#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rth s ILE 2 N 0.00 3.16 0.20 4.25 1.01 -1.26 -4.30 121.20 124.26 1rth s ILE 2 Ca 0.00 0.38 0.08 0.00 0.00 0.00 0.00 60.65 61.11 1rth s ILE 2 Cb 0.00 -3.04 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 1rth s ILE 2 CO 0.00 -0.49 -0.16 -0.94 0.00 0.00 0.00 174.94 173.35 1rth s SER 3 N -3.73 2.64 -0.67 3.58 1.04 -0.51 -4.62 113.70 111.43 1rth s SER 3 Ca 0.61 -0.97 -0.05 0.00 0.48 0.00 0.00 55.95 56.02 1rth s SER 3 Cb -0.15 -0.15 0.03 0.00 0.10 0.00 0.00 66.02 65.85 1rth s SER 3 CO 0.55 -0.12 2.78 -0.81 0.98 0.00 0.00 173.24 176.62 1rth n PRO 4 N -0.18 2.97 -4.45 4.02 -0.04 -1.26 -4.65 135.00 131.41 1rth n PRO 4 Ca -0.09 -2.47 -0.35 0.00 -0.04 0.00 0.00 63.50 60.55 1rth n PRO 4 Cb 0.59 -2.28 -0.10 0.00 -0.04 0.00 0.00 33.50 31.68 1rth n PRO 4 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rth s ILE 5 N -1.43 4.13 0.10 0.52 1.10 -1.26 -5.07 121.20 119.28 1rth s ILE 5 Ca 0.59 -0.32 -0.35 0.00 -0.51 0.00 0.00 60.65 60.06 1rth s ILE 5 Cb 0.32 -2.72 -0.15 0.00 0.15 0.00 0.00 42.46 40.05 1rth s ILE 5 CO -0.16 0.60 1.51 -0.62 -2.11 0.00 0.00 174.94 174.16 1rth n GLU 6 N 2.21 1.73 -2.60 3.50 -0.58 -1.26 -4.83 120.64 118.81 1rth n GLU 6 Ca -0.18 0.63 -0.34 0.00 -0.42 0.00 0.00 57.16 56.84 1rth n GLU 6 Cb 0.53 -2.35 -0.04 0.00 -0.57 0.00 0.00 31.44 29.01 1rth n GLU 6 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1rth s THR 7 N 1.06 3.90 -0.20 2.62 -4.23 -1.26 -5.01 115.64 112.51 1rth s THR 7 Ca 0.83 1.21 -0.15 0.00 -1.18 0.00 0.00 61.69 62.39 1rth s THR 7 Cb -0.80 -3.50 -0.04 0.00 1.34 0.00 0.00 72.50 69.50 1rth s THR 7 CO 0.43 -0.23 0.38 -0.69 -0.54 0.00 0.00 174.62 173.98 1rth s VAL 8 N -1.98 5.21 0.11 2.29 1.01 -1.26 -4.96 120.40 120.82 1rth s VAL 8 Ca 0.65 0.67 -0.31 0.00 0.00 0.00 0.00 61.98 62.99 1rth s VAL 8 Cb -0.16 -3.71 -0.10 0.00 0.00 0.00 0.00 36.38 32.41 1rth s VAL 8 CO 0.19 0.26 1.81 -2.16 0.00 0.00 0.00 175.10 175.20 1rth s PRO 9 N 1.29 4.14 -0.06 2.72 0.04 -1.26 -4.32 135.00 137.55 1rth s PRO 9 Ca 0.18 2.56 0.02 0.00 0.04 0.00 0.00 61.00 63.80 1rth s PRO 9 Cb -0.15 -3.62 0.01 0.00 0.04 0.00 0.00 34.50 30.78 1rth s PRO 9 CO 0.08 -0.83 -0.12 0.08 0.04 0.00 0.00 177.00 176.25 1rth s VAL 10 N 2.81 1.09 0.11 -0.36 1.01 -1.26 -5.10 120.40 118.70 1rth s VAL 10 Ca 0.80 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 62.40 1rth s VAL 10 Cb -0.45 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1rth s VAL 10 CO 0.36 0.35 -0.17 -1.59 0.00 0.00 0.00 175.10 174.05 1rth s LYS 11 N 0.70 1.02 0.57 2.72 -2.85 -1.26 -4.51 119.74 116.13 1rth s LYS 11 Ca -0.14 -1.15 -0.18 0.00 -1.00 0.00 0.00 55.97 53.50 1rth s LYS 11 Cb -0.16 -1.08 -0.04 0.00 -2.06 0.00 0.00 37.83 34.49 1rth s LYS 11 CO 0.03 0.23 1.09 -0.51 0.10 0.00 0.00 175.35 176.29 1rth s LEU 12 N -2.11 3.62 0.66 2.77 1.43 -1.26 -1.71 118.68 122.08 1rth s LEU 12 Ca 0.06 2.00 -0.17 0.00 -1.03 0.00 0.00 54.13 54.99 1rth s LEU 12 Cb -0.08 -4.56 -0.07 0.00 0.03 0.00 0.00 46.19 41.51 1rth s LEU 12 CO 0.04 -1.21 0.41 0.29 0.23 0.00 0.00 176.35 176.11 1rth n LYS 13 N -1.67 0.33 -1.33 1.70 5.02 0.64 -4.57 118.16 118.29 1rth n LYS 13 Ca 0.10 0.14 -0.59 0.00 -2.02 0.00 0.00 58.31 55.94 1rth n LYS 13 Cb 0.52 -1.68 -0.11 0.00 -0.02 0.00 0.00 35.03 33.74 1rth n LYS 13 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1rth n PRO 14 N -0.17 0.00 -2.68 1.97 -0.04 -1.26 -1.76 135.00 131.06 1rth n PRO 14 Ca 0.10 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.36 1rth n PRO 14 Cb 0.49 -1.42 0.01 0.00 -0.04 0.00 0.00 33.50 32.55 1rth n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1rth n GLY 15 N 6.06 -0.40 3.61 0.55 0.00 -1.26 -5.03 105.19 108.73 1rth n GLY 15 Ca 0.45 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 46.21 1rth n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rth s MET 16 N -5.30 2.15 0.17 1.61 -1.94 -0.72 -5.14 119.30 110.13 1rth s MET 16 Ca 0.15 -1.55 0.11 0.00 -1.71 0.00 0.00 55.69 52.70 1rth s MET 16 Cb -0.07 -2.05 -0.04 0.00 2.01 0.00 0.00 34.83 34.68 1rth s MET 16 CO 0.19 0.30 -0.25 0.34 -0.01 0.00 0.00 175.02 175.59 1rth s ASP 17 N -3.66 3.35 1.02 3.03 2.15 -1.26 -4.84 116.67 116.47 1rth s ASP 17 Ca 0.32 -0.82 -0.22 0.00 0.43 0.00 0.00 52.55 52.26 1rth s ASP 17 Cb -0.05 -0.24 -0.10 0.00 -0.30 0.00 0.00 42.92 42.24 1rth s ASP 17 CO 0.19 0.14 -0.87 0.61 -0.17 0.00 0.00 175.17 175.06 1rth n GLY 18 N 0.53 -3.15 3.76 2.66 0.00 -1.26 -4.94 105.19 102.79 1rth n GLY 18 Ca -0.15 -0.47 -0.36 0.00 0.00 0.00 0.00 46.02 45.05 1rth n GLY 18 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1rth s PRO 19 N -2.48 3.18 -0.41 1.61 0.02 -1.26 -4.95 135.00 130.72 1rth s PRO 19 Ca 0.43 1.75 0.09 0.00 0.02 0.00 0.00 61.00 63.29 1rth s PRO 19 Cb -0.03 -2.00 0.31 0.00 0.02 0.00 0.00 34.50 32.80 1rth s PRO 19 CO 0.70 -1.02 0.79 1.63 -0.33 0.00 0.00 177.00 178.77 1rth n LYS 20 N -1.38 0.90 -4.22 5.54 5.02 -1.25 -1.32 118.16 121.44 1rth n LYS 20 Ca 0.12 -2.84 -0.32 0.00 -2.02 0.00 0.00 58.31 53.25 1rth n LYS 20 Cb 0.50 -1.42 -0.08 0.00 -0.02 0.00 0.00 35.03 34.01 1rth n LYS 20 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1rth s VAL 21 N -1.19 4.28 0.77 -0.18 0.11 -1.07 -4.90 120.40 118.22 1rth s VAL 21 Ca 0.34 -0.60 -0.11 0.00 -2.93 0.00 0.00 61.98 58.68 1rth s VAL 21 Cb 0.28 -2.94 0.05 0.00 -1.53 0.00 0.00 36.38 32.25 1rth s VAL 21 CO -0.10 0.34 1.08 -0.75 -3.33 0.00 0.00 175.10 172.34 1rth s LYS 22 N -1.70 2.32 -0.22 1.54 2.20 -1.26 -4.50 119.74 118.12 1rth s LYS 22 Ca 0.21 1.04 -0.10 0.00 -0.36 0.00 0.00 55.97 56.77 1rth s LYS 22 Cb -0.12 -1.91 -0.05 0.00 -1.51 0.00 0.00 37.83 34.24 1rth s LYS 22 CO 0.12 -1.56 0.14 -1.14 -0.36 0.00 0.00 175.35 172.55 1rth s GLN 23 N -4.96 4.09 0.91 4.03 2.00 -1.26 -4.67 119.66 119.79 1rth s GLN 23 Ca 0.61 -0.27 -0.10 0.00 -2.00 0.00 0.00 55.36 53.60 1rth s GLN 23 Cb -0.16 -3.46 0.14 0.00 0.80 0.00 0.00 33.01 30.33 1rth s GLN 23 CO 0.56 0.15 1.15 -1.58 -0.50 0.00 0.00 175.29 175.07 1rth s TRP 24 N 0.77 1.63 0.35 1.67 0.52 -1.26 -4.99 118.94 117.63 1rth s TRP 24 Ca 0.07 1.79 -0.16 0.00 0.02 0.00 0.00 56.10 57.82 1rth s TRP 24 Cb -0.13 -3.35 -0.09 0.00 -1.15 0.00 0.00 33.47 28.76 1rth s TRP 24 CO 0.02 -2.80 0.78 -1.25 0.02 0.00 0.00 176.95 173.72 1rth s PRO 25 N -4.64 4.03 0.11 4.98 0.04 -1.26 -4.95 135.00 133.31 1rth s PRO 25 Ca 0.67 0.75 0.05 0.00 0.04 0.00 0.00 61.00 62.51 1rth s PRO 25 Cb -0.23 -2.38 -0.04 0.00 0.04 0.00 0.00 34.50 31.90 1rth s PRO 25 CO 0.58 0.11 -0.13 -0.51 0.04 0.00 0.00 177.00 177.08 1rth s LEU 26 N -3.07 2.39 0.96 -3.56 1.43 -1.26 -5.14 118.68 110.43 1rth s LEU 26 Ca 0.56 -0.79 -0.11 0.00 -1.03 0.00 0.00 54.13 52.75 1rth s LEU 26 Cb -0.10 -0.50 0.17 0.00 0.03 0.00 0.00 46.19 45.79 1rth s LEU 26 CO 0.17 -0.16 1.10 -0.89 0.23 0.00 0.00 176.35 176.80 1rth s THR 27 N -2.10 2.31 0.27 5.49 2.01 -1.26 -4.82 115.64 117.54 1rth s THR 27 Ca 0.07 0.10 -0.02 0.00 0.31 0.00 0.00 61.69 62.15 1rth s THR 27 Cb -0.05 -2.27 0.27 0.00 0.01 0.00 0.00 72.50 70.46 1rth s THR 27 CO 0.02 -0.13 1.90 -0.08 -0.69 0.00 0.00 174.62 175.64 1rth h GLU 28 N -1.94 1.14 -0.07 4.92 4.81 -2.00 -2.69 114.58 118.76 1rth h GLU 28 Ca -0.49 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 58.65 1rth h GLU 28 Cb 1.29 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 1rth h GLU 28 CO 0.48 0.76 -0.03 0.93 -0.73 0.00 0.00 179.01 180.41 1rth h GLU 29 N 1.18 0.14 0.00 1.92 4.39 -1.99 -0.97 114.58 119.26 1rth h GLU 29 Ca 0.41 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1rth h GLU 29 Cb 0.11 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1rth h GLU 29 CO -0.15 0.51 0.00 1.63 -1.16 0.00 0.00 179.01 179.85 1rth n LYS 30 N -4.78 0.18 -0.11 2.33 5.02 -1.19 -1.77 118.16 117.84 1rth n LYS 30 Ca -0.07 0.40 -0.23 0.00 -2.02 0.00 0.00 58.31 56.39 1rth n LYS 30 Cb 0.25 -1.84 -0.10 0.00 -0.02 0.00 0.00 35.03 33.32 1rth n LYS 30 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1rth n ILE 31 N -2.18 1.52 -0.21 -0.18 5.41 -1.02 -3.54 119.36 119.17 1rth n ILE 31 Ca 0.02 -0.11 -0.02 0.00 1.00 0.00 0.00 62.75 63.64 1rth n ILE 31 Cb 0.23 -2.03 0.04 0.00 -0.71 0.00 0.00 39.64 37.18 1rth n ILE 31 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1rth h LYS 32 N -1.00 -0.07 0.43 0.38 1.57 -1.17 -0.33 116.57 116.38 1rth h LYS 32 Ca -0.42 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.35 1rth h LYS 32 Cb 1.34 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.65 1rth h LYS 32 CO -0.26 -0.05 -0.34 0.00 -0.57 0.00 0.00 179.45 178.24 1rth h ALA 33 N 1.38 -1.09 -0.76 3.86 0.00 -1.54 -2.13 119.26 118.99 1rth h ALA 33 Ca 0.28 -0.15 0.18 0.00 0.00 0.00 0.00 54.91 55.22 1rth h ALA 33 Cb 0.51 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 1rth h ALA 33 CO -0.67 -1.08 0.52 -0.07 0.00 0.00 0.00 179.25 177.94 1rth h LEU 34 N -0.75 0.25 -0.51 0.00 3.38 -1.53 0.35 115.31 116.50 1rth h LEU 34 Ca -0.06 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1rth h LEU 34 Cb 0.62 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1rth h LEU 34 CO 0.01 0.12 -0.00 0.58 0.09 0.00 0.00 178.44 179.24 1rth h VAL 35 N 0.26 1.26 0.13 1.22 2.07 -0.84 -0.79 116.25 119.56 1rth h VAL 35 Ca 0.37 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 1rth h VAL 35 Cb 1.08 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1rth h VAL 35 CO -0.09 0.38 -0.06 -0.33 0.02 0.00 0.00 177.57 177.49 1rth h GLU 36 N 0.77 -0.17 -0.64 1.57 5.08 0.27 -2.59 114.58 118.86 1rth h GLU 36 Ca 0.14 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.55 1rth h GLU 36 Cb 0.52 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 1rth h GLU 36 CO 0.03 0.04 0.39 0.82 -1.00 0.00 0.00 179.01 179.28 1rth h ILE 37 N -0.36 1.06 -0.15 3.13 5.03 -0.90 -2.69 117.51 122.63 1rth h ILE 37 Ca -0.02 -0.26 -0.15 0.00 -0.12 0.00 0.00 64.86 64.31 1rth h ILE 37 Cb 0.29 0.24 -0.01 0.00 -3.03 0.00 0.00 36.82 34.31 1rth h ILE 37 CO 0.03 0.14 -0.53 0.00 -0.68 0.00 0.00 178.15 177.11 1rth h THR 39 N 0.34 0.99 0.00 0.00 2.02 -1.28 0.61 112.91 115.60 1rth h THR 39 Ca 0.01 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1rth h THR 39 Cb 1.04 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1rth h THR 39 CO 0.09 0.13 0.00 1.21 0.37 0.00 0.00 175.52 177.32 1rth n GLU 40 N -4.24 0.00 0.13 6.66 4.07 -0.90 -0.65 120.64 125.72 1rth n GLU 40 Ca -0.03 0.11 0.19 0.00 -0.06 0.00 0.00 57.16 57.38 1rth n GLU 40 Cb 0.21 -0.95 0.73 0.00 -0.06 0.00 0.00 31.44 31.36 1rth n GLU 40 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1rth h MET 41 N 0.00 0.00 -0.21 5.31 -0.00 -1.41 0.63 114.93 119.25 1rth h MET 41 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.69 1rth h MET 41 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.59 1rth h MET 41 CO 0.00 0.00 0.11 1.49 -0.00 0.00 0.00 176.91 178.51 1rth h GLU 42 N 0.00 0.30 -0.09 -0.10 4.57 0.32 -1.05 114.58 118.53 1rth h GLU 42 Ca 0.16 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 58.21 1rth h GLU 42 Cb 1.12 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.65 1rth h GLU 42 CO -0.00 0.30 -0.39 1.57 -1.18 0.00 0.00 179.01 179.30 1rth h LYS 43 N 0.22 0.20 0.00 1.92 2.10 0.26 -2.55 116.57 118.71 1rth h LYS 43 Ca 0.07 -0.09 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1rth h LYS 43 Cb 0.09 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.42 1rth h LYS 43 CO -0.01 0.56 0.00 0.39 -2.00 0.00 0.00 179.45 178.39 1rth n GLU 44 N -4.05 0.28 -0.97 0.07 1.02 -0.53 -4.83 120.64 111.63 1rth n GLU 44 Ca -0.01 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1rth n GLU 44 Cb 0.46 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1rth n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rth n GLY 45 N 0.29 0.75 0.26 0.62 0.00 -0.70 -4.76 105.19 101.65 1rth n GLY 45 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 1rth n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rth h LYS 46 N 2.09 0.87 -5.72 1.61 1.57 -1.46 -3.44 116.57 112.08 1rth h LYS 46 Ca 0.00 -0.26 -0.49 0.00 -1.87 0.00 0.00 60.65 58.04 1rth h LYS 46 Cb 0.03 -0.09 -0.22 0.00 0.08 0.00 0.00 32.23 32.03 1rth h LYS 46 CO 0.00 0.88 -0.80 0.96 -0.57 0.00 0.00 179.45 179.92 1rth s ILE 47 N -5.10 1.39 0.09 1.86 -4.36 -1.20 -2.04 121.20 111.85 1rth s ILE 47 Ca -0.12 -1.36 0.08 0.00 -0.26 0.00 0.00 60.65 58.99 1rth s ILE 47 Cb 0.12 -1.29 -0.03 0.00 1.25 0.00 0.00 42.46 42.51 1rth s ILE 47 CO 0.82 -0.11 -0.22 -0.44 0.24 0.00 0.00 174.94 175.23 1rth s SER 48 N -1.71 2.67 0.36 4.36 0.01 -0.45 -4.32 113.70 114.62 1rth s SER 48 Ca 0.02 -0.66 -0.26 0.00 1.31 0.00 0.00 55.95 56.37 1rth s SER 48 Cb -0.10 -0.17 -0.09 0.00 0.21 0.00 0.00 66.02 65.87 1rth s SER 48 CO 0.03 0.11 1.07 -0.54 0.41 0.00 0.00 173.24 174.32 1rth s LYS 49 N -1.75 4.31 0.10 12.44 1.02 -1.26 -0.25 119.74 134.35 1rth s LYS 49 Ca 0.08 1.63 0.06 0.00 0.02 0.00 0.00 55.97 57.77 1rth s LYS 49 Cb -0.10 -2.77 -0.03 0.00 -0.52 0.00 0.00 37.83 34.41 1rth s LYS 49 CO 0.04 -0.04 -0.15 0.96 -0.92 0.00 0.00 175.35 175.23 1rth s ILE 50 N -1.47 1.34 0.00 2.17 -4.36 -1.12 -4.87 121.20 112.88 1rth s ILE 50 Ca 0.53 -1.56 0.00 0.00 -0.26 0.00 0.00 60.65 59.37 1rth s ILE 50 Cb -0.26 -1.39 0.00 0.00 1.25 0.00 0.00 42.46 42.06 1rth s ILE 50 CO 0.33 -0.29 0.00 0.61 0.24 0.00 0.00 174.94 175.83 1rth n GLY 51 N 0.87 1.32 0.10 6.27 0.00 -1.26 -4.51 105.19 107.98 1rth n GLY 51 Ca -0.18 -1.75 0.14 0.00 0.00 0.00 0.00 46.02 44.23 1rth n GLY 51 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rth n PRO 52 N 0.00 0.60 0.00 1.61 -0.04 -1.26 -3.87 135.00 132.05 1rth n PRO 52 Ca 0.00 -0.21 0.02 0.00 -0.04 0.00 0.00 63.50 63.27 1rth n PRO 52 Cb 0.00 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.07 1rth n PRO 52 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1rth n GLU 53 N -1.02 0.73 -4.06 0.54 0.00 -1.26 -4.44 120.64 111.12 1rth n GLU 53 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 57.16 56.97 1rth n GLU 53 Cb 0.29 -1.07 -0.15 0.00 0.00 0.00 0.00 31.44 30.50 1rth n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1rth s ASN 54 N -1.38 3.88 0.00 -1.84 3.84 -1.25 -5.00 114.94 113.19 1rth s ASN 54 Ca 0.05 -1.10 0.27 0.00 0.21 0.00 0.00 52.86 52.30 1rth s ASN 54 Cb 0.02 -1.46 0.95 0.00 -0.55 0.00 0.00 41.25 40.21 1rth s ASN 54 CO 0.04 -0.13 1.70 -0.81 -2.79 0.00 0.00 177.10 175.11 1rth n PRO 55 N 4.54 0.41 -2.12 0.43 -0.04 -1.26 -4.97 135.00 131.98 1rth n PRO 55 Ca -0.16 -0.17 -0.27 0.00 -0.04 0.00 0.00 63.50 62.86 1rth n PRO 55 Cb 0.45 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.51 1rth n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1rth s TYR 56 N -2.71 2.60 -0.30 0.54 2.02 -1.26 -4.81 117.35 113.44 1rth s TYR 56 Ca 0.21 0.43 -0.25 0.00 -0.37 0.00 0.00 57.07 57.09 1rth s TYR 56 Cb 0.19 -3.39 0.18 0.00 -0.40 0.00 0.00 41.96 38.54 1rth s TYR 56 CO 0.55 -1.71 1.38 1.21 -1.57 0.00 0.00 175.55 175.41 1rth s ASN 57 N -4.61 -0.11 -0.02 2.29 2.47 -0.44 -4.74 114.94 109.78 1rth s ASN 57 Ca 0.63 0.21 0.05 0.00 0.42 0.00 0.00 52.86 54.17 1rth s ASN 57 Cb -0.09 0.25 -0.01 0.00 -1.45 0.00 0.00 41.25 39.94 1rth s ASN 57 CO 0.47 -0.04 -0.17 -0.89 -3.72 0.00 0.00 177.10 172.75 1rth s THR 58 N 0.10 1.36 -0.20 -5.21 2.01 -0.73 -2.59 115.64 110.38 1rth s THR 58 Ca 0.06 -0.72 -0.29 0.00 0.31 0.00 0.00 61.69 61.05 1rth s THR 58 Cb -0.05 -1.14 -0.03 0.00 0.01 0.00 0.00 72.50 71.29 1rth s THR 58 CO -0.14 0.39 1.61 -2.16 -0.69 0.00 0.00 174.62 173.62 1rth s PRO 59 N -0.29 3.86 0.04 4.92 0.04 -1.26 -4.17 135.00 138.15 1rth s PRO 59 Ca 0.04 1.73 -0.18 0.00 0.04 0.00 0.00 61.00 62.64 1rth s PRO 59 Cb -0.08 -4.02 -0.06 0.00 0.04 0.00 0.00 34.50 30.38 1rth s PRO 59 CO -0.00 -1.21 0.51 0.08 0.04 0.00 0.00 177.00 176.42 1rth s VAL 60 N 4.98 4.85 0.36 -0.36 1.01 -1.26 -0.48 120.40 129.50 1rth s VAL 60 Ca 0.71 1.08 0.04 0.00 0.00 0.00 0.00 61.98 63.81 1rth s VAL 60 Cb -0.26 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 1rth s VAL 60 CO 0.28 0.56 0.06 -0.36 0.00 0.00 0.00 175.10 175.64 1rth s PHE 61 N -1.07 2.03 -0.06 5.22 0.08 0.19 -4.85 117.98 119.52 1rth s PHE 61 Ca 0.27 -0.96 -0.03 0.00 0.12 0.00 0.00 56.93 56.34 1rth s PHE 61 Cb -0.18 -1.37 0.04 0.00 -0.57 0.00 0.00 43.02 40.93 1rth s PHE 61 CO 0.17 0.05 0.10 0.00 -0.10 0.00 0.00 175.22 175.44 1rth s ALA 62 N -3.16 0.05 -0.07 5.36 0.00 -1.26 -1.92 121.76 120.76 1rth s ALA 62 Ca 0.32 0.36 -0.01 0.00 0.00 0.00 0.00 51.96 52.64 1rth s ALA 62 Cb 0.08 -0.68 0.03 0.00 0.00 0.00 0.00 23.12 22.54 1rth s ALA 62 CO 0.15 -0.50 -0.02 -1.50 0.00 0.00 0.00 175.76 173.89 1rth s ILE 63 N 2.16 0.49 -0.40 0.00 1.10 -1.12 -5.01 121.20 118.43 1rth s ILE 63 Ca 0.03 0.02 -0.28 0.00 -0.51 0.00 0.00 60.65 59.91 1rth s ILE 63 Cb -0.12 -0.60 -0.01 0.00 0.15 0.00 0.00 42.46 41.87 1rth s ILE 63 CO -0.04 0.27 1.72 -1.59 -2.11 0.00 0.00 174.94 173.19 1rth s LYS 64 N 1.72 3.26 0.35 3.50 -2.85 -1.26 -3.34 119.74 121.12 1rth s LYS 64 Ca 0.02 1.17 -0.29 0.00 -1.00 0.00 0.00 55.97 55.87 1rth s LYS 64 Cb -0.13 -4.19 -0.11 0.00 -2.06 0.00 0.00 37.83 31.34 1rth s LYS 64 CO -0.05 -1.95 1.51 0.36 0.10 0.00 0.00 175.35 175.33 1rth n LYS 65 N 8.49 2.66 -1.82 1.78 2.85 -1.25 -4.92 118.16 125.95 1rth n LYS 65 Ca 0.21 0.94 -0.41 0.00 -1.05 0.00 0.00 58.31 57.99 1rth n LYS 65 Cb 0.48 -2.68 -0.01 0.00 -0.65 0.00 0.00 35.03 32.17 1rth n LYS 65 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1rth s LYS 66 N -1.58 4.14 -0.37 -1.58 -0.14 -1.26 -2.69 119.74 116.26 1rth s LYS 66 Ca 0.57 2.53 -0.01 0.00 -1.36 0.00 0.00 55.97 57.70 1rth s LYS 66 Cb -0.49 -3.03 0.00 0.00 -1.68 0.00 0.00 37.83 32.64 1rth s LYS 66 CO 0.59 -0.58 0.19 -0.25 -0.76 0.00 0.00 175.35 174.53 1rth n ASP 67 N 1.95 -2.78 -3.15 2.83 8.00 -1.26 -5.01 116.55 117.13 1rth n ASP 67 Ca 0.07 -0.09 0.05 0.00 0.71 0.00 0.00 54.79 55.53 1rth n ASP 67 Cb 0.38 -1.61 -0.01 0.00 -0.02 0.00 0.00 41.12 39.86 1rth n ASP 67 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1rth s SER 68 N -2.97 -1.05 -0.18 -2.24 1.04 -1.09 -5.01 113.70 102.20 1rth s SER 68 Ca 0.09 0.61 0.00 0.00 0.48 0.00 0.00 55.95 57.13 1rth s SER 68 Cb -0.04 1.86 0.17 0.00 0.10 0.00 0.00 66.02 68.11 1rth s SER 68 CO 0.12 -0.20 1.69 0.41 0.98 0.00 0.00 173.24 176.24 1rth n THR 69 N 5.44 2.14 -4.35 2.02 -1.04 -1.26 -4.28 114.28 112.94 1rth n THR 69 Ca -0.02 -0.96 -0.25 0.00 -2.04 0.00 0.00 64.05 60.78 1rth n THR 69 Cb 0.52 -1.15 -0.09 0.00 -1.82 0.00 0.00 70.33 67.79 1rth n THR 69 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1rth s LYS 70 N -1.11 1.98 -0.09 -2.82 2.20 -1.26 -5.10 119.74 113.54 1rth s LYS 70 Ca 0.19 -1.47 -0.17 0.00 -0.36 0.00 0.00 55.97 54.16 1rth s LYS 70 Cb 0.15 -2.03 -0.05 0.00 -1.51 0.00 0.00 37.83 34.40 1rth s LYS 70 CO 0.01 0.38 0.45 -1.58 -0.36 0.00 0.00 175.35 174.26 1rth s TRP 71 N -2.09 3.57 0.45 4.03 0.52 -1.26 -3.85 118.94 120.30 1rth s TRP 71 Ca 0.28 0.90 0.04 0.00 0.02 0.00 0.00 56.10 57.34 1rth s TRP 71 Cb -0.07 -2.47 -0.05 0.00 -1.15 0.00 0.00 33.47 29.73 1rth s TRP 71 CO 0.16 0.30 0.01 0.50 0.02 0.00 0.00 176.95 177.94 1rth s ARG 72 N 0.16 2.04 0.33 4.98 3.52 -1.21 -4.98 118.95 123.79 1rth s ARG 72 Ca 0.25 -2.23 0.05 0.00 -0.13 0.00 0.00 55.73 53.67 1rth s ARG 72 Cb -0.15 -1.51 -0.07 0.00 -1.56 0.00 0.00 34.95 31.66 1rth s ARG 72 CO 0.11 -0.21 0.02 -1.59 -0.81 0.00 0.00 175.30 172.82 1rth s LYS 73 N -3.79 1.70 -0.19 5.12 -2.85 -1.26 -2.77 119.74 115.70 1rth s LYS 73 Ca 0.22 -1.93 -0.07 0.00 -1.00 0.00 0.00 55.97 53.19 1rth s LYS 73 Cb 0.06 -1.11 0.08 0.00 -2.06 0.00 0.00 37.83 34.81 1rth s LYS 73 CO 0.11 -0.11 0.40 -1.17 0.10 0.00 0.00 175.35 174.69 1rth s LEU 74 N -3.53 -0.53 -0.14 2.77 2.96 -0.81 -4.88 118.68 114.52 1rth s LEU 74 Ca 0.35 0.94 -0.06 0.00 -0.22 0.00 0.00 54.13 55.13 1rth s LEU 74 Cb 0.08 1.28 -0.04 0.00 0.50 0.00 0.00 46.19 48.01 1rth s LEU 74 CO 0.15 -0.23 0.08 -0.69 -1.32 0.00 0.00 176.35 174.34 1rth s VAL 75 N 2.43 4.96 -1.02 1.68 1.01 -1.26 0.58 120.40 128.76 1rth s VAL 75 Ca -0.02 0.