#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 0.80 -2.33 0.00 0.00 -1.26 -4.94 120.51 112.78 1xck n ALA 3 Ca 0.00 0.43 -0.21 0.00 0.00 0.00 0.00 53.44 53.67 1xck n ALA 3 Cb 0.00 -2.25 -0.03 0.00 0.00 0.00 0.00 19.45 17.17 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 -0.04 2.63 -0.22 0.00 -0.14 -1.26 -3.04 119.74 117.67 1xck s LYS 4 Ca 0.72 -1.42 0.01 0.00 -1.36 0.00 0.00 55.97 53.92 1xck s LYS 4 Cb -0.70 -2.44 0.04 0.00 -1.68 0.00 0.00 37.83 33.05 1xck s LYS 4 CO 0.47 -0.08 -0.15 0.34 -0.76 0.00 0.00 175.35 175.17 1xck s ASP 5 N -4.09 3.77 -0.15 2.83 -1.08 0.18 -4.74 116.67 113.40 1xck s ASP 5 Ca 0.45 -0.95 -0.03 0.00 -0.52 0.00 0.00 52.55 51.51 1xck s ASP 5 Cb -0.05 -1.53 -0.02 0.00 -1.46 0.00 0.00 42.92 39.86 1xck s ASP 5 CO 0.28 -0.09 -0.06 -0.69 0.52 0.00 0.00 175.17 175.13 1xck s VAL 6 N 1.23 3.66 0.05 1.11 1.01 -1.26 -2.12 120.40 124.08 1xck s VAL 6 Ca -0.01 -0.44 0.09 0.00 0.00 0.00 0.00 61.98 61.62 1xck s VAL 6 Cb -0.16 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1xck s VAL 6 CO -0.09 0.50 -0.25 -0.54 0.00 0.00 0.00 175.10 174.72 1xck s LYS 7 N 0.33 1.71 0.34 2.72 1.02 -0.42 -4.98 119.74 120.47 1xck s LYS 7 Ca -0.06 -1.09 0.09 0.00 0.02 0.00 0.00 55.97 54.93 1xck s LYS 7 Cb -0.15 -1.89 -0.06 0.00 -0.52 0.00 0.00 37.83 35.21 1xck s LYS 7 CO 0.04 0.49 -0.09 -0.06 -0.92 0.00 0.00 175.35 174.80 1xck s PHE 8 N -0.81 2.39 0.00 3.18 0.08 -1.26 -0.89 117.98 120.66 1xck s PHE 8 Ca 0.11 -0.51 0.00 0.00 0.12 0.00 0.00 56.93 56.65 1xck s PHE 8 Cb -0.10 -1.37 0.00 0.00 -0.57 0.00 0.00 43.02 40.98 1xck s PHE 8 CO 0.02 0.57 0.00 0.41 -0.10 0.00 0.00 175.22 176.13 1xck n GLY 9 N -0.79 1.08 0.30 4.36 0.00 0.13 -2.13 105.19 108.15 1xck n GLY 9 Ca -0.05 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.01 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 0.30 -0.94 1.61 -0.73 -1.93 0.25 115.58 114.15 1xck h ASN 10 Ca 0.00 0.14 0.07 0.00 1.87 0.00 0.00 56.30 58.38 1xck h ASN 10 Cb 0.00 0.12 -0.06 0.00 0.27 0.00 0.00 38.32 38.65 1xck h ASN 10 CO 0.00 0.04 0.61 -0.78 -0.37 0.00 0.00 177.43 176.93 1xck h ASP 11 N 0.42 0.93 -0.11 1.15 3.58 -1.88 -0.90 116.42 119.61 1xck h ASP 11 Ca 0.50 0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.90 1xck h ASP 11 Cb 0.88 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.74 1xck h ASP 11 CO -0.48 0.59 -0.18 0.00 -2.88 0.00 0.00 179.24 176.28 1xck h ALA 12 N 1.50 0.18 -0.73 -0.78 0.00 -0.45 -3.22 119.26 115.76 1xck h ALA 12 Ca 0.41 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1xck h ALA 12 Cb 0.23 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1xck h ALA 12 CO -0.16 0.10 0.40 0.00 0.00 0.00 0.00 179.25 179.58 1xck h ARG 13 N -0.10 1.01 -0.69 0.00 3.08 -0.67 -1.95 114.38 115.07 1xck h ARG 13 Ca 0.01 -0.11 -0.07 0.00 0.07 0.00 0.00 59.98 59.87 1xck h ARG 13 Cb 0.75 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1xck h ARG 13 CO 0.04 0.74 0.14 -0.39 -1.07 0.00 0.00 179.97 179.44 1xck h VAL 14 N 1.02 1.26 -0.29 2.04 -1.51 -1.26 -1.14 116.25 116.38 1xck h VAL 14 Ca 0.26 -1.00 0.05 0.00 -1.23 0.00 0.00 66.70 64.77 1xck h VAL 14 Cb 0.03 0.59 -0.04 0.00 -2.13 0.00 0.00 31.29 29.73 1xck h VAL 14 CO -0.04 0.38 0.00 0.11 -1.23 0.00 0.00 177.57 176.80 1xck h LYS 15 N 1.05 0.09 0.24 5.19 1.79 -1.42 0.21 116.57 123.72 1xck h LYS 15 Ca 0.21 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.67 1xck h LYS 15 Cb 0.41 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1xck h LYS 15 CO 0.01 0.06 -0.16 0.52 -1.08 0.00 0.00 179.45 178.80 1xck h MET 16 N 0.09 -0.38 -0.18 3.15 2.86 -1.03 -1.44 114.93 118.00 1xck h MET 16 Ca 0.14 0.03 0.05 0.00 -2.06 0.00 0.00 59.70 57.85 1xck h MET 16 Cb 0.18 0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.86 1xck h MET 16 CO -0.23 -0.25 -0.22 1.25 1.06 0.00 0.00 176.91 178.52 1xck h LEU 17 N -0.40 -0.68 -0.95 1.22 5.85 -0.84 0.53 115.31 120.04 1xck h LEU 17 Ca -0.02 0.12 0.21 0.00 0.84 0.00 0.00 57.88 59.03 1xck h LEU 17 Cb 0.34 0.32 -0.12 0.00 0.37 0.00 0.00 40.66 41.57 1xck h LEU 17 CO 0.01 -0.26 0.52 -0.09 -0.34 0.00 0.00 178.44 178.28 1xck h ARG 18 N -0.25 0.56 -0.24 1.25 9.65 -0.42 0.13 114.38 125.06 1xck h ARG 18 Ca 0.12 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.88 1xck h ARG 18 Cb 0.43 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.87 1xck h ARG 18 CO -0.32 0.37 -0.18 0.78 2.80 0.00 0.00 179.97 183.42 1xck h GLY 19 N 0.57 0.60 2.00 2.80 0.00 0.13 -2.93 103.07 106.25 1xck h GLY 19 Ca 0.58 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1xck h GLY 19 CO -0.45 0.52 -0.15 -0.39 0.00 0.00 0.00 176.54 176.07 1xck h VAL 20 N 0.26 0.35 -0.43 4.60 -1.51 0.17 -2.78 116.25 116.91 1xck h VAL 20 Ca 0.05 -0.96 -0.12 0.00 -1.23 0.00 0.00 66.70 64.44 1xck h VAL 20 Cb 0.71 1.73 -0.01 0.00 -2.13 0.00 0.00 31.29 31.58 1xck h VAL 20 CO 0.05 0.15 -0.20 0.78 -1.23 0.00 0.00 177.57 177.11 1xck h ASN 21 N 0.00 0.87 -0.26 4.19 2.35 -0.67 0.41 115.58 122.47 1xck h ASN 21 Ca -0.00 -0.31 -0.02 0.00 -0.55 0.00 0.00 56.30 55.41 1xck h ASN 21 Cb 0.72 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 1xck h ASN 21 CO 0.02 1.05 0.07 0.58 -1.65 0.00 0.00 177.43 177.50 1xck h VAL 22 N 0.75 1.21 0.30 2.81 2.07 -1.32 0.20 116.25 122.26 1xck h VAL 22 Ca 0.10 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1xck h VAL 22 Cb 0.73 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1xck h VAL 22 CO 0.06 0.22 -0.14 0.25 0.02 0.00 0.00 177.57 177.97 1xck h LEU 23 N 0.25 -0.34 -0.34 2.57 5.85 -1.32 -1.66 115.31 120.33 1xck h LEU 23 Ca 0.08 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1xck h LEU 23 Cb 0.26 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1xck h LEU 23 CO -0.00 -0.20 0.15 0.00 -0.34 0.00 0.00 178.44 178.06 1xck h ALA 24 N 0.24 0.44 -0.42 1.25 0.00 -0.13 -1.61 119.26 119.03 1xck h ALA 24 Ca -0.04 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1xck h ALA 24 Cb 0.34 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1xck h ALA 24 CO 0.07 0.01 0.15 -0.44 0.00 0.00 0.00 179.25 179.03 1xck h ASP 25 N 0.40 0.54 -0.26 0.00 3.32 -0.58 0.19 116.42 120.03 1xck h ASP 25 Ca 0.11 -0.06 -0.18 0.00 0.02 0.00 0.00 57.03 56.93 1xck h ASP 25 Cb 0.14 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1xck h ASP 25 CO -0.01 0.51 -0.51 0.00 -1.72 0.00 0.00 179.24 177.51 1xck h ALA 26 N 1.57 0.53 0.24 3.45 0.00 -1.06 -3.33 119.26 120.67 1xck h ALA 26 Ca 0.14 -0.50 -0.34 0.00 0.00 0.00 0.00 54.91 54.21 1xck h ALA 26 Cb 0.15 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.89 1xck h ALA 26 CO -0.01 0.68 -1.53 0.28 0.00 0.00 0.00 179.25 178.67 1xck h VAL 27 N 0.66 1.21 0.00 0.00 2.07 -0.83 -3.36 116.25 116.00 1xck h VAL 27 Ca 0.03 -2.66 0.00 0.00 0.82 0.00 0.00 66.70 64.89 1xck h VAL 27 Cb 1.10 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 33.86 1xck h VAL 27 CO 0.11 0.82 0.00 0.07 0.02 0.00 0.00 177.57 178.59 1xck h LYS 28 N 0.13 0.00 0.00 1.57 2.10 -0.76 -2.67 116.57 116.94 1xck h LYS 28 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 1xck h LYS 28 Cb 2.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.48 1xck h LYS 28 CO 0.26 0.00 0.00 1.33 -2.00 0.00 0.00 179.45 179.04 1xck n VAL 29 N -2.52 0.90 0.08 0.07 0.24 -1.25 -2.35 118.33 113.50 1xck n VAL 29 Ca 0.01 0.22 0.11 0.00 -2.04 0.00 0.00 64.34 62.64 1xck n VAL 29 Cb 0.19 -0.98 -0.09 0.00 -1.47 0.00 0.00 33.84 31.48 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 -1.43 0.25 0.00 3.34 -2.24 -1.00 0.20 114.28 113.40 1xck n THR 30 Ca 0.04 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1xck n THR 30 Cb 0.15 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 1xck n THR 30 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1xck n LEU 31 N -2.40 0.00 0.00 3.22 7.94 -0.99 -4.00 117.00 120.77 1xck n LEU 31 Ca -0.02 0.24 0.00 0.00 -1.11 0.00 0.00 56.01 55.12 1xck n LEU 31 Cb 0.55 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.50 1xck n LEU 31 CO 0.43 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.32 1xck n GLY 32 N -0.60 -3.28 0.15 -3.96 0.00 -1.26 -4.72 105.19 91.52 1xck n GLY 32 Ca 0.00 -1.25 0.15 0.00 0.00 0.00 0.00 46.02 44.92 1xck n GLY 32 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1xck n PRO 33 N -0.77 1.17 -0.51 1.61 -0.04 -1.26 -2.63 135.00 132.58 1xck n PRO 33 Ca 0.00 -0.30 0.05 0.00 -0.04 0.00 0.00 63.50 63.21 1xck n PRO 33 Cb 0.00 -1.49 0.19 0.00 -0.04 0.00 0.00 33.50 32.16 1xck n PRO 33 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1xck n LYS 34 N -0.65 1.63 -1.82 0.54 4.76 -1.26 -5.01 118.16 116.35 1xck n LYS 34 Ca 0.22 -3.10 -0.38 0.00 -2.87 0.00 0.00 58.31 52.18 1xck n LYS 34 Cb 0.19 -1.64 0.04 0.00 -1.84 0.00 0.00 35.03 31.79 1xck n LYS 34 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1xck s GLY 35 N -2.97 2.87 0.73 0.72 0.00 -1.08 -4.61 107.32 102.97 1xck s GLY 35 Ca 0.38 1.27 -0.06 0.00 0.00 0.00 0.00 44.72 46.31 1xck s GLY 35 CO -0.03 1.76 1.02 0.50 0.00 0.00 0.00 173.10 176.36 1xck s ARG 36 N -2.99 1.90 0.09 2.90 1.81 0.13 -4.92 118.95 117.87 1xck s ARG 36 Ca 0.73 -0.54 -0.09 0.00 -1.72 0.00 0.00 55.73 54.11 1xck s ARG 36 Cb -0.39 -2.20 -0.06 0.00 -0.45 0.00 0.00 34.95 31.86 1xck s ARG 36 CO 0.45 -1.39 0.40 -0.80 -0.68 0.00 0.00 175.30 173.28 1xck s ASN 37 N -4.61 6.62 -0.08 0.23 0.02 -1.26 -4.44 114.94 111.43 1xck s ASN 37 Ca 0.63 0.77 0.05 0.00 -1.02 0.00 0.00 52.86 53.29 1xck s ASN 37 Cb -0.08 -2.17 -0.00 0.00 0.02 0.00 0.00 41.25 39.02 1xck s ASN 37 CO 0.45 0.15 -0.23 -0.69 0.02 0.00 0.00 177.10 176.81 1xck s VAL 38 N -1.44 1.90 -0.29 1.60 1.01 0.62 -4.94 120.40 118.86 1xck s VAL 38 Ca 0.34 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 61.26 1xck s VAL 38 Cb -0.14 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 1xck s VAL 38 CO 0.19 0.53 0.18 -0.69 0.00 0.00 0.00 175.10 175.31 1xck s VAL 39 N 0.16 5.12 -0.27 2.92 1.01 -1.26 -1.27 120.40 126.81 1xck s VAL 39 Ca -0.12 0.