#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3koo s ALA 5 N 0.00 -0.01 -0.03 7.54 0.00 -0.01 -4.21 121.76 125.03 3koo s ALA 5 Ca 0.00 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.05 3koo s ALA 5 Cb 0.00 0.98 0.02 0.00 0.00 0.00 0.00 23.12 24.11 3koo s ALA 5 CO 0.00 -0.71 -0.03 0.00 0.00 0.00 0.00 175.76 175.02 3koo s ALA 6 N -4.00 0.50 -0.06 0.00 0.00 -0.54 -0.30 121.76 117.36 3koo s ALA 6 Ca 0.20 -0.01 0.05 0.00 0.00 0.00 0.00 51.96 52.20 3koo s ALA 6 Cb 0.02 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.83 3koo s ALA 6 CO 0.04 0.00 -0.21 0.08 0.00 0.00 0.00 175.76 175.67 3koo s VAL 7 N 0.71 1.74 -0.08 0.00 1.01 -0.21 -2.31 120.40 121.26 3koo s VAL 7 Ca -0.08 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.06 3koo s VAL 7 Cb -0.12 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.77 3koo s VAL 7 CO -0.00 0.49 -0.21 -0.36 0.00 0.00 0.00 175.10 175.01 3koo s PHE 8 N 0.08 2.24 0.66 5.22 0.40 0.40 -2.25 117.98 124.74 3koo s PHE 8 Ca -0.08 -0.83 -0.15 0.00 -0.60 0.00 0.00 56.93 55.27 3koo s PHE 8 Cb -0.14 -1.51 0.00 0.00 0.51 0.00 0.00 43.02 41.88 3koo s PHE 8 CO 0.04 -0.33 1.11 0.34 0.70 0.00 0.00 175.22 177.08 3koo s ASP 9 N 0.28 5.10 0.00 1.36 2.15 -1.18 -2.03 116.67 122.34 3koo s ASP 9 Ca -0.14 1.99 0.00 0.00 0.43 0.00 0.00 52.55 54.83 3koo s ASP 9 Cb -0.16 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 3koo s ASP 9 CO 0.06 -1.64 0.10 -0.11 -0.17 0.00 0.00 175.17 173.42 3koo n LEU 10 N -2.45 1.63 -4.58 -1.34 7.94 -1.26 -2.86 117.00 114.08 3koo n LEU 10 Ca 0.10 0.10 -0.44 0.00 -1.11 0.00 0.00 56.01 54.66 3koo n LEU 10 Cb 0.52 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.43 3koo n LEU 10 CO 0.48 0.00 1.82 -0.67 -1.11 0.00 0.00 177.39 177.91 3koo n ASP 11 N -0.37 3.13 0.00 1.96 4.64 -1.26 -1.38 116.55 123.27 3koo n ASP 11 Ca 0.00 0.30 0.00 0.00 -1.38 0.00 0.00 54.79 53.71 3koo n ASP 11 Cb 0.00 -1.50 0.00 0.00 -1.04 0.00 0.00 41.12 38.58 3koo n ASP 11 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3koo n GLY 12 N 5.79 0.31 0.78 0.27 0.00 -0.68 -4.72 105.19 106.93 3koo n GLY 12 Ca 0.31 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.33 3koo n GLY 12 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3koo n VAL 13 N -2.00 0.18 0.54 1.61 0.31 -0.48 -4.78 118.33 113.71 3koo n VAL 13 Ca 0.00 0.15 0.12 0.00 -0.01 0.00 0.00 64.34 64.59 3koo n VAL 13 Cb 0.00 -1.21 0.11 0.00 -0.91 0.00 0.00 33.84 31.83 3koo n VAL 13 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3koo n LEU 14 N -2.67 0.67 -3.79 7.52 4.77 -0.74 -4.71 117.00 118.05 3koo n LEU 14 Ca -0.00 0.15 -0.30 0.00 -0.03 0.00 0.00 56.01 55.83 3koo n LEU 14 Cb 0.02 -0.15 -0.15 0.00 -2.33 0.00 0.00 43.42 40.81 3koo n LEU 14 CO 0.01 -0.03 -0.34 0.00 -1.33 0.00 0.00 177.39 175.69 3koo s ALA 15 N -3.19 1.70 -0.02 -1.18 0.00 -1.01 0.20 121.76 118.26 3koo s ALA 15 Ca 0.05 -1.64 -0.09 0.00 0.00 0.00 0.00 51.96 50.28 3koo s ALA 15 Cb 0.13 -1.60 -0.05 0.00 0.00 0.00 0.00 23.12 21.61 3koo s ALA 15 CO 0.75 -1.56 0.53 -0.07 0.00 0.00 0.00 175.76 175.41 3koo h LEU 16 N 8.03 -0.28 -8.99 0.00 3.38 -1.61 -1.81 115.31 114.03 3koo h LEU 16 Ca -0.13 0.01 -0.68 0.00 0.09 0.00 0.00 57.88 57.16 3koo h LEU 16 Cb 1.03 0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.86 3koo h LEU 16 CO 0.46 -0.02 1.12 -2.65 0.09 0.00 0.00 178.44 177.44 3koo n PRO 17 N -3.92 1.42 -3.09 1.13 -0.02 -1.26 -4.31 135.00 124.95 3koo n PRO 17 Ca -0.04 0.49 -0.40 0.00 -2.02 0.00 0.00 63.50 61.53 3koo n PRO 17 Cb 0.13 -2.37 -0.06 0.00 -0.02 0.00 0.00 33.50 31.19 3koo n PRO 17 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3koo s ALA 18 N 4.89 3.53 0.38 3.55 0.00 -1.26 -4.60 121.76 128.25 3koo s ALA 18 Ca 1.00 -0.22 0.21 0.00 0.00 0.00 0.00 51.96 52.96 3koo s ALA 18 Cb -0.90 -3.00 1.26 0.00 0.00 0.00 0.00 23.12 20.48 3koo s ALA 18 CO 0.57 -0.55 1.63 0.28 0.00 0.00 0.00 175.76 177.69 3koo h VAL 19 N 5.16 0.17 -0.76 0.00 2.07 -1.91 0.74 116.25 121.73 3koo h VAL 19 Ca -0.31 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.18 3koo h VAL 19 Cb 1.14 -0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 3koo h VAL 19 CO 0.78 0.03 0.47 0.15 0.02 0.00 0.00 177.57 179.03 3koo h PHE 20 N 0.17 0.89 0.00 1.57 3.57 -1.97 -2.96 116.94 118.20 3koo h PHE 20 Ca 0.79 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 62.22 3koo h PHE 20 Cb 2.09 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 40.53 3koo h PHE 20 CO -0.01 0.50 -0.42 0.78 -2.23 0.00 0.00 178.31 176.93 3koo h GLY 21 N 0.92 0.00 2.00 2.40 0.00 0.08 -3.20 103.07 105.28 3koo h GLY 21 Ca 0.31 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.55 3koo h GLY 21 CO -0.12 0.00 -0.43 -0.24 0.00 0.00 0.00 176.54 175.75 3koo h VAL 22 N 0.00 1.01 0.25 4.60 3.04 -1.20 -2.97 116.25 120.99 3koo h VAL 22 Ca -0.00 -1.64 0.01 0.00 -1.01 0.00 0.00 66.70 64.06 3koo h VAL 22 Cb 1.14 1.97 -0.03 0.00 -2.01 0.00 0.00 31.29 32.35 3koo h VAL 22 CO 0.06 0.42 -0.40 -0.07 -1.01 0.00 0.00 177.57 176.56 3koo h LEU 23 N 0.00 -1.13 -0.48 3.16 3.38 -1.53 -0.84 115.31 117.86 3koo h LEU 23 Ca -0.00 0.11 0.10 0.00 0.09 0.00 0.00 57.88 58.18 3koo h LEU 23 Cb 0.93 0.40 -0.10 0.00 0.09 0.00 0.00 40.66 41.99 3koo h LEU 23 CO 0.06 -0.51 -0.17 1.23 0.09 0.00 0.00 178.44 179.14 3koo h GLY 24 N -0.72 0.25 1.00 0.83 0.00 -1.69 0.83 103.07 103.58 3koo h GLY 24 Ca -0.00 0.22 0.13 0.00 0.00 0.00 0.00 47.33 47.68 3koo h GLY 24 CO -0.15 -0.20 0.37 3.21 0.00 0.00 0.00 176.54 179.77 3koo h ARG 25 N -0.06 0.11 -0.15 4.80 3.08 -1.34 0.36 114.38 121.18 3koo h ARG 25 Ca 0.23 -0.01 -0.18 0.00 0.07 0.00 0.00 59.98 60.09 3koo h ARG 25 Cb 0.41 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.44 3koo h ARG 25 CO -0.53 0.07 -0.61 1.15 -1.07 0.00 0.00 179.97 178.98 3koo h THR 26 N 0.11 1.31 -0.09 2.04 2.02 0.56 -2.06 112.91 116.81 3koo h THR 26 Ca 0.25 -1.85 0.01 0.00 0.77 0.00 0.00 66.41 65.59 3koo h THR 26 Cb 0.84 2.01 -0.01 0.00 -1.74 0.00 0.00 68.15 69.25 3koo h THR 26 CO -0.03 0.58 -0.01 -0.33 0.37 0.00 0.00 175.52 176.10 3koo h GLU 27 N 0.38 0.02 0.13 6.66 5.08 0.13 0.88 114.58 127.86 3koo h GLU 27 Ca -0.03 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3koo h GLU 27 Cb 1.24 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 3koo h GLU 27 CO 0.13 0.01 -0.10 0.93 -1.00 0.00 0.00 179.01 178.99 3koo h GLU 28 N 0.02 -0.21 -0.88 2.33 5.08 -1.09 0.58 114.58 120.41 3koo h GLU 28 Ca 0.04 0.01 0.28 0.00 -1.00 0.00 0.00 59.36 58.70 3koo h GLU 28 Cb 0.05 0.05 -0.16 0.00 0.50 0.00 0.00 28.75 29.19 3koo h GLU 28 CO -0.07 -0.14 0.17 0.00 -1.00 0.00 0.00 179.01 177.96 3koo n ALA 29 N -2.28 0.60 1.21 3.43 0.00 -0.77 0.26 120.51 122.96 3koo n ALA 29 Ca -0.03 0.93 0.12 0.00 0.00 0.00 0.00 53.44 54.47 3koo n ALA 29 Cb 0.09 -0.76 0.38 0.00 0.00 0.00 0.00 19.45 19.16 3koo n ALA 29 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3koo n LEU 30 N -5.19 1.99 -3.65 0.00 4.77 0.30 -4.94 117.00 110.28 3koo n LEU 30 Ca 0.25 -0.74 -0.21 0.00 -0.03 0.00 0.00 56.01 55.28 3koo n LEU 30 Cb 0.83 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.90 3koo n LEU 30 CO -0.04 0.37 -0.04 0.00 -1.33 0.00 0.00 177.39 176.34 3koo n ALA 31 N 0.54 -2.06 -2.85 -1.18 0.00 0.14 -5.00 120.51 110.10 3koo n ALA 31 Ca 0.17 -0.15 -0.27 0.00 0.00 0.00 0.00 53.44 53.19 3koo n ALA 31 Cb 0.41 -2.25 -0.05 0.00 0.00 0.00 0.00 19.45 17.57 3koo n ALA 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3koo s LEU 32 N -6.57 4.02 -0.16 0.00 1.43 0.19 -5.02 118.68 112.56 3koo s LEU 32 Ca 0.04 0.02 -0.29 0.00 -1.03 0.00 0.00 54.13 52.87 3koo s LEU 32 Cb -0.01 -2.63 -0.06 0.00 0.03 0.00 0.00 46.19 43.52 3koo s LEU 32 CO 0.80 0.09 2.17 -2.65 0.23 0.00 0.00 176.35 176.99 3koo n PRO 33 N -0.23 2.17 -0.61 1.29 -0.02 -1.26 -4.58 135.00 131.75 3koo n PRO 33 Ca -0.08 0.65 -0.24 0.00 -2.02 0.00 0.00 63.50 61.81 3koo n PRO 33 Cb 0.54 -3.19 -0.03 0.00 -0.02 0.00 0.00 33.50 30.79 3koo n PRO 33 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3koo n ARG 34 N 8.49 0.00 -0.96 -0.52 5.12 -1.26 -0.63 116.66 126.90 3koo n ARG 34 Ca 0.28 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.20 3koo n ARG 34 Cb 0.44 -0.61 0.00 0.00 -1.16 0.00 0.00 32.46 31.12 3koo n ARG 34 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3koo n GLY 35 N 0.62 0.89 0.11 -0.13 0.00 -1.26 -4.92 105.19 100.50 3koo n GLY 35 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 3koo n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3koo h LEU 36 N 0.00 -0.20 -0.39 0.99 7.12 -1.23 -0.30 115.31 121.29 3koo h LEU 36 Ca 0.00 0.04 -0.08 0.00 0.13 0.00 0.00 57.88 57.97 3koo h LEU 36 Cb 0.01 0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 40.23 3koo h LEU 36 CO 0.00 -0.09 -0.07 -0.07 -0.13 0.00 0.00 178.44 178.08 3koo h LEU 37 N -0.08 0.74 -0.85 2.25 3.38 -1.91 -0.47 115.31 118.37 3koo h LEU 37 Ca 0.06 -0.35 -0.08 0.00 0.09 0.00 0.00 57.88 57.59 3koo h LEU 37 Cb 0.16 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3koo h LEU 37 CO -0.13 0.92 0.00 0.78 0.09 0.00 0.00 178.44 180.10 3koo h ASN 38 N 0.55 0.83 -0.16 -0.43 2.35 -1.91 0.27 115.58 117.08 3koo h ASN 38 Ca 0.10 -0.21 -0.22 0.00 -0.55 0.00 0.00 56.30 55.43 3koo h ASN 38 Cb 0.58 -0.22 0.01 0.00 0.05 0.00 0.00 38.32 38.74 3koo h ASN 38 CO 0.03 0.89 -0.74 -0.78 -1.65 0.00 0.00 177.43 175.19 3koo h ASP 39 N 0.80 0.93 0.94 5.81 -0.00 -1.00 -2.87 116.42 121.04 3koo h ASP 39 Ca 0.15 -0.62 0.00 0.00 -0.00 0.00 0.00 57.03 56.56 3koo h ASP 39 Cb 0.47 -0.28 0.00 0.00 -0.00 0.00 0.00 39.33 39.53 3koo h ASP 39 CO 0.02 1.40 0.00 0.00 -0.00 0.00 0.00 179.24 180.66 3koo h ALA 40 N 0.55 1.00 0.00 -0.78 0.00 -0.82 -2.84 119.26 116.37 3koo h ALA 40 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 3koo h ALA 40 Cb 1.37 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 3koo h ALA 40 CO 0.15 0.00 -0.56 0.35 0.00 0.00 0.00 179.25 179.20 3koo h PHE 41 N 0.00 0.00 -0.58 0.00 3.57 -0.23 -3.34 116.94 116.36 3koo h PHE 41 Ca 0.00 0.00 -0.40 0.00 3.53 0.00 0.00 57.97 61.10 3koo h PHE 41 Cb 0.47 0.00 -0.40 0.00 2.79 0.00 0.00 35.95 38.81 3koo h PHE 41 CO 0.00 0.56 -0.93 0.00 -2.23 0.00 0.00 178.31 175.71 3koo n GLN 42 N -3.57 2.72 -2.54 1.11 -0.00 -1.08 -4.38 117.38 109.64 3koo n GLN 42 Ca -0.00 -3.83 -0.42 0.00 -0.00 0.00 0.00 57.00 52.75 3koo n GLN 42 Cb 0.63 -1.94 -0.03 0.00 -0.00 0.00 0.00 30.24 28.90 3koo n GLN 42 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 3koo s LYS 43 N -3.58 4.42 0.00 2.61 2.47 -1.18 -3.26 119.74 121.22 3koo s LYS 43 Ca 0.41 1.60 0.00 0.00 -1.56 0.00 0.00 55.97 56.42 3koo s LYS 43 Cb 0.37 -3.49 0.00 0.00 -1.46 0.00 0.00 37.83 33.26 3koo s LYS 43 CO -0.00 -0.31 0.00 0.41 0.16 0.00 0.00 175.35 175.61 3koo n GLY 44 N 3.20 0.36 7.00 5.54 0.00 -1.26 -4.16 105.19 115.86 3koo n GLY 44 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3koo n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3koo n GLY 45 N -1.87 3.35 0.23 -0.02 0.00 -1.20 -2.40 105.19 103.28 3koo n GLY 45 Ca 0.00 -0.17 0.10 0.00 0.00 0.00 0.00 46.02 45.95 3koo n GLY 45 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3koo h PRO 46 N 0.00 0.00 0.00 1.61 0.11 -1.93 -1.31 132.00 130.48 3koo h PRO 46 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3koo h PRO 46 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3koo h PRO 46 CO 0.00 0.21 0.00 -0.85 -0.21 0.00 0.00 178.00 177.15 3koo n GLU 47 N -3.59 0.22 -2.26 1.05 0.00 -1.01 -4.27 120.64 110.78 3koo n GLU 47 Ca -0.01 0.28 -0.37 0.00 0.00 0.00 0.00 57.16 57.06 3koo n GLU 47 Cb 0.35 -1.81 -0.01 0.00 0.00 0.00 0.00 31.44 29.97 3koo n GLU 47 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 3koo s GLY 48 N -3.52 2.81 0.10 -1.84 0.00 -0.49 -4.73 107.32 99.65 3koo s GLY 48 Ca 0.08 0.95 -0.12 0.00 0.00 0.00 0.00 44.72 45.64 3koo s GLY 48 CO 0.51 1.43 0.80 0.00 0.00 0.00 0.00 173.10 175.84 3koo n ALA 49 N -0.29 -0.17 0.27 3.20 0.00 -1.26 -0.99 120.51 121.27 3koo n ALA 49 Ca 0.06 0.48 -0.16 0.00 0.00 0.00 0.00 53.44 53.82 3koo n ALA 49 Cb 0.47 -0.16 -0.08 0.00 0.00 0.00 0.00 19.45 19.68 3koo n ALA 49 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3koo h THR 50 N 0.00 0.38 -0.61 0.00 2.02 -1.87 -0.23 112.91 112.60 3koo h THR 50 Ca 0.14 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.43 3koo h THR 50 Cb 0.27 0.38 -0.08 0.00 -1.74 0.00 0.00 68.15 66.97 3koo h THR 50 CO -0.50 0.00 0.18 0.74 0.37 0.00 0.00 175.52 176.31 3koo h THR 51 N -0.74 0.70 -0.84 3.16 2.02 -1.26 0.43 112.91 116.37 3koo h THR 51 Ca -0.05 -0.11 0.19 0.00 0.77 0.00 0.00 66.41 67.20 3koo h THR 51 Cb 0.61 0.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.30 3koo h THR 51 CO 0.04 0.06 0.56 0.03 0.37 0.00 0.00 175.52 176.59 3koo h ARG 52 N 0.33 0.36 -0.11 6.66 3.08 -0.64 -0.27 114.38 123.79 3koo h ARG 52 Ca 0.32 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 60.18 3koo h ARG 52 Cb 0.44 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.42 3koo h ARG 52 CO -0.36 0.24 -0.59 1.25 -1.07 0.00 0.00 179.97 179.43 3koo h LEU 53 N 0.37 0.71 -1.41 3.04 5.85 0.15 -0.16 115.31 123.86 3koo h LEU 53 Ca 0.43 -0.65 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 3koo h LEU 53 Cb 1.10 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 3koo h LEU 53 CO -0.14 1.24 -0.22 0.24 -0.34 0.00 0.00 178.44 179.22 3koo h MET 54 N 0.23 0.11 0.00 1.25 2.86 0.27 -2.09 114.93 117.56 3koo h MET 54 Ca -0.04 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 3koo h MET 54 Cb 1.24 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.88 3koo h MET 54 CO 0.12 0.33 0.00 1.63 1.06 0.00 0.00 176.91 180.05 3koo n LYS 55 N -4.23 0.23 -0.90 1.72 4.76 -0.23 -1.61 118.16 117.90 3koo n LYS 55 Ca -0.02 0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 3koo n LYS 55 Cb 0.31 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 3koo n LYS 55 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3koo n GLY 56 N 0.99 0.47 0.17 0.72 0.00 -0.79 -4.11 105.19 102.63 3koo n GLY 56 Ca 0.10 -0.76 -0.18 0.00 0.00 0.00 0.00 46.02 45.17 3koo n GLY 56 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3koo h GLU 57 N 0.30 0.53 -4.99 1.61 5.08 -1.21 -3.46 114.58 112.45 3koo h GLU 57 Ca 0.00 -0.65 -0.33 0.00 -1.00 0.00 0.00 59.36 57.38 3koo h GLU 57 Cb 0.00 0.20 -0.18 0.00 0.50 0.00 0.00 28.75 29.27 3koo h GLU 57 CO 0.00 1.26 -0.74 0.96 -1.00 0.00 0.00 179.01 179.50 3koo s ILE 58 N -3.11 0.95 0.74 3.13 -4.36 -1.22 -5.02 121.20 112.31 3koo s ILE 58 Ca -0.08 -1.59 -0.11 0.00 -0.26 0.00 0.00 60.65 58.61 3koo s ILE 58 Cb 0.07 -1.31 0.04 0.00 1.25 0.00 0.00 42.46 42.51 3koo s ILE 58 CO 0.90 -0.52 1.07 0.42 0.24 0.00 0.00 174.94 177.06 3koo s THR 59 N -2.29 3.63 0.15 8.37 -4.23 -1.26 -4.60 115.64 115.41 3koo s THR 59 Ca 0.04 0.53 -0.18 0.00 -1.18 0.00 0.00 61.69 60.91 3koo s THR 59 Cb -0.04 -3.21 0.03 0.00 1.34 0.00 0.00 72.50 70.62 3koo s THR 59 CO 0.00 -0.69 1.70 0.25 -0.54 0.00 0.00 174.62 175.34 3koo h LEU 60 N -0.91 -0.17 -1.71 4.79 5.85 -1.39 -1.31 115.31 120.45 3koo h LEU 60 Ca -0.45 0.08 0.15 0.00 0.84 0.00 0.00 57.88 58.50 3koo h LEU 60 Cb 1.23 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.36 3koo h LEU 60 CO 0.56 -0.05 0.47 0.28 -0.34 0.00 0.00 178.44 179.36 3koo h SER 61 N 0.07 0.27 1.28 1.25 0.02 -1.90 0.21 113.55 114.75 3koo h SER 61 Ca 0.15 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 3koo h SER 61 Cb 0.21 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 3koo h SER 61 CO -0.27 0.14 -0.04 1.56 -1.14 0.00 0.00 176.83 177.08 3koo h GLN 62 N 0.29 0.00 0.13 3.45 4.20 -1.63 -3.28 115.11 118.27 3koo h GLN 62 Ca 0.33 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.72 3koo h GLN 62 Cb 0.90 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.67 3koo h GLN 62 CO -0.08 0.04 -1.61 2.35 -0.67 0.00 0.00 178.83 178.86 3koo h TRP 63 N 0.00 0.51 0.01 2.96 7.01 0.10 -3.36 115.95 123.17 3koo h TRP 63 Ca -0.00 -0.37 0.02 0.00 2.11 0.00 0.00 58.89 60.64 3koo h TRP 63 Cb 0.69 -0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 27.69 3koo h TRP 63 CO 0.00 1.46 -0.41 0.82 -2.79 0.00 0.00 178.44 177.52 3koo h ILE 64 N 0.08 0.00 -0.68 2.65 5.03 -1.46 0.47 117.51 123.59 3koo h ILE 64 Ca -0.27 0.00 0.15 0.00 -0.12 0.00 0.00 64.86 64.61 3koo h ILE 64 Cb 2.04 0.00 -0.12 0.00 -3.03 0.00 0.00 36.82 35.71 3koo h ILE 64 CO 0.16 0.00 -0.07 -0.65 -0.68 0.00 0.00 178.15 176.91 3koo h PRO 65 N -0.52 0.06 -0.13 2.37 0.11 -1.78 0.65 132.00 132.76 3koo h PRO 65 Ca 0.01 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.15 3koo h PRO 65 Cb 0.55 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 3koo h PRO 65 CO -0.27 0.04 0.15 -0.07 -0.21 0.00 0.00 178.00 177.63 3koo h LEU 66 N 0.06 0.00 0.20 2.35 -0.00 -0.91 -1.82 115.31 115.19 3koo h LEU 66 Ca 0.35 0.00 -0.35 0.00 -0.00 0.00 0.00 57.88 57.88 3koo h LEU 66 Cb 0.58 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 41.25 3koo h LEU 66 CO -0.64 0.00 -1.70 -0.03 -0.00 0.00 0.00 178.44 176.06 3koo h MET 67 N 0.00 0.43 -0.16 1.13 4.05 0.46 -3.33 114.93 117.52 3koo h MET 67 Ca 0.06 -0.73 0.02 0.00 -0.28 0.00 0.00 59.70 58.76 3koo h MET 67 Cb 0.35 0.27 -0.03 0.00 -0.80 0.00 0.00 31.60 31.40 3koo h MET 67 CO -0.00 1.35 -0.17 0.93 0.23 0.00 0.00 176.91 179.26 3koo h GLU 68 N 0.12 -0.09 -1.03 0.39 4.39 0.17 -2.96 114.58 115.56 3koo h GLU 68 Ca -0.33 0.01 0.27 0.00 0.34 0.00 0.00 59.36 59.64 3koo h GLU 68 Cb 2.12 0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 30.68 3koo h GLU 68 CO 0.20 -0.06 0.64 0.93 -1.16 0.00 0.00 179.01 179.56 3koo h GLU 69 N -0.09 0.45 -0.94 2.33 5.08 -1.60 2.09 114.58 121.89 3koo h GLU 69 Ca 0.03 -0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.47 3koo h GLU 69 Cb 0.16 -0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 3koo h GLU 69 CO -0.19 0.30 0.60 -0.91 -1.00 0.00 0.00 179.01 177.81 3koo h ASN 70 N 0.47 0.85 0.97 1.42 4.21 -1.63 -1.32 115.58 120.55 3koo h ASN 70 Ca 0.64 0.03 -0.18 0.00 1.21 0.00 0.00 56.30 58.00 3koo h ASN 70 Cb 1.43 -0.14 -0.03 0.00 -1.12 0.00 0.00 38.32 38.46 3koo h ASN 70 CO -0.41 0.48 -0.87 0.00 -1.29 0.00 0.00 177.43 175.34 3koo h ARG 72 N 0.00 -0.03 -0.36 0.00 -0.00 -0.87 -0.38 114.38 112.74 3koo h ARG 72 Ca -0.01 0.00 -0.05 0.00 -0.50 0.00 0.00 59.98 59.43 3koo h ARG 72 Cb 1.59 0.01 -0.01 0.00 0.00 0.00 0.00 29.97 31.55 3koo h ARG 72 CO 0.11 0.05 0.04 0.87 0.00 0.00 0.00 179.97 181.04 3koo h LYS 73 N -0.11 0.61 0.00 0.04 1.79 -1.11 -1.75 116.57 116.04 3koo h LYS 73 Ca -0.00 -0.17 -0.09 0.00 -2.18 0.00 0.00 60.65 58.20 3koo h LYS 73 Cb 0.10 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 3koo h LYS 73 CO 0.01 0.69 -0.44 0.00 -1.08 0.00 0.00 179.45 178.63 3koo h SER 75 N 0.00 0.01 0.18 0.00 4.64 -0.95 -3.11 113.55 114.32 3koo h SER 75 Ca -0.00 -0.01 -0.28 0.00 -0.47 0.00 0.00 61.79 61.03 3koo h SER 75 Cb 0.82 -0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.94 3koo h SER 75 CO 0.06 0.65 -1.21 -0.08 -0.87 0.00 0.00 176.83 175.37 3koo h GLU 76 N 0.01 0.51 -0.59 4.77 4.81 -0.14 0.62 114.58 124.57 3koo h GLU 76 Ca -0.01 -0.78 -0.09 0.00 -0.13 0.00 0.00 59.36 58.35 3koo h GLU 76 Cb 1.13 0.28 -0.02 0.00 0.63 0.00 0.00 28.75 30.77 3koo h GLU 76 CO 0.08 1.36 0.02 1.15 -0.73 0.00 0.00 179.01 180.90 3koo h THR 77 N 0.05 1.26 0.00 0.32 2.02 -1.17 -1.57 112.91 113.83 3koo h THR 77 Ca -0.20 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 65.87 3koo h THR 77 Cb 1.93 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.15 3koo h THR 77 CO 0.23 0.40 0.00 0.00 0.37 0.00 0.00 175.52 176.52 3koo n ALA 78 N -2.47 2.40 -3.30 6.16 0.00 -1.17 -4.96 120.51 117.17 3koo n ALA 78 Ca 0.03 -0.12 -0.13 0.00 0.00 0.00 0.00 53.44 53.21 3koo n ALA 78 Cb 0.33 -1.48 0.03 0.00 0.00 0.00 0.00 19.45 18.33 3koo n ALA 78 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3koo n LYS 79 N -1.37 -1.63 -4.55 0.00 5.02 0.80 -5.03 118.16 111.39 3koo n LYS 79 Ca 0.11 1.03 -0.27 0.00 -2.02 0.00 0.00 58.31 57.17 3koo n LYS 79 Cb 0.28 -5.20 -0.08 0.00 -0.02 0.00 0.00 35.03 30.01 3koo n LYS 79 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3koo s VAL 80 N -3.21 0.58 0.01 -0.18 1.01 0.18 -4.99 120.40 113.79 3koo s VAL 80 Ca 0.24 -2.00 0.05 0.00 0.00 0.00 0.00 61.98 60.27 3koo s VAL 80 Cb -0.05 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 3koo s VAL 80 CO 0.78 0.00 -0.13 0.00 0.00 0.00 0.00 175.10 175.75 3koo s LEU 82 N -1.29 4.15 0.75 0.00 1.43 -1.26 -5.06 118.68 117.40 3koo s LEU 82 Ca 0.15 0.31 -0.17 0.00 -1.03 0.00 0.00 54.13 53.39 3koo s LEU 82 Cb -0.11 -2.28 -0.14 0.00 0.03 0.00 0.00 46.19 43.69 3koo s LEU 82 CO 0.05 0.03 -0.37 -2.65 0.23 0.00 0.00 176.35 173.64 3koo n PRO 83 N 4.20 0.02 -0.09 1.29 -0.02 -1.26 -4.84 135.00 134.30 3koo n PRO 83 Ca -0.12 0.01 -0.09 0.00 -2.02 0.00 0.00 63.50 61.28 3koo n PRO 83 Cb 0.52 -1.08 -0.06 0.00 -0.02 0.00 0.00 33.50 32.85 3koo n PRO 83 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3koo h LYS 84 N -0.51 -0.25 -1.15 -0.52 2.10 -2.04 -2.71 116.57 111.49 3koo h LYS 84 Ca -0.43 0.02 -0.48 0.00 -2.00 0.00 0.00 60.65 57.76 3koo h LYS 84 Cb 1.37 0.06 -0.23 0.00 -0.90 0.00 0.00 32.23 32.53 3koo h LYS 84 CO 0.33 -0.17 0.62 0.09 -2.00 0.00 0.00 179.45 178.33 3koo n ASN 85 N -4.42 5.91 -4.68 7.07 3.02 -1.26 -4.97 115.26 115.94 3koo n ASN 85 Ca -0.02 -3.40 -0.42 0.00 -0.03 0.00 0.00 54.58 50.70 3koo n ASN 85 Cb 0.22 -0.93 -0.03 0.00 -0.61 0.00 0.00 39.78 38.44 3koo n ASN 85 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3koo s PHE 86 N -2.82 2.61 -0.05 3.10 5.36 -1.02 -5.00 117.98 120.15 3koo s PHE 86 Ca 0.48 0.67 -0.02 0.00 -0.96 0.00 0.00 56.93 57.10 3koo s PHE 86 Cb 0.39 -3.71 0.04 0.00 -0.34 0.00 0.00 43.02 39.39 3koo s PHE 86 CO 0.03 -2.73 0.10 0.45 -1.46 0.00 0.00 175.22 171.60 3koo s SER 87 N 2.29 0.51 0.25 6.13 0.15 -1.26 -5.03 113.70 116.74 3koo s SER 87 Ca 0.65 0.19 0.11 0.00 0.70 0.00 0.00 55.95 57.60 3koo s SER 87 Cb -0.30 0.07 0.25 0.00 -1.71 0.00 0.00 66.02 64.32 3koo s SER 87 CO 0.25 -0.20 1.54 0.40 1.20 0.00 0.00 173.24 176.44 3koo h ILE 88 N 6.30 1.42 0.26 6.45 2.04 -1.95 -3.09 117.51 128.94 3koo h ILE 88 Ca -0.27 -2.36 -0.01 0.00 1.00 0.00 0.00 64.86 63.22 3koo h ILE 88 Cb 1.12 2.30 -0.01 0.00 -0.74 0.00 0.00 36.82 39.49 3koo h ILE 88 CO 0.28 0.66 -0.28 0.50 0.00 0.00 0.00 178.15 179.32 3koo h LYS 89 N 0.00 -0.52 -0.74 2.37 1.63 -1.95 -2.50 116.57 114.86 3koo h LYS 89 Ca -0.01 0.04 0.11 0.00 -0.85 0.00 0.00 60.65 59.94 3koo h LYS 89 Cb 1.24 0.12 -0.08 0.00 -0.60 0.00 0.00 32.23 32.91 3koo h LYS 89 CO 0.09 -0.35 0.35 1.49 -3.45 0.00 0.00 179.45 177.58 3koo h GLU 90 N -0.54 0.55 -0.83 1.90 4.22 -2.00 -1.22 114.58 116.65 3koo h GLU 90 Ca -0.03 -0.03 0.10 0.00 0.08 0.00 0.00 59.36 59.47 3koo h GLU 90 Cb 0.48 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.53 3koo h GLU 90 CO -0.05 0.36 0.48 0.82 -2.18 0.00 0.00 179.01 178.44 3koo h ILE 91 N 0.57 0.90 0.15 2.32 2.04 -1.49 -2.73 117.51 119.26 3koo h ILE 91 Ca 0.38 -0.27 -0.29 0.00 1.00 0.00 0.00 64.86 65.68 3koo h ILE 91 Cb 0.47 0.04 0.02 0.00 -0.74 0.00 0.00 36.82 36.60 3koo h ILE 91 CO -0.31 0.14 -1.27 -0.26 0.00 0.00 0.00 178.15 176.45 3koo h PHE 92 N 0.79 0.68 0.00 1.37 -1.00 -0.93 -3.00 116.94 114.86 3koo h PHE 92 Ca 0.41 -0.48 0.00 0.00 2.81 0.00 0.00 57.97 60.71 3koo h PHE 92 Cb 0.39 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 3koo h PHE 92 CO -0.06 1.36 -0.10 -0.44 -1.61 0.00 0.00 178.31 177.46 3koo h ASP 93 N 0.13 -0.31 -0.77 2.17 3.32 -1.01 0.15 116.42 120.10 3koo h ASP 93 Ca -0.16 0.03 0.12 0.00 0.02 0.00 0.00 57.03 57.04 3koo h ASP 93 Cb 1.97 0.12 -0.13 0.00 0.22 0.00 0.00 39.33 41.51 3koo h ASP 93 CO 0.22 -0.10 -0.39 0.50 -1.72 0.00 0.00 179.24 177.75 3koo h LYS 94 N -0.13 -0.10 -0.00 3.56 3.64 -1.63 -1.84 116.57 120.07 3koo h LYS 94 Ca 0.00 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3koo h LYS 94 Cb 0.13 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 3koo h LYS 94 CO -0.07 -0.07 -0.32 0.00 -2.27 0.00 0.00 179.45 176.72 3koo h ALA 95 N 1.02 -0.77 -0.80 5.00 0.00 -1.31 0.36 119.26 122.76 3koo h ALA 95 Ca 0.26 -0.05 0.19 0.00 0.00 0.00 0.00 54.91 55.30 3koo h ALA 95 Cb 0.56 0.78 -0.12 0.00 0.00 0.00 0.00 17.79 19.01 3koo h ALA 95 CO -0.82 -0.87 0.21 0.82 0.00 0.00 0.00 179.25 178.60 3koo h ILE 96 N -0.41 0.45 -0.00 0.00 2.04 -0.59 0.40 117.51 119.39 3koo h ILE 96 Ca 0.01 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3koo h ILE 96 Cb 0.43 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 3koo h ILE 96 CO -0.22 0.05 -0.05 -1.20 0.00 0.00 0.00 178.15 176.73 3koo n SER 97 N -5.17 0.53 0.02 1.72 7.64 -0.73 -2.27 113.62 115.36 3koo n SER 97 Ca 0.17 -0.90 0.11 0.00 1.01 0.00 0.00 58.87 59.26 3koo n SER 97 Cb 0.54 -0.04 0.04 0.00 -1.01 0.00 0.00 64.21 63.74 3koo n SER 97 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3koo n ALA 98 N -0.73 3.57 -2.67 -0.43 0.00 0.13 -4.88 120.51 115.50 3koo n ALA 98 Ca 0.18 -0.42 -0.42 0.00 0.00 0.00 0.00 53.44 52.78 3koo n ALA 98 Cb 0.24 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.70 3koo n ALA 98 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3koo s ARG 99 N -3.15 4.34 0.10 0.00 3.52 -0.67 -4.69 118.95 118.40 3koo s ARG 99 Ca 0.05 1.30 0.08 0.00 -0.13 0.00 0.00 55.73 57.04 3koo s ARG 99 Cb 0.15 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.92 3koo s ARG 99 CO 0.80 -0.43 -0.21 0.15 -0.81 0.00 0.00 175.30 174.79 3koo s LYS 100 N 2.47 1.13 0.55 5.12 -0.14 -1.26 -4.98 119.74 122.62 3koo s LYS 100 Ca 0.45 -1.17 -0.18 0.00 -1.36 0.00 0.00 55.97 53.71 3koo s LYS 100 Cb -0.17 -1.40 -0.10 0.00 -1.68 0.00 0.00 37.83 34.48 3koo s LYS 100 CO 0.13 0.33 0.38 -0.89 -0.76 0.00 0.00 175.35 174.53 3koo n ILE 101 N 1.08 1.72 -3.35 2.17 5.41 -1.26 -1.85 119.36 123.28 3koo n ILE 101 Ca -0.19 -0.50 -0.46 0.00 1.00 0.00 0.00 62.75 62.60 3koo n ILE 101 Cb 0.53 -0.52 -0.01 0.00 -0.71 0.00 0.00 39.64 38.93 3koo n ILE 101 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 3koo s ASN 102 N -1.12 6.94 0.29 4.38 3.84 0.54 -4.55 114.94 125.25 3koo s ASN 102 Ca 0.66 -3.08 0.04 0.00 0.21 0.00 0.00 52.86 50.69 3koo s ASN 102 Cb -0.46 -2.20 0.72 0.00 -0.55 0.00 0.00 41.25 38.76 3koo s ASN 102 CO 0.57 -0.45 1.70 0.03 -2.79 0.00 0.00 177.10 176.17 3koo h ARG 103 N 7.28 0.42 -0.39 0.43 2.47 -1.91 -1.04 114.38 121.64 3koo h ARG 103 Ca 0.14 -0.03 -0.15 0.00 -1.26 0.00 0.00 59.98 58.68 3koo h ARG 103 Cb 0.97 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 29.18 3koo h ARG 103 CO 0.85 0.28 -0.34 -1.35 0.56 0.00 0.00 179.97 179.98 3koo h PRO 104 N 0.43 0.89 0.49 0.04 0.11 -1.97 0.22 132.00 132.22 3koo h PRO 104 Ca 0.55 -0.44 -0.02 0.00 0.11 0.00 0.00 66.00 66.20 3koo h PRO 104 Cb 1.03 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 3koo h PRO 104 CO -0.51 1.09 -0.24 1.98 -0.21 0.00 0.00 178.00 180.11 3koo h MET 105 N 0.74 -0.64 -0.57 1.05 4.05 -1.54 -1.06 114.93 116.96 3koo h MET 105 Ca 0.07 0.04 0.10 0.00 -0.28 0.00 0.00 59.70 59.63 3koo h MET 105 Cb 0.91 0.14 -0.11 0.00 -0.80 0.00 0.00 31.60 31.74 3koo h MET 105 CO 0.08 -0.40 -0.37 1.25 0.23 0.00 0.00 176.91 177.71 3koo h LEU 106 N -0.71 -1.26 -0.79 3.39 6.46 -1.28 -0.01 115.31 121.11 3koo h LEU 106 Ca -0.07 0.23 0.07 0.00 -0.12 0.00 0.00 57.88 57.99 3koo h LEU 106 Cb 0.53 0.60 -0.09 0.00 -0.73 0.00 0.00 40.66 40.97 3koo h LEU 106 CO 0.11 -0.32 -0.46 0.00 -0.62 0.00 0.00 178.44 177.15 3koo n GLN 107 N -5.43 -0.35 -0.15 1.25 6.02 0.78 -1.06 117.38 118.45 3koo n GLN 107 Ca 0.03 1.23 -0.04 0.00 -0.01 0.00 0.00 57.00 58.21 3koo n GLN 107 Cb 0.35 -1.80 0.02 0.00 1.02 0.00 0.00 30.24 29.83 3koo n GLN 107 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3koo h ALA 108 N 0.36 0.16 -0.56 -1.58 0.00 0.31 -1.12 119.26 116.82 3koo h ALA 108 Ca 0.13 0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.29 3koo h ALA 108 Cb 0.32 0.52 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 3koo h ALA 108 CO -0.74 -0.54 0.21 0.00 0.00 0.00 0.00 179.25 178.17 3koo h ALA 109 N 1.24 0.71 -0.44 0.00 0.00 -0.30 -0.28 119.26 120.19 3koo h ALA 109 Ca 0.23 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3koo h ALA 109 Cb 0.45 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3koo h ALA 109 CO -0.55 -0.20 0.22 -0.07 0.00 0.00 0.00 179.25 178.66 3koo h LEU 110 N 0.39 0.54 0.11 0.00 -0.00 -0.14 -0.17 115.31 116.04 3koo h LEU 110 Ca 0.28 -0.04 -0.01 0.00 -0.00 0.00 0.00 57.88 58.11 3koo h LEU 110 Cb 0.32 -0.14 0.00 0.00 -0.00 0.00 0.00 40.66 40.84 3koo h LEU 110 CO -0.28 0.46 -0.05 -0.03 -0.00 0.00 0.00 178.44 178.54 3koo h MET 111 N 0.62 -0.14 -0.02 1.13 4.05 0.06 0.17 114.93 120.78 3koo h MET 111 Ca 0.16 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.62 3koo h MET 111 Cb 0.05 0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 30.83 3koo h MET 111 CO -0.02 0.35 -0.27 -0.07 0.23 0.00 0.00 176.91 177.12 3koo h LEU 112 N -0.75 -0.81 -0.40 3.39 3.38 -1.00 0.71 115.31 119.82 3koo h LEU 112 Ca -0.01 0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.11 3koo h LEU 112 Cb 0.55 0.34 -0.06 0.00 0.09 0.00 0.00 40.66 41.58 3koo h LEU 112 CO 0.02 -0.34 -0.32 -0.09 0.09 0.00 0.00 178.44 177.81 3koo h ARG 113 N -0.40 -0.10 -0.13 1.13 2.43 -1.08 0.29 114.38 116.51 3koo h ARG 113 Ca 0.07 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.28 3koo h ARG 113 Cb 0.50 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 3koo h ARG 113 CO -0.25 -0.07 0.20 -0.22 -1.51 0.00 0.00 179.97 178.12 3koo h LYS 114 N -0.11 0.00 -0.47 0.20 3.64 0.02 0.69 116.57 120.55 3koo h LYS 114 Ca 0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3koo h LYS 114 Cb 0.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 3koo h LYS 114 CO -0.43 0.00 0.00 1.63 -2.27 0.00 0.00 179.45 178.38 3koo n LYS 115 N -3.53 2.05 0.00 1.90 4.76 0.24 -4.88 118.16 118.70 3koo n LYS 115 Ca 0.01 -1.26 0.00 0.00 -2.87 0.00 0.00 58.31 54.19 3koo n LYS 115 Cb 0.31 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 32.08 3koo n LYS 115 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3koo n GLY 116 N 0.82 0.32 3.77 0.72 0.00 0.24 -5.00 105.19 106.06 3koo n GLY 116 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 3koo n GLY 116 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3koo s PHE 117 N -2.00 3.32 -0.22 1.61 0.40 -0.19 -4.95 117.98 115.95 3koo s PHE 117 Ca 0.00 1.64 -0.20 0.00 -0.60 0.00 0.00 56.93 57.77 3koo s PHE 117 Cb 0.00 -3.26 -0.02 0.00 0.51 0.00 0.00 43.02 40.25 3koo s PHE 117 CO 0.00 -0.79 0.59 0.99 0.70 0.00 0.00 175.22 176.71 3koo s THR 118 N -1.41 5.03 0.32 0.64 2.01 -1.26 -4.07 115.64 116.89 3koo s THR 118 Ca 0.53 1.08 0.09 0.00 0.31 0.00 0.00 61.69 63.70 3koo s THR 118 Cb -0.28 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.28 3koo s THR 118 CO 0.35 0.10 -0.00 0.42 -0.69 0.00 0.00 174.62 174.80 3koo s THR 119 N 2.09 2.86 -0.29 -0.82 -4.23 -1.26 -1.46 115.64 112.52 3koo s THR 119 Ca 0.26 -1.97 -0.21 0.00 -1.18 0.00 0.00 61.69 58.59 3koo s THR 119 Cb -0.16 -2.77 0.13 0.00 1.34 0.00 0.00 72.50 71.04 3koo s THR 119 CO 0.09 -0.26 1.01 0.00 -0.54 0.00 0.00 174.62 174.93 3koo s ALA 120 N -2.46 -2.11 -0.26 3.99 0.00 -0.98 -2.39 121.76 117.55 3koo s ALA 120 Ca 0.34 2.03 -0.19 0.00 0.00 0.00 0.00 51.96 54.13 3koo s ALA 120 Cb -0.02 -1.57 -0.02 0.00 0.00 0.00 0.00 23.12 21.50 3koo s ALA 120 CO 0.19 -0.28 0.56 0.42 0.00 0.00 0.00 175.76 176.65 3koo s ILE 121 N 0.74 5.04 -0.53 0.00 1.01 -0.68 -0.45 121.20 126.33 3koo s ILE 121 Ca -0.02 0.99 -0.01 0.00 0.00 0.00 0.00 60.65 61.60 3koo s ILE 121 Cb -0.04 -3.87 0.14 0.00 0.01 0.00 0.00 42.46 38.69 3koo s ILE 121 CO -0.11 0.06 0.32 -0.22 0.00 0.00 0.00 174.94 175.00 3koo s LEU 122 N 2.37 5.08 0.00 2.97 0.20 -0.86 -0.18 118.68 128.26 3koo s LEU 122 Ca 0.23 -2.60 0.08 0.00 0.69 0.00 0.00 54.13 52.54 3koo s LEU 122 Cb -0.16 -1.80 -0.02 0.00 -0.43 0.00 0.00 46.19 43.78 3koo s LEU 122 CO 0.09 -0.40 -0.25 0.28 -0.29 0.00 0.00 176.35 175.78 3koo s THR 123 N 0.31 2.17 -0.44 3.68 -1.32 -0.46 -4.40 115.64 115.17 3koo s THR 123 Ca 0.14 -1.19 -0.28 0.00 -1.21 0.00 0.00 61.69 59.15 3koo s THR 123 Cb -0.22 -1.79 0.03 0.00 -1.51 0.00 0.00 72.50 69.01 3koo s THR 123 CO -0.03 0.50 1.06 0.20 -2.21 0.00 0.00 174.62 174.14 3koo s ASN 124 N -0.87 6.66 0.00 8.08 0.01 -1.26 -1.61 114.94 125.95 3koo s ASN 124 Ca 0.11 0.50 -0.14 0.00 -0.71 0.00 0.00 52.86 52.62 3koo s ASN 124 Cb -0.10 -2.52 0.02 0.00 0.41 0.00 0.00 41.25 39.06 3koo s ASN 124 CO 0.00 -1.12 0.29 0.28 -1.51 0.00 0.00 177.10 175.05 3koo s THR 125 N 4.09 0.07 0.73 1.60 -1.32 -1.26 -4.92 115.64 114.63 3koo s THR 125 Ca 0.44 -0.55 -0.03 0.00 -1.21 0.00 0.00 61.69 60.35 3koo s THR 125 Cb -0.09 -0.68 0.12 0.00 -1.51 0.00 0.00 72.50 70.35 3koo s THR 125 CO 0.27 -0.30 1.01 -1.66 -2.21 0.00 0.00 174.62 171.73 3koo s TRP 126 N -1.62 1.79 -0.41 9.09 -2.14 -1.26 -3.16 118.94 121.23 3koo s TRP 126 Ca -0.12 -0.15 -0.17 0.00 2.66 0.00 0.00 56.10 58.33 3koo s TRP 126 Cb -0.04 -3.10 0.02 0.00 -3.10 0.00 0.00 33.47 27.25 3koo s TRP 126 CO 0.02 -1.71 0.41 -0.51 -2.66 0.00 0.00 176.95 172.50 3koo s LEU 127 N -5.19 4.84 -0.44 -4.66 1.43 -1.26 -4.91 118.68 108.49 3koo s LEU 127 Ca 0.66 -0.64 -0.22 0.00 -1.03 0.00 0.00 54.13 52.90 3koo s LEU 127 Cb -0.06 -2.35 0.02 0.00 0.03 0.00 0.00 46.19 43.84 3koo s LEU 127 CO 0.45 -0.53 0.70 -0.62 0.23 0.00 0.00 176.35 176.58 3koo s ASP 128 N 1.78 6.37 -0.13 2.29 -1.08 -1.26 -0.88 116.67 123.76 3koo s ASP 128 Ca 0.11 -0.21 0.16 0.00 -0.52 0.00 0.00 52.55 52.09 3koo s ASP 128 Cb -0.17 -2.35 0.34 0.00 -1.46 0.00 0.00 42.92 39.28 3koo s ASP 128 CO 0.13 -0.82 1.23 -0.90 0.52 0.00 0.00 175.17 175.32 3koo n ASP 129 N 6.43 2.82 -4.33 -0.34 5.75 -1.26 -4.86 116.55 120.76 3koo n ASP 129 Ca -0.00 -2.92 -0.30 0.00 -0.01 0.00 0.00 54.79 51.56 3koo n ASP 129 Cb 0.48 -0.42 0.22 0.00 -1.03 0.00 0.00 41.12 40.37 3koo n ASP 129 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3koo n ARG 130 N -0.98 -2.19 -0.10 0.11 1.74 -1.26 -4.88 116.66 109.10 3koo n ARG 130 Ca 0.16 -0.62 -0.13 0.00 -0.77 0.00 0.00 57.85 56.49 3koo n ARG 130 Cb 0.67 -1.90 -0.04 0.00 -1.02 0.00 0.00 32.46 30.18 3koo n ARG 130 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3koo h ALA 131 N -2.44 0.47 -0.12 7.54 0.00 -2.06 -3.21 119.26 119.44 3koo h ALA 131 Ca -0.58 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 53.90 3koo h ALA 131 Cb 1.35 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3koo h ALA 131 CO 0.43 0.54 0.00 -0.85 0.00 0.00 0.00 179.25 179.37 3koo n GLU 132 N -4.17 1.57 0.15 0.00 0.00 -1.26 -4.30 120.64 112.61 3koo n GLU 132 Ca -0.03 -0.56 0.18 0.00 0.00 0.00 0.00 57.16 56.75 3koo n GLU 132 Cb 0.51 -1.41 0.78 0.00 0.00 0.00 0.00 31.44 31.32 3koo n GLU 132 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.13 177.20 3koo h ARG 133 N 0.79 0.00 -1.01 3.44 0.11 -1.88 -2.31 114.38 113.52 3koo h ARG 133 Ca 0.00 0.00 0.24 0.00 0.10 0.00 0.00 59.98 60.32 3koo h ARG 133 Cb 0.52 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 31.49 3koo h ARG 133 CO 0.05 0.00 0.61 0.22 0.10 0.00 0.00 179.97 180.95 3koo h ASP 134 N 0.00 0.65 0.49 0.08 -0.00 -1.88 0.11 116.42 115.87 3koo h ASP 134 Ca 0.14 0.13 -0.01 0.00 -0.00 0.00 0.00 57.03 57.29 3koo h ASP 134 Cb 0.74 0.02 -0.00 0.00 -0.00 0.00 0.00 39.33 40.09 3koo h ASP 134 CO -0.00 0.11 -0.03 1.23 -0.00 0.00 0.00 179.24 180.55 3koo h GLY 135 N 0.57 0.00 0.00 -0.78 0.00 -1.79 0.44 103.07 101.51 3koo h GLY 135 Ca 0.63 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.94 3koo h GLY 135 CO -0.44 0.00 -0.16 -2.00 0.00 0.00 0.00 176.54 173.94 3koo h LEU 136 N 0.00 0.00 -1.00 3.11 6.46 -1.00 -3.22 115.31 119.66 3koo h LEU 136 Ca -0.00 -0.63 0.13 0.00 -0.12 0.00 0.00 57.88 57.26 3koo h LEU 136 Cb 0.29 0.00 -0.09 0.00 -0.73 0.00 0.00 40.66 40.13 3koo h LEU 136 CO 0.00 0.91 0.62 0.00 -0.62 0.00 0.00 178.44 179.35 3koo h ALA 137 N -0.37 1.53 -0.61 1.25 0.00 -0.97 0.46 119.26 120.55 3koo h ALA 137 Ca -0.04 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3koo h ALA 137 Cb 0.74 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3koo h ALA 137 CO -0.02 0.18 0.33 0.37 0.00 0.00 0.00 179.25 180.11 3koo h GLN 138 N 0.95 0.85 0.03 0.00 4.15 -0.26 -2.12 115.11 118.72 3koo h GLN 138 Ca 0.51 -0.10 -0.24 0.00 0.77 0.00 0.00 58.65 59.59 3koo h GLN 138 Cb 0.55 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.07 3koo h GLN 138 CO -0.28 0.65 -1.02 1.25 -1.93 0.00 0.00 178.83 177.50 3koo h LEU 139 N 0.83 0.49 -2.31 -2.39 5.85 -1.43 -2.96 115.31 113.40 3koo h LEU 139 Ca 0.22 -0.43 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 3koo h LEU 139 Cb 0.05 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 40.92 3koo h LEU 139 CO -0.03 1.25 -0.03 0.24 -0.34 0.00 0.00 178.44 179.52 3koo h MET 140 N 0.18 0.00 0.02 1.25 2.86 -0.69 -2.53 114.93 116.02 3koo h MET 140 Ca -0.09 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.43 3koo h MET 140 Cb 1.67 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.32 3koo h MET 140 CO 0.17 0.03 -0.61 0.00 1.06 0.00 0.00 176.91 177.56 3koo n GLU 142 N -4.46 -0.29 0.04 0.00 -0.58 -1.06 -3.36 120.64 110.94 3koo n GLU 142 Ca -0.19 1.28 -0.02 0.00 -0.42 0.00 0.00 57.16 57.81 3koo n GLU 142 Cb 0.61 -1.89 -0.01 0.00 -0.57 0.00 0.00 31.44 29.58 3koo n GLU 142 