#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rt1 s THR 7 N 0.00 1.96 -0.09 2.62 -4.23 -1.26 -4.66 115.64 109.98 1rt1 s THR 7 Ca 0.00 -0.89 -0.25 0.00 -1.18 0.00 0.00 61.69 59.37 1rt1 s THR 7 Cb 0.00 -1.77 -0.03 0.00 1.34 0.00 0.00 72.50 72.04 1rt1 s THR 7 CO 0.00 0.53 0.80 0.54 -0.54 0.00 0.00 174.62 175.94 1rt1 s VAL 8 N 1.17 4.96 -0.86 2.29 0.11 -1.26 -4.89 120.40 121.91 1rt1 s VAL 8 Ca 0.01 1.62 -0.26 0.00 -2.93 0.00 0.00 61.98 60.42 1rt1 s VAL 8 Cb -0.14 -4.13 -0.15 0.00 -1.53 0.00 0.00 36.38 30.43 1rt1 s VAL 8 CO -0.09 0.15 2.33 -2.16 -3.33 0.00 0.00 175.10 172.01 1rt1 s PRO 9 N 1.32 1.53 0.61 1.54 0.04 -1.26 -4.48 135.00 134.30 1rt1 s PRO 9 Ca 0.40 0.26 -0.11 0.00 0.04 0.00 0.00 61.00 61.59 1rt1 s PRO 9 Cb -0.18 -4.84 -0.04 0.00 0.04 0.00 0.00 34.50 29.48 1rt1 s PRO 9 CO 0.18 -4.66 1.01 0.08 0.04 0.00 0.00 177.00 173.65 1rt1 s VAL 10 N 15.16 4.72 0.28 -0.36 1.01 -1.26 -5.08 120.40 134.88 1rt1 s VAL 10 Ca 0.89 0.82 -0.15 0.00 0.00 0.00 0.00 61.98 63.54 1rt1 s VAL 10 Cb -0.11 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.42 1rt1 s VAL 10 CO 0.10 -1.12 0.60 -0.54 0.00 0.00 0.00 175.10 174.13 1rt1 s LYS 11 N -5.14 1.75 0.30 2.72 1.02 -1.26 -4.78 119.74 114.35 1rt1 s LYS 11 Ca 0.54 -1.23 -0.03 0.00 0.02 0.00 0.00 55.97 55.27 1rt1 s LYS 11 Cb -0.11 0.53 -0.04 0.00 -0.52 0.00 0.00 37.83 37.69 1rt1 s LYS 11 CO 0.53 -0.77 0.54 -0.51 -0.92 0.00 0.00 175.35 174.23 1rt1 s LEU 12 N -3.01 4.04 0.58 3.17 1.43 -1.26 -1.98 118.68 121.65 1rt1 s LEU 12 Ca 0.18 0.61 -0.20 0.00 -1.03 0.00 0.00 54.13 53.69 1rt1 s LEU 12 Cb -0.03 -3.44 -0.03 0.00 0.03 0.00 0.00 46.19 42.71 1rt1 s LEU 12 CO 0.10 -0.23 1.31 -0.54 0.23 0.00 0.00 176.35 177.22 1rt1 s LYS 13 N -3.80 2.94 -0.20 1.70 1.02 -0.41 -4.62 119.74 116.37 1rt1 s LYS 13 Ca 0.42 2.10 -0.40 0.00 0.02 0.00 0.00 55.97 58.11 1rt1 s LYS 13 Cb -0.10 -2.08 -0.17 0.00 -0.52 0.00 0.00 37.83 34.96 1rt1 s LYS 13 CO 0.32 -1.31 1.58 -2.30 -0.92 0.00 0.00 175.35 172.73 1rt1 n PRO 14 N -1.38 0.92 0.00 -1.68 -0.02 -1.26 -0.98 135.00 130.60 1rt1 n PRO 14 Ca 0.13 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1rt1 n PRO 14 Cb 0.47 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 1rt1 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rt1 n GLY 15 N 3.58 2.16 3.85 -1.23 0.00 -1.26 -5.04 105.19 107.26 1rt1 n GLY 15 Ca 0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1rt1 n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rt1 s MET 16 N -0.33 3.85 0.13 1.61 -1.94 -0.16 -5.09 119.30 117.38 1rt1 s MET 16 Ca 0.00 0.81 0.08 0.00 -1.71 0.00 0.00 55.69 54.87 1rt1 s MET 16 Cb 0.00 -2.18 -0.04 0.00 2.01 0.00 0.00 34.83 34.62 1rt1 s MET 16 CO 0.00 -0.28 -0.18 0.34 -0.01 0.00 0.00 175.02 174.89 1rt1 s ASP 17 N -3.30 2.42 0.95 3.03 2.15 -1.26 -4.86 116.67 115.80 1rt1 s ASP 17 Ca 0.57 -0.78 -0.12 0.00 0.43 0.00 0.00 52.55 52.65 1rt1 s ASP 17 Cb -0.10 -0.12 0.10 0.00 -0.30 0.00 0.00 42.92 42.49 1rt1 s ASP 17 CO 0.35 -0.03 0.74 0.61 -0.17 0.00 0.00 175.17 176.68 1rt1 n GLY 18 N 0.65 -1.30 3.76 2.66 0.00 -1.26 -4.95 105.19 104.75 1rt1 n GLY 18 Ca -0.16 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 44.73 1rt1 n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rt1 s PRO 19 N -4.10 3.57 -0.36 1.61 0.04 -1.26 -4.92 135.00 129.58 1rt1 s PRO 19 Ca 0.62 2.00 0.15 0.00 0.04 0.00 0.00 61.00 63.81 1rt1 s PRO 19 Cb -0.22 -2.41 0.42 0.00 0.04 0.00 0.00 34.50 32.33 1rt1 s PRO 19 CO 0.63 -0.77 0.91 1.63 0.04 0.00 0.00 177.00 179.44 1rt1 n LYS 20 N -0.58 1.41 -3.04 4.56 5.02 -1.20 -0.93 118.16 123.41 1rt1 n LYS 20 Ca 0.08 -3.48 -0.40 0.00 -2.02 0.00 0.00 58.31 52.49 1rt1 n LYS 20 Cb 0.46 -1.51 -0.05 0.00 -0.02 0.00 0.00 35.03 33.91 1rt1 n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1rt1 s VAL 21 N -3.23 4.78 0.45 -0.18 1.01 -0.30 -4.81 120.40 118.11 1rt1 s VAL 21 Ca 0.33 1.54 -0.18 0.00 0.00 0.00 0.00 61.98 63.67 1rt1 s VAL 21 Cb 0.42 -4.07 -0.09 0.00 0.00 0.00 0.00 36.38 32.64 1rt1 s VAL 21 CO -0.02 0.38 0.92 -1.59 0.00 0.00 0.00 175.10 174.79 1rt1 s LYS 22 N -0.08 4.05 -0.11 2.72 -2.85 -1.26 -3.79 119.74 118.42 1rt1 s LYS 22 Ca 0.37 0.94 -0.30 0.00 -1.00 0.00 0.00 55.97 55.98 1rt1 s LYS 22 Cb -0.20 -2.21 -0.02 0.00 -2.06 0.00 0.00 37.83 33.33 1rt1 s LYS 22 CO 0.21 -0.10 1.24 -1.14 0.10 0.00 0.00 175.35 175.67 1rt1 s GLN 23 N -3.57 4.29 0.52 1.78 2.00 -1.26 -4.61 119.66 118.82 1rt1 s GLN 23 Ca 0.59 1.68 -0.19 0.00 -2.00 0.00 0.00 55.36 55.45 1rt1 s GLN 23 Cb -0.10 -3.66 -0.07 0.00 0.80 0.00 0.00 33.01 29.98 1rt1 s GLN 23 CO 0.22 -0.58 1.04 1.67 -0.50 0.00 0.00 175.29 177.14 1rt1 s TRP 24 N 2.87 3.01 0.53 1.67 -2.14 -1.26 -4.97 118.94 118.65 1rt1 s TRP 24 Ca 0.56 1.55 -0.22 0.00 2.66 0.00 0.00 56.10 60.65 1rt1 s TRP 24 Cb -0.24 -3.04 -0.06 0.00 -3.10 0.00 0.00 33.47 27.04 1rt1 s TRP 24 CO 0.19 -0.90 1.38 -1.25 -2.66 0.00 0.00 176.95 173.71 1rt1 s PRO 25 N -3.52 3.24 0.22 3.25 0.04 -1.26 -4.95 135.00 132.02 1rt1 s PRO 25 Ca 0.66 2.30 0.11 0.00 0.04 0.00 0.00 61.00 64.10 1rt1 s PRO 25 Cb -0.16 -2.34 -0.05 0.00 0.04 0.00 0.00 34.50 31.99 1rt1 s PRO 25 CO 0.25 -1.13 -0.22 -0.51 0.04 0.00 0.00 177.00 175.44 1rt1 s LEU 26 N -3.36 2.49 0.72 -3.56 1.43 -1.26 -5.13 118.68 110.01 1rt1 s LEU 26 Ca 0.69 -0.93 -0.11 0.00 -1.03 0.00 0.00 54.13 52.76 1rt1 s LEU 26 Cb -0.42 -1.08 0.02 0.00 0.03 0.00 0.00 46.19 44.75 1rt1 s LEU 26 CO 0.50 0.06 1.07 -0.89 0.23 0.00 0.00 176.35 177.32 1rt1 s THR 27 N -2.05 3.81 0.27 5.49 2.01 -1.26 -4.87 115.64 119.04 1rt1 s THR 27 Ca 0.23 0.59 -0.00 0.00 0.31 0.00 0.00 61.69 62.81 1rt1 s THR 27 Cb -0.06 -3.27 0.12 0.00 0.01 0.00 0.00 72.50 69.29 1rt1 s THR 27 CO 0.11 -0.77 1.78 -0.08 -0.69 0.00 0.00 174.62 174.97 1rt1 h GLU 28 N -0.84 0.71 -0.65 4.92 4.81 -2.00 -1.50 114.58 120.03 1rt1 h GLU 28 Ca -0.44 -0.19 0.04 0.00 -0.13 0.00 0.00 59.36 58.64 1rt1 h GLU 28 Cb 1.22 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.47 1rt1 h GLU 28 CO 0.56 0.75 0.39 1.05 -0.73 0.00 0.00 179.01 181.02 1rt1 h GLU 29 N 0.67 0.72 -0.16 1.92 4.11 -2.00 -1.40 114.58 118.44 1rt1 h GLU 29 Ca 0.13 -0.04 -0.16 0.00 0.07 0.00 0.00 59.36 59.36 1rt1 h GLU 29 Cb 0.45 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.54 1rt1 h GLU 29 CO 0.02 0.48 -0.53 0.87 0.07 0.00 0.00 179.01 179.92 1rt1 h LYS 30 N 0.74 0.63 -0.64 1.06 1.57 -1.88 -2.72 116.57 115.33 1rt1 h LYS 30 Ca 0.27 -0.47 -0.07 0.00 -1.87 0.00 0.00 60.65 58.51 1rt1 h LYS 30 Cb 0.09 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 1rt1 h LYS 30 CO -0.14 1.09 0.11 0.82 -0.57 0.00 0.00 179.45 180.77 1rt1 h ILE 31 N 0.30 1.26 -0.89 1.86 2.04 -1.12 -1.43 117.51 119.53 1rt1 h ILE 31 Ca -0.02 -1.01 0.00 0.00 1.00 0.00 0.00 64.86 64.83 1rt1 h ILE 31 Cb 1.16 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.87 1rt1 h ILE 31 CO 0.11 0.38 0.57 0.11 0.00 0.00 0.00 178.15 179.32 1rt1 h LYS 32 N 0.97 1.18 -0.09 2.37 1.57 -1.25 -0.03 116.57 121.29 1rt1 h LYS 32 Ca 0.20 -0.08 -0.14 0.00 -1.87 0.00 0.00 60.65 58.76 1rt1 h LYS 32 Cb 0.43 -0.26 0.01 0.00 0.08 0.00 0.00 32.23 32.48 1rt1 h LYS 32 CO 0.01 0.79 -0.48 0.00 -0.57 0.00 0.00 179.45 179.20 1rt1 h ALA 33 N 1.42 0.18 -0.95 3.86 0.00 -1.28 -2.32 119.26 120.18 1rt1 h ALA 33 Ca 0.32 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1rt1 h ALA 33 Cb -0.11 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 1rt1 h ALA 33 CO -0.07 0.35 0.57 -0.07 0.00 0.00 0.00 179.25 180.03 1rt1 h LEU 34 N 0.06 1.14 0.41 0.00 3.38 -1.08 0.23 115.31 119.44 1rt1 h LEU 34 Ca -0.04 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1rt1 h LEU 34 Cb 1.14 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1rt1 h LEU 34 CO 0.10 0.87 -0.20 0.58 0.09 0.00 0.00 178.44 179.88 1rt1 h VAL 35 N 1.31 0.59 0.05 1.22 2.07 -0.98 0.11 116.25 120.61 1rt1 h VAL 35 Ca 0.34 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.87 1rt1 h VAL 35 Cb -0.06 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 1rt1 h VAL 35 CO -0.06 0.00 -0.46 -0.33 0.02 0.00 0.00 177.57 176.74 1rt1 h GLU 36 N -0.56 -0.59 -0.93 1.57 5.08 -0.98 -1.38 114.58 116.79 1rt1 h GLU 36 Ca -0.06 0.04 0.20 0.00 -1.00 0.00 0.00 59.36 58.55 1rt1 h GLU 36 Cb 0.43 0.13 -0.11 0.00 0.50 0.00 0.00 28.75 29.70 1rt1 h GLU 36 CO 0.09 -0.40 0.49 0.82 -1.00 0.00 0.00 179.01 179.01 1rt1 h ILE 37 N -0.62 0.59 0.01 3.13 2.04 -0.48 -2.23 117.51 119.95 1rt1 h ILE 37 Ca 0.00 -0.19 -0.20 0.00 1.00 0.00 0.00 64.86 65.47 1rt1 h ILE 37 Cb 0.64 -0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 1rt1 h ILE 37 CO -0.28 0.10 -0.94 0.00 0.00 0.00 0.00 178.15 177.03 1rt1 h THR 39 N 0.01 1.26 0.82 0.00 1.35 -0.68 0.11 112.91 115.78 1rt1 h THR 39 Ca -0.02 -1.00 -0.04 0.00 -0.55 0.00 0.00 66.41 64.81 1rt1 h THR 39 Cb 1.65 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 1rt1 h THR 39 CO 0.13 0.36 -0.46 -0.33 -0.25 0.00 0.00 175.52 174.97 1rt1 h GLU 40 N 0.85 -1.15 -0.87 4.72 4.39 -1.44 0.22 114.58 121.30 1rt1 h GLU 40 Ca 0.17 0.08 0.19 0.00 0.34 0.00 0.00 59.36 60.14 1rt1 h GLU 40 Cb 0.43 0.26 -0.06 0.00 -0.10 0.00 0.00 28.75 29.28 1rt1 h GLU 40 CO 0.01 -0.77 0.58 0.52 -1.16 0.00 0.00 179.01 178.19 1rt1 h MET 41 N -1.19 0.41 -0.29 2.33 2.86 -1.21 0.20 114.93 118.03 1rt1 h MET 41 Ca -0.11 -0.02 -0.14 0.00 -2.06 0.00 0.00 59.70 57.36 1rt1 h MET 41 Cb 0.94 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.50 1rt1 h MET 41 CO 0.14 0.27 -0.40 1.49 1.06 0.00 0.00 176.91 179.47 1rt1 h GLU 42 N 0.42 0.70 -0.17 1.72 4.81 -0.34 -0.66 114.58 121.05 1rt1 h GLU 42 Ca 0.45 -0.36 -0.12 0.00 -0.13 0.00 0.00 59.36 59.20 1rt1 h GLU 42 Cb 1.09 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1rt1 h GLU 42 CO -0.17 0.97 -0.35 0.87 -0.73 0.00 0.00 179.01 179.60 1rt1 h LYS 43 N 0.57 0.55 0.00 1.92 1.79 0.23 -3.03 116.57 118.59 1rt1 h LYS 43 Ca 0.05 -0.36 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 1rt1 h LYS 43 Cb 0.93 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.63 1rt1 h LYS 43 CO 0.08 0.97 0.00 0.39 -1.08 0.00 0.00 179.45 179.81 1rt1 n GLU 44 N -4.31 0.29 -0.79 3.15 1.02 0.16 -4.87 120.64 115.29 1rt1 n GLU 44 Ca -0.06 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1rt1 n GLU 44 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1rt1 n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rt1 n GLY 45 N 0.03 0.75 0.10 0.62 0.00 -0.91 -4.95 105.19 100.82 1rt1 n GLY 45 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 1rt1 n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rt1 h LYS 46 N 2.53 0.00 -4.49 1.61 1.57 -1.40 -3.43 116.57 112.96 1rt1 h LYS 46 Ca 0.00 -0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.55 1rt1 h LYS 46 Cb 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.12 1rt1 h LYS 46 CO 0.00 0.82 -0.71 0.96 -0.57 0.00 0.00 179.45 179.94 1rt1 s ILE 47 N -3.14 0.50 -0.00 1.86 -4.36 -1.19 0.14 121.20 115.01 1rt1 s ILE 47 Ca -0.00 -1.37 0.03 0.00 -0.26 0.00 0.00 60.65 59.05 1rt1 s ILE 47 Cb 0.11 -0.95 -0.01 0.00 1.25 0.00 0.00 42.46 42.87 1rt1 s ILE 47 CO 0.79 -0.59 -0.09 -0.44 0.24 0.00 0.00 174.94 174.86 1rt1 s SER 48 N -2.10 1.00 0.58 4.36 0.01 -0.72 -4.20 113.70 112.63 1rt1 s SER 48 Ca -0.03 -0.17 -0.20 0.00 1.31 0.00 0.00 55.95 56.86 1rt1 s SER 48 Cb -0.04 -0.11 -0.04 0.00 0.21 0.00 0.00 66.02 66.05 1rt1 s SER 48 CO -0.02 0.10 1.33 -0.54 0.41 0.00 0.00 173.24 174.52 1rt1 s LYS 49 N -0.24 2.95 0.23 12.44 1.02 -1.26 -1.42 119.74 133.46 1rt1 s LYS 49 Ca 0.03 2.16 0.04 0.00 0.02 0.00 0.00 55.97 58.22 1rt1 s LYS 49 Cb -0.03 -2.11 -0.05 0.00 -0.52 0.00 0.00 37.83 35.11 1rt1 s LYS 49 CO -0.00 -1.31 -0.02 0.96 -0.92 0.00 0.00 175.35 174.06 1rt1 s ILE 50 N -1.35 1.11 0.43 2.17 -4.36 -0.98 -4.84 121.20 113.38 1rt1 s ILE 50 Ca 0.75 -2.05 -0.04 0.00 -0.26 0.00 0.00 60.65 59.06 1rt1 s ILE 50 Cb -0.39 -2.32 0.09 0.00 1.25 0.00 0.00 42.46 41.09 1rt1 s ILE 50 CO 0.44 -0.35 0.58 0.61 0.24 0.00 0.00 174.94 176.46 1rt1 n GLY 51 N -0.42 -0.14 0.13 6.27 0.00 -1.26 -4.78 105.19 104.98 1rt1 n GLY 51 Ca -0.05 -1.87 0.15 0.00 0.00 0.00 0.00 46.02 44.24 1rt1 n GLY 51 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rt1 n PRO 52 N -2.15 0.84 0.20 1.61 -0.04 -1.26 -3.45 135.00 130.75 1rt1 n PRO 52 Ca 0.08 -0.26 0.13 0.00 -0.04 0.00 0.00 63.50 63.41 1rt1 n PRO 52 Cb 0.30 -1.49 0.26 0.00 -0.04 0.00 0.00 33.50 32.53 1rt1 n PRO 52 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1rt1 h GLU 53 N 0.63 0.00 -5.28 0.54 9.09 -2.03 -3.40 114.58 114.12 1rt1 h GLU 53 Ca 0.00 0.00 -0.66 0.00 0.05 0.00 0.00 59.36 58.75 1rt1 h GLU 53 Cb 0.30 0.00 -0.16 0.00 -1.65 0.00 0.00 28.75 27.24 1rt1 h GLU 53 CO 0.00 0.00 0.19 1.21 0.05 0.00 0.00 179.01 180.46 1rt1 s ASN 54 N -5.84 6.27 0.00 3.06 3.84 -1.22 -4.93 114.94 116.12 1rt1 s ASN 54 Ca 0.07 -0.64 0.20 0.00 0.21 0.00 0.00 52.86 52.69 1rt1 s ASN 54 Cb 0.07 -2.33 0.83 0.00 -0.55 0.00 0.00 41.25 39.27 1rt1 s ASN 54 CO 0.64 -0.94 1.58 -0.81 -2.79 0.00 0.00 177.10 174.78 1rt1 n PRO 55 N 6.49 1.50 -2.40 0.43 -0.04 -1.26 -4.96 135.00 134.76 1rt1 n PRO 55 Ca -0.03 -0.75 -0.26 0.00 -0.04 0.00 0.00 63.50 62.41 1rt1 n PRO 55 Cb 0.46 -1.35 0.04 0.00 -0.04 0.00 0.00 33.50 32.61 1rt1 n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1rt1 s TYR 56 N -1.85 3.15 -0.21 0.54 2.02 -1.26 -4.82 117.35 114.92 1rt1 s TYR 56 Ca 0.30 0.53 -0.28 0.00 -0.37 0.00 0.00 57.07 57.25 1rt1 s TYR 56 Cb 0.16 -2.82 0.14 0.00 -0.40 0.00 0.00 41.96 39.03 1rt1 s TYR 56 CO 0.24 -0.93 1.07 1.21 -1.57 0.00 0.00 175.55 175.56 1rt1 s ASN 57 N -4.36 -0.34 -0.06 2.29 3.84 -0.11 -4.76 114.94 111.45 1rt1 s ASN 57 Ca 0.55 0.48 -0.02 0.00 0.21 0.00 0.00 52.86 54.08 1rt1 s ASN 57 Cb -0.11 0.42 0.04 0.00 -0.55 0.00 0.00 41.25 41.05 1rt1 s ASN 57 CO 0.44 -0.24 0.11 -0.89 -2.79 0.00 0.00 177.10 173.72 1rt1 s THR 58 N -0.67 -0.13 0.43 -5.21 2.01 -0.71 -1.15 115.64 110.21 1rt1 s THR 58 Ca 0.01 0.29 -0.26 0.00 0.31 0.00 0.00 61.69 62.05 1rt1 s THR 58 Cb -0.02 -0.20 -0.09 0.00 0.01 0.00 0.00 72.50 72.19 1rt1 s THR 58 CO -0.02 0.12 1.35 -2.65 -0.69 0.00 0.00 174.62 172.73 1rt1 n PRO 59 N 4.76 2.11 -4.27 4.92 -0.02 -1.26 -4.23 135.00 137.00 1rt1 n PRO 59 Ca -0.16 0.75 -0.17 0.00 -2.02 0.00 0.00 63.50 61.90 1rt1 n PRO 59 Cb 0.50 -2.49 -0.11 0.00 -0.02 0.00 0.00 33.50 31.38 1rt1 n PRO 59 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1rt1 s VAL 60 N -1.19 1.41 0.30 -1.45 -7.23 -1.26 -0.63 120.40 110.35 1rt1 s VAL 60 Ca 0.60 -1.91 -0.20 