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.81 1xck s VAL 39 Cb -0.16 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.73 1xck s VAL 39 CO 0.06 0.21 0.09 -0.76 0.00 0.00 0.00 175.10 174.70 1xck s LEU 40 N 1.72 3.67 0.24 3.92 1.43 0.88 -4.92 118.68 125.62 1xck s LEU 40 Ca 0.07 -0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 52.48 1xck s LEU 40 Cb -0.16 -1.93 -0.09 0.00 0.03 0.00 0.00 46.19 44.04 1xck s LEU 40 CO 0.10 -0.11 1.06 -0.62 0.23 0.00 0.00 176.35 177.01 1xck s ASP 41 N 1.59 7.35 -0.06 2.29 2.15 -1.26 -0.46 116.67 128.26 1xck s ASP 41 Ca 0.05 2.14 0.06 0.00 0.43 0.00 0.00 52.55 55.23 1xck s ASP 41 Cb -0.16 -2.62 -0.01 0.00 -0.30 0.00 0.00 42.92 39.83 1xck s ASP 41 CO 0.04 -0.10 -0.25 -0.54 -0.17 0.00 0.00 175.17 174.15 1xck s LYS 42 N -1.03 2.58 0.47 4.34 1.02 -1.26 -4.93 119.74 120.92 1xck s LYS 42 Ca 0.45 -0.90 0.21 0.00 0.02 0.00 0.00 55.97 55.75 1xck s LYS 42 Cb -0.30 -2.17 1.22 0.00 -0.52 0.00 0.00 37.83 36.06 1xck s LYS 42 CO 0.37 0.37 1.92 0.66 -0.92 0.00 0.00 175.35 177.75 1xck h SER 43 N 6.10 0.23 -3.62 2.83 4.64 -1.96 -3.39 113.55 118.38 1xck h SER 43 Ca -0.31 0.02 -0.65 0.00 -0.47 0.00 0.00 61.79 60.38 1xck h SER 43 Cb 1.18 -0.03 -0.22 0.00 -0.31 0.00 0.00 62.40 63.02 1xck h SER 43 CO 0.47 0.11 -0.62 -0.36 -0.87 0.00 0.00 176.83 175.55 1xck s PHE 44 N -5.24 3.09 0.00 4.77 0.08 -1.26 -5.03 117.98 114.39 1xck s PHE 44 Ca -0.07 -0.40 0.00 0.00 0.12 0.00 0.00 56.93 56.58 1xck s PHE 44 Cb 0.21 -2.23 0.00 0.00 -0.57 0.00 0.00 43.02 40.44 1xck s PHE 44 CO 0.76 -0.33 0.00 0.41 -0.10 0.00 0.00 175.22 175.96 1xck n GLY 45 N 4.84 -0.13 3.86 4.36 0.00 -1.26 -4.90 105.19 111.95 1xck n GLY 45 Ca -0.16 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.38 3.37 1.07 4.61 0.00 -1.26 -4.86 121.76 123.30 1xck s ALA 46 Ca 0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 51.96 51.77 1xck s ALA 46 Cb 0.00 -2.70 0.23 0.00 0.00 0.00 0.00 23.12 20.65 1xck s ALA 46 CO 0.00 0.28 1.06 -2.14 0.00 0.00 0.00 175.76 174.96 1xck s PRO 47 N -3.17 -0.17 -0.18 0.00 0.02 -1.26 -4.64 135.00 125.59 1xck s PRO 47 Ca 0.52 0.75 -0.07 0.00 0.02 0.00 0.00 61.00 62.22 1xck s PRO 47 Cb -0.10 -1.65 -0.04 0.00 0.02 0.00 0.00 34.50 32.73 1xck s PRO 47 CO 0.21 -3.20 0.06 0.99 -0.33 0.00 0.00 177.00 174.73 1xck s THR 48 N -2.70 4.72 -0.17 0.99 2.01 0.39 -4.94 115.64 115.94 1xck s THR 48 Ca 0.67 -0.06 -0.06 0.00 0.31 0.00 0.00 61.69 62.55 1xck s THR 48 Cb -0.22 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 1xck s THR 48 CO 0.61 0.46 0.03 -0.63 -0.69 0.00 0.00 174.62 174.40 1xck s ILE 49 N 0.41 4.51 0.10 1.82 1.01 -1.26 -0.08 121.20 127.71 1xck s ILE 49 Ca 0.03 -0.14 -0.09 0.00 0.00 0.00 0.00 60.65 60.45 1xck s ILE 49 Cb -0.13 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.33 1xck s ILE 49 CO 0.00 0.48 0.22 0.28 0.00 0.00 0.00 174.94 175.92 1xck s THR 50 N 0.30 0.13 -0.03 2.92 -1.32 -0.40 -4.96 115.64 112.28 1xck s THR 50 Ca 0.01 -1.16 0.05 0.00 -1.21 0.00 0.00 61.69 59.38 1xck s THR 50 Cb -0.13 -1.40 0.08 0.00 -1.51 0.00 0.00 72.50 69.54 1xck s THR 50 CO 0.01 -0.57 0.97 0.29 -2.21 0.00 0.00 174.62 173.11 1xck n LYS 51 N -0.10 1.92 -3.04 7.08 5.02 -1.26 -0.28 118.16 127.51 1xck n LYS 51 Ca -0.14 -1.61 -0.43 0.00 -2.02 0.00 0.00 58.31 54.10 1xck n LYS 51 Cb 0.63 -1.03 -0.06 0.00 -0.02 0.00 0.00 35.03 34.55 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 -1.36 6.31 0.49 4.39 2.15 -1.26 -4.85 116.67 122.54 1xck s ASP 52 Ca 0.09 -0.49 0.20 0.00 0.43 0.00 0.00 52.55 52.78 1xck s ASP 52 Cb 0.07 -2.35 1.24 0.00 -0.30 0.00 0.00 42.92 41.59 1xck s ASP 52 CO 0.01 -0.94 2.00 1.23 -0.17 0.00 0.00 175.17 177.29 1xck h GLY 53 N 10.07 0.25 1.17 2.66 0.00 -1.94 -1.74 103.07 113.55 1xck h GLY 53 Ca -0.26 -0.07 -0.14 0.00 0.00 0.00 0.00 47.33 46.86 1xck h GLY 53 CO 0.97 0.04 -0.31 -2.08 0.00 0.00 0.00 176.54 175.16 1xck h VAL 54 N 0.17 1.27 -0.11 4.60 2.07 -1.96 -0.49 116.25 121.80 1xck h VAL 54 Ca 0.25 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 1xck h VAL 54 Cb 0.77 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1xck h VAL 54 CO -0.04 0.50 0.03 0.28 0.02 0.00 0.00 177.57 178.36 1xck h SER 55 N 0.78 0.16 -0.10 0.57 0.02 -1.76 -2.24 113.55 110.98 1xck h SER 55 Ca 0.08 -0.22 0.03 0.00 -0.84 0.00 0.00 61.79 60.84 1xck h SER 55 Cb 0.88 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.35 1xck h SER 55 CO 0.08 0.35 -0.07 0.58 -1.14 0.00 0.00 176.83 176.62 1xck h VAL 56 N -0.02 0.78 -0.87 2.27 2.07 -1.33 -2.63 116.25 116.52 1xck h VAL 56 Ca 0.03 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.63 1xck h VAL 56 Cb 0.24 0.78 -0.07 0.00 -1.52 0.00 0.00 31.29 30.72 1xck h VAL 56 CO 0.00 0.00 0.53 0.00 0.02 0.00 0.00 177.57 178.12 1xck h ALA 57 N 0.99 1.22 -0.97 1.67 0.00 -1.02 -1.85 119.26 119.31 1xck h ALA 57 Ca 0.06 0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.14 1xck h ALA 57 Cb 0.18 -0.20 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 1xck h ALA 57 CO -0.15 0.21 0.61 -0.09 0.00 0.00 0.00 179.25 179.84 1xck h ARG 58 N 0.92 0.75 0.00 0.00 2.43 -1.03 -1.85 114.38 115.60 1xck h ARG 58 Ca 0.40 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1xck h ARG 58 Cb 0.27 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1xck h ARG 58 CO -0.21 0.50 0.00 0.39 -1.51 0.00 0.00 179.97 179.14 1xck n GLU 59 N -4.64 0.15 -2.67 0.20 -0.58 -0.70 -4.85 120.64 107.55 1xck n GLU 59 Ca 0.20 0.17 -0.43 0.00 -0.42 0.00 0.00 57.16 56.68 1xck n GLU 59 Cb 0.50 -1.69 -0.02 0.00 -0.57 0.00 0.00 31.44 29.66 1xck n GLU 59 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1xck s ILE 60 N -3.08 4.64 -0.15 -3.67 -1.09 -0.70 -4.99 121.20 112.17 1xck s ILE 60 Ca 0.11 1.92 -0.07 0.00 -2.23 0.00 0.00 60.65 60.38 1xck s ILE 60 Cb 0.14 -4.33 0.06 0.00 -1.58 0.00 0.00 42.46 36.75 1xck s ILE 60 CO 0.53 -0.26 0.34 -0.70 -1.23 0.00 0.00 174.94 173.62 1xck s GLU 61 N 3.30 0.29 0.08 2.79 2.12 -1.26 -4.89 118.70 121.13 1xck s GLU 61 Ca 0.44 0.72 0.01 0.00 0.36 0.00 0.00 54.97 56.50 1xck s GLU 61 Cb -0.14 -0.02 -0.04 0.00 0.26 0.00 0.00 34.13 34.19 1xck s GLU 61 CO 0.09 -0.19 0.18 -0.51 -0.54 0.00 0.00 175.26 174.29 1xck s LEU 62 N 1.63 4.20 0.11 2.70 1.43 -1.26 -5.03 118.68 122.46 1xck s LEU 62 Ca -0.07 0.17 -0.13 0.00 -1.03 0.00 0.00 54.13 53.07 1xck s LEU 62 Cb -0.10 -2.81 -0.09 0.00 0.03 0.00 0.00 46.19 43.22 1xck s LEU 62 CO -0.11 0.15 1.40 -0.08 0.23 0.00 0.00 176.35 177.94 1xck h GLU 63 N 2.98 0.82 -6.37 1.70 4.81 -2.00 -3.42 114.58 113.09 1xck h GLU 63 Ca -0.46 -0.50 -0.54 0.00 -0.13 0.00 0.00 59.36 57.73 1xck h GLU 63 Cb 1.17 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1xck h GLU 63 CO 0.72 1.13 0.94 0.34 -0.73 0.00 0.00 179.01 181.42 1xck s ASP 64 N -6.82 6.73 0.23 1.04 -1.08 -1.26 -4.90 116.67 110.60 1xck s ASP 64 Ca -0.11 2.25 -0.07 0.00 -0.52 0.00 0.00 52.55 54.10 1xck s ASP 64 Cb 0.09 -2.56 0.32 0.00 -1.46 0.00 0.00 42.92 39.32 1xck s ASP 64 CO 0.87 -0.82 1.81 0.11 0.52 0.00 0.00 175.17 177.66 1xck h LYS 65 N 8.36 0.71 0.04 4.34 1.79 -1.94 0.05 116.57 129.92 1xck h LYS 65 Ca -0.39 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.03 1xck h LYS 65 Cb 1.18 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 1xck h LYS 65 CO 0.92 0.47 -0.02 0.74 -1.08 0.00 0.00 179.45 180.48 1xck h PHE 66 N 0.73 -0.05 -1.00 -1.35 0.04 -1.94 -1.83 116.94 111.55 1xck h PHE 66 Ca 0.35 -0.00 0.07 0.00 2.80 0.00 0.00 57.97 61.18 1xck h PHE 66 Cb 0.28 0.02 -0.07 0.00 2.20 0.00 0.00 35.95 38.38 1xck h PHE 66 CO -0.07 0.37 0.64 0.93 -0.60 0.00 0.00 178.31 179.58 1xck h GLU 67 N -0.48 1.13 -0.60 1.51 5.08 -1.64 -1.14 114.58 118.45 1xck h GLU 67 Ca -0.01 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1xck h GLU 67 Cb 0.44 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1xck h GLU 67 CO 0.01 0.75 0.25 -0.97 -1.00 0.00 0.00 179.01 178.05 1xck h ASN 68 N 1.16 0.78 -0.46 1.42 -1.24 -0.85 -1.74 115.58 114.65 1xck h ASN 68 Ca 0.43 -0.09 -0.04 0.00 0.71 0.00 0.00 56.30 57.31 1xck h ASN 68 Cb 0.17 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.00 1xck h ASN 68 CO -0.17 0.69 0.15 0.24 -1.29 0.00 0.00 177.43 177.05 1xck h MET 69 N 0.85 0.77 -0.28 6.67 2.86 -0.34 0.11 114.93 125.58 1xck h MET 69 Ca 0.20 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.67 1xck h MET 69 Cb 0.15 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1xck h MET 69 CO -0.02 0.68 0.02 0.78 1.06 0.00 0.00 176.91 179.43 1xck h GLY 70 N 0.92 0.51 0.87 8.32 0.00 -0.92 -1.70 103.07 111.07 1xck h GLY 70 Ca 0.17 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 1xck h GLY 70 CO -0.01 0.33 -0.03 0.00 0.00 0.00 0.00 176.54 176.84 1xck h ALA 71 N 0.85 -0.07 -0.39 3.60 0.00 -0.97 -2.90 119.26 119.37 1xck h ALA 71 Ca 0.08 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1xck h ALA 71 Cb 0.38 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1xck h ALA 71 CO 0.01 -0.47 0.26 1.96 0.00 0.00 0.00 179.25 181.01 1xck h GLN 72 N -0.21 0.41 0.06 0.00 1.08 -0.97 -0.82 115.11 114.67 1xck h GLN 72 Ca -0.01 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1xck h GLN 72 Cb 0.18 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 1xck h GLN 72 CO 0.01 0.27 -0.03 0.52 -0.95 0.00 0.00 178.83 178.65 1xck h MET 73 N 0.42 -0.08 -0.04 1.46 2.86 -1.11 -0.34 114.93 118.11 1xck h MET 73 Ca 0.16 0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.63 1xck h MET 73 Cb 0.11 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1xck h MET 73 CO -0.04 0.16 -0.73 -0.39 1.06 0.00 0.00 176.91 176.97 1xck h VAL 74 N -0.32 1.43 -0.59 -2.22 -1.51 -1.40 -2.90 116.25 108.74 1xck h VAL 74 Ca -0.01 -2.27 0.07 0.00 -1.23 0.00 0.00 66.70 63.26 1xck h VAL 74 Cb 0.28 2.21 -0.06 0.00 -2.13 0.00 0.00 31.29 31.59 1xck h VAL 74 CO 0.01 0.67 0.28 0.50 -1.23 0.00 0.00 177.57 