#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 0.46 0.26 4.25 2.07 -1.25 -3.09 121.20 123.89 1s6q s ILE 2 Ca 0.00 -0.45 0.08 0.00 -1.41 0.00 0.00 60.65 58.87 1s6q s ILE 2 Cb 0.00 -0.42 -0.04 0.00 0.13 0.00 0.00 42.46 42.13 1s6q s ILE 2 CO 0.00 -0.01 0.11 -0.94 -1.91 0.00 0.00 174.94 172.19 1s6q s SER 3 N -0.50 5.09 -0.05 4.50 1.04 -0.19 -4.45 113.70 119.13 1s6q s SER 3 Ca -0.01 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 55.99 1s6q s SER 3 Cb -0.04 -1.15 0.07 0.00 0.10 0.00 0.00 66.02 64.99 1s6q s SER 3 CO -0.00 -0.03 1.33 -0.81 0.98 0.00 0.00 173.24 174.71 1s6q n PRO 4 N -1.06 1.15 -2.45 4.02 -0.04 -1.26 -4.66 135.00 130.69 1s6q n PRO 4 Ca -0.07 -0.33 -0.39 0.00 -0.04 0.00 0.00 63.50 62.67 1s6q n PRO 4 Cb 0.58 -1.13 -0.04 0.00 -0.04 0.00 0.00 33.50 32.88 1s6q n PRO 4 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1s6q s ILE 5 N -0.40 3.47 0.43 0.52 1.01 -1.26 -5.00 121.20 119.97 1s6q s ILE 5 Ca 0.06 1.36 -0.23 0.00 0.00 0.00 0.00 60.65 61.84 1s6q s ILE 5 Cb 0.05 -3.82 -0.09 0.00 0.01 0.00 0.00 42.46 38.62 1s6q s ILE 5 CO 0.01 0.24 1.07 -0.70 0.00 0.00 0.00 174.94 175.55 1s6q s GLU 6 N -1.81 4.02 0.26 2.79 2.12 -1.26 -4.80 118.70 120.02 1s6q s GLU 6 Ca 0.49 1.53 -0.04 0.00 0.36 0.00 0.00 54.97 57.31 1s6q s GLU 6 Cb -0.30 -2.43 -0.05 0.00 0.26 0.00 0.00 34.13 31.61 1s6q s GLU 6 CO 0.38 -0.27 0.51 0.95 -0.54 0.00 0.00 175.26 176.29 1s6q s THR 7 N -1.70 5.07 -0.19 -1.70 -4.23 -1.26 -4.95 115.64 106.68 1s6q s THR 7 Ca 0.61 -0.01 -0.19 0.00 -1.18 0.00 0.00 61.69 60.91 1s6q s THR 7 Cb -0.22 -3.72 -0.03 0.00 1.34 0.00 0.00 72.50 69.87 1s6q s THR 7 CO 0.27 -0.26 0.54 -0.69 -0.54 0.00 0.00 174.62 173.95 1s6q s VAL 8 N -2.00 5.09 0.18 2.29 1.01 -1.26 -4.98 120.40 120.74 1s6q s VAL 8 Ca 0.43 1.02 -0.30 0.00 0.00 0.00 0.00 61.98 63.12 1s6q s VAL 8 Cb -0.11 -3.87 -0.08 0.00 0.00 0.00 0.00 36.38 32.32 1s6q s VAL 8 CO 0.29 0.18 1.26 -2.16 0.00 0.00 0.00 175.10 174.67 1s6q s PRO 9 N 1.56 4.43 0.53 2.72 0.04 -1.26 -4.24 135.00 138.77 1s6q s PRO 9 Ca 0.26 1.97 0.01 0.00 0.04 0.00 0.00 61.00 63.27 1s6q s PRO 9 Cb -0.16 -3.22 0.01 0.00 0.04 0.00 0.00 34.50 31.17 1s6q s PRO 9 CO 0.10 -0.19 0.07 0.28 0.04 0.00 0.00 177.00 177.30 1s6q n VAL 10 N 2.66 0.00 -3.74 -0.36 0.31 -1.26 -5.08 118.33 110.86 1s6q n VAL 10 Ca 0.06 -2.42 -0.08 0.00 -0.01 0.00 0.00 64.34 61.89 1s6q n VAL 10 Cb 0.44 0.41 -0.02 0.00 -0.91 0.00 0.00 33.84 33.75 1s6q n VAL 10 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1s6q s LYS 11 N -3.95 1.56 -0.08 5.55 1.02 -1.26 -4.94 119.74 117.64 1s6q s LYS 11 Ca 0.05 -0.81 -0.02 0.00 0.02 0.00 0.00 55.97 55.22 1s6q s LYS 11 Cb -0.00 0.57 -0.03 0.00 -0.52 0.00 0.00 37.83 37.84 1s6q s LYS 11 CO 0.03 -0.71 0.00 -0.51 -0.92 0.00 0.00 175.35 173.25 1s6q s LEU 12 N -2.87 3.59 0.20 3.17 1.43 -1.26 -0.70 118.68 122.23 1s6q s LEU 12 Ca 0.09 0.14 -0.18 0.00 -1.03 0.00 0.00 54.13 53.16 1s6q s LEU 12 Cb -0.04 -1.83 -0.12 0.00 0.03 0.00 0.00 46.19 44.24 1s6q s LEU 12 CO 0.02 0.38 0.24 0.29 0.23 0.00 0.00 176.35 177.51 1s6q n LYS 13 N 2.12 0.00 0.00 1.70 5.02 0.45 -4.71 118.16 122.75 1s6q n LYS 13 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 1s6q n LYS 13 Cb 0.54 -0.71 0.00 0.00 -0.02 0.00 0.00 35.03 34.84 1s6q n LYS 13 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1s6q n PRO 14 N 0.80 0.00 0.05 1.97 -0.02 -1.26 -1.98 135.00 134.57 1s6q n PRO 14 Ca 0.11 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.70 1s6q n PRO 14 Cb 0.22 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.63 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 -0.67 -1.27 3.43 -1.23 0.00 -1.26 -5.02 105.19 99.17 1s6q n GLY 15 Ca 0.00 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 1s6q n GLY 15 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1s6q n MET 16 N -2.51 -2.81 -4.04 1.61 2.81 -0.84 -5.11 117.12 106.23 1s6q n MET 16 Ca -0.02 -0.80 -0.10 0.00 -1.81 0.00 0.00 57.70 54.97 1s6q n MET 16 Cb 0.57 -2.12 -0.07 0.00 -0.71 0.00 0.00 33.22 30.89 1s6q n MET 16 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1s6q s ASP 17 N -2.40 0.03 0.52 7.83 2.15 -1.26 -4.89 116.67 118.65 1s6q s ASP 17 Ca 0.68 -1.03 -0.18 0.00 0.43 0.00 0.00 52.55 52.45 1s6q s ASP 17 Cb -0.25 0.47 -0.12 0.00 -0.30 0.00 0.00 42.92 42.73 1s6q s ASP 17 CO 0.65 -0.97 0.26 0.61 -0.17 0.00 0.00 175.17 175.56 1s6q n GLY 18 N -0.29 -2.20 3.69 2.66 0.00 -1.26 -4.92 105.19 102.88 1s6q n GLY 18 Ca -0.03 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1s6q n GLY 18 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1s6q s PRO 19 N -1.58 4.32 -0.52 1.61 0.02 -1.26 -4.95 135.00 132.64 1s6q s PRO 19 Ca 0.63 1.85 0.03 0.00 0.02 0.00 0.00 61.00 63.52 1s6q s PRO 19 Cb -0.49 -3.53 0.43 0.00 0.02 0.00 0.00 34.50 30.93 1s6q s PRO 19 CO 0.59 -0.49 1.56 1.63 -0.33 0.00 0.00 177.00 179.96 1s6q n LYS 20 N 5.10 3.17 -2.41 5.54 5.02 -1.26 -2.66 118.16 130.67 1s6q n LYS 20 Ca 0.12 -3.88 -0.28 0.00 -2.02 0.00 0.00 58.31 52.25 1s6q n LYS 20 Cb 0.45 -2.28 0.01 0.00 -0.02 0.00 0.00 35.03 33.20 1s6q n LYS 20 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1s6q s VAL 21 N -4.94 4.37 0.31 -0.18 -7.23 -1.12 -4.80 120.40 106.81 1s6q s VAL 21 Ca 0.55 0.23 0.00 0.00 -1.81 0.00 0.00 61.98 60.95 1s6q s VAL 21 Cb 0.44 -3.70 -0.01 0.00 0.56 0.00 0.00 36.38 33.67 1s6q s VAL 21 CO -0.10 -0.74 0.36 -0.54 -0.31 0.00 0.00 175.10 173.77 1s6q s LYS 22 N -4.92 1.73 0.00 4.82 3.01 -1.26 -3.26 119.74 119.86 1s6q s LYS 22 Ca 0.51 -1.78 0.00 0.00 -1.01 0.00 0.00 55.97 53.69 1s6q s LYS 22 Cb -0.10 0.38 0.00 0.00 -1.01 0.00 0.00 37.83 37.10 1s6q s LYS 22 CO 0.47 -0.67 0.00 0.94 0.51 0.00 0.00 175.35 176.59 1s6q n GLN 23 N -0.52 0.00 -1.68 1.68 7.27 -1.26 -4.80 117.38 118.06 1s6q n GLN 23 Ca 0.03 0.00 0.01 0.00 0.07 0.00 0.00 57.00 57.11 1s6q n GLN 23 Cb 0.62 0.00 0.06 0.00 2.41 0.00 0.00 30.24 33.34 1s6q n GLN 23 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1s6q n TRP 24 N 0.00 0.52 -1.11 3.69 7.02 -1.26 -4.86 117.44 121.44 1s6q n TRP 24 Ca 0.00 -1.20 -0.30 0.00 -1.02 0.00 0.00 57.50 54.98 1s6q n TRP 24 Cb 0.00 -0.20 0.24 0.00 -2.42 0.00 0.00 31.31 28.92 1s6q n TRP 24 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 1s6q s PRO 25 N -1.77 -1.10 -0.48 -0.99 0.04 -1.26 -4.98 135.00 124.46 1s6q s PRO 25 Ca 0.35 -0.05 0.06 0.00 0.04 0.00 0.00 61.00 61.40 1s6q s PRO 25 Cb 0.37 -1.61 0.19 0.00 0.04 0.00 0.00 34.50 33.49 1s6q s PRO 25 CO -0.10 -3.64 0.62 1.28 0.04 0.00 0.00 177.00 175.20 1s6q n LEU 26 N -4.71 -2.52 -4.56 -3.56 4.77 -1.26 -4.81 117.00 100.35 1s6q n LEU 26 Ca 0.13 -3.39 -0.34 0.00 -0.03 0.00 0.00 56.01 52.38 1s6q n LEU 26 Cb 0.59 0.70 -0.04 0.00 -2.33 0.00 0.00 43.42 42.34 1s6q n LEU 26 CO 0.46 1.92 1.40 -0.89 -1.33 0.00 0.00 177.39 178.95 1s6q s THR 27 N 0.59 3.61 0.10 -5.08 2.01 -1.26 -4.82 115.64 110.79 1s6q s THR 27 Ca 0.31 -0.38 0.02 0.00 0.31 0.00 0.00 61.69 61.95 1s6q s THR 27 Cb 0.03 -4.40 0.13 0.00 0.01 0.00 0.00 72.50 68.26 1s6q s THR 27 CO -0.10 -1.33 0.50 -1.84 -0.69 0.00 0.00 174.62 171.16 1s6q n GLU 28 N 8.94 -0.02 -0.07 4.92 0.28 -1.26 0.10 120.64 133.52 1s6q n GLU 28 Ca 0.33 0.48 -0.12 0.00 -0.16 0.00 0.00 57.16 57.69 1s6q n GLU 28 Cb 0.49 -0.77 -0.05 0.00 1.43 0.00 0.00 31.44 32.54 1s6q n GLU 28 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1s6q h GLU 29 N 0.00 0.41 0.81 3.44 4.57 -1.99 -3.02 114.58 118.81 1s6q h GLU 29 Ca 0.21 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 58.19 1s6q h GLU 29 Cb 0.45 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 1s6q h GLU 29 CO -0.29 0.66 -0.43 0.87 -1.18 0.00 0.00 179.01 178.64 1s6q h LYS 30 N 0.14 -1.10 -0.92 1.92 1.57 0.26 -1.37 116.57 117.07 1s6q h LYS 30 Ca 0.05 0.07 0.27 0.00 -1.87 0.00 0.00 60.65 59.17 1s6q h LYS 30 Cb 0.51 0.25 -0.04 0.00 0.08 0.00 0.00 32.23 33.03 1s6q h LYS 30 CO 0.02 -0.73 1.16 -0.89 -0.57 0.00 0.00 179.45 178.44 1s6q n ILE 31 N -5.17 0.00 -0.06 1.86 2.08 -0.84 0.20 119.36 117.43 1s6q n ILE 31 Ca -0.14 1.18 -0.13 0.00 0.56 0.00 0.00 62.75 64.22 1s6q n ILE 31 Cb 0.46 -2.14 -0.12 0.00 -0.75 0.00 0.00 39.64 37.09 1s6q n ILE 31 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 1s6q h LYS 32 N 0.00 -0.00 -0.16 0.38 3.64 -1.14 -2.03 116.57 117.27 1s6q h LYS 32 Ca 0.44 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.86 1s6q h LYS 32 Cb 2.74 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 34.50 1s6q h LYS 32 CO -0.00 0.92 -0.45 0.00 -2.27 0.00 0.00 179.45 177.65 1s6q h ALA 33 N 0.00 -0.65 -0.41 5.00 0.00 0.29 0.76 119.26 124.25 1s6q h ALA 33 Ca -0.00 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1s6q h ALA 33 Cb 0.93 0.85 -0.05 0.00 0.00 0.00 0.00 17.79 19.52 1s6q h ALA 33 CO 0.00 -0.96 0.12 -0.07 0.00 0.00 0.00 179.25 178.34 1s6q h LEU 34 N -0.50 0.09 -2.08 0.00 3.38 -1.36 0.92 115.31 115.76 1s6q h LEU 34 Ca 0.07 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1s6q h LEU 34 Cb 0.64 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 1s6q h LEU 34 CO -0.42 0.08 -0.01 0.58 0.09 0.00 0.00 178.44 178.76 1s6q h VAL 35 N 0.26 0.06 0.19 1.22 2.07 -0.68 1.19 116.25 120.55 1s6q h VAL 35 Ca 0.20 -0.33 -0.32 0.00 0.82 0.00 0.00 66.70 67.07 1s6q h VAL 35 Cb 0.21 1.31 0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1s6q h VAL 35 CO -0.23 0.01 -1.47 -0.33 0.02 0.00 0.00 177.57 175.57 1s6q h GLU 36 N 0.00 0.39 0.50 1.57 5.08 0.36 -3.13 114.58 119.35 1s6q h GLU 36 Ca -0.00 -0.67 -0.02 0.00 -1.00 0.00 0.00 59.36 57.67 1s6q h GLU 36 Cb 0.31 0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1s6q h GLU 36 CO 0.00 1.30 -0.24 0.82 -1.00 0.00 0.00 179.01 179.89 1s6q h ILE 37 N 0.11 0.00 -0.98 3.13 1.08 0.20 -3.17 117.51 117.87 1s6q h ILE 37 Ca -0.24 -0.51 0.33 0.00 -0.39 0.00 0.00 64.86 64.05 1s6q h ILE 37 Cb 2.08 0.00 -0.18 0.00 -3.07 0.00 0.00 36.82 35.65 1s6q h ILE 37 CO 0.22 0.00 0.28 0.00 -0.69 0.00 0.00 178.15 177.96 1s6q h THR 39 N 0.05 0.00 -0.21 0.00 1.35 -1.61 0.50 112.91 112.99 1s6q h THR 39 Ca 0.70 -0.10 0.06 0.00 -0.55 0.00 0.00 66.41 66.51 1s6q h THR 39 Cb 1.63 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 68.04 1s6q h THR 39 CO -0.81 0.00 0.48 -0.33 -0.25 0.00 0.00 175.52 174.61 1s6q h GLU 40 N -1.02 0.00 0.13 4.72 3.07 -1.22 0.38 114.58 120.63 1s6q h GLU 40 Ca -0.09 0.00 -0.23 0.00 -0.50 0.00 0.00 59.36 58.54 1s6q h GLU 40 Cb 0.70 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.62 1s6q h GLU 40 CO 0.15 0.00 -1.10 0.52 -1.40 0.00 0.00 179.01 177.18 1s6q h MET 41 N 0.00 0.28 -0.05 2.33 2.86 0.07 -2.87 114.93 117.55 1s6q h MET 41 Ca 0.10 -0.47 -0.16 0.00 -2.06 0.00 0.00 59.70 57.10 1s6q h MET 41 Cb 1.07 0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.89 1s6q h MET 41 CO -0.00 1.23 -0.70 1.49 1.06 0.00 0.00 176.91 179.99 1s6q h GLU 42 N -0.34 0.24 -0.27 1.72 4.81 0.17 -1.19 114.58 119.72 1s6q h GLU 42 Ca -0.22 -0.19 -0.05 0.00 -0.13 0.00 0.00 59.36 58.77 1s6q h GLU 42 Cb 1.70 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 31.11 1s6q h GLU 42 CO 0.11 0.84 -0.04 -0.22 -0.73 0.00 0.00 179.01 178.97 1s6q h LYS 43 N 0.16 0.43 -0.08 1.92 3.64 -0.47 -0.04 116.57 122.13 1s6q h LYS 43 Ca -0.02 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1s6q h LYS 43 Cb 1.24 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1s6q h LYS 43 CO 0.11 0.49 0.00 0.39 -2.27 0.00 0.00 179.45 178.17 1s6q n GLU 44 N -4.28 1.53 -0.89 1.90 1.02 -1.08 -4.94 120.64 113.90 1s6q n GLU 44 Ca 0.01 -0.79 0.00 0.00 -0.02 0.00 0.00 57.16 56.36 1s6q n GLU 44 Cb 0.25 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 1s6q n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s6q n GLY 45 N 1.08 0.66 0.27 0.62 0.00 -0.03 -4.81 105.19 102.99 1s6q n GLY 45 Ca 0.17 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.37 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 1.93 0.00 -4.44 1.61 1.57 -1.46 -3.43 116.57 112.34 1s6q h LYS 46 Ca 0.00 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.50 1s6q h LYS 46 Cb 0.05 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.24 1s6q h LYS 46 CO 0.00 0.00 -0.43 0.96 -0.57 0.00 0.00 179.45 179.41 1s6q s ILE 47 N -3.67 0.00 -0.24 1.86 -4.36 -1.21 0.03 121.20 113.61 1s6q s ILE 47 Ca 0.01 -1.84 -0.15 0.00 -0.26 0.00 0.00 60.65 58.41 1s6q s ILE 47 Cb 0.09 -2.48 0.07 0.00 1.25 0.00 0.00 42.46 41.39 1s6q s ILE 47 CO 0.53 0.00 0.59 -0.44 0.24 0.00 0.00 174.94 175.86 1s6q s SER 48 N -3.21 -0.76 -0.18 4.36 0.01 0.58 -4.36 113.70 110.14 1s6q s SER 48 Ca 0.35 1.28 -0.35 0.00 1.31 0.00 0.00 55.95 58.55 1s6q s SER 48 Cb 0.03 1.18 -0.12 0.00 0.21 0.00 0.00 66.02 67.33 1s6q s SER 48 CO 0.17 -0.22 1.96 1.17 0.41 0.00 0.00 173.24 176.73 1s6q n LYS 49 N 4.00 1.81 -4.41 12.44 4.81 -1.26 -1.83 118.16 133.72 1s6q n LYS 49 Ca -0.20 0.63 -0.27 0.00 -0.87 0.00 0.00 58.31 57.60 1s6q n LYS 49 Cb 0.57 -2.59 -0.12 0.00 0.02 0.00 0.00 35.03 32.91 1s6q n LYS 49 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1s6q s ILE 50 N 5.06 2.28 0.14 3.15 2.07 0.67 -4.93 121.20 129.64 1s6q s ILE 50 Ca 0.98 -1.93 0.10 0.00 -1.41 0.00 0.00 60.65 58.38 1s6q s ILE 50 Cb -0.74 -2.06 -0.04 0.00 0.13 0.00 0.00 42.46 39.75 1s6q s ILE 50 CO 0.52 -0.06 -0.23 -0.83 -1.91 0.00 0.00 174.94 172.43 1s6q s GLY 51 N -2.46 1.48 -0.20 1.50 0.00 -1.26 -4.44 107.32 101.94 1s6q s GLY 51 Ca 0.18 -1.45 -0.11 0.00 0.00 0.00 0.00 44.72 43.34 1s6q s GLY 51 CO 0.08 -1.46 0.66 -1.05 0.00 0.00 0.00 173.10 171.33 1s6q n PRO 52 N 0.70 0.00 -2.72 2.90 -0.02 -1.26 -4.77 135.00 129.83 1s6q n PRO 52 Ca -0.16 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.23 1s6q n PRO 52 Cb 0.55 -0.42 0.09 0.00 -0.02 0.00 0.00 33.50 33.70 1s6q n PRO 52 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1s6q n GLU 53 N 2.21 0.93 -0.97 -0.52 4.07 -1.26 -4.96 120.64 120.13 1s6q n GLU 53 Ca 0.17 -1.79 0.00 0.00 -0.06 0.00 0.00 57.16 55.48 1s6q n GLU 53 Cb -0.00 -0.89 0.00 0.00 -0.06 0.00 0.00 31.44 30.49 1s6q n GLU 53 CO 0.00 0.00 0.00 0.27 -0.06 0.00 0.00 177.13 177.34 1s6q n ASN 54 N 0.33 -5.69 -4.30 4.31 6.94 -1.26 -4.95 115.26 110.62 1s6q n ASN 54 Ca 0.04 0.00 -0.42 0.00 -0.02 0.00 0.00 54.58 54.18 1s6q n ASN 54 Cb 0.71 -3.44 -0.00 0.00 -2.36 0.00 0.00 39.78 34.69 1s6q n ASN 54 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 1s6q n PRO 55 N 0.86 0.03 -3.76 -0.53 -0.02 -1.26 -4.90 135.00 125.41 1s6q n PRO 55 Ca 0.00 0.01 -0.37 0.00 -2.02 0.00 0.00 63.50 61.12 1s6q n PRO 55 Cb 0.47 -1.03 -0.12 0.00 -0.02 0.00 0.00 33.50 32.81 1s6q n PRO 55 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1s6q s TYR 56 N -1.69 3.33 1.13 6.00 1.51 -1.26 -5.01 117.35 121.35 1s6q s TYR 56 Ca 0.59 -1.69 -0.17 0.00 -1.01 0.00 0.00 57.07 54.79 1s6q s TYR 56 Cb -0.63 -2.53 0.25 0.00 -0.11 0.00 0.00 41.96 38.95 1s6q s TYR 56 CO 0.63 -0.81 1.13 1.21 -1.11 0.00 0.00 175.55 176.60 1s6q s ASN 57 N 1.58 1.58 0.08 2.29 2.47 -1.09 -4.20 114.94 117.66 1s6q s ASN 57 Ca 0.00 0.72 -0.20 0.00 0.42 0.00 0.00 52.86 53.80 1s6q s ASN 57 Cb -0.21 -1.05 0.05 0.00 -1.45 0.00 0.00 41.25 38.59 1s6q s ASN 57 CO 0.01 -3.72 0.48 -0.89 -3.72 0.00 0.00 177.10 169.25 1s6q s THR 58 N -3.10 0.04 0.31 -5.21 2.01 -1.02 -2.78 115.64 105.90 1s6q s THR 58 Ca 0.70 -0.34 -0.29 0.00 0.31 0.00 0.00 61.69 62.06 1s6q s THR 58 Cb -0.11 -1.02 -0.11 0.00 0.01 0.00 0.00 72.50 71.26 1s6q s THR 58 CO 0.56 -0.19 1.53 -2.84 -0.69 0.00 0.00 174.62 173.00 1s6q s PRO 59 N -2.96 4.14 0.33 4.92 0.02 -1.26 -4.25 135.00 135.93 1s6q s PRO 59 Ca -0.02 2.53 0.09 0.00 0.02 0.00 0.00 61.00 63.61 1s6q s PRO 59 Cb -0.00 -3.02 -0.05 0.00 0.02 0.00 0.00 34.50 31.45 1s6q s PRO 59 CO -0.06 -0.56 0.07 0.08 -0.33 0.00 0.00 177.00 176.20 1s6q s VAL 60 N -0.37 2.97 0.12 3.83 1.01 -1.26 -3.16 120.40 123.54 1s6q s VAL 60 Ca 0.59 -1.83 -0.25 0.00 0.00 0.00 0.00 61.98 60.50 1s6q s VAL 60 Cb -0.46 -2.89 0.08 0.00 0.00 0.00 0.00 36.38 33.10 1s6q s VAL 60 CO 0.52 -0.22 1.09 0.12 0.00 0.00 0.00 175.10 176.60 1s6q s PHE 61 N -2.44 -0.01 -0.04 5.22 5.36 -1.25 -4.97 117.98 119.85 1s6q s PHE 61 Ca 0.36 -0.28 -0.07 0.00 -0.96 0.00 0.00 56.93 55.98 1s6q s PHE 61 Cb -0.02 0.64 0.01 0.00 -0.34 0.00 0.00 43.02 43.31 1s6q s PHE 61 CO 0.21 -0.71 0.17 0.00 -1.46 0.00 0.00 175.22 173.43 1s6q s ALA 62 N -2.53 -0.42 0.17 11.12 0.00 -1.26 -2.79 121.76 126.06 1s6q s ALA 62 Ca 0.18 0.28 0.02 0.00 0.00 0.00 0.00 51.96 52.44 1s6q s ALA 62 Cb -0.01 -0.15 -0.05 0.00 0.00 0.00 0.00 23.12 22.92 1s6q s ALA 62 CO 0.02 -0.13 0.01 0.42 0.00 0.00 0.00 175.76 176.08 1s6q s ILE 63 N -0.45 0.62 0.00 0.00 1.01 -0.19 -4.94 121.20 117.25 1s6q s ILE 63 Ca -0.05 -1.97 -0.12 0.00 0.00 0.00 0.00 60.65 58.50 1s6q s ILE 63 Cb -0.04 -2.12 0.01 0.00 0.01 0.00 0.00 42.46 40.33 1s6q s ILE 63 CO 0.01 -0.47 0.25 -0.75 0.00 0.00 0.00 174.94 173.98 1s6q s LYS 64 N -3.93 0.64 0.53 2.79 2.20 -1.26 -1.23 119.74 119.48 1s6q s LYS 64 Ca 0.24 -0.34 0.08 0.00 -0.36 0.00 0.00 55.97 55.60 1s6q s LYS 64 Cb 0.06 0.28 0.08 0.00 -1.51 0.00 0.00 37.83 36.74 1s6q s LYS 64 CO 0.04 -0.18 0.68 0.36 -0.36 0.00 0.00 175.35 175.89 1s6q n LYS 65 N 1.16 0.65 -0.03 4.03 0.00 -1.26 -5.06 118.16 117.65 1s6q n LYS 65 Ca -0.21 -2.90 -0.18 0.00 -0.00 0.00 0.00 58.31 55.01 1s6q n LYS 65 Cb 0.57 -0.14 -0.14 0.00 -0.00 0.00 0.00 35.03 35.32 1s6q n LYS 65 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1s6q n LYS 66 N -2.09 0.72 -1.01 -1.58 4.81 -1.26 -3.72 118.16 114.03 1s6q n LYS 66 Ca 0.13 0.23 -0.21 0.00 -0.87 0.00 0.00 58.31 57.58 1s6q n LYS 66 Cb 0.55 -1.67 0.05 0.00 0.02 0.00 0.00 35.03 33.98 1s6q n LYS 66 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1s6q n ASP 67 N -3.33 6.78 -4.80 3.14 4.64 -1.26 -4.94 116.55 116.78 1s6q n ASP 67 Ca -0.33 -3.25 -0.31 0.00 -1.38 0.00 0.00 54.79 49.52 1s6q n ASP 67 Cb 1.04 -1.04 0.07 0.00 -1.04 0.00 0.00 41.12 40.16 1s6q n ASP 67 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 1s6q s SER 68 N -0.35 4.85 0.00 1.67 1.04 -1.24 -4.92 113.70 114.75 1s6q s SER 68 Ca 0.40 1.53 0.00 0.00 0.48 0.00 0.00 55.95 58.36 1s6q s SER 68 Cb 0.31 -2.33 0.00 0.00 0.10 0.00 0.00 66.02 64.10 1s6q s SER 68 CO -0.01 -1.77 0.00 0.35 0.98 0.00 0.00 173.24 172.79 1s6q n THR 69 N -3.33 0.00 -3.18 2.02 -2.24 -1.26 -5.06 114.28 101.23 1s6q n THR 69 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1s6q n THR 69 Cb 0.54 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1s6q n THR 69 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1s6q n LYS 70 N 0.00 0.17 -4.33 -0.78 5.02 -1.26 -5.19 118.16 111.78 1s6q n LYS 70 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.07 1s6q n LYS 70 Cb 0.08 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.01 1s6q n LYS 70 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1s6q n TRP 71 N 0.00 -0.50 -3.70 2.13 8.01 -1.26 -4.73 117.44 117.39 1s6q n TRP 71 Ca 0.00 -2.80 -0.11 0.00 -1.31 0.00 0.00 57.50 53.28 1s6q n TRP 71 Cb 0.00 0.20 -0.12 0.00 -2.01 0.00 0.00 31.31 29.38 1s6q n TRP 71 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 1s6q s ARG 72 N -3.45 0.30 -0.02 -0.99 0.52 -0.37 -4.95 118.95 109.99 1s6q s ARG 72 Ca 0.34 0.71 -0.26 0.00 -0.52 0.00 0.00 55.73 55.99 1s6q