#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kd9 s LEU 3 N 0.00 4.12 0.07 1.04 1.98 -1.26 -4.90 118.68 119.73 3kd9 s LEU 3 Ca 0.00 1.45 0.07 0.00 -2.89 0.00 0.00 54.13 52.76 3kd9 s LEU 3 Cb 0.00 -3.54 -0.04 0.00 0.66 0.00 0.00 46.19 43.27 3kd9 s LEU 3 CO 0.00 -0.68 -0.17 -0.54 -1.89 0.00 0.00 176.35 173.07 3kd9 s LYS 4 N 3.20 2.01 -0.19 1.98 -0.14 -1.26 -5.03 119.74 120.31 3kd9 s LYS 4 Ca 0.46 -1.03 -0.06 0.00 -1.36 0.00 0.00 55.97 53.98 3kd9 s LYS 4 Cb -0.16 -2.19 -0.03 0.00 -1.68 0.00 0.00 37.83 33.77 3kd9 s LYS 4 CO 0.08 0.52 0.02 0.15 -0.76 0.00 0.00 175.35 175.36 3kd9 s LYS 5 N -1.71 3.77 -0.12 1.68 1.02 -1.26 -2.30 119.74 120.82 3kd9 s LYS 5 Ca 0.16 -0.45 0.01 0.00 0.02 0.00 0.00 55.97 55.71 3kd9 s LYS 5 Cb -0.11 -3.11 -0.01 0.00 -0.52 0.00 0.00 37.83 34.09 3kd9 s LYS 5 CO 0.07 0.16 -0.16 0.08 -0.92 0.00 0.00 175.35 174.59 3kd9 s VAL 6 N 0.64 2.84 -0.10 3.17 1.01 0.21 -0.82 120.40 127.35 3kd9 s VAL 6 Ca 0.01 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.27 3kd9 s VAL 6 Cb -0.14 -2.17 0.01 0.00 0.00 0.00 0.00 36.38 34.09 3kd9 s VAL 6 CO 0.02 0.53 -0.17 -0.69 0.00 0.00 0.00 175.10 174.80 3kd9 s VAL 7 N 0.29 1.58 -0.22 2.92 1.01 -0.18 -1.19 120.40 124.62 3kd9 s VAL 7 Ca -0.12 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.17 3kd9 s VAL 7 Cb -0.16 -1.42 0.04 0.00 0.00 0.00 0.00 36.38 34.84 3kd9 s VAL 7 CO 0.06 0.46 -0.15 -0.63 0.00 0.00 0.00 175.10 174.84 3kd9 s ILE 8 N 0.77 2.16 -1.24 2.22 1.01 -0.62 -0.07 121.20 125.43 3kd9 s ILE 8 Ca -0.11 -1.28 -0.12 0.00 0.00 0.00 0.00 60.65 59.14 3kd9 s ILE 8 Cb -0.16 -2.10 0.17 0.00 0.01 0.00 0.00 42.46 40.38 3kd9 s ILE 8 CO 0.02 0.24 1.65 -0.38 0.00 0.00 0.00 174.94 176.47 3kd9 n ILE 9 N 4.53 4.31 0.00 2.92 5.41 -0.36 -1.19 119.36 134.98 3kd9 n ILE 9 Ca -0.17 -4.58 0.00 0.00 1.00 0.00 0.00 62.75 59.00 3kd9 n ILE 9 Cb 0.46 -2.41 0.00 0.00 -0.71 0.00 0.00 39.64 36.98 3kd9 n ILE 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3kd9 n GLY 10 N 3.45 -0.31 1.97 7.39 0.00 -0.80 -1.38 105.19 115.50 3kd9 n GLY 10 Ca 0.38 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.71 3kd9 n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kd9 n GLY 11 N 0.00 1.52 0.00 -0.02 0.00 -1.26 -4.17 105.19 101.26 3kd9 n GLY 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3kd9 n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kd9 n GLY 12 N -2.00 -0.33 0.33 -0.02 0.00 -1.26 -3.28 105.19 98.63 3kd9 n GLY 12 Ca 0.00 -1.79 -0.08 0.00 0.00 0.00 0.00 46.02 44.15 3kd9 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kd9 h ALA 13 N -1.38 -0.23 -0.12 4.61 0.00 -1.91 -1.53 119.26 118.71 3kd9 h ALA 13 Ca 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3kd9 h ALA 13 Cb 0.00 0.65 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3kd9 h ALA 13 CO 0.00 -0.74 0.03 0.00 0.00 0.00 0.00 179.25 178.55 3kd9 h ALA 14 N 0.67 0.16 -0.61 0.00 0.00 -1.89 -2.72 119.26 114.86 3kd9 h ALA 14 Ca 0.15 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.97 3kd9 h ALA 14 Cb 0.53 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3kd9 h ALA 14 CO -0.46 -0.21 0.34 0.78 0.00 0.00 0.00 179.25 179.70 3kd9 h GLY 15 N -0.00 0.89 1.47 0.00 0.00 -1.74 0.20 103.07 103.88 3kd9 h GLY 15 Ca 0.04 -0.24 -0.12 0.00 0.00 0.00 0.00 47.33 47.00 3kd9 h GLY 15 CO 0.00 0.16 -0.34 -0.33 0.00 0.00 0.00 176.54 176.03 3kd9 h MET 16 N 0.65 0.60 -0.56 4.80 2.86 -1.33 0.15 114.93 122.09 3kd9 h MET 16 Ca 0.27 -0.28 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 3kd9 h MET 16 Cb 0.14 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 3kd9 h MET 16 CO -0.16 0.86 0.08 0.77 1.06 0.00 0.00 176.91 179.52 3kd9 h SER 17 N 0.51 0.91 0.43 1.22 0.02 -1.07 -1.30 113.55 114.26 3kd9 h SER 17 Ca 0.05 -0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 60.72 3kd9 h SER 17 Cb 0.83 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.14 3kd9 h SER 17 CO 0.07 0.94 -0.20 0.00 -1.14 0.00 0.00 176.83 176.50 3kd9 h ALA 18 N 1.00 -0.57 -0.43 3.77 0.00 -0.76 -1.91 119.26 120.35 3kd9 h ALA 18 Ca 0.17 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.98 3kd9 h ALA 18 Cb 0.43 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.35 3kd9 h ALA 18 CO 0.01 -0.70 -0.33 0.00 0.00 0.00 0.00 179.25 178.23 3kd9 h ALA 19 N -0.35 -0.17 -0.80 0.00 0.00 -0.91 -1.29 119.26 115.75 3kd9 h ALA 19 Ca -0.06 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3kd9 h ALA 19 Cb 0.54 0.72 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 3kd9 h ALA 19 CO 0.10 -0.72 0.50 1.03 0.00 0.00 0.00 179.25 180.15 3kd9 h SER 20 N -0.24 0.94 -0.36 0.00 0.87 -1.25 -1.72 113.55 111.79 3kd9 h SER 20 Ca 0.18 -0.04 -0.14 0.00 -1.23 0.00 0.00 61.79 60.55 3kd9 h SER 20 Cb 0.54 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 3kd9 h SER 20 CO -0.56 0.71 -0.32 -0.09 -0.53 0.00 0.00 176.83 176.04 3kd9 h ARG 21 N 1.09 0.89 0.00 2.24 9.65 -0.45 -1.53 114.38 126.28 3kd9 h ARG 21 Ca 0.29 -0.43 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 3kd9 h ARG 21 Cb -0.07 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.50 3kd9 h ARG 21 CO -0.06 1.08 -0.05 -0.24 2.80 0.00 0.00 179.97 183.50 3kd9 h VAL 22 N 0.74 0.00 0.17 0.20 3.04 -1.15 -2.92 116.25 116.33 3kd9 h VAL 22 Ca 0.08 -0.98 -0.31 0.00 -1.01 0.00 0.00 66.70 64.48 3kd9 h VAL 22 Cb 0.89 1.96 0.03 0.00 -2.01 0.00 0.00 31.29 32.16 3kd9 h VAL 22 CO 0.08 0.00 -1.33 0.50 -1.01 0.00 0.00 177.57 175.82 3kd9 h LYS 23 N 0.00 0.56 0.00 4.17 1.63 -1.10 -0.13 116.57 121.71 3kd9 h LYS 23 Ca 0.00 -0.83 -0.09 0.00 -0.85 0.00 0.00 60.65 58.88 3kd9 h LYS 23 Cb 0.99 0.29 -0.01 0.00 -0.60 0.00 0.00 32.23 32.90 3kd9 h LYS 23 CO 0.00 1.38 -0.42 -0.09 -3.45 0.00 0.00 179.45 176.88 3kd9 h ARG 24 N 0.22 0.00 0.03 1.90 2.43 -1.32 -2.59 114.38 115.05 3kd9 h ARG 24 Ca -0.21 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 58.69 3kd9 h ARG 24 Cb 2.01 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 31.52 3kd9 h ARG 24 CO 0.25 0.42 -1.45 -0.07 -1.51 0.00 0.00 179.97 177.60 3kd9 h LEU 25 N 0.00 0.10 -6.31 3.80 3.38 -1.52 -3.41 115.31 111.35 3kd9 h LEU 25 Ca -0.00 -0.16 -0.59 0.00 0.09 0.00 0.00 57.88 57.23 3kd9 h LEU 25 Cb 0.87 -0.03 -0.39 0.00 0.09 0.00 0.00 40.66 41.20 3kd9 h LEU 25 CO 0.05 1.13 -0.91 0.29 0.09 0.00 0.00 178.44 179.09 3kd9 n LYS 26 N -3.25 0.94 0.12 1.13 4.76 -0.06 -4.97 118.16 116.83 3kd9 n LYS 26 Ca -0.12 -3.59 0.17 0.00 -2.87 0.00 0.00 58.31 51.90 3kd9 n LYS 26 Cb 1.01 -1.68 0.73 0.00 -1.84 0.00 0.00 35.03 33.26 3kd9 n LYS 26 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 3kd9 h PRO 27 N 4.82 0.00 0.00 1.97 0.11 -1.70 -1.70 132.00 135.50 3kd9 h PRO 27 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 3kd9 h PRO 27 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3kd9 h PRO 27 CO 0.52 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.40 3kd9 n GLU 28 N -4.17 0.22 -2.04 1.05 0.00 -1.26 -4.86 120.64 109.58 3kd9 n GLU 28 Ca 0.04 0.24 -0.30 0.00 0.00 0.00 0.00 57.16 57.14 3kd9 n GLU 28 Cb 0.42 -1.79 0.01 0.00 0.00 0.00 0.00 31.44 30.08 3kd9 n GLU 28 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 3kd9 s TRP 29 N -3.13 3.59 -0.36 4.31 0.52 -0.64 -4.80 118.94 118.42 3kd9 s TRP 29 Ca 0.10 1.16 -0.13 0.00 0.02 0.00 0.00 56.10 57.25 3kd9 s TRP 29 Cb 0.12 -2.66 0.00 0.00 -1.15 0.00 0.00 33.47 29.79 3kd9 s TRP 29 CO 0.54 -0.64 0.24 0.34 0.02 0.00 0.00 176.95 177.45 3kd9 s ASP 30 N -4.18 5.94 -0.23 2.95 2.15 -0.97 -5.01 116.67 117.32 3kd9 s ASP 30 Ca 0.54 -0.69 -0.04 0.00 0.43 0.00 0.00 52.55 52.78 3kd9 s ASP 30 Cb -0.11 -2.10 -0.01 0.00 -0.30 0.00 0.00 42.92 40.40 3kd9 s ASP 30 CO 0.52 -0.33 -0.02 -0.69 -0.17 0.00 0.00 175.17 174.48 3kd9 s VAL 31 N 1.66 3.53 0.12 1.11 1.01 -1.26 -0.62 120.40 125.96 3kd9 s VAL 31 Ca 0.05 -0.48 0.09 0.00 0.00 0.00 0.00 61.98 61.64 3kd9 s VAL 31 Cb -0.18 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 3kd9 s VAL 31 CO 0.09 0.38 -0.18 -0.54 0.00 0.00 0.00 175.10 174.85 3kd9 s LYS 32 N 1.49 1.77 -0.06 2.72 1.02 -0.33 -1.58 119.74 124.78 3kd9 s LYS 32 Ca 0.05 -1.20 -0.01 0.00 0.02 0.00 0.00 55.97 54.83 3kd9 s LYS 32 Cb -0.15 -2.10 0.03 0.00 -0.52 0.00 0.00 37.83 35.09 3kd9 s LYS 32 CO -0.02 0.47 -0.01 0.08 -0.92 0.00 0.00 175.35 174.95 3kd9 s VAL 33 N -1.19 0.40 -0.33 3.17 1.01 -0.54 -1.60 120.40 121.32 3kd9 s VAL 33 Ca 0.18 0.06 -0.09 0.00 0.00 0.00 0.00 61.98 62.13 3kd9 s VAL 33 Cb -0.10 -0.52 0.01 0.00 0.00 0.00 0.00 36.38 35.77 3kd9 s VAL 33 CO 0.10 0.24 0.15 -0.36 0.00 0.00 0.00 175.10 175.23 3kd9 s PHE 34 N 1.65 3.20 -0.20 5.22 0.08 -0.33 -0.69 117.98 126.89 3kd9 s PHE 34 Ca 0.00 -0.86 -0.04 0.00 0.12 0.00 0.00 56.93 56.15 3kd9 s PHE 34 Cb -0.13 -2.35 -0.02 0.00 -0.57 0.00 0.00 43.02 39.96 3kd9 s PHE 34 CO -0.04 -0.57 -0.02 -2.00 -0.10 0.00 0.00 175.22 172.49 3kd9 s GLU 35 N 1.55 3.51 0.43 0.44 -6.30 -1.02 -1.91 118.70 115.40 3kd9 s GLU 35 Ca 0.03 -0.57 0.30 0.00 -2.50 0.00 0.00 54.97 52.22 3kd9 s GLU 35 Cb -0.18 -3.03 1.46 0.00 0.00 0.00 0.00 34.13 32.38 3kd9 s GLU 35 CO 0.05 -0.06 1.90 0.00 0.02 0.00 0.00 175.26 177.17 3kd9 h ALA 36 N 7.70 1.00 -5.77 6.30 0.00 -1.81 -0.56 119.26 126.13 3kd9 h ALA 36 Ca -0.37 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.93 3kd9 h ALA 36 Cb 1.17 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 3kd9 h ALA 36 CO 0.60 0.00 -0.32 -2.37 0.00 0.00 0.00 179.25 177.16 3kd9 n THR 37 N -2.58 0.00 1.13 0.00 5.66 -1.26 -4.17 114.28 113.05 3kd9 n THR 37 Ca -0.01 -2.28 0.12 0.00 -3.05 0.00 0.00 64.05 58.83 3kd9 n THR 37 Cb 0.13 0.08 0.30 0.00 -1.55 0.00 0.00 70.33 69.29 3kd9 n THR 37 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 3kd9 n GLU 38 N -1.73 0.47 -4.01 1.09 0.28 -1.26 -1.07 120.64 114.41 3kd9 n GLU 38 Ca -0.06 -0.29 -0.25 0.00 -0.16 0.00 0.00 57.16 56.41 3kd9 n GLU 38 Cb 0.65 -1.49 -0.04 0.00 1.43 0.00 0.00 31.44 31.99 3kd9 n GLU 38 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 3kd9 s TRP 39 N -2.72 3.34 0.05 -1.84 0.51 -1.26 -4.89 118.94 112.13 3kd9 s TRP 39 Ca 0.18 0.03 -0.10 0.00 -2.12 0.00 0.00 56.10 54.09 3kd9 s TRP 39 Cb 0.18 -1.58 0.01 0.00 -0.81 0.00 0.00 33.47 31.27 3kd9 s TRP 39 CO 0.61 0.50 0.21 0.08 -0.51 0.00 0.00 176.95 177.85 3kd9 s VAL 40 N -1.83 0.11 0.00 4.03 1.01 -1.26 -4.88 120.40 117.58 3kd9 s VAL 40 Ca 0.33 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.43 3kd9 s VAL 40 Cb -0.10 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.31 3kd9 s VAL 40 CO 0.27 -0.49 0.00 -1.20 0.00 0.00 0.00 175.10 173.68 3kd9 n SER 41 N 0.57 0.00 -1.13 3.32 7.64 -1.20 -5.07 113.62 117.75 3kd9 n SER 41 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 3kd9 n SER 41 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 3kd9 n SER 41 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 3kd9 n GLU 66 N 0.00 -0.84 0.00 1.43 0.00 -1.26 -4.81 120.64 115.16 3kd9 n GLU 66 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 57.16 58.19 3kd9 n GLU 66 Cb 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 31.44 30.35 3kd9 n GLU 66 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 3kd9 n VAL 67 N 0.29 0.02 0.30 3.84 0.24 -1.26 -3.59 118.33 118.18 3kd9 n VAL 67 Ca 0.00 0.00 0.18 0.00 -2.04 0.00 0.00 64.34 62.48 3kd9 n VAL 67 Cb 0.00 -0.15 0.85 0.00 -1.47 0.00 0.00 33.84 33.07 3kd9 n VAL 67 CO 0.00 0.00 0.00 2.19 -2.14 0.00 0.00 176.83 176.88 3kd9 h PHE 68 N 0.97 0.00 -0.19 6.34 -0.00 -2.02 0.16 116.94 122.20 3kd9 h PHE 68 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.97 57.87 3kd9 h PHE 68 Cb 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.03 3kd9 h PHE 68 CO 0.00 0.00 -0.32 0.82 -0.00 0.00 0.00 178.31 178.81 3kd9 h ILE 69 N 0.00 1.28 0.00 0.88 5.03 -1.89 -1.81 117.51 121.00 3kd9 h ILE 69 Ca 0.00 -1.37 0.00 0.00 -0.12 0.00 0.00 64.86 63.37 3kd9 h ILE 69 Cb 0.23 1.49 0.00 0.00 -3.03 0.00 0.00 36.82 35.52 3kd9 h ILE 69 CO 0.00 0.42 0.00 0.11 -0.68 0.00 0.00 178.15 178.00 3kd9 h LYS 70 N 0.33 0.00 0.15 2.37 1.57 -0.68 -0.27 116.57 120.04 3kd9 h LYS 70 Ca 0.04 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.57 3kd9 h LYS 70 Cb 0.73 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.07 3kd9 h LYS 70 CO 0.06 0.00 -1.08 1.57 -0.57 0.00 0.00 179.45 179.42 3kd9 h LYS 71 N 0.00 0.48 0.00 3.15 -0.00 -1.38 -3.13 116.57 115.69 3kd9 h LYS 71 Ca 0.00 -0.71 0.00 0.00 -0.00 0.00 0.00 60.65 59.94 3kd9 h LYS 71 Cb 0.05 0.25 0.00 0.00 -0.00 0.00 0.00 32.23 32.52 3kd9 h LYS 71 CO 0.00 1.32 0.00 2.89 -0.00 0.00 0.00 179.45 183.66 3kd9 n ARG 72 N -3.94 0.16 0.00 0.07 0.00 -0.14 -4.79 116.66 108.03 3kd9 n ARG 72 Ca -0.14 0.13 0.00 0.00 -0.00 0.00 0.00 57.85 57.84 3kd9 n ARG 72 Cb 0.92 -1.50 0.00 0.00 -0.00 0.00 0.00 32.46 31.88 3kd9 n ARG 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3kd9 n GLY 73 N -0.60 0.75 3.58 2.89 0.00 -1.11 -4.95 105.19 105.75 3kd9 n GLY 73 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 3kd9 n GLY 73 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kd9 s ILE 74 N -2.00 5.30 -0.92 -0.61 1.01 -1.08 -4.67 121.20 118.24 3kd9 s ILE 74 Ca 0.00 0.10 -0.24 0.00 0.00 0.00 0.00 60.65 60.51 3kd9 s ILE 74 Cb 0.00 -3.56 0.04 0.00 0.01 0.00 0.00 42.46 38.95 3kd9 s ILE 74 CO 0.00 0.20 1.44 -0.62 0.00 0.00 0.00 174.94 175.96 3kd9 s ASP 75 N 1.75 6.28 -0.16 3.58 2.15 -0.62 -3.33 116.67 126.33 3kd9 s ASP 75 Ca 0.07 -1.05 -0.15 0.00 0.43 0.00 0.00 52.55 51.84 3kd9 s ASP 75 Cb -0.16 -2.57 -0.04 0.00 -0.30 0.00 0.00 42.92 39.85 3kd9 s ASP 75 CO 0.11 -1.71 0.36 -0.22 -0.17 0.00 0.00 175.17 173.54 3kd9 s LEU 76 N 5.63 4.23 -0.34 -1.34 2.96 -1.26 -1.46 118.68 127.10 3kd9 s LEU 76 Ca 0.45 0.58 -0.02 0.00 -0.22 0.00 0.00 54.13 54.92 3kd9 s LEU 76 Cb -0.03 -2.48 0.07 0.00 0.50 0.00 0.00 46.19 44.25 3kd9 s LEU 76 CO -0.01 0.04 0.07 -1.00 -1.32 0.00 0.00 176.35 174.13 3kd9 s HIS 77 N 0.69 3.42 0.39 5.38 3.76 0.13 -4.95 115.29 124.11 3kd9 s HIS 77 Ca 0.19 -2.15 -0.18 0.00 -0.15 0.00 0.00 55.06 52.77 3kd9 s HIS 77 Cb -0.14 -2.55 -0.10 0.00 1.11 0.00 0.00 32.58 30.90 3kd9 s HIS 77 CO 0.06 -0.87 0.86 -0.51 -0.85 0.00 0.00 174.74 173.43 3kd9 s LEU 78 N 1.19 3.97 -1.46 0.89 1.43 -1.26 -2.44 118.68 120.99 3kd9 s LEU 78 Ca 0.01 1.49 -0.09 0.00 -1.03 0.00 0.00 54.13 54.51 3kd9 s LEU 78 Cb -0.21 -4.33 0.04 0.00 0.03 0.00 0.00 46.19 41.72 3kd9 s LEU 78 CO -0.03 -0.31 0.86 0.59 0.23 0.00 0.00 176.35 177.69 3kd9 n ASN 79 N -0.61 -5.55 -4.05 2.29 4.13 -0.23 -4.93 115.26 106.31 3kd9 n ASN 79 Ca 0.05 -0.50 -0.33 0.00 1.68 