#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rtj s SER 3 N 0.00 4.29 0.00 9.51 0.01 -1.25 -4.98 113.70 121.29 1rtj s SER 3 Ca 0.00 -2.52 -0.23 0.00 1.31 0.00 0.00 55.95 54.51 1rtj s SER 3 Cb 0.00 -1.43 -0.28 0.00 0.21 0.00 0.00 66.02 64.51 1rtj s SER 3 CO 0.00 -0.30 1.36 -2.65 0.41 0.00 0.00 173.24 172.05 1rtj n PRO 4 N 3.74 0.00 0.00 12.44 -0.02 -1.26 -3.81 135.00 146.08 1rtj n PRO 4 Ca 0.05 -0.80 0.00 0.00 -2.02 0.00 0.00 63.50 60.73 1rtj n PRO 4 Cb 0.37 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1rtj n PRO 4 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1rtj n ILE 5 N 6.25 0.00 -4.00 4.25 -5.35 -1.26 -5.03 119.36 114.22 1rtj n ILE 5 Ca 0.35 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.51 1rtj n ILE 5 Cb 0.35 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 38.19 1rtj n ILE 5 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1rtj s GLU 6 N 1.43 3.21 -0.08 6.28 0.41 -1.26 -4.86 118.70 123.83 1rtj s GLU 6 Ca 0.00 -0.48 0.01 0.00 -0.41 0.00 0.00 54.97 54.09 1rtj s GLU 6 Cb 0.00 -2.93 -0.03 0.00 -1.78 0.00 0.00 34.13 29.39 1rtj s GLU 6 CO 0.00 0.63 -0.10 0.95 -0.49 0.00 0.00 175.26 176.25 1rtj s THR 7 N -1.35 3.42 0.06 3.63 -4.23 -1.26 -4.78 115.64 111.13 1rtj s THR 7 Ca 0.28 -0.57 -0.22 0.00 -1.18 0.00 0.00 61.69 60.00 1rtj s THR 7 Cb -0.12 -2.40 -0.06 0.00 1.34 0.00 0.00 72.50 71.25 1rtj s THR 7 CO 0.20 0.57 0.67 0.54 -0.54 0.00 0.00 174.62 176.07 1rtj s VAL 8 N -0.44 4.72 -0.56 2.29 0.11 -1.26 -4.88 120.40 120.37 1rtj s VAL 8 Ca 0.06 1.44 -0.26 0.00 -2.93 0.00 0.00 61.98 60.29 1rtj s VAL 8 Cb -0.12 -4.02 -0.24 0.00 -1.53 0.00 0.00 36.38 30.47 1rtj s VAL 8 CO 0.02 0.45 1.82 -0.81 -3.33 0.00 0.00 175.10 173.25 1rtj n PRO 9 N 2.31 0.84 -2.08 1.54 -0.04 -1.26 -4.49 135.00 131.83 1rtj n PRO 9 Ca -0.06 -1.59 -0.34 0.00 -0.04 0.00 0.00 63.50 61.47 1rtj n PRO 9 Cb 0.50 -2.94 0.02 0.00 -0.04 0.00 0.00 33.50 31.04 1rtj n PRO 9 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1rtj s VAL 10 N 7.47 3.32 0.20 0.52 1.01 -1.26 -5.06 120.40 126.60 1rtj s VAL 10 Ca 0.65 0.72 0.01 0.00 0.00 0.00 0.00 61.98 63.36 1rtj s VAL 10 Cb 0.11 -3.25 -0.00 0.00 0.00 0.00 0.00 36.38 33.24 1rtj s VAL 10 CO 0.21 -0.28 0.24 0.29 0.00 0.00 0.00 175.10 175.56 1rtj n LYS 11 N -1.76 0.34 -3.31 2.72 5.02 -1.26 -4.67 118.16 115.24 1rtj n LYS 11 Ca 0.11 -1.70 -0.23 0.00 -2.02 0.00 0.00 58.31 54.46 1rtj n LYS 11 Cb 0.52 1.55 -0.01 0.00 -0.02 0.00 0.00 35.03 37.07 1rtj n LYS 11 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1rtj s LEU 12 N 0.00 3.94 0.43 -0.35 1.43 -1.26 -3.26 118.68 119.61 1rtj s LEU 12 Ca 0.19 0.40 -0.25 0.00 -1.03 0.00 0.00 54.13 53.43 1rtj s LEU 12 Cb 0.00 -3.27 -0.09 0.00 0.03 0.00 0.00 46.19 42.86 1rtj s LEU 12 CO 0.13 -0.38 1.30 0.29 0.23 0.00 0.00 176.35 177.92 1rtj n LYS 13 N -1.84 1.97 -1.58 1.70 5.02 0.50 -4.55 118.16 119.38 1rtj n LYS 13 Ca -0.03 0.70 -0.43 0.00 -2.02 0.00 0.00 58.31 56.53 1rtj n LYS 13 Cb 0.56 -2.42 -0.00 0.00 -0.02 0.00 0.00 35.03 33.15 1rtj n LYS 13 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1rtj n PRO 14 N -0.01 1.24 0.00 1.97 -0.02 -1.26 -2.13 135.00 134.79 1rtj n PRO 14 Ca 0.06 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1rtj n PRO 14 Cb 0.40 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 1rtj n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rtj n GLY 15 N 1.28 1.70 3.75 -1.23 0.00 -1.26 -4.97 105.19 104.46 1rtj n GLY 15 Ca 0.10 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1rtj n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rtj s MET 16 N 0.00 3.11 0.26 1.61 -1.94 -0.90 -5.06 119.30 116.38 1rtj s MET 16 Ca 0.00 1.90 0.09 0.00 -1.71 0.00 0.00 55.69 55.98 1rtj s MET 16 Cb 0.00 -2.06 -0.04 0.00 2.01 0.00 0.00 34.83 34.74 1rtj s MET 16 CO 0.00 -1.11 0.01 0.34 -0.01 0.00 0.00 175.02 174.25 1rtj s ASP 17 N -1.43 4.61 0.94 3.03 -1.08 -1.26 -4.77 116.67 116.71 1rtj s ASP 17 Ca 0.74 -0.62 -0.12 0.00 -0.52 0.00 0.00 52.55 52.04 1rtj s ASP 17 Cb -0.32 -0.88 0.15 0.00 -1.46 0.00 0.00 42.92 40.41 1rtj s ASP 17 CO 0.36 -0.00 1.09 -0.83 0.52 0.00 0.00 175.17 176.31 1rtj s GLY 18 N -3.68 1.60 0.35 2.66 0.00 -1.26 -4.95 107.32 102.04 1rtj s GLY 18 Ca 0.31 -0.16 -0.28 0.00 0.00 0.00 0.00 44.72 44.59 1rtj s GLY 18 CO 0.20 0.37 1.30 2.56 0.00 0.00 0.00 173.10 177.54 1rtj s PRO 19 N -4.93 4.26 -0.37 2.90 0.04 -1.26 -4.99 135.00 130.65 1rtj s PRO 19 Ca 0.64 2.19 0.12 0.00 0.04 0.00 0.00 61.00 64.00 1rtj s PRO 19 Cb -0.18 -2.99 0.36 0.00 0.04 0.00 0.00 34.50 31.72 1rtj s PRO 19 CO 0.57 -0.26 0.75 1.63 0.04 0.00 0.00 177.00 179.73 1rtj n LYS 20 N 0.63 1.05 -3.52 4.56 5.02 -1.22 -0.79 118.16 123.90 1rtj n LYS 20 Ca 0.01 -3.42 -0.36 0.00 -2.02 0.00 0.00 58.31 52.51 1rtj n LYS 20 Cb 0.42 -1.70 -0.07 0.00 -0.02 0.00 0.00 35.03 33.66 1rtj n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1rtj s VAL 21 N -2.53 5.30 0.89 -0.18 1.01 -1.00 -4.92 120.40 118.96 1rtj s VAL 21 Ca 0.40 0.58 -0.11 0.00 0.00 0.00 0.00 61.98 62.84 1rtj s VAL 21 Cb 0.35 -3.65 0.12 0.00 0.00 0.00 0.00 36.38 33.21 1rtj s VAL 21 CO -0.08 0.38 1.11 0.29 0.00 0.00 0.00 175.10 176.80 1rtj n LYS 22 N 3.62 -0.26 -3.53 2.72 4.01 -1.26 -4.18 118.16 119.27 1rtj n LYS 22 Ca -0.11 -0.01 -0.37 0.00 -0.51 0.00 0.00 58.31 57.31 1rtj n LYS 22 Cb 0.52 -2.36 -0.07 0.00 -0.51 0.00 0.00 35.03 32.62 1rtj n LYS 22 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 1rtj s GLN 23 N -4.40 4.16 0.54 1.97 2.00 -1.26 -4.58 119.66 118.09 1rtj s GLN 23 Ca 0.68 0.16 -0.19 0.00 -2.00 0.00 0.00 55.36 54.01 1rtj s GLN 23 Cb -0.25 -3.38 -0.06 0.00 0.80 0.00 0.00 33.01 30.12 1rtj s GLN 23 CO 0.57 0.33 1.10 -1.58 -0.50 0.00 0.00 175.29 175.20 1rtj s TRP 24 N 0.17 2.79 0.20 1.67 0.51 -1.26 -4.99 118.94 118.03 1rtj s TRP 24 Ca 0.18 1.55 -0.18 0.00 -2.12 0.00 0.00 56.10 55.54 1rtj s TRP 24 Cb -0.14 -3.20 -0.08 0.00 -0.81 0.00 0.00 33.47 29.25 1rtj s TRP 24 CO 0.06 -1.32 0.67 -1.25 -0.51 0.00 0.00 176.95 174.60 1rtj s PRO 25 N -3.36 4.16 0.40 4.98 0.04 -1.26 -4.91 135.00 135.04 1rtj s PRO 25 Ca 0.70 0.75 0.08 0.00 0.04 0.00 0.00 61.00 62.57 1rtj s PRO 25 Cb -0.21 -2.89 -0.06 0.00 0.04 0.00 0.00 34.50 31.38 1rtj s PRO 25 CO 0.26 0.42 0.09 -0.51 0.04 0.00 0.00 177.00 177.30 1rtj s LEU 26 N -1.98 3.01 0.88 -3.56 1.02 -1.26 -5.13 118.68 111.66 1rtj s LEU 26 Ca 0.41 -1.15 -0.12 0.00 0.02 0.00 0.00 54.13 53.29 1rtj s LEU 26 Cb -0.16 -1.25 0.12 0.00 0.02 0.00 0.00 46.19 44.92 1rtj s LEU 26 CO 0.20 -0.45 1.15 0.42 0.02 0.00 0.00 176.35 177.69 1rtj s THR 27 N -2.62 2.03 0.09 5.49 -4.23 -1.26 -4.84 115.64 110.30 1rtj s THR 27 Ca 0.38 0.01 -0.19 0.00 -1.18 0.00 0.00 61.69 60.71 1rtj s THR 27 Cb 0.05 -2.82 -0.08 0.00 1.34 0.00 0.00 72.50 70.99 1rtj s THR 27 CO 0.20 -0.01 1.61 -0.08 -0.54 0.00 0.00 174.62 175.80 1rtj h GLU 28 N -1.38 0.35 -1.04 3.99 4.81 -2.00 -2.26 114.58 117.05 1rtj h GLU 28 Ca -0.49 -0.07 0.27 0.00 -0.13 0.00 0.00 59.36 58.94 1rtj h GLU 28 Cb 1.33 -0.05 -0.08 0.00 0.63 0.00 0.00 28.75 30.58 1rtj h GLU 28 CO 0.63 0.43 0.69 1.05 -0.73 0.00 0.00 179.01 181.08 1rtj h GLU 29 N 0.20 0.28 0.18 1.92 9.09 -2.00 -0.90 114.58 123.35 1rtj h GLU 29 Ca 0.07 -0.02 -0.34 0.00 0.05 0.00 0.00 59.36 59.13 1rtj h GLU 29 Cb 0.23 -0.06 0.01 0.00 -1.65 0.00 0.00 28.75 27.27 1rtj h GLU 29 CO -0.00 0.18 -1.63 0.87 0.05 0.00 0.00 179.01 178.48 1rtj h LYS 30 N 0.29 0.38 -0.62 1.06 1.57 -1.87 -2.92 116.57 114.45 1rtj h LYS 30 Ca 0.56 -0.65 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 1rtj h LYS 30 Cb 1.63 0.24 -0.03 0.00 0.08 0.00 0.00 32.23 34.15 1rtj h LYS 30 CO -0.20 1.28 0.21 0.82 -0.57 0.00 0.00 179.45 180.99 1rtj h ILE 31 N 0.10 1.24 0.03 1.86 1.08 -0.76 -2.42 117.51 118.65 1rtj h ILE 31 Ca -0.30 -0.82 -0.00 0.00 -0.39 0.00 0.00 64.86 63.36 1rtj h ILE 31 Cb 2.09 0.60 -0.00 0.00 -3.07 0.00 0.00 36.82 36.44 1rtj h ILE 31 CO 0.19 0.31 -0.04 0.11 -0.69 0.00 0.00 178.15 178.04 1rtj h LYS 32 N 0.89 -0.07 -0.89 2.37 1.57 -1.28 0.58 116.57 119.74 1rtj h LYS 32 Ca 0.20 0.00 0.24 0.00 -1.87 0.00 0.00 60.65 59.22 1rtj h LYS 32 Cb 0.27 0.02 -0.15 0.00 0.08 0.00 0.00 32.23 32.45 1rtj h LYS 32 CO -0.01 -0.05 0.14 0.00 -0.57 0.00 0.00 179.45 178.96 1rtj h ALA 33 N -1.63 1.17 -0.07 3.86 0.00 -1.57 0.20 119.26 121.22 1rtj h ALA 33 Ca -0.00 0.26 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 1rtj h ALA 33 Cb 0.07 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1rtj h ALA 33 CO -0.01 -0.50 -0.41 -0.07 0.00 0.00 0.00 179.25 178.26 1rtj h LEU 34 N 0.12 0.15 -0.13 0.00 3.38 -1.21 0.22 115.31 117.84 1rtj h LEU 34 Ca 0.54 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.42 1rtj h LEU 34 Cb 1.10 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1rtj h LEU 34 CO -0.74 0.54 -0.05 0.58 0.09 0.00 0.00 178.44 178.87 1rtj h VAL 35 N 0.12 1.30 0.97 1.22 2.07 0.17 0.09 116.25 122.20 1rtj h VAL 35 Ca 0.01 -1.04 -0.05 0.00 0.82 0.00 0.00 66.70 66.45 1rtj h VAL 35 Cb 0.77 1.72 0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1rtj h VAL 35 CO 0.06 0.30 -0.47 -0.08 0.02 0.00 0.00 177.57 177.40 1rtj h GLU 36 N -0.06 -1.26 -0.21 1.57 4.81 -1.00 0.23 114.58 118.67 1rtj h GLU 36 Ca 0.03 0.09 0.05 0.00 -0.13 0.00 0.00 59.36 59.40 1rtj h GLU 36 Cb 0.49 0.29 -0.07 0.00 0.63 0.00 0.00 28.75 30.08 1rtj h GLU 36 CO 0.02 -0.84 -0.42 0.82 -0.73 0.00 0.00 179.01 177.85 1rtj h ILE 37 N -1.32 0.13 -0.14 2.32 2.04 -0.65 -0.02 117.51 119.88 1rtj h ILE 37 Ca -0.13 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1rtj h ILE 37 Cb 1.00 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1rtj h ILE 37 CO 0.22 0.00 0.09 0.00 0.00 0.00 0.00 178.15 178.46 1rtj h THR 39 N 0.17 1.06 0.40 0.00 1.03 0.10 -2.75 112.91 112.93 1rtj h THR 39 Ca 0.05 -0.17 -0.01 0.00 -0.01 0.00 0.00 66.41 66.27 1rtj h THR 39 Cb 0.00 1.10 -0.03 0.00 -1.07 0.00 0.00 68.15 68.15 1rtj h THR 39 CO -0.01 0.05 -0.49 -0.33 -0.01 0.00 0.00 175.52 174.73 1rtj h GLU 40 N 0.00 -0.89 -1.22 0.00 5.08 -1.28 -2.28 114.58 114.00 1rtj h GLU 40 Ca 0.02 0.06 0.35 0.00 -1.00 0.00 0.00 59.36 58.79 1rtj h GLU 40 Cb 0.06 0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.46 1rtj h GLU 40 CO -0.00 -0.59 0.91 0.52 -1.00 0.00 0.00 179.01 178.84 1rtj h MET 41 N -0.92 0.00 -0.17 2.33 2.86 -1.51 0.57 114.93 118.09 1rtj h MET 41 Ca -0.04 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.39 1rtj h MET 41 Cb 0.83 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.50 1rtj h MET 41 CO -0.12 0.00 -0.72 1.49 1.06 0.00 0.00 176.91 178.63 1rtj h GLU 42 N 0.00 0.79 0.15 1.72 4.81 -1.10 -1.03 114.58 119.92 1rtj h GLU 42 Ca 0.58 -0.62 -0.29 0.00 -0.13 0.00 0.00 59.36 58.90 1rtj h GLU 42 Cb 2.38 0.12 0.01 0.00 0.63 0.00 0.00 28.75 31.90 1rtj h GLU 42 CO -0.01 1.23 -1.28 0.87 -0.73 0.00 0.00 179.01 179.09 1rtj h LYS 43 N 0.53 0.32 0.00 1.92 1.79 -0.50 -2.71 116.57 117.93 1rtj h LYS 43 Ca -0.04 -0.55 0.00 0.00 -2.18 0.00 0.00 60.65 57.88 1rtj h LYS 43 Cb 1.34 0.20 0.00 0.00 -1.58 0.00 0.00 32.23 32.20 1rtj h LYS 43 CO 0.15 1.26 0.00 0.39 -1.08 0.00 0.00 179.45 180.17 1rtj n GLU 44 N -3.57 0.73 0.00 3.15 1.02 0.17 -4.87 120.64 117.27 1rtj n GLU 44 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 1rtj n GLU 44 Cb 1.04 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 31.43 1rtj n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rtj n GLY 45 N 0.24 1.58 0.25 0.62 0.00 -0.98 -2.38 105.19 104.51 1rtj n GLY 45 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 1rtj n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rtj h LYS 46 N 1.01 0.57 -5.26 1.61 1.57 -1.45 -3.43 116.57 111.20 1rtj h LYS 46 Ca 0.00 -0.03 -0.39 0.00 -1.87 0.00 0.00 60.65 58.36 1rtj h LYS 46 Cb 0.00 -0.13 -0.20 0.00 0.08 0.00 0.00 32.23 31.99 1rtj h LYS 46 CO 0.00 0.38 -0.76 0.96 -0.57 0.00 0.00 179.45 179.46 1rtj s ILE 47 N -6.09 1.12 -0.04 1.86 -4.36 -1.18 0.18 121.20 112.70 1rtj s ILE 47 Ca -0.13 -1.50 -0.01 0.00 -0.26 0.00 0.00 60.65 58.74 1rtj s ILE 47 Cb 0.16 -1.27 0.03 0.00 1.25 0.00 0.00 42.46 42.63 1rtj s ILE 47 CO 0.75 -0.36 0.08 -0.94 0.24 0.00 0.00 174.94 174.70 1rtj s SER 48 N -2.12 -0.02 0.17 4.36 1.04 -0.83 -4.06 113.70 112.23 1rtj s SER 48 Ca 0.03 0.15 -0.31 0.00 0.48 0.00 0.00 55.95 56.29 1rtj s SER 48 Cb -0.07 0.06 -0.17 0.00 0.10 0.00 0.00 66.02 65.94 1rtj s SER 48 CO 0.02 -0.11 0.81 0.29 0.98 0.00 0.00 173.24 175.23 1rtj n LYS 49 N 3.95 0.39 -4.40 4.02 5.02 -1.26 -2.23 118.16 123.64 1rtj n LYS 49 Ca -0.24 0.14 -0.24 0.00 -2.02 0.00 0.00 58.31 55.95 1rtj n LYS 49 Cb 0.53 -1.38 -0.11 0.00 -0.02 0.00 0.00 35.03 34.05 1rtj n LYS 49 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1rtj s ILE 50 N -0.67 2.19 0.00 -0.18 -4.36 -0.51 -4.85 121.20 112.82 1rtj s ILE 50 Ca 0.70 -2.11 0.00 0.00 -0.26 0.00 0.00 60.65 58.98 1rtj s ILE 50 Cb -0.95 -2.08 0.00 0.00 1.25 0.00 0.00 42.46 40.67 1rtj s ILE 50 CO 0.56 -0.28 0.00 0.61 0.24 0.00 0.00 174.94 176.07 1rtj n GLY 51 N -0.00 -0.69 0.02 6.27 0.00 -1.26 -4.63 105.19 104.89 1rtj n GLY 51 Ca -0.10 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.39 1rtj n GLY 51 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rtj n PRO 52 N -0.01 0.17 0.05 1.61 -0.04 -1.26 -4.24 135.00 131.28 1rtj n PRO 52 Ca 0.00 -0.01 0.09 0.00 -0.04 0.00 0.00 63.50 63.54 1rtj n PRO 52 Cb 0.00 -1.54 0.39 0.00 -0.04 0.00 0.00 33.50 32.31 1rtj n PRO 52 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1rtj n GLU 53 N -1.76 0.08 -3.14 0.54 -0.00 -1.26 -4.43 120.64 110.67 1rtj n GLU 53 Ca 0.03 0.30 -0.43 0.00 -0.00 0.00 0.00 57.16 57.06 1rtj n GLU 53 Cb 0.39 -1.64 -0.07 0.00 -0.00 0.00 0.00 31.44 30.12 1rtj n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1rtj s ASN 54 N -3.50 6.26 0.00 -1.84 2.47 -1.26 -4.97 114.94 112.11 1rtj s ASN 54 Ca 0.06 -0.65 0.05 0.00 0.42 0.00 0.00 52.86 52.75 1rtj s ASN 54 Cb 0.10 -2.30 0.17 0.00 -1.45 0.00 0.00 41.25 37.77 1rtj s ASN 54 CO 0.33 -0.83 1.13 -0.81 -3.72 0.00 0.00 177.10 173.20 1rtj n PRO 55 N 6.20 1.36 -2.25 0.43 -0.04 -1.26 -4.91 135.00 134.53 1rtj n PRO 55 Ca -0.04 -0.57 -0.27 0.00 -0.04 0.00 0.00 63.50 62.58 1rtj n PRO 55 Cb 0.47 -1.13 0.13 0.00 -0.04 0.00 0.00 33.50 32.93 1rtj n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1rtj s TYR 56 N -1.79 1.79 0.00 0.54 2.02 -1.26 -4.73 117.35 113.92 1rtj s TYR 56 Ca 0.11 0.08 0.00 0.00 -0.37 0.00 0.00 57.07 56.89 1rtj s TYR 56 Cb 0.06 -3.50 0.00 0.00 -0.40 0.00 0.00 41.96 38.12 1rtj s TYR 56 CO 0.08 -2.06 0.00 -1.71 -1.57 0.00 0.00 175.55 170.28 1rtj n ASN 57 N -3.24 0.00 -3.72 2.29 2.85 0.03 -4.85 115.26 108.62 1rtj n ASN 57 Ca 0.14 0.00 -0.11 0.00 -0.11 0.00 0.00 54.58 54.50 1rtj n ASN 57 Cb 0.60 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 41.51 1rtj n ASN 57 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1rtj