#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s6q s ILE 2 N 0.00 3.83 -0.76 4.25 1.10 -1.26 -5.03 121.20 123.33 1s6q s ILE 2 Ca 0.00 -0.68 -0.26 0.00 -0.51 0.00 0.00 60.65 59.20 1s6q s ILE 2 Cb 0.00 -2.67 -0.11 0.00 0.15 0.00 0.00 42.46 39.83 1s6q s ILE 2 CO 0.00 0.41 2.33 -0.94 -2.11 0.00 0.00 174.94 174.63 1s6q s SER 3 N -1.40 4.16 0.00 4.50 1.04 -1.26 -4.80 113.70 115.95 1s6q s SER 3 Ca 0.17 0.10 0.22 0.00 0.48 0.00 0.00 55.95 56.92 1s6q s SER 3 Cb -0.11 -2.54 1.19 0.00 0.10 0.00 0.00 66.02 64.65 1s6q s SER 3 CO 0.08 -3.56 1.72 -0.81 0.98 0.00 0.00 173.24 171.64 1s6q n PRO 4 N 8.86 0.44 -2.38 4.02 -0.04 -1.26 -4.91 135.00 139.72 1s6q n PRO 4 Ca 0.44 0.05 -0.05 0.00 -0.04 0.00 0.00 63.50 63.91 1s6q n PRO 4 Cb 0.45 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.42 1s6q n PRO 4 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1s6q n ILE 5 N -1.20 0.00 -3.77 0.52 5.41 -1.26 -5.09 119.36 113.98 1s6q n ILE 5 Ca 0.12 -0.55 -0.30 0.00 1.00 0.00 0.00 62.75 63.02 1s6q n ILE 5 Cb 0.14 0.47 -0.15 0.00 -0.71 0.00 0.00 39.64 39.39 1s6q n ILE 5 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1s6q s GLU 6 N -2.13 0.81 0.40 0.38 0.41 -1.26 -4.95 118.70 112.37 1s6q s GLU 6 Ca 0.09 -1.19 -0.11 0.00 -0.41 0.00 0.00 54.97 53.35 1s6q s GLU 6 Cb -0.02 -2.13 -0.08 0.00 -1.78 0.00 0.00 34.13 30.12 1s6q s GLU 6 CO 0.07 -0.99 -0.60 0.25 -0.49 0.00 0.00 175.26 173.50 1s6q n THR 7 N 4.75 0.00 -4.16 3.63 -2.24 -1.26 -5.02 114.28 109.97 1s6q n THR 7 Ca -0.01 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.51 1s6q n THR 7 Cb 0.42 0.00 -0.17 0.00 -2.10 0.00 0.00 70.33 68.48 1s6q n THR 7 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1s6q s VAL 8 N -0.84 1.13 0.10 2.28 1.01 -1.26 -4.97 120.40 117.85 1s6q s VAL 8 Ca 0.14 -0.40 -0.33 0.00 0.00 0.00 0.00 61.98 61.39 1s6q s VAL 8 Cb 0.04 -1.09 -0.12 0.00 0.00 0.00 0.00 36.38 35.21 1s6q s VAL 8 CO 0.25 0.37 1.73 -2.65 0.00 0.00 0.00 175.10 174.81 1s6q n PRO 9 N 4.52 2.40 -4.03 2.72 -0.02 -1.26 -4.31 135.00 135.01 1s6q n PRO 9 Ca -0.17 0.87 -0.31 0.00 -2.02 0.00 0.00 63.50 61.88 1s6q n PRO 9 Cb 0.51 -2.70 -0.16 0.00 -0.02 0.00 0.00 33.50 31.12 1s6q n PRO 9 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1s6q s VAL 10 N 2.15 1.66 -0.15 -1.45 1.01 -1.26 -5.11 120.40 117.26 1s6q s VAL 10 Ca 0.82 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 62.09 1s6q s VAL 10 Cb -0.61 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.21 1s6q s VAL 10 CO 0.40 0.43 -0.19 -0.75 0.00 0.00 0.00 175.10 174.99 1s6q s LYS 11 N 1.44 2.78 1.09 2.72 2.20 -1.26 -4.75 119.74 123.96 1s6q s LYS 11 Ca 0.04 -0.76 -0.16 0.00 -0.36 0.00 0.00 55.97 54.73 1s6q s LYS 11 Cb -0.13 -2.34 0.14 0.00 -1.51 0.00 0.00 37.83 33.99 1s6q s LYS 11 CO -0.11 -0.11 0.37 1.28 -0.36 0.00 0.00 175.35 176.42 1s6q n LEU 12 N 4.34 -1.44 -4.77 5.43 4.32 -1.26 -4.89 117.00 118.73 1s6q n LEU 12 Ca -0.20 -0.02 -0.41 0.00 -0.02 0.00 0.00 56.01 55.37 1s6q n LEU 12 Cb 0.51 -1.10 -0.02 0.00 -1.62 0.00 0.00 43.42 41.19 1s6q n LEU 12 CO 0.25 -3.19 1.02 -0.75 -1.22 0.00 0.00 177.39 173.50 1s6q s LYS 13 N -3.76 4.30 0.53 3.23 2.20 -1.20 -4.92 119.74 120.12 1s6q s LYS 13 Ca 0.60 2.30 -0.22 0.00 -0.36 0.00 0.00 55.97 58.29 1s6q s LYS 13 Cb -0.17 -3.04 -0.06 0.00 -1.51 0.00 0.00 37.83 33.04 1s6q s LYS 13 CO 0.66 -0.27 1.22 -2.30 -0.36 0.00 0.00 175.35 174.29 1s6q n PRO 14 N 0.71 1.49 -0.99 4.03 -0.02 -1.26 -1.34 135.00 137.62 1s6q n PRO 14 Ca 0.00 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1s6q n PRO 14 Cb 0.41 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1s6q n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s6q n GLY 15 N 0.94 0.54 3.45 -1.23 0.00 -1.26 -5.01 105.19 102.62 1s6q n GLY 15 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1s6q n GLY 15 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1s6q s MET 16 N -0.14 2.89 0.20 1.61 0.00 -0.45 -5.12 119.30 118.30 1s6q s MET 16 Ca 0.00 -0.67 0.10 0.00 0.00 0.00 0.00 55.69 55.12 1s6q s MET 16 Cb 0.00 -2.52 -0.04 0.00 0.00 0.00 0.00 34.83 32.27 1s6q s MET 16 CO 0.00 0.47 -0.11 0.34 0.00 0.00 0.00 175.02 175.72 1s6q s ASP 17 N -0.32 4.13 1.00 1.11 3.68 -1.26 -4.77 116.67 120.24 1s6q s ASP 17 Ca 0.03 -0.66 -0.16 0.00 2.13 0.00 0.00 52.55 53.89 1s6q s ASP 17 Cb -0.13 -0.64 0.08 0.00 -1.45 0.00 0.00 42.92 40.78 1s6q s ASP 17 CO 0.02 0.09 -0.11 0.61 0.13 0.00 0.00 175.17 175.91 1s6q n GLY 18 N -0.10 -2.46 3.80 2.66 0.00 -1.26 -4.95 105.19 102.89 1s6q n GLY 18 Ca -0.10 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 44.92 1s6q n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1s6q s PRO 19 N -3.10 4.36 -0.44 1.61 0.04 -1.26 -5.01 135.00 131.19 1s6q s PRO 19 Ca 0.39 0.96 0.08 0.00 0.04 0.00 0.00 61.00 62.47 1s6q s PRO 19 Cb -0.04 -3.05 0.25 0.00 0.04 0.00 0.00 34.50 31.70 1s6q s PRO 19 CO 0.46 0.48 0.58 1.63 0.04 0.00 0.00 177.00 180.19 1s6q n LYS 20 N 1.12 1.11 -3.74 4.56 5.02 -1.24 -0.30 118.16 124.68 1s6q n LYS 20 Ca -0.04 -3.53 -0.29 0.00 -2.02 0.00 0.00 58.31 52.42 1s6q n LYS 20 Cb 0.50 -1.44 -0.04 0.00 -0.02 0.00 0.00 35.03 34.03 1s6q n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1s6q s VAL 21 N -1.50 5.23 0.28 -0.18 1.01 0.77 -4.87 120.40 121.13 1s6q s VAL 21 Ca 0.36 -0.28 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 1s6q s VAL 21 Cb 0.17 -3.68 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 1s6q s VAL 21 CO -0.09 -0.05 0.81 -0.54 0.00 0.00 0.00 175.10 175.23 1s6q s LYS 22 N -2.99 4.33 -0.12 2.72 -0.14 -1.26 -4.43 119.74 117.85 1s6q s LYS 22 Ca 0.38 1.01 -0.26 0.00 -1.36 0.00 0.00 55.97 55.74 1s6q s LYS 22 Cb -0.12 -2.77 -0.02 0.00 -1.68 0.00 0.00 37.83 33.24 1s6q s LYS 22 CO 0.28 0.31 0.86 -1.14 -0.76 0.00 0.00 175.35 174.90 1s6q s GLN 23 N -2.16 4.38 0.52 1.68 2.00 -1.26 -4.63 119.66 120.18 1s6q s GLN 23 Ca 0.47 1.11 -0.21 0.00 -2.00 0.00 0.00 55.36 54.74 1s6q s GLN 23 Cb -0.16 -3.53 -0.06 0.00 0.80 0.00 0.00 33.01 30.05 1s6q s GLN 23 CO 0.21 -0.22 1.15 -1.58 -0.50 0.00 0.00 175.29 174.34 1s6q s TRP 24 N 1.75 2.72 0.48 1.67 0.51 -1.26 -4.98 118.94 119.84 1s6q s TRP 24 Ca 0.42 1.54 -0.22 0.00 -2.12 0.00 0.00 56.10 55.72 1s6q s TRP 24 Cb -0.18 -3.33 -0.07 0.00 -0.81 0.00 0.00 33.47 29.08 1s6q s TRP 24 CO 0.16 -1.60 1.15 -1.25 -0.51 0.00 0.00 176.95 174.91 1s6q s PRO 25 N -3.09 3.64 0.35 4.98 0.04 -1.26 -4.93 135.00 134.73 1s6q s PRO 25 Ca 0.70 1.71 0.09 0.00 0.04 0.00 0.00 61.00 63.55 1s6q s PRO 25 Cb -0.26 -2.28 -0.06 0.00 0.04 0.00 0.00 34.50 31.94 1s6q s PRO 25 CO 0.30 -0.63 -0.05 -0.51 0.04 0.00 0.00 177.00 176.14 1s6q s LEU 26 N -3.26 2.82 0.56 -3.56 1.43 -1.26 -5.13 118.68 110.27 1s6q s LEU 26 Ca 0.66 -1.15 -0.18 0.00 -1.03 0.00 0.00 54.13 52.43 1s6q s LEU 26 Cb -0.27 -1.09 -0.05 0.00 0.03 0.00 0.00 46.19 44.81 1s6q s LEU 26 CO 0.32 -0.24 1.08 -0.89 0.23 0.00 0.00 176.35 176.85 1s6q s THR 27 N -2.59 3.57 0.45 5.49 2.01 -1.26 -4.89 115.64 118.42 1s6q s THR 27 Ca 0.33 0.86 0.14 0.00 0.31 0.00 0.00 61.69 63.34 1s6q s THR 27 Cb 0.02 -3.34 0.32 0.00 0.01 0.00 0.00 72.50 69.51 1s6q s THR 27 CO 0.17 -0.32 2.02 -0.08 -0.69 0.00 0.00 174.62 175.72 1s6q h GLU 28 N 0.89 0.32 0.20 4.92 4.81 -2.00 -1.88 114.58 121.85 1s6q h GLU 28 Ca -0.48 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.72 1s6q h GLU 28 Cb 1.23 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1s6q h GLU 28 CO 0.57 0.21 -0.10 0.93 -0.73 0.00 0.00 179.01 179.90 1s6q h GLU 29 N 0.33 -0.26 -0.97 1.92 3.07 -2.00 -3.04 114.58 113.63 1s6q h GLU 29 Ca 0.21 0.02 0.20 0.00 -0.50 0.00 0.00 59.36 59.30 1s6q h GLU 29 Cb 0.41 0.06 -0.11 0.00 -0.84 0.00 0.00 28.75 28.27 1s6q h GLU 29 CO -0.05 0.13 0.55 0.87 -1.40 0.00 0.00 179.01 179.12 1s6q h LYS 30 N -0.82 0.63 0.72 2.33 1.79 -1.85 -0.37 116.57 118.99 1s6q h LYS 30 Ca -0.03 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 1s6q h LYS 30 Cb 0.52 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 1s6q h LYS 30 CO 0.05 0.41 -0.41 0.82 -1.08 0.00 0.00 179.45 179.24 1s6q h ILE 31 N 0.64 0.00 -1.13 1.86 5.03 -1.32 -2.20 117.51 120.38 1s6q h ILE 31 Ca 0.58 0.00 0.39 0.00 -0.12 0.00 0.00 64.86 65.71 1s6q h ILE 31 Cb 0.98 0.00 -0.15 0.00 -3.03 0.00 0.00 36.82 34.63 1s6q h ILE 31 CO -0.43 0.00 0.68 0.11 -0.68 0.00 0.00 178.15 177.84 1s6q h LYS 32 N -1.04 0.14 0.08 2.37 1.57 -1.00 0.39 116.57 119.07 1s6q h LYS 32 Ca -0.10 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1s6q h LYS 32 Cb 0.82 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.10 1s6q h LYS 32 CO 0.12 0.09 -0.05 0.00 -0.57 0.00 0.00 179.45 179.04 1s6q h ALA 33 N 1.78 -0.90 -0.17 3.86 0.00 -0.83 -0.56 119.26 122.43 1s6q h ALA 33 Ca 0.79 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.73 1s6q h ALA 33 Cb 2.19 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 20.10 1s6q h ALA 33 CO -0.56 -0.89 -0.39 -0.07 0.00 0.00 0.00 179.25 177.34 1s6q h LEU 34 N -0.12 -1.23 -0.97 0.00 3.38 -0.08 0.91 115.31 117.19 1s6q h LEU 34 Ca -0.01 0.17 0.32 0.00 0.09 0.00 0.00 57.88 58.45 1s6q h LEU 34 Cb 0.10 0.51 -0.16 0.00 0.09 0.00 0.00 40.66 41.20 1s6q h LEU 34 CO 0.01 -0.40 0.41 0.58 0.09 0.00 0.00 178.44 179.13 1s6q h VAL 35 N -0.44 0.18 0.53 1.22 2.07 -0.34 0.76 116.25 120.24 1s6q h VAL 35 Ca 0.09 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 1s6q h VAL 35 Cb 0.60 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1s6q h VAL 35 CO -0.41 0.03 -0.26 -0.33 0.02 0.00 0.00 177.57 176.62 1s6q h GLU 36 N 0.17 -0.69 -0.73 1.57 4.39 0.77 -2.76 114.58 117.29 1s6q h GLU 36 Ca 0.71 0.05 0.15 0.00 0.34 0.00 0.00 59.36 60.60 1s6q h GLU 36 Cb 1.65 0.16 -0.14 0.00 -0.10 0.00 0.00 28.75 30.32 1s6q h GLU 36 CO -0.71 -0.43 -0.16 0.82 -1.16 0.00 0.00 179.01 177.38 1s6q h ILE 37 N -1.15 0.28 -0.10 3.13 2.04 0.12 -0.01 117.51 121.81 1s6q h ILE 37 Ca -0.07 -0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 1s6q h ILE 37 Cb 0.58 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1s6q h ILE 37 CO 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 178.15 178.09 1s6q h THR 39 N 0.15 1.23 0.05 0.00 2.02 -0.69 0.64 112.91 116.31 1s6q h THR 39 Ca 0.03 -1.31 -0.00 0.00 0.77 0.00 0.00 66.41 65.90 1s6q h THR 39 Cb 0.41 1.71 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 1s6q h THR 39 CO 0.03 0.37 -0.02 -0.33 0.37 0.00 0.00 175.52 175.93 1s6q h GLU 40 N 0.00 -0.06 -1.04 6.66 5.08 -1.31 -2.58 114.58 121.33 1s6q h GLU 40 Ca -0.00 0.00 0.27 0.00 -1.00 0.00 0.00 59.36 58.63 1s6q h GLU 40 Cb 0.68 0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.84 1s6q h GLU 40 CO 0.05 0.54 0.65 0.52 -1.00 0.00 0.00 179.01 179.77 1s6q h MET 41 N -0.91 0.43 -0.39 2.33 2.86 -0.96 0.25 114.93 118.54 1s6q h MET 41 Ca -0.01 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.55 1s6q h MET 41 Cb 0.63 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1s6q h MET 41 CO 0.01 0.29 0.02 1.49 1.06 0.00 0.00 176.91 179.78 1s6q h GLU 42 N 0.45 0.68 0.15 1.72 4.81 -0.88 0.22 114.58 121.72 1s6q h GLU 42 Ca 0.63 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.65 1s6q h GLU 42 Cb 1.46 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.78 1s6q h GLU 42 CO -0.39 0.76 -0.07 0.87 -0.73 0.00 0.00 179.01 179.45 1s6q h LYS 43 N 0.51 -0.19 -0.77 1.92 1.57 -0.24 -2.33 116.57 117.05 1s6q h LYS 43 Ca 0.11 0.01 0.22 0.00 -1.87 0.00 0.00 60.65 59.13 1s6q h LYS 43 Cb 0.44 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 1s6q h LYS 43 CO 0.02 0.09 0.62 0.93 -0.57 0.00 0.00 179.45 180.54 1s6q h GLU 44 N -0.47 0.00 0.00 3.15 5.08 -0.63 -3.45 114.58 118.27 1s6q h GLU 44 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1s6q h GLU 44 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1s6q h GLU 44 CO 0.03 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.45 1s6q n GLY 45 N -1.65 0.92 0.07 -3.84 0.00 -0.19 -4.76 105.19 95.74 1s6q n GLY 45 Ca 0.16 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 1s6q n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s6q h LYS 46 N 1.91 0.05 -6.18 1.61 1.57 -0.87 -3.45 116.57 111.20 1s6q h LYS 46 Ca 0.00 -0.04 -0.59 0.00 -1.87 0.00 0.00 60.65 58.15 1s6q h LYS 46 Cb 0.00 0.01 -0.12 0.00 0.08 0.00 0.00 32.23 32.20 1s6q h LYS 46 CO 0.00 0.70 -0.71 0.96 -0.57 0.00 0.00 179.45 179.83 1s6q s ILE 47 N -3.56 2.80 0.14 1.86 -4.36 -1.23 0.12 121.20 116.97 1s6q s ILE 47 Ca -0.17 -2.21 0.05 0.00 -0.26 0.00 0.00 60.65 58.07 1s6q s ILE 47 Cb 0.01 -2.53 -0.04 0.00 1.25 0.00 0.00 42.46 41.15 1s6q s ILE 47 CO 0.69 -0.37 -0.12 -0.44 0.24 0.00 0.00 174.94 174.94 1s6q s SER 48 N -3.58 1.94 0.20 4.36 0.01 0.18 -4.35 113.70 112.45 1s6q s SER 48 Ca 0.31 -0.90 -0.29 0.00 1.31 0.00 0.00 55.95 56.38 1s6q s SER 48 Cb -0.05 -0.05 -0.08 0.00 0.21 0.00 0.00 66.02 66.05 1s6q s SER 48 CO 0.17 -0.22 0.89 -0.54 0.41 0.00 0.00 173.24 173.95 1s6q s LYS 49 N -3.16 4.75 0.38 12.44 1.02 -1.26 -0.37 119.74 133.53 1s6q s LYS 49 Ca 0.13 1.38 0.08 0.00 0.02 0.00 0.00 55.97 57.58 1s6q s LYS 49 Cb -0.02 -3.29 -0.04 0.00 -0.52 0.00 0.00 37.83 33.96 1s6q s LYS 49 CO 0.02 0.49 0.21 0.96 -0.92 0.00 0.00 175.35 176.11 1s6q s ILE 50 N -0.98 2.77 0.02 2.17 -4.36 -0.58 -4.88 121.20 115.37 1s6q s ILE 50 Ca 0.40 -1.61 0.00 0.00 -0.26 0.00 0.00 60.65 59.19 1s6q s ILE 50 Cb -0.25 -3.00 0.00 0.00 1.25 0.00 0.00 42.46 40.47 1s6q s ILE 50 CO 0.30 -0.09 0.03 0.61 0.24 0.00 0.00 174.94 176.02 1s6q n GLY 51 N -1.26 2.03 0.07 6.27 0.00 -1.26 -4.82 105.19 106.22 1s6q n GLY 51 Ca -0.01 -2.14 0.13 0.00 0.00 0.00 0.00 46.02 44.00 1s6q n GLY 51 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1s6q n PRO 52 N -1.01 0.17 0.00 1.61 -0.02 -1.26 -2.91 135.00 131.59 1s6q n PRO 52 Ca 0.01 0.15 0.06 0.00 -2.02 0.00 0.00 63.50 61.70 1s6q n PRO 52 Cb 0.02 -1.71 0.30 0.00 -0.02 0.00 0.00 33.50 32.09 1s6q n PRO 52 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1s6q n GLU 53 N -2.01 0.05 -3.47 -0.52 0.00 -1.26 -4.25 120.64 109.18 1s6q n GLU 53 Ca 0.06 0.24 -0.43 0.00 0.00 0.00 0.00 57.16 57.03 1s6q n GLU 53 Cb 0.39 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.24 1s6q n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1s6q s ASN 54 N -2.89 5.98 0.38 -1.84 3.84 -1.15 -4.91 114.94 114.37 1s6q s ASN 54 Ca 0.08 -1.27 0.23 0.00 0.21 0.00 0.00 52.86 52.11 1s6q s ASN 54 Cb 0.09 -2.12 0.25 0.00 -0.55 0.00 0.00 41.25 38.92 1s6q s ASN 54 CO 0.23 -0.57 1.47 1.55 -2.79 0.00 0.00 177.10 176.99 1s6q h PRO 55 N 8.63 0.00 -7.39 0.43 0.13 -1.88 -3.48 132.00 128.44 1s6q h PRO 55 Ca -0.27 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.40 1s6q h PRO 55 Cb 1.10 0.00 0.15 0.00 0.13 0.00 0.00 31.00 32.38 1s6q h PRO 55 CO 0.81 0.01 0.24 0.71 -0.23 0.00 0.00 178.00 179.54 1s6q s TYR 56 N -3.24 2.31 -0.29 1.56 2.02 -1.26 -4.88 117.35 113.57 1s6q s TYR 56 Ca 0.05 1.03 -0.22 0.00 -0.37 0.00 0.00 57.07 57.57 1s6q s