0.00 0.00 54.58 55.48 3kd9 n ASN 79 Cb 0.54 -4.44 -0.13 0.00 -1.54 0.00 0.00 39.78 34.21 3kd9 n ASN 79 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3kd9 s ALA 80 N -3.21 3.12 0.45 5.41 0.00 -0.34 -4.34 121.76 122.84 3kd9 s ALA 80 Ca 0.49 -2.71 -0.12 0.00 0.00 0.00 0.00 51.96 49.63 3kd9 s ALA 80 Cb -0.23 -2.23 -0.06 0.00 0.00 0.00 0.00 23.12 20.59 3kd9 s ALA 80 CO 0.61 -1.82 0.84 -2.00 0.00 0.00 0.00 175.76 173.40 3kd9 s GLU 81 N 0.73 3.79 -0.22 0.00 2.12 -1.05 -3.61 118.70 120.46 3kd9 s GLU 81 Ca 0.11 0.59 -0.03 0.00 0.36 0.00 0.00 54.97 56.01 3kd9 s GLU 81 Cb -0.21 -2.30 0.01 0.00 0.26 0.00 0.00 34.13 31.88 3kd9 s GLU 81 CO -0.05 -0.14 -0.07 0.08 -0.54 0.00 0.00 175.26 174.54 3kd9 s VAL 82 N -2.52 3.05 0.06 3.70 1.01 -1.26 -0.37 120.40 124.07 3kd9 s VAL 82 Ca 0.53 -0.71 0.05 0.00 0.00 0.00 0.00 61.98 61.85 3kd9 s VAL 82 Cb -0.10 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 3kd9 s VAL 82 CO 0.34 0.37 -0.06 -0.63 0.00 0.00 0.00 175.10 175.12 3kd9 s ILE 83 N 1.41 3.69 0.20 2.22 -1.09 0.06 -4.99 121.20 122.70 3kd9 s ILE 83 Ca 0.04 -1.00 0.00 0.00 -2.23 0.00 0.00 60.65 57.46 3kd9 s ILE 83 Cb -0.15 -2.69 0.00 0.00 -1.58 0.00 0.00 42.46 38.04 3kd9 s ILE 83 CO -0.05 0.21 0.00 1.21 -1.23 0.00 0.00 174.94 175.08 3kd9 n GLU 84 N 0.96 -2.45 -3.64 2.79 2.13 -1.26 -3.29 120.64 115.88 3kd9 n GLU 84 Ca -0.13 1.78 -0.15 0.00 0.66 0.00 0.00 57.16 59.31 3kd9 n GLU 84 Cb 0.52 -2.24 -0.14 0.00 0.27 0.00 0.00 31.44 29.85 3kd9 n GLU 84 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3kd9 s VAL 85 N -1.84 -0.34 0.48 6.31 0.11 -1.26 -2.57 120.40 121.29 3kd9 s VAL 85 Ca 0.00 0.27 0.04 0.00 -2.93 0.00 0.00 61.98 59.36 3kd9 s VAL 85 Cb 0.00 -0.41 -0.02 0.00 -1.53 0.00 0.00 36.38 34.42 3kd9 s VAL 85 CO 0.00 0.09 0.11 -1.81 -3.33 0.00 0.00 175.10 170.17 3kd9 s ASP 86 N 2.36 4.24 -0.84 3.54 1.01 -0.45 -4.52 116.67 121.99 3kd9 s ASP 86 Ca 0.03 -1.41 -0.25 0.00 0.71 0.00 0.00 52.55 51.62 3kd9 s ASP 86 Cb -0.12 0.14 -0.11 0.00 1.01 0.00 0.00 42.92 43.83 3kd9 s ASP 86 CO -0.08 -0.77 2.24 -0.89 0.21 0.00 0.00 175.17 175.89 3kd9 s THR 87 N -2.77 3.16 0.00 -1.27 2.01 -1.26 -2.64 115.64 112.87 3kd9 s THR 87 Ca 0.23 -0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.09 3kd9 s THR 87 Cb 0.03 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 69.13 3kd9 s THR 87 CO 0.13 -0.34 0.00 0.61 -0.69 0.00 0.00 174.62 174.33 3kd9 n GLY 88 N 6.79 1.43 3.29 4.40 0.00 -1.26 -5.08 105.19 114.77 3kd9 n GLY 88 Ca 0.44 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.96 3kd9 n GLY 88 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kd9 s TYR 89 N -0.58 1.45 -0.06 1.61 -0.00 -1.08 -0.57 117.35 118.11 3kd9 s TYR 89 Ca 0.00 -1.16 -0.07 0.00 -0.00 0.00 0.00 57.07 55.84 3kd9 s TYR 89 Cb 0.00 -0.84 0.02 0.00 -0.00 0.00 0.00 41.96 41.14 3kd9 s TYR 89 CO 0.00 -0.33 0.18 0.54 -0.00 0.00 0.00 175.55 175.95 3kd9 s VAL 90 N -3.76 0.01 -0.28 -3.49 0.11 0.04 -1.34 120.40 111.69 3kd9 s VAL 90 Ca 0.35 -0.08 -0.06 0.00 -2.93 0.00 0.00 61.98 59.25 3kd9 s VAL 90 Cb 0.07 -0.29 0.00 0.00 -1.53 0.00 0.00 36.38 34.64 3kd9 s VAL 90 CO 0.12 -0.05 0.05 -0.60 -3.33 0.00 0.00 175.10 171.29 3kd9 s ARG 91 N -0.09 3.16 -0.02 1.54 3.52 -1.06 -0.28 118.95 125.71 3kd9 s ARG 91 Ca -0.02 -0.81 0.08 0.00 -0.13 0.00 0.00 55.73 54.85 3kd9 s ARG 91 Cb -0.02 -3.30 -0.02 0.00 -1.56 0.00 0.00 34.95 30.05 3kd9 s ARG 91 CO 0.00 -0.39 -0.26 0.54 -0.81 0.00 0.00 175.30 174.39 3kd9 s VAL 92 N 1.49 2.04 -0.53 7.11 0.11 0.25 -0.76 120.40 130.11 3kd9 s VAL 92 Ca 0.03 -1.10 -0.17 0.00 -2.93 0.00 0.00 61.98 57.81 3kd9 s VAL 92 Cb -0.17 -1.70 0.11 0.00 -1.53 0.00 0.00 36.38 33.10 3kd9 s VAL 92 CO 0.01 0.58 0.52 -0.60 -3.33 0.00 0.00 175.10 172.28 3kd9 s ARG 93 N -0.58 3.01 -0.03 1.54 6.06 0.50 -1.49 118.95 127.95 3kd9 s ARG 93 Ca 0.09 -1.49 0.05 0.00 -2.50 0.00 0.00 55.73 51.88 3kd9 s ARG 93 Cb -0.10 -4.24 -0.01 0.00 0.06 0.00 0.00 34.95 30.66 3kd9 s ARG 93 CO -0.01 -1.29 -0.18 -2.00 -2.50 0.00 0.00 175.30 169.32 3kd9 s GLU 94 N 1.89 1.71 -1.12 5.12 2.12 -0.68 -2.52 118.70 125.22 3kd9 s GLU 94 Ca 0.06 -0.63 -0.22 0.00 0.36 0.00 0.00 54.97 54.53 3kd9 s GLU 94 Cb -0.27 -1.53 0.00 0.00 0.26 0.00 0.00 34.13 32.59 3kd9 s GLU 94 CO 0.05 0.30 0.76 0.09 -0.54 0.00 0.00 175.26 175.92 3kd9 n ASN 95 N 2.97 -5.18 0.00 -1.70 5.03 -1.26 -1.69 115.26 113.43 3kd9 n ASN 95 Ca -0.17 -1.04 0.00 0.00 0.87 0.00 0.00 54.58 54.24 3kd9 n ASN 95 Cb 0.53 -3.01 0.00 0.00 -1.02 0.00 0.00 39.78 36.28 3kd9 n ASN 95 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3kd9 n GLY 96 N -1.76 0.97 3.96 7.41 0.00 -1.26 -4.90 105.19 109.61 3kd9 n GLY 96 Ca -0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 3kd9 n GLY 96 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kd9 s GLY 97 N 0.00 1.75 -0.01 -0.02 0.00 -0.68 -5.11 107.32 103.25 3kd9 s GLY 97 Ca 0.00 -1.36 0.01 0.00 0.00 0.00 0.00 44.72 43.37 3kd9 s GLY 97 CO 0.00 -0.74 -0.03 1.85 0.00 0.00 0.00 173.10 174.18 3kd9 s GLU 98 N -5.46 0.36 0.18 2.90 2.12 -1.26 -1.69 118.70 115.85 3kd9 s GLU 98 Ca 0.68 -0.09 -0.07 0.00 0.36 0.00 0.00 54.97 55.86 3kd9 s GLU 98 Cb -0.06 -0.40 -0.02 0.00 0.26 0.00 0.00 34.13 33.91 3kd9 s GLU 98 CO 0.48 0.02 0.25 0.15 -0.54 0.00 0.00 175.26 175.62 3kd9 s LYS 99 N 0.27 1.20 0.07 4.30 -0.14 -0.55 -5.00 119.74 119.88 3kd9 s LYS 99 Ca -0.03 -1.32 0.08 0.00 -1.36 0.00 0.00 55.97 53.34 3kd9 s LYS 99 Cb -0.06 0.35 -0.03 0.00 -1.68 0.00 0.00 37.83 36.42 3kd9 s LYS 99 CO -0.00 -0.43 -0.20 -1.54 -0.76 0.00 0.00 175.35 172.41 3kd9 s SER 100 N -3.03 2.45 0.05 2.83 1.04 -1.26 -0.59 113.70 115.20 3kd9 s SER 100 Ca 0.23 -0.58 0.05 0.00 0.48 0.00 0.00 55.95 56.13 3kd9 s SER 100 Cb 0.04 -0.17 -0.02 0.00 0.10 0.00 0.00 66.02 65.96 3kd9 s SER 100 CO 0.04 0.11 -0.14 -0.31 0.98 0.00 0.00 173.24 173.92 3kd9 s TYR 101 N -0.94 1.22 0.07 5.02 2.02 0.62 -4.95 117.35 120.40 3kd9 s TYR 101 Ca 0.07 -0.38 -0.16 0.00 -0.37 0.00 0.00 57.07 56.22 3kd9 s TYR 101 Cb -0.09 -0.71 -0.06 0.00 -0.40 0.00 0.00 41.96 40.69 3kd9 s TYR 101 CO 0.03 0.04 0.51 -1.21 -1.57 0.00 0.00 175.55 173.34 3kd9 s GLU 102 N -1.30 4.04 0.01 -0.62 2.02 -1.26 -0.78 118.70 120.81 3kd9 s GLU 102 Ca 0.01 0.55 0.02 0.00 0.02 0.00 0.00 54.97 55.56 3kd9 s GLU 102 Cb -0.08 -3.15 -0.01 0.00 0.10 0.00 0.00 34.13 30.98 3kd9 s GLU 102 CO 0.02 0.62 -0.06 1.67 0.02 0.00 0.00 175.26 177.53 3kd9 s TRP 103 N -1.19 0.49 -0.18 1.61 1.48 0.27 -4.74 118.94 116.68 3kd9 s TRP 103 Ca 0.29 -0.21 0.14 0.00 -1.06 0.00 0.00 56.10 55.27 3kd9 s TRP 103 Cb -0.17 -0.31 -0.21 0.00 -1.16 0.00 0.00 33.47 31.62 3kd9 s TRP 103 CO 0.17 -0.03 0.03 -0.25 -4.06 0.00 0.00 176.95 172.81 3kd9 n ASP 104 N 2.51 0.85 -4.02 -2.66 8.00 0.00 -4.46 116.55 116.78 3kd9 n ASP 104 Ca -0.16 -0.02 -0.24 0.00 0.71 0.00 0.00 54.79 55.09 3kd9 n ASP 104 Cb 0.57 0.77 -0.16 0.00 -0.02 0.00 0.00 41.12 42.28 3kd9 n ASP 104 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3kd9 s TYR 105 N -2.43 1.35 0.05 1.24 2.02 -0.97 -4.82 117.35 113.79 3kd9 s TYR 105 Ca -0.11 -0.46 0.09 0.00 -0.37 0.00 0.00 57.07 56.22 3kd9 s TYR 105 Cb 0.06 -0.99 -0.03 0.00 -0.40 0.00 0.00 41.96 40.60 3kd9 s TYR 105 CO 0.70 -0.23 -0.26 -1.17 -1.57 0.00 0.00 175.55 173.01 3kd9 s LEU 106 N 0.55 2.17 -0.14 -1.29 2.96 -0.23 -1.01 118.68 121.69 3kd9 s LEU 106 Ca -0.12 -0.59 -0.02 0.00 -0.22 0.00 0.00 54.13 53.18 3kd9 s LEU 106 Cb -0.14 -1.29 0.04 0.00 0.50 0.00 0.00 46.19 45.30 3kd9 s LEU 106 CO 0.03 0.26 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.63 3kd9 s VAL 107 N -0.81 0.64 -0.42 1.68 1.01 0.90 0.32 120.40 123.72 3kd9 s VAL 107 Ca 0.12 -0.34 -0.25 0.00 0.00 0.00 0.00 61.98 61.51 3kd9 s VAL 107 Cb -0.10 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.37 3kd9 s VAL 107 CO 0.02 0.05 0.91 -0.36 0.00 0.00 0.00 175.10 175.73 3kd9 s PHE 108 N 1.84 3.00 -0.02 5.22 0.08 0.17 -1.22 117.98 127.03 3kd9 s PHE 108 Ca 0.02 0.55 0.21 0.00 0.12 0.00 0.00 56.93 57.82 3kd9 s PHE 108 Cb -0.15 -3.80 0.36 0.00 -0.57 0.00 0.00 43.02 38.87 3kd9 s PHE 108 CO -0.07 -0.96 1.15 0.00 -0.10 0.00 0.00 175.22 175.24 3kd9 n ALA 109 N 6.95 2.44 0.82 5.36 0.00 -0.97 -1.84 120.51 133.26 3kd9 n ALA 109 Ca 0.06 -2.26 0.00 0.00 0.00 0.00 0.00 53.44 51.24 3kd9 n ALA 109 Cb 0.48 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.27 3kd9 n ALA 109 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3kd9 n ASN 110 N 0.22 1.61 0.00 0.00 0.23 -0.48 -4.37 115.26 112.47 3kd9 n ASN 110 Ca 0.07 -1.63 0.00 0.00 -0.53 0.00 0.00 54.58 52.48 3kd9 n ASN 110 Cb 1.03 -0.41 0.00 0.00 -2.08 0.00 0.00 39.78 38.32 3kd9 n ASN 110 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3kd9 n GLY 111 N 0.33 0.93 3.32 4.83 0.00 -1.26 -4.66 105.19 108.67 3kd9 n GLY 111 Ca 0.00 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.26 3kd9 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kd9 s ALA 112 N -1.09 1.89 0.20 4.61 0.00 -1.26 -2.38 121.76 123.73 3kd9 s ALA 112 Ca 0.00 -1.50 0.09 0.00 0.00 0.00 0.00 51.96 50.55 3kd9 s ALA 112 Cb 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 3kd9 s ALA 112 CO 0.00 0.15 -0.19 -1.12 0.00 0.00 0.00 175.76 174.61 3kd9 s SER 113 N -2.82 2.94 0.47 0.00 0.01 0.24 -4.89 113.70 109.65 3kd9 s SER 113 Ca 0.16 -0.93 -0.24 0.00 1.31 0.00 0.00 55.95 56.25 3kd9 s SER 113 Cb -0.04 -0.19 -0.08 0.00 0.21 0.00 0.00 66.02 65.92 3kd9 s SER 113 CO 0.06 -0.03 1.40 -2.65 0.41 0.00 0.00 173.24 172.43 3kd9 n PRO 114 N -0.04 2.08 -3.70 12.44 -0.02 -1.26 -0.74 135.00 143.76 3kd9 n PRO 114 Ca -0.10 0.75 -0.38 0.00 -2.02 0.00 0.00 63.50 61.74 3kd9 n PRO 114 Cb 0.58 -2.59 -0.12 0.00 -0.02 0.00 0.00 33.50 31.35 3kd9 n PRO 114 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3kd9 s GLN 115 N -2.53 2.85 0.27 -0.52 0.74 -0.86 -4.77 119.66 114.84 3kd9 s GLN 115 Ca 0.64 -1.04 -0.29 0.00 0.05 0.00 0.00 55.36 54.72 3kd9 s GLN 115 Cb -0.45 -3.52 -0.09 0.00 1.10 0.00 0.00 33.01 30.05 3kd9 s GLN 115 CO 0.56 -0.60 1.11 0.14 -0.55 0.00 0.00 175.29 175.95 3kd9 s VAL 116 N 1.48 3.50 0.93 1.34 -7.23 -1.26 -4.45 120.40 114.71 3kd9 s VAL 116 Ca 0.01 1.47 -0.12 0.00 -1.81 0.00 0.00 61.98 61.53 3kd9 s VAL 116 Cb -0.19 -3.94 0.15 0.00 0.56 0.00 0.00 36.38 32.97 3kd9 s VAL 116 CO 0.04 0.33 1.10 -2.84 -0.31 0.00 0.00 175.10 173.43 3kd9 s PRO 117 N -1.27 0.97 -0.74 4.82 0.02 -1.26 -4.96 135.00 132.58 3kd9 s PRO 117 Ca 0.46 0.56 -0.14 0.00 0.02 0.00 0.00 61.00 61.90 3kd9 s PRO 117 Cb -0.32 -1.80 0.19 0.00 0.02 0.00 0.00 34.50 32.60 3kd9 s PRO 117 CO 0.41 -2.37 0.68 0.00 -0.33 0.00 0.00 177.00 175.38 3kd9 s ALA 118 N -3.04 3.94 -0.14 -1.55 0.00 -1.26 -4.99 121.76 114.72 3kd9 s ALA 118 Ca 0.64 -3.12 -0.14 0.00 0.00 0.00 0.00 51.96 49.34 3kd9 s ALA 118 Cb -0.17 -3.39 0.04 0.00 0.00 0.00 0.00 23.12 19.59 3kd9 s ALA 118 CO 0.56 -2.20 0.39 0.96 0.00 0.00 0.00 175.76 175.47 3kd9 s ILE 119 N 0.50 0.00 0.22 0.00 -4.36 -1.26 -5.01 121.20 111.30 3kd9 s ILE 119 Ca 0.14 -0.04 -0.30 0.00 -0.26 0.00 0.00 60.65 60.19 3kd9 s ILE 119 Cb -0.16 -0.56 -0.15 0.00 1.25 0.00 0.00 42.46 42.84 3kd9 s ILE 119 CO -0.06 -0.02 0.95 1.21 0.24 0.00 0.00 174.94 177.26 3kd9 n GLU 120 N 2.71 0.94 -3.21 0.37 2.13 -1.06 -3.78 120.64 118.74 3kd9 n GLU 120 Ca -0.14 0.33 -0.18 0.00 0.66 0.00 0.00 57.16 57.83 3kd9 n GLU 120 Cb 0.57 -1.67 0.02 0.00 0.27 0.00 0.00 31.44 30.63 3kd9 n GLU 120 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3kd9 n GLY 121 N 1.65 -0.87 0.08 8.31 0.00 -1.26 -2.30 105.19 110.79 3kd9 n GLY 121 Ca 0.14 1.01 0.03 0.00 0.00 0.00 0.00 46.02 47.19 3kd9 n GLY 121 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3kd9 n VAL 122 N -0.85 0.83 -0.53 1.61 0.31 -1.25 -4.31 118.33 114.15 3kd9 n VAL 122 Ca -0.02 -0.65 0.03 0.00 -0.01 0.00 0.00 64.34 63.69 3kd9 n VAL 122 Cb 0.56 -0.44 0.31 0.00 -0.91 0.00 0.00 33.84 33.36 3kd9 n VAL 122 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3kd9 n ASN 123 N -2.67 4.67 -4.76 4.52 4.13 -1.26 -4.75 115.26 115.13 3kd9 n ASN 123 Ca -0.11 -2.79 -0.41 0.00 1.68 0.00 0.00 54.58 52.96 3kd9 n ASN 123 Cb 0.78 -0.66 -0.02 0.00 -1.54 0.00 0.00 39.78 38.34 3kd9 n ASN 123 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3kd9 s LEU 124 N -2.22 4.39 0.53 3.41 1.02 -1.26 -4.85 118.68 119.69 3kd9 s LEU 124 Ca 0.43 2.76 0.43 0.00 0.02 0.00 0.00 54.13 57.78 3kd9 s LEU 124 Cb 0.33 -3.64 1.63 0.00 0.02 0.00 0.00 46.19 44.53 3kd9 s LEU 124 CO 0.12 -0.66 1.63 0.11 0.02 0.00 0.00 176.35 177.57 3kd9 h LYS 125 N 3.84 0.02 -0.57 1.70 1.57 -1.67 0.27 116.57 121.73 3kd9 h LYS 125 Ca -0.48 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.31 3kd9 h LYS 125 Cb 1.23 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.50 3kd9 h LYS 125 CO 0.69 0.01 0.37 0.78 -0.57 0.00 0.00 179.45 180.73 3kd9 h GLY 126 N 0.02 0.80 -3.71 3.86 0.00 -1.81 -3.45 103.07 98.79 3kd9 h GLY 126 Ca 0.85 -0.29 -0.59 0.00 0.00 0.00 0.00 47.33 47.30 3kd9 h GLY 126 CO -0.12 0.28 -0.09 -0.62 0.00 0.00 0.00 176.54 175.99 3kd9 n VAL 127 N -4.71 2.29 -3.64 4.60 0.31 0.08 -3.14 118.33 114.14 3kd9 n VAL 127 Ca 0.04 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 63.77 3kd9 n VAL 127 Cb 0.03 -0.89 -0.07 0.00 -0.91 0.00 0.00 33.84 32.01 3kd9 n VAL 127 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3kd9 s PHE 128 N -1.39 -0.88 0.07 3.52 0.08 -0.15 -4.89 117.98 114.34 3kd9 s PHE 128 Ca 0.65 1.91 0.06 0.00 0.12 0.00 0.00 56.93 59.67 3kd9 s PHE 128 Cb -0.56 0.45 -0.04 0.00 -0.57 0.00 0.00 43.02 42.30 3kd9 s PHE 128 CO 0.56 -0.43 -0.10 0.95 -0.10 0.00 0.00 175.22 176.10 3kd9 s THR 129 N 1.02 3.35 -0.87 0.64 -4.23 -1.26 -1.33 115.64 112.97 3kd9 s THR 129 Ca -0.05 -1.15 -0.10 0.00 -1.18 0.00 0.00 61.69 59.21 3kd9 s THR 129 Cb -0.05 -2.52 0.22 0.00 1.34 0.00 0.00 72.50 71.49 3kd9 s THR 129 CO -0.10 0.20 0.80 0.00 -0.54 0.00 0.00 174.62 174.98 3kd9 s ALA 130 N -1.13 4.17 0.00 3.99 0.00 -1.26 -4.85 121.76 122.68 3kd9 s ALA 130 Ca 0.20 -3.47 0.00 0.00 0.00 0.00 0.00 51.96 48.69 3kd9 s ALA 130 Cb -0.11 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.65 3kd9 s ALA 130 CO 0.11 -2.23 0.00 -3.47 0.00 0.00 0.00 175.76 170.17 3kd9 n ASP 131 N 3.50 0.00 -4.25 0.00 -0.08 -1.26 -5.09 116.55 109.38 3kd9 n ASP 131 Ca 0.16 0.00 -0.34 0.00 -1.51 0.00 0.00 54.79 53.10 3kd9 n ASP 131 Cb 0.43 0.00 0.13 0.00 2.34 0.00 0.00 41.12 44.02 3kd9 n ASP 131 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 3kd9 n LEU 132 N 0.00 -2.18 0.00 -2.67 7.99 -1.26 -4.86 117.00 114.02 3kd9 n LEU 132 Ca 0.00 0.03 0.10 0.00 -0.01 0.00 0.00 