s THR 58 N -2.00 -0.02 0.41 -0.44 2.01 -0.35 -2.38 115.64 112.87 1rtj s THR 58 Ca 0.00 0.08 -0.27 0.00 0.31 0.00 0.00 61.69 61.82 1rtj s THR 58 Cb 0.00 -0.53 -0.10 0.00 0.01 0.00 0.00 72.50 71.88 1rtj s THR 58 CO 0.00 0.03 1.44 -2.84 -0.69 0.00 0.00 174.62 172.56 1rtj s PRO 59 N 1.08 3.92 0.13 4.92 0.02 -1.26 -4.21 135.00 139.60 1rtj s PRO 59 Ca -0.07 2.46 0.10 0.00 0.02 0.00 0.00 61.00 63.51 1rtj s PRO 59 Cb -0.07 -2.82 -0.04 0.00 0.02 0.00 0.00 34.50 31.58 1rtj s PRO 59 CO -0.09 -0.64 -0.22 0.08 -0.33 0.00 0.00 177.00 175.80 1rtj s VAL 60 N -1.17 2.55 0.31 3.83 1.01 -1.26 -0.97 120.40 124.71 1rtj s VAL 60 Ca 0.56 -1.66 0.07 0.00 0.00 0.00 0.00 61.98 60.95 1rtj s VAL 60 Cb -0.44 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 1rtj s VAL 60 CO 0.59 0.07 0.26 0.49 0.00 0.00 0.00 175.10 176.51 1rtj n PHE 61 N 0.79 -0.74 -3.69 5.22 3.72 0.71 -4.79 117.46 118.68 1rtj n PHE 61 Ca -0.16 -2.64 -0.11 0.00 -0.05 0.00 0.00 57.45 54.49 1rtj n PHE 61 Cb 0.53 0.27 -0.10 0.00 -0.94 0.00 0.00 39.48 39.24 1rtj n PHE 61 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rtj s ALA 62 N -3.27 -1.18 0.30 4.37 0.00 -1.26 -1.99 121.76 118.73 1rtj s ALA 62 Ca 0.37 1.57 0.05 0.00 0.00 0.00 0.00 51.96 53.95 1rtj s ALA 62 Cb 0.02 -0.94 -0.02 0.00 0.00 0.00 0.00 23.12 22.18 1rtj s ALA 62 CO 0.26 -0.27 0.18 0.44 0.00 0.00 0.00 175.76 176.38 1rtj n ILE 63 N 3.84 0.00 -3.69 0.00 -5.35 -1.01 -4.92 119.36 108.22 1rtj n ILE 63 Ca -0.20 -1.98 -0.29 0.00 -0.27 0.00 0.00 62.75 60.01 1rtj n ILE 63 Cb 0.56 0.86 -0.13 0.00 -1.74 0.00 0.00 39.64 39.20 1rtj n ILE 63 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1rtj s LYS 64 N -3.19 1.21 0.93 6.28 1.02 -1.26 -1.06 119.74 123.67 1rtj s LYS 64 Ca 0.26 -1.92 -0.15 0.00 0.02 0.00 0.00 55.97 54.18 1rtj s LYS 64 Cb 0.01 -2.24 0.23 0.00 -0.52 0.00 0.00 37.83 35.31 1rtj s LYS 64 CO 0.18 -1.16 0.51 1.63 -0.92 0.00 0.00 175.35 175.59 1rtj n LYS 65 N 3.62 -3.14 -0.03 1.68 5.02 -1.26 -4.68 118.16 119.37 1rtj n LYS 65 Ca 0.09 -0.86 -0.01 0.00 -2.02 0.00 0.00 58.31 55.50 1rtj n LYS 65 Cb 0.35 -1.23 -0.01 0.00 -0.02 0.00 0.00 35.03 34.12 1rtj n LYS 65 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1rtj n LYS 66 N -3.67 -0.03 -0.20 1.97 3.00 -1.26 -0.59 118.16 117.38 1rtj n LYS 66 Ca 0.08 0.45 0.10 0.00 -0.00 0.00 0.00 58.31 58.94 1rtj n LYS 66 Cb 0.36 -0.67 0.21 0.00 0.00 0.00 0.00 35.03 34.92 1rtj n LYS 66 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1rtj n ASP 67 N -2.75 3.31 -4.56 3.14 2.03 -1.26 -4.94 116.55 111.53 1rtj n ASP 67 Ca 0.00 -1.94 -0.38 0.00 0.52 0.00 0.00 54.79 52.99 1rtj n ASP 67 Cb 0.02 -0.26 -0.03 0.00 -0.72 0.00 0.00 41.12 40.12 1rtj n ASP 67 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1rtj s SER 68 N -1.26 4.82 0.00 1.67 0.01 0.25 -4.64 113.70 114.54 1rtj s SER 68 Ca 0.35 0.94 0.15 0.00 1.31 0.00 0.00 55.95 58.70 1rtj s SER 68 Cb 0.20 -2.51 0.13 0.00 0.21 0.00 0.00 66.02 64.05 1rtj s SER 68 CO 0.27 -2.62 0.98 0.35 0.41 0.00 0.00 173.24 172.64 1rtj n THR 69 N 7.72 0.04 -4.17 1.44 -2.24 -1.26 -4.54 114.28 111.28 1rtj n THR 69 Ca 0.31 -0.52 -0.18 0.00 -2.27 0.00 0.00 64.05 61.39 1rtj n THR 69 Cb 0.53 1.28 -0.12 0.00 -2.10 0.00 0.00 70.33 69.92 1rtj n THR 69 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1rtj s LYS 70 N -1.23 0.80 0.46 -0.78 2.47 -1.26 -5.14 119.74 115.06 1rtj s LYS 70 Ca 0.18 -0.95 -0.23 0.00 -1.56 0.00 0.00 55.97 53.40 1rtj s LYS 70 Cb 0.12 -0.79 -0.07 0.00 -1.46 0.00 0.00 37.83 35.63 1rtj s LYS 70 CO 0.19 0.17 1.21 -1.58 0.16 0.00 0.00 175.35 175.50 1rtj s TRP 71 N -1.31 2.82 0.31 4.03 0.52 -1.26 -4.83 118.94 119.21 1rtj s TRP 71 Ca -0.02 1.50 0.09 0.00 0.02 0.00 0.00 56.10 57.68 1rtj s TRP 71 Cb -0.10 -3.48 -0.04 0.00 -1.15 0.00 0.00 33.47 28.70 1rtj s TRP 71 CO 0.02 -1.74 0.09 0.50 0.02 0.00 0.00 176.95 175.83 1rtj s ARG 72 N -2.61 2.36 -0.06 4.98 6.06 -0.22 -4.98 118.95 124.48 1rtj s ARG 72 Ca 0.63 -1.49 0.00 0.00 -2.50 0.00 0.00 55.73 52.37 1rtj s ARG 72 Cb -0.32 -2.18 -0.03 0.00 0.06 0.00 0.00 34.95 32.48 1rtj s ARG 72 CO 0.39 0.22 -0.03 0.21 -2.50 0.00 0.00 175.30 173.59 1rtj s LYS 73 N -3.78 2.83 -0.15 5.12 2.20 -1.26 -2.40 119.74 122.29 1rtj s LYS 73 Ca 0.35 -0.52 -0.01 0.00 -0.36 0.00 0.00 55.97 55.43 1rtj s LYS 73 Cb -0.04 -2.67 0.04 0.00 -1.51 0.00 0.00 37.83 33.65 1rtj s LYS 73 CO 0.22 0.67 -0.02 -1.17 -0.36 0.00 0.00 175.35 174.69 1rtj s LEU 74 N -1.00 1.27 0.05 5.43 2.96 -0.84 -4.92 118.68 121.63 1rtj s LEU 74 Ca 0.14 -0.57 -0.02 0.00 -0.22 0.00 0.00 54.13 53.46 1rtj s LEU 74 Cb -0.11 -0.72 -0.04 0.00 0.50 0.00 0.00 46.19 45.81 1rtj s LEU 74 CO 0.03 -0.22 0.23 -0.69 -1.32 0.00 0.00 176.35 174.38 1rtj s VAL 75 N 1.77 5.37 -0.67 1.68 1.01 -1.26 -0.20 120.40 128.09 1rtj s VAL 75 Ca 0.01 -0.24 -0.08 0.00 0.00 0.00 0.00 61.98 61.68 1rtj s VAL 75 Cb -0.15 -3.60 0.18 0.00 0.00 0.00 0.00 36.38 32.80 1rtj s VAL 75 CO -0.07 0.19 0.54 -0.62 0.00 0.00 0.00 175.10 175.14 1rtj s ASP 76 N -2.29 5.84 0.00 3.32 -1.08 -0.14 -4.92 116.67 117.39 1rtj s ASP 76 Ca 0.33 -2.66 0.28 0.00 -0.52 0.00 0.00 52.55 49.98 1rtj s ASP 76 Cb -0.13 -2.00 1.14 0.00 -1.46 0.00 0.00 42.92 40.47 1rtj s ASP 76 CO 0.24 -0.49 1.79 0.49 0.52 0.00 0.00 175.17 177.73 1rtj n PHE 77 N 3.86 0.00 -0.23 -5.34 3.72 -1.26 -4.30 117.46 113.92 1rtj n PHE 77 Ca 0.08 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.50 1rtj n PHE 77 Cb 0.41 -0.01 0.07 0.00 -0.94 0.00 0.00 39.48 39.02 1rtj n PHE 77 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1rtj n ARG 78 N -0.02 -0.07 0.18 -1.08 1.74 -1.26 0.18 116.66 116.32 1rtj n ARG 78 Ca 0.19 0.96 0.04 0.00 -0.77 0.00 0.00 57.85 58.27 1rtj n ARG 78 Cb 0.33 -1.43 0.34 0.00 -1.02 0.00 0.00 32.46 30.67 1rtj n ARG 78 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1rtj h GLU 79 N 0.00 0.00 0.04 5.56 4.39 -2.00 -2.11 114.58 120.46 1rtj h GLU 79 Ca 0.28 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.98 1rtj h GLU 79 Cb 0.43 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1rtj h GLU 79 CO -0.63 0.41 -0.02 1.25 -1.16 0.00 0.00 179.01 178.86 1rtj h LEU 80 N 0.00 -0.04 -0.89 1.33 5.85 0.15 -2.86 115.31 118.85 1rtj h LEU 80 Ca -0.00 -0.60 0.24 0.00 0.84 0.00 0.00 57.88 58.35 1rtj h LEU 80 Cb 0.83 0.01 -0.15 0.00 0.37 0.00 0.00 40.66 41.72 1rtj h LEU 80 CO 0.05 0.72 0.15 0.78 -0.34 0.00 0.00 178.44 179.80 1rtj h ASN 81 N -0.94 -0.18 -0.33 1.25 4.21 -0.39 0.58 115.58 119.77 1rtj h ASN 81 Ca -0.00 0.22 -0.07 0.00 1.21 0.00 0.00 56.30 57.65 1rtj h ASN 81 Cb 0.64 0.34 -0.02 0.00 -1.12 0.00 0.00 38.32 38.16 1rtj h ASN 81 CO 0.01 -0.22 -0.03 0.11 -1.29 0.00 0.00 177.43 176.00 1rtj h LYS 82 N 0.13 0.72 0.00 0.81 1.57 -1.45 -2.13 116.57 116.21 1rtj h LYS 82 Ca 0.55 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1rtj h LYS 82 Cb 1.11 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.33 1rtj h LYS 82 CO -0.73 0.75 -0.25 0.54 -0.57 0.00 0.00 179.45 179.19 1rtj n ARG 83 N -4.21 0.19 -2.72 3.15 1.74 0.13 -4.83 116.66 110.10 1rtj n ARG 83 Ca 0.02 0.11 -0.42 0.00 -0.77 0.00 0.00 57.85 56.79 1rtj n ARG 83 Cb 0.31 -1.68 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 1rtj n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1rtj s THR 84 N -3.09 4.78 0.08 0.55 2.01 0.16 -0.37 115.64 119.76 1rtj s THR 84 Ca 0.10 1.96 -0.36 0.00 0.31 0.00 0.00 61.69 63.70 1rtj s THR 84 Cb 0.14 -4.28 -0.18 0.00 0.01 0.00 0.00 72.50 68.20 1rtj s THR 84 CO 0.64 -0.03 1.02 0.00 -0.69 0.00 0.00 174.62 175.56 1rtj n GLN 85 N 5.31 0.38 -0.68 4.92 10.64 -1.20 -4.71 117.38 132.03 1rtj n GLN 85 Ca 0.08 0.14 -0.29 0.00 -1.83 0.00 0.00 57.00 55.10 1rtj n GLN 85 Cb 0.48 -1.56 0.25 0.00 -0.86 0.00 0.00 30.24 28.55 1rtj n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1rtj s ASP 86 N -0.12 0.70 -0.46 2.61 1.01 -1.26 -4.94 116.67 114.20 1rtj s ASP 86 Ca 0.82 1.18 0.08 0.00 0.71 0.00 0.00 52.55 55.34 1rtj s ASP 86 Cb -1.08 -1.80 0.38 0.00 1.01 0.00 0.00 42.92 41.43 1rtj s ASP 86 CO 0.55 -4.33 0.93 0.49 0.21 0.00 0.00 175.17 173.02 1rtj n PHE 87 N -4.97 2.59 -3.15 4.23 3.72 -1.26 -4.92 117.46 113.70 1rtj n PHE 87 Ca 0.06 -3.60 -0.23 0.00 -0.05 0.00 0.00 57.45 53.63 1rtj n PHE 87 Cb 0.57 -0.37 -0.05 0.00 -0.94 0.00 0.00 39.48 38.69 1rtj n PHE 87 CO 0.00 0.00 0.00 1.87 -0.05 0.00 0.00 176.76 178.58 1rtj n TRP 88 N -0.15 1.86 0.08 1.38 -0.00 -1.26 -4.07 117.44 115.29 1rtj n TRP 88 Ca 0.28 -3.88 -0.22 0.00 -0.00 0.00 0.00 57.50 53.68 1rtj n TRP 88 Cb 0.57 -0.45 -0.12 0.00 -0.00 0.00 0.00 31.31 31.31 1rtj n TRP 88 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 177.69 179.18 1rtj h GLU 89 N 3.38 0.63 0.00 5.87 4.81 -2.02 -3.44 114.58 123.81 1rtj h GLU 89 Ca 0.12 -0.82 0.00 0.00 -0.13 0.00 0.00 59.36 58.53 1rtj h GLU 89 Cb 0.76 0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1rtj h GLU 89 CO 0.65 1.37 0.00 0.28 -0.73 0.00 0.00 179.01 180.58 1rtj n VAL 90 N -3.80 0.00 0.00 0.32 0.31 -1.26 -5.18 118.33 108.73 1rtj n VAL 90 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1rtj n VAL 90 Cb 0.97 -0.39 0.00 0.00 -0.91 0.00 0.00 33.84 33.51 1rtj n VAL 90 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rtj n GLN 91 N -3.45 0.00 -0.87 5.55 10.64 -1.26 -4.94 117.38 123.05 1rtj n GLN 91 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1rtj n GLN 91 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 1rtj n GLN 91 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1rtj n LEU 92 N 0.00 0.51 -4.20 2.61 4.77 -1.26 -4.62 117.00 114.81 1rtj n LEU 92 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 1rtj n LEU 92 Cb 0.00 -1.13 -0.12 0.00 -2.33 0.00 0.00 43.42 39.84 1rtj n LEU 92 CO 0.00 -0.38 -0.22 -0.83 -1.33 0.00 0.00 177.39 174.63 1rtj s GLY 93 N -2.00 1.89 0.02 -0.72 0.00 -1.26 -4.63 107.32 100.62 1rtj s GLY 93 Ca 0.00 -2.07 -0.37 0.00 0.00 0.00 0.00 44.72 42.27 1rtj s GLY 93 CO 0.00 0.87 1.39 4.51 0.00 0.00 0.00 173.10 179.87 1rtj n ILE 94 N 4.72 0.05 -1.94 0.90 3.06 -1.26 -5.01 119.36 119.87 1rtj n ILE 94 Ca -0.09 -0.01 -0.29 0.00 -2.50 0.00 0.00 62.75 59.86 1rtj n ILE 94 Cb 0.43 -0.84 0.13 0.00 0.54 0.00 0.00 39.64 39.89 1rtj n ILE 94 CO 0.00 0.00 0.00 -2.16 -2.50 0.00 0.00 176.55 171.89 1rtj s PRO 95 N 0.94 1.44 -0.42 9.51 0.04 -1.26 -5.05 135.00 140.21 1rtj s PRO 95 Ca 0.87 -0.14 -0.14 0.00 0.04 0.00 0.00 61.00 61.63 1rtj s PRO 95 Cb -0.99 -1.93 0.04 0.00 0.04 0.00 0.00 34.50 31.66 1rtj s PRO 95 CO 0.50 -1.90 0.30 -1.58 0.04 0.00 0.00 177.00 174.35 1rtj s HIS 96 N -3.68 3.25 -1.16 0.56 2.46 -1.26 -4.97 115.29 110.49 1rtj s HIS 96 Ca 0.67 -0.82 -0.21 0.00 0.47 0.00 0.00 55.06 55.17 1rtj s HIS 96 Cb -0.08 -2.70 -0.05 0.00 -0.13 0.00 0.00 32.58 29.61 1rtj s HIS 96 CO 0.50 -0.67 1.90 -0.35 -2.47 0.00 0.00 174.74 173.66 1rtj n PRO 97 N 5.11 2.05 0.00 2.88 -0.04 -1.26 -4.83 135.00 138.91 1rtj n PRO 97 Ca -0.11 -2.57 0.00 0.00 -0.04 0.00 0.00 63.50 60.78 1rtj n PRO 97 Cb 0.46 -3.51 0.00 0.00 -0.04 0.00 0.00 33.50 30.41 1rtj n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rtj n ALA 98 N 11.25 0.40 0.00 0.55 0.00 -1.26 -2.34 120.51 129.12 1rtj n ALA 98 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1rtj n ALA 98 Cb 0.45 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1rtj n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rtj n GLY 99 N 0.35 0.59 0.27 0.00 0.00 -1.26 -4.69 105.19 100.45 1rtj n GLY 99 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1rtj n GLY 99 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1rtj h LEU 100 N 0.00 0.00 0.04 0.99 -0.00 -1.79 -1.65 115.31 112.91 1rtj h LEU 100 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1rtj h LEU 100 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1rtj h LEU 100 CO 0.00 0.04 -0.02 0.07 -0.00 0.00 0.00 178.44 178.52 1rtj h LYS 101 N 0.00 -0.06 0.00 0.17 2.10 -1.84 -2.04 116.57 114.91 1rtj h LYS 101 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1rtj h LYS 101 Cb 0.07 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.42 1rtj h LYS 101 CO 0.00 0.08 0.00 1.63 -2.00 0.00 0.00 179.45 179.17 1rtj n LYS 102 N -5.05 0.18 -2.03 0.07 5.02 -0.68 -4.18 118.16 111.49 1rtj n LYS 102 Ca -0.08 0.51 -0.40 0.00 -2.02 0.00 0.00 58.31 56.32 1rtj n LYS 102 Cb 0.11 -1.92 -0.01 0.00 -0.02 0.00 0.00 35.03 33.19 1rtj n LYS 102 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1rtj s LYS 103 N -3.42 4.11 0.48 1.97 -0.14 -0.77 -4.73 119.74 117.24 1rtj s LYS 103 Ca 0.02 2.25 0.14 0.00 -1.36 0.00 0.00 55.97 57.02 1rtj s LYS 103 Cb 0.08 -2.89 1.13 0.00 -1.68 0.00 0.00 37.83 34.47 1rtj s LYS 103 CO 0.33 -0.41 2.09 -0.22 -0.76 0.00 0.00 175.35 176.38 1rtj h LYS 104 N 2.96 0.21 -1.94 1.68 1.63 -1.86 -3.25 116.57 116.00 1rtj h LYS 104 Ca -0.50 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.28 1rtj h LYS 104 Cb 1.24 -0.05 -0.22 0.00 -0.60 0.00 0.00 32.23 32.60 1rtj h LYS 104 CO 0.64 0.14 0.14 -1.12 -3.45 0.00 0.00 179.45 175.80 1rtj s SER 105 N -6.77 -0.76 0.02 4.20 0.01 -1.19 -4.55 113.70 104.66 1rtj s SER 105 Ca -0.06 1.39 0.06 0.00 1.31 0.00 0.00 55.95 58.64 1rtj s SER 105 Cb 0.18 1.38 -0.02 0.00 0.21 0.00 0.00 66.02 67.77 1rtj s SER 105 CO 0.70 -0.23 -0.18 -0.69 0.41 0.00 0.00 173.24 173.25 1rtj s VAL 106 N 0.71 1.43 -0.06 3.43 1.01 -1.19 -2.14 120.40 123.59 1rtj s VAL 106 Ca -0.02 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.06 1rtj s VAL 106 Cb -0.05 -1.22 -0.00 0.00 0.00 0.00 0.00 36.38 35.11 1rtj s VAL 106 CO -0.05 0.26 -0.20 -0.89 0.00 0.00 0.00 175.10 174.22 1rtj s THR 107 N -0.62 1.68 -0.00 3.92 2.01 -0.42 0.58 115.64 122.80 1rtj s THR 107 Ca 0.06 -0.84 -0.13 0.00 0.31 0.00 0.00 61.69 61.09 1rtj s THR 107 Cb -0.08 -1.45 -0.05 0.00 0.01 0.00 0.00 72.50 70.93 1rtj s THR 107 CO 0.00 0.48 0.38 -0.69 -0.69 0.00 0.00 174.62 174.10 1rtj s VAL 108 N 0.17 5.09 -0.11 3.82 1.01 -1.26 -1.01 120.40 128.10 1rtj s VAL 108 Ca -0.09 0.73 -0.01 0.00 0.00 0.00 0.00 61.98 62.60 1rtj s VAL 108 Cb -0.14 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.60 1rtj s VAL 108 CO 0.04 0.55 -0.02 -0.76 0.00 0.00 0.00 175.10 174.92 1rtj s LEU 109 N -1.16 0.94 -0.29 3.92 1.02 0.68 -4.92 118.68 118.87 1rtj s LEU 109 Ca 0.24 -0.32 -0.29 0.00 0.02 0.00 0.00 54.13 53.78 1rtj s LEU 109 Cb -0.16 -0.62 0.01 0.00 0.02 0.00 0.00 46.19 45.44 1rtj s LEU 109 CO 0.13 -0.19 1.20 -0.62 0.02 0.00 0.00 176.35 176.89 1rtj s ASP 110 N 1.85 6.83 -0.04 2.29 2.15 -1.26 0.51 116.67 129.00 1rtj s ASP 110 Ca 0.04 1.22 0.06 0.00 0.43 0.00 0.00 52.55 54.30 1rtj s ASP 110 Cb -0.13 -2.54 0.10 0.00 -0.30 0.00 0.00 42.92 40.04 1rtj s ASP 110 CO -0.07 -0.94 0.96 1.33 -0.17 0.00 0.00 175.17 176.28 1rtj n VAL 111 N 5.93 0.89 0.31 1.11 0.24 0.68 -3.40 118.33 124.09 1rtj n VAL 111 Ca 0.13 -1.02 0.19 0.00 -2.04 0.00 0.00 64.34 61.61 1rtj n VAL 111 Cb 0.46 0.33 1.04 0.00 -1.47 0.00 0.00 33.84 34.21 1rtj n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1rtj h GLY 112 N 0.00 0.00 0.13 7.63 0.00 -1.63 -2.75 103.07 106.45 1rtj h GLY 112 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.45 1rtj h GLY 112 CO 0.00 0.00 0.14 -0.55 0.00 0.00 0.00 176.54 176.13 1rtj h ASP 113 N 0.00 0.01 0.00 0.19 3.32 -1.88 -2.36 116.42 115.69 1rtj h ASP 113 Ca 0.01 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1rtj h ASP 113 Cb 0.14 0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1rtj h ASP 113 CO -0.00 0.00 0.82 0.00 -1.72 0.00 0.00 179.24 178.35 1rtj h ALA 114 N 1.51 1.76 -0.06 3.45 0.00 -1.76 -1.88 119.26 122.28 1rtj h ALA 114 Ca 0.34 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.09 1rtj h ALA 114 Cb 0.52 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1rtj h ALA 114 CO -0.43 -0.76 -0.65 1.88 0.00 0.00 0.00 179.25 179.30 1rtj h TYR 115 N 0.00 0.31 -0.85 0.00 0.05 -1.67 -3.30 116.97 111.52 1rtj h TYR 115 Ca 0.00 -0.13 0.20 0.00 0.05 0.00 0.00 58.73 58.85 1rtj h TYR 115 Cb 1.64 -0.05 -0.06 0.00 1.01 0.00 0.00 36.73 39.28 1rtj h TYR 115 CO 0.00 0.82 0.57 0.27 -1.05 0.00 0.00 178.16 178.77 1rtj h PHE 116 N 0.17 0.41 -0.06 4.88 -0.00 -1.47 -1.18 116.94 119.70 1rtj h PHE 116 Ca -0.01 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1rtj h PHE 116 Cb 1.17 -0.13 0.00 0.00 -0.00 0.00 0.00 35.95 36.99 1rtj h PHE 116 CO 0.02 0.12 0.00 -1.13 -0.00 0.00 0.00 178.31 177.32 1rtj n SER 117 N -4.46 1.22 -3.91 -0.68 3.41 -1.24 -3.86 113.62 104.10 1rtj n SER 117 Ca 0.18 -2.07 -0.24 0.00 -0.26 0.00 0.00 58.87 56.47 1rtj n SER 117 Cb 0.70 -0.43 -0.17 0.00 -0.26 0.00 0.00 64.21 64.06 1rtj n SER 117 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1rtj s VAL 118 N -1.31 0.86 0.59 -3.33 1.01 -0.45 -4.22 120.40 113.56 1rtj s VAL 118 Ca 0.05 -0.23 -0.16 0.00 0.00 0.00 0.00 61.98 61.63 1rtj s VAL 118 Cb 0.03 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 1rtj s VAL 118 CO 0.02 0.32 1.06 -2.16 0.00 0.00 0.00 175.10 174.34 1rtj s PRO 119 N 1.37 3.33 -0.16 2.72 0.04 -1.25 -2.34 135.00 138.71 1rtj s PRO 119 Ca -0.02 1.24 -0.05 0.00 0.04 0.00 0.00 61.00 62.21 1rtj s PRO 119 Cb -0.14 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1rtj s PRO 119 CO -0.04 -0.81 0.00 -1.17 0.04 0.00 0.00 177.00 175.03 1rtj s LEU 120 N -4.41 3.49 -0.49 -3.56 0.20 -0.64 -4.63 118.68 108.63 1rtj s LEU 120 Ca 0.64 -0.04 -0.44 0.00 0.69 0.00 0.00 54.13 54.99 1rtj s LEU 120 Cb -0.17 -1.86 -0.19 0.00 -0.43 0.00 0.00 46.19 43.55 1rtj s LEU 120 CO 0.35 0.18 2.07 -0.67 -0.29 0.00 0.00 176.35 177.99 1rtj n ASP 121 N 3.50 0.85 -0.28 3.68 2.03 -1.26 -4.77 116.55 120.30 1rtj n ASP 121 Ca -0.17 0.74 0.28 0.00 0.52 0.00 0.00 54.79 56.16 1rtj n ASP 121 Cb 0.52 -0.91 0.52 0.00 -0.72 0.00 0.00 41.12 40.53 1rtj n ASP 121 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1rtj n GLU 122 N 7.07 -0.05 0.27 -0.67 4.71 -1.26 0.07 120.64 130.77 1rtj n GLU 122 Ca 0.51 1.22 0.13 0.00 -0.01 0.00 0.00 57.16 59.01 1rtj n GLU 122 Cb -0.03 -2.18 0.73 0.00 -1.01 0.00 0.00 31.44 28.94 1rtj n GLU 122 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 1rtj h ASP 123 N 0.00 0.00 0.46 1.62 3.32 -1.94 -3.18 116.42 116.70 1rtj h ASP 123 Ca 0.75 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 57.50 1rtj h ASP 123 Cb 1.98 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 41.50 1rtj h ASP 123 CO -0.68 0.11 -1.66 0.15 -1.72 0.00 0.00 179.24 175.44 1rtj h PHE 124 N 0.00 0.18 -0.79 4.55 3.57 -0.63 -3.40 116.94 120.41 1rtj h PHE 124 Ca -0.00 -0.13 0.28 0.00 3.53 0.00 0.00 57.97 61.64 1rtj h PHE 124 Cb 0.36 -0.01 -0.15 0.00 2.79 0.00 0.00 35.95 38.95 1rtj h PHE 124 CO 0.00 1.23 0.23 0.54 -2.23 0.00 0.00 178.31 178.08 1rtj n ARG 125 N -3.24 -0.06 -0.27 1.11 1.74 -1.18 -0.80 116.66 113.96 1rtj n ARG 125 Ca -0.18 1.14 0.08 0.00 -0.77 0.00 0.00 57.85 58.12 1rtj n ARG 125 Cb 1.04 -1.93 0.22 0.00 -1.02 0.00 0.00 32.46 30.77 1rtj n ARG 125 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1rtj h LYS 126 N 0.00 0.24 0.00 5.56 2.10 -1.79 0.19 116.57 122.87 1rtj h LYS 126 Ca 0.58 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.22 1rtj h LYS 126 Cb 1.40 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.68 1rtj h LYS 126 CO -0.68 0.16 0.00 0.66 -2.00 0.00 0.00 179.45 177.59 1rtj n TYR 127 N -5.19 0.00 1.12 0.07 4.01 0.02 -1.95 117.16 115.23 1rtj n TYR 127 Ca 0.17 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.03 1rtj n TYR 127 Cb 0.54 -0.27 0.20 0.00 -0.31 0.00 0.00 39.34 39.50 1rtj n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1rtj n THR 128 N -1.27 0.00 -1.65 -0.72 -2.24 0.68 -4.70 114.28 104.38 1rtj n THR 128 Ca 0.06 -0.42 -0.54 0.00 -2.27 0.00 0.00 64.05 60.88 1rtj n THR 128 Cb 0.09 1.23 -0.06 0.00 -2.10 0.00 0.00 70.33 69.48 1rtj n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rtj n ALA 129 N 0.93 -0.42 -2.32 6.98 0.00 -0.83 -4.58 120.51 120.28 1rtj n ALA 129 Ca 0.15 0.45 -0.17 0.00 0.00 0.00 0.00 53.44 53.87 1rtj n ALA 129 Cb 0.53 -2.18 -0.10 0.00 0.00 0.00 0.00 19.45 17.70 1rtj n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1rtj s PHE 130 N 1.93 1.53 -0.04 0.00 -0.71 -1.16 -1.21 117.98 118.32 1rtj s PHE 130 Ca 0.90 -0.85 0.00 0.00 -1.04 0.00 0.00 56.93 55.94 1rtj s PHE 130 Cb -0.97 -0.85 0.03 0.00 -1.21 0.00 0.00 43.02 40.01 1rtj s PHE 130 CO 0.54 0.03 -0.00 0.99 -1.34 0.00 0.00 175.22 175.43 1rtj s THR 131 N -3.35 0.27 -0.32 -4.49 2.01 -1.26 -2.03 115.64 106.47 1rtj s THR 131 Ca 0.25 0.07 -0.20 0.00 0.31 0.00 0.00 61.69 62.13 1rtj s THR 131 Cb 0.04 -0.37 -0.01 0.00 0.01 0.00 0.00 72.50 72.18 1rtj s THR 131 CO 0.07 0.18 0.63 -0.63 -0.69 0.00 0.00 174.62 174.18 1rtj s ILE 132 N 1.25 4.93 0.86 1.82 1.01 -0.47 -4.72 121.20 125.87 1rtj s ILE 132 Ca -0.06 0.78 -0.12 0.00 0.00 0.00 0.00 60.65 61.24 1rtj s ILE 132 Cb -0.13 -4.02 0.13 0.00 0.01 0.00 0.00 42.46 38.45 1rtj s ILE 132 CO -0.02 -0.18 1.21 -2.16 0.00 0.00 0.00 174.94 173.79 1rtj s PRO 133 N 2.63 1.39 0.16 2.79 0.04 -1.26 0.14 135.00 140.89 1rtj s PRO 133 Ca 0.25 -0.24 0.10 0.00 0.04 0.00 0.00 61.00 61.15 1rtj s PRO 133 Cb -0.15 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 1rtj s PRO 133 CO 0.13 -1.91 -0.23 -1.54 0.04 0.00 0.00 177.00 173.49 1rtj s SER 134 N -4.72 3.12 0.39 6.66 1.04 -1.26 -4.87 113.70 114.06 1rtj s SER 134 Ca 0.67 -0.82 -0.27 0.00 0.48 0.00 0.00 55.95 56.01 1rtj s SER 134 Cb -0.07 -0.21 -0.09 0.00 0.10 0.00 0.00 66.02 65.74 1rtj s SER 134 CO 0.50 0.09 1.37 -0.63 0.98 0.00 0.00 173.24 175.55 1rtj s ILE 135 N -1.59 2.39 -0.95 -1.02 1.01 -1.26 -3.02 121.20 116.75 1rtj s ILE 135 Ca 0.17 0.37 0.00 0.00 0.00 0.00 0.00 60.65 61.18 1rtj s ILE 135 Cb -0.08 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.17 1rtj s ILE 135 CO 0.08 0.07 0.00 -3.20 0.00 0.00 0.00 174.94 171.89 1rtj n ASN 136 N 0.28 -3.01 -3.88 3.58 5.15 -1.26 -2.00 115.26 114.11 1rtj n ASN 136 Ca 0.03 0.22 -0.26 0.00 -0.60 0.00 0.00 54.58 53.96 1rtj n ASN 136 Cb 0.42 -2.69 0.01 0.00 -0.53 0.00 0.00 39.78 36.98 1rtj n ASN 136 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1rtj n ASN 137 N -0.05 -2.16 0.20 1.20 3.02 -1.17 -4.86 115.26 111.44 1rtj n ASN 137 Ca -0.09 -0.88 0.12 0.00 -0.03 0.00 0.00 54.58 53.71 1rtj n ASN 137 Cb 0.35 -3.62 0.24 0.00 -0.61 0.00 0.00 39.78 36.14 1rtj n ASN 137 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1rtj h GLU 138 N -1.89 0.00 -3.30 3.52 5.08 -1.65 -3.46 114.58 112.88 1rtj h GLU 138 Ca -0.61 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.70 1rtj h GLU 138 Cb 1.37 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.48 1rtj h GLU 138 CO 0.63 0.00 -0.08 -0.08 -1.00 0.00 0.00 179.01 178.48 1rtj s THR 139 N -3.21 0.07 0.91 1.13 -1.32 -1.26 -5.13 115.64 106.82 1rtj s THR 139 Ca 0.08 -0.55 -0.11 0.00 -1.21 0.00 0.00 61.69 59.89 1rtj s THR 139 Cb 0.07 -1.12 0.14 0.00 -1.51 0.00 0.00 72.50 70.08 1rtj s THR 139 CO 0.65 -0.30 1.09 -2.84 -2.21 0.00 0.00 174.62 171.00 1rtj s PRO 140 N -3.47 1.17 0.63 7.08 0.02 -1.26 -4.45 135.00 134.71 1rtj s PRO 140 Ca 0.01 0.87 -0.11 0.00 0.02 0.00 0.00 61.00 61.79 1rtj s PRO 140 Cb 0.01 -1.79 -0.03 0.00 0.02 0.00 0.00 34.50 32.71 1rtj s PRO 140 CO -0.10 -2.32 1.03 0.20 -0.33 0.00 0.00 177.00 175.49 1rtj s GLY 141 N -3.34 1.68 -0.53 0.52 0.00 -1.26 -4.66 107.32 99.74 1rtj s GLY 141 Ca 0.64 -0.04 -0.22 0.00 0.00 0.00 0.00 44.72 45.09 1rtj s GLY 141 CO 0.57 0.24 0.83 -0.42 0.00 0.00 0.00 173.10 174.32 1rtj s ILE 142 N -3.13 4.56 0.10 0.90 1.09 0.12 -4.77 121.20 120.06 1rtj s ILE 142 Ca 0.56 0.04 -0.30 0.00 -1.10 0.00 0.00 60.65 59.85 1rtj s ILE 142 Cb -0.12 -4.45 -0.05 0.00 -1.06 0.00 0.00 42.46 36.78 1rtj s ILE 142 CO 0.53 -0.99 0.96 -0.13 -0.10 0.00 0.00 174.94 175.21 1rtj s ARG 143 N 3.49 4.68 0.36 2.79 1.81 -1.26 -1.37 118.95 129.44 1rtj s ARG 143 Ca 0.25 1.44 0.04 0.00 -1.72 0.00 0.00 55.73 55.75 1rtj s ARG 143 Cb -0.15 -3.39 -0.02 0.00 -0.45 0.00 0.00 34.95 30.95 1rtj s ARG 143 CO 0.17 0.18 0.15 0.66 -0.68 0.00 0.00 175.30 175.78 1rtj n TYR 144 N 2.93 -0.01 -4.07 -0.53 4.01 -0.86 -1.43 117.16 117.20 1rtj n TYR 144 Ca 0.03 -2.38 -0.12 0.00 -0.16 0.00 0.00 57.90 55.26 1rtj n TYR 144 Cb 0.49 0.04 -0.06 0.00 -0.31 0.00 0.00 39.34 39.51 1rtj n TYR 144 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1rtj s GLN 145 N -3.37 1.64 0.04 -0.72 0.74 -0.95 -2.99 119.66 114.06 1rtj s GLN 145 Ca 0.21 -1.54 0.06 0.00 0.05 0.00 0.00 55.36 54.14 1rtj s GLN 145 Cb 0.01 0.42 -0.03 0.00 1.10 0.00 0.00 33.01 34.51 1rtj s GLN 145 CO 0.15 -0.66 -0.11 0.71 -0.55 0.00 0.00 175.29 174.82 1rtj s TYR 146 N -3.62 2.74 -0.07 1.67 2.02 -1.26 -1.97 117.35 116.85 1rtj s TYR 146 Ca 0.29 -0.15 0.07 0.00 -0.37 0.00 0.00 57.07 56.92 1rtj s TYR 146 Cb 0.01 -1.51 -0.10 0.00 -0.40 0.00 0.00 41.96 39.95 1rtj s TYR 146 CO 0.14 0.35 0.18 0.09 -1.57 0.00 0.00 175.55 174.74 1rtj n ASN 147 N 1.33 2.80 -4.59 2.29 5.03 0.47 -4.65 115.26 117.93 1rtj n ASN 147 Ca -0.15 -0.12 -0.31 0.00 0.87 0.00 0.00 54.58 54.87 1rtj n ASN 147 Cb 0.52 1.27 -0.08 0.00 -1.02 0.00 0.00 39.78 40.47 1rtj n ASN 147 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 1rtj s VAL 148 N -2.34 1.07 0.17 2.41 -7.23 -0.87 -1.62 120.40 111.99 1rtj s VAL 148 Ca -0.02 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 57.84 1rtj s VAL 148 Cb 0.05 -2.26 -0.10 0.00 0.56 0.00 0.00 36.38 34.62 1rtj s VAL 148 CO 0.29 0.00 1.55 -0.76 -0.31 0.00 0.00 175.10 175.87 1rtj s LEU 149 N -3.80 4.37 0.18 1.32 1.43 -0.99 -4.53 118.68 116.66 1rtj s LEU 149 Ca 0.12 2.60 -0.16 0.00 -1.03 0.00 0.00 54.13 55.66 1rtj s LEU 149 Cb 0.02 -3.60 -0.07 0.00 0.03 0.00 0.00 46.19 42.57 1rtj s LEU 149 CO 0.07 -0.80 0.62 -2.84 0.23 0.00 0.00 176.35 173.63 1rtj s PRO 150 N 1.01 4.09 0.76 1.29 0.02 -1.26 -4.02 135.00 136.90 1rtj s PRO 150 Ca 0.69 0.65 -0.12 0.00 0.02 0.00 0.00 61.00 62.23 1rtj s PRO 150 Cb -0.43 -2.90 0.06 0.00 0.02 0.00 0.00 34.50 31.25 1rtj s PRO 150 CO 0.32 0.44 1.13 -0.65 -0.33 0.00 0.00 177.00 177.91 1rtj s GLN 151 N -1.99 2.13 0.00 5.54 -0.21 -1.26 -3.46 119.66 120.41 1rtj s GLN 151 Ca 0.40 1.41 0.00 0.00 0.02 0.00 0.00 55.36 57.19 1rtj s GLN 151 Cb -0.16 -1.87 0.00 0.00 1.00 0.00 0.00 33.01 31.99 1rtj s GLN 151 CO 0.20 -1.77 0.00 0.41 -2.12 0.00 0.00 175.29 172.01 1rtj n GLY 152 N -0.46 0.21 3.82 3.09 0.00 -1.26 -4.89 105.19 105.70 1rtj n GLY 152 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1rtj n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1rtj s TRP 153 N -1.47 3.38 0.12 1.61 -0.00 -1.22 -4.36 118.94 117.00 1rtj s TRP 153 Ca 0.00 0.27 -0.12 0.00 -0.00 0.00 0.00 56.10 56.24 1rtj s TRP 153 Cb 0.00 -1.78 -0.07 0.00 -0.00 0.00 0.00 33.47 31.62 1rtj s TRP 153 CO 0.00 0.59 1.43 1.57 -0.00 0.00 0.00 176.95 180.54 1rtj h LYS 154 N 4.07 0.86 0.00 5.86 2.10 -1.91 -2.88 116.57 124.67 1rtj h LYS 154 Ca -0.49 -0.49 -0.00 0.00 -2.00 0.00 0.00 60.65 57.67 1rtj h LYS 154 Cb 1.19 0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.55 1rtj h LYS 154 CO 0.64 1.13 -0.00 0.78 -2.00 0.00 0.00 179.45 180.00 1rtj h GLY 155 N 0.65 0.00 0.02 0.07 0.00 -1.94 -3.29 103.07 98.58 1rtj h GLY 155 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 1rtj h GLY 155 CO 0.10 0.00 -0.01 1.76 0.00 0.00 0.00 176.54 178.39 1rtj h SER 156 N 0.00 -0.02 0.00 0.19 0.02 -1.78 -2.48 113.55 109.48 1rtj h SER 156 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1rtj h SER 156 Cb 0.01 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1rtj h SER 156 CO 0.00 -0.01 0.05 -0.81 -1.14 0.00 0.00 176.83 174.92 1rtj n PRO 157 N -2.09 0.00 0.04 3.45 -0.04 -1.24 -1.73 135.00 133.39 1rtj n PRO 157 Ca -0.00 0.26 -0.03 0.00 -0.04 0.00 0.00 63.50 63.69 1rtj n PRO 157 Cb 0.01 -1.55 -0.02 0.00 -0.04 0.00 0.00 33.50 31.90 1rtj n PRO 157 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rtj h ALA 158 N 1.67 -0.20 -0.27 0.55 0.00 -1.59 -3.29 119.26 116.12 1rtj h ALA 158 Ca 0.00 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1rtj h ALA 158 Cb 0.11 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1rtj h ALA 158 CO 0.00 -0.19 -0.07 0.82 0.00 0.00 0.00 179.25 179.81 1rtj h ILE 159 N -1.05 1.20 -0.40 0.00 2.04 -0.88 -1.85 117.51 116.57 1rtj h ILE 159 Ca -0.02 -0.85 -0.23 0.00 1.00 0.00 0.00 64.86 64.76 1rtj h ILE 159 Cb 0.17 1.07 -0.12 0.00 -0.74 0.00 0.00 36.82 37.20 1rtj h ILE 159 CO 0.03 0.28 0.29 0.33 0.00 0.00 0.00 178.15 179.08 1rtj n PHE 160 N -4.26 1.24 -0.00 1.37 7.35 -1.08 -4.25 117.46 117.83 1rtj n PHE 160 Ca 0.01 -1.29 -0.01 0.00 -0.76 0.00 0.00 57.45 55.40 1rtj n PHE 160 Cb 0.27 -0.64 -0.01 0.00 0.35 0.00 0.00 39.48 39.46 1rtj n PHE 160 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 1rtj h GLN 161 N 0.72 -0.08 -1.08 -4.13 5.75 -1.40 -3.05 115.11 111.84 1rtj h GLN 161 Ca 0.25 0.01 0.38 0.00 -0.15 0.00 0.00 58.65 59.14 1rtj h GLN 161 Cb 1.48 0.02 -0.15 0.00 1.07 0.00 0.00 27.48 29.89 1rtj h GLN 161 CO 0.50 -0.05 0.63 0.66 -2.65 0.00 0.00 178.83 177.92 1rtj h SER 162 N -0.79 0.38 1.16 -0.69 4.64 -1.82 0.33 113.55 116.76 1rtj h SER 162 Ca -0.01 0.20 -0.17 0.00 -0.47 0.00 0.00 61.79 61.34 1rtj h SER 162 Cb 0.06 0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1rtj h SER 162 CO 0.01 -0.26 -0.85 0.28 -0.87 0.00 0.00 176.83 175.15 1rtj h SER 163 N 0.15 0.00 1.36 4.97 0.02 -1.86 -2.91 113.55 115.28 1rtj h SER 163 Ca 0.80 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.61 1rtj h SER 163 Cb 2.10 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.62 1rtj h SER 163 CO -0.62 0.78 -0.64 0.24 -1.14 0.00 0.00 176.83 175.45 1rtj h MET 164 N 0.00 0.00 0.41 3.45 2.07 -0.29 -1.62 114.93 118.96 1rtj h MET 164 Ca -0.03 0.00 -0.02 0.00 -2.07 0.00 0.00 59.70 57.58 1rtj h MET 164 Cb 1.62 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 31.35 1rtj h MET 164 CO 0.10 0.63 -0.20 1.15 1.07 0.00 0.00 176.91 179.66 1rtj h THR 165 N 0.00 0.38 -0.77 2.22 2.02 -1.28 -1.56 112.91 113.91 1rtj h THR 165 Ca -0.01 -0.60 0.14 0.00 0.77 0.00 0.00 66.41 66.71 1rtj h THR 165 Cb 1.49 0.58 -0.09 0.00 -1.74 0.00 0.00 68.15 68.39 1rtj h THR 165 CO 0.08 0.08 0.35 0.11 0.37 0.00 0.00 175.52 176.51 1rtj h LYS 166 N -0.99 0.50 -0.54 6.66 1.57 -1.51 0.61 116.57 122.87 1rtj h LYS 166 Ca -0.06 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1rtj h LYS 166 Cb 0.55 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 1rtj h LYS 166 CO 0.09 0.33 0.26 0.82 -0.57 0.00 0.00 179.45 180.39 1rtj h ILE 167 N 0.52 1.18 0.13 1.86 2.04 -1.25 -3.30 117.51 118.69 1rtj h ILE 167 Ca 0.42 -0.50 -0.36 0.00 1.00 0.00 0.00 64.86 65.42 1rtj h ILE 167 Cb 0.60 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1rtj h ILE 167 CO -0.37 0.21 -1.92 -0.07 0.00 0.00 0.00 178.15 176.00 1rtj h LEU 168 N 0.76 0.43 -0.83 1.44 3.38 0.03 -3.41 115.31 117.10 1rtj h LEU 168 Ca 0.19 -0.88 0.13 0.00 0.09 0.00 0.00 57.88 57.41 1rtj h LEU 168 Cb 0.08 -0.14 -0.14 0.00 0.09 0.00 0.00 40.66 40.55 1rtj h LEU 168 CO -0.03 1.78 -0.40 -0.33 0.09 0.00 0.00 178.44 179.55 1rtj h GLU 169 N 0.07 -0.07 0.00 1.13 4.39 -1.05 0.63 114.58 119.68 1rtj h GLU 169 Ca -0.39 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.31 1rtj h GLU 169 Cb 2.05 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.71 1rtj h GLU 169 CO 0.11 -0.05 0.39 -2.30 -1.16 0.00 0.00 179.01 176.00 1rtj n PRO 170 N -5.44 0.06 -0.04 2.33 -0.02 -1.26 0.23 135.00 130.87 1rtj n PRO 170 Ca 0.07 0.50 -0.07 0.00 -2.02 0.00 0.00 63.50 61.98 1rtj n PRO 170 Cb 0.37 -2.09 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 1rtj n PRO 170 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1rtj n PHE 171 N -1.88 0.00 0.12 6.00 7.35 0.57 -4.30 117.46 125.32 1rtj n PHE 171 Ca -0.01 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.64 1rtj n PHE 171 Cb 0.41 -0.27 -0.02 0.00 0.35 0.00 0.00 39.48 39.94 1rtj n PHE 171 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1rtj h ARG 172 N -0.17 -0.30 -0.67 -4.13 3.08 0.24 0.59 114.38 113.01 1rtj h ARG 172 Ca -0.18 0.02 0.19 0.00 0.07 0.00 0.00 59.98 60.09 1rtj h ARG 172 Cb 1.19 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 31.29 1rtj h ARG 172 CO -0.08 -0.20 0.74 0.87 -1.07 0.00 0.00 179.97 180.23 1rtj h LYS 173 N -0.31 0.00 0.02 0.04 1.79 0.26 0.30 116.57 118.67 1rtj h LYS 173 Ca -0.03 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1rtj h LYS 173 Cb 0.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 1rtj h LYS 173 CO 0.05 0.00 -0.01 0.37 -1.08 0.00 0.00 179.45 178.78 1rtj h GLN 174 N 0.00 -0.03 -4.02 3.15 5.75 -1.34 -3.42 115.11 115.21 1rtj h GLN 174 Ca 0.32 0.00 -0.77 0.00 -0.15 0.00 0.00 58.65 58.05 1rtj h GLN 174 Cb 1.80 0.01 -0.25 0.00 1.07 0.00 0.00 27.48 30.11 1rtj h GLN 174 CO -0.00 0.23 -0.14 -0.80 -2.65 0.00 0.00 178.83 175.46 1rtj s ASN 175 N -5.68 6.31 0.00 -0.69 -0.87 0.20 -4.88 114.94 109.32 1rtj s ASN 175 Ca -0.05 -2.06 0.26 0.00 -1.57 0.00 0.00 52.86 49.44 1rtj s ASN 175 Cb -0.01 -2.19 0.76 0.00 -0.02 0.00 0.00 41.25 39.79 1rtj s ASN 175 CO 0.19 -0.76 1.57 -2.65 -2.57 0.00 0.00 177.10 172.87 1rtj n PRO 176 N 4.85 0.80 -0.34 -0.60 -0.02 -1.19 -3.64 135.00 134.85 1rtj n PRO 176 Ca -0.06 -0.47 0.03 0.00 -2.02 0.00 0.00 63.50 60.99 1rtj n PRO 176 Cb 0.42 -1.49 0.16 0.00 -0.02 0.00 0.00 33.50 32.57 1rtj n PRO 176 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1rtj n ASP 177 N -0.69 2.79 -3.83 2.55 5.75 -1.26 -4.75 116.55 117.12 1rtj n ASP 177 Ca 0.12 -2.34 -0.13 0.00 -0.01 0.00 0.00 54.79 52.43 1rtj n ASP 177 Cb 0.35 -0.54 -0.14 0.00 -1.03 0.00 0.00 41.12 39.76 1rtj n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1rtj s ILE 178 N -1.70 -0.01 -0.06 2.12 1.01 -1.24 -4.47 121.20 116.84 1rtj s ILE 178 Ca 0.22 0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.93 1rtj s ILE 178 Cb 0.16 -0.11 -0.03 0.00 0.01 0.00 0.00 42.46 42.49 1rtj s ILE 178 CO 0.07 0.02 -0.08 -0.69 0.00 0.00 0.00 174.94 174.26 1rtj s VAL 179 N 0.28 3.59 -0.18 2.92 1.01 0.08 -4.97 120.40 123.13 1rtj s VAL 179 Ca -0.02 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1rtj s VAL 179 Cb -0.03 -2.46 0.04 0.00 0.00 0.00 0.00 36.38 33.92 1rtj s VAL 179 CO -0.01 0.59 -0.10 -0.63 0.00 0.00 0.00 175.10 174.95 1rtj s ILE 180 N -0.81 1.51 -0.00 2.22 1.09 -1.26 -0.77 121.20 123.19 1rtj s ILE 180 Ca 0.12 -0.86 0.07 0.00 -1.10 0.00 0.00 60.65 58.88 1rtj s ILE 180 Cb -0.11 -1.58 -0.03 0.00 -1.06 0.00 0.00 42.46 39.68 1rtj s ILE 180 CO 0.02 0.21 -0.21 -0.47 -0.10 0.00 0.00 174.94 174.39 1rtj s TYR 181 N 1.46 2.49 -0.27 3.97 5.04 0.11 -4.95 117.35 125.20 1rtj s TYR 181 Ca 0.00 -0.31 0.01 0.00 -2.44 0.00 0.00 57.07 54.34 1rtj s TYR 181 Cb -0.15 -1.51 0.06 0.00 0.35 0.00 0.00 41.96 40.70 1rtj s TYR 181 CO -0.08 0.13 -0.07 -1.14 -1.34 0.00 0.00 175.55 173.04 1rtj s GLN 182 N -0.96 2.30 -0.20 4.97 0.74 -1.26 0.41 119.66 125.65 1rtj s GLN 182 Ca 0.12 -1.33 -0.04 0.00 0.05 0.00 0.00 55.36 54.17 1rtj s GLN 182 Cb -0.10 -2.99 -0.01 0.00 1.10 0.00 0.00 33.01 31.00 1rtj s GLN 182 CO 0.02 -0.59 -0.04 -0.47 -0.55 0.00 0.00 175.29 173.65 1rtj s TYR 183 N 1.15 2.96 0.00 1.67 5.04 -0.83 -4.94 117.35 122.40 1rtj s TYR 183 Ca -0.08 -0.77 0.00 0.00 -2.44 0.00 0.00 57.07 53.79 1rtj s TYR 183 Cb -0.20 -2.06 0.00 0.00 0.35 0.00 0.00 41.96 40.05 1rtj s TYR 183 CO -0.04 -0.42 0.00 -1.33 -1.34 0.00 0.00 175.55 172.43 1rtj n MET 184 N 4.46 0.00 0.00 4.97 2.81 -1.26 -0.86 117.12 127.24 1rtj n MET 184 Ca -0.18 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 55.83 1rtj n MET 184 Cb 0.51 0.00 0.72 0.00 -0.71 0.00 0.00 33.22 33.74 1rtj n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1rtj n ASP 185 N 2.25 0.00 -4.60 7.83 8.00 -1.26 -4.75 116.55 124.02 1rtj n ASP 185 Ca 0.00 -1.15 -0.26 0.00 0.71 0.00 0.00 54.79 54.09 1rtj n ASP 185 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 1rtj n ASP 185 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1rtj s ASP 186 N -1.80 3.94 -0.15 -2.24 1.47 -0.04 -0.23 116.67 117.62 1rtj s ASP 186 Ca 0.36 -1.18 0.01 0.00 1.18 0.00 0.00 52.55 52.92 1rtj s ASP 186 Cb 0.17 -0.42 0.02 0.00 -0.34 0.00 0.00 42.92 42.35 1rtj s ASP 186 CO 0.28 -0.31 -0.15 -0.22 0.68 0.00 0.00 175.17 175.45 1rtj s LEU 187 N -3.69 1.77 -0.20 2.11 2.96 0.18 -1.96 118.68 119.85 1rtj s LEU 187 Ca 0.34 -0.51 -0.14 0.00 -0.22 0.00 0.00 54.13 53.61 1rtj s LEU 187 Cb 0.04 -1.23 -0.04 0.00 0.50 0.00 0.00 46.19 45.46 1rtj s LEU 187 CO 0.18 -0.04 0.31 -0.31 -1.32 0.00 0.00 176.35 175.17 1rtj s TYR 188 N 1.40 3.38 -0.18 5.38 2.02 0.17 -0.23 117.35 129.28 1rtj s TYR 188 Ca 0.04 0.50 -0.02 0.00 -0.37 0.00 0.00 57.07 57.22 1rtj s TYR 188 Cb -0.13 -2.41 0.05 0.00 -0.40 0.00 0.00 41.96 39.07 1rtj s TYR 188 CO -0.10 0.07 -0.00 0.08 -1.57 0.00 0.00 175.55 174.02 1rtj s VAL 189 N 1.05 0.80 0.20 0.71 1.01 -0.18 0.06 120.40 124.04 1rtj s VAL 189 Ca 0.15 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.60 1rtj s VAL 189 Cb -0.14 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.05 1rtj s VAL 189 CO 0.06 -0.05 -0.08 -0.83 0.00 0.00 0.00 175.10 174.21 1rtj s GLY 190 N 1.75 1.39 -0.16 4.51 0.00 0.05 -1.30 107.32 113.56 1rtj s GLY 190 Ca -0.00 -1.66 -0.32 0.00 0.00 0.00 0.00 44.72 42.73 1rtj s GLY 190 CO -0.07 -1.68 1.12 -1.35 0.00 0.00 0.00 173.10 171.12 1rtj s SER 191 N -3.28 -0.21 0.00 1.64 1.04 -0.91 -0.74 113.70 111.24 1rtj s SER 191 Ca 0.23 0.06 0.30 0.00 0.48 0.00 0.00 55.95 57.03 1rtj s SER 191 Cb 0.03 0.21 1.51 0.00 0.10 0.00 0.00 66.02 67.87 1rtj s SER 191 CO 0.06 -0.31 2.04 0.47 0.98 0.00 0.00 173.24 176.47 1rtj n ASP 192 N 0.06 0.13 -4.55 7.02 8.00 -1.26 -3.14 116.55 122.81 1rtj n ASP 192 Ca -0.03 -0.40 -0.39 0.00 0.71 0.00 0.00 54.79 54.67 1rtj n ASP 192 Cb 0.59 -0.18 0.03 0.00 -0.02 0.00 0.00 41.12 41.54 1rtj n ASP 192 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1rtj n LEU 193 N -1.14 2.01 -4.62 0.64 7.99 -1.26 -4.90 117.00 115.71 1rtj n LEU 193 Ca 0.16 0.87 -0.32 0.00 -0.01 0.00 0.00 56.01 56.71 1rtj n LEU 193 Cb 0.23 -1.28 0.16 0.00 -0.11 0.00 0.00 43.42 42.42 1rtj n LEU 193 CO 0.22 -2.24 0.53 -1.84 -1.51 0.00 0.00 177.39 172.55 1rtj n GLU 194 N -0.17 -0.39 -0.35 3.23 -0.00 -1.26 -4.37 120.64 117.33 1rtj n GLU 194 Ca 0.11 -0.05 -0.09 0.00 -0.00 0.00 0.00 57.16 57.13 1rtj n GLU 194 Cb 0.44 -2.27 -0.08 0.00 -0.00 0.00 0.00 31.44 29.52 1rtj n GLU 194 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 1rtj n ILE 195 N -4.06 -0.56 0.05 3.84 -5.35 -1.26 -0.23 119.36 111.79 1rtj n ILE 195 Ca 0.11 2.02 -0.12 0.00 -0.27 0.00 0.00 62.75 64.48 1rtj n ILE 195 Cb 0.52 -2.49 -0.08 0.00 -1.74 0.00 0.00 39.64 35.86 1rtj n ILE 195 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1rtj h GLY 196 N 0.00 -0.05 1.75 3.28 0.00 -1.99 -0.45 103.07 105.61 1rtj h GLY 196 Ca 0.13 0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.50 1rtj h GLY 196 CO -0.78 -0.02 0.11 1.46 0.00 0.00 0.00 176.54 177.31 1rtj h GLN 197 N -0.12 0.00 0.00 4.80 4.20 -1.43 0.71 115.11 123.27 1rtj h GLN 197 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1rtj h GLN 197 Cb 0.11 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 1rtj h GLN 197 CO 0.01 0.00 -0.21 1.25 -0.67 0.00 0.00 178.83 179.21 1rtj h HIS 198 N 0.00 0.00 -0.89 2.96 2.76 -0.07 -3.27 115.15 116.64 1rtj h HIS 198 Ca 0.03 0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.25 1rtj h HIS 198 Cb 0.24 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.15 1rtj h HIS 198 CO 0.00 0.55 0.58 0.00 -1.30 0.00 0.00 177.93 177.77 1rtj h ARG 199 N -1.00 1.04 0.17 5.26 3.08 -0.47 -2.46 114.38 120.00 1rtj h ARG 199 Ca -0.04 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1rtj h ARG 199 Cb 0.59 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 1rtj h ARG 199 CO -0.02 0.69 -0.09 1.79 -1.07 0.00 0.00 179.97 181.26 1rtj h THR 200 N 1.07 0.81 0.00 2.04 1.35 -1.06 -0.83 112.91 116.29 1rtj h THR 200 Ca 0.37 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 66.23 1rtj h THR 200 Cb 0.10 0.81 -0.00 0.00 -1.73 0.00 0.00 68.15 67.33 1rtj h THR 200 CO -0.12 0.00 -0.01 0.50 -0.25 0.00 0.00 175.52 175.64 1rtj h LYS 201 N -0.25 0.00 -0.07 4.72 1.63 -1.51 0.98 116.57 122.08 1rtj h LYS 201 Ca -0.02 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1rtj h LYS 201 Cb 0.20 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.83 1rtj h LYS 201 CO 0.03 0.01 -0.08 0.82 -3.45 0.00 0.00 179.45 176.78 1rtj h ILE 202 N 0.00 1.38 -0.09 2.00 1.08 -0.95 -0.70 117.51 120.23 1rtj h ILE 202 Ca -0.00 -1.27 0.04 0.00 -0.39 0.00 0.00 64.86 63.24 1rtj h ILE 202 Cb 0.03 2.07 -0.06 0.00 -3.07 0.00 0.00 36.82 35.79 1rtj h ILE 202 CO 0.00 0.35 -0.31 -0.08 -0.69 0.00 0.00 178.15 177.42 1rtj h GLU 203 N -0.27 -0.39 -0.51 2.37 4.57 0.53 0.45 114.58 121.32 1rtj h GLU 203 Ca 0.01 0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.32 1rtj h GLU 203 Cb 0.60 0.09 -0.10 0.00 -0.16 0.00 0.00 28.75 29.18 1rtj h GLU 203 CO 0.02 -0.26 -0.17 0.93 -1.18 0.00 0.00 179.01 178.34 1rtj h GLU 204 N -0.41 -0.05 -0.83 1.92 5.08 -0.95 0.27 114.58 119.60 1rtj h GLU 204 Ca 0.09 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.50 1rtj h GLU 204 Cb 0.54 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.74 1rtj h GLU 204 CO -0.32 -0.03 0.52 1.25 -1.00 0.00 0.00 179.01 179.43 1rtj h LEU 205 N -0.05 0.83 -1.34 1.33 7.12 0.49 -0.31 115.31 123.38 1rtj h LEU 205 Ca 0.24 0.01 -0.00 0.00 0.13 0.00 0.00 57.88 58.26 1rtj h LEU 205 Cb 0.43 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 40.36 1rtj h LEU 205 CO -0.55 0.55 0.37 0.03 -0.13 0.00 0.00 178.44 178.70 1rtj h ARG 206 N 0.97 0.81 0.33 1.25 3.08 0.31 -1.11 114.38 120.03 1rtj h ARG 206 Ca 0.35 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.32 1rtj h ARG 206 Cb 0.11 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1rtj h ARG 206 CO -0.15 0.57 -0.16 1.96 -1.07 0.00 0.00 179.97 181.12 1rtj h GLN 207 N 0.83 -0.43 -1.08 0.04 1.08 0.69 0.99 115.11 117.23 1rtj h GLN 207 Ca 0.22 0.03 0.31 0.00 -1.45 0.00 0.00 58.65 57.75 1rtj h GLN 207 Cb -0.04 0.10 -0.05 0.00 -0.05 0.00 0.00 27.48 27.44 1rtj h GLN 207 CO -0.04 -0.15 0.76 0.45 -0.95 0.00 0.00 178.83 178.90 1rtj h HIS 208 N -0.70 0.11 0.05 2.96 3.86 -0.39 0.77 115.15 121.81 1rtj h HIS 208 Ca -0.05 0.00 -0.32 0.00 -1.16 0.00 0.00 60.37 58.85 1rtj h HIS 208 Cb 0.48 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 28.89 1rtj h HIS 208 CO 0.01 0.01 -1.83 1.28 0.86 0.00 0.00 177.93 178.26 1rtj n LEU 209 N -4.28 1.61 -0.01 2.43 4.77 -0.49 -2.02 117.00 119.02 1rtj n LEU 209 Ca 0.23 0.33 -0.13 0.00 -0.03 0.00 0.00 56.01 56.42 1rtj n LEU 209 Cb 1.10 -0.37 -0.08 0.00 -2.33 0.00 0.00 43.42 41.74 1rtj n LEU 209 CO 0.38 0.58 0.70 -0.07 -1.33 0.00 0.00 177.39 177.65 1rtj h LEU 210 N 0.03 0.07 -0.84 2.23 4.07 0.74 -0.81 115.31 120.81 1rtj h LEU 210 Ca -0.34 -0.35 0.18 0.00 0.08 0.00 0.00 57.88 57.44 1rtj h LEU 210 Cb 2.02 -0.02 -0.11 0.00 1.08 0.00 0.00 40.66 43.64 1rtj h LEU 210 CO 0.08 0.41 0.36 -0.09 -1.08 0.00 0.00 178.44 178.12 1rtj h ARG 211 N -0.27 0.44 0.04 1.13 1.12 0.35 -2.73 114.38 114.46 1rtj h ARG 211 Ca 0.01 -0.03 -0.12 0.00 -1.11 0.00 0.00 59.98 58.74 1rtj h ARG 211 Cb 0.37 -0.10 0.01 0.00 -0.01 0.00 0.00 29.97 30.25 1rtj h ARG 211 CO 0.00 0.29 -0.47 -1.49 -3.11 0.00 0.00 179.97 175.19 1rtj h TRP 212 N 0.45 0.41 0.00 2.20 4.06 -1.20 -3.48 115.95 118.39 1rtj h TRP 212 Ca 0.49 -0.25 0.00 0.00 2.06 0.00 0.00 58.89 61.19 1rtj h TRP 212 Cb 0.82 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 28.95 1rtj h TRP 212 CO -0.15 1.11 0.00 0.41 -3.56 0.00 0.00 178.44 176.25 1rtj n GLY 213 N 1.28 0.00 0.00 1.49 0.00 -0.40 -5.09 105.19 102.48 1rtj n GLY 213 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1rtj n GLY 213 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1rtj n LEU 214 N 0.00 0.00 -4.72 0.99 -0.00 -0.68 -4.68 117.00 107.91 1rtj n LEU 214 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.68 1rtj n LEU 214 Cb 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 43.42 43.53 1rtj n LEU 214 CO 0.00 0.00 0.75 -0.89 -0.00 0.00 0.00 177.39 177.25 1rtj s THR 215 N 0.00 2.45 -0.69 1.47 2.01 -1.26 -2.88 115.64 116.74 1rtj s THR 215 Ca 0.00 0.19 0.05 0.00 0.31 0.00 0.00 61.69 62.24 1rtj s THR 215 Cb 0.00 -2.62 0.27 0.00 0.01 0.00 0.00 72.50 70.16 1rtj s THR 215 CO 0.00 -0.15 0.88 0.41 -0.69 0.00 0.00 174.62 175.08 1rtj n THR 216 N -3.14 2.89 -2.64 -0.82 -1.04 -1.26 -4.74 114.28 103.54 1rtj n THR 216 Ca 0.12 -5.38 -0.43 0.00 -2.04 0.00 0.00 