5.05 118.70 126.58 2d3w s GLU 89 Ca 0.65 1.55 0.06 0.00 0.01 0.00 0.00 54.97 57.24 2d3w s GLU 89 Cb -0.25 -3.38 -0.01 0.00 -4.31 0.00 0.00 34.13 26.18 2d3w s GLU 89 CO 0.59 0.02 -0.20 0.96 0.01 0.00 0.00 175.26 176.64 2d3w s ILE 90 N 0.46 1.61 0.06 -1.63 -4.36 -1.26 -5.11 121.20 110.97 2d3w s ILE 90 Ca 0.51 -0.84 -0.35 0.00 -0.26 0.00 0.00 60.65 59.71 2d3w s ILE 90 Cb -0.25 -1.35 -0.14 0.00 1.25 0.00 0.00 42.46 41.96 2d3w s ILE 90 CO 0.30 0.46 1.58 -0.81 0.24 0.00 0.00 174.94 176.71 2d3w n PRO 91 N 2.82 1.81 -0.12 0.37 -0.04 -1.26 -2.40 135.00 136.19 2d3w n PRO 91 Ca -0.16 0.66 0.00 0.00 -0.04 0.00 0.00 63.50 63.95 2d3w n PRO 91 Cb 0.53 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.59 2d3w n PRO 91 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2d3w n GLY 92 N 3.41 2.42 3.53 0.55 0.00 -1.26 -4.99 105.19 108.85 2d3w n GLY 92 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2d3w n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d3w s VAL 93 N -2.87 3.76 0.18 1.61 1.01 -1.01 -5.11 120.40 117.98 2d3w s VAL 93 Ca 0.00 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.58 2d3w s VAL 93 Cb 0.00 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 2d3w s VAL 93 CO 0.00 0.54 0.32 -0.55 0.00 0.00 0.00 175.10 175.42 2d3w s SER 94 N -0.14 6.34 0.50 3.32 0.15 -1.26 -4.56 113.70 118.05 2d3w s SER 94 Ca 0.02 0.19 0.17 0.00 0.70 0.00 0.00 55.95 57.03 2d3w s SER 94 Cb -0.13 -1.92 1.23 0.00 -1.71 0.00 0.00 66.02 63.50 2d3w s SER 94 CO 0.03 0.00 2.08 0.78 1.20 0.00 0.00 173.24 177.33 2d3w h ASN 95 N 1.86 0.09 -1.01 5.45 2.35 -1.99 0.30 115.58 122.62 2d3w h ASN 95 Ca -0.49 -0.00 0.26 0.00 -0.55 0.00 0.00 56.30 55.52 2d3w h ASN 95 Cb 1.20 -0.02 -0.12 0.00 0.05 0.00 0.00 38.32 39.43 2d3w h ASN 95 CO 0.67 0.06 0.60 -0.61 -1.65 0.00 0.00 177.43 176.50 2d3w h GLN 96 N 0.10 0.52 -0.88 0.81 4.15 -1.95 0.19 115.11 118.05 2d3w h GLN 96 Ca 0.11 -0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.57 2d3w h GLN 96 Cb 0.30 -0.12 -0.06 0.00 0.21 0.00 0.00 27.48 27.81 2d3w h GLN 96 CO -0.01 0.34 0.57 0.35 -1.93 0.00 0.00 178.83 178.15 2d3w h PHE 97 N 0.53 0.98 0.09 3.99 3.57 -1.33 -0.83 116.94 123.95 2d3w h PHE 97 Ca 0.65 0.03 -0.27 0.00 3.53 0.00 0.00 57.97 61.91 2d3w h PHE 97 Cb 1.32 -0.32 0.01 0.00 2.79 0.00 0.00 35.95 39.75 2d3w h PHE 97 CO -0.01 0.49 -1.16 0.74 -2.23 0.00 0.00 178.31 176.15 2d3w h PHE 98 N 0.95 0.64 -0.49 0.41 0.04 -0.75 -1.96 116.94 115.77 2d3w h PHE 98 Ca 0.39 -0.41 -0.03 0.00 2.80 0.00 0.00 57.97 60.71 2d3w h PHE 98 Cb 0.28 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.36 2d3w h PHE 98 CO -0.00 1.28 0.17 1.25 -0.60 0.00 0.00 178.31 180.41 2d3w h LEU 99 N 0.16 0.69 -0.84 1.54 6.46 -1.08 0.35 115.31 122.59 2d3w h LEU 99 Ca -0.13 -0.19 0.04 0.00 -0.12 0.00 0.00 57.88 57.47 2d3w h LEU 99 Cb 1.84 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 41.54 2d3w h LEU 99 CO 0.20 0.70 0.54 -0.61 -0.62 0.00 0.00 178.44 178.65 2d3w h GLN 100 N 0.65 1.01 -0.42 1.25 4.15 -1.17 -0.31 115.11 120.27 2d3w h GLN 100 Ca 0.16 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.49 2d3w h GLN 100 Cb 0.24 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 2d3w h GLN 100 CO -0.01 0.67 0.14 1.15 -1.93 0.00 0.00 178.83 178.85 2d3w h THR 101 N 1.05 1.21 -0.74 2.39 2.02 -0.47 -1.26 112.91 117.12 2d3w h THR 101 Ca 0.34 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 2d3w h THR 101 Cb 0.02 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 2d3w h THR 101 CO -0.12 0.25 0.43 0.00 0.37 0.00 0.00 175.52 176.44 2d3w h ALA 102 N 0.99 0.94 -0.23 6.16 0.00 0.56 -0.20 119.26 127.47 2d3w h ALA 102 Ca 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2d3w h ALA 102 Cb 0.25 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2d3w h ALA 102 CO -0.01 0.43 0.08 1.25 0.00 0.00 0.00 179.25 181.00 2d3w h LEU 103 N 1.01 0.34 -1.49 0.00 5.85 -0.95 -2.19 115.31 117.88 2d3w h LEU 103 Ca 0.26 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 2d3w h LEU 103 Cb -0.00 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 2d3w h LEU 103 CO -0.05 0.45 -0.18 0.78 -0.34 0.00 0.00 178.44 179.10 2d3w h ASN 104 N 0.21 0.10 -0.36 1.25 -0.26 -0.98 0.18 115.58 115.73 2d3w h ASN 104 Ca 0.08 -0.02 -0.16 0.00 -0.56 0.00 0.00 56.30 55.64 2d3w h ASN 104 Cb 0.23 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.46 2d3w h ASN 104 CO -0.00 0.29 -0.39 0.00 -1.06 0.00 0.00 177.43 176.27 2d3w h ALA 105 N 1.72 0.59 -0.21 -0.83 0.00 -0.80 -1.11 119.26 118.61 2d3w h ALA 105 Ca 0.02 -0.46 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 2d3w h ALA 105 Cb 0.39 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2d3w h ALA 105 CO 0.03 0.68 -0.45 0.28 0.00 0.00 0.00 179.25 179.78 2d3w h VAL 106 N 0.75 1.31 -0.18 0.00 2.07 -0.75 -2.23 116.25 117.21 2d3w h VAL 106 Ca 0.06 -1.65 -0.22 0.00 0.82 0.00 0.00 66.70 65.72 2d3w h VAL 106 Cb 0.98 1.64 0.01 0.00 -1.52 0.00 0.00 31.29 32.40 2d3w h VAL 106 CO 0.10 0.51 -0.73 0.03 0.02 0.00 0.00 177.57 177.50 2d3w h ARG 107 N 0.43 0.82 -0.25 1.57 3.08 -0.55 -1.91 114.38 117.56 2d3w h ARG 107 Ca 0.03 -0.63 0.03 0.00 0.07 0.00 0.00 59.98 59.48 2d3w h ARG 107 Cb 0.96 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.10 2d3w h ARG 107 CO 0.09 1.25 0.05 0.77 -1.07 0.00 0.00 179.97 181.06 2d3w h SER 108 N 0.57 0.02 -0.67 7.04 0.02 -1.19 0.28 113.55 119.62 2d3w h SER 108 Ca -0.04 0.04 0.10 