s ARG 72 Cb 0.02 -0.04 -0.04 0.00 0.52 0.00 0.00 34.95 35.41 1s6q s ARG 72 CO 0.24 -0.17 0.82 0.21 0.02 0.00 0.00 175.30 176.42 1s6q s LYS 73 N 1.48 4.50 -0.32 3.54 2.20 -1.26 -1.03 119.74 128.85 1s6q s LYS 73 Ca -0.08 1.13 -0.02 0.00 -0.36 0.00 0.00 55.97 56.64 1s6q s LYS 73 Cb -0.10 -3.44 0.11 0.00 -1.51 0.00 0.00 37.83 32.90 1s6q s LYS 73 CO -0.11 0.05 0.14 -1.17 -0.36 0.00 0.00 175.35 173.91 1s6q s LEU 74 N 0.74 1.33 0.82 5.43 2.96 -1.12 -4.97 118.68 123.88 1s6q s LEU 74 Ca 0.43 -1.68 -0.12 0.00 -0.22 0.00 0.00 54.13 52.54 1s6q s LEU 74 Cb -0.20 -0.58 0.08 0.00 0.50 0.00 0.00 46.19 46.00 1s6q s LEU 74 CO 0.23 -0.39 1.13 -0.69 -1.32 0.00 0.00 176.35 175.31 1s6q s VAL 75 N 1.61 2.56 -0.24 1.68 1.01 -1.26 -3.83 120.40 121.93 1s6q s VAL 75 Ca 0.12 0.18 -0.01 0.00 0.00 0.00 0.00 61.98 62.27 1s6q s VAL 75 Cb -0.18 -3.04 0.07 0.00 0.00 0.00 0.00 36.38 33.22 1s6q s VAL 75 CO -0.23 -0.24 0.01 -0.62 0.00 0.00 0.00 175.10 174.02 1s6q s ASP 76 N -4.20 3.60 -0.01 3.32 2.15 -1.19 -4.87 116.67 115.47 1s6q s ASP 76 Ca 0.61 -1.17 0.21 0.00 0.43 0.00 0.00 52.55 52.63 1s6q s ASP 76 Cb -0.13 -0.95 0.61 0.00 -0.30 0.00 0.00 42.92 42.16 1s6q s ASP 76 CO 0.52 -0.30 1.51 0.49 -0.17 0.00 0.00 175.17 177.23 1s6q n PHE 77 N 4.81 0.97 -0.28 -5.34 3.01 -1.26 -4.35 117.46 115.02 1s6q n PHE 77 Ca -0.09 -0.47 0.15 0.00 1.01 0.00 0.00 57.45 58.05 1s6q n PHE 77 Cb 0.45 -0.03 0.28 0.00 -0.01 0.00 0.00 39.48 40.17 1s6q n PHE 77 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1s6q n ARG 78 N 1.45 -0.06 -0.03 -1.08 1.74 -1.26 0.42 116.66 117.84 1s6q n ARG 78 Ca 0.23 1.22 0.10 0.00 -0.77 0.00 0.00 57.85 58.63 1s6q n ARG 78 Cb 0.61 -1.97 0.50 0.00 -1.02 0.00 0.00 32.46 30.57 1s6q n ARG 78 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1s6q n GLU 79 N -5.13 1.28 -0.14 5.56 4.07 -1.26 -2.77 120.64 122.26 1s6q n GLU 79 Ca 0.21 -0.43 -0.30 0.00 -0.06 0.00 0.00 57.16 56.59 1s6q n GLU 79 Cb 0.70 -1.34 -0.10 0.00 -0.06 0.00 0.00 31.44 30.64 1s6q n GLU 79 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 1s6q n LEU 80 N -0.36 1.97 -0.15 4.31 7.94 1.42 -4.37 117.00 127.76 1s6q n LEU 80 Ca 0.15 0.34 0.08 0.00 -1.11 0.00 0.00 56.01 55.46 1s6q n LEU 80 Cb 0.17 -0.82 0.40 0.00 0.53 0.00 0.00 43.42 43.69 1s6q n LEU 80 CO 0.12 0.58 1.20 0.78 -1.11 0.00 0.00 177.39 178.96 1s6q h ASN 81 N -0.99 0.58 0.00 1.96 2.35 -1.07 0.25 115.58 118.66 1s6q h ASN 81 Ca -0.70 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.06 1s6q h ASN 81 Cb 1.62 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.87 1s6q h ASN 81 CO -0.42 0.37 0.00 1.17 -1.65 0.00 0.00 177.43 176.90 1s6q n LYS 82 N -4.48 0.48 0.00 0.81 4.81 -1.11 -2.16 118.16 116.51 1s6q n LYS 82 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.54 1s6q n LYS 82 Cb 0.26 -1.17 0.00 0.00 0.02 0.00 0.00 35.03 34.14 1s6q n LYS 82 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1s6q n ARG 83 N 0.04 0.00 -3.37 1.64 1.74 0.87 -4.97 116.66 112.62 1s6q n ARG 83 Ca 0.00 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.73 1s6q n ARG 83 Cb 0.09 -0.08 -0.06 0.00 -1.02 0.00 0.00 32.46 31.39 1s6q n ARG 83 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1s6q s THR 84 N 0.00 4.87 1.03 0.55 -4.23 -0.92 0.17 115.64 117.12 1s6q s THR 84 Ca 0.00 0.80 -0.16 0.00 -1.18 0.00 0.00 61.69 61.14 1s6q s THR 84 Cb 0.00 -3.73 0.11 0.00 1.34 0.00 0.00 72.50 70.23 1s6q s THR 84 CO 0.00 0.23 0.03 0.00 -0.54 0.00 0.00 174.62 174.34 1s6q n GLN 85 N 0.77 -1.81 -3.45 3.99 10.64 0.12 -4.44 117.38 123.19 1s6q n GLN 85 Ca -0.05 -0.53 -0.26 0.00 -1.83 0.00 0.00 57.00 54.34 1s6q n GLN 85 Cb 0.52 -1.49 -0.02 0.00 -0.86 0.00 0.00 30.24 28.39 1s6q n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1s6q s ASP 86 N -1.82 6.35 0.30 2.61 1.01 -1.26 -4.89 116.67 118.96 1s6q s ASP 86 Ca 0.42 0.49 0.05 0.00 0.71 0.00 0.00 52.55 54.22 1s6q s ASP 86 Cb -0.06 -2.05 -0.06 0.00 1.01 0.00 0.00 42.92 41.76 1s6q s ASP 86 CO 0.46 -0.21 -0.01 -0.36 0.21 0.00 0.00 175.17 175.26 1s6q s PHE 87 N -2.16 1.95 -0.22 4.23 0.40 -1.26 -5.08 117.98 115.84 1s6q s PHE 87 Ca 0.40 -0.80 -0.29 0.00 -0.60 0.00 0.00 56.93 55.65 1s6q s PHE 87 Cb -0.10 -1.19 -0.04 0.00 0.51 0.00 0.00 43.02 42.21 1s6q s PHE 87 CO 0.33 0.17 1.82 -0.46 0.70 0.00 0.00 175.22 177.79 1s6q s TRP 88 N -3.12 1.75 1.02 0.36 -0.00 -1.26 -4.94 118.94 112.74 1s6q s TRP 88 Ca 0.32 0.45 -0.21 0.00 -0.00 0.00 0.00 56.10 56.66 1s6q s TRP 88 Cb 0.06 -4.04 -0.10 0.00 -0.00 0.00 0.00 33.47 29.39 1s6q s TRP 88 CO 0.13 -3.45 -0.83 -0.85 -0.00 0.00 0.00 176.95 171.94 1s6q n GLU 89 N 8.08 -0.35 -0.02 5.86 -0.00 -1.26 -4.87 120.64 128.08 1s6q n GLU 89 Ca 0.22 -0.09 -0.02 0.00 -0.00 0.00 0.00 57.16 57.27 1s6q n GLU 89 Cb 0.45 -1.23 -0.02 0.00 -0.00 0.00 0.00 31.44 30.63 1s6q n GLU 89 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 1s6q n VAL 90 N -3.42 0.24 -3.04 3.84 0.24 -1.26 -4.85 118.33 110.07 1s6q n VAL 90 Ca -0.01 -0.12 -0.35 0.00 -2.04 0.00 0.00 64.34 61.82 1s6q n VAL 90 Cb 0.65 -0.80 -0.02 0.00 -1.47 0.00 0.00 33.84 32.21 1s6q n VAL 90 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1s6q n GLN 91 N -2.35 3.90 -0.23 7.34 1.13 -1.26 -4.85 117.38 121.06 1s6q n GLN 91 Ca -0.06 -4.67 -0.06 0.00 -1.94 0.00 0.00 57.00 50.26 1s6q n GLN 91 Cb 0.60 -2.38 -0.01 0.00 0.11 0.00 0.00 30.24 28.56 1s6q n GLN 91 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1s6q h LEU 92 N 4.36 -1.34 -7.00 1.08 5.85 -2.01 -3.43 115.31 112.82 1s6q h LEU 92 Ca 0.26 0.25 -0.04 0.00 0.84 0.00 0.00 57.88 59.18 1s6q h LEU 92 Cb 0.54 0.65 -0.16 0.00 0.37 0.00 0.00 40.66 42.06 1s6q h LEU 92 CO 1.07 -0.31 0.20 -0.83 -0.34 0.00 0.00 178.44 178.22 1s6q s GLY 93 N -3.07 -0.60 0.18 3.75 0.00 -1.26 -5.16 107.32 101.15 1s6q s GLY 93 Ca -0.14 0.98 -0.24 0.00 0.00 0.00 0.00 44.72 45.32 1s6q s GLY 93 CO 0.68 0.64 0.76 -0.42 0.00 0.00 0.00 173.10 174.76 1s6q s ILE 94 N -2.23 4.42 0.54 0.90 1.01 -1.26 -5.03 121.20 119.55 1s6q s ILE 94 Ca -0.06 1.60 -0.20 0.00 0.00 0.00 0.00 60.65 61.98 1s6q s ILE 94 Cb -0.00 -4.06 -0.05 0.00 0.01 0.00 0.00 42.46 38.35 1s6q s ILE 94 CO 0.01 0.44 1.20 -2.16 0.00 0.00 0.00 174.94 174.43 1s6q s PRO 95 N -1.36 3.29 -0.20 2.79 0.04 -1.26 -5.00 135.00 133.30 1s6q s PRO 95 Ca 0.38 1.82 -0.07 0.00 0.04 0.00 0.00 61.00 63.16 1s6q s PRO 95 Cb -0.21 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 1s6q s PRO 95 CO 0.25 -0.95 0.06 -1.58 0.04 0.00 0.00 177.00 174.82 1s6q s HIS 96 N -1.58 3.20 0.58 0.56 2.46 -1.26 -4.98 115.29 114.27 1s6q s HIS 96 Ca 0.72 -0.05 0.28 0.00 0.47 0.00 0.00 55.06 56.49 1s6q s HIS 96 Cb -0.30 -2.12 1.59 0.00 -0.13 0.00 0.00 32.58 31.62 1s6q s HIS 96 CO 0.34 0.02 2.04 -1.00 -2.47 0.00 0.00 174.74 173.67 1s6q h PRO 97 N 7.09 0.00 0.00 2.88 0.13 -1.97 -1.14 132.00 139.00 1s6q h PRO 97 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1s6q h PRO 97 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1s6q h PRO 97 CO 0.66 0.00 0.04 0.00 -0.23 0.00 0.00 178.00 178.47 1s6q n ALA 98 N -2.36 0.95 -1.71 -0.56 0.00 -1.26 -0.71 120.51 114.87 1s6q n ALA 98 Ca 0.04 0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.60 1s6q n ALA 98 Cb 0.43 -1.03 0.14 0.00 0.00 0.00 0.00 19.45 18.99 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 -1.41 3.81 3.83 0.00 0.00 -0.43 -4.37 105.19 106.62 1s6q n GLY 99 Ca -0.00 -1.06 -0.37 0.00 0.00 0.00 0.00 46.02 44.59 1s6q n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s6q s LEU 100 N -2.20 4.36 0.22 0.99 1.43 0.12 -4.84 118.68 118.76 1s6q s LEU 100 Ca 0.32 0.53 -0.24 0.00 -1.03 0.00 0.00 54.13 53.71 1s6q s LEU 100 Cb 0.32 -2.20 -0.09 0.00 0.03 0.00 0.00 46.19 44.25 1s6q s LEU 100 CO -0.06 0.32 0.81 -0.54 0.23 0.00 0.00 176.35 177.11 1s6q s LYS 101 N -0.66 4.51 0.66 1.70 3.01 -1.26 -2.07 119.74 125.63 1s6q s LYS 101 Ca 0.16 1.14 -0.17 0.00 -1.01 0.00 0.00 55.97 56.08 1s6q s LYS 101 Cb -0.13 -3.07 -0.00 0.00 -1.01 0.00 0.00 37.83 33.62 1s6q s LYS 101 CO 0.05 0.46 1.25 0.21 0.51 0.00 0.00 175.35 177.83 1s6q s LYS 102 N -1.56 2.52 0.15 1.68 2.20 -1.26 -4.94 119.74 118.52 1s6q s LYS 102 Ca 0.41 1.94 -0.02 0.00 -0.36 0.00 0.00 55.97 57.93 1s6q s LYS 102 Cb -0.21 -1.86 -0.04 0.00 -1.51 0.00 0.00 37.83 34.22 1s6q s LYS 102 CO 0.25 -1.59 0.11 0.15 -0.36 0.00 0.00 175.35 173.90 1s6q s LYS 103 N -3.51 1.01 0.00 4.03 -0.14 -1.19 -5.05 119.74 114.90 1s6q s LYS 103 Ca 0.79 -1.43 0.00 0.00 -1.36 0.00 0.00 55.97 53.97 1s6q s LYS 103 Cb -0.34 0.27 0.00 0.00 -1.68 0.00 0.00 37.83 36.08 1s6q s LYS 103 CO 0.40 -0.31 0.00 1.63 -0.76 0.00 0.00 175.35 176.31 1s6q n LYS 104 N -0.14 0.00 -4.36 1.68 4.76 0.82 -4.55 118.16 116.36 1s6q n LYS 104 Ca -0.04 0.35 -0.27 0.00 -2.87 0.00 0.00 58.31 55.48 1s6q n LYS 104 Cb 0.64 -0.85 -0.13 0.00 -1.84 0.00 0.00 35.03 32.85 1s6q n LYS 104 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1s6q s SER 105 N -2.44 3.05 0.24 4.39 1.04 -1.12 -4.79 113.70 114.07 1s6q s SER 105 Ca 0.00 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 55.71 1s6q s SER 105 Cb 0.00 -0.19 -0.00 0.00 0.10 0.00 0.00 66.02 65.93 1s6q s SER 105 CO 0.00 0.14 0.00 0.52 0.98 0.00 0.00 173.24 174.88 1s6q n VAL 106 N 0.98 0.00 -3.65 5.02 0.31 -1.26 -1.73 118.33 118.01 1s6q n VAL 106 Ca -0.18 -1.13 -0.03 0.00 -0.01 0.00 0.00 64.34 62.99 1s6q n VAL 106 Cb 0.53 0.23 -0.06 0.00 -0.91 0.00 0.00 33.84 33.63 1s6q n VAL 106 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1s6q s THR 107 N -1.88 0.00 -0.02 2.52 2.01 -0.24 -4.94 115.64 113.09 1s6q s THR 107 Ca 0.00 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.06 1s6q s THR 107 Cb 0.00 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.50 1s6q s THR 107 CO 0.00 0.00 -0.20 0.68 -0.69 0.00 0.00 174.62 174.41 1s6q s VAL 108 N -0.23 1.58 -0.09 3.82 -7.23 -1.26 0.14 120.40 117.13 1s6q s VAL 108 Ca 0.08 -0.85 0.02 0.00 -1.81 0.00 0.00 61.98 59.42 1s6q s VAL 108 Cb -0.04 -1.32 -0.02 0.00 0.56 0.00 0.00 36.38 35.56 1s6q s VAL 108 CO -0.14 0.45 -0.15 -0.76 -0.31 0.00 0.00 175.10 174.19 1s6q s LEU 109 N -0.37 2.65 -0.07 1.32 1.43 -0.70 -4.93 118.68 118.01 1s6q s LEU 109 Ca 0.05 -0.29 -0.30 0.00 -1.03 0.00 0.00 54.13 52.56 1s6q s LEU 109 Cb -0.09 -1.56 -0.03 0.00 0.03 0.00 0.00 46.19 44.54 1s6q s LEU 109 CO -0.00 0.25 1.13 -0.62 0.23 0.00 0.00 176.35 177.34 1s6q s ASP 110 N -0.15 7.12 -0.07 2.29 2.15 -1.26 -2.82 116.67 123.94 1s6q s ASP 110 Ca -0.01 1.73 0.10 0.00 0.43 0.00 0.00 52.55 54.80 1s6q s ASP 110 Cb -0.14 -2.56 0.16 0.00 -0.30 0.00 0.00 42.92 40.08 1s6q s ASP 110 CO 0.03 -0.53 1.08 1.33 -0.17 0.00 0.00 175.17 176.92 1s6q n VAL 111 N 4.55 1.03 0.18 1.11 0.24 -0.76 -4.50 118.33 120.18 1s6q n VAL 111 Ca 0.10 -1.23 -0.14 0.00 -2.04 0.00 0.00 64.34 61.03 1s6q n VAL 111 Cb 0.47 0.10 -0.07 0.00 -1.47 0.00 0.00 33.84 32.87 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 0.00 -0.67 -0.96 7.63 0.00 -1.89 -2.07 103.07 105.11 1s6q h GLY 112 Ca 0.00 0.35 0.41 0.00 0.00 0.00 0.00 47.33 48.10 1s6q h GLY 112 CO 0.00 -0.26 0.55 1.29 0.00 0.00 0.00 176.54 178.12 1s6q h ASP 113 N -0.61 0.34 -0.61 0.19 2.03 -1.90 -2.91 116.42 112.94 1s6q h ASP 113 Ca -0.00 0.25 0.09 0.00 -0.73 0.00 0.00 57.03 56.64 1s6q h ASP 113 Cb 0.58 0.26 -0.10 0.00 -0.83 0.00 0.00 39.33 39.24 1s6q h ASP 113 CO -0.09 -0.41 -0.24 0.00 -1.03 0.00 0.00 179.24 177.46 1s6q n ALA 114 N -2.27 -0.09 0.00 4.15 0.00 -0.78 -1.03 120.51 120.50 1s6q n ALA 114 Ca 0.37 0.61 0.00 0.00 0.00 0.00 0.00 53.44 54.42 1s6q n ALA 114 Cb 1.27 -0.27 0.00 0.00 0.00 0.00 0.00 19.45 20.45 1s6q n ALA 114 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1s6q n TYR 115 N -4.90 0.00 0.57 0.00 4.11 -1.10 0.15 117.16 115.99 1s6q n TYR 115 Ca 0.06 0.00 0.11 0.00 -0.00 0.00 0.00 57.90 58.07 1s6q n TYR 115 Cb 0.24 -0.28 0.27 0.00 -0.00 0.00 0.00 39.34 39.57 1s6q n TYR 115 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.86 178.05 1s6q n PHE 116 N -1.27 0.46 -0.03 -3.48 3.01 -0.20 -2.54 117.46 113.40 1s6q n PHE 116 Ca 0.00 -0.23 0.02 0.00 1.01 0.00 0.00 57.45 58.25 1s6q n PHE 116 Cb 0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 39.36 1s6q n PHE 116 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1s6q n SER 117 N 1.10 1.18 -4.71 4.37 7.64 0.41 -4.59 113.62 119.01 1s6q n SER 117 Ca 0.18 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.68 1s6q n SER 117 Cb 0.51 1.42 -0.06 0.00 -1.01 0.00 0.00 64.21 65.07 1s6q n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1s6q s VAL 118 N -2.86 5.13 0.56 0.44 1.01 -1.17 -1.03 120.40 122.49 1s6q s VAL 118 Ca -0.07 1.13 -0.21 0.00 0.00 0.00 0.00 61.98 62.83 1s6q s VAL 118 Cb 0.08 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 1s6q s VAL 118 CO 0.67 0.28 1.28 -2.65 0.00 0.00 0.00 175.10 174.68 1s6q n PRO 119 N 3.85 1.50 -4.29 2.72 -0.02 -1.26 -2.89 135.00 134.60 1s6q n PRO 119 Ca -0.05 0.56 -0.34 0.00 -2.02 0.00 0.00 63.50 61.65 1s6q n PRO 119 Cb 0.51 -2.48 -0.09 0.00 -0.02 0.00 0.00 33.50 31.42 1s6q n PRO 119 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1s6q s LEU 120 N -3.18 3.66 -0.32 2.45 2.96 -0.89 -4.75 118.68 118.62 1s6q s LEU 120 Ca 0.73 0.14 -0.37 0.00 -0.22 0.00 0.00 54.13 54.41 1s6q s LEU 120 Cb -0.42 -1.92 -0.13 0.00 0.50 0.00 0.00 46.19 44.21 1s6q s LEU 120 CO 0.48 0.35 2.03 -0.67 -1.32 0.00 0.00 176.35 177.22 1s6q n ASP 121 N 1.88 2.22 0.00 3.68 2.03 -1.26 -4.83 116.55 120.28 1s6q n ASP 121 Ca -0.17 0.68 0.00 0.00 0.52 0.00 0.00 54.79 55.82 1s6q n ASP 121 Cb 0.53 -1.21 0.00 0.00 -0.72 0.00 0.00 41.12 39.73 1s6q n ASP 121 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1s6q n GLU 122 N 7.18 0.00 0.00 -0.67 4.07 -1.26 0.47 120.64 130.43 1s6q n GLU 122 Ca 0.36 0.38 0.00 0.00 -0.06 0.00 0.00 57.16 57.85 1s6q n GLU 122 Cb 0.18 -0.58 0.00 0.00 -0.06 0.00 0.00 31.44 30.98 1s6q n GLU 122 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1s6q n ASP 123 N -2.28 0.00 -0.39 4.31 8.00 -1.26 -1.03 116.55 123.89 1s6q n ASP 123 Ca 0.00 0.18 0.04 0.00 0.71 0.00 0.00 54.79 55.72 1s6q n ASP 123 Cb 0.00 -0.18 0.10 0.00 -0.02 0.00 0.00 41.12 41.01 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 -1.11 0.29 0.03 1.24 7.35 0.18 -4.55 117.46 120.89 1s6q n PHE 124 Ca 0.00 -0.52 -0.20 0.00 -0.76 0.00 0.00 57.45 55.97 1s6q n PHE 124 Cb 0.10 -0.05 -0.11 0.00 0.35 0.00 0.00 39.48 39.78 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 1.21 0.63 0.00 -4.13 3.08 -1.07 -3.22 114.38 110.87 1s6q h ARG 125 Ca 0.00 -0.68 0.00 0.00 0.07 0.00 0.00 59.98 59.37 1s6q h ARG 125 Cb 0.67 0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1s6q h ARG 125 CO 0.01 1.27 0.27 0.36 -1.07 0.00 0.00 179.97 180.81 1s6q n LYS 126 N -3.95 0.00 -0.04 0.04 2.85 -1.26 0.85 118.16 116.64 1s6q n LYS 126 Ca -0.11 0.21 0.01 0.00 -1.05 0.00 0.00 58.31 57.37 1s6q n LYS 126 Cb 0.83 -1.77 -0.14 0.00 -0.65 0.00 0.00 35.03 33.29 1s6q n LYS 126 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1s6q n TYR 127 N -1.21 0.00 1.11 5.58 4.01 -1.22 -4.12 117.16 121.31 1s6q n TYR 127 Ca 0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 1s6q n TYR 127 Cb 0.27 -0.62 0.43 0.00 -0.31 0.00 0.00 39.34 39.12 1s6q n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1s6q n THR 128 N -2.37 0.00 -1.68 -0.72 -2.24 0.25 -4.77 114.28 102.75 1s6q n THR 128 Ca -0.15 0.00 -0.46 0.00 -2.27 0.00 0.00 64.05 61.17 1s6q n THR 128 Cb 0.76 -0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 68.31 1s6q n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s6q n ALA 129 N -0.91 1.50 -2.26 6.98 0.00 -1.24 -4.39 120.51 120.19 1s6q n ALA 129 Ca 0.11 0.37 -0.14 0.00 0.00 0.00 0.00 53.44 53.78 1s6q n ALA 129 Cb 0.05 -2.45 -0.10 0.00 0.00 0.00 0.00 19.45 16.95 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 2.12 1.30 -0.03 0.00 -0.12 -1.20 -2.43 117.98 117.62 1s6q s PHE 130 Ca 0.83 -1.12 -0.00 0.00 -0.05 0.00 0.00 56.93 56.59 1s6q s PHE 130 Cb -0.63 -0.74 0.03 0.00 -0.63 0.00 0.00 43.02 41.05 1s6q s PHE 130 CO 0.41 -0.31 0.03 0.99 -0.05 0.00 0.00 175.22 176.29 1s6q s THR 131 N -3.75 -0.00 -0.29 -4.49 2.01 -1.26 -3.06 115.64 104.80 1s6q s THR 131 Ca 0.30 0.24 -0.08 0.00 0.31 0.00 0.00 61.69 62.45 1s6q s THR 131 Cb 0.07 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.41 1s6q s THR 131 CO 0.08 0.13 0.11 -0.51 -0.69 0.00 0.00 174.62 173.74 1s6q s ILE 132 N 1.35 4.42 0.61 1.82 2.07 -0.76 -4.76 121.20 125.95 1s6q s ILE 132 Ca -0.05 -0.36 -0.19 0.00 -1.41 0.00 0.00 60.65 58.64 1s6q s ILE 132 Cb -0.13 -3.19 -0.03 0.00 0.13 0.00 0.00 42.46 39.24 1s6q s ILE 132 CO -0.03 0.17 1.23 -0.81 -1.91 0.00 0.00 174.94 173.59 1s6q n PRO 133 N 4.95 1.20 -0.00 3.50 -0.04 -1.26 -1.18 135.00 142.17 1s6q n PRO 133 Ca -0.15 0.46 -0.00 0.00 -0.04 0.00 0.00 63.50 63.77 1s6q n PRO 133 Cb 0.50 -2.45 -0.00 0.00 -0.04 0.00 0.00 33.50 31.51 1s6q n PRO 133 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1s6q h SER 134 N 0.74 0.00 0.00 3.54 0.02 -1.81 -3.44 113.55 112.59 1s6q h SER 134 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1s6q h SER 134 Cb 1.