#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xck n ALA 3 N 0.00 1.01 -2.14 0.00 0.00 -1.26 -4.94 120.51 113.18 1xck n ALA 3 Ca 0.00 0.43 -0.18 0.00 0.00 0.00 0.00 53.44 53.69 1xck n ALA 3 Cb 0.00 -2.34 -0.00 0.00 0.00 0.00 0.00 19.45 17.11 1xck n ALA 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xck s LYS 4 N 1.32 2.83 -0.22 0.00 -0.14 -1.26 -3.15 119.74 119.13 1xck s LYS 4 Ca 0.82 -1.25 0.02 0.00 -1.36 0.00 0.00 55.97 54.20 1xck s LYS 4 Cb -0.72 -2.70 0.04 0.00 -1.68 0.00 0.00 37.83 32.77 1xck s LYS 4 CO 0.41 -0.19 -0.15 0.34 -0.76 0.00 0.00 175.35 175.01 1xck s ASP 5 N -4.27 3.72 -0.17 2.83 -1.08 0.71 -4.77 116.67 113.63 1xck s ASP 5 Ca 0.52 -1.00 -0.04 0.00 -0.52 0.00 0.00 52.55 51.51 1xck s ASP 5 Cb -0.09 -1.48 -0.03 0.00 -1.46 0.00 0.00 42.92 39.87 1xck s ASP 5 CO 0.32 -0.10 -0.03 -0.69 0.52 0.00 0.00 175.17 175.19 1xck s VAL 6 N 1.22 3.88 0.08 1.11 1.01 -1.26 -2.12 120.40 124.32 1xck s VAL 6 Ca -0.02 -0.35 0.09 0.00 0.00 0.00 0.00 61.98 61.70 1xck s VAL 6 Cb -0.16 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1xck s VAL 6 CO -0.09 0.47 -0.21 -0.54 0.00 0.00 0.00 175.10 174.72 1xck s LYS 7 N 0.63 1.82 0.38 2.72 1.02 -0.37 -4.98 119.74 120.96 1xck s LYS 7 Ca -0.02 -1.12 0.08 0.00 0.02 0.00 0.00 55.97 54.93 1xck s LYS 7 Cb -0.14 -2.07 -0.07 0.00 -0.52 0.00 0.00 37.83 35.02 1xck s LYS 7 CO 0.02 0.50 -0.01 -0.06 -0.92 0.00 0.00 175.35 174.88 1xck s PHE 8 N -0.98 2.49 0.00 3.18 0.08 -1.26 -1.21 117.98 120.28 1xck s PHE 8 Ca 0.15 -0.57 0.00 0.00 0.12 0.00 0.00 56.93 56.63 1xck s PHE 8 Cb -0.10 -1.61 0.00 0.00 -0.57 0.00 0.00 43.02 40.74 1xck s PHE 8 CO 0.06 0.48 0.00 0.41 -0.10 0.00 0.00 175.22 176.07 1xck n GLY 9 N -0.93 0.52 0.31 4.36 0.00 0.13 -1.55 105.19 108.03 1xck n GLY 9 Ca -0.05 0.06 0.01 0.00 0.00 0.00 0.00 46.02 46.04 1xck n GLY 9 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1xck h ASN 10 N 0.00 0.76 -0.83 1.61 -0.73 -1.93 -0.61 115.58 113.85 1xck h ASN 10 Ca 0.00 0.02 0.06 0.00 1.87 0.00 0.00 56.30 58.26 1xck h ASN 10 Cb 0.00 -0.13 -0.06 0.00 0.27 0.00 0.00 38.32 38.40 1xck h ASN 10 CO 0.00 0.48 0.51 -0.78 -0.37 0.00 0.00 177.43 177.26 1xck h ASP 11 N 0.89 0.79 -0.37 1.15 -0.00 -1.84 -1.52 116.42 115.51 1xck h ASP 11 Ca 0.36 0.02 -0.11 0.00 -0.00 0.00 0.00 57.03 57.31 1xck h ASP 11 Cb 0.20 -0.14 -0.01 0.00 -0.00 0.00 0.00 39.33 39.38 1xck h ASP 11 CO -0.18 0.50 -0.18 0.00 -0.00 0.00 0.00 179.24 179.37 1xck h ALA 12 N 1.40 0.53 -0.46 -0.78 0.00 -0.32 -3.15 119.26 116.48 1xck h ALA 12 Ca 0.36 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1xck h ALA 12 Cb 0.18 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1xck h ALA 12 CO -0.18 0.47 -0.12 0.00 0.00 0.00 0.00 179.25 179.42 1xck h ARG 13 N 0.58 0.84 -0.28 0.00 3.08 -0.65 -2.51 114.38 115.44 1xck h ARG 13 Ca 0.08 -0.29 -0.09 0.00 0.07 0.00 0.00 59.98 59.75 1xck h ARG 13 Cb 0.73 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1xck h ARG 13 CO 0.05 0.92 -0.23 -0.39 -1.07 0.00 0.00 179.97 179.26 1xck h VAL 14 N 0.75 1.26 0.13 2.04 -1.51 -1.34 -0.82 116.25 116.77 1xck h VAL 14 Ca 0.12 -1.24 -0.01 0.00 -1.23 0.00 0.00 66.70 64.34 1xck h VAL 14 Cb 0.63 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 31.08 1xck h VAL 14 CO 0.04 0.40 -0.06 0.11 -1.23 0.00 0.00 177.57 176.83 1xck h LYS 15 N 0.47 -0.17 -0.30 5.19 1.79 -1.47 0.15 116.57 122.22 1xck h LYS 15 Ca 0.07 0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.59 1xck h LYS 15 Cb 0.65 0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.31 1xck h LYS 15 CO 0.05 -0.11 0.10 0.52 -1.08 0.00 0.00 179.45 178.93 1xck h MET 16 N -0.18 0.22 0.03 3.15 2.86 -1.18 -0.36 114.93 119.47 1xck h MET 16 Ca -0.02 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1xck h MET 16 Cb 0.14 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1xck h MET 16 CO 0.03 0.15 -0.12 1.25 1.06 0.00 0.00 176.91 179.28 1xck h LEU 17 N 0.23 -0.35 -1.09 1.22 5.85 -0.92 0.61 115.31 120.85 1xck h LEU 17 Ca 0.14 0.05 0.19 0.00 0.84 0.00 0.00 57.88 59.09 1xck h LEU 17 Cb 0.11 0.14 -0.10 0.00 0.37 0.00 0.00 40.66 41.18 1xck h LEU 17 CO -0.14 -0.18 0.61 -0.09 -0.34 0.00 0.00 178.44 178.30 1xck h ARG 18 N -0.22 0.70 -0.11 1.25 9.65 -0.33 0.50 114.38 125.81 1xck h ARG 18 Ca 0.04 -0.04 -0.06 0.00 -1.10 0.00 0.00 59.98 58.81 1xck h ARG 18 Cb 0.26 -0.16 -0.00 0.00 -1.39 0.00 0.00 29.97 28.68 1xck h ARG 18 CO -0.10 0.46 -0.17 0.78 2.80 0.00 0.00 179.97 183.74 1xck h GLY 19 N 0.72 0.35 2.00 2.80 0.00 0.06 -3.01 103.07 105.99 1xck h GLY 19 Ca 0.56 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.48 1xck h GLY 19 CO -0.34 0.35 -0.10 -0.39 0.00 0.00 0.00 176.54 176.06 1xck h VAL 20 N -0.10 0.32 -0.35 4.60 -1.51 0.15 -2.62 116.25 116.74 1xck h VAL 20 Ca 0.01 -0.66 -0.06 0.00 -1.23 0.00 0.00 66.70 64.76 1xck h VAL 20 Cb 0.73 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 31.38 1xck h VAL 20 CO 0.04 0.10 -0.02 0.78 -1.23 0.00 0.00 177.57 177.24 1xck h ASN 21 N 0.00 0.62 -0.29 4.19 2.35 -0.88 0.41 115.58 121.98 1xck h ASN 21 Ca -0.00 -0.32 0.01 0.00 -0.55 0.00 0.00 56.30 55.44 1xck h ASN 21 Cb 0.49 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 1xck h ASN 21 CO 0.01 0.79 0.17 0.58 -1.65 0.00 0.00 177.43 177.33 1xck h VAL 22 N 0.43 1.04 0.56 2.81 2.07 -1.34 0.29 116.25 122.12 1xck h VAL 22 Ca 0.10 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1xck h VAL 22 Cb 0.48 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1xck h VAL 22 CO 0.02 0.06 -0.30 0.25 0.02 0.00 0.00 177.57 177.63 1xck h LEU 23 N 0.35 -0.73 0.06 2.57 5.85 -1.30 -2.31 115.31 119.81 1xck h LEU 23 Ca 0.11 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.88 1xck h LEU 23 Cb -0.01 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1xck h LEU 23 CO -0.05 -0.49 -0.14 0.00 -0.34 0.00 0.00 178.44 177.42 1xck h ALA 24 N -0.38 -0.21 -0.19 1.25 0.00 0.03 -2.07 119.26 117.69 1xck h ALA 24 Ca -0.07 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xck h ALA 24 Cb 0.63 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1xck h ALA 24 CO 0.10 -0.65 0.13 -0.44 0.00 0.00 0.00 179.25 178.39 1xck h ASP 25 N -0.26 0.18 0.16 0.00 3.32 -0.43 0.20 116.42 119.59 1xck h ASP 25 Ca 0.03 -0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.87 1xck h ASP 25 Cb 0.29 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1xck h ASP 25 CO -0.09 0.13 -0.80 0.00 -1.72 0.00 0.00 179.24 176.76 1xck h ALA 26 N 1.89 0.46 0.15 3.45 0.00 -1.14 -3.34 119.26 120.72 1xck h ALA 26 Ca 0.07 -0.63 -0.22 0.00 0.00 0.00 0.00 54.91 54.13 1xck h ALA 26 Cb 0.04 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 17.81 1xck h ALA 26 CO -0.01 0.75 -1.03 0.28 0.00 0.00 0.00 179.25 179.24 1xck h VAL 27 N 0.34 1.38 0.00 0.00 2.07 -0.63 -3.37 116.25 116.04 1xck h VAL 27 Ca -0.05 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 64.94 1xck h VAL 27 Cb 1.40 3.08 0.00 0.00 -1.52 0.00 0.00 31.29 34.25 1xck h VAL 27 CO 0.15 0.73 0.00 2.29 0.02 0.00 0.00 177.57 180.75 1xck n LYS 28 N -4.03 0.15 0.00 1.57 2.85 0.64 -2.11 118.16 117.23 1xck n LYS 28 Ca -0.17 0.53 0.09 0.00 -1.05 0.00 0.00 58.31 57.71 1xck n LYS 28 Cb 0.88 -1.89 0.41 0.00 -0.65 0.00 0.00 35.03 33.78 1xck n LYS 28 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 1xck n VAL 29 N -2.20 0.68 1.03 0.58 0.24 -1.25 -2.51 118.33 114.91 1xck n VAL 29 Ca 0.00 0.17 0.11 0.00 -2.04 0.00 0.00 64.34 62.58 1xck n VAL 29 Cb 0.12 -0.84 0.06 0.00 -1.47 0.00 0.00 33.84 31.71 1xck n VAL 29 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1xck n THR 30 N -1.50 0.00 0.04 3.34 -2.24 -0.90 -0.17 114.28 112.86 1xck n THR 30 Ca 0.05 -0.08 -0.07 0.00 -2.27 0.00 0.00 64.05 61.67 1xck n THR 30 Cb 0.22 0.81 -0.05 0.00 -2.10 0.00 0.00 70.33 69.22 1xck n THR 30 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1xck h LEU 31 N 0.73 -0.75-10.30 3.22 5.85 -1.65 -3.39 115.31 109.02 1xck h LEU 31 Ca 0.00 0.08 -0.40 0.00 0.84 0.00 0.00 57.88 58.40 1xck h LEU 31 Cb 0.56 0.28 0.20 0.00 0.37 0.00 0.00 40.66 42.07 1xck h LEU 31 CO 0.00 -0.25 0.06 -0.83 -0.34 0.00 0.00 178.44 177.08 1xck s GLY 32 N -1.56 1.54 0.44 3.75 0.00 -1.26 -4.77 107.32 105.46 1xck s GLY 32 Ca -0.07 -0.96 0.30 0.00 0.00 0.00 0.00 44.72 43.99 1xck s GLY 32 CO 0.28 -0.02 1.89 -0.56 0.00 0.00 0.00 173.10 174.69 1xck h PRO 33 N -2.86 0.00 -0.91 2.90 0.13 -1.88 0.20 132.00 129.57 1xck h PRO 33 Ca -0.44 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.28 1xck h PRO 33 Cb 1.30 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.19 1xck h PRO 33 CO 0.30 0.00 0.52 1.63 -0.23 0.00 0.00 178.00 180.22 1xck n LYS 34 N -2.75 2.78 -1.72 0.86 4.76 -1.26 -5.00 118.16 115.84 1xck n LYS 34 Ca 0.01 -3.05 -0.38 0.00 -2.87 0.00 0.00 58.31 52.03 1xck n LYS 34 Cb 0.26 -2.19 0.06 0.00 -1.84 0.00 0.00 35.03 31.31 1xck n LYS 34 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xck n GLY 35 N -0.80 0.51 3.98 0.72 0.00 0.05 -4.62 105.19 105.04 1xck n GLY 35 Ca 0.53 -0.09 -0.23 0.00 0.00 0.00 0.00 46.02 46.23 1xck n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xck s ARG 36 N -3.12 1.98 0.05 1.61 1.81 0.76 -4.93 118.95 117.11 1xck s ARG 36 Ca 0.78 -0.91 -0.07 0.00 -1.72 0.00 0.00 55.73 53.82 1xck s ARG 36 Cb -0.40 -2.35 -0.05 0.00 -0.45 0.00 0.00 34.95 31.70 1xck s ARG 36 CO 0.44 -1.21 0.31 -0.80 -0.68 0.00 0.00 175.30 173.36 1xck s ASN 37 N -4.62 6.52 -0.07 0.23 0.02 -1.26 -4.38 114.94 111.38 1xck s ASN 37 Ca 0.63 0.60 0.05 0.00 -1.02 0.00 0.00 52.86 53.12 1xck s ASN 37 Cb -0.07 -2.10 -0.01 0.00 0.02 0.00 0.00 41.25 39.08 1xck s ASN 37 CO 0.43 0.19 -0.24 -0.69 0.02 0.00 0.00 177.10 176.81 1xck s VAL 38 N -1.40 2.15 -0.25 1.60 1.01 0.49 -4.94 120.40 119.06 1xck s VAL 38 Ca 0.32 -1.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 1xck s VAL 38 Cb -0.13 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1xck s VAL 38 CO 0.19 0.57 0.12 -0.69 0.00 0.00 0.00 175.10 175.28 1xck s VAL 39 N -0.11 4.76 -0.29 2.92 1.01 -1.26 -1.00 120.40 126.42 1xck s VAL 39 Ca -0.05 -0.02 -0.07 0.00 0.00 0.00 0.00 61.98 61.83 1xck s VAL 39 Cb -0.14 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1xck s VAL 39 CO 0.04 0.32 0.09 -0.76 0.00 0.00 0.00 175.10 174.79 1xck s LEU 40 N 1.54 3.86 0.42 3.92 1.43 0.19 -4.91 118.68 125.12 1xck s LEU 40 Ca 0.06 -0.61 -0.24 0.00 -1.03 0.00 0.00 54.13 52.31 1xck s LEU 40 Cb -0.15 -1.91 -0.08 0.00 0.03 0.00 0.00 46.19 44.07 1xck s LEU 40 CO 0.06 -0.18 1.10 -0.62 0.23 0.00 0.00 176.35 176.94 1xck s ASP 41 N 1.54 6.54 -0.07 2.29 2.15 -1.26 0.16 116.67 128.01 1xck s ASP 41 Ca 0.03 2.16 0.02 0.00 0.43 0.00 0.00 52.55 55.19 1xck s ASP 41 Cb -0.17 -2.59 0.01 0.00 -0.30 0.00 0.00 42.92 39.87 1xck s ASP 41 CO 0.03 -0.65 -0.13 -0.54 -0.17 0.00 0.00 175.17 173.71 1xck s LYS 42 N -2.55 1.77 0.34 4.34 1.02 -1.26 -4.88 119.74 118.51 1xck s LYS 42 Ca 0.60 -0.43 0.13 0.00 0.02 0.00 0.00 55.97 56.29 1xck s LYS 42 Cb -0.25 -1.46 1.06 0.00 -0.52 0.00 0.00 37.83 36.66 1xck s LYS 42 CO 0.31 0.02 1.65 0.66 -0.92 0.00 0.00 175.35 177.07 1xck h SER 43 N 7.02 0.40 -3.43 2.83 4.64 -1.96 -3.37 113.55 119.68 1xck h SER 43 Ca -0.30 0.20 -0.66 0.00 -0.47 0.00 0.00 61.79 60.56 1xck h SER 43 Cb 1.19 0.18 -0.27 0.00 -0.31 0.00 0.00 62.40 63.19 1xck h SER 43 CO 0.47 -0.18 -0.71 -0.36 -0.87 0.00 0.00 176.83 175.18 1xck s PHE 44 N -5.69 2.98 0.00 4.77 0.08 -1.26 -5.04 117.98 113.82 1xck s PHE 44 Ca -0.10 -0.85 0.00 0.00 0.12 0.00 0.00 56.93 56.10 1xck s PHE 44 Cb 0.30 -2.12 0.00 0.00 -0.57 0.00 0.00 43.02 40.63 1xck s PHE 44 CO 0.79 -0.51 0.00 0.41 -0.10 0.00 0.00 175.22 175.81 1xck n GLY 45 N 4.78 -1.27 3.84 4.36 0.00 -1.26 -4.95 105.19 110.69 1xck n GLY 45 Ca -0.18 -1.75 -0.33 0.00 0.00 0.00 0.00 46.02 43.77 1xck n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xck s ALA 46 N -1.71 3.25 0.95 4.61 0.00 -1.26 -4.82 121.76 122.79 1xck s ALA 46 Ca 0.00 0.14 -0.11 0.00 0.00 0.00 0.00 51.96 51.99 1xck s ALA 46 Cb 0.00 -2.87 0.17 0.00 0.00 0.00 0.00 23.12 20.42 1xck s ALA 46 CO 0.00 0.28 1.10 -2.14 0.00 0.00 0.00 175.76 175.01 1xck s PRO 47 N -3.00 0.74 -0.20 0.00 0.02 -1.26 -4.65 135.00 126.65 1xck s PRO 47 Ca 0.56 1.24 -0.11 0.00 0.02 0.00 0.00 61.00 62.71 1xck s PRO 47 Cb -0.10 -1.72 -0.05 0.00 0.02 0.00 0.00 34.50 32.65 1xck s PRO 47 CO 0.16 -2.72 0.16 0.99 -0.33 0.00 0.00 177.00 175.26 1xck s THR 48 N -2.68 5.39 -0.19 0.99 2.01 0.12 -4.91 115.64 116.37 1xck s THR 48 Ca 0.66 0.23 -0.07 0.00 0.31 0.00 0.00 61.69 62.82 1xck s THR 48 Cb -0.22 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 1xck s THR 48 CO 0.59 0.41 0.05 -0.63 -0.69 0.00 0.00 174.62 174.36 1xck s ILE 49 N 0.53 4.57 0.10 1.82 1.01 -1.26 0.54 121.20 128.51 1xck s ILE 49 Ca 0.09 -0.11 -0.08 0.00 0.00 0.00 0.00 60.65 60.56 1xck s ILE 49 Cb -0.12 -3.07 -0.01 0.00 0.01 0.00 0.00 42.46 39.27 1xck s ILE 49 CO -0.00 0.44 0.18 0.28 0.00 0.00 0.00 174.94 175.84 1xck s THR 50 N 0.63 0.14 -0.01 2.92 -1.32 -0.17 -4.96 115.64 112.87 1xck s THR 50 Ca 0.02 -1.29 0.01 0.00 -1.21 0.00 0.00 61.69 59.23 1xck s THR 50 Cb -0.13 -1.46 0.02 0.00 -1.51 0.00 0.00 72.50 69.42 1xck s THR 50 CO 0.02 -0.62 0.96 0.29 -2.21 0.00 0.00 174.62 173.06 1xck n LYS 51 N -0.07 2.57 -3.03 7.08 5.02 -1.26 -0.38 118.16 128.09 1xck n LYS 51 Ca -0.13 -1.48 -0.43 0.00 -2.02 0.00 0.00 58.31 54.25 1xck n LYS 51 Cb 0.62 -0.98 -0.06 0.00 -0.02 0.00 0.00 35.03 34.59 1xck n LYS 51 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1xck s ASP 52 N -1.04 6.33 0.58 4.39 2.15 -1.26 -4.81 116.67 123.01 1xck s ASP 52 Ca 0.02 -0.38 0.27 0.00 0.43 0.00 0.00 52.55 52.89 1xck s ASP 52 Cb 0.02 -2.35 1.66 0.00 -0.30 0.00 0.00 42.92 41.94 1xck s ASP 52 CO 0.00 -0.92 2.17 1.23 -0.17 0.00 0.00 175.17 177.49 1xck h GLY 53 N 10.05 0.00 1.19 2.66 0.00 -1.92 -1.81 103.07 113.24 1xck h GLY 53 Ca -0.26 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 46.88 1xck h GLY 53 CO 0.96 0.00 -0.59 -2.08 0.00 0.00 0.00 176.54 174.83 1xck h VAL 54 N 0.00 1.28 -0.09 4.60 2.07 -1.96 0.09 116.25 122.23 1xck h VAL 54 Ca 0.04 -1.78 -0.00 0.00 0.82 0.00 0.00 66.70 65.77 1xck h VAL 54 Cb 0.22 1.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 1xck h VAL 54 CO -0.00 0.58 0.04 0.28 0.02 0.00 0.00 177.57 178.49 1xck h SER 55 N 0.63 0.12 0.24 0.57 0.02 -1.77 -2.26 113.55 111.10 1xck h SER 55 Ca 0.00 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1xck h SER 55 Cb 1.20 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 1xck h SER 55 CO 0.13 0.23 -0.17 0.58 -1.14 0.00 0.00 176.83 176.45 1xck h VAL 56 N 0.01 0.63 -0.91 2.27 2.07 -1.38 -2.76 116.25 116.19 1xck h VAL 56 Ca 0.03 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.70 1xck h VAL 56 Cb 0.14 0.63 -0.09 0.00 -1.52 0.00 0.00 31.29 30.45 1xck h VAL 56 CO -0.00 0.00 0.51 0.00 0.02 0.00 0.00 177.57 178.10 1xck h ALA 57 N 0.32 1.39 -0.96 1.67 0.00 -0.91 -0.54 119.26 120.23 1xck h ALA 57 Ca -0.02 0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.12 1xck h ALA 57 Cb 0.36 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.99 1xck h ALA 57 CO 0.01 -0.01 0.60 -0.09 0.00 0.00 0.00 179.25 179.76 1xck h ARG 58 N 0.73 0.73 0.00 0.00 2.43 -1.11 -1.44 114.38 115.72 1xck h ARG 58 Ca 0.49 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.61 1xck h ARG 58 Cb 0.65 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1xck h ARG 58 CO -0.34 0.49 0.00 0.93 -1.51 0.00 0.00 179.97 179.54 1xck h GLU 59 N 0.76 0.00 -6.27 0.20 4.39 -0.99 -3.46 114.58 109.21 1xck h GLU 59 Ca 0.50 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.65 1xck h GLU 59 Cb 0.77 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.40 1xck h GLU 59 CO -0.27 0.00 0.90 0.42 -1.16 0.00 0.00 179.01 178.90 1xck s ILE 60 N -3.23 3.93 -0.23 3.13 -1.09 -0.55 -4.98 121.20 118.18 1xck s ILE 60 Ca 0.07 1.21 -0.10 0.00 -2.23 0.00 0.00 60.65 59.60 1xck s ILE 60 Cb 0.08 -3.78 0.09 0.00 -1.58 0.00 0.00 42.46 37.27 1xck s ILE 60 CO 0.62 -0.06 0.51 -0.70 -1.23 0.00 0.00 174.94 174.08 1xck s GLU 61 N 3.12 0.47 0.09 2.79 2.12 -1.26 -4.92 118.70 121.10 1xck s GLU 61 Ca 0.62 1.09 -0.00 0.00 0.36 0.00 0.00 54.97 57.04 1xck s GLU 61 Cb -0.28 0.31 -0.04 0.00 0.26 0.00 0.00 34.13 34.38 1xck s GLU 61 CO 0.23 -0.20 0.25 -0.51 -0.54 0.00 0.00 175.26 174.49 1xck s LEU 62 N 2.17 4.34 0.07 2.70 1.43 -1.26 -5.04 118.68 123.09 1xck s LEU 62 Ca -0.06 0.31 -0.18 0.00 -1.03 0.00 0.00 54.13 53.18 1xck s LEU 62 Cb -0.10 -3.02 -0.11 0.00 0.03 0.00 0.00 46.19 42.99 1xck s LEU 62 CO -0.15 0.13 1.40 -0.08 0.23 0.00 0.00 176.35 177.87 1xck h GLU 63 N 2.86 0.52 -6.26 1.70 4.81 -2.01 -3.42 114.58 112.79 1xck h GLU 63 Ca -0.46 -0.26 -0.55 0.00 -0.13 0.00 0.00 59.36 57.96 1xck h GLU 63 Cb 1.17 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.54 1xck h GLU 63 CO 0.74 0.84 1.14 0.34 -0.73 0.00 0.00 179.01 181.34 1xck s ASP 64 N -6.30 6.49 0.27 1.04 -1.08 -1.26 -4.89 116.67 110.95 1xck s ASP 64 Ca -0.13 2.13 0.01 0.00 -0.52 0.00 0.00 52.55 54.03 1xck s ASP 64 Cb 0.07 -2.53 0.58 0.00 -1.46 0.00 0.00 42.92 39.58 1xck s ASP 64 CO 0.79 -1.09 1.77 0.11 0.52 0.00 0.00 175.17 177.27 1xck h LYS 65 N 10.31 0.66 -0.02 4.34 1.79 -1.94 -0.10 116.57 131.61 1xck h LYS 65 Ca -0.39 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.03 1xck h LYS 65 Cb 1.18 -0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 31.68 1xck h LYS 65 CO 0.96 0.44 -0.01 0.74 -1.08 0.00 0.00 179.45 180.50 1xck h PHE 66 N 0.68 0.05 -0.99 -1.35 0.04 -1.94 -1.87 116.94 111.56 1xck h PHE 66 Ca 0.49 -0.01 0.06 0.00 2.80 0.00 0.00 57.97 61.31 1xck h PHE 66 Cb 0.70 -0.01 -0.06 0.00 2.20 0.00 0.00 35.95 38.77 1xck h PHE 66 CO -0.07 0.44 0.65 0.93 -0.60 0.00 0.00 178.31 179.66 1xck h GLU 67 N -0.36 1.16 -0.62 1.51 5.08 -1.61 -2.17 114.58 117.57 1xck h GLU 67 Ca 0.00 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1xck h GLU 67 Cb 0.43 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1xck h GLU 67 CO 0.00 0.76 0.32 -0.97 -1.00 0.00 0.00 179.01 178.13 1xck h ASN 68 N 1.19 0.80 -0.95 1.42 -1.24 -0.92 -1.76 115.58 114.12 1xck h ASN 68 Ca 0.42 -0.11 0.06 0.00 0.71 0.00 0.00 56.30 57.37 1xck h ASN 68 Cb 0.12 -0.20 -0.06 0.00 0.73 0.00 0.00 38.32 38.90 1xck h ASN 68 CO -0.15 0.68 0.61 0.24 -1.29 0.00 0.00 