0.00 -1.81 0.00 0.00 61.98 58.67 1rt1 s VAL 60 Cb -0.49 -1.73 0.04 0.00 0.56 0.00 0.00 36.38 34.77 1rt1 s VAL 60 CO 0.58 -0.52 0.79 0.72 -0.31 0.00 0.00 175.10 176.36 1rt1 s PHE 61 N -2.56 -0.07 -0.04 2.82 -0.71 0.33 -4.84 117.98 112.91 1rt1 s PHE 61 Ca 0.14 -0.45 0.07 0.00 -1.04 0.00 0.00 56.93 55.65 1rt1 s PHE 61 Cb -0.02 0.75 -0.02 0.00 -1.21 0.00 0.00 43.02 42.51 1rt1 s PHE 61 CO 0.04 -1.29 -0.24 0.00 -1.34 0.00 0.00 175.22 172.38 1rt1 s ALA 62 N -3.22 2.21 0.40 1.99 0.00 -1.26 -0.13 121.76 121.75 1rt1 s ALA 62 Ca 0.13 -1.08 0.05 0.00 0.00 0.00 0.00 51.96 51.07 1rt1 s ALA 62 Cb -0.05 -0.64 -0.07 0.00 0.00 0.00 0.00 23.12 22.36 1rt1 s ALA 62 CO 0.08 0.48 0.03 0.96 0.00 0.00 0.00 175.76 177.31 1rt1 s ILE 63 N -0.42 1.63 -0.21 0.00 -4.36 -0.03 -4.93 121.20 112.88 1rt1 s ILE 63 Ca 0.04 -2.00 -0.07 0.00 -0.26 0.00 0.00 60.65 58.36 1rt1 s ILE 63 Cb -0.12 -2.82 -0.04 0.00 1.25 0.00 0.00 42.46 40.74 1rt1 s ILE 63 CO 0.01 0.00 0.06 -0.54 0.24 0.00 0.00 174.94 174.71 1rt1 s LYS 64 N -3.78 3.83 -0.45 0.37 -0.14 -1.26 -0.35 119.74 117.96 1rt1 s LYS 64 Ca 0.31 -0.41 -0.29 0.00 -1.36 0.00 0.00 55.97 54.23 1rt1 s LYS 64 Cb 0.08 -3.25 0.02 0.00 -1.68 0.00 0.00 37.83 33.01 1rt1 s LYS 64 CO 0.15 0.08 1.22 0.15 -0.76 0.00 0.00 175.35 176.19 1rt1 s LYS 65 N 0.90 3.70 0.33 1.68 1.02 -1.18 -4.94 119.74 121.26 1rt1 s LYS 65 Ca 0.04 0.71 -0.24 0.00 0.02 0.00 0.00 55.97 56.49 1rt1 s LYS 65 Cb -0.14 -3.93 -0.15 0.00 -0.52 0.00 0.00 37.83 33.09 1rt1 s LYS 65 CO 0.03 -1.41 0.39 0.36 -0.92 0.00 0.00 175.35 173.80 1rt1 n LYS 66 N 7.86 0.20 0.00 1.68 2.85 -1.26 -1.86 118.16 127.63 1rt1 n LYS 66 Ca 0.13 0.07 0.00 0.00 -1.05 0.00 0.00 58.31 57.47 1rt1 n LYS 66 Cb 0.49 -1.16 0.00 0.00 -0.65 0.00 0.00 35.03 33.71 1rt1 n LYS 66 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1rt1 n ASP 67 N 1.93 0.00 -4.50 -5.58 2.03 -1.26 -4.98 116.55 104.20 1rt1 n ASP 67 Ca 0.13 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.20 1rt1 n ASP 67 Cb 0.34 -0.01 -0.10 0.00 -0.72 0.00 0.00 41.12 40.63 1rt1 n ASP 67 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1rt1 s SER 68 N -1.19 3.59 0.24 1.67 0.01 -0.78 -4.99 113.70 112.25 1rt1 s SER 68 Ca 0.00 -1.10 0.24 0.00 1.31 0.00 0.00 55.95 56.40 1rt1 s SER 68 Cb 0.00 -0.31 0.43 0.00 0.21 0.00 0.00 66.02 66.35 1rt1 s SER 68 CO 0.00 -0.08 1.48 0.71 0.41 0.00 0.00 173.24 175.77 1rt1 h THR 69 N 2.18 0.00 -2.17 1.44 1.35 -1.94 -3.42 112.91 110.36 1rt1 h THR 69 Ca -0.41 -0.69 -0.59 0.00 -0.55 0.00 0.00 66.41 64.17 1rt1 h THR 69 Cb 1.25 1.48 0.03 0.00 -1.73 0.00 0.00 68.15 69.19 1rt1 h THR 69 CO 0.64 0.00 1.02 0.29 -0.25 0.00 0.00 175.52 177.23 1rt1 n LYS 70 N -2.48 2.28 -3.27 4.72 4.76 -1.26 -4.96 118.16 117.93 1rt1 n LYS 70 Ca 0.04 0.83 -0.37 0.00 -2.87 0.00 0.00 58.31 55.93 1rt1 n LYS 70 Cb 0.48 -2.67 -0.06 0.00 -1.84 0.00 0.00 35.03 30.94 1rt1 n LYS 70 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1rt1 s TRP 71 N 3.06 3.74 0.10 2.13 0.52 -1.26 -3.12 118.94 124.10 1rt1 s TRP 71 Ca 0.87 1.23 0.05 0.00 0.02 0.00 0.00 56.10 58.28 1rt1 s TRP 71 Cb -0.65 -2.48 -0.04 0.00 -1.15 0.00 0.00 33.47 29.15 1rt1 s TRP 71 CO 0.46 0.52 0.00 0.50 0.02 0.00 0.00 176.95 178.44 1rt1 s ARG 72 N -1.44 2.54 -0.06 4.98 3.52 0.53 -4.92 118.95 124.10 1rt1 s ARG 72 Ca 0.33 -0.86 -0.11 0.00 -0.13 0.00 0.00 55.73 54.95 1rt1 s ARG 72 Cb -0.18 -2.53 -0.05 0.00 -1.56 0.00 0.00 34.95 30.63 1rt1 s ARG 72 CO 0.19 0.53 0.29 0.21 -0.81 0.00 0.00 175.30 175.71 1rt1 s LYS 73 N -2.37 3.75 -0.11 5.12 2.36 -1.26 -0.85 119.74 126.38 1rt1 s LYS 73 Ca 0.26 0.16 -0.02 0.00 -2.55 0.00 0.00 55.97 53.82 1rt1 s LYS 73 Cb -0.11 -3.23 0.04 0.00 -1.05 0.00 0.00 37.83 33.48 1rt1 s LYS 73 CO 0.18 0.69 0.01 -1.17 1.55 0.00 0.00 175.35 176.61 1rt1 s LEU 74 N -0.92 0.76 -0.08 5.43 2.96 0.82 -4.89 118.68 122.75 1rt1 s LEU 74 Ca 0.19 -0.30 -0.05 0.00 -0.22 0.00 0.00 54.13 53.75 1rt1 s LEU 74 Cb -0.14 -0.49 -0.04 0.00 0.50 0.00 0.00 46.19 46.02 1rt1 s LEU 74 CO 0.09 -0.23 0.15 -0.69 -1.32 0.00 0.00 176.35 174.35 1rt1 s VAL 75 N 1.94 5.42 -1.04 1.68 1.01 -1.26 -0.51 120.40 127.64 1rt1 s VAL 75 Ca 0.03 0.07 -0.13 0.00 0.00 0.00 0.00 61.98 61.96 1rt1 s VAL 75 Cb -0.14 -3.41 0.22 0.00 0.00 0.00 0.00 36.38 33.05 1rt1 s VAL 75 CO -0.06 0.53 1.09 -0.62 0.00 0.00 0.00 175.10 176.04 1rt1 s ASP 76 N -1.30 7.04 -0.00 3.32 2.15 0.20 -4.87 116.67 123.20 1rt1 s ASP 76 Ca 0.19 -3.05 0.01 0.00 0.43 0.00 0.00 52.55 50.13 1rt1 s ASP 76 Cb -0.12 -2.27 0.03 0.00 -0.30 0.00 0.00 42.92 40.26 1rt1 s ASP 76 CO 0.08 -0.55 0.87 0.49 -0.17 0.00 0.00 175.17 175.90 1rt1 n PHE 77 N 4.10 0.06 -0.28 -5.34 3.72 -1.26 -4.39 117.46 114.08 1rt1 n PHE 77 Ca 0.24 -0.03 0.10 0.00 -0.05 0.00 0.00 57.45 57.71 1rt1 n PHE 77 Cb 0.43 -0.04 0.24 0.00 -0.94 0.00 0.00 39.48 39.17 1rt1 n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rt1 h ARG 78 N 0.20 0.26 -0.30 -1.08 3.08 -1.89 0.34 114.38 114.98 1rt1 h ARG 78 Ca 0.00 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 59.86 1rt1 h ARG 78 Cb 0.22 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 1rt1 h ARG 78 CO 0.01 0.17 -0.49 0.93 -1.07 0.00 0.00 179.97 179.51 1rt1 h GLU 79 N 0.27 0.84 -0.03 0.04 4.39 -2.00 -2.47 114.58 115.61 1rt1 h GLU 79 Ca 0.49 -0.50 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1rt1 h GLU 79 Cb 0.91 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.61 1rt1 h GLU 79 CO -0.57 1.14 -0.02 1.25 -1.16 0.00 0.00 179.01 179.65 1rt1 h LEU 80 N 0.66 0.08 -0.41 1.33 5.85 -1.49 -2.37 115.31 118.96 1rt1 h LEU 80 Ca 0.03 -0.43 0.05 0.00 0.84 0.00 0.00 57.88 58.38 1rt1 h LEU 80 Cb 1.09 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.01 1rt1 h LEU 80 CO 0.11 0.49 -0.53 0.78 -0.34 0.00 0.00 178.44 178.95 1rt1 h ASN 81 N -0.33 -1.76 -0.90 1.25 4.21 -0.43 0.21 115.58 117.82 1rt1 h ASN 81 Ca 0.01 0.24 0.22 0.00 1.21 0.00 0.00 56.30 57.98 1rt1 h ASN 81 Cb 0.46 0.73 -0.06 0.00 -1.12 0.00 0.00 38.32 38.33 1rt1 h ASN 81 CO 0.01 -0.40 0.61 0.11 -1.29 0.00 0.00 177.43 176.46 1rt1 h LYS 82 N -0.38 0.27 0.00 0.81 1.57 -1.36 0.14 116.57 117.61 1rt1 h LYS 82 Ca 0.09 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1rt1 h LYS 82 Cb 0.60 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1rt1 h LYS 82 CO -0.59 0.18 -0.55 0.54 -0.57 0.00 0.00 179.45 178.46 1rt1 n ARG 83 N -4.44 0.01 -2.57 3.15 1.74 0.05 -4.91 116.66 109.68 1rt1 n ARG 83 Ca 0.19 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.86 1rt1 n ARG 83 Cb 0.78 -1.51 -0.04 0.00 -1.02 0.00 0.00 32.46 30.67 1rt1 n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1rt1 s THR 84 N -3.01 3.96 0.76 0.55 2.01 0.51 -1.28 115.64 119.14 1rt1 s THR 84 Ca 0.11 1.74 -0.15 0.00 0.31 0.00 0.00 61.69 63.69 1rt1 s THR 84 Cb 0.17 -4.11 -0.01 0.00 0.01 0.00 0.00 72.50 68.57 1rt1 s THR 84 CO 0.71 0.32 0.68 0.00 -0.69 0.00 0.00 174.62 175.65 1rt1 n GLN 85 N 2.22 0.26 -2.71 4.92 10.64 -0.84 -4.65 117.38 127.23 1rt1 n GLN 85 Ca 0.02 0.14 -0.27 0.00 -1.83 0.00 0.00 57.00 55.06 1rt1 n GLN 85 Cb 0.47 -1.99 -0.00 0.00 -0.86 0.00 0.00 30.24 27.86 1rt1 n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1rt1 s ASP 86 N -1.64 6.25 -0.44 2.61 1.01 -1.26 -4.97 116.67 118.21 1rt1 s ASP 86 Ca 0.67 0.87 0.05 0.00 0.71 0.00 0.00 52.55 54.85 1rt1 s ASP 86 Cb -0.33 -2.21 0.43 0.00 1.01 0.00 0.00 42.92 41.82 1rt1 s ASP 86 CO 0.57 -0.56 1.24 0.49 0.21 0.00 0.00 175.17 177.12 1rt1 n PHE 87 N -2.22 3.20 -3.60 4.23 3.72 -1.26 -5.11 117.46 116.41 1rt1 n PHE 87 Ca 0.00 -2.81 -0.36 0.00 -0.05 0.00 0.00 57.45 54.23 1rt1 n PHE 87 Cb 0.55 -0.29 -0.06 0.00 -0.94 0.00 0.00 39.48 38.74 1rt1 n PHE 87 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 176.76 177.62 1rt1 n TRP 88 N -0.56 4.24 -0.75 1.38 5.03 -1.26 -5.17 117.44 120.35 1rt1 n TRP 88 Ca 0.42 -4.09 0.05 0.00 3.03 0.00 0.00 57.50 56.92 1rt1 n TRP 88 Cb 0.71 -1.16 -0.01 0.00 -1.03 0.00 0.00 31.31 29.81 1rt1 n TRP 88 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1rt1 n GLY 93 N 2.25 -0.55 3.63 6.99 0.00 -1.26 -5.31 105.19 110.94 1rt1 n GLY 93 Ca 0.22 -0.37 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1rt1 n GLY 93 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1rt1 s ILE 94 N -1.09 3.73 0.38 -0.61 -4.36 -1.26 -5.10 121.20 112.89 1rt1 s ILE 94 Ca 0.00 -1.02 -0.27 0.00 -0.26 0.00 0.00 60.65 59.10 1rt1 s ILE 94 Cb 0.00 -2.73 -0.10 0.00 1.25 0.00 0.00 42.46 40.88 1rt1 s ILE 94 CO 0.00 0.19 1.38 -2.16 0.24 0.00 0.00 174.94 174.58 1rt1 s PRO 95 N -2.05 4.07 0.23 0.37 0.04 -1.26 -4.93 135.00 131.47 1rt1 s PRO 95 Ca 0.22 2.34 -0.30 0.00 0.04 0.00 0.00 61.00 63.30 1rt1 s PRO 95 Cb -0.11 -2.89 -0.10 0.00 0.04 0.00 0.00 34.50 31.44 1rt1 s PRO 95 CO 0.14 -0.47 1.41 -1.58 0.04 0.00 0.00 177.00 176.54 1rt1 s HIS 96 N -1.18 3.08 -0.63 0.56 2.46 -1.26 -4.95 115.29 113.37 1rt1 s HIS 96 Ca 0.54 1.06 -0.23 0.00 0.47 0.00 0.00 55.06 56.90 1rt1 s HIS 96 Cb -0.42 -3.77 0.06 0.00 -0.13 0.00 0.00 32.58 28.33 1rt1 s HIS 96 CO 0.55 -2.49 0.97 -1.25 -2.47 0.00 0.00 174.74 170.05 1rt1 s PRO 97 N -0.24 3.17 0.55 2.88 0.04 -1.26 -4.90 135.00 135.23 1rt1 s PRO 97 Ca 0.59 -0.66 0.30 0.00 0.04 0.00 0.00 61.00 61.27 1rt1 s PRO 97 Cb -0.40 -4.18 1.46 0.00 0.04 0.00 0.00 34.50 31.42 1rt1 s PRO 97 CO 0.41 -1.74 1.91 0.00 0.04 0.00 0.00 177.00 177.62 1rt1 h ALA 98 N 9.52 2.60 -0.21 8.56 0.00 -1.92 -0.70 119.26 137.10 1rt1 h ALA 98 Ca -0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1rt1 h ALA 98 Cb 1.07 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1rt1 h ALA 98 CO 1.16 -0.92 0.14 0.78 0.00 0.00 0.00 179.25 180.41 1rt1 h GLY 99 N 0.00 0.29 0.22 0.00 0.00 -1.97 -3.11 103.07 98.51 1rt1 h GLY 99 Ca 0.33 -0.11 0.22 0.00 0.00 0.00 0.00 47.33 47.78 1rt1 h GLY 99 CO -0.00 0.11 0.62 -2.00 0.00 0.00 0.00 176.54 175.26 1rt1 h LEU 100 N 0.28 0.36 -0.58 3.11 5.85 -1.45 -1.01 115.31 121.87 1rt1 h LEU 100 Ca 0.08 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 1rt1 h LEU 100 Cb -0.03 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1rt1 h LEU 100 CO -0.02 0.13 -0.53 0.07 -0.34 0.00 0.00 178.44 177.75 1rt1 h LYS 101 N 0.35 0.00 -1.28 1.25 2.10 -1.74 -3.23 116.57 114.02 1rt1 h LYS 101 Ca 0.48 0.00 -0.45 0.00 -2.00 0.00 0.00 60.65 58.68 1rt1 h LYS 101 Cb 1.30 0.00 -0.20 0.00 -0.90 0.00 0.00 32.23 32.43 1rt1 h LYS 101 CO -0.17 0.53 0.58 1.63 -2.00 0.00 0.00 179.45 180.02 1rt1 n LYS 102 N -3.49 2.12 -4.99 0.07 5.02 -0.38 -3.29 118.16 113.21 1rt1 n LYS 102 Ca 0.00 -2.22 -0.32 0.00 -2.02 0.00 0.00 58.31 53.74 1rt1 n LYS 102 Cb 0.63 -1.87 -0.15 0.00 -0.02 0.00 0.00 35.03 33.63 1rt1 n LYS 102 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1rt1 s LYS 103 N -2.57 2.75 0.30 1.97 -0.14 -1.22 -4.91 119.74 115.92 1rt1 s LYS 103 Ca 0.44 -0.77 0.01 0.00 -1.36 0.00 0.00 55.97 54.30 1rt1 s LYS 103 Cb 0.35 -2.37 0.56 0.00 -1.68 0.00 0.00 37.83 34.68 1rt1 s LYS 103 CO 0.00 0.43 1.90 0.87 -0.76 0.00 0.00 175.35 177.80 1rt1 h LYS 104 N 5.96 0.97 -2.59 1.68 1.57 -1.91 -3.09 116.57 119.16 1rt1 h LYS 104 Ca -0.36 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.25 1rt1 h LYS 104 Cb 1.18 -0.22 -0.28 0.00 0.08 0.00 0.00 32.23 32.99 1rt1 h LYS 104 CO 0.51 0.64 -0.39 -1.12 -0.57 0.00 0.00 179.45 178.52 1rt1 s SER 105 N -5.97 -0.18 0.02 0.86 0.01 -1.18 -4.30 113.70 102.97 1rt1 s SER 105 Ca -0.11 0.91 0.03 0.00 1.31 0.00 0.00 55.95 58.09 1rt1 s SER 105 Cb 0.20 1.17 -0.04 0.00 0.21 0.00 0.00 66.02 67.57 1rt1 s SER 105 CO 0.80 -0.23 -0.01 -0.69 0.41 0.00 0.00 173.24 173.52 1rt1 s VAL 106 N 2.44 4.01 0.06 3.43 1.01 0.11 -2.83 120.40 128.64 1rt1 s VAL 106 Ca -0.02 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.29 1rt1 s VAL 106 Cb -0.12 -2.82 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 1rt1 s VAL 106 CO -0.12 0.31 -0.20 -0.89 0.00 0.00 0.00 175.10 174.20 1rt1 s THR 107 N -1.13 1.61 -0.08 3.92 2.01 -0.12 -0.48 115.64 121.38 1rt1 s THR 107 Ca 0.21 -1.27 -0.00 0.00 0.31 0.00 0.00 61.69 60.93 1rt1 s THR 107 Cb -0.11 -1.43 -0.03 0.00 0.01 0.00 0.00 72.50 70.94 1rt1 s THR 107 CO 0.12 0.11 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.43 1rt1 s VAL 108 N -0.91 3.98 -0.02 3.82 1.01 -0.95 -0.33 120.40 126.99 1rt1 s VAL 108 Ca 0.06 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.69 1rt1 s VAL 108 Cb -0.09 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.65 1rt1 s VAL 108 CO 0.02 0.60 -0.06 -0.76 0.00 0.00 0.00 175.10 174.91 1rt1 s LEU 109 N -0.84 1.81 -0.92 3.92 1.43 -0.01 -3.79 118.68 120.27 1rt1 s LEU 109 Ca 0.13 -0.12 -0.19 0.00 -1.03 0.00 0.00 54.13 52.92 1rt1 s LEU 109 Cb -0.11 -0.36 0.13 0.00 0.03 0.00 0.00 46.19 45.87 1rt1 s LEU 109 CO 0.02 0.04 1.13 -0.62 0.23 0.00 0.00 176.35 177.15 1rt1 s ASP 110 N 0.16 6.61 -0.14 2.29 2.15 -1.26 -1.47 116.67 125.01 1rt1 s ASP 110 Ca -0.02 -2.00 0.06 0.00 0.43 0.00 0.00 52.55 51.02 1rt1 s ASP 110 Cb -0.06 -2.40 0.39 0.00 -0.30 0.00 0.00 42.92 40.55 1rt1 s ASP 110 CO -0.00 -1.09 1.18 1.33 -0.17 0.00 0.00 175.17 176.42 1rt1 n VAL 111 N 5.55 1.51 0.20 1.11 0.24 0.20 -4.19 118.33 122.95 1rt1 n VAL 111 Ca 0.23 -0.74 0.07 0.00 -2.04 0.00 0.00 64.34 61.87 1rt1 n VAL 111 Cb 0.49 -0.46 0.42 0.00 -1.47 0.00 0.00 33.84 32.82 1rt1 n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1rt1 h GLY 112 N 4.13 0.00 1.98 7.63 0.00 -1.81 -3.06 103.07 111.94 1rt1 h GLY 112 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1rt1 h GLY 112 CO 0.30 0.00 0.01 -0.55 0.00 0.00 0.00 176.54 176.30 1rt1 h ASP 113 N 0.00 0.00 0.73 0.19 3.32 -1.90 -2.94 116.42 115.82 1rt1 h ASP 113 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1rt1 h ASP 113 Cb 0.