0.00 -0.84 0.00 0.00 61.79 61.05 2d3w h SER 108 Cb 1.36 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.90 2d3w h SER 108 CO 0.15 0.05 0.45 0.22 -1.14 0.00 0.00 176.83 176.56 2d3w h TYR 109 N 0.15 0.54 -0.05 3.45 3.20 -1.31 0.56 116.97 123.50 2d3w h TYR 109 Ca 0.11 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2d3w h TYR 109 Cb 0.11 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.21 2d3w h TYR 109 CO -0.15 0.25 0.00 0.54 -1.64 0.00 0.00 178.16 177.16 2d3w n ARG 110 N -4.48 1.36 -1.86 1.82 1.74 -0.02 -4.87 116.66 110.35 2d3w n ARG 110 Ca 0.11 -0.53 -0.10 0.00 -0.77 0.00 0.00 57.85 56.57 2d3w n ARG 110 Cb 0.38 -1.40 -0.02 0.00 -1.02 0.00 0.00 32.46 30.40 2d3w n ARG 110 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2d3w n GLY 111 N 1.01 0.39 3.96 -0.13 0.00 0.20 -5.02 105.19 105.60 2d3w n GLY 111 Ca 0.18 -0.52 -0.19 0.00 0.00 0.00 0.00 46.02 45.48 2d3w n GLY 111 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2d3w s GLN 112 N -3.88 2.86 0.00 1.61 -0.21 0.79 -4.99 119.66 115.85 2d3w s GLN 112 Ca 0.00 -1.22 -0.30 0.00 0.02 0.00 0.00 55.36 53.86 2d3w s GLN 112 Cb 0.00 -2.68 -0.05 0.00 1.00 0.00 0.00 33.01 31.28 2d3w s GLN 112 CO 0.00 -0.10 1.27 -1.83 -2.12 0.00 0.00 175.29 172.51 2d3w s GLU 113 N -4.21 4.35 0.78 2.91 -1.05 -1.26 -4.12 118.70 116.10 2d3w s GLU 113 Ca 0.49 1.81 -0.11 0.00 -0.15 0.00 0.00 54.97 57.00 2d3w s GLU 113 Cb -0.08 -3.49 0.06 0.00 -0.44 0.00 0.00 34.13 30.18 2d3w s GLU 113 CO 0.31 -0.43 1.09 0.95 0.95 0.00 0.00 175.26 178.12 2d3w s THR 114 N 1.91 3.29 0.20 1.83 -4.23 -1.26 -4.93 115.64 112.44 2d3w s THR 114 Ca 0.59 0.42 0.04 0.00 -1.18 0.00 0.00 61.69 61.56 2d3w s THR 114 Cb -0.29 -3.14 -0.03 0.00 1.34 0.00 0.00 72.50 70.38 2d3w s THR 114 CO 0.26 -0.55 0.31 -0.76 -0.54 0.00 0.00 174.62 173.33 2d3w s LEU 115 N -5.75 4.27 0.48 4.79 1.43 -1.26 -5.11 118.68 117.53 2d3w s LEU 115 Ca 0.60 0.08 0.09 0.00 -1.03 0.00 0.00 54.13 53.87 2d3w s LEU 115 Cb -0.15 -2.82 0.04 0.00 0.03 0.00 0.00 46.19 43.29 2d3w s LEU 115 CO 0.55 -0.01 0.65 1.51 0.23 0.00 0.00 176.35 179.28 2d3w s ASP 116 N -3.62 5.41 0.32 2.29 -4.77 -1.26 -4.83 116.67 110.21 2d3w s ASP 116 Ca 0.34 -0.61 0.08 0.00 -3.30 0.00 0.00 52.55 49.06 2d3w s ASP 116 Cb -0.10 -0.26 0.93 0.00 -1.09 0.00 0.00 42.92 42.40 2d3w s ASP 116 CO 0.28 -0.99 1.61 -0.09 0.70 0.00 0.00 175.17 176.68 2d3w h ARG 117 N 0.47 0.12 0.00 2.11 2.43 -1.99 -0.07 114.38 117.45 2d3w h ARG 117 Ca -0.36 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.80 2d3w h ARG 117 Cb 1.28 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 2d3w h ARG 117 CO 0.44 0.08 -0.03 0.74 -1.51 0.00 0.00 179.97 179.68 2d3w h PHE 118 N 0.12 0.02 -0.65 2.20 0.04 -1.98 -1.79 116.94 114.90 2d3w h PHE 118 Ca 0.66 -0.02 0.04 0.00 2.80 0.00 0.00 57.97 61.46 2d3w h PHE 118 Cb 1.50 -0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.61 2d3w h PHE 118 CO -0.23 0.97 0.39 -0.44 -0.60 0.00 0.00 178.31 178.39 2d3w h ASP 119 N -0.93 0.61 -0.69 2.17 5.19 -1.85 0.14 116.42 121.06 2d3w h ASP 119 Ca -0.01 0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.37 2d3w h ASP 119 Cb 0.98 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 40.35 2d3w h ASP 119 CO 0.01 0.41 0.25 0.15 -3.12 0.00 0.00 179.24 176.93 2d3w h PHE 120 N 0.74 1.08 -0.97 4.55 3.57 -1.13 -1.65 116.94 123.14 2d3w h PHE 120 Ca 0.28 -0.09 0.10 0.00 3.53 0.00 0.00 57.97 61.78 2d3w h PHE 120 Cb 0.09 -0.32 -0.08 0.00 2.79 0.00 0.00 35.95 38.43 2d3w h PHE 120 CO -0.06 0.85 0.60 0.37 -2.23 0.00 0.00 178.31 177.84 2d3w h GLN 121 N 1.00 0.96 0.80 1.11 5.75 -0.15 -0.65 115.11 123.94 2d3w h GLN 121 Ca 0.23 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.63 2d3w h GLN 121 Cb 0.25 -0.22 0.01 0.00 1.07 0.00 0.00 27.48 28.59 2d3w h GLN 121 CO -0.01 0.64 -0.39 -0.44 -2.65 0.00 0.00 178.83 175.98 2d3w h ASP 122 N 0.99 -0.91 -0.96 -0.69 3.45 0.09 -2.66 116.42 115.72 2d3w h ASP 122 Ca 0.46 0.02 0.11 0.00 0.43 0.00 0.00 57.03 58.06 2d3w h ASP 122 Cb 0.40 0.24 -0.08 0.00 -0.56 0.00 0.00 39.33 39.33 2d3w h ASP 122 CO -0.24 -0.60 0.61 0.25 -1.57 0.00 0.00 179.24 177.69 2d3w h LEU 123 N -1.17 0.87 -0.86 1.55 5.85 -1.00 -0.62 115.31 119.92 2d3w h LEU 123 Ca -0.11 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 2d3w h LEU 123 Cb 0.84 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 2d3w h LEU 123 CO 0.18 0.48 0.29 -0.03 -0.34 0.00 0.00 178.44 179.02 2d3w h MET 124 N 0.94 1.13 -0.14 1.25 4.05 -1.09 -0.58 114.93 120.48 2d3w h MET 124 Ca 0.46 -0.20 -0.00 0.00 -0.28 0.00 0.00 59.70 59.68 2d3w h MET 124 Cb 0.48 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 31.09 2d3w h MET 124 CO -0.23 0.92 0.09 0.93 0.23 0.00 0.00 176.91 178.85 2d3w h GLU 125 N 1.10 0.19 -0.63 0.39 4.39 -0.78 -0.62 114.58 118.62 2d3w h GLU 125 Ca 0.25 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 60.01 2d3w h GLU 125 Cb 0.22 -0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 28.77 2d3w h GLU 125 CO -0.02 0.16 0.31 1.49 -1.16 0.00 0.00 179.01 179.79 2d3w h GLU 126 N 0.17 0.55 -0.46 2.33 4.81 -0.74 0.13 114.58 121.36 2d3w h GLU 126 Ca 0.05 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.14 2d3w h GLU 126 Cb 0.01 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 2d3w h GLU 126 CO -0.01 0.36 -0.14 0.87 -0.73 0.00 0.00 179.01 179.36 2d3w h LYS 127 N 0.56 0.87 -0.56 1.92 1.79 -0.74 -0.43 116.57 119.99 2d3w h LYS 127 Ca 0.30 -0.32 -0.07 0.00 -2.18 0.00 0.00 60.65 58.38 2d3w h LYS 127 Cb 0.26 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.83 2d3w h LYS 127 CO -0.22 0.95 0.07 0.82 -1.08 0.00 0.00 179.45 179.99 2d3w h ILE 128 N 0.77 1.26 0.17 1.86 2.04 -0.38 -0.86 117.51 122.37 2d3w h ILE 128 Ca 0.12 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 2d3w h ILE 128 Cb 0.66 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2d3w h ILE 128 CO 0.05 0.36 -0.08 0.00 0.00 0.00 0.00 178.15 178.48 2d3w h ALA 129 N 0.99 -0.22 0.00 1.87 0.00 -0.54 -0.93 119.26 120.42 2d3w h ALA 129 Ca 0.17 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2d3w h ALA 129 Cb 0.44 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2d3w h ALA 129 CO 0.01 -0.53 -0.15 -0.07 0.00 0.00 0.00 179.25 178.52 2d3w h LEU 130 N -0.42 0.00 -0.92 0.00 3.38 -1.01 -1.40 115.31 114.94 2d3w h LEU 130 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2d3w h LEU 130 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2d3w h LEU 130 CO 0.04 0.15 -0.12 0.18 0.09 0.00 0.00 178.44 178.77 2d3w n LEU 131 N -4.03 1.55 -3.66 1.67 4.77 -0.34 -4.97 117.00 112.00 2d3w n LEU 131 Ca -0.02 -0.50 -0.27 0.00 -0.03 0.00 0.00 56.01 55.19 2d3w n LEU 131 Cb 0.23 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.32 2d3w n LEU 131 CO 0.33 0.27 -0.08 0.29 -1.33 0.00 0.00 177.39 176.88 2d3w n LYS 132 N 0.02 -2.23 -4.47 3.23 4.76 -0.43 -5.00 118.16 114.03 2d3w n LYS 132 Ca 0.15 0.53 -0.27 0.00 -2.87 0.00 0.00 58.31 55.86 2d3w n LYS 132 Cb 0.39 -4.58 -0.10 0.00 -1.84 0.00 0.00 35.03 28.90 2d3w n LYS 132 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 2d3w s MET 133 N -5.83 2.04 0.12 1.97 -1.94 -0.73 -5.05 119.30 109.88 2d3w s MET 133 Ca 0.34 -2.03 -0.31 0.00 -1.71 0.00 0.00 55.69 51.98 2d3w s MET 133 Cb -0.11 -1.74 -0.10 0.00 2.01 0.00 0.00 34.83 34.89 2d3w s MET 133 CO 0.84 -0.07 1.81 -2.14 -0.01 0.00 0.00 175.02 175.45 2d3w s PRO 134 N -3.77 4.14 0.57 2.03 0.02 -1.26 -4.81 135.00 131.93 2d3w s PRO 134 Ca 0.37 2.57 0.28 0.00 0.02 0.00 0.00 61.00 64.24 2d3w s PRO 134 Cb 0.08 -3.59 1.50 0.00 0.02 0.00 0.00 34.50 32.51 2d3w s PRO 134 CO 0.19 -0.83 1.95 0.93 -0.33 0.00 0.00 177.00 178.92 2d3w h GLU 135 N 8.56 0.00 -0.81 5.54 5.08 -1.98 -2.02 114.58 128.95 2d3w h GLU 135 Ca -0.46 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.37 2d3w h GLU 135 Cb 1.22 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.16 2d3w h GLU 135 CO 0.95 0.00 0.17 -0.40 -1.00 0.00 0.00 179.01 178.72 2d3w n ASP 136 N -3.90 5.55 -0.17 1.42 5.75 -1.26 -4.75 116.55 119.19 2d3w n ASP 136 Ca 0.08 -3.76 -0.02 0.00 -0.01 0.00 0.00 54.79 51.08 2d3w n ASP 136 Cb 0.61 -0.71 0.08 0.00 -1.03 0.00 0.00 41.12 40.07 2d3w n ASP 136 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2d3w h LEU 137 N 1.78 0.06 -0.41 -2.12 5.85 -1.73 0.30 115.31 119.04 2d3w h LEU 137 Ca 0.47 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.28 2d3w h LEU 137 Cb 1.38 0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.51 2d3w h LEU 137 CO 1.08 0.06 0.00 0.18 -0.34 0.00 0.00 178.44 179.42 2d3w n LEU 138 N -5.08 0.37 0.00 2.25 7.99 -1.26 -3.98 117.00 117.29 2d3w n LEU 138 Ca 0.06 0.60 0.00 0.00 -0.01 0.00 0.00 56.01 56.66 2d3w n LEU 138 Cb 0.25 -0.55 0.00 0.00 -0.11 0.00 0.00 43.42 43.01 2d3w n LEU 138 CO 0.21 -0.44 -0.47 0.35 -1.51 0.00 0.00 177.39 175.52 2d3w n THR 139 N -1.92 0.00 -0.84 -5.08 -2.24 -0.71 -3.97 114.28 99.52 2d3w n THR 139 Ca 0.03 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.50 2d3w n THR 139 Cb 0.19 -0.70 0.16 0.00 -2.10 0.00 0.00 70.33 67.87 2d3w n THR 139 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d3w s ARG 140 N -1.95 1.15 0.14 -0.78 1.70 0.99 -5.05 118.95 115.15 2d3w s ARG 140 Ca 0.00 1.37 0.10 0.00 -0.47 0.00 0.00 55.73 56.72 2d3w s ARG 140 Cb 0.00 -1.76 -0.04 0.00 -0.57 0.00 0.00 34.95 32.59 2d3w s ARG 140 CO 0.00 -2.48 -0.23 0.45 -1.08 0.00 0.00 175.30 171.96 2d3w s SER 141 N -2.86 2.94 0.25 -2.89 0.15 -1.26 -4.96 113.70 105.07 2d3w s SER 141 Ca 0.65 -0.76 0.03 0.00 0.70 0.00 0.00 55.95 56.57 2d3w s SER 141 Cb -0.21 -0.19 -0.05 0.00 -1.71 0.00 0.00 66.02 63.86 2d3w s SER 141 CO 0.58 0.09 0.03 0.54 1.20 0.00 0.00 173.24 175.68 2d3w s VAL 142 N -1.36 0.92 0.40 4.45 0.11 -1.26 -5.13 120.40 118.53 2d3w s VAL 142 Ca 0.13 -2.02 -0.24 0.00 -2.93 0.00 0.00 61.98 56.92 2d3w s VAL 142 Cb -0.09 -2.49 -0.09 0.00 -1.53 0.00 0.00 36.38 32.18 2d3w s VAL 142 CO 0.06 -0.19 1.09 0.21 -3.33 0.00 0.00 175.10 172.94 2d3w s ASN 143 N -3.33 6.68 0.46 3.54 3.84 -1.26 -4.85 114.94 120.02 2d3w s ASN 143 Ca 0.32 2.14 0.24 0.00 0.21 0.00 0.00 52.86 55.77 2d3w s ASN 143 Cb 0.07 -2.60 1.25 0.00 -0.55 0.00 0.00 41.25 39.43 2d3w s ASN 143 CO 0.11 -0.55 1.85 0.58 -2.79 0.00 0.00 177.10 176.29 2d3w h VAL 144 N 2.24 0.58 -0.06 -5.21 2.07 -2.01 0.45 116.25 114.32 2d3w h VAL 144 Ca -0.48 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 66.97 2d3w h VAL 144 Cb 1.22 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 2d3w h VAL 144 CO 0.62 0.04 0.07 1.23 0.02 0.00 0.00 177.57 179.55 2d3w h GLY 145 N 0.24 0.00 0.68 2.17 0.00 -2.07 -2.69 103.07 101.41 2d3w h GLY 145 Ca 0.49 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.58 2d3w h GLY 145 CO -0.13 0.00 -1.77 0.69 0.00 0.00 0.00 176.54 175.32 2d3w n PHE 146 N -3.78 0.69 -0.21 5.60 3.01 0.16 -4.56 117.46 118.36 2d3w n PHE 146 Ca -0.02 0.24 0.12 0.00 1.01 0.00 