177.43 177.52 1xck h MET 69 N 0.85 1.10 0.15 6.67 2.86 -0.71 0.36 114.93 126.22 1xck h MET 69 Ca 0.22 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 1xck h MET 69 Cb 0.08 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 31.49 1xck h MET 69 CO -0.03 0.73 -0.07 0.78 1.06 0.00 0.00 176.91 179.38 1xck h GLY 70 N 1.14 -0.21 0.97 8.32 0.00 -1.02 -0.06 103.07 112.20 1xck h GLY 70 Ca 0.40 0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.81 1xck h GLY 70 CO -0.16 -0.08 0.22 0.00 0.00 0.00 0.00 176.54 176.52 1xck h ALA 71 N 0.62 0.48 -0.43 3.60 0.00 -0.57 -2.55 119.26 120.42 1xck h ALA 71 Ca -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1xck h ALA 71 Cb 0.17 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1xck h ALA 71 CO 0.03 -0.00 0.21 1.96 0.00 0.00 0.00 179.25 181.45 1xck h GLN 72 N 0.49 0.60 0.49 0.00 1.08 -0.13 -0.25 115.11 117.39 1xck h GLN 72 Ca 0.13 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.24 1xck h GLN 72 Cb 0.04 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.35 1xck h GLN 72 CO -0.02 0.47 -0.24 0.52 -0.95 0.00 0.00 178.83 178.61 1xck h MET 73 N 0.60 -0.64 -0.11 1.46 2.86 -0.58 -0.67 114.93 117.86 1xck h MET 73 Ca 0.15 0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.71 1xck h MET 73 Cb 0.07 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1xck h MET 73 CO -0.02 -0.38 -0.49 -0.39 1.06 0.00 0.00 176.91 176.69 1xck h VAL 74 N -0.76 1.34 -0.88 -2.22 -1.51 -1.43 -2.54 116.25 108.25 1xck h VAL 74 Ca -0.07 -1.71 0.11 0.00 -1.23 0.00 0.00 66.70 63.80 1xck h VAL 74 Cb 0.55 1.80 -0.08 0.00 -2.13 0.00 0.00 31.29 31.43 1xck h VAL 74 CO 0.11 0.51 0.51 0.50 -1.23 0.00 0.00 177.57 177.98 1xck h LYS 75 N 0.23 0.80 0.49 5.19 3.64 -0.92 0.98 116.57 126.98 1xck h LYS 75 Ca 0.01 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1xck h LYS 75 Cb 0.95 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1xck h LYS 75 CO 0.08 0.53 -0.24 1.49 -2.27 0.00 0.00 179.45 179.04 1xck h GLU 76 N 0.83 -0.64 0.00 1.90 4.81 -0.69 -2.80 114.58 117.99 1xck h GLU 76 Ca 0.44 0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.67 1xck h GLU 76 Cb 0.45 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1xck h GLU 76 CO -0.27 -0.34 -0.20 -0.39 -0.73 0.00 0.00 179.01 177.08 1xck h VAL 77 N -1.02 0.60 -0.49 0.32 -1.51 -1.38 -2.63 116.25 110.14 1xck h VAL 77 Ca -0.07 -0.92 -0.12 0.00 -1.23 0.00 0.00 66.70 64.36 1xck h VAL 77 Cb 0.60 1.61 -0.02 0.00 -2.13 0.00 0.00 31.29 31.35 1xck h VAL 77 CO 0.11 0.20 -0.17 0.00 -1.23 0.00 0.00 177.57 176.48 1xck h ALA 78 N 1.80 0.76 -0.68 5.19 0.00 -0.83 -2.72 119.26 122.78 1xck h ALA 78 Ca -0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1xck h ALA 78 Cb 0.59 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1xck h ALA 78 CO 0.03 0.67 0.38 0.66 0.00 0.00 0.00 179.25 180.98 1xck h SER 79 N 0.85 0.83 -0.72 0.00 4.64 -1.19 -1.37 113.55 116.60 1xck h SER 79 Ca 0.12 -0.06 0.20 0.00 -0.47 0.00 0.00 61.79 61.58 1xck h SER 79 Cb 0.73 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.58 1xck h SER 79 CO 0.06 0.67 0.51 0.11 -0.87 0.00 0.00 176.83 177.30 1xck h LYS 80 N 0.95 0.08 -0.25 4.77 1.57 -1.39 0.14 116.57 122.44 1xck h LYS 80 Ca 0.24 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.99 1xck h LYS 80 Cb 0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1xck h LYS 80 CO -0.04 0.05 0.05 0.00 -0.57 0.00 0.00 179.45 178.94 1xck h ALA 81 N 1.65 0.32 -0.72 3.86 0.00 -1.26 -1.35 119.26 121.76 1xck h ALA 81 Ca 0.35 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 81 Cb 1.26 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 1xck h ALA 81 CO -0.03 -0.01 0.25 -0.97 0.00 0.00 0.00 179.25 178.49 1xck h ASN 82 N 0.22 1.02 -0.83 0.00 -1.24 -0.83 -1.32 115.58 112.59 1xck h ASN 82 Ca 0.08 -0.17 -0.03 0.00 0.71 0.00 0.00 56.30 56.88 1xck h ASN 82 Cb 0.30 -0.26 -0.04 0.00 0.73 0.00 0.00 38.32 39.05 1xck h ASN 82 CO 0.00 0.93 0.39 0.44 -1.29 0.00 0.00 177.43 177.90 1xck h ASP 83 N 1.06 1.10 0.26 1.15 3.32 -0.98 0.80 116.42 123.14 1xck h ASP 83 Ca 0.24 -0.14 -0.24 0.00 0.02 0.00 0.00 57.03 56.91 1xck h ASP 83 Cb 0.26 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.53 1xck h ASP 83 CO -0.01 0.93 -1.00 0.00 -1.72 0.00 0.00 179.24 177.45 1xck h ALA 84 N 1.21 0.28 0.00 3.45 0.00 -0.84 -3.39 119.26 119.97 1xck h ALA 84 Ca 0.29 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1xck h ALA 84 Cb 0.13 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1xck h ALA 84 CO -0.03 0.79 0.00 0.00 0.00 0.00 0.00 179.25 180.00 1xck n ALA 85 N -2.57 1.71 -0.99 0.00 0.00 -0.53 -5.00 120.51 113.12 1xck n ALA 85 Ca -0.08 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.81 1xck n ALA 85 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.31 1xck n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 86 N -0.14 0.37 3.63 0.00 0.00 0.28 -4.69 105.19 104.65 1xck n GLY 86 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1xck n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xck s ASP 87 N -2.04 -0.12 0.00 1.61 2.15 -1.24 -4.96 116.67 112.07 1xck s ASP 87 Ca 0.00 -0.16 0.00 0.00 0.43 0.00 0.00 52.55 52.82 1xck s ASP 87 Cb 0.00 0.24 0.00 0.00 -0.30 0.00 0.00 42.92 42.86 1xck s ASP 87 CO 0.00 -0.43 0.00 0.61 -0.17 0.00 0.00 175.17 175.18 1xck n GLY 88 N -0.40 0.80 0.19 2.66 0.00 -1.26 -3.94 105.19 103.24 1xck n GLY 88 Ca -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 1xck n GLY 88 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xck h THR 89 N 0.00 1.27 -0.32 2.61 2.02 -1.89 -0.04 112.91 116.56 1xck h THR 89 Ca 0.00 -1.02 -0.04 0.00 0.77 0.00 0.00 66.41 66.12 1xck h THR 89 Cb 0.00 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 1xck h THR 89 CO 0.00 0.33 0.05 0.74 0.37 0.00 0.00 175.52 177.01 1xck h THR 90 N 0.39 1.24 -0.19 3.16 2.02 -1.91 -1.75 112.91 115.88 1xck h THR 90 Ca 0.09 -0.84 0.04 0.00 0.77 0.00 0.00 66.41 66.47 1xck h THR 90 Cb 0.49 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 68.02 1xck h THR 90 CO 0.02 0.28 -0.06 0.74 0.37 0.00 0.00 175.52 176.87 1xck h THR 91 N 0.36 0.78 -0.88 3.16 2.02 -1.96 -0.75 112.91 115.64 1xck h THR 91 Ca 0.10 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.38 1xck h THR 91 Cb 0.36 0.78 -0.06 0.00 -1.74 0.00 0.00 68.15 67.49 1xck h THR 91 CO 0.01 0.00 0.57 0.00 0.37 0.00 0.00 175.52 176.47 1xck h ALA 92 N 1.16 1.66 0.11 6.16 0.00 -0.85 -0.03 119.26 127.48 1xck h ALA 92 Ca 0.09 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1xck h ALA 92 Cb 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1xck h ALA 92 CO -0.21 0.15 -0.05 1.15 0.00 0.00 0.00 179.25 180.29 1xck h THR 93 N 0.85 1.06 -0.18 0.00 2.02 -0.31 0.25 112.91 116.60 1xck h THR 93 Ca 0.41 -0.69 -0.04 0.00 0.77 0.00 0.00 66.41 66.86 1xck h THR 93 Cb 0.44 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 1xck h THR 93 CO -0.18 0.16 -0.09 -0.37 0.37 0.00 0.00 175.52 175.42 1xck h VAL 94 N -0.47 1.17 -0.22 3.16 -1.51 -0.75 -0.59 116.25 117.04 1xck h VAL 94 Ca -0.02 -0.71 -0.03 0.00 -1.23 0.00 0.00 66.70 64.72 1xck h VAL 94 Cb 0.38 1.13 -0.01 0.00 -2.13 0.00 0.00 31.29 30.67 1xck h VAL 94 CO 0.02 0.22 0.03 -0.07 -1.23 0.00 0.00 177.57 176.55 1xck h LEU 95 N 0.26 0.35 -1.07 4.19 3.38 -0.86 -1.52 115.31 120.05 1xck h LEU 95 Ca 0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1xck h LEU 95 Cb 0.32 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1xck h LEU 95 CO 0.02 0.53 0.50 0.00 0.09 0.00 0.00 178.44 179.58 1xck h ALA 96 N 0.83 1.30 -0.37 1.53 0.00 -0.37 -0.99 119.26 121.19 1xck h ALA 96 Ca 0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1xck h ALA 96 Cb 0.33 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1xck h ALA 96 CO 0.01 0.60 0.18 0.37 0.00 0.00 0.00 179.25 180.40 1xck h GLN 97 N 1.16 0.54 -0.03 0.00 4.15 -0.87 0.46 115.11 120.53 1xck h GLN 97 Ca 0.30 -0.08 -0.00 0.00 0.77 0.00 0.00 58.65 59.64 1xck h GLN 97 Cb -0.04 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.55 1xck h GLN 97 CO -0.06 0.48 0.02 0.00 -1.93 0.00 0.00 178.83 177.34 1xck h ALA 98 N 1.03 0.03 -0.13 3.38 0.00 -0.75 -0.31 119.26 122.52 1xck h ALA 98 Ca 0.13 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xck h ALA 98 Cb 0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1xck h ALA 98 CO -0.02 -0.45 0.05 0.82 0.00 0.00 0.00 179.25 179.65 1xck h ILE 99 N 0.00 1.15 -0.60 0.00 2.04 -1.06 -2.69 117.51 116.35 1xck h ILE 99 Ca 0.01 -0.44 0.03 0.00 1.00 0.00 0.00 64.86 65.46 1xck h ILE 99 Cb 0.03 1.21 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 1xck h ILE 99 CO -0.00 0.13 0.36 0.40 0.00 0.00 0.00 178.15 179.04 1xck h ILE 100 N 0.05 1.05 0.88 -0.67 2.04 -0.80 0.88 117.51 120.93 1xck h ILE 100 Ca 0.04 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 1xck h ILE 100 Cb 0.17 0.28 0.01 0.00 -0.74 0.00 0.00 36.82 36.54 1xck h ILE 100 CO -0.00 0.13 -0.45 0.74 0.00 0.00 0.00 178.15 178.57 1xck h THR 101 N 0.71 0.09 -0.75 -0.27 2.02 -0.96 -0.34 112.91 113.40 1xck h THR 101 Ca 0.25 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.39 1xck h THR 101 Cb 0.05 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 66.51 1xck h THR 101 CO -0.11 0.00 0.32 -0.33 0.37 0.00 0.00 175.52 175.77 1xck h GLU 102 N -1.21 1.10 -0.31 6.66 4.39 -1.44 -2.00 114.58 121.77 1xck h GLU 102 Ca -0.12 -0.18 0.01 0.00 0.34 0.00 0.00 59.36 59.42 1xck h GLU 102 Cb 0.94 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.38 1xck h GLU 102 CO 0.18 0.88 0.17 0.78 -1.16 0.00 0.00 179.01 179.85 1xck h GLY 103 N 1.12 0.42 1.85 -3.84 0.00 -0.72 -1.30 103.07 100.60 1xck h GLY 103 Ca 0.25 -0.13 -0.06 0.00 0.00 0.00 0.00 47.33 47.40 1xck h GLY 103 CO -0.03 0.11 -0.22 1.41 0.00 0.00 0.00 176.54 177.82 1xck h LEU 104 N 0.35 0.18 -0.10 3.11 3.38 -0.84 -0.55 115.31 120.84 1xck h LEU 104 Ca 0.12 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1xck h LEU 104 Cb 0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1xck h LEU 104 CO -0.07 0.41 0.06 0.11 0.09 0.00 0.00 178.44 179.05 1xck h LYS 105 N 0.17 0.13 -0.63 1.13 1.57 -0.60 -0.72 116.57 117.62 1xck h LYS 105 Ca 0.03 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1xck h LYS 105 Cb 0.49 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 1xck h LYS 105 CO 0.03 0.09 0.39 0.00 -0.57 0.00 0.00 179.45 179.39 1xck h ALA 106 N 1.04 0.81 -0.86 3.86 0.00 -0.47 -0.58 119.26 123.06 1xck h ALA 106 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1xck h ALA 106 Cb -0.01 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 1xck h ALA 106 CO -0.01 0.16 0.57 0.28 0.00 0.00 0.00 179.25 180.24 1xck h VAL 107 N 0.78 1.20 -0.06 0.00 2.07 -0.72 -1.13 116.25 118.39 1xck h VAL 107 Ca 0.25 -0.39 -0.10 0.00 0.82 0.00 0.00 66.70 67.28 1xck h VAL 107 Cb -0.00 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.71 1xck h VAL 107 CO -0.09 0.21 -0.41 0.00 0.02 0.00 0.00 177.57 177.30 1xck h ALA 108 N 1.33 1.22 0.00 1.67 0.00 -0.51 -0.93 119.26 122.03 1xck h ALA 108 Ca 0.32 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xck h ALA 108 Cb -0.10 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1xck h ALA 108 CO -0.08 0.55 0.00 0.00 0.00 0.00 0.00 179.25 179.72 1xck n ALA 109 N -2.47 2.21 -0.37 0.00 0.00 -0.28 -4.84 120.51 114.77 1xck n ALA 109 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1xck n ALA 109 Cb 0.46 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1xck n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 110 N 0.30 0.81 3.83 0.00 0.00 -0.35 -5.07 105.19 104.71 1xck n GLY 110 Ca 0.14 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1xck n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xck s MET 111 N -0.64 4.05 -0.07 1.61 1.00 -0.64 -4.99 119.30 119.62 1xck s MET 111 Ca 0.00 1.03 -0.30 0.00 0.00 0.00 0.00 55.69 56.43 1xck s MET 111 Cb 0.00 -2.15 -0.05 0.00 0.00 0.00 0.00 34.83 32.63 1xck s MET 111 CO 0.00 -0.19 1.51 1.21 0.00 0.00 0.00 175.02 177.55 1xck s ASN 112 N -2.69 6.77 0.16 3.03 3.84 -1.26 -4.43 114.94 120.35 1xck s ASN 112 Ca 0.60 2.09 -0.17 0.00 0.21 0.00 0.00 52.86 55.59 1xck s ASN 112 Cb -0.10 -2.54 0.07 0.00 -0.55 0.00 0.00 41.25 38.13 1xck s ASN 112 CO 0.24 -0.85 1.71 -0.65 -2.79 0.00 0.00 177.10 174.76 1xck h PRO 113 N 8.85 0.12 -0.81 0.43 0.11 -1.94 -0.45 132.00 138.30 1xck h PRO 113 Ca -0.36 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.74 1xck h PRO 113 Cb 1.16 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 1xck h PRO 113 CO 0.95 0.08 0.50 0.52 -0.21 0.00 0.00 178.00 179.84 1xck h MET 114 N 0.12 1.09 -0.35 1.05 2.86 -1.91 -1.18 114.93 116.61 1xck h MET 114 Ca 0.17 -0.09 -0.17 0.00 -2.06 0.00 0.00 59.70 57.55 1xck h MET 114 Cb 0.22 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 1xck h MET 114 CO -0.26 0.75 -0.45 -0.44 1.06 0.00 0.00 176.91 177.57 1xck h ASP 115 N 1.12 1.00 -0.84 1.22 3.32 -1.78 -1.53 116.42 118.92 1xck h ASP 115 Ca 0.29 -0.49 0.03 0.00 0.02 0.00 0.00 57.03 56.89 1xck h ASP 115 Cb -0.07 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.14 1xck h ASP 115 CO -0.06 1.30 0.54 -0.07 -1.72 0.00 0.00 179.24 179.23 1xck h LEU 116 N 0.74 0.90 -0.11 1.55 3.38 -0.68 -0.01 115.31 121.07 1xck h LEU 116 Ca 0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1xck h LEU 116 Cb 1.05 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1xck h LEU 116 CO 0.11 0.62 0.03 0.50 0.09 0.00 0.00 178.44 179.78 1xck h LYS 117 N 1.05 0.17 -0.86 1.13 3.64 -1.06 -1.24 116.57 119.40 1xck h LYS 117 Ca 0.34 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.72 1xck h LYS 117 Cb 0.01 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 1xck h LYS 117 CO -0.11 0.34 0.57 -0.09 -2.27 0.00 0.00 179.45 177.88 1xck h ARG 118 N -0.02 1.02 -0.46 1.90 2.43 -0.78 0.17 114.38 118.64 1xck h ARG 118 Ca 0.03 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.05 1xck h ARG 118 Cb 0.24 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1xck h ARG 118 CO -0.00 0.68 -0.07 0.78 -1.51 0.00 0.00 179.97 179.85 1xck h GLY 119 N 1.05 0.93 0.94 2.80 0.00 -0.83 -0.55 103.07 107.40 1xck h GLY 119 Ca 0.35 -0.74 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 1xck h GLY 119 CO -0.11 0.67 0.11 -2.22 0.00 0.00 0.00 176.54 174.99 1xck h ILE 120 N 0.70 1.12 -0.84 2.60 2.04 -0.30 -1.35 117.51 121.48 1xck h ILE 120 Ca 0.12 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.66 1xck h ILE 120 Cb 0.60 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 1xck h ILE 120 CO 0.04 0.12 0.56 0.44 0.00 0.00 0.00 178.15 179.30 1xck h ASP 121 N 0.23 0.96 -0.23 1.72 3.32 -0.54 -0.86 116.42 121.01 1xck h ASP 121 Ca 0.07 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1xck h ASP 121 Cb 0.09 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1xck h ASP 121 CO -0.01 0.69 0.12 0.50 -1.72 0.00 0.00 179.24 178.82 1xck h LYS 122 N 1.13 0.31 -0.52 3.56 3.64 -0.81 -0.31 116.57 123.58 1xck h LYS 122 Ca 0.31 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.72 1xck h LYS 122 Cb -0.11 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.59 1xck h LYS 122 CO -0.07 0.28 0.21 0.00 -2.27 0.00 0.00 179.45 177.60 1xck h ALA 123 N 1.01 0.65 -0.18 5.00 0.00 -0.79 -0.92 119.26 124.03 1xck h ALA 123 Ca 0.08 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 123 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1xck h ALA 123 CO -0.01 -0.17 0.09 0.28 0.00 0.00 0.00 179.25 179.44 1xck h VAL 124 N 0.41 1.12 -0.33 0.00 2.07 -0.84 0.24 116.25 118.92 1xck h VAL 124 Ca 0.24 -0.34 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1xck h VAL 124 Cb 0.23 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 1xck h VAL 124 CO -0.22 0.11 0.01 0.74 0.02 0.00 0.00 177.57 178.24 1xck h THR 125 N 0.16 0.77 -0.87 2.57 2.02 -0.72 0.11 112.91 116.96 1xck h THR 125 Ca 0.06 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 1xck h THR 125 Cb 0.10 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 67.12 1xck h THR 125 CO -0.01 0.02 0.46 0.00 0.37 0.00 0.00 175.52 176.36 1xck h ALA 126 N 1.28 1.17 -0.69 6.16 0.00 -0.96 -2.64 119.26 123.59 1xck h ALA 126 Ca 0.16 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1xck h ALA 126 Cb 0.21 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1xck h ALA 126 CO -0.26 0.66 0.15 0.00 0.00 0.00 0.00 179.25 179.80 1xck h ALA 127 N 1.28 0.96 -0.42 0.00 0.00 0.58 -1.66 119.26 120.00 1xck h ALA 127 Ca 0.30 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1xck h ALA 127 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1xck h ALA 127 CO -0.05 0.66 0.04 0.28 0.00 0.00 0.00 179.25 180.18 1xck h VAL 128 N 1.05 1.21 -0.13 0.00 2.07 -0.48 0.85 116.25 120.83 1xck h VAL 128 Ca 0.21 -0.83 -0.05 0.00 0.82 0.00 0.00 66.70 66.86 1xck h VAL 128 Cb 0.40 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1xck h VAL 128 CO 0.01 0.29 -0.10 -0.33 0.02 0.00 0.00 177.57 177.46 1xck h GLU 129 N 0.63 0.29 -0.23 1.57 4.39 -1.18 -2.12 114.58 117.93 1xck h GLU 129 Ca 0.13 -0.14 0.07 0.00 0.34 0.00 0.00 59.36 59.76 1xck h GLU 129 Cb 0.34 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 1xck h GLU 129 CO 0.01 0.66 0.19 1.49 -1.16 0.00 0.00 179.01 180.20 1xck h GLU 130 N -0.08 0.00 -0.06 2.33 4.57 -0.93 -0.51 114.58 119.90 1xck h GLU 130 Ca 0.02 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.00 1xck h GLU 130 Cb 0.60 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.19 1xck h GLU 130 CO 0.03 0.00 -0.81 1.25 -1.18 0.00 0.00 179.01 178.29 1xck h LEU 131 N 0.00 0.54 -0.79 1.64 5.85 -0.36 -2.12 115.31 120.08 1xck h LEU 131 Ca 0.11 -0.38 -0.12 0.00 0.84 0.00 0.00 57.88 58.32 1xck h LEU 131 Cb 0.49 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1xck h LEU 131 CO -0.00 1.15 -0.40 0.11 -0.34 0.00 0.00 178.44 178.96 1xck h LYS 132 N 0.28 0.43 -0.38 1.25 1.57 -0.46 -1.57 116.57 117.70 1xck h LYS 132 Ca -0.05 -0.21 -0.11 0.00 -1.87 0.00 0.00 60.65 58.40 1xck h LYS 132 Cb 1.42 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.72 1xck h LYS 132 CO 0.14 0.77 -0.20 0.00 -0.57 0.00 0.00 179.45 179.59 1xck h ALA 133 N 1.21 0.54 0.00 3.86 0.00 -1.35 -2.90 119.26 120.62 1xck h ALA 133 Ca 0.03 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.51 