177.80 1xck h LYS 75 N 0.16 0.50 -0.32 5.19 3.64 -1.07 0.24 116.57 124.91 1xck h LYS 75 Ca -0.03 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 1xck h LYS 75 Cb 1.30 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 1xck h LYS 75 CO 0.11 0.33 -0.04 1.49 -2.27 0.00 0.00 179.45 179.07 1xck h GLU 76 N 0.51 0.59 -0.28 1.90 4.81 -0.92 -2.48 114.58 118.70 1xck h GLU 76 Ca 0.28 -0.21 -0.15 0.00 -0.13 0.00 0.00 59.36 59.15 1xck h GLU 76 Cb 0.25 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 1xck h GLU 76 CO -0.22 0.75 -0.42 0.28 -0.73 0.00 0.00 179.01 178.66 1xck h VAL 77 N 0.37 1.29 -0.12 0.32 2.07 -1.28 -3.08 116.25 115.84 1xck h VAL 77 Ca 0.09 -1.61 -0.05 0.00 0.82 0.00 0.00 66.70 65.95 1xck h VAL 77 Cb 0.51 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1xck h VAL 77 CO 0.02 0.52 -0.14 0.00 0.02 0.00 0.00 177.57 177.99 1xck h ALA 78 N 0.68 1.55 -0.30 1.67 0.00 -0.57 -2.14 119.26 120.16 1xck h ALA 78 Ca 0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1xck h ALA 78 Cb 1.02 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1xck h ALA 78 CO 0.10 0.32 0.04 0.66 0.00 0.00 0.00 179.25 180.38 1xck h SER 79 N 0.17 0.40 -0.14 0.00 4.64 -1.35 -1.91 113.55 115.37 1xck h SER 79 Ca 0.04 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1xck h SER 79 Cb 0.36 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1xck h SER 79 CO 0.02 0.43 0.06 0.11 -0.87 0.00 0.00 176.83 176.58 1xck h LYS 80 N 0.43 0.27 -0.43 4.77 1.57 -1.37 -2.05 116.57 119.75 1xck h LYS 80 Ca 0.10 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1xck h LYS 80 Cb 0.22 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1xck h LYS 80 CO 0.00 0.24 0.28 0.00 -0.57 0.00 0.00 179.45 179.40 1xck h ALA 81 N 1.80 0.55 -0.52 3.86 0.00 -1.39 0.63 119.26 124.19 1xck h ALA 81 Ca 0.07 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1xck h ALA 81 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1xck h ALA 81 CO -0.00 0.02 0.13 -0.97 0.00 0.00 0.00 179.25 178.43 1xck h ASN 82 N 0.58 0.79 -0.51 0.00 -1.24 -1.47 -0.96 115.58 112.77 1xck h ASN 82 Ca 0.16 -0.23 0.01 0.00 0.71 0.00 0.00 56.30 56.95 1xck h ASN 82 Cb -0.04 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 38.78 1xck h ASN 82 CO -0.03 0.81 0.34 0.44 -1.29 0.00 0.00 177.43 177.70 1xck h ASP 83 N 0.72 0.58 -0.18 1.15 3.32 -0.97 0.74 116.42 121.79 1xck h ASP 83 Ca 0.16 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 1xck h ASP 83 Cb 0.33 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1xck h ASP 83 CO 0.00 0.42 -0.11 0.00 -1.72 0.00 0.00 179.24 177.83 1xck h ALA 84 N 1.19 0.26 0.00 3.45 0.00 -0.68 -3.38 119.26 120.10 1xck h ALA 84 Ca 0.19 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1xck h ALA 84 Cb -0.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1xck h ALA 84 CO -0.05 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1xck n ALA 85 N -2.40 2.22 -1.06 0.00 0.00 -0.38 -5.00 120.51 113.89 1xck n ALA 85 Ca -0.05 -0.77 -0.02 0.00 0.00 0.00 0.00 53.44 52.59 1xck n ALA 85 Cb 0.33 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.77 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 -0.27 0.55 3.57 0.00 0.00 0.26 -4.66 105.19 104.64 1xck n GLY 86 Ca 0.00 -0.41 0.03 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.45 -0.02 0.00 1.61 2.15 -1.23 -4.92 116.67 111.82 1xck s ASP 87 Ca 0.00 -0.03 0.00 0.00 0.43 0.00 0.00 52.55 52.95 1xck s ASP 87 Cb 0.00 0.04 0.00 0.00 -0.30 0.00 0.00 42.92 42.66 1xck s ASP 87 CO 0.00 -0.07 0.00 0.61 -0.17 0.00 0.00 175.17 175.54 1xck n GLY 88 N -0.48 0.51 0.19 2.66 0.00 -1.26 -3.72 105.19 103.09 1xck n GLY 88 Ca -0.09 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 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 0.72 -0.37 2.61 2.02 -1.89 0.33 112.91 116.33 1xck h THR 89 Ca 0.00 -0.05 0.05 0.00 0.77 0.00 0.00 66.41 67.18 1xck h THR 89 Cb 0.00 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 1xck h THR 89 CO 0.00 0.01 0.12 0.74 0.37 0.00 0.00 175.52 176.76 1xck h THR 90 N -0.42 0.88 0.05 3.16 2.02 -1.90 -0.72 112.91 115.97 1xck h THR 90 Ca -0.04 -0.09 0.03 0.00 0.77 0.00 0.00 66.41 67.07 1xck h THR 90 Cb 0.32 0.58 -0.04 0.00 -1.74 0.00 0.00 68.15 67.27 1xck h THR 90 CO 0.07 0.05 -0.28 0.74 0.37 0.00 0.00 175.52 176.47 1xck h THR 91 N 0.27 0.38 -1.01 3.16 2.02 -1.94 0.50 112.91 116.30 1xck h THR 91 Ca 0.17 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.53 1xck h THR 91 Cb 0.16 0.38 -0.10 0.00 -1.74 0.00 0.00 68.15 66.85 1xck h THR 91 CO -0.18 0.00 0.62 0.00 0.37 0.00 0.00 175.52 176.32 1xck h ALA 92 N 0.30 1.64 0.02 6.16 0.00 -0.56 0.20 119.26 127.02 1xck h ALA 92 Ca 0.05 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1xck h ALA 92 Cb 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1xck h ALA 92 CO -0.21 0.00 -0.01 1.15 0.00 0.00 0.00 179.25 180.19 1xck h THR 93 N 0.81 1.22 -0.06 0.00 2.02 0.09 0.13 112.91 117.11 1xck h THR 93 Ca 0.57 -0.71 -0.07 0.00 0.77 0.00 0.00 66.41 66.97 1xck h THR 93 Cb 0.83 1.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.92 1xck h THR 93 CO -0.36 0.18 -0.29 -0.37 0.37 0.00 0.00 175.52 175.05 1xck h VAL 94 N -0.33 1.23 -0.13 3.16 -1.51 0.30 -0.85 116.25 118.12 1xck h VAL 94 Ca -0.00 -1.11 -0.02 0.00 -1.23 0.00 0.00 66.70 64.34 1xck h VAL 94 Cb 0.32 1.51 -0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1xck h VAL 94 CO 0.00 0.33 0.01 -0.07 -1.23 0.00 0.00 177.57 176.61 1xck h LEU 95 N 0.10 0.22 -0.79 4.19 3.38 -0.54 -2.05 115.31 119.83 1xck h LEU 95 Ca 0.01 -0.29 0.07 0.00 0.09 0.00 0.00 57.88 57.77 1xck h LEU 95 Cb 0.57 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 1xck h LEU 95 CO 0.04 0.46 0.46 0.00 0.09 0.00 0.00 178.44 179.49 1xck h ALA 96 N 0.77 1.09 -0.43 1.53 0.00 -0.12 -0.09 119.26 122.02 1xck h ALA 96 Ca 0.04 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1xck h ALA 96 Cb 0.34 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1xck h ALA 96 CO 0.01 0.13 0.25 0.37 0.00 0.00 0.00 179.25 180.01 1xck h GLN 97 N 0.81 0.59 -0.23 0.00 4.15 -1.02 -0.23 115.11 119.17 1xck h GLN 97 Ca 0.36 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.72 1xck h GLN 97 Cb 0.26 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 1xck h GLN 97 CO -0.21 0.45 0.13 0.00 -1.93 0.00 0.00 178.83 177.27 1xck h ALA 98 N 1.11 0.29 -0.21 3.38 0.00 -0.58 -0.90 119.26 122.35 1xck h ALA 98 Ca 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1xck h ALA 98 Cb 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1xck h ALA 98 CO -0.03 -0.19 0.05 0.82 0.00 0.00 0.00 179.25 179.90 1xck h ILE 99 N 0.27 1.21 -0.60 0.00 2.04 -0.87 -2.92 117.51 116.63 1xck h ILE 99 Ca 0.08 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 1xck h ILE 99 Cb 0.05 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 1xck h ILE 99 CO -0.01 0.21 0.36 0.40 0.00 0.00 0.00 178.15 179.10 1xck h ILE 100 N 0.15 1.18 0.62 -0.67 2.04 -0.94 0.74 117.51 120.62 1xck h ILE 100 Ca 0.06 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 1xck h ILE 100 Cb 0.27 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1xck h ILE 100 CO 0.00 0.18 -0.38 0.74 0.00 0.00 0.00 178.15 178.69 1xck h THR 101 N 0.81 0.23 -0.42 -0.27 2.02 -1.14 0.19 112.91 114.33 1xck h THR 101 Ca 0.21 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.29 1xck h THR 101 Cb -0.02 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.60 1xck h THR 101 CO -0.04 0.00 -0.16 -0.33 0.37 0.00 0.00 175.52 175.36 1xck h GLU 102 N -0.94 0.79 -0.50 6.66 4.39 -1.51 -2.43 114.58 121.04 1xck h GLU 102 Ca -0.08 -0.29 0.03 0.00 0.34 0.00 0.00 59.36 59.37 1xck h GLU 102 Cb 0.76 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.32 1xck h GLU 102 CO 0.08 0.90 0.27 0.78 -1.16 0.00 0.00 179.01 179.88 1xck h GLY 103 N 0.97 0.70 1.37 -3.84 0.00 -0.68 -1.20 103.07 100.39 1xck h GLY 103 Ca 0.11 -0.19 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 1xck h GLY 103 CO 0.05 0.15 -0.12 1.41 0.00 0.00 0.00 176.54 178.02 1xck h LEU 104 N 0.53 0.73 -0.32 3.11 3.38 -0.82 -1.55 115.31 120.38 1xck h LEU 104 Ca 0.21 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1xck h LEU 104 Cb 0.08 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1xck h LEU 104 CO -0.12 0.87 0.16 0.11 0.09 0.00 0.00 178.44 179.55 1xck h LYS 105 N 0.67 0.32 -0.61 1.13 1.57 -0.91 0.47 116.57 119.20 1xck h LYS 105 Ca 0.11 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.93 1xck h LYS 105 Cb 0.59 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 1xck h LYS 105 CO 0.04 0.21 0.33 0.00 -0.57 0.00 0.00 179.45 179.46 1xck h ALA 106 N 1.17 0.81 -0.64 3.86 0.00 -0.86 -0.43 119.26 123.17 1xck h ALA 106 Ca 0.14 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1xck h ALA 106 Cb 0.06 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1xck h ALA 106 CO -0.10 -0.00 0.36 0.28 0.00 0.00 0.00 179.25 179.79 1xck h VAL 107 N 0.62 1.20 -0.38 0.00 2.07 -0.42 -2.05 116.25 117.29 1xck h VAL 107 Ca 0.27 -0.50 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 1xck h VAL 107 Cb 0.17 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1xck h VAL 107 CO -0.18 0.22 0.04 0.00 0.02 0.00 0.00 177.57 177.67 1xck h ALA 108 N 1.17 1.37 0.00 1.67 0.00 -0.30 -0.17 119.26 123.00 1xck h ALA 108 Ca 0.23 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1xck h ALA 108 Cb 0.03 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1xck h ALA 108 CO -0.04 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.66 1xck n ALA 109 N -2.47 1.71 0.00 0.00 0.00 -0.23 -4.85 120.51 114.67 1xck n ALA 109 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1xck n ALA 109 Cb 0.23 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 -0.07 0.79 3.80 0.00 0.00 -0.07 -5.09 105.19 104.55 1xck n GLY 110 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.87 3.57 -0.07 