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.82 1rth s VAL 75 Cb -0.12 -3.18 0.18 0.00 0.00 0.00 0.00 36.38 33.27 1rth s VAL 75 CO -0.12 0.54 1.16 -0.62 0.00 0.00 0.00 175.10 176.06 1rth s ASP 76 N -0.38 6.89 -0.00 3.32 2.15 0.37 -4.89 116.67 124.12 1rth s ASP 76 Ca 0.10 -2.67 0.01 0.00 0.43 0.00 0.00 52.55 50.42 1rth s ASP 76 Cb -0.12 -2.34 0.03 0.00 -0.30 0.00 0.00 42.92 40.18 1rth s ASP 76 CO 0.02 -0.77 0.79 0.49 -0.17 0.00 0.00 175.17 175.52 1rth n PHE 77 N 5.30 0.05 -0.05 -5.34 3.72 -1.26 -4.32 117.46 115.56 1rth n PHE 77 Ca 0.26 -0.02 -0.13 0.00 -0.05 0.00 0.00 57.45 57.51 1rth n PHE 77 Cb 0.45 -0.05 -0.07 0.00 -0.94 0.00 0.00 39.48 38.87 1rth n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rth h ARG 78 N 0.14 -0.46 -0.25 -1.08 3.08 -1.92 0.31 114.38 114.20 1rth h ARG 78 Ca 0.00 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1rth h ARG 78 Cb 0.28 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1rth h ARG 78 CO 0.01 -0.30 0.10 1.49 -1.07 0.00 0.00 179.97 180.19 1rth h GLU 79 N -0.47 0.38 -0.68 0.04 4.57 -2.00 -1.91 114.58 114.50 1rth h GLU 79 Ca 0.08 -0.07 0.04 0.00 -1.18 0.00 0.00 59.36 58.23 1rth h GLU 79 Cb 0.63 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 29.12 1rth h GLU 79 CO -0.48 0.42 0.42 1.25 -1.18 0.00 0.00 179.01 179.43 1rth h LEU 80 N 0.26 0.66 -1.97 1.64 5.85 -1.81 -1.36 115.31 118.58 1rth h LEU 80 Ca 0.08 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.88 1rth h LEU 80 Cb 0.18 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1rth h LEU 80 CO -0.01 0.45 0.18 0.78 -0.34 0.00 0.00 178.44 179.51 1rth h ASN 81 N 0.80 0.03 -0.17 1.25 2.35 0.18 -1.02 115.58 119.00 1rth h ASN 81 Ca 0.28 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.98 1rth h ASN 81 Cb 0.07 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1rth h ASN 81 CO -0.13 0.02 -0.10 0.11 -1.65 0.00 0.00 177.43 175.68 1rth h LYS 82 N 0.03 0.37 0.00 0.81 1.57 -0.49 -3.22 116.57 115.64 1rth h LYS 82 Ca 0.12 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1rth h LYS 82 Cb 0.44 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1rth h LYS 82 CO -0.01 0.69 0.00 0.54 -0.57 0.00 0.00 179.45 180.11 1rth n ARG 83 N -4.59 0.68 -3.54 3.15 1.74 -0.42 -4.88 116.66 108.80 1rth n ARG 83 Ca -0.05 0.02 -0.34 0.00 -0.77 0.00 0.00 57.85 56.70 1rth n ARG 83 Cb 0.32 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.21 1rth n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1rth s THR 84 N -2.15 5.05 1.12 0.55 2.01 -0.99 -0.26 115.64 120.97 1rth s THR 84 Ca 0.34 0.44 -0.16 0.00 0.31 0.00 0.00 61.69 62.62 1rth s THR 84 Cb 0.17 -3.65 0.17 0.00 0.01 0.00 0.00 72.50 69.20 1rth s THR 84 CO 0.32 0.20 0.42 0.00 -0.69 0.00 0.00 174.62 174.86 1rth n GLN 85 N 0.63 -1.78 -3.65 4.92 10.64 -0.69 -4.38 117.38 123.06 1rth n GLN 85 Ca -0.06 -0.49 -0.24 0.00 -1.83 0.00 0.00 57.00 54.38 1rth n GLN 85 Cb 0.52 -1.89 -0.02 0.00 -0.86 0.00 0.00 30.24 27.99 1rth n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1rth s ASP 86 N -2.07 6.34 0.36 2.61 1.01 -1.26 -4.93 116.67 118.72 1rth s ASP 86 Ca 0.61 0.33 0.09 0.00 0.71 0.00 0.00 52.55 54.29 1rth s ASP 86 Cb -0.18 -1.98 -0.06 0.00 1.01 0.00 0.00 42.92 41.71 1rth s ASP 86 CO 0.66 -0.14 -0.01 -0.36 0.21 0.00 0.00 175.17 175.52 1rth s PHE 87 N -2.06 2.49 0.00 4.23 0.40 -1.26 -5.12 117.98 116.67 1rth s PHE 87 Ca 0.38 -0.52 0.00 0.00 -0.60 0.00 0.00 56.93 56.19 1rth s PHE 87 Cb -0.10 -1.54 0.00 0.00 0.51 0.00 0.00 43.02 41.89 1rth s PHE 87 CO 0.31 0.49 0.00 1.87 0.70 0.00 0.00 175.22 178.59 1rth n TRP 88 N -0.92 0.00 -3.53 0.36 -0.00 -1.26 -4.87 117.44 107.21 1rth n TRP 88 Ca -0.04 0.00 -0.23 0.00 -0.00 0.00 0.00 57.50 57.23 1rth n TRP 88 Cb 0.64 0.00 -0.14 0.00 -0.00 0.00 0.00 31.31 31.80 1rth n TRP 88 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 177.69 176.48 1rth s GLU 89 N 0.00 0.16 -0.49 5.87 2.02 -1.26 -5.07 118.70 119.93 1rth s GLU 89 Ca 0.00 -0.06 -0.22 0.00 0.02 0.00 0.00 54.97 54.72 1rth s GLU 89 Cb 0.00 -1.38 0.04 0.00 0.10 0.00 0.00 34.13 32.89 1rth s GLU 89 CO 0.00 -0.76 0.74 0.08 0.02 0.00 0.00 175.26 175.34 1rth s VAL 90 N 2.22 4.69 0.00 2.63 1.01 -1.26 -4.37 120.40 125.32 1rth s VAL 90 Ca 0.06 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1rth s VAL 90 Cb -0.16 -4.34 0.00 0.00 0.00 0.00 0.00 36.38 31.89 1rth s VAL 90 CO -0.17 -0.81 0.00 0.00 0.00 0.00 0.00 175.10 174.12 1rth n GLN 91 N 6.63 0.00 -0.17 2.72 6.02 -1.26 -4.98 117.38 126.34 1rth n GLN 91 Ca -0.01 0.17 -0.02 0.00 -0.01 0.00 0.00 57.00 57.14 1rth n GLN 91 Cb 0.47 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.25 1rth n GLN 91 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1rth n LEU 92 N -1.31 -0.33 0.00 1.08 -0.00 -1.26 -4.70 117.00 110.48 1rth n LEU 92 Ca 0.00 0.77 0.00 0.00 -0.00 0.00 0.00 56.01 56.78 1rth n LEU 92 Cb 0.49 -0.15 0.00 0.00 -0.00 0.00 0.00 43.42 43.76 1rth n LEU 92 CO 0.00 -0.67 0.00 0.61 -0.00 0.00 0.00 177.39 177.33 1rth n GLY 93 N -1.18 1.14 3.73 -3.96 0.00 -1.26 -5.15 105.19 98.50 1rth n GLY 93 Ca 0.03 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 1rth n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rth s ILE 94 N -2.00 4.33 0.48 -0.61 -1.09 -1.26 -5.03 121.20 116.03 1rth s ILE 94 Ca 0.00 1.94 -0.22 0.00 -2.23 0.00 0.00 60.65 60.13 1rth s ILE 94 Cb 0.00 -4.24 -0.07 0.00 -1.58 0.00 0.00 42.46 36.58 1rth s ILE 94 CO 0.00 0.30 1.19 -2.84 -1.23 0.00 0.00 174.94 172.36 1rth s PRO 95 N -0.03 3.60 -0.19 2.79 0.02 -1.26 -5.00 135.00 134.92 1rth s PRO 95 Ca 0.48 1.84 -0.08 0.00 0.02 0.00 0.00 61.00 63.26 1rth s PRO 95 Cb -0.25 -2.33 -0.04 0.00 0.02 0.00 0.00 34.50 31.89 1rth s PRO 95 CO 0.31 -0.70 0.07 -1.58 -0.33 0.00 0.00 177.00 174.77 1rth s HIS 96 N -1.53 3.24 0.37 6.54 2.46 -1.26 -4.99 115.29 120.13 1rth s HIS 96 Ca 0.66 0.05 0.25 0.00 0.47 0.00 0.00 55.06 56.49 1rth s HIS 96 Cb -0.30 -2.10 1.29 0.00 -0.13 0.00 0.00 32.58 31.34 1rth s HIS 96 CO 0.36 0.11 1.41 -2.30 -2.47 0.00 0.00 174.74 171.85 1rth n PRO 97 N 3.68 -0.04 0.00 2.88 -0.02 -1.26 0.13 135.00 140.36 1rth n PRO 97 Ca -0.16 1.17 0.06 0.00 -2.02 0.00 0.00 63.50 62.54 1rth n PRO 97 Cb 0.52 -2.22 0.27 0.00 -0.02 0.00 0.00 33.50 32.05 1rth n PRO 97 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rth n ALA 98 N -2.45 1.61 0.90 3.55 0.00 -1.26 -2.27 120.51 120.58 1rth n ALA 98 Ca 0.35 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.85 1rth n ALA 98 Cb 1.31 -1.18 0.01 0.00 0.00 0.00 0.00 19.45 19.59 1rth n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rth n GLY 99 N -0.32 0.15 3.88 0.00 0.00 0.35 -4.00 105.19 105.25 1rth n GLY 99 Ca 0.04 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 1rth n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rth s LEU 100 N -2.22 3.61 0.11 0.99 1.43 -0.96 -4.82 118.68 116.81 1rth s LEU 100 Ca 0.18 1.21 0.06 0.00 -1.03 0.00 0.00 54.13 54.55 1rth s LEU 100 Cb 0.17 -4.16 -0.04 0.00 0.03 0.00 0.00 46.19 42.18 1rth s LEU 100 CO 0.47 -0.59 -0.02 -0.54 0.23 0.00 0.00 176.35 175.90 1rth s LYS 101 N -4.43 2.42 0.59 1.70 1.02 -1.26 0.02 119.74 119.80 1rth s LYS 101 Ca 0.52 -0.93 -0.19 0.00 0.02 0.00 0.00 55.97 55.40 1rth s LYS 101 Cb -0.10 -2.45 -0.04 0.00 -0.52 0.00 0.00 37.83 34.71 1rth s LYS 101 CO 0.40 0.52 1.21 -1.59 -0.92 0.00 0.00 175.35 174.97 1rth s LYS 102 N -2.39 3.00 0.05 1.68 -2.85 -1.26 -4.92 119.74 113.06 1rth s LYS 102 Ca 0.25 1.84 0.06 0.00 -1.00 0.00 0.00 55.97 57.11 1rth s LYS 102 Cb -0.11 -1.95 -0.02 0.00 -2.06 0.00 0.00 37.83 33.68 1rth s LYS 102 CO 0.17 -1.18 -0.16 0.15 0.10 0.00 0.00 175.35 174.42 1rth s LYS 103 N -3.30 1.06 0.43 1.78 -0.14 -0.76 -4.97 119.74 113.83 1rth s LYS 103 Ca 0.77 -0.86 0.17 0.00 -1.36 0.00 0.00 55.97 54.69 1rth s LYS 103 Cb -0.31 -1.12 0.96 0.00 -1.68 0.00 0.00 37.83 35.69 1rth s LYS 103 CO 0.33 0.28 1.92 0.87 -0.76 0.00 0.00 175.35 177.99 1rth h LYS 104 N 4.77 0.00 -2.72 1.68 1.57 -1.52 -3.38 116.57 116.97 1rth h LYS 104 Ca -0.40 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.31 1rth h LYS 104 Cb 1.18 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.31 1rth h LYS 104 CO 0.43 0.26 -0.00 -1.54 -0.57 0.00 0.00 179.45 178.03 1rth s SER 105 N -6.74 -0.42 -0.02 0.86 1.04 -0.99 -4.96 113.70 102.47 1rth s SER 105 Ca -0.03 0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1rth s SER 105 Cb 0.14 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.75 1rth s SER 105 CO 0.68 -0.66 0.01 -0.69 0.98 0.00 0.00 173.24 173.57 1rth s VAL 106 N -2.10 0.04 0.09 5.02 1.01 -1.26 -1.78 120.40 121.42 1rth s VAL 106 Ca -0.07 0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.12 1rth s VAL 106 Cb -0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.19 1rth s VAL 106 CO 0.01 0.10 -0.19 -0.89 0.00 0.00 0.00 175.10 174.13 1rth s THR 107 N 0.93 1.56 -0.03 3.92 2.01 0.21 -4.76 115.64 119.47 1rth s THR 107 Ca -0.08 -1.48 0.05 0.00 0.31 0.00 0.00 61.69 60.49 1rth s THR 107 Cb -0.12 -1.43 -0.01 0.00 0.01 0.00 0.00 72.50 70.95 1rth s THR 107 CO -0.02 -0.10 -0.19 0.54 -0.69 0.00 0.00 174.62 174.16 1rth s VAL 108 N -1.18 1.56 -0.07 3.82 0.11 -1.26 0.67 120.40 124.04 1rth s VAL 108 Ca 0.04 -0.81 0.05 0.00 -2.93 0.00 0.00 61.98 58.33 1rth s VAL 108 Cb -0.10 -1.32 -0.01 0.00 -1.53 0.00 0.00 36.38 33.42 1rth s VAL 108 CO 0.04 0.44 -0.22 -0.76 -3.33 0.00 0.00 175.10 171.27 1rth s LEU 109 N -0.18 2.21 -0.56 2.54 1.02 0.55 -4.70 118.68 119.57 1rth s LEU 109 Ca 0.01 -0.47 -0.21 0.00 0.02 0.00 0.00 54.13 53.48 1rth s LEU 109 Cb -0.10 -1.42 0.06 0.00 0.02 0.00 0.00 46.19 44.75 1rth s LEU 109 CO 0.01 0.23 0.77 -0.62 0.02 0.00 0.00 176.35 176.76 1rth s ASP 110 N -0.07 6.23 -0.56 2.29 2.15 -1.26 0.11 116.67 125.56 1rth s ASP 110 Ca -0.06 -0.89 -0.03 0.00 0.43 0.00 0.00 52.55 52.01 1rth s ASP 110 Cb -0.14 -2.35 0.21 0.00 -0.30 0.00 0.00 42.92 40.34 1rth s ASP 110 CO 0.05 -1.10 2.37 1.33 -0.17 0.00 0.00 175.17 177.65 1rth n VAL 111 N 5.79 3.35 0.00 1.11 0.24 -0.47 -4.43 118.33 123.91 1rth n VAL 111 Ca -0.05 -3.13 0.00 0.00 -2.04 0.00 0.00 64.34 59.13 1rth n VAL 111 Cb 0.45 -1.41 0.00 0.00 -1.47 0.00 0.00 33.84 31.42 1rth n VAL 111 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rth n GLY 112 N 0.20 0.00 2.43 7.63 0.00 -1.24 -2.67 105.19 111.55 1rth n GLY 112 Ca 0.49 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.31 1rth n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rth n ASP 113 N 0.00 5.01 -0.09 1.61 5.68 -1.26 -4.04 116.55 123.46 1rth n ASP 113 Ca 0.00 -2.30 0.12 0.00 -0.50 0.00 0.00 54.79 52.11 1rth n ASP 113 Cb 0.00 -1.11 0.14 0.00 -1.14 0.00 0.00 41.12 39.02 1rth n ASP 113 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rth n ALA 114 N 3.64 3.81 -0.11 2.12 0.00 -1.09 -3.62 120.51 125.27 1rth n ALA 114 Ca 0.44 -0.46 -0.13 0.00 0.00 0.00 0.00 53.44 53.30 1rth n ALA 114 Cb 0.29 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.74 1rth n ALA 114 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1rth h TYR 115 N 0.46 1.08 0.00 0.00 0.05 -1.82 -0.24 116.97 116.50 1rth h TYR 115 Ca 0.00 -0.32 0.00 0.00 0.05 0.00 0.00 58.73 58.46 1rth h TYR 115 Cb 0.53 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 38.04 1rth h TYR 115 CO 0.00 1.14 0.00 1.19 -1.05 0.00 0.00 178.16 179.44 1rth n PHE 116 N -4.05 0.00 -0.02 4.88 3.01 -1.24 -2.74 117.46 117.29 1rth n PHE 116 Ca -0.02 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.23 1rth n PHE 116 Cb 0.54 0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 39.88 1rth n PHE 116 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1rth n SER 117 N -0.76 2.09 -4.73 4.37 7.64 -0.15 -4.42 113.62 117.66 1rth n SER 117 Ca 0.12 0.16 -0.40 0.00 1.01 0.00 0.00 58.87 59.76 1rth n SER 117 Cb 0.05 -0.80 -0.05 0.00 -1.01 0.00 0.00 64.21 62.41 1rth n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1rth s VAL 118 N -2.54 4.78 0.47 0.44 1.01 -0.91 -1.43 120.40 122.22 1rth s VAL 118 Ca -0.25 1.70 -0.20 0.00 0.00 0.00 0.00 61.98 63.24 1rth s VAL 118 Cb 0.07 -4.15 -0.09 0.00 0.00 0.00 0.00 36.38 32.21 1rth s VAL 118 CO 0.73 0.31 1.00 -2.16 0.00 0.00 0.00 175.10 174.99 1rth s PRO 119 N 0.26 3.94 -0.10 2.72 0.04 -1.26 -2.09 135.00 138.50 1rth s PRO 119 Ca 0.41 1.24 -0.11 0.00 0.04 0.00 0.00 61.00 62.58 1rth s PRO 119 Cb -0.20 -2.12 -0.05 0.00 0.04 0.00 0.00 34.50 32.16 1rth s PRO 119 CO 0.24 -0.30 0.26 -1.17 0.04 0.00 0.00 177.00 176.07 1rth s LEU 120 N -3.47 4.36 -0.40 -3.56 2.96 0.13 -4.61 118.68 114.09 1rth s LEU 120 Ca 0.65 0.60 -0.45 0.00 -0.22 0.00 0.00 54.13 54.71 1rth s LEU 120 Cb -0.13 -2.31 -0.19 0.00 0.50 0.00 0.00 46.19 44.06 1rth s LEU 120 CO 0.19 0.27 1.60 -0.67 -1.32 0.00 0.00 176.35 176.43 1rth n ASP 121 N 2.53 1.46 -0.32 3.68 -0.08 -1.26 -4.76 116.55 117.80 1rth n ASP 121 Ca -0.16 1.16 0.15 0.00 -1.51 0.00 0.00 54.79 54.43 1rth n ASP 121 Cb 0.53 -0.96 0.34 0.00 2.34 0.00 0.00 41.12 43.37 1rth n ASP 121 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 1rth h GLU 122 N 5.47 0.49 -0.04 -0.67 9.09 -1.93 -2.13 114.58 124.86 1rth h GLU 122 Ca -0.45 -0.03 -0.01 0.00 0.05 0.00 0.00 59.36 58.92 1rth h GLU 122 Cb 1.36 -0.11 -0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1rth h GLU 122 CO 0.95 0.33 0.01 -0.44 0.05 0.00 0.00 179.01 179.90 1rth h ASP 123 N 0.51 0.07 0.13 3.06 5.19 -1.95 -3.08 116.42 120.34 1rth h ASP 123 Ca 0.59 -0.27 -0.05 0.00 -0.62 0.00 0.00 57.03 56.69 1rth h ASP 123 Cb 1.11 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 40.59 1rth h ASP 123 CO -0.49 0.32 -0.17 0.15 -3.12 0.00 0.00 179.24 175.93 1rth h PHE 124 N -0.18 0.10 -1.60 4.55 3.04 -1.64 -3.23 116.94 117.99 1rth h PHE 124 Ca 0.01 -0.01 0.51 0.00 3.98 0.00 0.00 57.97 62.46 1rth h PHE 124 Cb 0.28 -0.03 -0.12 0.00 2.56 0.00 0.00 35.95 38.64 1rth h PHE 124 CO 0.02 0.27 1.09 0.54 -2.02 0.00 0.00 178.31 178.20 1rth n ARG 125 N -4.29 -0.02 0.10 1.11 1.74 -0.88 -0.88 116.66 113.54 1rth n ARG 125 Ca -0.02 1.18 0.08 0.00 -0.77 0.00 0.00 57.85 58.32 1rth n ARG 125 Cb 0.26 -2.46 0.54 0.00 -1.02 0.00 0.00 32.46 29.78 1rth n ARG 125 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1rth h LYS 126 N 0.00 0.26 0.00 5.56 2.10 -1.77 -2.27 116.57 120.46 1rth h LYS 126 Ca 0.90 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 59.52 1rth h LYS 126 Cb 3.18 -0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 34.45 1rth h LYS 126 CO -0.29 0.17 -0.05 1.88 -2.00 0.00 0.00 179.45 179.16 1rth h TYR 127 N 0.27 0.00 -0.06 0.07 0.05 -1.30 -2.94 116.97 113.06 1rth h TYR 127 Ca 0.11 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.89 1rth h TYR 127 Cb 0.10 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.84 1rth h TYR 127 CO -0.00 0.05 0.00 0.25 -1.05 0.00 0.00 178.16 177.41 1rth n THR 128 N -3.18 0.08 -1.63 -2.88 -2.24 -0.85 -4.52 114.28 99.06 1rth n THR 128 Ca 0.00 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 1rth n THR 128 Cb 0.32 -0.01 0.01 0.00 -2.10 0.00 0.00 70.33 68.55 1rth n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rth n ALA 129 N -0.34 0.41 -2.80 6.98 0.00 -1.11 -4.21 120.51 119.44 1rth n ALA 129 Ca 0.16 0.24 -0.10 0.00 0.00 0.00 0.00 53.44 53.74 1rth n ALA 129 Cb 0.18 -2.12 -0.06 0.00 0.00 0.00 0.00 19.45 17.45 1rth n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1rth s PHE 130 N -1.26 -0.02 0.02 0.00 -0.12 -0.34 -1.78 117.98 114.49 1rth s PHE 130 Ca 0.63 -0.36 0.08 0.00 -0.05 0.00 0.00 56.93 57.23 1rth s PHE 130 Cb -0.55 0.11 -0.02 0.00 -0.63 0.00 0.00 43.02 41.93 1rth s PHE 130 CO 0.57 -0.64 -0.24 0.99 -0.05 0.00 0.00 175.22 175.85 1rth s THR 131 N -3.84 1.92 -0.26 -4.49 2.01 -1.26 -1.16 115.64 108.56 1rth s THR 131 Ca 0.05 -1.19 -0.03 0.00 0.31 0.00 0.00 61.69 60.83 1rth s THR 131 Cb 0.03 -1.63 0.02 0.00 0.01 0.00 0.00 72.50 70.94 1rth s THR 131 CO -0.11 0.40 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.56 1rth s ILE 132 N -0.70 3.10 0.00 1.82 -1.09 0.61 -4.63 121.20 120.31 1rth s ILE 132 Ca 0.10 -0.98 0.00 0.00 -2.23 0.00 0.00 60.65 57.54 1rth s ILE 132 Cb -0.09 -2.59 0.00 0.00 -1.58 0.00 0.00 42.46 38.19 1rth s ILE 132 CO 0.01 0.16 0.00 -0.81 -1.23 0.00 0.00 174.94 173.07 1rth n PRO 133 N 4.71 1.40 -4.18 2.79 -0.04 -1.26 0.12 135.00 138.52 1rth n PRO 133 Ca -0.16 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.19 1rth n PRO 133 Cb 0.47 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.83 1rth n PRO 133 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1rth s SER 134 N -1.11 0.45 0.00 3.54 0.15 -1.26 -4.53 113.70 110.93 1rth s SER 134 Ca 0.00 -1.26 0.00 0.00 0.70 0.00 0.00 55.95 55.39 1rth s SER 134 Cb 0.00 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 1rth s SER 134 CO 0.00 -0.73 0.06 -0.38 1.20 0.00 0.00 173.24 173.38 1rth n ILE 135 N -0.18 0.00 0.79 6.45 5.41 -1.26 -2.85 119.36 127.72 1rth n ILE 135 Ca -0.03 0.53 0.00 0.00 1.00 0.00 0.00 62.75 64.24 1rth n ILE 135 Cb 0.64 -0.99 0.00 0.00 -0.71 0.00 0.00 39.64 38.58 1rth n ILE 135 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1rth n ASN 136 N -0.12 3.05 -4.04 4.38 0.23 -1.26 -4.80 115.26 112.69 1rth n ASN 136 Ca 0.00 -1.92 -0.28 0.00 -0.53 0.00 0.00 54.58 51.85 1rth n ASN 136 Cb 0.00 -0.53 -0.04 0.00 -2.08 0.00 0.00 39.78 37.13 1rth n ASN 136 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1rth n ASN 137 N 0.63 -0.28 0.00 0.53 4.05 -1.13 -4.90 115.26 114.15 1rth n ASN 137 Ca 0.00 -1.09 0.00 0.00 0.45 0.00 0.00 54.58 53.94 1rth n ASN 137 Cb 0.47 -2.64 0.00 0.00 1.23 0.00 0.00 39.78 38.84 1rth n ASN 137 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 177.26 172.37 1rth n GLU 138 N -4.46 0.00 0.00 1.20 0.00 -1.26 -4.94 120.64 111.17 1rth n GLU 138 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 57.16 56.86 1rth n GLU 138 Cb 0.68 -0.36 0.00 0.00 0.00 0.00 0.00 31.44 31.76 1rth n GLU 138 