TYR 56 Cb 0.06 -3.25 0.17 0.00 -0.40 0.00 0.00 41.96 38.54 1s6q s TYR 56 CO 0.70 -2.56 1.23 1.21 -1.57 0.00 0.00 175.55 174.56 1s6q s ASN 57 N -3.62 -0.23 0.00 2.29 2.47 0.59 -4.84 114.94 111.60 1s6q s ASN 57 Ca 0.64 0.42 0.04 0.00 0.42 0.00 0.00 52.86 54.38 1s6q s ASN 57 Cb -0.17 0.66 -0.01 0.00 -1.45 0.00 0.00 41.25 40.27 1s6q s ASN 57 CO 0.56 -0.07 -0.13 -0.89 -3.72 0.00 0.00 177.10 172.85 1s6q s THR 58 N 0.48 1.01 0.69 -5.21 2.01 -0.21 -0.16 115.64 114.24 1s6q s THR 58 Ca 0.01 -0.65 -0.17 0.00 0.31 0.00 0.00 61.69 61.19 1s6q s THR 58 Cb -0.04 -0.87 0.01 0.00 0.01 0.00 0.00 72.50 71.61 1s6q s THR 58 CO -0.12 0.21 1.19 -2.65 -0.69 0.00 0.00 174.62 172.56 1s6q n PRO 59 N 2.55 0.81 -3.96 4.92 -0.02 -1.26 -4.27 135.00 133.77 1s6q n PRO 59 Ca -0.15 0.34 -0.09 0.00 -2.02 0.00 0.00 63.50 61.58 1s6q n PRO 59 Cb 0.55 -2.43 -0.10 0.00 -0.02 0.00 0.00 33.50 31.51 1s6q n PRO 59 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1s6q s VAL 60 N -1.61 0.14 0.22 -1.45 -7.23 -1.26 -0.49 120.40 108.72 1s6q s VAL 60 Ca 0.79 -1.15 -0.04 0.00 -1.81 0.00 0.00 61.98 59.77 1s6q s VAL 60 Cb -0.36 -0.85 -0.03 0.00 0.56 0.00 0.00 36.38 35.70 1s6q s VAL 60 CO 0.44 -0.63 0.24 -0.36 -0.31 0.00 0.00 175.10 174.48 1s6q s PHE 61 N -2.54 0.98 -0.12 2.82 0.40 -0.83 -4.84 117.98 113.85 1s6q s PHE 61 Ca -0.06 -1.22 0.02 0.00 -0.60 0.00 0.00 56.93 55.08 1s6q s PHE 61 Cb -0.02 -0.36 0.01 0.00 0.51 0.00 0.00 43.02 43.16 1s6q s PHE 61 CO -0.04 -0.76 -0.19 0.00 0.70 0.00 0.00 175.22 174.93 1s6q s ALA 62 N -4.06 1.96 0.19 5.36 0.00 -1.26 -1.62 121.76 122.33 1s6q s ALA 62 Ca 0.35 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.43 1s6q s ALA 62 Cb 0.05 -0.87 -0.05 0.00 0.00 0.00 0.00 23.12 22.25 1s6q s ALA 62 CO 0.12 0.03 0.02 0.96 0.00 0.00 0.00 175.76 176.89 1s6q s ILE 63 N 0.77 0.63 -0.34 0.00 -4.36 -0.55 -4.95 121.20 112.39 1s6q s ILE 63 Ca -0.10 -1.98 -0.15 0.00 -0.26 0.00 0.00 60.65 58.16 1s6q s ILE 63 Cb -0.16 -2.21 -0.01 0.00 1.25 0.00 0.00 42.46 41.33 1s6q s ILE 63 CO 0.01 -0.38 0.35 -0.54 0.24 0.00 0.00 174.94 174.61 1s6q s LYS 64 N -3.94 3.54 -0.51 0.37 3.01 -1.26 0.11 119.74 121.05 1s6q s LYS 64 Ca 0.27 -0.46 -0.26 0.00 -1.01 0.00 0.00 55.97 54.51 1s6q s LYS 64 Cb 0.06 -3.81 0.03 0.00 -1.01 0.00 0.00 37.83 33.11 1s6q s LYS 64 CO 0.06 -0.52 0.99 0.21 0.51 0.00 0.00 175.35 176.59 1s6q s LYS 65 N 1.98 3.49 -2.04 1.68 2.47 -1.26 -3.95 119.74 122.10 1s6q s LYS 65 Ca 0.11 0.08 0.00 0.00 -1.56 0.00 0.00 55.97 54.60 1s6q s LYS 65 Cb -0.17 -3.98 0.00 0.00 -1.46 0.00 0.00 37.83 32.23 1s6q s LYS 65 CO 0.12 -1.39 0.00 1.63 0.16 0.00 0.00 175.35 175.87 1s6q n LYS 66 N 7.51 -1.49 -0.66 4.03 4.76 -1.26 -2.70 118.16 128.35 1s6q n LYS 66 Ca 0.06 1.15 0.00 0.00 -2.87 0.00 0.00 58.31 56.65 1s6q n LYS 66 Cb 0.48 -5.60 0.00 0.00 -1.84 0.00 0.00 35.03 28.07 1s6q n LYS 66 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1s6q n ASP 67 N -1.49 0.00 -3.52 4.39 5.75 -1.25 -5.02 116.55 115.40 1s6q n ASP 67 Ca -0.22 0.00 -0.09 0.00 -0.01 0.00 0.00 54.79 54.48 1s6q n ASP 67 Cb 0.68 -0.82 0.08 0.00 -1.03 0.00 0.00 41.12 40.03 1s6q n ASP 67 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1s6q n SER 68 N 0.00 -2.48 0.08 -1.12 7.64 -1.10 -4.89 113.62 111.76 1s6q n SER 68 Ca 0.00 -0.25 -0.15 0.00 1.01 0.00 0.00 58.87 59.48 1s6q n SER 68 Cb 0.00 -0.59 -0.08 0.00 -1.01 0.00 0.00 64.21 62.53 1s6q n SER 68 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1s6q h THR 69 N -2.40 1.43 -3.00 0.44 2.02 -1.95 -3.46 112.91 105.98 1s6q h THR 69 Ca -0.11 -2.66 -0.60 0.00 0.77 0.00 0.00 66.41 63.81 1s6q h THR 69 Cb 0.38 2.62 -0.04 0.00 -1.74 0.00 0.00 68.15 69.37 1s6q h THR 69 CO 0.07 0.79 -0.42 -0.75 0.37 0.00 0.00 175.52 175.57 1s6q s LYS 70 N -3.03 3.51 0.58 6.66 2.36 -1.26 -5.09 119.74 123.47 1s6q s LYS 70 Ca -0.05 -0.30 -0.16 0.00 -2.55 0.00 0.00 55.97 52.90 1s6q s LYS 70 Cb 0.08 -2.96 -0.04 0.00 -1.05 0.00 0.00 37.83 33.86 1s6q s LYS 70 CO 0.88 0.55 1.06 -1.58 1.55 0.00 0.00 175.35 177.80 1s6q s TRP 71 N -1.58 2.95 -0.02 4.03 0.52 -1.26 -4.43 118.94 119.14 1s6q s TRP 71 Ca 0.37 1.52 0.06 0.00 0.02 0.00 0.00 56.10 58.07 1s6q s TRP 71 Cb -0.13 -3.04 -0.01 0.00 -1.15 0.00 0.00 33.47 29.15 1s6q s TRP 71 CO 0.27 -1.14 -0.19 0.50 0.02 0.00 0.00 176.95 176.40 1s6q s ARG 72 N -3.96 1.67 -0.11 4.98 3.52 0.12 -4.96 118.95 120.20 1s6q s ARG 72 Ca 0.65 -0.69 -0.25 0.00 -0.13 0.00 0.00 55.73 55.30 1s6q s ARG 72 Cb -0.17 -1.57 -0.02 0.00 -1.56 0.00 0.00 34.95 31.63 1s6q s ARG 72 CO 0.35 0.39 0.80 0.21 -0.81 0.00 0.00 175.30 176.24 1s6q s LYS 73 N -0.36 4.37 -0.38 5.12 2.20 -1.26 -1.49 119.74 127.95 1s6q s LYS 73 Ca 0.05 1.00 0.04 0.00 -0.36 0.00 0.00 55.97 56.70 1s6q s LYS 73 Cb -0.09 -3.52 0.11 0.00 -1.51 0.00 0.00 37.83 32.82 1s6q s LYS 73 CO -0.00 -0.16 0.10 -1.17 -0.36 0.00 0.00 175.35 173.76 1s6q s LEU 74 N 1.55 4.53 0.19 5.43 2.96 -0.64 -4.99 118.68 127.71 1s6q s LEU 74 Ca 0.39 -2.32 -0.30 0.00 -0.22 0.00 0.00 54.13 51.68 1s6q s LEU 74 Cb -0.17 -1.59 -0.08 0.00 0.50 0.00 0.00 46.19 44.85 1s6q s LEU 74 CO 0.16 -0.35 1.11 -0.69 -1.32 0.00 0.00 176.35 175.27 1s6q s VAL 75 N 0.67 3.78 -1.28 1.68 1.01 -1.26 -1.96 120.40 123.04 1s6q s VAL 75 Ca 0.12 1.56 -0.07 0.00 0.00 0.00 0.00 61.98 63.59 1s6q s VAL 75 Cb -0.20 -4.00 0.16 0.00 0.00 0.00 0.00 36.38 32.34 1s6q s VAL 75 CO -0.07 0.28 2.05 -0.67 0.00 0.00 0.00 175.10 176.69 1s6q n ASP 76 N 2.25 6.34 -0.50 3.32 2.03 0.36 -4.81 116.55 125.54 1s6q n ASP 76 Ca 0.02 -3.15 0.00 0.00 0.52 0.00 0.00 54.79 52.19 1s6q n ASP 76 Cb 0.46 -1.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.44 1s6q n ASP 76 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1s6q n PHE 77 N 2.84 0.00 0.25 -0.67 3.72 -1.26 -4.25 117.46 118.08 1s6q n PHE 77 Ca 0.48 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.99 1s6q n PHE 77 Cb 0.31 -0.02 0.71 0.00 -0.94 0.00 0.00 39.48 39.54 1s6q n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1s6q h ARG 78 N 0.76 0.00 0.07 -1.08 3.08 -1.89 -2.19 114.38 113.12 1s6q h ARG 78 Ca 0.00 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.82 1s6q h ARG 78 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1s6q h ARG 78 CO 0.00 0.00 -1.21 1.49 -1.07 0.00 0.00 179.97 179.18 1s6q h GLU 79 N 0.00 0.14 -0.28 0.04 4.57 -2.01 -3.15 114.58 113.89 1s6q h GLU 79 Ca 0.02 -0.24 0.05 0.00 -1.18 0.00 0.00 59.36 58.02 1s6q h GLU 79 Cb 0.09 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 1s6q h GLU 79 CO -0.00 1.11 0.19 1.25 -1.18 0.00 0.00 179.01 180.39 1s6q h LEU 80 N -0.58 0.12 0.53 1.64 5.85 -1.87 -2.10 115.31 118.90 1s6q h LEU 80 Ca -0.28 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 1s6q h LEU 80 Cb 1.54 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 42.55 1s6q h LEU 80 CO -0.03 0.08 -0.25 0.78 -0.34 0.00 0.00 178.44 178.67 1s6q h ASN 81 N 0.13 -0.60 -0.90 1.25 2.35 -1.49 0.54 115.58 116.87 1s6q h ASN 81 Ca 0.12 0.02 0.20 0.00 -0.55 0.00 0.00 56.30 56.09 1s6q h ASN 81 Cb 0.33 0.16 -0.17 0.00 0.05 0.00 0.00 38.32 38.69 1s6q h ASN 81 CO -0.02 -0.38 -0.13 0.11 -1.65 0.00 0.00 177.43 175.36 1s6q h LYS 82 N -0.81 0.02 -0.15 0.81 1.57 -1.45 0.79 116.57 117.36 1s6q h LYS 82 Ca -0.07 -0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.61 1s6q h LYS 82 Cb 0.55 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 1s6q h LYS 82 CO 0.12 0.01 -0.35 0.00 -0.57 0.00 0.00 179.45 178.67 1s6q h ARG 83 N 0.02 0.30 0.00 3.15 3.08 -1.24 -3.35 114.38 116.33 1s6q h ARG 83 Ca 0.47 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1s6q h ARG 83 Cb 0.79 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1s6q h ARG 83 CO -0.88 0.61 0.00 0.25 -1.07 0.00 0.00 179.97 178.88 1s6q n THR 84 N -4.07 0.00 0.21 2.04 -2.24 0.27 -3.22 114.28 107.26 1s6q n THR 84 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1s6q n THR 84 Cb 0.44 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 1s6q n THR 84 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1s6q n GLN 85 N -0.92 0.02 -0.24 -0.78 0.00 -0.59 0.11 117.38 114.98 1s6q n GLN 85 Ca 0.00 0.61 -0.08 0.00 -0.00 0.00 0.00 57.00 57.53 1s6q n GLN 85 Cb 0.00 -2.31 0.04 0.00 0.00 0.00 0.00 30.24 27.97 1s6q n GLN 85 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 1s6q h ASP 86 N 0.00 1.03 -0.43 1.69 3.58 -1.68 0.86 116.42 121.47 1s6q h ASP 86 Ca 0.00 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.21 1s6q h ASP 86 Cb 1.61 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 42.39 1s6q h ASP 86 CO 0.00 1.01 0.00 0.49 -2.88 0.00 0.00 179.24 177.86 1s6q n PHE 87 N -4.26 1.54 -0.42 0.28 3.01 0.30 -2.95 117.46 114.96 1s6q n PHE 87 Ca 0.04 -0.53 0.00 0.00 1.01 0.00 0.00 57.45 57.97 1s6q n PHE 87 Cb 0.27 -0.40 0.00 0.00 -0.01 0.00 0.00 39.48 39.33 1s6q n PHE 87 CO 0.00 0.00 0.00 0.91 1.01 0.00 0.00 176.76 178.68 1s6q n TRP 88 N 0.47 0.00 0.77 1.38 7.02 0.03 -3.71 117.44 123.41 1s6q n TRP 88 Ca 0.21 -0.17 0.12 0.00 -1.02 0.00 0.00 57.50 56.63 1s6q n TRP 88 Cb 0.95 -0.02 0.13 0.00 -2.42 0.00 0.00 31.31 29.95 1s6q n TRP 88 CO 0.00 0.00 0.00 -0.85 -2.02 0.00 0.00 177.69 174.82 1s6q n GLU 89 N -0.17 2.29 0.00 -0.99 0.28 0.28 -2.94 120.64 119.39 1s6q n GLU 89 Ca 0.00 -1.99 0.00 0.00 -0.16 0.00 0.00 57.16 55.01 1s6q n GLU 89 Cb 0.25 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.66 1s6q n GLU 89 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1s6q n VAL 90 N 1.35 0.00 -0.33 3.84 0.31 -1.25 -3.64 118.33 118.61 1s6q n VAL 90 Ca 0.15 0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.60 1s6q n VAL 90 Cb 0.58 -0.36 0.24 0.00 -0.91 0.00 0.00 33.84 33.39 1s6q n VAL 90 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1s6q n GLN 91 N -0.29 -0.08 -0.82 5.55 7.27 -1.24 -1.15 117.38 126.62 1s6q n GLN 91 Ca 0.00 1.43 0.05 0.00 0.07 0.00 0.00 57.00 58.55 1s6q n GLN 91 Cb 0.00 -2.23 0.17 0.00 2.41 0.00 0.00 30.24 30.59 1s6q n GLN 91 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1s6q n LEU 92 N -5.44 2.40 -4.54 1.69 4.77 -1.21 -5.07 117.00 109.61 1s6q n LEU 92 Ca 0.20 -3.53 -0.50 0.00 -0.03 0.00 0.00 56.01 52.15 1s6q n LEU 92 Cb 0.65 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 41.29 1s6q n LEU 92 CO -0.08 1.24 0.57 0.61 -1.33 0.00 0.00 177.39 178.39 1s6q n GLY 93 N -0.78 -0.31 3.45 -0.72 0.00 -0.30 -4.81 105.19 101.73 1s6q n GLY 93 Ca 0.17 0.53 -0.42 0.00 0.00 0.00 0.00 46.02 46.30 1s6q n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s6q s ILE 94 N -0.33 5.15 0.27 -0.61 1.01 -1.26 -4.97 121.20 120.47 1s6q s ILE 94 Ca 0.74 -0.64 -0.30 0.00 0.00 0.00 0.00 60.65 60.44 1s6q s ILE 94 Cb -0.93 -3.85 -0.11 0.00 0.01 0.00 0.00 42.46 37.59 1s6q s ILE 94 CO 0.54 -0.27 1.56 -2.16 0.00 0.00 0.00 174.94 174.61 1s6q s PRO 95 N 1.66 4.16 -0.46 2.79 0.04 -1.26 -5.03 135.00 136.90 1s6q s PRO 95 Ca 0.05 2.50 -0.17 0.00 0.04 0.00 0.00 61.00 63.42 1s6q s PRO 95 Cb -0.19 -3.06 0.05 0.00 0.04 0.00 0.00 34.50 31.35 1s6q s PRO 95 CO 0.10 -0.58 0.45 -1.58 0.04 0.00 0.00 177.00 175.42 1s6q s HIS 96 N 0.12 3.18 -0.40 0.56 2.46 -1.26 -4.94 115.29 115.02 1s6q s HIS 96 Ca 0.63 -0.68 -0.29 0.00 0.47 0.00 0.00 55.06 55.19 1s6q s HIS 96 Cb -0.46 -3.13 -0.08 0.00 -0.13 0.00 0.00 32.58 28.78 1s6q s HIS 96 CO 0.45 -0.81 2.32 -0.35 -2.47 0.00 0.00 174.74 173.89 1s6q n PRO 97 N 5.50 1.30 0.00 2.88 -0.04 -1.26 -4.87 135.00 138.51 1s6q n PRO 97 Ca -0.10 0.25 0.01 0.00 -0.04 0.00 0.00 63.50 63.62 1s6q n PRO 97 Cb 0.45 -3.03 0.05 0.00 -0.04 0.00 0.00 33.50 30.94 1s6q n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1s6q n ALA 98 N 12.80 1.77 0.21 0.55 0.00 -1.26 -2.58 120.51 132.01 1s6q n ALA 98 Ca 0.38 -0.01 0.02 0.00 0.00 0.00 0.00 53.44 53.83 1s6q n ALA 98 Cb 0.41 -1.03 -0.00 0.00 0.00 0.00 0.00 19.45 18.83 1s6q n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s6q n GLY 99 N -0.29 -0.19 0.34 0.00 0.00 -1.26 -4.63 105.19 99.16 1s6q n GLY 99 Ca 0.01 -0.13 0.14 0.00 0.00 0.00 0.00 46.02 46.04 1s6q n GLY 99 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1s6q h LEU 100 N 0.48 0.14 -1.25 0.99 5.85 -1.79 -0.86 115.31 118.87 1s6q h LEU 100 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1s6q h LEU 100 Cb 0.15 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.16 1s6q h LEU 100 CO 0.00 0.09 -0.00 0.07 -0.34 0.00 0.00 178.44 178.26 1s6q h LYS 101 N 0.16 0.00 0.00 1.25 2.10 -1.82 -3.03 116.57 115.23 1s6q h LYS 101 Ca 0.19 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.67 1s6q h LYS 101 Cb 0.56 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.86 1s6q h LYS 101 CO -0.03 0.00 -1.02 0.87 -2.00 0.00 0.00 179.45 177.27 1s6q h LYS 102 N 0.00 0.00 -6.57 0.07 1.57 -1.44 -3.00 116.57 107.20 1s6q h LYS 102 Ca -0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 1s6q h LYS 102 Cb 0.58 0.00 0.17 0.00 0.08 0.00 0.00 32.23 33.07 1s6q h LYS 102 CO 0.00 0.55 -0.32 1.63 -0.57 0.00 0.00 179.45 180.74 1s6q n LYS 103 N -3.13 0.53 0.05 3.15 4.76 -1.15 -4.40 118.16 117.97 1s6q n LYS 103 Ca -0.04 0.21 0.00 0.00 -2.87 0.00 0.00 58.31 55.61 1s6q n LYS 103 Cb 0.85 -1.78 0.31 0.00 -1.84 0.00 0.00 35.03 32.57 1s6q n LYS 103 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1s6q h LYS 104 N 0.18 0.41 -2.06 1.97 3.11 -1.80 -3.31 116.57 115.06 1s6q h LYS 104 Ca -0.46 -0.10 -0.05 0.00 -2.81 0.00 0.00 60.65 57.23 1s6q h LYS 104 Cb 1.39 -0.05 -0.20 0.00 -1.00 0.00 0.00 32.23 32.36 1s6q h LYS 104 CO 0.47 0.51 0.12 -1.12 -2.81 0.00 0.00 179.45 176.63 1s6q s SER 105 N -6.80 -0.68 -0.11 4.20 0.01 -0.85 -4.64 113.70 104.83 1s6q s SER 105 Ca -0.07 1.10 0.01 0.00 1.31 0.00 0.00 55.95 58.30 1s6q s SER 105 Cb 0.15 1.05 0.02 0.00 0.21 0.00 0.00 66.02 67.45 1s6q s SER 105 CO 0.76 -0.39 -0.11 -0.69 0.41 0.00 0.00 173.24 173.22 1s6q s VAL 106 N -0.28 1.22 0.08 3.43 1.01 0.59 -2.11 120.40 124.34 1s6q s VAL 106 Ca -0.05 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.52 1s6q s VAL 106 Cb -0.03 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1s6q s VAL 106 CO 0.05 0.39 0.06 -0.89 0.00 0.00 0.00 175.10 174.71 1s6q s THR 107 N 1.29 4.45 -0.07 3.92 2.01 -0.68 -0.46 115.64 126.10 1s6q s THR 107 Ca -0.02 -0.78 0.05 0.00 0.31 0.00 0.00 61.69 61.25 1s6q s THR 107 Cb -0.14 -3.13 -0.00 0.00 0.01 0.00 0.00 72.50 69.24 1s6q s THR 107 CO -0.05 0.14 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.11 1s6q s VAL 108 N -1.36 1.88 -0.04 3.82 1.01 -1.18 -0.13 120.40 124.40 1s6q s VAL 108 Ca 0.28 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.34 1s6q s VAL 108 Cb -0.12 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.66 1s6q s VAL 108 CO 0.21 0.52 -0.10 -1.48 0.00 0.00 0.00 175.10 174.26 1s6q s LEU 109 N 0.11 1.65 -0.48 3.92 2.34 -0.58 -4.72 118.68 120.91 1s6q s LEU 109 Ca -0.10 -0.22 -0.28 0.00 0.06 0.00 0.00 54.13 53.60 1s6q s LEU 109 Cb -0.15 -0.64 -0.01 0.00 -0.56 0.00 0.00 46.19 44.82 1s6q s