1xck h ALA 133 Cb 0.86 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1xck h ALA 133 CO 0.07 0.49 -0.32 1.25 0.00 0.00 0.00 179.25 180.75 1xck h LEU 134 N 0.61 0.00 -9.91 0.00 7.12 -1.20 -3.45 115.31 108.48 1xck h LEU 134 Ca 0.08 0.00 -0.54 0.00 0.13 0.00 0.00 57.88 57.55 1xck h LEU 134 Cb 0.76 0.00 0.11 0.00 -0.53 0.00 0.00 40.66 40.99 1xck h LEU 134 CO 0.06 0.32 0.76 -0.24 -0.13 0.00 0.00 178.44 179.21 1xck n SER 135 N -3.88 3.73 -4.48 1.25 2.88 -0.61 -4.85 113.62 107.67 1xck n SER 135 Ca -0.01 1.22 -0.33 0.00 -1.33 0.00 0.00 58.87 58.41 1xck n SER 135 Cb 0.39 -1.61 -0.13 0.00 -0.75 0.00 0.00 64.21 62.12 1xck n SER 135 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1xck s VAL 136 N -1.01 3.56 0.68 2.46 1.01 0.11 -4.90 120.40 122.32 1xck s VAL 136 Ca 0.54 -0.49 -0.16 0.00 0.00 0.00 0.00 61.98 61.88 1xck s VAL 136 Cb -0.48 -2.51 0.01 0.00 0.00 0.00 0.00 36.38 33.39 1xck s VAL 136 CO 0.62 0.53 1.17 -2.84 0.00 0.00 0.00 175.10 174.59 1xck s PRO 137 N 0.06 2.51 -0.38 2.72 0.02 -1.26 -0.07 135.00 138.60 1xck s PRO 137 Ca -0.02 1.64 0.02 0.00 0.02 0.00 0.00 61.00 62.66 1xck s PRO 137 Cb -0.14 -1.89 0.15 0.00 0.02 0.00 0.00 34.50 32.64 1xck s PRO 137 CO 0.03 -1.52 0.26 0.00 -0.33 0.00 0.00 177.00 175.44 1xck n SER 139 N 3.57 0.70 -4.76 0.00 7.64 -1.26 -4.18 113.62 115.33 1xck n SER 139 Ca 0.18 0.09 -0.39 0.00 1.01 0.00 0.00 58.87 59.76 1xck n SER 139 Cb 0.41 -0.22 0.03 0.00 -1.01 0.00 0.00 64.21 63.42 1xck n SER 139 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1xck s ASP 140 N -5.62 5.54 0.14 6.43 -4.77 -1.26 -4.76 116.67 112.38 1xck s ASP 140 Ca -0.01 2.82 0.11 0.00 -3.30 0.00 0.00 52.55 52.18 1xck s ASP 140 Cb 0.00 -2.64 0.57 0.00 -1.09 0.00 0.00 42.92 39.76 1xck s ASP 140 CO 0.01 -1.39 1.34 -1.54 0.70 0.00 0.00 175.17 174.29 1xck n SER 141 N -0.66 0.26 -0.00 2.11 3.41 -1.26 -1.05 113.62 116.43 1xck n SER 141 Ca 0.08 0.61 -0.12 0.00 -0.26 0.00 0.00 58.87 59.18 1xck n SER 141 Cb 0.44 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 1xck n SER 141 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1xck h LYS 142 N 0.00 0.62 -0.04 4.33 3.64 -2.00 -1.97 116.57 121.16 1xck h LYS 142 Ca 0.00 -0.45 -0.14 0.00 -1.27 0.00 0.00 60.65 58.79 1xck h LYS 142 Cb 0.04 0.08 0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1xck h LYS 142 CO 0.00 1.07 -0.51 0.00 -2.27 0.00 0.00 179.45 177.74 1xck h ALA 143 N 0.82 0.11 -0.90 5.00 0.00 -1.44 -2.78 119.26 120.07 1xck h ALA 143 Ca -0.02 -0.53 0.13 0.00 0.00 0.00 0.00 54.91 54.50 1xck h ALA 143 Cb 1.24 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1xck h ALA 143 CO 0.13 0.31 0.58 0.82 0.00 0.00 0.00 179.25 181.09 1xck h ILE 144 N -0.09 0.87 -0.16 0.00 2.04 -1.40 -0.32 117.51 118.46 1xck h ILE 144 Ca -0.05 -0.26 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 1xck h ILE 144 Cb 1.20 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1xck h ILE 144 CO 0.10 0.14 -0.06 0.00 0.00 0.00 0.00 178.15 178.33 1xck h ALA 145 N 1.59 0.22 -0.65 1.87 0.00 -1.34 -1.95 119.26 119.00 1xck h ALA 145 Ca 0.45 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1xck h ALA 145 Cb 0.63 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1xck h ALA 145 CO -0.21 0.01 0.42 1.96 0.00 0.00 0.00 179.25 181.44 1xck h GLN 146 N 0.00 0.83 0.14 0.00 4.20 -0.97 0.14 115.11 119.45 1xck h GLN 146 Ca 0.04 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1xck h GLN 146 Cb 0.52 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1xck h GLN 146 CO 0.02 0.55 -0.07 0.28 -0.67 0.00 0.00 178.83 178.94 1xck h VAL 147 N 0.86 0.96 -0.87 -0.54 2.07 -1.12 -0.22 116.25 117.38 1xck h VAL 147 Ca 0.25 -0.38 0.09 0.00 0.82 0.00 0.00 66.70 67.48 1xck h VAL 147 Cb -0.06 1.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 1xck h VAL 147 CO -0.07 0.09 0.56 1.23 0.02 0.00 0.00 177.57 179.40 1xck h GLY 148 N -0.36 1.24 0.94 2.17 0.00 -1.08 -0.05 103.07 105.92 1xck h GLY 148 Ca -0.02 -0.36 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 1xck h GLY 148 CO 0.03 0.22 -0.02 -0.84 0.00 0.00 0.00 176.54 175.94 1xck h THR 149 N 0.89 1.26 -0.66 4.70 2.02 -0.34 0.91 112.91 121.69 1xck h THR 149 Ca 0.39 -1.03 -0.08 0.00 0.77 0.00 0.00 66.41 66.47 1xck h THR 149 Cb 0.35 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.91 1xck h THR 149 CO -0.16 0.34 0.11 0.40 0.37 0.00 0.00 175.52 176.58 1xck h ILE 150 N 0.50 1.26 0.00 3.11 2.04 -0.39 0.45 117.51 124.49 1xck h ILE 150 Ca 0.11 -1.03 -0.11 0.00 1.00 0.00 0.00 64.86 64.83 1xck h ILE 150 Cb 0.49 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1xck h ILE 150 CO 0.02 0.39 -0.52 0.28 0.00 0.00 0.00 178.15 178.32 1xck h SER 151 N 1.02 0.00 -0.10 1.72 0.02 -0.90 -2.68 113.55 112.64 1xck h SER 151 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1xck h SER 151 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 1xck h SER 151 CO 0.01 0.52 0.00 0.00 -1.14 0.00 0.00 176.83 176.23 1xck n ALA 152 N -2.37 2.50 -2.72 3.77 0.00 0.30 -4.49 120.51 117.49 1xck n ALA 152 Ca -0.01 -0.19 -0.06 0.00 0.00 0.00 0.00 53.44 53.18 1xck n ALA 152 Cb 0.57 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 19.02 1xck n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xck n ASN 153 N -0.23 -2.96 -0.46 0.00 5.15 -1.01 -3.71 115.26 112.05 1xck n ASN 153 Ca 0.05 -0.13 -0.05 0.00 -0.60 0.00 0.00 54.58 53.84 1xck n ASN 153 Cb 0.10 -1.61 -0.02 0.00 -0.53 0.00 0.00 39.78 37.72 1xck n ASN 153 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1xck n SER 154 N 0.20 -3.22 -4.42 1.20 7.64 0.16 -5.00 113.62 110.19 1xck n SER 154 Ca -0.00 0.09 -0.44 0.00 1.01 0.00 0.00 58.87 59.52 1xck n SER 154 Cb 0.52 -1.59 -0.05 0.00 -1.01 0.00 0.00 64.21 62.07 1xck n SER 154 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1xck s ASP 155 N -2.89 6.21 0.46 6.43 -1.08 -1.10 -4.91 116.67 119.79 1xck s ASP 155 Ca 0.00 -1.11 0.12 0.00 -0.52 0.00 0.00 52.55 51.04 1xck s ASP 155 Cb 0.00 -2.30 1.07 0.00 -1.46 0.00 0.00 42.92 40.22 1xck s ASP 155 CO 0.00 -1.02 2.08 -0.33 0.52 0.00 0.00 175.17 176.43 1xck h GLU 156 N 9.11 0.28 -0.43 4.34 5.08 -1.94 -2.57 114.58 128.44 1xck h GLU 156 Ca -0.28 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.12 1xck h GLU 156 Cb 1.09 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 30.22 1xck h GLU 156 CO 1.03 0.19 0.14 1.15 -1.00 0.00 0.00 179.01 180.52 1xck h THR 157 N 0.29 0.84 -0.64 1.13 2.02 -1.97 0.25 112.91 114.83 1xck h THR 157 Ca 0.11 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 1xck h THR 157 Cb 0.09 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 1xck h THR 157 CO -0.02 0.05 0.26 0.58 0.37 0.00 0.00 175.52 176.76 1xck h VAL 158 N 0.30 1.23 -0.18 3.16 2.07 -1.82 0.73 116.25 121.75 1xck h VAL 158 Ca 0.20 -0.72 0.03 0.00 0.82 0.00 0.00 66.70 67.03 1xck h VAL 158 Cb 0.21 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1xck h VAL 158 CO -0.22 0.29 0.02 1.23 0.02 0.00 0.00 177.57 178.90 1xck h GLY 159 N 0.90 0.19 0.67 2.17 0.00 -1.23 -0.37 103.07 105.39 1xck h GLY 159 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 1xck h GLY 159 CO -0.02 -0.01 -0.37 1.70 0.00 0.00 0.00 176.54 177.83 1xck h LYS 160 N 0.09 -0.78 -0.56 4.80 3.64 -0.65 -0.10 116.57 123.01 1xck h LYS 160 Ca 0.08 0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.61 1xck h LYS 160 Cb 0.09 0.18 -0.11 0.00 -0.41 0.00 0.00 32.23 31.98 1xck h LYS 160 CO -0.12 -0.52 -0.39 -0.07 -2.27 0.00 0.00 179.45 176.07 1xck h LEU 161 N -0.81 -1.35 -0.49 5.20 3.38 -0.58 0.22 115.31 120.87 1xck h LEU 161 Ca -0.04 0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1xck h LEU 161 Cb 0.71 0.63 -0.02 0.00 0.09 0.00 0.00 40.66 42.06 1xck h LEU 161 CO -0.03 -0.33 0.31 0.40 0.09 0.00 0.00 178.44 178.88 1xck h ILE 162 N -0.21 1.14 -0.26 1.22 2.04 -0.92 -0.78 117.51 119.74 1xck h ILE 162 Ca 0.20 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.78 1xck h ILE 162 Cb 0.56 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1xck h ILE 162 CO -0.67 0.14 0.11 0.00 0.00 0.00 0.00 178.15 177.73 1xck h ALA 163 N 1.16 0.30 -0.74 1.87 0.00 0.31 -0.20 119.26 121.96 1xck h ALA 163 Ca 0.18 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1xck h ALA 163 Cb -0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1xck h ALA 163 CO -0.04 -0.30 0.35 0.93 0.00 0.00 0.00 179.25 180.19 1xck h GLU 164 N 0.23 1.06 -0.64 0.00 5.08 -0.38 -1.48 114.58 118.45 1xck h GLU 164 Ca 0.11 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 1xck h GLU 164 Cb 0.06 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1xck h GLU 164 CO -0.10 0.83 0.04 0.00 -1.00 0.00 0.00 179.01 178.79 1xck h ALA 165 N 1.17 0.87 0.00 3.43 0.00 -0.73 -2.00 119.26 122.00 1xck h ALA 165 Ca 0.25 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1xck h ALA 165 Cb 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1xck h ALA 165 CO -0.03 0.67 -0.43 0.52 0.00 0.00 0.00 179.25 179.98 1xck h MET 166 N 1.01 0.00 -0.39 0.00 2.86 -0.78 -2.41 114.93 115.22 1xck h MET 166 Ca 0.19 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.72 1xck h MET 166 Cb 0.52 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 1xck h MET 166 CO 0.02 0.43 -0.18 0.22 1.06 0.00 0.00 176.91 178.46 1xck h ASP 167 N 0.00 0.75 0.12 1.22 3.58 -0.82 0.60 116.42 121.87 1xck h ASP 167 Ca -0.00 -0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.19 1xck h ASP 167 Cb 0.80 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.65 1xck h ASP 167 CO 0.06 0.93 -0.06 0.11 -2.88 0.00 0.00 179.24 177.40 1xck h LYS 168 N 0.66 -0.15 -0.01 0.28 1.79 -0.89 -3.34 116.57 114.90 1xck h LYS 168 Ca 0.10 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.58 1xck h LYS 168 Cb 0.67 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.36 1xck h LYS 168 CO 0.05 0.20 -0.71 1.33 -1.08 0.00 0.00 179.45 179.24 1xck n VAL 169 N -4.99 0.00 0.00 0.50 0.24 -1.01 -5.10 118.33 107.97 1xck n VAL 169 Ca -0.09 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.07 1xck n VAL 169 Cb 0.22 1.15 0.00 0.00 -1.47 0.00 0.00 33.84 33.74 1xck n VAL 169 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xck n GLY 170 N 1.46 0.17 0.37 7.63 0.00 0.21 -3.29 105.19 111.74 1xck n GLY 170 Ca 0.07 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1xck n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xck h LYS 171 N 0.00 1.22 -0.02 1.61 1.79 -1.95 -1.70 116.57 117.52 1xck h LYS 171 Ca 0.00 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1xck h LYS 171 Cb 0.00 -0.28 0.00 0.00 -1.58 0.00 0.00 32.23 30.37 1xck h LYS 171 CO 0.00 0.81 0.00 0.39 -1.08 0.00 0.00 179.45 179.57 1xck n GLU 172 N -4.45 1.46 -1.02 3.15 -0.58 -1.26 -4.96 120.64 112.97 1xck n GLU 172 Ca 0.14 -0.67 -0.30 0.00 -0.42 0.00 0.00 57.16 55.90 1xck n GLU 172 Cb 0.10 -1.47 0.14 0.00 -0.57 0.00 0.00 31.44 29.64 1xck n GLU 172 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1xck s GLY 173 N -1.95 1.64 -0.27 0.62 0.00 -0.64 -5.01 107.32 101.72 1xck s GLY 173 Ca 0.40 0.17 -0.15 0.00 0.00 0.00 0.00 44.72 45.14 1xck s GLY 173 CO 0.33 0.63 0.39 0.14 0.00 0.00 0.00 173.10 174.60 1xck s VAL 174 N -2.81 5.16 -0.10 1.40 1.01 -1.26 -4.96 120.40 118.84 1xck s VAL 174 Ca 0.64 0.62 0.02 0.00 0.00 0.00 0.00 61.98 63.25 1xck s VAL 174 Cb -0.20 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 1xck s VAL 174 CO 0.58 0.14 -0.16 -0.63 0.00 0.00 0.00 175.10 175.03 1xck s ILE 175 N 2.11 2.84 0.27 2.22 1.01 -1.26 0.14 121.20 128.52 1xck s ILE 175 Ca 0.16 -0.76 0.12 0.00 0.00 0.00 0.00 60.65 60.17 1xck s ILE 175 Cb -0.16 -2.15 -0.05 0.00 0.01 0.00 0.00 42.46 40.11 1xck s ILE 175 CO 0.10 0.55 -0.20 -0.89 0.00 0.00 0.00 174.94 174.49 1xck s THR 176 N 0.05 2.47 -0.05 2.92 2.01 0.14 -4.95 115.64 118.24 1xck s THR 176 Ca -0.06 -2.36 0.02 0.00 0.31 0.00 0.00 61.69 59.60 1xck s THR 176 Cb -0.15 -2.28 0.02 0.00 0.01 0.00 0.00 72.50 70.09 1xck s THR 176 CO 0.05 -0.36 -0.08 -0.69 -0.69 0.00 0.00 174.62 172.84 1xck s VAL 177 N -2.40 0.78 0.20 3.82 1.01 -1.26 -0.77 120.40 121.77 1xck s VAL 177 Ca 0.29 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1xck s VAL 177 Cb -0.05 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 1xck s VAL 177 CO 0.14 0.27 0.08 -1.61 0.00 0.00 0.00 175.10 173.99 1xck s GLU 178 N 0.67 1.21 0.52 2.72 2.02 0.14 -4.96 118.70 121.01 1xck s GLU 178 Ca -0.11 -1.62 -0.22 0.00 0.02 0.00 0.00 54.97 53.04 1xck s GLU 178 Cb -0.14 -0.01 -0.06 0.00 0.10 0.00 0.00 34.13 34.03 1xck s GLU 178 CO 0.01 -0.29 1.29 -0.51 0.02 0.00 0.00 175.26 175.78 1xck s ASP 179 N -3.19 5.56 0.52 -0.19 1.01 -1.26 -1.92 116.67 117.21 1xck s ASP 179 Ca 0.33 2.59 -0.09 0.00 0.71 0.00 0.00 52.55 56.10 1xck s ASP 179 Cb 0.07 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.33 1xck s ASP 179 CO 0.09 -1.36 0.89 -0.83 0.21 0.00 0.00 175.17 174.17 1xck s GLY 180 N -1.12 1.66 0.34 0.21 0.00 -0.34 -4.48 107.32 103.59 1xck s GLY 180 Ca 0.69 -0.26 0.24 0.00 0.00 0.00 0.00 44.72 45.39 1xck s GLY 180 CO 0.43 -0.05 1.58 -0.91 0.00 0.00 0.00 173.10 174.15 1xck h THR 181 N 0.20 0.00 -0.02 0.90 1.35 -1.88 -3.48 112.91 109.99 1xck h THR 181 Ca -0.46 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.56 1xck h THR 181 Cb 1.20 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.38 1xck h THR 181 CO 0.62 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.50 1xck n GLY 182 N 1.17 1.06 3.76 5.82 0.00 -1.26 -5.12 105.19 110.63 1xck n GLY 182 Ca 0.04 -0.34 -0.39 0.00 0.00 0.00 0.00 46.02 45.32 1xck n GLY 182 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xck s LEU 183 N 0.00 4.49 0.00 0.99 1.98 -1.19 -2.55 118.68 122.40 1xck s LEU 183 Ca 0.00 2.08 0.00 0.00 -2.89 0.00 0.00 54.13 53.32 1xck s LEU 183 Cb 0.00 -3.76 0.00 0.00 0.66 0.00 0.00 46.19 43.09 1xck s LEU 183 CO 0.00 -0.10 0.00 0.00 -1.89 0.00 0.00 176.35 174.36 1xck n GLN 184 N 0.99 0.00 -0.94 1.98 6.02 -1.26 -4.78 117.38 119.39 1xck n GLN 184 Ca 0.00 0.15 -0.28 0.00 -0.01 0.00 0.00 57.00 56.85 1xck n GLN 184 Cb 0.47 0.00 0.21 0.00 1.02 0.00 0.00 30.24 31.94 1xck n GLN 184 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1xck s ASP 185 N -0.05 1.79 -0.09 1.08 1.01 -1.26 -4.11 116.67 115.05 1xck s ASP 185 Ca 0.00 1.23 -0.11 0.00 0.71 0.00 0.00 52.55 54.38 1xck s ASP 185 Cb 0.00 -1.91 0.03 0.00 1.01 0.00 0.00 42.92 42.04 1xck s ASP 185 CO 0.00 -3.65 0.29 -1.61 0.21 0.00 0.00 175.17 170.40 1xck s GLU 186 N -4.82 0.41 -0.01 8.23 2.02 -0.29 -4.88 118.70 119.36 1xck s GLU 186 Ca 0.67 0.25 0.01 0.00 0.02 0.00 0.00 54.97 55.92 1xck s GLU 186 Cb -0.20 0.19 0.00 0.00 0.10 0.00 0.00 34.13 34.22 1xck s GLU 186 CO 0.60 -0.07 -0.03 -1.17 0.02 0.00 0.00 175.26 174.61 1xck s LEU 187 N -0.22 1.83 -0.29 1.80 2.96 -1.26 -0.65 118.68 122.86 1xck s LEU 187 Ca -0.03 -0.06 -0.21 0.00 -0.22 0.00 0.00 54.13 53.60 1xck s LEU 187 Cb -0.03 -0.21 0.15 0.00 0.50 0.00 0.00 46.19 46.60 1xck s LEU 187 CO 0.01 0.02 1.11 1.51 -1.32 0.00 0.00 176.35 177.68 1xck s ASP 188 N 0.14 -0.36 -0.17 3.68 -4.77 -1.11 -4.98 116.67 109.10 1xck s ASP 188 Ca -0.01 0.65 -0.22 0.00 -3.30 0.00 0.00 52.55 49.67 1xck s ASP 188 Cb -0.04 0.86 -0.03 0.00 -1.09 0.00 0.00 42.92 42.62 1xck s ASP 188 CO -0.00 -0.11 0.67 -0.69 0.70 0.00 0.00 175.17 175.74 1xck s VAL 189 N 0.62 5.01 0.49 2.11 1.01 -1.26 -1.40 120.40 126.98 1xck s VAL 189 Ca -0.01 1.29 0.03 0.00 0.00 0.00 0.00 61.98 63.29 1xck s VAL 189 Cb -0.04 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 1xck s VAL 189 CO -0.11 0.13 0.03 0.68 0.00 0.00 0.00 175.10 175.82 1xck s VAL 190 N 1.74 1.37 0.15 2.92 -7.23 -0.82 -4.91 120.40 113.61 1xck s VAL 190 Ca 0.32 -1.96 -0.31 0.00 -1.81 0.00 0.00 61.98 58.21 1xck s VAL 190 Cb -0.16 -2.33 -0.08 0.00 0.56 0.00 0.00 36.38 34.37 1xck s VAL 190 CO 0.12 0.00 1.36 -1.61 -0.31 0.00 0.00 175.10 174.66 1xck s GLU 191 N -3.87 4.35 -0.08 4.82 0.41 -1.26 -1.64 118.70 121.42 1xck s GLU 191 Ca 0.13 2.07 -0.32 0.00 -0.41 0.00 0.00 54.97 56.44 1xck s GLU 191 Cb 0.03 -3.22 0.14 0.00 -1.78 0.00 0.00 34.13 29.30 1xck s GLU 191 CO 0.07 -0.36 1.41 0.20 -0.49 0.00 0.00 175.26 176.09 1xck s GLY 192 N 0.79 -0.49 0.23 -1.39 0.00 -1.26 0.56 107.32 105.76 1xck s GLY 192 Ca 0.61 0.93 -0.19 0.00 0.00 0.00 0.00 44.72 46.07 1xck s GLY 192 CO 0.34 0.17 0.60 -0.29 0.00 0.00 0.00 173.10 173.92 1xck s MET 193 N -2.10 1.53 -0.16 2.90 1.75 -0.68 -3.92 119.30 118.62 1xck s MET 193 Ca 0.15 -0.89 -0.06 0.00 -1.25 0.00 0.00 55.69 53.64 1xck s MET 193 Cb 0.07 0.56 0.07 0.00 2.84 0.00 0.00 34.83 38.37 1xck s MET 193 CO -0.06 -0.67 0.33 -1.14 -0.65 0.00 0.00 175.02 172.83 1xck s GLN 194 N -3.89 0.24 0.25 4.11 0.74 -1.26 -0.72 119.66 119.13 1xck s GLN 194 Ca 0.10 0.84 0.10 0.00 0.05 0.00 0.00 55.36 56.45 1xck s GLN 194 Cb -0.03 0.10 -0.05 0.00 1.10 0.00 0.00 33.01 34.13 1xck s GLN 194 CO 0.00 -0.25 -0.11 -0.59 -0.55 0.00 0.00 175.29 173.79 1xck s PHE 195 N 2.31 2.52 -1.28 1.67 -0.71 -0.25 -4.98 117.98 117.25 1xck s PHE 195 Ca -0.02 -0.27 -0.17 0.00 -1.04 0.00 0.00 56.93 55.43 1xck s PHE 195 Cb -0.12 -1.14 0.09 0.00 -1.21 0.00 0.00 43.02 40.64 1xck s PHE 195 CO -0.10 0.62 1.68 -0.51 -1.34 0.00 0.00 175.22 175.56 1xck s ASP 196 N -3.36 6.89 -0.22 1.98 1.01 -1.26 -1.36 116.67 120.34 1xck s ASP 196 Ca 0.29 -2.56 -0.15 0.00 0.71 0.00 0.00 52.55 50.84 1xck s ASP 196 Cb -0.07 -2.54 0.07 0.00 1.01 0.00 0.00 42.92 41.39 1xck s ASP 196 CO 0.16 -1.09 0.57 -0.13 0.21 0.00 0.00 175.17 174.89 1xck s ARG 197 N 3.69 0.60 0.05 8.23 1.81 -1.17 -4.86 118.95 127.30 1xck s ARG 197 Ca 0.52 0.94 0.00 0.00 -1.72 0.00 0.00 55.73 55.48 1xck s ARG 197 Cb 0.03 0.16 0.00 0.00 -0.45 0.00 0.00 34.95 34.69 1xck s ARG 197 CO 0.06 -0.13 0.04 0.41 -0.68 0.00 0.00 175.30 175.01 1xck n GLY 198 N 3.75 2.78 3.77 -3.53 0.00 -1.25 -0.57 105.19 110.14 1xck n GLY 198 Ca -0.19 -2.17 -0.40 0.00 0.00 0.00 0.00 46.02 43.26 1xck n GLY 198 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xck s TYR 199 N -0.00 2.48 -1.97 1.61 -0.85 -0.63 -4.47 117.35 113.51 1xck s TYR 199 Ca 0.03 1.22 0.00 0.00 -0.52 0.00 0.00 57.07 57.80 1xck s TYR 199 Cb -0.00 -3.97 0.00 0.00 0.38 0.00 0.00 41.96 38.37 1xck s TYR 199 CO 0.02 -3.00 0.92 1.28 -1.52 0.00 0.00 175.55 173.25 1xck n LEU 200 N 0.01 0.02 