64.05 56.33 1rtj n THR 216 Cb 0.51 -1.98 -0.02 0.00 -1.82 0.00 0.00 70.33 67.02 1rtj n THR 216 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1rtj s PRO 217 N -2.72 4.38 0.03 -2.82 0.02 -1.22 -4.77 135.00 127.90 1rtj s PRO 217 Ca 0.40 1.44 0.00 0.00 0.02 0.00 0.00 61.00 62.86 1rtj s PRO 217 Cb 0.16 -3.57 0.00 0.00 0.02 0.00 0.00 34.50 31.11 1rtj s PRO 217 CO -0.02 -0.39 0.00 0.41 -0.33 0.00 0.00 177.00 176.67 1rtj n GLY 231 N 3.19 0.00 2.74 0.52 0.00 -1.26 -3.98 105.19 106.40 1rtj n GLY 231 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 1rtj n GLY 231 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1rtj s TYR 232 N -0.12 0.25 0.17 1.61 6.14 -1.26 -5.10 117.35 119.05 1rtj s TYR 232 Ca 0.00 0.09 -0.11 0.00 0.64 0.00 0.00 57.07 57.69 1rtj s TYR 232 Cb 0.00 -0.51 0.00 0.00 0.42 0.00 0.00 41.96 41.88 1rtj s TYR 232 CO 0.00 -0.19 0.35 -1.21 0.64 0.00 0.00 175.55 175.13 1rtj s GLU 233 N 1.73 1.21 0.89 4.97 8.01 -1.26 -5.03 118.70 129.22 1rtj s GLU 233 Ca -0.00 -1.08 -0.14 0.00 0.01 0.00 0.00 54.97 53.76 1rtj s GLU 233 Cb -0.13 0.42 0.14 0.00 -4.31 0.00 0.00 34.13 30.25 1rtj s GLU 233 CO -0.03 -0.46 1.21 -0.51 0.01 0.00 0.00 175.26 175.47 1rtj s LEU 234 N -2.94 2.36 -0.41 1.80 1.02 0.20 -4.90 118.68 115.81 1rtj s LEU 234 Ca 0.15 0.67 0.09 0.00 0.02 0.00 0.00 54.13 55.06 1rtj s LEU 234 Cb 0.02 -2.97 0.34 0.00 0.02 0.00 0.00 46.19 43.61 1rtj s LEU 234 CO -0.01 -2.39 0.93 1.41 0.02 0.00 0.00 176.35 176.31 1rtj n HIS 235 N -3.61 -1.23 0.22 0.29 8.25 -1.26 -3.15 115.22 114.73 1rtj n HIS 235 Ca 0.10 -2.99 0.06 0.00 -0.26 0.00 0.00 57.72 54.64 1rtj n HIS 235 Cb 0.60 0.55 0.33 0.00 1.12 0.00 0.00 29.99 32.60 1rtj n HIS 235 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1rtj h PRO 236 N 2.97 0.00 -0.11 -0.41 0.11 -1.81 0.18 132.00 132.93 1rtj h PRO 236 Ca -0.01 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.96 1rtj h PRO 236 Cb 1.04 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1rtj h PRO 236 CO 0.32 0.00 -0.58 0.38 -0.21 0.00 0.00 178.00 177.91 1rtj h ASP 237 N 0.00 0.40 1.36 -2.05 2.03 -1.72 -3.30 116.42 113.15 1rtj h ASP 237 Ca 0.00 -0.22 0.00 0.00 -0.73 0.00 0.00 57.03 56.08 1rtj h ASP 237 Cb 0.97 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 39.36 1rtj h ASP 237 CO 0.00 0.89 -0.39 0.07 -1.03 0.00 0.00 179.24 178.77 1rtj h LYS 238 N 0.27 0.00 -5.68 4.15 2.10 -1.01 -3.45 116.57 112.96 1rtj h LYS 238 Ca -0.00 0.00 -0.30 0.00 -2.00 0.00 0.00 60.65 58.35 1rtj h LYS 238 Cb 1.09 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.39 1rtj h LYS 238 CO 0.10 0.00 0.85 -1.58 -2.00 0.00 0.00 179.45 176.82 1rtj s TRP 239 N -3.21 1.51 -0.16 0.07 0.51 -1.24 -4.94 118.94 111.48 1rtj s TRP 239 Ca 0.06 1.12 -0.18 0.00 -2.12 0.00 0.00 56.10 54.98 1rtj s TRP 239 Cb 0.10 -3.85 -0.04 0.00 -0.81 0.00 0.00 33.47 28.87 1rtj s TRP 239 CO 0.70 -1.95 0.46 0.99 -0.51 0.00 0.00 176.95 176.63 1rtj s THR 240 N 11.25 5.17 -0.33 2.01 2.01 -1.26 -5.03 115.64 129.47 1rtj s THR 240 Ca 0.79 0.89 -0.29 0.00 0.31 0.00 0.00 61.69 63.38 1rtj s THR 240 Cb -0.11 -3.80 0.01 0.00 0.01 0.00 0.00 72.50 68.61 1rtj s THR 240 CO 0.10 0.28 1.29 0.68 -0.69 0.00 0.00 174.62 176.27 1rtj s VAL 241 N 1.01 4.14 0.39 3.82 -7.23 -1.26 -4.99 120.40 116.29 1rtj s VAL 241 Ca 0.24 1.27 -0.20 0.00 -1.81 0.00 0.00 61.98 61.48 1rtj s VAL 241 Cb -0.15 -4.22 -0.10 0.00 0.56 0.00 0.00 36.38 32.47 1rtj s VAL 241 CO 0.09 -0.55 0.89 -1.10 -0.31 0.00 0.00 175.10 174.13 1rtj s GLN 242 N 4.24 4.20 0.05 4.82 -1.52 -1.26 -5.05 119.66 125.14 1rtj s GLN 242 Ca 0.55 1.02 -0.05 0.00 -1.95 0.00 0.00 55.36 54.93 1rtj s GLN 242 Cb -0.15 -2.29 -0.05 0.00 -0.22 0.00 0.00 33.01 30.30 1rtj s GLN 242 CO 0.24 0.04 0.29 -1.25 -0.25 0.00 0.00 175.29 174.37 1rtj s PRO 243 N -3.05 3.58 0.21 2.91 0.04 -1.26 -4.87 135.00 132.56 1rtj s PRO 243 Ca 0.59 -0.12 -0.30 0.00 0.04 0.00 0.00 61.00 61.21 1rtj s PRO 243 Cb -0.10 -3.01 -0.09 0.00 0.04 0.00 0.00 34.50 31.35 1rtj s PRO 243 CO 0.15 0.59 1.21 0.42 0.04 0.00 0.00 177.00 179.41 1rtj s ILE 244 N -1.43 3.44 -0.17 0.56 -1.09 -1.26 0.39 121.20 121.64 1rtj s ILE 244 Ca 0.32 1.25 -0.00 0.00 -2.23 0.00 0.00 60.65 59.99 1rtj s ILE 244 Cb -0.13 -3.80 0.04 0.00 -1.58 0.00 0.00 42.46 37.00 1rtj s ILE 244 CO 0.20 0.22 -0.05 0.68 -1.23 0.00 0.00 174.94 174.76 1rtj s VAL 245 N -0.26 1.13 0.59 2.92 -7.23 -1.03 -4.81 120.40 111.71 1rtj s VAL 245 Ca 0.52 -0.69 -0.19 0.00 -1.81 0.00 0.00 61.98 59.81 1rtj s VAL 245 Cb -0.34 -1.33 -0.04 0.00 0.56 0.00 0.00 36.38 35.23 1rtj s VAL 245 CO 0.39 0.09 1.18 -0.76 -0.31 0.00 0.00 175.10 175.69 1rtj s LEU 246 N 1.62 3.66 0.80 1.32 1.43 -1.26 -4.80 118.68 121.45 1rtj s LEU 246 Ca -0.00 2.31 -0.13 0.00 -1.03 0.00 0.00 54.13 55.28 1rtj s LEU 246 Cb -0.16 -4.59 0.08 0.00 0.03 0.00 0.00 46.19 41.55 1rtj s LEU 246 CO -0.08 -1.52 1.20 -2.84 0.23 0.00 0.00 176.35 173.34 1rtj s PRO 247 N -3.38 1.67 -0.41 1.29 0.02 -1.26 -5.02 135.00 127.92 1rtj s PRO 247 Ca 0.75 1.72 0.09 0.00 0.02 0.00 0.00 61.00 63.58 1rtj s PRO 247 Cb -0.28 -1.78 0.30 0.00 0.02 0.00 0.00 34.50 32.75 1rtj s PRO 247 CO 0.32 -2.18 0.77 -1.91 -0.33 0.00 0.00 177.00 173.68 1rtj n GLU 248 N -3.31 0.87 -1.89 5.54 4.07 -1.26 -5.12 120.64 119.55 1rtj n GLU 248 Ca 0.13 -2.78 -0.33 0.00 -0.06 0.00 0.00 57.16 54.13 1rtj n GLU 248 Cb 0.51 -1.39 0.03 0.00 -0.06 0.00 0.00 31.44 30.52 1rtj n GLU 248 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 1rtj s LYS 249 N -1.03 3.09 0.32 5.31 0.00 -1.26 -4.93 119.74 121.24 1rtj s LYS 249 Ca 0.34 1.24 0.04 0.00 0.00 0.00 0.00 55.97 57.58 1rtj s LYS 249 Cb 0.27 -2.00 0.55 0.00 0.00 0.00 0.00 37.83 36.65 1rtj s LYS 249 CO -0.11 -1.00 1.83 0.38 0.00 0.00 0.00 175.35 176.45 1rtj h ASP 250 N 0.16 0.47 -3.79 0.03 2.03 -2.05 -3.43 116.42 109.83 1rtj h ASP 250 Ca -0.46 -0.11 -0.40 0.00 -0.73 0.00 0.00 57.03 55.32 1rtj h ASP 250 Cb 1.23 -0.12 -0.31 0.00 -0.83 0.00 0.00 39.33 39.30 1rtj h ASP 250 CO 0.56 0.60 -0.78 -0.94 -1.03 0.00 0.00 179.24 177.66 1rtj s SER 251 N -6.77 1.04 0.13 4.15 1.04 -1.26 -5.09 113.70 106.94 1rtj s SER 251 Ca -0.07 -0.16 0.06 0.00 0.48 0.00 0.00 55.95 56.26 1rtj s SER 251 Cb 0.15 -0.28 -0.04 0.00 0.10 0.00 0.00 66.02 65.95 1rtj s SER 251 CO 0.77 0.05 0.02 0.26 0.98 0.00 0.00 173.24 175.31 1rtj s TRP 252 N 0.23 2.96 0.39 5.02 0.52 -1.26 -5.05 118.94 121.74 1rtj s TRP 252 Ca -0.03 -0.06 0.08 0.00 0.02 0.00 0.00 56.10 56.10 1rtj s TRP 252 Cb -0.08 -1.48 -0.05 0.00 -1.15 0.00 0.00 33.47 30.71 1rtj s TRP 252 CO 0.00 0.50 0.18 0.95 0.02 0.00 0.00 176.95 178.60 1rtj s THR 253 N -1.50 2.55 0.35 2.01 -4.23 -1.26 -2.18 115.64 111.38 1rtj s THR 253 Ca 0.27 -1.68 0.06 0.00 -1.18 0.00 0.00 61.69 59.16 1rtj s THR 253 Cb -0.11 -2.98 0.30 0.00 1.34 0.00 0.00 72.50 71.06 1rtj s THR 253 CO 0.19 -0.06 1.91 0.58 -0.54 0.00 0.00 174.62 176.70 1rtj h VAL 254 N 1.44 0.95 -0.16 2.29 2.07 -1.10 0.14 116.25 121.88 1rtj h VAL 254 Ca -0.43 -0.27 -0.20 0.00 0.82 0.00 0.00 66.70 66.63 1rtj h VAL 254 Cb 1.25 0.11 0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1rtj h VAL 254 CO 0.67 0.14 -0.67 -1.13 0.02 0.00 0.00 177.57 176.59 1rtj h ASN 255 N 0.78 0.88 -0.27 0.57 -0.00 -1.76 -0.68 115.58 115.09 1rtj h ASN 255 Ca 0.38 -0.62 0.03 0.00 -0.00 0.00 0.00 56.30 56.10 1rtj h ASN 255 Cb 0.44 -0.26 -0.03 0.00 -0.00 0.00 0.00 38.32 38.48 1rtj h ASN 255 CO -0.15 1.35 0.09 0.44 -0.00 0.00 0.00 177.43 179.16 1rtj h ASP 256 N 0.46 0.10 -0.51 1.15 3.32 -1.35 0.22 116.42 119.81 1rtj h ASP 256 Ca -0.04 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1rtj h ASP 256 Cb 1.30 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 1rtj h ASP 256 CO 0.14 0.09 0.18 0.40 -1.72 0.00 0.00 179.24 178.34 1rtj h ILE 257 N 0.22 1.22 -0.20 0.35 1.08 -1.08 -0.60 117.51 118.49 1rtj h ILE 257 Ca 0.12 -0.72 -0.04 0.00 -0.39 0.00 0.00 64.86 63.83 1rtj h ILE 257 Cb 0.09 0.73 -0.01 0.00 -3.07 0.00 0.00 36.82 34.55 1rtj h ILE 257 CO -0.12 0.27 -0.05 1.56 -0.69 0.00 0.00 178.15 179.11 1rtj h GLN 258 N 0.70 0.31 0.19 2.37 4.20 -0.29 0.11 115.11 122.69 1rtj h GLN 258 Ca 0.17 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 1rtj h GLN 258 Cb 0.23 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1rtj h GLN 258 CO -0.01 0.38 -0.09 0.87 -0.67 0.00 0.00 178.83 179.31 1rtj h LYS 259 N 0.30 -0.24 -0.80 1.46 1.57 -0.33 -2.96 116.57 115.56 1rtj h LYS 259 Ca 0.07 0.02 0.18 0.00 -1.87 0.00 0.00 60.65 59.05 1rtj h LYS 259 Cb 0.29 0.06 -0.14 0.00 0.08 0.00 0.00 32.23 32.51 1rtj h LYS 259 CO 0.01 0.13 -0.04 1.25 -0.57 0.00 0.00 179.45 180.22 1rtj h LEU 260 N -0.93 -0.47 -1.52 2.94 5.85 -0.91 0.33 115.31 120.60 1rtj h LEU 260 Ca -0.03 0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 1rtj h LEU 260 Cb 0.48 0.40 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 1rtj h LEU 260 CO 0.04 -0.23 -0.02 0.58 -0.34 0.00 0.00 178.44 178.47 1rtj h VAL 261 N 0.06 1.14 -0.04 1.05 2.07 -0.85 -1.78 116.25 117.91 1rtj h VAL 261 Ca 0.43 -0.55 -0.16 0.00 0.82 0.00 0.00 66.70 67.25 1rtj h VAL 261 Cb 0.76 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1rtj h VAL 261 CO -0.74 0.18 -0.68 1.23 0.02 0.00 0.00 177.57 177.58 1rtj h GLY 262 N 0.60 0.21 0.46 2.17 0.00 -0.75 -2.50 103.07 103.26 1rtj h GLY 262 Ca 0.06 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1rtj h GLY 262 CO 0.01 0.25 -0.09 0.50 0.00 0.00 0.00 176.54 177.21 1rtj h LYS 263 N 0.13 -0.25 -0.50 4.80 1.57 -1.33 -2.85 116.57 118.13 1rtj h LYS 263 Ca -0.02 0.02 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 1rtj h LYS 263 Cb 1.22 0.06 -0.08 0.00 0.08 0.00 0.00 32.23 33.50 1rtj h LYS 263 CO 0.10 0.15 0.03 -0.07 -0.57 0.00 0.00 179.45 179.09 1rtj h LEU 264 N -0.80 -0.16 -1.71 2.94 3.38 -1.40 0.21 115.31 117.77 1rtj h LEU 264 Ca -0.03 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1rtj h LEU 264 Cb 0.52 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1rtj h LEU 264 CO 0.04 -0.05 0.00 -1.13 0.09 0.00 0.00 178.44 177.39 1rtj h ASN 265 N 0.15 0.00 0.09 -0.43 -1.24 -1.49 -1.98 115.58 110.67 1rtj h ASN 265 Ca 0.26 0.00 -0.33 0.00 0.71 0.00 0.00 56.30 56.93 1rtj h ASN 265 Cb 0.38 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.40 1rtj h ASN 265 CO -0.40 0.00 -1.84 1.87 -1.29 0.00 0.00 177.43 175.77 1rtj n TRP 266 N -2.62 1.13 0.21 0.67 -0.00 0.46 -4.05 117.44 113.24 1rtj n TRP 266 Ca -0.01 0.30 0.14 0.00 -0.00 0.00 0.00 57.50 57.93 1rtj n TRP 266 Cb 0.13 -1.14 0.76 0.00 -0.00 0.00 0.00 31.31 31.07 1rtj n TRP 266 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1rtj h ALA 267 N -0.10 1.92 0.00 5.87 0.00 -0.07 -1.69 119.26 125.20 1rtj h ALA 267 Ca -0.42 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1rtj h ALA 267 Cb 1.83 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1rtj h ALA 267 CO -0.01 -0.19 0.00 -1.13 0.00 0.00 0.00 179.25 177.93 1rtj n SER 268 N -4.16 0.00 0.15 0.00 3.41 -0.82 0.37 113.62 112.57 1rtj n SER 268 Ca 0.00 -0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.73 1rtj n SER 268 Cb 0.24 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.25 1rtj n SER 268 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1rtj h GLN 269 N 0.00 0.00 0.00 4.33 4.20 -1.57 -3.32 115.11 118.76 1rtj h GLN 269 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1rtj h GLN 269 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1rtj h GLN 269 CO 0.00 0.01 -0.01 -0.89 -0.67 0.00 0.00 178.83 177.27 1rtj n ILE 270 N -2.85 0.02 -3.18 2.54 5.41 0.16 -4.82 119.36 116.64 1rtj n ILE 270 Ca 0.01 0.49 -0.46 0.00 1.00 0.00 0.00 62.75 63.80 1rtj n ILE 270 Cb 0.55 -1.51 -0.03 0.00 -0.71 0.00 0.00 39.64 37.94 1rtj n ILE 270 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1rtj s TYR 271 N -1.03 3.40 -1.02 1.39 1.51 -1.02 -4.95 117.35 115.64 1rtj s TYR 271 Ca -0.00 -1.58 0.00 0.00 -1.01 0.00 0.00 57.07 54.48 1rtj s TYR 271 Cb 0.00 -3.98 0.00 0.00 -0.11 0.00 0.00 41.96 37.87 1rtj s TYR 271 CO 0.01 -1.19 0.82 -2.30 -1.11 0.00 0.00 175.55 171.78 1rtj n PRO 272 N 5.21 0.00 -0.19 -1.71 -0.02 -1.25 -1.51 135.00 135.53 1rtj n PRO 272 Ca 0.10 0.33 0.07 0.00 -2.02 0.00 0.00 63.50 61.98 1rtj n PRO 272 Cb 0.46 -1.56 0.19 0.00 -0.02 0.00 0.00 33.50 32.57 1rtj n PRO 272 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rtj n GLY 273 N -1.32 0.82 3.67 -1.23 0.00 -1.26 -4.80 105.19 101.07 1rtj n GLY 273 Ca 0.00 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 1rtj n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rtj s ILE 274 N -1.49 4.21 -0.07 -0.61 -1.09 -0.57 -4.89 121.20 116.69 1rtj s ILE 274 Ca 0.27 1.49 0.05 0.00 -2.23 0.00 0.00 60.65 60.23 1rtj s ILE 274 Cb 0.14 -3.96 -0.01 0.00 -1.58 0.00 0.00 42.46 37.04 1rtj s ILE 274 CO 0.19 -0.09 -0.22 -0.54 -1.23 0.00 0.00 174.94 173.05 1rtj s LYS 275 N 3.12 2.68 0.00 2.79 -0.14 -1.26 -4.83 119.74 122.10 1rtj s LYS 275 Ca 0.56 -0.84 0.00 0.00 -1.36 0.00 0.00 55.97 54.33 1rtj s LYS 275 Cb -0.24 -2.26 0.00 0.00 -1.68 0.00 0.00 37.83 33.65 1rtj s LYS 275 CO 0.18 0.38 0.80 1.55 -0.76 0.00 0.00 175.35 177.50 1rtj n VAL 276 N 2.96 0.63 0.47 3.17 3.14 -1.26 -4.87 118.33 122.57 1rtj n VAL 276 Ca -0.18 -0.67 -0.20 0.00 -2.96 0.00 0.00 64.34 60.34 1rtj n VAL 276 Cb 0.52 0.72 -0.10 0.00 -1.06 0.00 0.00 33.84 33.93 1rtj n VAL 276 CO 0.00 0.00 0.00 0.03 -6.46 0.00 0.00 176.83 170.40 1rtj h ARG 277 N 0.00 -1.13 0.00 1.45 3.08 -1.98 0.01 114.38 115.81 1rtj h ARG 277 Ca 0.00 0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1rtj h ARG 277 Cb 0.58 0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.89 1rtj h ARG 277 CO 0.00 -0.76 0.00 1.04 -1.07 0.00 0.00 179.97 179.18 1rtj n GLN 278 N -5.60 0.03 -0.13 0.04 1.13 -1.26 -1.75 117.38 109.84 1rtj n GLN 278 Ca -0.16 0.23 -0.27 0.00 -1.94 0.00 0.00 57.00 54.86 1rtj n GLN 278 Cb 0.47 -1.50 -0.09 0.00 0.11 0.00 0.00 30.24 29.23 1rtj n GLN 278 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1rtj n LEU 279 N -1.24 1.96 -0.03 1.08 4.77 -0.96 -4.11 117.00 118.47 1rtj n LEU 279 Ca 0.01 0.34 0.24 0.00 -0.03 0.00 0.00 56.01 56.57 1rtj n LEU 279 Cb 0.01 -0.81 0.71 0.00 -2.33 0.00 0.00 43.42 41.01 1rtj n LEU 279 CO 0.01 0.47 1.22 0.00 -1.33 0.00 0.00 177.39 177.75 1rtj h LYS 281 N 0.00 0.25 0.00 0.00 1.79 -1.53 -1.89 116.57 115.19 1rtj h LYS 281 Ca 0.30 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.73 1rtj h LYS 281 Cb 1.45 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 32.05 1rtj h LYS 281 CO -0.00 0.28 0.00 1.28 -1.08 0.00 0.00 179.45 179.93 1rtj n LEU 282 N -4.89 0.47 -0.51 2.94 4.77 0.25 -1.98 117.00 118.05 1rtj n LEU 282 Ca -0.04 0.70 0.09 0.00 -0.03 0.00 0.00 56.01 56.73 1rtj n LEU 282 Cb 0.09 -0.74 0.34 0.00 -2.33 0.00 0.00 43.42 40.79 1rtj n LEU 282 CO 0.34 -0.81 0.75 0.18 -1.33 0.00 0.00 177.39 176.52 1rtj