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3koo h LEU 143 N 0.00 -0.09 0.00 -4.62 3.38 -1.58 -3.35 115.31 109.06 3koo h LEU 143 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3koo h LEU 143 Cb 0.42 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3koo h LEU 143 CO -0.81 0.01 0.00 1.17 0.09 0.00 0.00 178.44 178.89 3koo n LYS 144 N -2.68 0.00 -0.05 1.13 4.81 -0.96 -0.14 118.16 120.28 3koo n LYS 144 Ca -0.01 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.52 3koo n LYS 144 Cb 0.04 0.00 0.47 0.00 0.02 0.00 0.00 35.03 35.57 3koo n LYS 144 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3koo h MET 145 N 0.00 0.44 -0.63 1.64 -0.00 -1.68 -2.35 114.93 112.35 3koo h MET 145 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 59.70 59.67 3koo h MET 145 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 31.60 31.50 3koo h MET 145 CO 0.00 0.29 0.00 0.72 -0.00 0.00 0.00 176.91 177.92 3koo n HIS 146 N -4.47 0.77 -4.24 -0.10 8.25 0.81 -4.83 115.22 111.41 3koo n HIS 146 Ca 0.07 -0.29 -0.16 0.00 -0.26 0.00 0.00 57.72 57.08 3koo n HIS 146 Cb 0.25 -0.18 -0.11 0.00 1.12 0.00 0.00 29.99 31.08 3koo n HIS 146 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3koo s PHE 147 N -1.71 1.31 0.17 4.41 0.40 -0.88 -4.71 117.98 116.96 3koo s PHE 147 Ca 0.24 -0.64 0.06 0.00 -0.60 0.00 0.00 56.93 55.99 3koo s PHE 147 Cb 0.16 -0.68 -0.02 0.00 0.51 0.00 0.00 43.02 42.99 3koo s PHE 147 CO 0.10 0.11 1.38 -0.44 0.70 0.00 0.00 175.22 177.07 3koo h ASP 148 N 3.23 0.08 -4.60 1.36 5.19 -1.75 -3.47 116.42 116.46 3koo h ASP 148 Ca -0.38 -0.07 -0.16 0.00 -0.62 0.00 0.00 57.03 55.80 3koo h ASP 148 Cb 1.19 -0.03 -0.22 0.00 0.18 0.00 0.00 39.33 40.45 3koo h ASP 148 CO 0.56 0.92 -0.50 -0.36 -3.12 0.00 0.00 179.24 176.74 3koo s PHE 149 N -3.05 -0.03 -0.14 4.55 0.08 -1.17 -5.05 117.98 113.16 3koo s PHE 149 Ca -0.01 0.05 0.01 0.00 0.12 0.00 0.00 56.93 57.10 3koo s PHE 149 Cb 0.11 -0.01 0.02 0.00 -0.57 0.00 0.00 43.02 42.56 3koo s PHE 149 CO 0.81 -0.22 -0.15 -1.17 -0.10 0.00 0.00 175.22 174.38 3koo s LEU 150 N -0.92 1.74 -0.33 -0.37 2.96 -1.26 -1.68 118.68 118.83 3koo s LEU 150 Ca -0.10 -0.50 -0.06 0.00 -0.22 0.00 0.00 54.13 53.25 3koo s LEU 150 Cb -0.06 -1.20 0.03 0.00 0.50 0.00 0.00 46.19 45.47 3koo s LEU 150 CO 0.01 -0.03 0.09 -0.63 -1.32 0.00 0.00 176.35 174.47 3koo s ILE 151 N 1.37 3.77 -0.19 6.68 1.01 0.74 -4.98 121.20 129.59 3koo s ILE 151 Ca 0.03 -1.07 -0.07 0.00 0.00 0.00 0.00 60.65 59.54 3koo s ILE 151 Cb -0.13 -3.10 -0.04 0.00 0.01 0.00 0.00 42.46 39.20 3koo s ILE 151 CO -0.09 -0.13 0.05 -1.61 0.00 0.00 0.00 174.94 173.17 3koo s GLU 152 N 1.41 3.88 0.50 2.79 2.02 -1.26 -1.36 118.70 126.68 3koo s GLU 152 Ca -0.01 -0.39 0.23 0.00 0.02 0.00 0.00 54.97 54.82 3koo s GLU 152 Cb -0.19 -3.21 1.30 0.00 0.10 0.00 0.00 34.13 32.13 3koo s GLU 152 CO 0.02 0.17 1.96 0.66 0.02 0.00 0.00 175.26 178.09 3koo h SER 153 N 7.03 0.12 1.33 -0.19 4.64 -1.49 -1.83 113.55 123.15 3koo h SER 153 Ca -0.36 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3koo h SER 153 Cb 1.17 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3koo h SER 153 CO 0.67 0.06 0.00 0.00 -0.87 0.00 0.00 176.83 176.69 3koo n GLN 155 N -2.29 0.61 0.24 0.00 1.13 -0.71 -3.72 117.38 112.65 3koo n GLN 155 Ca 0.05 0.26 0.09 0.00 -1.94 0.00 0.00 57.00 55.46 3koo n GLN 155 Cb 0.39 -1.54 0.61 0.00 0.11 0.00 0.00 30.24 29.82 3koo n GLN 155 CO 0.00 0.00 0.00 -0.39 -1.44 0.00 0.00 177.06 175.23 3koo h VAL 156 N -0.69 0.82 0.00 5.09 -1.51 -1.58 -3.47 116.25 114.92 3koo h VAL 156 Ca -0.62 -0.66 0.00 0.00 -1.23 0.00 0.00 66.70 64.19 3koo h VAL 156 Cb 1.68 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 32.23 3koo h VAL 156 CO -0.29 0.17 0.00 0.61 -1.23 0.00 0.00 177.57 176.82 3koo n GLY 157 N -0.75 0.65 3.15 5.19 0.00 -0.76 -5.06 105.19 107.62 3koo n GLY 157 Ca -0.02 -0.21 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 3koo n GLY 157 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3koo s MET 158 N -0.63 0.88 0.06 1.61 -1.94 -1.13 -4.84 119.30 113.31 3koo s MET 158 Ca 0.00 -0.82 0.08 0.00 -1.71 0.00 0.00 55.69 53.24 3koo s MET 158 Cb 0.00 -0.89 -0.03 0.00 2.01 0.00 0.00 34.83 35.92 3koo s MET 158 CO 0.00 0.21 -0.23 0.54 -0.01 0.00 0.00 175.02 175.54 3koo s VAL 159 N -1.00 1.83 0.28 -6.03 0.11 -1.26 -4.33 120.40 110.00 3koo s VAL 159 Ca 0.00 -1.35 -0.29 0.00 -2.93 0.00 0.00 61.98 57.41 3koo s VAL 159 Cb -0.09 -1.60 -0.10 0.00 -1.53 0.00 0.00 36.38 33.07 3koo s VAL 159 CO 0.02 0.19 1.23 -0.54 -3.33 0.00 0.00 175.10 172.67 3koo s LYS 160 N -1.38 4.47 -0.75 1.54 1.02 -1.26 -0.13 119.74 123.25 3koo s LYS 160 Ca 0.09 2.02 -0.00 0.00 0.02 0.00 0.00 55.97 58.10 3koo s LYS 160 Cb -0.09 -3.15 0.37 0.00 -0.52 0.00 0.00 37.83 34.44 3koo s LYS 160 CO 0.03 -0.06 1.77 -0.35 -0.92 0.00 0.00 175.35 175.81 3koo n PRO 161 N 1.44 3.02 -2.32 -1.68 -0.04 -1.26 -5.01 135.00 129.14 3koo n PRO 161 Ca 0.01 -3.83 -0.42 0.00 -0.04 0.00 0.00 63.50 59.22 3koo n PRO 161 Cb 0.43 -2.27 -0.03 0.00 -0.04 0.00 0.00 33.50 31.59 3koo n PRO 161 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3koo s GLU 162 N -3.94 4.32 0.59 0.54 2.02 0.81 -4.91 118.70 118.13 3koo s GLU 162 Ca 0.51 1.84 0.39 0.00 0.02 0.00 0.00 54.97 57.73 3koo s GLU 162 Cb 0.42 -3.54 1.98 0.00 0.10 0.00 0.00 34.13 33.08 3koo s GLU 162 CO -0.35 -0.50 2.17 -1.35 0.02 0.00 0.00 175.26 175.25 3koo h PRO 163 N 7.60 0.00 -0.09 0.39 0.11 -1.97 -2.71 132.00 135.32 3koo h PRO 163 Ca -0.37 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 3koo h PRO 163 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 3koo h PRO 163 CO 0.89 0.00 0.02 -0.56 -0.21 0.00 0.00 178.00 178.13 3koo h GLN 164 N 0.00 0.15 -0.29 1.05 3.07 -1.93 -1.85 115.11 115.31 3koo h GLN 164 Ca 0.00 -0.04 0.08 0.00 0.09 0.00 0.00 58.65 58.79 3koo h GLN 164 Cb 0.15 -0.02 -0.01 0.00 0.08 0.00 0.00 27.48 27.68 3koo h GLN 164 CO 0.00 0.35 0.21 0.97 0.09 0.00 0.00 178.83 180.46 3koo h ILE 165 N -0.08 0.82 0.37 1.86 2.10 -1.79 0.83 117.51 121.61 3koo h ILE 165 Ca 0.03 0.00 -0.02 0.00 1.08 0.00 0.00 64.86 65.95 3koo h ILE 165 Cb 0.27 0.85 0.00 0.00 -1.09 0.00 0.00 36.82 36.86 3koo h ILE 165 CO 0.00 0.00 -0.18 1.88 -1.08 0.00 0.00 178.15 178.78 3koo h TYR 166 N 0.00 -0.46 -0.42 2.19 -1.99 -1.49 0.27 116.97 115.07 3koo h TYR 166 Ca 0.14 -0.01 0.09 0.00 2.00 0.00 0.00 58.73 60.94 3koo h TYR 166 Cb 0.57 0.15 -0.09 0.00 2.00 0.00 0.00 36.73 39.36 3koo h TYR 166 CO 0.00 -0.12 -0.17 0.87 -0.00 0.00 0.00 178.16 178.73 3koo h LYS 167 N -0.92 -0.08 -0.30 4.88 1.57 -0.76 0.52 116.57 121.47 3koo h LYS 167 Ca -0.05 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.77 3koo h LYS 167 Cb 0.54 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.81 3koo h LYS 167 CO 0.08 -0.06 -0.37 0.35 -0.57 0.00 0.00 179.45 178.89 3koo h PHE 168 N -0.09 -1.12 -0.73 -1.35 3.57 0.75 0.68 116.94 118.64 3koo h PHE 168 Ca 0.20 0.06 0.16 0.00 3.53 0.00 0.00 57.97 61.92 3koo h PHE 168 Cb 0.40 0.53 -0.12 0.00 2.79 0.00 0.00 35.95 39.56 3koo h PHE 168 CO -0.42 -0.31 0.12 1.25 -2.23 0.00 0.00 178.31 176.71 3koo h LEU 169 N -0.24 -0.10 0.02 0.59 6.46 0.30 0.25 115.31 122.59 3koo h LEU 169 Ca 0.05 0.16 0.03 0.00 -0.12 0.00 0.00 57.88 58.00 3koo h LEU 169 Cb 0.38 0.24 -0.04 0.00 -0.73 0.00 0.00 40.66 40.51 3koo h LEU 169 CO -0.41 -0.09 -0.24 0.25 -0.62 0.00 0.00 178.44 177.33 3koo h LEU 170 N 0.21 -0.72 -1.03 2.25 5.85 0.17 0.37 115.31 122.41 3koo h LEU 170 Ca 0.41 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 59.15 3koo h LEU 170 Cb 0.71 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 3koo h LEU 170 CO -0.55 -0.32 -0.16 0.44 -0.34 0.00 0.00 178.44 177.51 3koo h ASP 171 N -0.39 0.50 0.44 1.25 5.19 0.14 0.43 116.42 123.98 3koo h ASP 171 Ca 0.06 -0.14 -0.11 0.00 -0.62 0.00 0.00 57.03 56.21 3koo h ASP 171 Cb 0.46 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.83 3koo h ASP 171 CO -0.21 0.68 -0.51 0.00 -3.12 0.00 0.00 179.24 176.08 3koo h THR 172 N 0.47 1.36 -0.00 0.35 1.03 -0.20 -2.66 112.91 113.26 3koo h THR 172 Ca 0.08 -1.76 -0.09 0.00 -0.01 0.00 0.00 66.41 64.63 3koo h THR 172 Cb 0.55 1.91 -0.01 0.00 -1.07 0.00 0.00 68.15 69.52 3koo h THR 172 CO 0.03 0.51 -0.44 0.25 -0.01 0.00 0.00 175.52 175.87 3koo h LEU 173 N 0.07 0.00 -1.47 0.00 5.85 0.89 -3.47 115.31 117.18 3koo h LEU 173 Ca -0.00 -0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.37 3koo h LEU 173 Cb 0.93 -0.00 0.16 0.00 0.37 0.00 0.00 40.66 42.11 3koo h LEU 173 CO 0.07 0.44 -0.75 0.29 -0.34 0.00 0.00 178.44 178.15 3koo n LYS 174 N -4.02 -6.86 -4.15 1.25 5.02 0.03 -5.04 118.16 104.39 3koo n LYS 174 Ca -0.02 0.84 -0.09 0.00 -2.02 0.00 0.00 58.31 57.01 3koo n LYS 174 Cb 0.46 -5.85 -0.10 0.00 -0.02 0.00 0.00 35.03 29.52 3koo n LYS 174 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3koo s ALA 175 N -3.36 0.84 0.42 7.82 0.00 -1.15 -5.07 121.76 121.26 3koo s ALA 175 Ca 0.13 -1.35 -0.22 0.00 0.00 0.00 0.00 51.96 50.53 3koo s ALA 175 Cb -0.06 0.34 -0.11 0.00 0.00 0.00 0.00 23.12 23.30 3koo s ALA 175 CO 0.73 -0.33 0.95 -1.12 0.00 0.00 0.00 175.76 176.00 3koo s SER 176 N -3.01 6.98 0.29 0.00 0.01 -1.26 -4.73 113.70 111.97 3koo s SER 176 Ca 0.13 1.72 0.04 0.00 1.31 0.00 0.00 55.95 59.16 3koo s SER 176 Cb 0.07 -2.55 0.72 0.00 0.21 0.00 0.00 66.02 64.47 3koo s SER 176 CO -0.05 -0.33 1.73 -0.65 0.41 0.00 0.00 173.24 174.35 3koo h PRO 177 N 2.09 0.51 0.00 12.44 0.11 -1.93 0.34 132.00 145.57 3koo h PRO 177 Ca -0.49 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 3koo h PRO 177 Cb 1.18 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3koo h PRO 177 CO 0.62 0.34 -0.03 0.66 -0.21 0.00 0.00 178.00 179.37 3koo h SER 178 N 0.53 0.00 0.53 -2.05 4.64 -1.85 -1.88 113.55 113.47 3koo h SER 178 Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 3koo h SER 178 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 3koo h SER 178 CO -0.46 0.03 -0.11 -0.62 -0.87 0.00 0.00 176.83 174.80 3koo n GLU 179 N -3.32 0.44 -4.79 4.77 1.02 0.11 -4.82 120.64 114.04 3koo n GLU 179 Ca -0.02 -0.12 -0.33 0.00 -0.02 0.00 0.00 57.16 56.67 3koo n GLU 179 Cb 0.17 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.96 3koo n GLU 179 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3koo s VAL 180 N -2.64 3.15 0.07 2.62 1.01 -0.71 -0.83 120.40 123.07 3koo s VAL 180 Ca 0.24 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 3koo s VAL 180 Cb 0.20 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 3koo s VAL 180 CO 0.50 0.56 0.25 -0.69 0.00 0.00 0.00 175.10 175.72 3koo s VAL 181 N -0.18 5.33 -0.25 2.92 1.01 0.59 -1.08 120.40 128.75 3koo s VAL 181 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 3koo s VAL 181 Cb -0.13 -3.61 0.13 0.00 0.00 0.00 0.00 36.38 32.76 3koo s VAL 181 CO 0.03 0.16 0.32 0.12 0.00 0.00 0.00 175.10 175.73 3koo s PHE 182 N -1.50 -0.60 -0.01 5.22 2.19 -0.66 -1.04 117.98 121.59 3koo s PHE 182 Ca 0.35 0.37 -0.07 0.00 0.33 0.00 0.00 56.93 57.91 3koo s PHE 182 Cb -0.13 -0.22 -0.05 0.00 -1.31 0.00 0.00 43.02 41.31 3koo s PHE 182 CO 0.25 -0.76 0.26 -0.51 1.83 0.00 0.00 175.22 176.29 3koo s LEU 183 N 2.44 4.38 -0.14 6.12 1.43 -0.95 -0.92 118.68 131.03 3koo s LEU 183 Ca 0.10 0.57 -0.29 0.00 -1.03 0.00 0.00 54.13 53.48 3koo s LEU 183 Cb -0.15 -2.60 0.09 0.00 0.03 0.00 0.00 46.19 43.56 3koo s LEU 183 CO -0.20 0.27 0.79 -0.62 0.23 0.00 0.00 176.35 176.82 3koo s ASP 184 N -1.59 -0.60 0.23 2.29 -1.08 -0.82 -3.13 116.67 111.97 3koo s ASP 184 Ca 0.26 0.82 0.24 0.00 -0.52 0.00 0.00 52.55 53.35 3koo s ASP 184 Cb -0.13 0.72 0.38 0.00 -1.46 0.00 0.00 42.92 42.43 3koo s ASP 184 CO 0.15 -0.43 1.43 -2.24 0.52 0.00 0.00 175.17 174.60 3koo h ASP 185 N 3.45 0.00 -3.39 -0.34 2.03 -1.85 -2.80 116.42 113.53 3koo h ASP 185 Ca -0.26 -0.07 -0.71 0.00 -0.73 0.00 0.00 57.03 55.25 3koo h ASP 185 Cb 1.15 0.00 -0.30 0.00 -0.83 0.00 0.00 39.33 39.35 3koo h ASP 185 CO 0.27 0.04 -0.45 -0.63 -1.03 0.00 0.00 179.24 177.43 3koo s ILE 186 N -3.20 3.96 0.22 4.15 1.01 -1.26 -4.78 121.20 121.31 3koo s ILE 186 Ca 0.06 -1.75 -0.15 0.00 0.00 0.00 0.00 60.65 58.82 3koo s ILE 186 Cb 0.11 -3.58 0.25 0.00 0.01 0.00 0.00 42.46 39.25 3koo s ILE 186 CO 0.69 -0.67 1.59 1.23 0.00 0.00 0.00 174.94 177.79 3koo h GLY 187 N 8.33 0.33 -1.00 6.18 0.00 -1.98 0.16 103.07 115.10 3koo h GLY 187 Ca -0.20 0.32 0.26 0.00 0.00 0.00 0.00 47.33 47.71 3koo h GLY 187 CO 0.79 -0.26 -0.05 0.00 0.00 0.00 0.00 176.54 177.02 3koo n ALA 188 N -3.24 0.44 0.25 3.60 0.00 -1.26 0.42 120.51 120.71 3koo n ALA 188 Ca 0.09 1.08 0.13 0.00 0.00 0.00 0.00 53.44 54.74 3koo n ALA 188 Cb 0.38 -0.75 0.54 0.00 0.00 0.00 0.00 19.45 19.62 3koo n ALA 188 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3koo h ASN 189 N 0.00 0.00 -0.05 0.00 2.35 -1.07 -3.01 115.58 113.80 3koo h ASN 189 Ca 0.57 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 56.14 3koo h ASN 189 Cb 1.11 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.48 3koo h ASN 189 CO -0.96 0.11 -0.62 -0.07 -1.65 0.00 0.00 177.43 174.24 3koo h LEU 190 N 0.00 0.75 -0.56 1.61 4.07 0.13 -3.37 115.31 117.94 3koo h LEU 190 Ca -0.00 -0.43 0.11 0.00 0.08 0.00 0.00 57.88 57.64 3koo h LEU 190 Cb 0.66 -0.22 -0.09 0.00 1.08 0.00 0.00 40.66 42.09 3koo h LEU 190 CO 0.01 1.19 0.04 0.50 -1.08 0.00 0.00 178.44 179.10 3koo h LYS 191 N 0.49 0.15 -0.30 1.13 1.63 -1.31 0.34 116.57 118.70 3koo h LYS 191 Ca -0.01 -0.01 -0.11 0.00 -0.85 0.00 0.00 60.65 59.68 3koo h LYS 191 Cb 1.20 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.78 3koo h LYS 191 CO 0.12 0.10 -0.26 -1.35 -3.45 0.00 0.00 179.45 174.61 3koo h PRO 192 N 0.16 0.60 0.21 1.90 0.11 -1.73 0.23 132.00 133.47 3koo h PRO 192 Ca 0.29 -0.24 -0.01 0.00 0.11 0.00 0.00 66.00 66.15 3koo h PRO 192 Cb 0.45 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.54 3koo h PRO 192 CO -0.45 0.80 -0.10 0.00 -0.21 0.00 0.00 178.00 178.05 3koo h ALA 193 N 1.20 -0.28 -0.71 -0.75 0.00 -1.55 -2.69 119.26 114.48 3koo h ALA 193 Ca 0.07 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.85 3koo h ALA 193 Cb 0.72 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.52 3koo h ALA 193 CO 0.06 -0.43 -0.55 -0.09 0.00 0.00 0.00 179.25 178.23 3koo h ARG 194 N -0.73 -0.18 0.00 0.00 2.43 -0.12 -0.66 114.38 115.13 3koo h ARG 194 Ca -0.03 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3koo h ARG 194 Cb 0.50 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3koo h ARG 194 CO 0.05 -0.12 0.00 -0.25 -1.51 0.00 0.00 179.97 178.14 3koo n ASP 195 N -5.33 0.00 -0.14 -3.80 9.92 0.77 0.83 116.55 118.80 3koo n ASP 195 Ca 0.00 -0.32 0.11 0.00 -0.53 0.00 0.00 54.79 54.05 3koo n ASP 195 Cb 0.31 -0.15 0.01 0.00 -0.64 0.00 0.00 41.12 40.65 3koo n ASP 195 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 3koo n LEU 196 N -1.15 1.18 0.00 0.64 7.94 -0.34 -4.98 117.00 120.29 3koo n LEU 196 Ca 0.12 -0.47 0.00 0.00 -1.11 0.00 0.00 56.01 54.56 3koo n LEU 196 Cb 0.12 -0.05 0.00 0.00 0.53 0.00 0.00 43.42 44.02 3koo n LEU 196 CO 0.13 0.26 0.00 0.61 -1.11 0.00 0.00 177.39 177.28 3koo n GLY 197 N 1.47 1.76 3.83 -3.96 0.00 0.24 -4.67 105.19 103.87 3koo n GLY 197 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 3koo n GLY 197 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3koo s MET 198 N -0.38 3.22 0.50 1.61 0.23 -1.02 -4.29 119.30 119.17 3koo s MET 198 Ca 0.00 0.95 -0.22 0.00 -1.03 0.00 0.00 55.69 55.39 3koo s MET 198 Cb 0.00 -2.03 -0.06 0.00 -1.53 0.00 0.00 34.83 31.21 3koo s MET 198 CO 0.00 -0.88 1.23 0.08 -2.03 0.00 0.00 175.02 173.42 3koo s VAL 199 N -2.94 2.74 -0.03 5.16 1.01 -0.24 -4.03 120.40 122.08 3koo s VAL 199 Ca 0.58 0.55 0.02 0.00 0.00 0.00 0.00 61.98 63.13 3koo s VAL 199 Cb -0.13 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 32.98 3koo s VAL 199 CO 0.50 -0.02 -0.07 0.42 0.00 0.00 0.00 175.10 175.94 3koo s THR 200 N -1.48 0.63 -0.10 3.92 -4.23 -1.26 -1.65 115.64 111.47 3koo s THR 200 Ca 0.67 -0.24 0.04 0.00 -1.18 0.00 0.00 61.69 60.97 3koo s THR 200 Cb -0.32 -0.59 -0.00 0.00 1.34 0.00 0.00 72.50 72.92 3koo s THR 200 CO 0.39 0.22 -0.23 -0.63 -0.54 0.00 0.00 174.62 173.82 3koo s ILE 201 N 0.44 2.15 -0.20 2.99 1.01 -0.10 -4.94 121.20 122.55 3koo s ILE 201 Ca -0.06 -0.99 -0.20 0.00 0.00 0.00 0.00 60.65 59.41 3koo s ILE 201 Cb -0.10 -1.83 -0.03 0.00 0.01 0.00 0.00 42.46 40.51 3koo s ILE 201 CO 0.00 0.56 0.57 -0.22 0.00 0.00 0.00 174.94 175.85 3koo s LEU 202 N 0.36 4.15 -0.16 2.97 0.20 -1.26 -1.94 118.68 122.99 3koo s LEU 202 Ca -0.18 0.76 -0.06 0.00 0.69 0.00 0.00 54.13 55.34 3koo s LEU 202 Cb -0.18 -2.80 -0.04 0.00 -0.43 0.00 0.00 46.19 42.75 3koo s LEU 202 CO 0.08 -0.22 0.04 -0.69 -0.29 0.00 0.00 176.35 175.27 3koo s VAL 203 N 1.74 4.58 0.00 1.68 1.01 -1.06 -4.65 120.40 123.71 3koo s VAL 203 Ca 0.26 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.13 3koo s VAL 203 Cb -0.16 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.20 3koo s VAL 203 CO 0.10 0.50 0.00 0.00 0.00 0.00 0.00 175.10 175.70 3koo n GLN 204 N 3.21 0.00 -2.15 2.72 6.02 -1.26 -4.57 117.38 121.36 3koo n GLN 204 Ca -0.17 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.42 3koo n GLN 204 Cb 0.53 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.77 3koo n GLN 204 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 3koo s ASP 205 N 1.00 6.57 0.29 1.08 -4.77 -1.26 -4.90 116.67 114.68 3koo s ASP 205 Ca 0.00 2.59 0.14 0.00 -3.30 0.00 0.00 52.55 51.98 3koo s ASP 205 Cb 0.00 -2.64 0.34 0.00 -1.09 0.00 0.00 42.92 39.53 3koo s ASP 205 CO 0.00 -0.66 1.57 0.74 0.70 0.00 0.00 175.17 177.52 3koo h THR 206 N 2.68 1.16 -0.39 2.11 2.02 -1.97 -3.13 112.91 115.38 3koo h THR 206 Ca -0.49 -2.12 -0.05 0.00 0.77 0.00 0.00 66.41 64.53 3koo h THR 206 Cb 1.23 2.23 -0.01 0.00 -1.74 0.00 0.00 68.15 69.86 3koo h THR 206 CO 0.64 0.55 0.05 0.44 0.37 0.00 0.00 175.52 177.57 3koo h ASP 207 N 0.00 0.63 -0.28 4.18 3.32 -1.99 0.19 116.42 122.46 3koo h ASP 207 Ca -0.01 -0.27 -0.19 0.00 0.02 0.00 0.00 57.03 56.59 3koo h ASP 207 Cb 1.18 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.57 3koo h ASP 207 CO 0.07 0.74 -0.55 0.74 -1.72 0.00 0.00 179.24 178.53 3koo h THR 208 N 0.49 1.27 -0.73 0.35 2.02 -1.97 -0.64 112.91 113.71 3koo h THR 208 Ca 0.12 -1.73 0.07 0.00 0.77 0.00 0.00 66.41 65.64 3koo h THR 208 Cb 0.39 1.62 -0.05 0.00 -1.74 0.00 0.00 68.15 68.37 3koo h THR 208 CO 0.01 0.57 0.48 0.00 0.37 0.00 0.00 175.52 176.94 3koo h ALA 209 N 0.69 1.73 0.12 6.16 0.00 -1.45 -0.46 119.26 126.05 3koo h ALA 209 Ca 0.02 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.63 3koo h ALA 209 Cb 1.16 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3koo h ALA 209 CO 0.12 0.15 -1.30 -0.07 0.00 0.00 0.00 