0.00 -3.49 4.77 -0.46 -4.77 117.00 113.08 1xck n LEU 200 Ca 0.04 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1xck n LEU 200 Cb 0.41 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1xck n LEU 200 CO 0.61 0.01 0.00 -0.24 -1.33 0.00 0.00 177.39 176.43 1xck n SER 201 N -0.49 0.00 -3.77 -1.43 2.88 -1.26 -5.08 113.62 104.47 1xck n SER 201 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1xck n SER 201 Cb 0.01 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 1xck n SER 201 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1xck n PRO 202 N -0.43 1.58 0.00 -1.46 -0.02 -1.26 -3.61 135.00 129.80 1xck n PRO 202 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1xck n PRO 202 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1xck n PRO 202 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1xck n TYR 203 N -0.41 0.00 0.39 6.00 4.01 -1.26 -4.43 117.16 121.46 1xck n TYR 203 Ca 0.00 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.79 1xck n TYR 203 Cb 0.00 0.00 0.23 0.00 -0.31 0.00 0.00 39.34 39.26 1xck n TYR 203 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1xck n PHE 204 N 0.00 0.00 -2.17 -0.72 3.72 -1.24 -4.65 117.46 112.40 1xck n PHE 204 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 1xck n PHE 204 Cb 0.00 -0.47 -0.03 0.00 -0.94 0.00 0.00 39.48 38.04 1xck n PHE 204 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1xck s ILE 205 N -2.94 3.67 -0.14 4.37 1.01 -1.26 -4.59 121.20 121.32 1xck s ILE 205 Ca 0.06 1.01 0.01 0.00 0.00 0.00 0.00 60.65 61.73 1xck s ILE 205 Cb 0.07 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.91 1xck s ILE 205 CO 0.19 -0.02 0.62 -0.46 0.00 0.00 0.00 174.94 175.27 1xck n ASN 206 N 5.80 1.27 -3.37 3.58 0.23 -1.14 -4.74 115.26 116.89 1xck n ASN 206 Ca 0.14 -1.22 -0.26 0.00 -0.53 0.00 0.00 54.58 52.72 1xck n ASN 206 Cb 0.43 -0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.05 1xck n ASN 206 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1xck n LYS 207 N -0.01 1.55 0.06 -3.83 4.76 -0.90 -4.95 118.16 114.83 1xck n LYS 207 Ca 0.01 -3.96 0.21 0.00 -2.87 0.00 0.00 58.31 51.70 1xck n LYS 207 Cb 0.07 -1.80 0.73 0.00 -1.84 0.00 0.00 35.03 32.19 1xck n LYS 207 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1xck h PRO 208 N 4.33 0.00 -0.18 1.97 0.13 -1.85 0.56 132.00 136.96 1xck h PRO 208 Ca 0.15 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.23 1xck h PRO 208 Cb 0.78 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 1xck h PRO 208 CO 0.64 0.00 -0.10 0.93 -0.23 0.00 0.00 178.00 179.24 1xck h GLU 209 N 0.00 0.39 0.00 0.86 3.07 -1.94 -3.02 114.58 113.93 1xck h GLU 209 Ca 0.23 -0.17 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1xck h GLU 209 Cb 1.22 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1xck h GLU 209 CO -0.00 0.70 -0.38 1.15 -1.40 0.00 0.00 179.01 179.07 1xck h THR 210 N 0.07 0.00 -2.02 1.13 2.02 -1.58 -3.47 112.91 109.05 1xck h THR 210 Ca 0.04 -0.82 -0.30 0.00 0.77 0.00 0.00 66.41 66.10 1xck h THR 210 Cb 0.58 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 1xck h THR 210 CO 0.03 0.00 -0.38 0.61 0.37 0.00 0.00 175.52 176.15 1xck n GLY 211 N 1.20 -0.10 3.40 2.16 0.00 0.18 -4.99 105.19 107.04 1xck n GLY 211 Ca 0.03 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 1xck n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xck s ALA 212 N -2.73 2.15 -0.03 4.61 0.00 -1.06 -4.61 121.76 120.09 1xck s ALA 212 Ca 0.00 -1.91 -0.04 0.00 0.00 0.00 0.00 51.96 50.01 1xck s ALA 212 Cb 0.00 0.49 -0.04 0.00 0.00 0.00 0.00 23.12 23.57 1xck s ALA 212 CO 0.00 -0.23 0.17 0.08 0.00 0.00 0.00 175.76 175.78 1xck s VAL 213 N -3.28 5.45 -0.17 0.00 1.01 -0.19 -2.12 120.40 121.11 1xck s VAL 213 Ca 0.32 -0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.18 1xck s VAL 213 Cb 0.06 -3.51 0.07 0.00 0.00 0.00 0.00 36.38 33.00 1xck s VAL 213 CO 0.12 0.39 0.14 -0.70 0.00 0.00 0.00 175.10 175.04 1xck s GLU 214 N -1.75 0.09 -0.06 2.72 2.12 -1.26 -1.36 118.70 119.20 1xck s GLU 214 Ca 0.25 0.09 0.04 0.00 0.36 0.00 0.00 54.97 55.70 1xck s GLU 214 Cb -0.12 -1.43 -0.02 0.00 0.26 0.00 0.00 34.13 32.81 1xck s GLU 214 CO 0.16 -0.62 -0.15 -0.51 -0.54 0.00 0.00 175.26 173.60 1xck s LEU 215 N 2.21 2.66 -0.13 2.70 1.43 -0.77 -4.96 118.68 121.83 1xck s LEU 215 Ca 0.04 -0.24 -0.01 0.00 -1.03 0.00 0.00 54.13 52.89 1xck s LEU 215 Cb -0.15 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.51 1xck s LEU 215 CO -0.09 0.32 -0.10 -1.61 0.23 0.00 0.00 176.35 175.10 1xck s GLU 216 N -0.59 3.35 -1.46 1.70 2.02 -1.26 -1.72 118.70 120.73 1xck s GLU 216 Ca 0.09 -0.63 -0.06 0.00 0.02 0.00 0.00 54.97 54.39 1xck s GLU 216 Cb -0.11 -2.69 0.04 0.00 0.10 0.00 0.00 34.13 31.47 1xck s GLU 216 CO 0.01 0.29 0.63 0.43 0.02 0.00 0.00 175.26 176.64 1xck n SER 217 N 3.32 -1.74 -4.91 -0.19 7.64 0.15 -4.62 113.62 113.27 1xck n SER 217 Ca -0.18 -0.93 -0.27 0.00 1.01 0.00 0.00 58.87 58.50 1xck n SER 217 Cb 0.53 -3.34 0.02 0.00 -1.01 0.00 0.00 64.21 60.41 1xck n SER 217 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1xck s PRO 218 N -6.51 3.11 0.20 1.43 0.04 -1.13 -4.57 135.00 127.57 1xck s PRO 218 Ca 0.24 0.12 -0.04 0.00 0.04 0.00 0.00 61.00 61.36 1xck s PRO 218 Cb -0.13 -2.27 -0.05 0.00 0.04 0.00 0.00 34.50 32.09 1xck s PRO 218 CO 0.87 -0.59 0.43 -0.06 0.04 0.00 0.00 177.00 177.69 1xck s PHE 219 N -2.97 3.47 -0.19 0.56 0.08 -0.67 -3.09 117.98 115.17 1xck s PHE 219 Ca 0.53 0.54 0.01 0.00 0.12 0.00 0.00 56.93 58.13 1xck s PHE 219 Cb -0.11 -2.01 0.04 0.00 -0.57 0.00 0.00 43.02 40.38 1xck s PHE 219 CO 0.46 0.35 -0.12 0.42 -0.10 0.00 0.00 175.22 176.23 1xck s ILE 220 N -1.82 1.67 -0.25 0.64 1.01 -0.16 -0.77 121.20 121.52 1xck s ILE 220 Ca 0.41 -0.96 -0.19 0.00 0.00 0.00 0.00 60.65 59.91 1xck s ILE 220 Cb -0.11 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 1xck s ILE 220 CO 0.27 0.23 0.58 -0.22 0.00 0.00 0.00 174.94 175.80 1xck s LEU 221 N 1.39 4.07 -0.38 2.97 2.96 0.71 -0.53 118.68 129.87 1xck s LEU 221 Ca -0.00 0.66 -0.07 0.00 -0.22 0.00 0.00 54.13 54.50 1xck s LEU 221 Cb -0.16 -2.78 0.07 0.00 0.50 0.00 0.00 46.19 43.82 1xck s LEU 221 CO -0.09 -0.32 0.18 -0.76 -1.32 0.00 0.00 176.35 174.04 1xck s LEU 222 N 2.34 4.78 -0.19 -0.68 1.43 -1.26 -0.09 118.68 125.01 1xck s LEU 222 Ca 0.25 -1.44 0.01 0.00 -1.03 0.00 0.00 54.13 51.91 1xck s LEU 222 Cb -0.16 -1.90 0.03 0.00 0.03 0.00 0.00 46.19 44.20 1xck s LEU 222 CO 0.09 -0.44 -0.15 0.00 0.23 0.00 0.00 176.35 176.08 1xck s ALA 223 N 1.36 2.14 -1.26 4.21 0.00 -0.95 -0.47 121.76 126.79 1xck s ALA 223 Ca 0.02 -1.20 -0.15 0.00 0.00 0.00 0.00 51.96 50.63 1xck s ALA 223 Cb -0.21 -1.22 0.13 0.00 0.00 0.00 0.00 23.12 21.81 1xck s ALA 223 CO 0.01 -0.60 1.59 -3.47 0.00 0.00 0.00 175.76 173.30 1xck n ASP 224 N 4.66 5.07 0.00 0.00 2.03 -0.67 -3.01 116.55 124.64 1xck n ASP 224 Ca -0.17 -2.96 0.00 0.00 0.52 0.00 0.00 54.79 52.18 1xck n ASP 224 Cb 0.48 -1.64 0.00 0.00 -0.72 0.00 0.00 41.12 39.24 1xck n ASP 224 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1xck n LYS 225 N 6.73 0.00 -2.66 -0.67 -0.00 -1.26 -4.19 118.16 116.12 1xck n LYS 225 Ca 0.42 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 58.33 1xck n LYS 225 Cb 0.44 0.00 -0.05 0.00 -0.00 0.00 0.00 35.03 35.42 1xck n LYS 225 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1xck s LYS 226 N -2.00 4.73 -0.29 -1.58 1.02 -1.26 -2.43 119.74 117.94 1xck s LYS 226 Ca 0.00 1.57 -0.05 0.00 0.02 0.00 0.00 55.97 57.51 1xck s LYS 226 Cb 0.00 -3.29 0.02 0.00 -0.52 0.00 0.00 37.83 34.04 1xck s LYS 226 CO 0.00 0.31 0.04 0.42 -0.92 0.00 0.00 175.35 175.20 1xck s ILE 227 N -0.69 3.63 -0.08 2.17 1.01 0.55 -4.94 121.20 122.85 1xck s ILE 227 Ca 0.45 -0.84 0.06 0.00 0.00 0.00 0.00 60.65 60.32 1xck s ILE 227 Cb -0.27 -2.89 -0.09 0.00 0.01 0.00 0.00 42.46 39.22 1xck s ILE 227 CO 0.33 0.08 0.17 -1.20 0.00 0.00 0.00 174.94 174.32 1xck n SER 228 N 4.80 2.73 -4.02 3.58 7.64 -1.26 -0.29 113.62 126.80 1xck n SER 228 Ca -0.15 -0.16 -0.26 0.00 1.01 0.00 0.00 58.87 59.31 1xck n SER 228 Cb 0.47 1.22 -0.17 0.00 -1.01 0.00 0.00 64.21 64.73 1xck n SER 228 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1xck s ASN 229 N -2.45 2.01 0.00 6.43 0.01 -1.26 -1.57 114.94 118.11 1xck s ASN 229 Ca -0.01 -0.33 0.00 0.00 -0.71 0.00 0.00 52.86 51.80 1xck s ASN 229 Cb 0.04 -0.90 0.00 0.00 0.41 0.00 0.00 41.25 40.80 1xck s ASN 229 CO 0.26 0.01 0.45 0.00 -1.51 0.00 0.00 177.10 176.31 1xck n ILE 230 N 4.02 0.00 0.05 0.60 3.06 -1.26 -3.36 119.36 122.47 1xck n ILE 230 Ca -0.21 0.00 -0.21 0.00 -2.50 0.00 0.00 62.75 59.84 1xck n ILE 230 Cb 0.51 -0.36 -0.11 0.00 0.54 0.00 0.00 39.64 40.23 1xck n ILE 230 CO 0.00 0.00 0.00 -0.09 -2.50 0.00 0.00 176.55 173.96 1xck h ARG 231 N 0.18 0.68 0.00 9.51 2.43 -1.97 -3.18 114.38 122.03 1xck h ARG 231 Ca 0.00 -0.77 -0.08 0.00 -0.81 0.00 0.00 59.98 58.32 1xck h ARG 231 Cb 0.34 0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1xck h ARG 231 CO 0.00 1.34 -0.39 0.93 -1.51 0.00 0.00 179.97 180.34 1xck h GLU 232 N 0.36 0.00 -0.39 0.20 5.08 -1.96 -3.22 114.58 114.64 1xck h GLU 232 Ca -0.14 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.08 1xck h GLU 232 Cb 1.74 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.98 1xck h GLU 232 CO 0.21 0.39 -0.29 0.52 -1.00 0.00 0.00 179.01 178.84 1xck h MET 233 N 0.00 0.89 -0.43 2.33 2.86 -1.76 -3.33 114.93 115.49 1xck h MET 233 Ca -0.00 -0.43 0.04 0.00 -2.06 0.00 0.00 59.70 57.24 1xck h MET 233 Cb 0.82 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.43 1xck h MET 233 CO 0.05 1.08 -0.25 1.28 1.06 0.00 0.00 176.91 180.13 1xck n LEU 234 N -4.15 -0.45 -0.31 1.22 4.77 -1.21 0.01 117.00 116.89 1xck n LEU 234 Ca -0.02 0.87 0.10 0.00 -0.03 0.00 0.00 56.01 56.93 1xck n LEU 234 Cb 0.49 -0.15 0.27 0.00 -2.33 0.00 0.00 43.42 41.69 1xck n LEU 234 CO 0.47 -0.67 1.10 1.55 -1.33 0.00 0.00 177.39 178.50 1xck h PRO 235 N 0.00 0.56 0.00 3.23 0.13 -1.82 0.00 132.00 134.10 1xck h PRO 235 Ca 0.07 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 65.08 1xck h PRO 235 Cb 0.17 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.17 1xck h PRO 235 CO -0.40 0.37 -0.71 0.28 -0.23 0.00 0.00 178.00 177.31 1xck h VAL 236 N 0.57 0.51 0.01 1.56 2.07 -0.71 -3.05 116.25 117.22 1xck h VAL 236 Ca 0.51 -1.79 -0.20 0.00 0.82 0.00 0.00 66.70 66.04 1xck h VAL 236 Cb 0.83 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 1xck h VAL 236 CO -0.42 0.29 -0.92 -0.07 0.02 0.00 0.00 177.57 176.48 1xck h LEU 237 N 0.00 0.20 -0.20 2.57 3.38 0.70 -2.88 115.31 119.08 1xck h LEU 237 Ca -0.04 -0.17 -0.22 0.00 0.09 0.00 0.00 57.88 57.54 1xck h LEU 237 Cb 1.32 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1xck h LEU 237 CO 0.04 1.01 -0.93 -0.33 0.09 0.00 0.00 178.44 178.32 1xck h GLU 238 N 0.07 0.31 0.00 1.13 5.08 -1.13 -0.67 114.58 119.38 1xck h GLU 238 Ca -0.04 -0.34 -0.05 0.00 -1.00 0.00 0.00 59.36 57.93 1xck h GLU 238 Cb 1.57 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.92 1xck h GLU 238 CO 0.14 1.05 -0.22 0.00 -1.00 0.00 0.00 179.01 178.98 1xck h ALA 239 N 0.83 1.38 0.00 3.43 0.00 -1.55 -1.36 119.26 121.99 1xck h ALA 239 Ca -0.07 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 1xck h ALA 239 Cb 1.57 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 1xck h ALA 239 CO 0.15 0.27 -0.98 0.28 0.00 0.00 0.00 179.25 178.97 1xck h VAL 240 N 0.00 0.66 -0.48 0.00 2.07 -1.28 -3.21 116.25 114.02 1xck h VAL 240 Ca -0.00 -2.08 -0.08 0.00 0.82 0.00 0.00 66.70 65.36 1xck h VAL 240 Cb 0.46 2.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 1xck h VAL 240 CO 0.03 0.38 -0.02 0.00 0.02 0.00 0.00 177.57 177.98 1xck h ALA 241 N 1.47 1.07 -2.29 1.67 0.00 -0.05 -3.20 119.26 117.93 1xck h ALA 241 Ca -0.08 -0.28 -0.48 0.00 0.00 0.00 0.00 54.91 54.08 1xck h ALA 241 Cb 1.48 -0.19 0.03 0.00 0.00 0.00 0.00 17.79 19.11 1xck h ALA 241 CO 0.05 0.58 0.38 0.15 0.00 0.00 0.00 179.25 180.41 1xck s LYS 242 N -4.95 3.70 0.00 0.00 1.02 -0.78 -2.47 119.74 116.26 1xck s LYS 242 Ca -0.10 1.21 0.00 0.00 0.02 0.00 0.00 55.97 57.11 1xck s LYS 242 Cb 0.14 -2.09 0.00 0.00 -0.52 0.00 0.00 37.83 35.37 1xck s LYS 242 CO 0.82 -0.50 0.00 0.00 -0.92 0.00 0.00 175.35 174.75 1xck n ALA 243 N -1.41 0.00 -3.90 5.17 0.00 -1.26 -4.31 120.51 114.80 1xck n ALA 243 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.24 1xck n ALA 243 Cb 0.53 -0.19 -0.01 0.00 0.00 0.00 0.00 19.45 19.78 1xck n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 244 N -2.00 -0.42 3.38 0.00 0.00 -1.03 -4.95 105.19 100.17 1xck n GLY 244 Ca 0.00 0.19 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 1xck n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xck s LYS 245 N -6.47 1.39 1.00 1.61 1.02 -1.21 -5.09 119.74 112.00 1xck s LYS 245 Ca 0.24 -1.42 -0.13 0.00 0.02 0.00 0.00 55.97 54.68 1xck s LYS 245 Cb -0.13 -1.70 0.19 0.00 -0.52 0.00 0.00 37.83 35.67 1xck s LYS 245 CO 0.66 0.38 1.10 -1.25 -0.92 0.00 0.00 175.35 175.31 1xck s PRO 246 N -2.46 0.39 -0.02 -1.68 0.04 -1.26 -4.72 135.00 125.29 1xck s PRO 246 Ca 0.16 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.61 1xck s PRO 246 Cb -0.08 -1.74 0.03 0.00 0.04 0.00 0.00 34.50 32.74 1xck s PRO 246 CO 0.08 -2.74 0.02 -1.17 0.04 0.00 0.00 177.00 173.23 1xck s LEU 247 N -6.43 1.21 -0.24 -3.56 2.96 0.55 -1.68 118.68 111.50 1xck s LEU 247 Ca 0.66 0.03 -0.06 0.00 -0.22 0.00 0.00 54.13 54.54 1xck s LEU 247 Cb -0.17 -0.07 -0.02 0.00 0.50 0.00 0.00 46.19 46.43 1xck s LEU 247 CO 0.57 -0.11 0.02 -0.22 -1.32 0.00 0.00 176.35 175.29 1xck s LEU 248 N 0.92 3.23 -0.32 -0.68 2.96 0.05 -1.35 118.68 123.49 1xck s LEU 248 Ca -0.08 -0.31 -0.15 0.00 -0.22 0.00 0.00 54.13 53.37 1xck s LEU 248 Cb -0.11 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.72 1xck s LEU 248 CO -0.03 -0.04 0.38 -0.63 -1.32 0.00 0.00 176.35 174.72 1xck s ILE 249 N 1.55 5.15 -0.62 6.68 -1.09 0.86 -0.21 121.20 133.52 1xck s ILE 249 Ca 0.06 0.25 -0.01 0.00 -2.23 0.00 0.00 60.65 58.72 1xck s ILE 249 Cb -0.15 -3.80 0.16 0.00 -1.58 0.00 0.00 42.46 37.09 1xck s ILE 249 CO 0.01 -0.03 0.42 -0.63 -1.23 0.00 0.00 174.94 173.47 1xck s ILE 250 N 2.09 3.46 0.52 2.92 1.01 0.88 -1.09 121.20 130.98 1xck s ILE 250 Ca 0.14 -3.14 0.03 0.00 0.00 0.00 0.00 60.65 57.68 1xck s ILE 250 Cb -0.16 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.04 1xck s ILE 250 CO 0.11 -0.87 0.15 0.00 0.00 0.00 0.00 174.94 174.33 1xck s ALA 251 N -0.23 4.19 0.43 9.38 0.00 -1.13 -2.24 121.76 132.16 1xck s ALA 251 Ca 0.18 -0.78 0.10 0.00 0.00 0.00 0.00 51.96 51.46 1xck s ALA 251 Cb -0.21 -0.25 0.96 0.00 0.00 0.00 0.00 23.12 23.62 1xck s ALA 251 CO -0.03 -0.18 2.05 1.49 0.00 0.00 0.00 175.76 179.09 1xck h GLU 252 N 1.15 0.43 0.00 0.00 4.81 -1.38 0.30 114.58 119.89 1xck h GLU 252 Ca -0.41 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 1xck h GLU 252 Cb 1.31 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1xck h GLU 252 CO 0.68 0.28 0.00 -3.47 -0.73 0.00 0.00 179.01 175.78 1xck n ASP 253 N -4.48 0.00 -3.98 1.04 2.03 -1.26 -4.38 116.55 105.52 1xck n ASP 253 Ca 0.04 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.06 1xck n ASP 253 Cb 0.15 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.38 1xck n ASP 253 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1xck s VAL 254 N -2.00 1.46 0.36 5.18 1.01 -1.26 -0.33 120.40 124.82 1xck s VAL 254 Ca 0.00 -0.69 0.08 0.00 0.00 0.00 0.00 61.98 61.37 1xck s VAL 254 Cb 0.00 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 1xck s VAL 254 CO 0.00 0.32 0.07 -1.61 0.00 0.00 0.00 175.10 173.89 1xck s GLU 255 N 1.51 2.16 0.00 2.72 2.02 0.61 -4.66 118.70 123.05 1xck s GLU 255 Ca 0.03 -1.76 0.00 0.00 0.02 0.00 0.00 54.97 53.26 1xck s GLU 255 Cb -0.14 -1.97 0.00 0.00 0.10 0.00 0.00 34.13 32.12 1xck s GLU 255 CO -0.09 0.06 0.00 0.41 0.02 0.00 0.00 175.26 175.66 1xck n GLY 256 N -1.05 0.00 0.31 -1.39 0.00 -1.26 -1.50 105.19 100.30 1xck n GLY 256 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 1xck n GLY 256 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xck n GLU 257 N 0.00 -0.27 0.11 1.61 0.00 -1.20 0.78 120.64 121.67 1xck n GLU 257 Ca 0.00 1.19 -0.13 0.00 0.00 0.00 0.00 57.16 58.22 1xck n GLU 257 Cb 0.00 -1.75 -0.08 0.00 0.00 0.00 0.00 31.44 29.61 1xck n GLU 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1xck h ALA 258 N 0.71 -0.30 -0.61 4.31 0.00 -0.47 -2.23 119.26 120.67 1xck h ALA 258 Ca 0.19 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.99 1xck h ALA 258 Cb 0.39 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1xck h ALA 258 CO -0.75 -0.48 0.30 1.25 0.00 0.00 0.00 179.25 179.56 1xck h LEU 259 N -0.68 0.39 -0.78 0.00 5.85 -0.11 -1.07 115.31 118.91 1xck h LEU 259 Ca -0.03 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 1xck h LEU 259 Cb 0.47 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1xck h LEU 259 CO 0.05 0.25 0.32 0.00 -0.34 0.00 0.00 178.44 178.72 1xck h ALA 260 N 1.36 1.01 -0.18 1.25 0.00 0.32 -1.03 119.26 122.00 1xck h ALA 260 Ca 0.29 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1xck h ALA 260 Cb 0.26 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1xck h ALA 260 CO -0.23 0.63 -0.22 1.15 0.00 0.00 0.00 179.25 180.58 1xck h THR 261 N 1.13 1.24 -0.04 0.00 2.02 -0.71 -2.41 112.91 114.13 1xck h THR 261 Ca 0.26 -1.10 -0.13 0.00 0.77 0.00 0.00 66.41 66.21 1xck h THR 261 Cb 0.20 1.35 0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1xck h THR 261 CO -0.02 0.34 -0.50 -0.07 0.37 0.00 0.00 175.52 175.64 1xck h LEU 262 N 0.29 0.51 -1.98 2.58 3.38 -0.85 -1.87 115.31 117.37 1xck h LEU 262 Ca 0.05 -0.71 0.07 0.00 0.09 0.00 0.00 57.88 57.38 1xck h LEU 262 Cb 0.56 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1xck h LEU 262 CO 0.04 1.14 0.19 0.58 0.09 0.00 0.00 178.44 180.48 1xck h VAL 263 N -0.08 0.88 0.00 1.22 2.07 -1.04 -2.02 116.25 117.27 1xck h VAL 263 Ca -0.05 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1xck h VAL 263 Cb 1.18 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1xck h VAL 263 CO 0.10 0.00 -0.04 0.58 0.02 0.00 0.00 177.57 178.23 1xck h VAL 264 N 0.02 0.00 -0.97 2.57 2.07 -1.39 -3.12 116.25 115.43 1xck h VAL 264 Ca 0.12 -0.55 0.27 0.00 0.82 0.00 0.00 