0.00 57.45 58.80 2d3w n PHE 146 Cb 0.16 -1.06 0.23 0.00 -0.01 0.00 0.00 39.48 38.80 2d3w n PHE 146 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2d3w n SER 147 N -2.86 -0.00 0.05 4.37 3.41 -1.01 -0.95 113.62 116.63 2d3w n SER 147 Ca -0.17 1.07 -0.13 0.00 -0.26 0.00 0.00 58.87 59.38 2d3w n SER 147 Cb 0.96 -0.42 -0.06 0.00 -0.26 0.00 0.00 64.21 64.43 2d3w n SER 147 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2d3w h GLY 148 N 0.00 -0.66 2.00 5.00 0.00 -1.80 -1.43 103.07 106.18 2d3w h GLY 148 Ca 0.42 0.46 0.00 0.00 0.00 0.00 0.00 47.33 48.21 2d3w h GLY 148 CO -0.57 -0.24 0.00 -1.33 0.00 0.00 0.00 176.54 174.40 2d3w h GLY 149 N -0.52 0.00 1.04 4.60 0.00 -1.38 -3.11 103.07 103.70 2d3w h GLY 149 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.27 2d3w h GLY 149 CO -0.32 0.00 -0.25 -2.09 0.00 0.00 0.00 176.54 173.89 2d3w h GLU 150 N 0.00 0.84 -0.30 4.80 4.57 -0.51 -0.41 114.58 123.57 2d3w h GLU 150 Ca 0.00 -0.40 -0.08 0.00 -1.18 0.00 0.00 59.36 57.70 2d3w h GLU 150 Cb 0.70 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 2d3w h GLU 150 CO 0.00 1.03 -0.14 1.57 -1.18 0.00 0.00 179.01 180.30 2d3w h LYS 151 N 0.64 0.63 -0.89 1.92 2.10 -1.24 -2.24 116.57 117.49 2d3w h LYS 151 Ca 0.08 -0.27 0.04 0.00 -2.00 0.00 0.00 60.65 58.49 2d3w h LYS 151 Cb 0.82 -0.02 -0.05 0.00 -0.90 0.00 0.00 32.23 32.07 2d3w h LYS 151 CO 0.07 0.85 0.57 0.87 -2.00 0.00 0.00 179.45 179.81 2d3w h LYS 152 N 0.39 1.08 -0.51 0.07 1.79 -1.52 0.47 116.57 118.34 2d3w h LYS 152 Ca 0.07 -0.06 0.02 0.00 -2.18 0.00 0.00 60.65 58.49 2d3w h LYS 152 Cb 0.66 -0.24 -0.03 0.00 -1.58 0.00 0.00 32.23 31.03 2d3w h LYS 152 CO 0.04 0.71 0.31 0.00 -1.08 0.00 0.00 179.45 179.44 2d3w h ARG 153 N 1.11 0.61 -0.54 3.15 3.08 -0.89 -0.57 114.38 120.34 2d3w h ARG 153 Ca 0.36 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.33 2d3w h ARG 153 Cb 0.02 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 2d3w h ARG 153 CO -0.12 0.40 0.15 -0.91 -1.07 0.00 0.00 179.97 178.42 2d3w h ASN 154 N 0.63 0.75 -0.53 7.04 4.21 -0.64 -0.83 115.58 126.21 2d3w h ASN 154 Ca 0.20 -0.12 -0.01 0.00 1.21 0.00 0.00 56.30 57.57 2d3w h ASN 154 Cb -0.01 -0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 36.97 2d3w h ASN 154 CO -0.08 0.73 0.27 0.44 -1.29 0.00 0.00 177.43 177.50 2d3w h ASP 155 N 0.79 0.67 -0.37 5.81 3.45 -0.35 -1.38 116.42 125.04 2d3w h ASP 155 Ca 0.18 -0.11 -0.14 0.00 0.43 0.00 0.00 57.03 57.39 2d3w h ASP 155 Cb 0.26 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.85 2d3w h ASP 155 CO -0.01 0.59 -0.30 0.40 -1.57 0.00 0.00 179.24 178.35 2d3w h ILE 156 N 0.70 1.27 -0.18 0.35 2.04 -0.67 -2.31 117.51 118.72 2d3w h ILE 156 Ca 0.18 -1.46 -0.05 0.00 1.00 0.00 0.00 64.86 64.53 2d3w h ILE 156 Cb 0.08 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2d3w h ILE 156 CO -0.03 0.49 -0.10 0.25 0.00 0.00 0.00 178.15 178.77 2d3w h LEU 157 N 0.76 0.27 -0.19 1.44 5.85 -0.96 -1.32 115.31 121.16 2d3w h LEU 157 Ca 0.08 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2d3w h LEU 157 Cb 0.87 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 2d3w h LEU 157 CO 0.08 0.40 0.07 1.56 -0.34 0.00 0.00 178.44 180.21 2d3w h GLN 158 N 0.27 0.28 -0.03 1.25 4.20 -0.79 -0.89 115.11 119.41 2d3w h GLN 158 Ca 0.06 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2d3w h GLN 158 Cb 0.35 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 2d3w h GLN 158 CO 0.02 0.37 0.02 0.52 -0.67 0.00 0.00 178.83 179.09 2d3w h MET 159 N 0.14 0.04 -0.46 1.46 2.86 -1.04 0.26 114.93 118.19 2d3w h MET 159 Ca 0.06 -0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.75 2d3w h MET 159 Cb 0.20 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.80 2d3w h MET 159 CO -0.00 0.05 0.18 0.00 1.06 0.00 0.00 176.91 178.19 2d3w h ALA 160 N 0.99 0.56 -0.28 6.32 0.00 -1.15 0.74 119.26 126.44 2d3w h ALA 160 Ca 0.01 0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 2d3w h ALA 160 Cb 0.02 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2d3w h ALA 160 CO -0.00 -0.20 -0.52 0.28 0.00 0.00 0.00 179.25 178.81 2d3w h VAL 161 N 0.36 1.28 0.00 0.00 2.07 -0.92 -3.21 116.25 115.84 2d3w h VAL 161 Ca 0.21 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 66.03 2d3w h VAL 161 Cb 0.20 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 2d3w h VAL 161 CO -0.20 0.55 -0.46 0.18 0.02 0.00 0.00 177.57 177.66 2d3w n LEU 162 N -4.01 0.50 -3.79 2.57 4.77 0.89 -5.00 117.00 112.95 2d3w n LEU 162 Ca -0.04 0.16 -0.29 0.00 -0.03 0.00 0.00 56.01 55.81 2d3w n LEU 162 Cb 0.61 -0.26 0.01 0.00 -2.33 0.00 0.00 43.42 41.44 2d3w n LEU 162 CO 0.49 0.04 -0.19 -0.62 -1.33 0.00 0.00 177.39 175.78 2d3w n GLU 163 N -1.72 -0.94 -1.72 3.23 1.02 0.26 -4.93 120.64 115.83 2d3w n GLU 163 Ca 0.05 0.38 -0.30 0.00 -0.02 0.00 0.00 57.16 57.27 2d3w n GLU 163 Cb 0.37 -1.92 0.08 0.00 -0.02 0.00 0.00 31.44 29.95 2d3w n GLU 163 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2d3w s PRO 164 N -5.57 2.21 0.01 3.49 0.04 -1.26 -4.98 135.00 128.94 2d3w s PRO 164 Ca 0.17 0.44 0.15 0.00 0.04 0.00 0.00 61.00 61.80 2d3w s PRO 164 Cb -0.09 -1.95 -0.18 0.00 0.04 0.00 0.00 34.50 32.32 2d3w s PRO 164 CO 0.80 -1.49 0.74 0.39 0.04 0.00 0.00 177.00 177.49 2d3w n GLU 165 N -3.31 0.63 -3.84 4.56 1.02 -0.13 -4.79 120.64 114.78 2d3w n GLU 165 Ca 0.07 0.25 -0.28 0.00 -0.02 0.00 0.00 57.16 57.18 2d3w n GLU 165 Cb 0.58 -1.80 -0.16 0.00 -0.02 0.00 0.00 31.44 