#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3isn s ILE 2 N 0.00 2.06 -0.41 4.25 -4.36 -1.26 -5.05 121.20 116.43 3isn s ILE 2 Ca 0.00 -1.91 -0.23 0.00 -0.26 0.00 0.00 60.65 58.26 3isn s ILE 2 Cb 0.00 -2.97 0.02 0.00 1.25 0.00 0.00 42.46 40.76 3isn s ILE 2 CO 0.00 0.00 0.75 -0.94 0.24 0.00 0.00 174.94 174.99 3isn s SER 3 N -3.78 6.45 0.00 4.36 1.04 -1.25 -4.93 113.70 115.59 3isn s SER 3 Ca 0.36 0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.84 3isn s SER 3 Cb 0.08 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.82 3isn s SER 3 CO 0.19 -0.81 0.25 -2.65 0.98 0.00 0.00 173.24 171.20 3isn n PRO 4 N 6.50 0.00 -1.94 4.02 -0.02 -1.26 -4.47 135.00 137.84 3isn n PRO 4 Ca 0.02 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.11 3isn n PRO 4 Cb 0.48 -1.28 0.01 0.00 -0.02 0.00 0.00 33.50 32.70 3isn n PRO 4 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3isn s ILE 5 N -1.86 2.39 0.36 4.25 1.09 -1.26 -4.93 121.20 121.24 3isn s ILE 5 Ca 0.00 0.33 -0.23 0.00 -1.10 0.00 0.00 60.65 59.65 3isn s ILE 5 Cb 0.00 -3.19 -0.15 0.00 -1.06 0.00 0.00 42.46 38.06 3isn s ILE 5 CO 0.00 0.03 0.31 -0.62 -0.10 0.00 0.00 174.94 174.56 3isn n GLU 6 N -0.30 0.17 -3.87 2.79 -0.58 -1.26 -4.78 120.64 112.81 3isn n GLU 6 Ca 0.06 0.06 -0.35 0.00 -0.42 0.00 0.00 57.16 56.52 3isn n GLU 6 Cb 0.44 -1.14 -0.05 0.00 -0.57 0.00 0.00 31.44 30.12 3isn n GLU 6 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3isn s THR 7 N -1.47 5.43 0.11 2.62 -4.23 -1.26 -4.92 115.64 111.92 3isn s THR 7 Ca 0.61 0.00 -0.30 0.00 -1.18 0.00 0.00 61.69 60.82 3isn s THR 7 Cb -0.69 -3.51 -0.06 0.00 1.34 0.00 0.00 72.50 69.57 3isn s THR 7 CO 0.60 0.41 1.15 -0.69 -0.54 0.00 0.00 174.62 175.55 3isn s VAL 8 N -1.24 3.96 0.13 2.29 1.01 -1.26 -4.92 120.40 120.37 3isn s VAL 8 Ca 0.24 1.52 -0.31 0.00 0.00 0.00 0.00 61.98 63.44 3isn s VAL 8 Cb -0.13 -3.97 -0.08 0.00 0.00 0.00 0.00 36.38 32.20 3isn s VAL 8 CO 0.15 0.18 1.36 -2.16 0.00 0.00 0.00 175.10 174.63 3isn s PRO 9 N 0.42 4.34 -0.08 2.72 0.04 -1.26 -4.22 135.00 136.97 3isn s PRO 9 Ca 0.55 2.05 0.04 0.00 0.04 0.00 0.00 61.00 63.67 3isn s PRO 9 Cb -0.29 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.00 3isn s PRO 9 CO 0.32 -0.39 -0.20 0.08 0.04 0.00 0.00 177.00 176.85 3isn s VAL 10 N 0.93 1.72 0.29 -0.36 1.01 -1.26 -5.09 120.40 117.63 3isn s VAL 10 Ca 0.63 -0.83 0.11 0.00 0.00 0.00 0.00 61.98 61.89 3isn s VAL 10 Cb -0.36 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 3isn s VAL 10 CO 0.32 0.48 -0.17 -0.54 0.00 0.00 0.00 175.10 175.19 3isn s LYS 11 N 0.33 1.74 0.52 2.72 -0.14 -1.26 -4.73 119.74 118.92 3isn s LYS 11 Ca -0.14 -1.78 -0.06 0.00 -1.36 0.00 0.00 55.97 52.63 3isn s LYS 11 Cb -0.16 -1.78 -0.03 0.00 -1.68 0.00 0.00 37.83 34.17 3isn s LYS 11 CO 0.06 0.30 0.85 -0.51 -0.76 0.00 0.00 175.35 175.28 3isn s LEU 12 N -3.54 3.52 0.40 3.17 1.43 -1.26 -1.64 118.68 120.76 3isn s LEU 12 Ca 0.31 1.02 -0.27 0.00 -1.03 0.00 0.00 54.13 54.15 3isn s LEU 12 Cb -0.04 -3.99 -0.10 0.00 0.03 0.00 0.00 46.19 42.09 3isn s LEU 12 CO 0.16 -0.67 1.47 0.29 0.23 0.00 0.00 176.35 177.82 3isn n LYS 13 N -2.39 2.54 -1.66 1.70 5.02 -0.68 -4.55 118.16 118.13 3isn n LYS 13 Ca 0.02 0.89 -0.46 0.00 -2.02 0.00 0.00 58.31 56.74 3isn n LYS 13 Cb 0.55 -2.65 -0.04 0.00 -0.02 0.00 0.00 35.03 32.87 3isn n LYS 13 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3isn n PRO 14 N 0.24 2.04 0.00 1.97 -0.04 -1.26 -1.59 135.00 136.36 3isn n PRO 14 Ca 0.03 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.22 3isn n PRO 14 Cb 0.40 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.40 3isn n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3isn n GLY 15 N 2.97 1.65 3.88 0.55 0.00 -1.26 -5.04 105.19 107.95 3isn n GLY 15 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 3isn n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3isn s MET 16 N -0.76 3.40 0.40 1.61 -1.94 -0.62 -5.12 119.30 116.26 3isn s MET 16 Ca 0.00 -0.29 0.04 0.00 -1.71 0.00 0.00 55.69 53.73 3isn s MET 16 Cb 0.00 -3.09 0.04 0.00 2.01 0.00 0.00 34.83 33.78 3isn s MET 16 CO 0.00 0.70 0.30 -3.47 -0.01 0.00 0.00 175.02 172.54 3isn n ASP 17 N 1.24 2.26 -4.55 3.03 2.03 -1.26 -4.79 116.55 114.51 3isn n ASP 17 Ca -0.13 -2.36 -0.29 0.00 0.52 0.00 0.00 54.79 52.52 3isn n ASP 17 Cb 0.53 -0.03 0.17 0.00 -0.72 0.00 0.00 41.12 41.07 3isn n ASP 17 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 3isn s GLY 18 N -3.48 1.59 0.36 0.27 0.00 -1.26 -4.96 107.32 99.84 3isn s GLY 18 Ca 0.22 -0.62 -0.27 0.00 0.00 0.00 0.00 44.72 44.06 3isn s GLY 18 CO 0.14 0.03 1.19 2.56 0.00 0.00 0.00 173.10 177.02 3isn s PRO 19 N -5.27 4.22 -0.48 2.90 0.05 -1.26 -4.97 135.00 130.18 3isn s PRO 19 Ca 0.66 1.91 0.08 0.00 0.05 0.00 0.00 61.00 63.70 3isn s PRO 19 Cb -0.14 -2.85 0.30 0.00 0.05 0.00 0.00 34.50 31.87 3isn s PRO 19 CO 0.55 -0.20 0.74 1.63 0.05 0.00 0.00 177.00 179.77 3isn n LYS 20 N 0.42 1.80 -3.94 4.56 4.76 -1.25 -1.32 118.16 123.18 3isn n LYS 20 Ca 0.02 -3.98 -0.35 0.00 -2.87 0.00 0.00 58.31 51.14 3isn n LYS 20 Cb 0.45 -1.84 -0.10 0.00 -1.84 0.00 0.00 35.03 31.71 3isn n LYS 20 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3isn s VAL 21 N -2.68 4.82 0.42 -0.18 1.01 -0.81 -4.89 120.40 118.09 3isn s VAL 21 Ca 0.41 -0.02 -0.24 0.00 0.00 0.00 0.00 61.98 62.13 3isn s VAL 21 Cb 0.25 -3.19 -0.08 0.00 0.00 0.00 0.00 36.38 33.36 3isn s VAL 21 CO -0.09 0.44 1.16 -0.54 0.00 0.00 0.00 175.10 176.07 3isn s LYS 22 N 0.55 3.96 0.07 2.72 -0.14 -1.26 -4.03 119.74 121.60 3isn s LYS 22 Ca 0.04 1.80 -0.30 0.00 -1.36 0.00 0.00 55.97 56.14 3isn s LYS 22 Cb -0.13 -2.57 -0.05 0.00 -1.68 0.00 0.00 37.83 33.40 3isn s LYS 22 CO 0.01 -0.39 1.03 -1.14 -0.76 0.00 0.00 175.35 174.09 3isn s GLN 23 N -2.45 4.58 0.52 1.68 2.00 -1.26 -4.63 119.66 120.10 3isn s GLN 23 Ca 0.59 1.52 -0.06 0.00 -2.00 0.00 0.00 55.36 55.42 3isn s GLN 23 Cb -0.29 -3.39 -0.03 0.00 0.80 0.00 0.00 33.01 30.09 3isn s GLN 23 CO 0.36 0.01 0.84 1.67 -0.50 0.00 0.00 175.29 177.68 3isn s TRP 24 N 0.56 3.55 0.39 1.67 -2.14 -1.26 -5.03 118.94 116.68 3isn s TRP 24 Ca 0.51 0.89 -0.26 0.00 2.66 0.00 0.00 56.10 59.90 3isn s TRP 24 Cb -0.24 -2.41 -0.09 0.00 -3.10 0.00 0.00 33.47 27.63 3isn s TRP 24 CO 0.30 -0.40 1.28 -2.14 -2.66 0.00 0.00 176.95 173.33 3isn s PRO 25 N -4.84 4.03 0.15 3.25 0.02 -1.26 -4.95 135.00 131.39 3isn s PRO 25 Ca 0.49 2.11 0.11 0.00 0.02 0.00 0.00 61.00 63.73 3isn s PRO 25 Cb -0.10 -2.79 -0.04 0.00 0.02 0.00 0.00 34.50 31.59 3isn s PRO 25 CO 0.47 -0.42 -0.26 -0.51 -0.33 0.00 0.00 177.00 175.95 3isn s LEU 26 N -2.36 2.35 0.95 -5.54 1.43 -1.26 -5.14 118.68 109.12 3isn s LEU 26 Ca 0.56 -0.78 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 3isn s LEU 26 Cb -0.37 -1.17 0.16 0.00 0.03 0.00 0.00 46.19 44.83 3isn s LEU 26 CO 0.48 0.15 1.11 0.42 0.23 0.00 0.00 176.35 178.73 3isn s THR 27 N -1.27 2.20 0.09 5.49 -4.23 -1.26 -4.88 115.64 111.78 3isn s THR 27 Ca 0.16 0.07 -0.18 0.00 -1.18 0.00 0.00 61.69 60.55 3isn s THR 27 Cb -0.09 -2.65 -0.08 0.00 1.34 0.00 0.00 72.50 71.02 3isn s THR 27 CO 0.07 -0.09 1.50 -0.08 -0.54 0.00 0.00 174.62 175.49 3isn h GLU 28 N -1.68 0.50 -0.67 3.99 4.81 -2.00 -1.90 114.58 117.62 3isn h GLU 28 Ca -0.52 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 58.45 3isn h GLU 28 Cb 1.32 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.64 3isn h GLU 28 CO 0.59 0.68 0.11 1.05 -0.73 0.00 0.00 179.01 180.71 3isn h GLU 29 N 0.27 1.11 -0.86 1.92 4.11 -1.99 0.57 114.58 119.71 3isn h GLU 29 Ca 0.07 -0.30 0.00 0.00 0.07 0.00 0.00 59.36 59.21 3isn h GLU 29 Cb 0.48 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 3isn h GLU 29 CO 0.02 1.01 0.55 0.87 0.07 0.00 0.00 179.01 181.54 3isn h LYS 30 N 1.04 1.15 0.64 1.06 1.57 -1.93 -0.66 116.57 119.44 3isn h LYS 30 Ca 0.21 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 3isn h LYS 30 Cb 0.44 -0.25 0.01 0.00 0.08 0.00 0.00 32.23 32.50 3isn h LYS 30 CO 0.01 0.78 -0.31 0.82 -0.57 0.00 0.00 179.45 180.19 3isn h ILE 31 N 1.18 0.00 -1.01 1.86 2.04 -0.56 -1.96 117.51 119.06 3isn h ILE 31 Ca 0.31 -0.12 0.25 0.00 1.00 0.00 0.00 64.86 66.30 3isn h ILE 31 Cb -0.10 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 35.89 3isn h ILE 31 CO -0.06 0.00 0.65 0.11 0.00 0.00 0.00 178.15 178.85 3isn h LYS 32 N -0.98 0.42 -0.10 2.37 1.57 -0.86 0.14 116.57 119.13 3isn h LYS 32 Ca -0.09 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3isn h LYS 32 Cb 0.66 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.87 3isn h LYS 32 CO 0.14 0.28 0.05 0.00 -0.57 0.00 0.00 179.45 179.36 3isn h ALA 33 N 1.62 0.12 -0.37 3.86 0.00 -0.98 -2.44 119.26 121.08 3isn h ALA 33 Ca 0.57 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 55.26 3isn h ALA 33 Cb 1.38 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 3isn h ALA 33 CO -0.28 -0.34 -0.42 -0.07 0.00 0.00 0.00 179.25 178.15 3isn h LEU 34 N 0.06 1.00 -1.10 0.00 3.38 -0.01 0.10 115.31 118.73 3isn h LEU 34 Ca 0.03 -0.48 0.02 0.00 0.09 0.00 0.00 57.88 57.54 3isn h LEU 34 Cb 0.08 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 3isn h LEU 34 CO -0.01 1.28 0.61 0.58 0.09 0.00 0.00 178.44 180.99 3isn h VAL 35 N 0.74 1.22 0.22 1.22 2.07 -1.10 0.20 116.25 120.82 3isn h VAL 35 Ca 0.05 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 3isn h VAL 35 Cb 1.01 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3isn h VAL 35 CO 0.10 0.22 -0.11 -0.08 0.02 0.00 0.00 177.57 177.73 3isn h GLU 36 N 1.22 -0.29 0.09 1.57 4.81 -1.00 -1.83 114.58 119.16 3isn h GLU 36 Ca 0.34 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.61 3isn h GLU 36 Cb -0.10 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.31 3isn h GLU 36 CO -0.08 -0.04 -0.26 0.82 -0.73 0.00 0.00 179.01 178.72 3isn h ILE 37 N -0.52 0.43 -0.10 2.32 2.04 -0.52 -2.78 117.51 118.38 3isn h ILE 37 Ca -0.03 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 3isn h ILE 37 Cb 0.39 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 3isn h ILE 37 CO 0.05 0.00 0.05 0.00 0.00 0.00 0.00 178.15 178.25 3isn h THR 39 N 0.06 0.32 -0.72 0.00 2.02 -1.26 0.39 112.91 113.72 3isn h THR 39 Ca 0.04 -0.01 0.01 0.00 0.77 0.00 0.00 66.41 67.21 3isn h THR 39 Cb 0.10 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 66.77 3isn h THR 39 CO -0.01 0.01 0.48 -0.33 0.37 0.00 0.00 175.52 176.04 3isn h GLU 40 N 0.03 0.95 -0.43 6.66 4.39 -1.17 -2.66 114.58 122.35 3isn h GLU 40 Ca 0.35 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.92 3isn h GLU 40 Cb 0.56 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 3isn h GLU 40 CO -0.69 0.63 -0.03 0.52 -1.16 0.00 0.00 179.01 178.28 3isn h MET 41 N 0.98 0.72 -0.35 2.33 2.86 0.10 -2.64 114.93 118.93 3isn h MET 41 Ca 0.26 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.67 3isn h MET 41 Cb -0.11 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.45 3isn h MET 41 CO -0.06 0.75 0.06 1.49 1.06 0.00 0.00 176.91 180.21 3isn h GLU 42 N 0.67 0.57 -0.97 1.72 4.81 -0.65 0.69 114.58 121.43 3isn h GLU 42 Ca 0.13 -0.15 0.15 0.00 -0.13 0.00 0.00 59.36 59.36 3isn h GLU 42 Cb 0.46 -0.07 -0.09 0.00 0.63 0.00 0.00 28.75 29.68 3isn h GLU 42 CO 0.02 0.65 0.61 0.87 -0.73 0.00 0.00 179.01 180.43 3isn h LYS 43 N 0.41 0.78 -0.07 1.92 1.57 -1.17 0.22 116.57 120.23 3isn h LYS 43 Ca 0.11 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3isn h LYS 43 Cb 0.35 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3isn h LYS 43 CO 0.01 0.52 0.00 0.39 -0.57 0.00 0.00 179.45 179.80 3isn n GLU 44 N -4.64 1.20 -1.10 3.15 1.02 -1.02 -4.79 120.64 114.46 3isn n GLU 44 Ca 0.20 -0.31 -0.03 0.00 -0.02 0.00 0.00 57.16 56.99 3isn n GLU 44 Cb 0.48 -1.20 -0.01 0.00 -0.02 0.00 0.00 31.44 30.68 3isn n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3isn n GLY 45 N 0.77 0.47 0.28 0.62 0.00 0.76 -3.10 105.19 104.99 3isn n GLY 45 Ca 0.09 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 3isn n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3isn h LYS 46 N 0.23 0.86 -4.79 1.61 1.79 -1.07 -3.42 116.57 111.77 3isn h LYS 46 Ca -0.07 -0.28 -0.28 0.00 -2.18 0.00 0.00 60.65 57.83 3isn h LYS 46 Cb 0.76 -0.07 -0.15 0.00 -1.58 0.00 0.00 32.23 31.19 3isn h LYS 46 CO 0.10 0.91 -0.66 0.96 -1.08 0.00 0.00 179.45 179.68 3isn s ILE 47 N -4.86 0.66 0.01 1.86 -4.36 -1.23 -1.12 121.20 112.17 3isn s ILE 47 Ca -0.10 -1.98 0.03 0.00 -0.26 0.00 0.00 60.65 58.34 3isn s ILE 47 Cb 0.14 -2.11 -0.01 0.00 1.25 0.00 0.00 42.46 41.72 3isn s ILE 47 CO 0.83 -0.48 -0.09 -0.44 0.24 0.00 0.00 174.94 175.00 3isn s SER 48 N -3.17 1.08 0.37 4.36 0.01 -0.55 -4.19 113.70 111.61 3isn s SER 48 Ca 0.24 -0.29 -0.28 0.00 1.31 0.00 0.00 55.95 56.93 3isn s SER 48 Cb 0.06 -0.08 -0.10 0.00 0.21 0.00 0.00 66.02 66.11 3isn s SER 48 CO 0.04 0.03 1.36 -0.54 0.41 0.00 0.00 173.24 174.54 3isn s LYS 49 N -0.66 4.15 0.22 12.44 1.02 -1.26 -1.71 119.74 133.95 3isn s LYS 49 Ca 0.00 2.31 -0.00 0.00 0.02 0.00 0.00 55.97 58.30 3isn s LYS 49 Cb -0.05 -2.94 -0.04 0.00 -0.52 0.00 0.00 37.83 34.27 3isn s LYS 49 CO 0.00 -0.39 0.12 0.96 -0.92 0.00 0.00 175.35 175.12 3isn s ILE 50 N -1.17 0.20 0.00 2.17 -4.36 -0.92 -4.87 121.20 112.25 3isn s ILE 50 Ca 0.53 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.92 3isn s ILE 50 Cb -0.41 -2.54 0.00 0.00 1.25 0.00 0.00 42.46 40.76 3isn s ILE 50 CO 0.55 -0.01 0.00 0.61 0.24 0.00 0.00 174.94 176.33 3isn n GLY 51 N -0.33 4.36 0.00 6.27 0.00 -1.26 -4.44 105.19 109.78 3isn n GLY 51 Ca 0.01 -2.13 0.14 0.00 0.00 0.00 0.00 46.02 44.03 3isn n GLY 51 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3isn n PRO 52 N -0.20 0.17 0.05 1.61 -0.04 -1.26 -3.13 135.00 132.19 3isn n PRO 52 Ca 0.00 0.02 0.13 0.00 -0.04 0.00 0.00 63.50 63.61 3isn n PRO 52 Cb 0.00 -1.50 0.50 0.00 -0.04 0.00 0.00 33.50 32.46 3isn n PRO 52 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3isn n GLU 53 N -1.41 0.10 -2.87 0.54 0.00 -1.26 -4.37 120.64 111.37 3isn n GLU 53 Ca 0.10 0.14 -0.43 0.00 0.00 0.00 0.00 57.16 56.97 3isn n GLU 53 Cb 0.28 -1.63 -0.04 0.00 0.00 0.00 0.00 31.44 30.05 3isn n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 3isn s ASN 54 N -3.61 6.58 0.05 -1.84 3.84 -1.18 -4.96 114.94 113.82 3isn s ASN 54 Ca 0.11 0.36 0.27 0.00 0.21 0.00 0.00 52.86 53.82 3isn s ASN 54 Cb 0.15 -2.44 1.09 0.00 -0.55 0.00 0.00 41.25 39.50 3isn s ASN 54 CO 0.51 -0.87 1.85 -0.81 -2.79 0.00 0.00 177.10 174.99 3isn n PRO 55 N 6.75 0.06 -2.44 0.43 -0.04 -1.26 -4.92 135.00 133.58 3isn n PRO 55 Ca 0.05 0.08 -0.27 0.00 -0.04 0.00 0.00 63.50 63.32 3isn n PRO 55 Cb 0.48 -1.57 0.02 0.00 -0.04 0.00 0.00 33.50 32.39 3isn n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3isn s TYR 56 N -3.03 3.38 -0.17 0.54 2.02 -1.26 -4.80 117.35 114.03 3isn s TYR 56 Ca 0.12 0.74 -0.29 0.00 -0.37 0.00 0.00 57.07 57.27 3isn s TYR 56 Cb 0.17 -2.59 0.11 0.00 -0.40 0.00 0.00 41.96 39.24 3isn s TYR 56 CO 0.52 -0.64 0.92 1.21 -1.57 0.00 0.00 175.55 175.99 3isn s ASN 57 N -4.23 -0.47 -0.00 2.29 3.84 -0.43 -4.74 114.94 111.19 3isn s ASN 57 Ca 0.52 0.62 0.01 0.00 0.21 0.00 0.00 52.86 54.22 3isn s ASN 57 Cb -0.10 0.54 -0.00 0.00 -0.55 0.00 0.00 41.25 41.13 3isn s ASN 57 CO 0.46 -0.36 -0.02 -0.89 -2.79 0.00 0.00 177.10 173.50 3isn s THR 58 N -0.78 0.19 0.54 -5.21 2.01 -0.45 -1.92 115.64 110.02 3isn s THR 58 Ca -0.03 -0.10 -0.18 0.00 0.31 0.00 0.00 61.69 61.69 3isn s THR 58 Cb -0.02 -0.17 -0.06 0.00 0.01 0.00 0.00 72.50 72.27 3isn s THR 58 CO 0.02 0.05 1.06 -2.84 -0.69 0.00 0.00 174.62 172.22 3isn s PRO 59 N -0.03 3.55 0.11 4.92 0.02 -1.26 -4.28 135.00 138.02 3isn s PRO 59 Ca 0.01 1.33 0.07 0.00 0.02 0.00 0.00 61.00 62.42 3isn s PRO 59 Cb -0.01 -2.06 -0.03 0.00 0.02 0.00 0.00 34.50 32.41 3isn s PRO 59 CO -0.00 -0.64 -0.17 0.54 -0.33 0.00 0.00 177.00 176.40 3isn s VAL 60 N -2.15 1.44 0.00 3.83 0.11 -1.26 -1.61 120.40 120.75 3isn s VAL 60 Ca 0.66 -1.56 0.00 0.00 -2.93 0.00 0.00 61.98 58.15 3isn s VAL 60 Cb -0.17 -1.43 0.00 0.00 -1.53 0.00 0.00 36.38 33.25 3isn s VAL 60 CO 0.28 -0.24 0.00 2.22 -3.33 0.00 0.00 175.10 174.03 3isn n PHE 61 N 0.90 -0.46 -4.11 1.54 -1.74 -0.19 -4.90 117.46 108.50 3isn n PHE 61 Ca -0.18 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.56 3isn n PHE 61 Cb 0.55 0.00 -0.13 0.00 1.52 0.00 0.00 39.48 41.42 3isn n PHE 61 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3isn s ALA 62 N -1.28 0.55 0.26 1.98 0.00 -1.26 -0.81 121.76 121.19 3isn s ALA 62 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 51.96 51.40 3isn s ALA 62 Cb 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.05 3isn s ALA 62 CO 0.00 0.04 0.10 0.96 0.00 0.00 0.00 175.76 176.85 3isn s ILE 63 N -0.90 0.56 -0.27 0.00 -4.36 0.47 -4.94 121.20 111.75 3isn s ILE 63 Ca -0.05 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.36 3isn s ILE 63 Cb -0.07 -2.64 0.06 0.00 1.25 0.00 0.00 42.46 41.07 3isn s ILE 63 CO 0.00 0.00 -0.08 -0.54 0.24 0.00 0.00 174.94 174.56 3isn s LYS 64 N -4.03 2.21 0.00 0.37 1.02 -1.26 0.19 119.74 118.24 3isn s LYS 64 Ca 0.38 -1.38 0.00 0.00 0.02 0.00 0.00 55.97 54.98 3isn s LYS 64 Cb 0.08 -2.96 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 3isn s LYS 64 CO 0.14 -0.61 0.00 1.17 -0.92 0.00 0.00 175.35 175.13 3isn n LYS 65 N 4.45 0.00 -1.45 1.68 4.81 -1.26 -4.40 118.16 121.98 3isn n LYS 65 Ca -0.12 0.00 -0.52 0.00 -0.87 0.00 0.00 58.31 56.80 3isn n LYS 65 Cb 0.42 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.40 3isn n LYS 65 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 3isn n LYS 66 N 0.00 1.04 -3.64 1.64 4.01 -1.26 -2.81 118.16 117.13 3isn n LYS 66 Ca 0.00 0.29 -0.21 0.00 -0.51 0.00 0.00 58.31 57.89 3isn n LYS 66 Cb 0.00 -2.38 0.04 0.00 -0.51 0.00 0.00 35.03 32.18 3isn n LYS 66 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 3isn n ASP 67 N 9.36 -1.53 -3.91 4.39 9.92 -1.26 -3.43 116.55 130.08 3isn n ASP 67 Ca 0.41 -0.79 -0.31 0.00 -0.53 0.00 0.00 54.79 53.57 3isn n ASP 67 Cb 0.21 -4.26 -0.01 0.00 -0.64 0.00 0.00 41.12 36.42 3isn n ASP 67 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 3isn n SER 68 N -3.07 -3.73 0.00 -2.24 2.88 -1.12 -4.94 113.62 101.40 3isn n SER 68 Ca -0.29 -0.78 0.00 0.00 -1.33 0.00 0.00 58.87 56.47 3isn n SER 68 Cb 0.67 -3.05 0.00 0.00 -0.75 0.00 0.00 64.21 61.09 3isn n SER 68 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 3isn n THR 69 N -4.30 0.00 -4.29 2.46 5.66 -1.22 -4.99 114.28 107.60 3isn n THR 69 Ca 0.05 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 60.87 3isn n THR 69 Cb 0.51 -0.75 -0.09 0.00 -1.55 0.00 0.00 70.33 68.45 3isn n THR 69 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 3isn s LYS 70 N 0.00 1.56 0.07 1.09 1.02 -1.26 -5.03 119.74 117.19 3isn s LYS 70 Ca 0.00 -1.89 -0.31 0.00 0.02 0.00 0.00 55.97 53.80 3isn s LYS 70 Cb 0.00 0.11 -0.07 0.00 -0.52 0.00 0.00 37.83 37.35 3isn s LYS 70 CO 0.00 -0.50 1.48 -1.58 -0.92 0.00 0.00 175.35 173.83 3isn s TRP 71 N -3.68 2.86 0.16 3.18 0.52 -1.26 -4.49 118.94 116.24 3isn s TRP 71 Ca 0.38 0.70 0.08 0.00 0.02 0.00 0.00 56.10 57.28 3isn s TRP 71 Cb 0.05 -3.78 -0.04 0.00 -1.15 0.00 0.00 33.47 28.55 3isn s TRP 71 CO 0.19 -2.91 -0.05 0.50 0.02 0.00 0.00 176.95 174.70 3isn s ARG 72 N 1.98 2.23 -0.12 4.98 3.52 0.13 -4.95 118.95 126.72 3isn s ARG 72 Ca 0.67 -1.15 -0.06 0.00 -0.13 0.00 0.00 55.73 55.07 3isn s ARG 72 Cb -0.36 -2.28 -0.04 0.00 -1.56 0.00 0.00 34.95 30.71 3isn s ARG 72 CO 0.30 0.46 0.09 0.21 -0.81 0.00 0.00 175.30 175.54 3isn s LYS 73 N -2.77 3.38 -0.04 5.12 2.36 -1.26 -0.39 119.74 126.14 3isn s LYS 73 Ca 0.25 -0.24 -0.02 0.00 -2.55 0.00 0.00 55.97 53.41 3isn s LYS 73 Cb -0.09 -3.08 0.03 0.00 -1.05 0.00 0.00 37.83 33.64 3isn s LYS 73 CO 0.17 0.69 0.06 -1.17 1.55 0.00 0.00 175.35 176.64 3isn s LEU 74 N -0.79 0.19 -0.12 5.43 2.96 0.00 -4.92 118.68 121.43 3isn s LEU 74 Ca 0.13 0.07 -0.04 0.00 -0.22 0.00 0.00 54.13 54.08 3isn s LEU 74 Cb -0.12 -0.15 -0.03 0.00 0.50 0.00 0.00 46.19 46.39 3isn s LEU 74 CO 0.03 -0.24 0.01 -0.69 -1.32 0.00 0.00 176.35 174.13 3isn s VAL 75 N 2.12 4.37 -0.87 1.68 1.01 -1.26 -1.03 120.40 126.42 3isn s VAL 75 Ca 0.04 -0.21 -0.17 0.00 0.00 0.00 0.00 61.98 61.65 3isn s VAL 75 Cb -0.12 -2.88 0.17 0.00 0.00 0.00 0.00 36.38 33.54 3isn s VAL 75 CO -0.03 0.55 0.95 -0.62 0.00 0.00 0.00 175.10 175.95 3isn s ASP 76 N -0.35 6.67 -0.10 3.32 -1.08 -0.64 -4.84 116.67 119.65 3isn s ASP 76 Ca 0.07 -2.30 0.13 0.00 -0.52 0.00 0.00 52.55 49.94 3isn s ASP 76 Cb -0.12 -2.31 0.55 0.00 -1.46 0.00 0.00 42.92 39.58 3isn s ASP 76 CO 0.02 -0.85 1.41 0.49 0.52 0.00 0.00 175.17 176.76 3isn n PHE 77 N 5.41 1.20 -0.29 -5.34 3.72 -1.26 -4.29 117.46 116.61 3isn n PHE 77 Ca 0.18 -0.46 0.11 0.00 -0.05 0.00 0.00 57.45 57.23 3isn n PHE 77 Cb 0.48 -0.24 0.27 0.00 -0.94 0.00 0.00 39.48 39.06 3isn n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3isn h ARG 78 N 3.04 0.36 -0.13 -1.08 3.08 -1.89 0.34 114.38 118.11 3isn h ARG 78 Ca 0.00 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 3isn h ARG 78 Cb 1.23 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.20 3isn h ARG 78 CO 0.21 0.24 -0.04 1.49 -1.07 0.00 0.00 179.97 180.80 3isn h GLU 79 N 0.37 0.26 -0.79 0.04 4.57 -2.01 -2.68 114.58 114.35 3isn h GLU 79 Ca 0.52 -0.10 -0.03 0.00 -1.18 0.00 0.00 59.36 58.57 3isn h GLU 79 Cb 0.96 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.50 3isn h GLU 79 CO -0.52 0.56 0.40 1.25 -1.18 0.00 0.00 179.01 179.51 3isn h LEU 80 N -0.05 1.03 -1.34 1.64 5.85 -1.68 -2.21 115.31 118.55 3isn h LEU 80 Ca 0.03 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.65 3isn h LEU 80 Cb 0.47 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 3isn h LEU 80 CO 0.01 0.86 0.46 0.78 -0.34 0.00 0.00 178.44 180.22 3isn h ASN 81 N 1.12 0.76 -0.10 1.25 2.35 -0.33 -0.12 115.58 120.50 3isn h ASN 81 Ca 0.27 -0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 55.84 3isn h ASN 81 Cb 0.10 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.28 3isn h ASN 81 CO -0.04 0.53 -0.56 0.11 -1.65 0.00 0.00 177.43 175.82 3isn h LYS 82 N 0.88 0.70 -0.00 0.81 1.57 -1.13 -3.05 116.57 116.36 3isn h LYS 82 Ca 0.27 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3isn h LYS 82 Cb -0.01 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3isn h LYS 82 CO -0.07 1.07 -0.05 0.54 -0.57 0.00 0.00 179.45 180.37 3isn n ARG 83 N -3.97 0.41 -3.47 3.15 1.74 -0.86 -4.84 116.66 108.81 3isn n ARG 83 Ca -0.04 -0.05 -0.37 0.00 -0.77 0.00 0.00 57.85 56.62 3isn n ARG 83 Cb 0.62 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.49 3isn n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3isn s THR 84 N -2.63 5.27 0.63 0.55 2.01 -0.11 -1.69 115.64 119.67 3isn s THR 84 Ca 0.26 0.64 -0.17 0.00 0.31 0.00 0.00 61.69 62.72 3isn s THR 84 Cb 0.20 -3.68 -0.11 0.00 0.01 0.00 0.00 72.50 68.92 3isn s THR 84 CO 0.48 0.35 0.08 1.67 -0.69 0.00 0.00 174.62 176.51 3isn n GLN 85 N 3.81 0.17 -2.22 4.92 -0.06 -0.65 -4.68 117.38 118.67 3isn n GLN 85 Ca -0.10 0.07 -0.26 0.00 -2.00 0.00 0.00 57.00 54.71 3isn n GLN 85 Cb 0.52 -1.34 0.06 0.00 -4.06 0.00 0.00 30.24 25.42 3isn n GLN 85 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 3isn s ASP 86 N -1.14 4.90 -0.13 1.69 1.01 -1.26 -4.96 116.67 116.77 3isn s ASP 86 Ca 0.59 0.49 0.19 0.00 0.71 0.00 0.00 52.55 54.53 3isn s ASP 86 Cb -0.41 -1.17 0.29 0.00 1.01 0.00 0.00 42.92 42.63 3isn s ASP 86 CO 0.64 -1.54 1.15 0.49 0.21 0.00 0.00 175.17 176.12 3isn n PHE 87 N -2.88 0.00 0.00 4.23 3.01 -1.25 -5.06 117.46 115.50 3isn n PHE 87 Ca 0.08 -1.00 0.00 0.00 1.01 0.00 0.00 57.45 57.54 3isn n PHE 87 Cb 0.60 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 39.92 3isn n PHE 87 CO 0.00 0.00 0.00 -2.67 1.01 0.00 0.00 176.76 175.10 3isn n TRP 88 N -1.43 0.00 -0.34 1.38 4.27 -1.26 -2.13 117.44 117.93 3isn n TRP 88 Ca 0.16 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 53.89 3isn n TRP 88 Cb 0.64 0.00 0.32 0.00 -1.36 0.00 0.00 31.31 30.91 3isn n TRP 88 CO 0.00 0.00 0.00 1.49 -2.29 0.00 0.00 177.69 176.89 3isn h GLU 89 N 0.00 0.77 -1.82 -2.67 4.81 -1.98 1.03 114.58 114.72 3isn h GLU 89 Ca 0.00 -0.05 -0.32 0.00 -0.13 0.00 0.00 59.36 58.86 3isn h GLU 89 Cb 0.00 -0.17 -0.12 0.00 0.63 0.00 0.00 28.75 29.08 3isn h GLU 89 CO 0.00 0.51 0.22 1.33 -0.73 0.00 0.00 179.01 180.34 3isn n VAL 90 N -4.69 2.90 -0.03 0.32 0.24 -0.90 -4.72 118.33 111.44 3isn n VAL 90 Ca 0.22 -1.93 -0.01 0.00 -2.04 0.00 0.00 64.34 60.58 3isn n VAL 90 Cb 0.52 -1.55 -0.01 0.00 -1.47 0.00 0.00 33.84 31.33 3isn n VAL 90 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3isn n GLN 91 N 1.03 -0.03 -0.55 7.34 10.64 0.35 -3.14 117.38 133.02 3isn n GLN 91 Ca 0.35 1.00 0.06 0.00 -1.83 0.00 0.00 57.00 56.58 3isn n GLN 91 Cb 0.62 -1.50 0.12 0.00 -0.86 0.00 0.00 30.24 28.61 3isn n GLN 91 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12 3isn n LEU 92 N -3.14 1.81 0.00 2.61 7.94 -1.26 -3.91 117.00 121.05 3isn n LEU 92 Ca 0.00 -2.79 0.00 0.00 -1.11 0.00 0.00 56.01 52.11 3isn n LEU 92 Cb 0.02 -0.31 0.00 0.00 0.53 0.00 0.00 43.42 43.66 3isn n LEU 92 CO -0.01 0.81 0.00 0.61 -1.11 0.00 0.00 177.39 177.69 3isn n GLY 93 N -0.75 1.11 3.64 -3.96 0.00 -1.19 -4.75 105.19 99.30 3isn n GLY 93 Ca 0.12 -1.01 -0.27 0.00 0.00 0.00 0.00 46.02 44.87 3isn n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3isn s ILE 94 N 0.00 2.16 0.99 -0.61 1.01 -1.26 -4.11 121.20 119.38 3isn s ILE 94 Ca 0.00 -1.94 -0.18 0.00 0.00 0.00 0.00 60.65 58.53 3isn s ILE 94 Cb 0.00 -2.94 -0.15 0.00 0.01 0.00 0.00 42.46 39.38 3isn s ILE 94 CO 0.00 -0.04 -0.85 -2.65 0.00 0.00 0.00 174.94 171.40 3isn n PRO 95 N -1.02 0.00 -4.41 2.79 -0.02 -1.26 -4.95 135.00 126.13 3isn n PRO 95 Ca -0.04 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.10 3isn n PRO 95 Cb 0.66 -0.99 -0.14 0.00 -0.02 0.00 0.00 33.50 33.01 3isn n PRO 95 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3isn s HIS 96 N -1.97 2.88 0.17 6.00 2.46 -1.26 -4.97 115.29 118.60 3isn s HIS 96 Ca 0.39 -0.77 -0.31 0.00 0.47 0.00 0.00 55.06 54.85 3isn s HIS 96 Cb -0.16 -1.95 -0.09 0.00 -0.13 0.00 0.00 32.58 30.26 3isn s HIS 96 CO 0.81 -0.34 1.40 -2.14 -2.47 0.00 0.00 174.74 172.00 3isn s PRO 97 N 0.78 4.31 0.44 2.88 0.02 -1.26 -4.88 135.00 137.29 3isn s PRO 97 Ca -0.04 2.16 0.26 0.00 0.02 0.00 0.00 61.00 63.40 3isn s PRO 97 Cb -0.15 -3.19 0.69 0.00 0.02 0.00 0.00 34.50 31.87 3isn s PRO 97 CO 0.01 -0.40 1.73 0.00 -0.33 0.00 0.00 177.00 178.01 3isn h ALA 98 N 6.02 1.00 -0.12 -1.55 0.00 -1.94 -3.30 119.26 119.36 3isn h ALA 98 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3isn h ALA 98 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3isn h ALA 98 CO 0.83 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.49 3isn n GLY 99 N 0.79 0.62 0.24 0.00 0.00 -1.26 -4.05 105.19 101.53 3isn n GLY 99 Ca 0.03 -0.55 -0.15 0.00 0.00 0.00 0.00 46.02 45.34 3isn n GLY 99 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3isn h LEU 100 N 3.29 0.95 0.00 0.99 5.85 -1.88 -3.00 115.31 121.51 3isn h LEU 100 Ca 0.00 -0.56 0.00 0.00 0.84 0.00 0.00 57.88 58.16 3isn h LEU 100 Cb 0.71 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3isn h LEU 100 CO 0.00 1.33 0.00 2.29 -0.34 0.00 0.00 178.44 181.72 3isn n LYS 101 N -4.02 0.22 -0.33 1.25 2.85 -1.26 -2.88 118.16 114.00 3isn n LYS 101 Ca -0.05 0.13 0.08 0.00 -1.05 0.00 0.00 58.31 57.42 3isn n LYS 101 Cb 0.65 -1.50 0.23 0.00 -0.65 0.00 0.00 35.03 33.75 3isn n LYS 101 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3isn n LYS 102 N -1.23 3.02 -3.60 -1.58 5.02 -1.13 -4.45 118.16 114.20 3isn n LYS 102 Ca 0.07 -2.42 -0.30 0.00 -2.02 0.00 0.00 58.31 53.64 3isn n LYS 102 Cb 0.09 -1.52 -0.04 0.00 -0.02 0.00 0.00 35.03 33.53 3isn n LYS 102 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3isn s LYS 103 N -1.50 3.61 0.05 1.97 -0.14 -1.14 -4.94 119.74 117.65 3isn s LYS 103 Ca 0.35 -0.12 -0.15 0.00 -1.36 0.00 0.00 55.97 54.69 3isn s LYS 103 Cb 0.21 -2.80 -0.06 0.00 -1.68 0.00 0.00 37.83 33.51 3isn s LYS 103 CO 0.18 0.40 1.24 0.87 -0.76 0.00 0.00 175.35 177.28 3isn h LYS 104 N 2.39 -0.28 -5.86 1.68 1.79 -1.84 -3.34 116.57 111.11 3isn h LYS 104 Ca -0.47 0.02 -0.52 0.00 -2.18 0.00 0.00 60.65 57.50 3isn h LYS 104 Cb 1.18 0.06 -0.15 0.00 -1.58 0.00 0.00 32.23 31.74 3isn h LYS 104 CO 0.70 -0.19 -0.75 -1.54 -1.08 0.00 0.00 179.45 176.59 3isn s SER 105 N -3.49 2.93 -0.02 0.86 1.04 -1.02 -4.11 113.70 109.89 3isn s SER 105 Ca -0.07 -0.99 0.00 0.00 0.48 0.00 0.00 55.95 55.37 3isn s SER 105 Cb 0.03 -0.19 0.03 0.00 0.10 0.00 0.00 66.02 65.98 3isn s SER 105 CO 0.26 -0.07 0.02 -0.69 0.98 0.00 0.00 173.24 173.74 3isn s VAL 106 N -2.64 -0.01 0.13 5.02 1.01 0.94 -2.37 120.40 122.47 3isn s VAL 106 Ca 0.24 0.18 0.08 0.00 0.00 0.00 0.00 61.98 62.48 3isn s VAL 106 Cb -0.03 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.20 3isn s VAL 106 CO 0.09 0.09 -0.12 -0.89 0.00 0.00 0.00 