56.01 56.13 3kd9 n LEU 132 Cb 0.00 -0.94 0.49 0.00 -0.11 0.00 0.00 43.42 42.86 3kd9 n LEU 132 CO 0.00 -3.37 0.82 -2.65 -1.51 0.00 0.00 177.39 170.68 3kd9 n PRO 133 N -1.00 0.20 0.08 3.23 -0.02 -1.26 -3.33 135.00 132.90 3kd9 n PRO 133 Ca 0.02 0.11 -0.11 0.00 -2.02 0.00 0.00 63.50 61.50 3kd9 n PRO 133 Cb 0.62 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.56 3kd9 n PRO 133 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3kd9 h PRO 134 N 0.00 0.29 -0.72 0.52 0.13 -1.98 -0.93 132.00 129.31 3kd9 h PRO 134 Ca 0.00 -0.33 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3kd9 h PRO 134 Cb 0.24 0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.43 3kd9 h PRO 134 CO 0.00 1.04 0.47 -0.44 -0.23 0.00 0.00 178.00 178.83 3kd9 h ASP 135 N 0.16 0.84 -0.30 1.44 5.19 -1.88 4.03 116.42 125.89 3kd9 h ASP 135 Ca -0.06 -0.03 -0.00 0.00 -0.62 0.00 0.00 57.03 56.32 3kd9 h ASP 135 Cb 1.57 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 40.85 3kd9 h ASP 135 CO 0.15 0.62 0.19 0.00 -3.12 0.00 0.00 179.24 177.07 3kd9 h ALA 136 N 1.53 0.39 0.12 3.45 0.00 -1.49 -0.36 119.26 122.90 3kd9 h ALA 136 Ca 0.26 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3kd9 h ALA 136 Cb -0.09 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3kd9 h ALA 136 CO -0.05 -0.12 -0.06 1.37 0.00 0.00 0.00 179.25 180.39 3kd9 h LEU 137 N 0.39 -0.14 -0.06 0.00 -0.00 0.39 -3.18 115.31 112.71 3kd9 h LEU 137 Ca 0.11 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 58.00 3kd9 h LEU 137 Cb 0.00 0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 40.69 3kd9 h LEU 137 CO -0.02 0.11 -0.05 0.00 -0.00 0.00 0.00 178.44 178.49 3kd9 h ALA 138 N -1.50 -0.16 -1.01 0.17 0.00 0.76 0.27 119.26 117.79 3kd9 h ALA 138 Ca -0.02 0.01 0.26 0.00 0.00 0.00 0.00 54.91 55.16 3kd9 h ALA 138 Cb 0.12 0.92 -0.12 0.00 0.00 0.00 0.00 17.79 18.71 3kd9 h ALA 138 CO 0.03 -0.19 0.61 0.82 0.00 0.00 0.00 179.25 180.51 3kd9 h ILE 139 N -0.01 0.50 0.00 0.00 5.03 -1.20 1.12 117.51 122.95 3kd9 h ILE 139 Ca 0.01 -0.18 -0.04 0.00 -0.12 0.00 0.00 64.86 64.53 3kd9 h ILE 139 Cb 0.04 -0.07 -0.01 0.00 -3.03 0.00 0.00 36.82 33.76 3kd9 h ILE 139 CO -0.07 0.10 -0.19 0.03 -0.68 0.00 0.00 178.15 177.34 3kd9 h ARG 140 N 0.52 0.00 0.00 2.37 2.47 -0.82 -2.52 114.38 116.41 3kd9 h ARG 140 Ca 0.65 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.37 3kd9 h ARG 140 Cb 1.33 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.65 3kd9 h ARG 140 CO -0.47 0.19 -0.10 0.93 0.56 0.00 0.00 179.97 181.09 3kd9 h GLU 141 N 0.00 0.00 -0.97 0.04 4.39 0.44 -3.05 114.58 115.44 3kd9 h GLU 141 Ca -0.00 0.00 0.19 0.00 0.34 0.00 0.00 59.36 59.89 3kd9 h GLU 141 Cb 0.58 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 29.05 3kd9 h GLU 141 CO 0.02 0.00 -0.26 0.98 -1.16 0.00 0.00 179.01 178.59 3kd9 n TYR 142 N -3.28 0.30 0.18 4.33 -0.00 0.45 0.02 117.16 119.17 3kd9 n TYR 142 Ca -0.01 1.18 -0.09 0.00 -0.00 0.00 0.00 57.90 58.98 3kd9 n TYR 142 Cb 0.05 -1.03 -0.05 0.00 -0.00 0.00 0.00 39.34 38.31 3kd9 n TYR 142 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.86 177.38 3kd9 h MET 143 N 0.00 -0.51 -2.02 2.98 2.07 -1.64 -1.83 114.93 113.99 3kd9 h MET 143 Ca 0.45 0.03 -0.00 0.00 -2.07 0.00 0.00 59.70 58.11 3kd9 h MET 143 Cb 0.69 0.12 -0.00 0.00 -1.87 0.00 0.00 31.60 30.53 3kd9 h MET 143 CO -0.99 -0.34 0.01 0.39 1.07 0.00 0.00 176.91 177.04 3kd9 n GLU 144 N -3.75 0.34 0.00 1.72 1.02 0.10 -3.81 120.64 116.26 3kd9 n GLU 144 Ca -0.06 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 3kd9 n GLU 144 Cb 0.23 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 3kd9 n GLU 144 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3kd9 n LYS 145 N 1.87 0.00 -1.69 3.49 4.81 -0.62 -4.91 118.16 121.11 3kd9 n LYS 145 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 58.31 56.91 3kd9 n LYS 145 Cb 0.17 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.16 3kd9 n LYS 145 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3kd9 n TYR 146 N 0.00 2.15 -1.65 5.64 4.02 -0.73 -4.77 117.16 121.83 3kd9 n TYR 146 Ca 0.00 0.30 -0.58 0.00 -0.01 0.00 0.00 57.90 57.61 3kd9 n TYR 146 Cb 0.00 -2.55 -0.07 0.00 -0.02 0.00 0.00 39.34 36.70 3kd9 n TYR 146 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 3kd9 n LYS 147 N 6.07 0.78 -3.86 -0.72 0.00 -1.26 -4.64 118.16 114.53 3kd9 n LYS 147 Ca 0.26 0.28 -0.29 0.00 -0.00 0.00 0.00 58.31 58.56 3kd9 n LYS 147 Cb 0.20 -1.90 -0.16 0.00 -0.00 0.00 0.00 35.03 33.18 3kd9 n LYS 147 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3kd9 s VAL 148 N 1.98 1.17 -0.03 0.58 1.01 -1.26 -4.96 120.40 118.90 3kd9 s VAL 148 Ca 0.94 -1.06 0.15 0.00 0.00 0.00 0.00 61.98 62.01 3kd9 s VAL 148 Cb -1.14 -1.57 -0.23 0.00 0.00 0.00 0.00 36.38 33.45 3kd9 s VAL 148 CO 0.61 -0.20 0.31 -0.62 0.00 0.00 0.00 175.10 175.20 3kd9 n GLU 149 N 4.80 0.53 -3.82 2.72 1.02 -1.26 -4.89 120.64 119.74 3kd9 n GLU 149 Ca -0.10 -0.13 -0.27 0.00 -0.02 0.00 0.00 57.16 56.65 3kd9 n GLU 149 Cb 0.45 -1.35 -0.17 0.00 -0.02 0.00 0.00 31.44 30.35 3kd9 n GLU 149 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3kd9 s ASN 150 N -3.77 2.63 -0.10 1.62 -0.87 -1.26 -0.60 114.94 112.59 3kd9 s ASN 150 Ca -0.06 -0.61 0.02 0.00 -1.57 0.00 0.00 52.86 50.64 3kd9 s ASN 150 Cb 0.09 -0.72 -0.01 0.00 -0.02 0.00 0.00 41.25 40.58 3kd9 s ASN 150 CO 0.61 -0.23 -0.16 0.54 -2.57 0.00 0.00 177.10 175.29 3kd9 s VAL 151 N 1.77 2.78 -0.13 1.60 0.11 -0.79 -0.41 120.40 125.33 3kd9 s VAL 151 Ca 0.01 -0.78 -0.01 0.00 -2.93 0.00 0.00 61.98 58.27 3kd9 s VAL 151 Cb -0.15 -2.12 -0.02 0.00 -1.53 0.00 0.00 36.38 32.55 3kd9 s VAL 151 CO -0.07 0.55 -0.09 -0.69 -3.33 0.00 0.00 175.10 171.47 3kd9 s VAL 152 N 0.07 3.46 -0.23 2.04 1.01 -0.72 -1.43 120.40 124.61 3kd9 s VAL 152 Ca -0.07 -0.52 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 3kd9 s VAL 152 Cb -0.15 -2.47 0.00 0.00 0.00 0.00 0.00 36.38 33.76 3kd9 s VAL 152 CO 0.05 0.53 -0.06 -0.63 0.00 0.00 0.00 175.10 174.99 3kd9 s ILE 153 N 0.15 3.13 -0.44 2.22 1.01 0.27 -1.23 121.20 126.31 3kd9 s ILE 153 Ca -0.04 -0.69 -0.21 0.00 0.00 0.00 0.00 60.65 59.71 3kd9 s ILE 153 Cb -0.14 -2.47 0.03 0.00 0.01 0.00 0.00 42.46 39.88 3kd9 s ILE 153 CO 0.04 0.36 0.65 -0.63 0.00 0.00 0.00 174.94 175.36 3kd9 s ILE 154 N 1.42 4.82 0.00 2.92 1.01 -0.44 -1.14 121.20 129.78 3kd9 s ILE 154 Ca 0.04 0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.80 3kd9 s ILE 154 Cb -0.15 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.10 3kd9 s ILE 154 CO -0.04 -0.61 0.00 0.61 0.00 0.00 0.00 174.94 174.89 3kd9 n GLY 155 N 5.04 4.57 1.88 6.18 0.00 -0.96 -1.24 105.19 120.65 3kd9 n GLY 155 Ca -0.02 -1.20 -0.15 0.00 0.00 0.00 0.00 46.02 44.65 3kd9 n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kd9 n GLY 156 N -1.69 5.46 0.00 -0.02 0.00 -1.26 -4.59 105.19 103.09 3kd9 n GLY 156 Ca 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.83 3kd9 n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kd9 n GLY 157 N -0.73 2.91 0.44 -0.02 0.00 -1.26 0.04 105.19 106.56 3kd9 n GLY 157 Ca 0.34 -2.08 -0.17 0.00 0.00 0.00 0.00 46.02 44.11 3kd9 n GLY 157 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3kd9 h TYR 158 N 0.08 -1.03 -0.47 1.61 0.05 -1.97 -1.15 116.97 114.09 3kd9 h TYR 158 Ca 0.00 -0.02 0.09 0.00 0.05 0.00 0.00 58.73 58.85 3kd9 h TYR 158 Cb 0.00 0.34 -0.10 0.00 1.01 0.00 0.00 36.73 37.98 3kd9 h TYR 158 CO 0.00 -0.64 -0.25 -0.84 -1.05 0.00 0.00 178.16 175.38 3kd9 h ILE 159 N -1.13 0.31 -0.89 -2.88 3.07 -1.96 -0.17 117.51 113.86 3kd9 h ILE 159 Ca -0.11 0.00 0.13 0.00 1.55 0.00 0.00 64.86 66.43 3kd9 h ILE 159 Cb 0.85 0.31 -0.09 0.00 -0.27 0.00 0.00 36.82 37.62 3kd9 h ILE 159 CO 0.19 0.00 0.50 1.23 -1.05 0.00 0.00 178.15 179.02 3kd9 h GLY 160 N -0.15 1.45 0.77 0.16 0.00 -1.79 -2.11 103.07 101.40 3kd9 h GLY 160 Ca 0.22 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 3kd9 h GLY 160 CO -0.56 0.04 -0.14 -2.22 0.00 0.00 0.00 176.54 173.66 3kd9 h ILE 161 N 0.75 1.33 -0.43 2.60 2.04 0.21 -1.65 117.51 122.36 3kd9 h ILE 161 Ca 0.47 -1.28 0.04 0.00 1.00 0.00 0.00 64.86 65.09 3kd9 h ILE 161 Cb 0.57 1.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.42 3kd9 h ILE 161 CO -0.32 0.38 0.19 -0.33 0.00 0.00 0.00 178.15 178.08 3kd9 h GLU 162 N 0.04 0.38 -0.63 2.37 5.08 -0.78 -1.06 114.58 119.97 3kd9 h GLU 162 Ca 0.03 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 3kd9 h GLU 162 Cb 0.66 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 3kd9 h GLU 162 CO 0.04 0.25 0.37 0.52 -1.00 0.00 0.00 179.01 179.18 3kd9 h MET 163 N 0.39 0.86 0.00 2.33 2.86 -1.37 0.39 114.93 120.39 3kd9 h MET 163 Ca 0.19 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.73 3kd9 h MET 163 Cb 0.14 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 3kd9 h MET 163 CO -0.16 0.62 -0.12 0.00 1.06 0.00 0.00 176.91 178.30 3kd9 h ALA 164 N 1.53 1.52 0.16 6.32 0.00 -0.22 -2.13 119.26 126.44 3kd9 h ALA 164 Ca 0.23 -0.11 -0.31 0.00 0.00 0.00 0.00 54.91 54.71 3kd9 h ALA 164 Cb -0.01 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.76 3kd9 h ALA 164 CO -0.04 0.15 -1.56 1.49 0.00 0.00 0.00 179.25 179.28 3kd9 h GLU 165 N 0.00 0.34 -0.32 0.00 4.81 -0.41 -2.81 114.58 116.20 3kd9 h GLU 165 Ca -0.00 -0.58 0.07 0.00 -0.13 0.00 0.00 59.36 58.72 3kd9 h GLU 165 Cb 0.26 0.21 -0.08 0.00 0.63 0.00 0.00 28.75 29.77 3kd9 h GLU 165 CO 0.02 1.28 -0.36 0.00 -0.73 0.00 0.00 179.01 179.21 3kd9 h ALA 166 N 0.05 -0.34 -0.13 2.92 0.00 -0.57 -1.61 119.26 119.57 3kd9 h ALA 166 Ca -0.32 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 3kd9 h ALA 166 Cb 1.95 0.75 0.01 0.00 0.00 0.00 0.00 17.79 20.49 3kd9 h ALA 166 CO 0.13 -0.80 -0.52 0.74 0.00 0.00 0.00 179.25 178.80 3kd9 h PHE 167 N -0.33 0.79 -0.67 0.00 0.04 -1.56 -3.10 116.94 112.10 3kd9 h PHE 167 Ca 0.14 -0.33 0.14 0.00 2.80 0.00 0.00 57.97 60.71 3kd9 h PHE 167 Cb 0.56 -0.13 -0.04 0.00 2.20 0.00 0.00 35.95 38.55 3kd9 h PHE 167 CO -0.53 1.12 0.45 0.00 -0.60 0.00 0.00 178.31 178.75 3kd9 h ALA 168 N 0.52 2.17 0.00 2.45 0.00 -1.30 0.49 119.26 123.58 3kd9 h ALA 168 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3kd9 h ALA 168 Cb 1.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3kd9 h ALA 168 CO 0.11 -0.34 -0.10 0.00 0.00 0.00 0.00 179.25 178.92 3kd9 n ALA 169 N -2.55 2.42 1.69 0.00 0.00 -0.62 -2.16 120.51 119.29 3kd9 n ALA 169 Ca 0.12 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.59 3kd9 n ALA 169 Cb 0.51 -1.42 0.52 0.00 0.00 0.00 0.00 19.45 19.06 3kd9 n ALA 169 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3kd9 n GLN 170 N -2.03 1.31 -0.83 0.00 1.13 0.17 -4.87 117.38 112.27 3kd9 n GLN 170 Ca 0.06 -0.46 0.00 0.00 -1.94 0.00 0.00 57.00 54.65 3kd9 n GLN 170 Cb 0.41 -1.36 0.00 0.00 0.11 0.00 0.00 30.24 29.39 3kd9 n GLN 170 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3kd9 n GLY 171 N 0.96 0.47 3.82 1.08 0.00 -0.92 -4.97 105.19 105.62 3kd9 n GLY 171 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3kd9 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kd9 s LYS 172 N -0.58 4.01 0.49 1.61 3.01 -1.14 -5.00 119.74 122.13 3kd9 s LYS 172 Ca 0.00 1.12 -0.23 0.00 -1.01 0.00 0.00 55.97 55.86 3kd9 s LYS 172 Cb 0.00 -2.14 -0.07 0.00 -1.01 0.00 0.00 37.83 34.61 3kd9 s LYS 172 CO 0.00 -0.22 1.23 1.21 0.51 0.00 0.00 175.35 178.08 3kd9 s ASN 173 N -2.44 5.88 -0.02 2.83 3.84 0.23 -4.39 114.94 120.87 3kd9 s ASN 173 Ca 0.62 2.46 0.00 0.00 0.21 0.00 0.00 52.86 56.15 3kd9 s ASN 173 Cb -0.11 -2.61 0.02 0.00 -0.55 0.00 0.00 41.25 38.00 3kd9 s ASN 173 CO 0.21 -1.13 0.01 -0.69 -2.79 0.00 0.00 177.10 172.71 3kd9 s VAL 174 N -1.46 0.09 -0.13 -5.21 1.01 -1.26 -1.88 120.40 111.56 3kd9 s VAL 174 Ca 0.66 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.72 3kd9 s VAL 174 Cb -0.32 -0.18 0.04 0.00 0.00 0.00 0.00 36.38 35.91 3kd9 s VAL 174 CO 0.39 0.10 -0.03 -0.89 0.00 0.00 0.00 175.10 174.67 3kd9 s THR 175 N 0.81 0.79 -0.04 3.92 2.01 -0.51 -1.28 115.64 121.33 3kd9 s THR 175 Ca -0.08 -0.31 -0.09 0.00 0.31 0.00 0.00 61.69 61.53 3kd9 s THR 175 Cb -0.11 -0.97 -0.05 0.00 0.01 0.00 0.00 72.50 71.39 3kd9 s THR 175 CO -0.02 0.18 0.26 -0.32 -0.69 0.00 0.00 174.62 174.03 3kd9 s MET 176 N 1.79 3.61 -0.32 4.92 1.75 -0.80 -0.57 119.30 129.68 3kd9 s MET 176 Ca 0.03 0.03 -0.01 0.00 -1.25 0.00 0.00 55.69 54.49 3kd9 s MET 176 Cb -0.14 -3.15 0.10 0.00 2.84 0.00 0.00 34.83 34.48 3kd9 s MET 176 CO -0.07 0.71 0.12 0.42 -0.65 0.00 0.00 175.02 175.54 3kd9 s ILE 177 N -1.14 0.78 -0.11 10.11 1.01 -0.30 -1.94 121.20 129.60 3kd9 s ILE 177 Ca 0.22 -1.42 -0.04 0.00 0.00 0.00 0.00 60.65 59.41 3kd9 s ILE 177 Cb -0.14 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 3kd9 s ILE 177 CO 0.11 -0.71 0.03 0.54 0.00 0.00 0.00 174.94 174.90 3kd9 s VAL 178 N 1.56 4.52 -0.43 2.92 0.11 -0.61 -2.27 120.40 126.20 3kd9 s VAL 178 Ca 0.11 -0.16 0.23 0.00 -2.93 0.00 0.00 61.98 59.23 3kd9 s VAL 178 Cb -0.18 -2.94 0.34 0.00 -1.53 0.00 0.00 36.38 32.07 3kd9 s VAL 178 CO -0.24 0.57 1.62 0.08 -3.33 0.00 0.00 175.10 173.80 3kd9 h ARG 179 N 5.55 0.00 -7.58 1.54 0.11 -1.86 0.36 114.38 112.50 3kd9 h ARG 179 Ca -0.47 0.00 -0.46 0.00 0.10 0.00 0.00 59.98 59.15 3kd9 h ARG 179 Cb 1.19 0.00 0.12 0.00 1.11 0.00 0.00 29.97 32.40 3kd9 h ARG 179 CO 0.58 0.00 0.35 0.20 0.10 0.00 0.00 179.97 181.21 3kd9 s GLY 180 N -4.21 1.61 0.00 0.08 0.00 -1.26 -3.21 107.32 100.33 3kd9 s GLY 180 Ca 0.07 -0.67 0.14 0.00 0.00 0.00 0.00 44.72 44.26 3kd9 s GLY 180 CO 0.67 -0.10 1.50 -1.84 0.00 0.00 0.00 173.10 173.33 3kd9 n GLU 181 N -3.62 0.94 -3.64 2.90 0.00 -1.26 -1.92 120.64 114.04 3kd9 n GLU 181 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 57.16 57.22 3kd9 n GLU 181 Cb 0.60 -1.24 -0.03 0.00 0.00 0.00 0.00 31.44 30.78 3kd9 n GLU 181 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 3kd9 s ARG 182 N -2.00 0.08 0.91 3.44 1.70 -1.26 -4.97 118.95 116.85 3kd9 s ARG 182 Ca 0.21 -0.01 -0.12 0.00 -0.47 0.00 0.00 55.73 55.34 3kd9 s ARG 182 Cb 0.10 0.04 0.14 0.00 -0.57 0.00 0.00 34.95 34.65 3kd9 s ARG 182 CO 0.16 -0.03 1.09 0.14 -1.08 0.00 0.00 175.30 175.59 3kd9 s VAL 183 N -1.75 2.57 -0.27 4.99 -7.23 -1.26 -3.18 120.40 114.27 3kd9 s VAL 183 Ca 0.10 0.19 0.00 0.00 -1.81 0.00 0.00 61.98 60.46 3kd9 s VAL 183 Cb -0.01 -2.67 0.00 0.00 0.56 0.00 0.00 36.38 34.26 3kd9 s VAL 183 CO -0.04 -0.24 0.00 0.18 -0.31 0.00 0.00 175.10 174.68 3kd9 n LEU 184 N -3.93 -0.26 -0.32 1.32 4.77 0.11 -4.78 117.00 113.91 3kd9 n LEU 184 Ca 0.07 0.31 0.25 0.00 -0.03 0.00 0.00 56.01 