n LEU 283 N -2.11 1.51 -4.69 2.23 4.32 -0.71 -4.87 117.00 112.69 1rtj n LEU 283 Ca -0.01 -0.66 -0.39 0.00 -0.02 0.00 0.00 56.01 54.94 1rtj n LEU 283 Cb 0.06 -0.12 -0.06 0.00 -1.62 0.00 0.00 43.42 41.68 1rtj n LEU 283 CO 0.09 0.33 0.21 -0.13 -1.22 0.00 0.00 177.39 176.68 1rtj s ARG 284 N -1.77 4.25 0.00 3.23 0.52 -0.84 -4.90 118.95 119.44 1rtj s ARG 284 Ca 0.30 0.42 0.00 0.00 -0.52 0.00 0.00 55.73 55.93 1rtj s ARG 284 Cb 0.16 -3.51 0.00 0.00 0.52 0.00 0.00 34.95 32.11 1rtj s ARG 284 CO 0.23 -0.03 0.00 0.41 0.02 0.00 0.00 175.30 175.93 1rtj n GLY 285 N 3.65 4.14 3.49 -3.53 0.00 -1.26 -4.98 105.19 106.71 1rtj n GLY 285 Ca -0.06 -1.36 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 1rtj n GLY 285 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rtj s THR 286 N -1.44 4.61 0.35 2.61 -4.23 -1.26 -5.00 115.64 111.28 1rtj s THR 286 Ca 0.00 -1.89 0.08 0.00 -1.18 0.00 0.00 61.69 58.70 1rtj s THR 286 Cb 0.00 -4.94 -0.04 0.00 1.34 0.00 0.00 72.50 68.86 1rtj s THR 286 CO 0.00 -1.70 0.18 -0.54 -0.54 0.00 0.00 174.62 172.02 1rtj s LYS 287 N 2.89 2.43 -0.01 3.99 1.02 -1.26 -5.04 119.74 123.76 1rtj s LYS 287 Ca 0.42 -1.52 -0.33 0.00 0.02 0.00 0.00 55.97 54.56 1rtj s LYS 287 Cb -0.02 -2.23 -0.11 0.00 -0.52 0.00 0.00 37.83 34.95 1rtj s LYS 287 CO -0.03 0.08 1.86 0.00 -0.92 0.00 0.00 175.35 176.34 1rtj n ALA 288 N -1.21 1.23 -0.31 5.17 0.00 -1.26 -4.74 120.51 119.38 1rtj n ALA 288 Ca -0.02 0.29 0.35 0.00 0.00 0.00 0.00 53.44 54.05 1rtj n ALA 288 Cb 0.61 -2.53 0.75 0.00 0.00 0.00 0.00 19.45 18.28 1rtj n ALA 288 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1rtj h LEU 289 N 9.06 0.00 -0.26 0.00 5.85 -1.98 0.71 115.31 128.68 1rtj h LEU 289 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1rtj h LEU 289 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1rtj h LEU 289 CO 0.94 0.00 -0.06 0.35 -0.34 0.00 0.00 178.44 179.33 1rtj n THR 290 N -4.14 0.00 -2.11 1.05 -2.24 -1.26 -2.45 114.28 103.13 1rtj n THR 290 Ca 0.25 -0.07 -0.41 0.00 -2.27 0.00 0.00 64.05 61.55 1rtj n THR 290 Cb 1.24 -0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 69.30 1rtj n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1rtj s GLU 291 N -2.29 4.35 0.18 -0.78 2.56 0.25 -4.83 118.70 118.14 1rtj s GLU 291 Ca 0.35 2.22 -0.12 0.00 0.00 0.00 0.00 54.97 57.42 1rtj s GLU 291 Cb 0.21 -3.08 -0.07 0.00 2.00 0.00 0.00 34.13 33.19 1rtj s GLU 291 CO 0.43 -0.20 0.55 0.08 -0.56 0.00 0.00 175.26 175.55 1rtj s VAL 292 N -1.04 4.89 -0.05 3.70 1.01 -1.26 -1.00 120.40 126.65 1rtj s VAL 292 Ca 0.50 0.68 -0.04 0.00 0.00 0.00 0.00 61.98 63.12 1rtj s VAL 292 Cb -0.40 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.32 1rtj s VAL 292 CO 0.52 0.11 0.13 -0.63 0.00 0.00 0.00 175.10 175.22 1rtj s ILE 293 N -1.62 -0.01 0.51 2.22 1.01 -0.93 -4.92 121.20 117.47 1rtj s ILE 293 Ca 0.42 0.03 -0.17 0.00 0.00 0.00 0.00 60.65 60.93 1rtj s ILE 293 Cb -0.13 -0.19 -0.08 0.00 0.01 0.00 0.00 42.46 42.07 1rtj s ILE 293 CO 0.20 0.01 0.99 -2.84 0.00 0.00 0.00 174.94 173.30 1rtj s PRO 294 N 0.24 3.94 -0.08 2.79 0.02 -1.26 -4.29 135.00 136.35 1rtj s PRO 294 Ca -0.01 1.00 -0.20 0.00 0.02 0.00 0.00 61.00 61.80 1rtj s PRO 294 Cb -0.03 -2.13 -0.04 0.00 0.02 0.00 0.00 34.50 32.32 1rtj s PRO 294 CO -0.01 -0.28 0.58 -0.51 -0.33 0.00 0.00 177.00 176.45 1rtj s LEU 295 N -3.98 4.31 0.39 -5.54 1.43 -1.26 -5.05 118.68 108.98 1rtj s LEU 295 Ca 0.60 1.00 -0.27 0.00 -1.03 0.00 0.00 54.13 54.43 1rtj s LEU 295 Cb -0.10 -2.87 -0.09 0.00 0.03 0.00 0.00 46.19 43.15 1rtj s LEU 295 CO 0.29 -0.03 1.32 0.42 0.23 0.00 0.00 176.35 178.59 1rtj s THR 296 N 0.56 2.58 0.67 5.49 -4.23 -1.26 -4.77 115.64 114.68 1rtj s THR 296 Ca 0.31 0.54 0.40 0.00 -1.18 0.00 0.00 61.69 61.76 1rtj s THR 296 Cb -0.17 -3.33 0.40 0.00 1.34 0.00 0.00 72.50 70.75 1rtj s THR 296 CO 0.14 0.09 2.23 -0.08 -0.54 0.00 0.00 174.62 176.47 1rtj h GLU 297 N 2.85 0.00 0.01 3.99 4.57 -1.97 0.58 114.58 124.61 1rtj h GLU 297 Ca -0.50 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1rtj h GLU 297 Cb 1.24 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.83 1rtj h GLU 297 CO 0.63 0.00 -0.01 0.93 -1.18 0.00 0.00 179.01 179.39 1rtj h GLU 298 N 0.00 -0.02 -0.88 1.92 3.07 -1.94 -2.59 114.58 114.14 1rtj h GLU 298 Ca 0.00 0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.97 1rtj h GLU 298 Cb 0.21 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.06 1rtj h GLU 298 CO -0.00 0.68 0.57 0.00 -1.40 0.00 0.00 179.01 178.86 1rtj h ALA 299 N -0.24 1.67 -0.46 3.43 0.00 -1.19 0.36 119.26 122.83 1rtj h ALA 299 Ca -0.00 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1rtj h ALA 299 Cb 0.70 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 1rtj h ALA 299 CO 0.00 0.14 0.13 1.49 0.00 0.00 0.00 179.25 181.01 1rtj h GLU 300 N 0.84 0.27 0.02 0.00 4.57 0.06 -1.74 114.58 118.60 1rtj h GLU 300 Ca 0.41 -0.02 -0.21 0.00 -1.18 0.00 0.00 59.36 58.37 1rtj h GLU 300 Cb 0.46 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 1rtj h GLU 300 CO -0.18 0.18 -0.96 1.25 -1.18 0.00 0.00 179.01 178.12 1rtj h LEU 301 N 0.28 0.11 -1.26 1.64 5.85 -0.95 -3.17 115.31 117.80 1rtj h LEU 301 Ca 0.22 -0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.91 1rtj h LEU 301 Cb 0.26 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 1rtj h LEU 301 CO -0.26 1.00 0.54 -0.08 -0.34 0.00 0.00 178.44 179.30 1rtj h GLU 302 N 0.03 0.85 0.34 1.25 4.81 -0.26 1.10 114.58 122.70 1rtj h GLU 302 Ca -0.03 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1rtj h GLU 302 Cb 1.65 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.84 1rtj h GLU 302 CO 0.13 0.56 -0.16 -0.07 -0.73 0.00 0.00 179.01 178.75 1rtj h LEU 303 N 0.88 -0.38 -0.82 1.64 3.38 -1.40 -1.05 115.31 117.56 1rtj h LEU 303 Ca 0.36 -0.15 0.11 0.00 0.09 0.00 0.00 57.88 58.28 1rtj h LEU 303 Cb 0.27 0.10 -0.13 0.00 0.09 0.00 0.00 40.66 40.99 1rtj h LEU 303 CO -0.13 -0.03 -0.46 0.00 0.09 0.00 0.00 178.44 177.92 1rtj h ALA 304 N -0.27 -0.22 0.00 1.53 0.00 -1.33 0.76 119.26 119.74 1rtj h ALA 304 Ca -0.05 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1rtj h ALA 304 Cb 0.51 1.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 1rtj h ALA 304 CO 0.08 -0.79 -0.14 0.93 0.00 0.00 0.00 179.25 179.32 1rtj h GLU 305 N -0.10 0.00 0.01 0.00 5.08 0.13 -1.66 114.58 118.05 1rtj h GLU 305 Ca 0.23 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.38 1rtj h GLU 305 Cb 0.54 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.81 1rtj h GLU 305 CO -0.85 0.14 -0.84 -0.91 -1.00 0.00 0.00 179.01 175.55 1rtj h ASN 306 N 0.00 0.72 -0.52 1.42 2.35 0.13 -2.41 115.58 117.27 1rtj h ASN 306 Ca -0.00 -0.76 -0.01 0.00 -0.55 0.00 0.00 56.30 54.98 1rtj h ASN 306 Cb 0.32 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 1rtj h ASN 306 CO 0.02 1.39 0.30 0.03 -1.65 0.00 0.00 177.43 177.52 1rtj h ARG 307 N 0.12 0.73 0.07 0.81 3.08 0.80 -1.75 114.38 118.24 1rtj h ARG 307 Ca -0.11 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.87 1rtj h ARG 307 Cb 1.53 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.43 1rtj h ARG 307 CO 0.16 0.53 -0.03 1.49 -1.07 0.00 0.00 179.97 181.06 1rtj h GLU 308 N 0.74 -0.09 -0.99 0.04 4.57 -1.33 -2.44 114.58 115.09 1rtj h GLU 308 Ca 0.19 0.01 0.12 0.00 -1.18 0.00 0.00 59.36 58.50 1rtj h GLU 308 Cb 0.01 0.02 -0.08 0.00 -0.16 0.00 0.00 28.75 28.53 1rtj h GLU 308 CO -0.03 0.29 0.62 0.82 -1.18 0.00 0.00 179.01 179.53 1rtj h ILE 309 N -0.48 0.91 0.00 2.32 2.04 -1.03 -1.64 117.51 119.63 1rtj h ILE 309 Ca -0.01 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1rtj h ILE 309 Cb 0.42 -0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.37 1rtj h ILE 309 CO 0.02 0.17 0.00 0.18 0.00 0.00 0.00 178.15 178.52 1rtj n LEU 310 N -4.61 0.49 0.00 1.44 4.77 -0.69 -3.75 117.00 114.65 1rtj n LEU 310 Ca 0.19 0.61 0.03 0.00 -0.03 0.00 0.00 56.01 56.80 1rtj n LEU 310 Cb 0.37 -0.52 0.16 0.00 -2.33 0.00 0.00 43.42 41.09 1rtj n LEU 310 CO 0.28 -0.41 0.40 0.29 -1.33 0.00 0.00 177.39 176.62 1rtj n LYS 311 N -2.03 0.53 -3.45 3.23 5.02 -0.62 -4.30 118.16 116.54 1rtj n LYS 311 Ca 0.03 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.21 1rtj n LYS 311 Cb 0.25 -1.16 -0.02 0.00 -0.02 0.00 0.00 35.03 34.08 1rtj n LYS 311 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1rtj s GLU 312 N -2.00 1.18 0.47 1.97 2.02 -1.25 -5.04 118.70 116.05 1rtj s GLU 312 Ca 0.08 -0.44 -0.22 0.00 0.02 0.00 0.00 54.97 54.41 1rtj s GLU 312 Cb 0.04 0.54 -0.08 0.00 0.10 0.00 0.00 34.13 34.73 1rtj s GLU 312 CO 0.06 -0.52 1.11 -1.25 0.02 0.00 0.00 175.26 174.69 1rtj s PRO 313 N -3.60 3.75 0.25 0.39 0.04 -1.26 -4.92 135.00 129.65 1rtj s PRO 313 Ca 0.02 1.62 -0.31 0.00 0.04 0.00 0.00 61.00 62.37 1rtj s PRO 313 Cb -0.01 -2.29 -0.13 0.00 0.04 0.00 0.00 34.50 32.10 1rtj s PRO 313 CO -0.12 -0.52 1.39 1.55 0.04 0.00 0.00 177.00 179.35 1rtj n VAL 314 N -0.66 1.04 -1.88 -0.36 3.14 -1.26 -4.89 118.33 113.45 1rtj n VAL 314 Ca 0.08 -0.26 -0.41 0.00 -2.96 0.00 0.00 64.34 60.79 1rtj n VAL 314 Cb 0.50 -1.47 -0.01 0.00 -1.06 0.00 0.00 33.84 31.80 1rtj n VAL 314 CO 0.00 0.00 0.00 -1.00 -6.46 0.00 0.00 176.83 169.37 1rtj s HIS 315 N -0.15 2.71 0.00 1.45 3.76 -1.26 -3.80 115.29 118.00 1rtj s HIS 315 Ca 0.67 1.21 0.00 0.00 -0.15 0.00 0.00 55.06 56.79 1rtj s HIS 315 Cb -0.65 -3.94 0.00 0.00 1.11 0.00 0.00 32.58 29.11 1rtj s HIS 315 CO 0.51 -2.73 0.00 0.41 -0.85 0.00 0.00 174.74 172.07 1rtj n GLY 316 N 0.64 0.54 3.67 -2.22 0.00 -1.26 -5.05 105.19 101.52 1rtj n GLY 316 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1rtj n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rtj s VAL 317 N -2.12 4.66 -0.01 1.61 1.01 -1.25 -5.00 120.40 119.30 1rtj s VAL 317 Ca 0.00 1.96 0.00 0.00 0.00 0.00 0.00 61.98 63.95 1rtj s VAL 317 Cb 0.00 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 32.12 1rtj s VAL 317 CO 0.00 -0.08 -0.01 -0.31 0.00 0.00 0.00 175.10 174.70 1rtj s TYR 318 N 2.63 0.13 0.20 5.22 2.02 -1.26 -5.06 117.35 121.23 1rtj s TYR 318 Ca 0.48 -0.00 -0.30 0.00 -0.37 0.00 0.00 57.07 56.87 1rtj s TYR 318 Cb -0.18 -0.14 -0.09 0.00 -0.40 0.00 0.00 41.96 41.16 1rtj s TYR 318 CO 0.13 -0.03 1.35 -0.47 -1.57 0.00 0.00 175.55 174.97 1rtj s TYR 319 N 0.22 3.20 -0.38 2.71 5.04 -1.26 -5.01 117.35 121.88 1rtj s TYR 319 Ca -0.02 1.13 0.02 0.00 -2.44 0.00 0.00 57.07 55.76 1rtj s TYR 319 Cb -0.04 -3.66 0.11 0.00 0.35 0.00 0.00 41.96 38.72 1rtj s TYR 319 CO -0.01 -2.14 0.12 0.34 -1.34 0.00 0.00 175.55 172.53 1rtj s ASP 320 N 0.47 4.93 0.62 4.32 -1.08 -1.26 -4.99 116.67 119.67 1rtj s ASP 320 Ca 0.59 -2.17 0.30 0.00 -0.52 0.00 0.00 52.55 50.74 1rtj s ASP 320 Cb -0.38 -1.70 1.62 0.00 -1.46 0.00 0.00 42.92 41.00 1rtj s ASP 320 CO 0.38 -0.43 1.98 1.55 0.52 0.00 0.00 175.17 179.17 1rtj h PRO 321 N 7.69 0.00 0.00 4.34 0.13 -1.99 -0.93 132.00 141.25 1rtj h PRO 321 Ca -0.07 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.93 1rtj h PRO 321 Cb 1.02 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.13 1rtj h PRO 321 CO 0.59 0.00 -0.61 0.77 -0.23 0.00 0.00 178.00 178.52 1rtj h SER 322 N 0.00 0.00 -3.47 1.44 0.02 -2.04 -3.45 113.55 106.05 1rtj h SER 322 Ca 0.10 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.51 1rtj h SER 322 Cb 0.77 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.27 1rtj h SER 322 CO -0.00 0.60 0.05 -0.54 -1.14 0.00 0.00 176.83 175.80 1rtj s LYS 323 N -2.91 4.22 0.63 3.45 1.02 -0.35 -5.03 119.74 120.76 1rtj s LYS 323 Ca 0.03 0.80 -0.18 0.00 0.02 0.00 0.00 55.97 56.64 1rtj s LYS 323 Cb 0.08 -2.98 -0.02 0.00 -0.52 0.00 0.00 37.83 34.39 1rtj s LYS 323 CO 0.76 0.46 1.26 -0.51 -0.92 0.00 0.00 175.35 176.40 1rtj s ASP 324 N -1.54 4.81 -0.21 2.83 1.01 -1.26 -4.88 116.67 117.43 1rtj s ASP 324 Ca 0.39 2.53 -0.10 0.00 0.71 0.00 0.00 52.55 56.08 1rtj s ASP 324 Cb -0.17 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.10 1rtj s ASP 324 CO 0.21 -1.86 0.15 -0.22 0.21 0.00 0.00 175.17 173.66 1rtj s LEU 325 N -4.28 4.19 0.05 1.23 2.96 -1.26 -4.60 118.68 116.96 1rtj s LEU 325 Ca 0.80 0.22 0.06 0.00 -0.22 0.00 0.00 54.13 55.00 1rtj s LEU 325 Cb -0.35 -2.12 -0.03 0.00 0.50 0.00 0.00 46.19 44.19 1rtj s LEU 325 CO 0.37 0.14 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.77 1rtj s ILE 326 N 0.57 3.04 -0.03 6.68 -1.09 0.20 -1.73 121.20 128.84 1rtj s ILE 326 Ca 0.09 -1.13 0.01 0.00 -2.23 0.00 0.00 60.65 57.38 1rtj s ILE 326 Cb -0.12 -2.32 0.01 0.00 -1.58 0.00 0.00 42.46 38.46 1rtj s ILE 326 CO 0.00 0.30 -0.04 0.00 -1.23 0.00 0.00 174.94 173.98 1rtj s ALA 327 N -0.99 0.50 -0.06 9.38 0.00 -0.34 0.05 121.76 130.30 1rtj s ALA 327 Ca 0.16 -0.06 0.04 0.00 0.00 0.00 0.00 51.96 52.10 1rtj s ALA 327 Cb -0.11 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.74 1rtj s ALA 327 CO 0.07 0.02 -0.18 -2.00 0.00 0.00 0.00 175.76 173.68 1rtj s GLU 328 N 0.54 2.11 0.08 0.00 2.12 -0.57 0.13 118.70 123.11 1rtj s GLU 328 Ca -0.06 -0.64 0.09 0.00 0.36 0.00 0.00 54.97 54.72 1rtj s GLU 328 Cb -0.10 -1.73 -0.03 0.00 0.26 0.00 0.00 34.13 32.53 1rtj s GLU 328 CO -0.00 0.18 -0.22 0.42 -0.54 0.00 0.00 175.26 175.10 1rtj s ILE 329 N 0.27 2.54 -0.02 -3.70 1.01 -0.95 -1.59 121.20 118.75 1rtj s ILE 329 Ca -0.10 -1.43 0.02 0.00 0.00 0.00 0.00 60.65 59.14 1rtj s ILE 329 Cb -0.14 -2.08 0.00 0.00 0.01 0.00 0.00 42.46 40.25 1rtj s ILE 329 CO 0.04 0.24 -0.07 -1.10 0.00 0.00 0.00 174.94 174.05 1rtj s GLN 330 N -1.68 0.79 0.01 2.79 1.11 0.24 -4.30 119.66 118.62 1rtj s GLN 330 Ca 0.15 -0.25 -0.29 0.00 0.01 0.00 0.00 55.36 54.98 1rtj s GLN 330 Cb -0.10 -0.76 -0.03 0.00 -1.01 0.00 0.00 33.01 31.10 1rtj s GLN 330 CO 0.06 0.09 0.95 0.21 0.01 0.00 0.00 175.29 176.60 1rtj s LYS 331 N 0.20 4.56 0.00 2.91 2.20 -1.26 -0.40 119.74 127.95 1rtj s LYS 331 Ca -0.03 1.36 0.15 0.00 -0.36 0.00 0.00 55.97 57.09 1rtj s LYS 331 Cb -0.08 -3.45 0.04 0.00 -1.51 0.00 0.00 37.83 32.83 1rtj s LYS 331 CO 0.00 -0.00 0.86 1.04 -0.36 0.00 0.00 175.35 176.88 1rtj n GLN 332 N 3.75 1.57 -0.35 4.03 1.13 -0.34 -4.94 117.38 122.23 1rtj n GLN 332 Ca 0.05 -0.97 0.04 0.00 -1.94 0.00 0.00 57.00 54.19 1rtj n GLN 332 Cb 0.51 -1.25 -0.02 0.00 0.11 0.00 0.00 30.24 29.59 1rtj n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rtj n GLY 333 N 1.01 -2.37 2.41 1.08 0.00 -1.16 -4.83 105.19 101.34 1rtj n GLY 333 Ca 0.07 -1.38 -0.18 0.00 0.00 0.00 0.00 46.02 44.52 1rtj n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rtj n GLN 334 N -2.81 -1.83 0.00 1.61 1.13 -1.26 -2.77 117.38 111.45 1rtj n GLN 334 Ca -0.01 0.89 0.00 0.00 -1.94 0.00 0.00 57.00 55.94 1rtj n GLN 334 Cb 0.17 -5.52 0.00 0.00 0.11 0.00 0.00 30.24 24.99 1rtj n GLN 334 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rtj n GLY 335 N -0.91 2.77 3.82 1.08 0.00 -1.26 -4.99 105.19 105.69 1rtj n GLY 335 Ca -0.21 