1.61 1.00 -0.83 -4.97 119.30 118.74 1xck s MET 111 Ca 0.00 1.24 -0.30 0.00 0.00 0.00 0.00 55.69 56.63 1xck s MET 111 Cb 0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 34.83 32.73 1xck s MET 111 CO 0.00 -0.61 1.30 1.21 0.00 0.00 0.00 175.02 176.92 1xck s ASN 112 N -2.50 6.94 0.21 3.03 3.84 -1.26 -4.45 114.94 120.75 1xck s ASN 112 Ca 0.65 1.89 -0.09 0.00 0.21 0.00 0.00 52.86 55.52 1xck s ASN 112 Cb -0.15 -2.55 0.27 0.00 -0.55 0.00 0.00 41.25 38.26 1xck s ASN 112 CO 0.30 -0.69 1.77 -0.65 -2.79 0.00 0.00 177.10 175.04 1xck h PRO 113 N 7.88 0.52 -0.77 0.43 0.11 -1.93 -0.96 132.00 137.27 1xck h PRO 113 Ca -0.34 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.71 1xck h PRO 113 Cb 1.15 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 1xck h PRO 113 CO 0.91 0.34 0.36 0.52 -0.21 0.00 0.00 178.00 179.93 1xck h MET 114 N 0.53 1.11 -0.25 1.05 2.86 -1.92 -1.37 114.93 116.94 1xck h MET 114 Ca 0.30 -0.16 -0.19 0.00 -2.06 0.00 0.00 59.70 57.60 1xck h MET 114 Cb 0.30 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.76 1xck h MET 114 CO -0.25 0.86 -0.58 -0.44 1.06 0.00 0.00 176.91 177.56 1xck h ASP 115 N 1.10 0.89 -0.59 1.22 3.32 -1.78 -1.71 116.42 118.87 1xck h ASP 115 Ca 0.26 -0.50 0.04 0.00 0.02 0.00 0.00 57.03 56.86 1xck h ASP 115 Cb 0.12 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 1xck h ASP 115 CO -0.03 1.28 0.34 -0.07 -1.72 0.00 0.00 179.24 179.04 1xck h LEU 116 N 0.60 0.53 -0.30 1.55 3.38 -0.91 -0.63 115.31 119.54 1xck h LEU 116 Ca 0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1xck h LEU 116 Cb 1.18 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1xck h LEU 116 CO 0.12 0.37 0.09 0.50 0.09 0.00 0.00 178.44 179.61 1xck h LYS 117 N 0.66 0.46 -0.96 1.13 3.64 -1.18 -1.13 116.57 119.20 1xck h LYS 117 Ca 0.25 -0.10 0.05 0.00 -1.27 0.00 0.00 60.65 59.58 1xck h LYS 117 Cb 0.08 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.77 1xck h LYS 117 CO -0.13 0.51 0.62 -0.09 -2.27 0.00 0.00 179.45 178.10 1xck h ARG 118 N 0.32 1.11 -0.28 1.90 2.43 -0.77 0.36 114.38 119.45 1xck h ARG 118 Ca 0.10 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.14 1xck h ARG 118 Cb 0.24 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1xck h ARG 118 CO -0.00 0.74 -0.05 0.78 -1.51 0.00 0.00 179.97 179.92 1xck h GLY 119 N 1.15 0.56 0.79 2.80 0.00 -0.87 -0.58 103.07 106.91 1xck h GLY 119 Ca 0.40 -0.45 0.04 0.00 0.00 0.00 0.00 47.33 47.31 1xck h GLY 119 CO -0.14 0.42 0.31 -2.22 0.00 0.00 0.00 176.54 174.91 1xck h ILE 120 N 0.28 1.01 -0.50 2.60 2.04 -0.55 -0.95 117.51 121.44 1xck h ILE 120 Ca 0.07 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 1xck h ILE 120 Cb 0.52 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1xck h ILE 120 CO 0.02 0.11 0.19 0.44 0.00 0.00 0.00 178.15 178.91 1xck h ASP 121 N 0.61 0.71 -0.45 1.72 3.32 -0.78 -1.19 116.42 120.35 1xck h ASP 121 Ca 0.24 -0.18 0.03 0.00 0.02 0.00 0.00 57.03 57.14 1xck h ASP 121 Cb 0.09 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.42 1xck h ASP 121 CO -0.13 0.70 0.23 0.50 -1.72 0.00 0.00 179.24 178.82 1xck h LYS 122 N 0.67 0.46 -0.71 3.56 3.64 -0.55 0.89 116.57 124.53 1xck h LYS 122 Ca 0.17 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1xck h LYS 122 Cb 0.22 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1xck h LYS 122 CO -0.01 0.30 0.45 0.00 -2.27 0.00 0.00 179.45 177.92 1xck h ALA 123 N 1.23 0.90 -0.54 5.00 0.00 -0.96 -1.78 119.26 123.11 1xck h ALA 123 Ca 0.19 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1xck h ALA 123 Cb 0.08 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1xck h ALA 123 CO -0.13 0.35 -0.01 0.28 0.00 0.00 0.00 179.25 179.74 1xck h VAL 124 N 0.96 1.26 -0.69 0.00 2.07 -0.52 0.20 116.25 119.54 1xck h VAL 124 Ca 0.26 -1.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 1xck h VAL 124 Cb -0.07 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1xck h VAL 124 CO -0.05 0.40 0.33 0.74 0.02 0.00 0.00 177.57 179.01 1xck h THR 125 N 0.84 1.22 -0.20 2.57 2.02 -0.53 0.14 112.91 118.96 1xck h THR 125 Ca 0.15 -0.61 -0.09 0.00 0.77 0.00 0.00 66.41 66.63 1xck h THR 125 Cb 0.54 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1xck h THR 125 CO 0.03 0.26 -0.24 0.00 0.37 0.00 0.00 175.52 175.94 1xck h ALA 126 N 1.40 0.30 -0.84 6.16 0.00 -1.02 -2.88 119.26 122.36 1xck h ALA 126 Ca 0.24 -0.38 0.06 0.00 0.00 0.00 0.00 54.91 54.83 1xck h ALA 126 Cb 0.09 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1xck h ALA 126 CO -0.03 0.26 0.52 0.00 0.00 0.00 0.00 179.25 180.00 1xck h ALA 127 N 0.63 1.15 -0.39 0.00 0.00 -0.01 -0.58 119.26 120.06 1xck h ALA 127 Ca 0.03 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1xck h ALA 127 Cb 0.80 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1xck h ALA 127 CO 0.06 0.28 0.00 0.28 0.00 0.00 0.00 179.25 179.87 1xck h VAL 128 N 0.97 1.21 -0.15 0.00 2.07 -0.67 -0.59 116.25 119.10 1xck h VAL 128 Ca 0.36 -0.86 -0.18 0.00 0.82 0.00 0.00 66.70 66.83 1xck h VAL 128 Cb 0.14 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1xck h VAL 128 CO -0.16 0.30 -0.66 -0.08 0.02 0.00 0.00 177.57 176.99 1xck h GLU 129 N 0.59 0.59 -0.06 1.57 4.57 -1.12 -2.45 114.58 118.26 1xck h GLU 129 Ca 0.12 -0.43 -0.08 0.00 -1.18 0.00 0.00 59.36 57.80 1xck h GLU 129 Cb 0.37 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 1xck h GLU 129 CO 0.01 1.05 -0.33 1.49 -1.18 0.00 0.00 179.01 180.05 1xck h GLU 130 N 0.42 0.12 -0.36 1.92 4.57 -0.74 -2.38 114.58 118.14 1xck h GLU 130 Ca -0.02 -0.04 -0.12 0.00 -1.18 0.00 0.00 59.36 58.00 1xck h GLU 130 Cb 1.23 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.80 1xck h GLU 130 CO 0.12 0.44 -0.26 1.25 -1.18 0.00 0.00 179.01 179.39 1xck h LEU 131 N 0.11 0.75 -0.51 1.64 5.85 -0.84 -1.04 115.31 121.26 1xck h LEU 131 Ca 0.01 -0.28 -0.10 0.00 0.84 0.00 0.00 57.88 58.35 1xck h LEU 131 Cb 0.64 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 1xck h LEU 131 CO 0.05 0.97 -0.09 0.11 -0.34 0.00 0.00 178.44 179.14 1xck h LYS 132 N 0.63 0.95 -0.30 1.25 1.57 -0.97 -1.58 116.57 118.12 1xck h LYS 132 Ca 0.08 -0.35 -0.08 0.00 -1.87 0.00 0.00 60.65 58.43 1xck h LYS 132 Cb 0.76 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1xck h LYS 132 CO 0.06 1.01 -0.17 0.00 -0.57 0.00 0.00 179.45 179.79 1xck h ALA 133 N 0.91 1.14 -0.10 3.86 0.00 -1.21 -2.84 119.26 121.02 1xck h ALA 133 Ca 0.13 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1xck h ALA 133 Cb 0.64 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1xck h ALA 133 CO 0.04 0.54 -0.63 1.25 0.00 0.00 0.00 179.25 180.45 1xck h LEU 134 N 0.49 0.43 -9.41 0.00 6.46 -1.00 -3.46 115.31 108.82 1xck h LEU 134 Ca 0.08 -0.25 -0.63 0.00 -0.12 0.00 0.00 57.88 56.96 1xck h LEU 134 Cb 0.57 -0.12 0.08 0.00 -0.73 0.00 0.00 40.66 40.46 1xck h LEU 134 CO 0.04 0.95 0.36 -0.24 -0.62 0.00 0.00 178.44 178.93 1xck n SER 135 N -3.88 1.73 -4.64 1.25 2.88 -0.61 -4.92 113.62 105.43 1xck n SER 135 Ca -0.03 1.14 -0.35 0.00 -1.33 0.00 0.00 58.87 58.31 1xck n SER 135 Cb 0.64 -1.28 -0.10 0.00 -0.75 0.00 0.00 64.21 62.73 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 -0.18 4.68 0.60 2.46 1.01 0.20 -4.90 120.40 124.27 1xck s VAL 136 Ca 0.71 -0.08 -0.18 0.00 0.00 0.00 0.00 61.98 62.43 1xck s VAL 136 Cb -0.79 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1xck s VAL 136 CO 0.52 0.49 1.15 -2.84 0.00 0.00 0.00 175.10 174.43 1xck s PRO 137 N 0.11 3.02 -0.42 2.72 0.02 -1.26 -0.74 135.00 138.44 1xck s PRO 137 Ca 0.04 1.64 0.02 0.00 0.02 0.00 0.00 61.00 62.72 1xck s PRO 137 Cb -0.12 -1.96 0.15 0.00 0.02 0.00 0.00 34.50 32.59 1xck s PRO 137 CO 0.01 -1.12 0.27 0.00 -0.33 0.00 0.00 177.00 175.83 1xck n SER 139 N 3.46 0.30 -4.76 0.00 7.64 -1.26 -4.27 113.62 114.72 1xck n SER 139 Ca 0.15 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.69 1xck n SER 139 Cb 0.38 -0.01 0.03 0.00 -1.01 0.00 0.00 64.21 63.61 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 -4.95 5.25 0.00 6.43 -4.77 -1.26 -4.84 116.67 112.53 1xck s ASP 140 Ca -0.00 2.15 0.14 0.00 -3.30 0.00 0.00 52.55 51.53 1xck s ASP 140 Cb 0.00 -2.57 0.68 0.00 -1.09 0.00 0.00 42.92 39.93 1xck s ASP 140 CO 0.00 -1.54 1.36 -1.54 0.70 0.00 0.00 175.17 174.16 1xck n SER 141 N -1.95 0.00 0.01 2.11 3.41 -1.26 -1.68 113.62 114.27 1xck n SER 141 Ca 0.11 0.13 -0.19 0.00 -0.26 0.00 0.00 58.87 58.67 1xck n SER 141 Cb 0.51 -0.30 -0.10 0.00 -0.26 0.00 0.00 64.21 64.06 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 0.64 -0.20 4.33 3.64 -2.00 -2.45 116.57 120.53 1xck h LYS 142 Ca 0.00 -0.63 -0.06 0.00 -1.27 0.00 0.00 60.65 58.69 1xck h LYS 142 Cb 0.14 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1xck h LYS 142 CO 0.00 1.23 -0.11 0.00 -2.27 0.00 0.00 179.45 178.31 1xck h ALA 143 N 0.42 0.29 -0.91 5.00 0.00 -1.68 -2.56 119.26 119.81 1xck h ALA 143 Ca -0.09 -0.30 0.11 0.00 0.00 0.00 0.00 54.91 54.63 1xck h ALA 143 Cb 1.49 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 19.13 1xck h ALA 143 CO 0.17 0.13 0.55 0.82 0.00 0.00 0.00 179.25 180.91 1xck h ILE 144 N 0.13 0.90 -0.46 0.00 2.04 -1.50 0.06 117.51 118.67 1xck h ILE 144 Ca 0.04 -0.30 -0.11 0.00 1.00 0.00 0.00 64.86 65.49 1xck h ILE 144 Cb 0.60 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 1xck h ILE 144 CO 0.03 0.16 -0.16 0.00 0.00 0.00 0.00 178.15 178.18 1xck h ALA 145 N 1.51 0.84 -0.26 1.87 0.00 -1.31 -2.07 119.26 119.83 1xck h ALA 145 Ca 0.45 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1xck h ALA 145 Cb 0.45 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1xck h ALA 145 CO -0.27 0.65 0.07 1.96 0.00 0.00 0.00 179.25 181.66 1xck h GLN 146 N 0.79 0.42 -0.57 0.00 4.20 -0.75 -0.17 115.11 119.02 1xck h GLN 146 Ca 0.12 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.69 1xck h GLN 146 Cb 0.70 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.40 1xck h GLN 146 