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.88 1s6q h SER 134 CO 0.53 0.00 0.00 -0.38 -1.14 0.00 0.00 176.83 175.85 1s6q n ILE 135 N -2.03 0.00 0.00 3.27 5.41 -1.26 -4.91 119.36 119.84 1s6q n ILE 135 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1s6q n ILE 135 Cb 0.00 -0.07 0.00 0.00 -0.71 0.00 0.00 39.64 38.86 1s6q n ILE 135 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1s6q n ASN 136 N -2.82 0.00 -2.64 4.38 4.05 -1.26 -4.92 115.26 112.05 1s6q n ASN 136 Ca 0.00 0.00 -0.05 0.00 0.45 0.00 0.00 54.58 54.98 1s6q n ASN 136 Cb 0.00 0.00 0.11 0.00 1.23 0.00 0.00 39.78 41.12 1s6q n ASN 136 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 1s6q n ASN 137 N 0.00 -1.63 -0.04 1.20 5.15 -1.26 -4.90 115.26 113.78 1s6q n ASN 137 Ca 0.00 -2.26 0.02 0.00 -0.60 0.00 0.00 54.58 51.74 1s6q n ASN 137 Cb 0.00 0.87 -0.13 0.00 -0.53 0.00 0.00 39.78 39.99 1s6q n ASN 137 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1s6q n GLU 138 N -0.89 0.89 -5.21 1.20 0.00 -1.26 -4.91 120.64 110.47 1s6q n GLU 138 Ca -0.10 -0.09 -0.32 0.00 0.00 0.00 0.00 57.16 56.65 1s6q n GLU 138 Cb 0.83 -1.41 -0.16 0.00 0.00 0.00 0.00 31.44 30.70 1s6q n GLU 138 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 1s6q s THR 139 N -2.85 2.21 0.62 6.31 -4.23 -1.26 -4.98 115.64 111.46 1s6q s THR 139 Ca -0.07 -1.02 0.33 0.00 -1.18 0.00 0.00 61.69 59.76 1s6q s THR 139 Cb 0.08 -1.81 0.37 0.00 1.34 0.00 0.00 72.50 72.49 1s6q s THR 139 CO 0.68 0.57 2.16 -0.65 -0.54 0.00 0.00 174.62 176.84 1s6q h PRO 140 N 5.97 0.00 0.00 3.99 0.11 -1.95 -3.42 132.00 136.70 1s6q h PRO 140 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1s6q h PRO 140 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1s6q h PRO 140 CO 0.48 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.68 1s6q n GLY 141 N -1.28 0.92 3.79 -0.55 0.00 -1.26 -4.15 105.19 102.66 1s6q n GLY 141 Ca -0.01 -1.94 -0.36 0.00 0.00 0.00 0.00 46.02 43.71 1s6q n GLY 141 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1s6q s ILE 142 N -2.31 5.38 -0.21 -0.61 1.10 -0.32 -4.84 121.20 119.37 1s6q s ILE 142 Ca 0.00 0.36 -0.03 0.00 -0.51 0.00 0.00 60.65 60.47 1s6q s ILE 142 Cb 0.00 -3.51 0.00 0.00 0.15 0.00 0.00 42.46 39.10 1s6q s ILE 142 CO 0.00 0.50 -0.08 -0.60 -2.11 0.00 0.00 174.94 172.65 1s6q s ARG 143 N -0.24 3.26 0.51 3.50 3.52 -1.26 -1.82 118.95 126.42 1s6q s ARG 143 Ca 0.14 -0.69 0.03 0.00 -0.13 0.00 0.00 55.73 55.08 1s6q s ARG 143 Cb -0.12 -2.91 0.00 0.00 -1.56 0.00 0.00 34.95 30.36 1s6q s ARG 143 CO 0.03 -0.21 0.17 0.71 -0.81 0.00 0.00 175.30 175.19 1s6q s TYR 144 N 1.43 1.84 -0.10 5.12 2.02 -1.17 -0.24 117.35 126.25 1s6q s TYR 144 Ca 0.05 -0.88 -0.19 0.00 -0.37 0.00 0.00 57.07 55.69 1s6q s TYR 144 Cb -0.14 -1.76 0.04 0.00 -0.40 0.00 0.00 41.96 39.71 1s6q s TYR 144 CO -0.06 -0.04 0.46 -1.14 -1.57 0.00 0.00 175.55 173.21 1s6q s GLN 145 N -4.03 0.69 0.21 -0.62 0.74 -0.76 -3.23 119.66 112.65 1s6q s GLN 145 Ca 0.20 0.32 -0.28 0.00 0.05 0.00 0.00 55.36 55.64 1s6q s GLN 145 Cb 0.01 0.32 -0.08 0.00 1.10 0.00 0.00 33.01 34.35 1s6q s GLN 145 CO 0.12 -0.15 0.88 0.71 -0.55 0.00 0.00 175.29 176.30 1s6q s TYR 146 N -0.52 3.95 -0.22 1.67 2.02 -1.26 -0.30 117.35 122.69 1s6q s TYR 146 Ca -0.06 1.81 0.08 0.00 -0.37 0.00 0.00 57.07 58.53 1s6q s TYR 146 Cb -0.03 -2.91 -0.11 0.00 -0.40 0.00 0.00 41.96 38.51 1s6q s TYR 146 CO 0.04 0.46 0.27 0.09 -1.57 0.00 0.00 175.55 174.84 1s6q n ASN 147 N 1.61 1.57 0.00 2.29 3.02 0.10 -4.69 115.26 119.16 1s6q n ASN 147 Ca -0.03 -0.39 0.00 0.00 -0.03 0.00 0.00 54.58 54.13 1s6q n ASN 147 Cb 0.48 1.16 0.00 0.00 -0.61 0.00 0.00 39.78 40.81 1s6q n ASN 147 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1s6q n VAL 148 N -1.45 0.00 -3.79 2.41 0.24 -1.21 -2.09 118.33 112.44 1s6q n VAL 148 Ca 0.00 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.93 1s6q n VAL 148 Cb 0.16 0.00 -0.13 0.00 -1.47 0.00 0.00 33.84 32.41 1s6q n VAL 148 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1s6q s LEU 149 N 0.00 3.94 0.74 1.34 1.43 -1.05 -3.83 118.68 121.25 1s6q s LEU 149 Ca 0.00 -0.91 -0.17 0.00 -1.03 0.00 0.00 54.13 52.03 1s6q s LEU 149 Cb 0.00 -1.84 -0.09 0.00 0.03 0.00 0.00 46.19 44.28 1s6q s LEU 149 CO 0.00 -0.23 -0.01 -2.65 0.23 0.00 0.00 176.35 173.68 1s6q n PRO 150 N 4.81 0.10 0.18 1.29 -0.02 -1.26 -4.54 135.00 135.56 1s6q n PRO 150 Ca -0.14 0.05 0.06 0.00 -2.02 0.00 0.00 63.50 61.45 1s6q n PRO 150 Cb 0.46 -1.38 0.22 0.00 -0.02 0.00 0.00 33.50 32.79 1s6q n PRO 150 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1s6q h GLN 151 N -0.50 0.00 0.00 -0.52 4.15 -1.96 -3.34 115.11 112.94 1s6q h GLN 151 Ca -0.44 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.98 1s6q h GLN 151 Cb 1.36 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.05 1s6q h GLN 151 CO 0.37 0.36 -0.01 0.41 -1.93 0.00 0.00 178.83 178.04 1s6q n GLY 152 N 0.73 3.70 3.75 2.39 0.00 -1.26 -5.05 105.19 109.44 1s6q n GLY 152 Ca 0.01 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.78 2.34 0.01 1.61 -0.00 -1.26 -4.76 118.94 115.10 1s6q s TRP 153 Ca 0.14 1.61 -0.20 0.00 -0.00 0.00 0.00 56.10 57.65 1s6q s TRP 153 Cb 0.12 -3.16 -0.11 0.00 -0.00 0.00 0.00 33.47 30.32 1s6q s TRP 153 CO 0.01 -2.06 1.03 -0.22 -0.00 0.00 0.00 176.95 175.72 1s6q h LYS 154 N -1.02 -0.68 -1.20 5.86 3.64 -1.94 -3.25 116.57 117.97 1s6q h LYS 154 Ca -0.44 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1s6q h LYS 154 Cb 1.25 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 33.22 1s6q h LYS 154 CO 0.50 -0.45 0.00 0.41 -2.27 0.00 0.00 179.45 177.63 1s6q n GLY 155 N -0.60 1.45 0.12 5.01 0.00 -1.26 -3.99 105.19 105.91 1s6q n GLY 155 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1s6q n GLY 155 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1s6q n SER 156 N 0.57 1.94 -0.10 1.61 7.64 -1.23 -2.64 113.62 121.42 1s6q n SER 156 Ca 0.00 0.34 -0.05 0.00 1.01 0.00 0.00 58.87 60.17 1s6q n SER 156 Cb 0.35 -0.91 0.01 0.00 -1.01 0.00 0.00 64.21 62.65 1s6q n SER 156 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1s6q h PRO 157 N -0.70 0.05 0.00 1.43 0.11 -1.81 -0.45 132.00 130.62 1s6q h PRO 157 Ca -0.41 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1s6q h PRO 157 Cb 1.54 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.64 1s6q h PRO 157 CO -0.15 0.03 0.00 0.00 -0.21 0.00 0.00 178.00 177.67 1s6q n ALA 158 N -2.57 0.00 0.01 -0.75 0.00 -1.26 -0.96 120.51 114.99 1s6q n ALA 158 Ca 0.01 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.65 1s6q n ALA 158 Cb 0.19 0.15 0.47 0.00 0.00 0.00 0.00 19.45 20.26 1s6q n ALA 158 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1s6q h ILE 159 N 0.00 0.08 0.00 0.00 2.04 -1.49 -0.29 117.51 117.85 1s6q h ILE 159 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1s6q h ILE 159 Cb 0.00 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1s6q h ILE 159 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 178.15 178.48 1s6q n PHE 160 N -3.18 0.00 -0.40 1.37 7.35 -0.18 -2.40 117.46 120.03 1s6q n PHE 160 Ca 0.13 0.00 0.33 0.00 -0.76 0.00 0.00 57.45 57.15 1s6q n PHE 160 Cb 1.10 -0.32 0.55 0.00 0.35 0.00 0.00 39.48 41.17 1s6q n PHE 160 CO 0.00 0.00 0.00 0.94 -0.76 0.00 0.00 176.76 176.94 1s6q n GLN 161 N -1.46 -0.03 0.01 -4.13 0.00 -0.13 0.89 117.38 112.54 1s6q n GLN 161 Ca 0.00 0.99 -0.01 0.00 -0.00 0.00 0.00 57.00 57.98 1s6q n GLN 161 Cb 0.00 -1.97 -0.00 0.00 0.00 0.00 0.00 30.24 28.26 1s6q n GLN 161 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 1s6q h SER 162 N 0.00 -0.03 -0.98 1.69 0.87 -1.19 -2.62 113.55 111.29 1s6q h SER 162 Ca 0.71 0.00 0.24 0.00 -1.23 0.00 0.00 61.79 61.51 1s6q h SER 162 Cb 2.34 0.01 -0.18 0.00 -0.44 0.00 0.00 62.40 64.12 1s6q h SER 162 CO -0.34 -0.01 -0.08 -1.20 -0.53 0.00 0.00 176.83 174.67 1s6q n SER 163 N -2.14 -0.20 0.01 6.23 7.64 0.26 -0.45 113.62 124.97 1s6q n SER 163 Ca -0.00 1.67 -0.10 0.00 1.01 0.00 0.00 58.87 61.45 1s6q n SER 163 Cb 0.01 -0.57 -0.04 0.00 -1.01 0.00 0.00 64.21 62.60 1s6q n SER 163 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1s6q h MET 164 N 0.00 -0.12 -0.89 1.43 -1.53 -1.08 -2.09 114.93 110.64 1s6q h MET 164 Ca 0.55 0.01 0.17 0.00 -3.44 0.00 0.00 59.70 56.99 1s6q h MET 164 Cb 1.04 0.03 -0.07 0.00 -0.55 0.00 0.00 31.60 32.05 1s6q h MET 164 CO -0.95 -0.08 0.58 1.15 0.14 0.00 0.00 176.91 177.75 1s6q h THR 165 N -0.13 0.76 -0.19 -0.77 2.02 -0.36 -0.74 112.91 113.51 1s6q h THR 165 Ca 0.07 -0.19 -0.17 0.00 0.77 0.00 0.00 66.41 66.89 1s6q h THR 165 Cb 0.23 0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 66.78 1s6q h THR 165 CO -0.18 0.10 -0.57 0.11 0.37 0.00 0.00 175.52 175.36 1s6q h LYS 166 N 0.57 0.59 -0.32 6.66 1.57 -0.90 -3.07 116.57 121.67 1s6q h LYS 166 Ca 0.46 -0.38 -0.14 0.00 -1.87 0.00 0.00 60.65 58.72 1s6q h LYS 166 Cb 0.92 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 1s6q h LYS 166 CO -0.20 1.00 -0.37 0.82 -0.57 0.00 0.00 179.45 180.12 1s6q h ILE 167 N 0.45 1.28 -0.70 1.86 2.04 -0.79 -3.12 117.51 118.53 1s6q h ILE 167 Ca 0.00 -1.54 -0.05 0.00 1.00 0.00 0.00 64.86 64.27 1s6q h ILE 167 Cb 1.13 1.44 -0.03 0.00 -0.74 0.00 0.00 36.82 38.61 1s6q h ILE 167 CO 0.11 0.50 0.24 -0.07 0.00 0.00 0.00 178.15 178.93 1s6q h LEU 168 N 0.62 1.01 -0.41 1.44 3.38 -1.19 -3.35 115.31 116.81 1s6q h LEU 168 Ca 0.06 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.87 1s6q h LEU 168 Cb 0.92 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.35 1s6q h LEU 168 CO 0.08 0.94 -0.24 1.21 0.09 0.00 0.00 178.44 180.52 1s6q n GLU 169 N -4.32 -0.17 -0.19 1.13 2.13 -1.16 0.85 120.64 118.90 1s6q n GLU 169 Ca 0.05 0.62 -0.02 0.00 0.66 0.00 0.00 57.16 58.47 1s6q n GLU 169 Cb 0.21 -0.92 0.08 0.00 0.27 0.00 0.00 31.44 31.08 1s6q n GLU 169 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1s6q h PRO 170 N 0.00 0.49 -0.06 5.31 0.11 -1.78 -1.28 132.00 134.78 1s6q h PRO 170 Ca 0.07 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.15 1s6q h PRO 170 Cb 0.18 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.17 1s6q h PRO 170 CO -0.39 0.32 0.04 0.35 -0.21 0.00 0.00 178.00 178.11 1s6q h PHE 171 N 0.50 0.08 -0.77 0.65 3.57 0.23 -1.43 116.94 119.78 1s6q h PHE 171 Ca 0.26 0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.92 1s6q h PHE 171 Cb 0.22 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 38.88 1s6q h PHE 171 CO -0.12 0.09 0.51 0.87 -2.23 0.00 0.00 178.31 177.43 1s6q h LYS 172 N 0.06 0.39 0.14 1.11 1.57 -0.14 -2.39 116.57 117.31 1s6q h LYS 172 Ca 0.02 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1s6q h LYS 172 Cb 0.03 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1s6q h LYS 172 CO -0.00 0.26 -0.07 0.87 -0.57 0.00 0.00 179.45 179.93 1s6q h LYS 173 N 0.40 -0.19 -0.01 3.15 1.57 -0.77 -3.16 116.57 117.55 1s6q h LYS 173 Ca 0.38 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1s6q h LYS 173 Cb 0.90 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.25 1s6q h LYS 173 CO -0.12 0.07 0.00 1.04 -0.57 0.00 0.00 179.45 179.87 1s6q n GLN 174 N -4.89 0.03 -2.71 3.15 6.02 -0.58 -3.00 117.38 115.40 1s6q n GLN 174 Ca -0.05 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.88 1s6q n GLN 174 Cb 0.17 -1.01 0.08 0.00 1.02 0.00 0.00 30.24 30.50 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 -0.09 -2.12 0.25 1.08 3.02 -0.92 -5.01 115.26 111.48 1s6q n ASN 175 Ca 0.00 -2.82 0.12 0.00 -0.03 0.00 0.00 54.58 51.86 1s6q n ASN 175 Cb 0.00 1.49 0.77 0.00 -0.61 0.00 0.00 39.78 41.43 1s6q n ASN 175 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1s6q h PRO 176 N 3.25 0.00 0.27 3.52 0.13 -1.50 -3.02 132.00 134.65 1s6q h PRO 176 Ca -0.18 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.94 1s6q h PRO 176 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 1s6q h PRO 176 CO 0.10 0.00 -0.33 0.22 -0.23 0.00 0.00 178.00 177.77 1s6q h ASP 177 N 0.00 -0.92 -1.77 1.44 3.58 -1.92 -3.43 116.42 113.41 1s6q h ASP 177 Ca 0.03 0.08 -0.67 0.00 0.42 0.00 0.00 57.03 56.89 1s6q h ASP 177 Cb 0.13 0.31 0.05 0.00 1.72 0.00 0.00 39.33 41.53 1s6q h ASP 177 CO -0.00 -0.41 0.62 -0.38 -2.88 0.00 0.00 179.24 176.19 1s6q n ILE 178 N -4.35 0.09 -3.98 2.25 5.41 -1.14 -4.88 119.36 112.76 1s6q n ILE 178 Ca -0.07 -0.02 -0.35 0.00 1.00 0.00 0.00 62.75 63.31 1s6q n ILE 178 Cb 0.29 -1.07 -0.11 0.00 -0.71 0.00 0.00 39.64 38.04 1s6q n ILE 178 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 1s6q s VAL 179 N 1.30 4.47 -0.07 1.39 -7.23 -0.43 -4.96 120.40 114.88 1s6q s VAL 179 Ca 0.86 -0.14 0.04 0.00 -1.81 0.00 0.00 61.98 60.94 1s6q s VAL 179 Cb -0.92 -3.04 -0.02 0.00 0.56 0.00 0.00 36.38 32.97 1s6q s VAL 179 CO 0.49 0.42 -0.20 -0.63 -0.31 0.00 0.00 175.10 174.87 1s6q s ILE 180 N 0.85 2.51 -0.07 -0.62 1.01 -1.26 -1.12 121.20 122.49 1s6q s ILE 180 Ca 0.03 -0.90 -0.03 0.00 0.00 0.00 0.00 60.65 59.75 1s6q s ILE 180 Cb -0.14 -1.96 0.04 0.00 0.01 0.00 0.00 42.46 40.41 1s6q s ILE 180 CO 0.02 0.57 0.15 -0.47 0.00 0.00 0.00 174.94 175.21 1s6q s TYR 181 N -0.22 -0.17 -0.13 3.97 5.04 -0.68 -5.03 117.35 120.13 1s6q s TYR 181 Ca -0.01 0.54 -0.01 0.00 -2.44 0.00 0.00 57.07 55.15 1s6q s TYR 181 Cb -0.13 -0.14 -0.02 0.00 0.35 0.00 0.00 41.96 42.01 1s6q s TYR 181 CO 0.03 -0.21 -0.11 1.14 -1.34 0.00 0.00 175.55 175.07 1s6q s GLN 182 N 1.58 3.34 -0.13 4.97 -2.07 -1.26 -0.40 119.66 125.69 1s6q s GLN 182 Ca -0.05 -0.64 -0.02 0.00 -1.82 0.00 0.00 55.36 52.84 1s6q s GLN 182 Cb -0.12 -2.67 0.04 0.00 -1.09 0.00 0.00 33.01 29.17 1s6q s GLN 182 CO -0.06 0.28 -0.01 -0.47 -1.32 0.00 0.00 175.29 173.72 1s6q s TYR 183 N 0.19 1.09 0.00 9.60 5.04 0.20 -4.97 117.35 128.50 1s6q s TYR 183 Ca -0.06 -0.64 0.00 0.00 -2.44 0.00 0.00 57.07 53.93 1s6q s TYR 183 Cb -0.15 -1.03 0.00 0.00 0.35 0.00 0.00 41.96 41.14 1s6q s TYR 183 CO 0.04 -0.50 0.00 -1.33 -1.34 0.00 0.00 175.55 172.43 1s6q n MET 184 N 5.04 0.00 0.00 4.97 2.81 -1.26 0.07 117.12 128.75 1s6q n MET 184 Ca -0.09 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 55.91 1s6q n MET 184 Cb 0.49 0.00 0.05 0.00 -0.71 0.00 0.00 33.22 33.05 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 10.12 2.49 -4.92 7.83 8.00 -1.26 -4.93 116.55 133.88 1s6q n ASP 185 Ca 0.00 -1.75 -0.31 0.00 0.71 0.00 0.00 54.79 53.45 1s6q n ASP 185 Cb 0.00 0.24 -0.04 0.00 -0.02 0.00 0.00 41.12 41.30 1s6q n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1s6q s ASP 186 N -2.24 6.36 -0.39 -2.24 1.01 0.11 -1.82 116.67 117.46 1s6q s ASP 186 Ca 0.23 0.27 0.01 0.00 0.71 0.00 0.00 52.55 53.77 1s6q s ASP 186 Cb 0.19 -1.96 0.14 0.00 1.01 0.00 0.00 42.92 42.30 1s6q s ASP 186 CO 0.44 0.16 0.24 -0.22 0.21 0.00 0.00 175.17 176.00 1s6q s LEU 187 N -2.57 1.66 0.14 1.23 2.96 -1.13 0.60 118.68 121.59 1s6q s LEU 187 Ca 0.35 -2.45 -0.30 0.00 -0.22 0.00 0.00 54.13 51.51 1s6q s LEU 187 Cb -0.13 -0.64 -0.07 0.00 0.50 0.00 0.00 46.19 45.86 1s6q s LEU 187 CO 0.28 -0.28 1.02 -0.31 -1.32 0.00 0.00 176.35 175.74 1s6q s TYR 188 N 0.69 3.73 -0.03 5.38 1.51 0.46 -1.72 117.35 127.36 1s6q s TYR 188 Ca 0.19 1.72 0.07 0.00 -1.01 0.00 0.00 57.07 58.04 1s6q s TYR 188 Cb -0.20 -3.14 -0.01 0.00 -0.11 0.00 0.00 41.96 38.49 1s6q s TYR 188 CO -0.02 -0.12 -0.23 0.08 -1.11 0.00 0.00 175.55 174.15 1s6q s VAL 189 N -0.11 1.87 -0.05 0.71 1.01 0.36 -1.69 120.40 122.50 1s6q s VAL 189 Ca 0.48 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 1s6q s VAL 189 Cb -0.26 -1.57 0.04 0.00 0.00 0.00 0.00 36.38 34.59 1s6q s VAL 189 CO 0.32 0.53 0.12 -0.83 0.00 0.00 0.00 175.10 175.23 1s6q s GLY 190 N -0.35 0.01 0.00 4.51 0.00 -0.28 -1.08 107.32 110.13 1s6q s GLY 190 Ca 0.03 0.58 0.00 0.00 0.00 0.00 0.00 44.72 45.33 1s6q s GLY 190 CO 0.01 0.94 0.00 -1.14 0.00 0.00 0.00 173.10 172.91 1s6q n SER 191 N 4.23 0.05 -0.16 1.64 3.41 -0.70 -1.31 113.62 120.78 1s6q n SER 191 Ca -0.26 -0.53 0.03 0.00 -0.26 0.00 0.00 58.87 57.85 1s6q n SER 191 Cb 0.51 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.52 1s6q n SER 191 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1s6q n ASP 192 N -1.56 2.30 -4.86 4.04 8.00 -1.26 -0.13 116.55 123.08 1s6q n ASP 192 Ca 0.00 -2.25 -0.31 0.00 0.71 0.00 0.00 54.79 52.94 1s6q n ASP 192 Cb 0.00 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 40.93 1s6q n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1s6q s LEU 193 N -1.44 3.71 -0.00 0.64 1.43 -1.26 -4.82 118.68 116.94 1s6q s LEU 193 Ca 0.12 1.29 -0.30 0.00 -1.03 0.00 0.00 54.13 54.21 1s6q s LEU 193 Cb 0.09 -4.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.06 1s6q s LEU 193 CO 0.03 -0.51 1.13 -1.61 0.23 0.00 0.00 176.35 175.63 1s6q s GLU 194 N -4.06 4.43 0.00 1.70 2.02 -1.26 -4.36 118.70 117.17 1s6q s GLU 194 Ca 0.54 1.63 0.00 0.00 0.02 0.00 0.00 54.97 57.16 1s6q s GLU 194 Cb -0.10 -3.45 0.00 0.00 0.10 0.00 0.00 34.13 30.67 1s6q s GLU 194 CO 0.34 -0.27 0.00 -0.89 0.02 0.00 0.00 175.26 174.45 1s6q n ILE 195 N 4.19 0.00 0.00 -1.63 5.41 -1.26 -0.94 119.36 125.12 1s6q n ILE 195 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.84 1s6q n ILE 195 Cb 0.48 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.41 1s6q n ILE 195 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1s6q n GLY 196 N -0.43 -2.82 0.33 7.39 0.00 -1.26 -1.31 105.19 107.09 1s6q n GLY 196 Ca 0.00 0.26 0.04 0.00 0.00 0.00 0.00 46.02 46.32 1s6q n GLY 196 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1s6q h GLN 197 N 0.00 0.89 -0.63 1.61 4.20 -1.40 -1.82 115.11 117.96 1s6q h GLN 197 Ca 0.00 -0.05 0.13 0.00 0.06 0.00 0.00 58.65 58.78 1s6q h GLN 197 Cb 0.00 -0.20 -0.12 0.00 0.30 0.00 0.00 27.48 27.46 1s6q h GLN 197 CO 0.00 0.59 -0.18 1.25 -0.67 0.00 0.00 178.83 179.82 1s6q h HIS 198 N 0.91 -0.40 0.00 2.96 2.76 -1.44 0.62 115.15 120.56 1s6q h HIS 198 Ca 0.43 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.66 1s6q h HIS 198 Cb 0.35 0.28 0.00 0.00 1.55 0.00 0.00 27.41 29.59 1s6q h HIS 198 CO -0.04 -0.29 0.00 0.00 -1.30 0.00 0.00 177.93 176.31 1s6q h ARG 199 N -0.02 0.00 0.57 5.26 3.08 -0.34 0.17 114.38 123.09 1s6q h ARG 199 Ca 0.30 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.32 1s6q h ARG 199 Cb 0.48 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.54 1s6q h ARG 199 CO -0.66 0.00 -0.27 1.15 -1.07 0.00 0.00 179.97 179.12 1s6q h THR 200 N 0.00 0.00 -0.26 2.04 2.02 0.54 -1.19 112.91 116.06 1s6q h THR 200 Ca 0.00 -0.16 0.06 0.00 0.77 0.00 0.00 66.41 67.08 1s6q h THR 200 Cb 0.52 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.85 1s6q h THR 200 CO 0.00 0.00 -0.35 0.50 0.37 0.00 0.00 175.52 176.04 1s6q h LYS 201 N -0.93 -0.34 -0.53 6.66 1.63 -1.06 -0.20 116.57 121.81 1s6q h LYS 201 Ca -0.08 0.02 0.10 0.00 -0.85 0.00 0.00 60.65 59.84 1s6q h LYS 201 Cb 0.59 0.08 -0.11 0.00 -0.60 0.00 0.00 32.23 32.19 1s6q h LYS 201 CO 0.13 -0.23 -0.33 0.82 -3.45 0.00 0.00 179.45 176.39 1s6q h ILE 202 N -0.35 0.19 -0.11 2.00 1.08 -0.68 1.32 117.51 120.96 1s6q h ILE 202 Ca 0.13 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.63 1s6q h ILE 202 Cb 0.56 0.19 -0.00 0.00 -3.07 0.00 0.00 36.82 34.50 1s6q h ILE 202 CO -0.46 0.00 0.09 -0.08 -0.69 0.00 0.00 178.15 177.02 1s6q h GLU 203 N -0.19 0.00 -0.23 2.37 4.57 0.11 0.54 114.58 121.75 1s6q h GLU 203 Ca 0.21 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.28 1s6q h GLU 203 Cb 0.55 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.13 1s6q h GLU 203 CO -0.63 0.00 -0.30 0.93 -1.18 0.00 0.00 179.01 177.83 1s6q h GLU 204 N 0.00 0.61 -0.41 1.92 5.08 0.31 0.04 114.58 122.12 1s6q h GLU 204 Ca 0.05 -0.35 0.08 0.00 -1.00 0.00 0.00 59.36 58.15 1s6q h GLU 204 Cb 0.24 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.44 1s6q h GLU 204 CO -0.00 0.95 -0.14 1.25 -1.00 0.00 0.00 179.01 180.07 1s6q h LEU 205 N 0.30 -0.50 0.05 1.33 5.85 0.50 0.27 115.31 123.11 1s6q h LEU 205 Ca 0.03 0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.91 1s6q h LEU 205 Cb 0.88 0.30 -0.04 0.00 0.37 0.00 0.00 40.66 42.16 1s6q h LEU 205 CO 0.07 -0.18 -0.31 -0.09 -0.34 0.00 0.00 178.44 177.59 1s6q h ARG 206 N -0.05 -0.47 -0.59 1.25 2.43 -0.42 -0.05 114.38 116.47 1s6q h ARG 206 Ca 0.20 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.47 1s6q h ARG 206 Cb 0.36 0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.96 1s6q h ARG 206 CO -0.45 -0.32 0.27 0.37 -1.51 0.00 0.00 179.97 178.33 1s6q h GLN 207 N -0.49 0.49 0.27 0.20 5.75 -0.09 0.28 115.11 121.52 1s6q h GLN 207 Ca 0.05 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1s6q h GLN 207 Cb 0.56 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.97 1s6q h GLN 207 CO -0.23 0.32 -0.38 1.25 -2.65 0.00 0.00 178.83 177.14 1s6q h HIS 208 N 0.50 -1.07 -0.58 3.99 2.76 0.05 -1.69 115.15 119.11 1s6q h HIS 208 Ca 0.28 0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.58 1s6q h HIS 208 Cb 0.26 0.43 -0.11 0.00 1.55 0.00 0.00 27.41 29.54 1s6q h HIS 208 CO -0.12 -0.48 -0.20 -0.07 -1.30 0.00 0.00 177.93 175.76 1s6q h LEU 209 N -0.68 -0.70 -1.54 0.26 3.38 -0.45 -0.66 115.31 114.92 1s6q h LEU 209 Ca -0.03 0.19 0.25 0.00 0.09 0.00 0.00 57.88 58.38 1s6q h LEU 209 Cb 0.61 0.42 -0.07 0.00 0.09 0.00 0.00 40.66 41.71 1s6q h LEU 209 CO -0.10 -0.23 0.66 0.25 0.09 0.00 0.00 178.44 179.11 1s6q h LEU 210 N -0.05 0.35 -1.11 1.67 5.85 0.21 0.86 115.31 123.09 1s6q h LEU 210 Ca 0.27 0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.05 