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 1rtj n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rtj s GLN 336 N 0.00 3.96 0.21 1.61 1.11 -1.12 -2.62 119.66 122.81 1rtj s GLN 336 Ca 0.00 1.13 0.01 0.00 0.01 0.00 0.00 55.36 56.51 1rtj s GLN 336 Cb 0.00 -2.13 -0.05 0.00 -1.01 0.00 0.00 33.01 29.82 1rtj s GLN 336 CO 0.00 -0.27 0.07 -1.58 0.01 0.00 0.00 175.29 173.52 1rtj s TRP 337 N -2.30 1.29 0.00 0.91 0.52 0.11 -1.20 118.94 118.27 1rtj s TRP 337 Ca 0.62 -1.18 -0.04 0.00 0.02 0.00 0.00 56.10 55.52 1rtj s TRP 337 Cb -0.12 -0.72 -0.00 0.00 -1.15 0.00 0.00 33.47 31.47 1rtj s TRP 337 CO 0.22 -0.38 0.08 0.95 0.02 0.00 0.00 176.95 177.83 1rtj s THR 338 N -3.84 0.08 0.20 2.01 -4.23 0.47 -2.30 115.64 108.02 1rtj s THR 338 Ca 0.33 -0.68 -0.13 0.00 -1.18 0.00 0.00 61.69 60.03 1rtj s THR 338 Cb 0.07 -0.34 0.00 0.00 1.34 0.00 0.00 72.50 73.58 1rtj s THR 338 CO 0.09 -0.37 0.41 -0.72 -0.54 0.00 0.00 174.62 173.49 1rtj s TYR 339 N -1.23 0.25 -0.19 3.99 1.13 -0.45 0.79 117.35 121.64 1rtj s TYR 339 Ca -0.13 -0.61 -0.09 0.00 -1.41 0.00 0.00 57.07 54.83 1rtj s TYR 339 Cb -0.08 0.15 0.08 0.00 -1.10 0.00 0.00 41.96 41.01 1rtj s TYR 339 CO 0.01 -0.87 0.44 -0.65 -2.51 0.00 0.00 175.55 171.97 1rtj s GLN 340 N -3.96 0.38 -0.03 -3.49 1.11 -0.62 -0.98 119.66 112.07 1rtj s GLN 340 Ca 0.17 0.96 -0.07 0.00 0.01 0.00 0.00 55.36 56.42 1rtj s GLN 340 Cb 0.01 0.19 -0.05 0.00 -1.01 0.00 0.00 33.01 32.15 1rtj s GLN 340 CO 0.02 -0.20 0.25 0.42 0.01 0.00 0.00 175.29 175.79 1rtj s ILE 341 N 2.06 5.33 0.07 1.08 1.09 0.12 -1.51 121.20 129.44 1rtj s ILE 341 Ca -0.06 0.24 -0.26 0.00 -1.10 0.00 0.00 60.65 59.47 1rtj s ILE 341 Cb -0.10 -3.54 0.09 0.00 -1.06 0.00 0.00 42.46 37.85 1rtj s ILE 341 CO -0.13 0.45 1.16 -0.72 -0.10 0.00 0.00 174.94 175.60 1rtj s TYR 342 N -1.21 0.00 0.00 3.97 -0.85 0.11 -1.83 117.35 117.54 1rtj s TYR 342 Ca 0.24 -0.24 0.00 0.00 -0.52 0.00 0.00 57.07 56.55 1rtj s TYR 342 Cb -0.13 0.61 0.00 0.00 0.38 0.00 0.00 41.96 42.82 1rtj s TYR 342 CO 0.13 -0.56 0.00 1.04 -1.52 0.00 0.00 175.55 174.64 1rtj n GLN 343 N -0.68 2.94 -4.36 -3.49 6.02 -1.25 0.58 117.38 117.14 1rtj n GLN 343 Ca -0.03 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.78 1rtj n GLN 343 Cb 0.60 -0.73 -0.14 0.00 1.02 0.00 0.00 30.24 30.99 1rtj n GLN 343 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1rtj s GLU 344 N -1.03 0.75 0.01 -1.09 2.56 -1.26 -4.89 118.70 113.75 1rtj s GLU 344 Ca 0.00 -0.38 -0.37 0.00 0.00 0.00 0.00 54.97 54.22 1rtj s GLU 344 Cb 0.00 -0.72 -0.16 0.00 2.00 0.00 0.00 34.13 35.25 1rtj s GLU 344 CO 0.00 0.20 1.51 -0.35 -0.56 0.00 0.00 175.26 176.05 1rtj n PRO 345 N 2.71 1.40 -0.38 4.30 -0.04 -1.26 -1.52 135.00 140.21 1rtj n PRO 345 Ca -0.14 0.51 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 1rtj n PRO 345 Cb 0.57 -2.20 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 1rtj n PRO 345 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1rtj n PHE 346 N 3.57 0.00 -3.36 0.54 3.72 -1.26 -4.94 117.46 115.72 1rtj n PHE 346 Ca 0.20 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.19 1rtj n PHE 346 Cb 0.20 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.72 1rtj n PHE 346 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1rtj n LYS 347 N -2.00 3.43 -2.55 -1.08 4.01 -0.58 -4.84 118.16 114.55 1rtj n LYS 347 Ca 0.00 -4.49 -0.43 0.00 -0.51 0.00 0.00 58.31 52.88 1rtj n LYS 347 Cb 0.00 -2.49 -0.02 0.00 -0.51 0.00 0.00 35.03 32.01 1rtj n LYS 347 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 1rtj s ASN 348 N 0.12 7.05 -0.04 4.39 0.01 -1.26 -3.96 114.94 121.25 1rtj s ASN 348 Ca 0.31 1.57 -0.21 0.00 -0.71 0.00 0.00 52.86 53.81 1rtj s ASN 348 Cb -0.05 -2.54 -0.16 0.00 0.41 0.00 0.00 41.25 38.91 1rtj s ASN 348 CO -0.05 -0.67 0.91 -0.07 -1.51 0.00 0.00 177.10 175.70 1rtj h LEU 349 N 9.23 -0.20 -8.15 0.60 3.38 -1.72 -3.47 115.31 114.98 1rtj h LEU 349 Ca -0.25 -0.33 -0.11 0.00 0.09 0.00 0.00 57.88 57.28 1rtj h LEU 349 Cb 1.10 0.05 -0.15 0.00 0.09 0.00 0.00 40.66 41.75 1rtj h LEU 349 CO 0.95 0.33 -0.61 -0.75 0.09 0.00 0.00 178.44 178.44 1rtj s LYS 350 N -3.55 0.66 0.06 1.13 2.20 -0.89 -5.00 119.74 114.36 1rtj s LYS 350 Ca -0.13 -1.16 -0.09 0.00 -0.36 0.00 0.00 55.97 54.23 1rtj s LYS 350 Cb 0.01 0.24 0.00 0.00 -1.51 0.00 0.00 37.83 36.57 1rtj s LYS 350 CO 0.48 -0.14 0.20 0.95 -0.36 0.00 0.00 175.35 176.48 1rtj s THR 351 N -3.89 0.12 0.02 3.43 -4.23 -1.26 0.13 115.64 109.96 1rtj s THR 351 Ca 0.06 -1.00 -0.27 0.00 -1.18 0.00 0.00 61.69 59.31 1rtj s THR 351 Cb 0.07 -1.10 0.09 0.00 1.34 0.00 0.00 72.50 72.90 1rtj s THR 351 CO -0.10 -0.55 1.23 0.61 -0.54 0.00 0.00 174.62 175.27 1rtj n GLY 352 N 0.35 0.29 3.13 3.99 0.00 -0.15 -4.29 105.19 108.51 1rtj n GLY 352 Ca -0.17 -1.07 -0.25 0.00 0.00 0.00 0.00 46.02 44.53 1rtj n GLY 352 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rtj s LYS 353 N -2.02 1.59 -0.08 1.61 2.47 -1.26 -1.34 119.74 120.70 1rtj s LYS 353 Ca 0.29 -0.58 0.03 0.00 -1.56 0.00 0.00 55.97 54.14 1rtj s LYS 353 Cb -0.01 -1.43 0.01 0.00 -1.46 0.00 0.00 37.83 34.94 1rtj s LYS 353 CO 0.01 0.27 -0.16 -0.47 0.16 0.00 0.00 175.35 175.15 1rtj s TYR 354 N -0.07 1.88 -0.20 4.03 6.14 -0.97 -4.99 117.35 123.17 1rtj s TYR 354 Ca -0.01 -0.76 -0.08 0.00 0.64 0.00 0.00 57.07 56.87 1rtj s TYR 354 Cb -0.10 -1.33 -0.04 0.00 0.42 0.00 0.00 41.96 40.92 1rtj s TYR 354 CO 0.01 -0.35 0.07 0.00 0.64 0.00 0.00 175.55 175.92 1rtj s ALA 355 N 0.62 3.36 0.41 3.97 0.00 -1.26 -0.72 121.76 128.15 1rtj s ALA 355 Ca -0.15 -0.85 -0.18 0.00 0.00 0.00 0.00 51.96 50.78 1rtj s ALA 355 Cb -0.16 -1.99 -0.14 0.00 0.00 0.00 0.00 23.12 20.82 1rtj s ALA 355 CO 0.04 -0.01 -0.00 2.89 0.00 0.00 0.00 175.76 178.68 1rtj n ARG 356 N 3.93 0.00 -1.30 0.00 1.85 -1.08 -4.95 116.66 115.12 1rtj n ARG 356 Ca -0.16 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.40 1rtj n ARG 356 Cb 0.52 -0.93 0.15 0.00 -1.05 0.00 0.00 32.46 31.16 1rtj n ARG 356 CO 0.00 0.00 0.00 1.41 -0.01 0.00 0.00 177.63 179.03 1rtj s MET 357 N -0.93 0.85 0.37 2.89 -2.45 -1.26 -4.96 119.30 113.81 1rtj s MET 357 Ca 0.54 0.50 -0.28 0.00 -1.25 0.00 0.00 55.69 55.21 1rtj s MET 357 Cb -0.54 -1.79 -0.10 0.00 1.25 0.00 0.00 34.83 33.65 1rtj s MET 357 CO 0.60 -2.44 1.40 1.03 1.05 0.00 0.00 175.02 176.65 1rtj s ARG 358 N -5.06 4.14 0.00 4.11 0.52 -1.26 -2.95 118.95 118.46 1rtj s ARG 358 Ca 0.64 2.39 0.00 0.00 -0.52 0.00 0.00 55.73 58.24 1rtj s ARG 358 Cb -0.17 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.34 1rtj s ARG 358 CO 0.56 -0.43 0.00 0.41 0.02 0.00 0.00 175.30 175.86 1rtj n GLY 359 N 0.61 1.47 0.00 -3.53 0.00 -1.26 -4.81 105.19 97.67 1rtj n GLY 359 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1rtj n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rtj n ALA 360 N 0.00 0.28 -0.34 4.61 0.00 -1.15 -4.07 120.51 119.83 1rtj n ALA 360 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1rtj n ALA 360 Cb 0.00 -0.21 0.27 0.00 0.00 0.00 0.00 19.45 19.51 1rtj n ALA 360 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1rtj h HIS 361 N 0.00 -0.10 -0.24 0.00 6.17 -1.87 -1.40 115.15 117.71 1rtj h HIS 361 Ca 0.00 0.07 0.00 0.00 0.71 0.00 0.00 60.37 61.15 1rtj h HIS 361 Cb 0.24 0.20 0.00 0.00 2.52 0.00 0.00 27.41 30.38 1rtj h HIS 361 CO 0.00 -0.43 0.00 2.41 0.71 0.00 0.00 177.93 180.62 1rtj n THR 362 N -5.50 0.31 -3.87 6.26 -1.04 -1.26 -4.76 114.28 104.42 1rtj n THR 362 Ca 0.22 -0.45 -0.30 0.00 -2.04 0.00 0.00 64.05 61.48 1rtj n THR 362 Cb 0.73 0.47 -0.15 0.00 -1.82 0.00 0.00 70.33 69.56 1rtj n THR 362 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1rtj s ASN 363 N -1.47 4.36 0.30 8.00 3.84 -0.53 -4.94 114.94 124.50 1rtj s ASN 363 Ca 0.33 -1.96 -0.00 0.00 0.21 0.00 0.00 52.86 51.44 1rtj s ASN 363 Cb 0.18 -1.24 0.51 0.00 -0.55 0.00 0.00 41.25 40.15 1rtj s ASN 363 CO 0.26 -0.39 1.94 0.44 -2.79 0.00 0.00 177.10 176.56 1rtj h ASP 364 N 7.76 0.91 -0.51 -4.21 5.19 -1.86 -1.38 116.42 122.32 1rtj h ASP 364 Ca -0.09 -0.01 -0.11 0.00 -0.62 0.00 0.00 57.03 56.21 1rtj h ASP 364 Cb 1.01 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 40.30 1rtj h ASP 364 CO 0.50 0.62 -0.10 0.58 -3.12 0.00 0.00 179.24 177.71 1rtj h VAL 365 N 1.05 1.27 0.61 -1.35 2.07 -1.94 0.16 116.25 118.11 1rtj h VAL 365 Ca 0.35 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.60 1rtj h VAL 365 Cb 0.07 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1rtj h VAL 365 CO -0.11 0.44 -0.37 0.50 0.02 0.00 0.00 177.57 178.05 1rtj h LYS 366 N 0.89 -0.88 -0.81 1.57 3.64 -1.69 -0.42 116.57 118.87 1rtj h LYS 366 Ca 0.14 0.06 0.19 0.00 -1.27 0.00 0.00 60.65 59.78 1rtj h LYS 366 Cb 0.66 0.20 -0.14 0.00 -0.41 0.00 0.00 32.23 32.54 1rtj h LYS 366 CO 0.05 -0.58 0.04 1.96 -2.27 0.00 0.00 179.45 178.64 1rtj h GLN 367 N -0.91 0.11 0.16 1.90 4.20 -1.15 -0.23 115.11 119.19 1rtj h GLN 367 Ca -0.08 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1rtj h GLN 367 Cb 0.73 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.48 1rtj h GLN 367 CO 0.09 0.07 -0.08 1.25 -0.67 0.00 0.00 178.83 179.49 1rtj h LEU 368 N 0.11 -0.18 -1.16 1.46 6.46 -0.39 -2.64 115.31 118.96 1rtj h LEU 368 Ca 0.46 -0.13 0.02 0.00 -0.12 0.00 0.00 57.88 58.11 1rtj h LEU 368 Cb 0.85 0.05 -0.05 0.00 -0.73 0.00 0.00 40.66 40.78 1rtj h LEU 368 CO -0.70 0.02 0.57 0.71 -0.62 0.00 0.00 178.44 178.42 1rtj h THR 369 N -0.38 1.18 -0.66 1.05 1.35 0.55 -1.12 112.91 114.88 1rtj h THR 369 Ca -0.02 -0.38 0.08 0.00 -0.55 0.00 0.00 66.41 65.54 1rtj h THR 369 Cb 0.30 -0.04 -0.04 0.00 -1.73 0.00 0.00 68.15 66.64 1rtj h THR 369 CO 0.04 0.20 0.44 -0.33 -0.25 0.00 0.00 175.52 175.62 1rtj h GLU 370 N 1.12 0.55 0.13 4.72 5.08 -1.03 -1.71 114.58 123.43 1rtj h GLU 370 Ca 0.33 -0.03 -0.21 0.00 -1.00 0.00 0.00 59.36 58.45 1rtj h GLU 370 Cb -0.04 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.10 1rtj h GLU 370 CO -0.09 0.36 -0.98 0.00 -1.00 0.00 0.00 179.01 177.31 1rtj h ALA 371 N 1.66 -0.00 -0.73 3.43 0.00 -0.88 -2.32 119.26 120.42 1rtj h ALA 371 Ca 0.30 -0.82 0.17 0.00 0.00 0.00 0.00 54.91 54.56 1rtj h ALA 371 Cb 0.42 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1rtj h ALA 371 CO -0.09 0.51 0.50 0.28 0.00 0.00 0.00 179.25 180.44 1rtj h VAL 372 N -0.39 0.73 0.38 0.00 2.07 -1.06 0.23 116.25 118.21 1rtj h VAL 372 Ca -0.19 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1rtj h VAL 372 Cb 1.65 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1rtj h VAL 372 CO 0.11 0.05 -0.18 1.56 0.02 0.00 0.00 177.57 179.13 1rtj h GLN 373 N 0.25 -0.49 -0.95 1.57 4.20 -1.32 -0.99 115.11 117.37 1rtj h GLN 373 Ca 0.36 0.03 0.12 0.00 0.06 0.00 0.00 58.65 59.22 1rtj h GLN 373 Cb 1.05 0.11 -0.08 0.00 0.30 0.00 0.00 27.48 28.86 1rtj h GLN 373 CO -0.08 -0.27 0.61 -0.22 -0.67 0.00 0.00 178.83 178.19 1rtj h LYS 374 N -1.10 0.88 -0.37 1.46 3.11 -0.84 -0.93 116.57 118.78 1rtj h LYS 374 Ca -0.05 -0.05 -0.16 0.00 -2.81 0.00 0.00 60.65 57.57 1rtj h LYS 374 Cb 0.44 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.46 1rtj h LYS 374 CO 0.08 0.58 -0.40 0.82 -2.81 0.00 0.00 179.45 177.73 1rtj h ILE 375 N 0.91 1.27 0.00 2.00 2.04 -0.62 -2.81 117.51 120.30 1rtj h ILE 375 Ca 0.46 -1.58 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 1rtj h ILE 375 Cb 0.51 1.41 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1rtj h ILE 375 CO -0.23 0.53 -0.07 0.74 0.00 0.00 0.00 178.15 179.12 1rtj h THR 376 N 0.75 0.27 0.18 -0.27 2.02 0.12 -2.23 112.91 113.75 1rtj h THR 376 Ca 0.06 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 1rtj h THR 376 Cb 1.00 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 68.77 1rtj h THR 376 CO 0.10 0.07 -0.09 0.74 0.37 0.00 0.00 175.52 176.71 1rtj h THR 377 N 0.00 0.93 -0.04 3.16 2.02 -1.02 -2.73 112.91 115.24 1rtj h THR 377 Ca -0.00 -0.57 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 1rtj h THR 377 Cb 0.36 1.27 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1rtj h THR 377 CO 0.01 0.13 0.02 -0.33 0.37 0.00 0.00 175.52 175.72 1rtj h GLU 378 N -0.52 0.05 -0.01 6.66 5.08 -1.53 0.27 114.58 124.59 1rtj h GLU 378 Ca -0.02 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1rtj h GLU 378 Cb 0.40 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1rtj h GLU 378 CO 0.04 0.10 0.44 0.77 -1.00 0.00 0.00 179.01 179.36 1rtj h SER 379 N -0.01 0.00 0.00 1.42 0.02 -1.36 0.30 113.55 113.93 1rtj h SER 379 Ca 0.01 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.78 1rtj h SER 379 Cb 0.06 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 1rtj h SER 379 CO -0.00 0.00 -1.22 -0.38 -1.14 0.00 0.00 176.83 174.09 1rtj n ILE 380 N -2.84 1.50 -0.02 3.27 5.41 -0.01 -1.34 119.36 125.33 1rtj n ILE 380 Ca -0.01 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.72 1rtj n ILE 380 Cb 0.49 -2.13 -0.01 0.00 -0.71 0.00 0.00 39.64 37.27 1rtj n ILE 380 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1rtj h VAL 381 N -1.00 0.00 0.04 1.39 2.07 0.13 2.52 116.25 121.40 1rtj h VAL 381 Ca -0.28 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.25 1rtj h VAL 381 Cb 1.11 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1rtj h VAL 381 CO -0.17 0.00 -0.09 0.40 0.02 0.00 0.00 177.57 177.73 1rtj h ILE 382 N -0.05 0.79 0.00 4.57 2.04 -0.72 -3.34 117.51 120.80 1rtj h ILE 382 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1rtj h ILE 382 Cb 0.08 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1rtj h ILE 382 CO -0.08 0.00 -1.18 0.79 0.00 0.00 0.00 178.15 177.68 1rtj n TRP 383 N -5.20 0.00 -2.39 1.37 8.01 -1.09 -4.98 117.44 113.16 1rtj n TRP 383 Ca -0.06 0.00 -0.08 0.00 -1.31 0.00 0.00 57.50 56.04 1rtj n TRP 383 Cb 0.13 -0.17 0.01 0.00 -2.01 0.00 0.00 31.31 29.26 1rtj n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1rtj n GLY 384 N 1.66 0.14 3.65 6.99 0.00 0.85 -4.94 105.19 113.53 1rtj n GLY 384 Ca -0.01 -0.48 -0.08 0.00 0.00 0.00 0.00 46.02 45.45 1rtj n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rtj s LYS 385 N -4.74 1.42 0.02 1.61 -2.85 -0.45 -4.91 119.74 109.84 1rtj s LYS 385 Ca 0.07 -0.68 -0.04 0.00 -1.00 0.00 0.00 55.97 54.31 1rtj s LYS 385 Cb -0.03 0.55 -0.04 0.00 -2.06 0.00 0.00 37.83 36.25 1rtj s LYS 385 CO 0.08 -0.64 0.24 0.95 0.10 0.00 0.00 175.35 176.09 1rtj s THR 386 N -3.68 5.35 0.19 3.79 -4.23 -1.26 -2.98 115.64 112.82 1rtj s THR 386 Ca 0.07 -0.01 -0.12 0.00 -1.18 0.00 0.00 61.69 60.45 1rtj s THR 386 Cb -0.03 -3.57 -0.07 0.00 1.34 0.00 0.00 72.50 70.17 1rtj s THR 386 CO -0.03 0.31 0.55 -2.16 -0.54 0.00 0.00 174.62 172.75 1rtj s PRO 387 N -1.96 3.88 -0.28 3.99 0.04 -1.26 -4.70 135.00 134.71 1rtj s PRO 387 Ca 0.29 0.38 -0.23 0.00 0.04 0.00 0.00 61.00 61.48 1rtj s PRO 387 Cb -0.13 -2.77 -0.00 0.00 0.04 0.00 0.00 34.50 31.64 1rtj s PRO 387 CO 0.19 0.39 0.76 0.21 0.04 0.00 