LEU 109 CO 0.05 0.03 1.76 -0.62 -1.06 0.00 0.00 176.35 176.52 1s6q s ASP 110 N 0.50 5.67 -0.01 1.48 2.15 -1.26 -1.76 116.67 123.44 1s6q s ASP 110 Ca -0.09 0.74 0.20 0.00 0.43 0.00 0.00 52.55 53.83 1s6q s ASP 110 Cb -0.12 -2.53 0.59 0.00 -0.30 0.00 0.00 42.92 40.55 1s6q s ASP 110 CO 0.02 -1.99 1.49 1.33 -0.17 0.00 0.00 175.17 175.85 1s6q n VAL 111 N 7.25 1.04 -0.39 1.11 0.24 0.77 -4.60 118.33 123.75 1s6q n VAL 111 Ca 0.20 -1.01 0.37 0.00 -2.04 0.00 0.00 64.34 61.87 1s6q n VAL 111 Cb 0.49 0.48 0.75 0.00 -1.47 0.00 0.00 33.84 34.09 1s6q n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1s6q h GLY 112 N 3.87 0.11 1.38 7.63 0.00 -1.77 0.99 103.07 115.28 1s6q h GLY 112 Ca 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 47.33 47.40 1s6q h GLY 112 CO 0.01 -0.02 0.22 -1.80 0.00 0.00 0.00 176.54 174.95 1s6q h ASP 113 N 0.03 0.01 -0.27 0.19 1.82 -1.86 -3.14 116.42 113.21 1s6q h ASP 113 Ca 0.63 0.00 0.05 0.00 -0.39 0.00 0.00 57.03 57.32 1s6q h ASP 113 Cb 2.46 -0.00 -0.08 0.00 0.68 0.00 0.00 39.33 42.39 1s6q h ASP 113 CO -0.04 0.01 -0.45 0.00 -1.61 0.00 0.00 179.24 177.15 1s6q h ALA 114 N 1.84 -0.58 -1.00 -0.78 0.00 -1.10 -2.73 119.26 114.91 1s6q h ALA 114 Ca 0.15 0.01 0.22 0.00 0.00 0.00 0.00 54.91 55.30 1s6q h ALA 114 Cb 0.58 0.89 -0.11 0.00 0.00 0.00 0.00 17.79 19.15 1s6q h ALA 114 CO -0.00 -0.94 0.62 1.88 0.00 0.00 0.00 179.25 180.81 1s6q h TYR 115 N -0.43 0.94 0.00 0.00 0.99 -1.76 -3.24 116.97 113.47 1s6q h TYR 115 Ca 0.09 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.86 1s6q h TYR 115 Cb 0.62 -0.28 0.00 0.00 1.00 0.00 0.00 36.73 38.07 1s6q h TYR 115 CO -0.58 0.14 0.00 1.19 -0.00 0.00 0.00 178.16 178.92 1s6q n PHE 116 N -4.76 0.00 0.00 4.88 0.99 -1.03 -0.95 117.46 116.59 1s6q n PHE 116 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.70 1s6q n PHE 116 Cb 0.69 -0.03 0.00 0.00 -1.00 0.00 0.00 39.48 39.15 1s6q n PHE 116 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1s6q n SER 117 N 0.53 1.28 -4.53 4.37 3.41 -1.22 -5.00 113.62 112.46 1s6q n SER 117 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.18 1s6q n SER 117 Cb 0.00 0.19 -0.05 0.00 -0.26 0.00 0.00 64.21 64.09 1s6q n SER 117 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1s6q s VAL 118 N -0.90 4.51 0.40 -3.33 0.11 -0.13 -4.59 120.40 116.48 1s6q s VAL 118 Ca 0.00 0.35 -0.26 0.00 -2.93 0.00 0.00 61.98 59.14 1s6q s VAL 118 Cb 0.00 -4.44 -0.10 0.00 -1.53 0.00 0.00 36.38 30.30 1s6q s VAL 118 CO 0.00 -0.93 1.24 -0.81 -3.33 0.00 0.00 175.10 171.27 1s6q n PRO 119 N 7.10 1.89 -3.43 1.54 -0.04 -1.26 -2.04 135.00 138.75 1s6q n PRO 119 Ca 0.02 0.67 -0.38 0.00 -0.04 0.00 0.00 63.50 63.77 1s6q n PRO 119 Cb 0.48 -2.32 -0.06 0.00 -0.04 0.00 0.00 33.50 31.55 1s6q n PRO 119 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1s6q s LEU 120 N -1.38 4.44 -0.34 1.53 2.96 -0.69 -4.48 118.68 120.72 1s6q s LEU 120 Ca 0.60 0.97 -0.43 0.00 -0.22 0.00 0.00 54.13 55.05 1s6q s LEU 120 Cb -0.53 -2.65 -0.18 0.00 0.50 0.00 0.00 46.19 43.34 1s6q s LEU 120 CO 0.59 0.26 1.62 -0.67 -1.32 0.00 0.00 176.35 176.83 1s6q n ASP 121 N 2.18 1.70 -0.19 3.68 2.03 -1.26 -4.82 116.55 119.87 1s6q n ASP 121 Ca -0.12 1.13 0.06 0.00 0.52 0.00 0.00 54.79 56.38 1s6q n ASP 121 Cb 0.52 -1.02 0.34 0.00 -0.72 0.00 0.00 41.12 40.25 1s6q n ASP 121 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1s6q h GLU 122 N 5.87 0.75 0.00 -0.67 4.57 -1.94 -1.85 114.58 121.32 1s6q h GLU 122 Ca -0.46 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1s6q h GLU 122 Cb 1.35 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1s6q h GLU 122 CO 0.94 0.50 0.00 -0.25 -1.18 0.00 0.00 179.01 179.02 1s6q n ASP 123 N -4.48 0.00 -0.07 1.04 8.00 -1.26 -2.87 116.55 116.91 1s6q n ASP 123 Ca 0.11 -0.22 -0.04 0.00 0.71 0.00 0.00 54.79 55.34 1s6q n ASP 123 Cb 0.22 -0.19 -0.15 0.00 -0.02 0.00 0.00 41.12 40.99 1s6q n ASP 123 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1s6q n PHE 124 N -1.19 0.00 -0.11 1.24 7.35 -0.70 -4.70 117.46 119.35 1s6q n PHE 124 Ca 0.12 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.76 1s6q n PHE 124 Cb 0.13 -0.79 -0.04 0.00 0.35 0.00 0.00 39.48 39.14 1s6q n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1s6q h ARG 125 N 0.00 -0.06 -0.17 -4.13 3.08 -1.42 -1.13 114.38 110.56 1s6q h ARG 125 Ca -0.37 0.00 0.07 0.00 0.07 0.00 0.00 59.98 59.75 1s6q h ARG 125 Cb 1.82 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 31.86 1s6q h ARG 125 CO 0.02 -0.04 0.09 0.36 -1.07 0.00 0.00 179.97 179.33 1s6q n LYS 126 N -3.75 -0.01 0.21 0.04 2.85 -1.26 0.54 118.16 116.78 1s6q n LYS 126 Ca -0.00 0.21 0.05 0.00 -1.05 0.00 0.00 58.31 57.53 1s6q n LYS 126 Cb 0.11 -0.39 0.46 0.00 -0.65 0.00 0.00 35.03 34.55 1s6q n LYS 126 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 177.40 179.23 1s6q h TYR 127 N 0.00 0.00 0.00 5.58 0.05 -1.55 -3.03 116.97 118.02 1s6q h TYR 127 Ca 0.13 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.91 1s6q h TYR 127 Cb 0.37 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.11 1s6q h TYR 127 CO -0.00 0.29 0.00 1.79 -1.05 0.00 0.00 178.16 179.19 1s6q h THR 128 N 0.00 0.00 -1.00 -2.88 1.35 -0.08 -3.43 112.91 106.87 1s6q h THR 128 Ca -0.00 -0.47 -0.76 0.00 -0.55 0.00 0.00 66.41 64.63 1s6q h THR 128 Cb 0.56 1.42 0.07 0.00 -1.73 0.00 0.00 68.15 68.46 1s6q h THR 128 CO 0.04 0.00 -0.10 0.00 -0.25 0.00 0.00 175.52 175.21 1s6q n ALA 129 N -1.82 -3.44 -2.30 6.62 0.00 -1.14 -4.66 120.51 113.76 1s6q n ALA 129 Ca 0.05 0.56 -0.16 0.00 0.00 0.00 0.00 53.44 53.88 1s6q n ALA 129 Cb 0.39 -1.71 -0.10 0.00 0.00 0.00 0.00 19.45 18.03 1s6q n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1s6q s PHE 130 N -0.27 1.43 -0.04 0.00 -0.71 0.00 -1.05 117.98 117.35 1s6q s PHE 130 Ca 0.83 -0.91 0.01 0.00 -1.04 0.00 0.00 56.93 55.83 1s6q s PHE 130 Cb -1.17 -0.81 0.02 0.00 -1.21 0.00 0.00 43.02 39.85 1s6q s PHE 130 CO 0.57 -0.05 -0.05 0.99 -1.34 0.00 0.00 175.22 175.34 1s6q s THR 131 N -3.45 0.56 -0.21 -4.49 2.01 -1.26 -1.80 115.64 107.00 1s6q s THR 131 Ca 0.25 -0.15 -0.21 0.00 0.31 0.00 0.00 61.69 61.90 1s6q s THR 131 Cb 0.05 -0.57 -0.02 0.00 0.01 0.00 0.00 72.50 71.97 1s6q s THR 131 CO 0.06 0.22 0.62 -0.63 -0.69 0.00 0.00 174.62 174.21 1s6q s ILE 132 N 0.81 5.02 1.06 1.82 1.01 -0.58 -4.82 121.20 125.52 1s6q s ILE 132 Ca -0.11 1.16 -0.15 0.00 0.00 0.00 0.00 60.65 61.55 1s6q s ILE 132 Cb -0.14 -3.94 0.22 0.00 0.01 0.00 0.00 42.46 38.62 1s6q s ILE 132 CO 0.00 0.10 1.12 -2.16 0.00 0.00 0.00 174.94 174.00 1s6q s PRO 133 N 2.02 -0.11 0.03 2.79 0.04 -1.26 -1.45 135.00 137.06 1s6q s PRO 133 Ca 0.28 0.19 0.04 0.00 0.04 0.00 0.00 61.00 61.55 1s6q s PRO 133 Cb -0.16 -1.70 -0.02 0.00 0.04 0.00 0.00 34.50 32.66 1s6q s PRO 133 CO 0.10 -3.02 -0.13 -1.54 0.04 0.00 0.00 177.00 172.45 1s6q s SER 134 N -3.80 1.55 0.50 6.66 1.04 -1.26 -4.82 113.70 113.57 1s6q s SER 134 Ca 0.68 -0.39 -0.24 0.00 0.48 0.00 0.00 55.95 56.48 1s6q s SER 134 Cb -0.14 -0.11 -0.07 0.00 0.10 0.00 0.00 66.02 65.80 1s6q s SER 134 CO 0.56 0.05 1.40 -0.63 0.98 0.00 0.00 173.24 175.61 1s6q s ILE 135 N -0.71 2.04 -1.02 -1.02 1.01 -1.26 -1.23 121.20 119.00 1s6q s ILE 135 Ca 0.02 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.70 1s6q s ILE 135 Cb -0.07 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.38 1s6q s ILE 135 CO 0.01 0.00 0.00 -3.20 0.00 0.00 0.00 174.94 171.75 1s6q n ASN 136 N -0.61 -3.66 -3.28 3.58 4.05 -1.26 -2.60 115.26 111.48 1s6q n ASN 136 Ca 0.08 0.22 -0.22 0.00 0.45 0.00 0.00 54.58 55.11 1s6q n ASN 136 Cb 0.43 -3.16 -0.05 0.00 1.23 0.00 0.00 39.78 38.24 1s6q n ASN 136 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1s6q n ASN 137 N -1.61 -0.61 0.11 1.20 3.02 -0.37 -4.74 115.26 112.26 1s6q n ASN 137 Ca -0.14 -0.70 -0.22 0.00 -0.03 0.00 0.00 54.58 53.49 1s6q n ASN 137 Cb 0.58 -0.89 -0.15 0.00 -0.61 0.00 0.00 39.78 38.71 1s6q n ASN 137 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1s6q h GLU 138 N -0.50 0.43 -5.95 3.52 5.08 -1.70 -3.46 114.58 112.00 1s6q h GLU 138 Ca -0.34 -0.74 -0.66 0.00 -1.00 0.00 0.00 59.36 56.62 1s6q h GLU 138 Cb 0.78 0.27 -0.11 0.00 0.50 0.00 0.00 28.75 30.20 1s6q h GLU 138 CO 0.47 1.34 -0.57 0.99 -1.00 0.00 0.00 179.01 180.24 1s6q s THR 139 N -2.61 4.74 0.17 1.13 2.01 -1.26 -5.04 115.64 114.78 1s6q s THR 139 Ca -0.10 -0.30 -0.33 0.00 0.31 0.00 0.00 61.69 61.27 1s6q s THR 139 Cb 0.05 -3.12 -0.13 0.00 0.01 0.00 0.00 72.50 69.31 1s6q s THR 139 CO 0.90 0.44 1.65 -0.81 -0.69 0.00 0.00 174.62 176.11 1s6q n PRO 140 N 1.48 2.38 -1.08 4.92 -0.04 -1.26 -4.51 135.00 136.89 1s6q n PRO 140 Ca -0.15 0.86 -0.35 0.00 -0.04 0.00 0.00 63.50 63.82 1s6q n PRO 140 Cb 0.53 -2.66 0.09 0.00 -0.04 0.00 0.00 33.50 31.41 1s6q n PRO 140 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1s6q n GLY 141 N 3.67 -1.85 3.83 0.55 0.00 -1.26 -4.95 105.19 105.18 1s6q n GLY 141 Ca 0.17 -0.53 -0.36 0.00 0.00 0.00 0.00 46.02 45.30 1s6q n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s6q s ILE 142 N -2.09 4.81 -0.10 -0.61 1.01 -0.53 -4.89 121.20 118.81 1s6q s ILE 142 Ca 0.61 0.96 0.02 0.00 0.00 0.00 0.00 60.65 62.24 1s6q s ILE 142 Cb -0.29 -3.79 0.01 0.00 0.01 0.00 0.00 42.46 38.40 1s6q s ILE 142 CO 0.62 0.34 -0.14 -0.13 0.00 0.00 0.00 174.94 175.64 1s6q s ARG 143 N -1.69 2.04 0.23 2.79 0.52 -1.26 -1.53 118.95 120.05 1s6q s ARG 143 Ca 0.35 -0.50 0.06 0.00 -0.52 0.00 0.00 55.73 55.12 1s6q s ARG 143 Cb -0.16 -1.75 -0.05 0.00 0.52 0.00 0.00 34.95 33.51 1s6q s ARG 143 CO 0.19 -0.06 -0.08 0.71 0.02 0.00 0.00 175.30 176.09 1s6q s TYR 144 N 0.97 1.71 0.03 -0.53 2.02 -0.74 -1.53 117.35 119.28 1s6q s TYR 144 Ca -0.08 -0.72 0.00 0.00 -0.37 0.00 0.00 57.07 55.91 1s6q s TYR 144 Cb -0.15 -0.92 -0.03 0.00 -0.40 0.00 0.00 41.96 40.47 1s6q s TYR 144 CO -0.01 0.21 -0.04 1.14 -1.57 0.00 0.00 175.55 175.29 1s6q s GLN 145 N -3.74 0.42 0.10 -0.62 -2.07 0.50 -0.82 119.66 113.44 1s6q s GLN 145 Ca 0.26 -0.79 -0.29 0.00 -1.82 0.00 0.00 55.36 52.71 1s6q s GLN 145 Cb 0.03 0.08 -0.06 0.00 -1.09 0.00 0.00 33.01 31.97 1s6q s GLN 145 CO 0.08 -0.05 0.92 0.71 -1.32 0.00 0.00 175.29 175.63 1s6q s TYR 146 N -2.10 3.81 -2.02 9.60 2.02 -1.26 -0.65 117.35 126.75 1s6q s TYR 146 Ca -0.09 1.74 0.17 0.00 -0.37 0.00 0.00 57.07 58.52 1s6q s TYR 146 Cb -0.05 -3.00 0.18 0.00 -0.40 0.00 0.00 41.96 38.69 1s6q s TYR 146 CO -0.03 0.23 1.09 0.09 -1.57 0.00 0.00 175.55 175.36 1s6q n ASN 147 N 2.72 2.56 -4.02 2.29 3.02 0.12 -4.70 115.26 117.26 1s6q n ASN 147 Ca 0.01 -1.75 -0.09 0.00 -0.03 0.00 0.00 54.58 52.72 1s6q n ASN 147 Cb 0.49 -0.05 -0.09 0.00 -0.61 0.00 0.00 39.78 39.52 1s6q n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1s6q s VAL 148 N -1.36 0.15 -0.64 2.41 -7.23 -1.22 -1.70 120.40 110.80 1s6q s VAL 148 Ca 0.22 -1.59 -0.28 0.00 -1.81 0.00 0.00 61.98 58.53 1s6q s VAL 148 Cb 0.15 -1.64 -0.12 0.00 0.56 0.00 0.00 36.38 35.33 1s6q s VAL 148 CO 0.22 -0.66 2.50 0.18 -0.31 0.00 0.00 175.10 177.03 1s6q n LEU 149 N -0.04 1.69 -4.78 1.32 4.77 -0.87 -4.69 117.00 114.41 1s6q n LEU 149 Ca -0.11 -0.27 -0.36 0.00 -0.03 0.00 0.00 56.01 55.23 1s6q n LEU 149 Cb 0.62 -1.37 -0.02 0.00 -2.33 0.00 0.00 43.42 40.32 1s6q n LEU 149 CO 0.26 -1.29 0.79 -2.16 -1.33 0.00 0.00 177.39 173.66 1s6q s PRO 150 N 8.46 3.84 0.84 3.23 0.04 -1.26 -4.35 135.00 145.80 1s6q s PRO 150 Ca 1.10 1.65 -0.11 0.00 0.04 0.00 0.00 61.00 63.68 1s6q s PRO 150 Cb -0.53 -2.38 0.10 0.00 0.04 0.00 0.00 34.50 31.73 1s6q s PRO 150 CO 0.34 -0.45 1.11 -0.65 0.04 0.00 0.00 177.00 177.38 1s6q s GLN 151 N -2.75 1.65 0.00 4.56 -0.21 -1.26 -3.26 119.66 118.39 1s6q s GLN 151 Ca 0.63 1.25 0.00 0.00 0.02 0.00 0.00 55.36 57.26 1s6q s GLN 151 Cb -0.25 -1.82 0.00 0.00 1.00 0.00 0.00 33.01 31.94 1s6q s GLN 151 CO 0.31 -2.10 0.00 0.41 -2.12 0.00 0.00 175.29 171.79 1s6q n GLY 152 N -0.67 1.66 3.61 3.09 0.00 -1.26 -4.86 105.19 106.75 1s6q n GLY 152 Ca 0.10 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1s6q n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1s6q s TRP 153 N -0.24 2.94 -1.39 1.61 -0.00 -1.20 -4.71 118.94 115.95 1s6q s TRP 153 Ca 0.00 0.86 0.00 0.00 -0.00 0.00 0.00 56.10 56.96 1s6q s TRP 153 Cb 0.00 -4.14 0.00 0.00 -0.00 0.00 0.00 33.47 29.33 1s6q s TRP 153 CO 0.00 -1.08 0.22 1.63 -0.00 0.00 0.00 176.95 177.72 1s6q n LYS 154 N 7.45 0.00 0.00 5.86 5.02 -1.26 -0.32 118.16 134.91 1s6q n LYS 154 Ca 0.12 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.51 1s6q n LYS 154 Cb 0.48 -1.32 -0.12 0.00 -0.02 0.00 0.00 35.03 34.06 1s6q n LYS 154 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s6q n GLY 155 N -0.67 -1.06 0.18 0.72 0.00 -1.26 -3.92 105.19 99.18 1s6q n GLY 155 Ca 0.00 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.37 1s6q n GLY 155 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1s6q h SER 156 N 0.00 -0.31 0.49 1.61 0.02 -0.93 -2.29 113.55 112.15 1s6q h SER 156 Ca 0.00 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 1s6q h SER 156 Cb 0.82 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 1s6q h SER 156 CO 0.00 -0.09 -0.32 1.55 -1.14 0.00 0.00 176.83 176.83 1s6q h PRO 157 N -0.53 -0.76 -0.30 3.45 0.13 -1.75 -1.79 132.00 130.46 1s6q h PRO 157 Ca -0.04 0.05 0.09 0.00 -0.87 0.00 0.00 66.00 65.23 1s6q h PRO 157 Cb 0.39 0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 1s6q h PRO 157 CO 0.06 -0.51 0.61 0.00 -0.23 0.00 0.00 178.00 177.94 1s6q h ALA 158 N -0.36 1.96 0.01 -0.56 0.00 -1.67 0.44 119.26 119.07 1s6q h ALA 158 Ca -0.05 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.53 1s6q h ALA 158 Cb 0.65 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1s6q h ALA 158 CO 0.04 -0.77 -1.87 -0.89 0.00 0.00 0.00 179.25 175.77 1s6q n ILE 159 N -3.16 1.57 0.13 0.00 5.41 -0.86 -4.23 119.36 118.22 1s6q n ILE 159 Ca 0.05 -0.80 -0.00 0.00 1.00 0.00 0.00 62.75 63.00 1s6q n ILE 159 Cb 0.74 -0.95 0.14 0.00 -0.71 0.00 0.00 39.64 38.85 1s6q n ILE 159 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 1s6q h PHE 160 N 0.00 0.00 0.00 1.39 3.57 0.66 -3.38 116.94 119.18 1s6q h PHE 160 Ca -0.35 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.15 1s6q h PHE 160 Cb 2.06 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.80 1s6q h PHE 160 CO 0.00 0.62 0.00 1.04 -2.23 0.00 0.00 178.31 177.75 1s6q n GLN 161 N -3.58 0.00 -0.05 1.11 6.02 -0.43 0.10 117.38 120.54 1s6q n GLN 161 Ca -0.00 0.22 -0.01 0.00 -0.01 0.00 0.00 57.00 57.19 1s6q n GLN 161 Cb 0.67 -0.40 -0.01 0.00 1.02 0.00 0.00 30.24 31.51 1s6q n GLN 161 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1s6q n SER 162 N -1.00 -0.13 0.08 1.08 2.88 -1.26 0.30 113.62 115.56 1s6q n SER 162 Ca 0.00 0.49 0.19 0.00 -1.33 0.00 0.00 58.87 58.21 1s6q n SER 162 Cb 0.00 -0.16 0.72 0.00 -0.75 0.00 0.00 64.21 64.02 1s6q n SER 162 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1s6q h SER 163 N 0.00 0.00 0.02 -3.46 0.87 