30.04 2d3w n GLU 165 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2d3w s LEU 166 N -5.90 1.57 -0.17 -4.62 2.96 -0.58 -0.07 118.68 111.87 2d3w s LEU 166 Ca -0.04 -0.75 -0.11 0.00 -0.22 0.00 0.00 54.13 53.01 2d3w s LEU 166 Cb 0.08 -0.83 -0.05 0.00 0.50 0.00 0.00 46.19 45.90 2d3w s LEU 166 CO 0.82 -0.23 0.20 0.00 -1.32 0.00 0.00 176.35 175.82 2d3w s ILE 168 N 0.17 2.99 -0.05 0.00 -1.09 -0.22 0.25 121.20 123.25 2d3w s ILE 168 Ca 0.12 -0.72 0.04 0.00 -2.23 0.00 0.00 60.65 57.87 2d3w s ILE 168 Cb -0.12 -2.39 -0.00 0.00 -1.58 0.00 0.00 42.46 38.37 2d3w s ILE 168 CO 0.01 0.39 -0.19 -0.76 -1.23 0.00 0.00 174.94 173.16 2d3w s LEU 169 N 1.40 1.94 -0.41 2.97 1.43 -0.71 -4.35 118.68 120.96 2d3w s LEU 169 Ca 0.04 -0.39 -0.07 0.00 -1.03 0.00 0.00 54.13 52.68 2d3w s LEU 169 Cb -0.15 -1.06 0.09 0.00 0.03 0.00 0.00 46.19 45.10 2d3w s LEU 169 CO -0.05 0.16 0.22 -0.62 0.23 0.00 0.00 176.35 176.29 2d3w s ASP 170 N 0.06 5.47 -0.25 2.29 3.68 -1.26 -1.51 116.67 125.15 2d3w s ASP 170 Ca -0.05 -1.62 0.14 0.00 2.13 0.00 0.00 52.55 53.14 2d3w s ASP 170 Cb -0.13 -1.92 0.78 0.00 -1.45 0.00 0.00 42.92 40.20 2d3w s ASP 170 CO 0.03 -0.52 1.73 -0.62 0.13 0.00 0.00 175.17 175.92 2d3w n GLU 171 N 4.81 4.45 -0.00 4.34 -0.58 0.31 -4.46 120.64 129.51 2d3w n GLU 171 Ca -0.08 -3.12 0.00 0.00 -0.42 0.00 0.00 57.16 53.53 2d3w n GLU 171 Cb 0.42 -2.21 0.00 0.00 -0.57 0.00 0.00 31.44 29.08 2d3w n GLU 171 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2d3w n SER 172 N 0.33 0.89 -4.42 1.62 3.41 -1.21 -3.46 113.62 110.79 2d3w n SER 172 Ca 0.30 -2.00 -0.45 0.00 -0.26 0.00 0.00 58.87 56.46 2d3w n SER 172 Cb 1.20 -0.44 -0.02 0.00 -0.26 0.00 0.00 64.21 64.70 2d3w n SER 172 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2d3w n ASP 173 N -0.06 -1.13 -0.88 4.04 9.92 -1.26 -4.79 116.55 122.38 2d3w n ASP 173 Ca 0.00 1.03 0.00 0.00 -0.53 0.00 0.00 54.79 55.29 2d3w n ASP 173 Cb 0.22 -1.02 0.00 0.00 -0.64 0.00 0.00 41.12 39.69 2d3w n ASP 173 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 2d3w n SER 174 N 1.82 0.00 0.00 -2.24 2.88 -1.26 -4.96 113.62 109.86 2d3w n SER 174 Ca 0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 2d3w n SER 174 Cb 0.32 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 2d3w n SER 174 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2d3w n LEU 176 N 0.68 0.00 -3.36 2.46 7.99 -1.26 -5.17 117.00 118.34 2d3w n LEU 176 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 56.01 55.89 2d3w n LEU 176 Cb 0.00 0.00 -0.08 0.00 -0.11 0.00 0.00 43.42 43.23 2d3w n LEU 176 CO 0.00 0.00 -0.09 1.51 -1.51 0.00 0.00 177.39 177.30 2d3w s ASP 177 N 0.00 0.60 0.15 -1.43 -4.77 -1.26 -5.06 116.67 104.90 2d3w s ASP 177 Ca 0.00 -0.08 -0.08 0.00 -3.30 0.00 0.00 52.55 49.09 2d3w s ASP 177 Cb 0.00 0.95 0.20 0.00 -1.09 0.00 0.00 42.92 42.98 2d3w s ASP 177 CO 0.00 -0.33 0.94 -0.38 0.70 0.00 0.00 175.17 176.11 2d3w n ILE 178 N 5.35 -0.29 -0.26 2.11 -0.00 -1.26 -1.98 119.36 123.03 2d3w n ILE 178 Ca -0.03 1.40 -0.07 0.00 -0.00 0.00 0.00 62.75 64.05 2d3w n ILE 178 Cb 0.49 -1.89 -0.06 0.00 -0.00 0.00 0.00 39.64 38.18 2d3w n ILE 178 CO 0.00 0.00 0.00 -0.78 -0.00 0.00 0.00 176.55 175.77 2d3w h ASP 179 N 0.00 -1.39 0.45 4.38 -0.00 -2.00 -1.97 116.42 115.89 2d3w h ASP 179 Ca 0.25 0.21 -0.01 0.00 -0.00 0.00 0.00 57.03 57.47 2d3w h ASP 179 Cb 0.40 0.61 -0.01 0.00 -0.00 0.00 0.00 39.33 40.33 2d3w h ASP 179 CO -0.61 -0.15 -0.33 0.00 -0.00 0.00 0.00 179.24 178.14 2d3w h ALA 180 N -0.05 -0.78 -0.63 -0.78 0.00 -1.71 -2.83 119.26 112.48 2d3w h ALA 180 Ca 0.10 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 54.99 2d3w h ALA 180 Cb 0.27 0.44 -0.12 0.00 0.00 0.00 0.00 17.79 18.38 2d3w h ALA 180 CO -0.60 -0.96 -0.29 -0.07 0.00 0.00 0.00 179.25 177.33 2d3w h LEU 181 N -0.77 -1.02 -1.04 0.00 -0.00 -1.43 0.11 115.31 111.16 2d3w h LEU 181 Ca -0.04 0.22 0.05 0.00 -0.00 0.00 0.00 57.88 58.11 2d3w h LEU 181 Cb 0.65 0.54 -0.06 0.00 -0.00 0.00 0.00 40.66 41.79 2d3w h LEU 181 CO 0.01 -0.28 0.64 0.11 -0.00 0.00 0.00 178.44 178.91 2d3w h LYS 182 N -0.11 1.15 -0.59 1.13 1.57 -1.36 0.28 116.57 118.63 2d3w h LYS 182 Ca 0.26 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 59.00 2d3w h LYS 182 Cb 0.54 -0.26 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 2d3w h LYS 182 CO -0.70 0.76 0.36 0.28 -0.57 0.00 0.00 179.45 179.58 2d3w h VAL 183 N 1.18 1.08 -0.11 0.50 2.07 -0.58 0.13 116.25 120.53 2d3w h VAL 183 Ca 0.41 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.68 2d3w h VAL 183 Cb 0.11 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 2d3w h VAL 183 CO -0.15 0.13 0.05 0.58 0.02 0.00 0.00 177.57 178.21 2d3w h VAL 184 N 0.72 1.12 -0.86 2.57 2.07 0.24 -1.75 116.25 120.35 2d3w h VAL 184 Ca 0.23 -0.34 0.11 0.00 0.82 0.00 0.00 66.70 67.52 2d3w h VAL 184 Cb 0.01 1.15 -0.08 0.00 -1.52 0.00 0.00 31.29 30.84 2d3w h VAL 184 CO -0.09 0.10 0.50 0.00 0.02 0.00 0.00 177.57 178.10 2d3w h ALA 185 N 0.92 1.26 -0.38 1.67 0.00 0.32 -1.04 119.26 122.02 2d3w h ALA 185 Ca 0.04 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2d3w h ALA 185 Cb 0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2d3w h ALA 185 CO -0.00 0.08 -0.16 -0.44 0.00 0.00 0.00 179.25 178.73 2d3w h ASP 186 N 0.79 0.79 0.22 0.00 3.45 -0.53 -2.20 116.42 118.94 2d3w h ASP 186 Ca 0.43 -0.40 -0.00 0.00 0.43 0.00 0.00 57.03 57.49 2d3w h ASP 186 Cb 0.45 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.00 