175.10 174.27 3isn s THR 107 N 0.99 3.15 -0.34 3.92 2.01 -0.43 -1.03 115.64 123.91 3isn s THR 107 Ca -0.09 -1.44 0.01 0.00 0.31 0.00 0.00 61.69 60.48 3isn s THR 107 Cb -0.12 -2.49 0.09 0.00 0.01 0.00 0.00 72.50 69.99 3isn s THR 107 CO -0.03 0.05 0.06 -0.69 -0.69 0.00 0.00 174.62 173.33 3isn s VAL 108 N -1.31 2.70 -0.02 3.82 1.01 -1.25 -1.08 120.40 124.27 3isn s VAL 108 Ca 0.21 -1.98 -0.18 0.00 0.00 0.00 0.00 61.98 60.03 3isn s VAL 108 Cb -0.10 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 3isn s VAL 108 CO 0.13 -0.46 0.51 -0.76 0.00 0.00 0.00 175.10 174.52 3isn s LEU 109 N 1.07 4.42 -0.76 3.92 1.43 -0.43 -4.65 118.68 123.68 3isn s LEU 109 Ca 0.04 1.04 -0.21 0.00 -1.03 0.00 0.00 54.13 53.98 3isn s LEU 109 Cb -0.20 -2.77 0.10 0.00 0.03 0.00 0.00 46.19 43.35 3isn s LEU 109 CO -0.05 0.17 1.00 -0.62 0.23 0.00 0.00 176.35 177.09 3isn s ASP 110 N -0.42 6.36 -0.34 2.29 -1.08 -1.26 -1.11 116.67 121.12 3isn s ASP 110 Ca 0.27 -1.48 0.07 0.00 -0.52 0.00 0.00 52.55 50.90 3isn s ASP 110 Cb -0.17 -2.40 0.68 0.00 -1.46 0.00 0.00 42.92 39.57 3isn s ASP 110 CO 0.15 -1.25 1.78 1.33 0.52 0.00 0.00 175.17 177.69 3isn n VAL 111 N 5.71 2.86 0.19 1.11 0.24 -0.72 -4.47 118.33 123.25 3isn n VAL 111 Ca 0.07 -1.59 0.04 0.00 -2.04 0.00 0.00 64.34 60.83 3isn n VAL 111 Cb 0.47 -0.42 0.37 0.00 -1.47 0.00 0.00 33.84 32.78 3isn n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3isn h GLY 112 N 2.39 0.00 1.26 7.63 0.00 -1.88 -3.03 103.07 109.44 3isn h GLY 112 Ca 0.35 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.75 3isn h GLY 112 CO 0.80 0.00 0.31 -0.55 0.00 0.00 0.00 176.54 177.10 3isn h ASP 113 N 0.00 0.00 -0.58 0.19 3.32 -1.83 -2.63 116.42 114.88 3isn h ASP 113 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3isn h ASP 113 Cb 0.77 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.29 3isn h ASP 113 CO 0.05 0.00 0.32 0.00 -1.72 0.00 0.00 179.24 177.89 3isn h ALA 114 N 1.59 1.41 -0.15 3.45 0.00 -1.84 -3.03 119.26 120.68 3isn h ALA 114 Ca 0.10 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3isn h ALA 114 Cb 0.72 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3isn h ALA 114 CO -0.00 0.48 -0.17 1.88 0.00 0.00 0.00 179.25 181.43 3isn h TYR 115 N 0.85 0.26 0.00 0.00 0.05 -1.71 -2.98 116.97 113.44 3isn h TYR 115 Ca 0.21 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.96 3isn h TYR 115 Cb 0.05 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 37.72 3isn h TYR 115 CO 0.01 0.42 0.00 1.19 -1.05 0.00 0.00 178.16 178.72 3isn n PHE 116 N -4.23 0.00 0.32 4.88 3.72 -1.15 -1.80 117.46 119.20 3isn n PHE 116 Ca -0.01 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.42 3isn n PHE 116 Cb 0.30 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.81 3isn n PHE 116 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3isn n SER 117 N -0.51 0.38 -4.67 4.37 3.41 -1.13 -4.94 113.62 110.54 3isn n SER 117 Ca 0.00 -0.69 -0.37 0.00 -0.26 0.00 0.00 58.87 57.55 3isn n SER 117 Cb 0.00 0.95 -0.09 0.00 -0.26 0.00 0.00 64.21 64.81 3isn n SER 117 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3isn s VAL 118 N -1.59 5.34 0.50 -3.33 1.01 -0.74 -3.96 120.40 117.63 3isn s VAL 118 Ca 0.03 0.26 -0.22 0.00 0.00 0.00 0.00 61.98 62.04 3isn s VAL 118 Cb 0.05 -3.53 -0.06 0.00 0.00 0.00 0.00 36.38 32.84 3isn s VAL 118 CO 0.27 0.34 1.26 -2.16 0.00 0.00 0.00 175.10 174.81 3isn s PRO 119 N 1.03 3.44 -0.12 2.72 0.04 -1.26 -1.91 135.00 138.95 3isn s PRO 119 Ca 0.09 2.00 -0.12 0.00 0.04 0.00 0.00 61.00 63.01 3isn s PRO 119 Cb -0.13 -2.32 -0.05 0.00 0.04 0.00 0.00 34.50 32.03 3isn s PRO 119 CO 0.04 -0.87 0.28 -1.17 0.04 0.00 0.00 177.00 175.32 3isn s LEU 120 N -3.29 4.33 -0.04 -3.56 2.96 -0.31 -4.59 118.68 114.17 3isn s LEU 120 Ca 0.68 0.59 -0.25 0.00 -0.22 0.00 0.00 54.13 54.93 3isn s LEU 120 Cb -0.34 -2.34 -0.12 0.00 0.50 0.00 0.00 46.19 43.88 3isn s LEU 120 CO 0.41 0.22 0.69 -0.67 -1.32 0.00 0.00 176.35 175.68 3isn n ASP 121 N 2.83 0.09 -0.31 3.68 2.03 -1.26 -4.81 116.55 118.80 3isn n ASP 121 Ca -0.14 0.71 -0.05 0.00 0.52 0.00 0.00 54.79 55.83 3isn n ASP 121 Cb 0.53 -0.56 0.08 0.00 -0.72 0.00 0.00 41.12 40.45 3isn n ASP 121 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 3isn h GLU 122 N 1.98 1.21 0.00 -0.67 4.22 -1.95 -2.52 114.58 116.84 3isn h GLU 122 Ca -0.30 -0.16 0.00 0.00 0.08 0.00 0.00 59.36 58.98 3isn h GLU 122 Cb 0.86 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3isn h GLU 122 CO 0.42 0.90 0.00 -0.25 -2.18 0.00 0.00 179.01 177.91 3isn n ASP 123 N -4.34 0.00 -0.00 1.04 8.00 -1.26 -3.08 116.55 116.91 3isn n ASP 123 Ca 0.09 -0.16 0.07 0.00 0.71 0.00 0.00 54.79 55.49 3isn n ASP 123 Cb 0.12 -0.23 -0.09 0.00 -0.02 0.00 0.00 41.12 40.90 3isn n ASP 123 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3isn n PHE 124 N -1.23 0.00 -0.32 1.24 7.35 -0.96 -4.55 117.46 118.99 3isn n PHE 124 Ca 0.12 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.81 3isn n PHE 124 Cb 0.16 -0.09 0.18 0.00 0.35 0.00 0.00 39.48 40.08 3isn n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3isn h ARG 125 N 0.00 1.14 -0.65 -4.13 3.08 -1.46 -2.77 114.38 109.59 3isn h ARG 125 Ca 0.00 -0.07 0.13 0.00 0.07 0.00 0.00 59.98 60.11 3isn h ARG 125 Cb 0.43 -0.26 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 3isn h ARG 125 CO 0.00 0.75 0.44 1.57 -1.07 0.00 0.00 179.97 181.66 3isn h LYS 126 N 1.17 0.32 0.00 0.04 2.10 -1.82 0.24 116.57 118.62 3isn h LYS 126 Ca 0.36 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.99 3isn h LYS 126 Cb -0.02 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.24 3isn h LYS 126 CO -0.10 0.21 0.00 0.66 -2.00 0.00 0.00 179.45 178.22 3isn n TYR 127 N -4.46 0.00 -0.00 0.07 4.01 -1.04 -3.03 117.16 112.70 3isn n TYR 127 Ca 0.12 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.91 3isn n TYR 127 Cb 0.48 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.62 3isn n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3isn n THR 128 N -0.77 0.73 -1.67 -0.72 -2.24 0.83 -4.71 114.28 105.73 3isn n THR 128 Ca 0.08 -0.87 -0.41 0.00 -2.27 0.00 0.00 64.05 60.58 3isn n THR 128 Cb 0.04 0.69 0.01 0.00 -2.10 0.00 0.00 70.33 68.96 3isn n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3isn n ALA 129 N 0.44 0.96 -2.71 6.98 0.00 -1.17 -4.39 120.51 120.62 3isn n ALA 129 Ca 0.09 0.27 -0.09 0.00 0.00 0.00 0.00 53.44 53.71 3isn n ALA 129 Cb 0.36 -2.21 -0.07 0.00 0.00 0.00 0.00 19.45 17.54 3isn n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3isn s PHE 130 N -1.20 0.23 -0.09 0.00 -0.71 -0.14 -1.34 117.98 114.74 3isn s PHE 130 Ca 0.61 -0.62 -0.02 0.00 -1.04 0.00 0.00 56.93 55.86 3isn s PHE 130 Cb -0.54 -0.01 0.04 0.00 -1.21 0.00 0.00 43.02 41.30 3isn s PHE 130 CO 0.58 -0.66 0.03 0.99 -1.34 0.00 0.00 175.22 174.82 3isn s THR 131 N -3.91 0.25 -0.09 -4.49 2.01 -1.26 -1.62 115.64 106.54 3isn s THR 131 Ca 0.11 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.87 3isn s THR 131 Cb 0.04 -0.53 -0.02 0.00 0.01 0.00 0.00 72.50 71.99 3isn s THR 131 CO -0.05 0.12 1.15 -0.63 -0.69 0.00 0.00 174.62 174.52 3isn s ILE 132 N 2.01 4.41 0.70 1.82 1.01 -0.35 -4.72 121.20 126.08 3isn s ILE 132 Ca 0.04 1.72 -0.11 0.00 0.00 0.00 0.00 60.65 62.29 3isn s ILE 132 Cb -0.13 -4.10 0.01 0.00 0.01 0.00 0.00 42.46 38.24 3isn s ILE 132 CO -0.06 -0.02 1.06 -2.16 0.00 0.00 0.00 174.94 173.77 3isn s PRO 133 N 2.33 2.89 0.08 2.79 0.05 -1.26 -2.36 135.00 139.51 3isn s PRO 133 Ca 0.53 0.84 0.06 0.00 0.05 0.00 0.00 61.00 62.48 3isn s PRO 133 Cb -0.22 -1.99 -0.04 0.00 0.05 0.00 0.00 34.50 32.30 3isn s PRO 133 CO 0.19 -1.10 -0.07 -1.54 0.05 0.00 0.00 177.00 174.53 3isn s SER 134 N -3.91 4.56 0.28 6.66 1.04 -1.26 -4.90 113.70 116.16 3isn s SER 134 Ca 0.58 -0.29 -0.30 0.00 0.48 0.00 0.00 55.95 56.42 3isn s SER 134 Cb -0.13 -0.96 -0.11 0.00 0.10 0.00 0.00 66.02 64.92 3isn s SER 134 CO 0.55 0.20 1.55 -0.63 0.98 0.00 0.00 173.24 175.89 3isn s ILE 135 N -1.18 2.23 -0.34 -1.02 1.01 -1.26 -1.69 121.20 118.96 3isn s ILE 135 Ca 0.21 0.20 0.00 0.00 0.00 0.00 0.00 60.65 61.06 3isn s ILE 135 Cb -0.11 -3.13 0.00 0.00 0.01 0.00 0.00 42.46 39.23 3isn s ILE 135 CO 0.13 0.03 0.00 -3.20 0.00 0.00 0.00 174.94 171.90 3isn n ASN 136 N 2.18 -1.07 -2.33 3.58 5.15 -1.26 -2.20 115.26 119.32 3isn n ASN 136 Ca 0.08 0.15 -0.17 0.00 -0.60 0.00 0.00 54.58 54.04 3isn n ASN 136 Cb 0.38 -1.28 -0.01 0.00 -0.53 0.00 0.00 39.78 38.33 3isn n ASN 136 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3isn n ASN 137 N 0.16 -4.87 0.19 1.20 3.02 -0.68 -4.91 115.26 109.37 3isn n ASN 137 Ca -0.03 0.12 -0.07 0.00 -0.03 0.00 0.00 54.58 54.56 3isn n ASN 137 Cb 0.20 -4.11 -0.04 0.00 -0.61 0.00 0.00 39.78 35.22 3isn n ASN 137 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3isn h GLU 138 N 0.00 -0.47 -7.17 3.52 4.39 -1.68 -3.42 114.58 109.75 3isn h GLU 138 Ca -0.39 0.03 -0.47 0.00 0.34 0.00 0.00 59.36 58.87 3isn h GLU 138 Cb 1.27 0.11 0.21 0.00 -0.10 0.00 0.00 28.75 30.24 3isn h GLU 138 CO 0.47 -0.31 0.06 2.41 -1.16 0.00 0.00 179.01 180.48 3isn n THR 139 N -3.33 0.00 -3.63 1.13 -1.04 -1.26 -5.10 114.28 101.05 3isn n THR 139 Ca -0.06 -0.28 -0.20 0.00 -2.04 0.00 0.00 64.05 61.47 3isn n THR 139 Cb 0.19 -0.99 -0.02 0.00 -1.82 0.00 0.00 70.33 67.69 3isn n THR 139 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3isn s PRO 140 N -4.47 2.83 0.47 -2.82 0.05 -1.26 -4.76 135.00 125.03 3isn s PRO 140 Ca 0.68 -1.23 -0.22 0.00 0.05 0.00 0.00 61.00 60.27 3isn s PRO 140 Cb -0.24 -2.59 -0.10 0.00 0.05 0.00 0.00 34.50 31.62 3isn s PRO 140 CO 0.63 0.03 0.88 0.41 0.05 0.00 0.00 177.00 179.00 3isn n GLY 141 N -1.50 -0.56 3.61 0.56 0.00 -1.26 -4.79 105.19 101.24 3isn n GLY 141 Ca -0.00 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3isn n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3isn s ILE 142 N -1.39 4.70 -0.12 -0.61 -1.09 -1.00 -4.91 121.20 116.79 3isn s ILE 142 Ca 0.66 1.17 -0.06 0.00 -2.23 0.00 0.00 60.65 60.18 3isn s ILE 142 Cb -0.53 -4.23 -0.04 0.00 -1.58 0.00 0.00 42.46 36.08 3isn s ILE 142 CO 0.55 -0.38 0.12 -0.13 -1.23 0.00 0.00 174.94 173.86 3isn s ARG 143 N 3.18 3.39 0.06 2.79 0.52 -1.26 -1.22 118.95 126.41 3isn s ARG 143 Ca 0.35 -0.18 -0.01 0.00 -0.52 0.00 0.00 55.73 55.37 3isn s ARG 143 Cb -0.13 -3.13 -0.04 0.00 0.52 0.00 0.00 34.95 32.17 3isn s ARG 143 CO 0.15 0.75 -0.04 0.71 0.02 0.00 0.00 175.30 176.90 3isn s TYR 144 N -0.96 0.57 0.29 -0.53 2.02 -0.64 -2.16 117.35 115.95 3isn s TYR 144 Ca 0.14 -1.03 0.04 0.00 -0.37 0.00 0.00 57.07 55.85 3isn s TYR 144 Cb -0.12 -0.40 -0.06 0.00 -0.40 0.00 0.00 41.96 40.98 3isn s TYR 144 CO 0.04 -0.34 0.04 1.14 -1.57 0.00 0.00 175.55 174.86 3isn s GLN 145 N -3.85 1.55 0.12 -0.62 -2.07 -0.69 -0.97 119.66 113.13 3isn s GLN 145 Ca 0.07 -1.84 -0.11 0.00 -1.82 0.00 0.00 55.36 51.66 3isn s GLN 145 Cb 0.07 -0.75 -0.06 0.00 -1.09 0.00 0.00 33.01 31.18 3isn s GLN 145 CO -0.09 -0.17 0.46 0.71 -1.32 0.00 0.00 175.29 174.88 3isn s TYR 146 N -3.37 3.57 -0.65 9.60 1.51 -1.26 -1.49 117.35 125.27 3isn s TYR 146 Ca 0.35 0.88 0.14 0.00 -1.01 0.00 0.00 57.07 57.43 3isn s TYR 146 Cb 0.08 -2.24 -0.15 0.00 -0.11 0.00 0.00 41.96 39.54 3isn s TYR 146 CO 0.14 0.46 0.59 0.09 -1.11 0.00 0.00 175.55 175.72 3isn n ASN 147 N 0.75 0.65 -4.28 2.29 3.02 -0.28 -4.67 115.26 112.75 3isn n ASN 147 Ca -0.06 -0.83 -0.15 0.00 -0.03 0.00 0.00 54.58 53.51 3isn n ASN 147 Cb 0.52 1.00 -0.10 0.00 -0.61 0.00 0.00 39.78 40.59 3isn n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3isn s VAL 148 N -2.31 1.12 -0.48 2.41 -7.23 -1.23 -1.16 120.40 111.53 3isn s VAL 148 Ca 0.05 -2.05 -0.46 0.00 -1.81 0.00 0.00 61.98 57.71 3isn s VAL 148 Cb 0.10 -2.03 -0.19 0.00 0.56 0.00 0.00 36.38 34.82 3isn s VAL 148 CO 0.57 -0.59 1.69 0.18 -0.31 0.00 0.00 175.10 176.64 3isn n LEU 149 N -0.28 1.29 -4.84 1.32 4.77 -0.80 -4.62 117.00 113.83 3isn n LEU 149 Ca -0.08 1.10 -0.33 0.00 -0.03 0.00 0.00 56.01 56.67 3isn n LEU 149 Cb 0.62 -0.91 -0.06 0.00 -2.33 0.00 0.00 43.42 40.73 3isn n LEU 149 CO 0.34 -0.79 0.45 -2.84 -1.33 0.00 0.00 177.39 173.22 3isn s PRO 150 N 3.48 4.05 0.36 3.23 0.02 -1.26 -3.93 135.00 140.94 3isn s PRO 150 Ca 1.06 0.74 -0.28 0.00 0.02 0.00 0.00 61.00 62.54 3isn s PRO 150 Cb -1.45 -2.44 -0.11 0.00 0.02 0.00 0.00 34.50 30.52 3isn s PRO 150 CO 0.78 0.16 1.48 -0.65 -0.33 0.00 0.00 177.00 178.43 3isn s GLN 151 N -2.91 4.15 0.00 5.54 -0.21 -1.26 -3.42 119.66 121.54 3isn s GLN 151 Ca 0.54 2.52 0.00 0.00 0.02 0.00 0.00 55.36 58.44 3isn s GLN 151 Cb -0.11 -2.99 0.00 0.00 1.00 0.00 0.00 33.01 30.91 3isn s GLN 151 CO 0.17 -0.50 0.00 0.41 -2.12 0.00 0.00 175.29 173.25 3isn n GLY 152 N 0.79 3.25 3.73 3.09 0.00 -1.26 -4.75 105.19 110.03 3isn n GLY 152 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3isn n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3isn s TRP 153 N -2.66 3.81 0.22 1.61 -0.00 -1.22 -4.71 118.94 116.00 3isn s TRP 153 Ca 0.00 1.79 0.28 0.00 -0.00 0.00 0.00 56.10 58.17 3isn s TRP 153 Cb 0.00 -3.07 1.21 0.00 -0.00 0.00 0.00 33.47 31.62 3isn s TRP 153 CO 0.00 0.17 1.95 1.57 -0.00 0.00 0.00 176.95 180.63 3isn h LYS 154 N 5.51 0.00 -0.48 5.86 2.10 -1.92 -2.32 116.57 125.33 3isn h LYS 154 Ca -0.43 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.20 3isn h LYS 154 Cb 1.21 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.52 3isn h LYS 154 CO 0.72 0.14 0.20 0.78 -2.00 0.00 0.00 179.45 179.29 3isn h GLY 155 N 1.66 0.72 0.62 0.07 0.00 -1.93 -3.33 103.07 100.87 3isn h GLY 155 Ca -0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 3isn h GLY 155 CO 0.02 0.33 -0.39 1.76 0.00 0.00 0.00 176.54 178.26 3isn h SER 156 N 0.67 -1.00 -0.67 0.19 0.02 -1.68 -1.44 113.55 109.64 3isn h SER 156 Ca 0.16 0.06 0.19 0.00 -0.84 0.00 0.00 61.79 61.37 3isn h SER 156 Cb 0.13 0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 3isn h SER 156 CO -0.02 -0.59 0.49 -0.65 -1.14 0.00 0.00 176.83 174.92 3isn h PRO 157 N -0.95 0.00 0.18 3.45 0.11 -1.73 -1.45 132.00 131.61 3isn h PRO 157 Ca -0.08 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.71 3isn h PRO 157 Cb 0.76 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.89 3isn h PRO 157 CO 0.07 0.00 -1.46 0.00 -0.21 0.00 0.00 178.00 176.41 3isn h ALA 158 N 1.64 0.05 0.00 -0.75 0.00 -1.58 -2.88 119.26 115.75 3isn h ALA 158 Ca 0.32 -0.96 -0.10 0.00 0.00 0.00 0.00 54.91 54.16 3isn h ALA 158 Cb 1.30 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 3isn