0.45 -2.58 113.55 108.84 1s6q h SER 163 Ca 0.02 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1s6q h SER 163 Cb 0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1s6q h SER 163 CO -0.12 0.00 -0.01 -0.03 -0.53 0.00 0.00 176.83 176.14 1s6q h MET 164 N 0.00 -0.02 0.00 2.24 -1.53 0.79 -3.01 114.93 113.40 1s6q h MET 164 Ca 0.19 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.45 1s6q h MET 164 Cb 0.83 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.89 1s6q h MET 164 CO -0.00 -0.01 0.39 1.79 0.14 0.00 0.00 176.91 179.21 1s6q h THR 165 N -0.41 0.00 0.02 -0.77 1.35 -1.09 0.44 112.91 112.45 1s6q h THR 165 Ca -0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1s6q h THR 165 Cb 0.02 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 66.69 1s6q h THR 165 CO 0.00 0.00 -0.01 0.50 -0.25 0.00 0.00 175.52 175.77 1s6q h LYS 166 N 0.00 -0.02 -1.26 4.72 3.64 -1.54 -2.63 116.57 119.47 1s6q h LYS 166 Ca 0.00 0.00 0.36 0.00 -1.27 0.00 0.00 60.65 59.75 1s6q h LYS 166 Cb 0.77 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.54 1s6q h LYS 166 CO 0.00 -0.01 0.90 0.82 -2.27 0.00 0.00 179.45 178.88 1s6q h ILE 167 N -0.95 0.36 0.12 2.00 2.04 -0.06 -2.79 117.51 118.23 1s6q h ILE 167 Ca -0.00 -0.02 -0.35 0.00 1.00 0.00 0.00 64.86 65.49 1s6q h ILE 167 Cb 0.02 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1s6q h ILE 167 CO 0.00 0.01 -1.91 -0.07 0.00 0.00 0.00 178.15 176.18 1s6q h LEU 168 N 0.05 0.38 -1.11 1.44 3.38 -1.14 -3.41 115.31 114.90 1s6q h LEU 168 Ca 0.62 -0.91 0.40 0.00 0.09 0.00 0.00 57.88 58.08 1s6q h LEU 168 Cb 2.36 -0.13 -0.12 0.00 0.09 0.00 0.00 40.66 42.86 1s6q h LEU 168 CO -0.06 1.82 0.70 1.21 0.09 0.00 0.00 178.44 182.20 1s6q n GLU 169 N -3.59 -0.03 -0.85 1.13 0.00 -0.99 -0.56 120.64 115.75 1s6q n GLU 169 Ca -0.32 1.08 -0.16 0.00 0.00 0.00 0.00 57.16 57.76 1s6q n GLU 169 Cb 1.01 -2.10 0.05 0.00 0.00 0.00 0.00 31.44 30.40 1s6q n GLU 169 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 1s6q n PRO 170 N -4.49 1.80 0.00 5.31 -0.04 -1.26 -2.07 135.00 134.25 1s6q n PRO 170 Ca 0.34 -1.62 0.00 0.00 -0.04 0.00 0.00 63.50 62.18 1s6q n PRO 170 Cb 1.29 -1.64 0.00 0.00 -0.04 0.00 0.00 33.50 33.11 1s6q n PRO 170 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1s6q n PHE 171 N 0.14 0.00 0.57 0.54 -0.00 0.28 -4.71 117.46 114.28 1s6q n PHE 171 Ca 0.31 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.88 1s6q n PHE 171 Cb 0.70 0.00 0.45 0.00 -0.00 0.00 0.00 39.48 40.63 1s6q n PHE 171 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 1s6q n LYS 172 N -0.83 0.18 0.07 -4.13 5.02 -0.76 -2.64 118.16 115.08 1s6q n LYS 172 Ca 0.00 0.27 -0.04 0.00 -2.02 0.00 0.00 58.31 56.53 1s6q n LYS 172 Cb 0.00 -1.77 -0.02 0.00 -0.02 0.00 0.00 35.03 33.22 1s6q n LYS 172 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1s6q h LYS 173 N 0.00 -0.23 -1.70 1.97 3.64 -1.67 -2.83 116.57 115.74 1s6q h LYS 173 Ca 0.00 0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 1s6q h LYS 173 Cb 0.52 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.35 1s6q h LYS 173 CO 0.00 -0.15 0.13 1.04 -2.27 0.00 0.00 179.45 178.20 1s6q n GLN 174 N -3.93 1.25 -2.23 1.90 6.02 -1.20 -3.13 117.38 116.05 1s6q n GLN 174 Ca -0.03 -0.50 -0.02 0.00 -0.01 0.00 0.00 57.00 56.44 1s6q n GLN 174 Cb 0.09 -1.20 0.01 0.00 1.02 0.00 0.00 30.24 30.16 1s6q n GLN 174 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1s6q n ASN 175 N 0.98 -0.77 0.00 1.08 3.02 -1.08 -4.98 115.26 113.51 1s6q n ASN 175 Ca 0.10 -1.48 0.00 0.00 -0.03 0.00 0.00 54.58 53.16 1s6q n ASN 175 Cb 0.55 0.60 0.00 0.00 -0.61 0.00 0.00 39.78 40.32 1s6q n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1s6q n PRO 176 N -0.42 0.00 -0.01 3.52 -0.04 -1.07 -2.50 135.00 134.48 1s6q n PRO 176 Ca -0.16 0.25 0.09 0.00 -0.04 0.00 0.00 63.50 63.64 1s6q n PRO 176 Cb 0.62 -1.52 -0.13 0.00 -0.04 0.00 0.00 33.50 32.42 1s6q n PRO 176 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1s6q n ASP 177 N -1.24 1.02 -4.77 3.54 8.00 -1.26 -4.90 116.55 116.94 1s6q n ASP 177 Ca 0.00 -0.02 -0.39 0.00 0.71 0.00 0.00 54.79 55.09 1s6q n ASP 177 Cb 0.02 1.78 -0.06 0.00 -0.02 0.00 0.00 41.12 42.85 1s6q n ASP 177 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1s6q s ILE 178 N -3.20 4.46 -0.11 0.53 -4.36 -1.04 -4.88 121.20 112.60 1s6q s ILE 178 Ca -0.06 1.67 -0.03 0.00 -0.26 0.00 0.00 60.65 61.96 1s6q s ILE 178 Cb 0.11 -4.12 -0.03 0.00 1.25 0.00 0.00 42.46 39.66 1s6q s ILE 178 CO 0.72 0.49 0.01 0.68 0.24 0.00 0.00 174.94 177.09 1s6q s VAL 179 N -0.92 4.37 -0.16 8.37 -7.23 -0.91 -4.94 120.40 118.98 1s6q s VAL 179 Ca 0.36 -0.21 0.02 0.00 -1.81 0.00 0.00 61.98 60.33 1s6q s VAL 179 Cb -0.22 -2.87 0.01 0.00 0.56 0.00 0.00 36.38 33.86 1s6q s VAL 179 CO 0.25 0.57 -0.21 -0.63 -0.31 0.00 0.00 175.10 174.77 1s6q s ILE 180 N -0.49 2.12 -0.04 -0.62 1.01 -1.26 -1.19 121.20 120.73 1s6q s ILE 180 Ca 0.09 -0.94 0.06 0.00 0.00 0.00 0.00 60.65 59.85 1s6q s ILE 180 Cb -0.12 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.46 1s6q s ILE 180 CO 0.02 0.54 -0.22 -0.47 0.00 0.00 0.00 174.94 174.82 1s6q s TYR 181 N 0.98 2.48 -0.26 3.97 5.04 -0.77 -4.96 117.35 123.83 1s6q s TYR 181 Ca -0.03 -0.43 -0.00 0.00 -2.44 0.00 0.00 57.07 54.17 1s6q s TYR 181 Cb -0.15 -1.58 0.04 0.00 0.35 0.00 0.00 41.96 40.63 1s6q s TYR 181 CO -0.05 -0.02 -0.07 -1.14 -1.34 0.00 0.00 175.55 172.92 1s6q s GLN 182 N -0.50 2.58 -0.40 4.97 0.74 -1.26 0.40 119.66 126.19 1s6q s GLN 182 Ca 0.07 -1.14 0.03 0.00 0.05 0.00 0.00 55.36 54.37 1s6q s GLN 182 Cb -0.11 -2.97 0.11 0.00 1.10 0.00 0.00 33.01 31.14 1s6q s GLN 182 CO 0.01 -0.49 0.13 -0.47 -0.55 0.00 0.00 175.29 173.92 1s6q s TYR 183 N 1.24 3.61 0.00 1.67 5.04 -0.74 -5.01 117.35 123.15 1s6q s TYR 183 Ca -0.03 -2.97 0.00 0.00 -2.44 0.00 0.00 57.07 51.63 1s6q s TYR 183 Cb -0.18 -2.95 0.00 0.00 0.35 0.00 0.00 41.96 39.18 1s6q s TYR 183 CO -0.05 -0.90 0.00 -1.33 -1.34 0.00 0.00 175.55 171.93 1s6q n MET 184 N 4.01 0.00 0.00 4.97 2.81 -1.26 -2.85 117.12 124.81 1s6q n MET 184 Ca 0.04 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.06 1s6q n MET 184 Cb 0.40 0.00 0.39 0.00 -0.71 0.00 0.00 33.22 33.30 1s6q n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1s6q n ASP 185 N 9.74 0.73 -4.63 7.83 9.92 -1.26 -4.68 116.55 134.20 1s6q n ASP 185 Ca 0.00 -0.58 -0.24 0.00 -0.53 0.00 0.00 54.79 53.44 1s6q n ASP 185 Cb 0.00 0.11 -0.07 0.00 -0.64 0.00 0.00 41.12 40.51 1s6q n ASP 185 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1s6q s ASP 186 N -2.67 4.50 -0.16 -2.24 1.01 -1.13 -0.16 116.67 115.82 1s6q s ASP 186 Ca 0.21 -0.64 0.01 0.00 0.71 0.00 0.00 52.55 52.84 1s6q s ASP 186 Cb 0.19 -0.83 0.02 0.00 1.01 0.00 0.00 42.92 43.31 1s6q s ASP 186 CO 0.57 0.02 -0.19 -0.22 0.21 0.00 0.00 175.17 175.56 1s6q s LEU 187 N -3.55 2.00 -0.39 1.23 2.96 -0.72 -1.80 118.68 118.40 1s6q s LEU 187 Ca 0.31 -0.59 -0.14 0.00 -0.22 0.00 0.00 54.13 53.48 1s6q s LEU 187 Cb -0.07 -1.38 0.02 0.00 0.50 0.00 0.00 46.19 45.26 1s6q s LEU 187 CO 0.19 0.00 0.27 -0.31 -1.32 0.00 0.00 176.35 175.19 1s6q s TYR 188 N 1.24 3.24 -0.25 5.38 1.51 0.16 -1.52 117.35 127.11 1s6q s TYR 188 Ca 0.02 -0.61 -0.07 0.00 -1.01 0.00 0.00 57.07 55.41 1s6q s TYR 188 Cb -0.13 -2.55 -0.03 0.00 -0.11 0.00 0.00 41.96 39.14 1s6q s TYR 188 CO -0.10 -0.57 0.06 0.08 -1.11 0.00 0.00 175.55 173.91 1s6q s VAL 189 N 1.66 4.21 -0.06 0.71 1.01 0.82 -1.85 120.40 126.90 1s6q s VAL 189 Ca 0.05 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 61.87 1s6q s VAL 189 Cb -0.19 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.21 1s6q s VAL 189 CO 0.09 0.34 -0.22 -0.83 0.00 0.00 0.00 175.10 174.49 1s6q s GLY 190 N 1.60 1.36 0.16 4.51 0.00 -0.33 -1.69 107.32 112.94 1s6q s GLY 190 Ca 0.06 -1.02 0.01 0.00 0.00 0.00 0.00 44.72 43.77 1s6q s GLY 190 CO 0.03 -0.64 0.02 -1.35 0.00 0.00 0.00 173.10 171.15 1s6q s SER 191 N -0.25 1.00 -0.34 1.64 1.04 -0.90 -2.15 113.70 113.75 1s6q s SER 191 Ca -0.01 -1.18 0.07 0.00 0.48 0.00 0.00 55.95 55.31 1s6q s SER 191 Cb -0.13 0.16 0.48 0.00 0.10 0.00 0.00 66.02 66.63 1s6q s SER 191 CO 0.03 -0.61 1.44 0.47 0.98 0.00 0.00 173.24 175.55 1s6q n ASP 192 N -0.21 4.01 -4.30 7.02 8.00 -1.26 -2.01 116.55 127.81 1s6q n ASP 192 Ca -0.06 -3.79 -0.31 0.00 0.71 0.00 0.00 54.79 51.33 1s6q n ASP 192 Cb 0.63 -0.58 -0.16 0.00 -0.02 0.00 0.00 41.12 40.99 1s6q n ASP 192 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 1s6q s LEU 193 N -3.46 2.07 0.02 0.64 2.34 -1.26 -4.93 118.68 114.10 1s6q s LEU 193 Ca 0.49 -0.48 -0.12 0.00 0.06 0.00 0.00 54.13 54.08 1s6q s LEU 193 Cb 0.42 -1.36 -0.06 0.00 -0.56 0.00 0.00 46.19 44.63 1s6q s LEU 193 CO 0.00 0.29 0.30 1.21 -1.06 0.00 0.00 176.35 177.09 1s6q n GLU 194 N 2.65 0.00 -0.30 1.48 0.00 -1.26 -3.76 120.64 119.45 1s6q n GLU 194 Ca -0.17 0.00 0.26 0.00 0.00 0.00 0.00 57.16 57.26 1s6q n GLU 194 Cb 0.51 -0.44 0.49 0.00 0.00 0.00 0.00 31.44 32.00 1s6q n GLU 194 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.13 178.64 1s6q n ILE 195 N 0.36 -0.39 -0.24 6.31 3.06 -1.26 0.24 119.36 127.43 1s6q n ILE 195 Ca 0.06 1.93 0.02 0.00 -2.50 0.00 0.00 62.75 62.26 1s6q n ILE 195 Cb 0.04 -3.07 0.14 0.00 0.54 0.00 0.00 39.64 37.30 1s6q n ILE 195 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 1s6q h GLY 196 N 0.00 1.05 0.64 4.50 0.00 -1.99 0.20 103.07 107.48 1s6q h GLY 196 Ca 0.75 -0.20 -0.08 0.00 0.00 0.00 0.00 47.33 47.80 1s6q h GLY 196 CO -0.75 0.03 -0.26 1.46 0.00 0.00 0.00 176.54 177.01 1s6q h GLN 197 N 0.56 0.29 0.00 4.80 4.20 -0.46 -3.11 115.11 121.40 1s6q h GLN 197 Ca 0.35 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1s6q h GLN 197 Cb 0.40 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1s6q h GLN 197 CO -0.29 0.86 0.00 1.58 -0.67 0.00 0.00 178.83 180.32 1s6q n HIS 198 N -4.48 0.00 0.29 2.96 -0.00 -0.78 0.96 115.22 114.17 1s6q n HIS 198 Ca -0.08 0.00 0.01 0.00 0.46 0.00 0.00 57.72 58.11 1s6q n HIS 198 Cb 0.47 -0.47 0.07 0.00 -0.12 0.00 0.00 29.99 29.94 1s6q n HIS 198 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1s6q h ARG 199 N 0.00 0.00 0.00 1.57 3.08 -0.72 1.14 114.38 119.45 1s6q h ARG 199 Ca 0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.81 1s6q h ARG 199 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 1s6q h ARG 199 CO 0.00 0.00 -1.55 2.41 -1.07 0.00 0.00 179.97 179.76 1s6q n THR 200 N -2.33 1.51 -0.41 2.04 -1.04 0.28 -2.94 114.28 111.39 1s6q n THR 200 Ca -0.00 -0.09 0.39 0.00 -2.04 0.00 0.00 64.05 62.31 1s6q n THR 200 Cb 0.87 -2.09 0.75 0.00 -1.82 0.00 0.00 70.33 68.05 1s6q n THR 200 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 1s6q h LYS 201 N -1.00 0.02 0.29 -2.82 1.63 0.80 1.68 116.57 117.17 1s6q h LYS 201 Ca -0.36 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.42 1s6q h LYS 201 Cb 1.24 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 1s6q h LYS 201 CO -0.22 0.01 -0.14 0.82 -3.45 0.00 0.00 179.45 176.47 1s6q h ILE 202 N 0.02 0.00 0.00 2.00 1.08 -0.25 0.17 117.51 120.53 1s6q h ILE 202 Ca 0.65 -0.14 0.00 0.00 -0.39 0.00 0.00 64.86 64.98 1s6q h ILE 202 Cb 2.56 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 36.31 1s6q h ILE 202 CO -0.03 0.00 0.24 -0.08 -0.69 0.00 0.00 178.15 177.59 1s6q h GLU 203 N -0.53 0.00 -0.20 2.37 4.57 -0.31 1.17 114.58 121.65 1s6q h GLU 203 Ca -0.04 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.07 1s6q h GLU 203 Cb 0.30 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.89 1s6q h GLU 203 CO 0.07 0.00 -0.14 1.49 -1.18 0.00 0.00 179.01 179.25 1s6q h GLU 204 N 0.00 0.45 0.02 1.92 4.57 0.29 -2.71 114.58 119.12 1s6q h GLU 204 Ca 0.00 -0.21 -0.00 0.00 -1.18 0.00 0.00 59.36 57.97 1s6q h GLU 204 Cb 0.49 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 1s6q h GLU 204 CO 0.00 0.76 -0.01 1.25 -1.18 0.00 0.00 179.01 179.83 1s6q h LEU 205 N 0.14 -0.02 -1.48 1.64 5.85 0.31 -2.82 115.31 118.92 1s6q h LEU 205 Ca 0.04 -0.67 0.40 0.00 0.84 0.00 0.00 57.88 58.48 1s6q h LEU 205 Cb 0.65 0.01 -0.11 0.00 0.37 0.00 0.00 40.66 41.57 1s6q h LEU 205 CO 0.04 0.69 0.84 -0.09 -0.34 0.00 0.00 178.44 179.58 1s6q h ARG 206 N -0.76 0.14 0.16 1.25 2.43 0.10 0.26 114.38 117.96 1s6q h ARG 206 Ca -0.00 -0.01 -0.34 0.00 -0.81 0.00 0.00 59.98 58.82 1s6q h ARG 206 Cb 0.70 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1s6q h ARG 206 CO 0.00 0.09 -1.71 1.96 -1.51 0.00 0.00 179.97 178.80 1s6q h GLN 207 N 0.15 0.33 -0.56 0.20 4.20 -1.50 -2.56 115.11 115.36 1s6q h GLN 207 Ca 0.75 -0.57 0.08 0.00 0.06 0.00 0.00 58.65 58.98 1s6q h GLN 207 Cb 2.37 0.21 -0.10 0.00 0.30 0.00 0.00 27.48 30.26 1s6q h GLN 207 CO -0.33 1.23 -0.48 1.25 -0.67 0.00 0.00 178.83 179.82 1s6q h HIS 208 N 0.09 -1.45 -0.18 2.96 2.76 -0.71 0.39 115.15 119.01 1s6q h HIS 208 Ca -0.32 0.09 0.04 0.00 -2.20 0.00 0.00 60.37 57.97 1s6q h HIS 208 Cb 2.07 0.71 -0.07 0.00 1.55 0.00 0.00 27.41 31.67 1s6q h HIS 208 CO 0.09 -0.44 -0.50 -0.07 -1.30 0.00 0.00 177.93 175.70 1s6q h LEU 209 N -0.26 -1.60 -1.98 0.26 3.38 -1.41 -1.04 115.31 112.66 1s6q h LEU 209 Ca 0.15 0.20 0.14 0.00 0.09 0.00 0.00 57.88 58.46 1s6q h LEU 209 Cb 0.56 0.64 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 1s6q h LEU 209 CO -0.68 -0.46 0.36 0.25 0.09 0.00 0.00 178.44 178.00 1s6q h LEU 210 N -0.53 0.02 0.00 1.67 5.85 -0.52 -1.27 115.31 120.53 1s6q h LEU 210 Ca 0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1s6q h LEU 210 Cb 0.66 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1s6q h LEU 210 CO -0.45 0.01 -0.32 0.08 -0.34 0.00 0.00 178.44 177.42 1s6q h ARG 211 N 0.03 0.00 -0.72 1.25 0.11 0.96 -2.92 114.38 113.09 1s6q h ARG 211 Ca 0.24 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 60.10 1s6q h ARG 211 Cb 0.92 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 31.87 1s6q h ARG 211 CO -0.01 0.00 0.27 0.91 0.10 0.00 0.00 179.97 181.24 1s6q n TRP 212 N -2.47 2.39 0.00 4.08 5.03 -0.50 -4.98 117.44 120.99 1s6q n TRP 212 Ca 0.04 -1.24 0.00 0.00 3.03 0.00 0.00 57.50 59.33 1s6q n TRP 212 Cb 0.47 -0.68 0.00 0.00 -1.03 0.00 0.00 31.31 30.07 1s6q n TRP 212 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1s6q n GLY 213 N -0.25 2.85 3.66 6.99 0.00 -1.05 -5.01 105.19 112.38 1s6q n GLY 213 Ca 0.41 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 1s6q n GLY 213 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s6q n LEU 214 N 0.00 4.14 -4.82 0.99 4.77 -1.05 -4.85 117.00 116.17 1s6q n LEU 214 Ca 0.00 0.91 -0.35 0.00 -0.03 0.00 0.00 56.01 56.54 1s6q n LEU 214 Cb 0.00 -1.52 -0.06 0.00 -2.33 0.00 0.00 43.42 39.51 1s6q n LEU 214 CO 0.00 0.19 0.45 0.42 -1.33 0.00 0.00 177.39 177.12 1s6q s THR 215 N 4.44 4.57 -0.53 -5.08 -4.23 -1.26 -2.37 115.64 111.18 1s6q s THR 215 Ca 0.89 1.22 0.03 0.00 -1.18 0.00 0.00 61.69 62.65 1s6q s THR 215 Cb -0.45 -3.77 0.41 0.00 1.34 0.00 0.00 72.50 70.03 1s6q s THR 215 CO 0.43 0.05 1.37 