179.25 178.15 3koo h LEU 210 N 0.74 0.40 -0.45 0.00 3.38 -0.85 -2.58 115.31 115.95 3koo h LEU 210 Ca 0.32 -0.46 0.04 0.00 0.09 0.00 0.00 57.88 57.88 3koo h LEU 210 Cb 0.30 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 3koo h LEU 210 CO -0.11 1.36 0.21 0.11 0.09 0.00 0.00 178.44 180.10 3koo h LYS 211 N 0.07 0.41 -0.80 1.13 1.57 -0.38 0.10 116.57 118.66 3koo h LYS 211 Ca -0.16 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 3koo h LYS 211 Cb 1.98 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 34.16 3koo h LYS 211 CO 0.19 0.27 0.47 0.93 -0.57 0.00 0.00 179.45 180.74 3koo h GLU 212 N 0.42 1.10 -0.21 3.15 5.08 -1.15 -0.85 114.58 122.12 3koo h GLU 212 Ca 0.20 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 3koo h GLU 212 Cb 0.14 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3koo h GLU 212 CO -0.16 0.79 0.04 1.25 -1.00 0.00 0.00 179.01 179.93 3koo h LEU 213 N 1.11 0.34 -0.93 1.33 6.46 -0.93 -2.16 115.31 120.52 3koo h LEU 213 Ca 0.29 -0.26 -0.11 0.00 -0.12 0.00 0.00 57.88 57.68 3koo h LEU 213 Cb -0.01 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 39.82 3koo h LEU 213 CO -0.05 0.51 -0.40 1.05 -0.62 0.00 0.00 178.44 178.93 3koo h GLU 214 N 0.16 0.28 -0.30 1.25 4.11 -0.78 -0.44 114.58 118.85 3koo h GLU 214 Ca 0.07 -0.13 0.06 0.00 0.07 0.00 0.00 59.36 59.42 3koo h GLU 214 Cb 0.32 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.51 3koo h GLU 214 CO 0.00 0.63 -0.03 -0.22 0.07 0.00 0.00 179.01 179.47 3koo h LYS 215 N 0.23 0.05 -0.00 1.06 1.63 -0.94 -0.37 116.57 118.23 3koo h LYS 215 Ca 0.02 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 3koo h LYS 215 Cb 0.81 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.43 3koo h LYS 215 CO 0.06 0.03 -0.47 1.55 -3.45 0.00 0.00 179.45 177.17 3koo n VAL 216 N -5.20 0.00 -0.06 2.00 3.14 -0.83 -3.94 118.33 113.44 3koo n VAL 216 Ca -0.00 -0.06 -0.09 0.00 -2.96 0.00 0.00 64.34 61.24 3koo n VAL 216 Cb 0.16 0.43 -0.15 0.00 -1.06 0.00 0.00 33.84 33.23 3koo n VAL 216 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 3koo n THR 217 N -1.14 1.48 -2.29 1.55 -2.24 -0.21 -4.98 114.28 106.44 3koo n THR 217 Ca 0.08 -0.82 -0.06 0.00 -2.27 0.00 0.00 64.05 60.98 3koo n THR 217 Cb 0.35 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 3koo n THR 217 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3koo n GLY 218 N 1.63 0.24 2.81 3.38 0.00 -0.16 -5.03 105.19 108.06 3koo n GLY 218 Ca -0.24 -0.58 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 3koo n GLY 218 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3koo s ILE 219 N -2.50 -0.20 0.06 -0.61 1.01 -1.21 -5.09 121.20 112.66 3koo s ILE 219 Ca 0.04 0.35 -0.31 0.00 0.00 0.00 0.00 60.65 60.73 3koo s ILE 219 Cb -0.02 -0.25 -0.07 0.00 0.01 0.00 0.00 42.46 42.13 3koo s ILE 219 CO 0.05 0.15 1.41 -1.58 0.00 0.00 0.00 174.94 174.97 3koo s GLN 220 N 2.10 4.30 0.00 2.79 0.74 -1.26 -4.41 119.66 123.91 3koo s GLN 220 Ca 0.02 2.04 0.00 0.00 0.05 0.00 0.00 55.36 57.47 3koo s GLN 220 Cb -0.12 -3.41 0.00 0.00 1.10 0.00 0.00 33.01 30.58 3koo s GLN 220 CO -0.05 -0.51 0.00 1.28 -0.55 0.00 0.00 175.29 175.46 3koo n LEU 221 N 4.65 2.11 -4.76 3.68 4.77 -1.26 -4.89 117.00 121.29 3koo n LEU 221 Ca 0.12 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.70 3koo n LEU 221 Cb 0.43 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 3koo n LEU 221 CO 0.59 0.35 0.92 -0.22 -1.33 0.00 0.00 177.39 177.70 3koo s LEU 222 N -4.58 4.46 -1.78 2.23 2.96 -1.26 -3.62 118.68 117.10 3koo s LEU 222 Ca 0.00 2.48 -0.21 0.00 -0.22 0.00 0.00 54.13 56.18 3koo s LEU 222 Cb 0.00 -3.63 0.20 0.00 0.50 0.00 0.00 46.19 43.26 3koo s LEU 222 CO 0.00 -0.41 0.70 -0.46 -1.32 0.00 0.00 176.35 174.85 3koo n ASN 223 N 1.43 -2.63 -4.87 3.68 2.04 -1.26 -4.93 115.26 108.72 3koo n ASN 223 Ca 0.01 -1.11 -0.31 0.00 -0.44 0.00 0.00 54.58 52.74 3koo n ASN 223 Cb 0.43 -2.20 -0.03 0.00 -2.53 0.00 0.00 39.78 35.45 3koo n ASN 223 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 3koo s THR 224 N -3.25 4.71 1.12 5.53 -1.32 -1.24 -5.02 115.64 116.17 3koo s THR 224 Ca 0.79 0.78 -0.18 0.00 -1.21 0.00 0.00 61.69 61.87 3koo s THR 224 Cb -0.44 -3.75 0.12 0.00 -1.51 0.00 0.00 72.50 66.92 3koo s THR 224 CO 0.97 -0.64 0.14 -2.65 -2.21 0.00 0.00 174.62 170.23 3koo n PRO 225 N -1.55 -1.61 -1.55 7.08 -0.02 -1.26 -4.78 135.00 131.32 3koo n PRO 225 Ca 0.04 -0.45 -0.37 0.00 -2.02 0.00 0.00 63.50 60.70 3koo n PRO 225 Cb 0.54 -1.76 -0.04 0.00 -0.02 0.00 0.00 33.50 32.22 3koo n PRO 225 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3koo n ALA 226 N -4.43 0.79 -1.77 3.55 0.00 -1.26 -4.96 120.51 112.42 3koo n ALA 226 Ca 0.01 -0.83 -0.37 0.00 0.00 0.00 0.00 53.44 52.25 3koo n ALA 226 Cb 0.61 -3.10 -0.02 0.00 0.00 0.00 0.00 19.45 16.94 3koo n ALA 226 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3koo s PRO 227 N 8.23 4.02 0.90 0.00 0.02 -1.26 -5.01 135.00 141.89 3koo s PRO 227 Ca 1.02 1.71 -0.10 0.00 0.02 0.00 0.00 61.00 63.65 3koo s PRO 227 Cb -0.30 -2.56 0.13 0.00 0.02 0.00 0.00 34.50 31.79 3koo s PRO 227 CO 0.29 -0.31 1.15 -0.51 -0.33 0.00 0.00 177.00 177.29 3koo s LEU 228 N -2.67 2.89 0.70 -5.54 1.43 -1.26 -4.98 118.68 109.25 3koo s LEU 228 Ca 0.59 2.19 -0.15 0.00 -1.03 0.00 0.00 54.13 55.72 3koo s LEU 228 Cb -0.27 -4.57 0.02 0.00 0.03 0.00 0.00 46.19 41.41 3koo s LEU 228 CO 0.34 -3.01 1.18 -2.84 0.23 0.00 0.00 176.35 172.25 3koo s PRO 229 N -4.62 2.36 0.23 1.29 0.02 -1.26 -4.94 135.00 128.08 3koo s PRO 229 Ca 0.67 1.66 -0.32 0.00 0.02 0.00 0.00 61.00 63.04 3koo s PRO 229 Cb -0.23 -1.87 -0.12 0.00 0.02 0.00 0.00 34.50 32.30 3koo s PRO 229 CO 0.57 -1.64 1.60 2.41 -0.33 0.00 0.00 177.00 179.60 3koo n THR 230 N -2.58 0.51 -1.63 0.99 -1.04 -1.26 -4.92 114.28 104.35 3koo n THR 230 Ca 0.13 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3koo n THR 230 Cb 0.51 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.22 3koo n THR 230 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 3koo n SER 231 N 2.94 0.00 -3.89 8.00 2.88 -1.26 -4.51 113.62 117.77 3koo n SER 231 Ca 0.13 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.48 3koo n SER 231 Cb 0.34 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.63 3koo n SER 231 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3koo s ASN 233 N 0.82 6.04 0.27 0.00 3.04 -1.26 -4.97 114.94 118.88 3koo s ASN 233 Ca -0.11 -1.51 0.18 0.00 0.04 0.00 0.00 52.86 51.46 3koo s ASN 233 Cb -0.14 -2.15 0.94 0.00 -1.54 0.00 0.00 41.25 38.37 3koo s ASN 233 CO 0.00 -0.69 1.03 -2.65 -3.04 0.00 0.00 177.10 171.76 3koo n PRO 234 N 5.15 -0.03 0.18 0.43 -0.02 -1.26 -0.32 135.00 139.13 3koo n PRO 234 Ca -0.12 0.86 -0.14 0.00 -2.02 0.00 0.00 63.50 62.07 3koo n PRO 234 Cb 0.42 -1.62 -0.08 0.00 -0.02 0.00 0.00 33.50 32.20 3koo n PRO 234 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3koo h SER 235 N 0.00 -0.38 0.00 2.55 0.02 -2.04 -2.97 113.55 110.72 3koo h SER 235 Ca 0.57 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 3koo h SER 235 Cb 1.70 0.10 0.00 0.00 0.14 0.00 0.00 62.40 64.34 3koo h SER 235 CO -0.39 -0.10 0.00 0.47 -1.14 0.00 0.00 176.83 175.67 3koo n ASP 236 N -5.20 0.00 -4.98 3.07 8.00 0.56 -4.83 116.55 113.17 3koo n ASP 236 Ca -0.10 -0.63 -0.20 0.00 0.71 0.00 0.00 54.79 54.57 3koo n ASP 236 Cb 0.25 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.38 3koo n ASP 236 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3koo s MET 237 N -2.00 2.63 -0.22 -1.24 -1.94 -1.12 -4.97 119.30 110.44 3koo s MET 237 Ca 0.02 -0.94 -0.07 0.00 -1.71 0.00 0.00 55.69 53.00 3koo s MET 237 Cb 0.01 -2.58 -0.03 0.00 2.01 0.00 0.00 34.83 34.24 3koo s MET 237 CO 0.01 -0.57 0.05 0.45 -0.01 0.00 0.00 175.02 174.95 3koo s SER 238 N -4.40 5.19 -0.16 3.03 0.15 -1.26 -5.07 113.70 111.17 3koo s SER 238 Ca 0.57 -0.13 -0.01 0.00 0.70 0.00 0.00 55.95 57.08 3koo s SER 238 Cb -0.10 -1.91 -0.01 0.00 -1.71 0.00 0.00 66.02 62.29 3koo s SER 238 CO 0.37 0.04 -0.12 -1.00 1.20 0.00 0.00 173.24 173.73 3koo s HIS 239 N 1.14 2.84 0.05 3.44 3.76 -1.26 -2.15 115.29 123.11 3koo s HIS 239 Ca 0.04 -0.87 0.04 0.00 -0.15 0.00 0.00 55.06 54.11 3koo s HIS 239 Cb -0.14 -1.92 -0.04 0.00 1.11 0.00 0.00 32.58 31.58 3koo s HIS 239 CO 0.03 -0.39 -0.03 0.20 -0.85 0.00 0.00 174.74 173.70 3koo s GLY 240 N 0.80 1.86 -0.04 -2.22 0.00 0.12 -4.94 107.32 102.89 3koo s GLY 240 Ca -0.04 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.62 3koo s GLY 240 CO 0.01 -0.98 -0.02 -0.19 0.00 0.00 0.00 173.10 171.92 3koo s TYR 241 N -1.17 0.58 -0.04 1.90 1.51 -1.26 -0.58 117.35 118.29 3koo s TYR 241 Ca 0.22 -0.12 0.00 0.00 -1.01 0.00 0.00 57.07 56.15 3koo s TYR 241 Cb -0.11 -0.61 0.03 0.00 -0.11 0.00 0.00 41.96 41.16 3koo s TYR 241 CO 0.13 -0.20 -0.00 0.08 -1.11 0.00 0.00 175.55 174.45 3koo s VAL 242 N 1.18 0.23 -0.14 0.71 1.01 -0.64 -4.99 120.40 117.76 3koo s VAL 242 Ca -0.07 0.09 -0.25 0.00 0.00 0.00 0.00 61.98 61.75 3koo s VAL 242 Cb -0.14 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.89 3koo s VAL 242 CO -0.02 0.17 0.79 -0.89 0.00 0.00 0.00 175.10 175.16 3koo s THR 243 N 1.21 4.93 -0.19 3.92 2.01 -1.26 -0.35 115.64 125.91 3koo s THR 243 Ca -0.07 1.57 0.19 0.00 0.31 0.00 0.00 61.69 63.70 3koo s THR 243 Cb -0.13 -4.11 -0.28 0.00 0.01 0.00 0.00 72.50 67.99 3koo s THR 243 CO -0.02 0.10 0.49 1.33 -0.69 0.00 0.00 174.62 175.83 3koo n VAL 244 N 4.45 0.00 -3.95 3.82 0.24 -0.34 -4.97 118.33 117.58 3koo n VAL 244 Ca 0.03 -0.37 -0.10 0.00 -2.04 0.00 0.00 64.34 61.86 3koo n VAL 244 Cb 0.50 0.24 -0.03 0.00 -1.47 0.00 0.00 33.84 33.08 3koo n VAL 244 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3koo s LYS 245 N -3.23 1.84 0.12 7.34 1.02 -1.16 -4.99 119.74 120.68 3koo s LYS 245 Ca -0.04 -1.36 -0.14 0.00 0.02 0.00 0.00 55.97 54.44 3koo s LYS 245 Cb 0.13 0.53 -0.05 0.00 -0.52 0.00 0.00 37.83 37.92 3koo s LYS 245 CO 0.79 -0.80 1.50 -1.35 -0.92 0.00 0.00 175.35 174.57 3koo h PRO 246 N 2.12 0.74 -0.50 -1.68 0.11 -2.04 -2.89 132.00 127.86 3koo h PRO 246 Ca -0.27 -0.31 -0.27 0.00 0.11 0.00 0.00 66.00 65.27 3koo h PRO 246 Cb 1.25 -0.03 -0.16 0.00 0.11 0.00 0.00 31.00 32.17 3koo h PRO 246 CO 0.35 0.92 0.06 0.54 -0.21 0.00 0.00 178.00 179.66 3koo n ARG 247 N -4.33 1.96 -3.57 1.05 5.12 -1.26 -4.87 116.66 110.76 3koo n ARG 247 Ca -0.02 -3.19 -0.29 0.00 -1.93 0.00 0.00 57.85 52.42 3koo n ARG 247 Cb 0.39 -1.91 -0.15 0.00 -1.16 0.00 0.00 32.46 29.63 3koo n ARG 247 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3koo s VAL 248 N -3.32 0.16 -0.11 1.55 1.01 -1.09 -4.82 120.40 113.78 3koo s VAL 248 Ca 0.48 -1.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.30 3koo s VAL 248 Cb 0.42 -1.15 -0.05 0.00 0.00 0.00 0.00 36.38 35.61 3koo s VAL 248 CO 0.02 -0.75 0.38 -0.60 0.00 0.00 0.00 175.10 174.15 3koo s ARG 249 N 1.88 4.18 -0.17 2.72 3.52 -1.26 -1.19 118.95 128.63 3koo s ARG 249 Ca 0.10 0.29 -0.07 0.00 -0.13 0.00 0.00 55.73 55.92 3koo s ARG 249 Cb -0.17 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.80 3koo s ARG 249 CO -0.30 0.33 0.07 -0.51 -0.81 0.00 0.00 175.30 174.08 3koo s LEU 250 N 0.11 3.90 0.03 -0.88 1.43 0.53 -0.70 118.68 123.09 3koo s LEU 250 Ca 0.22 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.48 3koo s LEU 250 Cb -0.15 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 3koo s LEU 250 CO 0.08 0.23 0.03 -2.28 0.23 0.00 0.00 176.35 174.64 3koo s HIS 251 N 0.06 3.13 0.34 0.29 5.65 -1.26 -1.62 115.29 121.88 3koo s HIS 251 Ca 0.06 0.09 -0.11 0.00 0.25 0.00 0.00 55.06 55.35 3koo s HIS 251 Cb -0.12 -1.66 0.02 0.00 -1.18 0.00 0.00 32.58 29.65 3koo s HIS 251 CO 0.01 0.50 0.62 -0.59 -0.65 0.00 0.00 174.74 174.62 3koo s PHE 252 N -1.20 0.45 -0.13 3.88 -0.71 0.25 -0.60 117.98 119.93 3koo s PHE 252 Ca 0.23 -0.90 0.02 0.00 -1.04 0.00 0.00 56.93 55.24 3koo s PHE 252 Cb -0.12 0.40 0.01 0.00 -1.21 0.00 0.00 43.02 42.11 3koo s PHE 252 CO 0.14 -1.29 -0.19 0.08 -1.34 0.00 0.00 175.22 172.62 3koo s VAL 253 N -3.02 1.86 -0.11 -2.49 1.01 -0.61 0.13 120.40 117.18 3koo s VAL 253 Ca 0.21 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 3koo s VAL 253 Cb -0.03 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 3koo s VAL 253 CO 0.14 0.51 0.04 -0.70 0.00 0.00 0.00 175.10 175.09 3koo s GLU 254 N 0.95 3.25 -0.28 2.72 2.12 -0.91 -1.49 118.70 125.04 3koo s GLU 254 Ca -0.05 -0.34 -0.22 0.00 0.36 0.00 0.00 54.97 54.72 3koo s GLU 254 Cb -0.15 -2.95 0.13 0.00 0.26 0.00 0.00 34.13 31.42 3koo s GLU 254 CO -0.03 0.64 1.01 -1.17 -0.54 0.00 0.00 175.26 175.17 3koo s LEU 255 N -0.70 -0.48 0.00 2.70 2.96 -0.72 -4.26 118.68 118.18 3koo s LEU 255 Ca 0.12 0.87 0.00 0.00 -0.22 0.00 0.00 54.13 54.90 3koo s LEU 255 Cb -0.12 1.86 0.00 0.00 0.50 0.00 0.00 46.19 48.43 3koo s LEU 255 CO 0.02 -0.15 0.00 0.61 -1.32 0.00 0.00 176.35 175.52 3koo n GLY 256 N 2.67 -0.68 3.00 7.98 0.00 -1.26 -0.11 105.19 116.78 3koo n GLY 256 Ca -0.14 -1.73 -0.09 0.00 0.00 0.00 0.00 46.02 44.06 3koo n GLY 256 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3koo s SER 257 N -2.04 0.20 0.00 1.61 1.04 -1.13 -4.52 113.70 108.87 3koo s SER 257 Ca 0.00 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.98 3koo s SER 257 Cb 0.00 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.24 3koo s SER 257 CO 0.00 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.52 3koo n GLY 258 N 1.58 0.74 3.76 7.32 0.00 -1.26 -3.06 105.19 114.27 3koo n GLY 258 Ca -0.24 -1.79 -0.35 0.00 0.00 0.00 0.00 46.02 43.64 3koo n GLY 258 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3koo s PRO 259 N -1.61 2.98 -0.10 1.61 0.02 -1.26 -4.32 135.00 132.32 3koo s PRO 259 Ca 0.00 1.67 -0.29 0.00 0.02 0.00 0.00 61.00 62.40 3koo s PRO 259 Cb 0.00 -1.95 -0.01 0.00 0.02 0.00 0.00 34.50 32.56 3koo s PRO 259 CO 0.00 -1.16 0.99 0.00 -0.33 0.00 0.00 177.00 176.50 3koo s ALA 260 N -1.82 3.40 -0.20 -1.55 0.00 -1.26 -1.22 121.76 119.11 3koo s ALA 260 Ca 0.74 0.36 -0.03 0.00 0.00 0.00 0.00 51.96 53.02 3koo s ALA 260 Cb -0.26 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.43 3koo s ALA 260 CO 0.34 -0.58 -0.05 0.08 0.00 0.00 0.00 175.76 175.54 3koo s VAL 261 N 1.95 3.44 -0.23 0.00 1.01 0.46 -0.71 120.40 126.33 3koo s VAL 261 Ca 0.48 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.95 3koo s VAL 261 Cb -0.18 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.67 3koo s VAL 261 CO 0.18 0.44 -0.07 0.00 0.00 0.00 0.00 175.10 175.65 3koo s LEU 263 N 1.38 3.90 -0.32 0.00 1.43 -0.94 -1.01 118.68 123.12 3koo s LEU 263 Ca 0.03 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 3koo s LEU 263 Cb -0.15 -2.07 0.08 0.00 0.03 0.00 0.00 46.19 44.08 3koo s LEU 263 CO -0.05 -0.03 0.02 0.00 0.23 0.00 0.00 176.35 176.51 3koo n HIS 265 N 4.41 -3.66 -1.95 0.00 1.44 -1.26 -1.00 115.22 113.20 3koo n HIS 265 Ca -0.05 -0.17 0.00 0.00 -2.01 0.00 0.00 57.72 55.49 3koo n HIS 265 Cb 0.42 -0.17 0.00 0.00 0.12 0.00 0.00 29.99 30.36 3koo n HIS 265 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3koo n GLY 266 N 2.72 5.15 3.33 -1.39 0.00 -1.11 -2.07 105.19 111.81 3koo n GLY 266 Ca 0.03 -1.64 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 3koo n GLY 266 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3koo s PHE 267 N 1.80 2.77 -0.39 1.61 2.19 -1.26 -2.77 117.98 121.93 3koo s PHE 267 Ca 0.00 -0.76 -0.05 0.00 0.33 0.00 0.00 56.93 56.46 3koo s PHE 267 Cb 0.00 -1.83 0.09 0.00 -1.31 0.00 0.00 43.02 39.97 3koo s PHE 267 CO 0.00 -0.28 0.17 -1.25 1.83 0.00 0.00 175.22 175.70 3koo s PRO 268 N 0.40 2.28 0.00 10.12 0.04 -1.26 -4.95 135.00 141.63 3koo s PRO 268 Ca -0.12 -1.58 0.00 0.00 0.04 0.00 0.00 61.00 59.34 3koo s PRO 268 Cb -0.16 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.83 3koo s PRO 268 CO 0.06 -0.93 0.00 0.39 0.04 0.00 0.00 177.00 176.55 3koo n GLU 269 N 4.70 1.97 -3.62 4.56 1.02 -1.11 -5.09 120.64 123.06 3koo n GLU 269 Ca -0.07 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.08 3koo n GLU 269 Cb 0.42 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.84 3koo n GLU 269 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3koo s SER 270 N 1.00 -0.06 0.52 1.62 1.04 -1.26 -4.89 113.70 111.67 3koo s SER 270 Ca 0.00 -0.13 0.39 0.00 0.48 0.00 0.00 55.95 56.69 3koo s SER 270 Cb 0.00 0.16 1.56 0.00 0.10 0.00 0.00 66.02 67.84 3koo s SER 270 CO 0.00 -0.30 1.69 4.11 0.98 0.00 0.00 173.24 179.72 3koo h TRP 271 N 2.00 0.14 0.00 5.02 5.08 -1.80 0.34 115.95 126.73 3koo h TRP 271 Ca -0.30 0.01 -0.00 0.00 1.08 0.00 0.00 58.89 59.68 3koo h TRP 271 Cb 1.20 -0.04 -0.00 0.00 -3.00 0.00 0.00 29.16 27.32 3koo h TRP 271 CO 0.32 -0.03 -0.01 -0.92 -1.28 0.00 0.00 178.44 176.52 3koo h TYR 272 N 0.05 0.00 0.00 0.12 3.20 -1.93 -2.38 116.97 116.03 3koo h TYR 272 Ca 0.74 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.61 3koo h TYR 272 Cb 2.78 0.00 0.00 0.00 1.54 0.00 0.00 36.73 41.05 3koo h TYR 272 CO -0.00 0.01 0.00 0.45 -1.64 0.00 0.00 178.16 176.98 3koo n SER 273 N -3.11 0.00 -0.34 -2.11 2.88 0.12 -0.81 113.62 110.25 3koo n SER 273 Ca 0.01 -0.28 0.03 0.00 -1.33 0.00 0.00 58.87 57.29 3koo n SER 273 Cb 0.31 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 63.85 3koo n SER 273 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 3koo n TRP 274 N -0.98 0.24 -0.31 0.66 7.02 -0.90 -4.74 117.44 118.44 3koo n TRP 274 Ca 0.06 -0.48 0.14 0.00 -1.02 0.00 0.00 57.50 56.20 3koo n TRP 274 Cb 0.03 -0.04 0.32 0.00 -2.42 0.00 0.00 31.31 29.20 3koo n TRP 274 CO 0.00 0.00 0.00 0.07 -2.02 0.00 0.00 177.69 175.74 3koo h ARG 275 N 1.09 0.30 -0.00 -0.99 0.11 -1.16 -0.37 114.38 113.36 3koo h ARG 275 Ca 0.00 -0.02 -0.13 0.00 0.10 0.00 0.00 59.98 59.93 3koo h ARG 275 Cb 0.61 -0.07 -0.02 0.00 1.11 0.00 0.00 29.97 31.61 3koo h ARG 275 CO 0.00 0.20 -0.62 1.88 0.10 0.00 0.00 179.97 181.52 3koo h TYR 276 N 0.31 0.00 0.00 4.08 0.05 -1.85 -3.23 116.97 116.33 3koo h TYR 276 Ca 0.58 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.36 3koo h TYR 276 Cb 1.16 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 3koo h TYR 276 CO -0.17 0.62 -0.96 0.00 -1.05 0.00 0.00 178.16 176.60 3koo n GLN 277 N -3.80 0.38 -0.33 4.88 0.00 -0.22 -4.35 117.38 113.94 3koo n GLN 277 Ca -0.01 0.04 -0.03 0.00 0.00 0.00 0.00 57.00 56.99 3koo n GLN 277 Cb 0.62 -1.67 0.09 0.00 0.00 0.00 0.00 30.24 29.28 3koo n GLN 277 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 3koo h ILE 278 N 0.00 1.24 -0.14 -0.39 2.04 -1.38 -1.95 117.51 116.93 3koo h ILE 278 Ca 0.00 -0.49 -0.13 0.00 1.00 0.00 0.00 64.86 65.24 3koo h ILE 278 Cb 0.81 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 3koo h ILE 278 CO 0.00 0.24 -0.43 -0.65 0.00 0.00 0.00 178.15 177.32 3koo h PRO 279 N 1.22 0.54 0.14 2.37 0.11 -1.78 -3.17 132.00 131.43 3koo h PRO 279 Ca 0.32 -0.39 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3koo h PRO 279 Cb -0.09 0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.06 3koo h PRO 279 CO -0.06 1.01 -0.34 0.00 -0.21 0.00 0.00 178.00 178.39 3koo h ALA 280 N 0.53 -0.88 -0.99 -0.75 0.00 -1.73 -0.38 119.26 115.06 3koo h ALA 280 Ca -0.01 -0.08 0.17 0.00 0.00 0.00 0.00 54.91 54.98 3koo h ALA 280 Cb 1.05 0.70 -0.09 0.00 0.00 0.00 0.00 17.79 19.45 3koo h ALA 280 CO 0.09 -0.95 0.62 -0.07 0.00 0.00 0.00 179.25 178.93 3koo h LEU 281 N -0.53 0.78 0.63 0.00 3.38 -1.51 0.51 115.31 118.57 3koo h LEU 281 Ca -0.01 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 3koo h LEU 281 Cb 0.51 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.19 3koo h LEU 281 CO -0.15 0.34 -0.30 0.00 0.09 0.00 0.00 178.44 178.41 3koo h ALA 282 N 1.61 -0.85 -0.14 1.53 0.00 -1.46 -1.03 119.26 118.92 3koo h ALA 282 Ca 0.53 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.31 3koo h ALA 282 Cb 0.79 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.84 3koo h ALA 282 CO -0.31 -0.98 -0.29 0.37 0.00 0.00 0.00 179.25 178.04 3koo h GLN 283 N -0.85 -0.34 0.00 0.00 5.75 0.03 0.31 115.11 120.01 3koo h GLN 283 Ca -0.09 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 3koo h GLN 283 Cb 0.65 0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.28 3koo h GLN 283 CO 0.14 -0.23 0.49 0.00 -2.65 0.00 0.00 178.83 176.59 3koo h ALA 284 N 0.53 1.42 0.00 3.38 0.00 0.15 -3.44 119.26 121.30 3koo h ALA 284 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3koo h ALA 284 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3koo h ALA 284 CO -0.34 -0.42 0.00 0.41 0.00 0.00 0.00 179.25 178.90 3koo n GLY 285 N -1.29 1.63 3.53 0.00 0.00 0.11 -5.06 105.19 104.11 3koo n GLY 285 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 3koo n GLY 285 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3koo s TYR 286 N -2.00 2.29 -0.44 1.61 1.51 -0.47 -4.22 117.35 115.63 3koo s TYR 286 Ca 0.00 -0.62 -0.14 0.00 -1.01 0.00 0.00 57.07 55.30 3koo s TYR 286 Cb 0.00 -1.40 0.06 0.00 -0.11 0.00 0.00 41.96 40.51 3koo s TYR 286 CO 0.00 0.44 0.34 0.50 -1.11 0.00 0.00 175.55 175.72 3koo s ARG 287 N -3.68 2.90 -0.06 -0.62 3.52 -0.35 -2.83 118.95 117.83 3koo s ARG 287 Ca 0.33 -1.29 -0.13 0.00 -0.13 0.00 0.00 55.73 54.51 3koo s ARG 287 Cb 0.05 -4.01 -0.05 0.00 -1.56 0.00 0.00 34.95 29.38 3koo s ARG 287 CO 0.16 -0.94 0.32 0.08 -0.81 0.00 0.00 175.30 174.11 3koo s VAL 288 N 1.60 5.20 -0.34 7.11 1.01 0.84 -0.40 120.40 135.42 3koo s VAL 288 Ca 0.04 0.64 -0.01 0.00 0.00 0.00 0.00 61.98 62.64 3koo s VAL 288 Cb -0.23 -3.62 0.12 0.00 0.00 0.00 0.00 36.38 32.65 3koo s VAL 288 CO 0.06 0.56 0.17 -0.76 0.00 0.00 0.00 175.10 175.13 3koo s LEU 289 N -0.80 1.32 -0.23 3.92 1.43 -0.38 -1.76 118.68 122.18 3koo s LEU 289 Ca 0.20 -1.85 -0.26 0.00 -1.03 0.00 0.00 54.13 51.19 3koo s LEU 289 Cb -0.15 -0.56 -0.00 0.00 0.03 0.00 0.00 46.19 45.51 3koo s LEU 289 CO 0.09 -0.37 0.88 0.00 0.23 0.00 0.00 176.35 177.18 3koo s ALA 290 N 1.41 3.63 0.13 4.21 0.00 -0.56 -2.22 121.76 128.36 3koo s ALA 290 Ca 0.13 -0.04 -0.30 0.00 0.00 0.00 0.00 51.96 51.76 3koo s ALA 290 Cb -0.20 -3.33 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 3koo s ALA 290 CO -0.16 -0.90 1.04 -1.64 0.00 0.00 0.00 175.76 174.10 3koo s MET 291 N 2.79 4.63 -0.63 0.00 1.00 -0.46 -1.58 119.30 125.05 3koo s MET 291 Ca 0.37 1.59 -0.27 0.00 0.00 0.00 0.00 55.69 57.39 3koo s MET 291 Cb -0.15 -3.33 0.04 0.00 0.00 0.00 0.00 34.83 31.38 3koo s MET 291 CO 0.08 0.11 1.16 -0.51 0.00 0.00 0.00 175.02 175.85 3koo s ASP 292 N 0.07 6.32 0.58 3.03 1.01 0.23 -2.64 116.67 125.27 3koo s ASP 292 Ca 0.49 -0.24 -0.20 0.00 0.71 0.00 0.00 52.55 53.31 3koo s ASP 292 Cb -0.26 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.11 3koo s ASP 292 CO 0.32 -1.55 1.27 -0.04 0.21 0.00 0.00 175.17 175.38 3koo s MET 293 N 4.95 2.97 -0.09 8.23 -1.94 -1.26 -4.24 119.30 127.92 3koo s MET 293 Ca 0.36 1.99 -0.36 0.00 -1.71 0.00 0.00 55.69 55.98 3koo s MET 293 Cb -0.09 -2.03 -0.17 0.00 2.01 0.00 0.00 34.83 34.54 3koo s MET 293 CO 0.20 -1.25 1.01 1.17 -0.01 0.00 0.00 175.02 176.14 3koo n LYS 294 N -1.43 0.00 -0.03 2.03 4.81 -1.26 -1.32 118.16 120.96 3koo n LYS 294 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 3koo n LYS 294 Cb 0.48 -1.29 0.00 0.00 0.02 0.00 0.00 35.03 34.24 3koo n LYS 294 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3koo n GLY 295 N 1.73 0.41 3.10 3.14 0.00 -0.79 -4.73 105.19 108.04 3koo n GLY 295 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3koo n GLY 295 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3koo s TYR 296 N -2.15 3.14 0.00 1.61 1.51 -0.43 -4.38 117.35 116.66 3koo s TYR 296 Ca 0.00 -2.09 0.00 0.00 -1.01 0.00 0.00 57.07 53.97 3koo s TYR 296 Cb 0.00 -1.95 0.00 0.00 -0.11 0.00 0.00 41.96 39.90 3koo s TYR 296 CO 0.00 -0.85 0.00 0.41 -1.11 0.00 0.00 175.55 174.00 3koo n GLY 297 N 4.50 1.87 1.50 0.71 0.00 -1.25 -2.87 105.19 109.64 3koo n GLY 297 Ca -0.16 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 45.86 3koo n GLY 297 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3koo n GLU 298 N 0.00 4.04 -4.36 1.61 1.02 -1.26 -4.57 120.64 117.12 3koo n GLU 298 Ca 0.00 -2.98 -0.31 0.00 -0.02 0.00 0.00 57.16 53.85 3koo n GLU 298 Cb 0.00 -2.03 -0.10 0.00 -0.02 0.00 0.00 31.44 29.29 3koo n GLU 298 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3koo s SER 299 N -1.14 4.51 0.42 1.62 0.01 -1.14 -4.26 113.70 113.73 3koo s SER 299 Ca 0.49 -0.26 -0.21 0.00 1.31 0.00 0.00 55.95 57.28 3koo s SER 299 Cb 0.37 -0.96 -0.14 0.00 0.21 0.00 0.00 66.02 65.49 3koo s SER 299 CO 0.16 0.23 0.28 -1.20 0.41 0.00 0.00 173.24 173.12 3koo n SER 300 N 1.15 -2.06 -3.25 2.44 7.64 0.12 -4.20 113.62 115.47 3koo n SER 300 Ca -0.14 0.84 -0.24 0.00 1.01 0.00 0.00 58.87 60.34 3koo n SER 300 Cb 0.52 -0.98 -0.08 0.00 -1.01 0.00 0.00 64.21 62.66 3koo n SER 300 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3koo n ALA 301 N -1.01 2.28 -1.79 -0.43 0.00 -1.26 -1.88 120.51 116.40 3koo n ALA 301 Ca 0.11 -3.06 -0.41 0.00 0.00 0.00 0.00 53.44 50.08 3koo n ALA 301 Cb 0.40 -0.84 -0.02 0.00 0.00 0.00 0.00 19.45 19.00 3koo n ALA 301 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3koo s PRO 302 N -0.40 4.16 0.43 0.00 0.02 -1.26 -4.84 135.00 133.11 3koo s PRO 302 Ca 0.34 2.50 0.24 0.00 0.02 0.00 0.00 61.00 64.09 3koo s PRO 302 Cb 0.10 -3.04 0.75 0.00 0.02 0.00 0.00 34.50 32.33 3koo s PRO 302 CO -0.16 -0.56 1.75 -1.00 -0.33 0.00 0.00 177.00 176.70 3koo h PRO 303 N 4.72 0.00 -6.74 5.54 0.13 -2.00 -3.43 132.00 130.22 3koo h PRO 303 Ca -0.47 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.14 3koo h PRO 303 Cb 1.22 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.39 3koo h PRO 303 CO 0.77 0.21 0.60 -1.21 -0.23 0.00 0.00 178.00 178.14 3koo s GLU 304 N -3.46 4.44 0.11 0.86 8.01 -1.26 -4.87 118.70 122.53 3koo s GLU 304 Ca 0.02 2.02 -0.32 0.00 0.01 0.00 0.00 54.97 56.70 3koo s GLU 304 Cb 0.09 -3.17 -0.11 0.00 -4.31 0.00 0.00 34.13 26.62 3koo s GLU 304 CO 0.65 -0.13 1.58 0.82 0.01 0.00 0.00 175.26 178.18 3koo h ILE 305 N 3.48 0.10 0.00 -1.63 5.03 -1.92 -3.00 117.51 119.58 3koo h ILE 305 Ca -0.46 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.28 3koo h ILE 305 Cb 1.22 0.10 0.00 0.00 -3.03 0.00 0.00 36.82 35.11 3koo h ILE 305 CO 0.72 0.00 0.12 -0.62 -0.68 0.00 0.00 178.15 177.70 3koo n GLU 306 N -5.47 0.11 0.00 2.37 4.71 -1.26 -1.31 120.64 119.79 3koo n GLU 306 Ca -0.07 0.60 0.00 0.00 -0.01 0.00 0.00 57.16 57.67 3koo n GLU 306 Cb 0.39 -1.98 0.00 0.00 -1.01 0.00 0.00 31.44 28.84 3koo n GLU 306 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3koo n GLU 307 N -2.12 1.00 0.00 3.49 -0.58 -1.13 -3.21 120.64 118.08 3koo n GLU 307 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 3koo n GLU 307 Cb 0.15 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.70 3koo n GLU 307 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3koo n TYR 308 N -0.18 0.00 -1.09 -0.32 4.02 -0.43 -4.77 117.16 114.39 3koo n TYR 308 Ca 0.00 -0.14 -0.31 0.00 -0.01 0.00 0.00 57.90 57.44 3koo n TYR 308 Cb 0.16 -0.01 0.12 0.00 -0.02 0.00 0.00 39.34 39.58 3koo n TYR 308 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3koo h MET 310 N -1.37 -0.63 0.00 0.00 2.86 -1.95 -1.61 114.93 112.23 3koo h MET 310 Ca -0.44 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.25 3koo h MET 310 Cb 1.24 0.14 0.00 0.00 0.06 0.00 0.00 31.60 33.05 3koo h MET 310 CO 0.49 -0.42 0.00 -1.91 1.06 0.00 0.00 176.91 176.12 3koo n GLU 311 N -4.05 0.00 0.03 1.72 2.13 -1.26 0.13 120.64 119.34 3koo n GLU 311 Ca -0.08 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.57 3koo n GLU 311 Cb 0.26 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.90 3koo n GLU 311 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 3koo h VAL 312 N 0.00 1.32 -0.90 6.31 3.04 -1.88 0.99 116.25 125.12 3koo h VAL 312 Ca 0.00 -2.23 0.09 0.00 -1.01 0.00 0.00 66.70 63.56 3koo h VAL 312 Cb 0.00 2.28 -0.07 0.00 -2.01 0.00 0.00 31.29 31.48 3koo h VAL 312 CO 0.00 0.68 0.55 -0.07 -1.01 0.00 0.00 177.57 177.72 3koo h LEU 313 N 0.38 0.81 0.01 3.16 3.38 0.48 0.12 115.31 123.64 3koo h LEU 313 Ca -0.09 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 3koo h LEU 313 Cb 1.57 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 42.21 3koo h LEU 313 CO 0.18 0.47 -0.61 0.00 0.09 0.00 0.00 178.44 178.57 3koo h LYS 315 N -0.14 0.18 0.00 0.00 1.79 -0.49 0.26 116.57 118.16 3koo h LYS 315 Ca -0.08 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 3koo h LYS 315 Cb 1.34 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.95 3koo h LYS 315 CO 0.12 0.12 -0.55 0.93 -1.08 0.00 0.00 179.45 178.98 3koo h GLU 316 N 0.18 0.00 0.16 3.15 5.08 -0.57 -2.58 114.58 120.00 3koo h GLU 316 Ca 0.59 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.73 3koo h GLU 316 Cb 1.93 0.00 0.03 0.00 0.50 0.00 0.00 28.75 31.20 3koo h GLU 316 CO -0.16 0.00 -0.96 0.52 -1.00 0.00 0.00 179.01 177.42 3koo h MET 317 N 0.00 0.36 -0.02 2.33 2.86 -0.13 0.38 114.93 120.71 3koo h MET 317 Ca 0.00 -0.61 0.01 0.00 -2.06 0.00 0.00 59.70 57.05 3koo h MET 317 Cb 0.95 0.22 -0.03 0.00 0.06 0.00 0.00 31.60 32.80 3koo h MET 317 CO 0.00 1.29 -0.28 0.28 1.06 0.00 0.00 176.91 179.25 3koo h VAL 318 N -0.24 0.00 -0.86 -2.22 2.07 -1.22 0.16 116.25 113.94 3koo h VAL 318 Ca -0.16 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.59 3koo h VAL 318 Cb 1.75 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 3koo h VAL 318 CO 0.18 0.00 0.61 0.74 0.02 0.00 0.00 177.57 179.12 3koo h THR 319 N -0.34 0.60 -0.33 2.57 2.02 -1.51 0.44 112.91 116.37 3koo h THR 319 Ca 0.01 -0.04 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 3koo h THR 319 Cb 0.37 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 3koo h THR 319 CO -0.20 0.02 0.06 0.15 0.37 0.00 0.00 175.52 175.92 3koo h PHE 320 N 0.11 0.57 -0.36 3.16 3.57 0.47 -2.82 116.94 121.66 3koo h PHE 320 Ca 0.42 -0.08 -0.06 0.00 3.53 0.00 0.00 57.97 61.78 3koo h PHE 320 Cb 1.50 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 40.06 3koo h PHE 320 CO -0.00 0.60 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.56 3koo h LEU 321 N 0.38 0.56 -0.28 0.59 3.38 0.25 -2.95 115.31 117.23 3koo h LEU 321 Ca 0.10 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 57.98 3koo h LEU 321 Cb 0.33 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.86 3koo h LEU 321 CO 0.00 0.66 -0.54 0.44 0.09 0.00 0.00 178.44 179.10 3koo h ASP 322 N 0.55 -1.76 0.00 -0.43 5.19 -0.45 -2.10 116.42 117.42 3koo h ASP 322 Ca 0.11 0.22 0.00 0.00 -0.62 0.00 0.00 57.03 56.74 3koo h ASP 322 Cb 0.43 0.71 0.00 0.00 0.18 0.00 0.00 39.33 40.65 3koo h ASP 322 CO 0.02 -0.43 0.00 0.29 -3.12 0.00 0.00 179.24 176.00 3koo n LYS 323 N -5.32 0.97 0.00 3.56 4.76 -1.08 -2.61 118.16 118.44 3koo n LYS 323 Ca -0.05 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.39 3koo n LYS 323 Cb 0.35 -1.07 0.00 0.00 -1.84 0.00 0.00 35.03 32.47 3koo n LYS 323 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 3koo n LEU 324 N -0.57 0.57 -0.15 -0.35 0.00 -1.07 -5.01 117.00 110.40 3koo n LEU 324 Ca 0.03 -0.67 -0.01 0.00 0.00 0.00 0.00 56.01 55.36 3koo n LEU 324 Cb 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 43.43 3koo n LEU 324 CO 0.03 0.14 -0.02 0.61 0.00 0.00 0.00 177.39 178.15 3koo n GLY 325 N 0.22 0.35 3.34 -3.96 0.00 -1.07 -5.04 105.19 99.02 3koo n GLY 325 Ca 0.00 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 3koo n GLY 325 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3koo s LEU 326 N -0.40 2.88 0.02 0.99 1.43 -0.81 -4.98 118.68 117.81 3koo s LEU 326 Ca 0.00 -0.36 -0.21 0.00 -1.03 0.00 0.00 54.13 52.54 3koo s LEU 326 Cb 0.00 -1.71 -0.17 0.00 0.03 0.00 0.00 46.19 44.34 3koo s LEU 326 CO 0.00 0.04 1.26 0.28 0.23 0.00 0.00 176.35 178.16 3koo h SER 327 N 7.67 0.40 -5.17 2.29 0.02 -1.95 -3.40 113.55 113.40 3koo h SER 327 Ca -0.37 -0.57 -0.07 0.00 -0.84 0.00 0.00 61.79 59.94 3koo h SER 327 Cb 1.17 -0.11 -0.12 0.00 0.14 0.00 0.00 62.40 63.48 3koo h SER 327 CO 0.60 0.89 -0.18 0.00 -1.14 0.00 0.00 176.83 177.00 3koo s GLN 328 N -3.97 1.19 0.05 3.45 -2.07 -1.26 -4.37 119.66 112.68 3koo s GLN 328 Ca -0.14 -1.00 -0.07 0.00 -1.82 0.00 0.00 55.36 52.33 3koo s GLN 328 Cb 0.04 0.43 -0.00 0.00 -1.09 0.00 0.00 33.01 32.39 3koo s GLN 328 CO 0.76 -0.46 0.15 0.00 -1.32 0.00 0.00 175.29 174.42 3koo s ALA 329 N -3.91 -0.19 -0.14 2.60 0.00 -0.85 -4.73 121.76 114.54 3koo s ALA 329 Ca 0.12 -0.48 -0.25 0.00 0.00 0.00 0.00 51.96 51.35 3koo s ALA 329 Cb 0.02 0.30 -0.02 0.00 0.00 0.00 0.00 23.12 23.42 3koo s ALA 329 CO -0.03 -0.37 0.79 0.54 0.00 0.00 0.00 175.76 176.69 3koo s VAL 330 N -2.84 4.93 -0.29 0.00 0.11 0.11 -1.75 120.40 120.67 3koo s VAL 330 Ca -0.03 1.57 -0.12 0.00 -2.93 0.00 0.00 61.98 60.46 3koo s VAL 330 Cb 0.00 -4.11 -0.04 0.00 -1.53 0.00 0.00 36.38 30.70 3koo s VAL 330 CO -0.06 0.09 0.24 -0.36 -3.33 0.00 0.00 175.10 171.69 3koo s PHE 331 N 1.81 3.23 -0.16 1.54 0.40 0.33 0.21 117.98 125.34 3koo s PHE 331 Ca 0.38 0.14 0.02 0.00 -0.60 0.00 0.00 56.93 56.86 3koo s PHE 331 Cb -0.17 -2.45 0.01 0.00 0.51 0.00 0.00 43.02 40.92 3koo s PHE 331 CO 0.14 -0.21 -0.20 0.42 0.70 0.00 0.00 175.22 176.07 3koo s ILE 332 N 1.84 2.14 0.24 0.64 1.01 -0.18 -0.00 121.20 126.88 3koo s ILE 332 Ca 0.09 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.83 3koo s ILE 332 Cb -0.16 -1.88 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 3koo s ILE 332 CO 0.11 0.54 0.02 -0.83 0.00 0.00 0.00 174.94 174.77 3koo s GLY 333 N 1.00 1.61 -0.04 6.18 0.00 -0.12 0.17 107.32 116.11 3koo s GLY 333 Ca -0.02 -1.80 -0.09 0.00 0.00 0.00 0.00 44.72 42.81 3koo s GLY 333 CO -0.06 -1.66 0.21 -1.58 0.00 0.00 0.00 173.10 170.01 3koo s HIS 334 N -3.46 -0.14 0.00 1.90 5.04 -0.17 -1.15 115.29 117.30 3koo s HIS 334 Ca 0.30 0.31 0.00 0.00 -1.54 0.00 0.00 55.06 54.13 3koo s HIS 334 Cb 0.06 0.04 0.00 0.00 0.04 0.00 0.00 32.58 32.73 3koo s HIS 334 CO 0.10 -0.22 0.00 -3.47 -2.34 0.00 0.00 174.74 168.81 3koo n ASP 335 N 2.18 0.00 0.27 9.88 4.64 -1.23 -0.28 116.55 132.02 3koo n ASP 335 Ca -0.17 0.00 0.17 0.00 -1.38 0.00 0.00 54.79 53.41 3koo n ASP 335 Cb 0.57 0.00 0.84 0.00 -1.04 0.00 0.00 41.12 41.49 3koo n ASP 335 CO 0.00 0.00 0.00 -0.50 -0.82 0.00 0.00 177.20 175.88 3koo h TRP 336 N 0.00 0.00 0.01 -0.67 4.06 -1.89 0.09 115.95 117.55 3koo h TRP 336 Ca 0.00 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.74 3koo h TRP 336 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 3koo h TRP 336 CO 0.00 0.00 -0.92 0.78 -3.56 0.00 0.00 178.44 174.74 3koo h GLY 337 N 0.00 0.28 1.64 1.49 0.00 -0.06 -2.44 103.07 103.99 3koo h GLY 337 Ca 0.05 -0.52 -0.09 0.00 0.00 0.00 0.00 47.33 46.77 3koo h GLY 337 CO -0.00 0.46 -0.24 -1.33 0.00 0.00 0.00 176.54 175.43 3koo h GLY 338 N 1.69 0.46 0.88 4.60 0.00 -0.86 -1.05 103.07 108.80 3koo h GLY 338 Ca -0.06 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 3koo h GLY 338 CO 0.15 0.33 -0.15 1.98 0.00 0.00 0.00 176.54 178.85 3koo h MET 339 N 0.38 -0.41 -0.42 4.80 -1.53 -1.42 -2.97 114.93 113.36 3koo h MET 339 Ca 0.06 0.03 0.09 0.00 -3.44 0.00 0.00 59.70 56.43 3koo h MET 339 Cb 0.63 0.09 -0.09 0.00 -0.55 0.00 0.00 31.60 31.68 3koo h MET 339 CO 0.05 -0.20 -0.22 1.25 0.14 0.00 0.00 176.91 177.93 3koo h LEU 340 N -0.55 -0.74 -1.68 3.39 7.12 -1.18 0.17 115.31 121.85 3koo h LEU 340 Ca -0.04 0.16 0.17 0.00 0.13 0.00 0.00 57.88 58.30 3koo h LEU 340 Cb 0.41 0.39 -0.05 0.00 -0.53 0.00 0.00 40.66 40.88 3koo h LEU 340 CO 0.07 -0.24 0.52 0.58 -0.13 0.00 0.00 178.44 179.23 3koo h VAL 341 N -0.14 0.74 -0.46 1.05 2.07 -1.20 0.16 116.25 118.46 3koo h VAL 341 Ca 0.20 -0.10 -0.14 0.00 0.82 0.00 0.00 66.70 67.48 3koo h VAL 341 Cb 0.45 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3koo h VAL 341 CO -0.50 0.06 -0.26 -0.50 0.02 0.00 0.00 177.57 176.38 3koo h TRP 342 N 0.30 1.15 -0.12 1.57 -0.00 -0.51 -1.42 115.95 116.93 3koo h TRP 342 Ca 0.38 -0.29 -0.07 0.00 -0.00 0.00 0.00 58.89 58.90 3koo h TRP 342 Cb 1.02 -0.26 -0.01 0.00 -0.00 0.00 0.00 29.16 29.91 3koo h TRP 342 CO -0.00 1.13 -0.24 1.88 -0.00 0.00 0.00 178.44 181.20 3koo h TYR 343 N 0.84 0.22 -0.22 0.49 -1.99 -0.54 -2.31 116.97 113.47 3koo h TYR 343 Ca 0.10 -0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.78 3koo h TYR 343 Cb 0.84 -0.06 -0.01 0.00 2.00 0.00 0.00 36.73 39.50 3koo h TYR 343 CO 0.06 0.44 0.10 0.52 -0.00 0.00 0.00 178.16 179.27 3koo h MET 344 N 0.19 0.32 0.00 4.88 2.86 -0.45 0.76 114.93 123.48 3koo h MET 344 Ca 0.03 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3koo h MET 344 Cb 0.54 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.14 3koo h MET 344 CO 0.04 0.34 0.00 0.00 1.06 0.00 0.00 176.91 178.35 3koo h ALA 345 N 0.96 1.00 0.00 6.32 0.00 -1.18 -0.98 119.26 125.38 3koo h ALA 345 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3koo h ALA 345 Cb 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3koo h ALA 345 CO -0.01 0.00 -1.64 1.28 0.00 0.00 0.00 179.25 178.89 3koo n LEU 346 N -2.82 0.35 0.00 0.00 4.77 -0.69 -4.13 117.00 114.47 3koo n LEU 346 Ca 0.01 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3koo n LEU 346 Cb 0.25 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3koo n LEU 346 CO 0.24 -0.04 -0.04 0.49 -1.33 0.00 0.00 177.39 176.71 3koo n PHE 347 N -2.46 0.00 -2.73 -1.77 3.72 0.18 -4.85 117.46 109.54 3koo n PHE 347 Ca -0.04 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.31 3koo n PHE 347 Cb 0.60 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 39.19 