66.70 67.36 1xck h VAL 264 Cb 0.48 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.11 1xck h VAL 264 CO -0.00 0.00 0.50 0.78 0.02 0.00 0.00 177.57 178.86 1xck h ASN 265 N -0.55 0.45 1.01 0.57 -0.26 -1.29 0.30 115.58 115.81 1xck h ASN 265 Ca 0.00 0.17 -0.15 0.00 -0.56 0.00 0.00 56.30 55.76 1xck h ASN 265 Cb 0.04 0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.40 1xck h ASN 265 CO 0.00 -0.05 -0.69 0.71 -1.06 0.00 0.00 177.43 176.34 1xck h THR 266 N 0.39 1.31 -0.05 2.81 1.35 -1.47 -0.93 112.91 116.34 1xck h THR 266 Ca 0.65 -2.53 0.00 0.00 -0.55 0.00 0.00 66.41 63.98 1xck h THR 266 Cb 1.36 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 70.22 1xck h THR 266 CO -0.56 0.68 0.00 0.80 -0.25 0.00 0.00 175.52 176.19 1xck n MET 267 N -3.45 1.11 -0.05 4.72 0.00 0.10 -2.64 117.12 116.92 1xck n MET 267 Ca 0.00 -0.17 0.01 0.00 -0.00 0.00 0.00 57.70 57.54 1xck n MET 267 Cb 0.75 -1.06 0.01 0.00 0.00 0.00 0.00 33.22 32.92 1xck n MET 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1xck n ARG 268 N -0.35 1.23 -0.89 2.12 1.74 -0.86 -4.99 116.66 114.67 1xck n ARG 268 Ca 0.02 -1.07 0.00 0.00 -0.77 0.00 0.00 57.85 56.03 1xck n ARG 268 Cb 0.05 -0.76 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 1xck n ARG 268 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xck n GLY 269 N -0.29 0.77 2.44 -0.13 0.00 -1.08 -4.90 105.19 101.99 1xck n GLY 269 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1xck n GLY 269 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xck n ILE 270 N -2.00 4.31 -0.27 -0.61 5.41 -0.37 -4.73 119.36 121.10 1xck n ILE 270 Ca 0.00 -3.01 0.00 0.00 1.00 0.00 0.00 62.75 60.74 1xck n ILE 270 Cb 0.00 -2.52 0.00 0.00 -0.71 0.00 0.00 39.64 36.41 1xck n ILE 270 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1xck n VAL 271 N 3.56 -1.16 -2.51 1.39 0.31 -1.26 -4.42 118.33 114.23 1xck n VAL 271 Ca 0.70 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 64.60 1xck n VAL 271 Cb 0.27 -1.16 -0.02 0.00 -0.91 0.00 0.00 33.84 32.01 1xck n VAL 271 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1xck s LYS 272 N -3.17 4.11 0.05 5.55 3.01 -1.26 -3.83 119.74 124.20 1xck s LYS 272 Ca 0.00 1.36 0.02 0.00 -1.01 0.00 0.00 55.97 56.35 1xck s LYS 272 Cb 0.00 -3.77 -0.03 0.00 -1.01 0.00 0.00 37.83 33.03 1xck s LYS 272 CO 0.00 -0.85 -0.08 0.08 0.51 0.00 0.00 175.35 175.01 1xck s VAL 273 N 3.72 0.59 -0.13 3.17 1.01 -1.26 -0.33 120.40 127.17 1xck s VAL 273 Ca 0.51 -1.20 -0.09 0.00 0.00 0.00 0.00 61.98 61.20 1xck s VAL 273 Cb -0.17 -0.77 0.04 0.00 0.00 0.00 0.00 36.38 35.49 1xck s VAL 273 CO 0.15 -0.43 0.32 0.00 0.00 0.00 0.00 175.10 175.14 1xck s ALA 274 N -1.64 -0.78 0.07 5.51 0.00 -0.46 -4.88 121.76 119.57 1xck s ALA 274 Ca -0.07 1.07 0.10 0.00 0.00 0.00 0.00 51.96 53.06 1xck s ALA 274 Cb -0.08 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.36 1xck s ALA 274 CO -0.00 -0.19 -0.26 0.00 0.00 0.00 0.00 175.76 175.31 1xck s ALA 275 N 0.76 2.24 0.03 0.00 0.00 -1.26 -0.10 121.76 123.43 1xck s ALA 275 Ca -0.05 -1.31 -0.10 0.00 0.00 0.00 0.00 51.96 50.51 1xck s ALA 275 Cb -0.06 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.63 1xck s ALA 275 CO -0.05 0.52 0.20 0.14 0.00 0.00 0.00 175.76 176.57 1xck s VAL 276 N -0.88 0.10 0.57 0.00 -7.23 -0.25 -1.36 120.40 111.35 1xck s VAL 276 Ca 0.12 -0.81 -0.17 0.00 -1.81 0.00 0.00 61.98 59.31 1xck s VAL 276 Cb -0.10 -0.81 -0.05 0.00 0.56 0.00 0.00 36.38 35.98 1xck s VAL 276 CO 0.03 -0.45 1.06 -0.54 -0.31 0.00 0.00 175.10 174.90 1xck s LYS 277 N -2.26 3.39 0.53 4.82 1.02 -1.26 -2.84 119.74 123.15 1xck s LYS 277 Ca -0.07 1.29 -0.20 0.00 0.02 0.00 0.00 55.97 57.00 1xck s LYS 277 Cb -0.02 -2.04 -0.06 0.00 -0.52 0.00 0.00 37.83 35.19 1xck s LYS 277 CO -0.02 -0.76 1.14 0.00 -0.92 0.00 0.00 175.35 174.79 1xck s ALA 278 N -2.28 2.73 0.54 5.17 0.00 0.11 -4.79 121.76 123.23 1xck s ALA 278 Ca 0.65 0.86 -0.20 0.00 0.00 0.00 0.00 51.96 53.27 1xck s ALA 278 Cb -0.17 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.53 1xck s ALA 278 CO 0.33 -0.78 1.20 -1.25 0.00 0.00 0.00 175.76 175.26 1xck s PRO 279 N -3.18 3.30 1.73 0.00 0.04 -1.26 -4.85 135.00 130.77 1xck s PRO 279 Ca 0.71 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.57 1xck s PRO 279 Cb -0.25 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.17 1xck s PRO 279 CO 0.29 -0.94 0.00 0.41 0.04 0.00 0.00 177.00 176.79 1xck n GLY 280 N 0.45 -1.24 3.23 0.56 0.00 -1.26 -4.44 105.19 102.47 1xck n GLY 280 Ca 0.11 -1.11 -0.11 0.00 0.00 0.00 0.00 46.02 44.91 1xck n GLY 280 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1xck s PHE 281 N 0.00 0.91 0.00 1.61 -0.71 -1.26 -4.78 117.98 113.75 1xck s PHE 281 Ca 0.00 -1.21 0.00 0.00 -1.04 0.00 0.00 56.93 54.68 1xck s PHE 281 Cb 0.00 -0.42 0.00 0.00 -1.21 0.00 0.00 43.02 41.39 1xck s PHE 281 CO 0.00 -0.63 0.00 0.41 -1.34 0.00 0.00 175.22 173.66 1xck n GLY 282 N -0.21 2.37 0.33 1.99 0.00 -1.26 -3.02 105.19 105.39 1xck n GLY 282 Ca -0.02 -0.48 -0.16 0.00 0.00 0.00 0.00 46.02 45.36 1xck n GLY 282 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xck h ASP 283 N 9.71 -0.67 0.00 1.61 3.32 -2.00 -2.38 116.42 126.00 1xck h ASP 283 Ca 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1xck h ASP 283 Cb 0.00 0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1xck h ASP 283 CO 0.00 -0.39 0.26 0.08 -1.72 0.00 0.00 179.24 177.47 1xck h ARG 284 N -0.93 0.00 0.01 3.56 0.11 -1.97 0.30 114.38 115.46 1xck h ARG 284 Ca -0.08 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.83 1xck h ARG 284 Cb 0.65 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.75 1xck h ARG 284 CO 0.13 0.00 -0.66 -0.09 0.10 0.00 0.00 179.97 179.45 1xck h ARG 285 N 0.00 0.43 -0.02 0.08 2.43 -1.33 -2.43 114.38 113.53 1xck h ARG 285 Ca 0.00 -0.48 -0.09 0.00 -0.81 0.00 0.00 59.98 58.60 1xck h ARG 285 Cb 0.53 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1xck h ARG 285 CO 0.00 1.14 -0.42 0.87 -1.51 0.00 0.00 179.97 180.05 1xck h LYS 286 N -0.08 0.04 -0.06 0.20 1.57 -0.39 -1.92 116.57 115.94 1xck h LYS 286 Ca -0.09 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1xck h LYS 286 Cb 1.38 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.69 1xck h LYS 286 CO 0.13 0.46 -0.02 0.00 -0.57 0.00 0.00 179.45 179.45 1xck h ALA 287 N 1.54 0.08 0.00 3.86 0.00 -1.36 -3.09 119.26 120.29 1xck h ALA 287 Ca 0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1xck h ALA 287 Cb 0.76 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1xck h ALA 287 CO 0.06 -0.19 -0.26 0.52 0.00 0.00 0.00 179.25 179.38 1xck h MET 288 N -0.26 0.00 -0.18 0.00 2.86 -1.29 -2.11 114.93 113.94 1xck h MET 288 Ca 0.01 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.58 1xck h MET 288 Cb 0.45 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 1xck h MET 288 CO 0.01 0.26 -0.19 -0.07 1.06 0.00 0.00 176.91 177.98 1xck h LEU 289 N 0.00 0.31 -0.15 1.22 3.38 -1.31 -1.28 115.31 117.48 1xck h LEU 289 Ca -0.00 -0.08 -0.23 0.00 0.09 0.00 0.00 57.88 57.65 1xck h LEU 289 Cb 0.49 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.17 1xck h LEU 289 CO 0.03 0.52 -0.90 -0.61 0.09 0.00 0.00 178.44 177.57 1xck h GLN 290 N 0.29 0.61 -0.42 1.13 5.75 -1.34 -1.89 115.11 119.23 1xck h GLN 290 Ca 0.05 -0.58 0.07 0.00 -0.15 0.00 0.00 58.65 58.04 1xck h GLN 290 Cb 0.51 0.15 -0.06 0.00 1.07 0.00 0.00 27.48 29.15 1xck h GLN 290 CO 0.03 1.20 0.03 -0.44 -2.65 0.00 0.00 178.83 177.01 1xck h ASP 291 N 0.37 -0.10 -0.26 -0.69 5.19 -0.83 0.25 116.42 120.35 1xck h ASP 291 Ca -0.08 0.09 -0.06 0.00 -0.62 0.00 0.00 57.03 56.36 1xck h ASP 291 Cb 1.54 0.14 -0.02 0.00 0.18 0.00 0.00 39.33 41.17 1xck h ASP 291 CO 0.17 -0.02 -0.01 0.40 -3.12 0.00 0.00 179.24 176.66 1xck h ILE 292 N 0.15 1.21 -0.23 0.35 2.04 -1.18 -1.40 117.51 118.45 1xck h ILE 292 Ca 0.21 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 1xck h ILE 292 Cb 0.28 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1xck h ILE 292 CO -0.32 0.30 -0.02 0.00 0.00 0.00 0.00 178.15 178.11 1xck h ALA 293 N 1.44 0.31 -0.53 1.87 0.00 -0.31 -0.53 119.26 121.51 1xck h ALA 293 Ca 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1xck h ALA 293 Cb 0.37 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1xck h ALA 293 CO 0.01 0.05 0.30 1.15 0.00 0.00 0.00 179.25 180.76 1xck h THR 294 N 0.17 1.17 -0.73 0.00 2.02 -0.31 0.78 112.91 116.01 1xck h THR 294 Ca 0.06 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 66.76 1xck h THR 294 Cb 0.44 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 1xck h THR 294 CO 0.01 0.18 0.23 0.25 0.37 0.00 0.00 175.52 176.57 1xck h LEU 295 N 0.71 1.05 -0.41 2.58 7.12 -1.17 -2.89 115.31 122.30 1xck h LEU 295 Ca 0.19 -0.19 0.00 0.00 0.13 0.00 0.00 57.88 58.00 1xck h LEU 295 Cb 0.03 -0.27 0.00 0.00 -0.53 0.00 0.00 40.66 39.89 1xck h LEU 295 CO -0.03 0.97 -0.52 0.35 -0.13 0.00 0.00 178.44 179.08 1xck n THR 296 N -4.26 0.00 -2.90 1.05 -2.24 -0.22 -1.03 114.28 104.69 1xck n THR 296 Ca 0.06 -0.11 -0.10 0.00 -2.27 0.00 0.00 64.05 61.63 1xck n THR 296 Cb 0.22 0.71 0.04 0.00 -2.10 0.00 0.00 70.33 69.20 1xck n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xck n GLY 297 N 1.43 0.18 3.70 3.38 0.00 0.24 -1.44 105.19 112.68 1xck n GLY 297 Ca 0.08 -0.22 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1xck n GLY 297 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xck s GLY 298 N -3.32 2.88 -0.10 -0.02 0.00 0.77 -4.51 107.32 103.01 1xck s GLY 298 Ca 0.18 -0.79 0.03 0.00 0.00 0.00 0.00 44.72 44.14 1xck s GLY 298 CO 0.35 -2.12 -0.20 -1.59 0.00 0.00 0.00 173.10 169.54 1xck s THR 299 N -2.92 2.47 -0.14 0.90 2.01 0.22 -4.45 115.64 113.73 1xck s THR 299 Ca 0.13 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 60.95 1xck s THR 299 Cb 0.03 -1.97 -0.01 0.00 0.01 0.00 0.00 72.50 70.56 1xck s THR 299 CO 0.07 0.55 1.10 -0.69 -0.69 0.00 0.00 174.62 174.96 1xck s VAL 300 N 0.18 4.57 -0.68 3.82 1.01 -1.26 -4.51 120.40 123.53 1xck s VAL 300 Ca -0.11 1.87 -0.20 0.00 0.00 0.00 0.00 61.98 63.53 1xck s VAL 300 Cb -0.16 -4.20 0.10 0.00 0.00 0.00 0.00 36.38 32.11 1xck s VAL 300 CO 0.06 -0.07 0.89 -0.63 0.00 0.00 0.00 175.10 175.35 1xck s ILE 301 N 2.60 4.61 -0.09 2.22 1.01 0.38 -4.93 121.20 126.99 1xck s ILE 301 Ca 0.50 -0.86 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 1xck s ILE 301 Cb -0.19 -4.62 -0.03 0.00 0.01 0.00 0.00 42.46 37.63 1xck s ILE 301 CO 0.15 -1.33 -0.02 -0.94 0.00 0.00 0.00 174.94 172.80 1xck s SER 302 N 3.61 5.04 0.44 3.58 1.04 -1.26 -1.67 113.70 124.47 1xck s SER 302 Ca 0.20 0.06 0.23 0.00 0.48 0.00 0.00 55.95 56.91 1xck s SER 302 Cb -0.18 -1.45 0.97 0.00 0.10 0.00 0.00 66.02 65.46 1xck s SER 302 CO 0.05 0.34 1.86 -0.33 0.98 0.00 0.00 173.24 176.14 1xck h GLU 303 N 5.45 0.00 0.28 4.02 5.08 -1.76 -2.23 114.58 125.41 1xck h GLU 303 Ca -0.47 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1xck h GLU 303 Cb 1.19 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 1xck h GLU 303 CO 0.55 0.25 -0.47 0.93 -1.00 0.00 0.00 179.01 179.28 1xck h GLU 304 N 0.00 -0.77 0.00 2.33 5.08 -1.90 0.18 114.58 119.50 1xck h GLU 304 Ca -0.00 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1xck h GLU 304 Cb 0.69 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1xck h GLU 304 CO 0.03 -0.51 0.00 -0.89 -1.00 0.00 0.00 179.01 176.64 1xck n ILE 305 N -5.21 0.00 -2.65 3.13 5.41 -1.22 -4.82 119.36 114.00 1xck n ILE 305 Ca -0.09 0.00 -0.06 0.00 1.00 0.00 0.00 62.75 63.60 1xck n ILE 305 Cb 0.40 -0.59 0.02 0.00 -0.71 0.00 0.00 39.64 38.76 1xck n ILE 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xck n GLY 306 N -0.17 0.45 3.92 7.39 0.00 0.64 -5.06 105.19 112.36 1xck n GLY 306 Ca 0.05 -0.40 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 1xck n GLY 306 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xck s MET 307 N -5.02 3.27 -0.02 1.61 -1.94 -0.84 -5.00 119.30 111.36 1xck s MET 307 Ca 0.10 -0.85 0.02 0.00 -1.71 0.00 0.00 55.69 53.26 1xck s MET 307 Cb -0.05 -2.79 0.00 0.00 2.01 0.00 0.00 34.83 34.01 1xck s MET 307 CO 0.19 0.43 -0.07 -1.21 -0.01 0.00 0.00 175.02 174.35 1xck s GLU 308 N -3.90 0.74 0.54 2.03 2.02 -1.26 -4.36 118.70 114.52 1xck s GLU 308 Ca 0.34 -0.22 0.23 0.00 0.02 0.00 0.00 54.97 55.33 1xck s GLU 308 Cb -0.09 -0.72 1.49 0.00 0.10 0.00 0.00 34.13 34.91 1xck s GLU 308 CO 0.28 0.08 2.17 -0.07 0.02 0.00 0.00 175.26 177.73 1xck h LEU 309 N 6.42 0.00 -1.55 1.80 3.38 -1.95 -0.58 115.31 122.83 1xck h LEU 309 Ca -0.33 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 1xck h LEU 309 Cb 1.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1xck h LEU 309 CO 0.49 0.04 -0.23 -0.33 0.09 0.00 0.00 178.44 178.49 1xck h GLU 310 N 0.00 0.00 -0.62 1.13 3.07 -1.95 -2.41 114.58 113.80 1xck h GLU 310 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xck h GLU 310 Cb 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1xck h GLU 310 CO 0.00 0.23 0.00 1.63 -1.40 0.00 0.00 179.01 179.48 1xck n LYS 311 N -3.93 4.01 -3.33 2.33 5.02 -0.23 -4.81 118.16 117.20 1xck n LYS 311 Ca -0.02 -2.96 -0.38 0.00 -2.02 0.00 0.00 58.31 52.93 1xck n LYS 311 Cb 0.32 -1.98 -0.06 0.00 -0.02 0.00 0.00 35.03 33.28 1xck n LYS 311 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xck s ALA 312 N -2.09 3.50 0.42 7.82 0.00 -0.91 -4.96 121.76 125.55 1xck s ALA 312 Ca 0.52 -0.27 0.07 0.00 0.00 0.00 0.00 51.96 52.29 1xck s ALA 312 Cb 0.35 -2.65 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 1xck s ALA 312 CO 0.22 -0.07 0.28 0.95 0.00 0.00 0.00 175.76 177.14 1xck s THR 313 N 0.80 2.41 0.62 0.00 -4.23 -1.26 -4.41 115.64 109.57 1xck s THR 313 Ca 0.24 -1.54 0.28 0.00 -1.18 0.00 0.00 61.69 59.49 1xck s THR 313 Cb -0.15 -2.94 0.34 0.00 1.34 0.00 0.00 72.50 71.08 1xck s THR 313 CO 0.09 0.00 1.83 -0.07 -0.54 0.00 0.00 174.62 175.93 1xck h LEU 314 N 1.22 0.00 -1.56 4.79 3.38 -1.93 0.14 115.31 121.35 1xck h LEU 314 Ca -0.42 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 1xck h LEU 314 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1xck h LEU 314 CO 0.64 0.00 -0.23 -0.08 0.09 0.00 0.00 178.44 178.86 1xck h GLU 315 N 0.00 0.00 0.00 1.13 4.81 -2.00 -2.57 114.58 115.94 1xck h GLU 315 Ca 0.15 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.28 1xck h GLU 315 Cb 1.15 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1xck h GLU 315 CO -0.00 0.23 -0.71 -0.44 -0.73 0.00 0.00 179.01 177.36 1xck h ASP 316 N 0.00 0.00 -3.96 1.04 3.32 -1.07 -3.44 116.42 112.31 1xck h ASP 316 Ca -0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1xck h ASP 316 Cb 0.49 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.12 1xck h ASP 316 CO 0.03 0.43 0.57 -0.76 -1.72 0.00 0.00 179.24 177.79 1xck s LEU 317 N -6.18 4.15 0.00 1.55 1.02 -0.97 0.71 118.68 118.96 1xck s LEU 317 Ca 0.02 2.54 -0.07 0.00 0.02 0.00 0.00 54.13 56.65 1xck s LEU 317 Cb 0.08 -4.01 0.16 0.00 0.02 0.00 0.00 46.19 42.44 1xck s LEU 317 CO 0.76 -0.88 0.99 0.61 0.02 0.00 0.00 176.35 177.85 1xck n GLY 318 N 0.64 -0.40 3.54 -3.19 0.00 0.31 -4.43 105.19 101.67 1xck n GLY 318 Ca 0.05 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 44.05 1xck n GLY 318 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xck s GLN 319 N -5.08 0.88 0.09 1.61 0.74 -0.52 -0.99 119.66 116.39 1xck s GLN 319 Ca 0.60 0.64 -0.15 0.00 0.05 0.00 0.00 55.36 56.50 1xck s GLN 319 Cb -0.02 0.42 0.03 0.00 1.10 0.00 0.00 33.01 34.53 1xck s GLN 319 CO 0.41 -0.18 0.36 0.00 -0.55 0.00 0.00 175.29 175.33 1xck s ALA 320 N -0.28 -0.81 0.32 1.58 0.00 -1.18 -0.50 121.76 120.89 1xck s ALA 320 Ca -0.05 -0.03 0.11 0.00 0.00 0.00 0.00 51.96 51.99 1xck s ALA 320 Cb -0.03 0.52 0.53 0.00 0.00 0.00 0.00 23.12 24.13 1xck s ALA 320 CO 0.04 -0.54 1.72 0.87 0.00 0.00 0.00 175.76 177.85 1xck h LYS 321 N 2.72 0.03 -1.60 0.00 1.57 -1.15 -2.97 116.57 115.17 1xck h LYS 321 Ca -0.33 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.50 1xck h LYS 321 Cb 1.23 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 33.27 1xck h LYS 321 CO 0.47 0.51 0.44 0.50 -0.57 0.00 0.00 179.45 180.80 1xck s ARG 322 N -3.93 0.49 0.03 3.15 3.52 -1.06 0.31 118.95 121.46 1xck s ARG 322 Ca -0.02 0.62 0.05 0.00 -0.13 0.00 0.00 55.73 56.25 1xck s ARG 322 Cb 0.13 0.22 -0.02 0.00 -1.56 0.00 0.00 34.95 33.72 1xck s ARG 322 CO 0.75 -0.06 -0.14 0.14 -0.81 0.00 0.00 175.30 175.17 1xck s VAL 323 N 0.43 1.14 -0.07 7.11 -7.23 -0.70 0.24 120.40 121.31 1xck s VAL 323 Ca 0.01 -0.91 0.01 0.00 -1.81 0.00 0.00 61.98 59.29 1xck s VAL 323 Cb -0.05 -1.01 0.02 0.00 0.56 0.00 0.00 36.38 35.90 1xck s VAL 323 CO -0.08 0.09 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.01 1xck s VAL 324 N -0.72 1.01 -0.09 1.32 1.01 -0.33 -1.84 120.40 120.75 1xck s VAL 324 Ca 0.03 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1xck s VAL 324 Cb -0.07 -0.96 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1xck s VAL 324 CO 0.01 0.34 -0.17 -0.63 0.00 0.00 0.00 175.10 174.65 1xck s ILE 325 N 0.94 2.78 0.00 2.22 1.01 -0.46 -1.21 121.20 126.48 1xck s ILE 325 Ca -0.10 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.77 1xck s ILE 325 Cb -0.15 -2.12 0.00 0.00 0.01 0.00 0.00 42.46 40.21 1xck s ILE 325 CO 0.00 0.55 0.00 0.59 0.00 0.00 0.00 174.94 176.09 1xck n ASN 326 N 3.11 0.33 0.12 3.58 3.02 0.17 -1.03 115.26 124.58 1xck n ASN 326 Ca -0.18 -0.30 -0.02 0.00 -0.03 0.00 0.00 54.58 54.06 1xck n ASN 326 Cb 0.52 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.80 1xck n ASN 326 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1xck h LYS 327 N 0.00 0.00 -0.01 3.52 3.64 -1.93 -1.68 116.57 120.10 1xck h LYS 327 Ca 0.00 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 1xck h LYS 327 Cb 0.00 0.00 -0.32 0.00 -0.41 0.00 0.00 32.23 31.50 1xck h LYS 327 CO 0.00 0.68 -0.84 -0.40 -2.27 0.00 0.00 179.45 176.62 1xck n ASP 328 N -3.64 0.47 -3.67 4.20 5.68 -1.26 -3.80 116.55 114.53 1xck n ASP 328 Ca -0.01 -2.00 -0.08 0.00 -0.50 0.00 0.00 54.79 52.20 1xck n ASP 328 Cb 0.69 -0.14 -0.09 0.00 -1.14 0.00 0.00 41.12 40.44 1xck n ASP 328 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1xck s THR 329 N -0.12 -0.36 -0.14 2.12 2.01 -1.01 -3.02 115.64 115.12 1xck s THR 329 Ca 0.25 0.10 