2d3w h ASP 186 CO -0.28 1.01 -0.15 1.23 -1.57 0.00 0.00 179.24 179.49 2d3w h GLY 187 N 0.57 -0.36 0.33 2.75 0.00 -0.56 0.94 103.07 106.74 2d3w h GLY 187 Ca 0.09 0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.60 2d3w h GLY 187 CO 0.05 -0.15 -0.37 -2.08 0.00 0.00 0.00 176.54 173.99 2d3w h VAL 188 N -0.36 0.24 -0.28 4.60 2.07 -1.24 0.58 116.25 121.86 2d3w h VAL 188 Ca -0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.55 2d3w h VAL 188 Cb 0.31 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 2d3w h VAL 188 CO 0.01 0.00 0.19 0.78 0.02 0.00 0.00 177.57 178.57 2d3w h ASN 189 N -0.58 0.16 1.67 0.57 -0.26 -1.12 0.63 115.58 116.65 2d3w h ASN 189 Ca 0.03 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.77 2d3w h ASN 189 Cb 0.62 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.85 2d3w h ASN 189 CO -0.23 0.11 0.00 0.28 -1.06 0.00 0.00 177.43 176.53 2d3w h SER 190 N 0.18 0.00 -0.07 5.81 0.02 0.31 -3.22 113.55 116.59 2d3w h SER 190 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2d3w h SER 190 Cb 0.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.80 2d3w h SER 190 CO -0.02 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.85 2d3w n LEU 191 N -3.09 2.84 -4.63 5.07 4.77 0.18 -4.91 117.00 117.23 2d3w n LEU 191 Ca 0.03 -1.07 -0.43 0.00 -0.03 0.00 0.00 56.01 54.51 2d3w n LEU 191 Cb 0.45 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.49 2d3w n LEU 191 CO 0.32 0.50 1.12 -0.13 -1.33 0.00 0.00 177.39 177.87 2d3w s ARG 192 N -1.72 3.89 0.00 3.23 0.52 -0.64 -4.81 118.95 119.42 2d3w s ARG 192 Ca 0.26 1.17 0.03 0.00 -0.52 0.00 0.00 55.73 56.67 2d3w s ARG 192 Cb 0.18 -3.88 0.00 0.00 0.52 0.00 0.00 34.95 31.77 2d3w s ARG 192 CO 0.27 -1.15 0.41 -0.40 0.02 0.00 0.00 175.30 174.45 2d3w n ASP 193 N 7.66 0.81 0.00 0.23 5.75 -1.26 -4.98 116.55 124.75 2d3w n ASP 193 Ca 0.14 -0.90 0.00 0.00 -0.01 0.00 0.00 54.79 54.02 2d3w n ASP 193 Cb 0.47 0.42 0.00 0.00 -1.03 0.00 0.00 41.12 40.97 2d3w n ASP 193 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2d3w n GLY 194 N 0.56 0.92 0.01 6.12 0.00 -1.26 -4.85 105.19 106.68 2d3w n GLY 194 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 2d3w n GLY 194 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2d3w n LYS 195 N -2.00 3.38 -3.25 1.61 -0.00 -1.26 -3.36 118.16 113.27 2d3w n LYS 195 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.92 2d3w n LYS 195 Cb 0.00 -1.06 -0.06 0.00 -0.00 0.00 0.00 35.03 33.91 2d3w n LYS 195 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 2d3w s ARG 196 N -2.06 4.25 0.29 -1.58 1.70 -1.26 -2.35 118.95 117.94 2d3w s ARG 196 Ca -0.01 0.74 0.07 0.00 -0.47 0.00 0.00 55.73 56.05 2d3w s ARG 196 Cb 0.01 -3.28 -0.03 0.00 -0.57 0.00 0.00 34.95 31.08 2d3w s ARG 196 CO 0.10 0.54 0.31 -1.12 -1.08 0.00 0.00 175.30 174.05 2d3w s SER 197 N -0.78 5.71 0.05 -2.89 0.01 0.90 -3.96 113.70 112.74 2d3w s SER 197 Ca 0.30 -0.24 0.03 0.00 1.31 0.00 0.00 55.95 57.35 2d3w s SER 197 Cb -0.19 -1.35 -0.02 0.00 0.21 0.00 0.00 66.02 64.67 2d3w s SER 197 CO 0.18 -0.21 -0.11 -0.36 0.41 0.00 0.00 173.24 173.16 2d3w s PHE 198 N -2.16 0.91 -0.16 2.43 0.08 0.17 0.17 117.98 119.42 2d3w s PHE 198 Ca 0.38 -0.43 -0.01 0.00 0.12 0.00 0.00 56.93 56.99 2d3w s PHE 198 Cb -0.08 -0.54 0.04 0.00 -0.57 0.00 0.00 43.02 41.88 2d3w s PHE 198 CO 0.27 -0.01 -0.03 0.42 -0.10 0.00 0.00 175.22 175.77 2d3w s ILE 199 N -1.15 0.95 -0.24 0.64 1.01 0.14 0.59 121.20 123.13 2d3w s ILE 199 Ca -0.05 -0.57 -0.04 0.00 0.00 0.00 0.00 60.65 60.00 2d3w s ILE 199 Cb -0.09 -1.19 0.00 0.00 0.01 0.00 0.00 42.46 41.20 2d3w s ILE 199 CO 0.01 0.07 -0.02 -0.63 0.00 0.00 0.00 174.94 174.38 2d3w s ILE 200 N 1.70 3.42 -0.35 2.92 1.01 0.29 -1.74 121.20 128.44 2d3w s ILE 200 Ca 0.01 -0.65 -0.13 0.00 0.00 0.00 0.00 60.65 59.88 2d3w s ILE 200 Cb -0.15 -2.64 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 2d3w s ILE 200 CO -0.07 0.29 0.25 -0.69 0.00 0.00 0.00 174.94 174.71 2d3w s VAL 201 N 1.45 5.24 0.03 2.92 1.01 -0.57 0.46 120.40 130.94 2d3w s VAL 201 Ca 0.04 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 61.75 2d3w s VAL 201 Cb -0.15 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 2d3w s VAL 201 CO -0.02 -0.06 -0.11 0.28 0.00 0.00 0.00 175.10 175.19 2d3w s THR 202 N 1.71 0.85 -0.07 3.92 -1.32 -0.89 0.11 115.64 119.95 2d3w s THR 202 Ca 0.06 -0.86 -0.21 0.00 -1.21 0.00 0.00 61.69 59.46 2d3w s THR 202 Cb -0.18 -0.79 -0.17 0.00 -1.51 0.00 0.00 72.50 69.86 2d3w s THR 202 CO 0.10 -0.06 0.82 -0.74 -2.21 0.00 0.00 174.62 172.53 2d3w h HIS 203 N 5.05 -0.13 0.00 9.09 -0.00 -1.87 -3.42 115.15 123.88 2d3w h HIS 203 Ca -0.36 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.01 2d3w h HIS 203 Cb 1.19 0.04 0.00 0.00 -0.00 0.00 0.00 27.41 28.64 2d3w h HIS 203 CO 0.53 0.37 0.00 2.48 -0.00 0.00 0.00 177.93 181.32 2d3w n TYR 204 N -4.85 0.00 0.00 5.26 0.18 -1.26 -4.47 117.16 112.02 2d3w n TYR 204 Ca -0.08 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.70 2d3w n TYR 204 Cb 0.28 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.24 2d3w n TYR 204 CO 0.00 0.00 0.00 2.89 -2.08 0.00 0.00 176.86 177.67 2d3w n ARG 206 N 0.00 0.00 0.28 -3.48 1.85 -1.26 -4.76 116.66 109.29 2d3w n ARG 206 Ca 0.00 0.00 0.16 0.00 -1.00 0.00 0.00 57.85 57.01 2d3w n ARG 206 Cb 0.00 0.00 0.92 0.00 -1.05 0.00 0.00 32.46 32.33 2d3w n ARG 206 CO 0.00 0.00 0.00 0.97 -0.01 0.00 0.00 177.63 