CO 0.05 0.51 0.19 0.28 -0.67 0.00 0.00 178.83 179.19 1xck h VAL 147 N 0.26 1.22 -0.22 -0.54 2.07 -1.01 -1.29 116.25 116.73 1xck h VAL 147 Ca 0.08 -0.72 -0.14 0.00 0.82 0.00 0.00 66.70 66.74 1xck h VAL 147 Cb 0.27 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1xck h VAL 147 CO 0.00 0.28 -0.46 1.23 0.02 0.00 0.00 177.57 178.64 1xck h GLY 148 N 0.96 0.62 0.97 2.17 0.00 -1.12 -1.33 103.07 105.34 1xck h GLY 148 Ca 0.19 -0.66 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 1xck h GLY 148 CO -0.01 0.60 -0.05 -0.84 0.00 0.00 0.00 176.54 176.24 1xck h THR 149 N 0.46 1.27 -0.43 4.70 2.02 -0.55 -2.00 112.91 118.38 1xck h THR 149 Ca 0.03 -1.11 -0.05 0.00 0.77 0.00 0.00 66.41 66.05 1xck h THR 149 Cb 0.98 1.16 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 1xck h THR 149 CO 0.09 0.37 0.09 0.40 0.37 0.00 0.00 175.52 176.85 1xck h ILE 150 N 0.58 1.24 0.00 3.11 2.04 -1.19 0.36 117.51 123.65 1xck h ILE 150 Ca 0.11 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.14 1xck h ILE 150 Cb 0.56 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1xck h ILE 150 CO 0.03 0.29 0.00 -1.20 0.00 0.00 0.00 178.15 177.27 1xck n SER 151 N -4.52 0.18 -1.24 1.72 7.64 -0.51 -2.42 113.62 114.48 1xck n SER 151 Ca 0.00 0.54 -0.02 0.00 1.01 0.00 0.00 58.87 60.40 1xck n SER 151 Cb 0.22 -0.58 0.23 0.00 -1.01 0.00 0.00 64.21 63.07 1xck n SER 151 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xck n ALA 152 N -1.57 4.01 -3.27 -0.43 0.00 -0.76 -4.20 120.51 114.29 1xck n ALA 152 Ca 0.03 -2.77 -0.16 0.00 0.00 0.00 0.00 53.44 50.54 1xck n ALA 152 Cb 0.20 -0.84 0.08 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.84 -2.77 -1.51 0.00 5.15 -1.01 -3.06 115.26 111.21 1xck n ASN 153 Ca 0.32 -0.52 -0.15 0.00 -0.60 0.00 0.00 54.58 53.64 1xck n ASN 153 Cb 1.08 -4.45 -0.03 0.00 -0.53 0.00 0.00 39.78 35.85 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 -2.74 -4.66 -4.39 1.20 7.64 0.12 -4.96 113.62 105.83 1xck n SER 154 Ca -0.20 0.13 -0.44 0.00 1.01 0.00 0.00 58.87 59.37 1xck n SER 154 Cb 0.63 -3.68 -0.04 0.00 -1.01 0.00 0.00 64.21 60.11 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 -2.52 6.22 0.49 6.43 -1.08 -1.08 -4.91 116.67 120.22 1xck s ASP 155 Ca 0.00 -1.41 0.19 0.00 -0.52 0.00 0.00 52.55 50.81 1xck s ASP 155 Cb 0.00 -2.33 1.21 0.00 -1.46 0.00 0.00 42.92 40.34 1xck s ASP 155 CO 0.00 -1.17 2.02 -0.33 0.52 0.00 0.00 175.17 176.21 1xck h GLU 156 N 9.22 0.17 -0.22 4.34 5.08 -1.92 -2.32 114.58 128.93 1xck h GLU 156 Ca -0.26 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.13 1xck h GLU 156 Cb 1.08 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.25 1xck h GLU 156 CO 1.11 0.11 -0.03 1.15 -1.00 0.00 0.00 179.01 180.35 1xck h THR 157 N 0.18 0.80 -0.66 1.13 2.02 -1.97 -0.95 112.91 113.46 1xck h THR 157 Ca 0.21 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.38 1xck h THR 157 Cb 0.61 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 1xck h THR 157 CO -0.03 0.00 0.39 0.58 0.37 0.00 0.00 175.52 176.83 1xck h VAL 158 N 0.02 1.19 -0.48 3.16 2.07 -1.76 0.98 116.25 121.42 1xck h VAL 158 Ca 0.10 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 1xck h VAL 158 Cb 0.15 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1xck h VAL 158 CO -0.21 0.20 0.29 1.23 0.02 0.00 0.00 177.57 179.11 1xck h GLY 159 N 0.89 0.70 0.90 2.17 0.00 -1.41 -0.98 103.07 105.34 1xck h GLY 159 Ca 0.24 -0.29 0.01 0.00 0.00 0.00 0.00 47.33 47.28 1xck h GLY 159 CO -0.04 0.28 0.10 1.70 0.00 0.00 0.00 176.54 178.59 1xck h LYS 160 N 0.65 0.22 -0.16 4.80 3.64 -0.68 -0.54 116.57 124.50 1xck h LYS 160 Ca 0.17 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.59 1xck h LYS 160 Cb -0.00 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.72 1xck h LYS 160 CO -0.03 0.15 -0.14 -0.07 -2.27 0.00 0.00 179.45 177.08 1xck h LEU 161 N 0.23 -0.46 -0.67 5.20 3.38 -0.44 -1.16 115.31 121.39 1xck h LEU 161 Ca 0.09 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 1xck h LEU 161 Cb 0.03 0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1xck h LEU 161 CO -0.06 -0.19 0.31 0.40 0.09 0.00 0.00 178.44 178.99 1xck h ILE 162 N -0.16 1.23 -0.48 1.22 2.04 -0.95 -1.61 117.51 118.79 1xck h ILE 162 Ca 0.10 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.30 1xck h ILE 162 Cb 0.32 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 1xck h ILE 162 CO -0.26 0.27 0.31 0.00 0.00 0.00 0.00 178.15 178.48 1xck h ALA 163 N 1.14 0.62 -0.57 1.87 0.00 -0.81 -0.63 119.26 120.88 1xck h ALA 163 Ca 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1xck h ALA 163 Cb 0.14 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1xck h ALA 163 CO -0.03 0.08 0.28 0.93 0.00 0.00 0.00 179.25 180.51 1xck h GLU 164 N 0.65 0.81 -0.31 0.00 5.08 -0.99 -1.05 114.58 118.78 1xck h GLU 164 Ca 0.18 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1xck h GLU 164 Cb -0.05 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1xck h GLU 164 CO -0.04 0.65 0.03 0.00 -1.00 0.00 0.00 179.01 178.66 1xck h ALA 165 N 1.12 0.42 0.00 3.43 0.00 -1.00 -2.15 119.26 121.08 1xck h ALA 165 Ca 0.20 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1xck h ALA 165 Cb 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1xck h ALA 165 CO -0.03 0.13 -0.20 0.52 0.00 0.00 0.00 179.25 179.67 1xck h MET 166 N 0.34 0.00 -0.27 0.00 2.86 -0.98 -1.73 114.93 115.15 1xck h MET 166 Ca 0.09 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.60 1xck h MET 166 Cb 0.38 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1xck h MET 166 CO 0.01 0.20 -0.37 0.22 1.06 0.00 0.00 176.91 178.03 1xck h ASP 167 N 0.00 0.63 0.61 1.22 3.58 -0.89 0.40 116.42 121.98 1xck h ASP 167 Ca -0.00 -0.27 -0.03 0.00 0.42 0.00 0.00 57.03 57.15 1xck h ASP 167 Cb 0.36 -0.18 0.01 0.00 1.72 0.00 0.00 39.33 41.24 1xck h ASP 167 CO 0.03 0.94 -0.30 0.11 -2.88 0.00 0.00 179.24 177.14 1xck h LYS 168 N 0.50 -0.80 -0.04 0.28 1.79 -0.68 -3.34 116.57 114.29 1xck h LYS 168 Ca 0.05 0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 1xck h LYS 168 Cb 0.87 0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1xck h LYS 168 CO 0.07 -0.53 0.00 1.33 -1.08 0.00 0.00 179.45 179.24 1xck n VAL 169 N -5.23 0.02 0.00 0.50 0.24 -0.85 -5.07 118.33 107.94 1xck n VAL 169 Ca -0.10 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 1xck n VAL 169 Cb 0.33 0.77 0.00 0.00 -1.47 0.00 0.00 33.84 33.46 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 1.23 -1.35 0.25 7.63 0.00 0.14 -2.92 105.19 110.16 1xck n GLY 170 Ca 0.18 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.69 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 0.00 0.00 1.61 1.57 -1.94 -1.31 116.57 116.50 1xck h LYS 171 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xck h LYS 171 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1xck h LYS 171 CO 0.00 0.09 -0.58 0.39 -0.57 0.00 0.00 179.45 178.78 1xck n GLU 172 N -4.27 0.26 -0.83 3.15 -0.58 -1.26 -4.97 120.64 112.14 1xck n GLU 172 Ca -0.03 0.08 -0.33 0.00 -0.42 0.00 0.00 57.16 56.46 1xck n GLU 172 Cb 0.17 -1.67 0.12 0.00 -0.57 0.00 0.00 31.44 29.49 1xck n GLU 172 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xck n GLY 173 N 1.36 -2.00 3.68 0.62 0.00 -0.49 -4.97 105.19 103.37 1xck n GLY 173 Ca 0.04 -0.73 -0.38 0.00 0.00 0.00 0.00 46.02 44.95 1xck n GLY 173 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xck s VAL 174 N -2.36 5.21 -0.12 1.61 1.01 -1.26 -4.96 120.40 119.53 1xck s VAL 174 Ca 0.57 0.71 0.02 0.00 0.00 0.00 0.00 61.98 63.28 1xck s VAL 174 Cb -0.22 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.45 1xck s VAL 174 CO 0.67 0.26 -0.18 -0.63 0.00 0.00 0.00 175.10 175.22 1xck s ILE 175 N 1.22 1.72 0.15 2.22 1.01 -1.26 0.01 121.20 126.27 1xck s ILE 175 Ca 0.19 -0.78 0.08 0.00 0.00 0.00 0.00 60.65 60.14 1xck s ILE 175 Cb -0.15 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 1xck s ILE 175 CO 0.08 0.48 -0.12 -0.89 0.00 0.00 0.00 174.94 174.50 1xck s THR 176 N 0.85 3.16 -0.03 2.92 2.01 0.95 -4.94 115.64 120.57 1xck s THR 176 Ca -0.08 -1.52 0.02 0.00 0.31 0.00 0.00 61.69 60.42 1xck s THR 176 Cb -0.15 -2.52 0.01 0.00 0.01 0.00 0.00 72.50 69.85 1xck s THR 176 CO -0.00 -0.00 -0.07 0.54 -0.69 0.00 0.00 174.62 174.39 1xck s VAL 177 N -1.45 0.66 0.22 3.82 0.11 -1.26 -0.33 120.40 122.18 1xck s VAL 177 Ca 0.22 -0.27 -0.05 0.00 -2.93 0.00 0.00 61.98 58.94 1xck s VAL 177 Cb -0.10 -0.61 -0.03 0.00 -1.53 0.00 0.00 36.38 34.11 1xck s VAL 177 CO 0.14 0.22 0.26 -1.83 -3.33 0.00 0.00 175.10 170.56 1xck s GLU 178 N 0.36 1.32 0.38 1.54 -1.05 0.30 -4.94 118.70 116.61 1xck s GLU 178 Ca -0.05 -1.48 -0.26 0.00 -0.15 0.00 0.00 54.97 53.03 1xck s GLU 178 Cb -0.10 0.34 -0.11 0.00 -0.44 0.00 0.00 34.13 33.82 1xck s GLU 178 CO 0.00 -0.48 1.07 -0.25 0.95 0.00 0.00 175.26 176.55 1xck n ASP 179 N -0.31 1.57 -4.93 0.83 8.00 -1.26 -1.99 116.55 118.46 1xck n ASP 179 Ca 0.00 1.09 -0.26 0.00 0.71 0.00 0.00 54.79 56.34 1xck n ASP 179 Cb 0.64 -1.37 0.04 0.00 -0.02 0.00 0.00 41.12 40.42 1xck n ASP 179 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1xck s GLY 180 N -0.63 1.65 0.00 0.44 0.00 -0.41 -4.44 107.32 103.93 1xck s GLY 180 Ca 0.61 -0.84 0.23 0.00 0.00 0.00 0.00 44.72 44.72 1xck s GLY 180 CO 0.58 -0.53 1.52 -1.30 0.00 0.00 0.00 173.10 173.37 1xck n THR 181 N -2.65 0.19 0.00 0.90 -2.24 -1.26 -4.90 114.28 104.32 1xck n THR 181 Ca 0.06 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1xck n THR 181 Cb 0.59 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 1xck n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xck n GLY 182 N 1.26 4.26 0.33 3.38 0.00 -1.26 -5.03 105.19 108.13 1xck n GLY 182 Ca 0.17 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1xck n GLY 182 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1xck n LEU 183 N 0.00 0.00 0.00 0.99 -0.00 -1.26 -4.54 117.00 112.18 1xck n