0.41 -0.54 0.00 0.00 174.62 176.33 1s6q n THR 216 N 0.29 2.72 -0.48 3.99 -1.04 -1.26 -4.77 114.28 113.73 1s6q n THR 216 Ca 0.00 -4.64 0.00 0.00 -2.04 0.00 0.00 64.05 57.38 1s6q n THR 216 Cb 0.52 -1.24 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 1s6q n THR 216 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1s6q n PRO 217 N -0.54 0.00 -2.74 -2.82 -0.02 -1.26 -4.35 135.00 123.27 1s6q n PRO 217 Ca 0.44 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.87 1s6q n PRO 217 Cb 0.59 -0.56 0.04 0.00 -0.02 0.00 0.00 33.50 33.56 1s6q n PRO 217 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1s6q n ASP 218 N 1.80 1.44 -1.72 2.55 8.00 -1.26 -4.96 116.55 122.41 1s6q n ASP 218 Ca 0.00 -2.40 -0.03 0.00 0.71 0.00 0.00 54.79 53.07 1s6q n ASP 218 Cb 0.10 -0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 40.67 1s6q n ASP 218 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1s6q n LYS 219 N -0.32 1.16 0.00 -1.24 4.76 -1.26 -4.79 118.16 116.47 1s6q n LYS 219 Ca 0.08 -0.28 0.00 0.00 -2.87 0.00 0.00 58.31 55.24 1s6q n LYS 219 Cb 0.81 -1.34 0.00 0.00 -1.84 0.00 0.00 35.03 32.67 1s6q n LYS 219 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1s6q n LYS 220 N 1.87 0.00 -1.85 1.97 2.85 -1.26 -4.72 118.16 117.02 1s6q n LYS 220 Ca 0.12 0.00 -0.03 0.00 -1.05 0.00 0.00 58.31 57.35 1s6q n LYS 220 Cb 0.56 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.94 1s6q n LYS 220 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 177.40 174.96 1s6q n HIS 221 N -3.04 -1.25 0.00 5.58 1.44 -1.26 -5.08 115.22 111.60 1s6q n HIS 221 Ca 0.00 -0.54 0.00 0.00 -2.01 0.00 0.00 57.72 55.17 1s6q n HIS 221 Cb 0.00 0.24 0.00 0.00 0.12 0.00 0.00 29.99 30.35 1s6q n HIS 221 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1s6q n GLN 222 N -0.15 0.00 -0.63 -1.40 6.02 -1.26 -5.04 117.38 114.93 1s6q n GLN 222 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1s6q n GLN 222 Cb 0.16 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.42 1s6q n GLN 222 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1s6q n LYS 223 N 0.00 0.00 -3.74 -1.09 5.02 -1.26 -4.94 118.16 112.15 1s6q n LYS 223 Ca 0.00 -0.90 -0.28 0.00 -2.02 0.00 0.00 58.31 55.10 1s6q n LYS 223 Cb 0.00 -0.31 -0.10 0.00 -0.02 0.00 0.00 35.03 34.60 1s6q n LYS 223 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1s6q n GLU 224 N 0.05 2.12 -2.24 1.97 1.02 -1.26 -5.08 120.64 117.23 1s6q n GLU 224 Ca -0.00 -4.55 -0.42 0.00 -0.02 0.00 0.00 57.16 52.17 1s6q n GLU 224 Cb 0.71 -2.29 -0.01 0.00 -0.02 0.00 0.00 31.44 29.83 1s6q n GLU 224 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1s6q n PRO 225 N 1.66 2.93 -2.24 3.49 -0.04 -1.26 -5.01 135.00 134.53 1s6q n PRO 225 Ca 0.23 -2.97 -0.41 0.00 -0.04 0.00 0.00 63.50 60.31 1s6q n PRO 225 Cb 0.37 -3.43 -0.03 0.00 -0.04 0.00 0.00 33.50 30.37 1s6q n PRO 225 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1s6q s PRO 226 N 4.10 4.41 -0.55 0.54 0.02 -1.26 -4.55 135.00 137.70 1s6q s PRO 226 Ca 0.53 2.04 -0.05 0.00 0.02 0.00 0.00 61.00 63.54 1s6q s PRO 226 Cb 0.07 -3.18 -0.19 0.00 0.02 0.00 0.00 34.50 31.22 1s6q s PRO 226 CO 0.03 -0.19 1.25 1.97 -0.33 0.00 0.00 177.00 179.74 1s6q n PHE 227 N 2.21 0.00 -2.65 6.54 1.16 -1.26 -4.46 117.46 119.00 1s6q n PHE 227 Ca 0.04 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.60 1s6q n PHE 227 Cb 0.43 -0.31 0.11 0.00 -1.61 0.00 0.00 39.48 38.11 1s6q n PHE 227 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1s6q n LEU 228 N 3.31 -1.32 -0.52 5.98 4.77 -1.26 -4.99 117.00 122.97 1s6q n LEU 228 Ca 0.38 -2.97 0.00 0.00 -0.03 0.00 0.00 56.01 53.38 1s6q n LEU 228 Cb 0.11 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1s6q n LEU 228 CO 0.64 1.64 0.08 -2.67 -1.33 0.00 0.00 177.39 175.75 1s6q n TRP 229 N -1.35 0.00 -3.18 -1.77 2.14 -1.26 -4.82 117.44 107.20 1s6q n TRP 229 Ca -0.16 -0.01 -0.39 0.00 2.07 0.00 0.00 57.50 59.02 1s6q n TRP 229 Cb 0.84 -0.04 -0.05 0.00 -0.81 0.00 0.00 31.31 31.25 1s6q n TRP 229 CO 0.00 0.00 0.00 1.41 2.07 0.00 0.00 177.69 181.17 1s6q s MET 230 N -0.94 4.35 -0.07 -2.67 1.75 -1.26 -5.06 119.30 115.41 1s6q s MET 230 Ca 0.00 0.75 -0.06 0.00 -1.25 0.00 0.00 55.69 55.12 1s6q s MET 230 Cb 0.00 -3.37 0.02 0.00 2.84 0.00 0.00 34.83 34.31 1s6q s MET 230 CO 0.00 0.28 0.18 0.20 -0.65 0.00 0.00 175.02 175.04 1s6q s GLY 231 N 0.10 -0.13 -0.32 2.11 0.00 -1.26 -4.92 107.32 102.89 1s6q s GLY 231 Ca 0.32 0.50 -0.28 0.00 0.00 0.00 0.00 44.72 45.26 1s6q s GLY 231 CO 0.17 0.43 1.93 -0.47 0.00 0.00 0.00 173.10 175.16 1s6q s TYR 232 N 0.06 1.61 -0.18 1.90 6.14 -1.26 -4.91 117.35 120.70 1s6q s TYR 232 Ca -0.00 0.64 -0.05 0.00 0.64 0.00 0.00 57.07 58.30 1s6q s TYR 232 Cb -0.01 -4.05 0.06 0.00 0.42 0.00 0.00 41.96 38.37 1s6q s TYR 232 CO 0.00 -3.21 0.09 -1.21 0.64 0.00 0.00 175.55 171.86 1s6q s GLU 233 N 5.99 0.09 0.17 4.97 2.02 -1.26 -3.11 118.70 127.58 1s6q s GLU 233 Ca 0.85 -0.13 0.03 0.00 0.02 0.00 0.00 54.97 55.74 1s6q s GLU 233 Cb -0.25 -1.78 -0.03 0.00 0.10 0.00 0.00 34.13 32.17 1s6q s GLU 233 CO 0.33 -0.70 0.28 -0.51 0.02 0.00 0.00 175.26 174.68 1s6q s LEU 234 N 2.13 4.27 -0.49 1.80 1.43 0.39 -4.88 118.68 123.31 1s6q s LEU 234 Ca 0.03 0.11 0.07 0.00 -1.03 0.00 0.00 54.13 53.30 1s6q s LEU 234 Cb -0.16 -2.83 0.23 0.00 0.03 0.00 0.00 46.19 43.46 1s6q s LEU 234 CO -0.12 0.03 0.56 1.41 0.23 0.00 0.00 176.35 178.46 1s6q n HIS 235 N -0.71 1.02 0.09 0.29 8.25 -1.26 -0.30 115.22 122.59 1s6q n HIS 235 Ca -0.08 -3.76 0.20 0.00 -0.26 0.00 0.00 57.72 53.83 1s6q n HIS 235 Cb 0.55 -0.34 0.74 0.00 1.12 0.00 0.00 29.99 32.05 1s6q n HIS 235 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1s6q h PRO 236 N 4.42 0.00 0.00 -0.41 0.13 -1.76 -0.94 132.00 133.44 1s6q h PRO 236 Ca 0.14 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1s6q h PRO 236 Cb 0.81 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.94 1s6q h PRO 236 CO 0.58 0.00 -0.02 0.38 -0.23 0.00 0.00 178.00 178.71 1s6q h ASP 237 N 0.00 0.00 0.15 1.44 3.04 -1.61 -2.61 116.42 116.83 1s6q h ASP 237 Ca 0.20 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.99 1s6q h ASP 237 Cb 1.12 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.41 1s6q h ASP 237 CO -0.00 0.02 -0.31 0.29 -2.04 0.00 0.00 179.24 177.20 1s6q n LYS 238 N -3.11 1.01 -1.42 4.15 5.02 -0.36 -4.66 118.16 118.78 1s6q n LYS 238 Ca 0.03 -0.68 -0.33 0.00 -2.02 0.00 0.00 58.31 55.31 1s6q n LYS 238 Cb 0.50 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.94 1s6q n LYS 238 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1s6q n TRP 239 N -0.40 1.64 -4.06 2.13 5.03 -0.98 -4.88 117.44 115.92 1s6q n TRP 239 Ca 0.12 -1.15 -0.23 0.00 3.03 0.00 0.00 57.50 59.26 1s6q n TRP 239 Cb 0.39 -2.01 -0.04 0.00 -1.03 0.00 0.00 31.31 28.62 1s6q n TRP 239 CO 0.00 0.00 0.00 0.95 -0.03 0.00 0.00 177.69 178.61 1s6q s THR 240 N 9.69 4.72 0.53 -0.99 -4.23 -1.26 -5.06 115.64 119.04 1s6q s THR 240 Ca 0.68 -1.19 -0.21 0.00 -1.18 0.00 0.00 61.69 59.79 1s6q s THR 240 Cb 0.06 -3.52 -0.05 0.00 1.34 0.00 0.00 72.50 70.33 1s6q s THR 240 CO 0.18 -0.28 1.21 -0.69 -0.54 0.00 0.00 174.62 174.50 1s6q s VAL 241 N -1.99 2.79 -0.71 2.29 1.01 -1.26 -4.95 120.40 117.58 1s6q s VAL 241 Ca 0.33 0.54 0.02 0.00 0.00 0.00 0.00 61.98 62.87 1s6q s VAL 241 Cb -0.09 -3.25 0.36 0.00 0.00 0.00 0.00 36.38 33.40 1s6q s VAL 241 CO 0.26 -0.06 1.41 0.00 0.00 0.00 0.00 175.10 176.71 1s6q n GLN 242 N -1.06 3.75 -1.30 2.72 -0.00 -1.25 -5.05 117.38 115.19 1s6q n GLN 242 Ca 0.11 -4.48 -0.55 0.00 -0.00 0.00 0.00 57.00 52.07 1s6q n GLN 242 Cb 0.48 -2.31 -0.13 0.00 -0.00 0.00 0.00 30.24 28.29 1s6q n GLN 242 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1s6q n PRO 243 N -0.31 0.00 -2.38 2.61 -0.04 -1.26 -4.83 135.00 128.79 1s6q n PRO 243 Ca 0.41 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.46 1s6q n PRO 243 Cb 0.39 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 32.33 1s6q n PRO 243 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1s6q s ILE 244 N 6.64 3.54 0.38 0.52 -0.00 -1.26 -5.01 121.20 126.00 1s6q s ILE 244 Ca 1.23 1.33 0.08 0.00 -0.00 0.00 0.00 60.65 63.28 1s6q s ILE 244 Cb -1.44 -3.85 -0.05 0.00 -0.00 0.00 0.00 42.46 37.13 1s6q s ILE 244 CO 0.62 0.23 0.13 -0.69 -0.00 0.00 0.00 174.94 175.22 1s6q s VAL 245 N -0.22 2.53 0.46 8.37 1.01 -1.26 -4.99 120.40 126.31 1s6q s VAL 245 Ca 0.52 -1.77 -0.12 0.00 0.00 0.00 0.00 61.98 60.61 1s6q s VAL 245 Cb -0.33 -2.94 -0.06 0.00 0.00 0.00 0.00 36.38 33.05 1s6q s VAL 245 CO 0.38 -0.09 0.86 -0.76 0.00 0.00 0.00 175.10 175.48 1s6q s LEU 246 N -3.84 3.69 0.19 3.92 1.43 -1.26 -5.04 118.68 117.77 1s6q s LEU 246 Ca 0.39 1.26 -0.28 0.00 -1.03 0.00 0.00 54.13 54.46 1s6q s LEU 246 Cb 0.02 -4.18 -0.08 0.00 0.03 0.00 0.00 46.19 41.97 1s6q s LEU 246 CO 0.22 -0.52 0.88 -2.16 0.23 0.00 0.00 176.35 175.00 1s6q s PRO 247 N -4.13 4.73 -0.18 1.29 0.04 -1.26 -5.04 135.00 130.45 1s6q s PRO 247 Ca 0.53 1.35 -0.16 0.00 0.04 0.00 0.00 61.00 62.77 1s6q s PRO 247 Cb -0.10 -3.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.11 1s6q s PRO 247 CO 0.35 0.49 0.38 -2.00 0.04 0.00 0.00 177.00 176.26 1s6q s GLU 248 N -0.97 4.21 0.01 4.56 2.12 -1.26 -5.07 118.70 122.30 1s6q s GLU 248 Ca 0.40 0.20 0.01 0.00 0.36 0.00 0.00 54.97 55.93 1s6q s GLU 248 Cb -0.24 -3.50 -0.01 0.00 0.26 0.00 0.00 34.13 30.64 1s6q s GLU 248 CO 0.29 0.04 -0.02 0.15 -0.54 0.00 0.00 175.26 175.18 1s6q s LYS 249 N 1.06 0.20 -0.03 4.30 1.02 -1.26 -5.04 119.74 119.99 1s6q s LYS 249 Ca 0.19 -0.23 -0.15 0.00 0.02 0.00 0.00 55.97 55.80 1s6q s LYS 249 Cb -0.14 -0.09 -0.08 0.00 -0.52 0.00 0.00 37.83 36.99 1s6q s LYS 249 CO 0.07 0.02 0.64 -0.44 -0.92 0.00 0.00 175.35 174.72 1s6q h ASP 250 N 5.67 -0.44 -3.70 2.83 3.32 -2.04 -3.42 116.42 118.62 1s6q h ASP 250 Ca -0.28 0.02 -0.66 0.00 0.02 0.00 0.00 57.03 56.13 1s6q h ASP 250 Cb 1.21 0.12 -0.21 0.00 0.22 0.00 0.00 39.33 40.66 1s6q h ASP 250 CO 0.48 -0.06 -0.56 -0.94 -1.72 0.00 0.00 179.24 176.44 1s6q s SER 251 N -4.67 5.56 -0.32 6.45 1.04 -1.26 -5.08 113.70 115.42 1s6q s SER 251 Ca -0.08 -0.34 -0.08 0.00 0.48 0.00 0.00 55.95 55.93 1s6q s SER 251 Cb 0.01 -2.01 0.01 0.00 0.10 0.00 0.00 66.02 64.13 1s6q s SER 251 CO 0.23 -0.13 0.13 0.26 0.98 0.00 0.00 173.24 174.71 1s6q s TRP 252 N 1.65 3.19 0.53 5.02 0.23 -1.26 -5.04 118.94 123.25 1s6q s TRP 252 Ca 0.06 -0.89 -0.02 0.00 -2.03 0.00 0.00 56.10 53.22 1s6q s TRP 252 Cb -0.16 -2.32 0.01 0.00 0.03 0.00 0.00 33.47 31.03 1s6q s TRP 252 CO 0.07 -0.57 0.78 0.95 0.96 0.00 0.00 176.95 179.14 1s6q s THR 253 N 1.54 3.46 0.13 2.01 -4.23 -1.26 0.07 115.64 117.36 1s6q s THR 253 Ca 0.03 -0.39 -0.25 0.00 -1.18 0.00 0.00 61.69 59.90 1s6q s THR 253 Cb -0.18 -3.32 -0.03 0.00 1.34 0.00 0.00 72.50 70.31 1s6q s THR 253 CO 0.04 -0.26 1.64 0.58 -0.54 0.00 0.00 174.62 176.08 1s6q h VAL 254 N 0.09 0.43 -0.16 2.29 2.07 -0.39 -0.69 116.25 119.90 1s6q h VAL 254 Ca -0.45 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.10 1s6q h VAL 254 Cb 1.27 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 1s6q h VAL 254 CO 0.57 0.00 -0.36 -1.13 0.02 0.00 0.00 177.57 176.67 1s6q h ASN 255 N -0.34 -1.17 -0.52 0.57 -0.73 -1.77 -0.69 115.58 110.94 1s6q h ASN 255 Ca 0.08 0.14 0.07 0.00 1.87 0.00 0.00 56.30 58.47 1s6q h ASN 255 Cb 0.46 0.46 -0.10 0.00 0.27 0.00 0.00 38.32 39.42 1s6q h ASN 255 CO -0.27 -0.30 -0.49 0.44 -0.37 0.00 0.00 177.43 176.44 1s6q h ASP 256 N -0.33 -1.67 -0.09 1.15 3.32 -1.78 0.79 116.42 117.82 1s6q h ASP 256 Ca 0.03 0.25 0.03 0.00 0.02 0.00 0.00 57.03 57.35 1s6q h ASP 256 Cb 0.42 0.72 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 1s6q h ASP 256 CO -0.33 -0.36 0.10 -0.29 -1.72 0.00 0.00 179.24 176.64 1s6q h ILE 257 N -0.29 0.50 0.73 0.35 2.10 -0.92 -2.04 117.51 117.94 1s6q h ILE 257 Ca 0.13 0.00 -0.04 0.00 1.08 0.00 0.00 64.86 66.04 1s6q h ILE 257 Cb 0.57 0.92 0.01 0.00 -1.09 0.00 0.00 36.82 37.23 1s6q h ILE 257 CO -0.65 0.00 -0.35 1.56 -1.08 0.00 0.00 178.15 177.63 1s6q h GLN 258 N 0.00 -0.94 -0.56 2.19 4.20 0.22 -1.21 115.11 119.01 1s6q h GLN 258 Ca 0.04 0.06 0.11 0.00 0.06 0.00 0.00 58.65 58.93 1s6q h GLN 258 Cb 0.24 0.21 -0.09 0.00 0.30 0.00 0.00 27.48 28.15 1s6q h GLN 258 CO -0.00 -0.63 0.04 0.87 -0.67 0.00 0.00 178.83 178.44 1s6q h LYS 259 N -1.09 0.15 -0.73 1.46 1.57 -0.99 -0.23 116.57 116.71 1s6q h LYS 259 Ca -0.10 -0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.81 1s6q h LYS 259 Cb 0.75 -0.03 -0.09 0.00 0.08 0.00 0.00 32.23 32.93 1s6q h LYS 259 CO 0.16 0.10 0.29 1.25 -0.57 0.00 0.00 179.45 180.68 1s6q h LEU 260 N 0.16 0.27 -1.75 2.94 5.85 -1.33 0.76 115.31 122.20 1s6q h LEU 260 Ca 0.29 0.10 -0.03 0.00 0.84 0.00 0.00 57.88 59.08 1s6q h LEU 260 Cb 0.44 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 1s6q h LEU 260 CO -0.44 0.11 -0.16 0.58 -0.34 0.00 0.00 178.44 178.19 1s6q h VAL 261 N 0.44 0.69 0.17 1.05 2.07 0.20 -2.40 116.25 118.46 1s6q h VAL 261 Ca 0.40 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1s6q h VAL 261 Cb 0.59 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1s6q h VAL 261 CO -0.39 0.16 -0.08 1.23 0.02 0.00 0.00 177.57 178.51 1s6q h GLY 262 N 0.95 -0.23 -0.57 2.17 0.00 0.15 -2.49 103.07 103.05 1s6q h GLY 262 Ca -0.00 0.09 0.27 0.00 0.00 0.00 0.00 47.33 47.69 1s6q h GLY 262 CO 0.02 -0.08 0.32 0.50 0.00 0.00 0.00 176.54 177.29 1s6q h LYS 263 N -0.57 0.19 -0.38 4.80 1.79 -0.66 0.51 116.57 122.25 1s6q h LYS 263 Ca -0.02 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 1s6q h LYS 263 Cb 0.17 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 1s6q h LYS 263 CO 0.04 0.13 0.20 -0.07 -1.08 0.00 0.00 179.45 178.66 1s6q h LEU 264 N 0.20 0.49 -1.66 2.94 3.38 -1.52 0.21 115.31 119.36 1s6q h LEU 264 Ca 0.62 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.45 1s6q h LEU 264 Cb 1.35 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 1s6q h LEU 264 CO -0.68 0.45 -0.20 -1.13 0.09 0.00 0.00 178.44 176.97 1s6q h ASN 265 N 0.48 0.00 0.77 -0.43 -0.73 -0.46 -0.69 115.58 114.52 1s6q h ASN 265 Ca 0.13 0.00 -0.25 0.00 1.87 0.00 0.00 56.30 58.05 1s6q h ASN 265 Cb 0.08 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.66 1s6q h ASN 265 CO -0.02 0.20 -1.18 -0.25 -0.37 0.00 0.00 177.43 175.80 1s6q h TRP 266 N 0.00 0.24 -0.81 0.67 7.01 -0.68 -3.29 115.95 119.09 1s6q h TRP 266 Ca -0.00 -0.18 0.04 0.00 2.11 0.00 0.00 58.89 60.86 1s6q h TRP 266 Cb 0.39 -0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 27.39 1s6q h TRP 266 CO 0.00 1.15 0.52 0.00 -2.79 0.00 0.00 178.44 177.32 1s6q h ALA 267 N 0.78 1.07 0.00 2.65 0.00 0.85 -2.96 119.26 121.66 1s6q h ALA 267 Ca -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1s6q h ALA 267 Cb 1.89 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1s6q h ALA 267 CO 0.16 0.33 0.12 -1.13 0.00 0.00 0.00 179.25 178.73 1s6q n SER 268 N -4.59 0.00 0.02 0.00 3.41 -0.61 -0.52 113.62 111.34 1s6q n SER 268 Ca 0.10 0.21 0.13 0.00 -0.26 0.00 0.00 58.87 59.05 1s6q n SER 268 Cb 0.10 -0.21 0.37 0.00 -0.26 0.00 0.00 64.21 64.20 1s6q n SER 268 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1s6q n GLN 269 N -1.15 0.09 -0.05 4.33 6.02 -1.12 -3.10 117.38 122.40 1s6q n GLN 269 Ca 0.00 0.04 -0.05 0.00 -0.01 0.00 0.00 57.00 56.98 1s6q n GLN 269 Cb 0.12 -1.57 -0.07 0.00 1.02 0.00 0.00 30.24 29.74 1s6q n GLN 269 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1s6q n ILE 270 N -1.71 0.63 -3.79 5.09 5.41 0.33 -4.79 119.36 120.52 1s6q n ILE 270 Ca 0.06 -0.34 -0.29 0.00 1.00 0.00 0.00 62.75 63.17 1s6q n ILE 270 Cb 0.37 -0.80 -0.15 0.00 -0.71 0.00 0.00 39.64 38.34 1s6q n ILE 270 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1s6q s TYR 271 N -2.22 1.83 -0.51 1.39 2.02 -0.93 -4.94 117.35 113.98 1s6q s TYR 271 Ca -0.08 -1.63 0.25 0.00 -0.37 0.00 0.00 57.07 55.25 1s6q s TYR 271 Cb 0.03 -1.62 0.93 0.00 -0.40 0.00 0.00 41.96 40.90 1s6q s TYR 271 CO 0.34 -0.80 1.76 -1.00 -1.57 0.00 0.00 175.55 174.27 1s6q h PRO 272 N 8.06 0.00 0.00 -1.71 0.13 -1.85 -3.24 132.00 133.40 1s6q h PRO 272 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1s6q h PRO 272 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1s6q h PRO 272 CO 0.43 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.61 1s6q n GLY 273 N 0.51 -0.70 3.84 1.56 0.00 -1.26 -4.80 105.19 104.34 1s6q n GLY 273 Ca 0.03 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1s6q n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s6q s ILE 274 N -2.00 5.03 0.11 -0.61 1.01 -1.22 -4.97 121.20 118.54 1s6q s ILE 274 Ca 0.02 0.74 0.03 0.00 0.00 0.00 0.00 60.65 61.44 1s6q s ILE 274 Cb 0.01 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 1s6q s ILE 274 CO 0.01 0.47 -0.09 -0.54 0.00 0.00 0.00 174.94 174.80 1s6q s LYS 275 N -1.37 0.89 0.00 2.79 1.02 -1.26 -4.95 119.74 116.85 1s6q s LYS 275 Ca 0.27 -1.26 0.00 0.00 0.02 0.00 0.00 55.97 55.00 1s6q s LYS 275 Cb -0.16 -0.46 0.00 0.00 -0.52 0.00 0.00 37.83 36.69 1s6q s LYS 275 CO 0.15 0.05 0.00 1.33 -0.92 0.00 0.00 175.35 175.97 1s6q n VAL 276 N 0.25 0.00 0.00 3.17 0.24 -1.26 -4.95 118.33 115.78 1s6q n VAL 276 Ca -0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 1s6q n VAL 276 Cb 0.59 -0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.74 1s6q n VAL 276 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1s6q n ARG 277 N -1.89 0.00 0.14 7.34 0.00 -1.26 0.26 116.66 121.26 1s6q n ARG 277 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.85 57.86 1s6q n ARG 277 Cb 0.13 0.00 0.30 0.00 -0.00 0.00 0.00 32.46 32.89 1s6q n ARG 277 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 1s6q h GLN 278 N 0.00 0.11 0.02 2.89 4.15 -1.97 1.38 115.11 121.69 1s6q h GLN 278 Ca 0.00 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.35 1s6q h GLN 278 Cb 0.00 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1s6q h GLN 278 CO 0.00 0.48 -0.12 1.25 -1.93 0.00 0.00 178.83 178.51 1s6q h LEU 279 N 0.09 0.07 -0.84 -2.39 6.46 0.33 -3.32 115.31 115.71 1s6q h LEU 279 Ca 0.01 -0.99 0.04 0.00 -0.12 0.00 0.00 57.88 56.82 1s6q h LEU 279 Cb 0.72 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.58 1s6q h LEU 279 CO 0.05 1.05 0.53 0.77 -0.62 0.00 0.00 178.44 180.23 1s6q h SER 280 N -0.90 0.87 0.00 1.25 4.64 -1.14 0.78 113.55 119.05 1s6q h SER 280 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1s6q h SER 280 Cb 1.09 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1s6q h SER 280 CO 0.02 0.58 0.21 0.07 -0.87 0.00 0.00 176.83 176.84 1s6q h LYS 281 N 1.02 0.00 -0.02 4.77 2.10 0.18 1.75 116.57 126.36 1s6q h LYS 281 Ca 0.35 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.00 1s6q h LYS 281 Cb 0.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.40 1s6q h LYS 281 CO -0.14 0.00 0.00 -0.11 -2.00 0.00 0.00 179.45 177.20 1s6q n LEU 282 N -2.66 0.13 -0.00 7.07 7.94 0.27 -2.96 117.00 126.79 1s6q n LEU 282 Ca -0.02 -0.06 0.00 0.00 -1.11 0.00 0.00 56.01 54.82 1s6q n LEU 282 Cb 0.25 -0.01 -0.00 0.00 0.53 0.00 0.00 43.42 44.19 1s6q n LEU 282 CO 0.13 0.03 -0.50 0.18 -1.11 0.00 0.00 177.39 176.11 1s6q n LEU 283 N -0.57 0.00 -0.25 -1.96 4.77 0.59 -4.74 117.00 114.84 1s6q n LEU 283 Ca 0.08 0.00 0.31 0.00 -0.03 0.00 0.00 56.01 56.37 1s6q n LEU 283 Cb 0.05 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 41.67 1s6q n LEU 283 CO 0.06 0.00 1.29 -0.09 -1.33 0.00 0.00 177.39 177.32 1s6q h ARG 284 N 0.00 0.00 -7.55 3.23 9.65 -1.41 -3.40 114.38 114.90 1s6q h ARG 284 Ca -0.00 0.00 -0.44 0.00 -1.10 0.00 0.00 59.98 58.44 1s6q h ARG 284 Cb 0.03 0.00 0.17 0.00 -1.39 0.00 0.00 29.97 28.78 1s6q h ARG 284 CO 0.00 0.00 0.26 0.20 2.80 0.00 0.00 179.97 183.23 1s6q s GLY 285 N -3.55 1.64 -0.53 2.80 0.00 -1.26 -4.98 107.32 101.43 1s6q s GLY 285 Ca -0.03 -0.91 0.04 0.00 0.00 0.00 0.00 44.72 43.82 1s6q s GLY 285 CO 0.54 -0.14 1.21 -1.30 0.00 0.00 0.00 173.10 173.41 1s6q n THR 286 N -4.22 2.77 -1.60 0.90 -2.24 -1.26 -5.06 114.28 103.57 1s6q n THR 286 Ca 0.12 -5.02 -0.30 0.00 -2.27 0.00 0.00 64.05 56.58 1s6q n THR 286 Cb 0.59 -1.30 0.09 0.00 -2.10 0.00 0.00 70.33 67.61 1s6q n THR 286 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1s6q s LYS 287 N -3.62 2.17 1.14 -0.78 1.02 -1.26 -5.04 119.74 113.37 1s6q s LYS 287 Ca 0.48 0.61 -0.19 0.00 0.02 0.00 0.00 55.97 56.89 1s6q s LYS 287 Cb 0.38 -1.93 0.29 0.00 -0.52 0.00 0.00 37.83 36.05 1s6q s LYS 287 CO -0.21 -1.56 0.66 0.00 -0.92 0.00 0.00 175.35 173.33 1s6q n ALA 288 N -3.38 -4.03 -0.09 5.17 0.00 -1.26 -4.96 120.51 111.96 1s6q n ALA 288 Ca 0.07 -1.17 -0.11 0.00 0.00 0.00 0.00 53.44 52.23 1s6q n ALA 288 Cb 0.56 -0.11 -0.11 0.00 0.00 0.00 0.00 19.45 19.80 1s6q n ALA 288 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1s6q n LEU 289 N 0.00 1.44 0.00 0.00 4.77 -1.26 -4.37 117.00 117.57 1s6q n LEU 289 Ca 0.11 -0.05 0.10 0.00 -0.03 0.00 0.00 56.01 56.13 1s6q n LEU 289 Cb 0.46 -0.14 0.46 0.00 -2.33 0.00 0.00 43.42 41.87 1s6q n LEU 289 CO 0.30 0.60 0.81 0.41 -1.33 0.00 0.00 177.39 178.18 1s6q n THR 290 N -2.81 0.54 -2.27 -5.08 -1.04 -1.26 -2.58 114.28 99.77 1s6q n THR 290 Ca -0.30 0.13 -0.42 0.00 -2.04 0.00 0.00 64.05 61.43 1s6q n THR 290 Cb 0.94 -0.80 -0.03 0.00 -1.82 0.00 0.00 70.33 68.62 1s6q n THR 290 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1s6q s GLU 291 N -2.79 4.38 0.39 -2.82 2.12 -1.26 -4.81 118.70 113.90 1s6q s GLU 291 Ca 0.14 1.96 -0.18 0.00 0.36 0.00 0.00 54.97 57.25 1s6q s GLU 291 Cb 0.13 -3.27 -0.10 0.00 0.26 0.00 0.00 34.13 31.15 1s6q s GLU 291 CO 0.33 -0.33 0.87 0.08 -0.54 0.00 0.00 175.26 175.66 1s6q s VAL 292 N 0.88 4.51 0.23 3.70 1.01 -1.26 0.08 120.40 129.54 1s6q s VAL 292 Ca 0.61 1.27 0.00 0.00 0.00 0.00 0.00 61.98 63.86 1s6q s VAL 292 Cb -0.34 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1s6q s VAL 292 CO 0.31 -0.28 0.14 0.27 0.00 0.00 0.00 175.10 175.54 1s6q s ILE 293 N -2.11 0.16 0.35 2.22 -4.36 0.11 -4.84 121.20 112.73 1s6q s ILE 293 Ca 0.59 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.98 1s6q s ILE 293 Cb -0.09 -2.53 -0.03 0.00 1.25 0.00 0.00 42.46 41.05 1s6q s ILE 293 CO 0.15 0.00 0.55 -2.16 0.24 0.00 0.00 174.94 173.73 1s6q s PRO 294 N -4.05 3.49 0.71 0.37 0.04 -1.26 -4.53 135.00 129.77 1s6q s PRO 294 Ca 0.39 -0.31 -0.12 0.00 0.04 0.00 0.00 61.00 61.00 1s6q s PRO 294 Cb 0.07 -2.65 0.18 0.00 0.04 0.00 0.00 34.50 32.13 1s6q s PRO 294 CO 0.14 0.14 0.52 1.47 0.04 0.00 0.00 177.00 179.31 1s6q n LEU 295 N -1.77 0.00 -3.90 -3.56 -0.00 -1.26 -5.05 117.00 101.46 1s6q n LEU 295 Ca -0.05 -0.54 -0.09 0.00 -0.00 0.00 0.00 56.01 55.34 1s6q n LEU 295 Cb 0.56 -0.52 -0.07 0.00 -0.00 0.00 0.00 43.42 43.39 1s6q n LEU 295 CO 0.49 -1.90 -0.04 -0.89 -0.00 0.00 0.00 177.39 175.05 1s6q s THR 296 N -1.81 0.10 0.00 1.47 2.01 -1.26 -5.01 115.64 111.13 1s6q s THR 296 Ca 0.36 -1.26 0.00 0.00 0.31 0.00 0.00 61.69 61.10 1s6q s THR 296 Cb -0.05 -1.61 0.00 0.00 0.01 0.00 0.00 72.50 70.85 1s6q s THR 296 CO 0.29 -0.43 0.00 1.21 -0.69 0.00 0.00 174.62 175.00 1s6q n GLU 297 N -0.16 0.00 -0.49 4.92 2.13 -1.26 -0.14 120.64 125.64 1s6q n GLU 297 Ca -0.11 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.80 1s6q n GLU 297 Cb 0.63 0.00 0.30 0.00 0.27 0.00 0.00 31.44 32.64 1s6q n GLU 297 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1s6q n GLU 298 N -0.08 3.41 -0.03 5.31 1.02 -1.26 -4.49 120.64 124.51 1s6q n GLU 298 Ca 0.00 -2.71 -0.08 0.00 -0.02 0.00 0.00 57.16 54.35 1s6q n GLU 298 Cb 0.00 -1.75 -0.02 0.00 -0.02 0.00 0.00 31.44 29.65 1s6q n GLU 298 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1s6q h ALA 299 N 3.26 0.05 0.00 0.62 0.00 -0.82 1.47 119.26 123.84 1s6q h ALA 299 Ca 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1s6q h ALA 299 Cb 1.30 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 1s6q h ALA 299 CO 0.18 -0.54 -0.17 0.93 0.00 0.00 0.00 179.25 179.65 1s6q h GLU 300 N -0.10 0.00 0.00 0.00 4.39 -1.78 0.37 114.58 117.46 1s6q h GLU 300 Ca 0.11 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.71 1s6q h GLU 300 Cb 0.26 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1s6q h GLU 300 CO -0.26 0.17 -0.50 1.25 -1.16 0.00 0.00 179.01 178.51 1s6q h LEU 301 N 0.00 0.00 0.11 1.33 6.46 -0.55 -2.79 115.31 119.86 1s6q h LEU 301 Ca -0.00 0.00 -0.32 0.00 -0.12 0.00 0.00 57.88 57.44 1s6q h LEU 301 Cb 0.41 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.33 1s6q h LEU 301 CO 0.02 0.50 -1.69 -0.33 -0.62 0.00 0.00 178.44 176.31 1s6q h GLU 302 N 0.00 0.24 -0.02 1.25 4.39 0.44 0.53 114.58 121.41 1s6q h GLU 302 Ca -0.00 -0.40 0.00 0.00 0.34 0.00 0.00 59.36 59.30 1s6q h GLU 302 Cb 1.06 0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.86 1s6q h GLU 302 CO 0.06 1.19 0.04 1.25 -1.16 0.00 0.00 179.01 180.40 1s6q h LEU 303 N -0.19 0.00 0.02 1.33 5.85 -0.44 0.35 115.31 122.22 1s6q h LEU 303 Ca -0.37 0.00 -0.38 0.00 0.84 0.00 0.00 57.88 57.97 1s6q h LEU 303 Cb 1.86 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.82 1s6q h LEU 303 CO 0.05 0.00 -2.38 0.00 -0.34 0.00 0.00 178.44 175.77 1s6q n ALA 304 N -2.15 1.38 0.44 1.25 0.00 -1.06 -3.16 120.51 117.21 1s6q n ALA 304 Ca -0.03 -1.07 -0.20 0.00 0.00 0.00 0.00 53.44 52.15 1s6q n ALA 304 Cb 0.12 -0.21 -0.10 0.00 0.00 0.00 0.00 19.45 19.26 1s6q n ALA 304 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1s6q h GLU 305 N 0.01 -1.14 0.34 0.00 4.57 -0.12 -2.63 114.58 115.61 1s6q h GLU 305 Ca -0.55 0.08 -0.02 0.00 -1.18 0.00 0.00 59.36 57.70 1s6q h GLU 305 Cb 1.98 0.26 0.00 0.00 -0.16 0.00 0.00 28.75 30.83 1s6q h GLU 305 CO -0.04 -0.76 -0.16 -0.91 -1.18 0.00 0.00 179.01 175.95 1s6q h ASN 306 N -1.19 -0.39 -0.39 1.04 2.35 -1.19 -1.61 115.58 114.21 1s6q h ASN 306 Ca -0.11 -0.02 0.11 0.00 -0.55 0.00 0.00 56.30 55.74 1s6q h ASN 306 Cb 0.94 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.40 1s6q h ASN 306 CO 0.13 -0.24 1.06 -1.14 -1.65 0.00 0.00 177.43 175.59 1s6q n ARG 307 N -5.27 0.02 -0.01 0.81 0.63 -1.19 -0.30 116.66 111.36 1s6q n ARG 307 Ca -0.10 0.95 -0.00 0.00 -0.92 0.00 0.00 57.85 57.77 1s6q n ARG 307 Cb 0.22 -2.48 -0.00 0.00 0.45 0.00 0.00 32.46 30.64 1s6q n ARG 307 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1s6q h GLU 308 N 0.00 0.00 -0.24 -0.14 4.57 -0.92 -3.28 114.58 114.57 1s6q h GLU 308 Ca 0.19 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.44 1s6q h GLU 308 Cb 2.30 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.88 1s6q h GLU 308 CO -0.00 0.00 0.69 0.97 -1.18 0.00 0.00 179.01 179.48 1s6q h ILE 309 N -0.11 0.07 -0.11 2.32 2.10 -0.60 1.65 117.51 122.83 1s6q h ILE 309 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1s6q h ILE 309 Cb 0.04 0.37 0.00 0.00 -1.09 0.00 0.00 36.82 36.14 1s6q h ILE 309 CO 0.00 0.00 0.00 -0.11 -1.08 0.00 0.00 178.15 176.96 1s6q n LEU 310 N -2.99 1.62 -0.26 2.19 0.00 0.59 -3.51 117.00 114.63 1s6q n LEU 310 Ca 0.04 -0.63 0.03 0.00 0.00 0.00 0.00 56.01 55.45 1s6q n LEU 310 Cb 0.79 -0.07 0.04 0.00 0.00 0.00 0.00 43.42 44.17 1s6q n LEU 310 CO 0.14 0.32 0.38 1.17 0.00 0.00 0.00 177.39 179.40 1s6q n LYS 311 N 0.28 0.35 -4.73 1.96 4.81 0.56 -4.85 118.16 116.53 1s6q n LYS 311 Ca 0.17 -1.02 -0.33 0.00 -0.87 0.00 0.00 58.31 56.26 1s6q n LYS 311 Cb 0.34 -1.12 -0.12 0.00 0.02 0.00 0.00 35.03 34.14 1s6q n LYS 311 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1s6q s GLU 312 N -0.59 2.81 0.46 1.64 -1.05 -1.15 -5.05 118.70 115.76 1s6q s GLU 312 Ca 0.08 -0.62 -0.24 0.00 -0.15 0.00 0.00 54.97 54.04 1s6q s GLU 312 Cb 0.05 -2.54 -0.07 0.00 -0.44 0.00 0.00 34.13 31.13 1s6q s GLU 312 CO 0.08 0.56 1.30 -1.25 0.95 0.00 0.00 175.26 176.89 1s6q s PRO 313 N -0.54 3.68 0.25 -4.83 0.04 -1.26 -4.97 135.00 127.38 1s6q s PRO 313 Ca 0.08 2.11 -0.30 0.00 0.04 0.00 0.00 61.00 62.93 1s6q s PRO 313 Cb -0.12 -2.54 -0.09 0.00 0.04 0.00 0.00 34.50 31.79 1s6q s PRO 313 CO 0.02 -0.71 0.99 0.54 0.04 0.00 0.00 177.00 177.87 1s6q s VAL 314 N -1.33 3.90 0.77 -0.36 0.11 -1.26 -5.07 120.40 117.16 1s6q s VAL 314 Ca 0.63 1.92 -0.06 0.00 -2.93 0.00 0.00 61.98 61.54 1s6q s VAL 314 Cb -0.37 -4.22 0.13 0.00 -1.53 0.00 0.00 36.38 30.39 1s6q s VAL 314 CO 0.46 0.46 1.07 -1.38 -3.33 0.00 0.00 175.10 172.37 1s6q s HIS 315 N -1.18 1.89 0.00 1.54 -3.43 -1.26 -4.29 115.29 108.57 1s6q s HIS 315 Ca 0.42 0.01 0.00 0.00 -0.80 0.00 0.00 55.06 54.69 1s6q s HIS 315 Cb -0.28 -3.30 0.00 0.00 -1.43 0.00 0.00 32.58 27.57 1s6q s HIS 315 CO 0.35 -1.85 0.00 0.41 -2.00 0.00 0.00 174.74 171.65 1s6q n GLY 316 N -3.06 2.18 3.47 -1.38 0.00 -1.26 -4.98 105.19 100.16 1s6q n GLY 316 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 1s6q n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s6q s VAL 317 N -3.06 4.58 0.28 1.61 1.01 -1.26 -5.02 120.40 118.54 1s6q s VAL 317 Ca 0.00 -0.24 0.07 0.00 0.00 0.00 0.00 61.98 61.81 1s6q s VAL 317 Cb 0.00 -4.49 -0.06 0.00 0.00 0.00 0.00 36.38 31.84 1s6q s VAL 317 CO 0.00 -1.09 -0.07 -0.31 0.00 0.00 0.00 175.10 173.63 1s6q s TYR 318 N 3.42 2.02 -0.51 5.22 1.51 -1.26 -5.07 117.35 122.68 1s6q s TYR 318 Ca 0.22 -0.65 -0.20 0.00 -1.01 0.00 0.00 57.07 55.43 1s6q s TYR 318 Cb -0.17 -1.13 0.05 0.00 -0.11 0.00 0.00 41.96 40.60 1s6q s TYR 318 CO 0.13 0.35 0.66 -0.47 -1.11 0.00 0.00 175.55 175.11 1s6q s TYR 319 N -2.93 3.02 -0.45 2.71 5.04 -1.26 -5.01 117.35 118.47 1s6q s TYR 319 Ca 0.30 -0.44 -0.27 0.00 -2.44 0.00 0.00 57.07 54.21 1s6q s TYR 319 Cb 0.03 -3.58 0.03 0.00 0.35 0.00 0.00 41.96 38.78 1s6q s TYR 319 CO 0.12 -1.06 1.04 0.34 -1.34 0.00 0.00 175.55 174.66 1s6q s ASP 320 N 2.65 6.62 0.00 4.32 -1.08 -1.26 -4.87 116.67 123.05 1s6q s ASP 320 Ca 0.17 0.42 0.12 0.00 -0.52 0.00 0.00 52.55 52.74 1s6q s ASP 320 Cb -0.18 -2.51 0.71 0.00 -1.46 0.00 0.00 42.92 39.49 1s6q s ASP 320 CO 0.13 -1.11 1.46 -2.65 0.52 0.00 0.00 175.17 173.51 1s6q n PRO 321 N 7.43 1.00 0.08 4.34 -0.02 -1.26 -2.44 135.00 144.13 1s6q n PRO 321 Ca 0.10 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.69 1s6q n PRO 321 Cb 0.49 -1.19 0.01 0.00 -0.02 0.00 0.00 33.50 32.79 1s6q n PRO 321 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1s6q n SER 322 N -0.69 0.75 -4.93 2.55 3.41 -1.26 -4.92 113.62 108.53 1s6q n SER 322 Ca 0.09 0.23 -0.20 0.00 -0.26 0.00 0.00 58.87 58.73 1s6q n SER 322 Cb 0.04 0.56 -0.01 0.00 -0.26 0.00 0.00 64.21 64.54 1s6q n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1s6q s LYS 323 N -3.34 2.58 0.39 4.33 1.02 -1.02 -5.12 119.74 118.58 1s6q s LYS 323 Ca 0.00 -1.49 0.03 0.00 0.02 0.00 0.00 55.97 54.53 1s6q s LYS 323 Cb 0.11 -2.50 -0.01 0.00 -0.52 0.00 0.00 37.83 34.91 1s6q s LYS 323 CO 0.79 -0.31 0.57 -0.51 -0.92 0.00 0.00 175.35 174.97 1s6q s ASP 324 N -4.26 5.90 -0.14 2.83 1.01 -1.26 -4.97 116.67 115.78 1s6q s ASP 324 Ca 0.50 0.06 -0.12 0.00 0.71 0.00 0.00 52.55 53.71 1s6q s ASP 324 Cb -0.05 -1.40 -0.05 0.00 1.01 0.00 0.00 42.92 42.43 1s6q s ASP 324 CO 0.30 -0.57 0.24 -0.76 0.21 0.00 0.00 175.17 174.59 1s6q s LEU 325 N -4.37 4.29 -0.23 1.23 1.43 -1.26 -4.55 118.68 115.22 1s6q s LEU 325 Ca 0.47 0.49 0.01 0.00 -1.03 0.00 0.00 54.13 54.07 1s6q s LEU 325 Cb -0.10 -2.28 0.04 0.00 0.03 0.00 0.00 46.19 43.88 1s6q s LEU 325 CO 0.35 0.20 -0.13 -0.63 0.23 0.00 0.00 176.35 176.37 1s6q s ILE 326 N -0.01 2.32 -0.25 -0.59 1.01 0.73 -0.05 121.20 124.37 1s6q s ILE 326 Ca 0.15 -1.22 -0.08 0.00 0.00 0.00 0.00 60.65 59.49 1s6q s ILE 326 Cb -0.13 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.12 1s6q s ILE 326 CO 0.04 0.23 0.10 0.00 0.00 0.00 0.00 174.94 175.31 1s6q s ALA 327 N 1.23 3.30 -0.07 9.38 0.00 -0.82 -0.05 121.76 134.72 1s6q s ALA 327 Ca -0.02 -1.06 -0.03 0.00 0.00 0.00 0.00 51.96 50.86 1s6q s ALA 327 Cb -0.17 -2.16 -0.04 0.00 0.00 0.00 0.00 23.12 20.76 1s6q s ALA 327 CO -0.08 -0.40 0.05 -1.21 0.00 0.00 0.00 175.76 174.12 1s6q s GLU 328 N 1.47 3.11 -0.07 0.00 2.02 0.17 -1.40 118.70 123.99 1s6q s GLU 328 Ca 0.06 -0.36 0.02 0.00 0.02 0.00 0.00 54.97 54.71 1s6q s GLU 328 Cb -0.15 -2.90 0.01 0.00 0.10 0.00 0.00 34.13 31.19 1s6q s GLU 328 CO 0.05 0.71 -0.12 0.42 0.02 0.00 0.00 175.26 176.33 1s6q s ILE 329 N -1.00 1.18 -0.04 -1.63 1.01 -1.23 -1.07 121.20 118.41 1s6q s ILE 329 Ca 0.16 -0.49 0.06 0.00 0.00 0.00 0.00 60.65 60.38 1s6q s ILE 329 Cb -0.12 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.26 1s6q s ILE 329 CO 0.06 0.37 -0.22 0.00 0.00 0.00 0.00 174.94 175.14 1s6q s GLN 330 N 0.74 2.15 -0.03 2.79 0.00 -0.50 -4.28 119.66 120.53 1s6q s GLN 330 Ca -0.13 -0.80 -0.30 0.00 -0.00 0.00 0.00 55.36 54.13 1s6q s GLN 330 Cb -0.16 -1.89 -0.03 0.00 0.00 0.00 0.00 33.01 30.93 1s6q s GLN 330 CO 0.03 0.37 1.07 0.21 0.00 0.00 0.00 175.29 176.97 1s6q s LYS 331 N -0.20 4.45 -0.07 9.60 2.20 -1.26 -1.68 119.74 132.78 1s6q s LYS 331 Ca -0.01 1.52 0.21 0.00 -0.36 0.00 0.00 55.97 57.33 1s6q s LYS 331 Cb -0.12 -3.49 -0.31 0.00 -1.51 0.00 0.00 37.83 32.40 1s6q s LYS 331 CO 0.02 -0.25 0.38 1.04 -0.36 0.00 0.00 175.35 176.18 1s6q n GLN 332 N 4.52 0.67 0.00 4.03 1.13 0.90 -4.95 117.38 123.67 1s6q n GLN 332 Ca 0.08 -0.14 0.00 0.00 -1.94 0.00 0.00 57.00 55.00 1s6q n GLN 332 Cb 0.49 -1.52 0.00 0.00 0.11 0.00 0.00 30.24 29.31 1s6q n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1s6q n GLY 333 N 1.39 2.07 3.28 1.08 0.00 -0.78 -4.89 105.19 107.34 1s6q n GLY 333 Ca -0.12 -1.68 -0.15 0.00 0.00 0.00 0.00 46.02 44.07 1s6q n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1s6q n GLN 334 N 1.93 -3.72 -1.73 1.61 6.02 -1.26 -2.80 117.38 117.42 1s6q n GLN 334 Ca 0.00 0.85 -0.21 0.00 -0.01 0.00 0.00 57.00 57.63 1s6q n GLN 334 Cb 0.00 -5.78 -0.08 0.00 1.02 0.00 0.00 30.24 25.40 1s6q n GLN 334 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s6q n GLY 335 N -1.20 1.61 3.11 1.08 0.00 -1.26 -4.90 105.19 103.64 1s6q n GLY 335 Ca -0.14 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.56 1s6q n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s6q s GLN 336 N -3.97 2.71 0.07 1.61 -0.21 -1.12 -1.23 119.66 117.51 1s6q s GLN 336 Ca 0.00 -0.73 0.07 0.00 0.02 0.00 0.00 55.36 54.72 1s6q s GLN 336 Cb 0.00 -2.27 -0.03 0.00 1.00 0.00 0.00 33.01 31.71 1s6q s GLN 336 CO 0.00 -0.10 -0.19 -1.58 -2.12 0.00 0.00 175.29 171.30 1s6q s TRP 337 N 1.05 1.68 0.22 0.91 0.52 -0.37 -0.07 118.94 122.87 1s6q s TRP 337 Ca -0.03 -0.40 0.11 0.00 0.02 0.00 0.00 56.10 55.81 1s6q s TRP 337 Cb -0.14 -0.96 -0.05 0.00 -1.15 0.00 0.00 33.47 31.17 1s6q s TRP 337 CO -0.05 0.13 -0.20 0.95 0.02 0.00 0.00 176.95 177.80 1s6q s THR 338 N -1.00 2.55 0.05 2.01 -4.23 -0.68 0.10 115.64 114.44 1s6q s THR 338 Ca 0.05 -2.09 -0.09 0.00 -1.18 0.00 0.00 61.69 58.38 1s6q s THR 338 Cb -0.09 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.48 1s6q s THR 338 CO 0.03 -0.21 0.19 -0.72 -0.54 0.00 0.00 174.62 173.36 1s6q s TYR 339 N -1.96 0.08 -0.07 3.99 1.13 -1.19 -1.40 117.35 117.92 1s6q s TYR 339 Ca 0.25 -0.34 0.01 0.00 -1.41 0.00 0.00 57.07 55.58 1s6q s TYR 339 Cb -0.07 -0.04 0.02 0.00 -1.10 0.00 0.00 41.96 40.77 1s6q s TYR 339 CO 0.13 -0.44 -0.06 -0.65 -2.51 0.00 0.00 175.55 172.01 1s6q s GLN 340 N -2.75 1.16 -0.31 -3.49 1.11 -0.23 -2.73 119.66 112.41 1s6q s GLN 340 Ca -0.04 -0.18 -0.06 0.00 0.01 0.00 0.00 55.36 55.10 1s6q s GLN 340 Cb -0.00 -1.17 0.03 0.00 -1.01 0.00 0.00 33.01 30.85 1s6q s GLN 340 CO -0.05 -0.14 0.07 0.42 0.01 0.00 0.00 175.29 175.61 1s6q s ILE 341 N 1.21 3.75 0.00 1.08 1.01 -0.86 0.43 121.20 127.82 1s6q s ILE 341 Ca -0.06 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.66 1s6q s ILE 341 Cb -0.14 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.31 1s6q s ILE 341 CO -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 174.94 174.89 1s6q n TYR 342 N 4.82 0.00 0.00 3.97 0.18 0.92 -1.86 117.16 125.19 1s6q n TYR 342 Ca -0.14 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.64 1s6q n TYR 342 Cb 0.46 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.42 1s6q n TYR 342 CO 0.00 0.00 0.00 1.04 -2.08 0.00 0.00 176.86 175.82 1s6q n GLN 343 N 0.00 4.45 -3.87 -3.48 6.02 -1.26 -0.19 117.38 119.04 1s6q n GLN 343 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.88 1s6q n GLN 343 Cb 0.00 -0.51 -0.11 0.00 1.02 0.00 0.00 30.24 30.63 1s6q n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1s6q s GLU 344 N -0.31 0.30 0.33 -1.09 0.41 -1.26 -4.95 118.70 112.12 1s6q s GLU 344 Ca 0.00 -0.17 -0.27 0.00 -0.41 0.00 0.00 54.97 54.12 1s6q s GLU 344 Cb 0.00 0.12 -0.13 0.00 -1.78 0.00 0.00 34.13 32.34 1s6q s GLU 344 CO 0.00 -0.06 1.03 -0.35 -0.49 0.00 0.00 175.26 175.39 1s6q n PRO 345 N 2.20 1.42 0.00 0.39 -0.04 -1.26 -2.50 135.00 135.21 1s6q n PRO 345 Ca -0.18 0.50 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 1s6q n PRO 345 Cb 0.57 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 32.10 1s6q n PRO 345 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1s6q n PHE 346 N 0.05 0.00 -2.71 0.54 3.01 -1.26 -4.84 117.46 112.25 1s6q n PHE 346 Ca 0.09 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.12 1s6q n PHE 346 Cb 0.34 -0.79 0.01 0.00 -0.01 0.00 0.00 39.48 39.03 1s6q n PHE 346 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1s6q n LYS 347 N -1.99 4.30 -2.02 -1.08 4.76 -1.04 -4.74 118.16 116.36 1s6q n LYS 347 Ca 0.00 -4.18 -0.40 0.00 -2.87 0.00 0.00 58.31 50.85 1s6q n LYS 347 Cb 0.00 -2.64 -0.01 0.00 -1.84 0.00 0.00 35.03 30.53 1s6q n LYS 347 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1s6q s ASN 348 N -0.83 6.54 -0.13 4.39 0.01 -1.26 -4.41 114.94 119.24 1s6q s ASN 348 Ca 0.35 2.77 -0.02 0.00 -0.71 0.00 0.00 52.86 55.26 1s6q s ASN 348 Cb 0.08 -2.65 -0.24 0.00 0.41 0.00 0.00 41.25 38.85 1s6q s ASN 348 CO 0.05 -0.71 0.31 0.18 -1.51 0.00 0.00 177.10 175.42 1s6q n LEU 349 N 0.53 2.35 -3.62 0.60 4.77 -0.78 -4.98 117.00 115.87 1s6q n LEU 349 Ca 0.01 0.18 -0.15 0.00 -0.03 0.00 0.00 56.01 56.02 1s6q n LEU 349 Cb 0.42 -0.85 -0.07 0.00 -2.33 0.00 0.00 43.42 40.59 1s6q n LEU 349 CO 0.59 0.79 0.37 -0.54 -1.33 0.00 0.00 177.39 177.27 1s6q s LYS 350 N -2.56 0.84 -0.07 3.23 -0.14 -1.20 -5.04 119.74 114.80 1s6q s LYS 350 Ca -0.21 0.73 -0.03 0.00 -1.36 0.00 0.00 55.97 55.10 1s6q s LYS 350 Cb 0.07 0.40 0.04 0.00 -1.68 0.00 0.00 37.83 36.67 1s6q s LYS 350 CO 0.75 -0.15 0.13 0.95 -0.76 0.00 0.00 175.35 176.28 1s6q s THR 351 N -0.07 -0.13 0.00 2.17 -4.23 -1.26 -2.03 115.64 110.09 1s6q s THR 351 Ca -0.03 0.26 0.00 0.00 -1.18 0.00 0.00 61.69 60.74 1s6q s THR 351 Cb -0.04 -0.24 0.00 0.00 1.34 0.00 0.00 72.50 73.57 1s6q s THR 351 CO 0.03 0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.83 1s6q n GLY 352 N 4.66 4.85 3.51 3.99 0.00 -1.11 -3.96 105.19 117.14 1s6q n GLY 352 Ca -0.18 -1.80 -0.15 0.00 0.00 0.00 0.00 46.02 43.89 1s6q n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s6q s LYS 353 N 2.32 1.01 0.25 1.61 -2.85 -1.26 -3.19 119.74 117.63 1s6q s LYS 353 Ca 0.00 0.08 0.04 0.00 -1.00 0.00 0.00 55.97 55.09 1s6q s LYS 353 Cb 0.00 0.47 -0.05 0.00 -2.06 0.00 0.00 37.83 36.19 1s6q s LYS 353 CO 0.00 -0.35 -0.01 -0.47 0.10 0.00 0.00 175.35 174.62 1s6q s TYR 354 N -1.75 1.68 -0.28 1.78 6.14 0.28 -4.96 117.35 120.24 1s6q s TYR 354 Ca -0.06 -0.87 -0.25 0.00 0.64 0.00 0.00 57.07 56.53 1s6q s TYR 354 Cb -0.00 -0.98 0.14 0.00 0.42 0.00 0.00 41.96 41.54 1s6q s TYR 354 CO 0.03 0.05 1.15 0.00 0.64 0.00 0.00 175.55 177.42 1s6q s ALA 355 N -3.31 -2.05 0.40 3.97 0.00 -1.25 -1.24 121.76 118.28 1s6q s ALA 355 Ca 0.29 1.81 0.08 0.00 0.00 0.00 0.00 51.96 54.14 1s6q s ALA 355 Cb 0.05 -1.52 -0.06 0.00 0.00 0.00 0.00 23.12 21.60 1s6q s ALA 355 CO 0.10 -0.20 0.11 0.50 0.00 0.00 0.00 175.76 176.27 1s6q s ARG 356 N 0.12 2.14 0.01 0.00 6.06 -0.37 -5.01 118.95 121.90 1s6q s ARG 356 Ca 0.04 -1.88 -0.00 0.00 -2.50 0.00 0.00 55.73 51.39 1s6q s ARG 356 Cb -0.05 -1.90 0.00 0.00 0.06 0.00 0.00 34.95 33.07 1s6q s ARG 356 CO -0.09 -0.05 0.00 -1.33 -2.50 0.00 0.00 175.30 171.34 1s6q n MET 357 N -1.12 -1.95 -3.04 5.12 2.81 -1.26 -4.73 117.12 112.94 1s6q n MET 357 Ca -0.03 -0.01 -0.40 0.00 -1.81 0.00 0.00 57.70 55.46 1s6q n MET 357 Cb 0.65 -0.01 -0.05 0.00 -0.71 0.00 0.00 33.22 33.10 1s6q n MET 357 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1s6q s ARG 358 N -3.01 4.42 0.00 0.03 3.52 -1.26 -4.77 118.95 117.88 1s6q s ARG 358 Ca 0.00 0.88 0.00 0.00 -0.13 0.00 0.00 55.73 56.48 1s6q s ARG 358 Cb -0.00 -3.46 0.00 0.00 -1.56 0.00 0.00 34.95 29.93 1s6q s ARG 358 CO 0.00 0.03 0.00 0.41 -0.81 0.00 0.00 175.30 174.94 1s6q n GLY 359 N 3.15 0.33 0.00 8.12 0.00 -1.26 -4.10 105.19 111.43 1s6q n GLY 359 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1s6q n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s6q n ALA 360 N 1.43 0.00 0.00 4.61 0.00 -1.26 -0.39 120.51 124.90 1s6q n ALA 360 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1s6q n ALA 360 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1s6q n ALA 360 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1s6q n HIS 361 N 0.00 0.00 -4.12 0.00 1.44 -1.26 -5.11 115.22 106.17 1s6q n HIS 361 Ca 0.00 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.56 1s6q n HIS 361 Cb 0.00 0.00 -0.14 0.00 0.12 0.00 0.00 29.99 29.97 1s6q n HIS 361 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 1s6q s THR 362 N -0.53 0.37 0.51 0.61 2.01 0.48 -5.15 115.64 113.93 1s6q s THR 362 Ca 0.00 -0.22 0.09 0.00 0.31 0.00 0.00 61.69 61.87 1s6q s THR 362 Cb 0.00 -0.31 0.05 0.00 0.01 0.00 0.00 72.50 72.25 1s6q s THR 362 CO 0.00 0.09 0.65 0.54 -0.69 0.00 0.00 174.62 175.21 1s6q s ASN 363 N -0.14 5.21 0.00 3.53 4.22 -1.26 -4.77 114.94 121.72 1s6q s ASN 363 Ca 0.01 -0.75 0.00 0.00 -2.14 0.00 0.00 52.86 49.98 1s6q s ASN 363 Cb -0.02 -0.04 0.00 0.00 1.28 0.00 0.00 41.25 42.47 1s6q s ASN 363 CO -0.00 -1.09 0.64 0.47 -2.04 0.00 0.00 177.10 175.08 1s6q n ASP 364 N -2.02 0.00 -0.05 3.54 8.00 -1.26 -2.99 116.55 121.77 1s6q n ASP 364 Ca 0.11 0.66 -0.01 0.00 0.71 0.00 0.00 54.79 56.26 1s6q n ASP 364 Cb 0.61 -0.20 -0.00 0.00 -0.02 0.00 0.00 41.12 41.51 1s6q n ASP 364 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1s6q n VAL 365 N -1.11 -0.08 -0.34 2.53 0.31 -1.26 0.43 118.33 118.82 1s6q n VAL 365 Ca 0.00 0.31 0.05 0.00 -0.01 0.00 0.00 64.34 64.69 1s6q n VAL 365 Cb 0.00 -0.41 0.23 0.00 -0.91 0.00 0.00 33.84 32.76 1s6q n VAL 365 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1s6q h LYS 366 N 0.00 1.01 0.99 5.55 3.64 -1.97 -1.37 116.57 124.41 1s6q h LYS 366 Ca 0.04 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.31 1s6q h LYS 366 Cb 0.07 -0.23 0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1s6q h LYS 366 CO -0.13 0.67 -0.47 1.96 -2.27 0.00 0.00 179.45 179.20 1s6q h GLN 367 N 1.04 -1.28 -0.76 1.90 4.20 0.89 -1.00 115.11 120.10 1s6q h GLN 367 Ca 0.44 0.09 0.17 0.00 0.06 0.00 0.00 58.65 59.40 1s6q h GLN 367 Cb 0.31 0.29 -0.14 0.00 0.30 0.00 0.00 27.48 28.24 1s6q h GLN 367 CO -0.19 -0.85 -0.08 1.25 -0.67 0.00 0.00 178.83 178.29 1s6q h LEU 368 N -1.35 -0.51 -0.30 1.46 5.85 -1.03 1.44 115.31 120.87 1s6q h LEU 368 Ca -0.14 0.21 0.06 0.00 0.84 0.00 0.00 57.88 58.86 1s6q h LEU 368 Cb 1.01 0.40 -0.06 0.00 0.37 0.00 0.00 40.66 42.39 1s6q h LEU 368 CO 0.22 -0.22 -0.07 0.74 -0.34 0.00 0.00 178.44 178.78 1s6q h THR 369 N 0.05 0.71 0.43 1.05 2.02 -1.14 0.33 112.91 116.36 1s6q h THR 369 Ca 0.40 -0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.55 1s6q h THR 369 Cb 0.67 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1s6q h THR 369 CO -0.72 0.00 -0.21 -0.33 0.37 0.00 0.00 175.52 174.63 1s6q h GLU 370 N 0.01 -0.56 -0.78 6.66 5.08 0.17 -0.82 114.58 124.34 1s6q h GLU 370 Ca 0.14 0.04 0.18 0.00 -1.00 0.00 0.00 59.36 58.72 1s6q h GLU 370 Cb 0.22 0.13 -0.13 0.00 0.50 0.00 0.00 28.75 29.46 1s6q h GLU 370 CO -0.30 -0.27 0.06 0.00 -1.00 0.00 0.00 179.01 177.51 1s6q h ALA 371 N -0.37 0.90 -0.30 3.43 0.00 0.19 0.20 119.26 123.31 1s6q h ALA 371 Ca -0.06 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1s6q h ALA 371 Cb 0.55 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1s6q h ALA 371 CO 0.10 -0.42 0.00 0.28 0.00 0.00 0.00 179.25 179.20 1s6q n VAL 372 N -5.31 0.00 -0.35 0.00 0.31 0.11 -0.67 118.33 112.42 1s6q n VAL 372 Ca 0.15 1.45 0.29 0.00 -0.01 0.00 0.00 64.34 66.22 1s6q n VAL 372 Cb 0.51 -2.34 0.59 0.00 -0.91 0.00 0.00 33.84 31.69 1s6q n VAL 372 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1s6q h GLN 373 N 0.00 0.24 0.10 5.55 4.20 -0.67 0.16 115.11 124.69 1s6q h GLN 373 Ca 0.00 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 1s6q h GLN 373 Cb 0.00 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.73 1s6q h GLN 373 CO 0.00 0.16 -0.05 -0.22 -0.67 0.00 0.00 178.83 178.05 1s6q h LYS 374 N 0.25 -0.13 -0.92 1.46 1.63 -0.18 -2.62 116.57 116.06 1s6q h LYS 374 Ca 0.64 0.01 0.13 0.00 -0.85 0.00 0.00 60.65 60.58 