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1rth n THR 139 N 0.00 0.00 -2.76 3.84 -1.04 -1.26 -5.10 114.28 107.96 1rth n THR 139 Ca 0.00 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.81 1rth n THR 139 Cb 0.00 -0.26 0.03 0.00 -1.82 0.00 0.00 70.33 68.28 1rth n THR 139 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1rth s PRO 140 N -0.25 2.61 0.22 -2.82 0.04 -1.26 -5.08 135.00 128.47 1rth s PRO 140 Ca 0.00 -0.95 0.09 0.00 0.04 0.00 0.00 61.00 60.18 1rth s PRO 140 Cb 0.00 -2.57 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 1rth s PRO 140 CO 0.00 -0.59 -0.04 0.20 0.04 0.00 0.00 177.00 176.61 1rth s GLY 141 N -4.41 1.69 -0.35 0.56 0.00 -1.26 -4.60 107.32 98.95 1rth s GLY 141 Ca 0.57 -1.55 -0.28 0.00 0.00 0.00 0.00 44.72 43.46 1rth s GLY 141 CO 0.37 -1.59 1.06 -0.42 0.00 0.00 0.00 173.10 172.52 1rth s ILE 142 N -2.02 4.48 0.02 0.90 1.09 0.31 -4.87 121.20 121.12 1rth s ILE 142 Ca 0.29 1.58 -0.01 0.00 -1.10 0.00 0.00 60.65 61.40 1rth s ILE 142 Cb -0.08 -4.43 -0.04 0.00 -1.06 0.00 0.00 42.46 36.85 1rth s ILE 142 CO 0.18 -0.56 0.17 -0.13 -0.10 0.00 0.00 174.94 174.49 1rth s ARG 143 N 3.74 3.33 0.34 2.79 0.52 -1.26 -0.28 118.95 128.12 1rth s ARG 143 Ca 0.45 -0.42 0.03 0.00 -0.52 0.00 0.00 55.73 55.26 1rth s ARG 143 Cb -0.11 -3.00 -0.01 0.00 0.52 0.00 0.00 34.95 32.34 1rth s ARG 143 CO 0.18 0.64 0.39 0.66 0.02 0.00 0.00 175.30 177.19 1rth n TYR 144 N 0.71 -1.14 -3.60 -0.53 4.01 -0.31 -2.80 117.16 113.51 1rth n TYR 144 Ca -0.09 -2.57 -0.15 0.00 -0.16 0.00 0.00 57.90 54.94 1rth n TYR 144 Cb 0.52 0.43 -0.06 0.00 -0.31 0.00 0.00 39.34 39.92 1rth n TYR 144 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 1rth s GLN 145 N -3.06 0.98 0.07 -0.72 -2.07 0.66 -1.20 119.66 114.32 1rth s GLN 145 Ca 0.34 -0.14 -0.24 0.00 -1.82 0.00 0.00 55.36 53.50 1rth s GLN 145 Cb 0.00 0.45 -0.06 0.00 -1.09 0.00 0.00 33.01 32.31 1rth s GLN 145 CO 0.24 -0.34 0.72 0.71 -1.32 0.00 0.00 175.29 175.31 1rth s TYR 146 N -2.06 3.78 -1.47 9.60 1.51 -1.26 -1.34 117.35 126.10 1rth s TYR 146 Ca -0.07 1.45 0.17 0.00 -1.01 0.00 0.00 57.07 57.61 1rth s TYR 146 Cb -0.01 -2.74 -0.03 0.00 -0.11 0.00 0.00 41.96 39.07 1rth s TYR 146 CO 0.01 0.37 0.87 0.09 -1.11 0.00 0.00 175.55 175.79 1rth n ASN 147 N 2.40 1.58 -4.26 2.29 3.02 -0.87 -4.66 115.26 114.77 1rth n ASN 147 Ca -0.05 -1.29 -0.15 0.00 -0.03 0.00 0.00 54.58 53.07 1rth n ASN 147 Cb 0.50 0.54 -0.10 0.00 -0.61 0.00 0.00 39.78 40.11 1rth n ASN 147 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1rth s VAL 148 N -2.07 1.23 0.03 2.41 0.11 -1.22 -0.70 120.40 120.19 1rth s VAL 148 Ca 0.13 -2.06 -0.33 0.00 -2.93 0.00 0.00 61.98 56.79 1rth s VAL 148 Cb 0.14 -1.85 -0.12 0.00 -1.53 0.00 0.00 36.38 33.02 1rth s VAL 148 CO 0.47 -0.72 1.80 0.18 -3.33 0.00 0.00 175.10 173.50 1rth n LEU 149 N -0.19 3.54 -4.80 2.54 4.77 -0.89 -4.57 117.00 117.40 1rth n LEU 149 Ca -0.10 1.00 -0.38 0.00 -0.03 0.00 0.00 56.01 56.50 1rth n LEU 149 Cb 0.60 -1.43 -0.06 0.00 -2.33 0.00 0.00 43.42 40.20 1rth n LEU 149 CO 0.32 -0.05 0.39 -2.16 -1.33 0.00 0.00 177.39 174.57 1rth s PRO 150 N 3.01 4.35 0.04 3.23 0.05 -1.26 -4.05 135.00 140.38 1rth s PRO 150 Ca 0.87 0.93 -0.30 0.00 0.05 0.00 0.00 61.00 62.54 1rth s PRO 150 Cb -0.62 -3.14 -0.08 0.00 0.05 0.00 0.00 34.50 30.71 1rth s PRO 150 CO 0.44 0.54 1.67 -1.14 0.05 0.00 0.00 177.00 178.56 1rth s GLN 151 N -1.39 4.19 0.00 4.56 2.00 -1.26 -2.14 119.66 125.62 1rth s GLN 151 Ca 0.36 2.32 0.00 0.00 -2.00 0.00 0.00 55.36 56.03 1rth s GLN 151 Cb -0.20 -3.70 0.00 0.00 0.80 0.00 0.00 33.01 29.91 1rth s GLN 151 CO 0.22 -0.76 0.00 0.41 -0.50 0.00 0.00 175.29 174.66 1rth n GLY 152 N 4.05 1.85 3.74 2.59 0.00 -1.26 -4.84 105.19 111.31 1rth n GLY 152 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1rth n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1rth s TRP 153 N -2.08 3.16 0.31 1.61 -0.00 -0.91 -4.88 118.94 116.15 1rth s TRP 153 Ca 0.00 1.13 0.03 0.00 -0.00 0.00 0.00 56.10 57.26 1rth s TRP 153 Cb 0.00 -3.70 0.80 0.00 -0.00 0.00 0.00 33.47 30.57 1rth s TRP 153 CO 0.00 -2.23 1.57 -0.22 -0.00 0.00 0.00 176.95 176.08 1rth h LYS 154 N 5.26 0.01 0.00 5.86 3.64 -1.91 -1.92 116.57 127.52 1rth h LYS 154 Ca -0.45 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.86 1rth h LYS 154 Cb 1.22 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1rth h LYS 154 CO 0.78 0.01 -0.32 0.78 -2.27 0.00 0.00 179.45 178.43 1rth h GLY 155 N 0.01 0.00 -0.55 5.01 0.00 -1.92 -3.38 103.07 102.24 1rth h GLY 155 Ca 0.62 0.00 0.13 0.00 0.00 0.00 0.00 47.33 48.07 1rth h GLY 155 CO -0.91 0.00 -0.31 1.76 0.00 0.00 0.00 176.54 177.08 1rth h SER 156 N 0.00 -1.09 -0.78 0.19 0.02 -1.63 -1.53 113.55 108.72 1rth h SER 156 Ca -0.00 0.24 0.04 0.00 -0.84 0.00 0.00 61.79 61.22 1rth h SER 156 Cb 1.16 0.58 -0.04 0.00 0.14 0.00 0.00 62.40 64.23 1rth h SER 156 CO 0.04 -0.29 0.51 -0.65 -1.14 0.00 0.00 176.83 175.31 1rth h PRO 157 N -0.09 0.93 -0.07 3.45 0.11 -1.77 0.13 132.00 134.68 1rth h PRO 157 Ca 0.29 -0.06 -0.19 0.00 0.11 0.00 0.00 66.00 66.15 1rth h PRO 157 Cb 0.56 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.47 1rth h PRO 157 CO -0.76 0.61 -0.71 0.00 -0.21 0.00 0.00 178.00 176.93 1rth h ALA 158 N 1.54 0.19 -0.29 -0.75 0.00 -1.56 -2.32 119.26 116.07 1rth h ALA 158 Ca 0.31 -0.58 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 1rth h ALA 158 Cb 0.05 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1rth h ALA 158 CO -0.09 0.52 -0.16 0.82 0.00 0.00 0.00 179.25 180.34 1rth h ILE 159 N 0.24 1.30 0.00 0.00 2.04 -1.18 -1.50 117.51 118.41 1rth h ILE 159 Ca -0.07 -1.27 -0.02 0.00 1.00 0.00 0.00 64.86 64.51 1rth h ILE 159 Cb 1.37 1.49 -0.00 0.00 -0.74 0.00 0.00 36.82 38.94 1rth h ILE 159 CO 0.14 0.40 -0.07 0.15 0.00 0.00 0.00 178.15 178.78 1rth h PHE 160 N 0.37 0.00 0.01 1.37 3.57 -0.78 -0.05 116.94 121.43 1rth h PHE 160 Ca 0.06 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 1rth h PHE 160 Cb 0.69 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.43 1rth h PHE 160 CO 0.06 0.07 -0.14 0.37 -2.23 0.00 0.00 178.31 176.44 1rth h GLN 161 N 0.00 0.08 -0.62 1.11 5.75 -1.13 -2.71 115.11 117.59 1rth h GLN 161 Ca -0.00 -0.10 -0.02 0.00 -0.15 0.00 0.00 58.65 58.38 1rth h GLN 161 Cb 0.13 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 1rth h GLN 161 CO 0.01 0.91 0.31 0.66 -2.65 0.00 0.00 178.83 178.07 1rth h SER 162 N -0.71 0.80 0.14 -0.69 4.64 -0.99 -1.95 113.55 114.79 1rth h SER 162 Ca -0.02 -0.12 0.01 0.00 -0.47 0.00 0.00 61.79 61.19 1rth h SER 162 Cb 0.97 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.83 1rth h SER 162 CO 0.03 0.69 -0.38 0.28 -0.87 0.00 0.00 176.83 176.57 1rth h SER 163 N 0.84 -1.13 -0.83 4.97 0.02 -1.10 -1.32 113.55 115.01 1rth h SER 163 Ca 0.21 0.11 0.21 0.00 -0.84 0.00 0.00 61.79 61.49 1rth h SER 163 Cb 0.09 0.41 -0.05 0.00 0.14 0.00 0.00 62.40 63.00 1rth h SER 163 CO -0.03 -0.42 0.57 -0.03 -1.14 0.00 0.00 176.83 175.78 1rth h MET 164 N -0.58 0.17 -0.49 3.45 -1.53 -1.42 -0.30 114.93 114.22 1rth h MET 164 Ca -0.01 -0.01 -0.10 0.00 -3.44 0.00 0.00 59.70 56.13 1rth h MET 164 Cb 0.57 -0.04 -0.02 0.00 -0.55 0.00 0.00 31.60 31.56 1rth h MET 164 CO -0.18 0.11 -0.11 1.15 0.14 0.00 0.00 176.91 178.03 1rth h THR 165 N 0.17 1.26 0.73 -0.77 2.02 -0.44 -1.29 112.91 114.59 1rth h THR 165 Ca 0.41 -1.22 -0.04 0.00 0.77 0.00 0.00 66.41 66.33 1rth h THR 165 Cb 1.34 0.99 0.01 0.00 -1.74 0.00 0.00 68.15 68.75 1rth h THR 165 CO -0.08 0.43 -0.35 0.11 0.37 0.00 0.00 175.52 176.00 1rth h LYS 166 N 0.82 -0.94 -1.03 6.66 1.57 -0.63 -1.66 116.57 121.36 1rth h LYS 166 Ca 0.13 0.06 0.29 0.00 -1.87 0.00 0.00 60.65 59.27 1rth h LYS 166 Cb 0.63 0.21 -0.05 0.00 0.08 0.00 0.00 32.23 33.11 1rth h LYS 166 CO 0.04 -0.60 0.73 0.82 -0.57 0.00 0.00 179.45 179.87 1rth h ILE 167 N -1.17 0.50 0.00 1.86 2.04 -1.26 0.11 117.51 119.59 1rth h ILE 167 Ca -0.10 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1rth h ILE 167 Cb 0.77 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1rth h ILE 167 CO 0.16 0.01 -0.93 0.18 0.00 0.00 0.00 178.15 177.58 1rth n LEU 168 N -4.29 0.63 -0.20 1.44 7.99 -0.49 -4.49 117.00 117.58 1rth n LEU 168 Ca 0.22 0.03 -0.04 0.00 -0.01 0.00 0.00 56.01 56.22 1rth n LEU 168 Cb 1.05 -0.12 0.03 0.00 -0.11 0.00 0.00 43.42 44.27 1rth n LEU 168 CO 0.37 0.03 0.67 -0.08 -1.51 0.00 0.00 177.39 176.87 1rth h GLU 169 N 0.00 -0.11 0.20 3.23 4.81 0.20 0.36 114.58 123.26 1rth h GLU 169 Ca 0.00 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1rth h GLU 169 Cb 0.72 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1rth h GLU 169 CO 0.00 -0.07 -0.09 -1.00 -0.73 0.00 0.00 179.01 177.11 1rth h PRO 170 N -0.12 -0.25 -0.86 0.92 0.13 -1.79 0.27 132.00 130.30 1rth h PRO 170 Ca 0.26 0.02 0.09 0.00 -0.87 0.00 0.00 66.00 65.49 1rth h PRO 170 Cb 0.52 0.06 -0.07 0.00 0.13 0.00 0.00 31.00 31.64 1rth h PRO 170 CO -0.66 -0.17 0.51 0.35 -0.23 0.00 0.00 178.00 177.80 1rth h PHE 171 N -0.27 0.93 -0.72 1.56 3.04 -1.74 -0.86 116.94 118.88 1rth h PHE 171 Ca -0.03 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.93 1rth h PHE 171 Cb 0.20 -0.29 -0.03 0.00 2.56 0.00 0.00 35.95 38.39 1rth h PHE 171 CO -0.06 0.40 0.38 0.00 -2.02 0.00 0.00 178.31 177.01 1rth h ARG 172 N 0.86 1.01 -0.08 1.11 3.08 0.25 -1.25 114.38 119.37 1rth h ARG 172 Ca 0.40 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.32 1rth h ARG 172 Cb 0.33 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 1rth h ARG 172 CO -0.23 0.76 -0.01 0.87 -1.07 0.00 0.00 179.97 180.29 1rth h LYS 173 N 1.02 0.14 0.00 0.04 1.79 0.37 -3.16 116.57 116.77 1rth h LYS 173 Ca 0.25 -0.05 -0.05 0.00 -2.18 0.00 0.00 60.65 58.63 1rth h LYS 173 Cb 0.05 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 1rth h LYS 173 CO -0.04 0.43 -0.23 1.96 -1.08 0.00 0.00 179.45 180.48 1rth h GLN 174 N -0.16 0.00 -2.17 3.15 4.20 -0.99 -3.35 115.11 115.78 1rth h GLN 174 Ca 0.02 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.15 1rth h GLN 174 Cb 0.37 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 27.73 1rth h GLN 174 CO 0.01 0.23 -0.74 0.09 -0.67 0.00 0.00 178.83 177.75 1rth n ASN 175 N -3.85 3.12 0.00 1.46 3.02 -0.50 -4.90 115.26 113.61 1rth n ASN 175 Ca -0.02 -3.35 0.07 0.00 -0.03 0.00 0.00 54.58 51.26 1rth n ASN 175 Cb 0.33 -0.63 0.31 0.00 -0.61 0.00 0.00 39.78 39.17 1rth n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1rth n PRO 176 N 0.63 0.01 0.00 3.52 -0.04 -1.21 -1.93 135.00 135.99 1rth n PRO 176 Ca 0.28 0.25 0.13 0.00 -0.04 0.00 0.00 63.50 64.13 1rth n PRO 176 Cb 0.44 -1.50 0.49 0.00 -0.04 0.00 0.00 33.50 32.89 1rth n PRO 176 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1rth n ASP 177 N -1.49 0.66 -4.77 3.54 5.68 -1.26 -4.83 116.55 114.08 1rth n ASP 177 Ca 0.04 -0.60 -0.30 0.00 -0.50 0.00 0.00 54.79 53.42 1rth n ASP 177 Cb 0.16 0.01 -0.06 0.00 -1.14 0.00 0.00 41.12 40.09 1rth n ASP 177 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1rth s ILE 178 N -2.56 4.49 -0.09 2.12 1.01 -0.81 -4.48 121.20 120.87 1rth s ILE 178 Ca 0.25 -0.82 0.04 0.00 0.00 0.00 0.00 60.65 60.11 1rth s ILE 178 Cb 0.19 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 39.49 1rth s ILE 178 CO 0.52 0.09 -0.23 -0.69 0.00 0.00 0.00 174.94 174.63 1rth s VAL 179 N -1.43 1.96 0.08 2.92 1.01 -0.29 -4.99 120.40 119.66 1rth s VAL 179 Ca 0.29 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.39 1rth s VAL 179 Cb -0.12 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 1rth s VAL 179 CO 0.22 0.54 -0.22 -0.63 0.00 0.00 0.00 175.10 175.00 1rth s ILE 180 N 0.34 1.83 -0.19 2.22 1.01 -1.26 -0.50 121.20 124.65 1rth s ILE 180 Ca -0.17 -1.45 -0.07 0.00 0.00 0.00 0.00 60.65 58.95 1rth s ILE 180 Cb -0.17 -1.62 0.09 0.00 0.01 0.00 0.00 42.46 40.76 1rth s ILE 180 CO 0.08 0.09 0.42 -0.47 0.00 0.00 0.00 174.94 175.06 1rth s TYR 181 N -0.99 -0.77 -0.01 3.97 5.04 -0.79 -4.98 117.35 118.82 1rth s TYR 181 Ca 0.09 1.50 -0.02 0.00 -2.44 0.00 0.00 57.07 56.19 1rth s TYR 181 Cb -0.10 0.30 -0.04 0.00 0.35 0.00 0.00 41.96 42.47 1rth s TYR 181 CO 0.04 -0.46 0.14 -1.14 -1.34 0.00 0.00 175.55 172.79 1rth s GLN 182 N 2.46 3.30 -0.25 4.97 0.74 -1.26 -0.04 119.66 129.57 1rth s GLN 182 Ca -0.03 -0.38 -0.04 0.00 0.05 0.00 0.00 55.36 54.97 1rth s GLN 182 Cb -0.12 -3.01 0.14 0.00 1.10 0.00 0.00 33.01 31.12 1rth s GLN 182 CO -0.13 0.67 0.46 -0.47 -0.55 0.00 0.00 175.29 175.27 1rth s TYR 183 N -1.27 -1.05 0.00 1.67 5.04 -0.84 -5.00 117.35 115.90 1rth s TYR 183 Ca 0.25 1.29 0.00 0.00 -2.44 0.00 0.00 57.07 56.18 1rth s TYR 183 Cb -0.12 0.27 0.00 0.00 0.35 0.00 0.00 41.96 42.45 1rth s TYR 183 CO 0.17 -0.71 0.00 -0.12 -1.34 0.00 0.00 175.55 173.55 1rth n MET 184 N 5.39 0.00 -0.92 4.97 1.56 -1.26 -1.89 117.12 124.97 1rth n MET 184 Ca -0.05 0.00 -0.08 0.00 -0.27 0.00 0.00 57.70 57.30 1rth n MET 184 Cb 0.50 0.00 0.19 0.00 2.15 0.00 0.00 33.22 36.06 1rth n MET 184 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 175.97 174.84 1rth n ASP 185 N 8.00 2.80 -4.11 6.12 5.68 -1.26 -4.97 116.55 128.79 1rth n ASP 185 Ca 0.00 -3.78 -0.30 0.00 -0.50 0.00 0.00 54.79 50.21 1rth n ASP 185 Cb 0.00 -0.66 -0.17 0.00 -1.14 0.00 0.00 41.12 39.16 1rth n ASP 185 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1rth s ASP 186 N -2.46 2.63 -0.30 -1.12 1.01 -0.79 -1.37 116.67 114.28 1rth s ASP 186 Ca 0.47 -0.48 -0.12 0.00 0.71 0.00 0.00 52.55 53.13 1rth s ASP 186 Cb 0.42 -1.20 -0.04 0.00 1.01 0.00 0.00 42.92 43.11 1rth s ASP 186 CO 0.01 0.07 0.22 -0.22 0.21 0.00 0.00 175.17 175.45 1rth s LEU 187 N 0.74 4.17 -0.38 1.23 2.96 0.12 -1.99 118.68 125.53 1rth s LEU 187 Ca -0.11 -0.12 -0.12 0.00 -0.22 0.00 0.00 54.13 53.56 1rth s LEU 187 Cb -0.16 -2.14 0.02 0.00 0.50 0.00 0.00 46.19 44.41 1rth s LEU 187 CO 0.02 -0.12 0.23 -0.31 -1.32 0.00 0.00 176.35 174.85 1rth s TYR 188 N 1.77 3.24 -0.12 5.38 1.51 0.94 -0.33 117.35 129.74 1rth s TYR 188 Ca 0.07 -0.85 -0.02 0.00 -1.01 0.00 0.00 57.07 55.26 1rth s TYR 188 Cb -0.16 -2.47 -0.03 0.00 -0.11 0.00 0.00 41.96 39.19 1rth s TYR 188 CO 0.11 -0.62 -0.04 0.08 -1.11 0.00 0.00 175.55 173.97 1rth s VAL 189 N 1.59 3.90 0.07 0.71 1.01 0.21 -1.89 120.40 126.01 1rth s VAL 189 Ca 0.03 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 1rth s VAL 189 Cb -0.19 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 1rth s VAL 189 CO 0.07 0.54 -0.01 -0.83 0.00 0.00 0.00 175.10 174.88 1rth s GLY 190 N -0.15 0.61 0.12 4.51 0.00 0.35 0.67 107.32 113.43 1rth s GLY 190 Ca 0.03 -1.28 -0.25 0.00 0.00 0.00 0.00 44.72 43.22 1rth s GLY 190 CO 0.02 -1.33 1.09 -1.35 0.00 0.00 0.00 173.10 171.54 1rth s SER 191 N -2.95 -0.04 -0.19 1.64 1.04 -0.73 -1.14 113.70 111.33 1rth s SER 191 Ca 0.12 -0.49 0.16 0.00 0.48 0.00 0.00 55.95 56.22 1rth s SER 191 Cb 0.08 0.40 0.54 0.00 0.10 0.00 0.00 66.02 67.14 1rth s SER 191 CO -0.07 -0.78 1.44 0.47 0.98 0.00 0.00 173.24 175.28 1rth n ASP 192 N -0.97 3.89 -4.76 7.02 8.00 -1.26 -1.37 116.55 127.10 1rth n ASP 192 Ca -0.03 -3.05 -0.30 0.00 0.71 0.00 0.00 54.79 52.12 1rth n ASP 192 Cb 0.60 -0.55 0.10 0.00 -0.02 0.00 0.00 41.12 41.25 1rth n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1rth s LEU 193 N -2.85 2.69 0.44 0.64 1.43 -1.26 -4.88 118.68 114.89 1rth s LEU 193 Ca 0.43 1.59 -0.24 0.00 -1.03 0.00 0.00 54.13 54.88 1rth s LEU 193 Cb 0.35 -4.20 -0.08 0.00 0.03 0.00 0.00 46.19 42.29 1rth s LEU 193 CO 0.09 -2.17 1.22 -0.70 0.23 0.00 0.00 176.35 175.02 1rth s GLU 194 N -4.97 3.83 0.51 1.70 -6.30 -1.26 -4.69 118.70 107.51 1rth s GLU 194 Ca 0.62 1.94 0.29 0.00 -2.50 0.00 0.00 54.97 55.32 1rth s GLU 194 Cb -0.17 -2.56 1.40 0.00 0.00 0.00 0.00 34.13 32.81 1rth s GLU 194 CO 0.56 -0.54 1.87 -0.84 0.02 0.00 0.00 175.26 176.33 1rth h ILE 195 N 2.11 0.55 -0.14 -3.70 3.07 -1.98 -0.45 117.51 116.97 1rth h ILE 195 Ca -0.49 -0.03 -0.11 0.00 1.55 0.00 0.00 64.86 65.78 1rth h ILE 195 Cb 1.25 0.45 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 1rth h ILE 195 CO 0.61 0.02 -0.34 1.23 -1.05 0.00 0.00 178.15 178.62 1rth h GLY 196 N 0.09 0.53 0.81 0.16 0.00 -1.99 0.18 103.07 102.85 1rth h GLY 196 Ca 0.46 -0.65 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 1rth h GLY 196 CO -0.05 0.58 -0.30 1.46 0.00 0.00 0.00 176.54 178.23 1rth h GLN 197 N 0.10 -0.69 -0.71 4.80 1.08 -1.64 0.22 115.11 118.27 1rth h GLN 197 Ca -0.00 0.05 0.14 0.00 -1.45 0.00 0.00 58.65 57.39 1rth h GLN 197 Cb 0.94 0.16 -0.10 0.00 -0.05 0.00 0.00 27.48 28.43 1rth h GLN 197 CO 0.07 -0.46 0.21 1.25 -0.95 0.00 0.00 178.83 178.95 1rth h HIS 198 N -0.71 0.34 -0.92 2.96 2.76 -1.08 0.29 115.15 118.79 1rth h HIS 198 Ca -0.04 0.04 0.05 0.00 -2.20 0.00 0.00 60.37 58.21 1rth h HIS 198 Cb 0.60 -0.04 -0.06 0.00 1.55 0.00 0.00 27.41 29.46 1rth h HIS 198 CO -0.12 -0.02 0.59 -0.09 -1.30 0.00 0.00 177.93 176.99 1rth h ARG 199 N 0.33 1.08 0.78 5.26 2.43 -0.23 -1.89 114.38 122.14 1rth h ARG 199 Ca 0.39 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.46 1rth h ARG 199 Cb 0.62 -0.24 0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1rth h ARG 199 CO -0.44 0.72 -0.37 1.15 -1.51 0.00 0.00 179.97 179.51 1rth h THR 200 N 1.12 0.22 -0.90 0.20 2.02 0.16 -2.59 112.91 113.14 1rth h THR 200 Ca 0.38 -0.03 0.16 0.00 0.77 0.00 0.00 66.41 67.69 1rth h THR 200 Cb 0.08 0.23 -0.10 0.00 -1.74 0.00 0.00 68.15 66.63 1rth h THR 200 CO -0.15 0.00 0.48 0.11 0.37 0.00 0.00 175.52 176.34 1rth h LYS 201 N -1.07 0.64 -0.30 6.66 1.79 -0.96 0.14 116.57 123.47 1rth h LYS 201 Ca -0.11 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.32 1rth h LYS 201 Cb 0.81 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.30 1rth h LYS 201 CO 0.18 0.42 0.18 0.82 -1.08 0.00 0.00 179.45 179.97 1rth h ILE 202 N 0.66 1.11 -0.70 1.86 1.08 -1.32 0.26 117.51 120.46 1rth h ILE 202 Ca 0.50 -0.26 0.07 0.00 -0.39 0.00 0.00 64.86 64.78 1rth h ILE 202 Cb 0.73 0.74 -0.04 0.00 -3.07 0.00 0.00 36.82 35.17 1rth h ILE 202 CO -0.37 0.11 0.46 -0.08 -0.69 0.00 0.00 178.15 177.58 1rth h GLU 203 N 0.39 0.67 0.68 2.37 4.57 -0.40 0.65 114.58 123.50 1rth h GLU 203 Ca 0.11 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.21 1rth h GLU 203 Cb 0.02 -0.15 0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1rth h GLU 203 CO -0.02 0.44 -0.32 1.49 -1.18 0.00 0.00 179.01 179.42 1rth h GLU 204 N 0.69 -0.87 -0.99 1.92 4.81 0.42 -0.54 114.58 120.01 1rth h GLU 204 Ca 0.31 0.06 0.10 0.00 -0.13 0.00 0.00 59.36 59.69 1rth h GLU 204 Cb 0.32 0.20 -0.08 0.00 0.63 0.00 0.00 28.75 29.82 1rth h GLU 204 CO -0.10 -0.55 0.63 1.25 -0.73 0.00 0.00 179.01 179.51 1rth h LEU 205 N -1.02 0.96 -1.79 1.64 6.46 0.29 0.13 115.31 121.98 1rth h LEU 205 Ca -0.09 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.68 1rth h LEU 205 Cb 0.72 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.48 1rth h LEU 205 CO 0.15 0.56 -0.07 -0.09 -0.62 0.00 0.00 178.44 178.37 1rth h ARG 206 N 1.06 0.05 0.18 1.25 2.43 0.71 -1.07 114.38 118.99 1rth h ARG 206 