178.59 2d3w h ILE 207 N 0.00 0.47 0.06 8.89 6.09 -2.00 0.25 117.51 131.27 2d3w h ILE 207 Ca 0.00 0.00 -0.28 0.00 -1.37 0.00 0.00 64.86 63.21 2d3w h ILE 207 Cb 0.00 0.96 0.02 0.00 0.47 0.00 0.00 36.82 38.27 2d3w h ILE 207 CO 0.00 0.00 -1.13 -0.07 -3.07 0.00 0.00 178.15 173.88 2d3w h LEU 208 N 0.00 0.83 -0.90 2.19 3.38 -1.98 -2.73 115.31 116.09 2d3w h LEU 208 Ca 0.02 -0.72 0.09 0.00 0.09 0.00 0.00 57.88 57.36 2d3w h LEU 208 Cb 0.12 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.54 2d3w h LEU 208 CO -0.00 1.52 0.55 0.44 0.09 0.00 0.00 178.44 181.05 2d3w h ASP 209 N 0.31 0.83 1.49 -0.43 3.45 -0.94 0.97 116.42 122.10 2d3w h ASP 209 Ca -0.15 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.34 2d3w h ASP 209 Cb 1.80 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 40.43 2d3w h ASP 209 CO 0.22 0.49 -0.42 1.88 -1.57 0.00 0.00 179.24 179.83 2d3w h TYR 210 N 0.94 0.00 0.09 4.55 0.05 -1.47 -3.36 116.97 117.78 2d3w h TYR 210 Ca 0.42 0.00 -0.37 0.00 0.05 0.00 0.00 58.73 58.83 2d3w h TYR 210 Cb 0.32 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.03 2d3w h TYR 210 CO -0.03 0.00 -2.11 -0.89 -1.05 0.00 0.00 178.16 174.07 2d3w n ILE 211 N -2.79 1.71 -3.06 -2.88 5.41 -0.67 -4.99 119.36 112.08 2d3w n ILE 211 Ca 0.03 -0.62 -0.00 0.00 1.00 0.00 0.00 62.75 63.15 2d3w n ILE 211 Cb 0.52 -1.66 0.00 0.00 -0.71 0.00 0.00 39.64 37.79 2d3w n ILE 211 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2d3w n LYS 212 N -3.44 -1.33 -1.92 0.38 4.76 0.33 -4.94 118.16 111.99 2d3w n LYS 212 Ca -0.36 1.50 -0.36 0.00 -2.87 0.00 0.00 58.31 56.23 2d3w n LYS 212 Cb 1.03 -5.76 0.04 0.00 -1.84 0.00 0.00 35.03 28.50 2d3w n LYS 212 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2d3w s PRO 213 N -3.01 2.85 0.18 1.97 0.04 -1.26 -4.91 135.00 130.86 2d3w s PRO 213 Ca 0.00 1.81 0.25 0.00 0.04 0.00 0.00 61.00 63.11 2d3w s PRO 213 Cb -0.00 -1.91 0.91 0.00 0.04 0.00 0.00 34.50 33.53 2d3w s PRO 213 CO 0.75 -1.30 1.76 -0.25 0.04 0.00 0.00 177.00 178.00 2d3w n ASP 214 N -1.77 0.60 -3.60 6.66 10.43 -0.63 -3.54 116.55 124.70 2d3w n ASP 214 Ca 0.14 0.58 -0.16 0.00 2.57 0.00 0.00 54.79 57.91 2d3w n ASP 214 Cb 0.50 -0.73 -0.07 0.00 1.84 0.00 0.00 41.12 42.65 2d3w n ASP 214 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 2d3w s TYR 215 N -3.13 -0.52 0.05 1.24 2.02 -1.17 -4.18 117.35 111.66 2d3w s TYR 215 Ca 0.09 0.90 0.05 0.00 -0.37 0.00 0.00 57.07 57.74 2d3w s TYR 215 Cb 0.12 0.31 -0.02 0.00 -0.40 0.00 0.00 41.96 41.97 2d3w s TYR 215 CO 0.51 -0.53 -0.14 0.08 -1.57 0.00 0.00 175.55 173.91 2d3w s VAL 216 N -1.14 1.09 0.01 0.71 1.01 0.12 -1.99 120.40 120.20 2d3w s VAL 216 Ca -0.11 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 60.81 2d3w s VAL 216 Cb -0.02 -1.01 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 2d3w s VAL 216 CO 0.08 -0.05 -0.02 -1.00 0.00 0.00 0.00 175.10 174.11 2d3w s HIS 217 N -0.95 0.14 -0.11 5.22 3.76 -0.28 -2.35 115.29 120.72 2d3w s HIS 217 Ca 0.01 -0.15 -0.01 0.00 -0.15 0.00 0.00 55.06 54.75 2d3w s HIS 217 Cb -0.08 -0.10 -0.03 0.00 1.11 0.00 0.00 32.58 33.48 2d3w s HIS 217 CO 0.01 -0.05 -0.06 0.08 -0.85 0.00 0.00 174.74 173.87 2d3w s VAL 218 N -0.41 3.69 -0.39 -0.90 1.01 -1.08 -1.03 120.40 121.30 2d3w s VAL 218 Ca -0.04 -0.46 -0.13 0.00 0.00 0.00 0.00 61.98 61.36 2d3w s VAL 218 Cb -0.03 -2.56 0.02 0.00 0.00 0.00 0.00 36.38 33.81 2d3w s VAL 218 CO -0.00 0.54 0.25 -0.76 0.00 0.00 0.00 175.10 175.13 2d3w s LEU 219 N -0.16 4.87 -0.58 3.92 2.01 0.34 -1.67 118.68 127.41 2d3w s LEU 219 Ca 0.02 -0.91 -0.04 0.00 0.01 0.00 0.00 54.13 53.21 2d3w s LEU 219 Cb -0.13 -2.09 0.15 0.00 0.01 0.00 0.00 46.19 44.13 2d3w s LEU 219 CO 0.03 -0.40 0.41 -0.47 1.01 0.00 0.00 176.35 176.92 2d3w s TYR 220 N 1.62 3.47 -0.38 0.29 5.04 -0.21 -4.25 117.35 122.93 2d3w s TYR 220 Ca 0.04 -2.52 -0.25 0.00 -2.44 0.00 0.00 57.07 51.89 2d3w s TYR 220 Cb -0.19 -3.28 0.04 0.00 0.35 0.00 0.00 41.96 38.88 2d3w s TYR 220 CO 0.08 -0.89 0.53 1.04 -1.34 0.00 0.00 175.55 174.97 2d3w n GLN 221 N 3.88 -1.98 -0.73 4.97 6.02 -1.26 -2.64 117.38 125.64 2d3w n GLN 221 Ca 0.05 1.65 0.00 0.00 -0.01 0.00 0.00 57.00 58.69 2d3w n GLN 221 Cb 0.39 -3.21 0.00 0.00 1.02 0.00 0.00 30.24 28.45 2d3w n GLN 221 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2d3w n GLY 222 N 0.02 0.00 2.84 1.08 0.00 -1.03 -4.66 105.19 103.44 2d3w n GLY 222 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 2d3w n GLY 222 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2d3w s ARG 223 N -1.47 0.00 -0.13 1.61 3.52 -1.08 0.55 118.95 121.96 2d3w s ARG 223 Ca 0.00 0.13 -0.29 0.00 -0.13 0.00 0.00 55.73 55.43 2d3w s ARG 223 Cb 0.00 -0.12 -0.02 0.00 -1.56 0.00 0.00 34.95 33.26 2d3w s ARG 223 CO 0.00 -0.09 1.17 0.42 -0.81 0.00 0.00 175.30 175.99 2d3w s ILE 224 N 0.57 4.40 0.00 4.11 1.01 -1.26 -1.04 121.20 128.98 2d3w s ILE 224 Ca -0.05 1.70 0.00 0.00 0.00 0.00 0.00 60.65 62.30 2d3w s ILE 224 Cb -0.07 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.31 2d3w s ILE 224 CO -0.02 -0.07 0.00 0.52 0.00 0.00 0.00 174.94 175.37 2d3w n VAL 225 N 4.98 0.00 -1.85 2.92 0.31 -0.67 -4.98 118.33 119.04 2d3w n VAL 225 Ca 0.12 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.13 2d3w n VAL 225 Cb 0.46 -0.30 0.02 0.00 -0.91 0.00 0.00 33.84 33.11 2d3w n VAL 225 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2d3w s LYS 226 N 0.09 3.30 0.21 5.55 3.01 -1.26 -4.90 119.74 125.73 2d3w s LYS 