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1rt1 h ASP 113 CO 0.04 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.56 1rt1 h ALA 114 N 1.99 1.00 -0.02 3.45 0.00 -1.70 -3.28 119.26 120.70 1rt1 h ALA 114 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1rt1 h ALA 114 Cb 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1rt1 h ALA 114 CO -0.00 0.00 -0.56 1.88 0.00 0.00 0.00 179.25 180.57 1rt1 h TYR 115 N 0.00 0.08 -0.13 0.00 0.05 -1.76 -3.17 116.97 112.04 1rt1 h TYR 115 Ca 0.00 -0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.79 1rt1 h TYR 115 Cb 0.36 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.08 1rt1 h TYR 115 CO 0.00 0.60 0.25 0.27 -1.05 0.00 0.00 178.16 178.24 1rt1 h PHE 116 N 0.05 0.00 -0.26 4.88 -0.00 -1.71 0.00 116.94 119.90 1rt1 h PHE 116 Ca -0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.97 57.86 1rt1 h PHE 116 Cb 1.00 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.94 1rt1 h PHE 116 CO 0.01 0.00 -0.29 0.77 -0.00 0.00 0.00 178.31 178.80 1rt1 h SER 117 N 0.00 0.53 -2.93 -0.68 0.02 -1.80 -3.44 113.55 105.25 1rt1 h SER 117 Ca 0.06 -0.19 -0.63 0.00 -0.84 0.00 0.00 61.79 60.19 1rt1 h SER 117 Cb 0.57 -0.15 -0.07 0.00 0.14 0.00 0.00 62.40 62.89 1rt1 h SER 117 CO -0.00 0.80 -0.36 -0.69 -1.14 0.00 0.00 176.83 175.43 1rt1 s VAL 118 N -4.44 5.31 0.54 2.27 1.01 -0.01 -5.06 120.40 120.02 1rt1 s VAL 118 Ca -0.07 0.47 -0.16 0.00 0.00 0.00 0.00 61.98 62.21 1rt1 s VAL 118 Cb 0.13 -3.55 -0.07 0.00 0.00 0.00 0.00 36.38 32.90 1rt1 s VAL 118 CO 0.80 0.55 1.01 -2.16 0.00 0.00 0.00 175.10 175.30 1rt1 s PRO 119 N -0.65 3.77 -0.14 2.72 0.04 -1.26 -1.84 135.00 137.63 1rt1 s PRO 119 Ca 0.17 1.03 -0.07 0.00 0.04 0.00 0.00 61.00 62.17 1rt1 s PRO 119 Cb -0.14 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 1rt1 s PRO 119 CO 0.06 -0.43 0.10 -1.17 0.04 0.00 0.00 177.00 175.60 1rt1 s LEU 120 N -4.20 4.10 -0.36 -3.56 2.96 -0.34 -4.59 118.68 112.70 1rt1 s LEU 120 Ca 0.60 0.28 -0.43 0.00 -0.22 0.00 0.00 54.13 54.37 1rt1 s LEU 120 Cb -0.12 -2.01 -0.17 0.00 0.50 0.00 0.00 46.19 44.39 1rt1 s LEU 120 CO 0.33 0.31 1.69 -0.67 -1.32 0.00 0.00 176.35 176.68 1rt1 n ASP 121 N 2.65 1.94 -0.33 3.68 2.03 -1.26 -4.78 116.55 120.49 1rt1 n ASP 121 Ca -0.18 1.12 0.21 0.00 0.52 0.00 0.00 54.79 56.45 1rt1 n ASP 121 Cb 0.54 -1.04 0.47 0.00 -0.72 0.00 0.00 41.12 40.36 1rt1 n ASP 121 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1rt1 h GLU 122 N 6.37 0.44 0.00 -0.67 4.11 -1.94 0.23 114.58 123.12 1rt1 h GLU 122 Ca -0.46 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.95 1rt1 h GLU 122 Cb 1.34 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1rt1 h GLU 122 CO 0.97 0.29 0.00 -0.25 0.07 0.00 0.00 179.01 180.09 1rt1 n ASP 123 N -4.68 0.07 -0.05 3.06 8.00 -1.26 -3.36 116.55 118.33 1rt1 n ASP 123 Ca 0.25 0.51 -0.02 0.00 0.71 0.00 0.00 54.79 56.25 1rt1 n ASP 123 Cb 0.82 -0.53 -0.15 0.00 -0.02 0.00 0.00 41.12 41.25 1rt1 n ASP 123 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1rt1 n PHE 124 N -1.57 0.22 -0.36 1.24 7.35 0.05 -4.58 117.46 119.81 1rt1 n PHE 124 Ca 0.06 0.07 0.28 0.00 -0.76 0.00 0.00 57.45 57.09 1rt1 n PHE 124 Cb 0.29 -0.87 0.53 0.00 0.35 0.00 0.00 39.48 39.78 1rt1 n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1rt1 h ARG 125 N 0.00 0.25 -0.97 -4.13 3.08 -1.51 -0.95 114.38 110.14 1rt1 h ARG 125 Ca -0.30 -0.02 0.11 0.00 0.07 0.00 0.00 59.98 59.84 1rt1 h ARG 125 Cb 1.74 -0.06 -0.08 0.00 0.08 0.00 0.00 29.97 31.65 1rt1 h ARG 125 CO 0.03 0.17 0.62 1.57 -1.07 0.00 0.00 179.97 181.28 1rt1 h LYS 126 N 0.26 0.94 0.00 0.04 2.10 -1.81 -0.46 116.57 117.64 1rt1 h LYS 126 Ca 0.74 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 59.33 1rt1 h LYS 126 Cb 1.92 -0.21 0.00 0.00 -0.90 0.00 0.00 32.23 33.03 1rt1 h LYS 126 CO -0.51 0.62 0.00 0.66 -2.00 0.00 0.00 179.45 178.23 1rt1 n TYR 127 N -4.57 0.58 0.05 0.07 4.01 -0.36 -1.63 117.16 115.31 1rt1 n TYR 127 Ca 0.17 0.28 0.12 0.00 -0.16 0.00 0.00 57.90 58.31 1rt1 n TYR 127 Cb 0.33 -0.94 0.27 0.00 -0.31 0.00 0.00 39.34 38.69 1rt1 n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1rt1 n THR 128 N -2.08 0.71 -1.60 -0.72 -2.24 -0.18 -4.66 114.28 103.53 1rt1 n THR 128 Ca 0.00 -0.84 -0.44 0.00 -2.27 0.00 0.00 64.05 60.50 1rt1 n THR 128 Cb 0.09 0.72 -0.01 0.00 -2.10 0.00 0.00 70.33 69.03 1rt1 n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rt1 n ALA 129 N 1.51 -0.10 -2.72 6.98 0.00 -0.65 -4.30 120.51 121.23 1rt1 n ALA 129 Ca 0.22 0.37 -0.10 0.00 0.00 0.00 0.00 53.44 53.92 1rt1 n ALA 129 Cb 0.60 -2.04 -0.07 0.00 0.00 0.00 0.00 19.45 17.94 1rt1 n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1rt1 s PHE 130 N -1.09 0.69 -0.00 0.00 -0.12 -0.53 -1.73 117.98 115.19 1rt1 s PHE 130 Ca 0.59 -1.00 0.01 0.00 -0.05 0.00 0.00 56.93 56.48 1rt1 s PHE 130 Cb -0.68 -0.15 0.00 0.00 -0.63 0.00 0.00 43.02 41.57 1rt1 s PHE 130 CO 0.60 -0.81 -0.02 0.99 -0.05 0.00 0.00 175.22 175.93 1rt1 s THR 131 N -4.07 0.15 -0.32 -4.49 2.01 -1.26 -2.50 115.64 105.16 1rt1 s THR 131 Ca 0.28 -0.07 -0.11 0.00 0.31 0.00 0.00 61.69 62.11 1rt1 s THR 131 Cb 0.03 -0.14 -0.01 0.00 0.01 0.00 0.00 72.50 72.39 1rt1 s THR 131 CO 0.09 0.05 0.18 -0.63 -0.69 0.00 0.00 174.62 173.62 1rt1 s ILE 132 N 0.03 4.84 1.12 1.82 1.01 -0.96 -4.63 121.20 124.44 1rt1 s ILE 132 Ca 0.00 -0.34 -0.18 0.00 0.00 0.00 0.00 60.65 60.13 1rt1 s ILE 132 Cb -0.02 -3.48 0.26 0.00 0.01 0.00 0.00 42.46 39.23 1rt1 s ILE 132 CO -0.00 0.04 1.17 -2.16 0.00 0.00 0.00 174.94 173.99 1rt1 s PRO 133 N 1.65 -0.61 0.01 2.79 0.04 -1.26 -1.73 135.00 135.89 1rt1 s PRO 133 Ca 0.05 -0.13 0.02 0.00 0.04 0.00 0.00 61.00 60.98 1rt1 s PRO 133 Cb -0.17 -1.67 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 1rt1 s PRO 133 CO 0.08 -3.29 -0.05 -1.54 0.04 0.00 0.00 177.00 172.23 1rt1 s SER 134 N -4.15 0.62 0.17 6.66 1.04 -1.26 -4.87 113.70 111.91 1rt1 s SER 134 Ca 0.71 -0.25 -0.33 0.00 0.48 0.00 0.00 55.95 56.56 1rt1 s SER 134 Cb -0.09 -0.02 -0.14 0.00 0.10 0.00 0.00 66.02 65.87 1rt1 s SER 134 CO 0.55 -0.04 1.48 -0.38 0.98 0.00 0.00 173.24 175.83 1rt1 n ILE 135 N 2.43 0.32 -0.79 -1.02 5.41 -1.26 -1.13 119.36 123.32 1rt1 n ILE 135 Ca -0.16 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.51 1rt1 n ILE 135 Cb 0.57 -1.39 0.00 0.00 -0.71 0.00 0.00 39.64 38.11 1rt1 n ILE 135 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1rt1 n ASN 136 N 2.86 -3.63 -3.65 4.38 2.85 -1.26 -2.30 115.26 114.51 1rt1 n ASN 136 Ca 0.15 0.00 -0.23 0.00 -0.11 0.00 0.00 54.58 54.39 1rt1 n ASN 136 Cb 0.28 -3.06 0.06 0.00 1.24 0.00 0.00 39.78 38.30 1rt1 n ASN 136 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1rt1 n ASN 137 N -0.57 -3.92 0.07 1.20 3.02 -0.28 -4.87 115.26 109.91 1rt1 n ASN 137 Ca 0.00 -0.67 0.13 0.00 -0.03 0.00 0.00 54.58 54.01 1rt1 n ASN 137 Cb 0.30 -4.60 0.34 0.00 -0.61 0.00 0.00 39.78 35.22 1rt1 n ASN 137 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1rt1 n GLU 138 N -4.58 0.23 -4.52 3.52 1.02 -0.97 -4.81 120.64 110.53 1rt1 n GLU 138 Ca -0.12 0.14 -0.21 0.00 -0.02 0.00 0.00 57.16 56.95 1rt1 n GLU 138 Cb 0.60 -1.72 -0.14 0.00 -0.02 0.00 0.00 31.44 30.16 1rt1 n GLU 138 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1rt1 s THR 139 N -3.11 1.07 0.65 2.62 2.01 -1.26 -5.13 115.64 112.49 1rt1 s THR 139 Ca 0.10 -0.72 -0.16 0.00 0.31 0.00 0.00 61.69 61.21 1rt1 s THR 139 Cb 0.14 -0.92 -0.01 0.00 0.01 0.00 0.00 72.50 71.72 1rt1 s THR 139 CO 0.64 0.20 1.15 -2.84 -0.69 0.00 0.00 174.62 173.08 1rt1 s PRO 140 N -0.60 2.76 0.75 4.92 0.02 -1.26 -4.50 135.00 137.08 1rt1 s PRO 140 Ca 0.04 1.60 -0.15 0.00 0.02 0.00 0.00 61.00 62.51 1rt1 s PRO 140 Cb -0.06 -1.93 0.05 0.00 0.02 0.00 0.00 34.50 32.59 1rt1 s PRO 140 CO 0.00 -1.32 1.23 0.20 -0.33 0.00 0.00 177.00 176.78 1rt1 s GLY 141 N -2.13 2.37 -0.50 0.52 0.00 -1.26 -4.83 107.32 101.49 1rt1 s GLY 141 Ca 0.72 0.95 -0.18 0.00 0.00 0.00 0.00 44.72 46.21 1rt1 s GLY 141 CO 0.38 1.37 0.55 -0.42 0.00 0.00 0.00 173.10 174.99 1rt1 s ILE 142 N -1.92 5.00 0.11 0.90 1.01 -0.71 -4.87 121.20 120.72 1rt1 s ILE 142 Ca 0.76 -0.75 -0.23 0.00 0.00 0.00 0.00 60.65 60.42 1rt1 s ILE 142 Cb -0.31 -4.26 -0.07 0.00 0.01 0.00 0.00 42.46 37.83 1rt1 s ILE 142 CO 0.47 -0.76 0.71 -0.13 0.00 0.00 0.00 174.94 175.23 1rt1 s ARG 143 N 2.27 4.44 0.16 2.79 1.81 -1.26 -2.27 118.95 126.88 1rt1 s ARG 143 Ca 0.11 1.00 -0.09 0.00 -1.72 0.00 0.00 55.73 55.04 1rt1 s ARG 143 Cb -0.22 -3.28 -0.01 0.00 -0.45 0.00 0.00 34.95 31.00 1rt1 s ARG 143 CO 0.09 0.54 0.27 0.71 -0.68 0.00 0.00 175.30 176.23 1rt1 s TYR 144 N -0.92 0.40 0.14 -0.53 1.51 -1.04 -2.33 117.35 114.58 1rt1 s TYR 144 Ca 0.34 -0.77 -0.02 0.00 -1.01 0.00 0.00 57.07 55.62 1rt1 s TYR 144 Cb -0.21 -0.07 -0.04 0.00 -0.11 0.00 0.00 41.96 41.52 1rt1 s TYR 144 CO 0.23 -0.70 0.08 1.14 -1.11 0.00 0.00 175.55 175.20 1rt1 s GLN 145 N -3.96 0.97 0.08 -0.62 -2.07 -0.51 -1.46 119.66 112.09 1rt1 s GLN 145 Ca 0.17 -1.44 -0.14 0.00 -1.82 0.00 0.00 55.36 52.12 1rt1 s GLN 145 Cb 0.04 0.26 -0.06 0.00 -1.09 0.00 0.00 33.01 32.15 1rt1 s GLN 145 CO -0.01 -0.29 0.48 0.71 -1.32 0.00 0.00 175.29 174.86 1rt1 s TYR 146 N -4.05 3.67 -0.43 9.60 1.51 -1.26 -1.76 117.35 124.62 1rt1 s TYR 146 Ca 0.25 1.01 0.14 0.00 -1.01 0.00 0.00 57.07 57.47 1rt1 s TYR 146 Cb 0.07 -2.32 -0.18 0.00 -0.11 0.00 0.00 41.96 39.42 1rt1 s TYR 146 CO 0.03 0.54 0.50 0.09 -1.11 0.00 0.00 175.55 175.60 1rt1 n ASN 147 N 1.27 1.03 -2.66 2.29 5.03 0.12 -4.62 115.26 117.73 1rt1 n ASN 147 Ca -0.09 -0.53 -0.09 0.00 0.87 0.00 0.00 54.58 54.74 1rt1 n ASN 147 Cb 0.52 1.25 -0.02 0.00 -1.02 0.00 0.00 39.78 40.51 1rt1 n ASN 147 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 1rt1 n VAL 148 N -1.58 0.00 -2.47 2.41 0.24 -1.16 -1.19 118.33 114.58 1rt1 n VAL 148 Ca 0.01 -0.65 -0.42 0.00 -2.04 0.00 0.00 64.34 61.23 1rt1 n VAL 148 Cb 0.28 0.14 -0.03 0.00 -1.47 0.00 0.00 33.84 32.77 1rt1 n VAL 148 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1rt1 s LEU 149 N 0.00 4.26 0.38 1.34 1.43 -0.77 -4.24 118.68 121.08 1rt1 s LEU 149 Ca 0.01 1.78 -0.24 0.00 -1.03 0.00 0.00 54.13 54.65 1rt1 s LEU 149 Cb 0.00 -3.56 -0.10 0.00 0.03 0.00 0.00 46.19 42.56 1rt1 s LEU 149 CO 0.00 -0.60 0.96 -2.84 0.23 0.00 0.00 176.35 174.10 1rt1 s PRO 150 N 2.38 4.37 0.36 1.29 0.02 -1.26 -4.09 135.00 138.08 1rt1 s PRO 150 Ca 0.55 1.27 -0.25 0.00 0.02 0.00 0.00 61.00 62.59 1rt1 s PRO 150 Cb -0.24 -2.51 -0.10 0.00 0.02 0.00 0.00 34.50 31.68 1rt1 s PRO 150 CO 0.21 0.09 1.00 -0.65 -0.33 0.00 0.00 177.00 177.31 1rt1 s GLN 151 N -2.58 4.38 0.00 5.54 -0.21 -1.26 -3.64 119.66 121.89 1rt1 s GLN 151 Ca 0.56 1.42 0.00 0.00 0.02 0.00 0.00 55.36 57.36 1rt1 s GLN 151 Cb -0.15 -2.66 0.00 0.00 1.00 0.00 0.00 33.01 31.20 1rt1 s GLN 151 CO 0.20 0.07 0.00 0.41 -2.12 0.00 0.00 175.29 173.85 1rt1 n GLY 152 N 0.41 1.11 3.87 3.09 0.00 -1.26 -4.73 105.19 107.67 1rt1 n GLY 152 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1rt1 n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1rt1 s TRP 153 N -3.23 3.64 0.30 1.61 -0.00 -1.24 -4.46 118.94 115.56 1rt1 s TRP 153 Ca 0.00 0.66 0.04 0.00 -0.00 0.00 0.00 56.10 56.80 1rt1 s TRP 153 Cb 0.00 -2.04 0.47 0.00 -0.00 0.00 0.00 33.47 31.90 1rt1 s TRP 153 CO 0.00 0.70 1.76 1.57 -0.00 0.00 0.00 176.95 180.98 1rt1 h LYS 154 N 4.82 0.46 0.00 5.86 2.10 -1.91 -2.93 116.57 124.96 1rt1 h LYS 154 Ca -0.54 -0.15 0.00 0.00 -2.00 0.00 0.00 60.65 57.96 1rt1 h LYS 154 Cb 1.22 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1rt1 h LYS 154 CO 0.60 0.64 0.00 0.78 -2.00 0.00 0.00 179.45 179.47 1rt1 h GLY 155 N 0.98 0.00 0.14 0.07 0.00 -1.94 -3.22 103.07 99.09 1rt1 h GLY 155 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 1rt1 h GLY 155 CO 0.04 0.00 -0.07 1.76 0.00 0.00 0.00 176.54 178.28 1rt1 h SER 156 N 0.00 -0.15 -1.15 0.19 0.02 -1.80 -2.38 113.55 108.28 1rt1 h SER 156 Ca 0.00 0.01 0.33 0.00 -0.84 0.00 0.00 61.79 61.29 1rt1 h SER 156 Cb 0.07 0.04 -0.10 0.00 0.14 0.00 0.00 62.40 62.55 1rt1 h SER 156 CO 0.00 -0.03 0.75 1.55 -1.14 0.00 0.00 176.83 177.95 1rt1 h PRO 157 N -0.34 0.25 0.58 3.45 0.13 -1.75 -0.55 132.00 133.77 1rt1 h PRO 157 Ca -0.02 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.07 1rt1 h PRO 157 Cb 0.14 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.22 1rt1 h PRO 157 CO 0.03 0.17 -0.29 0.00 -0.23 0.00 0.00 178.00 177.68 1rt1 h ALA 158 N 1.60 -1.20 -0.07 -0.56 0.00 -1.63 -2.05 119.26 115.35 1rt1 h ALA 158 Ca 0.68 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.44 1rt1 h ALA 158 Cb 1.94 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 20.05 1rt1 h ALA 158 CO -0.33 -1.15 0.07 0.82 0.00 0.00 0.00 179.25 178.67 1rt1 h ILE 159 N -0.79 0.60 -0.59 0.00 2.04 -0.71 -0.80 117.51 117.26 1rt1 h ILE 159 Ca -0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1rt1 h ILE 159 Cb 0.61 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1rt1 h ILE 159 CO 0.12 0.00 0.00 0.33 0.00 0.00 0.00 178.15 178.60 1rt1 n PHE 160 N -3.97 1.79 -0.05 1.37 7.35 -0.32 -4.56 117.46 119.07 1rt1 n PHE 160 Ca -0.01 -0.65 -0.14 0.00 -0.76 0.00 0.00 57.45 55.89 1rt1 n PHE 160 Cb 0.17 -0.39 -0.07 0.00 0.35 0.00 0.00 39.48 39.54 1rt1 n PHE 160 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 1rt1 h GLN 161 N 3.95 0.38 -0.70 -4.13 5.75 -0.39 -1.44 115.11 118.53 1rt1 h GLN 161 Ca 0.00 -0.23 0.08 0.00 -0.15 0.00 0.00 58.65 58.35 1rt1 h GLN 161 Cb 1.72 0.02 -0.06 0.00 1.07 0.00 0.00 27.48 30.23 1rt1 h GLN 161 CO 0.37 0.81 0.37 0.66 -2.65 0.00 0.00 178.83 178.40 1rt1 h SER 162 N -0.01 0.52 0.54 -0.69 4.64 -1.80 -0.00 113.55 116.74 1rt1 h SER 162 Ca 0.01 0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.26 1rt1 h SER 162 Cb 0.78 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.80 1rt1 h SER 162 CO 0.05 0.32 -0.57 0.28 -0.87 0.00 0.00 176.83 176.04 1rt1 h SER 163 N 0.66 0.03 0.05 4.97 0.02 -1.87 -1.80 113.55 115.61 1rt1 h SER 163 Ca 0.33 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.26 1rt1 h SER 163 Cb 0.28 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1rt1 h SER 163 CO -0.23 0.59 -0.02 -0.03 -1.14 0.00 0.00 176.83 176.00 1rt1 h MET 164 N 0.02 -0.07 -0.80 3.45 -1.53 -0.10 -2.54 114.93 113.36 1rt1 h MET 164 Ca -0.01 0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.26 1rt1 h MET 164 Cb 1.01 0.01 -0.04 0.00 -0.55 0.00 0.00 31.60 32.04 1rt1 h MET 164 CO 0.08 0.55 0.50 0.00 0.14 0.00 0.00 176.91 178.17 1rt1 h THR 165 N -0.78 1.22 -0.34 -0.77 1.03 -1.08 -1.34 112.91 110.84 1rt1 h THR 165 Ca -0.01 -0.45 0.06 0.00 -0.01 0.00 0.00 66.41 66.00 1rt1 h THR 165 Cb 0.64 0.07 -0.06 0.00 -1.07 0.00 0.00 68.15 67.74 1rt1 h THR 165 CO 0.01 0.22 -0.02 0.11 -0.01 0.00 0.00 175.52 175.83 1rt1 h LYS 166 N 1.10 0.06 0.00 0.00 1.57 -1.33 -1.33 116.57 116.65 1rt1 h LYS 166 Ca 0.29 -0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.99 1rt1 h LYS 166 Cb -0.07 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1rt1 h LYS 166 CO -0.06 0.04 -0.37 -0.84 -0.57 0.00 0.00 179.45 177.66 1rt1 h ILE 167 N 0.07 0.78 0.00 1.86 3.07 -0.98 -3.34 117.51 118.97 1rt1 h ILE 167 Ca 0.16 -1.61 -0.10 0.00 1.55 0.00 0.00 64.86 64.86 1rt1 h ILE 167 Cb 0.23 2.03 0.01 0.00 -0.27 0.00 0.00 36.82 38.82 1rt1 h ILE 167 