1s6q h LYS 374 Cb 1.91 0.03 -0.14 0.00 -0.60 0.00 0.00 32.23 33.43 1s6q h LYS 374 CO -0.27 -0.09 -0.43 0.82 -3.45 0.00 0.00 179.45 176.04 1s6q h ILE 375 N -0.14 0.02 -0.30 2.00 2.04 0.24 0.12 117.51 121.48 1s6q h ILE 375 Ca -0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 1s6q h ILE 375 Cb 0.10 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 36.16 1s6q h ILE 375 CO 0.02 0.00 -0.23 0.74 0.00 0.00 0.00 178.15 178.68 1s6q h THR 376 N -0.04 0.00 -0.81 -0.27 2.02 -0.73 -0.33 112.91 112.75 1s6q h THR 376 Ca 0.28 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.65 1s6q h THR 376 Cb 0.55 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.85 1s6q h THR 376 CO -0.92 0.00 0.26 0.74 0.37 0.00 0.00 175.52 175.97 1s6q h THR 377 N -0.07 0.49 -0.31 3.16 2.02 -0.61 0.41 112.91 117.99 1s6q h THR 377 Ca 0.05 -0.11 0.05 0.00 0.77 0.00 0.00 66.41 67.17 1s6q h THR 377 Cb 0.20 0.14 -0.08 0.00 -1.74 0.00 0.00 68.15 66.67 1s6q h THR 377 CO -0.32 0.06 -0.47 -0.33 0.37 0.00 0.00 175.52 174.82 1s6q h GLU 378 N 0.32 -0.40 -0.58 6.66 5.08 -0.27 0.16 114.58 125.54 1s6q h GLU 378 Ca 0.48 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.98 1s6q h GLU 378 Cb 0.86 0.09 -0.10 0.00 0.50 0.00 0.00 28.75 30.10 1s6q h GLU 378 CO -0.53 -0.27 -0.01 1.03 -1.00 0.00 0.00 179.01 178.24 1s6q h SER 379 N -0.42 -0.27 -0.60 1.42 0.87 0.80 0.32 113.55 115.69 1s6q h SER 379 Ca 0.10 0.14 0.06 0.00 -1.23 0.00 0.00 61.79 60.86 1s6q h SER 379 Cb 0.61 0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 62.78 1s6q h SER 379 CO -0.52 -0.10 0.31 0.40 -0.53 0.00 0.00 176.83 176.38 1s6q h ILE 380 N 0.11 0.94 0.00 2.23 2.04 0.56 0.22 117.51 123.62 1s6q h ILE 380 Ca 0.30 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.91 1s6q h ILE 380 Cb 0.47 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1s6q h ILE 380 CO -0.50 0.11 -0.21 0.58 0.00 0.00 0.00 178.15 178.13 1s6q h VAL 381 N 0.58 0.84 0.01 1.67 2.07 0.12 0.29 116.25 121.83 1s6q h VAL 381 Ca 0.27 -0.83 -0.37 0.00 0.82 0.00 0.00 66.70 66.59 1s6q h VAL 381 Cb 0.18 1.49 -0.07 0.00 -1.52 0.00 0.00 31.29 31.38 1s6q h VAL 381 CO -0.18 0.21 -2.33 -0.38 0.02 0.00 0.00 177.57 174.91 1s6q n ILE 382 N -3.82 1.46 -0.35 4.57 5.41 -0.32 -4.00 119.36 122.30 1s6q n ILE 382 Ca -0.02 -0.76 0.00 0.00 1.00 0.00 0.00 62.75 62.97 1s6q n ILE 382 Cb 0.31 -0.84 0.00 0.00 -0.71 0.00 0.00 39.64 38.40 1s6q n ILE 382 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1s6q n TRP 383 N -2.95 0.00 -1.63 1.39 8.01 0.71 -4.99 117.44 117.98 1s6q n TRP 383 Ca -0.35 0.00 -0.15 0.00 -1.31 0.00 0.00 57.50 55.69 1s6q n TRP 383 Cb 1.10 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 30.34 1s6q n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1s6q n GLY 384 N 0.05 1.15 3.63 6.99 0.00 0.10 -4.96 105.19 112.16 1s6q n GLY 384 Ca 0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 1s6q n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s6q s LYS 385 N -3.63 0.80 0.34 1.61 -2.85 -1.26 -4.94 119.74 109.81 1s6q s LYS 385 Ca 0.00 1.05 -0.27 0.00 -1.00 0.00 0.00 55.97 55.75 1s6q s LYS 385 Cb 0.00 0.34 -0.09 0.00 -2.06 0.00 0.00 37.83 36.01 1s6q s LYS 385 CO 0.00 -0.11 1.06 0.95 0.10 0.00 0.00 175.35 177.35 1s6q s THR 386 N 0.70 3.66 0.40 3.79 -4.23 -1.26 -4.24 115.64 114.45 1s6q s THR 386 Ca -0.03 1.46 -0.04 0.00 -1.18 0.00 0.00 61.69 61.90 1s6q s THR 386 Cb -0.05 -3.84 0.09 0.00 1.34 0.00 0.00 72.50 70.03 1s6q s THR 386 CO -0.05 0.19 0.54 -0.81 -0.54 0.00 0.00 174.62 173.95 1s6q n PRO 387 N 0.56 -0.20 -4.10 3.99 -0.04 -1.26 -4.74 135.00 129.20 1s6q n PRO 387 Ca 0.02 -1.08 -0.33 0.00 -0.04 0.00 0.00 63.50 62.08 1s6q n PRO 387 Cb 0.47 -0.48 -0.16 0.00 -0.04 0.00 0.00 33.50 33.30 1s6q n PRO 387 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1s6q s LYS 388 N -4.01 2.77 0.01 0.54 2.20 0.92 -3.75 119.74 118.42 1s6q s LYS 388 Ca 0.33 -0.98 -0.24 0.00 -0.36 0.00 0.00 55.97 54.71 1s6q s LYS 388 Cb -0.01 -2.67 -0.05 0.00 -1.51 0.00 0.00 37.83 33.59 1s6q s LYS 388 CO 0.22 -0.32 0.74 -0.06 -0.36 0.00 0.00 175.35 175.57 1s6q s PHE 389 N 1.23 3.68 -0.88 4.03 0.40 -0.08 -1.95 117.98 124.42 1s6q s PHE 389 Ca 0.01 1.39 -0.14 0.00 -0.60 0.00 0.00 56.93 57.59 1s6q s PHE 389 Cb -0.15 -2.81 0.22 0.00 0.51 0.00 0.00 43.02 40.79 1s6q s PHE 389 CO -0.11 0.22 0.84 0.15 0.70 0.00 0.00 175.22 177.02 1s6q s LYS 390 N 0.23 3.69 0.05 0.44 1.02 -0.49 -1.16 119.74 123.51 1s6q s LYS 390 Ca 0.38 -2.52 -0.30 0.00 0.02 0.00 0.00 55.97 53.55 1s6q s LYS 390 Cb -0.19 -4.48 -0.05 0.00 -0.52 0.00 0.00 37.83 32.58 1s6q s LYS 390 CO 0.21 -1.32 1.17 -0.51 -0.92 0.00 0.00 175.35 173.98 1s6q s LEU 391 N 0.15 4.37 -1.22 3.17 1.43 -0.07 -3.52 118.68 123.00 1s6q s LEU 391 Ca 0.21 1.96 -0.07 0.00 -1.03 0.00 0.00 54.13 55.21 1s6q s LEU 391 Cb -0.10 -3.58 0.21 0.00 0.03 0.00 0.00 46.19 42.75 1s6q s LEU 391 CO -0.09 -0.44 1.87 -0.81 0.23 0.00 0.00 176.35 177.11 1s6q n PRO 392 N 3.91 4.16 -3.85 1.29 -0.04 -1.26 -0.55 135.00 138.67 1s6q n PRO 392 Ca 0.08 -3.87 -0.09 0.00 -0.04 0.00 0.00 63.50 59.58 1s6q n PRO 392 Cb 0.47 -2.73 -0.08 0.00 -0.04 0.00 0.00 33.50 31.12 1s6q n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1s6q s ILE 393 N -1.08 0.13 0.14 0.52 2.07 -1.26 -4.98 121.20 116.73 1s6q s ILE 393 Ca 0.40 -1.06 -0.31 0.00 -1.41 0.00 0.00 60.65 58.28 1s6q s ILE 393 Cb 0.11 -1.18 -0.08 0.00 0.13 0.00 0.00 42.46 41.44 1s6q s ILE 393 CO 0.00 -0.58 1.30 -1.58 -1.91 0.00 0.00 174.94 172.16 1s6q s GLN 394 N -3.38 4.39 0.00 3.50 0.74 -1.26 -4.67 119.66 118.98 1s6q s GLN 394 Ca 0.01 1.97 0.00 0.00 0.05 0.00 0.00 55.36 57.39 1s6q s GLN 394 Cb 0.03 -3.25 0.00 0.00 1.10 0.00 0.00 33.01 30.88 1s6q s GLN 394 CO -0.08 -0.29 0.99 1.17 -0.55 0.00 0.00 175.29 176.53 1s6q n LYS 395 N 3.37 0.00 -0.28 1.67 4.81 -1.26 -1.64 118.16 124.82 1s6q n LYS 395 Ca 0.08 0.94 0.09 0.00 -0.87 0.00 0.00 58.31 58.56 1s6q n LYS 395 Cb 0.44 -1.49 0.23 0.00 0.02 0.00 0.00 35.03 34.22 1s6q n LYS 395 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1s6q h GLU 396 N 0.00 0.14 0.24 1.64 3.07 -1.98 0.08 114.58 117.77 1s6q h GLU 396 Ca 0.00 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1s6q h GLU 396 Cb 0.00 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.86 1s6q h GLU 396 CO 0.00 0.09 -0.32 1.15 -1.40 0.00 0.00 179.01 178.54 1s6q h THR 397 N 0.15 0.00 -0.89 1.13 2.02 -1.80 0.03 112.91 113.55 1s6q h THR 397 Ca 0.49 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.90 1s6q h THR 397 Cb 0.94 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 67.20 1s6q h THR 397 CO -0.68 0.00 0.08 -0.25 0.37 0.00 0.00 175.52 175.04 1s6q h TRP 398 N -0.58 0.06 -0.61 3.16 2.91 -0.10 0.87 115.95 121.66 1s6q h TRP 398 Ca -0.03 0.06 0.02 0.00 1.13 0.00 0.00 58.89 60.07 1s6q h TRP 398 Cb 0.52 0.11 -0.03 0.00 -0.51 0.00 0.00 29.16 29.25 1s6q h TRP 398 CO -0.24 -0.32 0.41 0.93 -1.03 0.00 0.00 178.44 178.19 1s6q h GLU 399 N 0.09 0.77 -0.17 2.65 5.08 -0.53 0.48 114.58 122.94 1s6q h GLU 399 Ca 0.53 -0.05 -0.16 0.00 -1.00 0.00 0.00 59.36 58.69 1s6q h GLU 399 Cb 1.05 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1s6q h GLU 399 CO -0.77 0.51 -0.51 1.15 -1.00 0.00 0.00 179.01 178.39 1s6q h THR 400 N 0.79 1.32 0.00 1.13 2.02 0.27 -3.40 112.91 115.05 1s6q h THR 400 Ca 0.23 -1.75 0.00 0.00 0.77 0.00 0.00 66.41 65.66 1s6q h THR 400 Cb -0.03 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.33 1s6q h THR 400 CO -0.06 0.54 -1.22 0.79 0.37 0.00 0.00 175.52 175.95 1s6q n TRP 401 N -4.16 0.00 -0.08 3.16 7.02 -0.83 -4.66 117.44 117.89 1s6q n TRP 401 Ca -0.07 0.00 0.23 0.00 -1.02 0.00 0.00 57.50 56.65 1s6q n TRP 401 Cb 0.60 -0.19 0.45 0.00 -2.42 0.00 0.00 31.31 29.75 1s6q n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 1s6q h TRP 402 N 0.00 0.00 0.00 -5.99 5.08 -1.12 0.99 115.95 114.91 1s6q h TRP 402 Ca 0.00 0.00 -0.14 0.00 1.08 0.00 0.00 58.89 59.83 1s6q h TRP 402 Cb 0.47 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.61 1s6q h TRP 402 CO 0.00 0.00 -0.98 0.00 -1.28 0.00 0.00 178.44 176.18 1s6q h THR 403 N 0.00 0.76 -0.17 0.12 1.03 -1.83 -3.16 112.91 109.66 1s6q h THR 403 Ca 0.37 -2.21 0.05 0.00 -0.01 0.00 0.00 66.41 64.61 1s6q h THR 403 Cb 2.46 2.28 -0.01 0.00 -1.07 0.00 0.00 68.15 71.81 1s6q h THR 403 CO -0.00 0.43 0.15 -0.08 -0.01 0.00 0.00 175.52 176.01 1s6q h GLU 404 N 0.00 0.00 0.00 0.00 4.57 0.73 -2.61 114.58 117.27 1s6q h GLU 404 Ca -0.08 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1s6q h GLU 404 Cb 1.51 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.10 1s6q h GLU 404 CO 0.06 0.00 -0.17 0.66 -1.18 0.00 0.00 179.01 178.38 1s6q n TYR 405 N -4.13 0.00 -2.63 0.92 4.02 -1.26 -4.95 117.16 109.13 1s6q n TYR 405 Ca 0.01 -0.37 -0.43 0.00 -0.01 0.00 0.00 57.90 57.11 1s6q n TYR 405 Cb 0.28 -0.07 -0.02 0.00 -0.02 0.00 0.00 39.34 39.51 1s6q n TYR 405 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 1s6q s TRP 406 N -0.98 2.91 -0.65 -0.72 -0.11 -0.99 -4.85 118.94 113.56 1s6q s TRP 406 Ca 0.09 0.82 0.18 0.00 1.22 0.00 0.00 56.10 58.41 1s6q s TRP 406 Cb 0.08 -4.20 -0.22 0.00 -1.50 0.00 0.00 33.47 27.64 1s6q s TRP 406 CO 0.01 -1.12 0.67 1.04 -4.62 0.00 0.00 176.95 172.93 1s6q n GLN 407 N 7.53 0.97 -1.55 5.86 6.02 -1.26 -4.61 117.38 130.34 1s6q n GLN 407 Ca 0.11 -0.04 -0.32 0.00 -0.01 0.00 0.00 57.00 56.74 1s6q n GLN 407 Cb 0.48 -1.36 0.07 0.00 1.02 0.00 0.00 30.24 30.45 1s6q n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1s6q s ALA 408 N -2.83 2.36 -0.24 -1.58 0.00 -1.26 -4.73 121.76 113.49 1s6q s ALA 408 Ca 0.04 0.46 0.18 0.00 0.00 0.00 0.00 51.96 52.64 1s6q s ALA 408 Cb 0.13 -3.31 0.10 0.00 0.00 0.00 0.00 23.12 20.04 1s6q s ALA 408 CO 0.74 -1.50 1.36 1.79 0.00 0.00 0.00 175.76 178.15 1s6q h THR 409 N -0.43 0.49 -1.33 0.00 1.35 -2.01 -3.47 112.91 107.51 1s6q h THR 409 Ca -0.46 -1.73 -0.57 0.00 -0.55 0.00 0.00 66.41 63.11 1s6q h THR 409 Cb 1.24 2.15 -0.08 0.00 -1.73 0.00 0.00 68.15 69.74 1s6q h THR 409 CO 0.53 0.28 -0.46 -1.66 -0.25 0.00 0.00 175.52 173.96 1s6q s TRP 410 N -3.07 2.41 -0.02 4.73 1.48 -1.26 -4.70 118.94 118.51 1s6q s TRP 410 Ca 0.03 -0.64 0.01 0.00 -1.06 0.00 0.00 56.10 54.43 1s6q s TRP 410 Cb 0.07 -1.95 0.02 0.00 -1.16 0.00 0.00 33.47 30.45 1s6q s TRP 410 CO 0.74 0.05 -0.01 0.42 -4.06 0.00 0.00 176.95 174.09 1s6q s ILE 411 N -2.63 0.21 0.00 0.66 1.01 -1.26 -5.09 121.20 114.10 1s6q s ILE 411 Ca 0.38 0.03 0.00 0.00 0.00 0.00 0.00 60.65 61.06 1s6q s ILE 411 Cb 0.02 -0.28 0.00 0.00 0.01 0.00 0.00 42.46 42.21 1s6q s ILE 411 CO 0.21 0.13 0.00 -0.81 0.00 0.00 0.00 174.94 174.48 1s6q n PRO 412 N 3.89 0.82 -4.62 2.79 -0.04 -1.26 -4.94 135.00 131.63 1s6q n PRO 412 Ca -0.24 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.89 1s6q n PRO 412 Cb 0.52 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.86 1s6q n PRO 412 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1s6q s GLU 413 N -0.90 3.17 0.34 0.54 0.41 -1.25 -5.06 118.70 115.96 1s6q s GLU 413 Ca 0.00 -0.59 -0.03 0.00 -0.41 0.00 0.00 54.97 53.94 1s6q s GLU 413 Cb 0.00 -2.68 0.00 0.00 -1.78 0.00 0.00 34.13 29.67 1s6q s GLU 413 CO 0.00 0.42 0.48 1.67 -0.49 0.00 0.00 175.26 177.34 1s6q s TRP 414 N -0.15 0.99 0.27 1.61 -2.14 -1.26 -0.91 118.94 117.35 1s6q s TRP 414 Ca 0.01 -1.25 -0.18 0.00 2.66 0.00 0.00 56.10 57.34 1s6q s TRP 414 Cb -0.13 -0.04 0.07 0.00 -3.10 0.00 0.00 33.47 30.27 1s6q s TRP 414 CO 0.03 -1.14 0.92 -0.85 -2.66 0.00 0.00 176.95 173.24 1s6q n GLU 415 N -0.55 0.84 -4.47 3.25 0.28 -0.31 -4.91 120.64 114.77 1s6q n GLU 415 Ca 0.00 -1.77 -0.27 0.00 -0.16 0.00 0.00 57.16 54.97 1s6q n GLU 415 Cb 0.62 2.30 -0.17 0.00 1.43 0.00 0.00 31.44 35.62 1s6q n GLU 415 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1s6q s PHE 416 N -2.21 1.72 -0.36 -1.84 0.08 -1.26 -0.89 117.98 113.22 1s6q s PHE 416 Ca 0.20 -0.74 -0.00 0.00 0.12 0.00 0.00 56.93 56.50 1s6q s PHE 416 Cb -0.04 -1.26 0.09 0.00 -0.57 0.00 0.00 43.02 41.24 1s6q s PHE 416 CO 0.08 -0.40 0.10 0.14 -0.10 0.00 0.00 175.22 175.05 1s6q s VAL 417 N 0.92 2.85 -1.33 -0.44 -7.23 0.29 -4.91 120.40 110.55 1s6q s VAL 417 Ca -0.09 -2.02 -0.15 0.00 -1.81 0.00 0.00 61.98 57.91 1s6q s VAL 417 Cb -0.15 -2.93 0.10 0.00 0.56 0.00 0.00 36.38 33.96 1s6q s VAL 417 CO 0.00 -0.53 1.84 -0.46 -0.31 0.00 0.00 175.10 175.64 1s6q n ASN 418 N 4.48 4.72 0.01 4.85 0.23 -1.26 -4.56 115.26 123.73 1s6q n ASN 418 Ca -0.03 -2.94 0.00 0.00 -0.53 0.00 0.00 54.58 51.09 1s6q n ASN 418 Cb 0.42 -1.65 0.00 0.00 -2.08 0.00 0.00 39.78 36.47 1s6q n ASN 418 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1s6q n THR 419 N 5.19 0.00 -0.72 5.53 -2.24 -1.26 -5.12 114.28 115.67 1s6q n THR 419 Ca 0.46 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 62.08 1s6q n THR 419 Cb 0.42 -0.12 -0.09 0.00 -2.10 0.00 0.00 70.33 68.44 1s6q n THR 419 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1s6q n PRO 420 N -2.56 0.00 0.00 -0.78 -0.04 -1.26 -4.94 135.00 125.42 1s6q n PRO 420 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1s6q n PRO 420 Cb 0.00 -0.63 0.00 0.00 -0.04 0.00 0.00 33.50 32.83 1s6q n PRO 420 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1s6q n PRO 421 N 3.53 0.00 -0.12 0.54 -0.04 -1.26 -4.55 135.00 133.11 1s6q n PRO 421 Ca 0.32 0.13 -0.10 0.00 -0.04 0.00 0.00 63.50 63.81 1s6q n PRO 421 Cb 0.03 -0.52 -0.02 0.00 -0.04 0.00 0.00 33.50 32.95 1s6q n PRO 421 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1s6q h LEU 422 N 0.00 0.55 -0.70 1.53 5.85 -2.01 -3.24 115.31 117.29 1s6q h LEU 422 Ca 0.00 -0.23 0.17 0.00 0.84 0.00 0.00 57.88 58.66 1s6q h LEU 422 Cb 0.00 -0.14 -0.13 0.00 0.37 0.00 0.00 40.66 40.75 1s6q h LEU 422 CO 0.00 0.63 -0.07 0.52 -0.34 0.00 0.00 178.44 179.18 1s6q n VAL 423 N -4.60 -0.30 -0.19 1.05 0.31 -1.26 0.80 118.33 114.13 1s6q n VAL 423 Ca -0.01 1.58 -0.03 0.00 -0.01 0.00 0.00 64.34 65.87 1s6q n VAL 423 Cb 0.20 -2.25 0.07 0.00 -0.91 0.00 0.00 33.84 30.94 1s6q n VAL 423 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1s6q h LYS 424 N 0.00 0.57 0.32 5.55 3.64 -1.79 -1.16 116.57 123.69 1s6q h LYS 424 Ca 0.39 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.72 1s6q h LYS 424 Cb 0.71 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1s6q h LYS 424 CO -0.69 0.37 -0.15 -0.07 -2.27 0.00 0.00 179.45 176.64 1s6q h LEU 425 N 0.58 -0.36 -1.59 5.20 3.38 0.24 -3.23 115.31 119.52 1s6q h LEU 425 Ca 0.25 -0.18 0.20 0.00 0.09 0.00 0.00 57.88 58.25 1s6q h LEU 425 Cb 0.15 0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 1s6q h LEU 425 CO -0.16 0.04 0.59 -0.25 0.09 0.00 0.00 178.44 178.74 1s6q h TRP 426 N -0.84 0.45 -0.02 1.13 -0.00 -0.67 -3.52 115.95 112.48 1s6q h TRP 426 Ca -0.04 0.01 0.00 0.00 -0.00 0.00 0.00 58.89 58.86 1s6q h TRP 426 Cb 0.52 -0.14 0.00 0.00 -0.00 0.00 0.00 29.16 29.54 1s6q h TRP 426 CO 0.03 0.12 0.00 0.66 -0.00 0.00 0.00 178.44 179.25