h ALA 158 CO -0.00 0.92 -0.49 0.82 0.00 0.00 0.00 179.25 180.50 3isn h ILE 159 N 0.10 1.11 -0.20 0.00 2.04 -0.79 -3.15 117.51 116.63 3isn h ILE 159 Ca -0.23 -1.81 0.00 0.00 1.00 0.00 0.00 64.86 63.82 3isn h ILE 159 Cb 2.07 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 40.19 3isn h ILE 159 CO 0.22 0.48 0.00 0.33 0.00 0.00 0.00 178.15 179.17 3isn n PHE 160 N -3.62 0.25 0.13 1.37 7.35 -0.59 -4.53 117.46 117.82 3isn n PHE 160 Ca -0.01 -0.12 -0.14 0.00 -0.76 0.00 0.00 57.45 56.43 3isn n PHE 160 Cb 0.57 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 40.33 3isn n PHE 160 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 3isn h GLN 161 N 2.71 -0.56 -0.13 -4.13 4.15 -1.46 -0.72 115.11 114.98 3isn h GLN 161 Ca 0.00 0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.45 3isn h GLN 161 Cb 0.59 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.40 3isn h GLN 161 CO 0.00 -0.37 0.02 0.66 -1.93 0.00 0.00 178.83 177.21 3isn h SER 162 N -0.58 0.16 -0.35 -0.69 4.64 -1.84 -0.99 113.55 113.89 3isn h SER 162 Ca 0.02 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.18 3isn h SER 162 Cb 0.60 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 3isn h SER 162 CO -0.18 0.18 -0.36 0.28 -0.87 0.00 0.00 176.83 175.88 3isn h SER 163 N 0.18 0.92 0.22 4.97 0.02 -1.73 -3.13 113.55 115.00 3isn h SER 163 Ca 0.04 -0.47 -0.01 0.00 -0.84 0.00 0.00 61.79 60.51 3isn h SER 163 Cb 0.09 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.37 3isn h SER 163 CO -0.00 1.20 -0.11 -0.03 -1.14 0.00 0.00 176.83 176.75 3isn h MET 164 N 0.66 -0.29 -0.35 3.45 -1.53 0.11 -0.47 114.93 116.51 3isn h MET 164 Ca 0.05 0.02 0.04 0.00 -3.44 0.00 0.00 59.70 56.37 3isn h MET 164 Cb 0.95 0.07 -0.06 0.00 -0.55 0.00 0.00 31.60 32.00 3isn h MET 164 CO 0.09 -0.18 -0.41 1.15 0.14 0.00 0.00 176.91 177.70 3isn h THR 165 N -0.31 0.00 -0.83 -0.77 2.02 -1.38 -0.26 112.91 111.38 3isn h THR 165 Ca -0.03 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.32 3isn h THR 165 Cb 0.24 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.54 3isn h THR 165 CO 0.05 0.00 0.35 0.11 0.37 0.00 0.00 175.52 176.40 3isn h LYS 166 N -0.26 0.44 -0.01 6.66 1.57 -1.51 0.16 116.57 123.62 3isn h LYS 166 Ca 0.06 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 3isn h LYS 166 Cb 0.42 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 3isn h LYS 166 CO -0.46 0.29 -0.36 0.82 -0.57 0.00 0.00 179.45 179.16 3isn h ILE 167 N 0.45 1.26 -0.02 1.86 2.04 0.10 -3.12 117.51 120.08 3isn h ILE 167 Ca 0.48 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 65.08 3isn h ILE 167 Cb 0.79 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 3isn h ILE 167 CO -0.45 0.36 -0.06 0.18 0.00 0.00 0.00 178.15 178.18 3isn n LEU 168 N -4.10 2.63 0.12 1.44 4.77 -0.22 -4.53 117.00 117.09 3isn n LEU 168 Ca -0.02 -0.97 -0.13 0.00 -0.03 0.00 0.00 56.01 54.87 3isn n LEU 168 Cb 0.40 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.43 3isn n LEU 168 CO 0.39 0.45 0.76 -0.08 -1.33 0.00 0.00 177.39 177.59 3isn h GLU 169 N 3.85 -0.32 -0.75 3.23 4.57 -0.65 -2.59 114.58 121.93 3isn h GLU 169 Ca 0.00 0.02 0.14 0.00 -1.18 0.00 0.00 59.36 58.34 3isn h GLU 169 Cb 0.85 0.07 -0.14 0.00 -0.16 0.00 0.00 28.75 29.37 3isn h GLU 169 CO 0.00 -0.21 -0.28 -1.35 -1.18 0.00 0.00 179.01 175.99 3isn h PRO 170 N -0.33 -0.06 0.00 0.92 0.11 -1.80 -2.20 132.00 128.65 3isn h PRO 170 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 3isn h PRO 170 Cb 0.32 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.44 3isn h PRO 170 CO -0.05 -0.04 0.00 0.35 -0.21 0.00 0.00 178.00 178.05 3isn h PHE 171 N -0.06 0.00 0.00 0.65 3.04 -1.79 -1.91 116.94 116.87 3isn h PHE 171 Ca 0.32 0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.20 3isn h PHE 171 Cb 0.57 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.07 3isn h PHE 171 CO -0.67 0.00 -1.11 0.87 -2.02 0.00 0.00 178.31 175.38 3isn h LYS 172 N 0.00 0.00 0.12 1.11 1.57 -1.04 -3.09 116.57 115.23 3isn h LYS 172 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3isn h LYS 172 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 3isn h LYS 172 CO 0.00 0.14 -0.06 -0.22 -0.57 0.00 0.00 179.45 178.74 3isn h LYS 173 N 0.00 -0.16 0.00 3.15 3.64 -0.77 -2.97 116.57 119.47 3isn h LYS 173 Ca -0.07 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3isn h LYS 173 Cb 1.25 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 3isn h LYS 173 CO 0.02 0.19 0.00 1.04 -2.27 0.00 0.00 179.45 178.43 3isn n GLN 174 N -5.00 0.48 -2.79 1.90 6.02 -1.03 -4.14 117.38 112.82 3isn n GLN 174 Ca -0.09 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.87 3isn n GLN 174 Cb 0.22 -1.49 0.01 0.00 1.02 0.00 0.00 30.24 29.99 3isn n GLN 174 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3isn s ASN 175 N -2.00 -1.39 0.21 1.08 0.01 -1.13 -5.01 114.94 106.71 3isn s ASN 175 Ca 0.23 -1.59 0.26 0.00 -0.71 0.00 0.00 52.86 51.05 3isn s ASN 175 Cb 0.11 1.82 0.80 0.00 0.41 0.00 0.00 41.25 44.39 3isn s ASN 175 CO 0.18 -0.06 1.77 -0.81 -1.51 0.00 0.00 177.10 176.67 3isn n PRO 176 N 3.04 0.26 -0.50 -0.60 -0.05 -1.16 -3.44 135.00 132.54 3isn n PRO 176 Ca 0.17 0.21 0.05 0.00 -0.05 0.00 0.00 63.50 63.89 3isn n PRO 176 Cb 0.57 -1.80 0.25 0.00 -0.05 0.00 0.00 33.50 32.47 3isn n PRO 176 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 175.50 175.20 3isn n ASP 177 N -2.26 3.72 -4.45 3.54 8.00 -1.26 -4.82 116.55 119.02 3isn n ASP 177 Ca 0.06 -2.45 -0.33 0.00 0.71 0.00 0.00 54.79 52.77 3isn n ASP 177 Cb 0.43 -0.55 -0.13 0.00 -0.02 0.00 0.00 41.12 40.85 3isn n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3isn s ILE 178 N -1.95 3.43 -0.15 0.53 1.09 -1.22 -4.47 121.20 118.46 3isn s ILE 178 Ca 0.35 -0.54 -0.06 0.00 -1.10 0.00 0.00 60.65 59.30 3isn s ILE 178 Cb 0.25 -2.45 -0.04 0.00 -1.06 0.00 0.00 42.46 39.15 3isn s ILE 178 CO 0.13 0.53 0.07 -0.69 -0.10 0.00 0.00 174.94 174.88 3isn s VAL 179 N 0.13 4.90 -0.05 2.92 1.01 -0.38 -4.97 120.40 123.96 3isn s VAL 179 Ca -0.04 -0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.95 3isn s VAL 179 Cb -0.14 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.09 3isn s VAL 179 CO 0.04 0.53 -0.10 -0.63 0.00 0.00 0.00 175.10 174.94 3isn s ILE 180 N -0.25 0.93 -0.02 2.22 1.01 -1.26 -0.96 121.20 122.88 3isn s ILE 180 Ca 0.08 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.35 3isn s ILE 180 Cb -0.12 -0.86 0.02 0.00 0.01 0.00 0.00 42.46 41.51 3isn s ILE 180 CO 0.01 0.30 0.01 -0.47 0.00 0.00 0.00 174.94 174.80 3isn s TYR 181 N 0.56 0.15 -0.22 3.97 5.04 -0.64 -4.94 117.35 121.27 3isn s TYR 181 Ca -0.11 0.05 -0.09 0.00 -2.44 0.00 0.00 57.07 54.49 3isn s TYR 181 Cb -0.13 -0.26 -0.04 0.00 0.35 0.00 0.00 41.96 41.87 3isn s TYR 181 CO 0.02 -0.08 0.11 -1.14 -1.34 0.00 0.00 175.55 173.12 3isn s GLN 182 N 0.80 3.94 -0.20 4.97 0.74 -1.26 0.58 119.66 129.23 3isn s GLN 182 Ca -0.07 -0.34 0.01 0.00 0.05 0.00 0.00 55.36 55.00 3isn s GLN 182 Cb -0.10 -3.38 0.05 0.00 1.10 0.00 0.00 33.01 30.67 3isn s GLN 182 CO -0.02 0.07 -0.09 -0.47 -0.55 0.00 0.00 175.29 174.23 3isn s TYR 183 N 0.97 2.34 0.00 1.67 5.04 -0.77 -4.78 117.35 121.83 3isn s TYR 183 Ca 0.06 -1.57 0.00 0.00 -2.44 0.00 0.00 57.07 53.12 3isn s TYR 183 Cb -0.14 -1.59 0.00 0.00 0.35 0.00 0.00 41.96 40.58 3isn s TYR 183 CO 0.03 -0.73 0.00 -1.33 -1.34 0.00 0.00 175.55 172.18 3isn n MET 184 N 4.70 0.00 0.00 4.97 2.81 -1.26 -1.23 117.12 127.11 3isn n MET 184 Ca -0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.75 3isn n MET 184 Cb 0.46 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.97 3isn n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3isn n ASP 185 N 3.92 0.09 -4.33 7.83 9.92 -1.26 -4.74 116.55 127.98 3isn n ASP 185 Ca 0.00 -1.81 -0.21 0.00 -0.53 0.00 0.00 54.79 52.24 3isn n ASP 185 Cb 0.00 -0.04 -0.11 0.00 -0.64 0.00 0.00 41.12 40.33 3isn n ASP 185 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 3isn s ASP 186 N -1.00 2.63 -0.10 -2.24 1.01 -0.36 -1.76 116.67 114.86 3isn s ASP 186 Ca 0.00 -0.87 0.01 0.00 0.71 0.00 0.00 52.55 52.40 3isn s ASP 186 Cb 0.00 -0.15 0.02 0.00 1.01 0.00 0.00 42.92 43.80 3isn s ASP 186 CO 0.00 -0.05 -0.13 -0.22 0.21 0.00 0.00 175.17 174.98 3isn s LEU 187 N -2.71 1.59 -0.32 1.23 2.96 -0.26 -1.84 118.68 119.33 3isn s LEU 187 Ca 0.16 -0.36 -0.08 0.00 -0.22 0.00 0.00 54.13 53.63 3isn s LEU 187 Cb -0.05 -0.96 0.02 0.00 0.50 0.00 0.00 46.19 45.70 3isn s LEU 187 CO 0.06 -0.01 0.11 -0.31 -1.32 0.00 0.00 176.35 174.89 3isn s TYR 188 N 1.03 3.19 -0.25 5.38 1.51 0.20 -1.31 117.35 127.10 3isn s TYR 188 Ca -0.07 -1.04 -0.01 0.00 -1.01 0.00 0.00 57.07 54.94 3isn s TYR 188 Cb -0.15 -2.30 0.03 0.00 -0.11 0.00 0.00 41.96 39.44 3isn s TYR 188 CO -0.01 -0.61 -0.07 0.08 -1.11 0.00 0.00 175.55 173.82 3isn s VAL 189 N 1.50 2.73 -0.13 0.71 1.01 -0.24 -1.61 120.40 124.37 3isn s VAL 189 Ca 0.02 -1.12 0.02 0.00 0.00 0.00 0.00 61.98 60.90 3isn s VAL 189 Cb -0.18 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.81 3isn s VAL 189 CO 0.04 0.18 -0.17 -0.83 0.00 0.00 0.00 175.10 174.31 3isn s GLY 190 N 1.29 1.17 0.17 4.51 0.00 -0.14 -1.31 107.32 113.01 3isn s GLY 190 Ca -0.01 -0.90 0.10 0.00 0.00 0.00 0.00 44.72 43.92 3isn s GLY 190 CO -0.05 0.22 -0.22 -1.35 0.00 0.00 0.00 173.10 171.71 3isn s SER 191 N 1.06 3.06 -0.96 1.64 1.04 -1.00 -1.25 113.70 117.28 3isn s SER 191 Ca -0.04 -0.84 -0.01 0.00 0.48 0.00 0.00 55.95 55.54 3isn s SER 191 Cb -0.15 -0.21 0.33 0.00 0.10 0.00 0.00 66.02 66.10 3isn s SER 191 CO -0.04 0.06 1.85 -0.90 0.98 0.00 0.00 173.24 175.19 3isn n ASP 192 N 0.38 7.31 -0.06 7.02 5.68 -1.26 -2.44 116.55 133.19 3isn n ASP 192 Ca -0.14 -3.73 -0.05 0.00 -0.50 0.00 0.00 54.79 50.37 3isn n ASP 192 Cb 0.56 -1.12 -0.02 0.00 -1.14 0.00 0.00 41.12 39.40 3isn n ASP 192 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3isn n LEU 193 N -0.20 1.40 0.00 -2.12 4.77 -1.26 -4.82 117.00 114.77 3isn n LEU 193 Ca 0.48 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.85 3isn n LEU 193 Cb 0.26 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 40.62 3isn n LEU 193 CO 0.51 -0.40 0.00 1.21 -1.33 0.00 0.00 177.39 177.38 3isn n GLU 194 N -3.99 0.00 -0.30 3.23 0.00 -1.26 -4.85 120.64 113.47 3isn n GLU 194 Ca -0.08 0.00 0.10 0.00 0.00 0.00 0.00 57.16 57.18 3isn n GLU 194 Cb 0.30 0.00 0.21 0.00 0.00 0.00 0.00 31.44 31.94 3isn n GLU 194 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.13 178.64 3isn n ILE 195 N 0.00 -0.36 0.01 6.31 0.13 -1.26 0.11 119.36 124.31 3isn n ILE 195 Ca 0.00 1.89 -0.19 0.00 -1.10 0.00 0.00 62.75 63.34 3isn n ILE 195 Cb 0.00 -2.71 -0.14 0.00 -0.84 0.00 0.00 39.64 35.95 3isn n ILE 195 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 3isn h GLY 196 N 0.00 0.26 0.10 4.50 0.00 -1.98 -1.22 103.07 104.73 3isn h GLY 196 Ca 0.48 -0.65 0.01 0.00 0.00 0.00 0.00 47.33 47.17 3isn h GLY 196 CO -0.82 0.57 -0.53 -1.61 0.00 0.00 0.00 176.54 174.15 3isn h GLN 197 N -0.50 -0.72 -0.14 4.80 4.15 -0.95 -1.85 115.11 119.91 3isn h GLN 197 Ca -0.16 0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.34 3isn h GLN 197 Cb 1.54 0.16 -0.07 0.00 0.21 0.00 0.00 27.48 29.33 3isn h GLN 197 CO 0.09 -0.48 -0.51 1.25 -1.93 0.00 0.00 178.83 177.25 3isn h HIS 198 N -0.74 -1.51 -0.70 3.99 2.76 0.74 -2.94 115.15 116.74 3isn h HIS 198 Ca -0.00 0.06 0.09 0.00 -2.20 0.00 0.00 60.37 58.31 3isn h HIS 198 Cb 0.76 0.68 -0.05 0.00 1.55 0.00 0.00 27.41 30.35 3isn h HIS 198 CO -0.47 -0.53 0.46 0.00 -1.30 0.00 0.00 177.93 176.09 3isn h ARG 199 N -0.56 0.59 -0.55 5.26 3.08 -0.98 0.24 114.38 121.47 3isn h ARG 199 Ca 0.05 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 3isn h ARG 199 Cb 0.67 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.56 3isn h ARG 199 CO -0.44 0.39 0.29 1.79 -1.07 0.00 0.00 179.97 180.94 3isn h THR 200 N 0.61 1.17 0.00 2.04 1.35 -1.16 -1.83 112.91 115.09 3isn h THR 200 Ca 0.32 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 3isn h THR 200 Cb 0.43 0.44 0.00 0.00 -1.73 0.00 0.00 68.15 67.29 3isn h THR 200 CO -0.11 0.19 0.00 0.11 -0.25 0.00 0.00 175.52 175.46 3isn h LYS 201 N 0.76 0.00 -0.00 4.72 1.57 -0.46 0.19 116.57 123.35 3isn h LYS 201 Ca 0.19 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3isn h LYS 201 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3isn h LYS 201 CO -0.03 0.00 -0.02 0.82 -0.57 0.00 0.00 179.45 179.65 3isn h ILE 202 N 0.00 1.58 -0.81 1.86 1.08 -1.06 -0.41 117.51 119.74 3isn h ILE 202 Ca 0.00 -1.71 0.01 0.00 -0.39 0.00 0.00 64.86 62.76 3isn h ILE 202 Cb 0.51 2.73 -0.04 0.00 -3.07 0.00 0.00 36.82 36.95 3isn h ILE 202 CO 0.00 0.45 0.53 -0.08 -0.69 0.00 0.00 178.15 178.36 3isn h GLU 203 N -0.70 1.07 0.16 2.37 4.57 -1.30 0.34 114.58 121.09 3isn h GLU 203 Ca -0.00 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 3isn h GLU 203 Cb 0.74 -0.24 -0.00 0.00 -0.16 0.00 0.00 28.75 29.09 3isn h GLU 203 CO 0.00 0.72 -0.10 1.49 -1.18 0.00 0.00 179.01 179.94 3isn h GLU 204 N 1.10 -0.24 -0.37 1.92 4.81 -0.65 0.59 114.58 121.74 3isn h GLU 204 Ca 0.30 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.49 3isn h GLU 204 Cb -0.12 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 3isn h GLU 204 CO -0.06 -0.16 0.02 1.25 -0.73 0.00 0.00 179.01 179.33 3isn h LEU 205 N -0.25 0.53 -0.51 1.64 5.85 -0.58 -1.68 115.31 120.32 3isn h LEU 205 Ca -0.01 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.56 3isn h LEU 205 Cb 0.21 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 3isn h LEU 205 CO 0.01 0.59 0.11 -0.09 -0.34 0.00 0.00 178.44 178.72 3isn h ARG 206 N 0.55 0.82 -0.56 1.25 2.43 0.03 0.30 114.38 119.20 3isn h ARG 206 Ca 0.12 -0.20 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 3isn h ARG 206 Cb 0.32 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 3isn h ARG 206 CO 0.01 0.79 0.26 1.96 -1.51 0.00 0.00 179.97 181.48 3isn h GLN 207 N 0.70 0.81 -0.55 0.20 1.08 -0.60 0.47 115.11 117.23 3isn h GLN 207 Ca 0.16 -0.13 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 3isn h GLN 207 Cb 0.35 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.61 3isn h GLN 207 CO 0.00 0.67 0.36 1.25 -0.95 0.00 0.00 178.83 180.17 3isn h HIS 208 N 0.76 0.70 -0.59 2.96 2.76 -0.94 -0.92 115.15 119.88 3isn h HIS 208 Ca 0.19 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.31 3isn h HIS 208 Cb 0.14 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 28.84 3isn h HIS 208 CO -0.00 0.45 0.11 -0.07 -1.30 0.00 0.00 177.93 177.12 3isn h LEU 209 N 0.75 0.89 -1.06 0.26 3.38 -0.43 -2.79 115.31 116.31 3isn h LEU 209 Ca 0.20 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3isn h LEU 209 Cb -0.07 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 3isn h LEU 209 CO -0.04 0.89 0.19 0.25 0.09 0.00 0.00 178.44 179.82 3isn h LEU 210 N 0.90 0.79 0.00 1.67 5.85 0.50 -1.22 115.31 123.80 3isn h LEU 210 Ca 0.19 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3isn h LEU 210 Cb 0.38 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.20 3isn h LEU 210 CO 0.01 0.74 0.00 0.54 -0.34 0.00 0.00 178.44 179.39 3isn n ARG 211 N -4.30 0.73 -0.30 1.25 1.74 -0.40 -3.21 116.66 112.17 3isn n ARG 211 Ca 0.05 0.01 0.08 0.00 -0.77 0.00 0.00 57.85 57.21 3isn n ARG 211 Cb 0.19 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.34 3isn n ARG 211 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3isn n TRP 212 N -1.03 0.63 0.00 -1.55 8.01 -0.50 -4.94 117.44 118.07 3isn n TRP 212 Ca 0.18 -0.81 0.00 0.00 -1.31 0.00 0.00 57.50 55.56 3isn n TRP 212 Cb 0.09 -0.22 0.00 0.00 -2.01 0.00 0.00 31.31 29.18 3isn n TRP 212 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3isn n GLY 213 N -0.49 3.15 3.57 6.99 0.00 -1.20 -4.96 105.19 112.26 3isn n GLY 213 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 3isn n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3isn s LEU 214 N 0.00 3.40 0.52 0.99 1.02 -0.97 -4.87 118.68 118.78 3isn s LEU 214 Ca 0.00 -1.57 -0.23 0.00 0.02 0.00 0.00 54.13 52.36 3isn s LEU 214 Cb 0.00 -2.57 -0.06 0.00 0.02 0.00 0.00 46.19 43.58 3isn s LEU 214 CO 0.00 -2.08 1.35 0.35 0.02 0.00 0.00 176.35 175.99 3isn n THR 215 N 7.21 3.54 -3.62 5.49 -2.24 -1.26 -2.98 114.28 120.42 3isn n THR 215 Ca 0.41 -0.50 -0.27 0.00 -2.27 0.00 0.00 64.05 61.42 3isn n THR 215 Cb 0.48 -1.67 -0.16 0.00 -2.10 0.00 0.00 70.33 66.88 3isn n THR 215 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3isn s THR 216 N -1.27 0.09 0.01 4.28 2.01 -1.26 -4.58 115.64 114.92 3isn s THR 216 Ca 0.69 -0.49 -0.11 0.00 0.31 0.00 0.00 61.69 62.08 3isn s THR 216 Cb -0.43 -0.85 -0.06 0.00 0.01 0.00 0.00 72.50 71.17 3isn s THR 216 CO 0.51 -0.43 0.29 -2.65 -0.69 0.00 0.00 174.62 171.65 3isn n PRO 217 N 5.20 0.00 -3.90 4.92 -0.02 -1.26 -5.05 135.00 134.89 3isn n PRO 217 Ca -0.07 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.26 3isn n PRO 217 Cb 0.46 -0.42 -0.16 0.00 -0.02 0.00 0.00 33.50 33.36 3isn n PRO 217 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3isn s ASP 218 N -0.07 0.27 0.00 2.55 3.68 -1.26 -4.94 116.67 116.90 3isn s ASP 218 Ca 0.26 -0.01 0.00 0.00 2.13 0.00 0.00 52.55 54.93 3isn s ASP 218 Cb -0.36 -0.12 0.00 0.00 -1.45 0.00 0.00 42.92 40.98 3isn s ASP 218 CO 0.17 -0.07 0.00 0.61 0.13 0.00 0.00 175.17 176.01 3isn n GLY 231 N 3.82 0.53 2.79 2.66 0.00 -1.26 -5.06 105.19 108.67 3isn n GLY 231 Ca -0.23 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.80 3isn n GLY 231 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3isn s TYR 232 N 3.19 -0.51 0.19 1.61 5.04 -1.26 -4.92 117.35 120.69 3isn s TYR 232 Ca 0.00 0.02 -0.32 0.00 -2.44 0.00 0.00 57.07 54.34 3isn s TYR 232 Cb 0.00 0.10 -0.11 0.00 0.35 0.00 0.00 41.96 42.30 3isn s TYR 232 CO 0.00 -0.36 1.62 -1.21 -1.34 0.00 0.00 175.55 174.26 3isn s GLU 233 N 1.74 4.18 -0.00 4.97 0.41 -1.26 -3.87 118.70 124.87 3isn s GLU 233 Ca 0.17 2.46 -0.03 0.00 -0.41 0.00 0.00 54.97 57.16 3isn s GLU 233 Cb 0.04 -3.12 -0.00 0.00 -1.78 0.00 0.00 34.13 29.27 3isn s GLU 233 CO -0.13 -0.66 0.05 -0.48 -0.49 0.00 0.00 175.26 173.55 3isn s LEU 234 N 1.08 1.86 -0.31 1.80 0.05 -0.20 -4.97 118.68 117.99 3isn s LEU 234 Ca 0.71 -0.18 0.02 0.00 0.05 0.00 0.00 54.13 54.73 3isn s LEU 234 Cb -0.46 0.31 0.09 0.00 -2.05 0.00 0.00 46.19 44.08 3isn s LEU 234 CO 0.32 -0.22 0.02 -1.00 -0.55 0.00 0.00 176.35 174.92 3isn s HIS 235 N -0.90 3.07 -1.80 3.48 3.76 -1.26 -0.04 115.29 121.60 3isn s HIS 235 Ca -0.10 -2.47 0.00 0.00 -0.15 0.00 0.00 55.06 52.35 3isn s HIS 235 Cb -0.06 -2.34 0.00 0.00 1.11 0.00 0.00 32.58 31.29 3isn s HIS 235 CO 0.00 -0.90 0.61 -2.30 -0.85 0.00 0.00 174.74 171.30 3isn n PRO 236 N 4.46 0.68 -0.04 8.40 -0.02 -1.25 -2.41 135.00 144.81 3isn n PRO 236 Ca -0.02 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.44 3isn n PRO 236 Cb 0.42 -1.07 -0.01 0.00 -0.02 0.00 0.00 33.50 32.83 3isn n PRO 236 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3isn h ASP 237 N 0.07 0.00 0.00 2.55 3.32 -1.78 -3.37 116.42 117.21 3isn h ASP 237 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3isn h ASP 237 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3isn h ASP 237 CO 0.00 0.47 0.00 0.29 -1.72 0.00 0.00 179.24 178.28 3isn n LYS 238 N -4.08 0.00 -3.69 3.56 5.02 -1.01 -4.46 118.16 113.51 3isn n LYS 238 Ca -0.02 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.88 3isn n LYS 238 Cb 0.09 -0.79 -0.12 0.00 -0.02 0.00 0.00 35.03 34.19 3isn n LYS 238 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3isn s TRP 239 N -0.45 3.21 0.26 2.13 0.52 -1.25 -5.05 118.94 118.30 3isn s TRP 239 Ca 0.00 -1.04 0.04 0.00 0.02 0.00 0.00 56.10 55.12 3isn s TRP 239 Cb 0.00 -2.34 -0.05 0.00 -1.15 0.00 0.00 33.47 29.93 3isn s TRP 239 CO 0.00 -0.63 0.00 0.95 0.02 0.00 0.00 176.95 177.29 3isn s THR 240 N 1.51 1.14 0.22 2.01 -4.23 -1.26 -5.08 115.64 109.94 3isn s THR 240 Ca 0.01 -2.04 -0.10 0.00 -1.18 0.00 0.00 61.69 58.38 3isn s THR 240 Cb -0.18 -2.45 -0.07 0.00 1.34 0.00 0.00 72.50 71.13 3isn s THR 240 CO 0.05 -0.25 0.54 0.68 -0.54 0.00 0.00 174.62 175.10 3isn s VAL 241 N -3.35 4.93 -0.58 2.29 -7.23 -1.26 -4.74 120.40 110.46 3isn s VAL 241 Ca 0.30 0.51 -0.28 0.00 -1.81 0.00 0.00 61.98 60.70 3isn s VAL 241 Cb 0.06 -3.63 0.02 0.00 0.56 0.00 0.00 36.38 33.39 3isn s VAL 241 CO 0.11 -0.03 1.30 -1.58 -0.31 0.00 0.00 175.10 174.59 3isn s GLN 242 N -2.70 3.40 0.34 4.82 2.00 -0.62 -4.95 119.66 121.95 3isn s GLN 242 Ca 0.46 0.33 -0.27 0.00 -2.00 0.00 0.00 55.36 53.87 3isn s GLN 242 Cb -0.12 -4.07 -0.09 0.00 0.80 0.00 0.00 33.01 29.53 3isn s GLN 242 CO 0.21 -1.83 1.13 -2.14 -0.50 0.00 0.00 175.29 172.16 3isn s PRO 243 N 5.26 4.38 0.23 1.67 0.02 -1.26 -4.83 135.00 140.46 3isn s PRO 243 Ca 0.47 1.81 -0.30 0.00 0.02 0.00 0.00 61.00 63.00 3isn s PRO 243 Cb -0.09 -2.94 -0.09 0.00 0.02 0.00 0.00 34.50 31.41 3isn s PRO 243 CO 0.25 -0.02 1.16 0.42 -0.33 0.00 0.00 177.00 178.48 3isn s ILE 244 N -1.31 3.50 0.08 2.83 1.01 -1.26 -5.03 121.20 121.01 3isn s ILE 244 Ca 0.50 1.36 0.03 0.00 0.00 0.00 0.00 60.65 62.55 3isn s ILE 244 Cb -0.31 -3.87 -0.03 0.00 0.01 0.00 0.00 42.46 38.26 3isn s ILE 244 CO 0.39 0.26 -0.10 0.68 0.00 0.00 0.00 174.94 176.18 3isn s VAL 245 N -0.53 0.82 0.21 2.92 -7.23 -1.26 -4.72 120.40 110.61 3isn s VAL 245 Ca 0.49 -1.45 0.07 0.00 -1.81 0.00 0.00 61.98 59.28 3isn s VAL 245 Cb -0.33 -1.12 -0.04 0.00 0.56 0.00 0.00 36.38 35.45 3isn s VAL 245 CO 0.39 -0.48 0.11 -0.76 -0.31 0.00 0.00 175.10 174.04 3isn s LEU 246 N -2.14 3.61 0.93 1.32 1.43 -1.26 -5.01 118.68 117.57 3isn s LEU 246 Ca 0.00 -0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 52.67 3isn s LEU 246 Cb -0.05 -2.19 0.15 0.00 0.03 0.00 0.00 46.19 44.13 3isn s LEU 246 CO 0.00 0.03 1.12 -2.84 0.23 0.00 0.00 176.35 174.88 3isn s PRO 247 N -3.41 0.96 -0.36 1.29 0.02 -1.26 -5.01 135.00 127.23 3isn s PRO 247 Ca 0.31 0.40 0.14 0.00 0.02 0.00 0.00 61.00 61.87 3isn s PRO 247 Cb -0.09 -1.81 0.39 0.00 0.02 0.00 0.00 34.50 33.01 3isn s PRO 247 CO 0.22 -2.34 0.85 -0.85 -0.33 0.00 0.00 177.00 174.55 3isn n GLU 248 N -3.89 1.04 -0.72 5.54 0.00 -1.26 -5.14 120.64 116.22 3isn n GLU 248 Ca 0.06 -3.20 -0.32 0.00 0.00 0.00 0.00 57.16 53.70 3isn n GLU 248 Cb 0.58 -1.45 0.15 0.00 0.00 0.00 0.00 31.44 30.73 3isn n GLU 248 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3isn n LYS 249 N 0.13 -0.65 0.03 3.44 5.02 -1.26 -4.98 118.16 119.88 3isn n LYS 249 Ca 0.17 -0.15 -0.13 0.00 -2.02 0.00 0.00 58.31 56.18 3isn n LYS 249 Cb 0.73 -2.01 -0.14 0.00 -0.02 0.00 0.00 35.03 33.58 3isn n LYS 249 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3isn h ASP 250 N -1.81 0.21 -3.28 4.39 3.32 -2.05 -3.45 116.42 113.76 3isn h ASP 250 Ca -0.46 -0.34 -0.59 0.00 0.02 0.00 0.00 57.03 55.66 3isn h ASP 250 Cb 1.29 -0.07 -0.37 0.00 0.22 0.00 0.00 39.33 40.41 3isn h ASP 250 CO 0.38 1.29 -0.81 -0.55 -1.72 0.00 0.00 179.24 177.82 3isn s SER 251 N -6.65 2.92 -0.28 6.45 0.15 -1.26 -5.12 113.70 109.91 3isn s SER 251 Ca -0.08 -0.65 -0.08 0.00 0.70 0.00 0.00 55.95 55.84 3isn s SER 251 Cb 0.08 -1.11 -0.02 0.00 -1.71 0.00 0.00 66.02 63.26 3isn s SER 251 CO 0.83 -0.12 0.11 0.26 1.20 0.00 0.00 173.24 175.52 3isn s TRP 252 N 1.51 3.13 0.83 3.44 0.52 -1.26 -5.04 118.94 122.07 3isn s TRP 252 Ca 0.02 -0.51 -0.08 0.00 0.02 0.00 0.00 56.10 55.56 3isn s TRP 252 Cb -0.14 -2.29 0.16 0.00 -1.15 0.00 0.00 33.47 30.05 3isn s TRP 252 CO -0.09 -0.41 1.15 0.95 0.02 0.00 0.00 176.95 178.57 3isn s THR 253 N 1.61 2.06 0.14 2.01 -4.23 -1.26 -0.05 115.64 115.93 3isn s THR 253 Ca 0.05 -0.33 -0.15 0.00 -1.18 0.00 0.00 61.69 60.08 3isn s THR 253 Cb -0.16 -2.73 0.01 0.00 1.34 0.00 0.00 72.50 70.96 3isn s THR 253 CO 0.05 0.00 1.73 0.58 -0.54 0.00 0.00 174.62 176.44 3isn h VAL 254 N -1.05 1.17 0.78 2.29 2.07 -0.87 -1.80 116.25 118.84 3isn h VAL 254 Ca -0.40 -0.48 -0.04 0.00 0.82 0.00 0.00 66.70 66.60 3isn h VAL 254 Cb 1.25 0.70 0.01 0.00 -1.52 0.00 0.00 31.29 31.73 3isn h VAL 254 CO 0.39 0.19 -0.37 -1.13 0.02 0.00 0.00 177.57 176.66 3isn h ASN 255 N 0.56 -0.88 -0.93 0.57 -0.00 -1.78 0.32 115.58 113.44 3isn h ASN 255 Ca 0.15 0.02 0.08 0.00 -0.00 0.00 0.00 56.30 56.55 3isn h ASN 255 Cb 0.10 0.23 -0.11 0.00 -0.00 0.00 0.00 38.32 38.54 3isn h ASN 255 CO -0.02 -0.60 -0.57 0.44 -0.00 0.00 0.00 177.43 176.69 3isn h ASP 256 N -1.11 -2.07 -0.69 1.15 3.32 -1.86 0.70 116.42 115.86 3isn h ASP 256 Ca -0.11 0.31 0.10 0.00 0.02 0.00 0.00 57.03 57.36 3isn h ASP 256 Cb 0.81 0.91 -0.04 0.00 0.22 0.00 0.00 39.33 41.23 3isn h ASP 256 CO 0.18 -0.23 0.46 0.40 -1.72 0.00 0.00 179.24 178.32 3isn h ILE 257 N -0.02 0.90 -0.21 0.35 2.04 -1.18 -1.22 117.51 118.17 3isn h ILE 257 Ca 0.15 -0.18 -0.15 0.00 1.00 0.00 0.00 64.86 65.68 3isn h ILE 257 Cb 0.40 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 3isn h ILE 257 CO -0.89 0.10 -0.46 1.56 0.00 0.00 0.00 178.15 178.46 3isn h GLN 258 N 0.53 0.68 0.47 2.37 4.20 0.24 -1.31 115.11 122.29 3isn h GLN 258 Ca 0.32 -0.45 -0.02 0.00 0.06 0.00 0.00 58.65 58.56 3isn h GLN 258 Cb 0.54 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 3isn h GLN 258 CO -0.10 1.07 -0.28 0.87 -0.67 0.00 0.00 178.83 179.72 3isn h LYS 259 N 0.38 -0.69 -0.42 1.46 1.79 -0.09 -2.50 116.57 116.51 3isn h LYS 259 Ca 0.00 0.05 0.09 0.00 -2.18 0.00 0.00 60.65 58.60 3isn h LYS 259 Cb 1.07 0.16 -0.09 0.00 -1.58 0.00 0.00 32.23 31.79 3isn h LYS 259 CO 0.10 -0.46 -0.26 1.25 -1.08 0.00 0.00 179.45 179.01 3isn h LEU 260 N -0.71 -0.87 -1.41 2.94 5.85 -1.08 0.22 115.31 120.26 3isn h LEU 260 Ca -0.05 0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.92 3isn h LEU 260 Cb 0.58 0.44 -0.05 0.00 0.37 0.00 0.00 40.66 42.00 3isn h LEU 260 CO 0.06 -0.28 0.48 0.58 -0.34 0.00 0.00 178.44 178.94 3isn h VAL 261 N -0.18 0.98 -0.05 1.05 2.07 -1.23 0.35 116.25 119.23 3isn h VAL 261 Ca 0.19 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 3isn h VAL 261 Cb 0.49 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 3isn h VAL 261 CO -0.52 0.13 0.03 1.23 0.02 0.00 0.00 177.57 178.45 3isn h GLY 262 N 0.69 0.07 0.80 2.17 0.00 -0.14 0.61 103.07 107.28 3isn h GLY 262 Ca 0.33 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.61 3isn h GLY 262 CO -0.11 0.03 -0.35 1.70 0.00 0.00 0.00 176.54 177.81 3isn h LYS 263 N 0.01 -0.80 -0.88 4.80 3.64 -0.56 -2.34 116.57 120.45 3isn h LYS 263 Ca 0.02 0.05 0.18 0.00 -1.27 0.00 0.00 60.65 59.63 3isn h LYS 263 Cb 0.05 0.18 -0.07 0.00 -0.41 0.00 0.00 32.23 31.99 3isn h LYS 263 CO -0.00 -0.53 0.58 -0.07 -2.27 0.00 0.00 179.45 177.15 3isn h LEU 264 N -0.83 0.49 0.21 5.20 3.38 -0.85 -0.61 115.31 122.31 3isn h LEU 264 Ca -0.06 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3isn h LEU 264 Cb 0.69 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3isn h LEU 264 CO 0.04 0.22 -0.10 -1.13 0.09 0.00 0.00 178.44 177.56 3isn h ASN 265 N 0.51 -0.23 -0.71 -0.43 -1.24 -0.51 -2.31 115.58 110.65 3isn h ASN 265 Ca 0.46 -0.27 0.16 0.00 0.71 0.00 0.00 56.30 57.36 3isn h ASN 265 Cb 0.98 0.06 -0.11 0.00 0.73 0.00 0.00 38.32 39.98 3isn h ASN 265 CO -0.19 0.18 0.10 -0.25 -1.29 0.00 0.00 177.43 175.98 3isn h TRP 266 N -0.69 0.13 0.00 0.67 7.01 -1.09 0.24 115.95 122.22 3isn h TRP 266 Ca -0.03 0.05 0.00 0.00 2.11 0.00 0.00 58.89 61.02 3isn h TRP 266 Cb 0.48 0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.60 3isn h TRP 266 CO 0.05 -0.14 0.00 0.00 -2.79 0.00 0.00 178.44 175.56 3isn n ALA 267 N -2.75 2.01 1.40 2.65 0.00 -0.26 -1.41 120.51 122.15 3isn n ALA 267 Ca 0.13 -0.09 0.14 0.00 0.00 0.00 0.00 53.44 53.62 3isn n ALA 267 Cb 0.44 -1.23 0.51 0.00 0.00 0.00 0.00 19.45 19.17 3isn n ALA 267 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3isn n SER 268 N -1.03 0.95 0.12 0.00 3.41 0.84 -2.60 113.62 115.31 3isn n SER 268 Ca 0.10 -0.98 0.06 0.00 -0.26 0.00 0.00 58.87 57.79 3isn n SER 268 Cb 0.06 0.04 0.02 0.00 -0.26 0.00 0.00 64.21 64.06 3isn n SER 268 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3isn h GLN 269 N 1.29 0.00 0.00 4.33 4.20 -1.33 -3.35 115.11 120.25 3isn h GLN 269 Ca 0.00 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.49 3isn h GLN 269 Cb 0.44 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 3isn h GLN 269 CO 0.00 0.24 -1.48 -0.89 -0.67 0.00 0.00 178.83 176.03 3isn n ILE 270 N -2.99 1.51 -3.57 2.54 5.41 -1.22 -4.82 119.36 116.21 3isn n ILE 270 Ca -0.01 -0.07 -0.41 0.00 1.00 0.00 0.00 62.75 63.26 3isn n ILE 270 Cb 0.68 -2.11 -0.10 0.00 -0.71 0.00 0.00 39.64 37.41 3isn n ILE 270 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 3isn s TYR 271 N -2.47 3.33 -1.83 1.39 1.51 -1.07 -4.97 117.35 113.24 3isn s TYR 271 Ca -0.29 -1.47 0.00 0.00 -1.01 0.00 0.00 57.07 54.29 3isn s TYR 271 Cb 0.08 -3.03 0.00 0.00 -0.11 0.00 0.00 41.96 38.90 3isn s TYR 271 CO 0.46 -0.85 0.65 -2.30 -1.11 0.00 0.00 175.55 172.41 3isn n PRO 272 N 4.95 0.72 0.00 -1.71 -0.02 -1.26 -3.47 135.00 134.22 3isn n PRO 272 Ca -0.10 