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 1xck s THR 329 Cb 0.29 -0.73 -0.02 0.00 0.01 0.00 0.00 72.50 72.05 1xck s THR 329 CO -0.12 0.04 -0.10 -0.89 -0.69 0.00 0.00 174.62 172.86 1xck s THR 330 N 2.05 3.36 -0.11 -0.82 2.01 0.27 0.46 115.64 122.85 1xck s THR 330 Ca -0.06 -0.55 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 1xck s THR 330 Cb -0.10 -2.43 0.03 0.00 0.01 0.00 0.00 72.50 70.02 1xck s THR 330 CO -0.14 0.51 -0.01 0.28 -0.69 0.00 0.00 174.62 174.57 1xck s THR 331 N 0.33 0.57 -0.31 -0.82 -1.32 -0.35 -1.10 115.64 112.64 1xck s THR 331 Ca -0.08 -0.13 -0.17 0.00 -1.21 0.00 0.00 61.69 60.10 1xck s THR 331 Cb -0.15 -0.77 -0.02 0.00 -1.51 0.00 0.00 72.50 70.05 1xck s THR 331 CO 0.05 0.18 0.47 -0.63 -2.21 0.00 0.00 174.62 172.47 1xck s ILE 332 N 1.88 5.08 -0.25 5.08 1.01 0.11 -1.19 121.20 132.92 1xck s ILE 332 Ca 0.04 0.51 -0.07 0.00 0.00 0.00 0.00 60.65 61.12 1xck s ILE 332 Cb -0.13 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.46 1xck s ILE 332 CO -0.06 -0.04 0.06 -0.63 0.00 0.00 0.00 174.94 174.27 1xck s ILE 333 N 2.26 4.24 -0.49 2.92 1.01 0.14 -1.69 121.20 129.58 1xck s ILE 333 Ca 0.18 -0.22 -0.04 0.00 0.00 0.00 0.00 60.65 60.56 1xck s ILE 333 Cb -0.16 -2.99 0.01 0.00 0.01 0.00 0.00 42.46 39.33 1xck s ILE 333 CO 0.11 0.33 0.52 -0.67 0.00 0.00 0.00 174.94 175.23 1xck n ASP 334 N 4.91 -6.56 -4.80 3.58 2.03 0.19 -2.54 116.55 113.36 1xck n ASP 334 Ca -0.16 0.11 -0.34 0.00 0.52 0.00 0.00 54.79 54.91 1xck n ASP 334 Cb 0.51 -4.39 -0.05 0.00 -0.72 0.00 0.00 41.12 36.47 1xck n ASP 334 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1xck s GLY 335 N -2.60 2.54 0.00 0.27 0.00 -0.82 -2.20 107.32 104.51 1xck s GLY 335 Ca 0.07 0.53 0.19 0.00 0.00 0.00 0.00 44.72 45.51 1xck s GLY 335 CO 0.59 0.86 1.56 -0.62 0.00 0.00 0.00 173.10 175.49 1xck n VAL 336 N -0.47 0.08 -1.57 1.40 0.31 0.34 -4.80 118.33 113.63 1xck n VAL 336 Ca 0.07 0.02 -0.42 0.00 -0.01 0.00 0.00 64.34 64.00 1xck n VAL 336 Cb 0.52 -0.72 0.01 0.00 -0.91 0.00 0.00 33.84 32.74 1xck n VAL 336 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xck n GLY 337 N 0.23 -0.54 3.75 2.92 0.00 -0.19 -4.73 105.19 106.64 1xck n GLY 337 Ca 0.14 0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.89 1xck n GLY 337 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xck s GLU 338 N -1.85 4.64 0.60 1.61 0.41 -1.26 -4.91 118.70 117.93 1xck s GLU 338 Ca 0.63 1.76 0.29 0.00 -0.41 0.00 0.00 54.97 57.24 1xck s GLU 338 Cb -0.59 -3.22 1.67 0.00 -1.78 0.00 0.00 34.13 30.20 1xck s GLU 338 CO 0.57 0.19 2.08 0.93 -0.49 0.00 0.00 175.26 178.54 1xck h GLU 339 N 4.28 0.00 0.39 1.61 4.39 -1.97 -0.53 114.58 122.74 1xck h GLU 339 Ca -0.46 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.22 1xck h GLU 339 Cb 1.21 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 1xck h GLU 339 CO 0.69 0.00 -0.19 0.00 -1.16 0.00 0.00 179.01 178.35 1xck h ALA 340 N 1.73 -0.52 0.14 3.43 0.00 -1.98 -2.53 119.26 119.53 1xck h ALA 340 Ca 0.09 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1xck h ALA 340 Cb 0.54 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1xck h ALA 340 CO -0.00 -0.49 -0.36 0.00 0.00 0.00 0.00 179.25 178.40 1xck h ALA 341 N -1.06 -0.64 0.09 0.00 0.00 -1.74 0.38 119.26 116.30 1xck h ALA 341 Ca -0.05 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1xck h ALA 341 Cb 0.43 0.59 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 1xck h ALA 341 CO 0.09 -0.92 -0.37 0.82 0.00 0.00 0.00 179.25 178.87 1xck h ILE 342 N -0.60 0.23 0.00 0.00 2.04 -1.27 -0.44 117.51 117.48 1xck h ILE 342 Ca 0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.87 1xck h ILE 342 Cb 0.62 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1xck h ILE 342 CO -0.20 0.00 -0.07 -0.61 0.00 0.00 0.00 178.15 177.26 1xck h GLN 343 N -0.58 0.00 -0.05 2.37 5.75 -1.38 -1.23 115.11 119.99 1xck h GLN 343 Ca 0.03 0.00 -0.19 0.00 -0.15 0.00 0.00 58.65 58.34 1xck h GLN 343 Cb 0.63 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.17 1xck h GLN 343 CO -0.23 0.07 -0.79 0.78 -2.65 0.00 0.00 178.83 176.01 1xck h GLY 344 N 0.45 0.42 0.93 2.39 0.00 0.13 -2.76 103.07 104.65 1xck h GLY 344 Ca -0.00 -0.64 -0.10 0.00 0.00 0.00 0.00 47.33 46.59 1xck h GLY 344 CO 0.01 0.57 -0.20 -0.09 0.00 0.00 0.00 176.54 176.82 1xck h ARG 345 N 0.25 0.66 -0.63 4.80 9.65 -0.04 -2.60 114.38 126.46 1xck h ARG 345 Ca -0.04 -0.31 0.12 0.00 -1.10 0.00 0.00 59.98 58.64 1xck h ARG 345 Cb 1.38 -0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.92 1xck h ARG 345 CO 0.13 0.91 0.43 0.28 2.80 0.00 0.00 179.97 184.52 1xck h VAL 346 N 0.40 0.85 0.53 0.20 2.07 -1.23 -1.52 116.25 117.55 1xck h VAL 346 Ca 0.06 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 1xck h VAL 346 Cb 0.75 0.45 0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1xck h VAL 346 CO 0.06 0.07 -0.25 0.00 0.02 0.00 0.00 177.57 177.46 1xck h ALA 347 N 1.69 -0.71 -0.08 1.67 0.00 -1.17 0.66 119.26 121.32 1xck h ALA 347 Ca 0.30 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1xck h ALA 347 Cb 0.67 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 1xck h ALA 347 CO -0.08 -0.80 -0.53 1.96 0.00 0.00 0.00 179.25 179.80 1xck h GLN 348 N -0.92 -0.59 -0.98 0.00 4.20 -1.11 0.15 115.11 115.87 1xck h GLN 348 Ca -0.07 0.04 0.19 0.00 0.06 0.00 0.00 58.65 58.87 1xck h GLN 348 Cb 0.62 0.14 -0.09 0.00 0.30 0.00 0.00 27.48 28.44 1xck h GLN 348 CO 0.12 -0.40 0.61 0.82 -0.67 0.00 0.00 178.83 179.32 1xck h ILE 349 N -0.62 0.72 0.00 2.54 2.04 -1.31 0.95 117.51 121.83 1xck h ILE 349 Ca 0.03 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1xck h ILE 349 Cb 0.70 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1xck h ILE 349 CO -0.40 0.12 0.00 -1.14 0.00 0.00 0.00 178.15 176.73 1xck n ARG 350 N -4.67 0.18 0.02 2.37 0.63 0.22 -2.55 116.66 112.86 1xck n ARG 350 Ca 0.22 0.29 -0.21 0.00 -0.92 0.00 0.00 57.85 57.22 1xck n ARG 350 Cb 0.60 -1.77 -0.14 0.00 0.45 0.00 0.00 32.46 31.59 1xck n ARG 350 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1xck h GLN 351 N 0.00 0.29 -0.88 -0.14 1.08 0.35 -3.34 115.11 112.46 1xck h GLN 351 Ca 0.00 -0.49 0.11 0.00 -1.45 0.00 0.00 58.65 56.82 1xck h GLN 351 Cb 0.50 0.18 -0.08 0.00 -0.05 0.00 0.00 27.48 28.03 1xck h GLN 351 CO 0.00 1.21 0.51 1.96 -0.95 0.00 0.00 178.83 181.56 1xck h GLN 352 N 0.08 0.79 -0.46 1.46 1.08 -0.48 -0.10 115.11 117.48 1xck h GLN 352 Ca -0.39 -0.05 0.12 0.00 -1.45 0.00 0.00 58.65 56.88 1xck h GLN 352 Cb 2.05 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 29.28 1xck h GLN 352 CO 0.11 0.52 0.33 0.82 -0.95 0.00 0.00 178.83 179.66 1xck h ILE 353 N 0.82 0.80 0.08 2.54 2.04 -1.61 -1.01 117.51 121.17 1xck h ILE 353 Ca 0.44 -0.02 -0.00 0.00 1.00 0.00 0.00 64.86 66.27 1xck h ILE 353 Cb 0.46 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1xck h ILE 353 CO -0.28 0.01 -0.04 -0.33 0.00 0.00 0.00 178.15 177.52 1xck h GLU 354 N 0.06 -0.11 -0.22 2.37 4.39 -1.17 -3.13 114.58 116.79 1xck h GLU 354 Ca 0.22 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.93 1xck h GLU 354 Cb 0.78 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1xck h GLU 354 CO -0.02 0.42 0.00 0.39 -1.16 0.00 0.00 179.01 178.64 1xck n GLU 355 N -4.81 0.47 -2.59 2.33 1.02 -0.81 -4.73 120.64 111.52 1xck n GLU 355 Ca -0.07 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.64 1xck n GLU 355 Cb 0.28 -1.11 -0.02 0.00 -0.02 0.00 0.00 31.44 30.57 1xck n GLU 355 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xck s ALA 356 N -1.54 3.42 -1.73 0.62 0.00 -0.45 -4.90 121.76 117.18 1xck s ALA 356 Ca 0.00 -0.08 0.28 0.00 0.00 0.00 0.00 51.96 52.15 1xck s ALA 356 Cb 0.00 -3.73 0.99 0.00 0.00 0.00 0.00 23.12 20.38 1xck s ALA 356 CO 0.00 -1.66 1.71 0.25 0.00 0.00 0.00 175.76 176.06 1xck n THR 357 N 6.08 0.00 -4.19 0.00 -2.24 -1.26 -4.91 114.28 107.76 1xck n THR 357 Ca 0.13 -0.10 -0.12 0.00 -2.27 0.00 0.00 64.05 61.69 1xck n THR 357 Cb 0.47 0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.77 1xck n THR 357 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xck s SER 358 N -2.47 0.37 -0.14 3.42 0.15 -1.26 -5.08 113.70 108.68 1xck s SER 358 Ca 0.27 -1.30 -0.26 0.00 0.70 0.00 0.00 55.95 55.35 1xck s SER 358 Cb 0.20 0.31 -0.24 0.00 -1.71 0.00 0.00 66.02 64.58 1xck s SER 358 CO 0.49 -0.77 0.69 0.44 1.20 0.00 0.00 173.24 175.29 1xck h ASP 359 N 2.70 0.00 -0.53 5.45 3.32 -1.99 -3.09 116.42 122.29 1xck h ASP 359 Ca -0.36 -0.90 0.11 0.00 0.02 0.00 0.00 57.03 55.89 1xck h ASP 359 Cb 1.23 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.67 1xck h ASP 359 CO 0.57 0.97 -0.21 0.22 -1.72 0.00 0.00 179.24 179.07 1xck h TYR 360 N -1.00 -0.53 0.00 4.55 3.20 -1.99 0.55 116.97 121.75 1xck h TYR 360 Ca -0.01 0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1xck h TYR 360 Cb 0.93 0.31 -0.00 0.00 1.54 0.00 0.00 36.73 39.51 1xck h TYR 360 CO 0.25 -0.30 -0.05 -0.44 -1.64 0.00 0.00 178.16 175.98 1xck h ASP 361 N -0.09 0.00 0.08 -2.11 5.19 -2.00 -1.60 116.42 115.89 1xck h ASP 361 Ca 0.25 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.46 1xck h ASP 361 Cb 0.47 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.00 1xck h ASP 361 CO -0.59 0.05 -0.80 -0.09 -3.12 0.00 0.00 179.24 174.68 1xck h ARG 362 N 0.00 0.41 0.14 3.56 2.43 -0.05 -3.00 114.38 117.88 1xck h ARG 362 Ca -0.00 -0.54 0.01 0.00 -0.81 0.00 0.00 59.98 58.63 1xck h ARG 362 Cb 0.11 0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1xck h ARG 362 CO 0.01 1.21 -0.18 0.93 -1.51 0.00 0.00 179.97 180.43 1xck h GLU 363 N -0.13 -0.36 -0.90 0.20 4.39 0.33 -1.72 114.58 116.39 1xck h GLU 363 Ca -0.12 0.02 0.09 0.00 0.34 0.00 0.00 59.36 59.69 1xck h GLU 363 Cb 1.55 0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 30.22 1xck h GLU 363 CO 0.15 -0.24 0.58 0.87 -1.16 0.00 0.00 179.01 179.22 1xck h LYS 364 N -0.37 0.89 -0.34 2.33 1.79 -1.42 -1.51 116.57 117.94 1xck h LYS 364 Ca 0.01 -0.05 -0.09 0.00 -2.18 0.00 0.00 60.65 58.33 1xck h LYS 364 Cb 0.37 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1xck h LYS 364 CO -0.07 0.59 -0.16 -0.07 -1.08 0.00 0.00 179.45 178.66 1xck h LEU 365 N 0.92 0.72 -1.32 2.94 3.38 -1.33 -2.75 115.31 117.88 1xck h LEU 365 Ca 0.41 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1xck h LEU 365 Cb 0.38 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1xck h LEU 365 CO -0.18 0.96 0.38 1.56 0.09 0.00 0.00 178.44 181.25 1xck h GLN 366 N 0.48 0.84 -0.43 1.13 1.08 -0.65 -1.80 115.11 115.76 1xck h GLN 366 Ca 0.08 -0.07 0.02 0.00 -1.45 0.00 0.00 58.65 57.23 1xck h GLN 366 Cb 0.69 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.91 1xck h GLN 366 CO 0.05 0.59 0.25 0.93 -0.95 0.00 0.00 178.83 179.70 1xck h GLU 367 N 0.86 0.50 -0.54 1.46 5.08 -1.06 -1.02 114.58 119.85 1xck h GLU 367 Ca 0.22 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.52 1xck h GLU 367 Cb -0.04 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1xck h GLU 367 CO -0.04 0.33 0.18 0.00 -1.00 0.00 0.00 179.01 178.48 1xck h ARG 368 N 0.51 0.83 -0.19 2.33 3.08 -1.06 -2.02 114.38 117.87 1xck h ARG 368 Ca 0.17 -0.17 -0.13 0.00 0.07 0.00 0.00 59.98 59.93 1xck h ARG 368 Cb 0.01 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1xck h ARG 368 CO -0.08 0.75 -0.42 -0.39 -1.07 0.00 0.00 179.97 178.76 1xck h VAL 369 N 0.74 1.31 -0.37 2.04 -1.51 -1.30 -1.91 116.25 115.25 1xck h VAL 369 Ca 0.18 -1.58 0.04 0.00 -1.23 0.00 0.00 66.70 64.11 1xck h VAL 369 Cb 0.25 1.62 -0.04 0.00 -2.13 0.00 0.00 31.29 31.00 1xck h VAL 369 CO -0.01 0.49 0.13 0.00 -1.23 0.00 0.00 177.57 176.95 1xck h ALA 370 N 1.19 0.44 0.38 5.19 0.00 -0.89 0.57 119.26 126.14 1xck h ALA 370 Ca 0.03 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1xck h ALA 370 Cb 0.89 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1xck h ALA 370 CO 0.07 -0.26 -0.18 0.87 0.00 0.00 0.00 179.25 179.75 1xck h LYS 371 N 0.28 -0.49 0.58 0.00 1.57 -1.19 0.10 116.57 117.42 1xck h LYS 371 Ca 0.17 0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 1xck h LYS 371 Cb 0.15 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1xck h LYS 371 CO -0.18 -0.23 -0.41 1.25 -0.57 0.00 0.00 179.45 179.32 1xck h LEU 372 N -0.70 -1.06 -1.11 2.94 5.85 -1.08 -2.99 115.31 117.16 1xck h LEU 372 Ca -0.05 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.65 1xck h LEU 372 Cb 0.50 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1xck h LEU 372 CO 0.09 -0.60 -0.38 0.00 -0.34 0.00 0.00 178.44 177.21 1xck h ALA 373 N -1.24 1.13 -0.21 1.25 0.00 0.04 -3.28 119.26 116.95 1xck h ALA 373 Ca -0.08 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 1xck h ALA 373 Cb 0.77 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1xck h ALA 373 CO 0.04 0.48 0.05 0.78 0.00 0.00 0.00 179.25 180.60 1xck h GLY 374 N 1.64 0.36 0.00 0.00 0.00 -0.77 -3.49 103.07 100.81 1xck h GLY 374 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1xck h GLY 374 CO 0.05 0.21 0.00 0.61 0.00 0.00 0.00 176.54 177.41 1xck n GLY 375 N -0.53 -1.36 2.97 4.60 0.00 -1.13 -4.90 105.19 104.84 1xck n GLY 375 Ca -0.04 -1.54 -0.14 0.00 0.00 0.00 0.00 46.02 44.30 1xck n GLY 375 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xck s VAL 376 N 0.00 -0.40 0.30 1.61 1.01 -0.65 -4.45 120.40 117.81 1xck s VAL 376 Ca 0.00 0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.93 1xck s VAL 376 Cb 0.00 -0.46 -0.10 0.00 0.00 0.00 0.00 36.38 35.82 1xck s VAL 376 CO 0.00 0.09 1.19 0.00 0.00 0.00 0.00 175.10 176.38 1xck s ALA 377 N 2.41 3.45 -0.22 5.51 0.00 0.12 -1.95 121.76 131.08 1xck s ALA 377 Ca 0.02 1.06 0.01 0.00 0.00 0.00 0.00 51.96 53.05 1xck s ALA 377 Cb -0.12 -3.40 0.05 0.00 0.00 0.00 0.00 23.12 19.65 1xck s ALA 377 CO -0.09 -0.38 -0.09 0.08 0.00 0.00 0.00 175.76 175.29 1xck s VAL 378 N -1.10 1.69 -0.33 0.00 1.01 -0.49 -0.68 120.40 120.50 1xck s VAL 378 Ca 0.47 -1.17 -0.16 0.00 0.00 0.00 0.00 61.98 61.12 1xck s VAL 378 Cb -0.35 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1xck s VAL 378 CO 0.46 0.06 0.39 -0.63 0.00 0.00 0.00 175.10 175.37 1xck s ILE 379 N 1.35 5.15 -0.32 2.22 1.01 0.05 -2.74 121.20 127.92 1xck s ILE 379 Ca -0.04 0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.68 1xck s ILE 379 Cb -0.18 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.46 1xck s ILE 379 CO -0.07 -0.07 0.18 -0.54 0.00 0.00 0.00 174.94 174.43 1xck s LYS 380 N 2.08 3.41 -0.12 2.79 1.02 0.18 -0.69 119.74 128.42 1xck s LYS 380 Ca 0.13 -0.67 -0.29 0.00 0.02 0.00 0.00 55.97 55.15 1xck s LYS 380 Cb -0.16 -3.63 -0.01 0.00 -0.52 0.00 0.00 37.83 33.51 1xck s LYS 380 CO 0.12 -0.41 1.01 0.08 -0.92 0.00 0.00 175.35 175.23 1xck s VAL 381 N 1.65 4.77 0.23 3.17 1.01 -0.81 -1.13 120.40 129.29 1xck s VAL 381 Ca 0.05 2.04 0.03 0.00 0.00 0.00 0.00 61.98 64.10 1xck s VAL 381 Cb -0.17 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 31.86 1xck s VAL 381 CO 0.08 -0.02 0.37 -0.83 0.00 0.00 0.00 175.10 174.70 1xck s GLY 382 N 1.11 1.44 0.11 4.51 0.00 -1.26 -1.20 107.32 112.03 1xck s GLY 382 Ca 0.48 -1.08 -0.26 0.00 0.00 0.00 0.00 44.72 43.86 1xck s GLY 382 CO 0.17 -1.07 0.97 0.00 0.00 0.00 0.00 173.10 173.17 1xck s ALA 383 N -1.95 -1.73 0.12 3.20 0.00 -1.06 -4.51 121.76 115.83 1xck s ALA 383 Ca 0.36 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.61 1xck s ALA 383 Cb -0.10 0.58 -0.14 0.00 0.00 0.00 0.00 23.12 23.46 1xck s ALA 383 CO 0.30 -0.98 1.26 0.00 0.00 0.00 0.00 175.76 176.34 1xck h ALA 384 N 2.00 0.30 -2.21 0.00 0.00 -1.95 -3.14 119.26 114.26 1xck h ALA 384 Ca -0.24 -0.76 -0.41 0.00 0.00 0.00 0.00 54.91 53.49 1xck h ALA 384 Cb 1.23 -0.02 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 1xck h ALA 384 CO 0.27 0.87 -0.72 0.95 0.00 0.00 0.00 179.25 180.61 1xck s THR 385 N -3.08 1.53 0.24 0.00 -4.23 -1.26 -4.94 115.64 103.89 1xck s THR 385 Ca -0.05 -2.15 -0.07 0.00 -1.18 0.00 0.00 61.69 58.24 1xck s THR 385 Cb 0.08 -2.03 0.22 0.00 1.34 0.00 0.00 72.50 72.12 1xck s THR 385 CO 0.87 -0.61 1.88 -0.08 -0.54 0.00 0.00 174.62 176.14 1xck h GLU 386 N 2.60 1.26 0.13 3.99 4.81 -1.99 -1.12 114.58 124.27 1xck h GLU 386 Ca -0.38 -0.12 0.01 0.00 -0.13 0.00 0.00 59.36 58.74 1xck h GLU 386 Cb 1.21 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 30.31 1xck h GLU 386 CO 0.63 0.89 -0.18 0.28 -0.73 0.00 0.00 179.01 179.89 1xck h VAL 387 N 1.28 0.58 -0.69 0.32 2.07 -1.99 0.52 116.25 118.34 1xck h VAL 387 Ca 0.33 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.85 1xck h VAL 387 Cb -0.04 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 1xck h VAL 387 CO -0.06 0.00 0.41 -0.33 0.02 0.00 0.00 177.57 177.61 1xck h GLU 388 N -0.37 0.94 0.29 1.57 5.08 -1.93 -1.51 114.58 118.66 1xck h GLU 388 Ca 0.02 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xck h GLU 388 Cb 0.38 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1xck h GLU 388 CO -0.08 0.68 -0.30 1.98 -1.00 0.00 0.00 179.01 180.29 1xck h MET 389 N 0.94 -0.60 -0.63 2.33 4.05 -0.81 0.15 114.93 120.35 1xck h MET 389 Ca 0.25 0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.77 1xck h MET 389 Cb -0.02 0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 30.88 1xck h MET 389 CO -0.05 -0.40 0.42 0.87 0.23 0.00 0.00 176.91 177.98 1xck h LYS 390 N -0.62 0.62 0.28 0.39 1.79 -0.74 0.21 116.57 118.50 1xck h LYS 390 Ca -0.01 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1xck h LYS 390 Cb 0.57 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1xck h LYS 390 CO -0.06 0.41 -0.13 1.49 -1.08 0.00 0.00 179.45 180.08 1xck h GLU 391 N 0.64 -0.36 -0.57 3.15 4.22 -0.69 -2.80 114.58 118.18 1xck h GLU 391 Ca 0.27 0.02 0.02 0.00 0.08 0.00 0.00 59.36 59.75 1xck h GLU 391 Cb 0.25 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1xck h GLU 391 CO -0.08 -0.02 0.37 -0.22 -2.18 0.00 0.00 179.01 176.88 1xck h LYS 392 N -0.78 0.70 -0.81 1.92 3.64 -0.39 -1.13 116.57 119.72 1xck h LYS 392 Ca -0.04 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1xck h LYS 392 Cb 0.51 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.12 1xck h LYS 392 CO 0.06 0.46 0.51 -0.22 -2.27 0.00 0.00 179.45 178.00 1xck h LYS 393 N 0.72 0.95 -0.55 1.90 3.64 -0.94 0.10 116.57 122.41 1xck h LYS 393 Ca 0.21 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.47 1xck h LYS 393 Cb -0.02 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.56 1xck h LYS 393 CO -0.05 0.63 0.07 0.00 -2.27 0.00 0.00 179.45 177.83 1xck h ALA 394 N 1.35 0.73 -0.06 5.00 0.00 -0.95 -1.12 119.26 124.21 1xck h ALA 394 Ca 0.33 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1xck h ALA 394 Cb 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1xck h ALA 394 CO -0.13 0.49 -0.34 0.00 0.00 0.00 0.00 179.25 179.27 1xck h ARG 395 N 0.80 0.11 -0.14 0.00 3.08 -0.69 -2.00 114.38 115.55 1xck h ARG 395 Ca 0.16 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 1xck h ARG 395 Cb 0.43 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 1xck h ARG 395 CO 0.01 0.44 -0.20 0.28 -1.07 0.00 0.00 179.97 179.43 1xck h VAL 396 N 0.10 1.36 -0.90 2.04 2.07 -0.55 -1.17 116.25 119.20 1xck h VAL 396 Ca 0.01 -1.42 0.06 0.00 0.82 0.00 0.00 66.70 66.17 1xck h VAL 396 Cb 0.65 1.96 -0.06 0.00 -1.52 0.00 0.00 31.29 32.32 1xck h VAL 396 CO 0.05 0.42 0.57 -0.33 0.02 0.00 0.00 177.57 178.30 1xck h GLU 397 N -0.01 1.02 0.42 1.57 5.08 -1.00 0.13 114.58 121.79 1xck h GLU 397 Ca 0.01 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1xck h GLU 397 Cb 0.77 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1xck h GLU 397 CO 0.05 0.68 -0.20 -0.44 -1.00 0.00 0.00 179.01 178.09 1xck h ASP 398 N 1.05 -0.47 -0.92 1.42 3.32 -1.34 -2.81 116.42 116.67 1xck h ASP 398 Ca 0.39 -0.09 0.23 0.00 0.02 0.00 0.00 57.03 57.58 1xck h ASP 398 Cb 0.14 0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.76 1xck h ASP 398 CO -0.16 -0.05 0.62 0.00 -1.72 0.00 0.00 179.24 177.93 1xck h ALA 399 N -0.80 2.43 0.11 3.45 0.00 -1.07 -0.59 119.26 122.79 1xck h ALA 399 Ca -0.06 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1xck h ALA 399 Cb 0.