1s6q h LEU 210 Cb 0.47 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.50 1s6q h LEU 210 CO -0.63 0.10 0.00 0.03 -0.34 0.00 0.00 178.44 177.60 1s6q h ARG 211 N 0.32 0.00 -0.84 1.25 3.08 -0.23 -2.54 114.38 115.43 1s6q h ARG 211 Ca 0.53 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 60.04 1s6q h ARG 211 Cb 1.48 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 31.24 1s6q h ARG 211 CO -0.20 0.00 0.32 0.91 -1.07 0.00 0.00 179.97 179.93 1s6q n TRP 212 N -2.39 2.74 -0.57 3.04 7.02 0.30 -4.92 117.44 122.67 1s6q n TRP 212 Ca 0.01 -2.42 0.00 0.00 -1.02 0.00 0.00 57.50 54.06 1s6q n TRP 212 Cb 0.18 -0.97 0.00 0.00 -2.42 0.00 0.00 31.31 28.10 1s6q n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1s6q n GLY 213 N -0.95 0.00 3.39 6.99 0.00 -0.96 -4.34 105.19 109.33 1s6q n GLY 213 Ca 0.53 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.11 1s6q n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s6q s LEU 214 N 0.00 5.43 0.58 0.99 1.43 -1.24 -3.43 118.68 122.44 1s6q s LEU 214 Ca 0.00 -1.28 -0.06 0.00 -1.03 0.00 0.00 54.13 51.76 1s6q s LEU 214 Cb 0.00 -2.30 0.00 0.00 0.03 0.00 0.00 46.19 43.92 1s6q s LEU 214 CO 0.00 -0.87 0.89 -0.89 0.23 0.00 0.00 176.35 175.71 1s6q s THR 215 N 2.21 3.75 0.16 5.49 2.01 -1.26 -3.78 115.64 124.22 1s6q s THR 215 Ca 0.09 0.02 -0.14 0.00 0.31 0.00 0.00 61.69 61.97 1s6q s THR 215 Cb -0.23 -3.48 0.02 0.00 0.01 0.00 0.00 72.50 68.81 1s6q s THR 215 CO 0.08 -0.50 0.40 0.42 -0.69 0.00 0.00 174.62 174.33 1s6q s THR 216 N -2.97 0.06 0.36 -0.82 -4.23 -1.26 -4.69 115.64 102.09 1s6q s THR 216 Ca 0.53 -0.89 0.07 0.00 -1.18 0.00 0.00 61.69 60.23 1s6q s THR 216 Cb -0.11 -1.49 -0.01 0.00 1.34 0.00 0.00 72.50 72.23 1s6q s THR 216 CO 0.45 -0.27 0.41 -2.16 -0.54 0.00 0.00 174.62 172.52 1s6q s PRO 217 N -3.87 2.83 -0.00 3.99 0.04 -1.26 -5.06 135.00 131.67 1s6q s PRO 217 Ca 0.09 -1.24 0.05 0.00 0.04 0.00 0.00 61.00 59.93 1s6q s PRO 217 Cb 0.01 -2.62 -0.06 0.00 0.04 0.00 0.00 34.50 31.88 1s6q s PRO 217 CO -0.06 -0.03 0.18 -3.47 0.04 0.00 0.00 177.00 173.67 1s6q n ASP 218 N -1.57 0.86 -2.72 6.66 -0.08 -1.26 -4.84 116.55 113.59 1s6q n ASP 218 Ca 0.01 -0.51 -0.06 0.00 -1.51 0.00 0.00 54.79 52.73 1s6q n ASP 218 Cb 0.59 1.04 0.04 0.00 2.34 0.00 0.00 41.12 45.14 1s6q n ASP 218 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1s6q n LYS 219 N -1.21 0.49 0.00 -0.67 4.81 -1.26 -5.13 118.16 115.19 1s6q n LYS 219 Ca 0.01 -1.47 0.00 0.00 -0.87 0.00 0.00 58.31 55.98 1s6q n LYS 219 Cb 0.08 -1.00 0.00 0.00 0.02 0.00 0.00 35.03 34.13 1s6q n LYS 219 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1s6q n LYS 220 N 2.07 0.00 0.00 1.64 3.00 -1.26 -5.11 118.16 118.50 1s6q n LYS 220 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.41 1s6q n LYS 220 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.66 1s6q n LYS 220 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1s6q n HIS 221 N 0.00 0.00 -0.61 5.64 8.25 -1.26 -5.12 115.22 122.12 1s6q n HIS 221 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 1s6q n HIS 221 Cb 0.00 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.19 1s6q n HIS 221 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1s6q n GLN 222 N -2.16 -1.36 -3.61 -0.41 7.27 -1.26 -5.07 117.38 110.77 1s6q n GLN 222 Ca 0.00 -0.40 -0.21 0.00 0.07 0.00 0.00 57.00 56.45 1s6q n GLN 222 Cb 0.00 -1.26 -0.03 0.00 2.41 0.00 0.00 30.24 31.35 1s6q n GLN 222 CO 0.00 0.00 0.00 -1.59 0.07 0.00 0.00 177.06 175.54 1s6q s LYS 223 N -2.86 2.51 0.00 3.69 -2.85 -1.26 -5.17 119.74 113.81 1s6q s LYS 223 Ca 0.20 -1.56 0.00 0.00 -1.00 0.00 0.00 55.97 53.61 1s6q s LYS 223 Cb -0.03 -2.35 0.00 0.00 -2.06 0.00 0.00 37.83 33.39 1s6q s LYS 223 CO 0.18 -0.18 0.00 0.39 0.10 0.00 0.00 175.35 175.84 1s6q n GLU 224 N -1.52 3.68 -1.58 1.78 -0.58 -1.26 -4.98 120.64 116.18 1s6q n GLU 224 Ca 0.03 0.00 -0.54 0.00 -0.42 0.00 0.00 57.16 56.23 1s6q n GLU 224 Cb 0.62 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.42 1s6q n GLU 224 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1s6q n PRO 225 N 0.00 0.87 -1.90 3.49 -0.02 -1.26 -3.95 135.00 132.23 1s6q n PRO 225 Ca 0.00 0.31 -0.35 0.00 -2.02 0.00 0.00 63.50 61.45 1s6q n PRO 225 Cb 0.00 -1.93 0.04 0.00 -0.02 0.00 0.00 33.50 31.59 1s6q n PRO 225 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1s6q s PRO 226 N 0.61 2.88 -0.29 0.52 0.04 -1.26 -5.13 135.00 132.37 1s6q s PRO 226 Ca 0.87 1.63 -0.10 0.00 0.04 0.00 0.00 61.00 63.44 1s6q s PRO 226 Cb -1.04 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 31.52 1s6q s PRO 226 CO 0.51 -1.23 0.17 -0.06 0.04 0.00 0.00 177.00 176.43 1s6q s PHE 227 N -1.93 3.19 -0.27 0.56 0.08 -0.79 -4.91 117.98 113.92 1s6q s PHE 227 Ca 0.73 -0.12 -0.24 0.00 0.12 0.00 0.00 56.93 57.42 1s6q s PHE 227 Cb -0.25 -2.36 -0.00 0.00 -0.57 0.00 0.00 43.02 39.83 1s6q s PHE 227 CO 0.36 -0.26 0.81 -1.17 -0.10 0.00 0.00 175.22 174.86 1s6q s LEU 228 N 1.71 4.07 -0.06 -0.37 0.20 -1.26 -1.28 118.68 121.69 1s6q s LEU 228 Ca 0.06 0.89 -0.06 0.00 0.69 0.00 0.00 54.13 55.72 1s6q s LEU 228 Cb -0.16 -3.15 0.02 0.00 -0.43 0.00 0.00 46.19 42.47 1s6q s LEU 228 CO 0.09 -0.56 0.17 0.86 -0.29 0.00 0.00 176.35 176.62 1s6q s TRP 229 N 2.90 -0.18 0.00 5.38 -0.00 -0.21 -4.91 118.94 121.92 1s6q s TRP 229 Ca 0.34 0.45 0.00 0.00 -0.00 0.00 0.00 56.10 56.89 1s6q s TRP 229 Cb -0.15 0.06 0.00 0.00 -0.00 0.00 0.00 33.47 33.38 1s6q s TRP 229 CO 0.09 -0.09 0.00 -1.33 -0.00 0.00 0.00 176.95 175.62 1s6q n MET 230 N 3.06 -2.01 -1.62 5.86 2.81 -1.26 0.48 117.12 124.43 1s6q n MET 230 Ca -0.13 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.76 1s6q n MET 230 Cb 0.58 -2.59 0.00 0.00 -0.71 0.00 0.00 33.22 30.51 1s6q n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1s6q n GLY 231 N -0.26 0.77 3.30 3.03 0.00 -1.26 -5.06 105.19 105.70 1s6q n GLY 231 Ca 0.00 -0.67 -0.17 0.00 0.00 0.00 0.00 46.02 45.18 1s6q n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s6q s TYR 232 N -2.13 1.54 -0.31 1.61 1.51 1.73 -2.86 117.35 118.44 1s6q s TYR 232 Ca 0.00 -0.62 0.03 0.00 -1.01 0.00 0.00 57.07 55.48 1s6q s TYR 232 Cb 0.00 -0.75 0.09 0.00 -0.11 0.00 0.00 41.96 41.19 1s6q s TYR 232 CO 0.00 0.24 -0.00 -2.00 -1.11 0.00 0.00 175.55 172.68 1s6q s GLU 233 N -3.46 1.68 -0.18 -0.62 2.12 0.12 -1.05 118.70 117.32 1s6q s GLU 233 Ca 0.18 -1.62 -0.09 0.00 0.36 0.00 0.00 54.97 53.81 1s6q s GLU 233 Cb -0.01 -3.01 -0.05 0.00 0.26 0.00 0.00 34.13 31.33 1s6q s GLU 233 CO 0.04 -0.81 0.12 -0.51 -0.54 0.00 0.00 175.26 173.56 1s6q s LEU 234 N 1.03 4.16 0.07 2.70 1.43 -0.40 -1.22 118.68 126.45 1s6q s LEU 234 Ca 0.04 0.25 0.07 0.00 -1.03 0.00 0.00 54.13 53.46 1s6q s LEU 234 Cb -0.19 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.94 1s6q s LEU 234 CO -0.08 0.23 -0.20 -1.00 0.23 0.00 0.00 176.35 175.53 1s6q s HIS 235 N 0.07 1.73 -0.73 0.29 3.76 -0.57 -1.88 115.29 117.97 1s6q s HIS 235 Ca 0.09 -0.40 0.00 0.00 -0.15 0.00 0.00 55.06 54.60 1s6q s HIS 235 Cb -0.11 -0.99 0.00 0.00 1.11 0.00 0.00 32.58 32.59 1s6q s HIS 235 CO -0.00 0.14 0.72 -2.30 -0.85 0.00 0.00 174.74 172.45 1s6q n PRO 236 N 1.44 0.00 0.00 8.40 -0.02 -1.26 -2.23 135.00 141.33 1s6q n PRO 236 Ca -0.19 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1s6q n PRO 236 Cb 0.54 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 1s6q n PRO 236 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1s6q n ASP 237 N -1.22 0.01 -2.99 2.55 5.75 -1.26 -3.15 116.55 116.25 1s6q n ASP 237 Ca 0.00 -0.02 -0.15 0.00 -0.01 0.00 0.00 54.79 54.62 1s6q n ASP 237 Cb 0.16 0.04 -0.03 0.00 -1.03 0.00 0.00 41.12 40.25 1s6q n ASP 237 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1s6q n LYS 238 N -0.04 0.70 -3.57 0.11 2.85 -0.95 -4.47 118.16 112.81 1s6q n LYS 238 Ca 0.00 -2.78 -0.17 0.00 -1.05 0.00 0.00 58.31 54.31 1s6q n LYS 238 Cb 0.00 2.69 -0.07 0.00 -0.65 0.00 0.00 35.03 37.00 1s6q n LYS 238 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 177.40 179.02 1s6q s TRP 239 N -2.92 -0.56 0.29 5.58 1.48 -0.28 -1.50 118.94 121.02 1s6q s TRP 239 Ca 0.29 0.95 -0.14 0.00 -1.06 0.00 0.00 56.10 56.14 1s6q s TRP 239 Cb -0.01 0.34 0.01 0.00 -1.16 0.00 0.00 33.47 32.66 1s6q s TRP 239 CO 0.21 -0.56 0.58 -0.08 -4.06 0.00 0.00 176.95 173.03 1s6q s THR 240 N -1.22 0.00 0.78 0.66 -1.32 -0.36 0.45 115.64 114.63 1s6q s THR 240 Ca -0.12 -1.29 -0.12 0.00 -1.21 0.00 0.00 61.69 58.96 1s6q s THR 240 Cb -0.01 -2.33 0.06 0.00 -1.51 0.00 0.00 72.50 68.71 1s6q s THR 240 CO 0.09 0.00 1.12 -0.69 -2.21 0.00 0.00 174.62 172.92 1s6q s VAL 241 N -3.60 2.90 0.27 5.08 1.01 -1.26 0.13 120.40 124.93 1s6q s VAL 241 Ca 0.20 0.29 -0.30 0.00 0.00 0.00 0.00 61.98 62.17 1s6q s VAL 241 Cb -0.02 -3.16 -0.10 0.00 0.00 0.00 0.00 36.38 33.09 1s6q s VAL 241 CO 0.11 -0.38 1.46 0.00 0.00 0.00 0.00 175.10 176.29 1s6q s GLN 242 N -5.31 4.24 0.10 2.72 -2.07 -1.13 -4.38 119.66 113.82 1s6q s GLN 242 Ca 0.60 2.36 -0.34 0.00 -1.82 0.00 0.00 55.36 56.17 1s6q s GLN 242 Cb -0.13 -3.08 -0.13 0.00 -1.09 0.00 0.00 33.01 28.58 1s6q s GLN 242 CO 0.52 -0.45 1.68 -2.30 -1.32 0.00 0.00 175.29 173.43 1s6q n PRO 243 N 2.13 2.25 -3.32 9.60 -0.02 -1.26 -4.93 135.00 139.45 1s6q n PRO 243 Ca 0.06 0.82 -0.18 0.00 -2.02 0.00 0.00 63.50 62.17 1s6q n PRO 243 Cb 0.40 -2.62 -0.00 0.00 -0.02 0.00 0.00 33.50 31.25 1s6q n PRO 243 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1s6q s ILE 244 N 1.88 3.51 -0.18 4.25 -4.36 -1.26 -5.12 121.20 119.92 1s6q s ILE 244 Ca 0.82 -1.05 -0.04 0.00 -0.26 0.00 0.00 60.65 60.13 1s6q s ILE 244 Cb -0.65 -3.20 0.06 0.00 1.25 0.00 0.00 42.46 39.91 1s6q s ILE 244 CO 0.41 -0.08 0.06 -0.69 0.24 0.00 0.00 174.94 174.87 1s6q s VAL 245 N -2.28 0.25 -0.79 8.37 1.01 -1.26 -5.08 120.40 120.62 1s6q s VAL 245 Ca 0.49 -0.34 -0.22 0.00 0.00 0.00 0.00 61.98 61.90 1s6q s VAL 245 Cb -0.09 -0.80 0.08 0.00 0.00 0.00 0.00 36.38 35.57 1s6q s VAL 245 CO 0.31 -0.21 1.13 -0.76 0.00 0.00 0.00 175.10 175.57 1s6q s LEU 246 N 1.99 4.24 0.53 3.92 1.43 -1.26 -5.00 118.68 124.53 1s6q s LEU 246 Ca 0.01 -1.25 -0.21 0.00 -1.03 0.00 0.00 54.13 51.65 1s6q s LEU 246 Cb -0.16 -2.46 -0.07 0.00 0.03 0.00 0.00 46.19 43.53 1s6q s LEU 246 CO -0.08 -1.41 1.06 -0.81 0.23 0.00 0.00 176.35 175.34 1s6q n PRO 247 N 7.83 1.23 -4.28 1.29 -0.04 -1.26 -4.99 135.00 134.78 1s6q n PRO 247 Ca 0.10 0.46 -0.34 0.00 -0.04 0.00 0.00 63.50 63.67 1s6q n PRO 247 Cb 0.48 -2.22 -0.13 0.00 -0.04 0.00 0.00 33.50 31.59 1s6q n PRO 247 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1s6q s GLU 248 N -2.54 3.48 0.06 0.54 2.02 -1.26 -5.11 118.70 115.89 1s6q s GLU 248 Ca 0.71 -0.60 0.00 0.00 0.02 0.00 0.00 54.97 55.10 1s6q s GLU 248 Cb -0.46 -2.89 -0.04 0.00 0.10 0.00 0.00 34.13 30.84 1s6q s GLU 248 CO 0.51 0.05 -0.05 0.15 0.02 0.00 0.00 175.26 175.94 1s6q s LYS 249 N 0.84 0.62 0.22 1.61 1.02 -1.26 -5.04 119.74 117.74 1s6q s LYS 249 Ca -0.02 -1.11 0.15 0.00 0.02 0.00 0.00 55.97 55.02 1s6q s LYS 249 Cb -0.15 0.02 0.00 0.00 -0.52 0.00 0.00 37.83 37.18 1s6q s LYS 249 CO 0.01 -0.06 1.27 -0.44 -0.92 0.00 0.00 175.35 175.22 1s6q h ASP 250 N 3.48 0.00 -3.09 2.83 3.32 -2.04 -3.44 116.42 117.48 1s6q h ASP 250 Ca -0.34 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.53 1s6q h ASP 250 Cb 1.17 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 40.42 1s6q h ASP 250 CO 0.59 0.53 -0.44 -0.94 -1.72 0.00 0.00 179.24 177.25 1s6q s SER 251 N -6.27 -0.14 -0.08 6.45 1.04 -1.26 -5.10 113.70 108.33 1s6q s SER 251 Ca 0.02 0.68 -0.00 0.00 0.48 0.00 0.00 55.95 57.12 1s6q s SER 251 Cb 0.08 0.68 -0.03 0.00 0.10 0.00 0.00 66.02 66.85 1s6q s SER 251 CO 0.77 -0.20 -0.05 0.26 0.98 0.00 0.00 173.24 175.00 1s6q s TRP 252 N 1.78 3.00 0.19 5.02 0.52 -1.26 -5.02 118.94 123.18 1s6q s TRP 252 Ca -0.05 0.02 0.09 0.00 0.02 0.00 0.00 56.10 56.17 1s6q s TRP 252 Cb -0.11 -1.76 -0.04 0.00 -1.15 0.00 0.00 33.47 30.41 1s6q s TRP 252 CO -0.10 0.32 -0.07 -0.08 0.02 0.00 0.00 176.95 177.04 1s6q s THR 253 N -0.67 3.31 0.17 2.01 -1.32 -1.26 0.01 115.64 117.90 1s6q s THR 253 Ca 0.10 -1.66 -0.14 0.00 -1.21 0.00 0.00 61.69 58.78 1s6q s THR 253 Cb -0.12 -2.66 0.16 0.00 -1.51 0.00 0.00 72.50 68.38 1s6q s THR 253 CO 0.02 -0.15 1.18 0.52 -2.21 0.00 0.00 174.62 173.98 1s6q n VAL 254 N -0.12 -0.41 -0.25 5.08 0.31 -1.23 0.49 118.33 122.20 1s6q n VAL 254 Ca -0.10 1.79 0.06 0.00 -0.01 0.00 0.00 64.34 66.08 1s6q n VAL 254 Cb 0.56 -2.35 0.18 0.00 -0.91 0.00 0.00 33.84 31.32 1s6q n VAL 254 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 1s6q h ASN 255 N 0.00 -0.09 0.58 4.52 -0.73 -1.89 0.39 115.58 118.37 1s6q h ASN 255 Ca 0.25 0.16 -0.18 0.00 1.87 0.00 0.00 56.30 58.41 1s6q h ASN 255 Cb 0.44 0.24 -0.01 0.00 0.27 0.00 0.00 38.32 39.26 1s6q h ASN 255 CO -0.75 -0.09 -0.79 0.44 -0.37 0.00 0.00 177.43 175.87 1s6q h ASP 256 N 0.21 0.20 -0.22 1.15 3.45 -0.28 -2.36 116.42 118.57 1s6q h ASP 256 Ca 0.42 -0.15 -0.03 0.00 0.43 0.00 0.00 57.03 57.71 1s6q h ASP 256 Cb 0.75 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.45 1s6q h ASP 256 CO -0.56 0.91 0.02 0.40 -1.57 0.00 0.00 179.24 178.43 1s6q h ILE 257 N 0.10 1.24 0.12 0.35 1.08 0.13 -0.65 117.51 119.88 1s6q h ILE 257 Ca -0.03 -0.83 -0.00 0.00 -0.39 0.00 0.00 64.86 63.61 1s6q h ILE 257 Cb 1.38 1.36 -0.00 0.00 -3.07 0.00 0.00 36.82 36.49 1s6q h ILE 257 CO 0.12 0.26 -0.11 1.56 -0.69 0.00 0.00 178.15 179.28 1s6q h GLN 258 N 0.16 -0.22 0.00 2.37 4.20 -0.31 0.68 115.11 121.99 1s6q h GLN 258 Ca 0.06 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1s6q h GLN 258 Cb 0.37 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1s6q h GLN 258 CO 0.01 -0.15 0.45 -0.22 -0.67 0.00 0.00 178.83 178.25 1s6q h LYS 259 N -0.23 0.00 0.03 1.46 3.64 -1.46 0.66 116.57 120.67 1s6q h LYS 259 Ca -0.02 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 1s6q h LYS 259 Cb 0.20 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1s6q h LYS 259 CO -0.01 0.00 -0.51 1.25 -2.27 0.00 0.00 179.45 177.91 1s6q h LEU 260 N 0.00 0.11 -0.47 5.20 5.85 -0.44 -3.24 115.31 122.31 1s6q h LEU 260 Ca 0.00 -0.88 -0.05 0.00 0.84 0.00 0.00 57.88 57.79 1s6q h LEU 260 Cb 0.91 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 1s6q h LEU 260 CO 0.00 1.22 0.11 0.58 -0.34 0.00 0.00 178.44 180.00 1s6q h VAL 261 N -0.84 1.24 -0.54 1.05 2.07 0.24 -2.98 116.25 116.50 1s6q h VAL 261 Ca -0.12 -0.85 0.11 0.00 0.82 0.00 0.00 66.70 66.66 1s6q h VAL 261 Cb 1.23 0.89 -0.10 0.00 -1.52 0.00 0.00 31.29 31.79 1s6q h VAL 261 CO -0.01 0.30 -0.11 1.23 0.02 0.00 0.00 177.57 179.00 1s6q h GLY 262 N 0.64 0.41 1.21 2.17 0.00 -0.14 -1.43 103.07 105.93 1s6q h GLY 262 Ca 0.15 0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.60 1s6q h GLY 262 CO 0.00 -0.20 0.28 0.50 0.00 0.00 0.00 176.54 177.12 1s6q h LYS 263 N 0.02 1.01 -0.42 4.80 1.57 -1.57 -2.94 116.57 119.04 1s6q h LYS 263 Ca 0.26 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1s6q h LYS 263 Cb 0.40 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1s6q h LYS 263 CO -0.54 0.82 0.26 -0.07 -0.57 0.00 0.00 179.45 179.36 1s6q h LEU 264 N 0.99 0.49 -0.50 2.94 3.38 -1.12 -1.45 115.31 120.06 1s6q h LEU 264 Ca 0.23 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 1s6q h LEU 264 Cb 0.18 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1s6q h LEU 264 CO -0.02 0.38 0.29 0.78 0.09 0.00 0.00 178.44 179.96 1s6q h ASN 265 N 0.56 0.60 -0.12 -0.43 2.35 -1.38 -1.28 115.58 115.88 1s6q h ASN 265 Ca 0.15 -0.07 0.04 0.00 -0.55 0.00 0.00 56.30 55.87 1s6q h ASN 265 Cb -0.03 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.18 1s6q h ASN 265 CO -0.03 0.50 0.09 -0.25 -1.65 0.00 0.00 177.43 176.09 1s6q h TRP 266 N 0.66 0.00 -0.00 1.19 2.91 -1.31 0.32 115.95 119.72 1s6q h TRP 266 Ca 0.18 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.20 1s6q h TRP 266 Cb 0.01 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.66 1s6q h TRP 266 CO -0.02 0.00 -0.30 0.00 -1.03 0.00 0.00 178.44 177.09 1s6q n ALA 267 N -2.53 3.09 0.16 2.65 0.00 -0.57 -3.85 120.51 119.46 1s6q n ALA 267 Ca -0.00 -0.28 0.01 0.00 0.00 0.00 0.00 53.44 53.17 1s6q n ALA 267 Cb 0.21 -1.24 0.25 0.00 0.00 0.00 0.00 19.45 18.67 1s6q n ALA 267 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1s6q h SER 268 N 0.17 0.00 0.00 0.00 0.87 0.75 -1.15 113.55 114.19 1s6q h SER 268 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1s6q h SER 268 Cb 0.48 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1s6q h SER 268 CO 0.00 0.51 0.16 0.06 -0.53 0.00 0.00 176.83 177.03 1s6q h GLN 269 N 0.00 0.00 0.00 2.24 3.07 -1.66 -3.30 115.11 115.45 1s6q h GLN 269 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.73 1s6q h GLN 269 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.51 1s6q h GLN 269 CO 0.07 0.00 -0.04 1.51 0.09 0.00 0.00 178.83 180.45 1s6q n ILE 270 N -2.96 0.00 -2.68 1.86 0.13 -1.23 0.33 119.36 114.81 1s6q n ILE 270 Ca -0.02 0.00 -0.42 0.00 -1.10 0.00 0.00 62.75 61.20 1s6q n ILE 270 Cb 0.22 -0.02 -0.03 0.00 -0.84 0.00 0.00 39.64 38.97 1s6q n ILE 270 CO 0.00 0.00 0.00 -0.31 2.80 0.00 0.00 176.55 179.04 1s6q s TYR 271 N -0.75 3.59 0.30 9.51 1.51 -0.44 -4.82 117.35 126.25 1s6q s TYR 271 Ca 0.00 1.63 -0.28 0.00 -1.01 0.00 0.00 57.07 57.41 1s6q s TYR 271 Cb 0.00 -3.16 -0.09 0.00 -0.11 0.00 0.00 41.96 38.59 1s6q s TYR 271 CO 0.00 -0.17 1.05 -2.14 -1.11 0.00 0.00 175.55 173.18 1s6q s PRO 272 N 1.40 4.58 0.00 -1.71 0.02 -1.26 -4.24 135.00 133.78 1s6q s PRO 272 Ca 0.51 1.67 0.00 0.00 0.02 0.00 0.00 61.00 63.20 1s6q s PRO 272 Cb -0.20 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.26 1s6q s PRO 272 CO 0.24 0.20 0.00 0.41 -0.33 0.00 0.00 177.00 177.52 1s6q n GLY 273 N 1.04 0.48 3.67 0.52 0.00 -1.26 -4.98 105.19 104.65 1s6q n GLY 273 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1s6q n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1s6q n ILE 274 N -2.15 0.72 -2.82 -0.61 5.41 -1.26 -4.98 119.36 113.66 1s6q n ILE 274 Ca 0.00 -0.13 -0.26 0.00 1.00 0.00 0.00 62.75 63.37 1s6q n ILE 274 Cb 0.06 -2.20 0.01 0.00 -0.71 0.00 0.00 39.64 36.80 1s6q n ILE 274 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1s6q s LYS 275 N 4.34 3.32 0.00 0.38 3.01 -1.26 -4.99 119.74 124.53 1s6q s LYS 275 Ca 0.90 -0.10 0.00 0.00 -1.01 0.00 0.00 55.97 55.76 1s6q s LYS 275 Cb -0.51 -2.46 0.00 0.00 -1.01 0.00 0.00 37.83 33.86 1s6q s LYS 275 CO 0.45 -0.23 0.00 0.28 0.51 0.00 0.00 175.35 176.35 1s6q n VAL 276 N -2.18 0.00 -0.06 3.17 0.31 -1.26 -4.97 118.33 113.34 1s6q n VAL 276 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.26 1s6q n VAL 276 Cb 0.56 0.41 -0.01 0.00 -0.91 0.00 0.00 33.84 33.89 1s6q n VAL 276 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1s6q h ARG 277 N 0.00 -0.07 0.09 5.55 2.43 -1.95 -3.10 114.38 117.33 1s6q h ARG 277 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1s6q h ARG 277 Cb 0.44 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1s6q h ARG 277 CO 0.00 -0.05 -0.04 1.96 -1.51 0.00 0.00 179.97 180.33 1s6q h GLN 278 N -0.07 -0.12 -0.37 0.20 1.08 -1.94 -2.15 115.11 111.73 1s6q h GLN 278 Ca 0.13 0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.41 1s6q h GLN 278 Cb 0.27 