3koo n PHE 347 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3koo n TYR 348 N -0.61 0.87 -0.30 1.38 4.02 -0.37 -4.95 117.16 117.19 3koo n TYR 348 Ca 0.00 -2.46 0.14 0.00 -0.01 0.00 0.00 57.90 55.57 3koo n TYR 348 Cb 0.00 -0.14 0.30 0.00 -0.02 0.00 0.00 39.34 39.48 3koo n TYR 348 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 3koo h PRO 349 N 2.72 0.15 -0.94 -0.72 0.11 -1.72 0.40 132.00 132.02 3koo h PRO 349 Ca -0.14 -0.01 0.15 0.00 0.11 0.00 0.00 66.00 66.11 3koo h PRO 349 Cb 1.22 -0.03 -0.15 0.00 0.11 0.00 0.00 31.00 32.15 3koo h PRO 349 CO 0.32 0.10 -0.35 0.39 -0.21 0.00 0.00 178.00 178.25 3koo n GLU 350 N -5.28 -0.20 -0.13 1.05 4.71 -1.26 -1.50 120.64 118.03 3koo n GLU 350 Ca 0.22 1.44 0.08 0.00 -0.01 0.00 0.00 57.16 58.89 3koo n GLU 350 Cb 0.72 -2.14 0.25 0.00 -1.01 0.00 0.00 31.44 29.25 3koo n GLU 350 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 3koo n ARG 351 N -5.40 1.73 -3.94 3.49 5.12 0.14 -4.70 116.66 113.11 3koo n ARG 351 Ca 0.10 -1.13 -0.31 0.00 -1.93 0.00 0.00 57.85 54.59 3koo n ARG 351 Cb 0.39 -1.32 -0.15 0.00 -1.16 0.00 0.00 32.46 30.22 3koo n ARG 351 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3koo s VAL 352 N -1.66 1.69 0.08 1.55 1.01 -0.56 -2.00 120.40 120.51 3koo s VAL 352 Ca 0.27 -1.64 -0.28 0.00 0.00 0.00 0.00 61.98 60.33 3koo s VAL 352 Cb 0.14 -2.09 -0.16 0.00 0.00 0.00 0.00 36.38 34.27 3koo s VAL 352 CO 0.20 -0.36 1.68 -0.09 0.00 0.00 0.00 175.10 176.53 3koo h ARG 353 N 7.86 -0.43 -2.72 2.72 2.43 -1.60 -3.46 114.38 119.17 3koo h ARG 353 Ca -0.13 0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 58.99 3koo h ARG 353 Cb 1.04 0.10 -0.18 0.00 -0.42 0.00 0.00 29.97 30.51 3koo h ARG 353 CO 0.46 -0.29 -0.04 0.00 -1.51 0.00 0.00 179.97 178.60 3koo s ALA 354 N -6.12 -1.22 0.15 2.80 0.00 -1.26 -4.53 121.76 111.58 3koo s ALA 354 Ca -0.15 0.62 0.09 0.00 0.00 0.00 0.00 51.96 52.52 3koo s ALA 354 Cb 0.05 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 3koo s ALA 354 CO 0.64 -0.41 -0.15 0.14 0.00 0.00 0.00 175.76 175.98 3koo s VAL 355 N -1.92 2.95 -0.17 0.00 -7.23 -0.79 -0.51 120.40 112.73 3koo s VAL 355 Ca -0.08 -1.63 -0.13 0.00 -1.81 0.00 0.00 61.98 58.32 3koo s VAL 355 Cb -0.02 -2.41 0.05 0.00 0.56 0.00 0.00 36.38 34.56 3koo s VAL 355 CO 0.02 -0.02 0.44 0.00 -0.31 0.00 0.00 175.10 175.23 3koo s ALA 356 N -1.46 -1.09 0.07 1.32 0.00 1.00 -2.36 121.76 119.24 3koo s ALA 356 Ca 0.21 1.36 0.10 0.00 0.00 0.00 0.00 51.96 53.63 3koo s ALA 356 Cb -0.09 -0.80 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 3koo s ALA 356 CO 0.12 -0.23 -0.27 0.45 0.00 0.00 0.00 175.76 175.84 3koo s SER 357 N 0.63 3.21 -0.22 0.00 0.15 -0.87 -0.95 113.70 115.66 3koo s SER 357 Ca -0.03 -0.63 -0.04 0.00 0.70 0.00 0.00 55.95 55.95 3koo s SER 357 Cb -0.05 -0.27 -0.01 0.00 -1.71 0.00 0.00 66.02 63.98 3koo s SER 357 CO -0.04 0.24 -0.05 -0.76 1.20 0.00 0.00 173.24 173.83 3koo s LEU 358 N -1.47 2.86 0.00 3.45 1.43 -0.30 -2.06 118.68 122.59 3koo s LEU 358 Ca 0.12 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.82 3koo s LEU 358 Cb -0.10 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.39 3koo s LEU 358 CO 0.03 -0.02 0.00 0.59 0.23 0.00 0.00 176.35 177.18 3koo n ASN 359 N 4.77 0.00 -4.71 2.29 4.13 0.55 -3.54 115.26 118.76 3koo n ASN 359 Ca -0.18 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.66 3koo n ASN 359 Cb 0.51 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.72 3koo n ASN 359 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3koo s THR 360 N 0.00 3.25 0.24 3.41 2.01 -1.26 -4.87 115.64 118.42 3koo s THR 360 Ca 0.00 0.83 0.02 0.00 0.31 0.00 0.00 61.69 62.85 3koo s THR 360 Cb 0.00 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.94 3koo s THR 360 CO 0.00 0.04 0.41 -2.16 -0.69 0.00 0.00 174.62 172.22 3koo s PRO 361 N 1.59 3.48 -0.56 4.92 0.04 -1.26 -4.78 135.00 138.43 3koo s PRO 361 Ca 0.67 -0.49 -0.22 0.00 0.04 0.00 0.00 61.00 61.00 3koo s PRO 361 Cb -0.37 -2.82 0.05 0.00 0.04 0.00 0.00 34.50 31.40 3koo s PRO 361 CO 0.30 0.36 0.86 0.12 0.04 0.00 0.00 177.00 178.68 3koo s PHE 362 N -2.00 2.84 -0.31 0.56 5.36 -1.26 -4.93 117.98 118.24 3koo s PHE 362 Ca 0.37 -0.27 -0.07 0.00 -0.96 0.00 0.00 56.93 56.00 3koo s PHE 362 Cb -0.10 -3.98 0.01 0.00 -0.34 0.00 0.00 43.02 38.61 3koo s PHE 362 CO 0.31 -1.33 0.09 0.42 -1.46 0.00 0.00 175.22 173.25 3koo s ILE 363 N 3.62 4.01 0.38 3.12 -1.09 -1.26 -4.62 121.20 125.35 3koo s ILE 363 Ca 0.24 -0.76 -0.26 0.00 -2.23 0.00 0.00 60.65 57.65 3koo s ILE 363 Cb -0.15 -3.11 -0.11 0.00 -1.58 0.00 0.00 42.46 37.51 3koo s ILE 363 CO 0.15 0.02 1.19 -0.81 -1.23 0.00 0.00 174.94 174.27 3koo n PRO 364 N 4.87 1.81 -2.83 2.79 -0.04 -1.26 -4.96 135.00 135.38 3koo n PRO 364 Ca -0.14 0.64 -0.41 0.00 -0.04 0.00 0.00 63.50 63.55 3koo n PRO 364 Cb 0.47 -2.23 -0.04 0.00 -0.04 0.00 0.00 33.50 31.67 3koo n PRO 364 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3koo s ALA 365 N -1.16 3.26 -0.36 0.55 0.00 -1.26 -5.01 121.76 117.79 3koo s ALA 365 Ca 0.59 0.35 -0.29 0.00 0.00 0.00 0.00 51.96 52.62 3koo s ALA 365 Cb -0.56 -3.21 0.01 0.00 0.00 0.00 0.00 23.12 19.36 3koo s ALA 365 CO 0.59 -0.25 1.32 1.21 0.00 0.00 0.00 175.76 178.63 3koo s ASN 366 N 0.96 6.56 0.25 0.00 3.84 -1.26 -4.88 114.94 120.40 3koo s ASN 366 Ca 0.46 1.00 -0.03 0.00 0.21 0.00 0.00 52.86 54.50 3koo s ASN 366 Cb -0.19 -2.54 0.50 0.00 -0.55 0.00 0.00 41.25 38.46 3koo s ASN 366 CO 0.23 -1.21 1.74 -0.65 -2.79 0.00 0.00 177.10 174.42 3koo h PRO 367 N 9.73 0.50 -0.29 0.43 0.11 -1.98 -2.14 132.00 138.36 3koo h PRO 367 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3koo h PRO 367 Cb 1.10 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.09 3koo h PRO 367 CO 1.06 0.33 0.00 0.09 -0.21 0.00 0.00 178.00 179.27 3koo n ASN 368 N -4.95 1.63 -3.52 -2.05 3.02 -1.26 -4.78 115.26 103.36 3koo n ASN 368 Ca 0.16 -1.96 -0.27 0.00 -0.03 0.00 0.00 54.58 52.48 3koo n ASN 368 Cb 0.43 -0.19 -0.14 0.00 -0.61 0.00 0.00 39.78 39.26 3koo n ASN 368 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 3koo s MET 369 N -1.61 0.20 -0.22 3.52 1.75 -0.81 -5.10 119.30 117.04 3koo s MET 369 Ca 0.22 -0.42 -0.36 0.00 -1.25 0.00 0.00 55.69 53.88 3koo s MET 369 Cb 0.11 -1.12 -0.13 0.00 2.84 0.00 0.00 34.83 36.54 3koo s MET 369 CO 0.15 -0.99 1.93 0.43 -0.65 0.00 0.00 175.02 175.90 3koo n SER 370 N 5.26 2.81 0.12 1.11 7.64 -1.26 -4.66 113.62 124.64 3koo n SER 370 Ca -0.05 0.84 0.06 0.00 1.01 0.00 0.00 58.87 60.72 3koo n SER 370 Cb 0.43 -1.28 0.31 0.00 -1.01 0.00 0.00 64.21 62.67 3koo n SER 370 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3koo n PRO 371 N 6.76 0.08 -0.02 1.43 -0.02 -1.26 0.65 135.00 142.61 3koo n PRO 371 Ca 0.29 0.53 -0.13 0.00 -2.02 0.00 0.00 63.50 62.16 3koo n PRO 371 Cb 0.23 -1.93 -0.10 0.00 -0.02 0.00 0.00 33.50 31.68 3koo n PRO 371 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3koo h LEU 372 N 0.00 0.06 -0.59 2.45 5.85 -1.96 -2.87 115.31 118.25 3koo h LEU 372 Ca 0.00 -0.53 0.10 0.00 0.84 0.00 0.00 57.88 58.29 3koo h LEU 372 Cb 0.36 -0.02 -0.11 0.00 0.37 0.00 0.00 40.66 41.26 3koo h LEU 372 CO 0.00 0.58 -0.36 -0.33 -0.34 0.00 0.00 178.44 177.99 3koo h GLU 373 N -0.46 -0.17 -0.01 1.25 5.08 -0.14 0.68 114.58 120.81 3koo h GLU 373 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3koo h GLU 373 Cb 0.57 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3koo h GLU 373 CO 0.01 -0.11 0.00 0.43 -1.00 0.00 0.00 179.01 178.33 3koo n SER 374 N -5.43 0.01 -0.13 1.42 7.64 -1.15 -2.60 113.62 113.39 3koo n SER 374 Ca 0.04 -0.58 -0.24 0.00 1.01 0.00 0.00 58.87 59.09 3koo n SER 374 Cb 0.35 -0.01 -0.11 0.00 -1.01 0.00 0.00 64.21 63.44 3koo n SER 374 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3koo n ILE 375 N -0.46 1.53 -0.00 0.44 -0.00 0.24 -4.56 119.36 116.54 3koo n ILE 375 Ca 0.00 -0.46 -0.10 0.00 -0.00 0.00 0.00 62.75 62.19 3koo n ILE 375 Cb 0.00 -1.69 -0.05 0.00 -0.00 0.00 0.00 39.64 37.90 3koo n ILE 375 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.55 176.66 3koo h LYS 376 N -0.53 -0.02 -6.67 0.38 6.56 -1.44 -3.42 116.57 111.43 3koo h LYS 376 Ca -0.62 0.00 -0.57 0.00 -1.06 0.00 0.00 60.65 58.40 3koo h LYS 376 Cb 1.74 0.00 0.18 0.00 -0.57 0.00 0.00 32.23 33.58 3koo h LYS 376 CO -0.25 -0.01 -0.24 0.00 -2.06 0.00 0.00 179.45 176.89 3koo n ALA 377 N -2.28 -0.90 -2.90 3.86 0.00 -1.25 -3.77 120.51 113.27 3koo n ALA 377 Ca -0.04 -0.11 -0.08 0.00 0.00 0.00 0.00 53.44 53.21 3koo n ALA 377 Cb 0.09 -1.92 0.01 0.00 0.00 0.00 0.00 19.45 17.63 3koo n ALA 377 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3koo n ASN 378 N -0.25 -7.88 -0.35 0.00 2.85 -1.26 -4.78 115.26 103.59 3koo n ASN 378 Ca 0.12 0.44 0.25 0.00 -0.11 0.00 0.00 54.58 55.28 3koo n ASN 378 Cb 0.49 -5.30 0.52 0.00 1.24 0.00 0.00 39.78 36.72 3koo n ASN 378 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3koo h PRO 379 N 1.79 0.34 0.00 1.20 0.11 -1.87 -1.12 132.00 132.45 3koo h PRO 379 Ca -0.01 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3koo h PRO 379 Cb 1.01 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3koo h PRO 379 CO 0.21 0.22 0.00 1.33 -0.21 0.00 0.00 178.00 179.56 3koo n VAL 380 N -4.70 0.00 -1.34 3.15 0.24 -1.26 -1.96 118.33 112.46 3koo n VAL 380 Ca 0.28 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.43 3koo n VAL 380 Cb 0.98 -0.75 0.19 0.00 -1.47 0.00 0.00 33.84 32.79 3koo n VAL 380 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3koo n PHE 381 N -0.80 2.20 -0.03 6.34 3.01 -0.42 -4.65 117.46 123.10 3koo n PHE 381 Ca 0.02 -1.76 -0.15 0.00 1.01 0.00 0.00 57.45 56.57 3koo n PHE 381 Cb 0.01 -0.75 -0.10 0.00 -0.01 0.00 0.00 39.48 38.62 3koo n PHE 381 CO 0.00 0.00 0.00 0.22 1.01 0.00 0.00 176.76 177.99 3koo h ASP 382 N 1.01 0.26 -0.63 4.37 -0.00 -1.51 -3.29 116.42 116.64 3koo h ASP 382 Ca 0.46 -0.67 0.10 0.00 -0.00 0.00 0.00 57.03 56.91 3koo h ASP 382 Cb 2.33 -0.08 -0.04 0.00 -0.00 0.00 0.00 39.33 41.54 3koo h ASP 382 CO 0.79 0.89 0.42 0.10 -0.00 0.00 0.00 179.24 181.45 3koo h TYR 383 N -0.35 0.49 -0.37 0.28 -0.00 -1.82 -0.80 116.97 114.40 3koo h TYR 383 Ca -0.02 0.01 0.08 0.00 0.00 0.00 0.00 58.73 58.81 3koo h TYR 383 Cb 0.89 -0.16 -0.09 0.00 0.00 0.00 0.00 36.73 37.38 3koo h TYR 383 CO 0.14 0.23 -0.24 1.96 -0.00 0.00 0.00 178.16 180.26 3koo h GLN 384 N 0.46 -0.18 -0.68 0.10 4.20 -1.91 0.18 115.11 117.29 3koo h GLN 384 Ca 0.29 0.01 0.08 0.00 0.06 0.00 0.00 58.65 59.10 3koo h GLN 384 Cb 0.53 0.04 -0.11 0.00 0.30 0.00 0.00 27.48 28.24 3koo h GLN 384 CO -0.09 -0.12 -0.50 1.25 -0.67 0.00 0.00 178.83 178.71 3koo h LEU 385 N -0.18 -1.75 -1.60 1.46 7.12 -1.29 -1.49 115.31 117.58 3koo h LEU 385 Ca 0.18 0.27 0.15 0.00 0.13 0.00 0.00 57.88 58.62 3koo h LEU 385 Cb 0.46 0.78 -0.02 0.00 -0.53 0.00 0.00 40.66 41.35 3koo h LEU 385 CO -0.48 -0.32 0.70 0.22 -0.13 0.00 0.00 178.44 178.43 3koo h TYR 386 N -0.20 0.00 0.07 1.25 3.20 -0.44 -1.39 116.97 119.47 3koo h TYR 386 Ca 0.16 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 3koo h TYR 386 Cb 0.54 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.81 3koo h TYR 386 CO -0.81 0.00 -0.04 0.74 -1.64 0.00 0.00 178.16 176.41 3koo h PHE 387 N 0.00 -0.09 0.00 -3.82 0.04 -0.58 -3.39 116.94 109.09 3koo h PHE 387 Ca 0.25 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.02 3koo h PHE 387 Cb 1.64 0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.83 3koo h PHE 387 CO 0.00 0.21 0.00 1.04 -0.60 0.00 0.00 178.31 178.96 3koo n GLN 388 N -4.81 0.00 -2.49 1.51 1.13 -0.52 -4.19 117.38 108.00 3koo n GLN 388 Ca -0.04 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.60 3koo n GLN 388 Cb 0.17 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.50 3koo n GLN 388 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3koo s GLU 389 N -2.82 3.48 -0.12 -1.09 2.56 -1.26 -4.95 118.70 114.50 3koo s GLU 389 Ca 0.00 0.45 -0.35 0.00 0.00 0.00 0.00 54.97 55.08 3koo s GLU 389 Cb 0.00 -4.04 -0.12 0.00 2.00 0.00 0.00 34.13 31.98 3koo s GLU 389 CO 0.00 -1.71 1.90 -2.30 -0.56 0.00 0.00 175.26 172.60 3koo n PRO 390 N 8.38 2.04 0.00 4.30 -0.02 -1.26 -2.43 135.00 146.01 3koo n PRO 390 Ca 0.11 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 3koo n PRO 390 Cb 0.49 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 3koo n PRO 390 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3koo n GLY 391 N 4.56 2.77 0.20 -1.23 0.00 -1.26 -4.98 105.19 105.25 3koo n GLY 391 Ca 0.24 -0.82 -0.06 0.00 0.00 0.00 0.00 46.02 45.38 3koo n GLY 391 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3koo h VAL 392 N 0.00 0.00 -0.17 1.61 2.07 -1.80 -2.28 116.25 115.68 3koo h VAL 392 Ca 0.00 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.34 3koo h VAL 392 Cb 0.00 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.77 3koo h VAL 392 CO 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 177.57 176.95 3koo h ALA 393 N -0.75 0.55 -0.22 1.67 0.00 -1.75 -3.08 119.26 115.67 3koo h ALA 393 Ca 0.03 -0.55 0.06 0.00 0.00 0.00 0.00 54.91 54.44 3koo h ALA 393 Cb 0.26 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 3koo h ALA 393 CO -0.26 0.70 -0.33 0.93 0.00 0.00 0.00 179.25 180.29 3koo h GLU 394 N 0.46 -0.34 -0.71 0.00 3.07 -1.86 0.65 114.58 115.85 3koo h GLU 394 Ca -0.01 0.02 0.15 0.00 -0.50 0.00 0.00 59.36 59.02 3koo h GLU 394 Cb 1.22 0.08 -0.11 0.00 -0.84 0.00 0.00 28.75 29.10 3koo h GLU 394 CO 0.12 -0.23 0.16 0.00 -1.40 0.00 0.00 179.01 177.67 3koo h ALA 395 N 0.51 0.90 -0.04 3.43 0.00 -1.33 0.04 119.26 122.77 3koo h ALA 395 Ca 0.12 0.17 -0.17 0.00 0.00 0.00 0.00 54.91 55.02 3koo h ALA 395 Cb 0.55 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3koo h ALA 395 CO -0.42 -0.34 -0.74 1.49 0.00 0.00 0.00 179.25 179.24 3koo h GLU 396 N 0.26 0.25 0.00 0.00 4.81 -1.09 -2.20 114.58 116.60 3koo h GLU 396 Ca 0.40 -0.22 -0.16 0.00 -0.13 0.00 0.00 59.36 59.25 3koo h GLU 396 Cb 0.67 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 3koo h GLU 396 CO -0.50 0.88 -1.08 -0.07 -0.73 0.00 0.00 179.01 177.51 3koo h LEU 397 N 0.16 0.00 0.00 1.64 3.38 -0.20 -3.28 115.31 117.02 3koo h LEU 397 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3koo h LEU 397 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 3koo h LEU 397 CO 0.12 0.63 -0.57 -0.62 0.09 0.00 0.00 178.44 178.09 3koo n GLU 398 N -3.06 0.25 0.26 1.13 1.02 -0.07 -4.26 120.64 115.91 3koo n GLU 398 Ca -0.05 0.08 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 3koo n GLU 398 Cb 0.83 -1.67 -0.07 0.00 -0.02 0.00 0.00 31.44 30.51 3koo n GLU 398 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 3koo h GLN 399 N 0.00 -0.75 -4.64 3.49 5.75 -1.46 -3.37 115.11 114.14 3koo h GLN 399 Ca 0.00 0.05 -0.68 0.00 -0.15 0.00 0.00 58.65 57.87 3koo h GLN 399 Cb 0.71 0.17 -0.36 0.00 1.07 0.00 0.00 27.48 29.07 3koo h GLN 399 CO 0.00 -0.50 -0.66 1.21 -2.65 0.00 0.00 178.83 176.23 3koo s ASN 400 N -3.58 4.95 0.04 -0.69 3.84 -1.26 -5.00 114.94 113.24 3koo s ASN 400 Ca -0.13 -1.90 -0.29 0.00 0.21 0.00 0.00 52.86 50.75 3koo s ASN 400 Cb 0.02 -1.71 -0.16 0.00 -0.55 0.00 0.00 41.25 38.85 3koo s ASN 400 CO 0.41 -0.41 1.36 -0.07 -2.79 0.00 0.00 177.10 175.60 3koo h LEU 401 N 7.85 -0.88 -0.61 3.21 3.38 -1.77 -1.13 115.31 125.36 3koo h LEU 401 Ca -0.11 0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.01 3koo h LEU 401 Cb 1.04 0.23 -0.10 0.00 0.09 0.00 0.00 40.66 41.92 3koo h LEU 401 CO 0.58 -0.60 0.03 -1.28 0.09 0.00 0.00 178.44 177.26 3koo h SER 402 N -1.11 -0.22 -0.40 -0.43 0.87 -1.94 -1.23 113.55 109.09 3koo h SER 402 Ca -0.11 0.14 0.08 0.00 -1.23 0.00 0.00 61.79 60.67 3koo h SER 402 Cb 0.80 0.25 -0.07 0.00 -0.44 0.00 0.00 62.40 62.94 3koo h SER 402 CO 0.18 -0.09 -0.03 -0.09 -0.53 0.00 0.00 176.83 176.26 3koo h ARG 403 N 0.14 0.07 -0.04 2.24 2.43 -1.84 -2.10 114.38 115.28 3koo h ARG 403 Ca 0.32 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.49 3koo h ARG 403 Cb 0.51 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 3koo h ARG 403 CO -0.50 0.05 -0.09 1.15 -1.51 0.00 0.00 179.97 179.07 3koo h THR 404 N 0.07 0.00 -0.31 0.20 2.02 0.03 0.12 112.91 115.04 3koo h THR 404 Ca 0.19 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.40 3koo h THR 404 Cb 0.28 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.67 3koo h THR 404 CO -0.35 0.00 0.15 -0.26 0.37 0.00 0.00 175.52 175.43 3koo h PHE 405 N -0.08 0.28 -0.82 3.16 0.04 -1.41 -0.39 116.94 117.71 3koo h PHE 405 Ca 0.01 0.01 0.20 0.00 2.80 0.00 0.00 57.97 60.99 3koo h PHE 405 Cb 0.10 -0.08 -0.13 0.00 2.20 0.00 0.00 35.95 38.04 3koo h PHE 405 CO -0.51 0.15 0.15 0.87 -0.60 0.00 0.00 178.31 178.37 3koo h LYS 406 N 0.31 0.18 -0.11 1.51 1.57 -1.37 0.20 116.57 118.86 3koo h LYS 406 Ca 0.13 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.78 3koo h LYS 406 Cb 0.05 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 3koo h LYS 406 CO -0.09 0.12 -0.46 0.77 -0.57 0.00 0.00 179.45 179.22 3koo h SER 407 N 0.18 0.28 0.03 0.86 0.02 0.60 -3.33 113.55 112.20 3koo h SER 407 Ca 0.49 -0.13 -0.21 0.00 -0.84 0.00 0.00 61.79 61.10 3koo h SER 407 Cb 0.93 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.37 3koo h SER 407 CO -0.64 0.70 -1.11 -0.07 -1.14 0.00 0.00 176.83 174.57 3koo h LEU 408 N 0.22 0.10 -8.18 5.07 3.38 -0.54 -3.42 115.31 111.94 3koo h LEU 408 Ca 0.01 -0.70 -0.36 0.00 0.09 0.00 0.00 57.88 56.93 3koo h LEU 408 Cb 0.89 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.55 3koo h LEU 408 CO 0.07 1.45 0.93 -0.36 0.09 0.00 0.00 178.44 180.62 3koo s PHE 409 N -2.37 1.97 -0.02 1.13 0.08 0.63 -4.91 117.98 114.49 3koo s PHE 409 Ca -0.25 0.31 -0.06 0.00 0.12 0.00 0.00 56.93 57.06 3koo s PHE 409 Cb 0.04 -4.17 0.00 0.00 -0.57 0.00 0.00 43.02 38.33 3koo s PHE 409 CO 0.66 -1.73 0.12 1.03 -0.10 0.00 0.00 175.22 175.20 3koo s ARG 410 N 6.55 0.35 1.27 0.44 0.52 -1.26 -4.62 118.95 122.19 3koo s ARG 410 Ca 0.65 -0.20 -0.16 0.00 -0.52 0.00 0.00 55.73 55.50 3koo s ARG 410 Cb -0.05 0.15 0.32 0.00 0.52 0.00 0.00 34.95 35.89 3koo s ARG 410 CO -0.01 -0.07 0.95 0.00 0.02 0.00 0.00 175.30 176.19 3koo n ALA 411 N 2.04 -3.65 -0.18 2.13 0.00 -1.26 -4.78 120.51 114.80 3koo n ALA 411 Ca -0.19 -1.43 -0.05 0.00 0.00 0.00 0.00 53.44 51.78 3koo n ALA 411 Cb 0.57 -1.88 -0.04 0.00 0.00 0.00 0.00 19.45 18.10 3koo n ALA 411 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3koo n SER 412 N -5.16 -0.46 -0.02 0.00 3.41 -1.26 -2.66 113.62 107.47 3koo n SER 412 Ca 0.05 1.19 0.12 0.00 -0.26 0.00 0.00 58.87 59.97 3koo n SER 412 Cb 0.56 -0.31 0.34 0.00 -0.26 0.00 0.00 64.21 64.53 3koo n SER 412 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3koo n ASP 413 N -3.98 0.44 0.00 4.04 5.68 -1.26 -3.40 116.55 118.06 3koo n ASP 413 Ca 0.01 -0.16 0.15 0.00 -0.50 0.00 0.00 54.79 54.29 3koo n ASP 413 Cb 0.11 0.10 0.85 0.00 -1.14 0.00 0.00 41.12 41.04 3koo n ASP 413 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3koo n GLU 414 N -1.43 0.75 -1.16 0.11 1.02 -1.09 -4.94 120.64 113.89 3koo n GLU 414 Ca 0.06 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.84 3koo n GLU 414 Cb 0.33 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 3koo n GLU 414 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3koo n SER 415 N -1.12 -2.97 -0.52 1.62 2.88 -1.22 -4.88 113.62 107.42 3koo n SER 415 Ca 0.20 0.67 0.00 0.00 -1.33 0.00 0.00 58.87 58.41 3koo n SER 415 Cb 0.16 -0.79 0.00 0.00 -0.75 0.00 0.00 64.21 62.83 3koo n SER 415 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3koo n VAL 416 N -1.14 0.00 -4.17 2.46 0.24 -1.26 -5.11 118.33 109.35 3koo n VAL 416 Ca 0.09 -0.02 -0.16 0.00 -2.04 0.00 0.00 64.34 62.21 3koo n VAL 416 Cb 0.40 0.44 -0.14 0.00 -1.47 0.00 0.00 33.84 33.07 3koo n VAL 416 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3koo s LEU 417 N 0.00 2.06 -0.73 1.34 1.02 -1.26 -4.49 118.68 116.62 3koo s LEU 417 Ca 0.01 -0.20 -0.01 0.00 0.02 0.00 0.00 54.13 53.94 3koo s LEU 417 Cb 0.01 -0.28 0.18 0.00 0.02 0.00 0.00 46.19 46.12 3koo s LEU 417 CO -0.00 0.02 0.57 -0.94 0.02 0.00 0.00 176.35 176.01 3koo s SER 418 N -0.45 5.42 0.00 2.29 1.04 -1.26 -4.96 113.70 115.77 3koo s SER 418 Ca -0.00 -3.31 0.00 0.00 0.48 0.00 0.00 55.95 53.12 3koo s SER 418 Cb -0.04 -1.84 0.00 0.00 0.10 0.00 0.00 66.02 64.24 3koo s SER 418 CO -0.00 -0.26 0.27 0.23 0.98 0.00 0.00 173.24 174.46 3koo n MET 419 N 2.85 0.51 -4.24 4.02 2.81 -1.26 -4.54 117.12 117.27 3koo n MET 419 Ca 0.14 0.00 -0.28 0.00 -1.81 0.00 0.00 57.70 55.75 3koo n MET 419 Cb 0.37 -1.25 -0.09 0.00 -0.71 0.00 0.00 33.22 31.53 3koo n MET 419 CO 0.00 0.00 0.00 -3.38 1.51 0.00 0.00 175.97 174.10 3koo s HIS 420 N -0.90 2.72 -0.02 2.03 -3.43 -1.26 -3.54 115.29 110.89 3koo s HIS 420 Ca 0.00 -0.18 0.00 0.00 -0.80 0.00 0.00 55.06 54.08 3koo s HIS 420 Cb 0.00 -1.37 0.00 0.00 -1.43 0.00 0.00 32.58 29.78 3koo s HIS 420 CO 0.00 0.47 0.00 1.63 -2.00 0.00 0.00 174.74 174.84 3koo n LYS 421 N 0.33 -0.77 -0.09 -0.38 5.02 -1.26 -4.93 118.16 116.09 3koo n LYS 421 Ca -0.12 0.21 -0.06 0.00 -2.02 0.00 0.00 58.31 56.32 3koo n LYS 421 Cb 0.54 -3.79 -0.00 0.00 -0.02 0.00 0.00 35.03 31.75 3koo n LYS 421 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3koo h VAL 422 N 0.00 0.65 0.18 -0.18 2.07 -1.80 0.57 116.25 117.74 3koo h VAL 422 Ca -0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3koo h VAL 422 Cb 0.39 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 3koo h VAL 422 CO 0.01 0.00 -0.29 0.00 0.02 0.00 0.00 177.57 177.31 3koo h GLU 424 N -0.54 0.87 -0.01 0.00 4.81 -1.88 -1.13 114.58 116.70 3koo h GLU 424 Ca 0.02 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3koo h GLU 424 Cb 0.54 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 3koo h GLU 424 CO -0.13 0.58 0.01 0.00 -0.73 0.00 0.00 179.01 178.74 3koo h ALA 425 N 1.41 1.60 0.00 2.92 0.00 -0.57 -3.46 119.26 121.16 3koo h ALA 425 Ca 0.37 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3koo h ALA 425 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3koo h ALA 425 CO -0.19 -0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.45 3koo n GLY 426 N -1.35 0.82 0.00 0.00 0.00 -0.43 -4.94 105.19 99.29 3koo n GLY 426 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3koo n GLY 426 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3koo n GLY 427 N -2.35 -1.57 0.14 -0.02 0.00 -1.10 -5.00 105.19 95.29 3koo n GLY 427 Ca 0.00 -1.06 -0.28 0.00 0.00 0.00 0.00 46.02 44.68 3koo n GLY 427 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3koo n LEU 428 N 0.00 2.05 -1.81 0.99 -0.00 -1.26 -4.38 117.00 112.59 3koo n LEU 428 Ca 0.00 0.30 -0.10 0.00 -0.00 0.00 0.00 56.01 56.21 3koo n LEU 428 Cb 0.00 -0.84 0.20 0.00 -0.00 0.00 0.00 43.42 42.78 3koo n LEU 428 CO 0.00 0.60 0.97 0.49 -0.00 0.00 0.00 177.39 179.45 3koo n PHE 429 N -4.16 2.09 -0.22 1.96 3.01 -1.26 -4.66 117.46 114.22 3koo n PHE 429 Ca -0.53 -1.20 0.02 0.00 1.01 0.00 0.00 57.45 56.76 3koo n PHE 429 Cb 0.89 -0.66 0.12 0.00 -0.01 0.00 0.00 39.48 39.82 3koo n PHE 429 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3koo h VAL 430 N 1.54 0.45 -0.46 -4.37 2.07 -1.92 -2.39 116.25 111.17 3koo h VAL 430 Ca 0.32 -0.04 -0.21 0.00 0.82 0.00 0.00 66.70 67.60 3koo h VAL 430 Cb 2.16 0.33 -0.12 0.00 -1.52 0.00 0.00 31.29 32.13 3koo h VAL 430 CO 0.69 0.02 0.06 0.59 0.02 0.00 0.00 177.57 178.95 3koo n ASN 431 N -5.30 3.01 -4.71 0.57 3.02 -1.26 -4.99 115.26 105.61 3koo n ASN 431 Ca 0.10 -3.60 -0.25 0.00 -0.03 0.00 0.00 54.58 50.80 3koo n ASN 431 Cb 0.38 -0.66 -0.08 0.00 -0.61 0.00 0.00 39.78 38.82 3koo n ASN 431 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3koo s SER 432 N -2.18 4.38 0.49 6.41 1.04 -0.90 -4.97 113.70 117.97 3koo s SER 432 Ca 0.47 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.88 3koo s SER 432 Cb 0.41 -0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.00 3koo s SER 432 CO 0.04 -0.42 0.00 -2.65 0.98 0.00 0.00 173.24 171.19 3koo n PRO 433 N -1.14 -0.25 0.00 4.02 -0.02 -1.26 -4.99 135.00 131.36 3koo n PRO 433 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 3koo n PRO 433 Cb 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.12 3koo n PRO 433 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3koo n GLU 434 N -0.87 1.00 -0.30 -0.52 1.02 -1.26 -4.77 120.64 114.94 3koo n GLU 434 Ca 0.00 -0.02 0.08 0.00 -0.02 0.00 0.00 57.16 57.20 3koo n GLU 434 Cb 0.00 -0.18 0.18 0.00 -0.02 0.00 0.00 31.44 31.41 3koo n GLU 434 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3koo n GLU 435 N -0.15 1.65 -1.26 3.49 4.71 -1.26 -4.80 120.64 123.03 3koo n GLU 435 Ca 0.00 -2.82 -0.45 0.00 -0.01 0.00 0.00 57.16 53.88 3koo n GLU 435 Cb 0.04 -1.61 -0.04 0.00 -1.01 0.00 0.00 31.44 28.82 3koo n GLU 435 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 3koo n PRO 436 N -1.20 0.00 -0.95 3.49 -0.02 -1.26 -4.90 135.00 130.16 3koo n PRO 436 Ca 0.19 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.37 3koo n PRO 436 Cb 0.72 -1.02 0.17 0.00 -0.02 0.00 0.00 33.50 33.35 3koo n PRO 436 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3koo s SER 437 N -0.59 2.78 -0.25 2.55 1.04 -1.26 -4.98 113.70 112.98 3koo s SER 437 Ca 0.64 1.64 -0.16 0.00 0.48 0.00 0.00 55.95 58.54 3koo s SER 437 Cb -0.91 -2.28 -0.03 0.00 0.10 0.00 0.00 66.02 62.89 3koo s SER 437 CO 0.49 -3.10 0.44 -0.22 0.98 0.00 0.00 173.24 171.83 3koo s LEU 438 N -6.53 4.07 0.90 2.42 2.96 -1.26 -4.92 118.68 116.32 3koo s LEU 438 Ca 0.65 0.43 -0.13 0.00 -0.22 0.00 0.00 54.13 54.86 3koo s LEU 438 Cb -0.21 -2.54 0.04 0.00 0.50 0.00 0.00 46.19 43.98 3koo s LEU 438 CO 0.59 -0.21 0.53 -0.24 -1.32 0.00 0.00 176.35 175.70 3koo n SER 439 N 5.25 -1.57 -0.00 3.68 2.88 -1.26 -4.93 113.62 117.67 3koo n SER 439 Ca -0.07 0.39 -0.03 0.00 -1.33 0.00 0.00 58.87 57.84 3koo n SER 439 Cb 0.50 -1.25 0.22 0.00 -0.75 0.00 0.00 64.21 62.93 3koo n SER 439 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 3koo h ARG 440 N -1.36 0.52 -0.51 -1.46 0.11 -1.97 -3.15 114.38 106.55 3koo h ARG 440 Ca -0.44 -0.17 0.01 0.00 0.10 0.00 0.00 59.98 59.48 3koo h ARG 440 Cb 1.29 -0.05 -0.03 0.00 1.11 0.00 0.00 29.97 32.30 3koo h ARG 440 CO 0.37 0.67 0.34 0.52 0.10 0.00 0.00 179.97 181.97 3koo h MET 441 N 0.47 0.67 -6.20 0.08 2.86 -1.91 -3.43 114.93 107.47 3koo h MET 441 Ca 0.08 -0.04 -0.63 0.00 -2.06 0.00 0.00 59.70 57.05 3koo h MET 441 Cb 0.57 -0.15 -0.29 0.00 0.06 0.00 0.00 31.60 31.79 3koo h MET 441 CO 0.04 0.44 -0.86 0.14 1.06 0.00 0.00 176.91 177.73 3koo s VAL 442 N -5.60 1.76 0.81 -2.22 -7.23 -1.19 -4.97 120.40 101.76 3koo s VAL 442 Ca -0.09 -1.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.96 3koo s VAL 442 Cb 0.18 -1.47 0.08 0.00 0.56 0.00 0.00 36.38 35.73 3koo s VAL 442 CO 0.75 0.45 1.17 0.42 -0.31 0.00 0.00 175.10 177.58 3koo s THR 443 N -0.56 2.07 0.42 5.32 -4.23 -1.26 -4.52 115.64 112.87 3koo s THR 443 Ca 0.09 0.02 0.22 0.00 -1.18 0.00 0.00 61.69 60.83 3koo s THR 443 Cb -0.09 -3.00 0.24 0.00 1.34 0.00 0.00 72.50 70.99 3koo s THR 443 CO -0.00 -0.03 2.02 -0.08 -0.54 0.00 0.00 174.62 175.99 3koo h GLU 444 N -1.07 0.00 0.00 3.99 4.57 -1.99 -2.54 114.58 117.54 3koo h GLU 444 Ca -0.46 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 57.62 3koo h GLU 444 Cb 1.33 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.90 3koo h GLU 444 CO 0.66 0.16 -0.67 0.93 -1.18 0.00 0.00 179.01 178.91 3koo h GLU 445 N 0.00 0.00 0.00 1.92 3.07 -2.00 -2.55 114.58 115.02 3koo h GLU 445 Ca -0.00 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.77 3koo h GLU 445 Cb 0.36 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.26 3koo h GLU 445 CO 0.02 0.37 -0.43 0.93 -1.40 0.00 0.00 179.01 178.50 3koo h GLU 446 N 0.00 0.00 0.25 2.33 5.08 -1.86 -3.06 114.58 117.32 3koo h GLU 446 Ca -0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3koo h GLU 446 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 3koo h GLU 446 CO 0.05 0.43 -0.12 0.82 -1.00 0.00 0.00 179.01 179.19 3koo h ILE 447 N 0.00 0.00 -1.60 3.13 1.08 -1.42 -3.31 117.51 115.39 3koo h ILE 447 Ca -0.00 -0.25 0.51 0.00 -0.39 0.00 0.00 64.86 64.73 3koo h ILE 447 Cb 1.32 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.95 3koo h ILE 447 CO 0.06 0.00 1.08 1.56 -0.69 0.00 0.00 178.15 180.16 3koo h GLN 448 N -0.58 0.01 0.66 2.37 1.08 -1.57 0.13 115.11 117.20 3koo h GLN 448 Ca -0.03 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.14 3koo h GLN 448 Cb 0.26 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 3koo h GLN 448 CO 0.06 0.00 -0.47 0.35 -0.95 0.00 0.00 178.83 177.82 3koo h PHE 449 N 0.01 -1.26 -0.90 2.96 3.57 -1.62 0.06 116.94 119.77 3koo h PHE 449 Ca 0.90 -0.01 0.21 0.00 3.53 0.00 0.00 57.97 62.61 3koo h PHE 449 Cb 3.17 0.46 -0.12 0.00 2.79 0.00 0.00 35.95 42.26 3koo h PHE 449 CO -0.00 -0.68 0.41 1.88 -2.23 0.00 0.00 178.31 177.70 3koo h TYR 450 N -1.08 0.69 -0.33 0.41 -1.99 -0.86 -0.10 116.97 113.71 3koo h TYR 450 Ca -0.08 0.04 0.07 0.00 2.00 0.00 0.00 58.73 60.76 3koo h TYR 450 Cb 0.89 -0.17 -0.07 0.00 2.00 0.00 0.00 36.73 39.38 3koo h TYR 450 CO -0.15 -0.01 -0.16 0.28 -0.00 0.00 0.00 178.16 178.11 3koo h VAL 451 N 0.44 0.51 -0.36 -2.88 2.07 -0.75 -2.65 116.25 112.62 3koo h VAL 451 Ca 0.56 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.99 3koo h VAL 451 Cb 1.03 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 3koo h VAL 451 CO -0.51 0.00 -0.15 0.06 0.02 0.00 0.00 177.57 177.00 3koo h GLN 452 N -0.11 0.64 -0.97 1.57 3.07 0.85 -2.88 115.11 117.28 3koo h GLN 452 Ca 0.17 -0.21 0.06 0.00 0.09 0.00 0.00 58.65 58.76 3koo h GLN 452 Cb 0.37 -0.05 -0.06 0.00 0.08 0.00 0.00 27.48 27.81 3koo h GLN 452 CO -0.40 0.76 0.63 1.96 0.09 0.00 0.00 178.83 181.87 3koo h GLN 453 N 0.58 1.10 0.00 0.06 1.08 -1.03 -2.86 115.11 114.03 3koo h GLN 453 Ca 0.10 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 3koo h GLN 453 Cb 0.58 -0.25 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 3koo h GLN 453 CO 0.04 0.72 -0.36 1.19 -0.95 0.00 0.00 178.83 179.47 3koo n PHE 454 N -4.49 0.14 0.31 2.96 3.01 -1.10 -2.97 117.46 115.32 3koo n PHE 454 Ca 0.15 0.04 0.19 0.00 1.01 0.00 0.00 57.45 58.84 3koo n PHE 454 Cb 0.19 -0.42 0.93 0.00 -0.01 0.00 0.00 39.48 40.17 3koo n PHE 454 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 3koo h LYS 455 N 0.00 0.00 0.00 -1.08 1.57 -1.42 -1.24 116.57 114.40 3koo h LYS 455 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3koo h LYS 455 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 3koo h LYS 455 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 179.45 180.05 3koo n LYS 456 N -3.00 0.00 0.00 3.15 0.00 -1.16 -4.57 118.16 112.58 3koo n LYS 456 Ca -0.01 0.22 0.12 0.00 0.00 0.00 0.00 58.31 58.65 3koo n LYS 456 Cb 0.17 -0.90 0.20 0.00 0.00 0.00 0.00 35.03 34.50 3koo n LYS 456 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 3koo n SER 457 N -1.17 1.90 -0.16 3.14 7.64 -1.23 -5.06 113.62 118.68 3koo n SER 457 Ca 0.00 -1.46 0.00 0.00 1.01 0.00 0.00 58.87 58.42 3koo n SER 457 Cb 0.00 0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.42 3koo n SER 457 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3koo n GLY 458 N 1.35 0.06 0.10 0.23 0.00 -0.47 -4.37 105.19 102.09 3koo n GLY 458 Ca 0.12 -0.97 0.09 0.00 0.00 0.00 0.00 46.02 45.26 3koo n GLY 458 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3koo n PHE 459 N -0.32 0.00 -0.05 1.61 3.01 -1.26 -4.63 117.46 115.83 3koo n PHE 459 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.37 3koo n PHE 459 Cb 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.41 3koo n PHE 459 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 3koo h ARG 460 N 0.47 -0.28 -0.24 -1.08 2.43 -1.94 -1.48 114.38 112.27 3koo h ARG 460 Ca 0.00 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.22 3koo h ARG 460 Cb 0.48 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.03 3koo h ARG 460 CO 0.00 -0.18 -0.48 0.78 -1.51 0.00 0.00 179.97 178.58 3koo h GLY 461 N -0.29 -1.15 0.45 2.80 0.00 -1.82 -1.02 103.07 102.05 3koo h GLY 461 Ca 0.03 0.71 0.11 0.00 0.00 0.00 0.00 47.33 48.18 3koo h GLY 461 CO -0.31 -0.23 0.49 -2.55 0.00 0.00 0.00 176.54 173.95 3koo h PRO 462 N -0.42 0.77 0.00 4.80 0.11 -1.74 0.67 132.00 136.19 3koo h PRO 462 Ca 0.05 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3koo h PRO 462 Cb 0.55 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.49 3koo h PRO 462 CO -0.45 0.51 0.00 -0.07 -0.21 0.00 0.00 178.00 177.78 3koo h LEU 463 N 0.79 0.00 -0.61 2.35 3.38 -0.76 -2.78 115.31 117.68 3koo h LEU 463 Ca 0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.40 3koo h LEU 463 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3koo h LEU 463 CO -0.27 0.00 0.00 0.78 0.09 0.00 0.00 178.44 179.04 3koo h ASN 464 N 0.00 0.00 -0.62 -0.43 2.35 0.47 -2.86 115.58 114.50 3koo h ASN 464 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 3koo h ASN 464 Cb 0.39 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.73 3koo h ASN 464 CO 0.00 0.00 0.25 -0.50 -1.65 0.00 0.00 177.43 175.53 3koo h TRP 465 N 0.00 0.97 0.00 1.19 4.06 -1.52 -0.68 115.95 119.97 3koo h TRP 465 Ca 0.00 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.89 3koo h TRP 465 Cb 0.59 -0.30 0.00 0.00 -1.00 0.00 0.00 29.16 28.46 3koo h TRP 465 CO 0.00 0.75 0.00 0.66 -3.56 0.00 0.00 178.44 176.29 3koo n TYR 466 N -4.30 0.00 -0.62 0.49 4.01 -1.08 -3.82 117.16 111.84 3koo n TYR 466 Ca 0.06 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.88 3koo n TYR 466 Cb 0.18 -0.30 0.30 0.00 -0.31 0.00 0.00 39.34 39.21 3koo n TYR 466 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3koo n ARG 467 N -1.30 3.46 -4.14 -0.72 1.74 -0.26 -4.79 116.66 110.65 3koo n ARG 467 Ca 0.10 -2.73 -0.17 0.00 -0.77 0.00 0.00 57.85 54.28 3koo n ARG 467 Cb 0.19 -1.78 -0.15 0.00 -1.02 0.00 0.00 32.46 29.70 3koo n ARG 467 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3koo s ASN 468 N -1.12 0.68 0.24 0.55 0.01 -1.24 -4.84 114.94 109.22 3koo s ASN 468 Ca 0.44 -0.10 0.00 0.00 -0.71 0.00 0.00 52.86 52.50 3koo s ASN 468 Cb 0.29 -0.20 0.00 0.00 0.41 0.00 0.00 41.25 41.76 3koo s ASN 468 CO 0.20 0.01 0.00 0.23 -1.51 0.00 0.00 177.10 176.03 3koo n MET 469 N 3.43 0.00 -0.34 -0.60 2.81 -1.26 -4.58 117.12 116.58 3koo n MET 469 Ca -0.19 0.00 0.19 0.00 -1.81 0.00 0.00 57.70 55.89 3koo n MET 469 Cb 0.55 0.00 0.41 0.00 -0.71 0.00 0.00 33.22 33.46 3koo n MET 469 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 3koo h GLU 470 N 0.00 0.50 0.00 0.03 4.57 -1.98 0.56 114.58 118.26 3koo h GLU 470 Ca 0.00 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.12 3koo h GLU 470 Cb 0.00 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 28.47 3koo h GLU 470 CO 0.00 0.33 -0.15 -0.09 -1.18 0.00 0.00 179.01 177.92 3koo h ARG 471 N 0.51 0.00 0.10 1.92 2.43 -1.95 -2.77 114.38 114.62 3koo h ARG 471 Ca 0.66 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.85 3koo h ARG 471 Cb 1.33 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.84 3koo h ARG 471 CO -0.51 0.81 -0.47 -0.91 -1.51 0.00 0.00 179.97 177.39 3koo h ASN 472 N -1.00 -1.40 -0.90 -3.80 2.35 -1.78 -0.70 115.58 108.34 3koo h ASN 472 Ca -0.04 0.15 0.15 0.00 -0.55 0.00 0.00 56.30 56.01 3koo h ASN 472 Cb 0.86 0.52 -0.15 0.00 0.05 0.00 0.00 38.32 39.60 3koo h ASN 472 CO -0.02 -0.49 -0.36 -0.25 -1.65 0.00 0.00 177.43 174.66 3koo h TRP 473 N -0.66 -0.99 -0.25 1.19 7.01 -0.01 0.56 115.95 122.80 3koo h TRP 473 Ca -0.00 0.10 0.04 0.00 2.11 0.00 0.00 58.89 61.13 3koo h TRP 473 Cb 0.66 0.57 -0.04 0.00 -2.10 0.00 0.00 29.16 28.25 3koo h TRP 473 CO -0.44 -0.40 0.02 0.87 -2.79 0.00 0.00 178.44 175.70 3koo h LYS 474 N -0.04 0.10 -0.99 2.65 1.57 -1.16 -0.30 116.57 118.40 3koo h LYS 474 Ca 0.33 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.18 3koo h LYS 474 Cb 0.60 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.81 3koo h LYS 474 CO -0.92 0.07 0.64 2.35 -0.57 0.00 0.00 179.45 181.02 3koo h TRP 475 N 0.10 1.18 0.00 -1.35 7.01 0.68 -2.57 115.95 121.00 3koo h TRP 475 Ca 0.12 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.13 3koo h TRP 475 Cb 0.14 -0.39 -0.00 0.00 -2.10 0.00 0.00 29.16 26.81 3koo h TRP 475 CO -0.18 0.59 -0.10 0.00 -2.79 0.00 0.00 178.44 175.96 3koo h ALA 476 N 1.46 1.06 -0.43 2.65 0.00 0.16 -3.02 119.26 121.14 3koo h ALA 476 Ca 0.44 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 55.11 3koo h ALA 476 Cb 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3koo h ALA 476 CO -0.18 0.13 -0.30 0.00 0.00 0.00 0.00 179.25 178.89 3koo h LYS 478 N 0.80 0.38 -0.42 0.00 1.57 -1.63 0.36 116.57 117.63 3koo h LYS 478 Ca 0.09 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3koo h LYS 478 Cb 0.88 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.11 3koo h LYS 478 CO 0.08 0.25 0.00 -1.13 -0.57 0.00 0.00 179.45 178.08 3koo n SER 479 N -4.69 2.00 0.11 0.86 3.41 -1.12 -3.97 113.62 110.22 3koo n SER 479 Ca 0.27 -2.08 0.10 0.00 -0.26 0.00 0.00 58.87 56.90 3koo n SER 479 Cb 0.91 -0.29 0.46 0.00 -0.26 0.00 0.00 64.21 65.03 3koo n SER 479 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3koo n LEU 480 N 0.42 0.50 0.16 1.04 4.77 0.12 -1.61 117.00 122.40 3koo n LEU 480 Ca 0.11 0.65 0.07 0.00 -0.03 0.00 0.00 56.01 56.82 3koo n LEU 480 Cb 0.35 -0.62 0.07 0.00 -2.33 0.00 0.00 43.42 40.89 3koo n LEU 480 CO 0.09 -0.61 0.48 1.23 -1.33 0.00 0.00 177.39 177.25 3koo h GLY 481 