LEU 183 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1xck n LEU 183 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1xck n LEU 183 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.39 177.39 1xck n GLN 184 N -0.05 0.00 -2.41 1.96 6.02 -1.26 -4.69 117.38 116.95 1xck n GLN 184 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.67 1xck n GLN 184 Cb 0.00 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.23 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 0.00 6.58 -0.01 1.08 1.01 -1.26 -3.40 116.67 120.68 1xck s ASP 185 Ca 0.00 1.51 0.01 0.00 0.71 0.00 0.00 52.55 54.78 1xck s ASP 185 Cb 0.00 -2.49 0.01 0.00 1.01 0.00 0.00 42.92 41.45 1xck s ASP 185 CO 0.00 -0.59 -0.02 -1.61 0.21 0.00 0.00 175.17 173.17 1xck s GLU 186 N -4.13 0.21 -0.12 8.23 2.02 -0.87 -4.94 118.70 119.10 1xck s GLU 186 Ca 0.58 -0.04 -0.00 0.00 0.02 0.00 0.00 54.97 55.53 1xck s GLU 186 Cb -0.10 -0.25 0.02 0.00 0.10 0.00 0.00 34.13 33.91 1xck s GLU 186 CO 0.33 0.01 -0.10 -1.17 0.02 0.00 0.00 175.26 174.34 1xck s LEU 187 N 0.20 1.37 -0.00 1.80 2.96 -1.26 -0.93 118.68 122.82 1xck s LEU 187 Ca -0.02 -0.36 -0.01 0.00 -0.22 0.00 0.00 54.13 53.51 1xck s LEU 187 Cb -0.04 -0.96 -0.00 0.00 0.50 0.00 0.00 46.19 45.69 1xck s LEU 187 CO -0.01 -0.09 0.02 -1.81 -1.32 0.00 0.00 176.35 173.15 1xck s ASP 188 N 1.58 0.06 -0.19 3.68 1.01 -0.80 -4.96 116.67 117.04 1xck s ASP 188 Ca 0.04 -0.15 -0.09 0.00 0.71 0.00 0.00 52.55 53.06 1xck s ASP 188 Cb -0.13 0.10 -0.05 0.00 1.01 0.00 0.00 42.92 43.85 1xck s ASP 188 CO -0.08 -0.15 0.11 -0.69 0.21 0.00 0.00 175.17 174.57 1xck s VAL 189 N -0.62 5.26 0.38 -1.27 1.01 -1.26 0.08 120.40 123.97 1xck s VAL 189 Ca -0.07 0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.08 1xck s VAL 189 Cb -0.04 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 1xck s VAL 189 CO -0.00 0.46 0.12 0.68 0.00 0.00 0.00 175.10 176.35 1xck s VAL 190 N 0.27 0.68 -0.08 2.92 -7.23 -0.74 -4.95 120.40 111.27 1xck s VAL 190 Ca 0.07 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.95 1xck s VAL 190 Cb -0.11 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 1xck s VAL 190 CO -0.01 0.00 1.46 -1.61 -0.31 0.00 0.00 175.10 174.63 1xck s GLU 191 N -3.77 4.22 0.25 4.82 0.41 -1.26 -1.68 118.70 121.70 1xck s GLU 191 Ca 0.28 1.95 -0.19 0.00 -0.41 0.00 0.00 54.97 56.60 1xck s GLU 191 Cb 0.04 -3.82 0.07 0.00 -1.78 0.00 0.00 34.13 28.65 1xck s GLU 191 CO 0.15 -0.74 0.95 0.41 -0.49 0.00 0.00 175.26 175.54 1xck n GLY 192 N 3.84 0.73 3.53 -1.39 0.00 -1.26 -0.68 105.19 109.95 1xck n GLY 192 Ca 0.15 -1.18 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 1xck n GLY 192 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xck s MET 193 N -2.06 0.76 -0.04 1.61 1.75 -0.76 -4.02 119.30 116.54 1xck s MET 193 Ca 0.20 -0.15 -0.01 0.00 -1.25 0.00 0.00 55.69 54.48 1xck s MET 193 Cb -0.03 0.35 0.03 0.00 2.84 0.00 0.00 34.83 38.02 1xck s MET 193 CO 0.08 -0.31 0.08 -1.14 -0.65 0.00 0.00 175.02 173.08 1xck s GLN 194 N -2.48 -0.01 0.26 4.11 0.74 -1.26 -0.57 119.66 120.47 1xck s GLN 194 Ca 0.03 0.30 0.09 0.00 0.05 0.00 0.00 55.36 55.83 1xck s GLN 194 Cb -0.01 -0.28 -0.05 0.00 1.10 0.00 0.00 33.01 33.77 1xck s GLN 194 CO -0.05 -0.21 -0.14 -0.59 -0.55 0.00 0.00 175.29 173.75 1xck s PHE 195 N 1.38 2.05 -1.31 1.67 -0.71 -0.53 -4.99 117.98 115.55 1xck s PHE 195 Ca -0.06 -0.50 -0.13 0.00 -1.04 0.00 0.00 56.93 55.20 1xck s PHE 195 Cb -0.12 -1.01 0.12 0.00 -1.21 0.00 0.00 43.02 40.80 1xck s PHE 195 CO -0.04 0.50 1.81 -0.25 -1.34 0.00 0.00 175.22 175.90 1xck n ASP 196 N -0.56 4.82 -3.73 1.98 8.00 -1.26 -1.82 116.55 123.98 1xck n ASP 196 Ca -0.06 -2.98 -0.12 0.00 0.71 0.00 0.00 54.79 52.34 1xck n ASP 196 Cb 0.61 -1.60 -0.13 0.00 -0.02 0.00 0.00 41.12 39.99 1xck n ASP 196 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1xck s ARG 197 N 2.12 0.23 0.53 -1.24 1.81 -1.16 -4.86 118.95 116.38 1xck s ARG 197 Ca 0.45 0.53 0.07 0.00 -1.72 0.00 0.00 55.73 55.06 1xck s ARG 197 Cb 0.06 -0.08 0.07 0.00 -0.45 0.00 0.00 34.95 34.55 1xck s ARG 197 CO -0.00 -0.15 0.61 0.41 -0.68 0.00 0.00 175.30 175.49 1xck n GLY 198 N 4.07 2.27 3.74 -3.53 0.00 -1.25 -1.27 105.19 109.22 1xck n GLY 198 Ca -0.24 -2.25 -0.40 0.00 0.00 0.00 0.00 46.02 43.14 1xck n GLY 198 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1xck n TYR 199 N -2.01 2.44 1.88 1.61 0.18 -0.78 -4.43 117.16 116.05 1xck n TYR 199 Ca 0.09 0.45 0.13 0.00 1.88 0.00 0.00 57.90 60.45 1xck n TYR 199 Cb 0.57 -2.41 0.77 0.00 -0.38 0.00 0.00 39.34 37.88 1xck n TYR 199 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1xck n LEU 200 N -0.25 0.00 -3.65 -3.48 4.77 -0.33 -4.78 117.00 109.28 1xck n LEU 200 Ca 0.07 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.02 1xck n LEU 200 Cb 0.42 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.44 1xck n LEU 200 CO 0.58 0.00 1.06 -0.55 -1.33 0.00 0.00 177.39 177.15 1xck s SER 201 N -1.87 -0.12 0.00 -1.43 0.15 -1.26 -5.09 113.70 104.08 1xck s SER 201 Ca 0.39 0.22 0.00 0.00 0.70 0.00 0.00 55.95 57.26 1xck s SER 201 Cb 0.18 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 1xck s SER 201 CO 0.30 -0.04 0.00 -2.65 1.20 0.00 0.00 173.24 172.05 1xck n PRO 202 N 2.05 2.32 0.00 5.44 -0.02 -1.26 -3.46 135.00 140.07 1xck n PRO 202 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1xck n PRO 202 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.05 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 0.00 0.00 0.30 6.00 4.01 -1.26 -4.20 117.16 122.01 1xck n TYR 203 Ca 0.00 0.00 0.19 0.00 -0.16 0.00 0.00 57.90 57.93 1xck n TYR 203 Cb 0.00 0.00 1.02 0.00 -0.31 0.00 0.00 39.34 40.05 1xck n TYR 203 CO 0.00 0.00 0.00 0.74 -0.46 0.00 0.00 176.86 177.14 1xck h PHE 204 N 0.00 0.00 -2.38 -0.72 0.04 -1.90 -3.41 116.94 108.56 1xck h PHE 204 Ca 0.00 0.00 -0.55 0.00 2.80 0.00 0.00 57.97 60.22 1xck h PHE 204 Cb 0.00 0.00 0.04 0.00 2.20 0.00 0.00 35.95 38.19 1xck h PHE 204 CO 0.00 0.00 1.06 -0.89 -0.60 0.00 0.00 178.31 177.88 1xck n ILE 205 N -3.38 0.35 -1.27 -0.55 5.41 -1.26 -4.66 119.36 113.99 1xck n ILE 205 Ca -0.02 -0.06 0.06 0.00 1.00 0.00 0.00 62.75 63.73 1xck n ILE 205 Cb 0.17 -2.00 0.08 0.00 -0.71 0.00 0.00 39.64 37.18 1xck n ILE 205 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1xck n ASN 206 N 5.49 1.49 -3.10 4.38 0.23 -1.08 -4.74 115.26 117.92 1xck n ASN 206 Ca 0.19 -2.58 -0.16 0.00 -0.53 0.00 0.00 54.58 51.50 1xck n ASN 206 Cb 0.35 -0.31 -0.01 0.00 -2.08 0.00 0.00 39.78 37.73 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 -0.86 0.98 -0.59 -3.83 4.76 -0.86 -4.88 118.16 112.88 1xck n LYS 207 Ca 0.09 -3.12 0.47 0.00 -2.87 0.00 0.00 58.31 52.88 1xck n LYS 207 Cb 0.62 -1.58 0.76 0.00 -1.84 0.00 0.00 35.03 32.99 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 3.00 0.01 0.03 1.97 0.13 -1.85 0.48 132.00 135.77 1xck h PRO 208 Ca 0.06 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1xck h PRO 208 Cb 1.00 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 1xck h PRO 208 CO 0.43 0.01 -0.09 0.93 -0.23 0.00 0.00 178.00 179.05 1xck h GLU 209 N 0.01 -0.13 -0.00 0.86 3.07 -1.95 -2.80 114.58 113.65 1xck h GLU 209 Ca 0.90 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.77 1xck h GLU 209 Cb 3.30 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 31.24 1xck h GLU 209 CO -0.21 -0.09 -0.09 0.25 -1.40 0.00 0.00 179.01 177.48 1xck n THR 210 N -2.91 0.00 -2.51 1.13 -2.24 -0.34 -4.93 114.28 102.48 1xck n THR 210 Ca -0.02 -0.01 -0.15 0.00 -2.27 0.00 0.00 64.05 61.60 1xck n THR 210 Cb 0.07 -0.33 0.01 0.00 -2.10 0.00 0.00 70.33 67.98 1xck n THR 210 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xck n GLY 211 N 1.41 -0.20 3.45 3.38 0.00 0.15 -5.01 105.19 108.38 1xck n GLY 211 Ca 0.10 -0.22 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.85 2.62 -0.11 4.61 0.00 -1.15 -4.64 121.76 120.24 1xck s ALA 212 Ca 0.10 -1.86 -0.12 0.00 0.00 0.00 0.00 51.96 50.08 1xck s ALA 212 Cb -0.04 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.83 1xck s ALA 212 CO 0.12 0.21 0.26 0.08 0.00 0.00 0.00 175.76 176.44 1xck s VAL 213 N -2.62 5.30 -0.18 0.00 1.01 -0.42 -2.02 120.40 121.47 1xck s VAL 213 Ca 0.29 0.49 -0.03 0.00 0.00 0.00 0.00 61.98 62.73 1xck s VAL 213 Cb -0.03 -3.57 0.06 0.00 0.00 0.00 0.00 36.38 32.84 1xck s VAL 213 CO 0.13 0.52 0.05 -0.70 0.00 0.00 0.00 175.10 175.10 1xck s GLU 214 N -0.43 0.46 -0.01 2.72 2.12 -1.26 -0.90 118.70 121.40 1xck s GLU 214 Ca 0.17 -0.30 0.03 0.00 0.36 0.00 0.00 54.97 55.23 1xck s GLU 214 Cb -0.14 -2.00 -0.03 0.00 0.26 0.00 0.00 34.13 32.22 1xck s GLU 214 CO 0.06 -0.64 -0.08 -0.51 -0.54 0.00 0.00 175.26 173.54 1xck s LEU 215 N 1.95 3.08 -0.08 2.70 1.43 -0.89 -4.97 118.68 121.90 1xck s LEU 215 Ca 0.00 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 52.96 1xck s LEU 215 Cb -0.17 -1.75 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 1xck s LEU 215 CO -0.08 0.29 -0.15 -1.61 0.23 0.00 0.00 176.35 175.04 1xck s GLU 216 N -1.30 2.85 -1.69 1.70 2.02 -1.26 -1.99 118.70 119.04 1xck s GLU 216 Ca 0.16 -0.71 -0.18 0.00 0.02 0.00 0.00 54.97 54.26 1xck s GLU 216 Cb -0.11 -2.46 0.15 0.00 0.10 0.00 0.00 34.13 31.81 1xck s GLU 216 CO 0.06 0.45 0.82 0.43 0.02 0.00 0.00 175.26 177.04 1xck n SER 217 N 2.83 -3.57 -4.83 -0.19 7.64 0.06 -4.52 113.62 111.03 1xck n SER 217 Ca -0.18 -0.98 -0.31 0.00 1.01 0.00 0.00 58.87 58.41 1xck n SER 217 Cb 0.52 -2.91 0.03 0.00 -1.01 0.00 0.00 64.21 60.84 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 -6.90 3.23 0.10 1.43 0.04 -1.19 -4.58 135.00 127.13 1xck s PRO 218 Ca 0.74 0.94 -0.08 0.00 0.04 0.00 0.00 61.00 62.64 1xck s PRO 218 Cb -0.40 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.05 1xck s PRO 218 CO 0.92 -0.86 0.40 -0.06 0.04 0.00 0.00 177.00 177.43 1xck s PHE 219 N -2.96 3.55 -0.17 0.56 0.08 -0.14 -3.33 117.98 115.57 1xck s PHE 219 Ca 0.58 0.73 0.01 0.00 0.12 0.00 