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 1s6q h GLN 278 CO -0.31 0.09 0.26 -0.07 -0.95 0.00 0.00 178.83 177.85 1s6q h LEU 279 N -0.31 0.16 0.01 1.46 3.38 -1.85 -2.40 115.31 115.76 1s6q h LEU 279 Ca -0.01 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.69 1s6q h LEU 279 Cb 0.26 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1s6q h LEU 279 CO 0.02 0.10 -1.53 0.28 0.09 0.00 0.00 178.44 177.41 1s6q h SER 280 N 0.19 0.03 -0.91 -0.43 0.02 -1.55 -3.28 113.55 107.61 1s6q h SER 280 Ca 0.17 -0.05 0.23 0.00 -0.84 0.00 0.00 61.79 61.31 1s6q h SER 280 Cb 0.44 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.91 1s6q h SER 280 CO -0.03 1.04 0.62 0.50 -1.14 0.00 0.00 176.83 177.83 1s6q h LYS 281 N 0.00 0.22 0.18 3.45 3.64 -0.85 -1.02 116.57 122.19 1s6q h LYS 281 Ca -0.22 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.14 1s6q h LYS 281 Cb 1.95 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.73 1s6q h LYS 281 CO 0.10 0.14 -0.09 -0.07 -2.27 0.00 0.00 179.45 177.26 1s6q h LEU 282 N 0.22 -0.20 0.00 5.20 3.38 -1.60 -3.02 115.31 119.30 1s6q h LEU 282 Ca 0.46 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.44 1s6q h LEU 282 Cb 1.43 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1s6q h LEU 282 CO -0.11 -0.09 0.23 -0.11 0.09 0.00 0.00 178.44 178.45 1s6q n LEU 283 N -2.96 0.00 0.00 1.67 7.94 -0.44 -2.70 117.00 120.51 1s6q n LEU 283 Ca -0.03 0.07 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 1s6q n LEU 283 Cb 0.10 -0.07 0.00 0.00 0.53 0.00 0.00 43.42 43.98 1s6q n LEU 283 CO 0.07 -0.07 0.43 0.54 -1.11 0.00 0.00 177.39 177.26 1s6q n ARG 284 N -0.91 0.00 -3.26 1.96 1.74 -0.90 -3.87 116.66 111.42 1s6q n ARG 284 Ca 0.00 0.21 -0.40 0.00 -0.77 0.00 0.00 57.85 56.89 1s6q n ARG 284 Cb 0.23 -1.70 -0.08 0.00 -1.02 0.00 0.00 32.46 29.90 1s6q n ARG 284 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1s6q s GLY 285 N -2.33 1.84 0.00 -0.13 0.00 -1.10 -4.99 107.32 100.61 1s6q s GLY 285 Ca 0.00 -0.74 0.27 0.00 0.00 0.00 0.00 44.72 44.25 1s6q s GLY 285 CO 0.00 1.21 1.68 -0.37 0.00 0.00 0.00 173.10 175.62 1s6q n THR 286 N 5.23 0.00 -0.25 0.90 5.66 -1.25 -4.61 114.28 119.95 1s6q n THR 286 Ca -0.05 -0.07 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 1s6q n THR 286 Cb 0.50 0.13 0.00 0.00 -1.55 0.00 0.00 70.33 69.41 1s6q n THR 286 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1s6q n LYS 287 N -0.95 1.29 -1.90 1.09 5.02 -1.26 -5.04 118.16 116.40 1s6q n LYS 287 Ca 0.12 -0.97 -0.29 0.00 -2.02 0.00 0.00 58.31 55.15 1s6q n LYS 287 Cb 0.32 -0.88 0.20 0.00 -0.02 0.00 0.00 35.03 34.65 1s6q n LYS 287 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1s6q n ALA 288 N -0.26 -1.46 0.00 7.82 0.00 -1.26 -5.00 120.51 120.36 1s6q n ALA 288 Ca 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 53.44 51.72 1s6q n ALA 288 Cb 0.23 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1s6q n ALA 288 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1s6q n LEU 289 N 0.00 0.00 -0.78 0.00 7.94 -1.26 -4.84 117.00 118.06 1s6q n LEU 289 Ca 0.16 0.00 0.07 0.00 -1.11 0.00 0.00 56.01 55.14 1s6q n LEU 289 Cb 0.57 0.46 0.17 0.00 0.53 0.00 0.00 43.42 45.16 1s6q n LEU 289 CO 0.42 -0.50 0.63 0.41 -1.11 0.00 0.00 177.39 177.24 1s6q n THR 290 N -2.50 0.82 -2.32 1.96 -1.04 -1.26 -3.16 114.28 106.78 1s6q n THR 290 Ca 0.00 -0.91 -0.41 0.00 -2.04 0.00 0.00 64.05 60.70 1s6q n THR 290 Cb 0.00 0.65 -0.03 0.00 -1.82 0.00 0.00 70.33 69.13 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 -1.04 3.09 0.37 -2.82 2.12 -1.26 -4.91 118.70 114.25 1s6q s GLU 291 Ca 0.27 0.36 -0.28 0.00 0.36 0.00 0.00 54.97 55.68 1s6q s GLU 291 Cb 0.15 -4.21 -0.11 0.00 0.26 0.00 0.00 34.13 30.22 1s6q s GLU 291 CO 0.20 -2.21 1.46 0.54 -0.54 0.00 0.00 175.26 174.71 1s6q s VAL 292 N 6.84 2.14 -0.05 3.70 0.11 -1.26 -3.47 120.40 128.41 1s6q s VAL 292 Ca 0.53 0.15 0.06 0.00 -2.93 0.00 0.00 61.98 59.79 1s6q s VAL 292 Cb -0.11 -3.09 -0.01 0.00 -1.53 0.00 0.00 36.38 31.64 1s6q s VAL 292 CO 0.22 0.03 -0.24 -0.63 -3.33 0.00 0.00 175.10 171.15 1s6q s ILE 293 N -1.11 1.96 -0.46 7.04 1.01 0.10 -4.95 121.20 124.80 1s6q s ILE 293 Ca 0.52 -1.02 -0.28 0.00 0.00 0.00 0.00 60.65 59.87 1s6q s ILE 293 Cb -0.46 -1.65 0.01 0.00 0.01 0.00 0.00 42.46 40.37 1s6q s ILE 293 CO 0.62 0.55 1.45 -2.16 0.00 0.00 0.00 174.94 175.39 1s6q s PRO 294 N -0.21 3.45 -0.29 2.79 0.04 -1.26 -4.22 135.00 135.30 1s6q s PRO 294 Ca -0.01 0.81 -0.28 0.00 0.04 0.00 0.00 61.00 61.56 1s6q s PRO 294 Cb -0.13 -4.07 -0.05 0.00 0.04 0.00 0.00 34.50 30.29 1s6q s PRO 294 CO 0.03 -1.72 2.16 -0.51 0.04 0.00 0.00 177.00 176.99 1s6q s LEU 295 N 5.80 3.44 1.38 -3.56 1.02 -1.26 -4.93 118.68 120.58 1s6q s LEU 295 Ca 0.60 1.62 -0.22 0.00 0.02 0.00 0.00 54.13 56.15 1s6q s LEU 295 Cb -0.13 -3.35 0.35 0.00 0.02 0.00 0.00 46.19 43.08 1s6q s LEU 295 CO 0.30 -2.06 0.97 0.42 0.02 0.00 0.00 176.35 176.00 1s6q s THR 296 N 8.63 1.27 0.08 5.49 -4.23 -1.26 -4.75 115.64 120.87 1s6q s THR 296 Ca 0.95 0.00 -0.34 0.00 -1.18 0.00 0.00 61.69 61.12 1s6q s THR 296 Cb -0.28 -2.16 -0.17 0.00 1.34 0.00 0.00 72.50 71.23 1s6q s THR 296 CO 0.33 0.00 1.60 -0.33 -0.54 0.00 0.00 174.62 175.68 1s6q h GLU 297 N -3.27 -0.95 0.27 3.99 3.07 -2.00 -2.65 114.58 113.03 1s6q h GLU 297 Ca -0.43 0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.49 1s6q h GLU 297 Cb 1.33 0.22 -0.04 0.00 -0.84 0.00 0.00 28.75 29.42 1s6q h GLU 297 CO 0.29 -0.63 -0.52 0.93 -1.40 0.00 0.00 179.01 177.67 1s6q h GLU 298 N -0.99 -0.82 -0.74 2.33 3.07 -1.99 -1.72 114.58 113.73 1s6q h GLU 298 Ca -0.08 0.06 0.15 0.00 -0.50 0.00 0.00 59.36 58.99 1s6q h GLU 298 Cb 0.81 0.19 -0.14 0.00 -0.84 0.00 0.00 28.75 28.77 1s6q h GLU 298 CO 0.06 -0.55 -0.18 0.00 -1.40 0.00 0.00 179.01 176.94 1s6q h ALA 299 N -0.68 0.49 0.27 3.43 0.00 -1.84 0.46 119.26 121.40 1s6q h ALA 299 Ca -0.03 0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1s6q h ALA 299 Cb 0.81 0.56 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 1s6q h ALA 299 CO -0.20 -0.41 -0.45 1.49 0.00 0.00 0.00 179.25 179.67 1s6q h GLU 300 N 0.00 -0.74 -0.88 0.00 4.22 -1.05 0.15 114.58 116.27 1s6q h GLU 300 Ca 0.36 0.05 0.20 0.00 0.08 0.00 0.00 59.36 60.05 1s6q h GLU 300 Cb 0.54 0.17 -0.12 0.00 0.50 0.00 0.00 28.75 29.84 1s6q h GLU 300 CO -0.76 -0.49 0.40 1.25 -2.18 0.00 0.00 179.01 177.24 1s6q h LEU 301 N -0.76 0.38 0.75 1.64 5.85 -0.37 -2.44 115.31 120.36 1s6q h LEU 301 Ca -0.03 0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 1s6q h LEU 301 Cb 0.71 0.10 0.01 0.00 0.37 0.00 0.00 40.66 41.85 1s6q h LEU 301 CO -0.15 0.06 -0.36 -0.08 -0.34 0.00 0.00 178.44 177.56 1s6q h GLU 302 N 0.46 -0.97 -0.97 1.25 4.81 -0.14 -2.94 114.58 116.08 1s6q h GLU 302 Ca 0.53 0.07 0.20 0.00 -0.13 0.00 0.00 59.36 60.03 1s6q h GLU 302 Cb 0.95 0.22 -0.18 0.00 0.63 0.00 0.00 28.75 30.37 1s6q h GLU 302 CO -0.48 -0.65 -0.21 -0.11 -0.73 0.00 0.00 179.01 176.82 1s6q n LEU 303 N -4.81 -0.32 -0.01 1.64 7.94 0.44 -0.68 117.00 121.20 1s6q n LEU 303 Ca -0.13 1.67 -0.09 0.00 -1.11 0.00 0.00 56.01 56.35 1s6q n LEU 303 Cb 0.40 -0.52 -0.03 0.00 0.53 0.00 0.00 43.42 43.81 1s6q n LEU 303 CO 0.30 -1.61 0.72 0.00 -1.11 0.00 0.00 177.39 175.69 1s6q h ALA 304 N 1.94 -0.15 -0.96 1.96 0.00 -1.43 -1.99 119.26 118.64 1s6q h ALA 304 Ca 0.48 0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.61 1s6q h ALA 304 Cb 0.76 0.41 -0.10 0.00 0.00 0.00 0.00 17.79 18.86 1s6q h ALA 304 CO -0.99 -0.66 0.56 0.93 0.00 0.00 0.00 179.25 179.09 1s6q h GLU 305 N -0.26 0.72 0.00 0.00 5.08 -0.72 0.89 114.58 120.29 1s6q h GLU 305 Ca 0.10 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1s6q h GLU 305 Cb 0.41 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 1s6q h GLU 305 CO -0.29 0.47 -0.09 -0.91 -1.00 0.00 0.00 179.01 177.19 1s6q h ASN 306 N 0.74 0.00 0.13 1.42 2.35 -1.09 0.11 115.58 119.24 1s6q h ASN 306 Ca 0.54 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.28 1s6q h ASN 306 Cb 0.79 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.17 1s6q h ASN 306 CO -0.37 0.09 -0.06 0.03 -1.65 0.00 0.00 177.43 175.47 1s6q h ARG 307 N 0.00 -0.16 -0.99 0.81 3.08 0.12 0.25 114.38 117.49 1s6q h ARG 307 Ca -0.00 0.01 0.21 0.00 0.07 0.00 0.00 59.98 60.27 1s6q h ARG 307 Cb 0.45 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 30.44 1s6q h ARG 307 CO 0.01 0.30 0.62 1.49 -1.07 0.00 0.00 179.97 181.32 1s6q h GLU 308 N -0.75 0.58 0.30 0.04 4.57 -0.60 0.73 114.58 119.44 1s6q h GLU 308 Ca -0.02 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1s6q h GLU 308 Cb 0.54 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 1s6q h GLU 308 CO 0.03 0.38 -0.14 0.82 -1.18 0.00 0.00 179.01 178.92 1s6q h ILE 309 N 0.60 0.00 -0.54 2.32 2.04 -0.85 -3.31 117.51 117.77 1s6q h ILE 309 Ca 0.56 -0.11 0.14 0.00 1.00 0.00 0.00 64.86 66.45 1s6q h ILE 309 Cb 1.11 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1s6q h ILE 309 CO -0.32 0.00 0.38 -0.07 0.00 0.00 0.00 178.15 178.14 1s6q h LEU 310 N -0.51 0.11 -1.47 1.44 3.38 0.72 -2.01 115.31 116.97 1s6q h LEU 310 Ca -0.04 0.00 0.22 0.00 0.09 0.00 0.00 57.88 58.15 1s6q h LEU 310 Cb 0.31 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 1s6q h LEU 310 CO 0.07 0.06 0.62 0.07 0.09 0.00 0.00 178.44 179.35 1s6q h LYS 311 N 0.12 0.40 -5.81 1.13 2.10 0.34 -3.38 116.57 111.47 1s6q h LYS 311 Ca 0.26 -0.02 -0.58 0.00 -2.00 0.00 0.00 60.65 58.31 1s6q h LYS 311 Cb 0.86 -0.09 -0.08 0.00 -0.90 0.00 0.00 32.23 32.03 1s6q h LYS 311 CO -0.03 0.26 0.05 -1.21 -2.00 0.00 0.00 179.45 176.52 1s6q s GLU 312 N -5.45 4.32 0.31 0.07 0.41 -0.76 -5.05 118.70 112.56 1s6q s GLU 312 Ca -0.08 0.67 -0.28 0.00 -0.41 0.00 0.00 54.97 54.86 1s6q s GLU 312 Cb 0.23 -3.50 -0.09 0.00 -1.78 0.00 0.00 34.13 28.99 1s6q s GLU 312 CO 0.79 -0.04 1.12 -1.25 -0.49 0.00 0.00 175.26 175.39 1s6q s PRO 313 N 1.22 4.51 -0.03 0.39 0.04 -1.26 -5.01 135.00 134.86 1s6q s PRO 313 Ca 0.31 1.82 0.01 0.00 0.04 0.00 0.00 61.00 63.18 1s6q s PRO 313 Cb -0.16 -3.06 0.01 0.00 0.04 0.00 0.00 34.50 31.33 1s6q s PRO 313 CO 0.13 0.09 -0.04 0.08 0.04 0.00 0.00 177.00 177.30 1s6q s VAL 314 N -1.24 0.40 0.23 -0.36 1.01 -1.26 -5.16 120.40 114.02 1s6q s VAL 314 Ca 0.47 -0.10 0.09 0.00 0.00 0.00 0.00 61.98 62.44 1s6q s VAL 314 Cb -0.32 -0.41 -0.05 0.00 0.00 0.00 0.00 36.38 35.60 1s6q s VAL 314 CO 0.41 0.17 -0.16 -1.38 0.00 0.00 0.00 175.10 174.13 1s6q s HIS 315 N 0.59 1.88 0.20 5.22 -3.43 -1.26 -4.69 115.29 113.81 1s6q s HIS 315 Ca -0.07 -0.50 0.09 0.00 -0.80 0.00 0.00 55.06 53.79 1s6q s HIS 315 Cb -0.10 -0.85 -0.04 0.00 -1.43 0.00 0.00 32.58 30.15 1s6q s HIS 315 CO -0.00 0.47 -0.09 0.20 -2.00 0.00 0.00 174.74 173.31 1s6q s GLY 316 N -3.36 1.72 0.51 -1.38 0.00 0.17 -4.67 107.32 100.32 1s6q s GLY 316 Ca 0.25 -1.54 0.05 0.00 0.00 0.00 0.00 44.72 43.47 1s6q s GLY 316 CO 0.09 -1.58 0.71 0.54 0.00 0.00 0.00 173.10 172.86 1s6q s VAL 317 N -1.88 2.71 0.68 1.40 0.11 -0.04 -1.13 120.40 122.24 1s6q s VAL 317 Ca 0.26 -0.84 0.04 0.00 -2.93 0.00 0.00 61.98 58.51 1s6q s VAL 317 Cb -0.08 -2.87 0.12 0.00 -1.53 0.00 0.00 36.38 32.02 1s6q s VAL 317 CO 0.16 0.00 0.93 -0.31 -3.33 0.00 0.00 175.10 172.55 1s6q s TYR 318 N -2.61 1.31 -0.20 1.54 4.12 -1.26 -4.56 117.35 115.70 1s6q s TYR 318 Ca 0.58 -0.53 -0.15 0.00 0.02 0.00 0.00 57.07 56.99 1s6q s TYR 318 Cb -0.09 -2.65 -0.04 0.00 -1.52 0.00 0.00 41.96 37.65 1s6q s TYR 318 CO 0.37 -1.57 0.34 -0.47 0.02 0.00 0.00 175.55 174.24 1s6q s TYR 319 N -2.97 3.39 -0.29 2.71 5.04 -0.88 -4.95 117.35 119.40 1s6q s TYR 319 Ca 0.65 0.56 -0.08 0.00 -2.44 0.00 0.00 57.07 55.77 1s6q s TYR 319 Cb -0.05 -2.45 -0.00 0.00 0.35 0.00 0.00 41.96 39.81 1s6q s TYR 319 CO 0.43 0.06 0.09 0.34 -1.34 0.00 0.00 175.55 175.13 1s6q s ASP 320 N 0.92 5.21 0.00 4.32 2.15 -1.26 -4.42 116.67 123.59 1s6q s ASP 320 Ca 0.17 -0.54 0.20 0.00 0.43 0.00 0.00 52.55 52.80 1s6q s ASP 320 Cb -0.14 -1.92 1.06 0.00 -0.30 0.00 0.00 42.92 41.62 1s6q s ASP 320 CO 0.07 -0.15 1.60 -0.81 -0.17 0.00 0.00 175.17 175.70 1s6q n PRO 321 N 4.91 0.40 0.21 4.34 -0.04 -1.26 -2.57 135.00 140.98 1s6q n PRO 321 Ca -0.15 0.07 0.10 0.00 -0.04 0.00 0.00 63.50 63.48 1s6q n PRO 321 Cb 0.49 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.65 1s6q n PRO 321 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1s6q h SER 322 N 0.00 0.00 -0.45 3.54 0.02 -2.04 -3.46 113.55 111.16 1s6q h SER 322 Ca 0.00 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.32 1s6q h SER 322 Cb 0.12 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.57 1s6q h SER 322 CO 0.00 0.13 -0.41 -0.54 -1.14 0.00 0.00 176.83 174.87 1s6q s LYS 323 N -3.22 2.23 0.87 3.45 1.02 -1.06 -5.15 119.74 117.88 1s6q s LYS 323 Ca 0.05 -2.22 -0.14 0.00 0.02 0.00 0.00 55.97 53.69 1s6q s LYS 323 Cb 0.06 -1.80 0.13 0.00 -0.52 0.00 0.00 37.83 35.70 1s6q s LYS 323 CO 0.67 -0.48 1.23 -0.51 -0.92 0.00 0.00 175.35 175.34 1s6q s ASP 324 N -4.07 3.92 -0.19 2.83 1.01 -1.26 -4.95 116.67 113.95 1s6q s ASP 324 Ca 0.19 0.60 0.01 0.00 0.71 0.00 0.00 52.55 54.06 1s6q s ASP 324 Cb -0.00 -0.93 0.04 0.00 1.01 0.00 0.00 42.92 43.04 1s6q s ASP 324 CO 0.11 -2.26 -0.10 -0.22 0.21 0.00 0.00 175.17 172.92 1s6q s LEU 325 N -5.73 2.19 -0.09 1.23 2.96 -1.26 -4.33 118.68 113.65 1s6q s LEU 325 Ca 0.67 -0.86 -0.02 0.00 -0.22 0.00 0.00 54.13 53.69 1s6q s LEU 325 Cb -0.09 -1.19 -0.03 0.00 0.50 0.00 0.00 46.19 45.38 1s6q s LEU 325 CO 0.51 -0.15 0.02 -0.63 -1.32 0.00 0.00 176.35 174.77 1s6q s ILE 326 N 1.43 4.44 -0.10 6.68 1.09 0.11 0.73 121.20 135.58 1s6q s ILE 326 Ca -0.01 -0.20 0.00 0.00 -1.10 0.00 0.00 60.65 59.34 1s6q s ILE 326 Cb -0.16 -2.88 0.02 0.00 -1.06 0.00 0.00 42.46 38.39 1s6q s ILE 326 CO -0.08 0.60 -0.09 0.00 -0.10 0.00 0.00 174.94 175.28 1s6q s ALA 327 N -0.86 1.30 -0.07 9.38 0.00 0.17 -1.72 121.76 129.96 1s6q s ALA 327 Ca 0.13 -0.51 0.06 0.00 0.00 0.00 0.00 51.96 51.64 1s6q s ALA 327 Cb -0.11 -0.82 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 1s6q s ALA 327 CO 0.02 -0.29 -0.25 -1.21 0.00 0.00 0.00 175.76 174.04 1s6q s GLU 328 N 1.45 2.67 -0.02 0.00 2.02 -1.18 0.14 118.70 123.78 1s6q s GLU 328 Ca 0.00 -0.90 0.05 0.00 0.02 0.00 0.00 54.97 54.14 1s6q s GLU 328 Cb -0.13 -2.20 -0.01 0.00 0.10 0.00 0.00 34.13 31.89 1s6q s GLU 328 CO -0.05 0.34 -0.16 0.42 0.02 0.00 0.00 175.26 175.82 1s6q s ILE 329 N -0.05 1.31 0.01 -1.63 1.01 -1.09 -2.87 121.20 117.90 1s6q s ILE 329 Ca -0.07 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 59.91 1s6q s ILE 329 Cb -0.15 -1.10 -0.01 0.00 0.01 0.00 0.00 42.46 41.21 1s6q s ILE 329 CO 0.05 0.37 -0.06 0.00 0.00 0.00 0.00 174.94 175.30 1s6q s GLN 330 N -0.26 0.48 0.02 2.79 0.00 -0.44 -4.30 119.66 117.94 1s6q s GLN 330 Ca 0.04 -0.42 -0.25 0.00 -0.00 0.00 0.00 55.36 54.73 1s6q s GLN 330 Cb -0.08 -0.38 -0.05 0.00 0.00 0.00 0.00 33.01 32.51 1s6q s GLN 330 CO 0.00 0.09 0.76 0.21 0.00 0.00 0.00 175.29 176.35 1s6q s LYS 331 N -0.70 4.48 -0.12 9.60 2.20 -1.26 -0.63 119.74 133.31 1s6q s LYS 331 Ca -0.03 1.04 0.07 0.00 -0.36 0.00 0.00 55.97 56.69 1s6q s LYS 331 Cb -0.05 -3.38 -0.24 0.00 -1.51 0.00 0.00 37.83 32.65 1s6q s LYS 331 CO 0.00 0.23 0.38 1.04 -0.36 0.00 0.00 175.35 176.64 1s6q n GLN 332 N 3.04 0.68 0.00 4.03 6.02 0.21 -4.70 117.38 126.66 1s6q n GLN 332 Ca -0.02 0.22 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 1s6q n GLN 332 Cb 0.50 -1.69 0.00 0.00 1.02 0.00 0.00 30.24 30.07 1s6q n GLN 332 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s6q n GLY 333 N 1.79 -1.37 3.35 1.08 0.00 -1.16 -4.96 105.19 103.91 1s6q n GLY 333 Ca -0.27 0.45 -0.45 0.00 0.00 0.00 0.00 46.02 45.75 1s6q n GLY 333 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s6q s GLN 334 N 0.00 4.12 0.00 1.61 -0.21 -1.26 -4.53 119.66 119.39 1s6q s GLN 334 Ca 0.00 -3.06 0.00 0.00 0.02 0.00 0.00 55.36 52.32 1s6q s GLN 334 Cb 0.00 -4.59 0.00 0.00 1.00 0.00 0.00 33.01 29.42 1s6q s GLN 334 CO 0.00 -1.30 0.00 0.41 -2.12 0.00 0.00 175.29 172.28 1s6q n GLY 335 N 3.01 0.48 3.76 3.09 0.00 -1.26 -4.97 105.19 109.29 1s6q n GLY 335 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.56 4.23 -0.01 1.61 -0.21 -1.26 -2.98 119.66 120.48 1s6q s GLN 336 Ca 0.00 0.50 0.00 0.00 0.02 0.00 0.00 55.36 55.88 1s6q s GLN 336 Cb 0.00 -3.36 0.01 0.00 1.00 0.00 0.00 33.01 30.66 1s6q s GLN 336 CO 0.00 0.34 0.00 -1.58 -2.12 0.00 0.00 175.29 171.93 1s6q s TRP 337 N -0.00 0.06 0.21 0.91 0.52 -0.88 0.67 118.94 120.43 1s6q s TRP 337 Ca 0.26 0.01 0.07 0.00 0.02 0.00 0.00 56.10 56.47 1s6q s TRP 337 Cb -0.16 -0.09 -0.05 0.00 -1.15 0.00 0.00 33.47 32.02 1s6q s TRP 337 CO 0.13 -0.02 -0.13 0.95 0.02 0.00 0.00 176.95 177.90 1s6q s THR 338 N 0.23 1.64 -0.02 2.01 -4.23 0.20 0.02 115.64 115.49 1s6q s THR 338 Ca -0.02 -2.18 -0.30 0.00 -1.18 0.00 0.00 61.69 58.01 1s6q s THR 338 Cb -0.03 -2.07 0.07 0.00 1.34 0.00 0.00 72.50 71.81 1s6q s THR 338 CO -0.01 -0.58 0.67 -0.72 -0.54 0.00 0.00 174.62 173.45 1s6q s TYR 339 N -3.03 -0.64 -0.01 3.99 1.13 -0.49 -1.33 117.35 116.98 1s6q s TYR 339 Ca 0.23 0.99 0.02 0.00 -1.41 0.00 0.00 57.07 56.89 1s6q s TYR 339 Cb 0.00 0.44 -0.00 0.00 -1.10 0.00 0.00 41.96 41.29 1s6q s TYR 339 CO 0.07 -0.65 -0.07 1.14 -2.51 0.00 0.00 175.55 173.53 1s6q s GLN 340 N -1.63 0.59 -0.19 -3.49 0.00 -1.14 -0.13 119.66 113.68 1s6q s GLN 340 Ca -0.09 -0.25 -0.02 0.00 -0.00 0.00 0.00 55.36 55.00 1s6q s GLN 340 Cb -0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 33.01 32.43 1s6q s GLN 340 CO 0.06 0.15 -0.08 0.42 0.00 0.00 0.00 175.29 175.83 1s6q s ILE 341 N -0.13 3.19 0.22 3.63 1.01 0.18 -3.13 121.20 126.16 1s6q s ILE 341 Ca 0.02 -0.58 -0.08 0.00 0.00 0.00 0.00 60.65 60.02 1s6q s ILE 341 Cb -0.03 -2.41 -0.02 0.00 0.01 0.00 0.00 42.46 40.01 1s6q s ILE 341 CO -0.00 0.47 0.32 -0.72 0.00 0.00 0.00 174.94 175.00 1s6q s TYR 342 N 1.05 0.69 -0.01 3.97 -0.85 -0.70 0.16 117.35 121.66 1s6q s TYR 342 Ca 0.00 -1.00 0.01 0.00 -0.52 0.00 0.00 57.07 55.57 1s6q s TYR 342 Cb -0.15 -0.14 -0.02 0.00 0.38 0.00 0.00 41.96 42.04 1s6q s TYR 342 CO -0.01 -0.82 0.01 1.04 -1.52 0.00 0.00 175.55 174.25 1s6q n GLN 343 N -0.32 2.41 -4.11 -3.49 6.02 -1.26 0.09 117.38 116.72 1s6q n GLN 343 Ca -0.01 -0.01 -0.33 0.00 -0.01 0.00 0.00 57.00 56.65 1s6q n GLN 343 Cb 0.64 -1.03 -0.16 0.00 1.02 0.00 0.00 30.24 30.71 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 -2.06 2.82 0.46 -1.09 0.41 -1.26 -4.89 118.70 113.08 1s6q s GLU 344 Ca -0.01 -0.94 0.10 0.00 -0.41 0.00 0.00 54.97 53.71 1s6q s GLU 344 Cb 0.01 -2.64 0.34 0.00 -1.78 0.00 0.00 34.13 30.05 1s6q s GLU 344 CO 0.06 -0.29 0.83 -2.30 -0.49 0.00 0.00 175.26 173.07 1s6q n PRO 345 N 4.58 0.02 0.00 0.39 -0.02 -1.26 -3.63 135.00 135.07 1s6q n PRO 345 Ca -0.19 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1s6q n PRO 345 Cb 0.48 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 1s6q n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1s6q n PHE 346 N -2.33 0.00 -2.17 6.00 3.01 -1.26 -4.99 117.46 115.72 1s6q n PHE 346 Ca 0.09 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.16 1s6q n PHE 346 Cb 0.92 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 40.38 1s6q n PHE 346 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1s6q