CO -0.30 0.36 -0.40 -0.07 -1.05 0.00 0.00 178.15 176.70 1rt1 h LEU 168 N 0.00 0.35 -0.17 0.16 3.38 -0.21 -3.40 115.31 115.42 1rt1 h LEU 168 Ca -0.00 -0.77 0.02 0.00 0.09 0.00 0.00 57.88 57.21 1rt1 h LEU 168 Cb 1.00 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1rt1 h LEU 168 CO 0.05 1.08 -0.10 -0.62 0.09 0.00 0.00 178.44 178.94 1rt1 n GLU 169 N -4.38 -0.07 -0.54 1.13 1.02 -0.62 -1.08 120.64 116.09 1rt1 n GLU 169 Ca -0.10 0.57 0.44 0.00 -0.02 0.00 0.00 57.16 58.04 1rt1 n GLU 169 Cb 0.58 -0.84 0.71 0.00 -0.02 0.00 0.00 31.44 31.87 1rt1 n GLU 169 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1rt1 n PRO 170 N -3.23 -0.02 0.05 3.49 -0.02 -1.26 0.26 135.00 134.27 1rt1 n PRO 170 Ca 0.00 1.16 -0.22 0.00 -2.02 0.00 0.00 63.50 62.43 1rt1 n PRO 170 Cb 0.04 -2.42 -0.15 0.00 -0.02 0.00 0.00 33.50 30.96 1rt1 n PRO 170 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1rt1 h PHE 171 N 0.00 0.62 -0.68 6.00 3.57 -1.38 -3.00 116.94 122.08 1rt1 h PHE 171 Ca 0.88 -0.46 0.03 0.00 3.53 0.00 0.00 57.97 61.96 1rt1 h PHE 171 Cb 3.10 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 41.77 1rt1 h PHE 171 CO -0.00 1.56 0.45 0.00 -2.23 0.00 0.00 178.31 178.09 1rt1 h ARG 172 N -0.12 0.79 0.21 1.11 3.08 0.02 0.14 114.38 119.62 1rt1 h ARG 172 Ca -0.29 -0.05 -0.32 0.00 0.07 0.00 0.00 59.98 59.39 1rt1 h ARG 172 Cb 1.91 -0.18 0.04 0.00 0.08 0.00 0.00 29.97 31.82 1rt1 h ARG 172 CO 0.14 0.52 -1.40 0.87 -1.07 0.00 0.00 179.97 179.03 1rt1 h LYS 173 N 0.81 0.56 0.00 0.04 6.56 -1.36 -1.41 116.57 121.77 1rt1 h LYS 173 Ca 0.27 -0.88 -0.03 0.00 -1.06 0.00 0.00 60.65 58.95 1rt1 h LYS 173 Cb 0.07 0.32 -0.00 0.00 -0.57 0.00 0.00 32.23 32.04 1rt1 h LYS 173 CO -0.08 1.42 -0.13 1.96 -2.06 0.00 0.00 179.45 180.56 1rt1 h GLN 174 N 0.19 0.00 -2.39 3.15 4.20 -1.25 -3.31 115.11 115.70 1rt1 h GLN 174 Ca -0.23 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 57.89 1rt1 h GLN 174 Cb 2.09 0.00 -0.38 0.00 0.30 0.00 0.00 27.48 29.49 1rt1 h GLN 174 CO 0.26 0.13 -0.96 -0.80 -0.67 0.00 0.00 178.83 176.79 1rt1 s ASN 175 N -6.55 1.54 0.00 1.46 -0.87 0.44 -4.99 114.94 105.97 1rt1 s ASN 175 Ca -0.04 -3.10 0.23 0.00 -1.57 0.00 0.00 52.86 48.38 1rt1 s ASN 175 Cb 0.15 -0.48 1.17 0.00 -0.02 0.00 0.00 41.25 42.07 1rt1 s ASN 175 CO 0.63 -0.17 1.74 -0.81 -2.57 0.00 0.00 177.10 175.92 1rt1 n PRO 176 N 2.81 0.37 0.00 -0.60 -0.04 -0.54 -2.92 135.00 134.07 1rt1 n PRO 176 Ca 0.30 0.06 0.13 0.00 -0.04 0.00 0.00 63.50 63.95 1rt1 n PRO 176 Cb 0.47 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.74 1rt1 n PRO 176 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1rt1 n ASP 177 N -1.25 1.60 -4.70 3.54 -0.08 -1.26 -4.88 116.55 109.51 1rt1 n ASP 177 Ca 0.11 -1.31 -0.35 0.00 -1.51 0.00 0.00 54.79 51.73 1rt1 n ASP 177 Cb 0.17 0.15 -0.09 0.00 2.34 0.00 0.00 41.12 43.69 1rt1 n ASP 177 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1rt1 s ILE 178 N -2.31 4.65 -0.13 5.18 1.01 -1.15 -4.49 121.20 123.97 1rt1 s ILE 178 Ca 0.27 -0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.76 1rt1 s ILE 178 Cb 0.20 -3.01 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 1rt1 s ILE 178 CO 0.46 0.57 0.06 -0.69 0.00 0.00 0.00 174.94 175.34 1rt1 s VAL 179 N -0.57 4.78 -0.14 2.92 1.01 0.12 -4.94 120.40 123.58 1rt1 s VAL 179 Ca 0.10 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1rt1 s VAL 179 Cb -0.12 -3.08 0.02 0.00 0.00 0.00 0.00 36.38 33.20 1rt1 s VAL 179 CO 0.02 0.56 -0.14 -0.63 0.00 0.00 0.00 175.10 174.91 1rt1 s ILE 180 N -0.45 1.51 -0.00 2.22 1.01 -1.26 -0.41 121.20 123.82 1rt1 s ILE 180 Ca 0.10 -0.61 0.06 0.00 0.00 0.00 0.00 60.65 60.20 1rt1 s ILE 180 Cb -0.12 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 1rt1 s ILE 180 CO 0.02 0.45 -0.20 -0.47 0.00 0.00 0.00 174.94 174.74 1rt1 s TYR 181 N 1.41 1.75 -0.20 3.97 5.04 -0.15 -4.95 117.35 124.22 1rt1 s TYR 181 Ca 0.03 -0.34 -0.01 0.00 -2.44 0.00 0.00 57.07 54.31 1rt1 s TYR 181 Cb -0.13 -1.11 0.01 0.00 0.35 0.00 0.00 41.96 41.08 1rt1 s TYR 181 CO -0.09 -0.00 -0.14 -1.14 -1.34 0.00 0.00 175.55 172.84 1rt1 s GLN 182 N -0.63 3.10 -0.12 4.97 0.74 -1.26 -0.31 119.66 126.15 1rt1 s GLN 182 Ca 0.07 -0.78 0.01 0.00 0.05 0.00 0.00 55.36 54.71 1rt1 s GLN 182 Cb -0.08 -2.75 0.02 0.00 1.10 0.00 0.00 33.01 31.30 1rt1 s GLN 182 CO -0.00 -0.22 -0.13 -0.47 -0.55 0.00 0.00 175.29 173.91 1rt1 s TYR 183 N 1.35 1.93 0.00 1.67 6.14 -0.73 -4.79 117.35 122.92 1rt1 s TYR 183 Ca 0.05 -0.98 0.00 0.00 0.64 0.00 0.00 57.07 56.78 1rt1 s TYR 183 Cb -0.14 -1.43 0.00 0.00 0.42 0.00 0.00 41.96 40.81 1rt1 s TYR 183 CO -0.09 -0.54 0.00 -1.33 0.64 0.00 0.00 175.55 174.23 1rt1 n MET 184 N 4.52 0.00 0.00 4.97 2.81 -1.26 -0.40 117.12 127.76 1rt1 n MET 184 Ca -0.17 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 55.84 1rt1 n MET 184 Cb 0.51 0.00 0.28 0.00 -0.71 0.00 0.00 33.22 33.30 1rt1 n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1rt1 n ASP 185 N 7.29 2.07 -4.91 7.83 8.00 -1.26 -4.59 116.55 130.98 1rt1 n ASP 185 Ca 0.00 -1.61 -0.21 0.00 0.71 0.00 0.00 54.79 53.68 1rt1 n ASP 185 Cb 0.00 0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 1rt1 n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1rt1 s ASP 186 N -2.12 5.88 -0.05 -2.24 1.01 0.46 0.60 116.67 120.21 1rt1 s ASP 186 Ca 0.30 -0.13 -0.01 0.00 0.71 0.00 0.00 52.55 53.42 1rt1 s ASP 186 Cb 0.20 -1.53 0.03 0.00 1.01 0.00 0.00 42.92 42.63 1rt1 s ASP 186 CO 0.37 -0.13 0.00 -0.22 0.21 0.00 0.00 175.17 175.41 1rt1 s LEU 187 N -3.95 0.80 -0.19 1.23 2.96 -0.54 -1.77 118.68 117.22 1rt1 s LEU 187 Ca 0.36 -0.06 -0.05 0.00 -0.22 0.00 0.00 54.13 54.15 1rt1 s LEU 187 Cb -0.08 -0.35 -0.03 0.00 0.50 0.00 0.00 46.19 46.23 1rt1 s LEU 187 CO 0.28 -0.15 0.01 -0.31 -1.32 0.00 0.00 176.35 174.85 1rt1 s TYR 188 N 1.58 3.07 -0.22 5.38 1.51 0.58 -0.83 117.35 128.42 1rt1 s TYR 188 Ca -0.01 -0.35 0.01 0.00 -1.01 0.00 0.00 57.07 55.70 1rt1 s TYR 188 Cb -0.13 -2.07 0.03 0.00 -0.11 0.00 0.00 41.96 39.68 1rt1 s TYR 188 CO -0.03 -0.16 -0.13 0.08 -1.11 0.00 0.00 175.55 174.20 1rt1 s VAL 189 N 0.84 2.37 -0.00 0.71 1.01 0.55 -0.98 120.40 124.90 1rt1 s VAL 189 Ca 0.01 -1.10 0.03 0.00 0.00 0.00 0.00 61.98 60.92 1rt1 s VAL 189 Cb -0.14 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1rt1 s VAL 189 CO 0.02 0.31 -0.07 -0.83 0.00 0.00 0.00 175.10 174.53 1rt1 s GLY 190 N 1.27 1.75 0.08 4.51 0.00 0.45 -0.94 107.32 114.43 1rt1 s GLY 190 Ca 0.01 -1.01 -0.18 0.00 0.00 0.00 0.00 44.72 43.53 1rt1 s GLY 190 CO -0.08 -0.87 0.44 -1.35 0.00 0.00 0.00 173.10 171.24 1rt1 s SER 191 N -1.37 -0.31 0.00 1.64 1.04 -1.13 0.15 113.70 113.72 1rt1 s SER 191 Ca 0.17 -0.08 0.21 0.00 0.48 0.00 0.00 55.95 56.73 1rt1 s SER 191 Cb -0.11 0.46 0.52 0.00 0.10 0.00 0.00 66.02 67.00 1rt1 s SER 191 CO 0.07 -0.76 1.45 0.47 0.98 0.00 0.00 173.24 175.45 1rt1 n ASP 192 N 0.19 3.07 -4.73 7.02 8.00 -1.26 -3.08 116.55 125.76 1rt1 n ASP 192 Ca -0.18 -1.95 -0.31 0.00 0.71 0.00 0.00 54.79 53.07 1rt1 n ASP 192 Cb 0.61 -0.28 0.12 0.00 -0.02 0.00 0.00 41.12 41.56 1rt1 n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1rt1 s LEU 193 N -1.34 2.82 0.38 0.64 1.43 -1.26 -4.89 118.68 116.45 1rt1 s LEU 193 Ca 0.38 1.86 -0.25 0.00 -1.03 0.00 0.00 54.13 55.09 1rt1 s LEU 193 Cb 0.21 -4.42 -0.09 0.00 0.03 0.00 0.00 46.19 41.92 1rt1 s LEU 193 CO 0.29 -2.43 1.02 -1.83 0.23 0.00 0.00 176.35 173.63 1rt1 s GLU 194 N -4.84 4.29 0.01 1.70 4.04 -1.26 -4.57 118.70 118.07 1rt1 s GLU 194 Ca 0.63 1.46 -0.01 0.00 0.04 0.00 0.00 54.97 57.09 1rt1 s GLU 194 Cb -0.19 -2.62 0.00 0.00 0.02 0.00 0.00 34.13 31.35 1rt1 s GLU 194 CO 0.57 -0.02 0.06 1.51 -1.84 0.00 0.00 175.26 175.55 1rt1 n ILE 195 N 0.11 -0.03 0.20 1.83 0.13 -1.26 -0.16 119.36 120.18 1rt1 n ILE 195 Ca 0.04 0.10 -0.13 0.00 -1.10 0.00 0.00 62.75 61.66 1rt1 n ILE 195 Cb 0.50 -0.12 -0.07 0.00 -0.84 0.00 0.00 39.64 39.10 1rt1 n ILE 195 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1rt1 h GLY 196 N 0.00 -0.56 1.33 4.50 0.00 -1.99 -0.01 103.07 106.35 1rt1 h GLY 196 Ca 0.01 0.21 0.09 0.00 0.00 0.00 0.00 47.33 47.64 1rt1 h GLY 196 CO -0.04 -0.20 0.25 1.46 0.00 0.00 0.00 176.54 178.01 1rt1 h GLN 197 N -0.90 0.05 0.26 4.80 4.20 -1.18 0.26 115.11 122.61 1rt1 h GLN 197 Ca -0.05 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 1rt1 h GLN 197 Cb 0.55 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1rt1 h GLN 197 CO 0.09 0.03 -0.13 1.25 -0.67 0.00 0.00 178.83 179.41 1rt1 h HIS 198 N 0.05 -0.33 -0.60 2.96 2.76 -0.43 -2.16 115.15 117.40 1rt1 h HIS 198 Ca 0.17 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.37 1rt1 h HIS 198 Cb 0.60 0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.63 1rt1 h HIS 198 CO -0.00 -0.20 0.40 0.00 -1.30 0.00 0.00 177.93 176.82 1rt1 h ARG 199 N -0.54 0.65 -0.56 5.26 3.08 -0.54 0.19 114.38 121.92 1rt1 h ARG 199 Ca -0.04 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 1rt1 h ARG 199 Cb 0.27 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1rt1 h ARG 199 CO 0.06 0.43 0.04 1.79 -1.07 0.00 0.00 179.97 181.22 1rt1 h THR 200 N 0.67 1.25 0.00 2.04 1.35 -0.58 0.26 112.91 117.90 1rt1 h THR 200 Ca 0.25 -1.02 -0.07 0.00 -0.55 0.00 0.00 66.41 65.02 1rt1 h THR 200 Cb 0.14 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 67.32 1rt1 h THR 200 CO -0.07 0.37 -0.32 0.50 -0.25 0.00 0.00 175.52 175.76 1rt1 h LYS 201 N 0.87 0.00 0.01 4.72 1.63 -0.02 -1.33 116.57 122.45 1rt1 h LYS 201 Ca 0.17 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.89 1rt1 h LYS 201 Cb 0.45 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.09 1rt1 h LYS 201 CO 0.02 0.32 -0.30 0.82 -3.45 0.00 0.00 179.45 176.85 1rt1 h ILE 202 N 0.00 1.56 0.00 2.00 1.08 -0.12 -2.79 117.51 119.24 1rt1 h ILE 202 Ca -0.00 -2.06 -0.01 0.00 -0.39 0.00 0.00 64.86 62.39 1rt1 h ILE 202 Cb 0.73 2.88 -0.00 0.00 -3.07 0.00 0.00 36.82 37.35 1rt1 h ILE 202 CO 0.04 0.57 -0.04 -0.08 -0.69 0.00 0.00 178.15 177.95 1rt1 h GLU 203 N -0.52 0.00 -0.83 2.37 4.22 -0.84 0.39 114.58 119.37 1rt1 h GLU 203 Ca -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.39 1rt1 h GLU 203 Cb 1.09 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.30 1rt1 h GLU 203 CO 0.06 0.04 0.50 1.49 -2.18 0.00 0.00 179.01 178.92 1rt1 h GLU 204 N 0.00 1.13 -0.36 1.92 4.81 -1.17 -0.14 114.58 120.77 1rt1 h GLU 204 Ca -0.00 -0.10 -0.06 0.00 -0.13 0.00 0.00 59.36 59.07 1rt1 h GLU 204 Cb 0.07 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1rt1 h GLU 204 CO 0.01 0.79 0.01 1.25 -0.73 0.00 0.00 179.01 180.34 1rt1 h LEU 205 N 1.15 0.62 -0.42 1.64 7.12 -0.03 -2.36 115.31 123.03 1rt1 h LEU 205 Ca 0.30 -0.30 -0.03 0.00 0.13 0.00 0.00 57.88 57.98 1rt1 h LEU 205 Cb -0.04 -0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 39.90 1rt1 h LEU 205 CO -0.06 0.77 0.15 -0.09 -0.13 0.00 0.00 178.44 179.08 1rt1 h ARG 206 N 0.45 0.63 -0.44 1.25 2.43 -0.07 0.36 114.38 118.98 1rt1 h ARG 206 Ca 0.10 -0.12 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 1rt1 h ARG 206 Cb 0.45 -0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 29.83 1rt1 h ARG 206 CO 0.02 0.60 0.04 1.96 -1.51 0.00 0.00 179.97 181.08 1rt1 h GLN 207 N 0.53 0.16 -0.31 0.20 4.20 -1.02 1.02 115.11 119.88 1rt1 h GLN 207 Ca 0.14 -0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.89 1rt1 h GLN 207 Cb 0.22 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.91 1rt1 h GLN 207 CO -0.01 0.10 0.00 1.25 -0.67 0.00 0.00 178.83 179.51 1rt1 h HIS 208 N 0.16 -0.02 0.00 2.96 2.76 -0.85 -1.58 115.15 118.58 1rt1 h HIS 208 Ca 0.22 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.37 1rt1 h HIS 208 Cb 0.30 0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.31 1rt1 h HIS 208 CO -0.25 -0.05 -0.22 -0.07 -1.30 0.00 0.00 177.93 176.04 1rt1 h LEU 209 N 0.09 0.00 -0.41 0.26 4.07 0.22 -2.98 115.31 116.57 1rt1 h LEU 209 Ca 0.15 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.98 1rt1 h LEU 209 Cb 0.20 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.92 1rt1 h LEU 209 CO -0.25 0.22 -0.62 0.25 -1.08 0.00 0.00 178.44 176.95 1rt1 h LEU 210 N 0.00 0.00 -1.64 1.67 5.85 0.19 -2.94 115.31 118.44 1rt1 h LEU 210 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1rt1 h LEU 210 Cb 0.59 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1rt1 h LEU 210 CO 0.03 0.62 0.00 -2.11 -0.34 0.00 0.00 178.44 176.64 1rt1 n ARG 211 N -3.45 0.74 0.04 1.25 1.85 -1.02 -2.65 116.66 113.42 1rt1 n ARG 211 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1rt1 n ARG 211 Cb 0.70 -1.21 0.00 0.00 -1.05 0.00 0.00 32.46 30.90 1rt1 n ARG 211 CO 0.00 0.00 0.00 0.91 -0.01 0.00 0.00 177.63 178.53 1rt1 n TRP 212 N 0.45 -0.74 0.00 2.89 7.02 -1.22 -5.09 117.44 120.75 1rt1 n TRP 212 Ca 0.00 0.13 0.00 0.00 -1.02 0.00 0.00 57.50 56.61 1rt1 n TRP 212 Cb 0.31 0.51 0.00 0.00 -2.42 0.00 0.00 31.31 29.71 1rt1 n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1rt1 n GLY 213 N 1.55 -0.75 3.60 6.99 0.00 -1.09 -5.14 105.19 110.36 1rt1 n GLY 213 Ca 0.00 0.23 -0.15 0.00 0.00 0.00 0.00 46.02 46.10 1rt1 n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rt1 s LEU 214 N 0.00 -0.72 -0.22 0.99 1.43 -1.13 -4.19 118.68 114.83 1rt1 s LEU 214 Ca 0.00 1.25 -0.06 0.00 -1.03 0.00 0.00 54.13 54.28 1rt1 s LEU 214 Cb 0.00 2.47 0.11 0.00 0.03 0.00 0.00 46.19 48.80 1rt1 s LEU 214 CO 0.00 -0.34 0.45 0.42 0.23 0.00 0.00 176.35 177.11 1rt1 s THR 215 N -0.03 -0.70 0.00 5.49 -4.23 -1.26 -3.67 115.64 111.25 1rt1 s THR 215 Ca -0.03 0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 1rt1 s THR 215 Cb -0.04 -0.74 0.00 0.00 1.34 0.00 0.00 72.50 73.06 1rt1 s THR 215 CO 0.03 0.03 0.00 0.00 -0.54 0.00 0.00 174.62 174.14 1rt1 n TYR 232 N 5.39 0.00 -3.66 3.99 4.19 -1.25 -4.71 117.16 121.12 1rt1 n TYR 232 Ca -0.08 0.00 -0.37 0.00 3.31 0.00 0.00 57.90 60.77 1rt1 n TYR 232 Cb 0.50 0.00 -0.08 0.00 0.49 0.00 0.00 39.34 40.25 1rt1 n TYR 232 CO 0.00 0.00 0.00 -1.21 0.91 0.00 0.00 176.86 176.56 1rt1 s GLU 233 N -3.53 2.94 0.45 2.98 0.41 -1.26 -2.25 118.70 118.43 1rt1 s GLU 233 Ca 0.00 -2.88 -0.04 0.00 -0.41 0.00 0.00 54.97 51.64 1rt1 s GLU 233 Cb 0.00 -3.86 -0.04 0.00 -1.78 0.00 0.00 34.13 28.45 1rt1 s GLU 233 CO 0.00 -1.22 0.74 -0.51 -0.49 0.00 0.00 175.26 173.77 1rt1 s LEU 234 N -0.66 3.72 -0.44 1.80 1.02 0.37 -4.89 118.68 119.60 1rt1 s LEU 234 Ca 0.22 0.84 0.07 0.00 0.02 0.00 0.00 54.13 55.28 1rt1 s LEU 234 Cb -0.14 -3.77 0.23 0.00 0.02 0.00 0.00 46.19 42.53 1rt1 s LEU 