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1xck h ALA 399 CO 0.09 -0.72 -0.05 1.25 0.00 0.00 0.00 179.25 179.83 1xck h LEU 400 N 0.27 -0.12 -0.84 0.00 5.85 -0.66 -0.39 115.31 119.42 1xck h LEU 400 Ca 0.47 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 59.06 1xck h LEU 400 Cb 1.39 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.41 1xck h LEU 400 CO -0.13 0.09 0.55 0.45 -0.34 0.00 0.00 178.44 179.05 1xck h HIS 401 N -0.33 1.03 0.37 1.25 3.86 -0.89 0.12 115.15 120.56 1xck h HIS 401 Ca -0.01 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1xck h HIS 401 Cb 0.27 -0.34 -0.00 0.00 1.06 0.00 0.00 27.41 28.39 1xck h HIS 401 CO -0.01 0.62 -0.22 0.00 0.86 0.00 0.00 177.93 179.18 1xck h ALA 402 N 1.33 -0.55 -0.61 2.45 0.00 -1.10 -1.83 119.26 118.94 1xck h ALA 402 Ca 0.32 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1xck h ALA 402 Cb -0.06 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1xck h ALA 402 CO -0.09 -0.82 0.31 1.15 0.00 0.00 0.00 179.25 179.80 1xck h THR 403 N -0.56 1.19 -0.68 0.00 2.02 -0.76 -0.17 112.91 113.96 1xck h THR 403 Ca -0.04 -0.52 0.03 0.00 0.77 0.00 0.00 66.41 66.65 1xck h THR 403 Cb 0.45 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 1xck h THR 403 CO 0.05 0.22 0.42 -0.09 0.37 0.00 0.00 175.52 176.49 1xck h ARG 404 N 0.86 0.79 -0.05 6.66 1.12 -0.51 0.18 114.38 123.42 1xck h ARG 404 Ca 0.22 -0.05 -0.17 0.00 -1.11 0.00 0.00 59.98 58.87 1xck h ARG 404 Cb 0.06 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 29.83 1xck h ARG 404 CO -0.03 0.52 -0.72 0.00 -3.11 0.00 0.00 179.97 176.63 1xck h ALA 405 N 1.30 0.68 -0.52 2.80 0.00 -0.66 -2.98 119.26 119.88 1xck h ALA 405 Ca 0.28 -0.61 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1xck h ALA 405 Cb 0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1xck h ALA 405 CO -0.12 0.79 0.01 0.00 0.00 0.00 0.00 179.25 179.93 1xck h ALA 406 N 1.05 0.70 -0.05 0.00 0.00 -0.39 -2.43 119.26 118.14 1xck h ALA 406 Ca -0.02 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 1xck h ALA 406 Cb 1.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1xck h ALA 406 CO 0.11 0.51 -0.23 0.28 0.00 0.00 0.00 179.25 179.93 1xck h VAL 407 N 0.78 1.19 -0.04 0.00 2.07 -0.96 0.41 116.25 119.71 1xck h VAL 407 Ca 0.15 -0.89 -0.11 0.00 0.82 0.00 0.00 66.70 66.67 1xck h VAL 407 Cb 0.52 1.41 0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1xck h VAL 407 CO 0.03 0.26 -0.41 -0.33 0.02 0.00 0.00 177.57 177.14 1xck h GLU 408 N 0.08 0.35 0.00 1.57 5.08 -1.31 -3.41 114.58 116.94 1xck h GLU 408 Ca 0.01 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1xck h GLU 408 Cb 0.45 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1xck h GLU 408 CO 0.03 0.99 -0.14 0.39 -1.00 0.00 0.00 179.01 179.28 1xck n GLU 409 N -4.36 0.73 0.00 2.33 1.02 -0.95 -5.08 120.64 114.32 1xck n GLU 409 Ca -0.09 -1.08 0.00 0.00 -0.02 0.00 0.00 57.16 55.97 1xck n GLU 409 Cb 0.56 -0.72 0.00 0.00 -0.02 0.00 0.00 31.44 31.27 1xck n GLU 409 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xck n GLY 410 N -0.27 -1.90 3.22 0.62 0.00 0.14 -4.45 105.19 102.56 1xck n GLY 410 Ca 0.02 -1.39 -0.15 0.00 0.00 0.00 0.00 46.02 44.51 1xck n GLY 410 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xck s VAL 411 N 0.00 1.10 0.21 1.61 -7.23 0.90 -0.95 120.40 116.04 1xck s VAL 411 Ca 0.00 -1.87 -0.00 0.00 -1.81 0.00 0.00 61.98 58.29 1xck s VAL 411 Cb 0.00 -1.64 -0.04 0.00 0.56 0.00 0.00 36.38 35.26 1xck s VAL 411 CO 0.00 -0.64 0.13 0.68 -0.31 0.00 0.00 175.10 174.96 1xck s VAL 412 N -2.88 0.08 0.28 1.32 -7.23 -0.59 0.10 120.40 111.48 1xck s VAL 412 Ca 0.12 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.99 1xck s VAL 412 Cb -0.00 -2.52 -0.13 0.00 0.56 0.00 0.00 36.38 34.29 1xck s VAL 412 CO 0.01 0.00 1.44 0.00 -0.31 0.00 0.00 175.10 176.24 1xck n ALA 413 N -0.31 1.64 -1.72 1.32 0.00 -1.26 -1.31 120.51 118.86 1xck n ALA 413 Ca 0.02 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1xck n ALA 413 Cb 0.66 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1xck n ALA 413 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 414 N 1.76 1.37 2.67 0.00 0.00 0.50 -3.12 105.19 108.37 1xck n GLY 414 Ca 0.09 -1.87 -0.11 0.00 0.00 0.00 0.00 46.02 44.13 1xck n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xck n GLY 415 N 5.00 1.14 2.21 -0.02 0.00 -1.26 -1.78 105.19 110.47 1xck n GLY 415 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.93 1xck n GLY 415 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xck n GLY 416 N -0.22 0.46 0.13 -0.02 0.00 -1.26 -4.42 105.19 99.86 1xck n GLY 416 Ca -0.11 -0.18 0.04 0.00 0.00 0.00 0.00 46.02 45.77 1xck n GLY 416 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1xck h VAL 417 N 0.00 0.48 -0.28 1.61 -1.51 -1.55 -3.25 116.25 111.75 1xck h VAL 417 Ca -0.02 -1.79 -0.00 0.00 -1.23 0.00 0.00 66.70 63.66 1xck h VAL 417 Cb 0.25 2.06 -0.01 0.00 -2.13 0.00 0.00 31.29 31.46 1xck h VAL 417 CO 0.03 0.27 0.17 0.00 -1.23 0.00 0.00 177.57 176.82 1xck h ALA 418 N 1.61 0.36 -0.78 5.19 0.00 -1.73 0.16 119.26 124.07 1xck h ALA 418 Ca -0.06 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1xck h ALA 418 Cb 1.35 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 1xck h ALA 418 CO 0.04 -0.14 0.34 -0.07 0.00 0.00 0.00 179.25 179.42 1xck h LEU 419 N 0.36 1.06 -0.75 0.00 3.38 -1.85 -0.41 115.31 117.10 1xck h LEU 419 Ca 0.10 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 1xck h LEU 419 Cb 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1xck h LEU 419 CO -0.02 0.93 -0.27 -0.29 0.09 0.00 0.00 178.44 178.87 1xck h ILE 420 N 1.12 1.28 0.09 1.22 2.10 -1.53 -1.56 117.51 120.24 1xck h ILE 420 Ca 0.26 -1.37 -0.00 0.00 1.08 0.00 0.00 64.86 64.83 1xck h ILE 420 Cb 0.18 1.33 0.00 0.00 -1.09 0.00 0.00 36.82 37.23 1xck h ILE 420 CO -0.03 0.45 -0.04 -0.09 -1.08 0.00 0.00 178.15 177.35 1xck h ARG 421 N 0.56 -0.12 -0.96 2.19 9.65 -0.55 -1.36 114.38 123.78 1xck h ARG 421 Ca 0.07 0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.03 1xck h ARG 421 Cb 0.76 0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 29.30 1xck h ARG 421 CO 0.06 0.08 0.62 0.28 2.80 0.00 0.00 179.97 183.80 1xck h VAL 422 N -0.30 1.08 -0.46 0.20 2.07 -0.98 -2.44 116.25 115.41 1xck h VAL 422 Ca -0.01 -0.38 -0.09 0.00 0.82 0.00 0.00 66.70 67.03 1xck h VAL 422 Cb 0.25 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 1xck h VAL 422 CO 0.02 0.20 -0.06 0.00 0.02 0.00 0.00 177.57 177.76 1xck h ALA 423 N 1.44 0.63 -0.02 1.67 0.00 -1.04 -2.64 119.26 119.30 1xck h ALA 423 Ca 0.42 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1xck h ALA 423 Cb 0.17 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1xck h ALA 423 CO -0.17 0.48 0.03 0.66 0.00 0.00 0.00 179.25 180.24 1xck h SER 424 N 0.70 0.00 1.76 0.00 4.64 -0.77 -1.19 113.55 118.68 1xck h SER 424 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1xck h SER 424 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1xck h SER 424 CO 0.04 0.00 -0.09 0.11 -0.87 0.00 0.00 176.83 176.01 1xck h LYS 425 N 0.00 0.00 -0.63 4.77 1.57 -1.21 -3.32 116.57 117.75 1xck h LYS 425 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1xck h LYS 425 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1xck h LYS 425 CO -0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 1xck n LEU 426 N -2.82 5.09 -0.28 2.94 4.77 -0.45 -4.62 117.00 121.63 1xck n LEU 426 Ca 0.04 -2.58 0.18 0.00 -0.03 0.00 0.00 56.01 53.62 1xck n LEU 426 Cb 0.50 -0.64 0.48 0.00 -2.33 0.00 0.00 43.42 41.42 1xck n LEU 426 CO 0.34 0.63 1.22 0.00 -1.33 0.00 0.00 177.39 178.24 1xck h ALA 427 N 3.87 2.12 -0.29 -1.18 0.00 -1.67 -0.43 119.26 121.68 1xck h ALA 427 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xck h ALA 427 Cb 1.73 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1xck h ALA 427 CO 0.40 -0.43 0.00 -0.25 0.00 0.00 0.00 179.25 178.96 1xck n ASP 428 N -4.57 2.31 -4.72 0.00 8.00 -1.26 -4.92 116.55 111.38 1xck n ASP 428 Ca 0.21 -1.85 -0.42 0.00 0.71 0.00 0.00 54.79 53.44 1xck n ASP 428 Cb 0.70 -0.19 -0.03 0.00 -0.02 0.00 0.00 41.12 41.58 1xck n ASP 428 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xck s LEU 429 N -1.41 4.38 0.16 0.64 2.96 -0.17 -5.01 118.68 120.23 1xck s LEU 429 Ca 0.33 2.50 0.03 0.00 -0.22 0.00 0.00 54.13 56.77 1xck s LEU 429 Cb 0.18 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.23 1xck s LEU 429 CO 0.26 -0.71 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.41 1xck s ARG 430 N 0.68 1.07 0.00 1.98 1.81 -1.26 -4.96 118.95 118.28 1xck s ARG 430 Ca 0.64 -1.49 0.00 0.00 -1.72 0.00 0.00 55.73 53.17 1xck s ARG 430 Cb -0.40 -0.42 0.00 0.00 -0.45 0.00 0.00 34.95 33.68 1xck s ARG 430 CO 0.34 -0.04 0.00 0.41 -0.68 0.00 0.00 175.30 175.33 1xck n GLY 431 N -0.21 6.08 0.16 -3.53 0.00 -1.26 -5.01 105.19 101.41 1xck n GLY 431 Ca -0.09 -2.04 0.04 0.00 0.00 0.00 0.00 46.02 43.93 1xck n GLY 431 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1xck h GLN 432 N 0.00 0.00 -4.13 1.61 4.20 -1.99 -3.47 115.11 111.32 1xck h GLN 432 Ca 0.00 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.45 1xck h GLN 432 Cb 0.00 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.69 1xck h GLN 432 CO 0.00 0.46 -0.21 0.54 -0.67 0.00 0.00 178.83 178.94 1xck s ASN 433 N -6.43 0.84 0.21 1.46 2.20 -1.26 -5.05 114.94 106.91 1xck s ASN 433 Ca 0.03 -1.45 -0.09 0.00 -0.94 0.00 0.00 52.86 50.41 1xck s ASN 433 Cb 0.08 0.64 0.15 0.00 -2.00 0.00 0.00 41.25 40.13 1xck s ASN 433 CO 0.72 -1.26 1.80 -0.08 -2.94 0.00 0.00 177.10 175.34 1xck h GLU 434 N 2.14 1.12 -0.46 3.55 4.57 -1.99 -1.76 114.58 121.76 1xck h GLU 434 Ca -0.28 -0.17 0.03 0.00 -1.18 0.00 0.00 59.36 57.76 1xck h GLU 434 Cb 1.24 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 29.59 1xck h GLU 434 CO 0.39 0.87 0.24 -0.44 -1.18 0.00 0.00 179.01 178.89 1xck h ASP 435 N 1.10 0.35 -0.45 1.04 3.32 -1.96 0.04 116.42 119.87 1xck h ASP 435 Ca 0.27 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.30 1xck h ASP 435 Cb 0.12 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1xck h ASP 435 CO -0.03 0.25 0.17 1.56 -1.72 0.00 0.00 179.24 179.47 1xck h GLN 436 N 0.47 0.73 -0.72 3.56 4.20 -1.62 -0.00 115.11 121.73 1xck h GLN 436 Ca 0.19 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 1xck h GLN 436 Cb 0.08 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 1xck h GLN 436 CO -0.13 0.63 0.38 -0.91 -0.67 0.00 0.00 178.83 178.13 1xck h ASN 437 N 0.72 0.91 -0.52 1.46 2.35 -0.35 0.37 115.58 120.52 1xck h ASN 437 Ca 0.17 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 1xck h ASN 437 Cb 0.19 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1xck h ASN 437 CO -0.01 0.75 0.25 0.58 -1.65 0.00 0.00 177.43 177.36 1xck h VAL 438 N 0.99 1.19 -0.71 2.81 2.07 -0.18 -1.65 116.25 120.78 1xck h VAL 438 Ca 0.25 -0.54 0.07 0.00 0.82 0.00 0.00 66.70 67.30 1xck h VAL 438 Cb 0.06 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 1xck h VAL 438 CO -0.04 0.22 0.40 1.23 0.02 0.00 0.00 177.57 179.40 1xck h GLY 439 N 0.69 1.06 1.00 2.17 0.00 -0.21 0.19 103.07 107.98 1xck h GLY 439 Ca 0.18 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 1xck h GLY 439 CO -0.02 0.16 0.35 -2.22 0.00 0.00 0.00 176.54 174.81 1xck h ILE 440 N 0.72 1.21 -0.43 2.60 2.04 -0.46 -2.12 117.51 121.07 1xck h ILE 440 Ca 0.33 -0.54 -0.09 0.00 1.00 0.00 0.00 64.86 65.55 1xck h ILE 440 Cb 0.22 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1xck h ILE 440 CO -0.20 0.23 -0.10 0.11 0.00 0.00 0.00 178.15 178.19 1xck h LYS 441 N 0.90 0.78 -0.52 2.37 1.79 -0.37 -1.34 116.57 120.17 1xck h LYS 441 Ca 0.23 -0.25 0.02 0.00 -2.18 0.00 0.00 60.65 58.47 1xck h LYS 441 Cb 0.05 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.60 1xck h LYS 441 CO -0.04 0.85 0.32 0.28 -1.08 0.00 0.00 179.45 179.78 1xck h VAL 442 N 0.70 1.06 -0.08 0.50 2.07 -0.27 -0.13 116.25 120.11 1xck h VAL 442 Ca 0.12 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 1xck h VAL 442 Cb 0.58 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1xck h VAL 442 CO 0.04 0.12 -0.00 0.00 0.02 0.00 0.00 177.57 177.74 1xck h ALA 443 N 1.23 0.11 -0.49 1.67 0.00 -1.15 -1.78 119.26 118.85 1xck h ALA 443 Ca 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1xck h ALA 443 Cb 0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1xck h ALA 443 CO -0.09 -0.20 0.28 -0.07 0.00 0.00 0.00 179.25 179.17 1xck h LEU 444 N -0.14 0.58 -0.43 0.00 3.38 -1.08 -1.35 115.31 116.27 1xck h LEU 444 Ca 0.02 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1xck h LEU 444 Cb 0.35 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1xck h LEU 444 CO 0.00 0.46 -0.22 -0.09 0.09 0.00 0.00 178.44 178.68 1xck h ARG 445 N 0.67 0.91 -0.26 1.13 2.43 -0.94 -3.03 114.38 115.29 1xck h ARG 445 Ca 0.17 -0.40 -0.05 0.00 -0.81 0.00 0.00 59.98 58.90 1xck h ARG 445 Cb -0.00 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1xck h ARG 445 CO -0.03 1.06 -0.04 0.00 -1.51 0.00 0.00 179.97 179.45 1xck h ALA 446 N 0.83 1.45 0.00 2.80 0.00 -0.38 -2.24 119.26 121.72 1xck h ALA 446 Ca 0.09 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xck h ALA 446 Cb 0.79 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1xck h ALA 446 CO 0.07 0.39 0.00 -1.33 0.00 0.00 0.00 179.25 178.37 1xck n MET 447 N -4.29 0.04 0.03 0.00 2.81 -0.61 -0.42 117.12 114.68 1xck n MET 447 Ca 0.01 0.29 0.11 0.00 -1.81 0.00 0.00 57.70 56.30 1xck n MET 447 Cb 0.24 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.24 1xck n MET 447 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1xck n GLU 448 N -1.33 0.33 -0.05 0.03 1.02 -0.84 -3.61 120.64 116.18 1xck n GLU 448 Ca 0.02 -0.02 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 1xck n GLU 448 Cb 0.03 -1.59 -0.03 0.00 -0.02 0.00 0.00 31.44 29.83 1xck n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xck h ALA 449 N 2.48 -0.24 0.09 0.62 0.00 -0.88 -1.78 119.26 119.55 1xck h ALA 449 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1xck h ALA 449 Cb 0.76 0.61 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 1xck h ALA 449 CO 0.00 -0.74 -0.52 -1.35 0.00 0.00 0.00 179.25 176.64 1xck h PRO 450 N -0.31 -0.70 -0.07 0.00 0.11 -1.79 0.12 132.00 129.36 1xck h PRO 450 Ca 0.13 0.05 0.04 0.00 0.11 0.00 0.00 66.00 66.32 1xck h PRO 450 Cb 0.52 0.16 -0.04 0.00 0.11 0.00 0.00 31.00 31.74 1xck h PRO 450 CO -0.42 -0.46 -0.18 1.25 -0.21 0.00 0.00 178.00 177.98 1xck h LEU 451 N -0.72 -0.55 -0.61 2.35 6.46 -1.69 -0.49 115.31 120.06 1xck h LEU 451 Ca -0.00 0.09 0.11 0.00 -0.12 0.00 0.00 57.88 57.96 1xck h LEU 451 Cb 0.74 0.24 -0.08 0.00 -0.73 0.00 0.00 40.66 40.82 1xck h LEU 451 CO -0.30 -0.24 0.15 0.03 -0.62 0.00 0.00 178.44 177.47 1xck h ARG 452 N -0.26 0.28 -0.19 1.25 3.08 -1.08 0.55 114.38 118.01 1xck h ARG 452 Ca 0.08 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 1xck h ARG 452 Cb 0.37 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1xck h ARG 452 CO -0.22 0.19 0.11 0.37 -1.07 0.00 0.00 179.97 179.34 1xck h GLN 453 N 0.29 0.26 -0.46 0.04 5.75 -0.15 0.36 115.11 121.20 1xck h GLN 453 Ca 0.32 -0.03 0.08 0.00 -0.15 0.00 0.00 58.65 58.87 1xck h GLN 453 Cb 0.47 -0.05 -0.06 0.00 1.07 0.00 0.00 27.48 28.90 1xck h GLN 453 CO -0.39 0.24 0.08 0.82 -2.65 0.00 0.00 178.83 176.93 1xck h ILE 454 N 0.21 0.73 -0.65 2.39 2.04 -0.06 0.13 117.51 122.30 1xck h ILE 454 Ca 0.07 -0.07 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 1xck h ILE 454 Cb 0.05 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 1xck h ILE 454 CO -0.01 0.04 0.16 0.58 0.00 0.00 0.00 178.15 178.92 1xck h VAL 455 N 0.21 1.25 -0.59 1.67 2.07 -0.68 -2.32 116.25 117.87 1xck h VAL 455 Ca 0.23 -0.91 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 1xck h VAL 455 Cb 0.30 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1xck h VAL 455 CO -0.31 0.35 0.30 0.25 0.02 0.00 0.00 177.57 178.18 1xck h LEU 456 N 0.97 0.75 -1.82 2.57 5.85 0.13 -1.53 115.31 122.23 1xck h LEU 456 Ca 0.21 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1xck h LEU 456 Cb 0.34 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 1xck h LEU 456 CO 0.00 0.65 -0.14 0.78 -0.34 0.00 0.00 178.44 179.39 1xck h ASN 457 N 0.79 0.00 0.78 1.25 2.35 -0.51 -0.53 115.58 119.71 1xck h ASN 457 Ca 0.20 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 1xck h ASN 457 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1xck