56.61 3kd9 n LEU 184 Cb 0.55 -1.13 0.46 0.00 -2.33 0.00 0.00 43.42 40.97 3kd9 n LEU 184 CO 0.56 -0.07 0.92 -1.14 -1.33 0.00 0.00 177.39 176.33 3kd9 n ARG 185 N -2.13 -0.06 -0.32 3.23 0.63 -1.19 -1.12 116.66 115.69 3kd9 n ARG 185 Ca -0.03 1.36 0.10 0.00 -0.92 0.00 0.00 57.85 58.37 3kd9 n ARG 185 Cb 0.39 -2.34 0.28 0.00 0.45 0.00 0.00 32.46 31.24 3kd9 n ARG 185 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3kd9 n ARG 186 N -5.26 2.74 -0.01 -0.14 1.74 -1.26 -4.51 116.66 109.96 3kd9 n ARG 186 Ca 0.31 -2.51 -0.00 0.00 -0.77 0.00 0.00 57.85 54.88 3kd9 n ARG 186 Cb 1.06 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.98 3kd9 n ARG 186 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3kd9 n SER 187 N 1.40 4.56 -4.10 0.55 7.64 -0.28 -5.06 113.62 118.33 3kd9 n SER 187 Ca 0.21 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.97 3kd9 n SER 187 Cb 0.58 0.77 -0.11 0.00 -1.01 0.00 0.00 64.21 64.44 3kd9 n SER 187 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3kd9 s PHE 188 N -2.08 0.76 0.55 1.43 0.08 -1.00 -4.92 117.98 112.80 3kd9 s PHE 188 Ca -0.01 -0.62 -0.18 0.00 0.12 0.00 0.00 56.93 56.24 3kd9 s PHE 188 Cb 0.01 -0.45 -0.06 0.00 -0.57 0.00 0.00 43.02 41.95 3kd9 s PHE 188 CO 0.08 -0.10 1.05 -0.51 -0.10 0.00 0.00 175.22 175.64 3kd9 s ASP 189 N -2.03 6.03 0.20 1.36 1.01 -1.26 -4.70 116.67 117.28 3kd9 s ASP 189 Ca -0.03 1.86 -0.21 0.00 0.71 0.00 0.00 52.55 54.88 3kd9 s ASP 189 Cb -0.05 -2.54 0.15 0.00 1.01 0.00 0.00 42.92 41.48 3kd9 s ASP 189 CO -0.01 -1.00 1.57 0.50 0.21 0.00 0.00 175.17 176.44 3kd9 h LYS 190 N 0.89 -0.10 -0.41 8.23 3.64 -1.96 -1.57 116.57 125.29 3kd9 h LYS 190 Ca -0.48 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.01 3kd9 h LYS 190 Cb 1.22 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.04 3kd9 h LYS 190 CO 0.58 -0.07 0.28 1.05 -2.27 0.00 0.00 179.45 179.03 3kd9 h GLU 191 N -0.11 0.10 -0.10 1.90 9.09 -2.00 0.27 114.58 123.74 3kd9 h GLU 191 Ca 0.26 -0.01 -0.20 0.00 0.05 0.00 0.00 59.36 59.47 3kd9 h GLU 191 Cb 0.57 -0.02 0.01 0.00 -1.65 0.00 0.00 28.75 27.65 3kd9 h GLU 191 CO -0.81 0.07 -0.72 0.28 0.05 0.00 0.00 179.01 177.88 3kd9 h VAL 192 N 0.10 1.32 0.16 -1.06 2.07 -1.68 -3.32 116.25 113.84 3kd9 h VAL 192 Ca 0.19 -1.98 -0.01 0.00 0.82 0.00 0.00 66.70 65.72 3kd9 h VAL 192 Cb 0.62 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 3kd9 h VAL 192 CO -0.02 0.61 -0.08 0.74 0.02 0.00 0.00 177.57 178.84 3kd9 h THR 193 N 0.33 0.87 -1.00 2.57 2.02 -0.45 -3.14 112.91 114.11 3kd9 h THR 193 Ca -0.06 -0.13 0.28 0.00 0.77 0.00 0.00 66.41 67.27 3kd9 h THR 193 Cb 1.37 0.95 -0.14 0.00 -1.74 0.00 0.00 68.15 68.59 3kd9 h THR 193 CO 0.15 0.03 0.57 0.44 0.37 0.00 0.00 175.52 177.07 3kd9 h ASP 194 N -0.28 0.58 -0.40 4.18 5.19 -0.66 0.31 116.42 125.34 3kd9 h ASP 194 Ca -0.02 0.16 -0.04 0.00 -0.62 0.00 0.00 57.03 56.51 3kd9 h ASP 194 Cb 0.22 0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.79 3kd9 h ASP 194 CO 0.04 -0.01 0.12 0.40 -3.12 0.00 0.00 179.24 176.67 3kd9 h ILE 195 N 0.45 1.20 0.01 0.35 5.03 -1.66 -2.09 117.51 120.81 3kd9 h ILE 195 Ca 0.68 -0.69 -0.23 0.00 -0.12 0.00 0.00 64.86 64.49 3kd9 h ILE 195 Cb 1.41 0.71 0.02 0.00 -3.03 0.00 0.00 36.82 35.93 3kd9 h ILE 195 CO -0.54 0.26 -0.92 0.25 -0.68 0.00 0.00 178.15 176.52 3kd9 h LEU 196 N 0.67 0.78 -1.20 1.44 5.85 -0.52 -3.26 115.31 119.08 3kd9 h LEU 196 Ca 0.15 -0.76 -0.00 0.00 0.84 0.00 0.00 57.88 58.11 3kd9 h LEU 196 Cb 0.23 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 3kd9 h LEU 196 CO -0.01 1.44 0.46 -0.33 -0.34 0.00 0.00 178.44 179.67 3kd9 h GLU 197 N 0.21 1.01 -0.37 1.25 5.08 -1.07 -0.82 114.58 119.87 3kd9 h GLU 197 Ca -0.12 -0.08 0.08 0.00 -1.00 0.00 0.00 59.36 58.24 3kd9 h GLU 197 Cb 1.60 -0.22 -0.07 0.00 0.50 0.00 0.00 28.75 30.56 3kd9 h GLU 197 CO 0.18 0.69 -0.12 1.49 -1.00 0.00 0.00 179.01 180.25 3kd9 h GLU 198 N 1.03 -0.04 -0.64 2.33 4.57 -1.42 0.53 114.58 120.94 3kd9 h GLU 198 Ca 0.27 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.39 3kd9 h GLU 198 Cb -0.06 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 3kd9 h GLU 198 CO -0.05 -0.03 0.16 -0.22 -1.18 0.00 0.00 179.01 177.70 3kd9 h LYS 199 N -0.04 1.02 -0.43 1.92 1.63 -1.47 -3.12 116.57 116.07 3kd9 h LYS 199 Ca 0.18 -0.24 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 3kd9 h LYS 199 Cb 0.32 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.79 3kd9 h LYS 199 CO -0.40 0.91 0.19 1.25 -3.45 0.00 0.00 179.45 177.95 3kd9 h LEU 200 N 0.94 0.57 -1.09 5.20 5.85 0.34 -2.92 115.31 124.20 3kd9 h LEU 200 Ca 0.20 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3kd9 h LEU 200 Cb 0.35 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.23 3kd9 h LEU 200 CO 0.00 0.56 0.00 0.29 -0.34 0.00 0.00 178.44 178.95 3kd9 n LYS 201 N -4.65 0.62 0.00 1.25 5.02 0.17 -1.48 118.16 119.09 3kd9 n LYS 201 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3kd9 n LYS 201 Cb 0.13 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 3kd9 n LYS 201 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3kd9 n LYS 202 N 0.23 -0.11 0.00 1.97 5.02 -1.10 -4.79 118.16 119.38 3kd9 n LYS 202 Ca 0.00 -0.47 0.00 0.00 -2.02 0.00 0.00 58.31 55.82 3kd9 n LYS 202 Cb 0.17 -0.81 0.00 0.00 -0.02 0.00 0.00 35.03 34.37 3kd9 n LYS 202 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3kd9 n HIS 203 N -0.06 0.00 -3.83 2.13 8.25 -0.55 -5.10 115.22 116.06 3kd9 n HIS 203 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.34 3kd9 n HIS 203 Cb 0.15 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.16 3kd9 n HIS 203 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3kd9 s VAL 204 N 0.00 0.06 -0.66 1.59 1.01 -0.70 -4.75 120.40 116.96 3kd9 s VAL 204 Ca 0.00 -0.53 -0.28 0.00 0.00 0.00 0.00 61.98 61.18 3kd9 s VAL 204 Cb 0.00 -0.47 0.03 0.00 0.00 0.00 0.00 36.38 35.94 3kd9 s VAL 204 CO 0.00 -0.29 1.25 0.21 0.00 0.00 0.00 175.10 176.27 3kd9 s ASN 205 N -1.14 6.29 -0.40 3.32 3.04 -0.40 -4.48 114.94 121.16 3kd9 s ASN 205 Ca -0.12 -0.15 -0.16 0.00 0.04 0.00 0.00 52.86 52.47 3kd9 s ASN 205 Cb -0.06 -2.56 0.01 0.00 -1.54 0.00 0.00 41.25 37.11 3kd9 s ASN 205 CO 0.02 -1.67 0.38 -0.22 -3.04 0.00 0.00 177.10 172.57 3kd9 s LEU 206 N 5.42 4.85 -0.24 3.21 2.96 -1.26 -1.91 118.68 131.71 3kd9 s LEU 206 Ca 0.40 -0.66 -0.06 0.00 -0.22 0.00 0.00 54.13 53.59 3kd9 s LEU 206 Cb -0.08 -2.30 -0.02 0.00 0.50 0.00 0.00 46.19 44.29 3kd9 s LEU 206 CO 0.20 -0.49 0.03 -0.13 -1.32 0.00 0.00 176.35 174.65 3kd9 s ARG 207 N 1.97 3.57 0.23 1.98 1.81 -0.82 -5.03 118.95 122.66 3kd9 s ARG 207 Ca 0.10 -0.52 0.07 0.00 -1.72 0.00 0.00 55.73 53.65 3kd9 s ARG 207 Cb -0.18 -3.21 -0.04 0.00 -0.45 0.00 0.00 34.95 31.08 3kd9 s ARG 207 CO 0.12 -0.17 0.16 -0.51 -0.68 0.00 0.00 175.30 174.22 3kd9 s LEU 208 N 1.50 3.75 -0.97 2.53 1.43 -1.26 -1.58 118.68 124.10 3kd9 s LEU 208 Ca 0.06 -0.25 -0.08 0.00 -1.03 0.00 0.00 54.13 52.82 3kd9 s LEU 208 Cb -0.15 -2.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.74 3kd9 s LEU 208 CO 0.01 -0.00 0.79 0.00 0.23 0.00 0.00 176.35 177.38 3kd9 n GLN 209 N -0.90 -1.60 -3.56 1.70 6.02 0.13 -4.93 117.38 114.23 3kd9 n GLN 209 Ca -0.08 0.91 -0.11 0.00 -0.01 0.00 0.00 57.00 57.71 3kd9 n GLN 209 Cb 0.57 -4.95 -0.11 0.00 1.02 0.00 0.00 30.24 26.77 3kd9 n GLN 209 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3kd9 s GLU 210 N -4.54 0.25 -0.09 -1.09 2.02 -1.15 -4.94 118.70 109.17 3kd9 s GLU 210 Ca 0.29 0.71 -0.27 0.00 0.02 0.00 0.00 54.97 55.73 3kd9 s GLU 210 Cb -0.07 -0.18 -0.02 0.00 0.10 0.00 0.00 34.13 33.95 3kd9 s GLU 210 CO 0.79 -0.41 0.87 0.42 0.02 0.00 0.00 175.26 176.96 3kd9 s ILE 211 N 2.50 4.90 0.36 -1.63 1.09 -1.26 -3.90 121.20 123.26 3kd9 s ILE 211 Ca 0.04 1.78 -0.26 0.00 -1.10 0.00 0.00 60.65 61.11 3kd9 s ILE 211 Cb -0.13 -4.20 -0.09 0.00 -1.06 0.00 0.00 42.46 36.98 3kd9 s ILE 211 CO -0.12 0.11 1.06 -0.89 -0.10 0.00 0.00 174.94 175.00 3kd9 s THR 212 N 1.53 3.65 -0.06 2.92 2.01 -1.26 -3.17 115.64 121.26 3kd9 s THR 212 Ca 0.44 1.38 -0.00 0.00 0.31 0.00 0.00 61.69 63.82 3kd9 s THR 212 Cb -0.18 -3.77 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 3kd9 s THR 212 CO 0.19 0.12 -0.05 0.23 -0.69 0.00 0.00 174.62 174.42 3kd9 n MET 213 N 0.33 0.14 0.00 4.92 0.00 -1.10 -4.95 117.12 116.45 3kd9 n MET 213 Ca 0.03 0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.77 3kd9 n MET 213 Cb 0.48 -1.06 0.00 0.00 0.00 0.00 0.00 33.22 32.64 3kd9 n MET 213 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 3kd9 n LYS 214 N -2.74 0.00 -3.75 0.03 0.00 -1.26 -2.55 118.16 107.89 3kd9 n LYS 214 Ca -0.10 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.85 3kd9 n LYS 214 Cb 0.60 0.00 -0.09 0.00 -0.00 0.00 0.00 35.03 35.54 3kd9 n LYS 214 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 3kd9 s ILE 215 N 0.00 5.22 0.47 0.58 -4.36 -0.97 -3.80 121.20 118.34 3kd9 s ILE 215 Ca 0.00 0.13 0.08 0.00 -0.26 0.00 0.00 60.65 60.60 3kd9 s ILE 215 Cb 0.00 -3.40 0.03 0.00 1.25 0.00 0.00 42.46 40.33 3kd9 s ILE 215 CO 0.00 0.40 0.59 -1.83 0.24 0.00 0.00 174.94 174.34 3kd9 s GLU 216 N 0.71 2.61 0.00 0.37 -1.05 -0.63 -4.54 118.70 116.18 3kd9 s GLU 216 Ca 0.07 -1.44 0.00 0.00 -0.15 0.00 0.00 54.97 53.45 3kd9 s GLU 216 Cb -0.12 -2.63 0.00 0.00 -0.44 0.00 0.00 34.13 30.93 3kd9 s GLU 216 CO 0.01 -0.44 0.00 0.41 0.95 0.00 0.00 175.26 176.20 3kd9 n GLY 217 N -1.90 -0.52 0.00 -3.83 0.00 -1.26 -0.20 105.19 97.48 3kd9 n GLY 217 Ca 0.09 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.18 3kd9 n GLY 217 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kd9 n GLU 218 N 0.00 0.00 -0.07 1.61 -0.58 -1.26 -4.91 120.64 115.43 3kd9 n GLU 218 Ca 0.00 0.00 -0.07 0.00 -0.42 0.00 0.00 57.16 56.67 3kd9 n GLU 218 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 3kd9 n GLU 218 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3kd9 h GLU 219 N 0.00 0.00 -6.16 3.49 4.39 -2.01 -3.47 114.58 110.83 3kd9 h GLU 219 Ca 0.00 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.12 3kd9 h GLU 219 Cb 0.00 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.61 3kd9 h GLU 219 CO 0.00 0.21 -0.26 -0.98 -1.16 0.00 0.00 179.01 176.82 3kd9 s ARG 220 N -2.11 3.70 0.81 2.33 1.70 -1.26 -1.83 118.95 122.29 3kd9 s ARG 220 Ca -0.14 0.08 -0.15 0.00 -0.47 0.00 0.00 55.73 55.05 3kd9 s ARG 220 Cb 0.02 -2.91 -0.02 0.00 -0.57 0.00 0.00 34.95 31.48 3kd9 s ARG 220 CO 0.26 0.50 0.45 1.55 -1.08 0.00 0.00 175.30 176.98 3kd9 n VAL 221 N 0.49 1.12 0.05 4.99 3.14 -1.26 -4.70 118.33 122.16 3kd9 n VAL 221 Ca -0.05 -0.33 0.00 0.00 -2.96 0.00 0.00 64.34 61.00 3kd9 n VAL 221 Cb 0.52 -0.68 0.00 0.00 -1.06 0.00 0.00 33.84 32.62 3kd9 n VAL 221 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 3kd9 n GLU 222 N -0.98 0.00 -3.92 1.45 -0.58 0.72 -4.65 120.64 112.68 3kd9 n GLU 222 Ca 0.09 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.71 3kd9 n GLU 222 Cb 0.51 -0.27 -0.13 0.00 -0.57 0.00 0.00 31.44 30.98 3kd9 n GLU 222 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3kd9 s LYS 223 N -1.73 0.13 -0.14 3.49 -0.14 -0.81 -1.25 119.74 119.29 3kd9 s LYS 223 Ca 0.00 -0.20 -0.05 0.00 -1.36 0.00 0.00 55.97 54.35 3kd9 s LYS 223 Cb 0.00 -0.00 -0.04 0.00 -1.68 0.00 0.00 37.83 36.11 3kd9 s LYS 223 CO 0.00 -0.01 0.05 0.54 -0.76 0.00 0.00 175.35 175.17 3kd9 s VAL 224 N -0.46 4.69 0.17 3.17 0.11 -0.60 -1.60 120.40 125.89 3kd9 s VAL 224 Ca -0.05 -0.08 0.10 0.00 -2.93 0.00 0.00 61.98 59.02 3kd9 s VAL 224 Cb -0.03 -3.06 -0.04 0.00 -1.53 0.00 0.00 36.38 31.72 3kd9 s VAL 224 CO -0.00 0.53 -0.17 0.54 -3.33 0.00 0.00 175.10 172.66 3kd9 s VAL 225 N -0.21 2.76 0.08 2.04 0.11 -1.25 -1.43 120.40 122.51 3kd9 s VAL 225 Ca 0.07 -1.79 -0.04 0.00 -2.93 0.00 0.00 61.98 57.29 3kd9 s VAL 225 Cb -0.12 -2.33 -0.03 0.00 -1.53 0.00 0.00 36.38 32.37 3kd9 s VAL 225 CO 0.02 -0.07 0.07 0.28 -3.33 0.00 0.00 175.10 172.06 3kd9 s THR 226 N -1.58 0.17 0.00 5.04 -1.32 -0.68 -2.71 115.64 114.56 3kd9 s THR 226 Ca 0.22 -1.58 0.00 0.00 -1.21 0.00 0.00 61.69 59.11 3kd9 s THR 226 Cb -0.09 -1.54 0.00 0.00 -1.51 0.00 0.00 72.50 69.37 3kd9 s THR 226 CO 0.12 -0.78 0.20 -0.90 -2.21 0.00 0.00 174.62 171.05 3kd9 n ASP 227 N 0.01 0.57 0.00 8.08 5.75 -1.19 -1.68 116.55 128.09 3kd9 n ASP 227 Ca -0.13 -0.58 0.00 0.00 -0.01 0.00 0.00 54.79 54.07 3kd9 n ASP 227 Cb 0.62 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 3kd9 n ASP 227 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3kd9 n ALA 228 N 1.22 0.00 -3.61 2.12 0.00 -1.26 -4.97 120.51 114.02 3kd9 n ALA 228 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 3kd9 n ALA 228 Cb 0.08 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.54 3kd9 n ALA 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kd9 n GLY 229 N 0.00 0.53 3.02 0.00 0.00 -0.67 -5.17 105.19 102.89 3kd9 n GLY 229 Ca 0.00 -1.00 -0.14 0.00 0.00 0.00 0.00 46.02 44.88 3kd9 n GLY 229 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kd9 s GLU 230 N -2.02 0.49 -0.05 1.61 0.41 -1.26 -1.68 118.70 116.19 3kd9 s GLU 230 Ca 0.17 -0.52 -0.04 0.00 -0.41 0.00 0.00 54.97 54.17 3kd9 s GLU 230 Cb -0.01 -0.35 0.02 0.00 -1.78 0.00 0.00 34.13 32.01 3kd9 s GLU 230 CO 0.01 0.08 0.14 0.71 -0.49 0.00 0.00 175.26 175.70 3kd9 s TYR 231 N -0.86 -0.15 0.68 1.61 1.51 -0.51 -5.03 117.35 114.60 3kd9 s TYR 231 Ca -0.05 0.38 -0.15 0.00 -1.01 0.00 0.00 57.07 56.24 3kd9 s TYR 231 Cb -0.07 0.03 0.01 0.00 -0.11 0.00 0.00 41.96 41.82 3kd9 s TYR 231 CO 0.00 -0.09 1.15 0.21 -1.11 0.00 0.00 175.55 175.71 3kd9 s LYS 232 N 0.25 2.57 -0.30 -0.62 2.47 -1.26 -1.55 119.74 121.30 3kd9 s LYS 232 Ca -0.02 1.55 -0.17 0.00 -1.56 0.00 0.00 55.97 55.77 3kd9 s LYS 232 Cb -0.03 -1.91 0.18 0.00 -1.46 0.00 0.00 37.83 34.62 3kd9 s LYS 232 CO -0.01 -1.45 1.15 0.00 0.16 0.00 0.00 175.35 175.20 3kd9 s ALA 233 N -2.17 -2.98 -0.18 3.13 0.00 -0.38 -4.72 121.76 114.46 3kd9 s ALA 233 Ca 0.70 1.92 -0.07 0.00 0.00 0.00 0.00 51.96 54.51 3kd9 s ALA 233 Cb -0.24 -2.16 -0.22 0.00 0.00 0.00 0.00 23.12 20.50 3kd9 s ALA 233 CO 0.42 -0.91 0.15 0.39 0.00 0.00 0.00 175.76 175.81 3kd9 n GLU 234 N 4.62 0.70 -4.66 0.00 4.71 0.45 -3.64 120.64 122.83 3kd9 n GLU 234 Ca -0.08 0.27 -0.28 0.00 -0.01 0.00 0.00 57.16 57.06 3kd9 n GLU 234 Cb 0.54 -1.65 -0.14 0.00 -1.01 0.00 0.00 31.44 29.18 3kd9 n GLU 234 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 3kd9 s LEU 235 N -7.05 2.21 0.03 -4.62 1.98 -1.20 -4.57 118.68 105.46 3kd9 s LEU 235 Ca -0.27 -0.62 -0.03 0.00 -2.89 0.00 0.00 54.13 50.32 3kd9 s LEU 235 Cb 0.08 -1.15 -0.02 0.00 0.66 0.00 0.00 46.19 45.76 3kd9 s LEU 235 CO 0.69 0.20 0.04 0.68 -1.89 0.00 0.00 176.35 176.06 3kd9 s VAL 236 N -0.90 0.13 -0.04 1.68 -7.23 -1.19 -1.75 120.40 111.10 3kd9 s VAL 236 Ca 0.11 -1.04 0.03 0.00 -1.81 0.00 0.00 61.98 59.27 3kd9 s VAL 236 Cb -0.10 -0.63 0.00 0.00 0.56 0.00 0.00 36.38 36.21 3kd9 s VAL 236 CO 0.03 -0.57 -0.14 -0.63 -0.31 0.00 0.00 175.10 173.48 3kd9 s ILE 237 N -2.09 1.17 -0.54 -0.62 -1.09 -0.36 -0.98 121.20 116.69 3kd9 s ILE 237 Ca -0.10 -0.56 -0.14 0.00 -2.23 0.00 0.00 60.65 57.62 3kd9 s ILE 237 Cb -0.05 -1.03 0.13 0.00 -1.58 0.00 0.00 42.46 39.94 3kd9 s ILE 237 CO -0.03 0.35 0.48 -0.76 -1.23 0.00 0.00 174.94 173.75 3kd9 s LEU 238 N 0.20 6.08 -0.51 2.97 1.02 -0.44 -1.33 118.68 126.67 3kd9 s LEU 238 Ca -0.05 -1.91 0.04 0.00 0.02 0.00 0.00 54.13 52.22 3kd9 s LEU 238 Cb -0.11 -2.15 0.40 0.00 0.02 0.00 0.00 46.19 44.35 3kd9 s LEU 238 CO 0.02 -0.78 1.22 0.00 0.02 0.00 0.00 176.35 176.82 3kd9 n ALA 239 N 5.03 5.23 0.87 4.21 0.00 -0.38 -4.41 120.51 131.07 3kd9 n ALA 239 Ca -0.10 -4.34 0.09 0.00 0.00 0.00 0.00 53.44 49.09 3kd9 n ALA 239 Cb 0.41 -0.76 0.27 0.00 0.00 0.00 0.00 19.45 19.36 3kd9 n ALA 239 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3kd9 n THR 240 N -0.46 0.40 0.00 0.00 -2.24 -1.24 -4.42 114.28 106.33 3kd9 n THR 240 Ca 0.40 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 3kd9 n THR 240 Cb 0.57 0.39 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 3kd9 n THR 240 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kd9 n GLY 241 N 1.19 2.17 3.22 3.38 0.00 -1.26 -4.95 105.19 108.93 3kd9 n GLY 241 Ca 0.15 -1.91 -0.13 0.00 0.00 0.00 0.00 46.02 44.13 3kd9 n GLY 241 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kd9 s ILE 242 N -1.57 0.97 0.02 -0.61 2.07 -1.26 -2.02 121.20 118.80 3kd9 s ILE 242 Ca 0.00 -2.00 0.01 0.00 -1.41 0.00 0.00 60.65 57.24 3kd9 s ILE 242 Cb 0.00 -1.77 -0.02 0.00 0.13 0.00 0.00 42.46 40.80 3kd9 s ILE 242 CO 0.00 -0.80 -0.04 -0.75 -1.91 0.00 0.00 174.94 171.44 3kd9 s LYS 243 N -3.78 0.34 0.10 3.50 2.20 0.08 -4.80 119.74 117.38 3kd9 s LYS 243 Ca 0.15 -0.48 -0.31 0.00 -0.36 0.00 0.00 55.97 54.97 3kd9 s LYS 243 Cb 0.04 -0.11 -0.07 0.00 -1.51 0.00 0.00 37.83 36.17 3kd9 s LYS 243 CO -0.02 0.01 1.30 -2.14 -0.36 0.00 0.00 175.35 174.15 3kd9 s PRO 244 N -1.02 4.37 -1.44 4.03 0.02 -1.26 -0.60 135.00 139.10 3kd9 s PRO 244 Ca -0.08 1.94 -0.12 0.00 0.02 0.00 0.00 61.00 62.76 3kd9 s PRO 244 Cb -0.07 -3.29 0.05 0.00 0.02 0.00 0.00 34.50 31.21 3kd9 s PRO 244 CO -0.00 -0.35 2.29 0.09 -0.33 0.00 0.00 177.00 178.70 3kd9 n ASN 245 N 3.86 5.15 0.13 2.53 3.02 -1.00 -4.65 115.26 124.30 3kd9 n ASN 245 Ca 0.10 -2.87 0.13 0.00 -0.03 0.00 0.00 54.58 51.91 3kd9 n ASN 245 Cb 0.44 -1.59 0.30 0.00 -0.61 0.00 0.00 39.78 38.32 3kd9 n ASN 245 CO 0.00 0.00 0.00 0.16 -2.62 0.00 0.00 177.26 174.80 3kd9 h ILE 246 N 3.70 0.00 -0.85 2.41 3.07 -1.89 -3.41 117.51 120.54 3kd9 h ILE 246 Ca 0.59 -0.63 0.14 0.00 1.55 0.00 0.00 64.86 66.51 3kd9 h ILE 246 Cb 0.56 1.56 -0.14 0.00 -0.27 0.00 0.00 36.82 38.52 3kd9 h ILE 246 CO 1.80 0.00 -0.36 -0.33 -1.05 0.00 0.00 178.15 178.21 3kd9 h GLU 247 N 0.00 -0.06 -0.40 0.16 4.39 -1.99 -0.63 114.58 116.05 3kd9 h GLU 247 Ca 0.00 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.75 3kd9 h GLU 247 Cb 0.81 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.45 3kd9 h GLU 247 CO 0.00 -0.04 0.27 1.25 -1.16 0.00 0.00 179.01 179.34 3kd9 h LEU 248 N -0.06 0.29 -0.16 1.33 5.85 -1.97 -2.12 115.31 118.47 3kd9 h LEU 248 Ca 0.31 -0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.80 3kd9 h LEU 248 Cb 0.58 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 3kd9 h LEU 248 CO -0.88 0.19 -0.97 0.00 -0.34 0.00 0.00 178.44 176.45 3kd9 h ALA 249 N 1.78 0.37 -0.24 1.25 0.00 -1.43 -3.04 119.26 117.94 3kd9 h ALA 249 Ca 0.17 -0.74 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 3kd9 h ALA 249 Cb 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3kd9 h ALA 249 CO -0.04 0.86 0.14 0.87 0.00 0.00 0.00 179.25 181.08 3kd9 h LYS 250 N 0.18 0.33 -0.03 0.00 1.57 -0.88 0.30 116.57 118.05 3kd9 h LYS 250 Ca -0.08 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.68 3kd9 h LYS 250 Cb 1.61 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.85 3kd9 h LYS 250 CO 0.16 0.24 0.03 0.37 -0.57 0.00 0.00 179.45 179.68 3kd9 h GLN 251 N 0.34 0.00 -0.52 3.15 4.15 -1.36 0.48 115.11 121.34 3kd9 h GLN 251 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.51 3kd9 h GLN 251 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 3kd9 h GLN 251 CO -0.02 0.00 0.00 -0.11 -1.93 0.00 0.00 178.83 176.77 3kd9 n LEU 252 N -3.82 3.58 -2.55 -2.39 0.00 0.10 -4.92 117.00 107.00 3kd9 n LEU 252 Ca -0.02 -2.10 -0.19 0.00 0.00 0.00 0.00 56.01 53.69 3kd9 n LEU 252 Cb 0.12 -0.39 0.03 0.00 0.00 0.00 0.00 43.42 43.18 3kd9 n LEU 252 CO 0.27 0.84 -0.01 0.61 0.00 0.00 0.00 177.39 179.10 3kd9 n GLY 253 N 0.96 -0.33 3.69 -3.96 0.00 0.16 -4.96 105.19 100.75 3kd9 n GLY 253 Ca 0.19 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3kd9 n GLY 253 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kd9 s VAL 254 N -3.07 4.83 0.20 1.61 1.01 -0.83 -4.84 120.40 119.31 3kd9 s VAL 254 Ca 0.25 1.97 -0.32 0.00 0.00 0.00 0.00 61.98 63.88 3kd9 s VAL 254 Cb -0.11 -4.28 -0.12 0.00 0.00 0.00 0.00 36.38 31.87 3kd9 s VAL 254 CO 0.30 0.07 1.73 -0.60 0.00 0.00 0.00 175.10 176.60 3kd9 s ARG 255 N 1.66 4.13 0.01 2.72 3.52 -1.26 -4.60 118.95 125.12 3kd9 s ARG 255 Ca 0.48 2.60 0.00 0.00 -0.13 0.00 0.00 55.73 58.69 3kd9 s ARG 255 Cb -0.19 -3.13 -0.04 0.00 -1.56 0.00 0.00 34.95 30.03 3kd9 s ARG 255 CO 0.20 -0.76 0.08 0.96 -0.81 0.00 0.00 175.30 174.97 3kd9 s ILE 256 N 1.35 4.66 0.84 4.11 -5.25 -1.26 -2.44 121.20 123.21 3kd9 s ILE 256 Ca 0.75 -0.48 -0.12 0.00 -0.99 0.00 0.00 60.65 59.81 3kd9 s ILE 256 Cb -0.49 -3.15 0.12 0.00 2.95 0.00 0.00 42.46 41.88 3kd9 s ILE 256 CO 0.32 0.31 1.19 -0.83 -1.79 0.00 0.00 174.94 174.15 3kd9 s GLY 257 N -1.84 1.67 0.57 6.27 0.00 0.60 -4.69 107.32 109.90 3kd9 s GLY 257 Ca 0.24 -0.90 0.30 0.00 0.00 0.00 0.00 44.72 44.36 3kd9 s GLY 257 CO 0.15 -0.33 2.19 -2.09 0.00 0.00 0.00 173.10 173.02 3kd9 h GLU 258 N -1.16 0.00 0.00 2.90 4.57 -1.97 0.73 114.58 119.66 3kd9 h GLU 258 Ca -0.45 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.72 3kd9 h GLU 258 Cb 1.30 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.88 3kd9 h GLU 258 CO 0.56 0.05 -0.06 1.79 -1.18 0.00 0.00 179.01 180.16 3kd9 h THR 259 N 0.00 0.13 0.00 0.32 1.35 -1.92 -3.47 112.91 109.32 3kd9 h THR 259 Ca -0.00 -0.94 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 3kd9 h THR 259 Cb 0.14 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 3kd9 h THR 259 CO 0.01 0.06 0.00 0.61 -0.25 0.00 0.00 175.52 175.95 3kd9 n GLY 260 N 0.63 2.11 3.92 5.82 0.00 0.25 -5.00 105.19 112.93 3kd9 n GLY 260 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 3kd9 n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kd9 s ALA 261 N -2.20 2.43 0.17 4.61 0.00 -1.26 -4.61 121.76 120.89 3kd9 s ALA 261 Ca 0.00 -1.03 -0.31 0.00 0.00 0.00 0.00 51.96 50.63 3kd9 s ALA 261 Cb 0.00 -2.81 -0.08 0.00 0.00 0.00 0.00 23.12 20.22 3kd9 s ALA 261 CO 0.00 -2.14 1.34 0.42 0.00 0.00 0.00 175.76 175.39 3kd9 s ILE 262 N -3.76 3.24 0.38 0.00 1.01 0.30 -0.29 121.20 122.08 3kd9 s ILE 262 Ca 0.70 0.96 -0.26 0.00 0.00 0.00 0.00 60.65 62.04 3kd9 s ILE 262 Cb -0.06 -3.61 -0.09 0.00 0.01 0.00 0.00 42.46 38.70 3kd9 s ILE 262 CO 0.51 0.12 1.23 0.86 0.00 0.00 0.00 174.94 177.66 3kd9 s TRP 263 N 0.52 3.01 0.22 3.97 -0.00 -1.02 0.42 118.94 126.05 3kd9 s TRP 263 Ca 0.60 1.49 -0.13 0.00 -0.00 0.00 0.00 56.10 58.06 3kd9 s TRP 263 Cb -0.37 -3.53 0.00 0.00 -0.00 0.00 0.00 33.47 29.58 3kd9 s TRP 263 CO 0.35 -1.62 0.44 -0.08 -0.00 0.00 0.00 176.95 176.04 3kd9 s THR 264 N -1.30 0.02 0.05 5.86 -1.32 -1.25 -4.42 115.64 113.27 3kd9 s THR 264 Ca 0.55 -1.27 0.00 0.00 -1.21 0.00 0.00 61.69 59.76 3kd9 s THR 264 Cb -0.35 -1.99 -0.00 0.00 -1.51 0.00 0.00 72.50 68.65 3kd9 s THR 264 CO 0.44 -0.09 0.00 -0.46 -2.21 0.00 0.00 174.62 172.31 3kd9 n ASN 265 N -0.34 1.83 -0.23 8.08 0.23 -0.73 -4.89 115.26 119.21 3kd9 n ASN 265 Ca -0.05 -1.22 0.16 0.00 -0.53 0.00 0.00 54.58 52.95 3kd9 n ASN 265 Cb 0.62 0.05 0.48 0.00 -2.08 0.00 0.00 39.78 38.85 3kd9 n ASN 265 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3kd9 h GLU 266 N 0.00 0.46 -0.41 -3.83 5.08 -1.91 0.36 114.58 114.33 3kd9 h GLU 266 Ca -0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3kd9 h GLU 266 Cb 0.12 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3kd9 h GLU 266 CO 0.06 0.31 0.00 1.63 -1.00 0.00 0.00 179.01 180.01 3kd9 n LYS 267 N -4.52 1.94 -2.28 2.33 5.02 -1.26 -0.40 118.16 118.98 3kd9 n LYS 267 Ca 0.17 -1.30 -0.17 0.00 -2.02 0.00 0.00 58.31 55.00 3kd9 n LYS 267 Cb 0.59 -1.34 -0.01 0.00 -0.02 0.00 0.00 35.03 34.25 3kd9 n LYS 267 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3kd9 n MET 268 N 0.51 -1.35 -3.41 1.97 2.81 0.13 -4.36 117.12 113.41 3kd9 n MET 268 Ca 0.12 0.84 -0.36 0.00 -1.81 0.00 0.00 57.70 56.49 3kd9 n MET 268 Cb 0.34 -5.28 -0.06 0.00 -0.71 0.00 0.00 33.22 27.52 3kd9 n MET 268 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3kd9 s GLN 269 N -4.78 3.96 0.39 0.03 -0.21 -1.26 -1.76 119.66 116.02 3kd9 s GLN 269 Ca 0.00 0.45 0.02 0.00 0.02 0.00 0.00 55.36 55.85 3kd9 s GLN 269 Cb 0.00 -3.02 0.07 0.00 1.00 0.00 0.00 33.01 31.06 3kd9 s GLN 269 CO 0.00 0.54 0.53 0.25 -2.12 0.00 0.00 175.29 174.50 3kd9 n THR 270 N 1.08 0.00 0.30 -0.19 -2.24 -0.66 -1.78 114.28 110.79 3kd9 n THR 270 Ca -0.08 -0.96 0.17 0.00 -2.27 0.00 0.00 64.05 60.91 3kd9 n THR 270 Cb 0.52 -0.98 0.73 0.00 -2.10 0.00 0.00 70.33 68.50 3kd9 n THR 270 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3kd9 h SER 271 N -0.21 0.00 -3.06 3.42 4.64 -1.86 -3.43 113.55 113.06 3kd9 h SER 271 Ca -0.18 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.52 3kd9 h SER 271 Cb 0.70 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.70 3kd9 h SER 271 CO 0.21 0.00 -0.40 -0.69 -0.87 0.00 0.00 176.83 175.08 3kd9 s VAL 272 N -3.68 5.36 0.38 0.95 1.01 -1.26 -4.97 120.40 118.19 3kd9 s VAL 272 Ca 0.01 0.38 -0.28 0.00 0.00 0.00 0.00 61.98 62.09 3kd9 s VAL 272 Cb 0.09 -3.53 -0.11 0.00 0.00 0.00 0.00 36.38 32.84 3kd9 s VAL 272 CO 0.50 0.49 1.48 -0.70 0.00 0.00 0.00 175.10 176.88 3kd9 s GLU 273 N -0.19 4.10 -0.99 2.72 2.12 -1.26 -2.29 118.70 122.90 3kd9 s GLU 273 Ca 0.15 2.57 0.00 0.00 0.36 0.00 0.00 54.97 58.04 3kd9 s GLU 273 Cb -0.13 -2.96 0.00 0.00 0.26 0.00 0.00 34.13 31.31 3kd9 s GLU 273 CO 0.03 -0.54 0.00 0.09 -0.54 0.00 0.00 175.26 174.30 3kd9 n ASN 274 N 0.44 -5.28 -4.10 -1.70 3.02 -1.26 -4.96 115.26 101.41 3kd9 n ASN 274 Ca 0.01 0.23 -0.33 0.00 -0.03 0.00 0.00 54.58 54.47 3kd9 n ASN 274 Cb 0.39 -3.61 -0.16 0.00 -0.61 0.00 0.00 39.78 35.80 3kd9 n ASN 274 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3kd9 s VAL 275 N -1.96 2.08 0.30 2.41 1.01 -0.97 -1.07 120.40 122.20 3kd9 s VAL 275 Ca 0.00 -1.14 0.08 0.00 0.00 0.00 0.00 61.98 60.93 3kd9 s VAL 275 Cb 0.00 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 3kd9 s VAL 275 CO 0.00 0.37 0.13 -0.31 0.00 0.00 0.00 175.10 175.30 3kd9 s TYR 276 N 1.24 2.80 -0.01 5.22 4.12 0.15 -1.65 117.35 129.22 3kd9 s TYR 276 Ca 0.01 -0.28 -0.03 0.00 0.02 0.00 0.00 57.07 56.79 3kd9 s TYR 276 Cb -0.15 -1.50 -0.00 0.00 -1.52 0.00 0.00 41.96 38.79 3kd9 s TYR 276 CO -0.11 0.42 0.06 0.00 0.02 0.00 0.00 175.55 175.94 3kd9 s ALA 277 N -2.33 -0.12 0.05 3.71 0.00 -0.72 -0.66 121.76 121.68 3kd9 s ALA 277 Ca 0.36 -0.04 -0.27 0.00 0.00 0.00 0.00 51.96 52.00 3kd9 s ALA 277 Cb -0.05 -0.01 0.08 0.00 0.00 0.00 0.00 23.12 23.13 3kd9 s ALA 277 CO 0.23 -0.09 0.67 0.00 0.00 0.00 0.00 175.76 176.57 3kd9 s ALA 278 N -0.54 -1.70 0.00 0.00 0.00 -0.77 -4.70 121.76 114.05 3kd9 s ALA 278 Ca -0.06 0.89 0.00 0.00 0.00 0.00 0.00 51.96 52.79 3kd9 s ALA 278 Cb -0.04 0.44 0.00 0.00 0.00 0.00 0.00 23.12 23.53 3kd9 s ALA 278 CO 0.00 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 175.58 3kd9 n GLY 279 N 0.17 -1.81 0.00 0.00 0.00 -1.26 -4.26 105.19 98.01 3kd9 n GLY 279 Ca -0.17 -1.93 0.03 0.00 0.00 0.00 0.00 46.02 43.96 3kd9 n GLY 279 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kd9 n ASP 280 N 0.05 0.00 0.12 1.61 8.00 -1.26 -1.08 116.55 123.99 3kd9 n ASP 280 Ca 0.00 0.25 0.09 0.00 0.71 0.00 0.00 54.79 55.84 3kd9 n ASP 280 Cb 0.00 -0.32 0.03 0.00 -0.02 0.00 0.00 41.12 40.80 3kd9 n ASP 280 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3kd9 h VAL 281 N 0.00 0.13 -2.62 2.53 2.07 -1.75 -3.40 116.25 113.21 3kd9 h VAL 281 Ca 0.00 -1.22 -0.54 0.00 0.82 0.00 0.00 66.70 65.75 3kd9 h VAL 281 Cb 0.07 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 3kd9 h VAL 281 CO 0.00 0.07 -0.44 0.00 0.02 0.00 0.00 177.57 177.22 3kd9 s ALA 282 N -3.24 3.94 -0.14 1.67 0.00 -0.24 -0.54 121.76 123.21 3kd9 s ALA 282 Ca 0.01 -0.99 -0.07 0.00 0.00 0.00 0.00 51.96 50.92 3kd9 s ALA 282 Cb 0.08 -1.