s LYS 347 N 0.00 4.06 0.71 -1.08 2.47 -1.24 -5.01 119.74 119.65 1s6q s LYS 347 Ca 0.00 2.02 -0.01 0.00 -1.56 0.00 0.00 55.97 56.42 1s6q s LYS 347 Cb 0.00 -2.77 0.11 0.00 -1.46 0.00 0.00 37.83 33.71 1s6q s LYS 347 CO 0.00 -0.37 0.98 -0.80 0.16 0.00 0.00 175.35 175.32 1s6q s ASN 348 N -0.87 4.44 -0.11 1.43 0.01 -1.26 -4.50 114.94 114.08 1s6q s ASN 348 Ca 0.56 -0.25 0.03 0.00 -0.71 0.00 0.00 52.86 52.48 1s6q s ASN 348 Cb -0.35 -0.19 -0.08 0.00 0.41 0.00 0.00 41.25 41.04 1s6q s ASN 348 CO 0.45 -1.79 -0.07 -0.11 -1.51 0.00 0.00 177.10 174.07 1s6q n LEU 349 N -2.81 2.22 -3.64 0.60 7.94 0.12 -0.86 117.00 120.57 1s6q n LEU 349 Ca 0.14 -0.05 -0.04 0.00 -1.11 0.00 0.00 56.01 54.95 1s6q n LEU 349 Cb 0.60 -0.24 -0.01 0.00 0.53 0.00 0.00 43.42 44.30 1s6q n LEU 349 CO 0.43 0.57 0.81 -0.75 -1.11 0.00 0.00 177.39 177.35 1s6q s LYS 350 N -2.22 0.82 0.21 1.96 2.20 -0.83 -4.55 119.74 117.33 1s6q s LYS 350 Ca -0.12 -0.41 -0.07 0.00 -0.36 0.00 0.00 55.97 55.01 1s6q s LYS 350 Cb 0.04 0.31 -0.02 0.00 -1.51 0.00 0.00 37.83 36.65 1s6q s LYS 350 CO 0.29 -0.37 0.30 0.95 -0.36 0.00 0.00 175.35 176.15 1s6q s THR 351 N -2.96 0.02 0.01 3.43 -4.23 0.15 0.47 115.64 112.53 1s6q s THR 351 Ca 0.10 -1.63 -0.15 0.00 -1.18 0.00 0.00 61.69 58.82 1s6q s THR 351 Cb 0.00 -2.22 0.05 0.00 1.34 0.00 0.00 72.50 71.67 1s6q s THR 351 CO -0.03 -0.08 0.70 0.61 -0.54 0.00 0.00 174.62 175.28 1s6q n GLY 352 N -0.29 0.50 3.15 3.99 0.00 0.82 -3.93 105.19 109.42 1s6q n GLY 352 Ca -0.02 -0.98 -0.08 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.01 0.80 -0.19 1.61 -2.85 -1.26 -1.39 119.74 114.45 1s6q s LYS 353 Ca 0.16 -1.26 -0.04 0.00 -1.00 0.00 0.00 55.97 53.83 1s6q s LYS 353 Cb -0.01 0.25 0.09 0.00 -2.06 0.00 0.00 37.83 36.11 1s6q s LYS 353 CO 0.00 -0.21 0.30 -0.47 0.10 0.00 0.00 175.35 175.07 1s6q s TYR 354 N -3.96 -0.52 -0.17 1.78 5.04 0.10 -4.98 117.35 114.64 1s6q s TYR 354 Ca 0.14 0.77 0.01 0.00 -2.44 0.00 0.00 57.07 55.54 1s6q s TYR 354 Cb 0.07 -0.09 0.02 0.00 0.35 0.00 0.00 41.96 42.32 1s6q s TYR 354 CO -0.05 -0.54 -0.17 0.00 -1.34 0.00 0.00 175.55 173.46 1s6q s ALA 355 N 2.44 2.12 -0.87 3.97 0.00 -1.25 -2.08 121.76 126.10 1s6q s ALA 355 Ca 0.06 -1.10 -0.25 0.00 0.00 0.00 0.00 51.96 50.66 1s6q s ALA 355 Cb -0.14 -1.14 -0.11 0.00 0.00 0.00 0.00 23.12 21.73 1s6q s ALA 355 CO -0.12 -0.40 2.22 0.50 0.00 0.00 0.00 175.76 177.96 1s6q s ARG 356 N 1.37 1.90 0.07 0.00 6.06 -1.16 -4.67 118.95 122.53 1s6q s ARG 356 Ca 0.04 0.10 -0.15 0.00 -2.50 0.00 0.00 55.73 53.23 1s6q s ARG 356 Cb -0.13 -4.91 -0.23 0.00 0.06 0.00 0.00 34.95 29.74 1s6q s ARG 356 CO -0.12 -4.18 1.19 0.52 -2.50 0.00 0.00 175.30 170.21 1s6q h MET 357 N 12.03 0.68 -6.15 5.12 2.86 -1.96 -3.46 114.93 124.04 1s6q h MET 357 Ca 0.04 -0.71 -0.74 0.00 -2.06 0.00 0.00 59.70 56.23 1s6q h MET 357 Cb 1.00 0.20 0.04 0.00 0.06 0.00 0.00 31.60 32.90 1s6q h MET 357 CO 1.08 1.30 0.46 0.54 1.06 0.00 0.00 176.91 181.34 1s6q n ARG 358 N -3.91 0.73 0.00 1.72 1.74 -1.26 -4.70 116.66 110.99 1s6q n ARG 358 Ca -0.11 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 1s6q n ARG 358 Cb 0.85 -1.87 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 1s6q n ARG 358 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s6q n GLY 359 N 2.71 2.74 0.57 -0.13 0.00 -1.26 -4.68 105.19 105.13 1s6q n GLY 359 Ca 0.22 -0.39 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 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 9.43 1.60 -2.85 4.61 0.00 -1.26 -5.08 120.51 126.97 1s6q n ALA 360 Ca 0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 53.44 53.17 1s6q n ALA 360 Cb 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 19.45 19.30 1s6q n ALA 360 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1s6q s HIS 361 N 0.00 -1.37 0.15 0.00 3.76 -1.26 -4.77 115.29 111.81 1s6q s HIS 361 Ca 0.00 -0.69 0.08 0.00 -0.15 0.00 0.00 55.06 54.31 1s6q s HIS 361 Cb 0.00 0.20 -0.04 0.00 1.11 0.00 0.00 32.58 33.85 1s6q s HIS 361 CO 0.00 -1.23 -0.18 0.99 -0.85 0.00 0.00 174.74 173.46 1s6q s THR 362 N 0.86 1.78 0.40 1.30 2.01 -1.26 -4.98 115.64 115.75 1s6q s THR 362 Ca 0.29 -1.86 -0.03 0.00 0.31 0.00 0.00 61.69 60.41 1s6q s THR 362 Cb -0.00 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 1s6q s THR 362 CO -0.06 -0.28 0.65 0.21 -0.69 0.00 0.00 174.62 174.45 1s6q s ASN 363 N -2.55 6.31 0.32 3.53 3.84 -1.26 -4.09 114.94 121.05 1s6q s ASN 363 Ca 0.14 0.70 0.08 0.00 0.21 0.00 0.00 52.86 53.99 1s6q s ASN 363 Cb -0.06 -2.14 0.56 0.00 -0.55 0.00 0.00 41.25 39.05 1s6q s ASN 363 CO 0.06 -0.40 1.77 0.44 -2.79 0.00 0.00 177.10 176.18 1s6q h ASP 364 N 0.67 0.22 0.40 -4.21 5.19 -1.94 -2.46 116.42 114.28 1s6q h ASP 364 Ca -0.48 -0.08 -0.27 0.00 -0.62 0.00 0.00 57.03 55.57 1s6q h ASP 364 Cb 1.21 -0.06 0.01 0.00 0.18 0.00 0.00 39.33 40.67 1s6q h ASP 364 CO 0.62 0.55 -1.19 0.58 -3.12 0.00 0.00 179.24 176.68 1s6q h VAL 365 N 0.19 1.40 -0.11 -1.35 2.07 -1.95 -2.51 116.25 113.99 1s6q h VAL 365 Ca 0.02 -2.73 -0.01 0.00 0.82 0.00 0.00 66.70 64.81 1s6q h VAL 365 Cb 0.69 2.76 -0.00 0.00 -1.52 0.00 0.00 31.29 33.22 1s6q h VAL 365 CO 0.05 0.81 0.04 0.50 0.02 0.00 0.00 177.57 178.99 1s6q h LYS 366 N 0.17 0.17 -0.66 1.57 3.64 -1.95 -2.83 116.57 116.68 1s6q h LYS 366 Ca -0.15 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.25 1s6q h LYS 366 Cb 1.88 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 33.62 1s6q h LYS 366 CO 0.21 0.28 0.39 0.37 -2.27 0.00 0.00 179.45 178.43 1s6q h GLN 367 N 0.02 0.72 -0.92 1.90 4.15 -1.51 0.07 115.11 119.54 1s6q h GLN 367 Ca 0.04 -0.04 0.18 0.00 0.77 0.00 0.00 58.65 59.59 1s6q h GLN 367 Cb 0.18 -0.16 -0.08 0.00 0.21 0.00 0.00 27.48 27.63 1s6q h GLN 367 CO -0.00 0.48 0.59 1.25 -1.93 0.00 0.00 178.83 179.22 1s6q h LEU 368 N 0.74 0.56 -0.01 -2.39 5.85 -1.25 -0.87 115.31 117.95 1s6q h LEU 368 Ca 0.28 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 59.03 1s6q h LEU 368 Cb 0.10 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1s6q h LEU 368 CO -0.14 0.24 -0.07 0.74 -0.34 0.00 0.00 178.44 178.87 1s6q h THR 369 N 0.57 1.56 -1.00 1.05 2.02 -0.84 -1.38 112.91 114.87 1s6q h THR 369 Ca 0.48 -1.72 0.23 0.00 0.77 0.00 0.00 66.41 66.17 1s6q h THR 369 Cb 0.97 2.69 -0.10 0.00 -1.74 0.00 0.00 68.15 69.97 1s6q h THR 369 CO -0.22 0.46 0.63 -0.33 0.37 0.00 0.00 175.52 176.42 1s6q h GLU 370 N -0.63 0.52 0.46 6.66 5.08 -0.37 0.11 114.58 126.40 1s6q h GLU 370 Ca -0.01 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1s6q h GLU 370 Cb 0.78 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1s6q h GLU 370 CO 0.01 0.34 -0.22 0.00 -1.00 0.00 0.00 179.01 178.15 1s6q h ALA 371 N 1.65 -0.90 -1.13 3.43 0.00 -1.04 0.26 119.26 121.52 1s6q h ALA 371 Ca 0.58 -0.13 0.40 0.00 0.00 0.00 0.00 54.91 55.76 1s6q h ALA 371 Cb 1.23 0.24 -0.15 0.00 0.00 0.00 0.00 17.79 19.11 1s6q h ALA 371 CO -0.33 -0.85 0.67 0.28 0.00 0.00 0.00 179.25 179.02 1s6q h VAL 372 N -0.78 0.13 -0.09 0.00 2.07 -0.69 0.72 116.25 117.61 1s6q h VAL 372 Ca -0.06 -0.04 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 1s6q h VAL 372 Cb 0.47 -0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1s6q h VAL 372 CO 0.10 0.02 -0.10 -0.61 0.02 0.00 0.00 177.57 177.01 1s6q h GLN 373 N 0.12 0.22 -0.92 1.57 5.75 -0.52 -2.18 115.11 119.16 1s6q h GLN 373 Ca 0.81 -0.12 0.19 0.00 -0.15 0.00 0.00 58.65 59.37 1s6q h GLN 373 Cb 2.23 0.01 -0.07 0.00 1.07 0.00 0.00 27.48 30.71 1s6q h GLN 373 CO -0.58 0.65 0.59 -0.22 -2.65 0.00 0.00 178.83 176.63 1s6q h LYS 374 N -0.19 0.52 0.13 1.69 3.64 0.40 -1.33 116.57 121.43 1s6q h LYS 374 Ca 0.01 -0.03 -0.29 0.00 -1.27 0.00 0.00 60.65 59.07 1s6q h LYS 374 Cb 0.61 -0.12 0.02 0.00 -0.41 0.00 0.00 32.23 32.34 1s6q h LYS 374 CO 0.02 0.34 -1.25 0.82 -2.27 0.00 0.00 179.45 177.12 1s6q h ILE 375 N 0.54 1.33 -0.39 2.00 2.04 -1.31 -2.99 117.51 118.71 1s6q h ILE 375 Ca 0.48 -2.58 0.01 0.00 1.00 0.00 0.00 64.86 63.77 1s6q h ILE 375 Cb 1.02 2.75 -0.02 0.00 -0.74 0.00 0.00 36.82 39.83 1s6q h ILE 375 CO -0.22 0.78 0.26 0.74 0.00 0.00 0.00 178.15 179.71 1s6q h THR 376 N 0.22 1.09 -0.95 -0.27 2.02 -0.61 0.28 112.91 114.69 1s6q h THR 376 Ca -0.18 -0.18 0.07 0.00 0.77 0.00 0.00 66.41 66.89 1s6q h THR 376 Cb 1.93 0.52 -0.07 0.00 -1.74 0.00 0.00 68.15 68.79 1s6q h THR 376 CO 0.23 0.10 0.61 0.74 0.37 0.00 0.00 175.52 177.56 1s6q h THR 377 N 0.53 1.05 0.14 3.16 2.02 -1.37 -2.38 112.91 116.05 1s6q h THR 377 Ca 0.15 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 1s6q h THR 377 Cb -0.05 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.23 1s6q h THR 377 CO -0.04 0.20 -0.07 -0.08 0.37 0.00 0.00 175.52 175.91 1s6q h GLU 378 N 1.09 -0.18 -0.54 6.66 4.81 -0.88 -3.15 114.58 122.39 1s6q h GLU 378 Ca 0.42 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.68 1s6q h GLU 378 Cb 0.20 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1s6q h GLU 378 CO -0.18 0.08 0.34 0.77 -0.73 0.00 0.00 179.01 179.29 1s6q h SER 379 N -0.43 0.55 -0.95 1.04 0.02 -0.41 -0.69 113.55 112.67 1s6q h SER 379 Ca -0.02 -0.00 0.19 0.00 -0.84 0.00 0.00 61.79 61.12 1s6q h SER 379 Cb 0.35 -0.12 -0.11 0.00 0.14 0.00 0.00 62.40 62.66 1s6q h SER 379 CO 0.03 0.39 0.54 0.40 -1.14 0.00 0.00 176.83 177.05 1s6q h ILE 380 N 0.67 0.65 -0.09 3.27 2.04 -1.44 0.72 117.51 123.34 1s6q h ILE 380 Ca 0.21 -0.22 -0.13 0.00 1.00 0.00 0.00 64.86 65.72 1s6q h ILE 380 Cb -0.00 -0.06 0.01 0.00 -0.74 0.00 0.00 36.82 36.02 1s6q h ILE 380 CO -0.08 0.12 -0.44 0.58 0.00 0.00 0.00 178.15 178.32 1s6q h VAL 381 N 0.66 1.39 0.01 1.67 2.07 -1.35 -2.57 116.25 118.12 1s6q h VAL 381 Ca 0.56 -1.80 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 1s6q h VAL 381 Cb 0.91 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 1s6q h VAL 381 CO -0.41 0.53 -0.00 0.40 0.02 0.00 0.00 177.57 178.11 1s6q h ILE 382 N 0.02 1.62 0.00 4.57 2.04 0.29 -3.41 117.51 122.64 1s6q h ILE 382 Ca -0.03 -2.05 0.00 0.00 1.00 0.00 0.00 64.86 63.78 1s6q h ILE 382 Cb 1.09 2.98 0.00 0.00 -0.74 0.00 0.00 36.82 40.15 1s6q h ILE 382 CO 0.09 0.52 -0.55 0.79 0.00 0.00 0.00 178.15 179.00 1s6q n TRP 383 N -4.67 0.00 -0.98 1.37 8.01 0.24 -4.79 117.44 116.62 1s6q n TRP 383 Ca -0.09 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.10 1s6q n TRP 383 Cb 0.41 -0.01 0.00 0.00 -2.01 0.00 0.00 31.31 29.70 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 1.28 0.49 3.44 6.99 0.00 -0.82 -4.99 105.19 111.58 1s6q n GLY 384 Ca 0.02 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.36 1.31 0.03 1.61 -2.85 -1.26 -4.92 119.74 113.31 1s6q s LYS 385 Ca 0.00 -1.12 -0.13 0.00 -1.00 0.00 0.00 55.97 53.71 1s6q s LYS 385 Cb 0.00 0.43 -0.06 0.00 -2.06 0.00 0.00 37.83 36.15 1s6q s LYS 385 CO 0.00 -0.52 0.42 0.95 0.10 0.00 0.00 175.35 176.30 1s6q s THR 386 N -3.96 5.03 0.98 3.79 -4.23 -1.26 -3.83 115.64 112.16 1s6q s THR 386 Ca 0.17 0.74 -0.16 0.00 -1.18 0.00 0.00 61.69 61.26 1s6q s THR 386 Cb 0.01 -3.70 0.20 0.00 1.34 0.00 0.00 72.50 70.35 1s6q s THR 386 CO 0.02 0.48 1.26 -2.16 -0.54 0.00 0.00 174.62 173.68 1s6q s PRO 387 N -1.35 0.49 -0.15 3.99 0.04 -1.26 -4.86 135.00 131.90 1s6q s PRO 387 Ca 0.27 -0.25 -0.07 0.00 0.04 0.00 0.00 61.00 60.99 1s6q s PRO 387 Cb -0.16 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 1s6q s PRO 387 CO 0.15 -2.54 0.09 0.15 0.04 0.00 0.00 177.00 174.90 1s6q s LYS 388 N -5.74 3.65 0.16 4.56 1.02 0.22 -4.86 119.74 118.76 1s6q s LYS 388 Ca 0.72 -0.25 -0.01 0.00 0.02 0.00 0.00 55.97 56.45 1s6q s LYS 388 Cb -0.06 -3.17 -0.04 0.00 -0.52 0.00 0.00 37.83 34.03 1s6q s LYS 388 CO 0.53 0.54 0.35 -0.06 -0.92 0.00 0.00 175.35 175.79 1s6q s PHE 389 N -0.36 3.49 -0.18 3.18 0.08 -1.17 0.45 117.98 123.48 1s6q s PHE 389 Ca 0.10 0.33 -0.02 0.00 0.12 0.00 0.00 56.93 57.46 1s6q s PHE 389 Cb -0.12 -1.83 0.05 0.00 -0.57 0.00 0.00 43.02 40.55 1s6q s PHE 389 CO 0.01 0.44 0.00 0.15 -0.10 0.00 0.00 175.22 175.72 1s6q s LYS 390 N -3.09 0.93 0.02 0.44 1.02 0.38 -1.84 119.74 117.59 1s6q s LYS 390 Ca 0.38 -0.44 -0.04 0.00 0.02 0.00 0.00 55.97 55.89 1s6q s LYS 390 Cb -0.11 -1.99 -0.01 0.00 -0.52 0.00 0.00 37.83 35.20 1s6q s LYS 390 CO 0.28 -0.54 0.06 -0.51 -0.92 0.00 0.00 175.35 173.72 1s6q s LEU 391 N 1.77 1.89 -0.46 3.17 1.43 -1.04 -2.66 118.68 122.78 1s6q s LEU 391 Ca -0.00 -0.42 -0.05 0.00 -1.03 0.00 0.00 54.13 52.62 1s6q s LEU 391 Cb -0.16 0.45 -0.13 0.00 0.03 0.00 0.00 46.19 46.37 1s6q s LEU 391 CO -0.07 -0.39 2.52 -0.81 0.23 0.00 0.00 176.35 177.82 1s6q n PRO 392 N 1.26 1.85 -3.80 1.29 -0.04 -1.25 -1.62 135.00 132.69 1s6q n PRO 392 Ca -0.22 -1.09 -0.13 0.00 -0.04 0.00 0.00 63.50 62.03 1s6q n PRO 392 Cb 0.56 -2.13 -0.12 0.00 -0.04 0.00 0.00 33.50 31.77 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 2.22 -0.00 -0.20 0.52 2.07 -1.26 -1.17 121.20 123.38 1s6q s ILE 393 Ca 0.47 0.01 -0.09 0.00 -1.41 0.00 0.00 60.65 59.62 1s6q s ILE 393 Cb 0.18 -0.29 -0.05 0.00 0.13 0.00 0.00 42.46 42.44 1s6q s ILE 393 CO -0.02 0.00 0.11 -1.58 -1.91 0.00 0.00 174.94 171.55 1s6q s GLN 394 N 0.17 4.14 0.07 3.50 -0.44 -1.26 -4.68 119.66 121.15 1s6q s GLN 394 Ca -0.00 -0.25 -0.14 0.00 -2.50 0.00 0.00 55.36 52.47 1s6q s GLN 394 Cb -0.02 -3.37 -0.03 0.00 -1.64 0.00 0.00 33.01 27.95 1s6q s GLN 394 CO -0.00 0.29 0.73 1.17 0.50 0.00 0.00 175.29 177.98 1s6q n LYS 395 N 3.53 -0.19 -0.30 1.67 4.81 -1.26 0.16 118.16 126.58 1s6q n LYS 395 Ca -0.16 0.71 0.12 0.00 -0.87 0.00 0.00 58.31 58.11 1s6q n LYS 395 Cb 0.52 -1.05 0.24 0.00 0.02 0.00 0.00 35.03 34.76 1s6q n LYS 395 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1s6q n GLU 396 N -4.39 -0.07 0.00 1.64 4.07 -1.26 -0.57 120.64 120.06 1s6q n GLU 396 Ca 0.01 1.30 0.00 0.00 -0.06 0.00 0.00 57.16 58.41 1s6q n GLU 396 Cb 0.11 -2.06 0.00 0.00 -0.06 0.00 0.00 31.44 29.43 1s6q n GLU 396 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1s6q n THR 397 N -5.28 0.00 -0.04 6.31 -1.04 0.43 -2.17 114.28 112.49 1s6q n THR 397 Ca 0.20 0.96 -0.01 0.00 -2.04 0.00 0.00 64.05 63.16 1s6q n THR 397 Cb 0.64 -1.95 -0.01 0.00 -1.82 0.00 0.00 70.33 67.19 1s6q n THR 397 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 1s6q n TRP 398 N -0.48 -0.04 -0.32 -1.42 -0.00 -0.29 -0.16 117.44 114.72 1s6q n TRP 398 Ca 0.00 0.13 0.22 0.00 -0.00 0.00 0.00 57.50 57.84 1s6q n TRP 398 Cb 0.00 -0.40 0.49 0.00 -0.00 0.00 0.00 31.31 31.41 1s6q n TRP 398 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 177.69 179.18 1s6q h GLU 399 N 0.00 0.41 0.13 5.87 4.81 -0.97 0.21 114.58 125.05 1s6q h GLU 399 Ca 0.02 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1s6q h GLU 399 Cb 0.04 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 1s6q h GLU 399 CO -0.10 0.27 -0.26 1.15 -0.73 0.00 0.00 179.01 179.34 1s6q h THR 400 N 0.43 0.42 0.04 0.32 2.02 -0.05 -2.90 112.91 113.19 1s6q h THR 400 Ca 0.59 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.77 1s6q h THR 400 Cb 1.43 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 1s6q h THR 400 CO -0.30 0.00 -0.04 -0.25 0.37 0.00 0.00 175.52 175.30 1s6q h TRP 401 N -0.48 -0.11 0.00 3.16 -0.00 -0.18 -1.61 115.95 116.73 1s6q h TRP 401 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.92 1s6q h TRP 401 Cb 0.50 0.04 0.00 0.00 -0.00 0.00 0.00 29.16 29.71 1s6q h TRP 401 CO -0.23 -0.07 0.00 -2.67 -0.00 0.00 0.00 178.44 175.47 1s6q n TRP 402 N -5.15 0.09 -0.05 2.65 4.27 -0.82 0.12 117.44 118.55 1s6q n TRP 402 Ca -0.07 0.04 -0.15 0.00 -3.89 0.00 0.00 57.50 53.43 1s6q n TRP 402 Cb 0.08 -0.57 -0.14 0.00 -1.36 0.00 0.00 31.31 29.32 1s6q n TRP 402 CO 0.00 0.00 0.00 2.41 -2.29 0.00 0.00 177.69 177.81 1s6q n THR 403 N -1.59 1.59 0.05 -1.67 -1.04 -0.99 -4.29 114.28 106.35 1s6q n THR 403 Ca 0.01 -0.72 -0.11 0.00 -2.04 0.00 0.00 64.05 61.20 1s6q n THR 403 Cb 0.07 -1.22 -0.13 0.00 -1.82 0.00 0.00 70.33 67.24 1s6q n THR 403 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1s6q h GLU 404 N 0.02 0.08 -6.72 -2.82 5.08 0.32 -3.47 114.58 107.08 1s6q h GLU 404 Ca -0.45 -0.15 -0.52 0.00 -1.00 0.00 0.00 59.36 57.24 1s6q h GLU 404 Cb 2.04 0.05 0.05 0.00 0.50 0.00 0.00 28.75 31.39 1s6q h GLU 404 CO 0.03 0.93 0.72 -0.47 -1.00 0.00 0.00 179.01 179.22 1s6q s TYR 405 N -2.66 3.12 -0.34 4.33 5.04 0.32 -4.95 117.35 122.21 1s6q s TYR 405 Ca -0.03 1.11 0.26 0.00 -2.44 0.00 0.00 57.07 55.97 1s6q s TYR 405 Cb 0.08 -3.73 1.08 0.00 0.35 0.00 0.00 41.96 39.75 1s6q s TYR 405 CO 0.83 -2.34 1.78 0.11 -1.34 0.00 0.00 175.55 174.59 1s6q h TRP 406 N 5.16 0.00 -2.55 4.97 5.08 -1.90 -3.45 115.95 123.26 1s6q h TRP 406 Ca -0.45 0.00 -0.54 0.00 1.08 0.00 0.00 58.89 58.97 1s6q h TRP 406 Cb 1.22 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 27.35 1s6q h TRP 406 CO 0.61 0.00 -0.48 -1.14 -1.28 0.00 0.00 178.44 176.15 1s6q s GLN 407 N -3.41 3.37 0.04 0.12 0.74 -1.26 -5.10 119.66 114.17 1s6q s GLN 407 Ca 0.03 -0.64 -0.18 0.00 0.05 0.00 0.00 55.36 54.62 1s6q s GLN 407 Cb 0.09 -2.92 -0.06 0.00 1.10 0.00 0.00 33.01 31.22 1s6q s GLN 407 CO 0.42 0.51 0.52 0.00 -0.55 0.00 0.00 175.29 176.19 1s6q s ALA 408 N -1.76 3.62 0.33 1.58 0.00 -1.26 -5.02 121.76 119.25 1s6q s ALA 408 Ca 0.34 -0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.29 1s6q s ALA 408 Cb -0.11 -2.56 -0.01 0.00 0.00 0.00 0.00 23.12 20.44 1s6q s ALA 408 CO 0.28 0.41 0.14 0.25 0.00 0.00 0.00 175.76 176.84 1s6q n THR 409 N 1.81 0.00 -2.86 0.00 -2.24 -1.26 -5.13 114.28 104.59 1s6q n THR 409 Ca -0.11 -1.97 -0.09 0.00 -2.27 0.00 0.00 64.05 59.61 1s6q n THR 409 Cb 0.51 0.76 -0.00 0.00 -2.10 0.00 0.00 70.33 69.50 1s6q n THR 409 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1s6q n TRP 410 N -0.72 -3.24 -2.44 4.78 -0.00 -1.26 -5.11 117.44 109.44 1s6q n TRP 410 Ca -0.03 -1.77 -0.43 0.00 -0.00 0.00 0.00 57.50 55.27 1s6q n TRP 410 Cb 0.50 1.27 -0.02 0.00 -0.00 0.00 0.00 31.31 33.06 1s6q n TRP 410 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 177.69 176.19 1s6q s ILE 411 N 0.66 4.12 0.00 5.87 1.10 -1.26 -5.01 121.20 126.68 1s6q s ILE 411 Ca 0.31 1.22 0.00 0.00 -0.51 0.00 0.00 60.65 61.67 1s6q s ILE 411 Cb 0.05 -4.24 0.00 0.00 0.15 0.00 0.00 42.46 38.41 1s6q s ILE 411 CO -0.11 -0.61 0.00 -0.81 -2.11 0.00 0.00 174.94 171.30 1s6q n PRO 412 N 7.53 0.64 -1.62 3.50 -0.04 -1.26 -4.88 135.00 138.88 1s6q n PRO 412 Ca 0.15 0.00 -0.59 0.00 -0.04 0.00 0.00 63.50 63.01 1s6q n PRO 412 Cb 0.47 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.85 1s6q n PRO 412 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1s6q n GLU 413 N -0.28 0.47 -3.68 0.54 1.02 -1.26 -4.97 120.64 112.48 1s6q n GLU 413 Ca 0.00 0.17 -0.12 0.00 -0.02 0.00 0.00 57.16 57.20 1s6q n GLU 413 Cb 0.00 -1.74 -0.09 0.00 -0.02 0.00 0.00 31.44 29.60 1s6q n GLU 413 CO 0.00 0.00 0.00 1.67 1.18 0.00 0.00 177.13 179.98 1s6q s TRP 414 N 1.47 -0.70 -0.09 -0.32 1.48 -1.26 -3.02 118.94 116.50 1s6q s TRP 414 Ca 0.94 1.59 -0.01 0.00 -1.06 0.00 0.00 56.10 57.55 1s6q s TRP 414 Cb -1.22 0.31 -0.03 0.00 -1.16 0.00 0.00 33.47 31.37 1s6q s TRP 414 CO 0.62 -0.35 -0.03 -2.00 -4.06 0.00 0.00 176.95 171.13 1s6q s GLU 415 N 0.80 3.03 0.06 3.25 2.12 -0.77 -5.00 118.70 122.20 1s6q s GLU 415 Ca -0.04 -0.47 -0.30 0.00 0.36 0.00 0.00 54.97 54.51 1s6q s GLU 415 Cb -0.05 -2.75 -0.05 0.00 0.26 0.00 