Ca 0.46 -0.01 -0.32 0.00 -0.81 0.00 0.00 59.98 59.31 1rth h ARG 206 Cb 0.36 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1rth h ARG 206 CO -0.22 0.12 -1.47 1.96 -1.51 0.00 0.00 179.97 178.84 1rth h GLN 207 N 0.05 0.39 0.36 0.20 4.20 0.78 -2.79 115.11 118.30 1rth h GLN 207 Ca 0.01 -0.66 -0.01 0.00 0.06 0.00 0.00 58.65 58.05 1rth h GLN 207 Cb 0.15 0.25 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 1rth h GLN 207 CO 0.01 1.30 -0.40 1.25 -0.67 0.00 0.00 178.83 180.32 1rth h HIS 208 N 0.11 -1.11 -0.78 2.96 2.76 0.20 -0.99 115.15 118.29 1rth h HIS 208 Ca -0.24 0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.04 1rth h HIS 208 Cb 2.08 0.44 -0.05 0.00 1.55 0.00 0.00 27.41 31.42 1rth h HIS 208 CO 0.09 -0.52 0.51 -0.07 -1.30 0.00 0.00 177.93 176.64 1rth h LEU 209 N -0.77 0.64 -1.96 0.26 3.38 -1.37 0.27 115.31 115.76 1rth h LEU 209 Ca -0.05 0.02 0.05 0.00 0.09 0.00 0.00 57.88 57.99 1rth h LEU 209 Cb 0.68 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1rth h LEU 209 CO -0.07 0.38 0.14 0.25 0.09 0.00 0.00 178.44 179.23 1rth h LEU 210 N 0.71 0.05 -1.21 1.67 5.85 -1.08 0.33 115.31 121.63 1rth h LEU 210 Ca 0.36 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 59.03 1rth h LEU 210 Cb 0.46 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 1rth h LEU 210 CO -0.14 0.03 -0.01 0.03 -0.34 0.00 0.00 178.44 178.02 1rth h ARG 211 N 0.05 0.53 -0.68 1.25 3.08 0.86 -2.38 114.38 117.10 1rth h ARG 211 Ca 0.09 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1rth h ARG 211 Cb 0.29 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1rth h ARG 211 CO -0.01 0.57 0.00 0.91 -1.07 0.00 0.00 179.97 180.37 1rth n TRP 212 N -4.27 0.42 0.00 3.04 7.02 0.11 -4.86 117.44 118.90 1rth n TRP 212 Ca 0.01 -0.16 0.00 0.00 -1.02 0.00 0.00 57.50 56.34 1rth n TRP 212 Cb 0.25 -0.14 0.00 0.00 -2.42 0.00 0.00 31.31 29.00 1rth n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1rth n GLY 213 N 0.35 3.02 3.55 6.99 0.00 -0.90 -4.42 105.19 113.78 1rth n GLY 213 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1rth n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rth s LEU 214 N 0.00 3.23 0.35 0.99 1.43 -1.15 -4.28 118.68 119.25 1rth s LEU 214 Ca 0.00 0.05 -0.22 0.00 -1.03 0.00 0.00 54.13 52.93 1rth s LEU 214 Cb 0.00 -2.54 -0.10 0.00 0.03 0.00 0.00 46.19 43.58 1rth s LEU 214 CO 0.00 -2.65 0.89 0.28 0.23 0.00 0.00 176.35 175.11 1rth s THR 215 N 10.08 4.39 0.13 5.49 -1.32 -1.26 -3.71 115.64 129.44 1rth s THR 215 Ca 0.73 1.51 0.06 0.00 -1.21 0.00 0.00 61.69 62.78 1rth s THR 215 Cb -0.11 -3.78 -0.04 0.00 -1.51 0.00 0.00 72.50 67.06 1rth s THR 215 CO 0.13 -0.08 -0.01 -0.89 -2.21 0.00 0.00 174.62 171.56 1rth s THR 216 N -1.88 3.78 0.72 5.08 2.01 -1.26 -4.71 115.64 119.39 1rth s THR 216 Ca 0.55 -1.24 -0.16 0.00 0.31 0.00 0.00 61.69 61.15 1rth s THR 216 Cb -0.13 -2.85 0.03 0.00 0.01 0.00 0.00 72.50 69.56 1rth s THR 216 CO 0.18 0.01 1.26 -0.81 -0.69 0.00 0.00 174.62 174.57 1rth n PRO 217 N 0.25 0.68 -2.00 4.92 -0.04 -1.26 -5.07 135.00 132.48 1rth n PRO 217 Ca -0.11 0.30 -0.35 0.00 -0.04 0.00 0.00 63.50 63.30 1rth n PRO 217 Cb 0.53 -2.49 0.03 0.00 -0.04 0.00 0.00 33.50 31.53 1rth n PRO 217 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1rth s ASP 218 N -1.73 5.28 0.55 3.54 -4.77 -1.26 -4.92 116.67 113.37 1rth s ASP 218 Ca 0.79 2.22 0.25 0.00 -3.30 0.00 0.00 52.55 52.50 1rth s ASP 218 Cb -0.34 -2.58 1.49 0.00 -1.09 0.00 0.00 42.92 40.40 1rth s ASP 218 CO 0.45 -1.52 2.09 0.50 0.70 0.00 0.00 175.17 177.39 1rth h LYS 219 N 0.71 0.00 0.00 2.11 1.63 -2.00 -0.75 116.57 118.27 1rth h LYS 219 Ca -0.49 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.31 1rth h LYS 219 Cb 1.27 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 1rth h LYS 219 CO 0.55 0.00 0.27 -0.22 -3.45 0.00 0.00 179.45 176.60 1rth h LYS 220 N 0.00 0.00 -0.72 1.90 1.63 -2.06 -3.35 116.57 113.97 1rth h LYS 220 Ca 0.11 0.00 0.01 0.00 -0.85 0.00 0.00 60.65 59.92 1rth h LYS 220 Cb 0.52 0.00 -0.19 0.00 -0.60 0.00 0.00 32.23 31.96 1rth h LYS 220 CO -0.00 0.00 -0.33 -3.38 -3.45 0.00 0.00 179.45 172.29 1rth s HIS 221 N -4.04 -1.26 0.08 1.91 -3.43 -0.29 -5.14 115.29 103.12 1rth s HIS 221 Ca -0.03 0.22 0.09 0.00 -0.80 0.00 0.00 55.06 54.54 1rth s HIS 221 Cb 0.09 0.23 -0.03 0.00 -1.43 0.00 0.00 32.58 31.44 1rth s HIS 221 CO 0.28 -0.85 -0.25 -1.14 -2.00 0.00 0.00 174.74 170.78 1rth s GLN 222 N 1.94 1.52 0.30 -0.38 0.74 -1.25 -4.64 119.66 117.89 1rth s GLN 222 Ca 0.16 -1.17 -0.09 0.00 0.05 0.00 0.00 55.36 54.31 1rth s GLN 222 Cb -0.02 -1.81 -0.07 0.00 1.10 0.00 0.00 33.01 32.22 1rth s GLN 222 CO -0.11 0.45 0.62 0.15 -0.55 0.00 0.00 175.29 175.85 1rth s LYS 223 N -1.58 3.76 0.08 1.67 1.02 -1.26 -5.10 119.74 118.33 1rth s LYS 223 Ca 0.11 0.26 0.01 0.00 0.02 0.00 0.00 55.97 56.38 1rth s LYS 223 Cb -0.10 -2.57 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 1rth s LYS 223 CO 0.04 0.19 -0.06 -1.21 -0.92 0.00 0.00 175.35 173.39 1rth s GLU 224 N -3.30 0.76 0.84 1.68 0.41 -1.26 -4.59 118.70 113.25 1rth s GLU 224 Ca 0.48 -1.26 -0.14 0.00 -0.41 0.00 0.00 54.97 53.63 1rth s GLU 224 Cb -0.11 -0.13 0.01 0.00 -1.78 0.00 0.00 34.13 32.12 1rth s GLU 224 CO 0.26 -0.03 0.53 -2.30 -0.49 0.00 0.00 175.26 173.23 1rth n PRO 225 N 0.12 0.00 -1.57 0.39 -0.02 -1.26 -4.65 135.00 128.00 1rth n PRO 225 Ca -0.13 0.05 -0.30 0.00 -2.02 0.00 0.00 63.50 61.10 1rth n PRO 225 Cb 0.60 -1.90 0.08 0.00 -0.02 0.00 0.00 33.50 32.26 1rth n PRO 225 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1rth s PRO 226 N -3.32 2.33 -0.11 0.52 0.02 -1.26 -5.12 135.00 128.06 1rth s PRO 226 Ca 0.62 0.71 -0.01 0.00 0.02 0.00 0.00 61.00 62.34 1rth s PRO 226 Cb -0.27 -1.94 -0.03 0.00 0.02 0.00 0.00 34.50 32.28 1rth s PRO 226 CO 0.62 -1.47 -0.08 -0.06 -0.33 0.00 0.00 177.00 175.69 1rth s PHE 227 N -3.14 2.92 -0.62 6.54 0.08 0.23 -4.81 117.98 119.19 1rth s PHE 227 Ca 0.60 -0.26 -0.24 0.00 0.12 0.00 0.00 56.93 57.15 1rth s PHE 227 Cb -0.14 -1.83 0.05 0.00 -0.57 0.00 0.00 43.02 40.53 1rth s PHE 227 CO 0.54 0.06 1.01 -1.17 -0.10 0.00 0.00 175.22 175.56 1rth s LEU 228 N -0.11 4.05 -0.49 -0.37 1.98 -1.26 0.47 118.68 122.95 1rth s LEU 228 Ca 0.01 -0.58 0.04 0.00 -2.89 0.00 0.00 54.13 50.71 1rth s LEU 228 Cb -0.13 -2.66 0.13 0.00 0.66 0.00 0.00 46.19 44.19 1rth s LEU 228 CO 0.03 -1.40 0.24 0.86 -1.89 0.00 0.00 176.35 174.19 1rth s TRP 229 N 4.27 3.03 -0.22 5.38 -0.00 -0.53 -4.91 118.94 125.96 1rth s TRP 229 Ca 0.28 -3.03 -0.19 0.00 -0.00 0.00 0.00 56.10 53.16 1rth s TRP 229 Cb -0.13 -2.67 0.03 0.00 -0.00 0.00 0.00 33.47 30.69 1rth s TRP 229 CO 0.16 -0.77 0.32 -1.33 -0.00 0.00 0.00 176.95 175.34 1rth n MET 230 N 3.29 -1.00 0.00 5.86 2.81 -1.26 -2.53 117.12 124.29 1rth n MET 230 Ca 0.05 0.88 0.00 0.00 -1.81 0.00 0.00 57.70 56.82 1rth n MET 230 Cb 0.33 -1.20 0.00 0.00 -0.71 0.00 0.00 33.22 31.64 1rth n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rth n GLY 231 N 0.28 3.05 3.82 3.03 0.00 -1.26 -5.01 105.19 109.08 1rth n GLY 231 Ca -0.04 -0.60 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 1rth n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rth s TYR 232 N -1.58 2.97 -0.36 1.61 1.51 -1.05 -2.66 117.35 117.80 1rth s TYR 232 Ca 0.00 -0.21 -0.00 0.00 -1.01 0.00 0.00 57.07 55.85 1rth s TYR 232 Cb 0.00 -1.56 0.09 0.00 -0.11 0.00 0.00 41.96 40.39 1rth s TYR 232 CO 0.00 0.38 0.10 -2.00 -1.11 0.00 0.00 175.55 172.93 1rth s GLU 233 N -3.89 1.94 -0.25 -0.62 2.12 0.11 -1.46 118.70 116.65 1rth s GLU 233 Ca 0.36 -1.71 -0.17 0.00 0.36 0.00 0.00 54.97 53.81 1rth s GLU 233 Cb -0.07 -3.36 -0.03 0.00 0.26 0.00 0.00 34.13 30.93 1rth s GLU 233 CO 0.25 -0.92 0.47 -0.51 -0.54 0.00 0.00 175.26 174.01 1rth s LEU 234 N 1.09 4.07 0.18 2.70 1.02 0.18 0.01 118.68 127.93 1rth s LEU 234 Ca 0.06 0.48 0.08 0.00 0.02 0.00 0.00 54.13 54.77 1rth s LEU 234 Cb -0.21 -2.59 -0.04 0.00 0.02 0.00 0.00 46.19 43.37 1rth s LEU 234 CO -0.05 -0.22 -0.00 -1.00 0.02 0.00 0.00 176.35 175.10 1rth s HIS 235 N 2.04 2.82 0.55 0.29 3.76 -0.34 0.75 115.29 125.16 1rth s HIS 235 Ca 0.20 -0.15 0.23 0.00 -0.15 0.00 0.00 55.06 55.19 1rth s HIS 235 Cb -0.16 -1.36 1.53 0.00 1.11 0.00 0.00 32.58 33.71 1rth s HIS 235 CO 0.09 0.52 2.19 -1.35 -0.85 0.00 0.00 174.74 175.35 1rth h PRO 236 N 2.64 0.00 -0.00 8.40 0.11 -1.93 -3.05 132.00 138.17 1rth h PRO 236 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1rth h PRO 236 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1rth h PRO 236 CO 0.58 0.00 -0.62 -0.40 -0.21 0.00 0.00 178.00 177.35 1rth n ASP 237 N -4.20 0.72 -3.54 -2.05 5.75 -1.26 -1.84 116.55 110.13 1rth n ASP 237 Ca -0.02 -0.86 -0.10 0.00 -0.01 0.00 0.00 54.79 53.79 1rth n ASP 237 Cb 0.11 0.95 -0.04 0.00 -1.03 0.00 0.00 41.12 41.12 1rth n ASP 237 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1rth s LYS 238 N -2.24 0.74 0.20 0.11 -2.85 -1.15 -4.66 119.74 109.88 1rth s LYS 238 Ca 0.06 -0.04 0.10 0.00 -1.00 0.00 0.00 55.97 55.08 1rth s LYS 238 Cb 0.10 0.35 -0.04 0.00 -2.06 0.00 0.00 37.83 36.18 1rth s LYS 238 CO 0.54 -0.28 -0.12 1.67 0.10 0.00 0.00 175.35 177.26 1rth s TRP 239 N -2.00 2.55 0.03 1.78 1.48 -1.19 -1.20 118.94 120.38 1rth s TRP 239 Ca 0.00 -0.26 0.01 0.00 -1.06 0.00 0.00 56.10 54.80 1rth s TRP 239 Cb -0.01 -1.23 -0.02 0.00 -1.16 0.00 0.00 33.47 31.06 1rth s TRP 239 CO -0.02 0.53 -0.06 0.99 -4.06 0.00 0.00 176.95 174.33 1rth s THR 240 N -1.80 0.37 -0.34 0.66 2.01 0.10 -1.57 115.64 115.07 1rth s THR 240 Ca 0.25 -0.83 -0.27 0.00 0.31 0.00 0.00 61.69 61.14 1rth s THR 240 Cb -0.08 -0.44 0.02 0.00 0.01 0.00 0.00 72.50 72.01 1rth s THR 240 CO 0.14 -0.31 0.99 -0.69 -0.69 0.00 0.00 174.62 174.06 1rth s VAL 241 N -1.12 4.55 0.35 3.82 1.01 -0.14 0.08 120.40 128.96 1rth s VAL 241 Ca -0.09 1.45 -0.28 0.00 0.00 0.00 0.00 61.98 63.05 1rth s VAL 241 Cb -0.08 -4.37 -0.10 0.00 0.00 0.00 0.00 36.38 31.83 1rth s VAL 241 CO -0.00 -0.51 1.38 -1.58 0.00 0.00 0.00 175.10 174.39 1rth s GLN 242 N 3.56 4.23 -0.21 2.72 0.74 -1.09 -4.66 119.66 124.96 1rth s GLN 242 Ca 0.41 2.36 -0.42 0.00 0.05 0.00 0.00 55.36 57.76 1rth s GLN 242 Cb -0.12 -3.01 -0.20 0.00 1.10 0.00 0.00 33.01 30.78 1rth s GLN 242 CO 0.17 -0.35 1.28 -0.35 -0.55 0.00 0.00 175.29 175.49 1rth n PRO 243 N 0.62 0.00 -3.92 1.67 -0.04 -1.26 -4.98 135.00 127.09 1rth n PRO 243 Ca 0.01 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 1rth n PRO 243 Cb 0.41 -1.48 -0.13 0.00 -0.04 0.00 0.00 33.50 32.26 1rth n PRO 243 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rth s ILE 244 N 1.25 2.73 -0.42 0.52 2.07 -1.26 -5.08 121.20 121.01 1rth s ILE 244 Ca 0.96 -2.59 -0.22 0.00 -1.41 0.00 0.00 60.65 57.39 1rth s ILE 244 Cb -1.35 -2.92 0.02 0.00 0.13 0.00 0.00 42.46 38.34 1rth s ILE 244 CO 0.67 -0.70 0.70 -0.69 -1.91 0.00 0.00 174.94 173.01 1rth s VAL 245 N 0.56 4.77 -0.33 4.00 1.01 -1.26 -4.99 120.40 124.16 1rth s VAL 245 Ca 0.13 0.35 -0.21 0.00 0.00 0.00 0.00 61.98 62.24 1rth s VAL 245 Cb -0.22 -4.22 -0.00 0.00 0.00 0.00 0.00 36.38 31.94 1rth s VAL 245 CO -0.05 -0.58 0.69 -0.76 0.00 0.00 0.00 175.10 174.41 1rth s LEU 246 N 2.98 4.16 -0.02 3.92 1.43 -1.26 -5.01 118.68 124.88 1rth s LEU 246 Ca 0.26 0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 53.44 1rth s LEU 246 Cb -0.13 -2.90 -0.07 0.00 0.03 0.00 0.00 46.19 43.12 1rth s LEU 246 CO 0.19 -0.59 1.74 -2.16 0.23 0.00 0.00 176.35 175.77 1rth s PRO 247 N 2.80 4.17 -0.04 1.29 0.04 -1.26 -4.94 135.00 137.06 1rth s PRO 247 Ca 0.27 2.31 -0.30 0.00 0.04 0.00 0.00 61.00 63.33 1rth s PRO 247 Cb -0.14 -4.02 -0.02 0.00 0.04 0.00 0.00 34.50 30.35 1rth s PRO 247 CO 0.14 -0.87 1.01 -2.00 0.04 0.00 0.00 177.00 175.32 1rth s GLU 248 N 4.11 4.49 0.11 4.56 2.56 -1.26 -5.02 118.70 128.24 1rth s GLU 248 Ca 0.78 1.44 -0.05 0.00 0.00 0.00 0.00 54.97 57.14 1rth s GLU 248 Cb -0.36 -3.49 -0.02 0.00 2.00 0.00 0.00 34.13 32.25 1rth s GLU 248 CO 0.33 -0.19 0.11 -1.59 -0.56 0.00 0.00 175.26 173.37 1rth s LYS 249 N 1.48 0.87 0.00 4.30 -2.85 -1.26 -5.09 119.74 117.18 1rth s LYS 249 Ca 0.51 -1.20 0.00 0.00 -1.00 0.00 0.00 55.97 54.28 1rth s LYS 249 Cb -0.21 0.29 0.00 0.00 -2.06 0.00 0.00 37.83 35.85 1rth s LYS 249 CO 0.24 -0.26 0.51 -0.25 0.10 0.00 0.00 175.35 175.69 1rth n ASP 250 N -0.06 0.00 -4.46 0.03 9.92 -1.26 -4.87 116.55 115.85 1rth n ASP 250 Ca -0.11 0.67 -0.33 0.00 -0.53 0.00 0.00 54.79 54.50 1rth n ASP 250 Cb 0.62 -0.39 -0.13 0.00 -0.64 0.00 0.00 41.12 40.59 1rth n ASP 250 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1rth s SER 251 N -2.24 4.04 -0.17 -2.24 1.04 -1.26 -5.05 113.70 107.81 1rth s SER 251 Ca 0.00 -0.21 -0.03 0.00 0.48 0.00 0.00 55.95 56.19 1rth s SER 251 Cb 0.00 -0.96 -0.02 0.00 0.10 0.00 0.00 66.02 65.14 1rth s SER 251 CO 0.00 0.32 -0.05 0.26 0.98 0.00 0.00 173.24 174.76 1rth s TRP 252 N -0.59 2.98 0.42 5.02 0.52 -1.26 -5.04 118.94 120.99 1rth s TRP 252 Ca 0.08 -0.51 -0.02 0.00 0.02 0.00 0.00 56.10 55.67 1rth s TRP 252 Cb -0.11 -1.99 -0.03 0.00 -1.15 0.00 0.00 33.47 30.18 1rth s TRP 252 CO 0.01 -0.21 0.67 0.95 0.02 0.00 0.00 176.95 178.40 1rth s THR 253 N 0.71 4.86 0.10 2.01 -4.23 -1.26 -0.55 115.64 117.29 1rth s THR 253 Ca -0.02 -0.17 -0.25 0.00 -1.18 0.00 0.00 61.69 60.06 1rth s THR 253 Cb -0.15 -3.81 -0.10 0.00 1.34 0.00 0.00 72.50 69.78 1rth s THR 253 CO 0.02 -0.66 1.67 0.58 -0.54 0.00 0.00 174.62 175.70 1rth h VAL 254 N 0.46 0.63 -0.10 2.29 2.07 -1.14 -0.91 116.25 119.54 1rth h VAL 254 Ca -0.48 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.07 1rth h VAL 254 Cb 1.22 0.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.55 1rth h VAL 254 CO 0.61 0.00 -0.49 -1.13 0.02 0.00 0.00 177.57 176.58 1rth h ASN 255 N -0.33 -1.53 -0.98 0.57 -1.24 -1.25 0.16 115.58 110.99 1rth h ASN 255 Ca 0.02 0.19 0.28 0.00 0.71 0.00 0.00 56.30 57.50 1rth h ASN 255 Cb 0.34 0.60 -0.14 0.00 0.73 0.00 0.00 38.32 39.85 1rth h ASN 255 CO -0.08 -0.47 0.54 0.44 -1.29 0.00 0.00 177.43 176.57 1rth h ASP 256 N -0.56 0.52 -0.53 1.15 3.32 -1.72 0.67 116.42 119.27 1rth h ASP 256 Ca 0.05 0.17 -0.10 0.00 0.02 0.00 0.00 57.03 57.16 1rth h ASP 256 Cb 0.67 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.31 1rth h ASP 256 CO -0.40 -0.04 -0.06 0.40 -1.72 0.00 0.00 179.24 177.42 1rth h ILE 257 N 0.42 1.26 0.01 0.35 1.08 0.63 -0.02 117.51 121.24 1rth h ILE 257 Ca 0.67 -1.20 0.02 0.00 -0.39 0.00 0.00 64.86 63.96 1rth h ILE 257 Cb 1.41 0.90 -0.02 0.00 -3.07 0.00 0.00 36.82 36.04 1rth h ILE 257 CO -0.56 0.43 -0.11 1.56 -0.69 0.00 0.00 178.15 178.79 1rth h GLN 258 N 0.91 -0.18 -0.72 2.37 4.20 0.24 0.30 115.11 122.22 1rth h GLN 258 Ca 0.15 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.87 1rth h GLN 258 Cb 0.61 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.40 1rth h GLN 258 CO 0.04 -0.12 0.43 0.87 -0.67 0.00 0.00 178.83 179.38 1rth h LYS 259 N -0.19 0.98 0.13 1.46 1.57 -1.09 0.20 116.57 119.63 1rth h LYS 259 Ca 0.04 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1rth h LYS 259 Cb 0.24 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1rth h LYS 259 CO -0.10 0.69 -0.06 1.25 -0.57 0.00 0.00 179.45 180.65 1rth h LEU 260 N 0.99 -0.15 -1.52 2.94 5.85 -0.54 -1.24 115.31 121.65 1rth h LEU 260 Ca 0.26 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 1rth h LEU 260 Cb -0.03 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1rth h LEU 260 CO -0.05 0.10 -0.24 0.58 -0.34 0.00 0.00 178.44 178.49 1rth h VAL 261 N -0.41 1.15 0.77 1.05 2.07 0.22 -1.57 116.25 119.53 1rth h VAL 261 Ca -0.02 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.63 1rth h VAL 261 Cb 0.33 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1rth h VAL 261 CO 0.03 0.24 -0.41 1.23 0.02 0.00 0.00 177.57 178.67 1rth h GLY 262 N 0.75 -1.19 0.39 2.17 0.00 -0.17 -1.25 103.07 103.77 1rth h GLY 262 Ca -0.00 0.46 0.08 0.00 0.00 0.00 0.00 47.33 47.87 1rth h GLY 262 CO 0.03 -0.42 0.12 0.50 0.00 0.00 0.00 176.54 176.77 1rth h LYS 263 N -1.09 0.26 -0.67 4.80 6.56 -1.02 -0.61 116.57 124.81 1rth h LYS 263 Ca -0.10 -0.02 0.05 0.00 -1.06 0.00 0.00 60.65 59.52 1rth h LYS 263 Cb 0.85 -0.06 -0.04 0.00 -0.57 0.00 0.00 32.23 32.41 1rth h LYS 263 CO 0.14 0.17 0.44 -0.07 -2.06 0.00 0.00 179.45 178.08 1rth h LEU 264 N 0.27 0.63 -0.40 2.94 -0.00 -1.24 -1.11 115.31 116.39 1rth h LEU 264 Ca 0.25 -0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.96 1rth h LEU 264 Cb 0.32 -0.14 -0.00 0.00 -0.00 0.00 0.00 40.66 40.84 1rth h LEU 264 CO -0.31 0.42 -0.51 -1.13 -0.00 0.00 0.00 178.44 176.91 1rth h ASN 265 N 0.73 0.85 -0.21 -0.43 -1.24 0.12 -2.28 115.58 113.11 1rth h ASN 265 Ca 0.28 -0.44 0.00 0.00 0.71 0.00 0.00 56.30 56.85 1rth h ASN 265 Cb 0.19 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 38.98 1rth h ASN 265 CO -0.09 1.21 0.14 -0.25 -1.29 0.00 0.00 177.43 177.15 1rth h TRP 266 N 0.60 0.27 -0.61 0.67 7.01 -0.72 -3.09 115.95 120.09 1rth h TRP 266 Ca 0.02 0.00 0.12 0.00 2.11 0.00 0.00 58.89 61.15 1rth h TRP 266 Cb 1.09 -0.09 -0.10 0.00 -2.10 0.00 0.00 29.16 27.97 1rth h TRP 266 CO 0.06 0.19 0.06 0.00 -2.79 0.00 0.00 178.44 175.96 1rth h ALA 267 N 1.06 0.67 0.00 2.65 0.00 -1.08 -2.82 119.26 119.74 1rth h ALA 267 Ca 0.08 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1rth h ALA 267 Cb -0.01 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1rth h ALA 267 CO -0.02 -0.36 0.39 0.66 0.00 0.00 0.00 179.25 179.93 1rth h SER 268 N 0.18 0.00 -0.07 0.00 4.64 -1.32 -1.06 113.55 115.91 1rth h SER 268 Ca 0.32 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.64 1rth h SER 268 Cb 0.51 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1rth h SER 268 CO -0.47 0.00 0.02 1.56 -0.87 0.00 0.00 176.83 177.07 1rth h GLN 269 N 0.00 0.11 0.20 4.77 1.08 -1.66 -2.96 115.11 116.65 1rth h GLN 269 Ca 0.00 -0.03 -0.35 0.00 -1.45 0.00 0.00 58.65 56.82 1rth h GLN 269 Cb 0.78 -0.02 0.01 0.00 -0.05 0.00 0.00 27.48 28.21 1rth h GLN 269 CO 0.00 0.29 -1.72 0.97 -0.95 0.00 0.00 178.83 177.42 1rth h ILE 270 N -0.08 0.98 -2.73 2.54 6.09 -1.48 -2.96 117.51 119.86 1rth h ILE 270 Ca 0.02 -2.53 -0.74 0.00 -1.37 0.00 0.00 64.86 60.24 1rth h ILE 270 Cb 0.22 2.80 -0.32 0.00 0.47 0.00 0.00 36.82 39.99 1rth h ILE 270 CO -0.00 0.85 0.34 -1.22 -3.07 0.00 0.00 178.15 175.05 1rth n TYR 271 N -3.62 2.81 -2.12 2.19 4.01 -0.51 -4.97 117.16 114.95 1rth n TYR 271 Ca -0.24 -3.13 -0.35 0.00 -0.16 0.00 0.00 57.90 54.02 1rth n TYR 271 Cb 1.08 -1.06 0.02 0.00 -0.31 0.00 0.00 39.34 39.07 1rth n TYR 271 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 1rth s PRO 272 N -2.62 3.16 0.00 -0.72 0.02 -1.12 -2.48 135.00 131.24 1rth s PRO 272 Ca 0.34 1.66 0.00 0.00 0.02 0.00 0.00 61.00 63.02 1rth s PRO 272 Cb 0.07 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.62 1rth s PRO 272 CO 0.06 -1.02 0.00 0.41 -0.33 0.00 0.00 177.00 176.12 1rth n GLY 273 N 0.21 2.10 3.64 0.52 0.00 -1.26 -5.07 105.19 105.33 1rth n GLY 273 Ca 0.12 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 