234 CO -0.08 -0.51 0.51 1.41 0.02 0.00 0.00 176.35 177.70 1rt1 n HIS 235 N -2.10 0.13 -0.37 0.29 8.25 -1.26 0.10 115.22 120.27 1rt1 n HIS 235 Ca -0.00 -3.61 0.30 0.00 -0.26 0.00 0.00 57.72 54.14 1rt1 n HIS 235 Cb 0.55 -0.26 0.60 0.00 1.12 0.00 0.00 29.99 32.00 1rt1 n HIS 235 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1rt1 h PRO 236 N 4.40 0.22 0.00 -0.41 0.11 -1.75 -1.85 132.00 132.73 1rt1 h PRO 236 Ca 0.13 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1rt1 h PRO 236 Cb 0.86 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1rt1 h PRO 236 CO 0.50 0.15 0.00 -0.40 -0.21 0.00 0.00 178.00 178.03 1rt1 n ASP 237 N -4.55 0.23 0.11 -2.05 5.75 -1.17 -2.22 116.55 112.65 1rt1 n ASP 237 Ca 0.29 0.56 0.11 0.00 -0.01 0.00 0.00 54.79 55.75 1rt1 n ASP 237 Cb 1.12 -0.61 0.01 0.00 -1.03 0.00 0.00 41.12 40.62 1rt1 n ASP 237 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 1rt1 h LYS 238 N 0.00 0.00 -5.30 0.11 2.10 -1.66 -3.44 116.57 108.37 1rt1 h LYS 238 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 1rt1 h LYS 238 Cb 0.27 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.60 1rt1 h LYS 238 CO 0.00 0.00 0.05 -1.58 -2.00 0.00 0.00 179.45 175.92 1rt1 s TRP 239 N -3.35 1.18 0.18 0.07 0.51 -0.94 -4.90 118.94 111.69 1rt1 s TRP 239 Ca 0.00 2.03 -0.30 0.00 -2.12 0.00 0.00 56.10 55.72 1rt1 s TRP 239 Cb 0.09 -3.43 -0.08 0.00 -0.81 0.00 0.00 33.47 29.25 1rt1 s TRP 239 CO 0.78 -1.35 1.07 0.95 -0.51 0.00 0.00 176.95 177.89 1rt1 s THR 240 N 15.23 3.94 -0.13 2.01 -4.23 -1.26 -5.01 115.64 126.19 1rt1 s THR 240 Ca 0.89 1.71 -0.29 0.00 -1.18 0.00 0.00 61.69 62.81 1rt1 s THR 240 Cb -0.11 -4.09 -0.01 0.00 1.34 0.00 0.00 72.50 69.63 1rt1 s THR 240 CO 0.10 0.31 1.14 -0.69 -0.54 0.00 0.00 174.62 174.94 1rt1 s VAL 241 N -0.37 4.47 -0.07 2.29 1.01 -1.26 -5.00 120.40 121.47 1rt1 s VAL 241 Ca 0.48 1.77 0.01 0.00 0.00 0.00 0.00 61.98 64.24 1rt1 s VAL 241 Cb -0.28 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 1rt1 s VAL 241 CO 0.34 -0.07 -0.09 -1.10 0.00 0.00 0.00 175.10 174.18 1rt1 s GLN 242 N 2.70 2.79 0.60 2.72 -1.52 -1.26 -5.13 119.66 120.56 1rt1 s GLN 242 Ca 0.51 -0.60 0.00 0.00 -1.95 0.00 0.00 55.36 53.33 1rt1 s GLN 242 Cb -0.20 -2.56 0.12 0.00 -0.22 0.00 0.00 33.01 30.15 1rt1 s GLN 242 CO 0.16 0.59 0.83 -0.35 -0.25 0.00 0.00 175.29 176.27 1rt1 n PRO 243 N 2.43 0.04 -3.70 2.91 -0.04 -1.26 -4.86 135.00 130.52 1rt1 n PRO 243 Ca -0.18 -2.30 -0.36 0.00 -0.04 0.00 0.00 63.50 60.62 1rt1 n PRO 243 Cb 0.53 -0.54 -0.09 0.00 -0.04 0.00 0.00 33.50 33.36 1rt1 n PRO 243 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1rt1 s ILE 244 N -2.52 5.29 -0.18 0.52 -1.09 -1.26 -0.62 121.20 121.34 1rt1 s ILE 244 Ca 0.55 0.15 -0.04 0.00 -2.23 0.00 0.00 60.65 59.08 1rt1 s ILE 244 Cb -0.03 -3.45 -0.03 0.00 -1.58 0.00 0.00 42.46 37.37 1rt1 s ILE 244 CO 0.37 0.37 -0.02 0.68 -1.23 0.00 0.00 174.94 175.11 1rt1 s VAL 245 N 0.89 3.96 0.25 2.92 -7.23 -0.54 -4.79 120.40 115.86 1rt1 s VAL 245 Ca 0.07 -0.32 -0.09 0.00 -1.81 0.00 0.00 61.98 59.83 1rt1 s VAL 245 Cb -0.13 -2.76 -0.07 0.00 0.56 0.00 0.00 36.38 33.98 1rt1 s VAL 245 CO 0.03 0.46 0.56 -0.76 -0.31 0.00 0.00 175.10 175.09 1rt1 s LEU 246 N 0.65 4.12 0.56 1.32 1.43 -1.26 -4.74 118.68 120.75 1rt1 s LEU 246 Ca -0.01 0.89 -0.21 0.00 -1.03 0.00 0.00 54.13 53.77 1rt1 s LEU 246 Cb -0.14 -3.67 -0.05 0.00 0.03 0.00 0.00 46.19 42.36 1rt1 s LEU 246 CO 0.02 -0.12 1.26 -2.16 0.23 0.00 0.00 176.35 175.59 1rt1 s PRO 247 N -3.03 3.14 0.04 1.29 0.04 -1.26 -5.04 135.00 130.18 1rt1 s PRO 247 Ca 0.47 1.99 0.06 0.00 0.04 0.00 0.00 61.00 63.56 1rt1 s PRO 247 Cb -0.11 -2.13 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 1rt1 s PRO 247 CO 0.24 -1.11 -0.17 -1.21 0.04 0.00 0.00 177.00 174.78 1rt1 s GLU 248 N -3.06 1.15 0.04 4.56 2.02 -1.26 -5.16 118.70 117.00 1rt1 s GLU 248 Ca 0.73 -0.85 -0.13 0.00 0.02 0.00 0.00 54.97 54.75 1rt1 s GLU 248 Cb -0.34 -1.22 0.02 0.00 0.10 0.00 0.00 34.13 32.68 1rt1 s GLU 248 CO 0.39 0.31 0.28 0.15 0.02 0.00 0.00 175.26 176.41 1rt1 s LYS 249 N -1.16 0.77 0.05 1.61 1.02 -1.26 -5.04 119.74 115.74 1rt1 s LYS 249 Ca 0.05 -0.52 -0.33 0.00 0.02 0.00 0.00 55.97 55.18 1rt1 s LYS 249 Cb -0.08 0.33 -0.19 0.00 -0.52 0.00 0.00 37.83 37.37 1rt1 s LYS 249 CO 0.02 -0.24 1.49 -0.44 -0.92 0.00 0.00 175.35 175.26 1rt1 h ASP 250 N 3.31 -0.86 -4.12 2.83 5.19 -2.04 -3.44 116.42 117.29 1rt1 h ASP 250 Ca -0.32 0.01 -0.45 0.00 -0.62 0.00 0.00 57.03 55.65 1rt1 h ASP 250 Cb 1.20 0.22 -0.20 0.00 0.18 0.00 0.00 39.33 40.73 1rt1 h ASP 250 CO 0.46 -0.57 -0.78 -0.44 -3.12 0.00 0.00 179.24 174.79 1rt1 s SER 251 N -4.34 2.09 -0.07 6.45 0.01 -1.26 -5.10 113.70 111.48 1rt1 s SER 251 Ca -0.17 -0.75 0.03 0.00 1.31 0.00 0.00 55.95 56.37 1rt1 s SER 251 Cb 0.03 -0.09 -0.02 0.00 0.21 0.00 0.00 66.02 66.15 1rt1 s SER 251 CO 0.58 -0.08 -0.15 0.26 0.41 0.00 0.00 173.24 174.25 1rt1 s TRP 252 N -1.74 2.70 0.34 2.43 0.52 -1.26 -5.04 118.94 116.88 1rt1 s TRP 252 Ca 0.07 -0.37 0.03 0.00 0.02 0.00 0.00 56.10 55.85 1rt1 s TRP 252 Cb -0.07 -1.69 -0.02 0.00 -1.15 0.00 0.00 33.47 30.54 1rt1 s TRP 252 CO 0.03 0.02 0.50 0.95 0.02 0.00 0.00 176.95 178.48 1rt1 s THR 253 N -0.34 4.63 0.24 2.01 -4.23 -1.26 -0.91 115.64 115.78 1rt1 s THR 253 Ca 0.03 -0.76 -0.05 0.00 -1.18 0.00 0.00 61.69 59.73 1rt1 s THR 253 Cb -0.13 -3.66 0.23 0.00 1.34 0.00 0.00 72.50 70.29 1rt1 s THR 253 CO 0.02 -0.34 1.68 0.58 -0.54 0.00 0.00 174.62 176.03 1rt1 h VAL 254 N 0.83 0.51 -0.11 2.29 2.07 -1.20 0.02 116.25 120.66 1rt1 h VAL 254 Ca -0.48 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 1rt1 h VAL 254 Cb 1.24 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1rt1 h VAL 254 CO 0.58 0.05 0.05 -1.13 0.02 0.00 0.00 177.57 177.14 1rt1 h ASN 255 N 0.26 0.14 -0.48 0.57 -0.00 -1.62 -0.31 115.58 114.14 1rt1 h ASN 255 Ca 0.42 -0.11 0.09 0.00 -0.00 0.00 0.00 56.30 56.69 1rt1 h ASN 255 Cb 0.71 -0.04 -0.08 0.00 -0.00 0.00 0.00 38.32 38.92 1rt1 h ASN 255 CO -0.52 0.21 0.00 0.44 -0.00 0.00 0.00 177.43 177.57 1rt1 h ASP 256 N 0.06 -0.20 -0.19 1.15 3.32 -1.33 0.38 116.42 119.61 1rt1 h ASP 256 Ca 0.04 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 1rt1 h ASP 256 Cb 0.11 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1rt1 h ASP 256 CO -0.01 -0.06 0.09 0.40 -1.72 0.00 0.00 179.24 177.94 1rt1 h ILE 257 N 0.12 1.13 -0.94 0.35 2.04 -0.94 0.50 117.51 119.76 1rt1 h ILE 257 Ca 0.24 -0.37 0.06 0.00 1.00 0.00 0.00 64.86 65.79 1rt1 h ILE 257 Cb 0.36 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.40 1rt1 h ILE 257 CO -0.40 0.13 0.61 1.56 0.00 0.00 0.00 178.15 180.05 1rt1 h GLN 258 N 0.18 1.06 -0.29 2.37 4.20 -0.13 0.61 115.11 123.11 1rt1 h GLN 258 Ca 0.07 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.64 1rt1 h GLN 258 Cb 0.12 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1rt1 h GLN 258 CO -0.01 0.70 -0.12 0.87 -0.67 0.00 0.00 178.83 179.61 1rt1 h LYS 259 N 1.09 0.59 -0.39 1.46 1.57 0.03 -2.69 116.57 118.23 1rt1 h LYS 259 Ca 0.40 -0.25 -0.05 0.00 -1.87 0.00 0.00 60.65 58.88 1rt1 h LYS 259 Cb 0.18 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1rt1 h LYS 259 CO -0.15 0.81 0.04 1.25 -0.57 0.00 0.00 179.45 180.83 1rt1 h LEU 260 N 0.34 0.64 -1.03 2.94 5.85 0.32 -2.89 115.31 121.48 1rt1 h LEU 260 Ca 0.07 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1rt1 h LEU 260 Cb 0.62 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 1rt1 h LEU 260 CO 0.04 0.76 0.61 0.58 -0.34 0.00 0.00 178.44 180.09 1rt1 h VAL 261 N 0.50 1.25 -0.48 1.05 2.07 0.14 -1.47 116.25 119.31 1rt1 h VAL 261 Ca 0.11 -0.49 -0.10 0.00 0.82 0.00 0.00 66.70 67.05 1rt1 h VAL 261 Cb 0.41 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1rt1 h VAL 261 CO 0.01 0.25 -0.09 1.23 0.02 0.00 0.00 177.57 179.00 1rt1 h GLY 262 N 1.30 0.92 0.99 2.17 0.00 -1.32 -1.10 103.07 106.02 1rt1 h GLY 262 Ca 0.34 -0.69 -0.15 0.00 0.00 0.00 0.00 47.33 46.83 1rt1 h GLY 262 CO -0.07 0.64 -0.48 0.50 0.00 0.00 0.00 176.54 177.12 1rt1 h LYS 263 N 0.77 0.67 -0.47 4.80 1.57 -1.29 -2.61 116.57 120.02 1rt1 h LYS 263 Ca 0.13 -0.46 -0.08 0.00 -1.87 0.00 0.00 60.65 58.37 1rt1 h LYS 263 Cb 0.59 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 1rt1 h LYS 263 CO 0.04 1.08 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.89 1rt1 h LEU 264 N 0.36 0.78 -0.36 2.94 3.38 -1.22 0.36 115.31 121.55 1rt1 h LEU 264 Ca -0.01 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 1rt1 h LEU 264 Cb 1.10 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 1rt1 h LEU 264 CO 0.11 0.87 0.04 -1.13 0.09 0.00 0.00 178.44 178.42 1rt1 h ASN 265 N 0.74 0.59 0.22 -0.43 -1.24 -1.20 -2.20 115.58 112.07 1rt1 h ASN 265 Ca 0.14 -0.28 -0.01 0.00 0.71 0.00 0.00 56.30 56.86 1rt1 h ASN 265 Cb 0.51 -0.16 0.00 0.00 0.73 0.00 0.00 38.32 39.40 1rt1 h ASN 265 CO 0.03 0.72 -0.11 -0.25 -1.29 0.00 0.00 177.43 176.53 1rt1 h TRP 266 N 0.44 -0.28 0.00 0.67 7.01 -1.17 -2.33 115.95 120.29 1rt1 h TRP 266 Ca 0.11 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.10 1rt1 h TRP 266 Cb 0.39 0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.54 1rt1 h TRP 266 CO 0.03 -0.16 0.12 0.00 -2.79 0.00 0.00 178.44 175.64 1rt1 n ALA 267 N -2.23 0.87 0.65 2.65 0.00 0.09 -1.89 120.51 120.65 1rt1 n ALA 267 Ca -0.09 0.16 0.09 0.00 0.00 0.00 0.00 53.44 53.59 1rt1 n ALA 267 Cb 0.15 -1.09 0.39 0.00 0.00 0.00 0.00 19.45 18.90 1rt1 n ALA 267 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1rt1 n SER 268 N -2.14 0.00 0.20 0.00 3.41 -0.85 -1.53 113.62 112.71 1rt1 n SER 268 Ca -0.01 0.41 0.14 0.00 -0.26 0.00 0.00 58.87 59.15 1rt1 n SER 268 Cb 0.15 -0.46 0.45 0.00 -0.26 0.00 0.00 64.21 64.09 1rt1 n SER 268 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1rt1 h GLN 269 N 0.00 0.00 0.00 4.33 4.20 -1.56 -3.18 115.11 118.90 1rt1 h GLN 269 Ca 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1rt1 h GLN 269 Cb 0.28 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 1rt1 h GLN 269 CO 0.00 0.00 -1.05 -0.89 -0.67 0.00 0.00 178.83 176.22 1rt1 n ILE 270 N -2.76 1.49 -3.78 2.54 5.41 -0.58 -4.84 119.36 116.84 1rt1 n ILE 270 Ca 0.03 0.11 -0.36 0.00 1.00 0.00 0.00 62.75 63.53 1rt1 n ILE 270 Cb 0.37 -2.32 -0.11 0.00 -0.71 0.00 0.00 39.64 36.87 1rt1 n ILE 270 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1rt1 s TYR 271 N -2.79 3.54 -0.20 1.39 2.02 -0.92 -4.97 117.35 115.42 1rt1 s TYR 271 Ca -0.28 -2.55 0.22 0.00 -0.37 0.00 0.00 57.07 54.09 1rt1 s TYR 271 Cb 0.05 -3.19 1.19 0.00 -0.40 0.00 0.00 41.96 39.60 1rt1 s TYR 271 CO 0.41 -0.93 1.68 -2.30 -1.57 0.00 0.00 175.55 172.84 1rt1 n PRO 272 N 4.24 0.15 0.00 -1.71 -0.02 -1.20 -1.64 135.00 134.81 1rt1 n PRO 272 Ca 0.01 0.63 0.15 0.00 -2.02 0.00 0.00 63.50 62.27 1rt1 n PRO 272 Cb 0.40 -1.96 0.77 0.00 -0.02 0.00 0.00 33.50 32.69 1rt1 n PRO 272 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rt1 n GLY 273 N -1.21 -0.74 3.69 -1.23 0.00 -1.26 -4.79 105.19 99.65 1rt1 n GLY 273 Ca -0.01 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 1rt1 n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rt1 s ILE 274 N -2.11 4.28 0.01 -0.61 1.01 -0.65 -4.92 121.20 118.21 1rt1 s ILE 274 Ca 0.41 1.61 0.06 0.00 0.00 0.00 0.00 60.65 62.73 1rt1 s ILE 274 Cb 0.21 -4.03 -0.02 0.00 0.01 0.00 0.00 42.46 38.63 1rt1 s ILE 274 CO 0.38 0.01 -0.18 -0.54 0.00 0.00 0.00 174.94 174.61 1rt1 s LYS 275 N 2.10 1.36 -0.03 2.79 1.02 -1.26 -4.82 119.74 120.89 1rt1 s LYS 275 Ca 0.56 -0.74 0.04 0.00 0.02 0.00 0.00 55.97 55.84 1rt1 s LYS 275 Cb -0.25 -1.37 0.06 0.00 -0.52 0.00 0.00 37.83 35.76 1rt1 s LYS 275 CO 0.22 0.36 0.96 1.33 -0.92 0.00 0.00 175.35 177.30 1rt1 n VAL 276 N 2.30 0.98 0.13 3.17 0.24 -1.26 -4.84 118.33 119.05 1rt1 n VAL 276 Ca -0.16 -1.07 -0.14 0.00 -2.04 0.00 0.00 64.34 60.94 1rt1 n VAL 276 Cb 0.54 0.41 -0.08 0.00 -1.47 0.00 0.00 33.84 33.24 1rt1 n VAL 276 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 1rt1 h ARG 277 N 0.00 -0.26 -0.54 7.34 -0.00 -1.98 0.42 114.38 119.36 1rt1 h ARG 277 Ca 0.00 0.02 0.02 0.00 -0.00 0.00 0.00 59.98 60.01 1rt1 h ARG 277 Cb 0.74 0.06 -0.03 0.00 -0.00 0.00 0.00 29.97 30.74 1rt1 h ARG 277 CO 0.00 -0.09 0.34 1.96 -0.00 0.00 0.00 179.97 182.18 1rt1 h GLN 278 N -0.38 0.66 -0.06 0.08 1.08 -1.91 -1.61 115.11 112.98 1rt1 h GLN 278 Ca -0.03 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1rt1 h GLN 278 Cb 0.29 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1rt1 h GLN 278 CO 0.05 0.44 0.03 -0.07 -0.95 0.00 0.00 178.83 178.33 1rt1 h LEU 279 N 0.68 0.07 -2.00 1.46 3.38 -1.84 -2.27 115.31 114.80 1rt1 h LEU 279 Ca 0.21 -0.03 0.20 0.00 0.09 0.00 0.00 57.88 58.35 1rt1 h LEU 279 Cb -0.03 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1rt1 h LEU 279 CO -0.07 0.07 0.52 0.00 0.09 0.00 0.00 178.44 179.05 1rt1 h LYS 281 N 0.00 0.00 0.00 0.00 1.57 -0.69 -1.73 116.57 115.72 1rt1 h LYS 281 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1rt1 h LYS 281 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.67 1rt1 h LYS 281 CO -0.00 0.39 0.00 1.28 -0.57 0.00 0.00 179.45 180.55 1rt1 n LEU 282 N -3.70 0.69 -1.42 2.94 4.77 0.15 -2.28 117.00 118.16 1rt1 n LEU 282 Ca -0.01 0.67 0.10 0.00 -0.03 0.00 0.00 56.01 56.74 1rt1 n LEU 282 Cb 0.48 -0.57 0.33 0.00 -2.33 0.00 0.00 43.42 41.32 1rt1 n LEU 282 CO 0.37 -0.56 0.78 0.18 -1.33 0.00 0.00 177.39 176.83 1rt1 n LEU 283 N -2.26 4.16 -4.64 2.23 4.32 -0.65 -4.87 117.00 115.28 1rt1 n LEU 283 Ca 0.02 -2.09 -0.43 0.00 -0.02 0.00 0.00 56.01 53.49 1rt1 n LEU 283 Cb 0.23 -0.52 -0.03 0.00 -1.62 0.00 0.00 43.42 41.49 1rt1 n LEU 283 CO 0.20 0.86 0.85 -0.60 -1.22 0.00 0.00 177.39 177.48 1rt1 s ARG 284 N -1.44 4.13 0.00 3.23 3.52 -0.97 -4.86 118.95 122.57 1rt1 s ARG 284 Ca 0.48 1.08 0.00 0.00 -0.13 0.00 0.00 55.73 57.16 1rt1 s ARG 284 Cb 0.28 -3.69 0.00 0.00 -1.56 0.00 0.00 34.95 29.98 1rt1 s ARG 284 CO 0.28 -0.73 0.00 0.41 -0.81 0.00 0.00 175.30 174.45 1rt1 n GLY 285 N 3.71 3.95 2.85 8.12 0.00 -1.26 -4.95 105.19 117.61 1rt1 n GLY 285 Ca 0.10 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 1rt1 n GLY 285 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rt1 n THR 286 N -0.82 4.64 -3.87 2.61 -2.24 -1.26 -4.98 114.28 108.35 1rt1 n THR 286 Ca 0.00 -4.71 -0.21 0.00 -2.27 0.00 0.00 64.05 56.86 1rt1 n THR 286 Cb 0.00 -2.27 -0.03 0.00 -2.10 0.00 0.00 70.33 65.94 1rt1 n THR 286 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1rt1 s LYS 287 