0.00 34.13 31.54 1s6q s GLU 415 CO -0.06 0.61 1.12 0.12 -0.54 0.00 0.00 175.26 176.50 1s6q s PHE 416 N -0.63 3.53 -0.43 5.30 5.36 -1.26 -2.50 117.98 127.35 1s6q s PHE 416 Ca 0.10 1.47 0.02 0.00 -0.96 0.00 0.00 56.93 57.56 1s6q s PHE 416 Cb -0.12 -3.30 0.12 0.00 -0.34 0.00 0.00 43.02 39.38 1s6q s PHE 416 CO 0.02 -0.78 0.17 0.08 -1.46 0.00 0.00 175.22 173.25 1s6q s VAL 417 N 0.84 2.68 -0.71 3.12 1.01 -0.64 -4.88 120.40 121.81 1s6q s VAL 417 Ca 0.55 -2.63 -0.26 0.00 0.00 0.00 0.00 61.98 59.65 1s6q s VAL 417 Cb -0.27 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 1s6q s VAL 417 CO 0.30 -0.70 1.92 0.21 0.00 0.00 0.00 175.10 176.83 1s6q s ASN 418 N 0.71 5.17 -0.29 3.32 2.47 -1.26 -3.93 114.94 121.13 1s6q s ASN 418 Ca 0.13 0.02 -0.14 0.00 0.42 0.00 0.00 52.86 53.28 1s6q s ASN 418 Cb -0.22 -2.54 0.10 0.00 -1.45 0.00 0.00 41.25 37.14 1s6q s ASN 418 CO -0.05 -2.55 0.69 0.42 -3.72 0.00 0.00 177.10 171.89 1s6q s THR 419 N 9.65 -0.31 0.44 -5.21 -4.23 -1.26 -5.14 115.64 109.57 1s6q s THR 419 Ca 0.70 0.00 -0.26 0.00 -1.18 0.00 0.00 61.69 60.95 1s6q s THR 419 Cb -0.11 -1.00 -0.08 0.00 1.34 0.00 0.00 72.50 72.65 1s6q s THR 419 CO 0.13 0.00 1.42 -2.84 -0.54 0.00 0.00 174.62 172.80 1s6q s PRO 420 N 2.03 3.74 0.66 3.99 0.02 -1.26 -4.48 135.00 139.69 1s6q s PRO 420 Ca -0.09 2.41 -0.11 0.00 0.02 0.00 0.00 61.00 63.23 1s6q s PRO 420 Cb -0.07 -2.69 0.17 0.00 0.02 0.00 0.00 34.50 31.93 1s6q s PRO 420 CO -0.19 -0.77 0.53 -0.35 -0.33 0.00 0.00 177.00 175.88 1s6q n PRO 421 N -0.12 -2.48 -3.75 5.54 -0.04 -1.26 -5.04 135.00 127.84 1s6q n PRO 421 Ca 0.05 -0.85 -0.14 0.00 -0.04 0.00 0.00 63.50 62.51 1s6q n PRO 421 Cb 0.42 -0.87 -0.15 0.00 -0.04 0.00 0.00 33.50 32.85 1s6q n PRO 421 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1s6q s LEU 422 N 0.00 0.82 -0.04 1.53 2.96 -1.26 -4.91 118.68 117.78 1s6q s LEU 422 Ca 0.36 0.20 -0.29 0.00 -0.22 0.00 0.00 54.13 54.18 1s6q s LEU 422 Cb -0.04 0.20 -0.03 0.00 0.50 0.00 0.00 46.19 46.82 1s6q s LEU 422 CO 0.28 -0.15 0.95 -0.69 -1.32 0.00 0.00 176.35 175.42 1s6q s VAL 423 N 1.18 4.87 -0.05 1.68 1.01 -0.32 -5.00 120.40 123.77 1s6q s VAL 423 Ca -0.09 1.97 -0.29 0.00 0.00 0.00 0.00 61.98 63.57 1s6q s VAL 423 Cb -0.12 -4.28 0.11 0.00 0.00 0.00 0.00 36.38 32.09 1s6q s VAL 423 CO -0.05 0.13 0.89 -1.59 0.00 0.00 0.00 175.10 174.48 1s6q s LYS 424 N 1.23 0.79 -0.02 2.72 -2.85 -1.26 -4.46 119.74 115.90 1s6q s LYS 424 Ca 0.49 -0.09 -0.30 0.00 -1.00 0.00 0.00 55.97 55.07 1s6q s LYS 424 Cb -0.20 0.37 -0.03 0.00 -2.06 0.00 0.00 37.83 35.91 1s6q s LYS 424 CO 0.24 -0.31 0.97 -0.51 0.10 0.00 0.00 175.35 175.85 1s6q s LEU 425 N -1.88 4.35 0.18 2.77 1.43 -1.26 -4.92 118.68 119.35 1s6q s LEU 425 Ca 0.01 1.62 0.24 0.00 -1.03 0.00 0.00 54.13 54.97 1s6q s LEU 425 Cb -0.01 -3.55 0.39 0.00 0.03 0.00 0.00 46.19 43.06 1s6q s LEU 425 CO -0.03 -0.28 1.40 -0.50 0.23 0.00 0.00 176.35 177.17 1s6q h TRP 426 N 6.84 0.00 -2.46 0.29 4.06 -1.98 -3.48 115.95 119.23 1s6q h TRP 426 Ca -0.40 0.00 0.16 0.00 2.06 0.00 0.00 58.89 60.71 1s6q h TRP 426 Cb 1.21 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 29.29 1s6q h TRP 426 CO 0.68 0.00 0.44 1.52 -3.56 0.00 0.00 178.44 177.52 1s6q s TYR 427 N -3.18 -0.14 -0.15 0.49 -0.85 -1.26 -4.82 117.35 107.43 1s6q s TYR 427 Ca 0.06 -0.20 -0.10 0.00 -0.52 0.00 0.00 57.07 56.31 1s6q s TYR 427 Cb 0.12 0.65 0.05 0.00 0.38 0.00 0.00 41.96 43.16 1s6q s TYR 427 CO 0.70 -0.90 0.39 -0.65 -1.52 0.00 0.00 175.55 173.56 1s6q s GLN 428 N -3.39 0.40 0.60 -3.49 -0.21 -1.26 -5.08 119.66 107.23 1s6q s GLN 428 Ca 0.12 0.67 -0.14 0.00 0.02 0.00 0.00 55.36 56.04 1s6q s GLN 428 Cb -0.02 0.06 -0.04 0.00 1.00 0.00 0.00 33.01 34.01 1s6q s GLN 428 CO 0.03 -0.12 1.04 -0.51 -2.12 0.00 0.00 175.29 173.61 1s6q s LEU 429 N 0.95 3.39 0.50 2.90 1.43 -1.26 -4.73 118.68 121.85 1s6q s LEU 429 Ca -0.06 1.64 -0.18 0.00 -1.03 0.00 0.00 54.13 54.50 1s6q s LEU 429 Cb -0.06 -4.51 -0.08 0.00 0.03 0.00 0.00 46.19 41.56 1s6q s LEU 429 CO -0.07 -1.05 0.98 -1.61 0.23 0.00 0.00 176.35 174.83 1s6q s GLU 430 N -4.51 3.99 0.00 1.70 0.41 0.58 -4.97 118.70 115.90 1s6q s GLU 430 Ca 0.60 1.01 0.24 0.00 -0.41 0.00 0.00 54.97 56.40 1s6q s GLU 430 Cb -0.13 -2.14 0.24 0.00 -1.78 0.00 0.00 34.13 30.31 1s6q s GLU 430 CO 0.43 -0.24 1.22 1.63 -0.49 0.00 0.00 175.26 177.82 1s6q n LYS 431 N -1.36 0.01 -4.02 1.61 5.02 -1.26 -4.72 118.16 113.44 1s6q n LYS 431 Ca 0.07 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.20 1s6q n LYS 431 Cb 0.54 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.89 1s6q n LYS 431 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1s6q s GLU 432 N -3.01 0.30 0.54 1.97 0.41 -1.26 -5.13 118.70 112.53 1s6q s GLU 432 Ca 0.10 -0.05 -0.20 0.00 -0.41 0.00 0.00 54.97 54.41 1s6q s GLU 432 Cb 0.17 -0.36 -0.08 0.00 -1.78 0.00 0.00 34.13 32.08 1s6q s GLU 432 CO 0.76 -0.00 0.76 -0.35 -0.49 0.00 0.00 175.26 175.94 1s6q n PRO 433 N 3.43 0.79 -3.31 0.39 -0.04 -1.26 -4.92 135.00 130.08 1s6q n PRO 433 Ca -0.18 0.30 -0.39 0.00 -0.04 0.00 0.00 63.50 63.19 1s6q n PRO 433 Cb 0.56 -1.91 -0.08 0.00 -0.04 0.00 0.00 33.50 32.03 1s6q n PRO 433 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1s6q s ILE 434 N -1.55 5.13 0.29 0.52 1.01 -1.26 -5.04 121.20 120.30 1s6q s ILE 434 Ca 0.70 0.80 -0.29 0.00 0.00 0.00 0.00 60.65 61.86 1s6q s ILE 434 Cb -0.47 -3.78 -0.10 0.00 0.01 0.00 0.00 42.46 38.12 1s6q s ILE 434 CO 0.52 0.17 1.29 -0.69 0.00 0.00 0.00 174.94 176.23 1s6q s VAL 435 N 1.80 2.93 0.00 2.92 1.01 -1.26 -3.10 120.40 124.70 1s6q s VAL 435 Ca 0.20 0.88 0.00 0.00 0.00 0.00 0.00 61.98 63.06 1s6q s VAL 435 Cb -0.15 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1s6q s VAL 435 CO 0.09 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1s6q n GLY 436 N 1.32 2.79 3.62 4.51 0.00 -1.26 -5.03 105.19 111.14 1s6q n GLY 436 Ca 0.02 -0.70 -0.46 0.00 0.00 0.00 0.00 46.02 44.87 1s6q n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s6q n ALA 437 N 0.00 0.10 -1.75 4.61 0.00 -1.18 -4.92 120.51 117.38 1s6q n ALA 437 Ca 0.00 0.42 -0.38 0.00 0.00 0.00 0.00 53.44 53.49 1s6q n ALA 437 Cb 0.00 -2.12 0.04 0.00 0.00 0.00 0.00 19.45 17.37 1s6q n ALA 437 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1s6q s GLU 438 N -0.77 3.12 -0.30 0.00 2.12 -1.26 -4.68 118.70 116.94 1s6q s GLU 438 Ca 0.67 2.10 -0.06 0.00 0.36 0.00 0.00 54.97 58.03 1s6q s GLU 438 Cb -0.73 -2.18 0.02 0.00 0.26 0.00 0.00 34.13 31.50 1s6q s GLU 438 CO 0.54 -1.16 0.07 0.99 -0.54 0.00 0.00 175.26 175.16 1s6q s THR 439 N -1.39 3.83 -0.25 -1.70 2.01 -1.26 -2.15 115.64 114.74 1s6q s THR 439 Ca 0.73 -0.82 -0.18 0.00 0.31 0.00 0.00 61.69 61.72 1s6q s THR 439 Cb -0.37 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.09 1s6q s THR 439 CO 0.43 0.03 0.54 -0.36 -0.69 0.00 0.00 174.62 174.57 1s6q s PHE 440 N 1.46 3.29 -1.15 4.92 0.40 0.18 -2.12 117.98 124.97 1s6q s PHE 440 Ca 0.01 0.70 -0.09 0.00 -0.60 0.00 0.00 56.93 56.95 1s6q s PHE 440 Cb -0.18 -2.73 0.25 0.00 0.51 0.00 0.00 43.02 40.87 1s6q s PHE 440 CO 0.02 -0.26 1.32 0.66 0.70 0.00 0.00 175.22 177.67 1s6q n TYR 441 N 5.43 4.47 -2.02 0.36 4.02 -0.63 -1.33 117.16 127.46 1s6q n TYR 441 Ca -0.04 -3.45 -0.34 0.00 -0.01 0.00 0.00 57.90 54.06 1s6q n TYR 441 Cb 0.50 -1.76 0.02 0.00 -0.02 0.00 0.00 39.34 38.08 1s6q n TYR 441 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1s6q s VAL 442 N -0.78 3.30 -0.02 -0.72 1.01 -0.87 -2.69 120.40 119.62 1s6q s VAL 442 Ca 0.34 0.69 -0.30 0.00 0.00 0.00 0.00 61.98 62.71 1s6q s VAL 442 Cb -0.04 -3.22 0.12 0.00 0.00 0.00 0.00 36.38 33.24 1s6q s VAL 442 CO -0.02 -0.29 1.25 -0.62 0.00 0.00 0.00 175.10 175.43 1s6q s ASP 443 N -2.25 -0.07 0.00 3.32 -1.08 -1.08 -4.54 116.67 110.97 1s6q s ASP 443 Ca 0.69 -0.14 0.00 0.00 -0.52 0.00 0.00 52.55 52.58 1s6q s ASP 443 Cb -0.21 0.19 0.00 0.00 -1.46 0.00 0.00 42.92 41.43 1s6q s ASP 443 CO 0.34 -0.34 0.00 0.61 0.52 0.00 0.00 175.17 176.30 1s6q n GLY 444 N -0.45 0.89 3.91 2.66 0.00 -1.26 -1.84 105.19 109.10 1s6q n GLY 444 Ca -0.08 0.58 -0.25 0.00 0.00 0.00 0.00 46.02 46.27 1s6q n GLY 444 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s6q s ALA 445 N 0.00 4.39 0.05 4.61 0.00 -1.15 -3.56 121.76 126.10 1s6q s ALA 445 Ca 0.00 -1.47 -0.12 0.00 0.00 0.00 0.00 51.96 50.36 1s6q s ALA 445 Cb 0.00 -0.84 0.02 0.00 0.00 0.00 0.00 23.12 22.29 1s6q s ALA 445 CO 0.00 -0.46 0.28 0.00 0.00 0.00 0.00 175.76 175.58 1s6q s ALA 446 N -2.72 -0.58 -0.38 0.00 0.00 -1.26 -2.37 121.76 114.44 1s6q s ALA 446 Ca 0.39 -0.13 -0.22 0.00 0.00 0.00 0.00 51.96 52.01 1s6q s ALA 446 Cb -0.03 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.47 1s6q s ALA 446 CO 0.24 -0.43 0.73 1.21 0.00 0.00 0.00 175.76 177.51 1s6q s ASN 447 N -2.22 6.47 0.57 0.00 3.84 0.18 -4.80 114.94 118.98 1s6q s ASN 447 Ca -0.03 0.16 0.27 0.00 0.21 0.00 0.00 52.86 53.46 1s6q s ASN 447 Cb 0.00 -2.37 1.65 0.00 -0.55 0.00 0.00 41.25 39.98 1s6q s ASN 447 CO -0.05 -0.72 2.17 0.03 -2.79 0.00 0.00 177.10 175.73 1s6q h ARG 448 N 8.59 0.00 0.00 0.43 3.08 -1.91 0.94 114.38 125.51 1s6q h ARG 448 Ca -0.25 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 1s6q h ARG 448 Cb 1.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.15 1s6q h ARG 448 CO 0.89 0.00 -0.50 0.93 -1.07 0.00 0.00 179.97 180.23 1s6q h GLU 449 N 0.00 0.00 0.00 0.04 3.07 -1.96 -3.39 114.58 112.34 1s6q h GLU 449 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1s6q h GLU 449 Cb 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 1s6q h GLU 449 CO -0.00 0.07 0.00 1.79 -1.40 0.00 0.00 179.01 179.47 1s6q h THR 450 N -1.00 0.00 -0.53 1.13 1.35 -1.95 -3.46 112.91 108.45 1s6q h THR 450 Ca -0.02 -0.47 -0.23 0.00 -0.55 0.00 0.00 66.41 65.14 1s6q h THR 450 Cb 0.51 1.39 -0.09 0.00 -1.73 0.00 0.00 68.15 68.23 1s6q h THR 450 CO -0.01 0.00 -0.20 0.29 -0.25 0.00 0.00 175.52 175.34 1s6q n LYS 451 N -2.44 -1.27 -4.32 4.72 5.02 0.32 -4.71 118.16 115.48 1s6q n LYS 451 Ca 0.04 0.85 -0.34 0.00 -2.02 0.00 0.00 58.31 56.84 1s6q n LYS 451 Cb 0.37 -5.04 -0.09 0.00 -0.02 0.00 0.00 35.03 30.25 1s6q n LYS 451 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1s6q s LEU 452 N -2.51 3.58 0.00 -0.35 1.43 -1.25 0.17 118.68 119.75 1s6q s LEU 452 Ca 0.00 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 1s6q s LEU 452 Cb 0.00 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.30 1s6q s LEU 452 CO 0.00 0.33 0.00 0.61 0.23 0.00 0.00 176.35 177.52 1s6q n GLY 453 N 1.80 2.57 3.46 -3.19 0.00 0.14 0.47 105.19 110.44 1s6q n GLY 453 Ca -0.17 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.05 1s6q n GLY 453 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s6q s LYS 454 N 1.14 1.12 -0.05 1.61 -2.85 -1.00 -0.49 119.74 119.22 1s6q s LYS 454 Ca 0.00 -0.32 -0.02 0.00 -1.00 0.00 0.00 55.97 54.63 1s6q s LYS 454 Cb 0.00 0.52 0.03 0.00 -2.06 0.00 0.00 37.83 36.32 1s6q s LYS 454 CO 0.00 -0.47 0.04 0.00 0.10 0.00 0.00 175.35 175.01 1s6q s ALA 455 N -3.20 0.41 0.00 0.59 0.00 -0.04 -2.95 121.76 116.57 1s6q s ALA 455 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1s6q s ALA 455 Cb -0.01 -0.66 0.00 0.00 0.00 0.00 0.00 23.12 22.46 1s6q s ALA 455 CO -0.09 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.62 1s6q n GLY 456 N 5.20 4.61 3.49 0.00 0.00 -0.77 -1.89 105.19 115.84 1s6q n GLY 456 Ca -0.05 -1.84 -0.14 0.00 0.00 0.00 0.00 46.02 43.99 1s6q n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1s6q s TYR 457 N -1.25 -0.54 -0.08 1.61 -0.00 -0.77 -2.63 117.35 113.69 1s6q s TYR 457 Ca 0.00 0.66 -0.03 0.00 -0.00 0.00 0.00 57.07 57.70 1s6q s TYR 457 Cb 0.00 0.49 0.04 0.00 -0.00 0.00 0.00 41.96 42.49 1s6q s TYR 457 CO 0.00 -0.66 0.10 0.08 -0.00 0.00 0.00 175.55 175.07 1s6q s VAL 458 N -2.36 -0.15 0.53 -3.49 1.01 -1.10 -2.78 120.40 112.07 1s6q s VAL 458 Ca -0.03 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.25 1s6q s VAL 458 Cb -0.01 -0.27 0.02 0.00 0.00 0.00 0.00 36.38 36.12 1s6q s VAL 458 CO -0.02 0.08 0.76 0.42 0.00 0.00 0.00 175.10 176.34 1s6q s THR 459 N 2.20 3.11 0.19 3.92 -4.23 0.05 -1.60 115.64 119.28 1s6q s THR 459 Ca 0.04 -0.57 -0.09 0.00 -1.18 0.00 0.00 61.69 59.89 1s6q s THR 459 Cb -0.13 -3.17 0.11 0.00 1.34 0.00 0.00 72.50 70.65 1s6q s THR 459 CO -0.05 -0.13 1.72 -0.55 -0.54 0.00 0.00 174.62 175.08 1s6q h ASN 460 N 0.14 1.03 0.00 3.99 -0.00 -1.76 -2.39 115.58 116.59 1s6q h ASN 460 Ca -0.44 -0.22 0.00 0.00 -0.00 0.00 0.00 56.30 55.65 1s6q h ASN 460 Cb 1.28 -0.27 0.00 0.00 -0.00 0.00 0.00 38.32 39.33 1s6q h ASN 460 CO 0.54 0.97 0.00 0.29 -0.00 0.00 0.00 177.43 179.24 1s6q n LYS 461 N -4.29 0.44 -0.17 4.14 5.02 -1.26 -4.82 118.16 117.22 1s6q n LYS 461 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1s6q n LYS 461 Cb 0.23 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.91 1s6q n LYS 461 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s6q n GLY 462 N -0.09 1.19 3.72 0.72 0.00 -0.90 -5.05 105.19 104.77 1s6q n GLY 462 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1s6q n GLY 462 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1s6q s ARG 463 N -0.52 4.43 0.28 1.61 3.52 -1.26 -4.81 118.95 122.20 1s6q s ARG 463 Ca 0.00 1.81 0.02 0.00 -0.13 0.00 0.00 55.73 57.43 1s6q s ARG 463 Cb 0.00 -3.32 -0.01 0.00 -1.56 0.00 0.00 34.95 30.06 1s6q s ARG 463 CO 0.00 -0.25 0.09 1.04 -0.81 0.00 0.00 175.30 175.37 1s6q n GLN 464 N 3.74 0.76 0.00 5.12 6.02 -1.26 -0.77 117.38 130.98 1s6q n GLN 464 Ca 0.08 -2.34 0.00 0.00 -0.01 0.00 0.00 57.00 54.73 1s6q n GLN 464 Cb 0.46 1.19 0.00 0.00 1.02 0.00 0.00 30.24 32.91 1s6q n GLN 464 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1s6q n LYS 465 N -0.65 0.00 -3.62 -1.09 4.81 -1.12 -4.95 118.16 111.55 1s6q n LYS 465 Ca -0.05 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.23 1s6q n LYS 465 Cb 0.41 0.00 -0.14 0.00 0.02 0.00 0.00 35.03 35.32 1s6q n LYS 465 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1s6q s VAL 466 N -1.34 -0.33 -0.12 3.15 1.01 -1.26 -1.85 120.40 119.66 1s6q s VAL 466 Ca 0.00 0.20 -0.03 0.00 0.00 0.00 0.00 61.98 62.14 1s6q s VAL 466 Cb 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 1s6q s VAL 466 CO 0.00 0.04 -0.01 -0.69 0.00 0.00 0.00 175.10 174.44 1s6q s VAL 467 N 2.34 4.20 0.06 2.92 1.01 -0.79 -4.95 120.40 125.19 1s6q s VAL 467 Ca 0.04 -0.27 -0.21 0.00 0.00 0.00 0.00 61.98 61.53 1s6q s VAL 467 Cb -0.13 -2.81 -0.06 0.00 0.00 0.00 0.00 36.38 33.38 1s6q s VAL 467 CO -0.08 0.55 0.64 -2.16 0.00 0.00 0.00 175.10 174.04 1s6q s PRO 468 N -0.29 4.34 -0.05 2.72 0.04 -1.26 -0.86 135.00 139.63 1s6q s PRO 468 Ca 0.06 0.85 0.03 0.00 0.04 0.00 0.00 61.00 61.98 1s6q s PRO 468 Cb -0.12 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 31.13 1s6q s PRO 468 CO 0.02 0.50 -0.13 -0.51 0.04 0.00 0.00 177.00 176.92 1s6q s LEU 469 N -0.70 1.77 -0.11 -3.56 1.43 0.35 -4.94 118.68 112.91 1s6q s LEU 469 Ca 0.32 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 1s6q s LEU 469 Cb -0.20 -0.82 -0.01 0.00 0.03 0.00 0.00 46.19 45.19 1s6q s LEU 469 CO 0.20 0.08 -0.16 0.42 0.23 0.00 0.00 176.35 177.13 1s6q s THR 470 N 0.36 2.82 -0.17 5.49 -4.23 -1.26 0.25 115.64 118.89 1s6q s THR 470 Ca -0.09 -0.75 -0.01 0.00 -1.18 0.00 0.00 61.69 59.66 1s6q s THR 470 Cb -0.13 -2.16 -0.01 0.00 1.34 0.00 0.00 72.50 71.55 1s6q s THR 470 CO 0.03 0.54 0.15 -3.20 -0.54 0.00 0.00 174.62 171.60 1s6q n ASN 471 N 3.39 -2.81 -3.79 3.99 5.15 0.45 -4.98 115.26 116.67 1s6q n ASN 471 Ca -0.18 -0.11 -0.09 0.00 -0.60 0.00 0.00 54.58 53.60 1s6q n ASN 471 Cb 0.53 -1.34 -0.04 0.00 -0.53 0.00 0.00 39.78 38.40 1s6q n ASN 471 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1s6q s THR 472 N -3.06 0.00 0.32 -0.44 -4.23 -0.44 -5.04 115.64 102.75 1s6q s THR 472 Ca 0.07 -1.29 0.09 0.00 -1.18 0.00 0.00 61.69 59.38 1s6q s THR 472 Cb -0.01 -2.26 -0.05 0.00 1.34 0.00 0.00 72.50 71.52 1s6q s THR 472 CO 0.13 0.00 0.06 0.42 -0.54 0.00 0.00 174.62 174.69 1s6q s THR 473 N -3.74 3.05 0.20 3.99 -4.23 -1.26 -4.58 115.64 109.08 1s6q s THR 473 Ca 0.20 -1.83 -0.10 0.00 -1.18 0.00 0.00 61.69 58.77 1s6q s THR 473 Cb -0.02 -2.89 0.13 0.00 1.34 0.00 0.00 72.50 71.06 1s6q s THR 473 CO 0.10 -0.25 1.83 0.78 -0.54 0.00 0.00 174.62 176.54 1s6q h ASN 474 N 1.72 0.62 -0.99 3.99 2.35 -1.90 0.14 115.58 121.50 1s6q h ASN 474 Ca -0.44 0.01 0.05 0.00 -0.55 0.00 0.00 56.30 55.37 1s6q h ASN 474 Cb 1.25 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 39.44 1s6q h ASN 474 CO 0.63 0.42 0.65 1.56 -1.65 0.00 0.00 177.43 179.04 1s6q h GLN 475 N 0.75 1.19 -0.75 0.81 4.20 -1.96 0.49 115.11 119.83 1s6q h GLN 475 Ca 0.28 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.89 1s6q h GLN 475 Cb 0.08 -0.27 -0.04 0.00 0.30 0.00 0.00 27.48 27.56 1s6q h GLN 475 CO -0.13 0.79 0.40 0.87 -0.67 0.00 0.00 178.83 180.08 1s6q h LYS 476 N 1.23 1.06 -0.03 1.46 1.79 -1.18 -2.45 116.57 118.45 1s6q h LYS 476 Ca 0.41 -0.13 -0.05 0.00 -2.18 0.00 0.00 60.65 58.70 1s6q h LYS 476 Cb 0.05 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.50 1s6q h LYS 476 CO -0.14 0.80 -0.16 1.79 -1.08 0.00 0.00 179.45 180.66 1s6q h THR 477 N 1.05 1.50 0.00 -0.16 1.35 -0.50 -1.49 112.91 114.65 1s6q h THR 477 Ca 0.26 -1.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.42 1s6q h THR 477 Cb 0.06 2.