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.47 3isn n PRO 272 Cb 0.43 -1.06 -0.01 0.00 -0.02 0.00 0.00 33.50 32.84 3isn n PRO 272 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3isn n GLY 273 N 0.20 -0.05 3.77 -1.23 0.00 -1.26 -4.97 105.19 101.65 3isn n GLY 273 Ca 0.00 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.11 3isn n GLY 273 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3isn s ILE 274 N -2.11 4.38 0.14 -0.61 2.07 -1.23 -5.04 121.20 118.80 3isn s ILE 274 Ca 0.14 1.75 0.08 0.00 -1.41 0.00 0.00 60.65 61.21 3isn s ILE 274 Cb 0.14 -4.16 -0.04 0.00 0.13 0.00 0.00 42.46 38.53 3isn s ILE 274 CO 0.47 0.50 -0.11 -0.75 -1.91 0.00 0.00 174.94 173.14 3isn s LYS 275 N -1.00 2.05 -0.00 3.50 2.47 -1.26 -4.99 119.74 120.52 3isn s LYS 275 Ca 0.37 -1.15 0.03 0.00 -1.56 0.00 0.00 55.97 53.66 3isn s LYS 275 Cb -0.23 -2.22 -0.04 0.00 -1.46 0.00 0.00 37.83 33.88 3isn s LYS 275 CO 0.27 0.47 0.07 0.28 0.16 0.00 0.00 175.35 176.60 3isn n VAL 276 N 0.42 0.00 -0.29 4.02 0.31 -1.26 -4.89 118.33 116.64 3isn n VAL 276 Ca -0.13 -0.14 -0.08 0.00 -0.01 0.00 0.00 64.34 63.99 3isn n VAL 276 Cb 0.54 0.56 -0.07 0.00 -0.91 0.00 0.00 33.84 33.96 3isn n VAL 276 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3isn n ARG 277 N -1.48 -0.31 0.31 5.55 0.63 -1.26 -0.59 116.66 119.52 3isn n ARG 277 Ca -0.00 1.17 0.18 0.00 -0.92 0.00 0.00 57.85 58.29 3isn n ARG 277 Cb 0.06 -1.73 0.98 0.00 0.45 0.00 0.00 32.46 32.23 3isn n ARG 277 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 3isn h GLN 278 N 0.00 0.00 0.06 -0.14 1.08 -1.90 -0.70 115.11 113.52 3isn h GLN 278 Ca 0.11 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.98 3isn h GLN 278 Cb 0.28 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.68 3isn h GLN 278 CO -0.65 0.00 -1.87 1.28 -0.95 0.00 0.00 178.83 176.63 3isn n LEU 279 N -2.89 1.73 -0.23 1.46 4.77 0.24 -3.74 117.00 118.35 3isn n LEU 279 Ca -0.02 0.30 -0.05 0.00 -0.03 0.00 0.00 56.01 56.21 3isn n LEU 279 Cb 0.19 -0.45 0.11 0.00 -2.33 0.00 0.00 43.42 40.94 3isn n LEU 279 CO 0.16 0.62 1.01 0.00 -1.33 0.00 0.00 177.39 177.85 3isn n LYS 281 N -4.27 -0.25 -0.06 0.00 4.81 -0.38 0.06 118.16 118.07 3isn n LYS 281 Ca 0.06 1.16 0.25 0.00 -0.87 0.00 0.00 58.31 58.91 3isn n LYS 281 Cb 0.21 -1.72 0.68 0.00 0.02 0.00 0.00 35.03 34.22 3isn n LYS 281 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 3isn h LEU 282 N 0.00 0.00 -0.89 3.14 3.38 -1.57 0.61 115.31 119.98 3isn h LEU 282 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3isn h LEU 282 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3isn h LEU 282 CO -0.54 0.00 -0.26 0.18 0.09 0.00 0.00 178.44 177.91 3isn n LEU 283 N -3.69 1.65 -4.57 1.67 4.77 0.11 -4.91 117.00 112.03 3isn n LEU 283 Ca 0.14 -0.54 -0.59 0.00 -0.03 0.00 0.00 56.01 55.00 3isn n LEU 283 Cb 0.95 -0.05 -0.09 0.00 -2.33 0.00 0.00 43.42 41.90 3isn n LEU 283 CO 0.29 0.30 1.48 0.54 -1.33 0.00 0.00 177.39 178.67 3isn n ARG 284 N -0.09 0.68 0.00 3.23 1.74 0.20 -4.65 116.66 117.77 3isn n ARG 284 Ca 0.12 0.23 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 3isn n ARG 284 Cb 0.42 -1.94 0.00 0.00 -1.02 0.00 0.00 32.46 29.91 3isn n ARG 284 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3isn n GLY 285 N 5.35 1.71 2.75 -0.13 0.00 -1.26 -4.91 105.19 108.70 3isn n GLY 285 Ca 0.36 -2.09 -0.35 0.00 0.00 0.00 0.00 46.02 43.95 3isn n GLY 285 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3isn n THR 286 N -1.43 3.47 -1.35 2.61 -1.04 -1.26 -5.06 114.28 110.21 3isn n THR 286 Ca 0.00 -4.79 -0.32 0.00 -2.04 0.00 0.00 64.05 56.90 3isn n THR 286 Cb 0.00 -1.30 0.09 0.00 -1.82 0.00 0.00 70.33 67.30 3isn n THR 286 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3isn s LYS 287 N -3.89 2.28 0.37 -2.82 1.02 -1.26 -5.02 119.74 110.41 3isn s LYS 287 Ca 0.49 1.29 -0.24 0.00 0.02 0.00 0.00 55.97 57.53 3isn s LYS 287 Cb 0.39 -1.89 -0.10 0.00 -0.52 0.00 0.00 37.83 35.71 3isn s LYS 287 CO -0.29 -1.64 0.98 0.00 -0.92 0.00 0.00 175.35 173.47 3isn s ALA 288 N -2.69 3.13 0.29 5.17 0.00 -1.26 -4.95 121.76 121.46 3isn s ALA 288 Ca 0.64 0.56 -0.00 0.00 0.00 0.00 0.00 51.96 53.15 3isn s ALA 288 Cb -0.19 -3.21 0.44 0.00 0.00 0.00 0.00 23.12 20.16 3isn s ALA 288 CO 0.52 0.04 1.83 -0.07 0.00 0.00 0.00 175.76 178.08 3isn h LEU 289 N 2.70 0.71 -1.93 0.00 3.38 -1.96 -1.78 115.31 116.42 3isn h LEU 289 Ca -0.48 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.34 3isn h LEU 289 Cb 1.20 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.76 3isn h LEU 289 CO 0.63 0.72 -0.09 0.71 0.09 0.00 0.00 178.44 180.50 3isn h THR 290 N 0.73 0.38 -1.75 0.22 1.35 -1.97 -2.57 112.91 109.29 3isn h THR 290 Ca 0.16 -0.50 -0.58 0.00 -0.55 0.00 0.00 66.41 64.95 3isn h THR 290 Cb 0.31 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 68.08 3isn h THR 290 CO 0.00 0.09 1.52 1.21 -0.25 0.00 0.00 175.52 178.09 3isn n GLU 291 N -3.44 1.63 -1.68 4.72 2.13 -0.67 -4.66 120.64 118.66 3isn n GLU 291 Ca -0.01 0.39 -0.45 0.00 0.66 0.00 0.00 57.16 57.74 3isn n GLU 291 Cb 0.24 -3.15 -0.04 0.00 0.27 0.00 0.00 31.44 28.76 3isn n GLU 291 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3isn n VAL 292 N 7.74 0.11 -4.53 6.31 0.31 -1.26 -1.37 118.33 125.63 3isn n VAL 292 Ca 0.34 -0.02 -0.34 0.00 -0.01 0.00 0.00 64.34 64.31 3isn n VAL 292 Cb 0.43 -1.72 -0.11 0.00 -0.91 0.00 0.00 33.84 31.53 3isn n VAL 292 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3isn s ILE 293 N 1.54 3.80 0.21 2.52 1.09 0.93 -4.89 121.20 126.41 3isn s ILE 293 Ca 0.80 -0.42 -0.28 0.00 -1.10 0.00 0.00 60.65 59.65 3isn s ILE 293 Cb -0.63 -2.60 -0.09 0.00 -1.06 0.00 0.00 42.46 38.09 3isn s ILE 293 CO 0.38 0.56 0.89 -2.84 -0.10 0.00 0.00 174.94 173.83 3isn s PRO 294 N -0.38 4.76 0.26 2.79 0.02 -1.26 -4.24 135.00 136.95 3isn s PRO 294 Ca 0.06 1.38 -0.27 0.00 0.02 0.00 0.00 61.00 62.19 3isn s PRO 294 Cb -0.12 -3.28 -0.09 0.00 0.02 0.00 0.00 34.50 31.03 3isn s PRO 294 CO 0.02 0.53 0.90 -0.51 -0.33 0.00 0.00 177.00 177.62 3isn s LEU 295 N -1.15 4.50 1.39 -5.54 1.43 -1.26 -5.05 118.68 113.01 3isn s LEU 295 Ca 0.39 1.83 -0.22 0.00 -1.03 0.00 0.00 54.13 55.10 3isn s LEU 295 Cb -0.25 -3.72 0.35 0.00 0.03 0.00 0.00 46.19 42.60 3isn s LEU 295 CO 0.30 0.07 0.80 0.41 0.23 0.00 0.00 176.35 178.16 3isn n THR 296 N 1.10 0.00 -0.04 5.49 -1.04 -1.26 -4.78 114.28 113.75 3isn n THR 296 Ca -0.01 -0.04 -0.21 0.00 -2.04 0.00 0.00 64.05 61.74 3isn n THR 296 Cb 0.49 -0.91 -0.13 0.00 -1.82 0.00 0.00 70.33 67.95 3isn n THR 296 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 3isn n GLU 297 N -5.14 0.71 0.22 -2.82 0.00 -1.26 -1.95 120.64 110.41 3isn n GLU 297 Ca 0.12 0.29 0.16 0.00 0.00 0.00 0.00 57.16 57.72 3isn n GLU 297 Cb 0.56 -1.68 0.69 0.00 0.00 0.00 0.00 31.44 31.01 3isn n GLU 297 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 3isn h GLU 298 N -0.14 0.00 0.01 3.44 5.08 -1.97 -1.01 114.58 119.99 3isn h GLU 298 Ca -0.45 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.50 3isn h GLU 298 Cb 1.89 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 31.08 3isn h GLU 298 CO -0.00 0.00 -2.32 0.00 -1.00 0.00 0.00 179.01 175.69 3isn n ALA 299 N -1.94 1.18 0.26 3.43 0.00 -1.26 -3.80 120.51 118.38 3isn n ALA 299 Ca 0.00 -0.99 0.11 0.00 0.00 0.00 0.00 53.44 52.56 3isn n ALA 299 Cb 0.21 -0.07 0.51 0.00 0.00 0.00 0.00 19.45 20.10 3isn n ALA 299 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3isn n GLU 300 N -4.00 0.15 0.02 0.00 2.13 -0.82 -1.22 120.64 116.90 3isn n GLU 300 Ca -0.48 0.53 -0.21 0.00 0.66 0.00 0.00 57.16 57.66 3isn n GLU 300 Cb 0.89 -1.88 -0.14 0.00 0.27 0.00 0.00 31.44 30.58 3isn n GLU 300 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3isn h LEU 301 N 0.00 0.39 -1.49 4.31 6.46 -1.38 -3.34 115.31 120.26 3isn h LEU 301 Ca 0.00 -0.88 0.43 0.00 -0.12 0.00 0.00 57.88 57.32 3isn h LEU 301 Cb 0.16 -0.13 -0.12 0.00 -0.73 0.00 0.00 40.66 39.85 3isn h LEU 301 CO 0.00 1.53 0.90 -0.08 -0.62 0.00 0.00 178.44 180.17 3isn h GLU 302 N -0.36 0.09 0.77 1.25 4.81 -1.26 -0.15 114.58 119.73 3isn h GLU 302 Ca -0.25 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.94 3isn h GLU 302 Cb 1.70 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 31.07 3isn h GLU 302 CO 0.08 0.06 -0.37 1.25 -0.73 0.00 0.00 179.01 179.30 3isn h LEU 303 N 0.09 -0.87 -2.27 1.64 6.46 -1.64 -2.07 115.31 116.65 3isn h LEU 303 Ca 0.81 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 58.58 3isn h LEU 303 Cb 2.62 0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 42.77 3isn h LEU 303 CO -0.35 -0.51 -0.03 0.00 -0.62 0.00 0.00 178.44 176.93 3isn h ALA 304 N -1.21 1.58 0.36 1.25 0.00 -1.22 0.32 119.26 120.34 3isn h ALA 304 Ca -0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3isn h ALA 304 Cb 0.80 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3isn h ALA 304 CO 0.17 0.03 -0.21 0.93 0.00 0.00 0.00 179.25 180.17 3isn h GLU 305 N 0.00 -0.51 -0.03 0.00 4.39 -1.15 -2.09 114.58 115.19 3isn h GLU 305 Ca -0.00 0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 3isn h GLU 305 Cb 0.07 0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 3isn h GLU 305 CO 0.00 -0.34 -0.00 -0.91 -1.16 0.00 0.00 179.01 176.60 3isn h ASN 306 N -0.53 0.03 -0.06 1.42 -0.26 -1.01 -1.21 115.58 113.96 3isn h ASN 306 Ca -0.05 -0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.65 3isn h ASN 306 Cb 0.42 -0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 37.66 3isn h ASN 306 CO 0.05 0.04 -0.08 -0.09 -1.06 0.00 0.00 177.43 176.30 3isn h ARG 307 N 0.04 0.31 0.02 0.81 2.43 -0.27 -0.67 114.38 117.05 3isn h ARG 307 Ca 0.01 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.05 3isn h ARG 307 Cb 0.03 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3isn h ARG 307 CO 0.00 0.40 -0.28 0.93 -1.51 0.00 0.00 179.97 179.51 3isn h GLU 308 N 0.30 0.16 -0.94 0.20 4.39 -0.53 -2.77 114.58 115.38 3isn h GLU 308 Ca 0.06 -0.19 0.17 0.00 0.34 0.00 0.00 59.36 59.74 3isn h GLU 308 Cb 0.33 0.06 -0.10 0.00 -0.10 0.00 0.00 28.75 28.94 3isn h GLU 308 CO 0.02 0.98 0.53 0.82 -1.16 0.00 0.00 179.01 180.19 3isn h ILE 309 N -0.58 0.71 -0.00 3.13 2.04 -1.08 0.38 117.51 122.11 3isn h ILE 309 Ca -0.04 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.58 3isn h ILE 309 Cb 1.09 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 3isn h ILE 309 CO 0.05 0.13 -0.05 0.18 0.00 0.00 0.00 178.15 178.46 3isn n LEU 310 N -4.82 0.13 0.07 1.44 4.32 -0.28 -3.14 117.00 114.73 3isn n LEU 310 Ca 0.21 0.26 0.12 0.00 -0.02 0.00 0.00 56.01 56.58 3isn n LEU 310 Cb 0.51 -0.31 0.26 0.00 -1.62 0.00 0.00 43.42 42.26 3isn n LEU 310 CO 0.21 0.03 0.55 1.17 -1.22 0.00 0.00 177.39 178.12 3isn n LYS 311 N -1.28 0.27 -4.13 3.23 4.81 0.13 -4.47 118.16 116.73 3isn n LYS 311 Ca 0.12 0.13 -0.35 0.00 -0.87 0.00 0.00 58.31 57.35 3isn n LYS 311 Cb 0.28 -1.72 -0.13 0.00 0.02 0.00 0.00 35.03 33.47 3isn n LYS 311 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 3isn s GLU 312 N -3.14 3.55 0.32 1.64 2.12 -1.14 -5.08 118.70 116.98 3isn s GLU 312 Ca 0.08 -0.56 -0.21 0.00 0.36 0.00 0.00 54.97 54.64 3isn s GLU 312 Cb 0.13 -3.01 -0.15 0.00 0.26 0.00 0.00 34.13 31.36 3isn s GLU 312 CO 0.67 0.01 0.18 -2.30 -0.54 0.00 0.00 175.26 173.29 3isn n PRO 313 N 4.23 0.00 -1.60 4.30 -0.02 -1.26 -4.84 135.00 135.80 3isn n PRO 313 Ca -0.17 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 60.93 3isn n PRO 313 Cb 0.52 -0.93 0.05 0.00 -0.02 0.00 0.00 33.50 33.12 3isn n PRO 313 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3isn n VAL 314 N -0.70 3.50 -4.40 -1.45 0.31 -1.26 -5.00 118.33 109.34 3isn n VAL 314 Ca 0.12 -0.50 -0.27 0.00 -0.01 0.00 0.00 64.34 63.68 3isn n VAL 314 Cb 0.33 -1.12 -0.12 0.00 -0.91 0.00 0.00 33.84 32.02 3isn n VAL 314 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 3isn s HIS 315 N -1.51 2.23 0.00 3.52 3.76 -1.26 -4.73 115.29 117.29 3isn s HIS 315 Ca 0.74 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 55.27 3isn s HIS 315 Cb -0.43 -1.15 0.00 0.00 1.11 0.00 0.00 32.58 32.12 3isn s HIS 315 CO 0.48 0.42 0.00 0.41 -0.85 0.00 0.00 174.74 175.20 3isn n GLY 316 N 0.53 0.70 3.79 -2.22 0.00 -1.26 -5.05 105.19 101.68 3isn n GLY 316 Ca -0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 3isn n GLY 316 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3isn s VAL 317 N -2.39 3.77 -0.27 1.61 -7.23 -1.26 -5.03 120.40 109.60 3isn s VAL 317 Ca 0.00 1.15 -0.03 0.00 -1.81 0.00 0.00 61.98 61.30 3isn s VAL 317 Cb 0.00 -3.49 0.09 0.00 0.56 0.00 0.00 36.38 33.54 3isn s VAL 317 CO 0.00 -0.19 0.10 -0.72 -0.31 0.00 0.00 175.10 173.98 3isn s TYR 318 N -1.91 0.98 0.18 2.82 -0.85 -1.26 -5.10 117.35 112.21 3isn s TYR 318 Ca 0.65 -1.18 -0.32 0.00 -0.52 0.00 0.00 57.07 55.70 3isn s TYR 318 Cb -0.18 -1.23 -0.11 0.00 0.38 0.00 0.00 41.96 40.82 3isn s TYR 318 CO 0.21 -0.79 1.65 -0.47 -1.52 0.00 0.00 175.55 174.64 3isn s TYR 319 N 1.87 2.91 -0.33 -3.49 5.04 -1.26 -4.96 117.35 117.12 3isn s TYR 319 Ca 0.07 0.45 0.00 0.00 -2.44 0.00 0.00 57.07 55.16 3isn s TYR 319 Cb -0.17 -4.04 0.08 0.00 0.35 0.00 0.00 41.96 38.19 3isn s TYR 319 CO -0.26 -3.91 0.05 0.34 -1.34 0.00 0.00 175.55 170.43 3isn s ASP 320 N 1.32 4.88 0.32 4.32 -1.08 -1.26 -4.99 116.67 120.18 3isn s ASP 320 Ca 0.73 -1.77 0.13 0.00 -0.52 0.00 0.00 52.55 51.12 3isn s ASP 320 Cb -0.46 -1.69 0.69 0.00 -1.46 0.00 0.00 42.92 40.00 3isn s ASP 320 CO 0.32 -0.36 1.28 -2.65 0.52 0.00 0.00 175.17 174.28 3isn n PRO 321 N 4.47 0.09 -0.01 4.34 -0.02 -1.26 -1.78 135.00 140.83 3isn n PRO 321 Ca -0.05 0.56 -0.07 0.00 -2.02 0.00 0.00 63.50 61.93 3isn n PRO 321 Cb 0.42 -2.09 -0.13 0.00 -0.02 0.00 0.00 33.50 31.69 3isn n PRO 321 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3isn n SER 322 N -2.04 0.84 -4.93 2.55 3.41 -1.26 -4.95 113.62 107.25 3isn n SER 322 Ca -0.01 0.39 -0.26 0.00 -0.26 0.00 0.00 58.87 58.74 3isn n SER 322 Cb 0.32 0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.28 3isn n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3isn s LYS 323 N -2.67 3.54 0.78 4.33 1.02 -0.73 -5.07 119.74 120.92 3isn s LYS 323 Ca -0.04 -0.17 -0.14 0.00 0.02 0.00 0.00 55.97 55.64 3isn s LYS 323 Cb 0.08 -2.63 0.07 0.00 -0.52 0.00 0.00 37.83 34.82 3isn s LYS 323 CO 0.82 0.14 1.20 -0.51 -0.92 0.00 0.00 175.35 176.08 3isn s ASP 324 N -3.74 3.85 -0.05 2.83 1.11 -1.26 -4.95 116.67 114.46 3isn s ASP 324 Ca 0.42 2.32 -0.13 0.00 0.18 0.00 0.00 52.55 55.34 