1rth n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1rth n ILE 274 N 0.00 2.67 -4.00 -0.61 2.08 -1.03 -4.97 119.36 113.49 1rth n ILE 274 Ca 0.00 -0.50 -0.08 0.00 0.56 0.00 0.00 62.75 62.73 1rth n ILE 274 Cb 0.00 -1.26 -0.10 0.00 -0.75 0.00 0.00 39.64 37.53 1rth n ILE 274 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 1rth s LYS 275 N -2.18 0.56 0.00 0.38 1.02 -1.26 -4.97 119.74 113.28 1rth s LYS 275 Ca 0.65 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.69 1rth s LYS 275 Cb -0.52 0.21 0.00 0.00 -0.52 0.00 0.00 37.83 37.00 1rth s LYS 275 CO 0.56 -0.12 0.32 1.33 -0.92 0.00 0.00 175.35 176.51 1rth n VAL 276 N 0.58 0.00 -0.18 3.17 0.24 -1.26 -4.95 118.33 115.93 1rth n VAL 276 Ca -0.17 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.09 1rth n VAL 276 Cb 0.59 1.15 0.03 0.00 -1.47 0.00 0.00 33.84 34.15 1rth n VAL 276 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1rth h ARG 277 N 0.00 -0.09 -0.07 7.34 2.43 -2.02 -2.38 114.38 119.60 1rth h ARG 277 Ca 0.00 0.01 -0.18 0.00 -0.81 0.00 0.00 59.98 59.00 1rth h ARG 277 Cb 0.85 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 1rth h ARG 277 CO 0.00 -0.06 -0.72 1.96 -1.51 0.00 0.00 179.97 179.64 1rth h GLN 278 N -0.09 0.37 -1.70 0.20 7.50 -1.92 -2.80 115.11 116.66 1rth h GLN 278 Ca 0.25 -0.30 0.00 0.00 0.50 0.00 0.00 58.65 59.10 1rth h GLN 278 Cb 0.49 0.06 0.00 0.00 0.05 0.00 0.00 27.48 28.08 1rth h GLN 278 CO -0.61 0.94 0.00 -0.11 -1.50 0.00 0.00 178.83 177.56 1rth n LEU 279 N -3.83 1.00 0.00 1.46 7.94 -0.90 -3.19 117.00 119.49 1rth n LEU 279 Ca -0.04 -0.50 0.00 0.00 -1.11 0.00 0.00 56.01 54.36 1rth n LEU 279 Cb 0.70 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 44.48 1rth n LEU 279 CO 0.48 0.17 0.00 0.29 -1.11 0.00 0.00 177.39 177.21 1rth n LYS 281 N 0.90 0.00 0.02 1.96 5.02 -1.06 -4.32 118.16 120.69 1rth n LYS 281 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.30 1rth n LYS 281 Cb 0.16 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.21 1rth n LYS 281 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1rth n LEU 282 N 0.00 0.04 0.08 -0.35 7.99 -1.19 -1.82 117.00 121.75 1rth n LEU 282 Ca 0.00 0.37 -0.23 0.00 -0.01 0.00 0.00 56.01 56.14 1rth n LEU 282 Cb 0.00 -0.36 -0.15 0.00 -0.11 0.00 0.00 43.42 42.80 1rth n LEU 282 CO 0.00 -0.38 -0.49 -0.07 -1.51 0.00 0.00 177.39 174.94 1rth h LEU 283 N 0.00 0.64 -6.46 2.23 -0.00 -1.91 -3.46 115.31 106.36 1rth h LEU 283 Ca 0.00 -0.93 -0.60 0.00 -0.00 0.00 0.00 57.88 56.35 1rth h LEU 283 Cb 0.34 -0.21 0.02 0.00 -0.00 0.00 0.00 40.66 40.81 1rth h LEU 283 CO 0.00 1.77 0.26 0.54 -0.00 0.00 0.00 178.44 181.01 1rth n ARG 284 N -3.64 0.00 -0.90 1.13 1.74 -0.75 -0.58 116.66 113.66 1rth n ARG 284 Ca -0.24 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.84 1rth n ARG 284 Cb 1.07 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 31.43 1rth n ARG 284 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rth n GLY 285 N 1.95 0.36 3.68 -0.13 0.00 -1.26 -4.97 105.19 104.83 1rth n GLY 285 Ca 0.18 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.70 1rth n GLY 285 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rth n THR 286 N -2.30 0.39 0.05 2.61 -2.24 0.26 -4.91 114.28 108.14 1rth n THR 286 Ca 0.00 -0.07 -0.04 0.00 -2.27 0.00 0.00 64.05 61.67 1rth n THR 286 Cb 0.14 -1.60 -0.09 0.00 -2.10 0.00 0.00 70.33 66.68 1rth n THR 286 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1rth h LYS 287 N 7.91 0.00 -4.18 -0.78 2.10 -1.93 -3.48 116.57 116.22 1rth h LYS 287 Ca -0.47 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.03 1rth h LYS 287 Cb 1.28 0.00 -0.14 0.00 -0.90 0.00 0.00 32.23 32.47 1rth h LYS 287 CO 0.93 0.65 -0.52 0.00 -2.00 0.00 0.00 179.45 178.50 1rth s ALA 288 N -2.78 0.45 -0.15 0.07 0.00 -1.26 -5.04 121.76 113.05 1rth s ALA 288 Ca -0.00 -1.18 0.19 0.00 0.00 0.00 0.00 51.96 50.96 1rth s ALA 288 Cb 0.09 0.76 0.31 0.00 0.00 0.00 0.00 23.12 24.28 1rth s ALA 288 CO 0.80 -0.53 1.56 1.25 0.00 0.00 0.00 175.76 178.85 1rth h LEU 289 N 2.79 0.00 -3.58 0.00 5.85 -1.98 -3.22 115.31 115.16 1rth h LEU 289 Ca -0.34 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.09 1rth h LEU 289 Cb 1.20 0.00 -0.18 0.00 0.37 0.00 0.00 40.66 42.06 1rth h LEU 289 CO 0.56 0.34 0.18 0.35 -0.34 0.00 0.00 178.44 179.53 1rth n THR 290 N -3.24 2.79 -3.36 1.05 -2.24 -1.26 -0.76 114.28 107.26 1rth n THR 290 Ca 0.02 -2.44 -0.38 0.00 -2.27 0.00 0.00 64.05 58.98 1rth n THR 290 Cb 0.63 -0.37 -0.06 0.00 -2.10 0.00 0.00 70.33 68.43 1rth n THR 290 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1rth s GLU 291 N -3.26 4.13 0.19 -0.78 -1.05 -1.22 -4.90 118.70 111.82 1rth s GLU 291 Ca 0.49 0.57 -0.26 0.00 -0.15 0.00 0.00 54.97 55.62 1rth s GLU 291 Cb 0.43 -3.27 -0.08 0.00 -0.44 0.00 0.00 34.13 30.77 1rth s GLU 291 CO 0.04 0.56 0.81 0.14 0.95 0.00 0.00 175.26 177.75 1rth s VAL 292 N -0.74 4.32 -0.00 1.83 -7.23 -1.26 -2.41 120.40 114.91 1rth s VAL 292 Ca 0.27 1.74 0.07 0.00 -1.81 0.00 0.00 61.98 62.25 1rth s VAL 292 Cb -0.18 -4.14 -0.03 0.00 0.56 0.00 0.00 36.38 32.60 1rth s VAL 292 CO 0.15 0.48 -0.22 -0.63 -0.31 0.00 0.00 175.10 174.57 1rth s ILE 293 N -1.21 2.41 -0.20 -0.62 1.09 0.29 -4.98 121.20 117.98 1rth s ILE 293 Ca 0.38 -1.10 -0.28 0.00 -1.10 0.00 0.00 60.65 58.55 1rth s ILE 293 Cb -0.23 -1.91 -0.00 0.00 -1.06 0.00 0.00 42.46 39.26 1rth s ILE 293 CO 0.27 0.50 0.96 -2.16 -0.10 0.00 0.00 174.94 174.41 1rth s PRO 294 N -0.91 4.28 -0.52 2.79 0.04 -1.26 -4.27 135.00 135.16 1rth s PRO 294 Ca 0.11 1.24 -0.27 0.00 0.04 0.00 0.00 61.00 62.12 1rth s PRO 294 Cb -0.10 -3.61 -0.02 0.00 0.04 0.00 0.00 34.50 30.81 1rth s PRO 294 CO 0.01 -0.51 1.81 -1.17 0.04 0.00 0.00 177.00 177.19 1rth s LEU 295 N 2.76 3.37 0.49 -3.56 0.20 -1.26 -4.96 118.68 115.72 1rth s LEU 295 Ca 0.42 0.64 -0.22 0.00 0.69 0.00 0.00 54.13 55.66 1rth s LEU 295 Cb -0.16 -2.87 -0.08 0.00 -0.43 0.00 0.00 46.19 42.65 1rth s LEU 295 CO 0.09 -2.13 1.05 1.07 -0.29 0.00 0.00 176.35 176.14 1rth n THR 296 N 7.26 2.96 0.30 3.68 5.66 -1.26 -4.69 114.28 128.19 1rth n THR 296 Ca 0.21 -0.50 0.19 0.00 -3.05 0.00 0.00 64.05 60.89 1rth n THR 296 Cb 0.50 -1.25 0.93 0.00 -1.55 0.00 0.00 70.33 68.97 1rth n THR 296 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 1rth h GLU 297 N 1.24 0.00 -0.06 1.09 4.11 -1.99 0.61 114.58 119.58 1rth h GLU 297 Ca -0.47 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 58.85 1rth h GLU 297 Cb 1.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 1rth h GLU 297 CO 0.55 0.00 -0.46 0.93 0.07 0.00 0.00 179.01 180.10 1rth h GLU 298 N 0.00 0.14 0.00 1.06 3.07 -1.99 -2.08 114.58 114.78 1rth h GLU 298 Ca 0.00 -0.07 -0.15 0.00 -0.50 0.00 0.00 59.36 58.64 1rth h GLU 298 Cb 0.14 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.03 1rth h GLU 298 CO 0.00 0.58 -0.71 0.00 -1.40 0.00 0.00 179.01 177.48 1rth h ALA 299 N 1.41 0.73 -0.10 3.43 0.00 -0.11 -2.74 119.26 121.88 1rth h ALA 299 Ca 0.01 -0.64 -0.07 0.00 0.00 0.00 0.00 54.91 54.21 1rth h ALA 299 Cb 0.87 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1rth h ALA 299 CO 0.07 0.89 -0.20 0.93 0.00 0.00 0.00 179.25 180.94 1rth h GLU 300 N 0.00 0.30 0.00 0.00 4.39 -1.16 -0.07 114.58 118.04 1rth h GLU 300 Ca -0.01 -0.20 -0.03 0.00 0.34 0.00 0.00 59.36 59.47 1rth h GLU 300 Cb 1.33 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 30.01 1rth h GLU 300 CO 0.09 0.79 -0.15 -0.07 -1.16 0.00 0.00 179.01 178.51 1rth h LEU 301 N -0.15 0.00 0.00 1.33 -0.00 -1.43 -0.08 115.31 114.97 1rth h LEU 301 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.88 57.75 1rth h LEU 301 Cb 0.78 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.42 1rth h LEU 301 CO 0.04 0.15 -0.82 -0.08 -0.00 0.00 0.00 178.44 177.74 1rth h GLU 302 N 0.00 0.00 -0.99 1.13 4.81 -1.49 -2.89 114.58 115.15 1rth h GLU 302 Ca -0.00 0.00 0.25 0.00 -0.13 0.00 0.00 59.36 59.48 1rth h GLU 302 Cb 0.32 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.63 1rth h GLU 302 CO 0.02 0.81 0.66 1.25 -0.73 0.00 0.00 179.01 181.01 1rth h LEU 303 N -1.00 0.36 0.62 1.64 6.46 -0.91 -2.48 115.31 119.99 1rth h LEU 303 Ca -0.21 0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 57.58 1rth h LEU 303 Cb 1.06 -0.01 0.01 0.00 -0.73 0.00 0.00 40.66 40.98 1rth h LEU 303 CO -0.13 0.10 -0.30 0.00 -0.62 0.00 0.00 178.44 177.50 1rth h ALA 304 N 1.59 -0.97 0.00 1.25 0.00 -1.11 -3.10 119.26 116.92 1rth h ALA 304 Ca 0.53 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1rth h ALA 304 Cb 1.46 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.58 1rth h ALA 304 CO -0.20 -0.91 0.25 -1.91 0.00 0.00 0.00 179.25 176.48 1rth n GLU 305 N -4.79 0.07 -0.05 0.00 2.13 -0.97 -0.59 120.64 116.45 1rth n GLU 305 Ca -0.10 0.51 -0.08 0.00 0.66 0.00 0.00 57.16 58.15 1rth n GLU 305 Cb 0.33 -1.99 -0.14 0.00 0.27 0.00 0.00 31.44 29.91 1rth n GLU 305 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1rth n ASN 306 N -1.89 0.52 0.20 4.31 3.02 -1.01 -3.29 115.26 117.12 1rth n ASN 306 Ca -0.01 0.25 0.04 0.00 -0.03 0.00 0.00 54.58 54.83 1rth n ASN 306 Cb 0.27 0.41 0.43 0.00 -0.61 0.00 0.00 39.78 40.27 1rth n ASN 306 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1rth h ARG 307 N 0.00 0.00 -0.17 3.52 3.08 -0.78 -2.12 114.38 117.91 1rth h ARG 307 Ca -0.37 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.54 1rth h ARG 307 Cb 2.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.10 1rth h ARG 307 CO 0.06 0.30 -0.43 0.93 -1.07 0.00 0.00 179.97 179.76 1rth h GLU 308 N 0.00 0.59 0.18 0.04 4.39 -1.66 -2.93 114.58 115.19 1rth h GLU 308 Ca -0.00 -0.41 -0.01 0.00 0.34 0.00 0.00 59.36 59.28 1rth h GLU 308 Cb 0.55 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1rth h GLU 308 CO 0.04 1.03 -0.09 0.82 -1.16 0.00 0.00 179.01 179.65 1rth h ILE 309 N 0.25 0.86 0.00 3.13 1.08 -1.51 -2.40 117.51 118.92 1rth h ILE 309 Ca -0.01 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.30 1rth h ILE 309 Cb 1.04 0.96 0.00 0.00 -3.07 0.00 0.00 36.82 35.75 1rth h ILE 309 CO 0.09 0.04 0.00 0.18 -0.69 0.00 0.00 178.15 177.77 1rth n LEU 310 N -5.16 0.32 -0.03 1.44 4.77 -0.81 -2.96 117.00 114.57 1rth n LEU 310 Ca -0.09 -0.16 -0.03 0.00 -0.03 0.00 0.00 56.01 55.70 1rth n LEU 310 Cb 0.15 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.07 1rth n LEU 310 CO 0.34 0.08 -0.19 1.17 -1.33 0.00 0.00 177.39 177.46 1rth n LYS 311 N -0.05 0.20 -1.49 3.23 3.00 -0.90 -4.82 118.16 117.32 1rth n LYS 311 Ca 0.00 0.27 -0.45 0.00 -0.00 0.00 0.00 58.31 58.13 1rth n LYS 311 Cb 0.08 -1.05 -0.07 0.00 0.00 0.00 0.00 35.03 33.99 1rth n LYS 311 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1rth n GLU 312 N -3.26 0.95 -1.24 1.64 2.13 -1.15 -4.90 120.64 114.81 1rth n GLU 312 Ca -0.04 0.18 -0.30 0.00 0.66 0.00 0.00 57.16 57.66 1rth n GLU 312 Cb 0.15 -2.63 0.13 0.00 0.27 0.00 0.00 31.44 29.36 1rth n GLU 312 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1rth s PRO 313 N 7.25 1.30 -0.05 5.31 0.04 -1.26 -5.03 135.00 142.56 1rth s PRO 313 Ca 1.10 0.79 0.04 0.00 0.04 0.00 0.00 61.00 62.97 1rth s PRO 313 Cb -0.70 -1.82 -0.00 0.00 0.04 0.00 0.00 34.50 32.02 1rth s PRO 313 CO 0.42 -2.20 -0.17 0.08 0.04 0.00 0.00 177.00 175.17 1rth s VAL 314 N -2.96 1.42 -0.04 -0.36 1.01 -1.26 -5.07 120.40 113.14 1rth s VAL 314 Ca 0.63 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.96 1rth s VAL 314 Cb -0.18 -1.23 -0.00 0.00 0.00 0.00 0.00 36.38 34.97 1rth s VAL 314 CO 0.57 0.41 -0.17 -1.38 0.00 0.00 0.00 175.10 174.53 1rth s HIS 315 N 0.13 1.65 0.16 5.22 -3.43 -1.26 -0.96 115.29 116.80 1rth s HIS 315 Ca -0.06 -0.45 0.01 0.00 -0.80 0.00 0.00 55.06 53.76 1rth s HIS 315 Cb -0.12 -1.11 0.01 0.00 -1.43 0.00 0.00 32.58 29.93 1rth s HIS 315 CO 0.03 -0.14 0.07 0.41 -2.00 0.00 0.00 174.74 173.11 1rth n GLY 316 N 3.07 3.39 3.29 -1.38 0.00 -0.61 -4.86 105.19 108.08 1rth n GLY 316 Ca -0.18 -2.23 -0.19 0.00 0.00 0.00 0.00 46.02 43.43 1rth n GLY 316 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rth s VAL 317 N -1.12 1.52 0.74 1.61 0.11 -1.17 -3.15 120.40 118.93 1rth s VAL 317 Ca 0.05 -1.90 -0.05 0.00 -2.93 0.00 0.00 61.98 57.15 1rth s VAL 317 Cb -0.00 -1.74 0.11 0.00 -1.53 0.00 0.00 36.38 33.21 1rth s VAL 317 CO 0.03 -0.46 1.03 -0.31 -3.33 0.00 0.00 175.10 172.07 1rth s TYR 318 N -2.39 2.22 0.17 1.54 2.02 -1.26 -4.58 117.35 115.07 1rth s TYR 318 Ca 0.14 0.12 -0.28 0.00 -0.37 0.00 0.00 57.07 56.68 1rth s TYR 318 Cb -0.04 -3.24 -0.08 0.00 -0.40 0.00 0.00 41.96 38.20 1rth s TYR 318 CO 0.04 -1.67 0.89 -0.47 -1.57 0.00 0.00 175.55 172.77 1rth s TYR 319 N -3.27 3.90 -0.27 2.71 5.04 0.10 -4.88 117.35 120.69 1rth s TYR 319 Ca 0.64 1.78 0.01 0.00 -2.44 0.00 0.00 57.07 57.07 1rth s TYR 319 Cb -0.08 -2.94 0.05 0.00 0.35 0.00 0.00 41.96 39.35 1rth s TYR 319 CO 0.45 0.39 -0.08 0.34 -1.34 0.00 0.00 175.55 175.31 1rth s ASP 320 N -0.77 4.50 0.31 4.32 -1.08 -1.26 -4.39 116.67 118.30 1rth s ASP 320 Ca 0.41 -1.29 0.22 0.00 -0.52 0.00 0.00 52.55 51.37 1rth s ASP 320 Cb -0.24 -1.60 1.15 0.00 -1.46 0.00 0.00 42.92 40.77 1rth s ASP 320 CO 0.29 -0.20 1.68 -2.65 0.52 0.00 0.00 175.17 174.82 1rth n PRO 321 N 4.51 0.15 -0.06 4.34 -0.02 -1.26 -1.30 135.00 141.37 1rth n PRO 321 Ca -0.14 0.60 0.12 0.00 -2.02 0.00 0.00 63.50 62.05 1rth n PRO 321 Cb 0.43 -1.95 0.42 0.00 -0.02 0.00 0.00 33.50 32.38 1rth n PRO 321 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1rth n SER 322 N -2.27 1.64 -4.50 2.55 3.41 -1.26 -4.89 113.62 108.31 1rth n SER 322 Ca -0.01 -1.65 -0.26 0.00 -0.26 0.00 0.00 58.87 56.70 1rth n SER 322 Cb 0.07 -0.07 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1rth n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1rth s LYS 323 N -1.85 1.79 0.51 4.33 1.02 -0.42 -5.14 119.74 119.99 1rth s LYS 323 Ca 0.34 -1.48 -0.19 0.00 0.02 0.00 0.00 55.97 54.66 1rth s LYS 323 Cb 0.19 -1.96 -0.07 0.00 -0.52 0.00 0.00 37.83 35.47 1rth s LYS 323 CO 0.29 0.39 1.05 0.16 -0.92 0.00 0.00 175.35 176.32 1rth s ASP 324 N -2.96 6.18 -0.18 2.83 1.47 -1.26 -4.94 116.67 117.81 1rth s ASP 324 Ca 0.25 1.92 -0.06 0.00 1.18 0.00 0.00 52.55 55.83 1rth s ASP 324 Cb -0.08 -2.56 -0.04 0.00 -0.34 0.00 0.00 42.92 39.91 1rth s ASP 324 CO 0.13 -0.90 0.04 -0.76 0.68 0.00 0.00 175.17 174.36 1rth s LEU 325 N -3.73 3.68 -0.13 2.11 1.43 -1.26 -4.49 118.68 116.28 1rth s LEU 325 Ca 0.67 0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.82 1rth s LEU 325 Cb -0.17 -1.92 -0.00 0.00 0.03 0.00 0.00 46.19 44.13 1rth s LEU 325 CO 0.24 0.17 -0.20 -0.63 0.23 0.00 0.00 176.35 176.17 1rth s ILE 326 N 0.37 2.37 -0.17 -0.59 -1.09 -0.31 -0.89 121.20 120.89 1rth s ILE 326 Ca 0.01 -0.89 0.01 0.00 -2.23 0.00 0.00 60.65 57.55 1rth s ILE 326 Cb -0.13 -1.96 0.01 0.00 -1.58 0.00 0.00 42.46 38.80 1rth s ILE 326 CO 0.01 0.54 -0.18 0.00 -1.23 0.00 0.00 174.94 174.08 1rth s ALA 327 N 0.57 2.40 -0.08 9.38 0.00 0.07 -0.75 121.76 133.36 1rth s ALA 327 Ca -0.11 -1.13 0.03 0.00 0.00 0.00 0.00 51.96 50.75 1rth s ALA 327 Cb -0.16 -1.20 -0.02 0.00 0.00 0.00 0.00 23.12 21.74 1rth s ALA 327 CO 0.04 -0.19 -0.18 -2.00 0.00 0.00 0.00 175.76 173.43 1rth s GLU 328 N 1.05 2.80 0.06 0.00 2.12 -0.32 -1.31 118.70 123.10 1rth s GLU 328 Ca -0.01 -0.77 0.09 0.00 0.36 0.00 0.00 54.97 54.64 1rth s GLU 328 Cb -0.14 -2.38 -0.03 0.00 0.26 0.00 0.00 34.13 31.84 1rth s GLU 328 CO -0.05 0.41 -0.24 0.42 -0.54 0.00 0.00 175.26 175.25 1rth s ILE 329 N -0.19 1.96 0.01 -3.70 1.01 -1.14 -1.84 121.20 117.31 1rth s ILE 329 Ca -0.01 -1.38 0.03 0.00 0.00 0.00 0.00 60.65 59.29 1rth s ILE 329 Cb -0.13 -1.70 -0.01 0.00 0.01 0.00 0.00 42.46 40.63 1rth s ILE 329 CO 0.03 0.25 -0.08 -1.10 0.00 0.00 0.00 174.94 174.04 1rth s GLN 330 N -1.36 0.63 -0.39 2.79 1.11 0.17 -4.28 119.66 118.32 1rth s GLN 330 Ca 0.10 -0.41 -0.20 0.00 0.01 0.00 0.00 55.36 54.86 1rth s GLN 330 Cb -0.10 -0.58 0.01 0.00 -1.01 0.00 0.00 33.01 31.34 1rth s GLN 330 CO 0.03 0.15 0.63 0.21 0.01 0.00 0.00 175.29 176.32 1rth s LYS 331 N -0.53 3.53 0.21 2.91 2.20 -1.26 0.60 119.74 127.40 1rth s LYS 331 Ca 0.01 -0.11 0.12 0.00 -0.36 0.00 0.00 55.97 55.62 1rth s LYS 331 Cb -0.05 -3.86 -0.05 0.00 -1.51 0.00 0.00 37.83 32.36 1rth s LYS 331 CO 0.00 -0.83 1.37 1.96 -0.36 0.00 0.00 175.35 177.49 1rth h GLN 332 N 8.62 0.00 0.00 4.03 1.08 -0.35 -3.45 115.11 125.04 1rth h GLN 332 Ca -0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.94 1rth h GLN 332 Cb 1.