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.34 3kd9 s ALA 282 CO 0.76 0.52 0.11 -2.00 0.00 0.00 0.00 175.76 175.16 3kd9 s GLU 283 N -3.24 3.59 0.29 0.00 2.12 0.17 -4.66 118.70 116.97 3kd9 s GLU 283 Ca 0.35 -0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.48 3kd9 s GLU 283 Cb -0.11 -3.18 -0.00 0.00 0.26 0.00 0.00 34.13 31.09 3kd9 s GLU 283 CO 0.29 0.62 0.02 -2.37 -0.54 0.00 0.00 175.26 173.27 3kd9 n THR 284 N 2.48 0.00 -4.15 -1.70 5.66 0.48 -3.95 114.28 113.09 3kd9 n THR 284 Ca -0.19 -1.43 -0.33 0.00 -3.05 0.00 0.00 64.05 59.05 3kd9 n THR 284 Cb 0.54 0.33 -0.08 0.00 -1.55 0.00 0.00 70.33 69.57 3kd9 n THR 284 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 3kd9 s ARG 285 N -3.06 3.02 0.02 1.09 3.52 -1.26 0.94 118.95 123.21 3kd9 s ARG 285 Ca 0.02 -0.49 -0.24 0.00 -0.13 0.00 0.00 55.73 54.89 3kd9 s ARG 285 Cb 0.00 -2.83 -0.05 0.00 -1.56 0.00 0.00 34.95 30.51 3kd9 s ARG 285 CO 0.02 0.65 0.74 -1.58 -0.81 0.00 0.00 175.30 174.32 3kd9 s HIS 286 N -1.14 3.70 0.31 5.12 5.65 -0.40 -0.38 115.29 128.15 3kd9 s HIS 286 Ca 0.21 1.40 0.02 0.00 0.25 0.00 0.00 55.06 56.94 3kd9 s HIS 286 Cb -0.12 -2.80 0.52 0.00 -1.18 0.00 0.00 32.58 29.01 3kd9 s HIS 286 CO 0.12 0.24 1.85 0.28 -0.65 0.00 0.00 174.74 176.58 3kd9 h VAL 287 N 4.26 1.21 0.04 0.89 2.07 -1.02 0.13 116.25 123.83 3kd9 h VAL 287 Ca -0.43 -0.82 -0.27 0.00 0.82 0.00 0.00 66.70 66.00 3kd9 h VAL 287 Cb 1.20 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 3kd9 h VAL 287 CO 0.72 0.29 -1.46 0.40 0.02 0.00 0.00 177.57 177.54 3kd9 h ILE 288 N 0.60 0.85 0.02 4.57 2.04 -1.93 -3.40 117.51 120.27 3kd9 h ILE 288 Ca 0.13 -2.24 -0.25 0.00 1.00 0.00 0.00 64.86 63.50 3kd9 h ILE 288 Cb 0.34 2.35 -0.03 0.00 -0.74 0.00 0.00 36.82 38.74 3kd9 h ILE 288 CO 0.01 0.50 -1.25 0.74 0.00 0.00 0.00 178.15 178.15 3kd9 h THR 289 N -0.66 1.43 0.00 -0.27 2.02 -1.94 -3.47 112.91 110.02 3kd9 h THR 289 Ca -0.36 -3.16 0.00 0.00 0.77 0.00 0.00 66.41 63.66 3kd9 h THR 289 Cb 1.54 2.74 0.00 0.00 -1.74 0.00 0.00 68.15 70.69 3kd9 h THR 289 CO -0.11 0.84 0.00 0.61 0.37 0.00 0.00 175.52 177.23 3kd9 n GLY 290 N 1.45 1.70 3.88 2.16 0.00 0.46 -4.97 105.19 109.87 3kd9 n GLY 290 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 3kd9 n GLY 290 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kd9 s ARG 291 N -0.07 3.78 0.26 1.61 3.00 -1.26 -4.59 118.95 121.68 3kd9 s ARG 291 Ca 0.00 0.39 -0.30 0.00 0.00 0.00 0.00 55.73 55.83 3kd9 s ARG 291 Cb 0.00 -2.47 -0.10 0.00 0.00 0.00 0.00 34.95 32.39 3kd9 s ARG 291 CO 0.00 0.07 1.32 1.03 0.00 0.00 0.00 175.30 177.72 3kd9 s ARG 292 N -3.57 4.37 0.11 3.54 1.81 -1.26 -1.28 118.95 122.67 3kd9 s ARG 292 Ca 0.50 2.14 -0.01 0.00 -1.72 0.00 0.00 55.73 56.64 3kd9 s ARG 292 Cb -0.10 -3.13 -0.04 0.00 -0.45 0.00 0.00 34.95 31.22 3kd9 s ARG 292 CO 0.28 -0.22 0.02 0.14 -0.68 0.00 0.00 175.30 174.84 3kd9 s VAL 293 N -0.47 0.18 -0.24 3.52 -7.23 0.27 -4.89 120.40 111.54 3kd9 s VAL 293 Ca 0.53 -1.88 0.02 0.00 -1.81 0.00 0.00 61.98 58.84 3kd9 s VAL 293 Cb -0.38 -1.87 0.06 0.00 0.56 0.00 0.00 36.38 34.74 3kd9 s VAL 293 CO 0.45 -0.64 -0.10 0.86 -0.31 0.00 0.00 175.10 175.35 3kd9 s TRP 294 N -3.98 2.95 -0.51 2.82 -0.00 -1.26 -0.39 118.94 118.57 3kd9 s TRP 294 Ca 0.18 -2.07 0.07 0.00 -0.00 0.00 0.00 56.10 54.28 3kd9 s TRP 294 Cb 0.08 -1.82 0.24 0.00 -0.00 0.00 0.00 33.47 31.96 3kd9 s TRP 294 CO -0.02 -0.84 0.59 0.28 -0.00 0.00 0.00 176.95 176.97 3kd9 n VAL 295 N 4.53 0.63 -1.64 5.86 0.31 -1.26 -5.05 118.33 121.71 3kd9 n VAL 295 Ca -0.14 -4.50 -0.15 0.00 -0.01 0.00 0.00 64.34 59.53 3kd9 n VAL 295 Cb 0.44 -2.01 -0.08 0.00 -0.91 0.00 0.00 33.84 31.28 3kd9 n VAL 295 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3kd9 s PRO 296 N -1.62 1.61 0.01 5.55 0.04 -1.26 -4.91 135.00 134.42 3kd9 s PRO 296 Ca 0.36 0.13 0.01 0.00 0.04 0.00 0.00 61.00 61.53 3kd9 s PRO 296 Cb 0.14 -4.88 -0.01 0.00 0.04 0.00 0.00 34.50 29.79 3kd9 s PRO 296 CO -0.08 -4.60 -0.03 -0.51 0.04 0.00 0.00 177.00 171.82 3kd9 s LEU 297 N 14.79 2.08 0.22 -3.56 1.43 -1.26 -4.99 118.68 127.40 3kd9 s LEU 297 Ca 0.87 -0.19 -0.10 0.00 -1.03 0.00 0.00 54.13 53.68 3kd9 s LEU 297 Cb -0.10 -0.05 0.32 0.00 0.03 0.00 0.00 46.19 46.39 3kd9 s LEU 297 CO 0.10 -0.07 1.65 0.00 0.23 0.00 0.00 176.35 178.25 3kd9 h ALA 298 N 5.62 0.62 0.23 4.21 0.00 -1.98 -1.92 119.26 126.04 3kd9 h ALA 298 Ca -0.28 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3kd9 h ALA 298 Cb 1.21 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 19.35 3kd9 h ALA 298 CO 0.48 -0.41 -0.44 -1.35 0.00 0.00 0.00 179.25 177.53 3kd9 h PRO 299 N 0.09 -0.69 -0.93 0.00 0.11 -1.98 -0.81 132.00 127.79 3kd9 h PRO 299 Ca 0.34 0.05 0.05 0.00 0.11 0.00 0.00 66.00 66.55 3kd9 h PRO 299 Cb 0.57 0.16 -0.06 0.00 0.11 0.00 0.00 31.00 31.77 3kd9 h PRO 299 CO -0.59 -0.46 0.59 0.00 -0.21 0.00 0.00 178.00 177.33 3kd9 h ALA 300 N -0.84 1.26 -0.26 -0.75 0.00 -1.92 -2.65 119.26 114.10 3kd9 h ALA 300 Ca -0.02 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.91 3kd9 h ALA 300 Cb 0.68 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 3kd9 h ALA 300 CO -0.17 0.40 -0.07 0.78 0.00 0.00 0.00 179.25 180.19 3kd9 h GLY 301 N 1.11 0.17 0.81 0.00 0.00 -0.90 0.43 103.07 104.69 3kd9 h GLY 301 Ca 0.39 0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.85 3kd9 h GLY 301 CO -0.15 -0.11 0.44 3.43 0.00 0.00 0.00 176.54 180.15 3kd9 h ASN 302 N -0.01 0.71 -0.25 0.19 2.35 -0.83 -0.78 115.58 116.96 3kd9 h ASN 302 Ca 0.13 0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.82 3kd9 h ASN 302 Cb 0.21 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 3kd9 h ASN 302 CO -0.27 0.48 -0.10 0.11 -1.65 0.00 0.00 177.43 175.99 3kd9 h LYS 303 N 0.84 0.51 -1.00 0.81 1.57 -1.06 0.44 116.57 118.68 3kd9 h LYS 303 Ca 0.30 -0.22 0.13 0.00 -1.87 0.00 0.00 60.65 58.99 3kd9 h LYS 303 Cb 0.07 -0.02 -0.09 0.00 0.08 0.00 0.00 32.23 32.28 3kd9 h LYS 303 CO -0.13 0.76 0.63 0.52 -0.57 0.00 0.00 179.45 180.66 3kd9 h MET 304 N 0.23 0.93 -0.22 3.15 2.86 0.17 0.24 114.93 122.29 3kd9 h MET 304 Ca 0.06 -0.06 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 3kd9 h MET 304 Cb 0.60 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 3kd9 h MET 304 CO 0.03 0.61 -0.38 0.78 1.06 0.00 0.00 176.91 179.01 3kd9 h GLY 305 N 0.95 0.72 0.66 8.32 0.00 -0.90 -2.39 103.07 110.44 3kd9 h GLY 305 Ca 0.51 -0.82 0.05 0.00 0.00 0.00 0.00 47.33 47.07 3kd9 h GLY 305 CO -0.28 0.74 0.26 -1.82 0.00 0.00 0.00 176.54 175.45 3kd9 h TYR 306 N 0.36 0.48 0.00 5.60 3.20 0.11 -0.65 116.97 126.07 3kd9 h TYR 306 Ca 0.02 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 3kd9 h TYR 306 Cb 0.98 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.10 3kd9 h TYR 306 CO 0.08 0.22 -0.51 -0.39 -1.64 0.00 0.00 178.16 175.92 3kd9 h VAL 307 N 0.50 1.03 -0.34 1.81 -1.51 -0.60 -1.10 116.25 116.05 3kd9 h VAL 307 Ca 0.25 -2.01 -0.14 0.00 -1.23 0.00 0.00 66.70 63.57 3kd9 h VAL 307 Cb 0.18 2.20 -0.01 0.00 -2.13 0.00 0.00 31.29 31.54 3kd9 h VAL 307 CO -0.19 0.50 -0.33 0.00 -1.23 0.00 0.00 177.57 176.32 3kd9 h ALA 308 N 1.49 0.49 -0.52 5.19 0.00 -1.01 -1.71 119.26 123.19 3kd9 h ALA 308 Ca -0.01 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 3kd9 h ALA 308 Cb 1.16 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3kd9 h ALA 308 CO 0.07 0.55 0.11 0.78 0.00 0.00 0.00 179.25 180.76 3kd9 h GLY 309 N 0.60 0.86 0.72 0.00 0.00 -0.98 -2.13 103.07 102.15 3kd9 h GLY 309 Ca 0.05 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 3kd9 h GLY 309 CO 0.08 0.47 -0.01 1.76 0.00 0.00 0.00 176.54 178.84 3kd9 h SER 310 N 0.77 -0.02 0.23 0.19 0.02 -0.95 -2.74 113.55 111.05 3kd9 h SER 310 Ca 0.17 -0.27 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 3kd9 h SER 310 Cb 0.31 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 3kd9 h SER 310 CO 0.00 0.26 -0.19 0.78 -1.14 0.00 0.00 176.83 176.54 3kd9 h ASN 311 N -0.31 0.00 -0.25 3.07 2.35 -1.05 -1.57 115.58 117.83 3kd9 h ASN 311 Ca -0.00 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.58 3kd9 h ASN 311 Cb 0.29 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 3kd9 h ASN 311 CO 0.00 0.19 -0.45 0.40 -1.65 0.00 0.00 177.43 175.92 3kd9 h ILE 312 N 0.00 1.28 0.00 2.81 2.04 -1.33 -2.92 117.51 119.39 3kd9 h ILE 312 Ca -0.00 -1.64 0.00 0.00 1.00 0.00 0.00 64.86 64.22 3kd9 h ILE 312 Cb 0.36 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 3kd9 h ILE 312 CO 0.02 0.53 0.00 0.00 0.00 0.00 0.00 178.15 178.71 3kd9 n ALA 313 N -2.54 2.51 0.00 1.87 0.00 -0.91 -4.88 120.51 116.56 3kd9 n ALA 313 Ca -0.03 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3kd9 n ALA 313 Cb 0.57 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.62 3kd9 n ALA 313 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kd9 n GLY 314 N 0.69 2.14 3.57 0.00 0.00 -1.09 -4.96 105.19 105.54 3kd9 n GLY 314 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 3kd9 n GLY 314 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kd9 s LYS 315 N -0.77 3.58 0.05 1.61 -0.14 -0.64 -4.96 119.74 118.48 3kd9 s LYS 315 Ca 0.00 0.14 -0.31 0.00 -1.36 0.00 0.00 55.97 54.44 3kd9 s LYS 315 Cb 0.00 -3.88 -0.07 0.00 -1.68 0.00 0.00 37.83 32.19 3kd9 s LYS 315 CO 0.00 -1.04 1.55 -1.21 -0.76 0.00 0.00 175.35 173.89 3kd9 s GLU 316 N 3.35 4.23 -0.06 1.68 2.02 -1.26 -2.59 118.70 126.07 3kd9 s GLU 316 Ca 0.33 2.20 -0.07 0.00 0.02 0.00 0.00 54.97 57.44 3kd9 s GLU 316 Cb -0.12 -3.56 0.02 0.00 0.10 0.00 0.00 34.13 30.57 3kd9 s GLU 316 CO 0.21 -0.66 0.19 -1.17 0.02 0.00 0.00 175.26 173.85 3kd9 s LEU 317 N 2.43 1.27 -0.04 1.80 2.96 -1.26 -4.99 118.68 120.86 3kd9 s LEU 317 Ca 0.70 0.31 0.05 0.00 -0.22 0.00 0.00 54.13 54.97 3kd9 s LEU 317 Cb -0.37 0.70 -0.02 0.00 0.50 0.00 0.00 46.19 46.99 3kd9 s LEU 317 CO 0.30 -0.12 -0.19 -1.00 -1.32 0.00 0.00 176.35 174.03 3kd9 s HIS 318 N -0.12 2.57 -0.24 5.38 3.76 -1.26 -4.40 115.29 120.97 3kd9 s HIS 318 Ca -0.02 -0.31 -0.14 0.00 -0.15 0.00 0.00 55.06 54.44 3kd9 s HIS 318 Cb -0.02 -1.60 -0.04 0.00 1.11 0.00 0.00 32.58 32.03 3kd9 s HIS 318 CO 0.01 0.07 0.31 0.12 -0.85 0.00 0.00 174.74 174.39 3kd9 s PHE 319 N -0.60 3.30 0.22 1.40 5.36 0.46 -4.97 117.98 123.16 3kd9 s PHE 319 Ca 0.09 0.40 0.23 0.00 -0.96 0.00 0.00 56.93 56.69 3kd9 s PHE 319 Cb -0.11 -2.46 0.99 0.00 -0.34 0.00 0.00 43.02 41.10 3kd9 s PHE 319 CO 0.00 -0.07 1.87 -1.00 -1.46 0.00 0.00 175.22 174.56 3kd9 h PRO 320 N 7.76 0.00 0.00 10.12 0.13 -1.97 -3.42 132.00 144.61 3kd9 h PRO 320 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3kd9 h PRO 320 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3kd9 h PRO 320 CO 0.66 0.24 0.00 0.41 -0.23 0.00 0.00 178.00 179.08 3kd9 n GLY 321 N -0.07 0.17 3.61 1.56 0.00 -1.26 -4.64 105.19 104.56 3kd9 n GLY 321 Ca -0.01 -2.30 -0.25 0.00 0.00 0.00 0.00 46.02 43.47 3kd9 n GLY 321 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kd9 s VAL 322 N -0.44 2.59 -0.57 1.61 -7.23 0.48 -4.75 120.40 112.10 3kd9 s VAL 322 Ca 0.00 -2.02 0.13 0.00 -1.81 0.00 0.00 61.98 58.28 3kd9 s VAL 322 Cb 0.00 -2.76 -0.14 0.00 0.56 0.00 0.00 36.38 34.04 3kd9 s VAL 322 CO 0.00 -0.21 0.53 -0.11 -0.31 0.00 0.00 175.10 175.00 3kd9 n LEU 323 N -0.92 0.57 0.00 1.32 7.94 -1.26 -0.45 117.00 124.20 3kd9 n LEU 323 Ca -0.04 -0.47 0.00 0.00 -1.11 0.00 0.00 56.01 54.39 3kd9 n LEU 323 Cb 0.62 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.57 3kd9 n LEU 323 CO 0.43 0.14 0.00 0.61 -1.11 0.00 0.00 177.39 177.46 3kd9 n GLY 324 N 1.33 0.56 3.68 -3.96 0.00 -1.26 -0.53 105.19 105.02 3kd9 n GLY 324 Ca 0.02 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 3kd9 n GLY 324 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kd9 s THR 325 N -2.00 2.80 0.01 2.61 2.01 -1.26 -4.46 115.64 115.35 3kd9 s THR 325 Ca 0.00 0.19 -0.08 0.00 0.31 0.00 0.00 61.69 62.11 3kd9 s THR 325 Cb 0.00 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.39 3kd9 s THR 325 CO 0.00 -0.00 0.15 0.00 -0.69 0.00 0.00 174.62 174.08 3kd9 s ALA 326 N 3.06 -0.34 -0.19 7.40 0.00 -0.90 -5.00 121.76 125.79 3kd9 s ALA 326 Ca 0.80 -0.15 -0.13 0.00 0.00 0.00 0.00 51.96 52.48 3kd9 s ALA 326 Cb -0.43 0.13 0.05 0.00 0.00 0.00 0.00 23.12 22.88 3kd9 s ALA 326 CO 0.36 -0.23 0.47 0.54 0.00 0.00 0.00 175.76 176.90 3kd9 s VAL 327 N -1.56 -0.01 0.35 0.00 0.11 -1.26 -1.77 120.40 116.26 3kd9 s VAL 327 Ca -0.13 0.04 -0.04 0.00 -2.93 0.00 0.00 61.98 58.91 3kd9 s VAL 327 Cb -0.07 -0.68 0.02 0.00 -1.53 0.00 0.00 36.38 34.13 3kd9 s VAL 327 CO 0.01 0.02 0.54 1.07 -3.33 0.00 0.00 175.10 173.40 3kd9 n THR 328 N 3.57 0.00 -3.47 5.04 5.66 -0.38 -5.02 114.28 119.69 3kd9 n THR 328 Ca -0.18 -1.59 -0.10 0.00 -3.05 0.00 0.00 64.05 59.13 3kd9 n THR 328 Cb 0.56 1.05 -0.02 0.00 -1.55 0.00 0.00 70.33 70.38 3kd9 n THR 328 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 3kd9 s LYS 329 N -2.64 1.06 -0.21 1.09 -2.85 -1.26 -1.10 119.74 113.82 3kd9 s LYS 329 Ca 0.26 -0.40 0.00 0.00 -1.00 0.00 0.00 55.97 54.83 3kd9 s LYS 329 Cb -0.02 0.48 0.06 0.00 -2.06 0.00 0.00 37.83 36.29 3kd9 s LYS 329 CO 0.19 -0.46 -0.05 0.12 0.10 0.00 0.00 175.35 175.25 3kd9 s PHE 330 N -3.44 2.09 0.00 1.78 2.19 -0.20 -4.75 117.98 115.65 3kd9 s PHE 330 Ca 0.03 -1.50 0.00 0.00 0.33 0.00 0.00 56.93 55.79 3kd9 s PHE 330 Cb -0.01 -1.46 0.00 0.00 -1.31 0.00 0.00 43.02 40.24 3kd9 s PHE 330 CO -0.11 -0.72 0.00 -1.33 1.83 0.00 0.00 175.22 174.89 3kd9 n MET 331 N 4.76 0.00 -0.34 10.12 2.81 -1.26 -1.30 117.12 131.91 3kd9 n MET 331 Ca -0.12 0.00 0.09 0.00 -1.81 0.00 0.00 57.70 55.86 3kd9 n MET 331 Cb 0.45 0.00 0.27 0.00 -0.71 0.00 0.00 33.22 33.23 3kd9 n MET 331 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3kd9 n ASP 332 N 9.00 3.70 -4.31 7.83 5.75 -1.26 -4.85 116.55 132.41 3kd9 n ASP 332 Ca 0.00 -2.09 -0.36 0.00 -0.01 0.00 0.00 54.79 52.33 3kd9 n ASP 332 Cb 0.00 -0.41 -0.13 0.00 -1.03 0.00 0.00 41.12 39.54 3kd9 n ASP 332 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3kd9 s VAL 333 N -1.17 3.54 0.28 2.12 0.11 -0.42 -4.66 120.40 120.19 3kd9 s VAL 333 Ca 0.40 -0.67 0.01 0.00 -2.93 0.00 0.00 61.98 58.79 3kd9 s VAL 333 Cb 0.22 -2.74 -0.04 0.00 -1.53 0.00 0.00 36.38 32.30 3kd9 s VAL 333 CO 0.25 0.24 0.46 -1.61 -3.33 0.00 0.00 175.10 171.11 3kd9 s GLU 334 N 1.46 3.49 -0.13 1.54 2.02 0.37 -1.04 118.70 126.41 3kd9 s GLU 334 Ca 0.03 -0.43 -0.07 0.00 0.02 0.00 0.00 54.97 54.52 3kd9 s GLU 334 Cb -0.16 -2.77 0.05 0.00 0.10 0.00 0.00 34.13 31.35 3kd9 s GLU 334 CO -0.01 0.29 0.31 -1.50 0.02 0.00 0.00 175.26 174.37 3kd9 s ILE 335 N -2.09 -0.03 0.26 -1.63 2.07 -0.26 -0.63 121.20 118.89 3kd9 s ILE 335 Ca 0.38 0.11 -0.11 0.00 -1.41 0.00 0.00 60.65 59.62 3kd9 s ILE 335 Cb -0.10 -0.46 -0.00 0.00 0.13 0.00 0.00 42.46 42.02 3kd9 s ILE 335 CO 0.32 0.05 0.47 -0.83 -1.91 0.00 0.00 174.94 173.04 3kd9 s GLY 336 N 1.19 0.68 0.25 1.50 0.00 -0.25 -1.24 107.32 109.45 3kd9 s GLY 336 Ca -0.08 -0.98 -0.20 0.00 0.00 0.00 0.00 44.72 43.45 3kd9 s GLY 336 CO -0.09 -0.69 0.66 -1.59 0.00 0.00 0.00 173.10 171.39 3kd9 s LYS 337 N -3.86 1.65 -0.29 2.90 -2.85 -0.73 -1.77 119.74 114.79 3kd9 s LYS 337 Ca 0.24 -0.92 -0.16 0.00 -1.00 0.00 0.00 55.97 54.13 3kd9 s LYS 337 Cb -0.00 0.59 0.12 0.00 -2.06 0.00 0.00 37.83 36.47 3kd9 s LYS 337 CO 0.10 -0.74 0.85 -0.08 0.10 0.00 0.00 175.35 175.58 3kd9 s THR 338 N -3.90 -0.03 0.00 3.79 -1.32 -0.91 -2.12 115.64 111.16 3kd9 s THR 338 Ca 0.10 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.58 3kd9 s THR 338 Cb -0.04 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.95 3kd9 s THR 338 CO 0.03 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 3kd9 n GLY 339 N 4.02 -1.75 3.84 6.08 0.00 0.31 -1.56 105.19 116.12 3kd9 n GLY 339 Ca -0.19 -1.71 -0.36 0.00 0.00 0.00 0.00 46.02 43.75 3kd9 n GLY 339 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kd9 s LEU 340 N 0.00 4.41 0.59 0.99 1.43 0.39 -4.82 118.68 121.67 3kd9 s LEU 340 Ca 0.00 1.06 -0.06 0.00 -1.03 0.00 0.00 54.13 54.10 3kd9 s LEU 340 Cb 0.00 -3.03 0.01 0.00 0.03 0.00 0.00 46.19 