0.00 177.00 178.58 1rtj s LYS 388 N -2.43 4.03 0.36 4.56 2.47 -0.71 -4.05 119.74 123.98 1rtj s LYS 388 Ca 0.43 0.64 -0.21 0.00 -1.56 0.00 0.00 55.97 55.27 1rtj s LYS 388 Cb -0.13 -3.70 -0.10 0.00 -1.46 0.00 0.00 37.83 32.45 1rtj s LYS 388 CO 0.20 -0.59 0.89 -0.06 0.16 0.00 0.00 175.35 175.95 1rtj s PHE 389 N 2.83 3.45 -0.37 4.03 0.40 -0.75 -1.20 117.98 126.38 1rtj s PHE 389 Ca 0.31 1.56 -0.01 0.00 -0.60 0.00 0.00 56.93 58.19 1rtj s PHE 389 Cb -0.15 -2.79 0.09 0.00 0.51 0.00 0.00 43.02 40.69 1rtj s PHE 389 CO 0.11 0.06 0.12 0.15 0.70 0.00 0.00 175.22 176.36 1rtj s LYS 390 N -2.73 2.03 -0.25 0.44 1.02 0.12 -1.71 119.74 118.67 1rtj s LYS 390 Ca 0.56 -1.68 -0.15 0.00 0.02 0.00 0.00 55.97 54.72 1rtj s LYS 390 Cb -0.12 -3.42 -0.04 0.00 -0.52 0.00 0.00 37.83 33.73 1rtj s LYS 390 CO 0.17 -0.93 0.36 -0.51 -0.92 0.00 0.00 175.35 173.53 1rtj s LEU 391 N 1.13 4.07 -1.52 3.17 1.43 0.13 -2.23 118.68 124.86 1rtj s LEU 391 Ca 0.05 0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 53.35 1rtj s LEU 391 Cb -0.21 -2.42 -0.01 0.00 0.03 0.00 0.00 46.19 43.57 1rtj s LEU 391 CO -0.04 -0.14 2.53 -0.81 0.23 0.00 0.00 176.35 178.12 1rtj n PRO 392 N 5.07 3.19 -3.57 1.29 -0.04 -1.26 -0.62 135.00 139.05 1rtj n PRO 392 Ca -0.09 -2.43 -0.14 0.00 -0.04 0.00 0.00 63.50 60.81 1rtj n PRO 392 Cb 0.51 -3.08 -0.05 0.00 -0.04 0.00 0.00 33.50 30.83 1rtj n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rtj s ILE 393 N 2.79 0.03 0.40 0.52 2.07 -1.26 -4.93 121.20 120.81 1rtj s ILE 393 Ca 0.56 -0.24 -0.24 0.00 -1.41 0.00 0.00 60.65 59.32 1rtj s ILE 393 Cb 0.16 -0.97 -0.09 0.00 0.13 0.00 0.00 42.46 41.68 1rtj s ILE 393 CO -0.08 -0.13 1.03 -1.58 -1.91 0.00 0.00 174.94 172.26 1rtj s GLN 394 N -2.44 4.20 0.12 3.50 0.74 -1.26 -4.35 119.66 120.18 1rtj s GLN 394 Ca -0.05 1.44 -0.27 0.00 0.05 0.00 0.00 55.36 56.53 1rtj s GLN 394 Cb -0.01 -2.51 -0.05 0.00 1.10 0.00 0.00 33.01 31.54 1rtj s GLN 394 CO -0.02 -0.09 1.62 -0.22 -0.55 0.00 0.00 175.29 176.03 1rtj h LYS 395 N 2.47 -0.43 -0.52 1.67 3.64 -1.97 -2.01 116.57 119.42 1rtj h LYS 395 Ca -0.48 0.03 0.06 0.00 -1.27 0.00 0.00 60.65 58.99 1rtj h LYS 395 Cb 1.21 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 33.07 1rtj h LYS 395 CO 0.62 -0.29 0.23 0.93 -2.27 0.00 0.00 179.45 178.67 1rtj h GLU 396 N -0.45 0.43 -0.17 1.90 3.07 -1.98 0.21 114.58 117.59 1rtj h GLU 396 Ca 0.06 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.88 1rtj h GLU 396 Cb 0.54 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 1rtj h GLU 396 CO -0.26 0.28 0.02 1.15 -1.40 0.00 0.00 179.01 178.80 1rtj h THR 397 N 0.44 1.10 0.00 1.13 2.02 -1.86 -2.34 112.91 113.40 1rtj h THR 397 Ca 0.24 -0.39 -0.07 0.00 0.77 0.00 0.00 66.41 66.96 1rtj h THR 397 Cb 0.21 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1rtj h THR 397 CO -0.21 0.13 -0.47 -0.25 0.37 0.00 0.00 175.52 175.09 1rtj h TRP 398 N 0.24 0.00 -0.20 3.16 2.91 -0.45 -3.25 115.95 118.36 1rtj h TRP 398 Ca 0.06 0.00 0.06 0.00 1.13 0.00 0.00 58.89 60.14 1rtj h TRP 398 Cb 0.14 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 28.79 1rtj h TRP 398 CO 0.00 0.80 0.26 0.93 -1.03 0.00 0.00 178.44 179.40 1rtj h GLU 399 N -1.00 0.00 0.02 2.65 5.08 -0.66 -0.24 114.58 120.44 1rtj h GLU 399 Ca -0.11 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.15 1rtj h GLU 399 Cb 0.83 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.09 1rtj h GLU 399 CO -0.07 0.00 -0.42 1.15 -1.00 0.00 0.00 179.01 178.68 1rtj h THR 400 N 0.00 1.54 0.00 1.13 2.02 -1.53 -3.40 112.91 112.66 1rtj h THR 400 Ca 0.10 -2.13 0.00 0.00 0.77 0.00 0.00 66.41 65.15 1rtj h THR 400 Cb 0.61 2.86 0.00 0.00 -1.74 0.00 0.00 68.15 69.88 1rtj h THR 400 CO -0.00 0.59 -0.06 0.79 0.37 0.00 0.00 175.52 177.21 1rtj n TRP 401 N -4.37 0.00 -0.07 3.16 8.01 -0.84 -4.81 117.44 118.51 1rtj n TRP 401 Ca -0.11 -0.66 -0.13 0.00 -1.31 0.00 0.00 57.50 55.29 1rtj n TRP 401 Cb 0.60 -0.10 -0.06 0.00 -2.01 0.00 0.00 31.31 29.74 1rtj n TRP 401 CO 0.00 0.00 0.00 0.11 -1.01 0.00 0.00 177.69 176.79 1rtj h TRP 402 N 0.00 0.64 0.00 -5.99 5.08 -1.29 -3.23 115.95 111.15 1rtj h TRP 402 Ca 0.00 -0.20 -0.01 0.00 1.08 0.00 0.00 58.89 59.76 1rtj h TRP 402 Cb 0.90 -0.13 -0.00 0.00 -3.00 0.00 0.00 29.16 26.93 1rtj h TRP 402 CO 0.01 0.90 -0.04 1.79 -1.28 0.00 0.00 178.44 179.82 1rtj h THR 403 N 0.19 0.63 -0.27 0.12 1.35 -1.87 -1.26 112.91 111.79 1rtj h THR 403 Ca 0.03 -0.18 0.08 0.00 -0.55 0.00 0.00 66.41 65.78 1rtj h THR 403 Cb 0.81 1.11 -0.01 0.00 -1.73 0.00 0.00 68.15 68.33 1rtj h THR 403 CO 0.06 0.04 0.47 -0.33 -0.25 0.00 0.00 175.52 175.51 1rtj h GLU 404 N 0.00 0.00 0.00 4.72 4.39 -1.89 -2.02 114.58 119.77 1rtj h GLU 404 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1rtj h GLU 404 Cb 0.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1rtj h GLU 404 CO 0.01 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.52 1rtj n TYR 405 N -3.33 0.00 -2.25 4.33 4.02 -0.51 -4.93 117.16 114.49 1rtj n TYR 405 Ca 0.04 -0.20 -0.42 0.00 -0.01 0.00 0.00 57.90 57.31 1rtj n TYR 405 Cb 0.59 -0.02 -0.03 0.00 -0.02 0.00 0.00 39.34 39.86 1rtj n TYR 405 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 1rtj s TRP 406 N -0.41 3.30 -0.09 -0.72 -0.00 -0.76 -4.84 118.94 115.42 1rtj s TRP 406 Ca 0.00 1.20 0.13 0.00 -0.00 0.00 0.00 56.10 57.43 1rtj s TRP 406 Cb 0.00 -3.57 0.26 0.00 -0.00 0.00 0.00 33.47 30.16 1rtj s TRP 406 CO 0.00 -1.83 1.13 1.04 -0.00 0.00 0.00 176.95 177.29 1rtj n GLN 407 N 3.08 0.74 -4.31 5.86 6.02 -1.26 -4.36 117.38 123.16 1rtj n GLN 407 Ca 0.07 -2.18 -0.18 0.00 -0.01 0.00 0.00 57.00 54.70 1rtj n GLN 407 Cb 0.43 -0.96 -0.10 0.00 1.02 0.00 0.00 30.24 30.63 1rtj n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1rtj s ALA 408 N -1.60 1.82 -0.20 -1.58 0.00 -1.26 -4.62 121.76 114.32 1rtj s ALA 408 Ca 0.25 -1.52 0.18 0.00 0.00 0.00 0.00 51.96 50.87 1rtj s ALA 408 Cb 0.24 -0.08 0.22 0.00 0.00 0.00 0.00 23.12 23.49 1rtj s ALA 408 CO -0.04 0.09 1.52 1.15 0.00 0.00 0.00 175.76 178.48 1rtj h THR 409 N 2.95 0.62 -3.14 0.00 2.02 -1.98 -3.45 112.91 109.93 1rtj h THR 409 Ca -0.39 -1.81 -0.63 0.00 0.77 0.00 0.00 66.41 64.35 1rtj h THR 409 Cb 1.21 2.26 -0.10 0.00 -1.74 0.00 0.00 68.15 69.78 1rtj h THR 409 CO 0.57 0.35 -0.62 -1.66 0.37 0.00 0.00 175.52 174.53 1rtj s TRP 410 N -3.09 3.08 -0.09 3.16 1.48 -1.26 -4.65 118.94 117.58 1rtj s TRP 410 Ca 0.04 0.01 0.04 0.00 -1.06 0.00 0.00 56.10 55.13 1rtj s TRP 410 Cb 0.07 -1.55 0.00 0.00 -1.16 0.00 0.00 33.47 30.83 1rtj s TRP 410 CO 0.72 0.51 -0.21 0.42 -4.06 0.00 0.00 176.95 174.33 1rtj s ILE 411 N -1.44 1.79 0.78 0.66 1.01 -1.26 -5.06 121.20 117.67 1rtj s ILE 411 Ca 0.28 -0.87 -0.13 0.00 0.00 0.00 0.00 60.65 59.93 1rtj s ILE 411 Cb -0.11 -1.56 0.18 0.00 0.01 0.00 0.00 42.46 40.98 1rtj s ILE 411 CO 0.21 0.50 1.00 -0.81 0.00 0.00 0.00 174.94 175.84 1rtj n PRO 412 N 3.57 -1.21 -4.00 2.79 -0.04 -1.26 -4.97 135.00 129.87 1rtj n PRO 412 Ca -0.20 -1.55 -0.22 0.00 -0.04 0.00 0.00 63.50 61.49 1rtj n PRO 412 Cb 0.53 -1.08 -0.03 0.00 -0.04 0.00 0.00 33.50 32.88 1rtj n PRO 412 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1rtj s GLU 413 N -5.20 3.30 0.28 0.54 0.41 -1.26 -5.04 118.70 111.74 1rtj s GLU 413 Ca 0.58 -0.81 -0.15 0.00 -0.41 0.00 0.00 54.97 54.17 1rtj s GLU 413 Cb -0.02 -2.82 0.01 0.00 -1.78 0.00 0.00 34.13 29.52 1rtj s GLU 413 CO 0.41 0.44 0.59 1.67 -0.49 0.00 0.00 175.26 177.87 1rtj s TRP 414 N -1.98 0.21 -0.00 1.61 -2.14 -1.26 -1.80 118.94 113.57 1rtj s TRP 414 Ca 0.34 -0.63 -0.20 0.00 2.66 0.00 0.00 56.10 58.27 1rtj s TRP 414 Cb -0.09 0.41 0.04 0.00 -3.10 0.00 0.00 33.47 30.72 1rtj s TRP 414 CO 0.28 -1.14 0.43 -1.83 -2.66 0.00 0.00 176.95 172.02 1rtj s GLU 415 N -3.74 0.84 -0.18 3.25 -1.05 -0.69 -4.92 118.70 112.20 1rtj s GLU 415 Ca 0.19 -0.14 -0.10 0.00 -0.15 0.00 0.00 54.97 54.77 1rtj s GLU 415 Cb -0.03 0.38 -0.05 0.00 -0.44 0.00 0.00 34.13 33.99 1rtj s GLU 415 CO 0.09 -0.26 0.14 -0.06 0.95 0.00 0.00 175.26 176.13 1rtj s PHE 416 N -1.66 3.45 0.20 4.83 0.08 -1.26 -0.69 117.98 122.93 1rtj s PHE 416 Ca -0.10 0.38 0.01 0.00 0.12 0.00 0.00 56.93 57.34 1rtj s PHE 416 Cb -0.03 -2.14 -0.05 0.00 -0.57 0.00 0.00 43.02 40.24 1rtj s PHE 416 CO 0.04 0.36 0.07 0.14 -0.10 0.00 0.00 175.22 175.73 1rtj s VAL 417 N 0.14 0.40 -0.65 -0.44 -7.23 0.20 -4.88 120.40 107.95 1rtj s VAL 417 Ca 0.10 -1.98 -0.09 0.00 -1.81 0.00 0.00 61.98 58.19 1rtj s VAL 417 Cb -0.11 -2.38 0.17 0.00 0.56 0.00 0.00 36.38 34.61 1rtj s VAL 417 CO -0.01 -0.20 0.54 0.20 -0.31 0.00 0.00 175.10 175.33 1rtj s ASN 418 N -3.20 5.97 -0.38 4.85 0.01 -1.26 -4.13 114.94 116.79 1rtj s ASN 418 Ca 0.32 -2.49 -0.39 0.00 -0.71 0.00 0.00 52.86 49.59 1rtj s ASN 418 Cb 0.07 -2.05 -0.15 0.00 0.41 0.00 0.00 41.25 39.54 1rtj s ASN 418 CO 0.09 -0.56 2.03 0.41 -1.51 0.00 0.00 177.10 177.57 1rtj n THR 419 N 4.13 0.16 -2.01 1.60 -1.04 -1.26 -4.90 114.28 110.96 1rtj n THR 419 Ca 0.05 -0.12 -0.42 0.00 -2.04 0.00 0.00 64.05 61.52 1rtj n THR 419 Cb 0.42 -1.17 -0.03 0.00 -1.82 0.00 0.00 70.33 67.73 1rtj n THR 419 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1rtj s PRO 420 N 5.31 4.26 0.31 -2.82 0.02 -1.26 -4.88 135.00 135.95 1rtj s PRO 420 Ca 1.09 2.29 0.08 0.00 0.02 0.00 0.00 61.00 64.48 1rtj s PRO 420 Cb -1.12 -3.14 0.82 0.00 0.02 0.00 0.00 34.50 31.08 1rtj s PRO 420 CO 0.60 -0.47 1.74 -1.35 -0.33 0.00 0.00 177.00 177.19 1rtj h PRO 421 N 5.70 0.62 -0.38 5.54 0.11 -2.02 -2.64 132.00 138.93 1rtj h PRO 421 Ca -0.45 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.48 1rtj h PRO 421 Cb 1.21 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1rtj h PRO 421 CO 0.82 0.41 -0.34 -0.07 -0.21 0.00 0.00 178.00 178.61 1rtj h LEU 422 N 0.64 0.96 -0.94 2.35 3.38 -1.99 -2.56 115.31 117.14 1rtj h LEU 422 Ca 0.62 -0.46 0.16 0.00 0.09 0.00 0.00 57.88 58.28 1rtj h LEU 422 Cb 1.09 -0.27 -0.10 0.00 0.09 0.00 0.00 40.66 41.48 1rtj h LEU 422 CO -0.45 1.21 0.55 0.58 0.09 0.00 0.00 178.44 180.43 1rtj h VAL 423 N 0.72 0.77 -0.16 1.22 2.07 -1.86 -0.08 116.25 118.92 1rtj h VAL 423 Ca 0.07 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 1rtj h VAL 423 Cb 0.93 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1rtj h VAL 423 CO 0.09 0.14 -0.07 0.50 0.02 0.00 0.00 177.57 178.25 1rtj h LYS 424 N 0.77 0.33 -0.67 1.57 3.11 -1.58 -1.94 116.57 118.15 1rtj h LYS 424 Ca 0.51 -0.14 0.10 0.00 -2.81 0.00 0.00 60.65 58.31 1rtj h LYS 424 Cb 0.70 -0.01 -0.04 0.00 -1.00 0.00 0.00 32.23 31.87 1rtj h LYS 424 CO -0.34 0.63 0.45 -0.07 -2.81 0.00 0.00 179.45 177.31 1rtj h LEU 425 N 0.01 0.48 0.16 5.20 -0.00 -0.82 -2.57 115.31 117.77 1rtj h LEU 425 Ca 0.04 0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.92 1rtj h LEU 425 Cb 0.53 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.10 1rtj h LEU 425 CO 0.02 0.29 -0.08 -0.25 -0.00 0.00 0.00 178.44 178.42 1rtj h TRP 426 N 0.54 -0.20 0.00 1.13 2.91 -0.92 -3.35 115.95 116.06 1rtj h TRP 426 Ca 0.31 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.32 1rtj h TRP 426 Cb 0.50 0.07 0.00 0.00 -0.51 0.00 0.00 29.16 29.21 1rtj h TRP 426 CO -0.00 -0.12 0.00 1.88 -1.03 0.00 0.00 178.44 179.17 1rtj h TYR 427 N -0.62 0.00 0.00 2.65 0.05 -1.41 0.38 116.97 118.03 1rtj h TYR 427 Ca -0.02 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.73 1rtj h TYR 427 Cb 0.16 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.90 1rtj h TYR 427 CO 0.03 0.00 -0.12 0.37 -1.05 0.00 0.00 178.16 177.39 1rtj h GLN 428 N 0.00 0.00 0.00 4.88 4.15 -1.59 -2.71 115.11 119.84 1rtj h GLN 428 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 1rtj h GLN 428 Cb 0.09 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.78 1rtj h GLN 428 CO 0.00 0.12 -0.08 -0.07 -1.93 0.00 0.00 178.83 176.87 1rtj h LEU 429 N 0.00 0.00 -7.57 -2.39 4.07 -0.36 -3.47 115.31 105.59 1rtj h LEU 429 Ca -0.00 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.43 1rtj h LEU 429 Cb 0.37 0.00 0.13 0.00 1.08 0.00 0.00 40.66 42.24 1rtj h LEU 429 CO 0.02 0.08 -0.76 -0.62 -1.08 0.00 0.00 178.44 176.09 1rtj n GLU 430 N -3.80 0.00 -2.38 1.13 1.02 -1.03 -2.48 120.64 113.10 1rtj n GLU 430 Ca -0.02 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.77 1rtj n GLU 430 Cb 0.18 -0.84 -0.02 0.00 -0.02 0.00 0.00 31.44 30.75 1rtj n GLU 430 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1rtj s LYS 431 N -0.84 3.57 0.20 3.49 2.20 0.16 -4.70 119.74 123.82 1rtj s LYS 431 Ca 0.50 1.45 0.05 0.00 -0.36 0.00 0.00 55.97 57.62 1rtj s LYS 431 Cb -0.57 -2.05 -0.05 0.00 -1.51 0.00 0.00 37.83 33.65 1rtj s LYS 431 CO 0.52 -0.64 -0.08 -1.21 -0.36 0.00 0.00 175.35 173.58 1rtj s GLU 432 N -3.32 1.26 0.87 4.03 2.02 -1.26 -4.83 118.70 117.47 1rtj s GLU 432 Ca 0.69 -1.59 -0.11 0.00 0.02 0.00 0.00 54.97 53.99 1rtj s GLU 432 Cb -0.19 -0.80 0.11 0.00 0.10 0.00 0.00 34.13 33.35 1rtj s GLU 432 CO 0.24 0.05 1.10 -1.25 0.02 0.00 0.00 175.26 175.42 1rtj s PRO 433 N -3.75 1.44 0.24 0.39 0.04 -1.26 -4.93 135.00 127.17 1rtj s PRO 433 Ca 0.23 1.12 -0.04 0.00 0.04 0.00 0.00 61.00 62.35 1rtj s PRO 433 Cb 0.03 -1.81 0.26 0.00 0.04 0.00 0.00 34.50 33.03 1rtj s PRO 433 CO 0.06 -2.20 1.76 -0.84 0.04 0.00 0.00 177.00 175.82 1rtj h ILE 434 N -1.53 1.25 0.00 0.56 3.07 -2.07 -3.42 117.51 115.37 1rtj h ILE 434 Ca -0.47 -0.95 0.00 0.00 1.55 0.00 0.00 64.86 65.00 1rtj h ILE 434 Cb 1.26 0.68 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 1rtj h ILE 434 CO 0.50 0.35 0.00 1.33 -1.05 0.00 0.00 178.15 179.28 1rtj n VAL 435 N -4.24 0.12 0.00 0.16 0.24 -1.26 -5.19 118.33 108.17 1rtj n VAL 435 Ca 0.04 0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 1rtj n VAL 435 Cb 0.27 -0.48 0.00 0.00 -1.47 0.00 0.00 33.84 32.15 1rtj n VAL 435 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rtj n GLY 436 N 2.15 -0.45 2.72 7.63 0.00 -1.26 -4.96 105.19 111.01 1rtj n GLY 436 Ca 0.00 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 1rtj n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rtj n ALA 437 N -0.04 4.69 -0.50 4.61 0.00 -1.26 -4.98 120.51 123.03 1rtj n ALA 437 Ca 0.00 -4.74 -0.21 0.00 0.00 0.00 0.00 53.44 48.49 1rtj n ALA 437 Cb 0.00 -1.16 0.17 0.00 0.00 0.00 0.00 19.45 18.46 1rtj n ALA 437 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1rtj n GLU 438 N 0.36 -2.55 -3.70 0.00 0.00 -1.26 -5.12 120.64 108.38 1rtj n GLU 438 Ca 0.32 -0.75 -0.14 0.00 0.00 0.00 0.00 57.16 56.59 1rtj n GLU 438 Cb 0.37 -1.56 -0.09 0.00 0.00 0.00 0.00 31.44 30.17 1rtj n GLU 438 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1rtj s THR 439 N -2.10 0.02 -2.21 3.84 2.01 -1.26 -5.29 115.64 110.66 1rtj s THR 439 Ca 0.42 -0.19 0.30 0.00 0.31 0.00 0.00 61.69 62.53 1rtj s THR 439 Cb -0.08 -0.68 0.76 0.00 0.01 0.00 0.00 72.50 72.51 1rtj s THR 439 CO 0.40 -0.11 2.03 0.33 -0.69 0.00 0.00 174.62 176.58