0.00 56.93 58.37 1xck s PHE 219 Cb -0.13 -2.12 0.02 0.00 -0.57 0.00 0.00 43.02 40.21 1xck s PHE 219 CO 0.50 0.48 -0.19 0.42 -0.10 0.00 0.00 175.22 176.33 1xck s ILE 220 N -1.48 2.16 -0.25 0.64 1.01 0.86 -0.49 121.20 123.64 1xck s ILE 220 Ca 0.36 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 59.94 1xck s ILE 220 Cb -0.13 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 1xck s ILE 220 CO 0.20 0.53 0.37 -0.22 0.00 0.00 0.00 174.94 175.82 1xck s LEU 221 N 1.20 4.07 -0.40 2.97 2.96 0.39 0.34 118.68 130.20 1xck s LEU 221 Ca 0.02 0.35 -0.08 0.00 -0.22 0.00 0.00 54.13 54.21 1xck s LEU 221 Cb -0.14 -2.44 0.08 0.00 0.50 0.00 0.00 46.19 44.19 1xck s LEU 221 CO -0.10 -0.15 0.22 -0.76 -1.32 0.00 0.00 176.35 174.24 1xck s LEU 222 N 1.83 5.01 -0.24 -0.68 1.43 -1.26 -0.79 118.68 123.98 1xck s LEU 222 Ca 0.16 -1.52 0.02 0.00 -1.03 0.00 0.00 54.13 51.76 1xck s LEU 222 Cb -0.15 -1.94 0.05 0.00 0.03 0.00 0.00 46.19 44.18 1xck s LEU 222 CO 0.09 -0.50 -0.13 0.00 0.23 0.00 0.00 176.35 176.04 1xck s ALA 223 N 1.37 2.46 -1.30 4.21 0.00 -0.71 -0.92 121.76 126.87 1xck s ALA 223 Ca 0.03 -1.59 -0.18 0.00 0.00 0.00 0.00 51.96 50.23 1xck s ALA 223 Cb -0.22 -1.46 0.07 0.00 0.00 0.00 0.00 23.12 21.51 1xck s ALA 223 CO 0.01 -0.96 1.74 -3.47 0.00 0.00 0.00 175.76 173.08 1xck n ASP 224 N 4.50 4.92 0.00 0.00 2.03 -1.02 -3.02 116.55 123.95 1xck n ASP 224 Ca -0.16 -2.92 0.00 0.00 0.52 0.00 0.00 54.79 52.23 1xck n ASP 224 Cb 0.44 -1.74 0.00 0.00 -0.72 0.00 0.00 41.12 39.11 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 8.15 -1.53 -3.75 -0.67 2.85 -1.26 -3.85 118.16 118.09 1xck n LYS 225 Ca 0.48 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 57.38 1xck n LYS 225 Cb 0.46 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.77 1xck n LYS 225 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1xck s LYS 226 N -2.00 3.77 -0.29 -1.58 1.02 -1.26 -0.84 119.74 118.55 1xck s LYS 226 Ca 0.00 -0.05 -0.07 0.00 0.02 0.00 0.00 55.97 55.87 1xck s LYS 226 Cb 0.00 -3.27 0.01 0.00 -0.52 0.00 0.00 37.83 34.04 1xck s LYS 226 CO 0.00 0.60 0.09 0.42 -0.92 0.00 0.00 175.35 175.53 1xck s ILE 227 N -0.54 4.02 -0.07 2.17 1.01 -0.43 -4.93 121.20 122.43 1xck s ILE 227 Ca 0.15 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.17 1xck s ILE 227 Cb -0.13 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 1xck s ILE 227 CO 0.04 0.09 0.10 -1.20 0.00 0.00 0.00 174.94 173.96 1xck n SER 228 N 4.88 2.35 -3.90 3.58 7.64 -1.26 -0.23 113.62 126.68 1xck n SER 228 Ca -0.15 -0.27 -0.24 0.00 1.01 0.00 0.00 58.87 59.23 1xck n SER 228 Cb 0.48 1.08 -0.17 0.00 -1.01 0.00 0.00 64.21 64.59 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 -1.86 1.75 0.00 6.43 0.01 -1.26 -1.53 114.94 118.47 1xck s ASN 229 Ca -0.00 -0.22 0.04 0.00 -0.71 0.00 0.00 52.86 51.97 1xck s ASN 229 Cb 0.02 -0.68 0.26 0.00 0.41 0.00 0.00 41.25 41.26 1xck s ASN 229 CO 0.13 -0.10 0.62 0.00 -1.51 0.00 0.00 177.10 176.25 1xck n ILE 230 N 4.62 0.00 0.10 0.60 3.06 -1.26 -2.94 119.36 123.53 1xck n ILE 230 Ca -0.15 0.00 -0.03 0.00 -2.50 0.00 0.00 62.75 60.07 1xck n ILE 230 Cb 0.50 -0.58 0.20 0.00 0.54 0.00 0.00 39.64 40.30 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 0.00 0.21 0.00 9.51 2.43 -1.99 -2.29 114.38 122.25 1xck h ARG 231 Ca 0.00 -0.11 -0.11 0.00 -0.81 0.00 0.00 59.98 58.94 1xck h ARG 231 Cb 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1xck h ARG 231 CO 0.00 0.65 -0.55 0.93 -1.51 0.00 0.00 179.97 179.49 1xck h GLU 232 N 0.17 0.00 -0.07 0.20 5.08 -1.94 -3.31 114.58 114.71 1xck h GLU 232 Ca 0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 1xck h GLU 232 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1xck h GLU 232 CO 0.07 0.55 -0.17 0.52 -1.00 0.00 0.00 179.01 178.98 1xck h MET 233 N 0.00 0.24 -0.18 2.33 2.86 -1.67 -3.32 114.93 115.19 1xck h MET 233 Ca -0.01 -0.16 0.02 0.00 -2.06 0.00 0.00 59.70 57.49 1xck h MET 233 Cb 1.21 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.88 1xck h MET 233 CO 0.07 0.77 -0.11 1.28 1.06 0.00 0.00 176.91 179.98 1xck n LEU 234 N -4.58 -0.19 -0.18 1.22 4.77 -0.90 0.34 117.00 117.48 1xck n LEU 234 Ca -0.08 0.32 -0.02 0.00 -0.03 0.00 0.00 56.01 56.20 1xck n LEU 234 Cb 0.40 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.53 1xck n LEU 234 CO 0.39 -0.26 0.99 1.55 -1.33 0.00 0.00 177.39 178.73 1xck h PRO 235 N 0.00 0.41 -0.10 3.23 0.13 -1.83 -1.05 132.00 132.79 1xck h PRO 235 Ca 0.03 -0.02 -0.17 0.00 -0.87 0.00 0.00 66.00 64.97 1xck h PRO 235 Cb 0.07 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.10 1xck h PRO 235 CO -0.17 0.27 -0.65 0.28 -0.23 0.00 0.00 178.00 177.50 1xck h VAL 236 N 0.42 1.37 -0.01 1.56 2.07 -0.34 -2.87 116.25 118.46 1xck h VAL 236 Ca 0.27 -2.01 -0.08 0.00 0.82 0.00 0.00 66.70 65.70 1xck h VAL 236 Cb 0.28 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 1xck h VAL 236 CO -0.25 0.61 -0.38 -0.07 0.02 0.00 0.00 177.57 177.49 1xck h LEU 237 N 0.29 0.01 -0.07 2.57 3.38 -0.58 -2.36 115.31 118.55 1xck h LEU 237 Ca -0.01 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 1xck h LEU 237 Cb 1.20 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1xck h LEU 237 CO 0.11 0.39 -0.78 -0.33 0.09 0.00 0.00 178.44 177.92 1xck h GLU 238 N 0.01 0.00 -0.05 1.13 5.08 -1.16 -0.54 114.58 119.05 1xck h GLU 238 Ca -0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.22 1xck h GLU 238 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1xck h GLU 238 CO 0.05 0.78 -0.57 0.00 -1.00 0.00 0.00 179.01 178.27 1xck h ALA 239 N 1.22 0.95 0.00 3.43 0.00 -1.26 -2.54 119.26 121.06 1xck h ALA 239 Ca -0.01 -0.52 -0.19 0.00 0.00 0.00 0.00 54.91 54.19 1xck h ALA 239 Cb 1.57 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.25 1xck h ALA 239 CO 0.10 0.71 -0.97 0.28 0.00 0.00 0.00 179.25 179.38 1xck h VAL 240 N 0.12 1.32 -0.48 0.00 2.07 -1.34 -3.24 116.25 114.69 1xck h VAL 240 Ca -0.00 -2.94 -0.01 0.00 0.82 0.00 0.00 66.70 64.57 1xck h VAL 240 Cb 1.04 2.64 -0.02 0.00 -1.52 0.00 0.00 31.29 33.43 1xck h VAL 240 CO 0.08 0.75 0.25 0.00 0.02 0.00 0.00 177.57 178.67 1xck h ALA 241 N 1.16 0.62 -1.94 1.67 0.00 -0.82 -3.18 119.26 116.78 1xck h ALA 241 Ca -0.05 -0.11 -0.42 0.00 0.00 0.00 0.00 54.91 54.34 1xck h ALA 241 Cb 1.68 -0.19 0.19 0.00 0.00 0.00 0.00 17.79 19.47 1xck h ALA 241 CO 0.10 0.17 0.22 0.15 0.00 0.00 0.00 179.25 179.89 1xck s LYS 242 N -5.76 -0.94 0.00 0.00 1.02 -0.98 -2.84 119.74 110.24 1xck s LYS 242 Ca -0.13 -0.28 0.00 0.00 0.02 0.00 0.00 55.97 55.58 1xck s LYS 242 Cb 0.11 -1.65 0.00 0.00 -0.52 0.00 0.00 37.83 35.77 1xck s LYS 242 CO 0.76 -3.49 0.00 0.00 -0.92 0.00 0.00 175.35 171.70 1xck n ALA 243 N -4.55 0.00 -3.15 5.17 0.00 -1.26 -4.13 120.51 112.58 1xck n ALA 243 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.45 1xck n ALA 243 Cb 0.60 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.11 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 0.00 -0.17 3.35 0.00 0.00 -1.13 -5.05 105.19 102.19 1xck n GLY 244 Ca 0.00 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 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 -5.30 1.33 1.06 1.61 1.02 -1.21 -5.09 119.74 113.16 1xck s LYS 245 Ca 0.13 -1.45 -0.15 0.00 0.02 0.00 0.00 55.97 54.51 1xck s LYS 245 Cb -0.06 -1.42 0.22 0.00 -0.52 0.00 0.00 37.83 36.05 1xck s LYS 245 CO 0.55 0.29 1.13 -1.25 -0.92 0.00 0.00 175.35 175.15 1xck s PRO 246 N -2.85 -0.06 0.00 -1.68 0.04 -1.26 -4.77 135.00 124.42 1xck s PRO 246 Ca 0.18 0.16 0.00 0.00 0.04 0.00 0.00 61.00 61.38 1xck s PRO 246 Cb -0.06 -1.71 -0.00 0.00 0.04 0.00 0.00 34.50 32.77 1xck s PRO 246 CO 0.08 -2.98 -0.01 -1.17 0.04 0.00 0.00 177.00 172.96 1xck s LEU 247 N -6.51 2.01 -0.21 -3.56 2.96 0.07 -0.97 118.68 112.47 1xck s LEU 247 Ca 0.68 -0.03 -0.00 0.00 -0.22 0.00 0.00 54.13 54.56 1xck s LEU 247 Cb -0.13 -0.03 0.02 0.00 0.50 0.00 0.00 46.19 46.55 1xck s LEU 247 CO 0.56 -0.00 -0.13 -0.22 -1.32 0.00 0.00 176.35 175.23 1xck s LEU 248 N -0.06 2.62 -0.26 -0.68 2.96 0.35 -1.39 118.68 122.23 1xck s LEU 248 Ca -0.00 -0.72 -0.13 0.00 -0.22 0.00 0.00 54.13 53.05 1xck s LEU 248 Cb -0.01 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.07 1xck s LEU 248 CO -0.00 -0.05 0.29 -0.63 -1.32 0.00 0.00 176.35 174.64 1xck s ILE 249 N 1.31 5.24 -0.34 6.68 -1.09 0.74 -0.46 121.20 133.29 1xck s ILE 249 Ca 0.03 0.41 0.04 0.00 -2.23 0.00 0.00 60.65 58.90 1xck s ILE 249 Cb -0.15 -3.62 0.10 0.00 -1.58 0.00 0.00 42.46 37.21 1xck s ILE 249 CO -0.09 0.22 0.04 -0.63 -1.23 0.00 0.00 174.94 173.26 1xck s ILE 250 N 1.74 2.31 0.38 2.92 1.01 0.03 -0.96 121.20 128.62 1xck s ILE 250 Ca 0.12 -2.28 0.04 0.00 0.00 0.00 0.00 60.65 58.53 1xck s ILE 250 Cb -0.15 -2.68 -0.03 0.00 0.01 0.00 0.00 42.46 39.60 1xck s ILE 250 CO 0.09 -0.56 0.12 0.00 0.00 0.00 0.00 174.94 174.59 1xck s ALA 251 N 0.93 2.66 0.54 9.38 0.00 -1.11 -1.75 121.76 132.41 1xck s ALA 251 Ca 0.09 -1.48 0.24 0.00 0.00 0.00 0.00 51.96 50.81 1xck s ALA 251 Cb -0.19 0.79 1.42 0.00 0.00 0.00 0.00 23.12 25.13 1xck s ALA 251 CO -0.08 -0.36 2.06 1.49 0.00 0.00 0.00 175.76 178.87 1xck h GLU 252 N 1.92 0.00 0.00 0.00 4.81 -0.90 0.19 114.58 120.60 1xck h GLU 252 Ca -0.36 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1xck h GLU 252 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1xck h GLU 252 CO 0.59 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 175.40 1xck n ASP 253 N -4.30 0.00 -3.79 1.04 -0.08 -1.24 -4.49 116.55 103.69 1xck n ASP 253 Ca 0.05 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 53.04 1xck n ASP 253 Cb 0.42 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.71 1xck n ASP 253 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1xck s VAL 254 N -2.00 0.80 0.44 5.18 1.01 -1.26 -1.31 120.40 123.26 1xck s VAL 254 Ca 0.00 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.32 1xck s VAL 254 Cb 0.00 