43.20 3kd9 s LEU 340 CO 0.00 0.19 0.91 0.28 0.23 0.00 0.00 176.35 177.96 3kd9 s THR 341 N -1.31 3.67 0.49 5.49 -1.32 -1.26 -3.87 115.64 117.53 3kd9 s THR 341 Ca 0.33 0.04 0.19 0.00 -1.21 0.00 0.00 61.69 61.03 3kd9 s THR 341 Cb -0.16 -3.46 0.25 0.00 -1.51 0.00 0.00 72.50 67.62 3kd9 s THR 341 CO 0.18 -0.48 2.10 -0.08 -2.21 0.00 0.00 174.62 174.12 3kd9 h GLU 342 N -0.19 0.00 0.25 7.08 4.81 -1.97 -0.18 114.58 124.37 3kd9 h GLU 342 Ca -0.45 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 3kd9 h GLU 342 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 3kd9 h GLU 342 CO 0.61 0.08 -0.12 0.52 -0.73 0.00 0.00 179.01 179.37 3kd9 h MET 343 N 0.00 -0.33 -0.58 1.92 2.86 -1.98 -2.82 114.93 114.01 3kd9 h MET 343 Ca -0.00 0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.69 3kd9 h MET 343 Cb 0.15 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 3kd9 h MET 343 CO 0.01 -0.02 0.36 0.93 1.06 0.00 0.00 176.91 179.24 3kd9 h GLU 344 N -0.64 0.68 -0.93 1.72 5.08 -1.79 -1.43 114.58 117.28 3kd9 h GLU 344 Ca -0.03 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.29 3kd9 h GLU 344 Cb 0.45 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.50 3kd9 h GLU 344 CO 0.06 0.45 0.61 0.00 -1.00 0.00 0.00 179.01 179.12 3kd9 h ALA 345 N 1.25 1.32 -0.27 3.43 0.00 -1.10 -1.37 119.26 122.53 3kd9 h ALA 345 Ca 0.23 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 3kd9 h ALA 345 Cb 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.43 3kd9 h ALA 345 CO -0.10 0.62 -0.48 -0.07 0.00 0.00 0.00 179.25 179.23 3kd9 h LEU 346 N 1.27 0.88 -2.22 0.00 3.38 -1.22 -2.71 115.31 114.68 3kd9 h LEU 346 Ca 0.34 -0.53 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 3kd9 h LEU 346 Cb -0.13 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.37 3kd9 h LEU 346 CO -0.07 1.25 -0.06 0.50 0.09 0.00 0.00 178.44 180.15 3kd9 h LYS 347 N 0.55 0.00 0.00 1.13 1.63 -0.78 -0.68 116.57 118.42 3kd9 h LYS 347 Ca 0.02 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 3kd9 h LYS 347 Cb 1.09 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 3kd9 h LYS 347 CO 0.11 0.06 -0.53 0.93 -3.45 0.00 0.00 179.45 176.56 3kd9 h GLU 348 N 0.00 0.00 0.00 1.90 4.39 -1.11 -3.48 114.58 116.28 3kd9 h GLU 348 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3kd9 h GLU 348 Cb 0.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 3kd9 h GLU 348 CO 0.01 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.27 3kd9 n GLY 349 N 1.17 0.81 3.77 -3.84 0.00 -0.26 -5.09 105.19 101.75 3kd9 n GLY 349 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 3kd9 n GLY 349 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kd9 s TYR 350 N -2.00 2.59 -0.47 1.61 2.02 -1.04 -4.98 117.35 115.08 3kd9 s TYR 350 Ca 0.00 1.55 -0.18 0.00 -0.37 0.00 0.00 57.07 58.07 3kd9 s TYR 350 Cb 0.00 -3.21 0.04 0.00 -0.40 0.00 0.00 41.96 38.39 3kd9 s TYR 350 CO 0.00 -1.73 0.54 0.34 -1.57 0.00 0.00 175.55 173.13 3kd9 s ASP 351 N -2.40 6.22 0.17 2.29 2.15 -1.26 -4.71 116.67 119.14 3kd9 s ASP 351 Ca 0.69 -0.80 0.08 0.00 0.43 0.00 0.00 52.55 52.94 3kd9 s ASP 351 Cb -0.22 -2.26 -0.04 0.00 -0.30 0.00 0.00 42.92 40.10 3kd9 s ASP 351 CO 0.39 -0.75 -0.05 0.68 -0.17 0.00 0.00 175.17 175.28 3kd9 s VAL 352 N 2.38 3.47 0.03 1.11 -7.23 -1.26 -0.13 120.40 118.78 3kd9 s VAL 352 Ca 0.14 -1.52 0.05 0.00 -1.81 0.00 0.00 61.98 58.83 3kd9 s VAL 352 Cb -0.18 -2.73 -0.02 0.00 0.56 0.00 0.00 36.38 34.01 3kd9 s VAL 352 CO 0.13 -0.10 -0.14 0.00 -0.31 0.00 0.00 175.10 174.68 3kd9 s ARG 353 N -2.86 0.93 0.25 4.82 1.70 -0.88 -4.86 118.95 118.04 3kd9 s ARG 353 Ca 0.26 -0.73 0.01 0.00 -0.47 0.00 0.00 55.73 54.80 3kd9 s ARG 353 Cb -0.09 -0.92 -0.05 0.00 -0.57 0.00 0.00 34.95 33.31 3kd9 s ARG 353 CO 0.17 0.23 0.09 0.95 -1.08 0.00 0.00 175.30 175.66 3kd9 s THR 354 N -0.82 0.54 0.01 4.99 -4.23 -1.26 -1.07 115.64 113.81 3kd9 s THR 354 Ca 0.01 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.37 3kd9 s THR 354 Cb -0.08 -2.60 0.03 0.00 1.34 0.00 0.00 72.50 71.19 3kd9 s THR 354 CO 0.01 -0.03 0.34 0.00 -0.54 0.00 0.00 174.62 174.40 3kd9 s ALA 355 N -3.77 -0.83 -0.16 3.99 0.00 -0.67 -4.99 121.76 115.33 3kd9 s ALA 355 Ca 0.37 0.28 -0.04 0.00 0.00 0.00 0.00 51.96 52.57 3kd9 s ALA 355 Cb 0.08 0.18 0.07 0.00 0.00 0.00 0.00 23.12 23.44 3kd9 s ALA 355 CO 0.13 -0.33 0.14 0.12 0.00 0.00 0.00 175.76 175.82 3kd9 s PHE 356 N -1.81 -0.04 0.25 0.00 5.36 -1.26 -0.59 117.98 119.89 3kd9 s PHE 356 Ca -0.10 0.05 0.11 0.00 -0.96 0.00 0.00 56.93 56.03 3kd9 s PHE 356 Cb -0.03 -0.50 -0.05 0.00 -0.34 0.00 0.00 43.02 42.10 3kd9 s PHE 356 CO 0.02 -0.49 -0.20 0.96 -1.46 0.00 0.00 175.22 174.05 3kd9 s ILE 357 N 2.23 2.34 0.03 3.12 -4.36 -0.21 -4.96 121.20 119.39 3kd9 s ILE 357 Ca 0.04 -2.29 0.06 0.00 -0.26 0.00 0.00 60.65 58.20 3kd9 s ILE 357 Cb -0.15 -2.22 -0.03 0.00 1.25 0.00 0.00 42.46 41.31 3kd9 s ILE 357 CO -0.09 -0.36 -0.17 -0.75 0.24 0.00 0.00 174.94 173.81 3kd9 s LYS 358 N -3.33 2.17 0.32 0.37 2.20 -1.26 -0.81 119.74 119.39 3kd9 s LYS 358 Ca 0.27 -0.92 -0.11 0.00 -0.36 0.00 0.00 55.97 54.84 3kd9 s LYS 358 Cb -0.05 -2.24 0.02 0.00 -1.51 0.00 0.00 37.83 34.05 3kd9 s LYS 358 CO 0.13 0.55 0.59 0.00 -0.36 0.00 0.00 175.35 176.26 3kd9 s ALA 359 N -0.91 -0.18 0.09 3.13 0.00 -0.06 -5.01 121.76 118.83 3kd9 s ALA 359 Ca 0.15 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.16 3kd9 s ALA 359 Cb -0.11 0.96 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 3kd9 s ALA 359 CO 0.05 -0.89 0.08 0.45 0.00 0.00 0.00 175.76 175.45 3kd9 s SER 360 N -3.09 5.49 0.25 0.00 0.15 -1.26 -1.88 113.70 113.35 3kd9 s SER 360 Ca 0.22 -0.04 0.25 0.00 0.70 0.00 0.00 55.95 57.08 3kd9 s SER 360 Cb -0.02 -1.45 0.89 0.00 -1.71 0.00 0.00 66.02 63.72 3kd9 s SER 360 CO 0.13 0.16 1.75 0.00 1.20 0.00 0.00 173.24 176.48 3kd9 h THR 361 N 2.52 0.00 -4.52 6.45 1.03 -1.58 -3.43 112.91 113.38 3kd9 h THR 361 Ca -0.47 -0.39 -0.28 0.00 -0.01 0.00 0.00 66.41 65.27 3kd9 h THR 361 Cb 1.17 1.27 -0.15 0.00 -1.07 0.00 0.00 68.15 69.37 3kd9 h THR 361 CO 0.65 0.00 -0.61 -0.13 -0.01 0.00 0.00 175.52 175.42 3kd9 s ARG 362 N -3.22 1.28 -0.06 0.00 3.00 -1.26 -4.27 118.95 114.42 3kd9 s ARG 362 Ca 0.07 -1.68 -0.30 0.00 0.00 0.00 0.00 55.73 53.82 3kd9 s ARG 362 Cb 0.11 0.21 -0.04 0.00 0.00 0.00 0.00 34.95 35.23 3kd9 s ARG 362 CO 0.51 -0.40 1.37 -2.14 0.00 0.00 0.00 175.30 174.63 3kd9 s PRO 363 N -4.08 4.27 -0.24 3.54 0.02 -1.26 -4.59 135.00 132.65 3kd9 s PRO 363 Ca 0.39 1.88 -0.29 0.00 0.02 0.00 0.00 61.00 63.00 3kd9 s PRO 363 Cb 0.07 -3.68 -0.03 0.00 0.02 0.00 0.00 34.50 30.88 3kd9 s PRO 363 CO 0.14 -0.62 1.70 -3.38 -0.33 0.00 0.00 177.00 174.50 3kd9 s HIS 364 N 2.87 1.96 0.00 6.54 -3.43 -1.26 -1.33 115.29 120.63 3kd9 s HIS 364 Ca 0.62 0.53 0.00 0.00 -0.80 0.00 0.00 55.06 55.40 3kd9 s HIS 364 Cb -0.28 -4.04 0.00 0.00 -1.43 0.00 0.00 32.58 26.83 3kd9 s HIS 364 CO 0.23 -3.08 0.00 2.48 -2.00 0.00 0.00 174.74 172.38 3kd9 n TYR 365 N 9.04 0.00 -1.71 0.38 0.18 -1.26 -5.10 117.16 118.68 3kd9 n TYR 365 Ca 0.20 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.56 3kd9 n TYR 365 Cb 0.45 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.41 3kd9 n TYR 365 CO 0.00 0.00 0.00 0.98 -2.08 0.00 0.00 176.86 175.76 3kd9 n TYR 366 N 0.00 2.39 -1.62 -3.48 9.36 -0.45 -4.91 117.16 118.45 3kd9 n TYR 366 Ca 0.00 0.53 -0.34 0.00 3.32 0.00 0.00 57.90 61.41 3kd9 n TYR 366 Cb 0.00 -2.44 0.07 0.00 -0.63 0.00 0.00 39.34 36.34 3kd9 n TYR 366 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 3kd9 s PRO 367 N -1.86 2.51 0.00 2.98 0.04 -1.26 -4.09 135.00 133.32 3kd9 s PRO 367 Ca 0.55 1.57 0.00 0.00 0.04 0.00 0.00 61.00 63.17 3kd9 s PRO 367 Cb -0.56 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.09 3kd9 s PRO 367 CO 0.62 -1.51 0.00 0.41 0.04 0.00 0.00 177.00 176.56 3kd9 n GLY 368 N -0.05 1.34 3.73 0.56 0.00 -1.26 -5.02 105.19 104.48 3kd9 n GLY 368 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3kd9 n GLY 368 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kd9 n GLY 369 N -2.00 1.32 3.43 -0.02 0.00 -1.26 -4.90 105.19 101.75 3kd9 n GLY 369 Ca 0.00 0.51 -0.22 0.00 0.00 0.00 0.00 46.02 46.31 3kd9 n GLY 369 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kd9 s ARG 370 N -0.04 1.56 0.42 1.61 1.81 -1.26 -4.88 118.95 118.16 3kd9 s ARG 370 Ca 0.68 -1.71 -0.24 0.00 -1.72 0.00 0.00 55.73 52.74 3kd9 s ARG 370 Cb -0.52 -1.52 -0.08 0.00 -0.45 0.00 0.00 34.95 32.38 3kd9 s ARG 370 CO 0.44 0.27 1.14 -1.21 -0.68 0.00 0.00 175.30 175.26 3kd9 s GLU 371 N -3.57 3.95 -0.08 3.54 2.02 -1.26 -1.46 118.70 121.85 3kd9 s GLU 371 Ca 0.27 1.74 -0.05 0.00 0.02 0.00 0.00 54.97 56.95 3kd9 s GLU 371 Cb -0.03 -2.53 0.03 0.00 0.10 0.00 0.00 34.13 31.70 3kd9 s GLU 371 CO 0.12 -0.38 0.19 -1.50 0.02 0.00 0.00 175.26 173.71 3kd9 s ILE 372 N -1.53 -0.02 -0.01 -1.63 2.07 -0.79 -1.55 121.20 117.74 3kd9 s ILE 372 Ca 0.60 0.08 0.08 0.00 -1.41 0.00 0.00 60.65 59.99 3kd9 s ILE 372 Cb -0.28 -0.28 -0.02 0.00 0.13 0.00 0.00 42.46 42.01 3kd9 s ILE 372 CO 0.34 0.03 -0.24 0.26 -1.91 0.00 0.00 174.94 173.43 3kd9 s TRP 373 N 0.62 2.12 -0.04 3.50 0.51 -0.44 -0.88 118.94 124.33 3kd9 s TRP 373 Ca -0.04 -0.40 0.03 0.00 -2.12 0.00 0.00 56.10 53.56 3kd9 s TRP 373 Cb -0.06 -1.35 0.00 0.00 -0.81 0.00 0.00 33.47 31.26 3kd9 s TRP 373 CO -0.03 -0.01 -0.11 -0.51 -0.51 0.00 0.00 176.95 175.78 3kd9 s LEU 374 N -0.69 1.76 -0.12 2.99 1.02 0.01 -1.18 118.68 122.45 3kd9 s LEU 374 Ca 0.09 -0.24 -0.01 0.00 0.02 0.00 0.00 54.13 53.99 3kd9 s LEU 374 Cb -0.09 -0.68 -0.02 0.00 0.02 0.00 0.00 46.19 45.41 3kd9 s LEU 374 CO -0.00 0.07 -0.07 -0.75 0.02 0.00 0.00 176.35 175.62 3kd9 s LYS 375 N 0.30 3.34 -0.02 1.70 2.47 0.15 -1.04 119.74 126.63 3kd9 s LYS 375 Ca -0.06 -0.57 0.03 0.00 -1.56 0.00 0.00 55.97 53.81 3kd9 s LYS 375 Cb -0.11 -2.75 -0.00 0.00 -1.46 0.00 0.00 37.83 33.51 3kd9 s LYS 375 CO 0.01 0.36 -0.12 0.20 0.16 0.00 0.00 175.35 175.96 3kd9 s GLY 376 N 0.02 0.61 -0.11 5.54 0.00 0.24 -0.53 107.32 113.09 3kd9 s GLY 376 Ca -0.01 -0.47 0.02 0.00 0.00 0.00 0.00 44.72 44.25 3kd9 s GLY 376 CO 0.03 -0.30 -0.16 0.14 0.00 0.00 0.00 173.10 172.81 3kd9 s VAL 377 N -0.08 1.59 0.09 1.40 1.01 -0.46 -1.68 120.40 122.28 3kd9 s VAL 377 Ca 0.01 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.38 3kd9 s VAL 377 Cb -0.07 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 3kd9 s VAL 377 CO 0.00 0.46 -0.22 -0.69 0.00 0.00 0.00 175.10 174.65 3kd9 s VAL 378 N 0.93 1.83 -0.46 2.92 1.01 -0.23 -0.27 120.40 126.14 3kd9 s VAL 378 Ca -0.07 -1.52 -0.29 0.00 0.00 0.00 0.00 61.98 60.10 3kd9 s VAL 378 Cb -0.15 -1.64 0.03 0.00 0.00 0.00 0.00 36.38 34.62 3kd9 s VAL 378 CO -0.01 0.04 1.12 -0.62 0.00 0.00 0.00 175.10 175.62 3kd9 s ASP 379 N -1.77 6.66 0.64 3.32 -1.08 0.58 -2.07 116.67 122.95 3kd9 s ASP 379 Ca 0.08 0.52 0.39 0.00 -0.52 0.00 0.00 52.55 53.03 3kd9 s ASP 379 Cb -0.10 -2.54 2.20 0.00 -1.46 0.00 0.00 42.92 41.02 3kd9 s ASP 379 CO 0.04 -1.19 2.32 -1.13 0.52 0.00 0.00 175.17 175.73 3kd9 h ASN 380 N 9.07 0.00 0.83 -0.34 -0.73 -0.85 0.17 115.58 123.73 3kd9 h ASN 380 Ca -0.23 0.00 -0.11 0.00 1.87 0.00 0.00 56.30 57.83 3kd9 h ASN 380 Cb 1.06 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.63 3kd9 h ASN 380 CO 1.11 0.00 -1.24 -0.33 -0.37 0.00 0.00 177.43 176.60 3kd9 h GLU 381 N 0.00 0.00 -0.00 6.67 5.08 -1.91 -3.38 114.58 121.04 3kd9 h GLU 381 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3kd9 h GLU 381 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3kd9 h GLU 381 CO -0.00 0.21 -0.08 0.25 -1.00 0.00 0.00 179.01 178.39 3kd9 n THR 382 N -2.84 0.00 -1.25 1.13 -2.24 -0.97 -4.97 114.28 103.15 3kd9 n THR 382 Ca -0.06 -0.46 -0.08 0.00 -2.27 0.00 0.00 64.05 61.17 3kd9 n THR 382 Cb 0.75 1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 69.95 3kd9 n THR 382 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3kd9 n ASN 383 N -0.82 -4.80 -4.77 3.42 4.13 0.56 -4.92 115.26 108.06 3kd9 n ASN 383 Ca 0.01 0.21 -0.40 0.00 1.68 0.00 0.00 54.58 56.08 3kd9 n ASN 383 Cb 0.04 -3.04 -0.06 0.00 -1.54 0.00 0.00 39.78 35.17 3kd9 n ASN 383 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 3kd9 s ARG 384 N -2.46 4.65 -0.19 3.52 3.52 -1.22 -0.47 118.95 126.31 3kd9 s ARG 384 Ca 0.00 1.26 -0.29 0.00 -0.13 0.00 0.00 55.73 56.56 3kd9 s ARG 384 Cb 0.00 -3.28 -0.01 0.00 -1.56 0.00 0.00 34.95 30.10 3kd9 s ARG 384 CO 0.00 0.53 1.25 -1.17 -0.81 0.00 0.00 175.30 175.10 3kd9 s LEU 385 N -1.04 4.14 0.01 -0.88 2.96 -0.71 -0.31 118.68 122.85 3kd9 s LEU 385 Ca 0.38 1.61 0.19 0.00 -0.22 0.00 0.00 54.13 56.08 3kd9 s LEU 385 Cb -0.24 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.73 3kd9 s LEU 385 CO 0.28 -0.79 0.64 0.18 -1.32 0.00 0.00 176.35 175.33 3kd9 n LEU 386 N 6.72 0.52 -3.63 -0.68 4.77 0.63 -4.86 117.00 120.47 3kd9 n LEU 386 Ca 0.14 0.22 -0.03 0.00 -0.03 0.00 0.00 56.01 56.31 3kd9 n LEU 386 Cb 0.45 0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.64 3kd9 n LEU 386 CO 0.56 0.14 1.10 -0.83 -1.33 0.00 0.00 177.39 177.04 3kd9 s GLY 387 N -4.82 -0.16 -0.03 -0.72 0.00 -0.98 -0.46 107.32 100.15 3kd9 s GLY 387 Ca -0.05 2.04 -0.02 0.00 0.00 0.00 0.00 44.72 46.69 3kd9 s GLY 387 CO 0.83 0.73 0.06 0.14 0.00 0.00 0.00 173.10 174.86 3kd9 s VAL 388 N -1.89 -0.02 -0.02 1.40 1.01 -0.60 -1.35 120.40 118.93 3kd9 s VAL 388 Ca 0.10 0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.21 3kd9 s VAL 388 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 36.38 36.25 3kd9 s VAL 388 CO -0.04 0.03 -0.22 -1.10 0.00 0.00 0.00 175.10 173.77 3kd9 s GLN 389 N 0.37 1.86 -0.01 2.72 -0.21 0.31 -2.13 119.66 122.57 3kd9 s GLN 389 Ca -0.03 -0.78 0.02 0.00 0.02 0.00 0.00 55.36 54.59 3kd9 s GLN 389 Cb -0.04 -1.75 -0.00 0.00 1.00 0.00 0.00 33.01 32.22 3kd9 s GLN 389 CO -0.01 0.44 -0.06 0.08 -2.12 0.00 0.00 175.29 173.62 3kd9 s VAL 390 N -0.42 0.47 -0.06 1.09 1.01 -0.73 0.30 120.40 122.06 3kd9 s VAL 390 Ca 0.06 -0.25 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 3kd9 s VAL 390 Cb -0.09 -0.40 0.04 0.00 0.00 0.00 0.00 36.38 35.92 3kd9 s VAL 390 CO -0.00 0.14 0.14 0.54 0.00 0.00 0.00 175.10 175.92 3kd9 s VAL 391 N -0.10 -0.05 0.00 2.92 0.11 -0.33 -1.09 120.40 121.87 3kd9 s VAL 391 Ca 0.02 0.17 0.00 0.00 -2.93 0.00 0.00 61.98 59.24 3kd9 s VAL 391 Cb -0.03 -0.24 0.00 0.00 -1.53 0.00 0.00 36.38 34.59 3kd9 s VAL 391 CO -0.00 0.07 0.00 0.61 -3.33 0.00 0.00 175.10 172.45 3kd9 n GLY 392 N 4.16 0.46 3.59 6.54 0.00 0.20 -1.33 105.19 118.81 3kd9 n GLY 392 Ca -0.26 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 