226 Ca 0.00 0.97 -0.20 0.00 -1.01 0.00 0.00 55.97 55.73 2d3w s LYS 226 Cb 0.00 -2.04 0.04 0.00 -1.01 0.00 0.00 37.83 34.82 2d3w s LYS 226 CO 0.00 -0.81 0.61 -1.12 0.51 0.00 0.00 175.35 174.54 2d3w s SER 227 N -3.53 -0.36 0.00 2.83 0.01 -1.26 -2.62 113.70 108.76 2d3w s SER 227 Ca 0.59 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.49 2d3w s SER 227 Cb -0.13 0.63 0.00 0.00 0.21 0.00 0.00 66.02 66.73 2d3w s SER 227 CO 0.47 -1.12 0.00 0.61 0.41 0.00 0.00 173.24 173.62 2d3w n GLY 228 N -0.39 3.13 3.24 3.44 0.00 -0.99 -4.94 105.19 108.68 2d3w n GLY 228 Ca -0.10 -1.64 -0.28 0.00 0.00 0.00 0.00 46.02 44.00 2d3w n GLY 228 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2d3w n ASP 229 N 0.00 -3.24 -0.24 1.61 3.85 -1.26 0.11 116.55 117.38 2d3w n ASP 229 Ca 0.00 -0.55 0.30 0.00 -0.71 0.00 0.00 54.79 53.83 2d3w n ASP 229 Cb 0.00 -1.01 0.70 0.00 -1.35 0.00 0.00 41.12 39.46 2d3w n ASP 229 CO 0.00 0.00 0.00 2.19 -1.01 0.00 0.00 177.20 178.38 2d3w h PHE 230 N -3.10 0.09 0.00 2.11 -0.00 -1.76 -0.48 116.94 113.79 2d3w h PHE 230 Ca -0.44 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 57.53 2d3w h PHE 230 Cb 1.23 -0.03 -0.00 0.00 -0.00 0.00 0.00 35.95 37.15 2d3w h PHE 230 CO -2.35 0.01 -0.01 1.79 -0.00 0.00 0.00 178.31 177.76 2d3w h THR 231 N 0.06 0.12 -1.00 0.88 1.35 -1.91 -3.01 112.91 109.39 2d3w h THR 231 Ca 0.49 -0.07 0.15 0.00 -0.55 0.00 0.00 66.41 66.42 2d3w h THR 231 Cb 1.84 1.06 -0.09 0.00 -1.73 0.00 0.00 68.15 69.22 2d3w h THR 231 CO -0.04 0.01 0.62 0.25 -0.25 0.00 0.00 175.52 176.11 2d3w h LEU 232 N 0.00 0.87 -1.74 3.87 6.46 -1.36 -0.37 115.31 123.04 2d3w h LEU 232 Ca -0.00 0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 57.79 2d3w h LEU 232 Cb 0.06 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 39.88 2d3w h LEU 232 CO 0.00 0.41 -0.14 0.58 -0.62 0.00 0.00 178.44 178.67 2d3w h VAL 233 N 0.90 1.07 0.17 1.05 2.07 -1.76 -0.61 116.25 119.13 2d3w h VAL 233 Ca 0.52 -0.49 -0.29 0.00 0.82 0.00 0.00 66.70 67.26 2d3w h VAL 233 Cb 0.64 1.27 0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2d3w h VAL 233 CO -0.30 0.14 -1.37 0.50 0.02 0.00 0.00 177.57 176.55 2d3w h LYS 234 N 0.00 0.36 0.27 1.57 1.63 -1.43 -3.02 116.57 115.95 2d3w h LYS 234 Ca -0.00 -0.61 0.00 0.00 -0.85 0.00 0.00 60.65 59.19 2d3w h LYS 234 Cb 0.26 0.23 -0.04 0.00 -0.60 0.00 0.00 32.23 32.08 2d3w h LYS 234 CO 0.02 1.29 -0.47 1.96 -3.45 0.00 0.00 179.45 178.80 2d3w h GLN 235 N -0.13 -0.78 -0.79 1.90 7.50 -0.70 0.49 115.11 122.60 2d3w h GLN 235 Ca -0.27 0.05 0.15 0.00 0.50 0.00 0.00 58.65 59.09 2d3w h GLN 235 Cb 1.90 0.18 -0.10 0.00 0.05 0.00 0.00 27.48 29.51 2d3w h GLN 235 CO 0.16 -0.52 0.34 -0.07 -1.50 0.00 0.00 178.83 177.23 2d3w h LEU 236 N -0.81 0.34 -1.78 1.46 3.38 -1.26 0.20 115.31 116.84 2d3w h LEU 236 Ca -0.02 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2d3w h LEU 236 Cb 0.77 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 2d3w h LEU 236 CO -0.18 0.12 -0.13 -0.08 0.09 0.00 0.00 178.44 178.26 2d3w h GLU 237 N 0.48 0.00 0.00 1.13 4.22 -1.20 0.66 114.58 119.87 2d3w h GLU 237 Ca 0.44 0.00 -0.08 0.00 0.08 0.00 0.00 59.36 59.80 2d3w h GLU 237 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2d3w h GLU 237 CO -0.41 0.13 -1.38 0.39 -2.18 0.00 0.00 179.01 175.55 2d3w n GLU 238 N -4.32 0.62 -0.62 1.92 -0.58 0.27 -3.82 120.64 114.12 2d3w n GLU 238 Ca -0.03 0.10 0.04 0.00 -0.42 0.00 0.00 57.16 56.85 2d3w n GLU 238 Cb 0.20 -1.75 0.27 0.00 -0.57 0.00 0.00 31.44 29.58 2d3w n GLU 238 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2d3w n GLN 239 N -2.69 3.60 0.00 3.49 6.02 0.46 -4.90 117.38 123.36 2d3w n GLN 239 Ca -0.06 -2.13 0.00 0.00 -0.01 0.00 0.00 57.00 54.80 2d3w n GLN 239 Cb 0.69 -2.02 0.00 0.00 1.02 0.00 0.00 30.24 29.93 2d3w n GLN 239 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2d3w n GLY 240 N 0.39 2.76 1.91 1.08 0.00 -1.10 -4.90 105.19 105.34 2d3w n GLY 240 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 2d3w n GLY 240 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2d3w n TYR 241 N -0.51 0.00 0.03 1.61 4.02 0.20 -4.33 117.16 118.19 2d3w n TYR 241 Ca 0.00 -1.17 -0.04 0.00 -0.01 0.00 0.00 57.90 56.68 2d3w n TYR 241 Cb 0.00 -1.15 0.19 0.00 -0.02 0.00 0.00 39.34 38.36 2d3w n TYR 241 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2d3w h GLY 242 N 4.52 0.47 1.33 2.72 0.00 -1.75 -2.98 103.07 107.38 2d3w h GLY 242 Ca 0.12 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 47.06 2d3w h GLY 242 CO 0.18 0.38 0.31 0.11 0.00 0.00 0.00 176.54 177.52 2d3w h TRP 243 N 0.38 0.00 0.22 5.60 5.08 -1.90 -3.09 115.95 122.22 2d3w h TRP 243 Ca 0.05 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.01 2d3w h TRP 243 Cb 0.75 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.91 2d3w h TRP 243 CO 0.02 0.00 -0.11 -0.07 -1.28 0.00 0.00 178.44 177.01 2d3w h LEU 244 N 0.00 -0.25 -9.87 0.11 3.38 -1.89 -3.44 115.31 103.35 2d3w h LEU 244 Ca 0.05 0.01 -0.49 0.00 0.09 0.00 0.00 57.88 57.54 2d3w h LEU 244 Cb 0.66 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2d3w h LEU 244 CO -0.00 -0.18 0.40 0.42 0.09 0.00 0.00 178.44 179.17 2d3w s THR 245 N -3.65 3.85 0.00 0.22 -4.23 -1.17 -4.81 115.64 105.85 2d3w s THR 245 Ca -0.04 1.63 0.00 0.00 -1.18 0.00 0.00 61.69 62.10 2d3w s THR 245 Cb 0.00 -3.95 0.00 0.00 1.34 0.00 0.00 72.50 69.90 2d3w s THR 245 CO 0.13 0.22 0.00 1.21 -0.54 0.00 0.00 174.62 175.64