3isn s ASP 324 Cb -0.10 -2.58 -0.05 0.00 1.07 0.00 0.00 42.92 41.25 3isn s ASP 324 CO 0.35 -2.49 0.34 -0.76 1.18 0.00 0.00 175.17 173.79 3isn s LEU 325 N -5.53 4.42 -0.03 1.23 1.43 -1.26 -4.62 118.68 114.31 3isn s LEU 325 Ca 0.73 0.79 0.07 0.00 -1.03 0.00 0.00 54.13 54.69 3isn s LEU 325 Cb -0.28 -2.45 -0.02 0.00 0.03 0.00 0.00 46.19 43.47 3isn s LEU 325 CO 0.49 0.30 -0.24 -0.63 0.23 0.00 0.00 176.35 176.50 3isn s ILE 326 N -0.78 2.21 -0.11 -0.59 1.01 -0.85 -0.43 121.20 121.67 3isn s ILE 326 Ca 0.21 -1.04 0.02 0.00 0.00 0.00 0.00 60.65 59.84 3isn s ILE 326 Cb -0.15 -1.79 0.01 0.00 0.01 0.00 0.00 42.46 40.55 3isn s ILE 326 CO 0.10 0.58 -0.16 0.00 0.00 0.00 0.00 174.94 175.46 3isn s ALA 327 N -0.55 1.74 -0.07 9.38 0.00 0.48 -1.96 121.76 130.78 3isn s ALA 327 Ca 0.08 -0.75 -0.01 0.00 0.00 0.00 0.00 51.96 51.28 3isn s ALA 327 Cb -0.11 -0.82 -0.03 0.00 0.00 0.00 0.00 23.12 22.16 3isn s ALA 327 CO 0.00 -0.02 -0.02 -1.21 0.00 0.00 0.00 175.76 174.51 3isn s GLU 328 N 0.88 2.90 0.01 0.00 2.02 -0.47 -0.04 118.70 124.00 3isn s GLU 328 Ca -0.09 -0.46 0.07 0.00 0.02 0.00 0.00 54.97 54.51 3isn s GLU 328 Cb -0.15 -2.72 -0.02 0.00 0.10 0.00 0.00 34.13 31.33 3isn s GLU 328 CO -0.00 0.69 -0.21 0.42 0.02 0.00 0.00 175.26 176.18 3isn s ILE 329 N -0.88 1.65 -0.11 -1.63 1.01 -1.23 -1.70 121.20 118.32 3isn s ILE 329 Ca 0.13 -1.04 0.01 0.00 0.00 0.00 0.00 60.65 59.75 3isn s ILE 329 Cb -0.11 -1.40 0.02 0.00 0.01 0.00 0.00 42.46 40.97 3isn s ILE 329 CO 0.03 0.34 -0.12 -1.10 0.00 0.00 0.00 174.94 174.09 3isn s GLN 330 N -0.82 1.86 -0.14 2.79 1.11 0.15 -4.54 119.66 120.06 3isn s GLN 330 Ca 0.08 -0.41 -0.29 0.00 0.01 0.00 0.00 55.36 54.74 3isn s GLN 330 Cb -0.08 -1.70 -0.03 0.00 -1.01 0.00 0.00 33.01 30.18 3isn s GLN 330 CO 0.00 -0.15 1.49 0.21 0.01 0.00 0.00 175.29 176.86 3isn s LYS 331 N 1.26 4.10 0.00 2.91 2.20 -1.26 -1.67 119.74 127.28 3isn s LYS 331 Ca -0.02 1.85 0.16 0.00 -0.36 0.00 0.00 55.97 57.60 3isn s LYS 331 Cb -0.14 -3.92 0.34 0.00 -1.51 0.00 0.00 37.83 32.60 3isn s LYS 331 CO -0.04 -0.91 1.25 1.04 -0.36 0.00 0.00 175.35 176.33 3isn n GLN 332 N 7.08 2.26 -0.54 4.03 1.13 -0.23 -5.00 117.38 126.09 3isn n GLN 332 Ca 0.16 -2.02 0.07 0.00 -1.94 0.00 0.00 57.00 53.27 3isn n GLN 332 Cb 0.44 -1.37 -0.02 0.00 0.11 0.00 0.00 30.24 29.40 3isn n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3isn n GLY 333 N 1.00 -1.75 2.61 1.08 0.00 -1.24 -4.86 105.19 102.03 3isn n GLY 333 Ca 0.15 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.79 3isn n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3isn n GLN 334 N -2.55 -1.16 -2.80 1.61 1.13 -1.26 -1.61 117.38 110.73 3isn n GLN 334 Ca -0.00 0.29 -0.09 0.00 -1.94 0.00 0.00 57.00 55.26 3isn n GLN 334 Cb 0.25 -4.17 0.04 0.00 0.11 0.00 0.00 30.24 26.46 3isn n GLN 334 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3isn n GLY 335 N -0.66 0.22 2.95 1.08 0.00 -1.26 -4.70 105.19 102.82 3isn n GLY 335 Ca 0.00 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.65 3isn n GLY 335 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3isn s GLN 336 N -5.11 0.19 0.14 1.61 0.74 -0.64 0.06 119.66 116.66 3isn s GLN 336 Ca 0.14 -0.28 -0.06 0.00 0.05 0.00 0.00 55.36 55.21 3isn s GLN 336 Cb -0.06 0.07 -0.02 0.00 1.10 0.00 0.00 33.01 34.10 3isn s GLN 336 CO 0.31 -0.03 0.20 -1.58 -0.55 0.00 0.00 175.29 173.63 3isn s TRP 337 N -0.73 0.52 0.01 1.67 0.52 -0.63 -1.07 118.94 119.23 3isn s TRP 337 Ca -0.08 -0.90 -0.04 0.00 0.02 0.00 0.00 56.10 55.10 3isn s TRP 337 Cb -0.05 -0.20 -0.01 0.00 -1.15 0.00 0.00 33.47 32.06 3isn s TRP 337 CO -0.00 -0.63 0.06 0.95 0.02 0.00 0.00 176.95 177.34 3isn s THR 338 N -3.98 0.10 -0.01 2.01 -4.23 -0.67 -1.49 115.64 107.37 3isn s THR 338 Ca 0.18 -0.84 -0.12 0.00 -1.18 0.00 0.00 61.69 59.73 3isn s THR 338 Cb 0.05 -0.41 0.02 0.00 1.34 0.00 0.00 72.50 73.49 3isn s THR 338 CO -0.01 -0.46 0.25 -0.72 -0.54 0.00 0.00 174.62 173.14 3isn s TYR 339 N -1.56 -0.12 0.01 3.99 -0.85 -1.03 0.33 117.35 118.12 3isn s TYR 339 Ca -0.14 0.17 0.06 0.00 -0.52 0.00 0.00 57.07 56.64 3isn s TYR 339 Cb -0.08 0.05 -0.02 0.00 0.38 0.00 0.00 41.96 42.29 3isn s TYR 339 CO -0.00 -0.34 -0.19 -0.65 -1.52 0.00 0.00 175.55 172.85 3isn s GLN 340 N -1.25 1.40 -0.00 -3.49 1.11 -0.69 -1.87 119.66 114.87 3isn s GLN 340 Ca -0.13 -0.78 0.05 0.00 0.01 0.00 0.00 55.36 54.52 3isn s GLN 340 Cb -0.06 -1.42 -0.03 0.00 -1.01 0.00 0.00 33.01 30.49 3isn s GLN 340 CO 0.03 0.38 -0.15 0.42 0.01 0.00 0.00 175.29 175.97 3isn s ILE 341 N -0.61 2.97 0.02 1.08 1.01 -0.59 -1.37 121.20 123.71 3isn s ILE 341 Ca 0.07 -0.94 -0.28 0.00 0.00 0.00 0.00 60.65 59.49 3isn s ILE 341 Cb -0.08 -2.21 0.10 0.00 0.01 0.00 0.00 42.46 40.28 3isn s ILE 341 CO 0.00 0.46 0.97 -0.72 0.00 0.00 0.00 174.94 175.65 3isn s TYR 342 N -0.84 -0.24 -0.16 3.97 -0.85 -0.83 -0.50 117.35 117.91 3isn s TYR 342 Ca 0.13 0.07 0.05 0.00 -0.52 0.00 0.00 57.07 56.80 3isn s TYR 342 Cb -0.11 0.57 -0.13 0.00 0.38 0.00 0.00 41.96 42.67 3isn s TYR 342 CO 0.03 -0.57 -0.08 1.04 -1.52 0.00 0.00 175.55 174.45 3isn n GLN 343 N -0.31 0.94 -5.04 -3.49 6.02 -1.26 -2.01 117.38 112.23 3isn n GLN 343 Ca -0.07 0.06 -0.28 0.00 -0.01 0.00 0.00 57.00 56.70 3isn n GLN 343 Cb 0.61 -1.34 -0.16 0.00 1.02 0.00 0.00 30.24 30.37 3isn n GLN 343 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3isn s GLU 344 N -2.33 1.92 0.08 -1.09 2.56 -1.26 -4.92 118.70 113.65 3isn s GLU 344 Ca -0.17 -0.75 -0.37 0.00 0.00 0.00 0.00 54.97 53.68 3isn s GLU 344 Cb 0.05 -1.75 -0.17 0.00 2.00 0.00 0.00 34.13 34.26 3isn s GLU 344 CO 0.45 0.39 1.27 -2.30 -0.56 0.00 0.00 175.26 174.51 3isn n PRO 345 N 2.80 0.95 -0.03 4.30 -0.02 -1.26 -1.23 135.00 140.50 3isn n PRO 345 Ca -0.16 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 3isn n PRO 345 Cb 0.53 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 3isn n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3isn n PHE 346 N 2.24 0.00 -3.45 6.00 3.72 -1.26 -4.91 117.46 119.79 3isn n PHE 346 Ca 0.18 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.16 3isn n PHE 346 Cb 0.18 -0.11 -0.03 0.00 -0.94 0.00 0.00 39.48 38.58 3isn n PHE 346 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3isn s LYS 347 N -0.00 3.70 0.03 -1.08 3.01 -0.37 -4.71 119.74 120.32 3isn s LYS 347 Ca 0.00 -3.03 -0.24 0.00 -1.01 0.00 0.00 55.97 51.69 3isn s LYS 347 Cb 0.00 -4.30 -0.05 0.00 -1.01 0.00 0.00 37.83 32.46 3isn s LYS 347 CO 0.00 -1.25 0.75 -0.80 0.51 0.00 0.00 175.35 174.56 3isn s ASN 348 N 1.05 7.17 0.01 2.83 0.01 -1.26 -4.08 114.94 120.68 3isn s ASN 348 Ca 0.26 1.40 0.11 0.00 -0.71 0.00 0.00 52.86 53.93 3isn s ASN 348 Cb -0.10 -2.46 -0.22 0.00 0.41 0.00 0.00 41.25 38.88 3isn s ASN 348 CO -0.09 0.01 0.87 -0.07 -1.51 0.00 0.00 177.10 176.30 3isn h LEU 349 N 5.77 0.00 -7.46 0.60 3.38 -1.16 -3.48 115.31 112.96 3isn h LEU 349 Ca -0.44 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 3isn h LEU 349 Cb 1.20 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 3isn h LEU 349 CO 0.71 0.98 -0.12 -0.75 0.09 0.00 0.00 178.44 179.35 3isn s LYS 350 N -2.64 1.02 -0.04 1.13 2.20 -1.11 -5.01 119.74 115.29 3isn s LYS 350 Ca -0.03 -0.73 -0.05 0.00 -0.36 0.00 0.00 55.97 54.80 3isn s LYS 350 Cb 0.09 0.45 0.01 0.00 -1.51 0.00 0.00 37.83 36.86 3isn s LYS 350 CO 0.82 -0.39 0.13 0.95 -0.36 0.00 0.00 175.35 176.51 3isn s THR 351 N -3.74 0.02 0.18 3.43 -4.23 -1.26 -1.54 115.64 108.49 3isn s THR 351 Ca 0.03 -0.16 -0.04 0.00 -1.18 0.00 0.00 61.69 60.34 3isn s THR 351 Cb 0.02 -0.25 0.02 0.00 1.34 0.00 0.00 72.50 73.63 3isn s THR 351 CO -0.11 -0.09 0.31 0.61 -0.54 0.00 0.00 174.62 174.79 3isn n GLY 352 N 2.67 2.06 3.10 3.99 0.00 -0.78 -1.58 105.19 114.64 3isn n GLY 352 Ca -0.15 -1.30 -0.16 0.00 0.00 0.00 0.00 46.02 44.41 3isn n GLY 352 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3isn s LYS 353 N -2.21 0.66 -0.33 1.61 2.20 -1.26 -2.45 119.74 117.96 3isn s LYS 353 Ca 0.11 -0.76 0.00 0.00 -0.36 0.00 0.00 55.97 54.96 3isn s LYS 353 Cb -0.01 -0.56 0.10 0.00 -1.51 0.00 0.00 37.83 35.85 3isn s LYS 353 CO 0.08 0.12 0.11 -0.47 -0.36 0.00 0.00 175.35 174.83 3isn s TYR 354 N -1.15 1.94 -0.07 4.03 5.04 -0.55 -4.98 117.35 121.60 3isn s TYR 354 Ca -0.05 -1.94 -0.06 0.00 -2.44 0.00 0.00 57.07 52.58 3isn s TYR 354 Cb -0.09 -1.85 -0.04 0.00 0.35 0.00 0.00 41.96 40.33 3isn s TYR 354 CO 0.01 -0.88 0.18 0.00 -1.34 0.00 0.00 175.55 173.52 3isn s ALA 355 N 1.41 3.89 0.00 3.97 0.00 -1.26 -1.61 121.76 128.16 3isn s ALA 355 Ca 0.11 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.42 3isn s ALA 355 Cb -0.18 -1.98 0.00 0.00 0.00 0.00 0.00 23.12 20.96 3isn s ALA 355 CO -0.21 0.65 0.00 0.54 0.00 0.00 0.00 175.76 176.74 3isn n ARG 356 N 1.62 0.00 0.00 0.00 3.00 0.11 -5.00 116.66 116.39 3isn n ARG 356 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.68 3isn n ARG 356 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.00 3isn n ARG 356 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.63 177.51 3isn n MET 357 N 0.00 0.00 -4.48 5.56 1.56 -1.26 -4.75 117.12 113.75 3isn n MET 357 Ca 0.00 0.00 -0.40 0.00 -0.27 0.00 0.00 57.70 57.03 3isn n MET 357 Cb 0.00 0.00 -0.08 0.00 2.15 0.00 0.00 33.22 35.29 3isn n MET 357 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 3isn n ARG 358 N 0.00 -0.77 0.19 2.12 5.12 -1.26 -4.51 116.66 117.55 3isn n ARG 358 Ca 0.00 0.13 0.00 0.00 -1.93 0.00 0.00 57.85 56.05 3isn n ARG 358 Cb 0.00 -4.42 0.00 0.00 -1.16 0.00 0.00 32.46 26.88 3isn n ARG 358 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3isn n GLY 359 N -1.43 -1.63 0.00 -0.13 0.00 -1.26 -5.07 105.19 95.66 3isn n GLY 359 Ca 0.01 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.36 3isn n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3isn n ALA 360 N -3.31 0.00 -3.95 4.61 0.00 -1.26 -5.11 120.51 111.49 3isn n ALA 360 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 3isn n ALA 360 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 3isn n ALA 360 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3isn s HIS 361 N 0.00 3.01 -1.34 0.00 0.00 -1.26 -4.89 115.29 110.81 3isn s HIS 361 Ca 0.00 -2.43 0.06 0.00 -3.00 0.00 0.00 55.06 49.69 3isn s HIS 361 Cb 0.00 -2.32 0.25 0.00 -4.00 0.00 0.00 32.58 26.51 3isn s HIS 361 CO 0.00 -0.90 1.04 2.41 -1.00 0.00 0.00 174.74 176.30 3isn n THR 362 N 4.48 0.65 -3.24 -5.38 -1.04 -1.26 -4.53 114.28 103.95 3isn n THR 362 Ca -0.02 -0.40 -0.41 0.00 -2.04 0.00 0.00 64.05 61.17 3isn n THR 362 Cb 0.42 -0.15 -0.08 0.00 -1.82 0.00 0.00 70.33 68.71 3isn n THR 362 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3isn s ASN 363 N -0.61 6.33 0.20 8.00 3.84 -1.26 -4.96 114.94 126.47 3isn s ASN 363 Ca 0.18 0.02 -0.07 0.00 0.21 0.00 0.00 52.86 53.19 3isn s ASN 363 Cb 0.11 -2.27 0.13 0.00 -0.55 0.00 0.00 41.25 38.67 3isn s ASN 363 CO 0.08 -0.47 1.65 -0.78 -2.79 0.00 0.00 177.10 174.79 3isn h ASP 364 N 8.43 0.96 -0.00 -4.21 3.58 -2.00 -2.16 116.42 121.02 3isn h ASP 364 Ca -0.28 -0.29 -0.02 0.00 0.42 0.00 0.00 57.03 56.86 3isn h ASP 364 Cb 1.13 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.92 3isn h ASP 364 CO 0.77 1.05 -0.08 0.58 -2.88 0.00 0.00 179.24 178.68 3isn h VAL 365 N 0.87 1.60 -0.93 2.25 2.07 -2.00 -2.72 116.25 117.38 3isn h VAL 365 Ca 0.15 -1.87 0.25 0.00 0.82 0.00 0.00 66.70 66.05 3isn h VAL 365 Cb 0.61 2.83 -0.13 0.00 -1.52 0.00 0.00 31.29 33.08 3isn h VAL 365 CO 0.04 0.49 0.44 0.50 0.02 0.00 0.00 177.57 179.06 3isn h LYS 366 N -0.68 0.37 -0.45 1.57 3.64 -1.95 0.43 116.57 119.50 3isn h LYS 366 Ca -0.01 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 3isn h LYS 366 Cb 0.85 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.57 3isn h LYS 366 CO 0.02 0.24 -0.13 1.96 -2.27 0.00 0.00 179.45 179.27 3isn h GLN 367 N 0.38 0.83 -0.02 1.90 4.20 -1.34 -1.66 115.11 119.40 3isn h GLN 367 Ca 0.61 -0.29 -0.23 0.00 0.06 0.00 0.00 58.65 58.80 3isn h GLN 367 Cb 1.23 -0.06 0.01 0.00 0.30 0.00 0.00 27.48 28.96 3isn h GLN 367 CO -0.56 0.91 -0.93 1.25 -0.67 0.00 0.00 178.83 178.83 3isn h LEU 368 N 0.74 0.63 -1.41 1.46 5.85 -0.94 -1.86 115.31 119.79 3isn h LEU 368 Ca 0.12 -0.49 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 3isn h LEU 368 Cb 0.63 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 3isn h LEU 368 CO 0.04 1.28 0.00 0.74 -0.34 0.00 0.00 178.44 180.17 3isn h THR 369 N 0.29 1.16 -0.06 1.05 2.02 -0.88 -0.89 112.91 115.61 3isn h THR 369 Ca -0.08 -0.62 -0.22 0.00 0.77 0.00 0.00 66.41 66.26 3isn h THR 369 Cb 1.56 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.94 3isn h THR 369 CO 0.17 0.21 -0.85 -0.33 0.37 0.00 0.00 175.52 175.09 3isn h GLU 370 N 0.38 0.52 -0.22 6.66 5.08 -1.21 -2.96 114.58 122.81 3isn h GLU 370 Ca 0.09 -0.48 -0.03 0.00 -1.00 0.00 0.00 59.36 57.93 3isn h GLU 370 Cb 0.25 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 3isn h GLU 370 CO 0.01 1.11 0.01 0.00 -1.00 0.00 0.00 179.01 179.14 3isn h ALA 371 N 0.74 0.30 -0.96 3.43 0.00 -0.84 -2.16 119.26 119.77 3isn h ALA 371 Ca -0.06 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 54.87 3isn h ALA 371 Cb 1.46 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.09 3isn h ALA 371 CO 0.15 0.01 0.63 0.28 0.00 0.00 0.00 179.25 180.32 3isn h VAL 372 N 0.16 0.63 0.03 0.00 2.07 -1.24 -0.28 116.25 117.63 3isn h VAL 372 Ca 0.06 -0.14 -0.24 0.00 0.82 0.00 0.00 66.70 67.20 3isn h VAL 372 Cb 0.38 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3isn h VAL 372 CO 0.01 0.08 -1.01 1.56 0.02 0.00 0.00 177.57 178.22 3isn h GLN 373 N 0.42 0.38 -0.46 1.57 4.20 -1.28 -1.93 115.11 118.01 3isn h GLN 373 Ca 0.51 -0.46 -0.10 0.00 0.06 0.00 0.00 58.65 58.67 3isn h GLN 373 Cb 1.27 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 29.18 3isn h GLN 373 CO -0.22 1.13 -0.10 0.87 -0.67 0.00 0.00 178.83 179.84 3isn h LYS 374 N 0.20 0.88 -0.38 1.46 1.79 -0.75 -1.12 116.57 118.64 3isn h LYS 374 Ca -0.09 -0.33 -0.08 0.00 -2.18 0.00 0.00 60.65 57.96 3isn h LYS 374 Cb 1.67 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 32.26 3isn h LYS 374 CO 0.17 0.97 -0.09 0.82 -1.08 0.00 0.00 179.45 180.25 3isn h ILE 375 N 0.72 1.28 -0.09 1.86 2.04 -1.13 -0.75 117.51 121.43 3isn h ILE 375 Ca 0.12 -1.16 -0.00 0.00 1.00 0.00 0.00 64.86 64.81 3isn h ILE 375 Cb 0.65 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 37.97 3isn h ILE 375 CO 0.04 0.39 0.05 0.74 0.00 0.00 0.00 178.15 179.37 3isn h THR 376 N 0.54 1.09 -0.48 -0.27 2.02 -1.28 -0.26 112.91 114.27 3isn h THR 376 Ca 0.10 -0.26 0.07 0.00 0.77 0.00 0.00 66.41 67.09 3isn h THR 376 Cb 0.60 1.10 -0.06 0.00 -1.74 0.00 0.00 68.15 68.05 3isn h THR 376 CO 0.04 0.08 0.13 0.74 0.37 0.00 0.00 175.52 176.87 3isn h THR 377 N 0.04 0.78 -0.59 3.16 2.02 -1.18 0.39 112.91 117.53 3isn h THR 377 Ca 0.03 -0.10 0.02 0.00 0.77 0.00 0.00 66.41 67.13 3isn h THR 377 Cb 0.09 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 66.94 3isn h THR 377 CO -0.00 0.05 0.38 -0.33 0.37 0.00 0.00 175.52 175.98 3isn h GLU 378 N 0.28 0.73 -0.36 6.66 5.08 -0.81 0.50 114.58 126.66 3isn h GLU 378 Ca 0.24 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 3isn h GLU 378 Cb 0.29 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 3isn h GLU 378 CO -0.28 0.49 -0.16 1.03 -1.00 0.00 0.00 179.01 179.08 3isn h SER 379 N 0.76 0.66 0.29 1.42 0.87 -0.30 -0.68 113.55 116.55 3isn h SER 379 Ca 0.23 -0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 3isn h SER 379 Cb -0.03 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 3isn h SER 379 CO -0.07 0.83 -0.14 0.40 -0.53 0.00 0.00 176.83 177.32 3isn h ILE 380 N 0.60 0.75 -0.55 2.23 2.04 0.59 -0.56 117.51 122.61 3isn h ILE 380 Ca 0.10 -0.24 0.10 0.00 1.00 0.00 0.00 64.86 65.81 3isn h ILE 380 Cb 0.62 0.89 -0.08 0.00 -0.74 0.00 0.00 36.82 37.50 3isn h ILE 380 CO 0.04 0.05 0.08 0.58 0.00 0.00 0.00 178.15 178.90 3isn h VAL 381 N -0.51 0.64 -0.04 1.67 2.07 -0.38 0.32 116.25 120.02 3isn h VAL 381 Ca -0.04 -0.07 -0.16 0.00 0.82 0.00 0.00 66.70 67.25 3isn h VAL 381 Cb 0.38 0.42 0.01 0.00 -1.52 0.00 0.00 31.29 30.58 3isn h VAL 381 CO 0.06 0.04 -0.59 0.40 0.02 0.00 0.00 177.57 177.51 3isn h ILE 382 N 0.20 1.39 0.00 4.57 2.04 -1.13 -3.40 117.51 121.19 3isn h ILE 382 Ca 0.28 -1.98 0.00 0.00 1.00 0.00 0.00 64.86 64.16 3isn h ILE 382 Cb 0.41 2.42 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 3isn h ILE 382 CO -0.39 0.59 0.00 0.79 0.00 0.00 0.00 178.15 179.13 3isn n TRP 383 N -4.20 0.00 -1.19 1.37 8.01 -0.24 -4.96 117.44 116.22 3isn n TRP 383 Ca -0.09 0.00 -0.07 0.00 -1.31 0.00 0.00 57.50 56.03 3isn n TRP 383 Cb 0.65 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.93 3isn n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3isn n GLY 384 N 0.60 0.82 3.29 6.99 0.00 0.11 -4.98 105.19 112.02 3isn n GLY 384 Ca 0.00 -0.26 -0.16 0.00 0.00 0.00 0.00 46.02 45.60 3isn n GLY 384 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3isn s LYS 385 N -2.18 1.16 0.11 1.61 1.02 -1.25 -4.95 119.74 115.25 3isn s LYS 385 Ca 0.00 -1.50 -0.11 0.00 0.02 0.00 0.00 55.97 54.38 3isn s LYS 385 Cb 0.00 -0.82 -0.06 0.00 -0.52 0.00 0.00 37.83 36.43 3isn s LYS 385 CO 0.00 0.12 0.46 0.95 -0.92 0.00 0.00 175.35 175.96 3isn s THR 386 N -3.17 5.00 0.42 2.17 -4.23 -1.26 -3.78 115.64 110.79 3isn s THR 386 Ca 0.19 0.58 -0.15 0.00 -1.18 0.00 0.00 61.69 61.12 3isn s THR 386 Cb 0.01 -3.68 -0.08 0.00 1.34 0.00 0.00 72.50 70.09 3isn s THR 386 CO 0.03 0.25 0.86 -2.16 -0.54 0.00 0.00 174.62 173.06 3isn s PRO 387 N -1.99 3.97 0.10 3.99 0.05 -1.26 -4.56 135.00 135.29 3isn s PRO 387 Ca 0.36 0.79 -0.29 0.00 0.05 0.00 0.00 61.00 61.90 3isn s PRO 387 Cb -0.14 -2.28 -0.06 0.00 0.05 0.00 0.00 34.50 32.07 3isn s PRO 387 CO 0.19 -0.06 0.94 0.21 0.05 0.00 0.00 177.00 178.32 3isn s LYS 388 N -3.59 4.67 -0.16 4.56 2.47 0.43 -4.27 119.74 123.85 3isn s LYS 388 Ca 0.56 1.41 -0.06 0.00 -1.56 0.00 0.00 55.97 56.31 3isn s LYS 388 Cb -0.10 -3.38 -0.04 0.00 -1.46 0.00 0.00 37.83 32.85 3isn s LYS 388 CO 0.25 0.21 0.06 -0.06 0.16 0.00 0.00 175.35 175.96 3isn s PHE 389 N 0.04 3.28 -0.49 4.03 0.40 -0.44 -0.39 117.98 124.42 3isn s PHE 389 Ca 0.46 0.15 -0.19 0.00 -0.60 0.00 0.00 56.93 56.75 3isn s PHE 389 Cb -0.23 -2.01 0.05 0.00 0.51 0.00 0.00 43.02 41.35 3isn s PHE 389 CO 0.29 0.28 0.60 0.15 0.70 0.00 0.00 175.22 177.24 3isn s LYS 390 N -0.04 3.13 -0.27 0.44 1.02 0.95 -0.20 119.74 124.77 3isn s LYS 390 Ca 0.06 -0.83 -0.10 0.00 0.02 0.00 0.00 55.97 55.12 3isn s LYS 390 Cb -0.12 -4.07 -0.04 0.00 -0.52 0.00 0.00 37.83 33.08 3isn s LYS 390 CO 0.01 -1.15 0.15 -0.51 -0.92 0.00 0.00 175.35 172.93 3isn s LEU 391 N 2.56 3.83 -0.97 3.17 1.43 0.08 -3.50 118.68 125.28 3isn s LEU 391 Ca 0.15 -0.07 -0.20 0.00 -1.03 0.00 0.00 54.13 52.98 3isn s LEU 391 Cb -0.19 -2.05 -0.10 0.00 0.03 0.00 0.00 46.19 43.88 3isn s LEU 391 CO 0.13 -0.04 1.98 -2.65 0.23 0.00 0.00 176.35 176.00 3isn n PRO 392 N 4.97 1.86 -3.60 1.29 -0.02 -1.26 -1.97 135.00 136.26 3isn n PRO 392 Ca -0.15 -2.12 -0.09 0.00 -2.02 0.00 0.00 63.50 59.12 3isn n PRO 392 Cb 0.52 -3.10 -0.05 0.00 -0.02 0.00 0.00 33.50 30.84 3isn n PRO 392 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3isn s ILE 393 N 5.24 0.00 0.08 4.25 2.07 -1.26 -4.99 121.20 126.59 3isn s ILE 393 Ca 0.56 0.00 -0.31 0.00 -1.41 0.00 0.00 60.65 59.50 3isn s ILE 393 Cb 0.12 -1.00 -0.07 0.00 0.13 0.00 0.00 42.46 41.65 3isn s ILE 393 CO 0.08 0.00 1.30 -1.10 -1.91 0.00 0.00 174.94 173.31 3isn s GLN 394 N -0.90 4.37 0.28 3.50 -1.52 -1.26 -4.52 119.66 119.60 3isn s GLN 394 Ca 0.01 1.92 0.04 0.00 -1.95 0.00 0.00 55.36 55.38 3isn s GLN 394 Cb -0.01 -3.33 0.74 0.00 -0.22 0.00 0.00 33.01 30.18 3isn s GLN 394 CO -0.02 -0.37 1.37 1.17 -0.25 0.00 0.00 175.29 177.19 3isn n LYS 395 N 4.11 -0.07 -0.06 2.91 4.81 -1.26 -1.25 118.16 127.36 3isn n LYS 395 Ca 0.10 1.30 -0.15 0.00 -0.87 0.00 0.00 58.31 58.69 3isn n LYS 395 Cb 0.44 -2.09 -0.06 0.00 0.02 0.00 0.00 35.03 33.34 3isn n LYS 395 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 3isn h GLU 396 N 0.00 0.74 0.12 1.64 3.07 -1.98 -0.04 114.58 118.14 3isn h GLU 396 Ca 0.56 -0.51 0.01 0.00 -0.50 0.00 0.00 59.36 58.92 3isn h GLU 396 Cb 1.21 0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 29.17 3isn h GLU 396 CO -0.80 1.13 -0.21 1.15 -1.40 0.00 0.00 179.01 178.88 3isn h THR 397 N 0.47 0.53 -0.72 1.13 2.02 -1.57 0.99 112.91 115.77 3isn h THR 397 Ca -0.01 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 3isn h THR 397 Cb 1.15 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 3isn h THR 397 CO 0.12 0.00 0.20 -0.25 0.37 0.00 0.00 175.52 175.95 3isn h TRP 398 N -0.40 1.18 -0.32 3.16 2.91 -1.25 -2.95 115.95 118.29 3isn h TRP 398 Ca 0.02 -0.13 -0.13 0.00 1.13 0.00 0.00 58.89 59.78 3isn h TRP 398 Cb 0.41 -0.34 -0.01 0.00 -0.51 0.00 0.00 29.16 28.72 3isn h TRP 398 CO -0.19 0.95 -0.32 0.93 -1.03 0.00 0.00 178.44 178.77 3isn h GLU 399 N 1.07 0.70 0.00 2.65 5.08 -0.74 -0.78 114.58 122.56 3isn h GLU 399 Ca 0.23 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3isn h GLU 399 Cb 0.34 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3isn h GLU 399 CO -0.00 0.93 0.00 1.79 -1.00 0.00 0.00 179.01 180.72 3isn h THR 400 N 0.59 0.00 0.00 1.13 1.35 -0.65 -3.40 112.91 111.93 3isn h THR 400 Ca 0.07 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 3isn h THR 400 Cb 0.83 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 3isn h THR 400 CO 0.07 0.00 -0.56 0.79 -0.25 0.00 0.00 175.52 175.57 3isn n TRP 401 N -2.99 0.00 -0.32 4.73 7.02 -1.05 -4.89 117.44 119.95 3isn n TRP 401 Ca 0.00 0.00 0.15 0.00 -1.02 0.00 0.00 57.50 56.64 3isn n TRP 401 Cb 0.26 0.00 0.34 0.00 -2.42 0.00 0.00 31.31 29.49 3isn n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 3isn h TRP 402 N 0.00 0.75 0.00 -5.99 5.08 -1.37 -1.87 115.95 112.56 3isn h TRP 402 Ca 0.00 0.04 0.00 0.00 1.08 0.00 0.00 58.89 60.01 3isn h TRP 402 Cb 0.56 -0.19 0.00 0.00 -3.00 0.00 0.00 29.16 26.53 3isn h TRP 402 CO 0.00 -0.04 0.00 1.79 -1.28 0.00 0.00 178.44 178.91 3isn h THR 403 N 0.43 0.00 0.00 0.12 1.35 -1.87 -1.42 112.91 111.52 3isn h THR 403 Ca 0.60 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 66.38 3isn h THR 403 Cb 1.17 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 3isn h THR 403 CO -0.53 0.00 0.00 -0.33 -0.25 0.00 0.00 175.52 174.41 3isn h GLU 404 N 0.00 0.00 0.00 4.72 4.39 -1.71 -3.14 114.58 118.84 3isn h GLU 404 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3isn h GLU 404 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3isn h GLU 404 CO 0.00 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.51 3isn n TYR 405 N -2.72 0.00 -2.27 4.33 4.02 -0.56 -5.03 117.16 114.92 3isn n TYR 405 Ca 0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.49 3isn n TYR 405 Cb 0.30 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.59 3isn n TYR 405 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 3isn s TRP 406 N -0.07 3.32 0.00 -0.72 -0.11 -1.05 -4.84 118.94 115.47 3isn s TRP 406 Ca 0.00 1.20 0.00 0.00 1.22 0.00 0.00 56.10 58.52 3isn s TRP 406 Cb 0.00 -3.56 0.00 0.00 -1.50 0.00 0.00 33.47 28.41 3isn s TRP 406 CO 0.00 -1.77 0.53 1.04 -4.62 0.00 0.00 176.95 172.13 3isn n GLN 407 N 3.21 0.63 -3.70 5.86 6.02 -1.26 -4.55 117.38 123.59 3isn n GLN 407 Ca 0.08 -0.67 -0.26 0.00 -0.01 0.00 0.00 57.00 56.14 3isn n GLN 407 Cb 0.44 -0.75 -0.03 0.00 1.02 0.00 0.00 30.24 30.92 3isn n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3isn s ALA 408 N -0.28 3.83 -2.47 -1.58 0.00 -1.26 -4.70 121.76 115.30 3isn s ALA 408 Ca 0.00 -0.93 0.26 0.00 0.00 0.00 0.00 51.96 51.30 3isn s ALA 408 Cb 0.00 -1.96 0.94 0.00 0.00 0.00 0.00 23.12 22.10 3isn s ALA 408 CO 0.00 0.32 1.68 0.25 0.00 0.00 0.00 175.76 178.01 3isn n THR 409 N -0.99 0.05 -4.46 0.00 -2.24 -1.26 -4.87 114.28 100.51 3isn n THR 409 Ca -0.06 -0.29 -0.26 0.00 -2.27 0.00 0.00 64.05 61.17 3isn n THR 409 Cb 0.55 0.52 -0.10 0.00 -2.10 0.00 0.00 70.33 69.20 3isn n THR 409 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3isn s TRP 410 N -1.95 2.51 -0.07 4.78 1.48 -1.26 -4.78 118.94 119.65 3isn s TRP 410 Ca 0.36 -0.56 -0.03 0.00 -1.06 0.00 0.00 56.10 54.82 3isn s TRP 410 Cb 0.20 -1.64 0.04 0.00 -1.16 0.00 0.00 33.47 30.92 3isn s TRP 410 CO 0.32 0.45 0.12 0.42 -4.06 0.00 0.00 176.95 174.20 3isn s ILE 411 N -2.62 -0.20 0.70 0.66 1.01 -1.26 -5.04 121.20 114.45 3isn s ILE 411 Ca 0.35 0.38 -0.11 0.00 0.00 0.00 0.00 60.65 61.27 3isn s ILE 411 Cb 0.05 -0.24 0.01 0.00 0.01 0.00 0.00 42.46 42.29 3isn s ILE 411 CO 0.19 0.16 1.08 -2.16 0.00 0.00 0.00 174.94 174.21 3isn s PRO 412 N 2.24 2.93 0.54 2.79 0.04 -1.26 -4.91 135.00 137.36 3isn s PRO 412 Ca 0.04 0.55 -0.19 0.00 0.04 0.00 0.00 61.00 61.44 3isn s PRO 412 Cb -0.12 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 3isn s PRO 412 CO -0.05 -1.01 1.10 -2.00 0.04 0.00 0.00 177.00 175.09 3isn s GLU 413 N -5.29 3.44 0.11 4.56 2.56 -1.26 -4.97 118.70 117.85 3isn s GLU 413 Ca 0.58 1.52 -0.17 0.00 0.00 0.00 0.00 54.97 56.91 3isn s GLU 413 Cb -0.11 -2.03 0.04 0.00 2.00 0.00 0.00 34.13 34.03 3isn s GLU 413 CO 0.53 -0.76 0.41 1.67 -0.56 0.00 0.00 175.26 176.54 3isn s TRP 414 N -1.88 -0.22 0.18 5.30 -2.14 -1.26 -1.32 118.94 117.60 3isn s TRP 414 Ca 0.71 -0.05 -0.02 0.00 2.66 0.00 0.00 56.10 59.40 3isn s TRP 414 Cb -0.22 0.26 -0.04 0.00 -3.10 0.00 0.00 33.47 30.38 3isn s TRP 414 CO 0.26 -0.69 0.14 -1.83 -2.66 0.00 0.00 176.95 172.18 3isn s GLU 415 N -3.60 1.14 -0.18 3.25 -1.05 0.72 -4.88 118.70 114.11 3isn s GLU 415 Ca 0.02 -1.51 -0.04 0.00 -0.15 0.00 0.00 54.97 53.29 3isn s GLU 415 Cb 0.01 0.28 -0.02 0.00 -0.44 0.00 0.00 34.13 33.97 3isn s GLU 415 CO -0.11 -0.37 -0.04 -0.06 0.95 0.00 0.00 175.26 175.63 3isn s PHE 416 N -4.10 2.99 0.41 4.83 0.08 -1.26 -0.74 117.98 120.18 3isn s PHE 416 Ca 0.32 -0.50 0.06 0.00 0.12 0.00 0.00 56.93 56.93 3isn s PHE 416 Cb 0.06 -2.01 0.06 0.00 -0.57 0.00 0.00 43.02 40.56 3isn s PHE 416 CO 0.08 -0.21 0.50 1.33 -0.10 0.00 0.00 175.22 176.81 3isn n VAL 417 N 3.98 0.00 -3.33 -0.44 0.24 -0.83 -4.88 118.33 113.07 3isn n VAL 417 Ca -0.17 -1.42 -0.26 0.00 -2.04 0.00 0.00 64.34 60.45 3isn n VAL 417 Cb 0.52 -0.53 -0.08 0.00 -1.47 0.00 0.00 33.84 32.28 3isn n VAL 417 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3isn n ASN 418 N -2.36 1.73 -4.70 -1.34 3.02 -1.26 -4.53 115.26 105.83 3isn n ASN 418 Ca 0.08 -3.01 -0.43 0.00 -0.03 0.00 0.00 54.58 51.19 3isn n ASN 418 Cb 0.43 -0.65 -0.02 0.00 -0.61 0.00 0.00 39.78 38.93 3isn n ASN 418 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3isn n THR 419 N 1.29 1.29 -2.49 3.41 -1.04 -1.26 -5.05 114.28 110.43 3isn n THR 419 Ca 0.25 -0.32 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 3isn n THR 419 Cb 0.47 -1.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.37 3isn n THR 419 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3isn n PRO 420 N 1.59 2.40 -1.60 -2.82 -0.05 -1.26 -5.00 135.00 128.26 3isn n PRO 420 Ca 0.09 0.00 -0.35 0.00 -0.05 0.00 0.00 63.50 63.18 3isn n PRO 420 Cb 0.34 0.00 -0.04 0.00 -0.05 0.00 0.00 33.50 33.75 3isn n PRO 420 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 175.50 173.15 3isn n PRO 421 N -0.32 3.77 -0.14 0.54 -0.02 -1.26 -3.92 135.00 133.66 3isn n PRO 421 Ca 0.00 -2.65 0.04 0.00 -2.02 0.00 0.00 63.50 58.87 3isn n PRO 421 Cb 0.00 -2.56 0.11 0.00 -0.02 0.00 0.00 33.50 31.03 3isn n PRO 421 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 3isn n LEU 422 N 2.31 2.68 0.01 2.45 -0.00 -1.26 -4.66 117.00 118.53 3isn n LEU 422 Ca 0.64 -2.18 -0.08 0.00 -0.00 0.00 0.00 56.01 54.39 3isn n LEU 422 Cb 0.35 -0.20 -0.06 0.00 -0.00 0.00 0.00 43.42 43.50 3isn n LEU 422 CO 0.64 0.65 0.27 0.58 -0.00 0.00 0.00 177.39 179.53 3isn h VAL 423 N 1.19 0.74 0.00 1.47 2.07 -1.97 -3.30 116.25 116.45 3isn h VAL 423 Ca 0.00 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.20 3isn h VAL 423 Cb 0.75 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 3isn h VAL 423 CO 0.02 0.22 0.00 1.17 0.02 0.00 0.00 177.57 179.01 3isn n LYS 424 N -4.83 0.60 -0.00 1.57 3.00 -1.26 -1.98 118.16 115.26 3isn n LYS 424 Ca -0.06 0.00 0.02 0.00 -0.00 0.00 0.00 58.31 58.27 3isn n LYS 424 Cb 0.23 -1.29 -0.03 0.00 0.00 0.00 0.00 35.03 33.94 3isn n LYS 424 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 3isn n LEU 425 N 0.26 0.00 -0.87 3.14 4.32 -1.24 -4.54 117.00 118.07 3isn n LEU 425 Ca 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 56.01 56.11 3isn n LEU 425 Cb 0.17 0.01 0.19 0.00 -1.62 0.00 0.00 43.42 42.17 3isn n LEU 425 CO 0.00 0.01 0.68 0.79 -1.22 0.00 0.00 177.39 177.65 3isn n TRP 426 N -1.70 0.01 0.00 -1.77 7.02 -0.84 -4.91 117.44 115.26 3isn n TRP 426 Ca -0.01 -0.01 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 3isn n TRP 426 Cb 0.16 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.05 3isn n TRP 426 CO 0.00 0.00 0.00 0.98 -2.02 0.00 0.00 177.69 176.65