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 1rth h GLN 332 CO 0.85 0.72 0.00 0.41 -0.95 0.00 0.00 178.83 179.86 1rth n GLY 333 N 1.27 1.82 3.64 3.46 0.00 -1.19 -4.99 105.19 109.20 1rth n GLY 333 Ca 0.01 -0.81 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 1rth n GLY 333 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1rth s GLN 334 N -0.45 3.96 -0.52 1.61 0.74 -1.26 -2.54 119.66 121.19 1rth s GLN 334 Ca 0.00 1.62 0.00 0.00 0.05 0.00 0.00 55.36 57.03 1rth s GLN 334 Cb 0.00 -3.94 0.00 0.00 1.10 0.00 0.00 33.01 30.17 1rth s GLN 334 CO 0.00 -1.07 0.00 0.41 -0.55 0.00 0.00 175.29 174.08 1rth n GLY 335 N 4.29 0.61 2.87 2.59 0.00 -1.26 -4.83 105.19 109.46 1rth n GLY 335 Ca 0.17 -0.78 -0.25 0.00 0.00 0.00 0.00 46.02 45.15 1rth n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rth s GLN 336 N -2.96 1.22 0.08 1.61 -0.21 -1.05 0.12 119.66 118.47 1rth s GLN 336 Ca 0.00 -0.14 0.06 0.00 0.02 0.00 0.00 55.36 55.30 1rth s GLN 336 Cb 0.00 -1.35 -0.03 0.00 1.00 0.00 0.00 33.01 32.63 1rth s GLN 336 CO 0.00 -0.25 -0.16 -1.58 -2.12 0.00 0.00 175.29 171.18 1rth s TRP 337 N 1.68 1.39 0.10 0.91 0.52 -0.79 0.44 118.94 123.19 1rth s TRP 337 Ca 0.03 -0.46 0.05 0.00 0.02 0.00 0.00 56.10 55.75 1rth s TRP 337 Cb -0.13 -0.77 -0.03 0.00 -1.15 0.00 0.00 33.47 31.39 1rth s TRP 337 CO -0.06 0.11 -0.13 0.95 0.02 0.00 0.00 176.95 177.83 1rth s THR 338 N -1.31 1.17 0.08 2.01 -4.23 0.20 -1.46 115.64 112.10 1rth s THR 338 Ca 0.01 -1.56 -0.13 0.00 -1.18 0.00 0.00 61.69 58.84 1rth s THR 338 Cb -0.10 -1.33 0.02 0.00 1.34 0.00 0.00 72.50 72.43 1rth s THR 338 CO 0.03 -0.38 0.30 -0.72 -0.54 0.00 0.00 174.62 173.31 1rth s TYR 339 N -1.90 -0.06 -0.11 3.99 1.13 -0.69 0.43 117.35 120.14 1rth s TYR 339 Ca 0.04 -0.21 -0.05 0.00 -1.41 0.00 0.00 57.07 55.44 1rth s TYR 339 Cb -0.06 0.09 0.05 0.00 -1.10 0.00 0.00 41.96 40.94 1rth s TYR 339 CO 0.02 -0.57 0.26 1.14 -2.51 0.00 0.00 175.55 173.90 1rth s GLN 340 N -3.25 0.21 -0.19 -3.49 0.00 -0.76 -1.86 119.66 110.31 1rth s GLN 340 Ca -0.00 0.59 -0.08 0.00 -0.00 0.00 0.00 55.36 55.87 1rth s GLN 340 Cb 0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 33.01 32.88 1rth s GLN 340 CO -0.08 -0.19 0.09 0.42 0.00 0.00 0.00 175.29 175.53 1rth s ILE 341 N 1.49 4.98 0.14 3.63 1.01 0.16 -1.17 121.20 131.43 1rth s ILE 341 Ca -0.07 0.04 -0.10 0.00 0.00 0.00 0.00 60.65 60.51 1rth s ILE 341 Cb -0.11 -3.26 0.00 0.00 0.01 0.00 0.00 42.46 39.10 1rth s ILE 341 CO -0.09 0.44 0.29 -0.72 0.00 0.00 0.00 174.94 174.86 1rth s TYR 342 N 0.46 0.21 -0.17 3.97 -0.85 0.07 -1.30 117.35 119.74 1rth s TYR 342 Ca 0.05 -0.59 -0.01 0.00 -0.52 0.00 0.00 57.07 56.00 1rth s TYR 342 Cb -0.12 0.02 -0.10 0.00 0.38 0.00 0.00 41.96 42.14 1rth s TYR 342 CO 0.00 -0.68 -0.16 1.04 -1.52 0.00 0.00 175.55 174.23 1rth n GLN 343 N -0.18 0.40 -4.05 -3.49 6.02 -1.26 -1.16 117.38 113.66 1rth n GLN 343 Ca -0.11 0.11 -0.34 0.00 -0.01 0.00 0.00 57.00 56.65 1rth n GLN 343 Cb 0.63 -1.29 -0.15 0.00 1.02 0.00 0.00 30.24 30.45 1rth n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1rth s GLU 344 N -2.33 2.99 0.14 -1.09 2.02 -1.26 -4.82 118.70 114.36 1rth s GLU 344 Ca -0.22 -0.84 -0.26 0.00 0.02 0.00 0.00 54.97 53.66 1rth s GLU 344 Cb 0.06 -2.73 -0.15 0.00 0.10 0.00 0.00 34.13 31.41 1rth s GLU 344 CO 0.36 -0.26 0.53 -0.35 0.02 0.00 0.00 175.26 175.57 1rth n PRO 345 N 4.65 0.00 -0.75 0.39 -0.04 -1.26 -0.36 135.00 137.63 1rth n PRO 345 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 1rth n PRO 345 Cb 0.49 -0.93 0.00 0.00 -0.04 0.00 0.00 33.50 33.02 1rth n PRO 345 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1rth n PHE 346 N 0.24 0.00 -3.65 0.54 3.01 -1.26 -4.86 117.46 111.47 1rth n PHE 346 Ca 0.16 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.26 1rth n PHE 346 Cb 0.19 -1.09 -0.07 0.00 -0.01 0.00 0.00 39.48 38.49 1rth n PHE 346 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1rth s LYS 347 N -0.84 3.19 0.13 -1.08 -0.14 0.51 -5.07 119.74 116.44 1rth s LYS 347 Ca 0.00 -3.21 -0.30 0.00 -1.36 0.00 0.00 55.97 51.10 1rth s LYS 347 Cb 0.00 -3.92 -0.06 0.00 -1.68 0.00 0.00 37.83 32.17 1rth s LYS 347 CO 0.00 -1.26 1.02 -0.80 -0.76 0.00 0.00 175.35 173.55 1rth s ASN 348 N -0.10 7.41 -0.16 2.83 0.01 -1.26 -4.02 114.94 119.64 1rth s ASN 348 Ca 0.26 1.89 -0.23 0.00 -0.71 0.00 0.00 52.86 54.07 1rth s ASN 348 Cb -0.08 -2.59 -0.23 0.00 0.41 0.00 0.00 41.25 38.75 1rth s ASN 348 CO -0.12 -0.14 0.49 -0.07 -1.51 0.00 0.00 177.10 175.75 1rth h LEU 349 N 5.53 0.08 -7.43 0.60 3.38 -1.44 -3.10 115.31 112.93 1rth h LEU 349 Ca -0.43 -0.75 -0.10 0.00 0.09 0.00 0.00 57.88 56.69 1rth h LEU 349 Cb 1.21 -0.03 -0.19 0.00 0.09 0.00 0.00 40.66 41.75 1rth h LEU 349 CO 0.73 1.34 -0.18 -0.75 0.09 0.00 0.00 178.44 179.66 1rth s LYS 350 N -2.33 0.78 0.07 1.13 2.20 -0.77 -4.61 119.74 116.21 1rth s LYS 350 Ca -0.23 -0.20 -0.03 0.00 -0.36 0.00 0.00 55.97 55.14 1rth s LYS 350 Cb 0.02 0.35 -0.03 0.00 -1.51 0.00 0.00 37.83 36.66 1rth s LYS 350 CO 0.66 -0.23 0.04 0.95 -0.36 0.00 0.00 175.35 176.41 1rth s THR 351 N -1.66 0.18 0.11 3.43 -4.23 -1.26 0.37 115.64 112.57 1rth s THR 351 Ca -0.11 -1.67 -0.25 0.00 -1.18 0.00 0.00 61.69 58.49 1rth s THR 351 Cb -0.03 -1.57 0.09 0.00 1.34 0.00 0.00 72.50 72.33 1rth s THR 351 CO 0.03 -0.82 1.13 -0.83 -0.54 0.00 0.00 174.62 173.59 1rth s GLY 352 N -2.93 -0.02 0.09 3.99 0.00 -0.78 -4.50 107.32 103.17 1rth s GLY 352 Ca 0.09 -0.11 -0.13 0.00 0.00 0.00 0.00 44.72 44.58 1rth s GLY 352 CO -0.08 3.06 0.30 -1.59 0.00 0.00 0.00 173.10 174.79 1rth s LYS 353 N -2.21 0.91 -0.04 2.90 -2.85 -1.26 -1.70 119.74 115.49 1rth s LYS 353 Ca 0.23 -0.74 0.01 0.00 -1.00 0.00 0.00 55.97 54.47 1rth s LYS 353 Cb -0.01 0.39 0.02 0.00 -2.06 0.00 0.00 37.83 36.17 1rth s LYS 353 CO 0.03 -0.32 -0.03 0.71 0.10 0.00 0.00 175.35 175.84 1rth s TYR 354 N -3.45 0.60 -0.19 1.78 2.02 -0.54 -4.97 117.35 112.60 1rth s TYR 354 Ca 0.01 -0.13 -0.06 0.00 -0.37 0.00 0.00 57.07 56.52 1rth s TYR 354 Cb 0.02 -0.57 -0.03 0.00 -0.40 0.00 0.00 41.96 40.98 1rth s TYR 354 CO -0.09 -0.16 0.02 0.00 -1.57 0.00 0.00 175.55 173.75 1rth s ALA 355 N 0.92 3.17 -0.42 3.71 0.00 -1.26 -1.89 121.76 125.99 1rth s ALA 355 Ca -0.11 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 50.97 1rth s ALA 355 Cb -0.14 -1.81 0.11 0.00 0.00 0.00 0.00 23.12 21.28 1rth s ALA 355 CO -0.00 0.01 0.18 1.03 0.00 0.00 0.00 175.76 176.99 1rth s ARG 356 N 0.70 1.89 -0.60 0.00 0.52 0.12 -5.01 118.95 116.57 1rth s ARG 356 Ca 0.01 -1.98 -0.28 0.00 -0.52 0.00 0.00 55.73 52.96 1rth s ARG 356 Cb -0.14 -3.46 -0.11 0.00 0.52 0.00 0.00 34.95 31.76 1rth s ARG 356 CO 0.02 -1.04 2.47 -0.12 0.02 0.00 0.00 175.30 176.65 1rth n MET 357 N 4.25 0.82 0.00 3.54 0.00 -1.26 -4.72 117.12 119.74 1rth n MET 357 Ca 0.01 0.02 0.00 0.00 -0.00 0.00 0.00 57.70 57.74 1rth n MET 357 Cb 0.40 -2.93 0.00 0.00 0.00 0.00 0.00 33.22 30.70 1rth n MET 357 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 1rth n ARG 358 N 8.84 0.00 0.00 2.12 1.85 -1.26 -4.82 116.66 123.39 1rth n ARG 358 Ca 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.29 1rth n ARG 358 Cb 0.40 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.81 1rth n ARG 358 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rth n GLY 359 N -0.75 -0.89 0.00 2.89 0.00 -1.26 -4.30 105.19 100.87 1rth n GLY 359 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1rth n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rth n ALA 360 N 0.08 0.00 -3.65 4.61 0.00 -1.26 -2.35 120.51 117.93 1rth n ALA 360 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1rth n ALA 360 Cb 0.00 0.29 -0.07 0.00 0.00 0.00 0.00 19.45 19.67 1rth n ALA 360 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1rth s HIS 361 N -1.59 -1.08 0.05 0.00 -3.43 -1.26 -2.87 115.29 105.10 1rth s HIS 361 Ca 0.00 2.02 0.01 0.00 -0.80 0.00 0.00 55.06 56.29 1rth s HIS 361 Cb 0.00 0.61 -0.00 0.00 -1.43 0.00 0.00 32.58 31.76 1rth s HIS 361 CO 0.00 -0.56 0.05 2.41 -2.00 0.00 0.00 174.74 174.64 1rth n THR 362 N 4.94 0.00 -3.82 -5.38 -1.04 -1.08 -4.97 114.28 102.94 1rth n THR 362 Ca -0.15 -0.29 -0.10 0.00 -2.04 0.00 0.00 64.05 61.47 1rth n THR 362 Cb 0.53 0.16 -0.08 0.00 -1.82 0.00 0.00 70.33 69.12 1rth n THR 362 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1rth s ASN 363 N -1.30 0.01 0.27 8.00 2.20 -1.26 -0.47 114.94 122.38 1rth s ASN 363 Ca 0.05 -0.41 0.00 0.00 -0.94 0.00 0.00 52.86 51.56 1rth s ASN 363 Cb 0.00 0.33 0.54 0.00 -2.00 0.00 0.00 41.25 40.12 1rth s ASN 363 CO 0.03 -0.64 1.80 0.44 -2.94 0.00 0.00 177.10 175.80 1rth h ASP 364 N 3.13 0.75 -0.03 3.54 3.32 -1.93 -0.85 116.42 124.35 1rth h ASP 364 Ca -0.33 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1rth h ASP 364 Cb 1.20 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.67 1rth h ASP 364 CO 0.50 0.37 -0.01 0.58 -1.72 0.00 0.00 179.24 178.96 1rth h VAL 365 N 0.82 1.29 -0.69 -1.35 2.07 -1.97 0.45 116.25 116.88 1rth h VAL 365 Ca 0.48 -0.88 0.12 0.00 0.82 0.00 0.00 66.70 67.23 1rth h VAL 365 Cb 0.56 1.84 -0.08 0.00 -1.52 0.00 0.00 31.29 32.08 1rth h VAL 365 CO -0.30 0.24 0.26 0.50 0.02 0.00 0.00 177.57 178.28 1rth h LYS 366 N -0.30 0.41 -0.84 1.57 1.63 -1.92 0.24 116.57 117.35 1rth h LYS 366 Ca 0.01 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1rth h LYS 366 Cb 0.38 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 1rth h LYS 366 CO 0.00 0.27 0.39 1.96 -3.45 0.00 0.00 179.45 178.63 1rth h GLN 367 N 0.43 1.22 0.32 1.90 4.20 -0.72 -1.80 115.11 120.66 1rth h GLN 367 Ca 0.36 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 1rth h GLN 367 Cb 0.50 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1rth h GLN 367 CO -0.36 0.95 -0.33 1.25 -0.67 0.00 0.00 178.83 179.66 1rth h LEU 368 N 1.21 -0.91 -1.17 1.46 6.46 0.30 -2.16 115.31 120.49 1rth h LEU 368 Ca 0.29 0.08 0.41 0.00 -0.12 0.00 0.00 57.88 58.54 1rth h LEU 368 Cb 0.13 0.31 -0.15 0.00 -0.73 0.00 0.00 40.66 40.22 1rth h LEU 368 CO -0.03 -0.47 0.68 0.74 -0.62 0.00 0.00 178.44 178.74 1rth h THR 369 N -0.69 0.10 0.00 1.05 2.02 -0.14 0.57 112.91 115.82 1rth h THR 369 Ca -0.02 -0.03 -0.10 0.00 0.77 0.00 0.00 66.41 67.03 1rth h THR 369 Cb 0.63 -0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 1rth h THR 369 CO -0.07 0.02 -0.47 -0.33 0.37 0.00 0.00 175.52 175.04 1rth h GLU 370 N 0.10 0.00 0.56 6.66 5.08 -0.72 -2.23 114.58 124.03 1rth h GLU 370 Ca 0.82 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 59.15 1rth h GLU 370 Cb 2.29 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.55 1rth h GLU 370 CO -0.59 0.47 -0.27 0.00 -1.00 0.00 0.00 179.01 177.62 1rth h ALA 371 N 1.53 -0.89 -0.80 3.43 0.00 0.45 -0.89 119.26 122.09 1rth h ALA 371 Ca -0.00 -0.16 0.17 0.00 0.00 0.00 0.00 54.91 54.91 1rth h ALA 371 Cb 1.23 0.29 -0.15 0.00 0.00 0.00 0.00 17.79 19.16 1rth h ALA 371 CO 0.06 -0.84 -0.16 0.28 0.00 0.00 0.00 179.25 178.60 1rth h VAL 372 N -1.00 0.22 -0.39 0.00 2.07 -1.41 0.34 116.25 116.07 1rth h VAL 372 Ca -0.08 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1rth h VAL 372 Cb 0.58 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1rth h VAL 372 CO 0.13 0.00 0.15 -0.61 0.02 0.00 0.00 177.57 177.26 1rth h GLN 373 N 0.02 0.58 -0.80 1.57 5.75 -1.41 0.53 115.11 121.35 1rth h GLN 373 Ca 0.40 -0.11 -0.03 0.00 -0.15 0.00 0.00 58.65 58.76 1rth h GLN 373 Cb 0.63 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.05 1rth h GLN 373 CO -0.80 0.56 0.38 0.87 -2.65 0.00 0.00 178.83 177.19 1rth h LYS 374 N 0.48 1.14 -0.12 1.69 1.57 0.97 -1.93 116.57 120.37 1rth h LYS 374 Ca 0.13 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1rth h LYS 374 Cb 0.20 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 1rth h LYS 374 CO -0.01 0.88 0.02 0.82 -0.57 0.00 0.00 179.45 180.59 1rth h ILE 375 N 1.13 1.21 -0.92 1.86 2.04 0.01 -2.60 117.51 120.25 1rth h ILE 375 Ca 0.28 -0.65 0.14 0.00 1.00 0.00 0.00 64.86 65.62 1rth h ILE 375 Cb 0.11 1.42 -0.09 0.00 -0.74 0.00 0.00 36.82 37.52 1rth h ILE 375 CO -0.04 0.19 0.53 0.74 0.00 0.00 0.00 178.15 179.57 1rth h THR 376 N -0.02 0.80 -0.29 -0.27 2.02 0.46 0.65 112.91 116.26 1rth h THR 376 Ca 0.04 -0.27 -0.12 0.00 0.77 0.00 0.00 66.41 66.83 1rth h THR 376 Cb 0.28 -0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1rth h THR 376 CO 0.00 0.14 -0.30 0.74 0.37 0.00 0.00 175.52 176.47 1rth h THR 377 N 0.78 1.30 0.00 3.16 2.02 -1.26 -2.24 112.91 116.67 1rth h THR 377 Ca 0.49 -1.47 -0.13 0.00 0.77 0.00 0.00 66.41 66.07 1rth h THR 377 Cb 0.61 1.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.59 1rth h THR 377 CO -0.32 0.47 -0.60 1.05 0.37 0.00 0.00 175.52 176.49 1rth h GLU 378 N 0.46 0.00 -0.37 6.66 4.11 -0.93 -2.13 114.58 122.38 1rth h GLU 378 Ca 0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.45 1rth h GLU 378 Cb 0.88 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1rth h GLU 378 CO 0.07 0.60 0.14 0.77 0.07 0.00 0.00 179.01 180.66 1rth h SER 379 N 0.00 0.52 0.04 3.06 0.02 -0.80 -0.87 113.55 115.53 1rth h SER 379 Ca -0.01 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 60.74 1rth h SER 379 Cb 1.06 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 1rth h SER 379 CO 0.08 0.56 -0.08 0.40 -1.14 0.00 0.00 176.83 176.64 1rth h ILE 380 N 0.46 1.11 0.00 3.27 2.04 -1.27 0.20 117.51 123.32 1rth h ILE 380 Ca 0.12 -0.47 -0.15 0.00 1.00 0.00 0.00 64.86 65.37 1rth h ILE 380 Cb 0.20 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1rth h ILE 380 CO -0.01 0.14 -0.71 0.58 0.00 0.00 0.00 178.15 178.15 1rth h VAL 381 N 0.10 1.38 0.05 1.67 2.07 -0.96 -2.41 116.25 118.16 1rth h VAL 381 Ca 0.02 -2.55 -0.32 0.00 0.82 0.00 0.00 66.70 64.67 1rth h VAL 381 Cb 0.22 2.43 -0.03 0.00 -1.52 0.00 0.00 31.29 32.38 1rth h VAL 381 CO 0.01 0.70 -1.77 -0.38 0.02 0.00 0.00 177.57 176.15 1rth n ILE 382 N -3.50 1.63 -1.02 4.57 5.41 -0.14 -4.55 119.36 121.76 1rth n ILE 382 Ca -0.00 -0.36 0.07 0.00 1.00 0.00 0.00 62.75 63.46 1rth n ILE 382 Cb 0.74 -1.86 0.10 0.00 -0.71 0.00 0.00 39.64 37.92 1rth n ILE 382 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1rth n TRP 383 N -3.94 0.00 -1.09 1.39 8.01 0.54 -4.70 117.44 117.64 1rth n TRP 383 Ca -0.35 -0.80 -0.06 0.00 -1.31 0.00 0.00 57.50 54.98 1rth n TRP 383 Cb 0.87 -0.12 -0.03 0.00 -2.01 0.00 0.00 31.31 30.03 1rth n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1rth n GLY 384 N -1.11 0.61 3.31 6.99 0.00 -0.91 -4.85 105.19 109.23 1rth n GLY 384 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 1rth n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rth s LYS 385 N -2.34 1.07 -0.10 1.61 -2.85 -1.25 -4.91 119.74 110.97 1rth s LYS 385 Ca 0.00 -1.04 -0.01 0.00 -1.00 0.00 0.00 55.97 53.92 1rth s LYS 385 Cb 0.00 0.39 -0.03 0.00 -2.06 0.00 0.00 37.83 36.13 1rth s LYS 385 CO 0.00 -0.39 -0.04 0.95 0.10 0.00 0.00 175.35 175.98 1rth s THR 386 N -3.91 3.97 0.70 3.79 -4.23 -1.26 -3.00 115.64 111.69 1rth s THR 386 Ca 0.11 -0.36 -0.16 0.00 -1.18 0.00 0.00 61.69 60.10 1rth s THR 386 Cb 0.03 -2.67 0.02 0.00 1.34 0.00 0.00 72.50 71.22 1rth s THR 386 CO -0.05 0.57 1.23 -2.84 -0.54 0.00 0.00 174.62 172.99 1rth s PRO 387 N -0.48 2.31 0.20 3.99 0.02 -1.26 -4.93 135.00 134.85 1rth s PRO 387 Ca 0.08 1.83 -0.27 0.00 0.02 0.00 0.00 61.00 62.66 1rth s PRO 387 Cb -0.12 -1.85 -0.08 0.00 0.02 0.00 0.00 34.50 32.47 1rth s PRO 387 CO 0.02 -1.72 0.84 0.15 -0.33 0.00 0.00 177.00 175.96 1rth s LYS 388 N -3.73 4.67 -0.11 5.54 1.02 -0.07 -4.80 119.74 122.26 1rth s LYS 388 Ca 0.76 1.28 -0.03 0.00 0.02 0.00 0.00 55.97 58.00 1rth s LYS 388 Cb -0.31 -3.25 -0.03 0.00 -0.52 0.00 0.00 37.83 33.72 1rth s LYS 388 CO 0.43 0.54 0.01 -0.06 -0.92 0.00 0.00 175.35 175.35 1rth s PHE 389 N -1.18 3.16 -0.29 3.18 0.08 -0.99 -0.75 117.98 121.20 1rth s PHE 389 Ca 0.38 0.11 -0.06 0.00 0.12 0.00 0.00 56.93 57.47 1rth s PHE 389 Cb -0.24 -1.86 0.01 0.00 -0.57 0.00 0.00 43.02 40.36 1rth s PHE 389 CO 0.28 0.35 0.07 0.15 -0.10 0.00 0.00 175.22 175.97 1rth s LYS 390 N -0.50 3.03 -0.00 0.44 -0.14 -0.43 0.77 119.74 122.91 1rth s LYS 390 Ca 0.09 -0.89 0.07 0.00 -1.36 0.00 0.00 55.97 53.88 1rth s LYS 390 Cb -0.12 -3.33 -0.02 0.00 -1.68 0.00 0.00 37.83 32.68 1rth s LYS 390 CO 0.02 -0.45 -0.22 -0.51 -0.76 0.00 0.00 175.35 173.43 1rth s LEU 391 N 1.47 2.07 -1.38 3.17 1.43 0.13 -2.90 118.68 122.68 1rth s LEU 391 Ca 0.02 -0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 52.61 1rth s LEU 391 Cb -0.17 -1.09 -0.10 0.00 0.03 0.00 0.00 46.19 44.86 1rth s LEU 391 CO 0.02 0.25 2.90 -0.81 0.23 0.00 0.00 176.35 178.93 1rth n PRO 392 N 2.39 3.32 -3.63 1.29 -0.04 -1.26 -0.95 135.00 136.12 1rth n PRO 392 Ca -0.16 -1.98 -0.11 0.00 -0.04 0.00 0.00 63.50 61.21 1rth n PRO 392 Cb 0.53 -2.68 -0.07 0.00 -0.04 0.00 0.00 33.50 31.24 1rth n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rth s ILE 393 N 2.24 0.00 0.50 0.52 2.07 -1.26 -0.83 121.20 124.45 1rth s ILE 393 Ca 0.65 0.00 -0.21 0.00 -1.41 0.00 0.00 60.65 59.68 1rth s ILE 393 Cb 0.18 -1.00 -0.06 0.00 0.13 0.00 0.00 42.46 41.71 1rth s ILE 393 CO -0.05 0.00 1.16 -1.10 -1.91 0.00 0.00 174.94 173.04 1rth s GLN 394 N 0.54 3.53 0.41 3.50 -0.21 -1.26 -4.58 119.66 121.59 1rth s GLN 394 Ca -0.01 1.74 0.12 0.00 0.02 0.00 0.00 55.36 57.23 1rth s GLN 394 Cb -0.05 -2.22 0.87 0.00 1.00 0.00 0.00 33.01 32.61 1rth s GLN 394 CO -0.05 -0.73 1.94 0.87 -2.12 0.00 0.00 175.29 175.21 1rth h LYS 395 N 1.64 0.13 0.27 2.91 1.79 -1.99 -2.20 116.57 119.11 1rth h LYS 395 Ca -0.50 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 57.93 1rth h LYS 395 Cb 1.26 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1rth h LYS 395 CO 0.59 0.29 -0.13 0.93 -1.08 0.00 0.00 179.45 180.05 1rth h GLU 396 N 0.12 -0.35 -0.20 3.15 3.07 -1.99 -1.45 114.58 116.92 1rth h GLU 396 Ca 0.02 0.02 0.05 0.00 -0.50 0.00 0.00 59.36 58.95 1rth h GLU 396 Cb 0.37 0.08 -0.05 0.00 -0.84 0.00 0.00 28.75 28.31 1rth h GLU 396 CO 0.02 -0.09 -0.09 1.15 -1.40 0.00 0.00 179.01 178.60 1rth h THR 397 N -0.59 0.70 0.01 1.13 2.02 -1.86 -1.57 112.91 112.75 1rth h THR 397 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1rth h THR 397 Cb 0.43 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1rth h THR 397 CO 0.06 0.00 -0.03 -0.25 0.37 0.00 0.00 175.52 175.67 1rth h TRP 398 N -0.07 -0.07 -0.77 3.16 2.91 -1.38 -1.10 115.95 118.63 1rth h TRP 398 Ca 0.11 0.00 0.12 0.00 1.13 0.00 0.00 58.89 60.25 1rth h TRP 398 Cb 0.23 0.03 -0.08 0.00 -0.51 0.00 0.00 29.16 28.83 1rth h TRP 398 CO -0.25 -0.04 0.38 0.93 -1.03 0.00 0.00 178.44 178.42 1rth h GLU 399 N -0.05 0.58 0.34 2.65 4.39 -1.11 -0.60 114.58 120.78 1rth h GLU 399 Ca 0.01 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 1rth h GLU 399 Cb 0.06 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1rth h GLU 399 CO -0.02 0.38 -0.16 1.15 -1.16 0.00 0.00 179.01 179.20 1rth h THR 400 N 0.60 0.67 0.17 1.13 2.02 -0.91 -2.83 112.91 113.77 1rth h THR 400 Ca 0.40 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1rth h THR 400 Cb 0.51 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1rth h THR 400 CO -0.32 0.08 -0.15 -0.25 0.37 0.00 0.00 175.52 175.24 1rth h TRP 401 N -0.67 -0.41 -0.79 3.16 7.01 -0.77 -3.29 115.95 120.18 1rth h TRP 401 Ca -0.05 0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.04 1rth h TRP 401 Cb 0.47 0.16 -0.07 0.00 -2.10 0.00 0.00 29.16 27.62 1rth h TRP 401 CO -0.00 -0.21 0.44 0.11 -2.79 0.00 0.00 178.44 176.00 1rth h TRP 402 N -0.32 0.81 -0.31 2.65 5.08 -1.23 -0.39 115.95 122.23 1rth h TRP 402 Ca -0.02 0.03 0.09 0.00 1.08 0.00 0.00 58.89 60.07 1rth h TRP 402 Cb 0.27 -0.25 -0.01 0.00 -3.00 0.00 0.00 29.16 26.17 1rth h TRP 402 CO -0.08 0.34 0.24 1.79 -1.28 0.00 0.00 178.44 179.45 1rth h THR 403 N 0.76 0.72 0.00 0.12 1.35 -1.58 -2.78 112.91 111.50 1rth h THR 403 Ca 0.37 0.00 -0.23 0.00 -0.55 0.00 0.00 66.41 66.01 1rth h THR 403 Cb 0.32 0.82 -0.04 0.00 -1.73 0.00 0.00 68.15 67.52 1rth h THR 403 CO -0.23 0.00 -2.15 -0.62 -0.25 0.00 0.00 175.52 172.27 1rth n GLU 404 N -4.25 0.86 -1.22 4.72 1.02 -0.98 -5.02 120.64 115.78 1rth n GLU 404 Ca 0.04 -0.07 -0.36 0.00 -0.02 0.00 0.00 57.16 56.76 1rth n GLU 404 Cb 0.41 -1.47 0.07 0.00 -0.02 0.00 0.00 31.44 30.43 1rth n GLU 404 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1rth n TYR 405 N -2.52 -0.84 0.22 -0.32 9.36 -0.19 -4.90 117.16 117.96 1rth n TYR 405 Ca -0.21 0.34 0.12 0.00 3.32 0.00 0.00 57.90 61.46 1rth n TYR 405 Cb 0.91 -1.91 0.17 0.00 -0.63 0.00 0.00 39.34 37.88 1rth n TYR 405 CO 0.00 0.00 0.00 0.11 0.22 0.00 0.00 176.86 177.19 1rth h TRP 406 N -0.49 0.00 -2.92 2.98 5.08 -1.90 -3.46 115.95 115.26 1rth h TRP 406 Ca -0.45 0.00 -0.61 0.00 1.08 0.00 0.00 58.89 58.91 1rth h TRP 406 Cb 1.34 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 27.45 1rth h TRP 406 CO 0.35 0.01 -0.53 -1.14 -1.28 0.00 0.00 178.44 175.85 1rth s GLN 407 N -3.20 3.22 0.17 0.12 0.74 -1.26 -5.08 119.66 114.36 1rth s GLN 407 Ca 0.07 -0.58 -0.30 0.00 0.05 0.00 0.00 55.36 54.60 1rth s GLN 407 Cb 0.05 -2.90 -0.08 0.00 1.10 0.00 0.00 33.01 31.19 1rth s GLN 407 CO 0.67 0.57 1.18 0.00 -0.55 0.00 0.00 175.29 177.16 1rth s ALA 408 N -1.53 3.42 0.08 1.58 0.00 -1.26 -5.00 121.76 119.04 1rth s ALA 408 Ca 0.33 0.91 -0.15 0.00 0.00 0.00 0.00 51.96 53.05 1rth s ALA 408 Cb -0.12 -3.41 0.03 0.00 0.00 0.00 0.00 23.12 19.62 1rth s ALA 408 CO 0.26 -0.35 0.35 -0.08 0.00 0.00 0.00 175.76 175.95 1rth s THR 409 N 0.04 0.08 0.10 0.00 -1.32 -1.26 -5.18 115.64 