3kd9 n GLY 392 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3kd9 s SER 393 N -4.00 4.67 -1.15 1.61 0.15 -0.60 -0.48 113.70 113.90 3kd9 s SER 393 Ca 0.00 -0.06 -0.02 0.00 0.70 0.00 0.00 55.95 56.56 3kd9 s SER 393 Cb 0.00 -1.15 -0.02 0.00 -1.71 0.00 0.00 66.02 63.14 3kd9 s SER 393 CO 0.00 0.33 0.95 0.47 1.20 0.00 0.00 173.24 176.19 3kd9 n ASP 394 N 1.94 -3.62 -0.04 5.45 10.43 -1.26 -4.67 116.55 124.77 3kd9 n ASP 394 Ca -0.17 -0.67 -0.14 0.00 2.57 0.00 0.00 54.79 56.39 3kd9 n ASP 394 Cb 0.53 -5.07 -0.11 0.00 1.84 0.00 0.00 41.12 38.31 3kd9 n ASP 394 CO 0.00 0.00 0.00 0.40 -1.07 0.00 0.00 177.20 176.53 3kd9 h ILE 395 N -1.62 1.60 -0.80 0.53 1.08 -1.96 -3.39 117.51 112.95 3kd9 h ILE 395 Ca -0.60 -1.78 0.21 0.00 -0.39 0.00 0.00 64.86 62.29 3kd9 h ILE 395 Cb 1.33 2.80 -0.15 0.00 -3.07 0.00 0.00 36.82 37.73 3kd9 h ILE 395 CO 0.48 0.47 -0.03 -0.11 -0.69 0.00 0.00 178.15 178.27 3kd9 n LEU 396 N -4.71 -0.14 -0.21 1.44 7.94 -1.26 -0.84 117.00 119.23 3kd9 n LEU 396 Ca -0.09 1.36 -0.07 0.00 -1.11 0.00 0.00 56.01 56.10 3kd9 n LEU 396 Cb 0.38 -0.48 0.03 0.00 0.53 0.00 0.00 43.42 43.89 3kd9 n LEU 396 CO 0.34 -1.36 1.08 -0.65 -1.11 0.00 0.00 177.39 175.70 3kd9 h PRO 397 N 0.00 0.80 -0.23 1.96 0.11 -2.00 -0.74 132.00 131.90 3kd9 h PRO 397 Ca 0.46 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.42 3kd9 h PRO 397 Cb 0.90 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.84 3kd9 h PRO 397 CO -0.77 0.57 -0.15 0.00 -0.21 0.00 0.00 178.00 177.45 3kd9 h ARG 398 N 0.79 0.50 -0.24 1.05 -0.00 -1.23 -1.71 114.38 113.54 3kd9 h ARG 398 Ca 0.21 -0.24 -0.17 0.00 -0.50 0.00 0.00 59.98 59.28 3kd9 h ARG 398 Cb -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.95 3kd9 h ARG 398 CO -0.04 0.80 -0.51 -0.84 0.00 0.00 0.00 179.97 179.38 3kd9 h ILE 399 N 0.20 1.29 -0.69 2.04 -0.00 -1.35 -0.44 117.51 118.57 3kd9 h ILE 399 Ca 0.05 -1.71 -0.05 0.00 -0.00 0.00 0.00 64.86 63.14 3kd9 h ILE 399 Cb 0.67 1.75 -0.03 0.00 -0.00 0.00 0.00 36.82 39.21 3kd9 h ILE 399 CO 0.04 0.55 0.22 0.44 -0.00 0.00 0.00 178.15 179.40 3kd9 h ASP 400 N 0.52 0.98 -0.42 2.16 3.32 -1.19 -1.10 116.42 120.69 3kd9 h ASP 400 Ca 0.01 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.77 3kd9 h ASP 400 Cb 1.12 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 3kd9 h ASP 400 CO 0.11 0.91 -0.18 0.74 -1.72 0.00 0.00 179.24 179.10 3kd9 h THR 401 N 1.02 1.28 0.00 0.35 2.02 -1.23 -2.79 112.91 113.56 3kd9 h THR 401 Ca 0.23 -1.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.07 3kd9 h THR 401 Cb 0.28 1.23 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 3kd9 h THR 401 CO -0.01 0.44 -0.07 0.00 0.37 0.00 0.00 175.52 176.25 3kd9 h ALA 402 N 0.83 1.05 -0.06 6.16 0.00 -0.80 -2.41 119.26 124.03 3kd9 h ALA 402 Ca 0.10 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 3kd9 h ALA 402 Cb 0.74 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 3kd9 h ALA 402 CO 0.06 0.09 -0.78 0.00 0.00 0.00 0.00 179.25 178.61 3kd9 h ALA 403 N 1.93 0.54 -0.14 0.00 0.00 -0.94 -1.22 119.26 119.42 3kd9 h ALA 403 Ca -0.00 -0.64 -0.07 0.00 0.00 0.00 0.00 54.91 54.21 3kd9 h ALA 403 Cb 0.50 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3kd9 h ALA 403 CO 0.01 0.78 -0.17 0.00 0.00 0.00 0.00 179.25 179.87 3kd9 h ALA 404 N 0.90 0.21 -0.82 0.00 0.00 -1.24 0.84 119.26 119.15 3kd9 h ALA 404 Ca -0.04 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.58 3kd9 h ALA 404 Cb 1.38 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.07 3kd9 h ALA 404 CO 0.13 0.12 0.51 0.52 0.00 0.00 0.00 179.25 180.53 3kd9 h MET 405 N -0.02 0.91 -0.31 0.00 2.86 -1.43 -0.57 114.93 116.37 3kd9 h MET 405 Ca 0.02 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 3kd9 h MET 405 Cb 0.72 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 3kd9 h MET 405 CO 0.04 0.60 0.03 -0.07 1.06 0.00 0.00 176.91 178.58 3kd9 h LEU 406 N 0.94 0.51 -2.45 1.22 4.07 -1.12 -0.34 115.31 118.14 3kd9 h LEU 406 Ca 0.35 -0.28 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 3kd9 h LEU 406 Cb 0.13 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 41.73 3kd9 h LEU 406 CO -0.16 0.66 -0.02 -0.03 -1.08 0.00 0.00 178.44 177.81 3kd9 h MET 407 N 0.34 0.00 -0.01 1.13 4.05 -0.21 -2.57 114.93 117.66 3kd9 h MET 407 Ca 0.09 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.51 3kd9 h MET 407 Cb 0.38 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 3kd9 h MET 407 CO 0.01 0.02 -0.48 0.00 0.23 0.00 0.00 176.91 176.69 3kd9 n ALA 408 N -2.16 3.54 -1.85 0.39 0.00 -0.28 -4.98 120.51 115.17 3kd9 n ALA 408 Ca -0.02 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.82 3kd9 n ALA 408 Cb 0.14 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 18.89 3kd9 n ALA 408 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kd9 n GLY 409 N 1.33 0.41 3.77 0.00 0.00 -0.69 -5.01 105.19 104.99 3kd9 n GLY 409 Ca 0.08 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.81 3kd9 n GLY 409 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kd9 s PHE 410 N -2.00 2.49 0.47 1.61 0.40 -0.22 -4.89 117.98 115.84 3kd9 s PHE 410 Ca 0.00 1.28 0.04 0.00 -0.60 0.00 0.00 56.93 57.66 3kd9 s PHE 410 Cb 0.00 -3.89 0.02 0.00 0.51 0.00 0.00 43.02 39.66 3kd9 s PHE 410 CO 0.00 -2.84 0.66 0.95 0.70 0.00 0.00 175.22 174.69 3kd9 s THR 411 N -1.21 3.06 0.43 0.64 -4.23 -1.26 -1.74 115.64 111.33 3kd9 s THR 411 Ca 0.61 -0.81 0.09 0.00 -1.18 0.00 0.00 61.69 60.40 3kd9 s THR 411 Cb -0.43 -3.09 0.27 0.00 1.34 0.00 0.00 72.50 70.59 3kd9 s THR 411 CO 0.55 -0.05 2.07 0.00 -0.54 0.00 0.00 174.62 176.65 3kd9 h THR 412 N 0.40 1.07 -0.13 3.99 1.03 -1.10 -0.37 112.91 117.79 3kd9 h THR 412 Ca -0.42 -0.16 -0.23 0.00 -0.01 0.00 0.00 66.41 65.59 3kd9 h THR 412 Cb 1.28 0.57 0.01 0.00 -1.07 0.00 0.00 68.15 68.94 3kd9 h THR 412 CO 0.50 0.08 -0.81 0.50 -0.01 0.00 0.00 175.52 175.79 3kd9 h LYS 413 N 0.46 0.75 0.00 0.00 3.64 -1.86 -2.48 116.57 117.09 3kd9 h LYS 413 Ca 0.14 -0.64 0.02 0.00 -1.27 0.00 0.00 60.65 58.91 3kd9 h LYS 413 Cb 0.00 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 3kd9 h LYS 413 CO -0.03 1.24 -0.14 -0.44 -2.27 0.00 0.00 179.45 177.81 3kd9 h ASP 414 N 0.50 -0.41 -0.43 4.20 3.32 -1.50 -2.32 116.42 119.79 3kd9 h ASP 414 Ca -0.06 0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.09 3kd9 h ASP 414 Cb 1.44 0.17 -0.04 0.00 0.22 0.00 0.00 39.33 41.12 3kd9 h ASP 414 CO 0.16 -0.20 0.19 0.00 -1.72 0.00 0.00 179.24 177.68 3kd9 h ALA 415 N 0.71 0.52 -0.79 3.45 0.00 -1.19 -2.89 119.26 119.07 3kd9 h ALA 415 Ca 0.05 0.03 0.17 0.00 0.00 0.00 0.00 54.91 55.15 3kd9 h ALA 415 Cb 0.30 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 17.95 3kd9 h ALA 415 CO -0.14 -0.18 0.31 0.35 0.00 0.00 0.00 179.25 179.59 3kd9 h PHE 416 N 0.39 0.51 -0.34 0.00 3.57 -0.94 -2.06 116.94 118.07 3kd9 h PHE 416 Ca 0.19 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.73 3kd9 h PHE 416 Cb 0.13 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.76 3kd9 h PHE 416 CO -0.12 0.01 0.00 1.19 -2.23 0.00 0.00 178.31 177.16 3kd9 n PHE 417 N -5.04 0.45 -2.15 0.41 3.72 -0.96 -4.92 117.46 108.98 3kd9 n PHE 417 Ca 0.16 -0.22 -0.42 0.00 -0.05 0.00 0.00 57.45 56.92 3kd9 n PHE 417 Cb 0.48 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.00 3kd9 n PHE 417 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 3kd9 s THR 418 N -1.55 3.44 -1.00 4.37 2.01 -0.78 -4.88 115.64 117.25 3kd9 s THR 418 Ca 0.29 0.92 -0.24 0.00 0.31 0.00 0.00 61.69 62.97 3kd9 s THR 418 Cb 0.15 -3.59 -0.05 0.00 0.01 0.00 0.00 72.50 69.02 3kd9 s THR 418 CO 0.21 0.02 1.92 -0.62 -0.69 0.00 0.00 174.62 175.46 3kd9 s ASP 419 N 1.72 5.18 0.55 3.53 -1.08 -1.26 -4.94 116.67 120.37 3kd9 s ASP 419 Ca 0.66 -1.02 0.01 0.00 -0.52 0.00 0.00 52.55 51.68 3kd9 s ASP 419 Cb -0.35 -2.57 0.03 0.00 -1.46 0.00 0.00 42.92 38.57 3kd9 s ASP 419 CO 0.29 -2.78 0.78 -0.76 0.52 0.00 0.00 175.17 173.22 3kd9 s LEU 420 N 10.10 3.29 0.46 -1.34 1.43 -1.26 -5.08 118.68 126.28 3kd9 s LEU 420 Ca 0.69 0.07 -0.20 0.00 -1.03 0.00 0.00 54.13 53.65 3kd9 s LEU 420 Cb -0.05 -2.93 -0.10 0.00 0.03 0.00 0.00 46.19 43.15 3kd9 s LEU 420 CO 0.03 -1.11 0.97 0.00 0.23 0.00 0.00 176.35 176.47 3kd9 s ALA 421 N -2.77 3.01 -0.14 4.21 0.00 -1.26 -5.07 121.76 119.74 3kd9 s ALA 421 Ca 0.56 0.39 -0.10 0.00 0.00 0.00 0.00 51.96 52.82 3kd9 s ALA 421 Cb -0.10 -3.16 0.05 0.00 0.00 0.00 0.00 23.12 19.90 3kd9 s ALA 421 CO 0.39 -0.04 0.35 -0.47 0.00 0.00 0.00 175.76 175.99 3kd9 s TYR 422 N -2.24 -0.45 0.00 0.00 5.04 -1.26 -4.78 117.35 113.66 3kd9 s TYR 422 Ca 0.62 1.03 0.00 0.00 -2.44 0.00 0.00 57.07 56.28 3kd9 s TYR 422 Cb -0.11 0.16 0.00 0.00 0.35 0.00 0.00 41.96 42.37 3kd9 s TYR 422 CO 0.18 -0.25 0.00 0.00 -1.34 0.00 0.00 175.55 174.14 3kd9 n ALA 423 N 3.64 0.00 -0.27 3.97 0.00 -1.25 -4.98 120.51 121.62 3kd9 n ALA 423 Ca -0.19 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.51 3kd9 n ALA 423 Cb 0.56 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.48 3kd9 n ALA 423 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3kd9 n PRO 424 N 0.00 -0.05 0.08 0.00 -0.02 -1.26 0.06 135.00 133.80 3kd9 n PRO 424 Ca 0.00 1.18 -0.05 0.00 -2.02 0.00 0.00 63.50 62.61 3kd9 n PRO 424 Cb 0.00 -2.09 0.13 0.00 -0.02 0.00 0.00 33.50 31.52 3kd9 n PRO 424 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3kd9 h PRO 425 N 0.00 0.27 0.12 0.52 0.11 -1.97 -3.36 132.00 127.70 3kd9 h PRO 425 Ca 0.70 -0.17 -0.29 0.00 0.11 0.00 0.00 66.00 66.35 3kd9 h PRO 425 Cb 1.83 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.96 3kd9 h PRO 425 CO -0.67 0.76 -1.45 0.74 -0.21 0.00 0.00 178.00 177.17 3kd9 h PHE 426 N 0.21 0.48 -1.88 0.65 0.04 -0.73 -3.49 116.94 112.22 3kd9 h PHE 426 Ca 0.00 -0.35 0.24 0.00 2.80 0.00 0.00 57.97 60.66 3kd9 h PHE 426 Cb 1.04 -0.02 -0.12 0.00 2.20 0.00 0.00 35.95 39.06 3kd9 h PHE 426 CO 0.02 1.57 0.66 0.00 -0.60 0.00 0.00 178.31 179.96 3kd9 s ALA 427 N -2.49 -1.95 0.78 2.45 0.00 -0.68 -4.91 121.76 114.96 3kd9 s ALA 427 Ca -0.19 0.62 -0.12 0.00 0.00 0.00 0.00 51.96 52.27 3kd9 s ALA 427 Cb 0.04 0.42 0.06 0.00 0.00 0.00 0.00 23.12 23.64 3kd9 s ALA 427 CO 0.78 -0.95 1.11 -1.25 0.00 0.00 0.00 175.76 175.44 3kd9 s PRO 428 N -2.83 2.26 0.14 0.00 0.04 -1.26 -3.83 135.00 129.52 3kd9 s PRO 428 Ca 0.12 0.51 -0.28 0.00 0.04 0.00 0.00 61.00 61.39 3kd9 s PRO 428 Cb 0.01 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 3kd9 s PRO 428 CO -0.02 -1.47 1.59 0.28 0.04 0.00 0.00 177.00 177.42 3kd9 h VAL 429 N -0.97 0.20 -3.50 -0.36 2.07 -1.94 -3.26 116.25 108.48 3kd9 h VAL 429 Ca -0.46 0.00 -0.66 0.00 0.82 0.00 0.00 66.70 66.39 3kd9 h VAL 429 Cb 1.27 0.20 -0.16 0.00 -1.52 0.00 0.00 31.29 31.08 3kd9 h VAL 429 CO 0.62 0.00 0.11 0.26 0.02 0.00 0.00 177.57 178.58 3kd9 s TRP 430 N -5.93 3.05 0.57 1.57 0.52 -1.26 -4.92 118.94 112.54 3kd9 s TRP 430 Ca -0.15 -0.17 -0.21 0.00 0.02 0.00 0.00 56.10 55.58 3kd9 s TRP 430 Cb 0.10 -3.40 -0.04 0.00 -1.15 0.00 0.00 33.47 28.98 3kd9 s TRP 430 CO 0.65 -0.92 1.34 0.34 0.02 0.00 0.00 176.95 178.38 3kd9 s ASP 431 N 2.17 5.13 0.44 2.95 2.15 -1.23 -4.72 116.67 123.56 3kd9 s ASP 431 Ca 0.21 2.73 0.17 0.00 0.43 0.00 0.00 52.55 56.10 3kd9 s ASP 431 Cb -0.15 -2.63 1.10 0.00 -0.30 0.00 0.00 42.92 40.94 3kd9 s ASP 431 CO 0.17 -1.66 1.91 -0.65 -0.17 0.00 0.00 175.17 174.77 3kd9 h PRO 432 N 1.26 0.35 -0.35 4.34 0.11 -1.90 0.95 132.00 136.77 3kd9 h PRO 432 Ca -0.51 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.45 3kd9 h PRO 432 Cb 1.31 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3kd9 h PRO 432 CO 0.56 0.23 -0.28 1.25 -0.21 0.00 0.00 178.00 179.56 3kd9 h LEU 433 N 0.36 0.84 -1.23 2.35 5.85 -1.97 -1.63 115.31 119.89 3kd9 h LEU 433 Ca 0.38 -0.45 -0.07 0.00 0.84 0.00 0.00 57.88 58.58 3kd9 h LEU 433 Cb 0.95 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 3kd9 h LEU 433 CO -0.11 1.11 -0.24 0.40 -0.34 0.00 0.00 178.44 179.26 3kd9 h ILE 434 N 0.58 1.23 -0.37 4.05 5.03 -1.28 -1.88 117.51 124.86 3kd9 h ILE 434 Ca 0.06 -1.07 -0.10 0.00 -0.12 0.00 0.00 64.86 63.64 3kd9 h ILE 434 Cb 0.85 1.40 -0.01 0.00 -3.03 0.00 0.00 36.82 36.03 3kd9 h ILE 434 CO 0.07 0.32 -0.14 0.58 -0.68 0.00 0.00 178.15 178.30 3kd9 h VAL 435 N 0.21 1.28 0.04 1.67 2.07 -0.65 -1.76 116.25 119.12 3kd9 h VAL 435 Ca 0.04 -1.25 0.01 0.00 0.82 0.00 0.00 66.70 66.31 3kd9 h VAL 435 Cb 0.54 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 3kd9 h VAL 435 CO 0.04 0.42 -0.07 0.25 0.02 0.00 0.00 177.57 178.23 3kd9 h LEU 436 N 0.56 -0.18 -1.55 2.57 5.85 -0.98 -1.39 115.31 120.18 3kd9 h LEU 436 Ca 0.09 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.87 3kd9 h LEU 436 Cb 0.68 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 3kd9 h LEU 436 CO 0.05 -0.10 0.36 0.00 -0.34 0.00 0.00 178.44 178.40 3kd9 h ALA 437 N 0.81 1.77 -0.47 1.25 0.00 -1.27 0.22 119.26 121.56 3kd9 h ALA 437 Ca 0.01 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3kd9 h ALA 437 Cb 0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3kd9 h ALA 437 CO -0.04 0.17 -0.04 -0.09 0.00 0.00 0.00 179.25 179.24 3kd9 h ARG 438 N 0.58 0.86 -0.27 0.00 9.65 -0.84 0.26 114.38 124.62 3kd9 h ARG 438 Ca 0.22 -0.30 -0.02 0.00 -1.10 0.00 0.00 59.98 58.78 3kd9 h ARG 438 Cb 0.14 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 3kd9 h ARG 438 CO -0.06 0.93 0.08 0.28 2.80 0.00 0.00 179.97 184.00 3kd9 h VAL 439 N 0.71 1.20 -0.56 0.20 2.07 -0.07 -2.15 116.25 117.64 3kd9 h VAL 439 Ca 0.13 -0.64 -0.11 0.00 0.82 0.00 0.00 66.70 66.90 3kd9 h VAL 439 Cb 0.57 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 3kd9 h VAL 439 CO 0.03 0.21 -0.07 -0.07 0.02 0.00 0.00 177.57 177.70 3kd9 h LEU 440 N 0.28 1.03 -0.16 2.57 -0.00 -0.91 -3.15 115.31 114.96 3kd9 h LEU 440 Ca 0.09 -0.32 0.05 0.00 -0.00 0.00 0.00 57.88 57.70 3kd9 h LEU 440 Cb 0.25 -0.28 -0.06 0.00 -0.00 0.00 0.00 40.66 40.56 3kd9 h LEU 440 CO -0.00 1.11 -0.27 0.50 -0.00 0.00 0.00 178.44 179.78 3kd9 h LYS 441 N 0.93 -0.31 -1.99 1.13 3.64 -0.30 -0.76 116.57 118.92 3kd9 h LYS 441 Ca 0.15 0.02 -0.20 0.00 -1.27 0.00 0.00 60.65 59.36 3kd9 h LYS 441 Cb 0.63 0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.45 3kd9 h LYS 441 CO 0.04 -0.21 -0.24 0.39 -2.27 0.00 0.00 179.45 177.16 3kd9 n GLU 442 N -5.39 1.89 0.00 1.90 1.02 -0.83 -5.03 120.64 114.21 3kd9 n GLU 442 Ca -0.02 -1.00 0.07 0.00 -0.02 0.00 0.00 57.16 56.18 3kd9 n GLU 442 Cb 0.30 -1.86 0.06 0.00 -0.02 0.00 0.00 31.44 29.92 3kd9 n GLU 442 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72