N -0.43 3.06 0.29 -0.78 -2.85 -1.26 -5.06 119.74 112.71 1rt1 s LYS 287 Ca 0.39 -1.02 -0.30 0.00 -1.00 0.00 0.00 55.97 54.04 1rt1 s LYS 287 Cb 0.10 -2.69 -0.12 0.00 -2.06 0.00 0.00 37.83 33.06 1rt1 s LYS 287 CO 0.01 0.27 1.61 0.00 0.10 0.00 0.00 175.35 177.34 1rt1 n ALA 288 N -1.38 2.58 -0.19 0.59 0.00 -1.26 -4.88 120.51 115.96 1rt1 n ALA 288 Ca -0.05 0.38 0.24 0.00 0.00 0.00 0.00 53.44 54.00 1rt1 n ALA 288 Cb 0.58 -2.47 0.63 0.00 0.00 0.00 0.00 19.45 18.20 1rt1 n ALA 288 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1rt1 h LEU 289 N 4.98 0.17 -0.03 0.00 4.07 -1.97 0.99 115.31 123.52 1rt1 h LEU 289 Ca -0.47 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.51 1rt1 h LEU 289 Cb 1.22 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.95 1rt1 h LEU 289 CO 0.81 0.06 -0.29 0.35 -1.08 0.00 0.00 178.44 178.29 1rt1 n THR 290 N -4.38 0.00 -1.98 0.22 -2.24 -1.26 -1.68 114.28 102.96 1rt1 n THR 290 Ca 0.18 -0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.55 1rt1 n THR 290 Cb 0.83 -0.03 -0.01 0.00 -2.10 0.00 0.00 70.33 69.02 1rt1 n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1rt1 s GLU 291 N -2.95 4.25 -0.01 -0.78 2.12 0.34 -4.77 118.70 116.90 1rt1 s GLU 291 Ca 0.14 2.37 -0.22 0.00 0.36 0.00 0.00 54.97 57.62 1rt1 s GLU 291 Cb 0.18 -3.03 -0.05 0.00 0.26 0.00 0.00 34.13 31.49 1rt1 s GLU 291 CO 0.62 -0.35 0.65 0.08 -0.54 0.00 0.00 175.26 175.72 1rt1 s VAL 292 N -1.06 4.90 -0.13 3.70 1.01 -1.26 -1.63 120.40 125.93 1rt1 s VAL 292 Ca 0.51 1.35 -0.02 0.00 0.00 0.00 0.00 61.98 63.83 1rt1 s VAL 292 Cb -0.43 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 1rt1 s VAL 292 CO 0.57 0.38 -0.08 -0.63 0.00 0.00 0.00 175.10 175.33 1rt1 s ILE 293 N 0.03 3.52 -0.07 2.22 -1.09 -0.09 -4.95 121.20 120.77 1rt1 s ILE 293 Ca 0.34 -0.50 -0.30 0.00 -2.23 0.00 0.00 60.65 57.96 1rt1 s ILE 293 Cb -0.19 -2.51 -0.02 0.00 -1.58 0.00 0.00 42.46 38.17 1rt1 s ILE 293 CO 0.18 0.52 1.03 -2.16 -1.23 0.00 0.00 174.94 173.28 1rt1 s PRO 294 N 0.22 4.44 -0.10 2.79 0.04 -1.26 -4.20 135.00 136.93 1rt1 s PRO 294 Ca -0.05 1.44 -0.30 0.00 0.04 0.00 0.00 61.00 62.14 1rt1 s PRO 294 Cb -0.14 -3.52 -0.02 0.00 0.04 0.00 0.00 34.50 30.85 1rt1 s PRO 294 CO 0.04 -0.28 1.12 -0.51 0.04 0.00 0.00 177.00 177.41 1rt1 s LEU 295 N 1.81 4.24 0.42 -3.56 1.43 -1.26 -5.02 118.68 116.75 1rt1 s LEU 295 Ca 0.50 1.66 -0.24 0.00 -1.03 0.00 0.00 54.13 55.02 1rt1 s LEU 295 Cb -0.20 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 42.38 1rt1 s LEU 295 CO 0.21 -0.55 1.13 0.42 0.23 0.00 0.00 176.35 177.78 1rt1 s THR 296 N 2.31 3.31 0.39 5.49 -4.23 -1.26 -4.82 115.64 116.84 1rt1 s THR 296 Ca 0.52 1.02 0.13 0.00 -1.18 0.00 0.00 61.69 62.18 1rt1 s THR 296 Cb -0.21 -3.54 0.34 0.00 1.34 0.00 0.00 72.50 70.43 1rt1 s THR 296 CO 0.19 0.02 1.89 -0.33 -0.54 0.00 0.00 174.62 175.85 1rt1 h GLU 297 N 2.35 0.53 -0.84 3.99 4.39 -1.98 0.27 114.58 123.29 1rt1 h GLU 297 Ca -0.49 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.15 1rt1 h GLU 297 Cb 1.23 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.73 1rt1 h GLU 297 CO 0.61 0.35 0.41 0.93 -1.16 0.00 0.00 179.01 180.15 1rt1 h GLU 298 N 0.54 1.21 -0.27 2.33 3.07 -2.00 0.10 114.58 119.57 1rt1 h GLU 298 Ca 0.42 -0.17 -0.13 0.00 -0.50 0.00 0.00 59.36 58.97 1rt1 h GLU 298 Cb 0.83 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.51 1rt1 h GLU 298 CO -0.17 0.93 -0.39 0.00 -1.40 0.00 0.00 179.01 177.98 1rt1 h ALA 299 N 1.22 0.82 -0.07 3.43 0.00 -0.88 -2.70 119.26 121.08 1rt1 h ALA 299 Ca 0.29 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1rt1 h ALA 299 Cb 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1rt1 h ALA 299 CO -0.04 0.65 -0.47 0.93 0.00 0.00 0.00 179.25 180.32 1rt1 h GLU 300 N 0.51 0.16 -0.09 0.00 5.08 -0.20 -2.39 114.58 117.65 1rt1 h GLU 300 Ca 0.05 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1rt1 h GLU 300 Cb 0.90 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 1rt1 h GLU 300 CO 0.08 0.60 -0.12 1.25 -1.00 0.00 0.00 179.01 179.81 1rt1 h LEU 301 N 0.13 0.27 -0.65 1.33 5.85 -0.74 -2.36 115.31 119.14 1rt1 h LEU 301 Ca 0.01 -0.52 0.14 0.00 0.84 0.00 0.00 57.88 58.35 1rt1 h LEU 301 Cb 0.88 -0.08 -0.10 0.00 0.37 0.00 0.00 40.66 41.73 1rt1 h LEU 301 CO 0.07 0.73 0.09 -0.08 -0.34 0.00 0.00 178.44 178.92 1rt1 h GLU 302 N -0.18 0.20 -0.37 1.25 4.81 -1.38 0.37 114.58 119.28 1rt1 h GLU 302 Ca 0.01 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1rt1 h GLU 302 Cb 0.67 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1rt1 h GLU 302 CO 0.03 0.13 0.08 1.25 -0.73 0.00 0.00 179.01 179.78 1rt1 h LEU 303 N 0.20 0.56 -1.22 1.64 6.46 -1.45 -1.19 115.31 120.31 1rt1 h LEU 303 Ca 0.35 -0.24 -0.04 0.00 -0.12 0.00 0.00 57.88 57.84 1rt1 h LEU 303 Cb 0.57 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.33 1rt1 h LEU 303 CO -0.49 0.65 0.14 0.00 -0.62 0.00 0.00 178.44 178.12 1rt1 h ALA 304 N 0.93 1.38 0.00 1.25 0.00 -0.56 0.26 119.26 122.52 1rt1 h ALA 304 Ca 0.11 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1rt1 h ALA 304 Cb 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1rt1 h ALA 304 CO 0.00 0.45 -0.20 0.93 0.00 0.00 0.00 179.25 180.44 1rt1 h GLU 305 N 0.66 0.00 0.16 0.00 5.08 -0.09 -2.45 114.58 117.95 1rt1 h GLU 305 Ca 0.15 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.22 1rt1 h GLU 305 Cb 0.21 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.49 1rt1 h GLU 305 CO -0.01 0.20 -1.24 -0.91 -1.00 0.00 0.00 179.01 176.05 1rt1 h ASN 306 N 0.00 0.82 -1.00 1.42 2.35 0.24 -2.93 115.58 116.48 1rt1 h ASN 306 Ca -0.00 -0.86 0.01 0.00 -0.55 0.00 0.00 56.30 54.89 1rt1 h ASN 306 Cb 0.73 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.79 1rt1 h ASN 306 CO 0.03 1.61 0.66 0.03 -1.65 0.00 0.00 177.43 178.10 1rt1 h ARG 307 N 0.15 1.32 -0.50 0.81 3.08 -0.90 -0.65 114.38 117.70 1rt1 h ARG 307 Ca -0.20 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.75 1rt1 h ARG 307 Cb 1.94 -0.30 -0.02 0.00 0.08 0.00 0.00 29.97 31.67 1rt1 h ARG 307 CO 0.24 0.87 0.23 0.93 -1.07 0.00 0.00 179.97 181.17 1rt1 h GLU 308 N 1.35 0.72 -0.06 0.04 4.39 -1.52 -1.43 114.58 118.08 1rt1 h GLU 308 Ca 0.37 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.95 1rt1 h GLU 308 Cb -0.15 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.37 1rt1 h GLU 308 CO -0.08 0.61 0.04 0.82 -1.16 0.00 0.00 179.01 179.24 1rt1 h ILE 309 N 0.66 1.06 0.00 3.13 2.04 -1.13 -2.55 117.51 120.72 1rt1 h ILE 309 Ca 0.17 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1rt1 h ILE 309 Cb 0.14 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1rt1 h ILE 309 CO -0.02 0.05 0.00 0.18 0.00 0.00 0.00 178.15 178.36 1rt1 n LEU 310 N -5.01 0.00 0.06 1.44 4.77 -0.33 -3.26 117.00 114.67 1rt1 n LEU 310 Ca -0.06 0.31 0.07 0.00 -0.03 0.00 0.00 56.01 56.30 1rt1 n LEU 310 Cb 0.06 -0.31 0.32 0.00 -2.33 0.00 0.00 43.42 41.16 1rt1 n LEU 310 CO 0.33 -0.13 0.72 0.29 -1.33 0.00 0.00 177.39 177.27 1rt1 n LYS 311 N -1.31 0.07 -3.76 3.23 5.02 -0.55 -4.11 118.16 116.74 1rt1 n LYS 311 Ca 0.08 0.43 -0.11 0.00 -2.02 0.00 0.00 58.31 56.68 1rt1 n LYS 311 Cb 0.14 -1.67 -0.07 0.00 -0.02 0.00 0.00 35.03 33.41 1rt1 n LYS 311 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1rt1 s GLU 312 N -3.18 0.81 0.56 1.97 2.02 -1.20 -4.97 118.70 114.72 1rt1 s GLU 312 Ca 0.03 -0.55 -0.21 0.00 0.02 0.00 0.00 54.97 54.26 1rt1 s GLU 312 Cb 0.06 0.35 -0.04 0.00 0.10 0.00 0.00 34.13 34.60 1rt1 s GLU 312 CO 0.21 -0.26 1.34 -2.14 0.02 0.00 0.00 175.26 174.43 1rt1 s PRO 313 N -2.68 3.07 0.54 0.39 0.02 -1.26 -4.94 135.00 130.14 1rt1 s PRO 313 Ca -0.04 2.19 -0.22 0.00 0.02 0.00 0.00 61.00 62.95 1rt1 s PRO 313 Cb -0.00 -2.20 -0.05 0.00 0.02 0.00 0.00 34.50 32.27 1rt1 s PRO 313 CO -0.04 -1.23 1.34 1.55 -0.33 0.00 0.00 177.00 178.30 1rt1 n VAL 314 N -1.15 3.69 -1.34 3.83 3.14 -1.26 -4.96 118.33 120.28 1rt1 n VAL 314 Ca 0.11 -0.50 -0.31 0.00 -2.96 0.00 0.00 64.34 60.68 1rt1 n VAL 314 Cb 0.46 -1.65 0.09 0.00 -1.06 0.00 0.00 33.84 31.67 1rt1 n VAL 314 CO 0.00 0.00 0.00 -1.00 -6.46 0.00 0.00 176.83 169.37 1rt1 s HIS 315 N -1.28 2.66 -1.64 1.45 3.76 -1.26 -4.32 115.29 114.66 1rt1 s HIS 315 Ca 0.70 1.43 -0.01 0.00 -0.15 0.00 0.00 55.06 57.03 1rt1 s HIS 315 Cb -0.42 -3.04 0.00 0.00 1.11 0.00 0.00 32.58 30.23 1rt1 s HIS 315 CO 0.50 -1.79 0.16 0.41 -0.85 0.00 0.00 174.74 173.17 1rt1 n GLY 316 N -1.44 -0.51 3.52 -2.22 0.00 -1.26 -4.99 105.19 98.30 1rt1 n GLY 316 Ca 0.08 0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1rt1 n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rt1 s VAL 317 N -3.02 4.98 0.13 1.61 1.01 -1.26 -5.07 120.40 118.77 1rt1 s VAL 317 Ca 0.08 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.04 1rt1 s VAL 317 Cb -0.04 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1rt1 s VAL 317 CO 0.10 0.19 -0.13 -0.31 0.00 0.00 0.00 175.10 174.95 1rt1 s TYR 318 N 1.70 1.35 -0.13 5.22 2.02 -1.26 -5.03 117.35 121.21 1rt1 s TYR 318 Ca 0.06 -0.60 -0.25 0.00 -0.37 0.00 0.00 57.07 55.92 1rt1 s TYR 318 Cb -0.16 -0.70 -0.02 0.00 -0.40 0.00 0.00 41.96 40.67 1rt1 s TYR 318 CO 0.09 0.13 0.79 -0.47 -1.57 0.00 0.00 175.55 174.51 1rt1 s TYR 319 N -2.37 3.47 -0.47 2.71 5.04 -1.26 -5.02 117.35 119.45 1rt1 s TYR 319 Ca 0.10 1.26 -0.14 0.00 -2.44 0.00 0.00 57.07 55.85 1rt1 s TYR 319 Cb -0.03 -2.95 0.08 0.00 0.35 0.00 0.00 41.96 39.41 1rt1 s TYR 319 CO 0.02 -0.13 0.38 0.34 -1.34 0.00 0.00 175.55 174.82 1rt1 s ASP 320 N 1.05 6.02 0.57 4.32 -1.08 -1.26 -4.96 116.67 121.34 1rt1 s ASP 320 Ca 0.38 -1.46 0.32 0.00 -0.52 0.00 0.00 52.55 51.27 1rt1 s ASP 320 Cb -0.17 -2.14 1.44 0.00 -1.46 0.00 0.00 42.92 40.59 1rt1 s ASP 320 CO 0.15 -0.65 1.79 -0.65 0.52 0.00 0.00 175.17 176.33 1rt1 h PRO 321 N 8.68 0.00 -1.12 4.34 0.11 -2.00 -1.23 132.00 140.78 1rt1 h PRO 321 Ca -0.27 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.41 1rt1 h PRO 321 Cb 1.10 0.00 -0.22 0.00 0.11 0.00 0.00 31.00 31.99 1rt1 h PRO 321 CO 0.87 0.00 0.55 -1.13 -0.21 0.00 0.00 178.00 178.08 1rt1 n SER 322 N -3.89 5.11 -3.82 -2.05 3.41 -1.26 -4.89 113.62 106.23 1rt1 n SER 322 Ca 0.17 -3.27 -0.12 0.00 -0.26 0.00 0.00 58.87 55.39 1rt1 n SER 322 Cb 1.01 -0.87 -0.11 0.00 -0.26 0.00 0.00 64.21 63.98 1rt1 n SER 322 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1rt1 s LYS 323 N -2.55 0.40 0.37 4.33 2.20 -0.47 -5.13 119.74 118.90 1rt1 s LYS 323 Ca 0.44 -0.06 -0.27 0.00 -0.36 0.00 0.00 55.97 55.71 1rt1 s LYS 323 Cb 0.36 0.18 -0.10 0.00 -1.51 0.00 0.00 37.83 36.76 1rt1 s LYS 323 CO 0.04 -0.09 1.33 -0.51 -0.36 0.00 0.00 175.35 175.76 1rt1 s ASP 324 N -0.71 6.52 0.11 1.43 1.01 -1.26 -4.93 116.67 118.84 1rt1 s ASP 324 Ca -0.08 2.72 -0.13 0.00 0.71 0.00 0.00 52.55 55.77 1rt1 s ASP 324 Cb -0.05 -2.65 -0.06 0.00 1.01 0.00 0.00 42.92 41.17 1rt1 s ASP 324 CO 0.01 -0.71 0.48 -0.22 0.21 0.00 0.00 175.17 174.95 1rt1 s LEU 325 N -2.10 4.36 0.04 1.23 2.96 -1.26 -4.58 118.68 119.32 1rt1 s LEU 325 Ca 0.53 0.97 0.04 0.00 -0.22 0.00 0.00 54.13 55.45 1rt1 s LEU 325 Cb -0.40 -3.08 -0.02 0.00 0.50 0.00 0.00 46.19 43.19 1rt1 s LEU 325 CO 0.52 0.16 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.95 1rt1 s ILE 326 N -1.39 0.98 -0.11 6.68 1.01 0.83 -1.94 121.20 127.26 1rt1 s ILE 326 Ca 0.34 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 1rt1 s ILE 326 Cb -0.15 -0.90 0.03 0.00 0.01 0.00 0.00 42.46 41.45 1rt1 s ILE 326 CO 0.18 -0.03 -0.02 0.00 0.00 0.00 0.00 174.94 175.08 1rt1 s ALA 327 N -0.85 0.97 0.05 9.38 0.00 -0.10 -1.32 121.76 129.89 1rt1 s ALA 327 Ca 0.00 -0.39 0.04 0.00 0.00 0.00 0.00 51.96 51.61 1rt1 s ALA 327 Cb -0.08 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.11 1rt1 s ALA 327 CO 0.01 -0.61 -0.02 -2.00 0.00 0.00 0.00 175.76 173.14 1rt1 s GLU 328 N 1.86 2.59 0.04 0.00 2.12 -1.02 -0.61 118.70 123.68 1rt1 s GLU 328 Ca 0.04 -0.76 0.03 0.00 0.36 0.00 0.00 54.97 54.63 1rt1 s GLU 328 Cb -0.13 -2.56 -0.02 0.00 0.26 0.00 0.00 34.13 31.68 1rt1 s GLU 328 CO -0.07 0.57 -0.09 0.42 -0.54 0.00 0.00 175.26 175.56 1rt1 s ILE 329 N -1.18 0.66 -0.03 -3.70 1.01 -1.09 -2.06 121.20 114.81 1rt1 s ILE 329 Ca 0.22 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 59.94 1rt1 s ILE 329 Cb -0.11 -0.67 0.01 0.00 0.01 0.00 0.00 42.46 41.69 1rt1 s ILE 329 CO 0.14 -0.23 -0.08 -1.10 0.00 0.00 0.00 174.94 173.67 1rt1 s GLN 330 N -1.29 0.91 -0.36 2.79 1.11 0.24 -4.28 119.66 118.78 1rt1 s GLN 330 Ca -0.05 -0.25 -0.27 0.00 0.01 0.00 0.00 55.36 54.80 1rt1 s GLN 330 Cb -0.08 -0.86 0.02 0.00 -1.01 0.00 0.00 33.01 31.08 1rt1 s GLN 330 CO 0.01 0.06 0.97 0.21 0.01 0.00 0.00 175.29 176.55 1rt1 s LYS 331 N 0.35 3.89 0.04 2.91 2.20 -1.26 -1.46 119.74 126.40 1rt1 s LYS 331 Ca -0.05 0.68 0.25 0.00 -0.36 0.00 0.00 55.97 56.49 1rt1 s LYS 331 Cb -0.10 -3.79 0.58 0.00 -1.51 0.00 0.00 37.83 33.01 1rt1 s LYS 331 CO 0.01 -0.96 1.47 1.04 -0.36 0.00 0.00 175.35 176.55 1rt1 n GLN 332 N 6.84 0.09 0.00 4.03 1.13 0.21 -4.98 117.38 124.70 1rt1 n GLN 332 Ca 0.08 0.03 0.00 0.00 -1.94 0.00 0.00 57.00 55.17 1rt1 n GLN 332 Cb 0.48 -1.56 0.00 0.00 0.11 0.00 0.00 30.24 29.27 1rt1 n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rt1 n GLY 333 N 1.45 0.54 3.66 1.08 0.00 -1.07 -4.84 105.19 106.02 1rt1 n GLY 333 Ca 0.05 -1.76 -0.28 0.00 0.00 0.00 0.00 46.02 44.04 1rt1 n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rt1 n GLN 334 N 0.61 -4.65 -0.99 1.61 1.13 -1.26 -0.96 117.38 112.88 1rt1 n GLN 334 Ca 0.00 0.58 0.00 0.00 -1.94 0.00 0.00 57.00 55.64 1rt1 n GLN 334 Cb 0.00 -5.41 0.00 0.00 0.11 0.00 0.00 30.24 24.94 1rt1 n GLN 334 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rt1 n GLY 335 N -1.49 0.93 3.90 1.08 0.00 -1.26 -4.91 105.19 103.43 1rt1 n GLY 335 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1rt1 n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rt1 s GLN 336 N -0.03 3.51 0.01 1.61 1.11 -0.13 -0.79 119.66 124.96 1rt1 s GLN 336 Ca 0.00 -0.20 -0.01 0.00 0.01 0.00 0.00 55.36 55.16 1rt1 s GLN 336 Cb 0.00 -3.07 -0.01 0.00 -1.01 0.00 0.00 33.01 28.92 1rt1 s GLN 336 CO 0.00 0.65 0.00 -1.58 0.01 0.00 0.00 175.29 174.37 1rt1 s TRP 337 N -1.34 0.17 0.11 0.91 0.52 0.78 -0.62 118.94 119.48 1rt1 s TRP 337 Ca 0.28 -0.35 0.07 0.00 0.02 0.00 0.00 56.10 56.13 1rt1 s TRP 337 Cb -0.13 -0.13 -0.04 0.00 -1.15 0.00 0.00 33.47 32.03 1rt1 s TRP 337 CO 0.18 -0.16 -0.18 0.95 0.02 0.00 0.00 176.95 177.76 1rt1 s THR 338 N -1.12 1.55 0.15 2.01 -4.23 -0.54 -0.28 115.64 