108.11 1rth s THR 409 Ca 0.53 -0.64 -0.24 0.00 -1.21 0.00 0.00 61.69 60.12 1rth s THR 409 Cb -0.32 -1.07 0.07 0.00 -1.51 0.00 0.00 72.50 69.67 1rth s THR 409 CO 0.35 -0.35 0.60 0.86 -2.21 0.00 0.00 174.62 173.87 1rth s TRP 410 N -3.13 -0.55 -0.06 9.09 -0.00 -1.26 -5.07 118.94 117.96 1rth s TRP 410 Ca -0.01 0.50 -0.01 0.00 -0.00 0.00 0.00 56.10 56.58 1rth s TRP 410 Cb 0.01 0.50 0.03 0.00 -0.00 0.00 0.00 33.47 34.01 1rth s TRP 410 CO -0.07 -0.78 0.01 0.42 -0.00 0.00 0.00 176.95 176.54 1rth s ILE 411 N -3.09 0.27 0.98 5.86 1.01 -1.26 -4.94 121.20 120.02 1rth s ILE 411 Ca -0.02 0.19 -0.13 0.00 0.00 0.00 0.00 60.65 60.69 1rth s ILE 411 Cb -0.01 -0.44 0.10 0.00 0.01 0.00 0.00 42.46 42.12 1rth s ILE 411 CO -0.07 0.24 0.62 -2.65 0.00 0.00 0.00 174.94 173.08 1rth n PRO 412 N 5.14 -0.66 -1.22 2.79 -0.02 -1.26 -4.74 135.00 135.03 1rth n PRO 412 Ca -0.07 -0.15 -0.48 0.00 -2.02 0.00 0.00 63.50 60.79 1rth n PRO 412 Cb 0.50 -2.01 -0.07 0.00 -0.02 0.00 0.00 33.50 31.90 1rth n PRO 412 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1rth n GLU 413 N -2.72 0.00 -4.08 -0.52 2.13 -1.26 -4.80 120.64 109.38 1rth n GLU 413 Ca 0.07 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.76 1rth n GLU 413 Cb 0.54 -1.13 -0.05 0.00 0.27 0.00 0.00 31.44 31.07 1rth n GLU 413 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 1rth s TRP 414 N 1.08 0.91 -0.14 4.31 1.48 -1.26 -2.34 118.94 122.99 1rth s TRP 414 Ca 0.74 -1.17 -0.12 0.00 -1.06 0.00 0.00 56.10 54.48 1rth s TRP 414 Cb -1.04 -0.09 0.04 0.00 -1.16 0.00 0.00 33.47 31.22 1rth s TRP 414 CO 0.52 -1.03 0.37 -2.00 -4.06 0.00 0.00 176.95 170.75 1rth s GLU 415 N -3.44 0.42 0.16 3.25 2.12 0.23 -4.90 118.70 116.54 1rth s GLU 415 Ca 0.30 0.53 -0.31 0.00 0.36 0.00 0.00 54.97 55.84 1rth s GLU 415 Cb 0.01 0.19 -0.09 0.00 0.26 0.00 0.00 34.13 34.49 1rth s GLU 415 CO 0.17 -0.06 1.51 0.12 -0.54 0.00 0.00 175.26 176.46 1rth s PHE 416 N 0.28 3.11 -0.20 5.30 5.36 -1.26 0.22 117.98 130.78 1rth s PHE 416 Ca -0.01 0.74 0.01 0.00 -0.96 0.00 0.00 56.93 56.71 1rth s PHE 416 Cb -0.03 -3.86 0.04 0.00 -0.34 0.00 0.00 43.02 38.83 1rth s PHE 416 CO -0.00 -3.10 -0.13 0.54 -1.46 0.00 0.00 175.22 171.07 1rth s VAL 417 N 1.06 1.81 -0.57 3.12 0.11 -0.12 -4.77 120.40 121.05 1rth s VAL 417 Ca 0.68 -1.05 -0.05 0.00 -2.93 0.00 0.00 61.98 58.63 1rth s VAL 417 Cb -0.42 -1.81 -0.10 0.00 -1.53 0.00 0.00 36.38 32.52 1rth s VAL 417 CO 0.32 0.26 2.24 -3.20 -3.33 0.00 0.00 175.10 171.38 1rth n ASN 418 N 4.64 4.33 -4.52 3.54 5.15 -1.26 -4.17 115.26 122.96 1rth n ASN 418 Ca -0.16 -2.23 -0.41 0.00 -0.60 0.00 0.00 54.58 51.18 1rth n ASN 418 Cb 0.47 -1.01 -0.10 0.00 -0.53 0.00 0.00 39.78 38.61 1rth n ASN 418 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1rth s THR 419 N 2.71 5.24 0.68 -0.44 -1.32 -1.26 -5.06 115.64 116.19 1rth s THR 419 Ca 0.41 -0.24 -0.15 0.00 -1.21 0.00 0.00 61.69 60.50 1rth s THR 419 Cb 0.14 -3.80 0.01 0.00 -1.51 0.00 0.00 72.50 67.34 1rth s THR 419 CO -0.02 -0.11 1.12 -2.84 -2.21 0.00 0.00 174.62 170.56 1rth s PRO 420 N 1.82 2.66 -0.06 7.08 0.02 -1.26 -4.12 135.00 141.14 1rth s PRO 420 Ca 0.08 1.42 -0.17 0.00 0.02 0.00 0.00 61.00 62.35 1rth s PRO 420 Cb -0.17 -1.93 -0.05 0.00 0.02 0.00 0.00 34.50 32.37 1rth s PRO 420 CO 0.11 -1.36 0.46 -1.25 -0.33 0.00 0.00 177.00 174.63 1rth s PRO 421 N -4.12 4.19 0.52 5.54 0.04 -1.26 -5.02 135.00 134.88 1rth s PRO 421 Ca 0.67 0.47 -0.19 0.00 0.04 0.00 0.00 61.00 61.99 1rth s PRO 421 Cb -0.21 -3.34 -0.07 0.00 0.04 0.00 0.00 34.50 30.92 1rth s PRO 421 CO 0.43 0.39 1.07 -0.51 0.04 0.00 0.00 177.00 178.42 1rth s LEU 422 N -0.13 3.75 -0.03 -3.56 1.43 -1.26 -4.74 118.68 114.15 1rth s LEU 422 Ca 0.25 1.99 -0.21 0.00 -1.03 0.00 0.00 54.13 55.13 1rth s LEU 422 Cb -0.16 -4.56 -0.05 0.00 0.03 0.00 0.00 46.19 41.45 1rth s LEU 422 CO 0.12 -0.99 0.62 0.68 0.23 0.00 0.00 176.35 177.01 1rth s VAL 423 N -2.00 4.96 0.22 -1.59 -7.23 -0.01 -5.02 120.40 109.74 1rth s VAL 423 Ca 0.68 1.28 0.00 0.00 -1.81 0.00 0.00 61.98 62.14 1rth s VAL 423 Cb -0.19 -3.95 -0.05 0.00 0.56 0.00 0.00 36.38 32.75 1rth s VAL 423 CO 0.25 0.37 0.10 -1.59 -0.31 0.00 0.00 175.10 173.91 1rth s LYS 424 N 0.12 1.27 -0.49 4.82 0.00 -1.26 -4.62 119.74 119.58 1rth s LYS 424 Ca 0.32 -1.67 -0.29 0.00 0.00 0.00 0.00 55.97 54.33 1rth s LYS 424 Cb -0.18 -0.04 0.03 0.00 0.00 0.00 0.00 37.83 37.64 1rth s LYS 424 CO 0.17 -0.31 1.17 -0.51 0.00 0.00 0.00 175.35 175.87 1rth s LEU 425 N -3.23 3.59 0.32 2.77 1.43 -1.26 -4.88 118.68 117.42 1rth s LEU 425 Ca 0.36 0.42 0.01 0.00 -1.03 0.00 0.00 54.13 53.90 1rth s LEU 425 Cb 0.07 -3.48 0.57 0.00 0.03 0.00 0.00 46.19 43.38 1rth s LEU 425 CO 0.11 -1.32 1.93 -0.50 0.23 0.00 0.00 176.35 176.81 1rth h TRP 426 N 9.42 0.98 -2.90 0.29 -0.00 -1.99 -3.45 115.95 118.30 1rth h TRP 426 Ca -0.24 0.02 0.06 0.00 -0.00 0.00 0.00 58.89 58.74 1rth h TRP 426 Cb 1.06 -0.32 -0.07 0.00 -0.00 0.00 0.00 29.16 29.83 1rth h TRP 426 CO 0.99 0.53 0.26 1.52 -0.00 0.00 0.00 178.44 181.74 1rth s TYR 427 N -5.85 -0.26 -0.13 0.49 -0.85 -1.26 -4.79 117.35 104.69 1rth s TYR 427 Ca -0.11 -0.12 -0.05 0.00 -0.52 0.00 0.00 57.07 56.27 1rth s TYR 427 Cb 0.19 0.67 0.07 0.00 0.38 0.00 0.00 41.96 43.26 1rth s TYR 427 CO 0.79 -1.09 0.26 -0.65 -1.52 0.00 0.00 175.55 173.34 1rth s GLN 428 N -3.79 0.15 0.38 -3.49 -0.21 -1.26 -5.10 119.66 106.34 1rth s GLN 428 Ca 0.09 0.74 -0.27 0.00 0.02 0.00 0.00 55.36 55.94 1rth s GLN 428 Cb -0.04 -0.05 -0.10 0.00 1.00 0.00 0.00 33.01 33.82 1rth s GLN 428 CO 0.02 -0.29 1.37 -0.51 -2.12 0.00 0.00 175.29 173.75 1rth s LEU 429 N 2.42 4.31 0.67 2.90 1.43 -1.26 -4.73 118.68 124.42 1rth s LEU 429 Ca 0.01 2.81 -0.15 0.00 -1.03 0.00 0.00 54.13 55.77 1rth s LEU 429 Cb -0.12 -3.75 0.01 0.00 0.03 0.00 0.00 46.19 42.36 1rth s LEU 429 CO -0.09 -0.78 1.14 -1.61 0.23 0.00 0.00 176.35 175.25 1rth s GLU 430 N -2.06 2.66 0.19 1.70 0.41 -0.09 -4.96 118.70 116.54 1rth s GLU 430 Ca 0.53 1.51 0.18 0.00 -0.41 0.00 0.00 54.97 56.79 1rth s GLU 430 Cb -0.42 -1.92 -0.01 0.00 -1.78 0.00 0.00 34.13 30.00 1rth s GLU 430 CO 0.55 -1.38 1.11 0.87 -0.49 0.00 0.00 175.26 175.92 1rth h LYS 431 N 0.04 0.00 -4.72 1.61 1.57 -1.93 -3.44 116.57 109.71 1rth h LYS 431 Ca -0.47 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.04 1rth h LYS 431 Cb 1.26 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.42 1rth h LYS 431 CO 0.53 0.26 -0.66 -1.83 -0.57 0.00 0.00 179.45 177.18 1rth s GLU 432 N -3.05 1.08 0.53 3.15 -1.05 -1.26 -5.11 118.70 112.98 1rth s GLU 432 Ca 0.00 -1.52 -0.22 0.00 -0.15 0.00 0.00 54.97 53.09 1rth s GLU 432 Cb 0.08 -0.15 -0.06 0.00 -0.44 0.00 0.00 34.13 33.56 1rth s GLU 432 CO 0.78 -0.16 1.23 -0.35 0.95 0.00 0.00 175.26 177.70 1rth n PRO 433 N -0.21 1.50 -2.93 -4.83 -0.04 -1.26 -4.89 135.00 122.33 1rth n PRO 433 Ca -0.06 0.55 -0.41 0.00 -0.04 0.00 0.00 63.50 63.55 1rth n PRO 433 Cb 0.63 -2.41 -0.04 0.00 -0.04 0.00 0.00 33.50 31.64 1rth n PRO 433 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1rth s ILE 434 N -1.33 4.98 0.11 0.52 1.01 -1.26 -5.06 121.20 120.17 1rth s ILE 434 Ca 0.71 1.64 -0.26 0.00 0.00 0.00 0.00 60.65 62.74 1rth s ILE 434 Cb -0.44 -4.13 -0.07 0.00 0.01 0.00 0.00 42.46 37.83 1rth s ILE 434 CO 0.50 0.20 0.80 -0.69 0.00 0.00 0.00 174.94 175.75 1rth s VAL 435 N 1.00 4.53 -0.37 2.92 1.01 -1.26 -3.81 120.40 124.42 1rth s VAL 435 Ca 0.42 1.73 -0.02 0.00 0.00 0.00 0.00 61.98 64.10 1rth s VAL 435 Cb -0.19 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.04 1rth s VAL 435 CO 0.20 0.43 0.32 0.61 0.00 0.00 0.00 175.10 176.67 1rth n GLY 436 N 2.01 0.48 2.96 4.51 0.00 -1.26 -5.05 105.19 108.85 1rth n GLY 436 Ca -0.03 -0.40 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 1rth n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rth s ALA 437 N -3.09 -0.10 0.62 4.61 0.00 -1.25 -5.03 121.76 117.52 1rth s ALA 437 Ca 0.13 -0.06 -0.17 0.00 0.00 0.00 0.00 51.96 51.86 1rth s ALA 437 Cb -0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 1rth s ALA 437 CO 0.20 -0.08 1.17 -2.00 0.00 0.00 0.00 175.76 175.05 1rth s GLU 438 N -0.49 2.88 -0.22 0.00 2.12 -1.26 -4.78 118.70 116.95 1rth s GLU 438 Ca -0.06 1.68 0.02 0.00 0.36 0.00 0.00 54.97 56.97 1rth s GLU 438 Cb -0.04 -1.93 0.04 0.00 0.26 0.00 0.00 34.13 32.46 1rth s GLU 438 CO -0.00 -1.24 -0.13 0.99 -0.54 0.00 0.00 175.26 174.34 1rth s THR 439 N -1.86 1.96 -0.18 -1.70 2.01 -1.26 -1.48 115.64 113.14 1rth s THR 439 Ca 0.74 -1.24 -0.11 0.00 0.31 0.00 0.00 61.69 61.39 1rth s THR 439 Cb -0.27 -1.97 -0.05 0.00 0.01 0.00 0.00 72.50 70.22 1rth s THR 439 CO 0.35 0.19 0.18 -0.36 -0.69 0.00 0.00 174.62 174.30 1rth s PHE 440 N 1.25 3.45 -0.38 4.92 0.40 -0.72 -2.07 117.98 124.83 1rth s PHE 440 Ca -0.03 0.43 -0.09 0.00 -0.60 0.00 0.00 56.93 56.65 1rth s PHE 440 Cb -0.17 -2.20 0.05 0.00 0.51 0.00 0.00 43.02 41.21 1rth s PHE 440 CO -0.08 0.32 0.19 0.71 0.70 0.00 0.00 175.22 177.06 1rth s TYR 441 N 0.25 3.27 0.12 0.36 1.51 -0.73 -0.70 117.35 121.44 1rth s TYR 441 Ca 0.11 -1.26 0.03 0.00 -1.01 0.00 0.00 57.07 54.94 1rth s TYR 441 Cb -0.12 -2.54 -0.04 0.00 -0.11 0.00 0.00 41.96 39.15 1rth s TYR 441 CO 0.00 -0.73 0.20 0.14 -1.11 0.00 0.00 175.55 174.06 1rth s VAL 442 N 1.47 5.03 -0.02 0.71 -7.23 0.05 -2.35 120.40 118.05 1rth s VAL 442 Ca 0.01 -0.72 -0.26 0.00 -1.81 0.00 0.00 61.98 59.20 1rth s VAL 442 Cb -0.20 -3.53 0.06 0.00 0.56 0.00 0.00 36.38 33.26 1rth s VAL 442 CO 0.04 -0.01 0.57 -0.62 -0.31 0.00 0.00 175.10 174.78 1rth s ASP 443 N -2.92 -0.52 -0.18 4.85 2.15 -0.68 -4.52 116.67 114.84 1rth s ASP 443 Ca 0.33 0.49 -0.18 0.00 0.43 0.00 0.00 52.55 53.62 1rth s ASP 443 Cb -0.11 0.48 0.05 0.00 -0.30 0.00 0.00 42.92 43.04 1rth s ASP 443 CO 0.26 -0.60 0.51 -0.83 -0.17 0.00 0.00 175.17 174.35 1rth s GLY 444 N -1.36 -0.38 0.01 2.66 0.00 -1.26 -2.24 107.32 104.75 1rth s GLY 444 Ca -0.11 1.40 -0.04 0.00 0.00 0.00 0.00 44.72 45.97 1rth s GLY 444 CO 0.07 1.19 0.07 0.00 0.00 0.00 0.00 173.10 174.43 1rth s ALA 445 N 0.15 -0.13 0.01 3.20 0.00 -0.95 -4.36 121.76 119.69 1rth s ALA 445 Ca -0.01 -0.36 -0.02 0.00 0.00 0.00 0.00 51.96 51.57 1rth s ALA 445 Cb -0.04 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.21 1rth s ALA 445 CO 0.01 -0.21 0.02 0.00 0.00 0.00 0.00 175.76 175.59 1rth s ALA 446 N -1.58 -0.03 -0.32 0.00 0.00 -1.26 -1.29 121.76 117.29 1rth s ALA 446 Ca -0.14 -0.44 -0.25 0.00 0.00 0.00 0.00 51.96 51.12 1rth s ALA 446 Cb -0.08 0.14 0.01 0.00 0.00 0.00 0.00 23.12 23.19 1rth s ALA 446 CO -0.00 -0.18 0.89 1.21 0.00 0.00 0.00 175.76 177.69 1rth s ASN 447 N -1.43 6.75 0.23 0.00 3.84 0.24 -4.76 114.94 119.81 1rth s ASN 447 Ca -0.16 0.77 -0.09 0.00 0.21 0.00 0.00 52.86 53.59 1rth s ASN 447 Cb -0.09 -2.46 0.35 0.00 -0.55 0.00 0.00 41.25 38.50 1rth s ASN 447 CO -0.00 -0.73 1.65 0.03 -2.79 0.00 0.00 177.10 175.26 1rth h ARG 448 N 8.15 0.11 -0.05 0.43 2.47 -1.94 0.10 114.38 123.65 1rth h ARG 448 Ca -0.23 -0.01 -0.10 0.00 -1.26 0.00 0.00 59.98 58.38 1rth h ARG 448 Cb 1.08 -0.02 0.01 0.00 -1.65 0.00 0.00 29.97 29.38 1rth h ARG 448 CO 0.94 0.07 -0.36 0.93 0.56 0.00 0.00 179.97 182.11 1rth h GLU 449 N 0.11 0.32 0.00 0.04 5.08 -1.97 -3.32 114.58 114.84 1rth h GLU 449 Ca 0.36 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1rth h GLU 449 Cb 0.60 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1rth h GLU 449 CO -0.59 0.95 -0.44 1.79 -1.00 0.00 0.00 179.01 179.73 1rth h THR 450 N -0.20 0.00 -5.49 1.13 1.35 -1.96 -3.48 112.91 104.26 1rth h THR 450 Ca -0.03 -0.72 -0.38 0.00 -0.55 0.00 0.00 66.41 64.73 1rth h THR 450 Cb 1.04 1.47 0.13 0.00 -1.73 0.00 0.00 68.15 69.06 1rth h THR 450 CO 0.07 0.00 -0.64 0.29 -0.25 0.00 0.00 175.52 175.00 1rth n LYS 451 N -2.50 -7.39 -4.21 4.72 5.02 0.35 -4.66 118.16 109.49 1rth n LYS 451 Ca 0.03 0.79 -0.34 0.00 -2.02 0.00 0.00 58.31 56.77 1rth n LYS 451 Cb 0.48 -5.69 -0.14 0.00 -0.02 0.00 0.00 35.03 29.67 1rth n LYS 451 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1rth s LEU 452 N -6.91 2.85 0.35 -0.35 1.98 -1.24 0.03 118.68 115.38 1rth s LEU 452 Ca 0.54 -0.36 0.04 0.00 -2.89 0.00 0.00 54.13 51.46 1rth s LEU 452 Cb -0.24 -1.70 -0.02 0.00 0.66 0.00 0.00 46.19 44.90 1rth s LEU 452 CO 0.67 0.05 0.37 -0.83 -1.89 0.00 0.00 176.35 174.72 1rth s GLY 453 N 1.03 2.07 0.04 7.98 0.00 0.39 -0.59 107.32 118.24 1rth s GLY 453 Ca 0.00 -1.89 0.01 0.00 0.00 0.00 0.00 44.72 42.84 1rth s GLY 453 CO -0.01 -1.29 -0.05 0.54 0.00 0.00 0.00 173.10 172.29 1rth s LYS 454 N -3.19 0.50 -0.03 2.90 1.02 -0.41 -0.11 119.74 120.42 1rth s LYS 454 Ca 0.37 -0.84 -0.08 0.00 0.02 0.00 0.00 55.97 55.44 1rth s LYS 454 Cb 0.01 -0.08 0.01 0.00 -0.52 0.00 0.00 37.83 37.25 1rth s LYS 454 CO 0.26 -0.01 0.19 0.00 -0.92 0.00 0.00 175.35 174.86 1rth s ALA 455 N -2.01 -0.46 0.00 5.17 0.00 -0.54 -2.23 121.76 121.69 1rth s ALA 455 Ca -0.07 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.09 1rth s ALA 455 Cb -0.06 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.00 1rth s ALA 455 CO -0.02 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 175.98 1rth n GLY 456 N 2.01 -1.20 3.70 0.00 0.00 -0.95 -0.06 105.19 108.68 1rth n GLY 456 Ca -0.19 -0.88 -0.07 0.00 0.00 0.00 0.00 46.02 44.88 1rth n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1rth s TYR 457 N -3.00 -0.25 -0.00 1.61 -0.85 -1.13 -1.69 117.35 112.04 1rth s TYR 457 Ca 0.00 -0.07 -0.03 0.00 -0.52 0.00 0.00 57.07 56.46 1rth s TYR 457 Cb 0.00 0.63 -0.00 0.00 0.38 0.00 0.00 41.96 42.97 1rth s TYR 457 CO 0.00 -0.92 0.05 0.54 -1.52 0.00 0.00 175.55 173.70 1rth s VAL 458 N -3.54 0.06 0.36 -3.49 0.11 -0.99 -2.65 120.40 110.26 1rth s VAL 458 Ca 0.09 -0.47 0.09 0.00 -2.93 0.00 0.00 61.98 58.76 1rth s VAL 458 Cb -0.03 -0.23 -0.06 0.00 -1.53 0.00 0.00 36.38 34.53 1rth s VAL 458 CO -0.00 -0.26 0.03 0.42 -3.33 0.00 0.00 175.10 171.96 1rth s THR 459 N -0.80 2.51 -1.10 5.04 -4.23 -0.12 -1.78 115.64 115.16 1rth s THR 459 Ca -0.09 -1.94 0.12 0.00 -1.18 0.00 0.00 61.69 58.60 1rth s THR 459 Cb -0.05 -2.84 0.13 0.00 1.34 0.00 0.00 72.50 71.08 1rth s THR 459 CO 0.00 -0.15 1.38 -0.46 -0.54 0.00 0.00 174.62 174.84 1rth n ASN 460 N -0.99 0.00 -1.13 3.99 6.94 -0.88 -1.85 115.26 121.34 1rth n ASN 460 Ca -0.04 0.40 0.12 0.00 -0.02 0.00 0.00 54.58 55.04 1rth n ASN 460 Cb 0.63 -0.45 0.20 0.00 -2.36 0.00 0.00 39.78 37.81 1rth n ASN 460 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1rth n ARG 461 N -1.45 2.48 0.00 -3.83 1.74 -1.26 -4.99 116.66 109.36 1rth n ARG 461 Ca 0.04 -2.26 0.00 0.00 -0.77 0.00 0.00 57.85 54.86 1rth n ARG 461 Cb 0.13 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 1rth n ARG 461 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rth n GLY 462 N 1.47 2.79 3.76 -0.13 0.00 -0.77 -5.06 105.19 107.26 1rth n GLY 462 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1rth n GLY 462 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1rth s ARG 463 N -0.86 2.70 0.14 1.61 3.52 -1.26 -4.76 118.95 120.04 1rth s ARG 463 Ca 0.00 1.46 -0.24 0.00 -0.13 0.00 0.00 55.73 56.82 1rth s ARG 463 Cb 0.00 -1.93 0.07 0.00 -1.56 0.00 0.00 34.95 31.53 1rth s ARG 463 CO 0.00 -1.34 0.74 1.14 -0.81 0.00 0.00 175.30 175.03 1rth s GLN 464 N -4.03 1.23 -0.02 5.12 -2.07 -1.26 -0.94 119.66 117.69 1rth s GLN 464 Ca 0.68 -0.54 -0.30 0.00 -1.82 0.00 0.00 55.36 53.39 1rth s GLN 464 Cb -0.22 0.51 0.11 0.00 -1.09 0.00 0.00 33.01 32.32 1rth s GLN 464 CO 0.42 -0.55 1.03 0.21 -1.32 0.00 0.00 175.29 175.08 1rth s LYS 465 N -3.55 0.72 -0.12 9.60 2.20 -1.08 -5.00 119.74 122.50 1rth s LYS 465 Ca 0.05 -0.32 -0.30 0.00 -0.36 0.00 0.00 55.97 55.04 1rth s LYS 465 Cb -0.02 0.30 0.11 0.00 -1.51 0.00 0.00 37.83 36.70 1rth s LYS 465 CO -0.07 -0.32 0.89 0.54 -0.36 0.00 0.00 175.35 176.03 1rth s VAL 466 N -2.90 0.00 0.04 4.02 0.11 -1.26 -2.82 120.40 117.59 1rth s VAL 466 Ca 0.09 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.13 1rth s VAL 466 Cb -0.00 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 1rth s VAL 466 CO -0.05 0.00 -0.03 -0.69 -3.33 0.00 0.00 175.10 171.00 1rth s VAL 467 N -1.14 0.18 -0.11 2.04 1.01 0.91 -4.95 120.40 118.34 1rth s VAL 467 Ca -0.05 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 60.59 1rth s VAL 467 Cb -0.00 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 1rth s VAL 467 CO 0.04 -0.73 -0.12 -0.89 0.00 0.00 0.00 175.10 173.40 1rth s THR 468 N -2.61 3.17 -0.04 3.92 2.01 -1.26 -1.47 115.64 119.36 1rth s THR 468 Ca -0.05 -0.63 0.06 0.00 0.31 0.00 0.00 61.69 61.38 1rth s THR 468 Cb -0.02 -2.32 -0.01 0.00 0.01 0.00 0.00 72.50 70.16 1rth s THR 468 CO -0.05 0.54 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.43 1rth s LEU 469 N 0.09 2.03 -0.01 4.42 1.43 0.85 -4.98 118.68 122.51 1rth s LEU 469 Ca -0.05 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 52.62 1rth s LEU 469 Cb -0.15 -1.