h ASN 457 CO -0.03 0.14 -0.03 0.00 -1.65 0.00 0.00 177.43 175.86 1xck n GLY 459 N 1.41 0.38 3.81 0.00 0.00 -0.21 -5.06 105.19 105.52 1xck n GLY 459 Ca 0.10 -0.94 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 1xck n GLY 459 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xck s GLU 460 N -3.47 2.27 -0.52 1.61 0.41 -0.73 -5.03 118.70 113.23 1xck s GLU 460 Ca 0.00 -1.93 -0.24 0.00 -0.41 0.00 0.00 54.97 52.39 1xck s GLU 460 Cb 0.00 -2.02 0.04 0.00 -1.78 0.00 0.00 34.13 30.37 1xck s GLU 460 CO 0.00 -0.32 0.93 -1.21 -0.49 0.00 0.00 175.26 174.17 1xck s GLU 461 N -4.06 3.39 0.20 1.61 2.02 -1.26 -4.31 118.70 116.29 1xck s GLU 461 Ca 0.36 -0.14 -0.15 0.00 0.02 0.00 0.00 54.97 55.06 1xck s GLU 461 Cb 0.01 -4.02 0.20 0.00 0.10 0.00 0.00 34.13 30.42 1xck s GLU 461 CO 0.21 -1.41 1.64 -1.35 0.02 0.00 0.00 175.26 174.37 1xck h PRO 462 N 9.24 -0.00 -0.66 0.39 0.11 -1.87 -2.11 132.00 137.10 1xck h PRO 462 Ca -0.26 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.93 1xck h PRO 462 Cb 1.07 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 1xck h PRO 462 CO 1.07 -0.00 0.33 0.77 -0.21 0.00 0.00 178.00 179.96 1xck h SER 463 N -0.00 0.44 0.15 -2.05 0.02 -1.95 0.30 113.55 110.47 1xck h SER 463 Ca 0.27 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.27 1xck h SER 463 Cb 0.41 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1xck h SER 463 CO -0.58 0.27 -0.07 0.58 -1.14 0.00 0.00 176.83 175.88 1xck h VAL 464 N 0.58 0.97 -0.48 2.27 2.07 -1.82 -0.21 116.25 119.64 1xck h VAL 464 Ca 0.32 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1xck h VAL 464 Cb 0.30 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1xck h VAL 464 CO -0.24 0.13 0.21 0.58 0.02 0.00 0.00 177.57 178.27 1xck h VAL 465 N -0.47 1.20 -0.90 2.57 2.07 -1.21 -0.23 116.25 119.27 1xck h VAL 465 Ca -0.02 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 66.93 1xck h VAL 465 Cb 0.37 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 1xck h VAL 465 CO 0.03 0.23 0.59 0.00 0.02 0.00 0.00 177.57 178.44 1xck h ALA 466 N 1.05 1.19 0.12 1.67 0.00 -0.39 -0.24 119.26 122.65 1xck h ALA 466 Ca 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1xck h ALA 466 Cb 0.16 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1xck h ALA 466 CO -0.02 0.46 -0.06 -0.97 0.00 0.00 0.00 179.25 178.67 1xck h ASN 467 N 1.15 -0.14 -0.31 0.00 -1.24 -0.53 -1.41 115.58 113.10 1xck h ASN 467 Ca 0.36 -0.16 0.03 0.00 0.71 0.00 0.00 56.30 57.24 1xck h ASN 467 Cb -0.02 0.04 -0.03 0.00 0.73 0.00 0.00 38.32 39.04 1xck h ASN 467 CO -0.11 0.08 0.13 0.74 -1.29 0.00 0.00 177.43 176.97 1xck h THR 468 N -0.35 0.94 -0.47 -3.57 2.02 -0.73 -2.20 112.91 108.55 1xck h THR 468 Ca -0.02 -0.09 0.03 0.00 0.77 0.00 0.00 66.41 67.10 1xck h THR 468 Cb 0.28 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 1xck h THR 468 CO 0.03 0.05 0.25 0.58 0.37 0.00 0.00 175.52 176.80 1xck h VAL 469 N 0.27 0.99 -0.29 3.16 2.07 -0.97 -1.37 116.25 120.12 1xck h VAL 469 Ca 0.14 -0.17 0.04 0.00 0.82 0.00 0.00 66.70 67.53 1xck h VAL 469 Cb 0.09 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1xck h VAL 469 CO -0.12 0.09 0.20 0.11 0.02 0.00 0.00 177.57 177.87 1xck h LYS 470 N 0.50 0.20 -0.23 1.57 1.57 -0.85 -1.94 116.57 117.39 1xck h LYS 470 Ca 0.20 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.89 1xck h LYS 470 Cb 0.08 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1xck h LYS 470 CO -0.12 0.13 -0.18 0.78 -0.57 0.00 0.00 179.45 179.48 1xck h GLY 471 N 0.20 0.43 0.00 3.86 0.00 -0.64 -3.45 103.07 103.47 1xck h GLY 471 Ca 0.13 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1xck h GLY 471 CO -0.02 0.28 0.00 0.61 0.00 0.00 0.00 176.54 177.41 1xck n GLY 472 N -0.59 -1.81 3.21 4.60 0.00 -0.73 -5.11 105.19 104.76 1xck n GLY 472 Ca -0.00 -1.52 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 1xck n GLY 472 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xck s ASP 473 N -1.30 0.53 0.70 1.61 1.01 -1.26 -5.02 116.67 112.93 1xck s ASP 473 Ca 0.00 -1.30 0.00 0.00 0.71 0.00 0.00 52.55 51.96 1xck s ASP 473 Cb 0.00 0.28 0.00 0.00 1.01 0.00 0.00 42.92 44.21 1xck s ASP 473 CO 0.00 -0.75 0.00 0.61 0.21 0.00 0.00 175.17 175.24 1xck n GLY 474 N -0.24 2.54 1.55 0.21 0.00 -1.26 -1.36 105.19 106.63 1xck n GLY 474 Ca -0.02 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 1xck n GLY 474 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xck n ASN 475 N 1.07 3.38 -4.69 1.61 4.13 -1.26 -4.88 115.26 114.63 1xck n ASN 475 Ca 0.00 -2.75 -0.42 0.00 1.68 0.00 0.00 54.58 53.09 1xck n ASN 475 Cb 0.00 -0.66 -0.03 0.00 -1.54 0.00 0.00 39.78 37.56 1xck n ASN 475 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1xck s TYR 476 N -1.70 3.47 0.00 3.10 5.04 -0.46 -0.43 117.35 126.37 1xck s TYR 476 Ca 0.28 1.54 0.00 0.00 -2.44 0.00 0.00 57.07 56.45 1xck s TYR 476 Cb 0.24 -3.23 0.00 0.00 0.35 0.00 0.00 41.96 39.32 1xck s TYR 476 CO 0.06 -0.41 0.00 0.41 -1.34 0.00 0.00 175.55 174.27 1xck n GLY 477 N 3.12 4.10 3.20 8.97 0.00 0.80 -4.68 105.19 120.71 1xck n GLY 477 Ca 0.09 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 1xck n GLY 477 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1xck s TYR 478 N -1.77 2.86 -0.87 1.61 5.04 -1.26 -1.84 117.35 121.13 1xck s TYR 478 Ca 0.00 -1.34 -0.24 0.00 -2.44 0.00 0.00 57.07 53.05 1xck s TYR 478 Cb 0.00 -2.00 0.05 0.00 0.35 0.00 0.00 41.96 40.36 1xck s TYR 478 CO 0.00 -0.70 1.32 1.21 -1.34 0.00 0.00 175.55 176.04 1xck s ASN 479 N 1.37 6.34 0.50 4.32 3.84 0.26 -4.84 114.94 126.73 1xck s ASN 479 Ca 0.05 -1.05 0.22 0.00 0.21 0.00 0.00 52.86 52.30 1xck s ASN 479 Cb -0.14 -2.54 1.29 0.00 -0.55 0.00 0.00 41.25 39.31 1xck s ASN 479 CO -0.09 -1.61 1.98 0.00 -2.79 0.00 0.00 177.10 174.60 1xck h ALA 480 N 9.80 2.37 -0.23 1.71 0.00 -1.94 0.39 119.26 131.36 1xck h ALA 480 Ca -0.04 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1xck h ALA 480 Cb 1.03 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1xck h ALA 480 CO 1.32 -0.53 -0.35 0.00 0.00 0.00 0.00 179.25 179.69 1xck h ALA 481 N 1.72 0.98 -0.01 0.00 0.00 -1.96 -3.31 119.26 116.67 1xck h ALA 481 Ca 0.28 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1xck h ALA 481 Cb 0.93 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1xck h ALA 481 CO -0.03 0.61 0.00 0.25 0.00 0.00 0.00 179.25 180.07 1xck n THR 482 N -4.06 0.04 -2.25 0.00 -2.24 -0.66 -4.99 114.28 100.13 1xck n THR 482 Ca -0.01 -0.52 -0.21 0.00 -2.27 0.00 0.00 64.05 61.04 1xck n THR 482 Cb 0.47 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.72 1xck n THR 482 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xck n GLU 483 N 0.18 -1.65 -4.65 -0.78 1.02 0.13 -4.98 120.64 109.91 1xck n GLU 483 Ca 0.02 1.05 -0.33 0.00 -0.02 0.00 0.00 57.16 57.88 1xck n GLU 483 Cb 0.10 -5.66 -0.12 0.00 -0.02 0.00 0.00 31.44 25.73 1xck n GLU 483 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1xck s GLU 484 N -4.80 3.02 0.18 3.49 0.41 -1.19 -4.92 118.70 114.90 1xck s GLU 484 Ca 0.00 -0.59 -0.08 0.00 -0.41 0.00 0.00 54.97 53.89 1xck s GLU 484 Cb 0.00 -2.63 -0.06 0.00 -1.78 0.00 0.00 34.13 29.65 1xck s GLU 484 CO 0.00 0.49 0.47 0.71 -0.49 0.00 0.00 175.26 176.43 1xck s TYR 485 N -0.34 3.46 -2.85 1.61 1.51 -1.26 -0.57 117.35 118.90 1xck s TYR 485 Ca 0.04 0.73 0.00 0.00 -1.01 0.00 0.00 57.07 56.84 1xck s TYR 485 Cb -0.12 -2.14 0.00 0.00 -0.11 0.00 0.00 41.96 39.58 1xck s TYR 485 CO 0.02 0.36 0.00 0.41 -1.11 0.00 0.00 175.55 175.23 1xck n GLY 486 N 0.03 -0.83 3.62 0.71 0.00 -0.76 -4.96 105.19 102.99 1xck n GLY 486 Ca -0.01 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.63 1xck n GLY 486 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xck s ASN 487 N -4.00 6.80 0.23 1.61 3.84 -1.26 -0.14 114.94 122.01 1xck s ASN 487 Ca 0.00 0.82 -0.07 0.00 0.21 0.00 0.00 52.86 53.82 1xck s ASN 487 Cb 0.00 -2.55 0.35 0.00 -0.55 0.00 0.00 41.25 38.51 1xck s ASN 487 CO 0.00 -1.04 1.75 0.24 -2.79 0.00 0.00 177.10 175.26 1xck h MET 488 N 8.61 0.46 -0.47 0.43 2.86 -1.06 -1.04 114.93 124.72 1xck h MET 488 Ca -0.22 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.38 1xck h MET 488 Cb 1.06 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.60 1xck h MET 488 CO 1.07 0.30 0.24 0.82 1.06 0.00 0.00 176.91 180.41 1xck h ILE 489 N 0.47 1.18 -0.65 -1.22 1.08 -1.76 -0.18 117.51 116.43 1xck h ILE 489 Ca 0.35 -0.48 -0.03 0.00 -0.39 0.00 0.00 64.86 64.31 1xck h ILE 489 Cb 0.46 0.63 -0.03 0.00 -3.07 0.00 0.00 36.82 34.81 1xck h ILE 489 CO -0.33 0.19 0.28 0.44 -0.69 0.00 0.00 178.15 178.04 1xck h ASP 490 N 0.62 0.86 0.00 1.72 3.32 -1.79 -0.63 116.42 120.53 1xck h ASP 490 Ca 0.16 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1xck h ASP 490 Cb 0.09 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.42 1xck h ASP 490 CO -0.02 0.76 0.00 0.23 -1.72 0.00 0.00 179.24 178.49 1xck n MET 491 N -4.32 0.92 -1.85 3.56 2.81 -0.45 -4.87 117.12 112.92 1xck n MET 491 Ca 0.06 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.84 1xck n MET 491 Cb 0.16 -1.22 -0.02 0.00 -0.71 0.00 0.00 33.22 31.43 1xck n MET 491 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xck n GLY 492 N 0.60 0.45 3.06 3.03 0.00 -0.24 -4.98 105.19 107.11 1xck n GLY 492 Ca 0.10 -0.46 -0.35 0.00 0.00 0.00 0.00 46.02 45.31 1xck n GLY 492 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xck s ILE 493 N -2.50 3.44 0.29 -0.61 1.01 -0.12 -5.00 121.20 117.70 1xck s ILE 493 Ca 0.00 -3.02 0.02 0.00 0.00 0.00 0.00 60.65 57.66 1xck s ILE 493 Cb 0.00 -3.27 -0.05 0.00 0.01 0.00 0.00 42.46 39.15 1xck s ILE 493 CO 0.00 -0.85 0.12 -1.48 0.00 0.00 0.00 174.94 172.73 1xck s LEU 494 N -0.08 1.69 0.01 2.97 0.05 -1.26 -0.37 118.68 121.68 1xck s LEU 494 Ca 0.17 -1.46 0.00 0.00 0.05 0.00 0.00 54.13 52.88 1xck s LEU 494 Cb -0.21 0.06 -0.01 0.00 -2.05 0.00 0.00 46.19 43.98 1xck s LEU 494 CO -0.03 -0.79 -0.01 -1.81 -0.55 0.00 0.00 176.35 173.16 1xck s ASP 495 N -3.36 0.10 0.15 1.48 1.01 -0.42 -4.52 116.67 111.11 1xck s ASP 495 Ca 0.36 -0.13 -0.31 0.00 0.71 0.00 0.00 52.55 53.17 1xck s ASP 495 Cb 0.07 0.02 -0.10 0.00 1.01 0.00 0.00 42.92 43.91 1xck s ASP 495 CO 0.15 -0.07 1.68 -2.84 0.21 0.00 0.00 175.17 174.30 1xck s PRO 496 N -0.38 4.17 0.51 8.23 0.02 -1.26 -1.55 135.00 144.74 1xck s PRO 496 Ca -0.04 2.47 0.37 0.00 0.02 0.00 0.00 61.00 63.82 1xck s PRO 496 Cb -0.03 -3.31 1.53 0.00 0.02 0.00 0.00 34.50 32.71 1xck s PRO 496 CO -0.00 -0.72 1.72 1.15 -0.33 0.00 0.00 177.00 178.81 1xck h THR 497 N 4.25 0.28 -0.59 0.99 2.02 -1.26 0.33 112.91 118.94 1xck h THR 497 Ca -0.43 -0.02 -0.06 0.00 0.77 0.00 0.00 66.41 66.66 1xck h THR 497 Cb 1.21 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 1xck h THR 497 CO 0.94 0.01 0.12 0.50 0.37 0.00 0.00 175.52 177.46 1xck h LYS 498 N 0.06 0.92 -0.22 6.66 3.64 -1.81 -1.22 116.57 124.60 1xck h LYS 498 Ca 0.70 -0.21 -0.18 0.00 -1.27 0.00 0.00 60.65 59.69 1xck h LYS 498 Cb 2.60 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 34.29 1xck h LYS 498 CO -0.10 0.83 -0.57 -0.39 -2.27 0.00 0.00 179.45 176.95 1xck h VAL 499 N 0.88 1.29 -0.14 2.00 -1.51 -0.66 -0.99 116.25 117.12 1xck h VAL 499 Ca 0.19 -1.77 -0.01 0.00 -1.23 0.00 0.00 66.70 63.87 1xck h VAL 499 Cb 0.34 1.81 -0.01 0.00 -2.13 0.00 0.00 31.29 31.31 1xck h VAL 499 CO 0.00 0.57 0.05 0.74 -1.23 0.00 0.00 177.57 177.70 1xck h THR 500 N 0.51 1.17 -0.31 7.19 2.02 -1.44 0.50 112.91 122.54 1xck h THR 500 Ca -0.01 -0.52 0.04 0.00 0.77 0.00 0.00 66.41 66.69 1xck h THR 500 Cb 1.18 1.25 -0.04 0.00 -1.74 0.00 0.00 68.15 68.80 1xck h THR 500 CO 0.12 0.16 0.09 -0.09 0.37 0.00 0.00 175.52 176.17 1xck h ARG 501 N 0.06 0.20 0.04 6.66 2.43 -1.21 -1.67 114.38 120.90 1xck h ARG 501 Ca 0.05 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1xck h ARG 501 Cb 0.20 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1xck h ARG 501 CO -0.00 0.13 -0.02 0.77 -1.51 0.00 0.00 179.97 179.34 1xck h SER 502 N 0.21 -0.05 -0.34 -3.80 0.02 -1.02 -0.96 113.55 107.61 1xck h SER 502 Ca 0.14 -0.02 0.07 0.00 -0.84 0.00 0.00 61.79 61.15 1xck h SER 502 Cb 0.14 0.01 -0.07 0.00 0.14 0.00 0.00 62.40 62.62 1xck h SER 502 CO -0.17 -0.02 -0.11 0.00 -1.14 0.00 0.00 176.83 175.39 1xck h ALA 503 N 0.88 0.19 0.47 3.77 0.00 -0.67 0.53 119.26 124.42 1xck h ALA 503 Ca -0.01 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1xck h ALA 503 Cb 0.06 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1xck h ALA 503 CO 0.01 -0.48 -0.22 1.25 0.00 0.00 0.00 179.25 179.80 1xck h LEU 504 N -0.03 -0.53 -0.56 0.00 5.85 -1.16 -0.61 115.31 118.26 1xck h LEU 504 Ca 0.17 -0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.93 1xck h LEU 504 Cb 0.29 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1xck h LEU 504 CO -0.37 -0.32 0.26 1.56 -0.34 0.00 0.00 178.44 179.23 1xck h GLN 505 N -0.71 0.48 -0.52 1.25 4.20 -0.95 0.63 115.11 119.48 1xck h GLN 505 Ca -0.06 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.55 1xck h GLN 505 Cb 0.52 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 1xck h GLN 505 CO 0.11 0.32 0.05 1.88 -0.67 0.00 0.00 178.83 180.51 1xck h TYR 506 N 0.49 0.96 0.48 2.96 0.05 -0.84 -0.11 116.97 120.96 1xck h TYR 506 Ca 0.26 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.87 1xck h TYR 506 Cb 0.22 -0.26 0.00 0.00 1.01 0.00 0.00 36.73 37.71 1xck h TYR 506 CO -0.12 0.87 -0.23 0.00 -1.05 0.00 0.00 178.16 177.63 1xck h ALA 507 N 0.97 -0.65 -0.69 3.88 0.00 -0.67 -2.18 119.26 119.92 1xck h ALA 507 Ca 0.16 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 507 Cb 0.45 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1xck h ALA 507 CO 0.02 -0.86 0.46 0.00 0.00 0.00 0.00 179.25 178.87 1xck h ALA 508 N -0.13 2.04 0.69 0.00 0.00 -0.79 -0.92 119.26 120.15 1xck h ALA 508 Ca -0.07 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1xck h ALA 508 Cb 0.50 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.22 1xck h ALA 508 CO 0.11 -0.20 -0.33 1.03 0.00 0.00 0.00 179.25 179.85 1xck h SER 509 N 0.45 -0.79 -0.41 0.00 0.87 -0.41 -0.20 113.55 113.06 1xck h SER 509 Ca 0.33 -0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.81 1xck h SER 509 Cb 0.67 0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.82 1xck h SER 509 CO -0.10 -0.48 -0.00 1.62 -0.53 0.00 0.00 176.83 177.34 1xck h VAL 510 N -1.07 1.24 -0.75 2.23 3.04 -1.18 -2.25 116.25 117.51 1xck h VAL 510 Ca -0.10 -1.01 -0.02 0.00 -1.01 0.00 0.00 66.70 64.56 1xck h VAL 510 Cb 0.74 0.88 -0.03 0.00 -2.01 0.00 0.00 31.29 30.86 1xck h VAL 510 CO 0.16 0.36 0.39 0.00 -1.01 0.00 0.00 177.57 177.47 1xck h ALA 511 N 1.24 0.96 -0.79 3.17 0.00 -1.16 -1.44 119.26 121.26 1xck h ALA 511 Ca 0.15 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1xck h ALA 511 Cb 0.46 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1xck h ALA 511 CO 0.02 0.49 0.36 0.78 0.00 0.00 0.00 179.25 180.90 1xck h GLY 512 N 1.04 1.23 0.94 0.00 0.00 -0.68 -1.87 103.07 103.72 1xck h GLY 512 Ca 0.26 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 1xck h GLY 512 CO -0.04 0.59 0.16 1.41 0.00 0.00 0.00 176.54 178.66 1xck h LEU 513 N 1.12 0.44 -0.40 3.11 3.38 -0.81 -2.69 115.31 119.46 1xck h LEU 513 Ca 0.27 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1xck h LEU 513 Cb 0.14 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1xck h LEU 513 CO -0.03 0.45 0.17 0.24 0.09 0.00 0.00 178.44 179.36 1xck h MET 514 N 0.41 0.60 -0.21 1.13 2.86 -1.10 -2.18 114.93 116.43 1xck h MET 514 Ca 0.12 -0.11 0.06 0.00 -2.06 0.00 0.00 59.70 57.71 1xck h MET 514 Cb 0.13 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1xck h MET 514 CO -0.01 0.56 0.15 0.82 1.06 0.00 0.00 176.91 179.49 1xck h ILE 515 N 0.51 0.87 -0.89 -1.22 2.04 -1.27 -0.82 117.51 116.73 1xck h ILE 515 Ca 0.13 0.00 -0.44 0.00 1.00 0.00 0.00 64.86 65.56 1xck h ILE 515 Cb 0.18 0.89 -0.26 0.00 -0.74 0.00 0.00 36.82 36.89 1xck h ILE 515 CO -0.01 0.00 0.52 0.35 0.00 0.00 0.00 178.15 179.01 1xck n THR 516 N -4.43 3.09 -3.99 -0.27 -2.24 -0.84 -4.82 114.28 100.79 1xck n THR 516 Ca 0.02 -1.98 -0.35 0.00 -2.27 0.00 0.00 64.05 59.47 1xck n THR 516 Cb 0.29 -0.44 -0.09 0.00 -2.10 0.00 0.00 70.33 68.00 1xck n THR 516 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1xck s THR 517 N -3.25 4.91 -0.04 4.28 2.01 -0.31 -4.97 115.64 118.26 1xck s THR 517 Ca 0.55 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.62 1xck s THR 517 Cb 0.47 -3.20 -0.09 0.00 0.01 0.00 0.00 72.50 69.69 1xck s THR 517 CO 0.10 0.49 0.14 -0.62 -0.69 0.00 0.00 174.62 174.04 1xck n GLU 518 N 3.21 0.81 -3.84 4.92 -0.58 -1.26 -4.81 120.64 119.08 1xck n GLU 518 Ca -0.17 -0.05 -0.12 0.00 -0.42 0.00 0.00 57.16 56.40 1xck n GLU 518 Cb 0.53 -1.09 -0.11 0.00 -0.57 0.00 0.00 31.44 30.19 1xck n GLU 518 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xck s MET 520 N -0.61 1.05 -0.12 0.00 -1.94 -0.35 -5.00 119.30 112.32 1xck s MET 520 Ca -0.07 -0.24 0.03 0.00 -1.71 0.00 0.00 55.69 53.70 1xck s MET 520 Cb -0.04 -0.97 0.01 0.00 2.01 0.00 0.00 34.83 35.84 1xck s MET 520 CO 0.01 0.01 -0.20 0.08 -0.01 0.00 0.00 175.02 174.91 1xck s VAL 521 N 0.60 1.86 0.25 -6.03 1.01 -1.26 -1.23 120.40 115.59 1xck s VAL 521 Ca -0.09 -0.87 -0.05 0.00 0.00 0.00 0.00 61.98 60.97 1xck s VAL 521 Cb -0.13 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 1xck s VAL 521 CO 0.01 0.51 0.31 0.28 0.00 0.00 0.00 175.10 176.22 1xck s THR 522 N 0.75 0.00 0.72 3.92 -1.32 -0.90 -4.98 115.64 113.83 1xck s THR 522 Ca -0.10 -1.74 -0.11 0.00 -1.21 0.00 0.00 61.69 58.53 1xck s THR 522 Cb -0.16 -2.42 0.02 0.00 -1.51 0.00 0.00 72.50 68.43 1xck s THR 522 CO 0.01 0.00 1.07 -1.81 -2.21 0.00 0.00 174.62 171.68 1xck s ASP 523 N -3.14 5.19 0.05 8.08 1.11 -1.26 -0.21 116.67 126.49 1xck s ASP 523 Ca 0.32 1.51 -0.30 0.00 0.18 0.00 0.00 52.55 54.26 1xck s ASP 523 Cb 0.03 -2.35 -0.04 0.00 1.07 0.00 0.00 42.92 41.62 1xck s ASP 523 CO 0.14 -1.55 1.00 -0.22 1.18 0.00 0.00 175.17 175.71 1xck s LEU 524 N -5.58 4.42 0.00 1.23 2.96 -1.19 -4.48 118.68 116.04 1xck s LEU 524 Ca 0.59 1.76 0.00 0.00 -0.22 0.00 0.00 54.13 56.25 1xck s LEU 524 Cb -0.14 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.97 1xck s LEU 524 CO 0.55 -0.21 0.21 -0.81 -1.32 0.00 0.00 176.35 174.77