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 1s6q h THR 477 CO -0.04 0.46 0.20 -0.62 -0.25 0.00 0.00 175.52 175.27 1s6q n GLU 478 N -4.59 0.00 -0.01 4.72 1.02 0.17 0.18 120.64 122.11 1s6q n GLU 478 Ca -0.09 0.26 0.02 0.00 -0.02 0.00 0.00 57.16 57.33 1s6q n GLU 478 Cb 0.43 -1.70 -0.07 0.00 -0.02 0.00 0.00 31.44 30.08 1s6q n GLU 478 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1s6q n LEU 479 N -1.24 0.00 0.15 -4.62 4.77 -0.93 -4.33 117.00 110.80 1s6q n LEU 479 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 1s6q n LEU 479 Cb 0.20 0.06 0.06 0.00 -2.33 0.00 0.00 43.42 41.41 1s6q n LEU 479 CO 0.00 0.06 0.36 -0.61 -1.33 0.00 0.00 177.39 175.86 1s6q h GLN 480 N 0.00 0.00 -0.20 3.23 5.75 0.29 -2.36 115.11 121.82 1s6q h GLN 480 Ca -0.06 0.00 -0.21 0.00 -0.15 0.00 0.00 58.65 58.23 1s6q h GLN 480 Cb 0.72 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.27 1s6q h GLN 480 CO 0.00 0.08 -0.69 0.00 -2.65 0.00 0.00 178.83 175.58 1s6q h ALA 481 N 1.89 0.40 -0.24 3.38 0.00 -0.72 -0.90 119.26 123.07 1s6q h ALA 481 Ca -0.02 -0.57 -0.18 0.00 0.00 0.00 0.00 54.91 54.15 1s6q h ALA 481 Cb 1.09 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1s6q h ALA 481 CO 0.01 0.69 -0.57 0.82 0.00 0.00 0.00 179.25 180.20 1s6q h ILE 482 N 0.57 1.29 0.00 0.00 2.04 -1.75 -2.05 117.51 117.62 1s6q h ILE 482 Ca -0.03 -1.78 -0.00 0.00 1.00 0.00 0.00 64.86 64.05 1s6q h ILE 482 Cb 1.30 1.71 -0.00 0.00 -0.74 0.00 0.00 36.82 39.10 1s6q h ILE 482 CO 0.14 0.57 -0.00 0.22 0.00 0.00 0.00 178.15 179.08 1s6q h TYR 483 N 0.57 0.00 0.07 1.37 3.20 -1.28 -2.39 116.97 118.51 1s6q h TYR 483 Ca 0.01 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1s6q h TYR 483 Cb 1.15 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.42 1s6q h TYR 483 CO 0.06 0.00 -0.04 1.25 -1.64 0.00 0.00 178.16 177.80 1s6q h LEU 484 N 0.00 -0.08 -0.21 2.82 5.85 -0.60 -2.27 115.31 120.82 1s6q h LEU 484 Ca -0.00 -0.52 0.05 0.00 0.84 0.00 0.00 57.88 58.25 1s6q h LEU 484 Cb 0.43 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.42 1s6q h LEU 484 CO 0.00 0.54 -0.16 0.00 -0.34 0.00 0.00 178.44 178.48 1s6q h ALA 485 N -0.00 -0.02 -0.79 1.25 0.00 -1.23 -1.80 119.26 116.67 1s6q h ALA 485 Ca -0.01 0.08 0.13 0.00 0.00 0.00 0.00 54.91 55.11 1s6q h ALA 485 Cb 0.60 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 1s6q h ALA 485 CO 0.02 -0.59 0.38 -0.07 0.00 0.00 0.00 179.25 178.99 1s6q h LEU 486 N -0.16 0.45 -1.00 0.00 3.38 -1.44 0.47 115.31 117.00 1s6q h LEU 486 Ca 0.12 0.09 -0.08 0.00 0.09 0.00 0.00 57.88 58.10 1s6q h LEU 486 Cb 0.35 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1s6q h LEU 486 CO -0.31 0.21 -0.13 1.56 0.09 0.00 0.00 178.44 179.86 1s6q h GLN 487 N 0.58 0.58 0.00 1.13 4.20 -0.72 -3.14 115.11 117.73 1s6q h GLN 487 Ca 0.42 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.95 1s6q h GLN 487 Cb 0.57 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1s6q h GLN 487 CO -0.35 0.69 -1.07 -0.25 -0.67 0.00 0.00 178.83 177.18 1s6q n ASP 488 N -4.18 0.67 -3.88 1.46 8.00 -0.76 -4.95 116.55 112.90 1s6q n ASP 488 Ca 0.01 0.13 -0.30 0.00 0.71 0.00 0.00 54.79 55.34 1s6q n ASP 488 Cb 0.34 0.67 0.22 0.00 -0.02 0.00 0.00 41.12 42.34 1s6q n ASP 488 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1s6q s SER 489 N -4.75 1.71 0.00 -2.24 1.04 0.16 -5.08 113.70 104.54 1s6q s SER 489 Ca 0.01 0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.87 1s6q s SER 489 Cb 0.12 -0.56 0.00 0.00 0.10 0.00 0.00 66.02 65.68 1s6q s SER 489 CO 0.80 -3.62 0.00 0.61 0.98 0.00 0.00 173.24 172.01 1s6q n GLY 490 N -2.14 1.64 0.11 7.32 0.00 -1.26 -5.00 105.19 105.86 1s6q n GLY 490 Ca 0.15 -1.88 0.13 0.00 0.00 0.00 0.00 46.02 44.42 1s6q n GLY 490 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s6q n LEU 491 N 0.00 0.82 -3.81 0.99 4.77 -1.26 -4.63 117.00 113.88 1s6q n LEU 491 Ca 0.00 0.59 -0.26 0.00 -0.03 0.00 0.00 56.01 56.31 1s6q n LEU 491 Cb 0.00 -0.34 -0.17 0.00 -2.33 0.00 0.00 43.42 40.58 1s6q n LEU 491 CO 0.00 -0.22 -0.40 -1.61 -1.33 0.00 0.00 177.39 173.83 1s6q s GLU 492 N -3.12 0.92 0.05 3.23 2.02 -1.26 -1.99 118.70 118.56 1s6q s GLU 492 Ca 0.10 -0.18 0.03 0.00 0.02 0.00 0.00 54.97 54.94 1s6q s GLU 492 Cb 0.12 -1.51 -0.03 0.00 0.10 0.00 0.00 34.13 32.81 1s6q s GLU 492 CO 0.58 -0.39 -0.10 0.54 0.02 0.00 0.00 175.26 175.91 1s6q s VAL 493 N 1.84 0.75 -0.25 2.63 0.11 0.04 -4.10 120.40 121.44 1s6q s VAL 493 Ca 0.03 -1.14 -0.03 0.00 -2.93 0.00 0.00 61.98 57.91 1s6q s VAL 493 Cb -0.14 -0.78 0.02 0.00 -1.53 0.00 0.00 36.38 33.95 1s6q s VAL 493 CO -0.07 -0.31 -0.04 0.20 -3.33 0.00 0.00 175.10 171.55 1s6q s ASN 494 N -1.60 4.38 -0.10 3.54 -0.87 -0.91 -1.34 114.94 118.03 1s6q s ASN 494 Ca -0.07 -0.73 0.03 0.00 -1.57 0.00 0.00 52.86 50.52 1s6q s ASN 494 Cb -0.10 -1.70 -0.01 0.00 -0.02 0.00 0.00 41.25 39.42 1s6q s ASN 494 CO 0.01 -0.11 -0.20 -0.63 -2.57 0.00 0.00 177.10 173.60 1s6q s ILE 495 N 1.38 2.40 -0.13 0.60 1.01 0.64 0.51 121.20 127.60 1s6q s ILE 495 Ca 0.02 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1s6q s ILE 495 Cb -0.16 -1.94 0.00 0.00 0.01 0.00 0.00 42.46 40.37 1s6q s ILE 495 CO -0.04 0.55 -0.20 -0.69 0.00 0.00 0.00 174.94 174.57 1s6q s VAL 496 N 0.26 2.35 0.10 2.92 1.01 -0.44 0.56 120.40 127.15 1s6q s VAL 496 Ca -0.14 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.02 1s6q s VAL 496 Cb -0.17 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1s6q s VAL 496 CO 0.07 0.54 -0.20 -0.89 0.00 0.00 0.00 175.10 174.63 1s6q s THR 497 N 0.62 1.61 -0.57 3.92 2.01 0.72 -2.06 115.64 121.89 1s6q s THR 497 Ca -0.10 -1.52 0.02 0.00 0.31 0.00 0.00 61.69 60.40 1s6q s THR 497 Cb -0.16 -1.48 0.42 0.00 0.01 0.00 0.00 72.50 71.29 1s6q s THR 497 CO 0.03 -0.10 1.63 -0.90 -0.69 0.00 0.00 174.62 174.59 1s6q n ASP 498 N 1.09 6.36 -3.53 3.53 5.75 -1.26 -2.01 116.55 126.48 1s6q n ASP 498 Ca -0.20 -3.78 -0.27 0.00 -0.01 0.00 0.00 54.79 50.54 1s6q n ASP 498 Cb 0.54 -0.73 -0.15 0.00 -1.03 0.00 0.00 41.12 39.75 1s6q n ASP 498 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1s6q s SER 499 N -2.44 3.14 0.54 -1.12 0.15 -1.26 -4.37 113.70 108.35 1s6q s SER 499 Ca 0.55 -1.13 0.29 0.00 0.70 0.00 0.00 55.95 56.35 1s6q s SER 499 Cb 0.45 -0.22 1.55 0.00 -1.71 0.00 0.00 66.02 66.09 1s6q s SER 499 CO -0.13 -0.42 2.11 1.56 1.20 0.00 0.00 173.24 177.56 1s6q h GLN 500 N 8.39 0.00 0.53 5.44 4.20 -1.93 -0.08 115.11 131.67 1s6q h GLN 500 Ca -0.19 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.50 1s6q h GLN 500 Cb 1.04 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.82 1s6q h GLN 500 CO 0.41 0.09 -0.25 -0.92 -0.67 0.00 0.00 178.83 177.49 1s6q h TYR 501 N 0.00 -0.66 -0.79 2.96 3.20 -1.99 -0.35 116.97 119.34 1s6q h TYR 501 Ca -0.00 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.91 1s6q h TYR 501 Cb 0.27 0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.71 1s6q h TYR 501 CO 0.00 -0.41 0.52 0.00 -1.64 0.00 0.00 178.16 176.63 1s6q h ALA 502 N -1.55 1.61 -1.67 1.82 0.00 -1.81 -2.04 119.26 115.61 1s6q h ALA 502 Ca -0.07 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1s6q h ALA 502 Cb 0.54 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1s6q h ALA 502 CO 0.12 0.28 0.00 -0.11 0.00 0.00 0.00 179.25 179.54 1s6q n LEU 503 N -4.48 0.00 -0.30 0.00 7.94 -0.06 -2.16 117.00 117.95 1s6q n LEU 503 Ca 0.11 0.72 0.13 0.00 -1.11 0.00 0.00 56.01 55.87 1s6q n LEU 503 Cb 0.19 -0.22 0.29 0.00 0.53 0.00 0.00 43.42 44.21 1s6q n LEU 503 CO 0.34 -0.22 0.91 1.23 -1.11 0.00 0.00 177.39 178.53 1s6q h GLY 504 N 0.00 1.32 0.39 -3.96 0.00 -0.94 0.52 103.07 100.40 1s6q h GLY 504 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 1s6q h GLY 504 CO 0.00 -0.41 -0.47 -2.22 0.00 0.00 0.00 176.54 173.44 1s6q h ILE 505 N 0.15 0.00 -0.50 2.60 2.04 -1.37 0.21 117.51 120.64 1s6q h ILE 505 Ca 0.56 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.52 1s6q h ILE 505 Cb 1.15 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.14 1s6q h ILE 505 CO -0.71 0.00 -0.02 0.40 0.00 0.00 0.00 178.15 177.82 1s6q h ILE 506 N -0.88 0.59 -0.93 -0.67 5.03 -0.83 -2.08 117.51 117.75 1s6q h ILE 506 Ca -0.05 -0.03 0.11 0.00 -0.12 0.00 0.00 64.86 64.77 1s6q h ILE 506 Cb 0.78 0.49 -0.07 0.00 -3.03 0.00 0.00 36.82 34.99 1s6q h ILE 506 CO -0.10 0.02 0.60 1.56 -0.68 0.00 0.00 178.15 179.55 1s6q h GLN 507 N 0.10 0.89 -0.51 2.37 4.20 -0.23 -1.05 115.11 120.87 1s6q h GLN 507 Ca 0.25 -0.05 0.15 0.00 0.06 0.00 0.00 58.65 59.05 1s6q h GLN 507 Cb 0.38 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 1s6q h GLN 507 CO -0.43 0.59 0.57 0.00 -0.67 0.00 0.00 178.83 178.89 1s6q h ALA 508 N 1.55 2.24 -3.81 3.87 0.00 0.13 -3.45 119.26 119.80 1s6q h ALA 508 Ca 0.44 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.17 1s6q h ALA 508 Cb 0.45 0.04 0.08 0.00 0.00 0.00 0.00 17.79 18.37 1s6q h ALA 508 CO -0.20 -0.84 -0.38 1.04 0.00 0.00 0.00 179.25 178.87 1s6q n GLN 509 N -3.61 -3.25 -1.67 0.00 6.02 -0.40 -4.84 117.38 109.63 1s6q n GLN 509 Ca 0.10 0.42 -0.45 0.00 -0.01 0.00 0.00 57.00 57.06 1s6q n GLN 509 Cb 0.77 -4.16 -0.04 0.00 1.02 0.00 0.00 30.24 27.83 1s6q n GLN 509 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1s6q n PRO 510 N -2.54 2.53 -0.19 -1.09 -0.02 -1.26 -4.77 135.00 127.65 1s6q n PRO 510 Ca -0.14 0.93 -0.07 0.00 -2.02 0.00 0.00 63.50 62.19 1s6q n PRO 510 Cb 0.58 -2.82 0.02 0.00 -0.02 0.00 0.00 33.50 31.27 1s6q n PRO 510 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1s6q h ASP 511 N 9.42 0.69 -1.46 2.55 3.04 -1.91 -3.47 116.42 125.28 1s6q h ASP 511 Ca -0.48 -0.10 -0.01 0.00 -3.24 0.00 0.00 57.03 53.19 1s6q h ASP 511 Cb 1.25 -0.18 -0.00 0.00 -1.04 0.00 0.00 39.33 39.36 1s6q h ASP 511 CO 0.94 0.59 0.01 0.29 -2.04 0.00 0.00 179.24 179.03 1s6q n LYS 512 N -4.61 0.10 0.00 4.15 4.76 -1.26 -5.01 118.16 116.30 1s6q n LYS 512 Ca 0.03 -0.26 0.00 0.00 -2.87 0.00 0.00 58.31 55.21 1s6q n LYS 512 Cb 0.09 0.29 0.00 0.00 -1.84 0.00 0.00 35.03 33.57 1s6q n LYS 512 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1s6q n SER 513 N -1.47 0.00 0.22 4.39 2.88 -1.26 -4.37 113.62 114.01 1s6q n SER 513 Ca -0.01 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.69 1s6q n SER 513 Cb 0.06 0.00 0.63 0.00 -0.75 0.00 0.00 64.21 64.15 1s6q n SER 513 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1s6q h GLU 514 N 0.00 0.00 -5.18 -1.46 4.57 -2.01 -3.40 114.58 107.10 1s6q h GLU 514 Ca 0.00 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.07 1s6q h GLU 514 Cb 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 1s6q h GLU 514 CO 0.00 0.00 0.70 0.45 -1.18 0.00 0.00 179.01 178.98 1s6q n SER 515 N -2.75 0.48 -0.13 1.04 2.88 -1.26 -4.65 113.62 109.22 1s6q n SER 515 Ca 0.01 -1.31 0.23 0.00 -1.33 0.00 0.00 58.87 56.47 1s6q n SER 515 Cb 0.27 -1.25 0.35 0.00 -0.75 0.00 0.00 64.21 62.83 1s6q n SER 515 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1s6q n GLU 516 N 7.42 0.02 0.27 -1.46 2.13 -1.26 -0.09 120.64 127.66 1s6q n GLU 516 Ca 0.50 0.95 -0.11 0.00 0.66 0.00 0.00 57.16 59.16 1s6q n GLU 516 Cb 0.35 -2.40 -0.05 0.00 0.27 0.00 0.00 31.44 29.61 1s6q n GLU 516 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1s6q h LEU 517 N 0.00 -0.62 -2.04 4.31 5.85 -1.93 -2.06 115.31 118.82 1s6q h LEU 517 Ca 0.40 0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.27 1s6q h LEU 517 Cb 2.66 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 43.83 1s6q h LEU 517 CO -0.00 -0.25 0.35 0.58 -0.34 0.00 0.00 178.44 178.78 1s6q h VAL 518 N -1.13 0.61 0.06 1.05 2.07 -0.85 -1.42 116.25 116.64 1s6q h VAL 518 Ca -0.07 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 1s6q h VAL 518 Cb 0.56 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1s6q h VAL 518 CO 0.12 0.00 -0.03 0.78 0.02 0.00 0.00 177.57 178.47 1s6q h ASN 519 N 0.00 -0.06 -0.97 0.57 4.21 -1.28 0.83 115.58 118.87 1s6q h ASN 519 Ca 0.20 -0.45 0.10 0.00 1.21 0.00 0.00 56.30 57.35 1s6q h ASN 519 Cb 0.89 0.02 -0.07 0.00 -1.12 0.00 0.00 38.32 38.04 1s6q h ASN 519 CO -0.00 0.44 0.62 1.56 -1.29 0.00 0.00 177.43 178.76 1s6q h GLN 520 N -0.59 0.99 0.45 0.81 4.20 -0.65 0.24 115.11 120.56 1s6q h GLN 520 Ca -0.01 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1s6q h GLN 520 Cb 0.51 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1s6q h GLN 520 CO 0.01 0.65 -0.22 0.82 -0.67 0.00 0.00 178.83 179.43 1s6q h ILE 521 N 1.02 0.46 -0.94 2.54 2.04 -1.05 -1.88 117.51 119.69 1s6q h ILE 521 Ca 0.46 -0.44 0.21 0.00 1.00 0.00 0.00 64.86 66.09 1s6q h ILE 521 Cb 0.37 0.64 -0.12 0.00 -0.74 0.00 0.00 36.82 36.97 1s6q h ILE 521 CO -0.21 0.07 0.50 0.40 0.00 0.00 0.00 178.15 178.90 1s6q h ILE 522 N -0.90 0.56 0.00 -0.67 2.04 0.15 0.13 117.51 118.82 1s6q h ILE 522 Ca -0.06 -0.19 -0.08 0.00 1.00 0.00 0.00 64.86 65.53 1s6q h ILE 522 Cb 0.57 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1s6q h ILE 522 CO 0.10 0.10 -0.36 -0.33 0.00 0.00 0.00 178.15 177.66 1s6q h GLU 523 N 0.54 0.00 -0.11 2.37 5.08 -0.35 -1.60 114.58 120.52 1s6q h GLU 523 Ca 0.58 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.85 1s6q h GLU 523 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1s6q h GLU 523 CO -0.47 0.36 -0.28 1.96 -1.00 0.00 0.00 179.01 179.59 1s6q h GLN 524 N 0.00 0.39 -0.88 2.33 1.08 -0.19 -1.20 115.11 116.63 1s6q h GLN 524 Ca -0.00 -0.27 0.11 0.00 -1.45 0.00 0.00 58.65 57.04 1s6q h GLN 524 Cb 0.68 0.04 -0.07 0.00 -0.05 0.00 0.00 27.48 28.09 1s6q h GLN 524 CO 0.05 0.88 0.57 -0.07 -0.95 0.00 0.00 178.83 179.30 1s6q h LEU 525 N -0.04 0.75 -0.77 1.46 3.38 -0.82 0.12 115.31 119.38 1s6q h LEU 525 Ca -0.00 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 1s6q h LEU 525 Cb 0.89 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1s6q h LEU 525 CO 0.06 0.43 -0.47 0.40 0.09 0.00 0.00 178.44 178.95 1s6q h ILE 526 N 0.82 1.33 0.00 1.22 2.04 -1.00 -2.84 117.51 119.08 1s6q h ILE 526 Ca 0.42 -1.67 0.00 0.00 1.00 0.00 0.00 64.86 64.61 1s6q h ILE 526 Cb 0.50 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.31 1s6q h ILE 526 CO -0.18 0.50 0.00 1.17 0.00 0.00 0.00 178.15 179.64 1s6q n LYS 527 N -3.98 0.15 -1.95 2.37 4.81 0.25 -4.85 118.16 114.96 1s6q n LYS 527 Ca -0.02 0.16 -0.29 0.00 -0.87 0.00 0.00 58.31 57.29 1s6q n LYS 527 Cb 0.53 -1.69 0.14 0.00 0.02 0.00 0.00 35.03 34.03 1s6q n LYS 527 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1s6q s LYS 528 N -3.08 1.20 -0.11 1.64 -0.14 -0.27 -5.02 119.74 113.96 1s6q s LYS 528 Ca 0.11 -0.24 -0.07 0.00 -1.36 0.00 0.00 55.97 54.41 1s6q s LYS 528 Cb 0.14 -1.91 -0.05 0.00 -1.68 0.00 0.00 37.83 34.33 1s6q s LYS 528 CO 0.54 -2.05 -0.17 -1.91 -0.76 0.00 0.00 175.35 171.00 1s6q n GLU 529 N -3.55 0.27 -3.70 1.68 2.13 -0.84 -5.00 120.64 111.63 1s6q n GLU 529 Ca 0.12 0.12 -0.20 0.00 0.66 0.00 0.00 57.16 57.86 1s6q n GLU 529 Cb 0.60 -0.96 -0.18 0.00 0.27 0.00 0.00 31.44 31.17 1s6q n GLU 529 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1s6q s LYS 530 N -2.29 0.03 0.03 5.31 1.02 -0.88 -5.03 119.74 117.92 1s6q s LYS 530 Ca -0.17 0.32 0.08 0.00 0.02 0.00 0.00 55.97 56.21 1s6q s LYS 530 Cb 0.06 -0.55 -0.02 0.00 -0.52 0.00 0.00 37.83 36.79 1s6q s LYS 530 CO 0.23 -0.31 -0.22 0.08 -0.92 0.00 0.00 175.35 174.21 1s6q s VAL 531 N 2.02 1.79 -0.05 3.17 1.01 -1.26 -0.78 120.40 126.30 1s6q s VAL 531 Ca 0.03 -1.17 -0.01 0.00 0.00 0.00 0.00 61.98 60.83 1s6q s VAL 531 Cb -0.12 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.76 1s6q s VAL 531 CO -0.03 0.32 0.02 -0.47 0.00 0.00 0.00 175.10 174.93 1s6q s TYR 532 N -0.72 0.37 0.06 5.22 6.14 -0.45 -0.30 117.35 127.66 1s6q s TYR 532 Ca 0.09 0.02 0.02 0.00 0.64 0.00 0.00 57.07 57.83 1s6q s TYR 532 Cb -0.09 -0.58 -0.04 0.00 0.42 0.00 0.00 41.96 41.67 1s6q s TYR 532 CO 0.01 -0.22 0.11 -0.51 0.64 0.00 0.00 175.55 175.58 1s6q s LEU 533 N 1.73 3.95 -0.05 6.97 1.43 -1.26 -0.26 118.68 131.19 1s6q s LEU 533 Ca 0.00 0.09 -0.03 0.00 -1.03 0.00 0.00 54.13 53.16 1s6q s LEU 533 Cb -0.13 -2.55 0.03 0.00 0.03 0.00 0.00 46.19 43.57 1s6q s LEU 533 CO -0.03 0.19 0.12 0.00 0.23 0.00 0.00 176.35 176.86 1s6q s ALA 534 N -1.38 -0.22 0.36 4.21 0.00 0.19 -4.92 121.76 120.00 1s6q s ALA 534 Ca 0.29 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1s6q s ALA 534 Cb -0.12 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 1s6q s ALA 534 CO 0.22 -0.13 0.57 -0.46 0.00 0.00 0.00 175.76 175.96 1s6q s TRP 535 N 0.93 3.46 -0.28 0.00 -0.00 -1.26 -0.20 118.94 121.59 1s6q s TRP 535 Ca -0.07 0.34 -0.24 0.00 -0.00 0.00 0.00 56.10 56.12 1s6q s TRP 535 Cb -0.09 -1.95 0.10 0.00 -0.00 0.00 0.00 33.47 31.52 1s6q s TRP 535 CO -0.04 0.05 0.89 0.08 -0.00 0.00 0.00 176.95 177.93 1s6q s VAL 536 N -2.35 0.00 -0.17 5.86 1.01 -0.85 -4.87 120.40 119.02 1s6q s VAL 536 Ca 0.41 0.00 -0.31 0.00 0.00 0.00 0.00 61.98 62.09 1s6q s VAL 536 Cb -0.10 -1.00 -0.08 0.00 0.00 0.00 0.00 36.38 35.21 1s6q s VAL 536 CO 0.36 0.00 2.13 -2.65 0.00 0.00 0.00 175.10 174.94 1s6q n PRO 537 N 2.54 2.01 0.00 2.72 -0.02 -1.26 -4.15 135.00 136.85 1s6q n PRO 537 Ca -0.14 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1s6q n PRO 537 Cb 0.56 -2.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.05 1s6q n PRO 537 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s6q n ALA 538 N 9.91 0.00 -0.70 3.55 0.00 -1.26 -4.39 120.51 127.62 1s6q n ALA 538 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1s6q n ALA 538 Cb 0.38 0.21 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1s6q n ALA 538 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1s6q n HIS 539 N -1.16 0.00 -1.57 0.00 8.25 -1.26 -4.61 115.22 114.87 1s6q n HIS 539 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.07 1s6q n HIS 539 Cb 0.00 -0.15 -0.03 0.00 1.12 0.00 0.00 29.99 30.93 1s6q n HIS 539 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 1s6q n LYS 540 N -0.94 1.36 0.00 -0.41 2.85 -1.26 -4.51 118.16 115.24 1s6q n LYS 540 Ca 0.00 0.19 0.00 0.00 -1.05 0.00 0.00 58.31 57.45 1s6q n LYS 540 Cb 0.00 -3.34 0.00 0.00 -0.65 0.00 0.00 35.03 31.04 1s6q n LYS 540 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1s6q n GLY 541 N 5.94 -0.57 3.41 2.58 0.00 -1.26 -4.76 105.19 110.52 1s6q n GLY 541 Ca 0.35 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 1s6q n GLY 541 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1s6q n ILE 542 N 0.00 0.00 0.40 -0.61 5.41 -1.26 -4.96 119.36 118.33 1s6q n ILE 542 Ca 0.00 -0.28 0.06 0.00 1.00 0.00 0.00 62.75 63.53 1s6q n ILE 542 Cb 0.00 -0.77 -0.08 0.00 -0.71 0.00 0.00 39.64 38.09 1s6q n ILE 542 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1s6q n GLY 543 N 1.42 -0.25 0.15 7.39 0.00 -1.26 -4.52 105.19 108.11 1s6q n GLY 543 Ca 0.04 -0.32 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 1s6q n GLY 543 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1s6q h GLY 544 N 2.65 0.44 0.87 -0.02 0.00 -1.95 -1.06 103.07 104.00 1s6q h GLY 544 Ca 0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 1s6q h GLY 544 CO 0.00 0.37 -0.10 3.43 0.00 0.00 0.00 176.54 180.24 1s6q h ASN 545 N 0.09 -0.24 -0.36 0.19 2.35 -1.83 -2.83 115.58 112.95 1s6q h ASN 545 Ca 0.04 -0.09 0.08 0.00 -0.55 0.00 0.00 56.30 55.77 1s6q h ASN 545 Cb 0.60 0.06 -0.07 0.00 0.05 0.00 0.00 38.32 38.96 1s6q h ASN 545 CO 0.03 -0.05 -0.13 -0.08 -1.65 0.00 0.00 177.43 175.54 1s6q h GLU 546 N -0.41 -0.06 -0.00 0.81 4.22 -1.79 0.65 114.58 117.99 1s6q h GLU 546 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.42 1s6q h GLU 546 Cb 0.32 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1s6q h GLU 546 CO 0.05 -0.04 0.45 1.96 -2.18 0.00 0.00 179.01 179.25 1s6q h GLN 547 N -0.06 0.00 0.00 1.92 4.20 -1.00 0.62 115.11 120.78 1s6q h GLN 547 Ca 0.18 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.83 1s6q h GLN 547 Cb 0.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1s6q h GLN 547 CO -0.40 0.00 -2.02 0.28 -0.67 0.00 0.00 178.83 176.02 1s6q n VAL 548 N -2.82 0.21 0.09 -0.54 0.31 0.11 -3.93 118.33 111.76 1s6q n VAL 548 Ca -0.02 -0.53 0.05 0.00 -0.01 0.00 0.00 64.34 63.83 1s6q n VAL 548 Cb 0.49 -0.06 -0.01 0.00 -0.91 0.00 0.00 33.84 33.35 1s6q n VAL 548 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1s6q h ASP 549 N 0.00 0.00 -0.28 4.52 3.32 0.12 0.35 116.42 124.45 1s6q h ASP 549 Ca -0.08 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.84 1s6q h ASP 549 Cb 1.16 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 1s6q h ASP 549 CO 0.00 0.34 -0.33 0.50 -1.72 0.00 0.00 179.24 178.04 1s6q h LYS 550 N 0.00 0.73 0.44 3.56 3.64 -0.75 -3.06 116.57 121.13 1s6q h LYS 550 Ca -0.07 -0.40 -0.02 0.00 -1.27 0.00 0.00 60.65 58.89 1s6q h LYS 550 Cb 1.32 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.16 1s6q h LYS 550 CO 0.03 1.02 -0.31 -0.07 -2.27 0.00 0.00 179.45 177.86 1s6q h LEU 551 N 0.47 -0.79 0.00 5.20 3.38 -1.66 -3.52 115.31 118.39 1s6q h LEU 551 Ca 0.04 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1s6q h LEU 551 Cb 0.91 0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1s6q h LEU 551 CO 0.08 -0.45 0.00 0.52 0.09 0.00 0.00 178.44 178.68