113.18 1rt1 s THR 338 Ca -0.12 -1.58 -0.09 0.00 -1.18 0.00 0.00 61.69 58.72 1rt1 s THR 338 Cb -0.08 -1.50 -0.01 0.00 1.34 0.00 0.00 72.50 72.26 1rt1 s THR 338 CO -0.00 -0.19 0.26 -0.72 -0.54 0.00 0.00 174.62 173.43 1rt1 s TYR 339 N -1.48 0.36 -0.14 3.99 1.13 -0.82 -0.59 117.35 119.81 1rt1 s TYR 339 Ca 0.07 -0.74 -0.06 0.00 -1.41 0.00 0.00 57.07 54.92 1rt1 s TYR 339 Cb -0.09 -0.07 0.06 0.00 -1.10 0.00 0.00 41.96 40.77 1rt1 s TYR 339 CO 0.04 -0.68 0.32 -0.65 -2.51 0.00 0.00 175.55 172.07 1rt1 s GLN 340 N -3.95 0.26 -0.20 -3.49 1.11 -0.88 -1.70 119.66 110.82 1rt1 s GLN 340 Ca 0.15 0.71 -0.10 0.00 0.01 0.00 0.00 55.36 56.13 1rt1 s GLN 340 Cb 0.04 -0.02 -0.05 0.00 -1.01 0.00 0.00 33.01 31.97 1rt1 s GLN 340 CO -0.02 -0.20 0.13 0.42 0.01 0.00 0.00 175.29 175.63 1rt1 s ILE 341 N 1.71 5.41 0.38 1.08 1.01 0.39 -2.43 121.20 128.75 1rt1 s ILE 341 Ca -0.06 0.19 -0.08 0.00 0.00 0.00 0.00 60.65 60.69 1rt1 s ILE 341 Cb -0.10 -3.47 0.03 0.00 0.01 0.00 0.00 42.46 38.93 1rt1 s ILE 341 CO -0.10 0.44 0.64 -0.72 0.00 0.00 0.00 174.94 175.20 1rt1 s TYR 342 N 0.34 0.64 0.00 3.97 -0.85 -0.44 -0.85 117.35 120.16 1rt1 s TYR 342 Ca 0.08 -1.10 0.00 0.00 -0.52 0.00 0.00 57.07 55.53 1rt1 s TYR 342 Cb -0.11 0.39 0.00 0.00 0.38 0.00 0.00 41.96 42.61 1rt1 s TYR 342 CO -0.02 -1.39 0.00 1.04 -1.52 0.00 0.00 175.55 173.66 1rt1 n GLN 343 N -0.57 2.05 -5.15 -3.49 6.02 -1.26 -0.12 117.38 114.86 1rt1 n GLN 343 Ca -0.04 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.65 1rt1 n GLN 343 Cb 0.61 -0.76 -0.16 0.00 1.02 0.00 0.00 30.24 30.95 1rt1 n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1rt1 s GLU 344 N -1.52 1.94 0.26 -1.09 0.41 -1.26 -4.94 118.70 112.50 1rt1 s GLU 344 Ca 0.00 -0.93 -0.31 0.00 -0.41 0.00 0.00 54.97 53.33 1rt1 s GLU 344 Cb 0.00 -1.92 -0.13 0.00 -1.78 0.00 0.00 34.13 30.30 1rt1 s GLU 344 CO 0.00 0.52 1.50 -2.30 -0.49 0.00 0.00 175.26 174.49 1rt1 n PRO 345 N 2.32 2.35 -0.84 0.39 -0.02 -1.26 -2.32 135.00 135.62 1rt1 n PRO 345 Ca -0.16 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1rt1 n PRO 345 Cb 0.52 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 1rt1 n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1rt1 n PHE 346 N 2.09 0.00 -3.85 6.00 3.72 -1.26 -4.93 117.46 119.22 1rt1 n PHE 346 Ca 0.10 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.19 1rt1 n PHE 346 Cb 0.34 -0.67 -0.12 0.00 -0.94 0.00 0.00 39.48 38.09 1rt1 n PHE 346 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1rt1 s LYS 347 N -0.51 2.44 0.19 -1.08 1.02 -0.98 -4.85 119.74 115.97 1rt1 s LYS 347 Ca 0.00 -2.99 -0.30 0.00 0.02 0.00 0.00 55.97 52.70 1rt1 s LYS 347 Cb 0.00 -3.51 -0.08 0.00 -0.52 0.00 0.00 37.83 33.72 1rt1 s LYS 347 CO 0.00 -1.21 0.94 -0.80 -0.92 0.00 0.00 175.35 173.36 1rt1 s ASN 348 N -0.59 7.58 -0.04 2.83 0.01 -1.26 -4.16 114.94 119.32 1rt1 s ASN 348 Ca 0.21 1.88 0.13 0.00 -0.71 0.00 0.00 52.86 54.37 1rt1 s ASN 348 Cb -0.14 -2.60 -0.22 0.00 0.41 0.00 0.00 41.25 38.70 1rt1 s ASN 348 CO -0.09 0.09 0.67 0.18 -1.51 0.00 0.00 177.10 176.45 1rt1 n LEU 349 N 1.92 0.87 -3.60 0.60 4.77 -0.03 -4.96 117.00 116.56 1rt1 n LEU 349 Ca -0.01 0.41 -0.10 0.00 -0.03 0.00 0.00 56.01 56.28 1rt1 n LEU 349 Cb 0.48 0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.67 1rt1 n LEU 349 CO 0.50 0.37 0.75 -0.75 -1.33 0.00 0.00 177.39 176.93 1rt1 s LYS 350 N -2.62 0.56 0.15 3.23 2.20 -1.14 -5.01 119.74 117.12 1rt1 s LYS 350 Ca -0.05 0.36 0.05 0.00 -0.36 0.00 0.00 55.97 55.97 1rt1 s LYS 350 Cb 0.08 0.27 -0.04 0.00 -1.51 0.00 0.00 37.83 36.63 1rt1 s LYS 350 CO 0.82 -0.13 -0.11 0.95 -0.36 0.00 0.00 175.35 176.52 1rt1 s THR 351 N -0.49 1.27 0.05 3.43 -4.23 -1.26 -0.46 115.64 113.95 1rt1 s THR 351 Ca 0.00 -2.06 -0.18 0.00 -1.18 0.00 0.00 61.69 58.27 1rt1 s THR 351 Cb -0.03 -1.86 0.06 0.00 1.34 0.00 0.00 72.50 72.02 1rt1 s THR 351 CO -0.02 -0.70 0.83 0.61 -0.54 0.00 0.00 174.62 174.80 1rt1 n GLY 352 N -0.18 0.54 3.16 3.99 0.00 -0.69 -4.70 105.19 107.32 1rt1 n GLY 352 Ca -0.10 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 44.74 1rt1 n GLY 352 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rt1 s LYS 353 N -2.02 0.81 -0.04 1.61 2.20 -1.26 -1.94 119.74 119.10 1rt1 s LYS 353 Ca 0.19 -1.10 0.00 0.00 -0.36 0.00 0.00 55.97 54.70 1rt1 s LYS 353 Cb -0.01 -0.54 0.03 0.00 -1.51 0.00 0.00 37.83 35.79 1rt1 s LYS 353 CO 0.01 0.09 -0.01 -0.47 -0.36 0.00 0.00 175.35 174.62 1rt1 s TYR 354 N -2.21 0.47 -0.11 4.03 5.04 0.61 -4.97 117.35 120.21 1rt1 s TYR 354 Ca 0.03 -0.06 -0.02 0.00 -2.44 0.00 0.00 57.07 54.57 1rt1 s TYR 354 Cb -0.04 -0.55 -0.03 0.00 0.35 0.00 0.00 41.96 41.68 1rt1 s TYR 354 CO 0.00 -0.19 -0.01 0.00 -1.34 0.00 0.00 175.55 174.02 1rt1 s ALA 355 N 1.26 3.20 0.68 3.97 0.00 -1.26 -0.15 121.76 129.45 1rt1 s ALA 355 Ca -0.06 -0.81 -0.17 0.00 0.00 0.00 0.00 51.96 50.92 1rt1 s ALA 355 Cb -0.13 -1.50 -0.05 0.00 0.00 0.00 0.00 23.12 21.44 1rt1 s ALA 355 CO -0.02 0.47 0.60 2.89 0.00 0.00 0.00 175.76 179.70 1rt1 n ARG 356 N 2.57 0.42 -3.34 0.00 1.85 0.03 -4.98 116.66 113.21 1rt1 n ARG 356 Ca -0.18 0.18 -0.34 0.00 -1.00 0.00 0.00 57.85 56.51 1rt1 n ARG 356 Cb 0.53 -1.86 -0.06 0.00 -1.05 0.00 0.00 32.46 30.02 1rt1 n ARG 356 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 1rt1 s MET 357 N -2.65 3.94 0.07 2.89 -1.94 -1.26 -4.98 119.30 115.37 1rt1 s MET 357 Ca 0.68 0.46 -0.37 0.00 -1.71 0.00 0.00 55.69 54.75 1rt1 s MET 357 Cb -0.38 -2.78 -0.18 0.00 2.01 0.00 0.00 34.83 33.50 1rt1 s MET 357 CO 0.55 0.39 1.15 -2.13 -0.01 0.00 0.00 175.02 174.97 1rt1 n ARG 358 N 0.37 0.59 0.00 2.03 0.63 -1.26 -1.24 116.66 117.78 1rt1 n ARG 358 Ca -0.02 0.21 0.00 0.00 -0.92 0.00 0.00 57.85 57.12 1rt1 n ARG 358 Cb 0.52 -1.73 0.00 0.00 0.45 0.00 0.00 32.46 31.70 1rt1 n ARG 358 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1rt1 n GLY 359 N 1.98 2.83 0.00 5.14 0.00 -1.26 -4.89 105.19 108.99 1rt1 n GLY 359 Ca 0.19 -0.35 0.06 0.00 0.00 0.00 0.00 46.02 45.92 1rt1 n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rt1 n ALA 360 N 0.00 2.36 -0.24 4.61 0.00 -0.37 -4.56 120.51 122.30 1rt1 n ALA 360 Ca 0.00 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.48 1rt1 n ALA 360 Cb 0.00 -1.21 0.24 0.00 0.00 0.00 0.00 19.45 18.48 1rt1 n ALA 360 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1rt1 n HIS 361 N -0.75 0.51 0.03 0.00 1.44 -1.26 -1.56 115.22 113.61 1rt1 n HIS 361 Ca 0.09 0.85 0.07 0.00 -2.01 0.00 0.00 57.72 56.73 1rt1 n HIS 361 Cb 0.04 -1.07 0.16 0.00 0.12 0.00 0.00 29.99 29.25 1rt1 n HIS 361 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1rt1 n THR 362 N -4.91 0.69 -3.91 0.61 -2.24 -1.26 -4.94 114.28 98.32 1rt1 n THR 362 Ca 0.18 -0.85 -0.30 0.00 -2.27 0.00 0.00 64.05 60.81 1rt1 n THR 362 Cb 0.60 0.75 -0.16 0.00 -2.10 0.00 0.00 70.33 69.42 1rt1 n THR 362 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1rt1 s ASN 363 N -1.07 3.90 0.17 3.42 3.84 -0.60 -5.00 114.94 119.59 1rt1 s ASN 363 Ca 0.27 -1.30 -0.09 0.00 0.21 0.00 0.00 52.86 51.94 1rt1 s ASN 363 Cb 0.15 -1.15 0.03 0.00 -0.55 0.00 0.00 41.25 39.73 1rt1 s ASN 363 CO 0.20 -0.27 1.55 0.44 -2.79 0.00 0.00 177.10 176.22 1rt1 h ASP 364 N 7.96 0.98 0.00 -4.21 3.32 -1.92 -2.66 116.42 119.88 1rt1 h ASP 364 Ca -0.16 -0.39 -0.05 0.00 0.02 0.00 0.00 57.03 56.45 1rt1 h ASP 364 Cb 1.06 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 1rt1 h ASP 364 CO 0.42 1.17 -0.13 0.58 -1.72 0.00 0.00 179.24 179.57 1rt1 h VAL 365 N 0.81 1.18 -0.03 -1.35 2.07 -1.96 0.16 116.25 117.13 1rt1 h VAL 365 Ca 0.10 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 1rt1 h VAL 365 Cb 0.83 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1rt1 h VAL 365 CO 0.07 0.25 -0.03 0.50 0.02 0.00 0.00 177.57 178.38 1rt1 h LYS 366 N 0.25 0.07 -1.01 1.57 3.64 -1.91 0.83 116.57 120.02 1rt1 h LYS 366 Ca 0.05 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 1rt1 h LYS 366 Cb 0.38 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.15 1rt1 h LYS 366 CO 0.02 0.57 0.66 1.96 -2.27 0.00 0.00 179.45 180.39 1rt1 h GLN 367 N -0.42 1.21 0.20 1.90 4.20 -1.16 0.18 115.11 121.22 1rt1 h GLN 367 Ca 0.00 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 1rt1 h GLN 367 Cb 0.56 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1rt1 h GLN 367 CO 0.01 0.80 -0.10 1.25 -0.67 0.00 0.00 178.83 180.12 1rt1 h LEU 368 N 1.25 -0.23 -0.96 1.46 6.46 -0.55 0.13 115.31 122.86 1rt1 h LEU 368 Ca 0.41 -0.22 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 1rt1 h LEU 368 Cb 0.05 0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 39.99 1rt1 h LEU 368 CO -0.14 0.11 0.61 0.71 -0.62 0.00 0.00 178.44 179.11 1rt1 h THR 369 N -0.59 1.26 -0.59 1.05 1.35 -0.49 0.65 112.91 115.55 1rt1 h THR 369 Ca -0.03 -0.52 -0.02 0.00 -0.55 0.00 0.00 66.41 65.29 1rt1 h THR 369 Cb 0.43 -0.13 -0.03 0.00 -1.73 0.00 0.00 68.15 66.69 1rt1 h THR 369 CO 0.05 0.26 0.27 -0.33 -0.25 0.00 0.00 175.52 175.52 1rt1 h GLU 370 N 1.32 0.86 -0.27 4.72 5.08 -0.56 -0.28 114.58 125.45 1rt1 h GLU 370 Ca 0.35 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1rt1 h GLU 370 Cb -0.10 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 28.98 1rt1 h GLU 370 CO -0.07 0.71 0.16 0.00 -1.00 0.00 0.00 179.01 178.81 1rt1 h ALA 371 N 1.11 0.34 -0.81 3.43 0.00 -0.00 -0.43 119.26 122.89 1rt1 h ALA 371 Ca 0.20 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.12 1rt1 h ALA 371 Cb 0.14 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1rt1 h ALA 371 CO -0.02 -0.16 0.53 0.28 0.00 0.00 0.00 179.25 179.87 1rt1 h VAL 372 N 0.34 1.09 -0.15 0.00 2.07 -0.56 -0.30 116.25 118.74 1rt1 h VAL 372 Ca 0.10 -0.33 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 1rt1 h VAL 372 Cb 0.01 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 29.84 1rt1 h VAL 372 CO -0.02 0.17 -0.19 1.56 0.02 0.00 0.00 177.57 179.11 1rt1 h GLN 373 N 0.95 0.39 0.58 1.57 4.20 -0.25 -0.50 115.11 122.06 1rt1 h GLN 373 Ca 0.33 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 1rt1 h GLN 373 Cb 0.12 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1rt1 h GLN 373 CO -0.11 0.80 -0.40 -0.22 -0.67 0.00 0.00 178.83 178.23 1rt1 h LYS 374 N 0.02 -0.92 -0.76 1.46 3.64 -0.56 -0.41 116.57 119.03 1rt1 h LYS 374 Ca 0.02 0.06 0.10 0.00 -1.27 0.00 0.00 60.65 59.56 1rt1 h LYS 374 Cb 0.75 0.21 -0.08 0.00 -0.41 0.00 0.00 32.23 32.70 1rt1 h LYS 374 CO 0.05 -0.61 0.39 0.82 -2.27 0.00 0.00 179.45 177.83 1rt1 h ILE 375 N -0.95 0.84 -0.33 2.00 2.04 -1.14 -0.64 117.51 119.32 1rt1 h ILE 375 Ca -0.07 -0.22 -0.07 0.00 1.00 0.00 0.00 64.86 65.50 1rt1 h ILE 375 Cb 0.79 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1rt1 h ILE 375 CO 0.04 0.12 -0.11 0.74 0.00 0.00 0.00 178.15 178.94 1rt1 h THR 376 N 0.65 1.24 -0.04 -0.27 2.02 -0.73 -1.99 112.91 113.78 1rt1 h THR 376 Ca 0.38 -1.04 -0.14 0.00 0.77 0.00 0.00 66.41 66.38 1rt1 h THR 376 Cb 0.42 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 1rt1 h THR 376 CO -0.28 0.34 -0.61 0.71 0.37 0.00 0.00 175.52 176.05 1rt1 h THR 377 N 0.53 1.41 -0.09 3.16 1.35 0.42 -1.76 112.91 117.93 1rt1 h THR 377 Ca 0.10 -2.04 -0.01 0.00 -0.55 0.00 0.00 66.41 63.91 1rt1 h THR 377 Cb 0.50 2.06 -0.00 0.00 -1.73 0.00 0.00 68.15 68.97 1rt1 h THR 377 CO 0.03 0.59 0.03 -0.33 -0.25 0.00 0.00 175.52 175.59 1rt1 h GLU 378 N 0.12 0.14 -0.33 4.72 5.08 -1.10 0.92 114.58 124.12 1rt1 h GLU 378 Ca -0.01 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.39 1rt1 h GLU 378 Cb 1.11 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 30.28 1rt1 h GLU 378 CO 0.09 0.28 -0.09 1.03 -1.00 0.00 0.00 179.01 179.32 1rt1 h SER 379 N -0.04 -0.33 0.41 1.42 0.87 -1.19 0.39 113.55 115.07 1rt1 h SER 379 Ca 0.03 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1rt1 h SER 379 Cb 0.20 0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 1rt1 h SER 379 CO -0.00 -0.12 -0.41 0.40 -0.53 0.00 0.00 176.83 176.17 1rt1 h ILE 380 N -0.01 0.17 -0.98 2.23 2.04 -1.14 0.20 117.51 120.02 1rt1 h ILE 380 Ca 0.16 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.25 1rt1 h ILE 380 Cb 0.26 0.17 -0.12 0.00 -0.74 0.00 0.00 36.82 36.39 1rt1 h ILE 380 CO -0.35 0.00 0.56 0.58 0.00 0.00 0.00 178.15 178.95 1rt1 h VAL 381 N -0.84 0.57 0.00 1.67 2.07 0.10 0.92 116.25 120.74 1rt1 h VAL 381 Ca -0.04 -0.20 -0.14 0.00 0.82 0.00 0.00 66.70 67.15 1rt1 h VAL 381 Cb 0.75 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1rt1 h VAL 381 CO -0.07 0.11 -0.75 0.40 0.02 0.00 0.00 177.57 177.28 1rt1 h ILE 382 N 0.59 1.18 -0.00 4.57 2.04 0.11 -3.39 117.51 122.60 1rt1 h ILE 382 Ca 0.61 -2.17 0.00 0.00 1.00 0.00 0.00 64.86 64.30 1rt1 h ILE 382 Cb 1.12 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 39.71 1rt1 h ILE 382 CO -0.46 0.40 -0.12 0.79 0.00 0.00 0.00 178.15 178.76 1rt1 n TRP 383 N -4.51 0.00 -3.16 1.37 8.01 0.67 -4.94 117.44 114.88 1rt1 n TRP 383 Ca -0.23 0.00 -0.15 0.00 -1.31 0.00 0.00 57.50 55.82 1rt1 n TRP 383 Cb 0.58 0.00 0.06 0.00 -2.01 0.00 0.00 31.31 29.94 1rt1 n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1rt1 n GLY 384 N 0.70 -0.11 3.57 6.99 0.00 0.32 -4.92 105.19 111.74 1rt1 n GLY 384 Ca 0.02 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1rt1 n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rt1 s LYS 385 N -5.49 0.61 0.26 1.61 -2.85 -1.25 -4.96 119.74 107.67 1rt1 s LYS 385 Ca 0.23 0.06 -0.11 0.00 -1.00 0.00 0.00 55.97 55.14 1rt1 s LYS 385 Cb -0.10 0.29 -0.08 0.00 -2.06 0.00 0.00 37.83 35.88 1rt1 s LYS 385 CO 0.52 -0.21 0.61 0.95 0.10 0.00 0.00 175.35 177.31 1rt1 s THR 386 N -1.50 4.85 0.88 3.79 -4.23 -1.26 -3.14 115.64 115.03 1rt1 s THR 386 Ca -0.00 0.63 -0.09 0.00 -1.18 0.00 0.00 61.69 61.05 1rt1 s THR 386 Cb -0.01 -3.62 0.19 0.00 1.34 0.00 0.00 72.50 70.41 1rt1 s THR 386 CO -0.01 -0.10 1.21 -2.16 -0.54 0.00 0.00 174.62 173.02 1rt1 s PRO 387 N -2.85 0.87 -0.24 3.99 0.04 -1.26 -4.79 135.00 130.76 1rt1 s PRO 387 Ca 0.49 -0.87 -0.07 0.00 0.04 0.00 0.00 61.00 60.59 1rt1 s PRO 387 Cb -0.11 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 1rt1 s PRO 387 CO 0.20 -2.13 0.07 0.21 0.04 0.00 0.00 177.00 175.38 1rt1 s LYS 388 N -5.61 3.68 0.33 4.56 2.36 -0.82 -3.89 119.74 120.35 1rt1 s LYS 388 Ca 0.73 -0.47 -0.07 0.00 -2.55 0.00 0.00 55.97 53.61 1rt1 s LYS 388 Cb -0.03 -3.30 -0.06 0.00 -1.05 0.00 0.00 37.83 33.40 1rt1 s LYS 388 CO 0.50 -0.14 0.63 -0.06 1.55 0.00 0.00 175.35 177.83 1rt1 s PHE 389 N 1.47 3.48 -0.31 4.03 0.40 -0.74 -0.93 117.98 125.38 1rt1 s PHE 389 Ca 0.06 0.78 0.02 0.00 -0.60 0.00 0.00 56.93 57.18 1rt1 s PHE 389 Cb -0.15 -2.22 0.09 0.00 0.51 0.00 0.00 43.02 41.25 1rt1 s PHE 389 CO 0.03 0.07 0.04 0.15 0.70 0.00 0.00 175.22 176.22 1rt1 s LYS 390 N -3.69 1.29 -0.17 0.44 1.02 0.22 -0.49 119.74 118.35 1rt1 s LYS 390 Ca 0.46 -1.48 -0.12 0.00 0.02 0.00 0.00 55.97 54.85 1rt1 s LYS 390 Cb -0.11 -2.73 -0.05 0.00 -0.52 0.00 0.00 37.83 34.43 1rt1 s LYS 390 CO 0.31 -0.89 0.22 -0.51 -0.92 0.00 0.00 175.35 173.55 1rt1 s LEU 391 N 1.20 4.24 -1.44 3.17 1.43 0.04 -2.66 118.68 124.67 1rt1 s LEU 391 Ca 0.08 0.40 -0.09 0.00 -1.03 0.00 0.00 54.13 53.49 1rt1 s LEU 391 Cb -0.18 -2.24 -0.05 0.00 0.03 0.00 0.00 46.19 43.74 1rt1 s LEU 391 CO -0.13 0.16 2.88 -0.81 0.23 0.00 0.00 176.35 178.68 1rt1 n PRO 392 N 3.40 3.77 -3.84 1.29 -0.04 -1.26 -0.72 135.00 137.60 1rt1 n PRO 392 Ca -0.14 -2.41 -0.11 0.00 -0.04 0.00 0.00 63.50 60.81 1rt1 n PRO 392 Cb 0.52 -2.70 -0.09 0.00 -0.04 0.00 0.00 33.50 31.20 1rt1 n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rt1 s ILE 393 N 1.28 0.10 0.32 0.52 2.07 -1.26 -4.93 121.20 119.30 1rt1 s ILE 393 Ca 0.66 -0.83 -0.26 0.00 -1.41 0.00 0.00 60.65 58.81 1rt1 s ILE 393 Cb 0.19 -0.82 -0.10 0.00 0.13 0.00 0.00 42.46 41.87 1rt1 s ILE 393 CO -0.07 -0.46 0.95 -1.58 -1.91 0.00 0.00 174.94 171.88 1rt1 s GLN 394 N -2.30 4.57 0.20 3.50 0.74 -1.26 -4.31 119.66 120.80 1rt1 s GLN 394 Ca -0.07 1.36 -0.21 0.00 0.05 0.00 0.00 55.36 56.49 1rt1 s GLN 394 Cb -0.02 -2.81 0.14 0.00 1.10 0.00 0.00 33.01 31.41 1rt1 s GLN 394 CO -0.02 0.26 1.57 -0.22 -0.55 0.00 0.00 175.29 176.33 1rt1 h LYS 395 N 3.19 -0.12 -0.32 1.67 3.64 -1.96 -2.14 116.57 120.53 1rt1 h LYS 395 Ca -0.47 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 58.88 1rt1 h LYS 395 Cb 1.19 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.02 1rt1 h LYS 395 CO 0.65 -0.08 0.03 0.93 -2.27 0.00 0.00 179.45 178.71 1rt1 h GLU 396 N -0.12 0.48 -0.36 1.90 3.07 -1.98 0.18 114.58 117.75 1rt1 h GLU 396 Ca 0.26 -0.09 -0.05 0.00 -0.50 0.00 0.00 59.36 58.97 1rt1 h GLU 396 Cb 0.56 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 1rt1 h GLU 396 CO -0.78 0.49 0.01 1.15 -1.40 0.00 0.00 179.01 178.48 1rt1 h THR 397 N 0.47 1.26 0.60 1.13 2.02 -1.79 -2.54 112.91 114.06 1rt1 h THR 397 Ca 0.10 -0.96 -0.03 0.00 0.77 0.00 0.00 66.41 66.30 1rt1 h THR 397 Cb 0.27 1.17 0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1rt1 h THR 397 CO 0.00 0.32 -0.29 -0.25 0.37 0.00 0.00 175.52 175.67 1rt1 h TRP 398 N 0.45 -0.75 -0.87 3.16 2.91 -1.05 -3.06 115.95 116.75 1rt1 h TRP 398 Ca 0.10 -0.02 0.19 0.00 1.13 0.00 0.00 58.89 60.30 1rt1 h TRP 398 Cb 0.44 0.25 -0.06 0.00 -0.51 0.00 0.00 29.16 29.28 1rt1 h TRP 398 CO 0.03 -0.42 0.58 0.93 -1.03 0.00 0.00 178.44 178.54 1rt1 h GLU 399 N -1.09 0.37 -0.00 2.65 5.08 -1.06 -0.46 114.58 120.06 1rt1 h GLU 399 Ca -0.08 -0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 58.10 1rt1 h GLU 399 Cb 0.67 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 1rt1 h GLU 399 CO 0.14 0.24 -0.75 1.15 -1.00 0.00 0.00 179.01 178.78 1rt1 h THR 400 N 0.38 1.53 0.00 1.13 2.02 -1.48 -3.42 112.91 113.08 1rt1 h THR 400 Ca 0.44 -2.56 0.00 0.00 0.77 0.00 0.00 66.41 65.06 1rt1 h THR 400 Cb 1.13 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.93 1rt1 h THR 400 CO -0.15 0.73 0.00 0.79 0.37 0.00 0.00 175.52 177.26 1rt1 n TRP 401 N -3.65 0.00 -0.35 3.16 8.01 -0.83 -4.86 117.44 118.92 1rt1 n TRP 401 Ca -0.01 0.00 0.08 0.00 -1.31 0.00 0.00 57.50 56.26 1rt1 n TRP 401 Cb 0.73 0.00 0.25 0.00 -2.01 0.00 0.00 31.31 30.28 1rt1 n TRP 401 CO 0.00 0.00 0.00 0.11 -1.01 0.00 0.00 177.69 176.79 1rt1 h TRP 402 N 0.00 1.10 -0.70 -5.99 5.08 -1.34 -2.12 115.95 111.98 1rt1 h TRP 402 Ca 0.00 0.03 0.05 0.00 1.08 0.00 0.00 58.89 60.06 1rt1 h TRP 402 Cb 0.04 -0.34 -0.04 0.00 -3.00 0.00 0.00 29.16 25.82 1rt1 h TRP 402 CO 0.00 0.38 0.46 1.79 -1.28 0.00 0.00 178.44 179.79 1rt1 h THR 403 N 0.91 1.05 -0.97 0.12 1.35 -1.89 -1.24 112.91 112.25 1rt1 h THR 403 Ca 0.51 -0.26 0.27 0.00 -0.55 0.00 0.00 66.41 66.38 1rt1 h THR 403 Cb 0.59 0.21 -0.05 0.00 -1.73 0.00 0.00 68.15 67.18 1rt1 h THR 403 CO -0.30 0.14 0.68 -0.33 -0.25 0.00 0.00 175.52 175.46 1rt1 h GLU 404 N 0.77 0.07 0.00 4.72 4.39 -1.73 -1.05 114.58 121.75 1rt1 h GLU 404 Ca 0.29 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1rt1 h GLU 404 Cb 0.19 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1rt1 h GLU 404 CO -0.09 0.05 -0.00 0.66 -1.16 0.00 0.00 179.01 178.46 1rt1 n TYR 405 N -4.31 0.00 -2.74 4.33 4.01 -0.51 -4.97 117.16 112.97 1rt1 n TYR 405 Ca 0.21 -0.60 -0.39 0.00 -0.16 0.00 0.00 57.90 56.95 1rt1 n TYR 405 Cb 0.98 -0.07 -0.06 0.00 -0.31 0.00 0.00 39.34 39.88 1rt1 n TYR 405 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 1rt1 s TRP 406 N -1.41 3.87 0.00 -0.72 -0.11 -0.40 -4.73 118.94 115.44 1rt1 s TRP 406 Ca 0.08 1.87 0.00 0.00 1.22 0.00 0.00 56.10 59.26 1rt1 s TRP 406 Cb 0.07 -2.98 0.00 0.00 -1.50 0.00 0.00 33.47 29.06 1rt1 s TRP 406 CO 0.01 0.33 0.06 1.04 -4.62 0.00 0.00 176.95 173.76 1rt1 n GLN 407 N 1.18 0.06 -3.79 5.86 6.02 -1.26 -4.59 117.38 120.87 1rt1 n GLN 407 Ca -0.01 -0.06 -0.25 0.00 -0.01 0.00 0.00 57.00 56.67 1rt1 n GLN 407 Cb 0.48 -0.48 -0.03 0.00 1.02 0.00 0.00 30.24 31.23 1rt1 n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1rt1 s ALA 408 N -0.03 3.88 0.22 -1.58 0.00 -1.26 -5.02 121.76 117.97 1rt1 s ALA 408 Ca 0.00 -0.98 0.10 0.00 0.00 0.00 0.00 51.96 51.07 1rt1 s ALA 408 Cb 0.00 -1.89 0.19 0.00 0.00 0.00 0.00 23.12 21.42 1rt1 s ALA 408 CO 0.00 0.37 1.51 1.79 0.00 0.00 0.00 175.76 179.43 1rt1 h THR 409 N 1.40 1.51 -2.10 0.00 1.35 -1.99 -3.45 112.91 109.62 1rt1 h THR 409 Ca -0.49 -2.51 -0.45 0.00 -0.55 0.00 0.00 66.41 62.40 1rt1 h THR 409 Cb 1.20 2.36 0.06 0.00 -1.73 0.00 0.00 68.15 70.04 1rt1 h THR 409 CO 0.66 0.71 0.01 -1.66 -0.25 0.00 0.00 175.52 174.99 1rt1 s TRP 410 N -3.33 2.15 -0.11 4.73 1.48 -1.26 -4.73 118.94 117.86 1rt1 s TRP 410 Ca -0.01 -0.23 -0.05 0.00 -1.06 0.00 0.00 56.10 54.76 1rt1 s TRP 410 Cb 0.12 -2.77 0.05 0.00 -1.16 0.00 0.00 33.47 29.71 1rt1 s TRP 410 CO 0.78 -1.23 0.25 0.42 -4.06 0.00 0.00 176.95 173.11 1rt1 s ILE 411 N -2.89 -0.17 0.84 0.66 1.01 -1.26 -5.01 121.20 114.38 1rt1 s ILE 411 Ca 0.61 0.19 -0.11 0.00 0.00 0.00 0.00 60.65 61.35 1rt1 s ILE 411 Cb -0.08 -0.40 0.13 0.00 0.01 0.00 0.00 42.46 42.12 1rt1 s ILE 411 CO 0.41 0.08 1.18 -2.16 0.00 0.00 0.00 174.94 174.45 1rt1 s PRO 412 N 1.66 1.44 0.56 2.79 0.04 -1.26 -4.96 135.00 135.27 1rt1 s PRO 412 Ca -0.06 -0.31 -0.07 0.00 0.04 0.00 0.00 61.00 60.60 1rt1 s PRO 412 Cb -0.11 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 1rt1 s PRO 412 CO -0.09 -1.84 0.90 -1.21 0.04 0.00 0.00 177.00 174.80 1rt1 s GLU 413 N -5.59 3.30 0.10 4.56 0.41 -1.25 -4.99 118.70 115.25 1rt1 s GLU 413 Ca 0.67 0.27 -0.23 0.00 -0.41 0.00 0.00 54.97 55.27 1rt1 s GLU 413 Cb -0.07 -2.25 0.06 0.00 -1.78 0.00 0.00 34.13 30.08 1rt1 s GLU 413 CO 0.49 -0.50 0.56 1.67 -0.49 0.00 0.00 175.26 176.99 1rt1 s TRP 414 N -2.96 -0.48 0.02 1.61 -2.14 -1.26 -1.79 118.94 111.94 1rt1 s TRP 414 Ca 0.52 0.39 -0.00 0.00 2.66 0.00 0.00 56.10 59.67 1rt1 s TRP 414 Cb -0.11 0.45 -0.02 0.00 -3.10 0.00 0.00 33.47 30.69 1rt1 s TRP 414 CO 0.47 -0.75 -0.03 -1.83 -2.66 0.00 0.00 176.95 172.15 1rt1 s GLU 415 N -3.16 0.32 -0.20 3.25 -1.05 0.35 -4.89 118.70 113.33 1rt1 s GLU 415 Ca -0.02 -0.62 -0.09 0.00 -0.15 0.00 0.00 54.97 54.10 1rt1 s GLU 415 Cb -0.00 0.11 -0.05 0.00 -0.44 0.00 0.00 34.13 33.75 1rt1 s GLU 415 CO -0.08 -0.05 0.11 -0.06 0.95 0.00 0.00 175.26 176.13 1rt1 s PHE 416 N -1.51 3.36 0.32 4.83 0.08 -1.26 -0.78 117.98 123.02 1rt1 s PHE 416 Ca -0.16 0.25 0.03 0.00 0.12 0.00 0.00 56.93 57.17 1rt1 s PHE 416 Cb -0.10 -2.14 -0.06 0.00 -0.57 0.00 0.00 43.02 40.16 1rt1 s PHE 416 CO -0.01 0.24 0.07 0.14 -0.10 0.00 0.00 175.22 175.56 1rt1 s VAL 417 N 0.39 0.99 -0.24 -0.44 -7.23 0.10 -4.90 120.40 109.06 1rt1 s VAL 417 Ca 0.06 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.18 1rt1 s VAL 417 Cb -0.12 -2.71 -0.01 0.00 0.56 0.00 0.00 36.38 34.10 1rt1 s VAL 417 CO -0.01 0.00 0.02 0.20 -0.31 0.00 0.00 175.10 175.00 1rt1 s ASN 418 N -3.46 4.77 -0.20 4.85 0.01 -1.26 -4.19 114.94 115.46 1rt1 s ASN 418 Ca 0.35 -0.36 -0.29 0.00 -0.71 0.00 0.00 52.86 51.85 1rt1 s ASN 418 Cb 0.08 -1.84 -0.01 0.00 0.41 0.00 0.00 41.25 39.89 1rt1 s ASN 418 CO 0.15 -0.05 1.34 -0.89 -1.51 0.00 0.00 177.10 176.14 1rt1 s THR 419 N 1.54 4.13 0.17 1.60 2.01 -1.26 -4.98 115.64 118.85 1rt1 s THR 419 Ca 0.06 1.34 -0.31 0.00 0.31 0.00 0.00 61.69 63.08 1rt1 s THR 419 Cb -0.15 -3.97 -0.10 0.00 0.01 0.00 0.00 72.50 68.29 1rt1 s THR 419 CO 0.00 -0.24 1.52 -2.84 -0.69 0.00 0.00 174.62 172.37 1rt1 s PRO 420 N 3.84 4.24 0.39 4.92 0.02 -1.26 -4.89 135.00 142.26 1rt1 s PRO 420 Ca 0.58 2.30 0.16 0.00 0.02 0.00 0.00 61.00 64.07 1rt1 s PRO 420 Cb -0.21 -3.16 1.05 0.00 0.02 0.00 0.00 34.50 32.19 1rt1 s PRO 420 CO 0.19 -0.54 1.79 -1.35 -0.33 0.00 0.00 177.00 176.76 1rt1 h PRO 421 N 6.47 0.44 0.05 5.54 0.11 -2.02 -2.65 132.00 139.95 1rt1 h PRO 421 Ca -0.43 -0.03 -0.24 0.00 0.11 0.00 0.00 66.00 65.42 1rt1 h PRO 421 Cb 1.21 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1rt1 h PRO 421 CO 0.88 0.29 -1.05 -0.07 -0.21 0.00 0.00 178.00 177.84 1rt1 h LEU 422 N 0.45 0.37 -1.01 2.35 3.38 -1.99 -2.56 115.31 116.30 1rt1 h LEU 422 Ca 0.56 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 58.24 1rt1 h LEU 422 Cb 1.33 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.90 1rt1 h LEU 422 CO -0.28 1.20 0.66 0.58 0.09 0.00 0.00 178.44 180.69 1rt1 h VAL 423 N 0.12 1.14 0.07 1.22 2.07 -1.86 0.11 116.25 119.11 1rt1 h VAL 423 Ca -0.09 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 1rt1 h VAL 423 Cb 1.73 -0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1rt1 h VAL 423 CO 0.17 0.23 -0.03 0.50 0.02 0.00 0.00 177.57 178.45 1rt1 h LYS 424 N 1.23 -0.09 -0.95 1.57 3.11 -1.59 -2.67 116.57 117.18 1rt1 h LYS 424 Ca 0.41 0.01 0.14 0.00 -2.81 0.00 0.00 60.65 58.40 1rt1 h LYS 424 Cb 0.07 0.02 -0.08 0.00 -1.00 0.00 0.00 32.23 31.24 1rt1 h LYS 424 CO -0.14 0.29 0.60 -0.07 -2.81 0.00 0.00 179.45 177.32 1rt1 h LEU 425 N -0.48 0.78 0.09 5.20 -0.00 -0.99 -1.56 115.31 118.35 1rt1 h LEU 425 Ca -0.01 0.05 -0.00 0.00 -0.00 0.00 0.00 57.88 57.92 1rt1 h LEU 425 Cb 0.42 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 40.98 1rt1 h LEU 425 CO 0.02 0.39 -0.04 -0.25 -0.00 0.00 0.00 178.44 178.55 1rt1 h TRP 426 N 0.82 -0.11 0.00 1.13 2.91 -0.97 -3.29 115.95 116.44 1rt1 h TRP 426 Ca 0.48 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.50 1rt1 h TRP 426 Cb 0.65 0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.34 1rt1 h TRP 426 CO -0.00 0.38 0.00 1.88 -1.03 0.00 0.00 178.44 179.67 1rt1 h TYR 427 N -0.68 0.00 0.00 2.65 0.05 -1.23 -1.42 116.97 116.35 1rt1 h TYR 427 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1rt1 h TYR 427 Cb 0.54 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.28 1rt1 h TYR 427 CO 0.10 0.00 0.00 0.37 -1.05 0.00 0.00 178.16 177.58 1rt1 h GLN 428 N 0.00 0.00 0.00 4.88 4.15 -1.35 -2.10 115.11 120.68 1rt1 h GLN 428 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1rt1 h GLN 428 Cb 0.44 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.13 1rt1 h GLN 428 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 178.83 176.79 1rt1 n LEU 429 N -2.92 0.00 -4.75 -2.39 7.94 -0.53 -4.90 117.00 109.44 1rt1 n LEU 429 Ca 0.01 0.17 -0.39 0.00 -1.11 0.00 0.00 56.01 54.68 1rt1 n LEU 429 Cb 0.27 -0.17 0.03 0.00 0.53 0.00 0.00 43.42 44.08 1rt1 n LEU 429 CO 0.25 -0.03 1.02 -0.62 -1.11 0.00 0.00 177.39 176.90 1rt1 n GLU 430 N -1.17 1.91 -2.24 1.96 1.02 -0.79 -1.47 120.64 119.86 1rt1 n GLU 430 Ca 0.15 0.69 -0.41 0.00 -0.02 0.00 0.00 57.16 57.57 1rt1 n GLU 430 Cb 0.16 -2.60 -0.03 0.00 -0.02 0.00 0.00 31.44 28.95 1rt1 n GLU 430 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1rt1 s LYS 431 N -2.71 4.40 0.36 3.49 2.20 0.21 -4.77 119.74 122.91 1rt1 s LYS 431 Ca 0.68 2.03 0.08 0.00 -0.36 0.00 0.00 55.97 58.40 1rt1 s LYS 431 Cb -0.43 -3.21 -0.05 0.00 -1.51 0.00 0.00 37.83 32.64 1rt1 s LYS 431 CO 0.52 -0.25 0.11 -1.21 -0.36 0.00 0.00 175.35 174.17 1rt1 s GLU 432 N -0.02 2.25 1.17 4.03 2.02 -1.26 -4.83 118.70 122.06 1rt1 s GLU 432 Ca 0.57 -1.68 -0.14 0.00 0.02 0.00 0.00 54.97 53.74 1rt1 s GLU 432 Cb -0.36 -2.06 0.26 0.00 0.10 0.00 0.00 34.13 32.08 1rt1 s GLU 432 CO 0.37 0.06 0.87 -2.30 0.02 0.00 0.00 175.26 174.28 1rt1 n PRO 433 N -1.12 -2.33 0.22 0.39 -0.02 -1.26 -4.97 135.00 125.92 1rt1 n PRO 433 Ca -0.03 -0.65 -0.11 0.00 -2.02 0.00 0.00 63.50 60.70 1rt1 n PRO 433 Cb 0.62 -2.10 -0.05 0.00 -0.02 0.00 0.00 33.50 31.95 1rt1 n PRO 433 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1rt1 h ILE 434 N -2.60 0.10 0.00 4.25 2.04 -2.06 -3.42 117.51 115.82 1rt1 h ILE 434 Ca -0.60 -0.55 -0.14 0.00 1.00 0.00 0.00 64.86 64.57 1rt1 h ILE 434 Cb 1.34 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1rt1 h ILE 434 CO 0.47 0.02 -1.48 1.33 0.00 0.00 0.00 178.15 178.49 1rt1 n VAL 435 N -5.20 0.48 0.00 1.67 0.24 -1.26 -5.15 118.33 109.11 1rt1 n VAL 435 Ca -0.08 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 1rt1 n VAL 435 Cb 0.27 -1.21 0.00 0.00 -1.47 0.00 0.00 33.84 31.42 1rt1 n VAL 435 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rt1 n GLY 436 N 2.77 3.26 3.56 7.63 0.00 -1.26 -4.97 105.19 116.17 1rt1 n GLY 436 Ca -0.16 -1.74 -0.28 0.00 0.00 0.00 0.00 46.02 43.83 1rt1 n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rt1 s ALA 437 N -2.00 1.67 -0.49 4.61 0.00 -1.26 -4.88 121.76 119.40 1rt1 s ALA 437 Ca 0.00 -1.14 -0.27 0.00 0.00 0.00 0.00 51.96 50.54 1rt1 s ALA 437 Cb 0.00 -4.49 -0.09 0.00 0.00 0.00 0.00 23.12 18.55 1rt1 s ALA 437 CO 0.00 -4.71 2.41 -1.91 0.00 0.00 0.00 175.76 171.55 1rt1 n GLU 438 N 8.94 1.07 -3.17 0.00 2.13 -1.26 -4.89 120.64 123.46 1rt1 n GLU 438 Ca 0.36 0.09 -0.44 0.00 0.66 0.00 0.00 57.16 57.83 1rt1 n GLU 438 Cb 0.48 -3.17 0.00 0.00 0.27 0.00 0.00 31.44 29.03 1rt1 n GLU 438 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1rt1 n THR 439 N 7.87 4.97 0.00 6.31 -1.04 -1.26 -5.28 114.28 125.85 1rt1 n THR 439 Ca 0.39 -5.67 0.00 0.00 -2.04 0.00 0.00 64.05 56.74 1rt1 n THR 439 Cb 0.46 -2.33 0.00 0.00 -1.82 0.00 0.00 70.33 66.64 1rt1 n THR 439 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76