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.81 1rth s LEU 469 CO 0.04 0.25 -0.02 -0.89 0.23 0.00 0.00 176.35 175.96 1rth s THR 470 N -0.30 4.01 -1.46 5.49 2.01 -1.26 -0.46 115.64 123.67 1rth s THR 470 Ca 0.02 -0.62 -0.07 0.00 0.31 0.00 0.00 61.69 61.33 1rth s THR 470 Cb -0.11 -2.76 0.01 0.00 0.01 0.00 0.00 72.50 69.65 1rth s THR 470 CO 0.01 0.41 0.93 -0.67 -0.69 0.00 0.00 174.62 174.61 1rth n ASP 471 N 1.53 -6.23 -3.53 3.53 2.03 0.47 -4.97 116.55 109.38 1rth n ASP 471 Ca -0.15 -0.44 -0.14 0.00 0.52 0.00 0.00 54.79 54.58 1rth n ASP 471 Cb 0.53 -4.96 0.00 0.00 -0.72 0.00 0.00 41.12 35.97 1rth n ASP 471 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1rth n THR 472 N -4.79 0.00 -4.18 5.18 5.66 0.10 -5.02 114.28 111.24 1rth n THR 472 Ca -0.04 -1.17 -0.11 0.00 -3.05 0.00 0.00 64.05 59.67 1rth n THR 472 Cb 0.59 -0.26 -0.10 0.00 -1.55 0.00 0.00 70.33 69.01 1rth n THR 472 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1rth s THR 473 N -1.45 0.02 0.08 1.09 -4.23 -1.26 -4.47 115.64 105.41 1rth s THR 473 Ca 0.17 -1.96 -0.23 0.00 -1.18 0.00 0.00 61.69 58.49 1rth s THR 473 Cb -0.01 -2.38 -0.16 0.00 1.34 0.00 0.00 72.50 71.29 1rth s THR 473 CO 0.11 -0.11 1.68 -1.13 -0.54 0.00 0.00 174.62 174.63 1rth h ASN 474 N 2.67 0.00 -0.84 3.99 -1.24 -1.93 -0.67 115.58 117.57 1rth h ASN 474 Ca -0.36 -0.06 0.05 0.00 0.71 0.00 0.00 56.30 56.64 1rth h ASN 474 Cb 1.24 -0.00 -0.06 0.00 0.73 0.00 0.00 38.32 40.23 1rth h ASN 474 CO 0.54 0.06 0.53 0.06 -1.29 0.00 0.00 177.43 177.33 1rth h GLN 475 N -0.06 0.96 -0.06 6.67 -0.00 -1.98 -0.03 115.11 120.61 1rth h GLN 475 Ca 0.00 -0.06 0.01 0.00 -0.00 0.00 0.00 58.65 58.60 1rth h GLN 475 Cb 0.06 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.48 27.31 1rth h GLN 475 CO -0.00 0.64 0.01 0.87 -0.00 0.00 0.00 178.83 180.34 1rth h LYS 476 N 0.99 0.03 -0.22 0.06 1.57 -1.91 -0.12 116.57 116.97 1rth h LYS 476 Ca 0.35 -0.00 0.05 0.00 -1.87 0.00 0.00 60.65 59.18 1rth h LYS 476 Cb 0.10 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.35 1rth h LYS 476 CO -0.15 0.02 -0.09 1.15 -0.57 0.00 0.00 179.45 179.82 1rth h THR 477 N 0.03 0.70 -0.99 -0.16 2.02 -0.47 0.83 112.91 114.87 1rth h THR 477 Ca 0.03 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.21 1rth h THR 477 Cb 0.02 0.70 -0.05 0.00 -1.74 0.00 0.00 68.15 67.09 1rth h THR 477 CO -0.04 0.00 0.66 -0.33 0.37 0.00 0.00 175.52 176.18 1rth h GLU 478 N -0.05 1.31 -0.37 6.66 5.08 -0.58 -0.12 114.58 126.52 1rth h GLU 478 Ca 0.12 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.31 1rth h GLU 478 Cb 0.22 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1rth h GLU 478 CO -0.26 0.87 -0.08 -0.07 -1.00 0.00 0.00 179.01 178.48 1rth h LEU 479 N 1.35 0.71 -1.27 1.33 3.38 0.09 -2.54 115.31 118.38 1rth h LEU 479 Ca 0.36 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1rth h LEU 479 Cb -0.15 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.36 1rth h LEU 479 CO -0.08 0.90 0.51 -0.61 0.09 0.00 0.00 178.44 179.25 1rth h GLN 480 N 0.51 0.95 -0.80 1.13 -0.00 0.15 0.31 115.11 117.35 1rth h GLN 480 Ca 0.10 -0.06 0.04 0.00 -0.00 0.00 0.00 58.65 58.73 1rth h GLN 480 Cb 0.58 -0.21 -0.05 0.00 0.00 0.00 0.00 27.48 27.80 1rth h GLN 480 CO 0.03 0.63 0.51 0.00 0.00 0.00 0.00 178.83 180.00 1rth h ALA 481 N 1.54 1.07 -0.15 3.38 0.00 -0.69 0.88 119.26 125.29 1rth h ALA 481 Ca 0.30 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.00 1rth h ALA 481 Cb -0.00 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1rth h ALA 481 CO -0.08 0.31 -0.67 0.82 0.00 0.00 0.00 179.25 179.63 1rth h ILE 482 N 0.98 1.32 -0.10 0.00 2.04 -0.23 -3.02 117.51 118.51 1rth h ILE 482 Ca 0.33 -1.96 0.00 0.00 1.00 0.00 0.00 64.86 64.23 1rth h ILE 482 Cb 0.04 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 1rth h ILE 482 CO -0.12 0.61 0.06 0.22 0.00 0.00 0.00 178.15 178.91 1rth h TYR 483 N 0.43 0.11 -0.91 1.37 3.20 0.85 -2.32 116.97 119.70 1rth h TYR 483 Ca -0.02 0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.92 1rth h TYR 483 Cb 1.26 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 39.43 1rth h TYR 483 CO 0.06 0.07 0.57 -0.07 -1.64 0.00 0.00 178.16 177.15 1rth h LEU 484 N 0.12 0.90 -1.12 2.82 3.38 -0.87 0.18 115.31 120.72 1rth h LEU 484 Ca 0.04 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1rth h LEU 484 Cb -0.01 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1rth h LEU 484 CO -0.01 0.57 -0.08 0.00 0.09 0.00 0.00 178.44 179.00 1rth h ALA 485 N 1.43 1.27 -0.07 1.53 0.00 -1.39 0.19 119.26 122.22 1rth h ALA 485 Ca 0.40 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1rth h ALA 485 Cb 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1rth h ALA 485 CO -0.18 0.48 -0.17 -0.07 0.00 0.00 0.00 179.25 179.32 1rth h LEU 486 N 0.49 0.27 -0.31 0.00 3.38 -0.58 -2.02 115.31 116.54 1rth h LEU 486 Ca 0.09 -0.58 0.03 0.00 0.09 0.00 0.00 57.88 57.51 1rth h LEU 486 Cb 0.44 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1rth h LEU 486 CO 0.02 0.80 0.13 1.56 0.09 0.00 0.00 178.44 181.05 1rth h GLN 487 N -0.24 0.28 -0.26 1.13 4.20 -0.18 -2.98 115.11 117.06 1rth h GLN 487 Ca 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1rth h GLN 487 Cb 0.76 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.48 1rth h GLN 487 CO 0.04 0.18 0.00 -0.25 -0.67 0.00 0.00 178.83 178.13 1rth n ASP 488 N -4.99 1.90 0.02 1.46 8.00 0.01 -4.58 116.55 118.37 1rth n ASP 488 Ca -0.00 -1.83 -0.21 0.00 0.71 0.00 0.00 54.79 53.46 1rth n ASP 488 Cb 0.09 -0.17 -0.14 0.00 -0.02 0.00 0.00 41.12 40.88 1rth n ASP 488 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1rth h SER 489 N 2.33 0.40 -5.00 -2.24 4.64 -1.19 -3.50 113.55 108.98 1rth h SER 489 Ca 0.00 -0.89 0.00 0.00 -0.47 0.00 0.00 61.79 60.43 1rth h SER 489 Cb 0.52 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1rth h SER 489 CO 0.00 1.49 0.00 0.61 -0.87 0.00 0.00 176.83 178.06 1rth n GLY 490 N 1.69 1.79 0.26 -0.77 0.00 -1.26 -4.81 105.19 102.09 1rth n GLY 490 Ca -0.20 -2.05 0.05 0.00 0.00 0.00 0.00 46.02 43.82 1rth n GLY 490 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1rth h LEU 491 N 0.00 -0.02 -8.82 0.99 4.07 -1.95 -3.41 115.31 106.18 1rth h LEU 491 Ca 0.00 0.14 -0.68 0.00 0.08 0.00 0.00 57.88 57.43 1rth h LEU 491 Cb 0.00 0.20 -0.24 0.00 1.08 0.00 0.00 40.66 41.70 1rth h LEU 491 CO 0.00 -0.04 -0.76 -1.61 -1.08 0.00 0.00 178.44 174.95 1rth s GLU 492 N -6.06 2.88 -0.05 1.13 2.02 -1.26 -1.13 118.70 116.24 1rth s GLU 492 Ca -0.13 -0.67 -0.15 0.00 0.02 0.00 0.00 54.97 54.04 1rth s GLU 492 Cb 0.21 -2.51 0.03 0.00 0.10 0.00 0.00 34.13 31.96 1rth s GLU 492 CO 0.75 0.46 0.35 0.08 0.02 0.00 0.00 175.26 176.92 1rth s VAL 493 N -0.31 0.04 -0.06 2.63 1.01 -0.93 -4.35 120.40 118.44 1rth s VAL 493 Ca 0.03 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1rth s VAL 493 Cb -0.13 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 1rth s VAL 493 CO 0.03 -0.18 -0.12 0.20 0.00 0.00 0.00 175.10 175.03 1rth s ASN 494 N -0.91 4.22 -0.02 3.32 0.01 -0.55 -1.88 114.94 119.12 1rth s ASN 494 Ca -0.10 -0.15 -0.00 0.00 -0.71 0.00 0.00 52.86 51.90 1rth s ASN 494 Cb -0.04 -0.98 0.03 0.00 0.41 0.00 0.00 41.25 40.67 1rth s ASN 494 CO 0.04 0.34 0.04 -0.63 -1.51 0.00 0.00 177.10 175.38 1rth s ILE 495 N -0.71 -0.06 -0.06 0.60 1.01 -0.28 -1.76 121.20 119.94 1rth s ILE 495 Ca 0.11 0.23 0.04 0.00 0.00 0.00 0.00 60.65 61.03 1rth s ILE 495 Cb -0.11 -0.10 -0.02 0.00 0.01 0.00 0.00 42.46 42.24 1rth s ILE 495 CO 0.01 0.10 -0.17 0.68 0.00 0.00 0.00 174.94 175.55 1rth s VAL 496 N 1.17 2.77 0.08 2.92 -7.23 0.12 -0.51 120.40 119.73 1rth s VAL 496 Ca -0.08 -0.82 -0.10 0.00 -1.81 0.00 0.00 61.98 59.18 1rth s VAL 496 Cb -0.13 -2.07 0.00 0.00 0.56 0.00 0.00 36.38 34.74 1rth s VAL 496 CO -0.03 0.58 0.21 0.28 -0.31 0.00 0.00 175.10 175.83 1rth s THR 497 N -0.46 0.13 -0.29 5.32 -1.32 0.27 -0.77 115.64 118.51 1rth s THR 497 Ca 0.06 -1.06 0.14 0.00 -1.21 0.00 0.00 61.69 59.62 1rth s THR 497 Cb -0.12 -1.23 0.37 0.00 -1.51 0.00 0.00 72.50 70.01 1rth s THR 497 CO 0.02 -0.58 1.28 -0.90 -2.21 0.00 0.00 174.62 172.22 1rth n ASP 498 N 0.10 3.11 -4.75 8.08 5.75 -1.26 -2.12 116.55 125.46 1rth n ASP 498 Ca -0.16 -2.73 -0.41 0.00 -0.01 0.00 0.00 54.79 51.49 1rth n ASP 498 Cb 0.62 -0.40 -0.04 0.00 -1.03 0.00 0.00 41.12 40.27 1rth n ASP 498 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1rth s SER 499 N -1.88 7.25 0.09 -1.12 0.15 -1.26 -4.55 113.70 112.38 1rth s SER 499 Ca 0.31 2.20 -0.19 0.00 0.70 0.00 0.00 55.95 58.97 1rth s SER 499 Cb 0.25 -2.62 -0.08 0.00 -1.71 0.00 0.00 66.02 61.86 1rth s SER 499 CO 0.08 -0.19 1.57 1.56 1.20 0.00 0.00 173.24 177.46 1rth h GLN 500 N 4.43 0.40 -0.18 5.44 1.08 -1.97 -2.79 115.11 121.52 1rth h GLN 500 Ca -0.46 -0.10 0.02 0.00 -1.45 0.00 0.00 58.65 56.66 1rth h GLN 500 Cb 1.21 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.58 1rth h GLN 500 CO 0.70 0.51 0.12 -0.92 -0.95 0.00 0.00 178.83 178.29 1rth h TYR 501 N 0.22 0.14 -0.10 2.96 5.03 -1.99 0.24 116.97 123.47 1rth h TYR 501 Ca 0.08 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.36 1rth h TYR 501 Cb 0.30 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.53 1rth h TYR 501 CO 0.02 0.09 -0.09 0.00 -1.32 0.00 0.00 178.16 176.85 1rth h ALA 502 N 1.90 1.66 -0.47 1.82 0.00 -1.89 -1.85 119.26 120.44 1rth h ALA 502 Ca 0.07 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1rth h ALA 502 Cb 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1rth h ALA 502 CO -0.01 0.25 0.12 1.25 0.00 0.00 0.00 179.25 180.86 1rth h LEU 503 N 0.15 0.70 0.28 0.00 5.85 -0.50 -0.91 115.31 120.88 1rth h LEU 503 Ca 0.03 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.53 1rth h LEU 503 Cb 0.26 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1rth h LEU 503 CO 0.01 0.74 -0.42 1.23 -0.34 0.00 0.00 178.44 179.67 1rth h GLY 504 N 0.62 -0.94 0.74 3.75 0.00 -1.24 -0.67 103.07 105.34 1rth h GLY 504 Ca 0.15 0.49 0.06 0.00 0.00 0.00 0.00 47.33 48.03 1rth h GLY 504 CO -0.00 -0.30 0.48 -2.22 0.00 0.00 0.00 176.54 174.50 1rth h ILE 505 N -0.76 1.04 -0.61 2.60 2.04 -1.34 0.85 117.51 121.33 1rth h ILE 505 Ca -0.01 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 1rth h ILE 505 Cb 0.72 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1rth h ILE 505 CO -0.15 0.16 0.27 0.40 0.00 0.00 0.00 178.15 178.83 1rth h ILE 506 N 0.89 1.21 0.39 -0.67 2.04 -0.81 0.46 117.51 121.02 1rth h ILE 506 Ca 0.34 -0.62 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 1rth h ILE 506 Cb 0.15 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1rth h ILE 506 CO -0.16 0.25 -0.19 -0.61 0.00 0.00 0.00 178.15 177.44 1rth h GLN 507 N 0.86 -0.51 0.00 2.37 4.15 -0.03 -3.39 115.11 118.56 1rth h GLN 507 Ca 0.21 0.03 -0.20 0.00 0.77 0.00 0.00 58.65 59.47 1rth h GLN 507 Cb 0.13 0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.90 1rth h GLN 507 CO -0.02 -0.29 -1.02 0.00 -1.93 0.00 0.00 178.83 175.57 1rth h ALA 508 N -1.02 0.50 -6.64 3.38 0.00 -0.88 -3.44 119.26 111.16 1rth h ALA 508 Ca -0.05 -0.88 -0.53 0.00 0.00 0.00 0.00 54.91 53.44 1rth h ALA 508 Cb 0.46 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1rth h ALA 508 CO 0.09 1.14 -0.96 1.04 0.00 0.00 0.00 179.25 180.55 1rth n GLN 509 N -3.25 -1.20 -0.89 0.00 6.02 0.16 -4.89 117.38 113.32 1rth n GLN 509 Ca -0.03 0.26 -0.31 0.00 -0.01 0.00 0.00 57.00 56.92 1rth n GLN 509 Cb 0.90 -3.54 0.15 0.00 1.02 0.00 0.00 30.24 28.77 1rth n GLN 509 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1rth s PRO 510 N -6.79 1.28 0.00 -1.09 0.04 -1.26 -4.87 135.00 122.31 1rth s PRO 510 Ca 0.34 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.71 1rth s PRO 510 Cb -0.16 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.61 1rth s PRO 510 CO 0.92 -2.38 0.77 -0.40 0.04 0.00 0.00 177.00 175.95 1rth n ASP 511 N -4.04 1.30 -3.52 6.66 5.68 0.38 -4.96 116.55 118.04 1rth n ASP 511 Ca 0.10 -1.59 -0.14 0.00 -0.50 0.00 0.00 54.79 52.66 1rth n ASP 511 Cb 0.53 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.46 1rth n ASP 511 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rth s GLN 512 N -0.59 1.11 0.07 0.11 -2.07 -1.10 -4.96 119.66 112.23 1rth s GLN 512 Ca 0.00 -0.19 -0.27 0.00 -1.82 0.00 0.00 55.36 53.08 1rth s GLN 512 Cb 0.00 0.51 0.09 0.00 -1.09 0.00 0.00 33.01 32.52 1rth s GLN 512 CO 0.00 -0.42 0.87 0.45 -1.32 0.00 0.00 175.29 174.88 1rth s SER 513 N -2.01 -0.33 0.21 12.60 0.15 -1.26 -2.62 113.70 120.43 1rth s SER 513 Ca -0.05 -0.13 0.07 0.00 0.70 0.00 0.00 55.95 56.54 1rth s SER 513 Cb -0.01 0.45 0.12 0.00 -1.71 0.00 0.00 66.02 64.87 1rth s SER 513 CO -0.02 -0.76 1.47 1.05 1.20 0.00 0.00 173.24 176.18 1rth h GLU 514 N 2.00 0.09 -6.29 5.44 -0.00 -1.32 -3.44 114.58 111.05 1rth h GLU 514 Ca -0.24 -0.09 -0.57 0.00 -0.00 0.00 0.00 59.36 58.47 1rth h GLU 514 Cb 1.25 0.02 -0.04 0.00 -0.00 0.00 0.00 28.75 29.98 1rth h GLU 514 CO 0.30 0.81 0.99 0.45 -0.00 0.00 0.00 179.01 181.56 1rth s SER 515 N -6.85 6.68 0.33 3.06 0.15 -1.26 -4.90 113.70 110.90 1rth s SER 515 Ca -0.02 1.42 0.05 0.00 0.70 0.00 0.00 55.95 58.10 1rth s SER 515 Cb 0.11 -2.54 0.67 0.00 -1.71 0.00 0.00 66.02 62.56 1rth s SER 515 CO 0.80 -1.04 1.89 -0.08 1.20 0.00 0.00 173.24 176.01 1rth h GLU 516 N 9.33 0.83 -0.10 5.44 4.57 -1.99 0.31 114.58 132.98 1rth h GLU 516 Ca -0.28 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 57.84 1rth h GLU 516 Cb 1.11 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 29.51 1rth h GLU 516 CO 1.01 0.55 0.05 1.25 -1.18 0.00 0.00 179.01 180.69 1rth h LEU 517 N 0.86 0.14 -0.54 1.64 6.46 -1.98 0.99 115.31 122.88 1rth h LEU 517 Ca 0.41 -0.14 -0.03 0.00 -0.12 0.00 0.00 57.88 57.99 1rth h LEU 517 Cb 0.43 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.30 1rth h LEU 517 CO -0.18 0.24 0.20 0.58 -0.62 0.00 0.00 178.44 178.67 1rth h VAL 518 N 0.03 1.22 -0.52 1.05 2.07 -1.75 -0.51 116.25 117.84 1rth h VAL 518 Ca 0.04 -0.71 0.08 0.00 0.82 0.00 0.00 66.70 66.93 1rth h VAL 518 Cb 0.15 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 1rth h VAL 518 CO -0.00 0.27 0.16 0.78 0.02 0.00 0.00 177.57 178.79 1rth h ASN 519 N 0.73 0.12 -0.69 0.57 2.35 -0.22 0.38 115.58 118.83 1rth h ASN 519 Ca 0.18 0.07 0.02 0.00 -0.55 0.00 0.00 56.30 56.02 1rth h ASN 519 Cb 0.22 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 1rth h ASN 519 CO -0.01 0.09 0.44 1.56 -1.65 0.00 0.00 177.43 177.86 1rth h GLN 520 N 0.32 0.86 -0.79 0.81 1.08 0.10 -0.22 115.11 117.28 1rth h GLN 520 Ca 0.26 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.40 1rth h GLN 520 Cb 0.31 -0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 27.51 1rth h GLN 520 CO -0.29 0.57 0.49 0.82 -0.95 0.00 0.00 178.83 179.47 1rth h ILE 521 N 0.89 1.22 -0.54 2.54 2.04 0.51 -2.40 117.51 121.76 1rth h ILE 521 Ca 0.26 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1rth h ILE 521 Cb -0.05 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.11 1rth h ILE 521 CO -0.08 0.22 0.20 0.40 0.00 0.00 0.00 178.15 178.89 1rth h ILE 522 N 1.07 1.22 -0.86 -0.67 2.04 0.92 0.44 117.51 121.67 1rth h ILE 522 Ca 0.28 -0.72 0.06 0.00 1.00 0.00 0.00 64.86 65.49 1rth h ILE 522 Cb -0.06 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 36.64 1rth h ILE 522 CO -0.06 0.27 0.56 -0.33 0.00 0.00 0.00 178.15 178.60 1rth h GLU 523 N 0.74 0.95 -0.12 2.37 4.39 -0.80 -0.38 114.58 121.73 1rth h GLU 523 Ca 0.18 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 1rth h GLU 523 Cb 0.22 -0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1rth h GLU 523 CO -0.01 0.63 -0.06 0.37 -1.16 0.00 0.00 179.01 178.78 1rth h GLN 524 N 0.98 0.25 -0.76 2.33 5.75 -1.18 -2.09 115.11 120.40 1rth h GLN 524 Ca 0.37 -0.11 0.11 0.00 -0.15 0.00 0.00 58.65 58.87 1rth h GLN 524 Cb 0.18 -0.01 -0.08 0.00 1.07 0.00 0.00 27.48 28.65 1rth h GLN 524 CO -0.13 0.59 0.39 -0.07 -2.65 0.00 0.00 178.83 176.96 1rth h LEU 525 N -0.10 0.50 -0.49 -2.39 3.38 -0.17 -2.06 115.31 113.97 1rth h LEU 525 Ca 0.03 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1rth h LEU 525 Cb 0.52 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1rth h LEU 525 CO 0.02 0.27 0.23 0.40 0.09 0.00 0.00 178.44 179.45 1rth h ILE 526 N 0.63 1.19 0.00 1.22 2.04 -0.88 -2.77 117.51 118.95 1rth h ILE 526 Ca 0.38 -0.56 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 1rth h ILE 526 Cb 0.44 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1rth h ILE 526 CO -0.29 0.22 -0.06 0.11 0.00 0.00 0.00 178.15 178.12 1rth h LYS 527 N 0.65 0.00 -7.22 2.37 1.79 -0.67 -3.44 116.57 110.06 1rth h LYS 527 Ca 0.17 0.00 -0.50 0.00 -2.18 0.00 0.00 60.65 58.13 1rth h LYS 527 Cb 0.13 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 30.87 1rth h LYS 527 CO -0.02 0.06 0.37 0.15 -1.08 0.00 0.00 179.45 178.93 1rth s LYS 528 N -4.75 2.91 -0.03 3.15 -0.14 -1.05 -4.97 119.74 114.88 1rth s LYS 528 Ca -0.04 1.28 0.06 0.00 -1.36 0.00 0.00 55.97 55.91 1rth s LYS 528 Cb 0.16 -1.97 -0.24 0.00 -1.68 0.00 0.00 37.83 34.09 1rth s LYS 528 CO 0.64 -1.15 0.73 1.49 -0.76 0.00 0.00 175.35 176.30 1rth h GLU 529 N -0.02 0.09 -2.23 1.68 4.81 -1.42 -3.46 114.58 114.03 1rth h GLU 529 Ca -0.46 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 58.62 1rth h GLU 529 Cb 1.23 0.06 -0.23 0.00 0.63 0.00 0.00 28.75 30.44 1rth h GLU 529 CO 0.55 0.78 -0.22 0.15 -0.73 0.00 0.00 179.01 179.54 1rth s LYS 530 N -2.61 0.48 -0.10 1.92 1.02 -1.05 -5.01 119.74 114.40 1rth s LYS 530 Ca -0.08 1.25 0.01 0.00 0.02 0.00 0.00 55.97 57.17 1rth s LYS 530 Cb 0.08 0.57 0.02 0.00 -0.52 0.00 0.00 37.83 37.97 1rth s LYS 530 CO 0.82 -0.21 -0.12 0.08 -0.92 0.00 0.00 175.35 175.00 1rth s VAL 531 N 2.62 1.22 -0.20 3.17 1.01 -1.26 -2.19 120.40 124.76 1rth s VAL 531 Ca -0.05 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 1rth s VAL 531 Cb -0.11 -1.15 0.01 0.00 0.00 0.00 0.00 36.38 35.13 1rth s VAL 531 CO -0.16 0.39 -0.13 -0.47 0.00 0.00 0.00 175.10 174.73 1rth s TYR 532 N 1.12 2.89 -0.11 5.22 5.04 -0.79 -0.92 117.35 129.81 1rth s TYR 532 Ca -0.05 -1.42 0.00 0.00 -2.44 0.00 0.00 57.07 53.16 1rth s TYR 532 Cb -0.14 -2.00 -0.02 0.00 0.35 0.00 0.00 41.96 40.15 1rth s TYR 532 CO -0.02 -0.72 -0.11 -1.17 -1.34 0.00 0.00 175.55 172.19 1rth s LEU 533 N 1.35 2.85 0.00 6.97 2.96 -1.26 -1.13 118.68 130.42 1rth s LEU 533 Ca 0.04 -0.24 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 1rth s LEU 533 Cb -0.14 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.91 1rth s LEU 533 CO -0.08 0.22 -0.06 0.00 -1.32 0.00 0.00 176.35 175.10 1rth s ALA 534 N 0.03 0.51 -0.04 5.97 0.00 0.33 -4.96 121.76 123.61 1rth s ALA 534 Ca -0.03 -0.33 0.02 0.00 0.00 0.00 0.00 51.96 51.62 1rth s ALA 534 Cb -0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.84 1rth s ALA 534 CO 0.04 0.11 -0.08 -0.46 0.00 0.00 0.00 175.76 175.37 1rth s TRP 535 N -0.31 2.89 0.02 0.00 -0.00 -1.24 -0.57 118.94 119.74 1rth s TRP 535 Ca 0.01 -0.02 0.02 0.00 -0.00 0.00 0.00 56.10 56.11 1rth s TRP 535 Cb -0.03 -1.66 -0.02 0.00 -0.00 0.00 0.00 33.47 31.76 1rth s TRP 535 CO -0.00 0.33 -0.07 0.14 -0.00 0.00 0.00 176.95 177.35 1rth s VAL 536 N -0.87 0.50 0.58 5.86 -7.23 -0.90 -4.96 120.40 113.38 1rth s VAL 536 Ca 0.14 -0.74 -0.21 0.00 -1.81 0.00 0.00 61.98 59.37 1rth s VAL 536 Cb -0.11 -0.51 -0.04 0.00 0.56 0.00 0.00 36.38 36.28 1rth s VAL 536 CO 0.04 -0.18 1.34 -2.84 -0.31 0.00 0.00 175.10 173.15 1rth s PRO 537 N -1.00 2.94 0.53 4.82 0.02 -1.26 -4.10 135.00 136.95 1rth s PRO 537 Ca -0.05 2.19 -0.18 0.00 0.02 0.00 0.00 61.00 62.98 1rth s PRO 537 Cb -0.07 -2.12 -0.07 0.00 0.02 0.00 0.00 34.50 32.26 1rth s PRO 537 CO 0.00 -1.33 1.03 0.00 -0.33 0.00 0.00 177.00 176.36 1rth s ALA 538 N -1.33 2.88 -1.76 -1.55 0.00 -1.26 -3.87 121.76 114.88 1rth s ALA 538 Ca 0.75 0.42 0.00 0.00 0.00 0.00 0.00 51.96 53.13 1rth s ALA 538 Cb -0.40 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1rth s ALA 538 CO 0.45 -0.44 0.00 0.72 0.00 0.00 0.00 175.76 176.50 1rth n HIS 539 N -1.46 -0.07 -2.21 0.00 8.25 -1.26 -4.97 115.22 113.51 1rth n HIS 539 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1rth n HIS 539 Cb 0.53 -3.10 0.00 0.00 1.12 0.00 0.00 29.99 28.54 1rth n HIS 539 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1rth n LYS 540 N -1.82 0.79 -0.05 -0.41 3.00 -1.25 -5.02 118.16 113.40 1rth n LYS 540 Ca -0.17 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.03 1rth n LYS 540 Cb 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.58 1rth n LYS 540 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1rth h GLY 541 N 0.00 0.30 -1.51 3.14 0.00 -1.93 -3.47 103.07 99.60 1rth h GLY 541 Ca 0.00 -0.23 -0.19 0.00 0.00 0.00 0.00 47.33 46.91 1rth h GLY 541 CO 0.00 0.21 0.09 1.39 0.00 0.00 0.00 176.54 178.23 1rth n ILE 542 N -4.73 0.00 0.00 2.60 -0.00 -1.26 -5.22 119.36 110.75 1rth n ILE 542 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.70 1rth n ILE 542 Cb 0.23 -0.06 0.00 0.00 -0.00 0.00 0.00 39.64 39.81 1rth n ILE 542 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16