N 1.59 0.00 -2.15 -0.72 0.00 -1.80 -3.48 103.07 96.51 3koo h GLY 481 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 3koo h GLY 481 CO 0.00 0.00 0.09 0.50 0.00 0.00 0.00 176.54 177.13 3koo s ARG 482 N -3.11 3.57 0.04 4.80 0.52 -0.63 -5.11 118.95 119.03 3koo s ARG 482 Ca 0.04 0.21 0.07 0.00 -0.52 0.00 0.00 55.73 55.53 3koo s ARG 482 Cb 0.07 -2.40 -0.02 0.00 0.52 0.00 0.00 34.95 33.12 3koo s ARG 482 CO 0.73 -0.16 -0.20 0.15 0.02 0.00 0.00 175.30 175.84 3koo s LYS 483 N -4.56 1.39 -0.29 3.54 1.02 -1.26 -5.05 119.74 114.52 3koo s LYS 483 Ca 0.47 -0.92 -0.24 0.00 0.02 0.00 0.00 55.97 55.30 3koo s LYS 483 Cb -0.10 -1.49 0.00 0.00 -0.52 0.00 0.00 37.83 35.72 3koo s LYS 483 CO 0.42 0.38 0.84 0.42 -0.92 0.00 0.00 175.35 176.49 3koo s ILE 484 N -0.79 4.77 0.00 2.17 1.01 -1.02 -4.90 121.20 122.45 3koo s ILE 484 Ca 0.07 1.36 0.00 0.00 0.00 0.00 0.00 60.65 62.08 3koo s ILE 484 Cb -0.09 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.21 3koo s ILE 484 CO 0.02 -0.23 0.40 0.18 0.00 0.00 0.00 174.94 175.30 3koo n LEU 485 N 6.23 0.80 -4.84 2.97 4.77 -1.26 -4.26 117.00 121.41 3koo n LEU 485 Ca 0.05 -0.86 -0.29 0.00 -0.03 0.00 0.00 56.01 54.89 3koo n LEU 485 Cb 0.48 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.69 3koo n LEU 485 CO 0.51 0.20 0.75 0.27 -1.33 0.00 0.00 177.39 177.79 3koo s ILE 486 N -0.12 1.99 -0.03 -0.08 -4.36 -1.26 -4.98 121.20 112.36 3koo s ILE 486 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 60.65 60.09 3koo s ILE 486 Cb 0.00 -2.86 -0.05 0.00 1.25 0.00 0.00 42.46 40.80 3koo s ILE 486 CO 0.00 0.00 1.38 -2.84 0.24 0.00 0.00 174.94 173.72 3koo s PRO 487 N -5.44 4.27 0.15 0.37 0.02 -1.26 -4.95 135.00 128.16 3koo s PRO 487 Ca 0.64 1.91 0.07 0.00 0.02 0.00 0.00 61.00 63.64 3koo s PRO 487 Cb -0.12 -3.64 -0.04 0.00 0.02 0.00 0.00 34.50 30.72 3koo s PRO 487 CO 0.52 -0.60 -0.15 0.00 -0.33 0.00 0.00 177.00 176.44 3koo s ALA 488 N 2.68 1.69 -0.04 -1.55 0.00 -1.26 -1.88 121.76 121.39 3koo s ALA 488 Ca 0.63 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 51.16 3koo s ALA 488 Cb -0.29 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 22.77 3koo s ALA 488 CO 0.25 0.10 -0.01 -1.17 0.00 0.00 0.00 175.76 174.93 3koo s LEU 489 N -2.74 1.02 -0.21 0.00 0.20 -0.99 -1.87 118.68 114.08 3koo s LEU 489 Ca 0.14 -0.07 -0.03 0.00 0.69 0.00 0.00 54.13 54.86 3koo s LEU 489 Cb -0.03 -0.34 -0.00 0.00 -0.43 0.00 0.00 46.19 45.38 3koo s LEU 489 CO 0.04 -0.12 -0.07 -0.32 -0.29 0.00 0.00 176.35 175.59 3koo s MET 490 N 1.29 3.32 -0.22 1.98 -2.45 -0.35 -2.04 119.30 120.83 3koo s MET 490 Ca -0.06 -0.66 -0.02 0.00 -1.25 0.00 0.00 55.69 53.70 3koo s MET 490 Cb -0.13 -2.93 0.01 0.00 1.25 0.00 0.00 34.83 33.02 3koo s MET 490 CO -0.02 -0.18 -0.08 0.08 1.05 0.00 0.00 175.02 175.86 3koo s VAL 491 N 1.41 2.97 0.21 10.11 1.01 -0.88 -0.54 120.40 134.69 3koo s VAL 491 Ca 0.05 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 3koo s VAL 491 Cb -0.14 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 3koo s VAL 491 CO -0.04 0.40 0.40 0.42 0.00 0.00 0.00 175.10 176.28 3koo s THR 492 N 1.40 5.19 -0.02 3.92 -4.23 0.48 -0.33 115.64 122.05 3koo s THR 492 Ca 0.04 -0.34 0.06 0.00 -1.18 0.00 0.00 61.69 60.28 3koo s THR 492 Cb -0.14 -3.74 -0.02 0.00 1.34 0.00 0.00 72.50 69.94 3koo s THR 492 CO -0.06 -0.19 -0.21 0.00 -0.54 0.00 0.00 174.62 173.62 3koo s ALA 493 N -1.89 2.37 -0.00 3.99 0.00 -1.26 -1.58 121.76 123.39 3koo s ALA 493 Ca 0.39 -1.09 -0.24 0.00 0.00 0.00 0.00 51.96 51.02 3koo s ALA 493 Cb -0.11 -0.70 -0.15 0.00 0.00 0.00 0.00 23.12 22.16 3koo s ALA 493 CO 0.29 0.54 1.08 1.49 0.00 0.00 0.00 175.76 179.16 3koo h GLU 494 N 5.32 -0.51 -1.73 0.00 4.81 -1.29 -3.34 114.58 117.83 3koo h GLU 494 Ca -0.45 0.04 -0.63 0.00 -0.13 0.00 0.00 59.36 58.18 3koo h GLU 494 Cb 1.14 0.12 -0.24 0.00 0.63 0.00 0.00 28.75 30.40 3koo h GLU 494 CO 0.48 -0.20 0.78 1.63 -0.73 0.00 0.00 179.01 180.97 3koo n LYS 495 N -5.17 2.54 -3.62 1.92 4.76 0.18 -4.75 118.16 114.02 3koo n LYS 495 Ca -0.09 -2.96 -0.39 0.00 -2.87 0.00 0.00 58.31 52.00 3koo n LYS 495 Cb 0.28 -2.17 -0.09 0.00 -1.84 0.00 0.00 35.03 31.21 3koo n LYS 495 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3koo s ASP 496 N -0.74 5.56 0.28 4.39 -1.08 -1.25 -4.16 116.67 119.67 3koo s ASP 496 Ca 0.54 -1.98 -0.03 0.00 -0.52 0.00 0.00 52.55 50.57 3koo s ASP 496 Cb 0.42 -1.95 0.39 0.00 -1.46 0.00 0.00 42.92 40.31 3koo s ASP 496 CO -0.24 -0.64 1.92 -0.26 0.52 0.00 0.00 175.17 176.47 3koo h PHE 497 N 8.29 1.04 0.15 -5.34 -1.00 -1.94 -2.87 116.94 115.28 3koo h PHE 497 Ca -0.18 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.58 3koo h PHE 497 Cb 1.06 -0.34 0.00 0.00 3.61 0.00 0.00 35.95 40.28 3koo h PHE 497 CO 0.62 0.71 -0.07 0.28 -1.61 0.00 0.00 178.31 178.23 3koo h VAL 498 N 1.08 0.00 -3.11 -0.55 2.07 -1.93 -3.38 116.25 110.43 3koo h VAL 498 Ca 0.28 -0.84 -0.77 0.00 0.82 0.00 0.00 66.70 66.19 3koo h VAL 498 Cb -0.01 0.00 -0.24 0.00 -1.52 0.00 0.00 31.29 29.52 3koo h VAL 498 CO -0.05 0.00 0.68 -0.76 0.02 0.00 0.00 177.57 177.46 3koo s LEU 499 N -8.70 5.94 0.40 2.57 1.43 -1.24 -5.05 118.68 114.02 3koo s LEU 499 Ca -0.03 -3.14 -0.23 0.00 -1.03 0.00 0.00 54.13 49.70 3koo s LEU 499 Cb 0.00 -2.28 -0.10 0.00 0.03 0.00 0.00 46.19 43.84 3koo s LEU 499 CO 0.09 -0.53 0.97 -0.69 0.23 0.00 0.00 176.35 176.42 3koo s VAL 500 N 0.12 4.19 0.61 -1.59 1.01 -1.08 -4.60 120.40 119.06 3koo s VAL 500 Ca 0.32 1.54 0.29 0.00 0.00 0.00 0.00 61.98 64.13 3koo s VAL 500 Cb -0.08 -3.73 0.35 0.00 0.00 0.00 0.00 36.38 32.93 3koo s VAL 500 CO -0.06 -0.12 1.91 -0.65 0.00 0.00 0.00 175.10 176.17 3koo h PRO 501 N 2.36 0.00 0.00 2.72 0.11 -1.83 -2.63 132.00 132.73 3koo h PRO 501 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3koo h PRO 501 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3koo h PRO 501 CO 0.62 0.00 -0.10 0.00 -0.21 0.00 0.00 178.00 178.31 3koo n GLN 502 N -3.45 0.10 0.23 1.05 10.64 -1.26 -2.87 117.38 121.81 3koo n GLN 502 Ca 0.05 0.07 0.11 0.00 -1.83 0.00 0.00 57.00 55.39 3koo n GLN 502 Cb 0.56 -1.60 0.48 0.00 -0.86 0.00 0.00 30.24 28.81 3koo n GLN 502 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.06 175.75 3koo h MET 503 N 0.00 0.00 0.00 2.61 2.86 -1.87 -2.81 114.93 115.73 3koo h MET 503 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3koo h MET 503 Cb 0.59 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.25 3koo h MET 503 CO 0.00 0.20 -0.34 -1.13 1.06 0.00 0.00 176.91 176.71 3koo n SER 504 N -3.37 0.46 -0.40 1.22 3.41 -1.14 -4.21 113.62 109.59 3koo n SER 504 Ca 0.00 0.15 0.34 0.00 -0.26 0.00 0.00 58.87 59.10 3koo n SER 504 Cb 0.42 -0.10 0.57 0.00 -0.26 0.00 0.00 64.21 64.83 3koo n SER 504 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 3koo n GLN 505 N -1.75 -0.03 -0.02 4.33 7.27 -1.06 -0.63 117.38 125.49 3koo n GLN 505 Ca 0.05 1.04 0.12 0.00 0.07 0.00 0.00 57.00 58.29 3koo n GLN 505 Cb 0.38 -2.06 0.14 0.00 2.41 0.00 0.00 30.24 31.11 3koo n GLN 505 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 3koo n HIS 506 N -4.36 0.05 0.31 3.69 8.25 -1.26 -4.49 115.22 117.42 3koo n HIS 506 Ca 0.34 -0.02 0.19 0.00 -0.26 0.00 0.00 57.72 57.96 3koo n HIS 506 Cb 1.31 0.00 1.04 0.00 1.12 0.00 0.00 29.99 33.47 3koo n HIS 506 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3koo h MET 507 N 4.50 0.00 -0.31 -0.41 2.86 -1.13 -2.00 114.93 118.44 3koo h MET 507 Ca 0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 3koo h MET 507 Cb 0.96 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.60 3koo h MET 507 CO 0.00 0.01 -0.10 0.93 1.06 0.00 0.00 176.91 178.81 3koo h GLU 508 N 0.00 0.52 0.00 1.72 4.39 -1.79 -0.03 114.58 119.39 3koo h GLU 508 Ca -0.00 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.56 3koo h GLU 508 Cb 0.07 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 3koo h GLU 508 CO 0.00 0.62 0.09 -0.44 -1.16 0.00 0.00 179.01 178.13 3koo h ASP 509 N 0.48 0.00 0.00 1.42 5.19 -1.70 -3.19 116.42 118.62 3koo h ASP 509 Ca 0.09 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.38 3koo h ASP 509 Cb 0.47 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.96 3koo h ASP 509 CO 0.03 0.00 -1.47 0.79 -3.12 0.00 0.00 179.24 175.47 3koo n TRP 510 N -2.58 0.00 -3.77 4.55 7.02 -0.45 -4.86 117.44 117.34 3koo n TRP 510 Ca -0.02 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.17 3koo n TRP 510 Cb 0.14 -0.33 -0.12 0.00 -2.42 0.00 0.00 31.31 28.58 3koo n TRP 510 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3koo s ILE 511 N -2.17 1.99 0.18 -0.99 1.01 -0.15 -2.42 121.20 118.66 3koo s ILE 511 Ca -0.07 -3.34 -0.19 0.00 0.00 0.00 0.00 60.65 57.05 3koo s ILE 511 Cb 0.02 -2.35 0.13 0.00 0.01 0.00 0.00 42.46 40.27 3koo s ILE 511 CO 0.24 -0.97 1.61 -0.65 0.00 0.00 0.00 174.94 175.17 3koo h PRO 512 N 6.03 -0.14 -1.98 2.79 0.11 -1.74 -1.82 132.00 135.25 3koo h PRO 512 Ca 0.08 0.01 -0.75 0.00 0.11 0.00 0.00 66.00 65.45 3koo h PRO 512 Cb 0.85 0.03 -0.29 0.00 0.11 0.00 0.00 31.00 31.71 3koo h PRO 512 CO 0.59 -0.09 0.84 0.72 -0.21 0.00 0.00 178.00 179.85 3koo n HIS 513 N -5.42 3.02 -2.28 0.65 8.25 -1.26 -4.97 115.22 113.21 3koo n HIS 513 Ca 0.04 -2.46 -0.42 0.00 -0.26 0.00 0.00 57.72 54.61 3koo n HIS 513 Cb 0.33 -1.06 -0.03 0.00 1.12 0.00 0.00 29.99 30.35 3koo n HIS 513 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3koo s LEU 514 N -4.04 4.31 0.39 2.41 1.98 -0.69 -4.52 118.68 118.52 3koo s LEU 514 Ca 0.50 2.04 -0.09 0.00 -2.89 0.00 0.00 54.13 53.70 3koo s LEU 514 Cb 0.41 -3.56 -0.06 0.00 0.66 0.00 0.00 46.19 43.64 3koo s LEU 514 CO -0.36 -0.68 0.73 -0.54 -1.89 0.00 0.00 176.35 173.61 3koo s LYS 515 N 2.28 3.73 -0.02 1.98 -0.14 -0.78 -4.97 119.74 121.81 3koo s LYS 515 Ca 0.62 0.35 0.03 0.00 -1.36 0.00 0.00 55.97 55.61 3koo s LYS 515 Cb -0.30 -2.44 -0.00 0.00 -1.68 0.00 0.00 37.83 33.41 3koo s LYS 515 CO 0.26 -0.00 -0.11 1.03 -0.76 0.00 0.00 175.35 175.76 3koo s ARG 516 N -3.87 1.05 -0.04 1.68 0.52 -1.26 -1.21 118.95 115.82 3koo s ARG 516 Ca 0.49 -0.40 0.03 0.00 -0.52 0.00 0.00 55.73 55.34 3koo s ARG 516 Cb -0.10 -0.99 0.00 0.00 0.52 0.00 0.00 34.95 34.38 3koo s ARG 516 CO 0.32 0.20 -0.13 0.20 0.02 0.00 0.00 175.30 175.91 3koo s GLY 517 N -0.06 0.76 0.30 -3.53 0.00 0.30 -4.94 107.32 100.15 3koo s GLY 517 Ca 0.01 -0.50 0.11 0.00 0.00 0.00 0.00 44.72 44.33 3koo s GLY 517 CO 0.00 -0.15 -0.13 -1.58 0.00 0.00 0.00 173.10 171.25 3koo s HIS 518 N 0.24 2.40 -0.19 1.90 2.46 -1.26 -0.38 115.29 120.46 3koo s HIS 518 Ca -0.06 -0.36 -0.04 0.00 0.47 0.00 0.00 55.06 55.07 3koo s HIS 518 Cb -0.12 -1.16 0.09 0.00 -0.13 0.00 0.00 32.58 31.27 3koo s HIS 518 CO 0.02 0.65 0.23 0.42 -2.47 0.00 0.00 174.74 173.59 3koo s ILE 519 N -2.50 -0.34 0.77 0.89 1.01 -0.62 -4.88 121.20 115.53 3koo s ILE 519 Ca 0.31 -0.04 -0.12 0.00 0.00 0.00 0.00 60.65 60.80 3koo s ILE 519 Cb -0.03 -0.63 0.05 0.00 0.01 0.00 0.00 42.46 41.86 3koo s ILE 519 CO 0.17 -0.15 1.10 -1.61 0.00 0.00 0.00 174.94 174.45 3koo s GLU 520 N 2.34 2.30 -1.10 2.79 2.02 -1.26 -1.87 118.70 123.92 3koo s GLU 520 Ca 0.06 0.52 0.00 0.00 0.02 0.00 0.00 54.97 55.58 3koo s GLU 520 Cb -0.15 -1.95 0.00 0.00 0.10 0.00 0.00 34.13 32.13 3koo s GLU 520 CO -0.11 -1.44 0.00 -3.47 0.02 0.00 0.00 175.26 170.25 3koo n ASP 521 N -3.29 -3.19 -4.54 -0.19 2.03 -1.26 -4.80 116.55 101.30 3koo n ASP 521 Ca 0.07 0.26 -0.33 0.00 0.52 0.00 0.00 54.79 55.30 3koo n ASP 521 Cb 0.57 -2.93 -0.12 0.00 -0.72 0.00 0.00 41.12 37.93 3koo n ASP 521 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3koo n GLY 523 N 2.17 1.31 0.07 0.00 0.00 -1.26 0.48 105.19 107.95 3koo n GLY 523 Ca -0.17 -1.61 0.11 0.00 0.00 0.00 0.00 46.02 44.35 3koo n GLY 523 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3koo n HIS 524 N 0.00 0.53 -2.59 1.61 -0.00 -1.26 -4.37 115.22 109.14 3koo n HIS 524 Ca 0.00 0.15 -0.42 0.00 0.46 0.00 0.00 57.72 57.91 3koo n HIS 524 Cb 0.00 -0.71 0.01 0.00 -0.12 0.00 0.00 29.99 29.17 3koo n HIS 524 CO 0.00 0.00 0.00 0.91 0.46 0.00 0.00 176.34 177.71 3koo n TRP 525 N -2.40 2.58 0.16 1.57 7.02 -1.26 -4.79 117.44 120.32 3koo n TRP 525 Ca -0.01 -2.68 0.05 0.00 -1.02 0.00 0.00 57.50 53.85 3koo n TRP 525 Cb 0.53 -1.58 0.49 0.00 -2.42 0.00 0.00 31.31 28.33 3koo n TRP 525 CO 0.00 0.00 0.00 1.15 -2.02 0.00 0.00 177.69 176.82 3koo h THR 526 N 3.35 1.10 -0.04 -0.99 2.02 -1.98 -1.49 112.91 114.88 3koo h THR 526 Ca 0.36 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 3koo h THR 526 Cb 0.56 1.03 -0.00 0.00 -1.74 0.00 0.00 68.15 68.00 3koo h THR 526 CO 1.46 0.13 0.01 1.56 0.37 0.00 0.00 175.52 179.04 3koo h GLN 527 N 0.18 0.07 0.00 6.66 7.50 -1.86 -2.61 115.11 125.05 3koo h GLN 527 Ca 0.04 -0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.17 3koo h GLN 527 Cb 0.16 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 27.68 3koo h GLN 527 CO 0.00 0.31 -0.84 0.00 -1.50 0.00 0.00 178.83 176.80 3koo h MET 528 N -0.18 0.00 0.00 1.46 -0.00 -1.75 -3.05 114.93 111.40 3koo h MET 528 Ca 0.01 0.00 -0.18 0.00 -0.00 0.00 0.00 59.70 59.54 3koo h MET 528 Cb 0.27 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 31.85 3koo h MET 528 CO 0.00 0.00 -0.92 0.22 -0.00 0.00 0.00 176.91 176.21 3koo h ASP 529 N 0.00 0.00 -0.70 -0.10 1.82 -1.35 -3.40 116.42 112.69 3koo h ASP 529 Ca 0.00 0.00 -0.32 0.00 -0.39 0.00 0.00 57.03 56.32 3koo h ASP 529 Cb 0.98 0.00 -0.29 0.00 0.68 0.00 0.00 39.33 40.69 3koo h ASP 529 CO 0.00 0.78 -0.85 0.29 -1.61 0.00 0.00 179.24 177.85 3koo n LYS 530 N -3.23 1.13 -0.16 0.28 4.76 -0.98 -4.98 118.16 114.98 3koo n LYS 530 Ca -0.02 -2.67 -0.08 0.00 -2.87 0.00 0.00 58.31 52.68 3koo n LYS 530 Cb 0.87 -0.87 0.01 0.00 -1.84 0.00 0.00 35.03 33.19 3koo n LYS 530 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 3koo h PRO 531 N 2.66 0.65 -0.76 1.97 0.11 -1.70 0.53 132.00 135.46 3koo h PRO 531 Ca -0.14 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 65.87 3koo h PRO 531 Cb 1.19 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 3koo h PRO 531 CO 0.28 0.50 0.33 1.15 -0.21 0.00 0.00 178.00 180.05 3koo h THR 532 N 0.62 1.25 0.08 -1.15 2.02 -1.93 -1.03 112.91 112.76 3koo h THR 532 Ca 0.17 -0.74 -0.19 0.00 0.77 0.00 0.00 66.41 66.42 3koo h THR 532 Cb 0.03 0.30 0.02 0.00 -1.74 0.00 0.00 68.15 66.76 3koo h THR 532 CO -0.03 0.31 -0.79 1.05 0.37 0.00 0.00 175.52 176.43 3koo h GLU 533 N 1.09 0.39 -0.78 6.66 9.09 -1.84 -1.69 114.58 127.50 3koo h GLU 533 Ca 0.26 -0.53 0.18 0.00 0.05 0.00 0.00 59.36 59.32 3koo h GLU 533 Cb 0.16 0.18 -0.13 0.00 -1.65 0.00 0.00 28.75 27.30 3koo h GLU 533 CO -0.03 1.21 0.05 0.28 0.05 0.00 0.00 179.01 180.57 3koo h VAL 534 N -0.18 0.33 -0.40 -1.06 2.07 -0.83 -0.11 116.25 116.07 3koo h VAL 534 Ca -0.12 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 3koo h VAL 534 Cb 1.55 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 3koo h VAL 534 CO 0.15 0.02 0.24 0.78 0.02 0.00 0.00 177.57 178.79 3koo h ASN 535 N 0.13 0.47 0.59 0.57 4.21 -1.03 -2.15 115.58 118.37 3koo h ASN 535 Ca 0.44 -0.05 -0.02 0.00 1.21 0.00 0.00 56.30 57.88 3koo h ASN 535 Cb 0.80 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.87 3koo h ASN 535 CO -0.67 0.38 -0.41 -0.61 -1.29 0.00 0.00 177.43 174.84 3koo h GLN 536 N 0.53 -0.92 -0.34 0.81 -0.00 -0.10 -0.89 115.11 114.19 3koo h GLN 536 Ca 0.14 0.06 0.06 0.00 -0.00 0.00 0.00 58.65 58.92 3koo h GLN 536 Cb -0.01 0.21 -0.05 0.00 0.00 0.00 0.00 27.48 27.62 3koo h GLN 536 CO -0.03 -0.61 0.01 0.82 0.00 0.00 0.00 178.83 179.02 3koo h ILE 537 N -0.96 0.75 -0.38 2.39 2.04 -1.22 -2.24 117.51 117.90 3koo h ILE 537 Ca -0.07 -0.04 -0.15 0.00 1.00 0.00 0.00 64.86 65.60 3koo h ILE 537 Cb 0.79 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 3koo h ILE 537 CO 0.04 0.02 -0.37 -0.07 0.00 0.00 0.00 178.15 177.77 3koo h LEU 538 N 0.11 0.97 -0.46 1.44 3.38 -1.35 -2.66 115.31 116.74 3koo h LEU 538 Ca 0.17 -0.46 -0.09 0.00 0.09 0.00 0.00 57.88 57.58 3koo h LEU 538 Cb 0.22 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3koo h LEU 538 CO -0.27 1.24 -0.08 0.40 0.09 0.00 0.00 178.44 179.82 3koo h ILE 539 N 0.73 1.27 -0.22 1.22 2.04 -1.10 -0.22 117.51 121.22 3koo h ILE 539 Ca 0.06 -1.18 0.04 0.00 1.00 0.00 0.00 64.86 64.78 3koo h ILE 539 Cb 0.96 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 3koo h ILE 539 CO 0.09 0.41 0.01 0.50 0.00 0.00 0.00 178.15 179.16 3koo h LYS 540 N 0.70 0.08 0.00 2.37 3.64 -1.43 -1.70 116.57 120.23 3koo h LYS 540 Ca 0.12 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 3koo h LYS 540 Cb 0.61 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3koo h LYS 540 CO 0.04 0.05 -0.39 2.35 -2.27 0.00 0.00 179.45 179.23 3koo h TRP 541 N 0.08 0.00 0.01 1.91 7.01 -1.35 -0.49 115.95 123.12 3koo h TRP 541 Ca 0.11 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.10 3koo h TRP 541 Cb 0.13 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.19 3koo h TRP 541 CO -0.18 0.39 -0.01 -0.07 -2.79 0.00 0.00 178.44 175.79 3koo h LEU 542 N 0.00 -0.01 -0.67 0.65 3.38 -0.49 0.61 115.31 118.77 3koo h LEU 542 Ca -0.00 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 3koo h LEU 542 Cb 0.76 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 3koo h LEU 542 CO 0.05 0.30 0.25 0.44 0.09 0.00 0.00 178.44 179.57 3koo h ASP 543 N -0.33 0.95 -0.19 -0.43 3.32 -1.19 -0.40 116.42 118.15 3koo h ASP 543 Ca -0.00 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.81 3koo h ASP 543 Cb 0.32 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 3koo h ASP 543 CO 0.00 0.88 -0.07 -1.28 -1.72 0.00 0.00 179.24 177.05 3koo h SER 544 N 0.97 0.39 0.00 6.45 0.87 -1.00 -3.34 113.55 117.89 3koo h SER 544 Ca 0.22 -0.39 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 3koo h SER 544 Cb 0.24 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 3koo h SER 544 CO -0.01 0.69 -1.06 0.47 -0.53 0.00 0.00 176.83 176.39 3koo n ASP 545 N -4.61 2.53 0.00 6.23 10.43 0.21 -4.58 116.55 126.76 3koo n ASP 545 Ca -0.05 -0.18 0.00 0.00 2.57 0.00 0.00 54.79 57.13 3koo n ASP 545 Cb 0.30 1.24 0.00 0.00 1.84 0.00 0.00 41.12 44.50 3koo n ASP 545 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3koo n ALA 546 N -1.59 0.00 0.26 2.24 0.00 -0.16 -4.65 120.51 116.60 3koo n ALA 546 Ca -0.01 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 3koo n ALA 546 Cb 0.17 0.00 0.79 0.00 0.00 0.00 0.00 19.45 20.41 3koo n ALA 546 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3koo h ARG 547 N 0.00 0.00 0.00 0.00 2.43 -1.83 -3.50 114.38 111.48 3koo h ARG 547 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3koo h ARG 547 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3koo h ARG 547 CO 0.00 0.00 0.00 0.09 -1.51 0.00 0.00 179.97 178.55