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 1xck s VAL 254 CO 0.00 -0.17 0.27 -1.61 0.00 0.00 0.00 175.10 173.59 1xck s GLU 255 N 1.73 2.32 0.00 2.72 2.02 0.68 -4.63 118.70 123.54 1xck s GLU 255 Ca -0.02 -1.81 0.00 0.00 0.02 0.00 0.00 54.97 53.16 1xck s GLU 255 Cb -0.17 -2.10 0.00 0.00 0.10 0.00 0.00 34.13 31.96 1xck s GLU 255 CO -0.07 -0.24 0.00 0.41 0.02 0.00 0.00 175.26 175.37 1xck n GLY 256 N -1.42 0.00 0.39 -1.39 0.00 -1.26 -1.63 105.19 99.88 1xck n GLY 256 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.32 0.08 1.61 0.00 -1.19 0.25 120.64 121.08 1xck n GLU 257 Ca 0.00 1.50 -0.12 0.00 0.00 0.00 0.00 57.16 58.54 1xck n GLU 257 Cb 0.00 -2.22 -0.05 0.00 0.00 0.00 0.00 31.44 29.17 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 0.97 -0.32 -0.01 4.31 0.00 -0.89 0.51 119.26 123.85 1xck h ALA 258 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1xck h ALA 258 Cb 0.51 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1xck h ALA 258 CO -0.95 -0.73 -0.01 1.25 0.00 0.00 0.00 179.25 178.81 1xck h LEU 259 N -0.37 -0.04 -0.20 0.00 5.85 -0.24 -0.93 115.31 119.39 1xck h LEU 259 Ca 0.04 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1xck h LEU 259 Cb 0.42 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.40 1xck h LEU 259 CO -0.16 -0.02 -0.52 0.00 -0.34 0.00 0.00 178.44 177.40 1xck h ALA 260 N 0.99 -0.79 -0.72 1.25 0.00 0.07 0.16 119.26 120.22 1xck h ALA 260 Ca 0.01 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.00 1xck h ALA 260 Cb 0.03 0.99 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 1xck h ALA 260 CO -0.02 -1.04 0.32 1.15 0.00 0.00 0.00 179.25 179.66 1xck h THR 261 N -0.52 0.76 -0.21 0.00 2.02 -0.69 -1.78 112.91 112.49 1xck h THR 261 Ca 0.06 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1xck h THR 261 Cb 0.65 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1xck h THR 261 CO -0.47 0.10 0.10 -0.07 0.37 0.00 0.00 175.52 175.55 1xck h LEU 262 N 0.52 0.28 -0.69 2.58 3.38 -0.05 -1.03 115.31 120.30 1xck h LEU 262 Ca 0.37 -0.13 0.11 0.00 0.09 0.00 0.00 57.88 58.33 1xck h LEU 262 Cb 0.48 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.08 1xck h LEU 262 CO -0.33 0.33 0.29 0.58 0.09 0.00 0.00 178.44 179.40 1xck h VAL 263 N 0.21 0.74 0.07 1.22 2.07 -0.03 -2.38 116.25 118.15 1xck h VAL 263 Ca 0.07 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1xck h VAL 263 Cb 0.12 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 1xck h VAL 263 CO -0.01 0.09 -0.04 0.58 0.02 0.00 0.00 177.57 178.21 1xck h VAL 264 N 0.47 0.00 -0.88 2.57 2.07 -1.07 -2.94 116.25 116.47 1xck h VAL 264 Ca 0.36 -0.04 0.18 0.00 0.82 0.00 0.00 66.70 68.03 1xck h VAL 264 Cb 0.48 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.08 1xck h VAL 264 CO -0.34 0.00 -0.20 0.78 0.02 0.00 0.00 177.57 177.83 1xck h ASN 265 N -0.14 -0.79 0.48 0.57 -0.26 -1.18 0.99 115.58 115.26 1xck h ASN 265 Ca -0.01 0.26 -0.02 0.00 -0.56 0.00 0.00 56.30 55.98 1xck h ASN 265 Cb 0.08 0.54 -0.00 0.00 -1.06 0.00 0.00 38.32 37.87 1xck h ASN 265 CO 0.02 -0.29 -0.08 0.71 -1.06 0.00 0.00 177.43 176.73 1xck h THR 266 N 0.00 0.32 -0.32 2.81 1.35 -1.52 -0.57 112.91 114.99 1xck h THR 266 Ca 0.43 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 1xck h THR 266 Cb 0.67 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 1xck h THR 266 CO -0.90 0.07 0.00 0.80 -0.25 0.00 0.00 175.52 175.24 1xck n MET 267 N -3.39 2.53 -0.33 4.72 0.00 0.34 -3.38 117.12 117.62 1xck n MET 267 Ca -0.01 -1.49 0.00 0.00 0.00 0.00 0.00 57.70 56.20 1xck n MET 267 Cb 0.23 -1.65 0.01 0.00 0.00 0.00 0.00 33.22 31.81 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 0.42 0.10 -0.59 2.12 1.74 -0.30 -4.98 116.66 115.17 1xck n ARG 268 Ca 0.13 -0.92 0.00 0.00 -0.77 0.00 0.00 57.85 56.29 1xck n ARG 268 Cb 0.57 -0.55 0.00 0.00 -1.02 0.00 0.00 32.46 31.46 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 -0.06 0.66 2.63 -0.13 0.00 -1.16 -4.87 105.19 102.26 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 3.48 -0.63 -0.61 5.41 -0.75 -4.65 119.36 119.61 1xck n ILE 270 Ca 0.00 -2.64 0.00 0.00 1.00 0.00 0.00 62.75 61.11 1xck n ILE 270 Cb 0.00 -2.55 0.00 0.00 -0.71 0.00 0.00 39.64 36.38 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 4.68 -1.98 -2.62 1.39 0.31 -1.26 -4.32 118.33 114.53 1xck n VAL 271 Ca 0.59 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 64.49 1xck n VAL 271 Cb 0.33 -2.24 -0.02 0.00 -0.91 0.00 0.00 33.84 30.99 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 -2.73 3.86 0.15 5.55 3.01 -1.26 -3.77 119.74 124.56 1xck s LYS 272 Ca 0.00 0.77 0.06 0.00 -1.01 0.00 0.00 55.97 55.79 1xck s LYS 272 Cb 0.00 -3.84 -0.04 0.00 -1.01 0.00 0.00 37.83 32.94 1xck s LYS 272 CO 0.00 -1.17 -0.14 0.08 0.51 0.00 0.00 175.35 174.63 1xck s VAL 273 N 4.10 1.44 -0.16 3.17 1.01 -1.26 -0.75 120.40 127.94 1xck s VAL 273 Ca 0.47 -1.94 -0.13 0.00 0.00 0.00 0.00 61.98 60.37 1xck s VAL 273 Cb -0.09 -1.76 0.05 0.00 0.00 0.00 0.00 36.38 34.57 1xck s VAL 273 CO 0.25 -0.53 0.42 0.00 0.00 0.00 0.00 175.10 175.23 1xck s ALA 274 N -2.62 -1.05 -0.01 5.51 0.00 -0.48 -4.89 121.76 118.21 1xck s ALA 274 Ca 0.15 1.29 0.06 0.00 0.00 0.00 0.00 51.96 53.46 1xck s ALA 274 Cb -0.02 -0.76 -0.01 0.00 0.00 0.00 0.00 23.12 22.32 1xck s ALA 274 CO 0.04 -0.22 -0.18 0.00 0.00 0.00 0.00 175.76 175.40 1xck s ALA 275 N 0.56 1.51 0.03 0.00 0.00 -1.26 -0.18 121.76 122.42 1xck s ALA 275 Ca -0.03 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.13 1xck s ALA 275 Cb -0.04 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 1xck s ALA 275 CO -0.03 0.37 -0.01 0.14 0.00 0.00 0.00 175.76 176.22 1xck s VAL 276 N -0.45 0.14 0.48 0.00 -7.23 -0.14 -1.19 120.40 112.01 1xck s VAL 276 Ca 0.07 -1.12 -0.22 0.00 -1.81 0.00 0.00 61.98 58.90 1xck s VAL 276 Cb -0.07 -0.61 -0.07 0.00 0.56 0.00 0.00 36.38 36.19 1xck s VAL 276 CO -0.01 -0.62 1.15 -0.54 -0.31 0.00 0.00 175.10 174.78 1xck s LYS 277 N -2.11 3.66 0.60 4.82 1.02 -1.26 -2.75 119.74 123.72 1xck s LYS 277 Ca -0.10 1.71 -0.18 0.00 0.02 0.00 0.00 55.97 57.41 1xck s LYS 277 Cb -0.05 -2.29 -0.03 0.00 -0.52 0.00 0.00 37.83 34.94 1xck s LYS 277 CO -0.03 -0.62 1.20 0.00 -0.92 0.00 0.00 175.35 174.98 1xck s ALA 278 N -1.63 2.51 0.59 5.17 0.00 0.67 -4.79 121.76 124.28 1xck s ALA 278 Ca 0.66 0.98 -0.17 0.00 0.00 0.00 0.00 51.96 53.42 1xck s ALA 278 Cb -0.27 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.37 1xck s ALA 278 CO 0.32 -1.21 1.11 -1.25 0.00 0.00 0.00 175.76 174.72 1xck s PRO 279 N -3.41 3.18 1.87 0.00 0.04 -1.26 -4.87 135.00 130.56 1xck s PRO 279 Ca 0.77 1.46 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1xck s PRO 279 Cb -0.30 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1xck s PRO 279 CO 0.34 -0.96 0.00 0.41 0.04 0.00 0.00 177.00 176.83 1xck n GLY 280 N -0.26 -1.02 2.87 0.56 0.00 -1.26 -4.51 105.19 101.57 1xck n GLY 280 Ca 0.11 -1.08 -0.15 0.00 0.00 0.00 0.00 46.02 44.90 1xck n GLY 280 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1xck n PHE 281 N -1.29 -1.05 -3.35 1.61 -1.74 -1.26 -4.81 117.46 105.58 1xck n PHE 281 Ca 0.00 -2.21 0.00 0.00 -0.56 0.00 0.00 57.45 54.68 1xck n PHE 281 Cb 0.00 0.38 0.00 0.00 1.52 0.00 0.00 39.48 41.38 1xck n PHE 281 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1xck n GLY 282 N -0.52 2.08 0.24 4.97 0.00 -1.26 -2.08 105.19 108.62 1xck n GLY 282 Ca 0.03 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.51 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 6.54 -0.46 0.00 1.61 3.32 -2.01 -2.78 116.42 122.63 1xck h ASP 283 Ca 0.00 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1xck h ASP 283 Cb 0.00 0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1xck h ASP 283 CO 0.00 -0.15 0.24 0.08 -1.72 0.00 0.00 179.24 177.70 1xck h ARG 284 N -0.79 0.00 -0.17 3.56 0.11 -1.98 0.42 114.38 115.53 1xck h ARG 284 Ca -0.06 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.84 1xck h ARG 284 Cb 0.54 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.61 1xck h ARG 284 CO 0.09 0.00 -0.63 -0.09 0.10 0.00 0.00 179.97 179.44 1xck h ARG 285 N 0.00 0.61 0.00 0.08 2.43 -1.12 -2.08 114.38 114.29 1xck h ARG 285 Ca 0.00 -0.43 -0.12 0.00 -0.81 0.00 0.00 59.98 58.62 1xck h ARG 285 Cb 0.49 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 1xck h ARG 285 CO 0.00 1.05 -0.57 0.87 -1.51 0.00 0.00 179.97 179.80 1xck h LYS 286 N 0.44 0.00 -0.10 0.20 1.57 -0.22 -2.27 116.57 116.19 1xck h LYS 286 Ca -0.01 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 1xck h LYS 286 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.52 1xck h LYS 286 CO 0.12 0.57 -0.14 0.00 -0.57 0.00 0.00 179.45 179.43 1xck h ALA 287 N 1.43 0.15 -0.18 3.86 0.00 -1.31 -3.00 119.26 120.21 1xck h ALA 287 Ca -0.01 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1xck h ALA 287 Cb 1.13 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1xck h ALA 287 CO 0.07 0.04 -0.24 0.52 0.00 0.00 0.00 179.25 179.65 1xck h MET 288 N -0.15 0.33 -0.56 0.00 2.86 -1.35 -1.00 114.93 115.06 1xck h MET 288 Ca 0.01 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1xck h MET 288 Cb 0.69 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 1xck h MET 288 CO 0.03 0.56 0.30 -0.07 1.06 0.00 0.00 176.91 178.79 1xck h LEU 289 N 0.30 0.68 -0.28 1.22 3.38 -1.40 -0.79 115.31 118.41 1xck h LEU 289 Ca 0.05 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 1xck h LEU 289 Cb 0.59 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1xck h LEU 289 CO 0.04 0.55 -0.33 -0.61 0.09 0.00 0.00 178.44 178.18 1xck h GLN 290 N 0.77 0.72 -0.41 1.13 5.75 -1.17 -1.41 115.11 120.49 1xck h GLN 290 Ca 0.20 -0.40 0.09 0.00 -0.15 0.00 0.00 58.65 58.38 1xck h GLN 290 Cb 0.03 0.02 -0.09 0.00 1.07 0.00 0.00 27.48 28.52 1xck h GLN 290 CO -0.03 1.02 -0.17 -0.44 -2.65 0.00 0.00 178.83 176.56 1xck h ASP 291 N 0.46 -0.59 -0.57 -0.69 3.32 -0.16 0.13 116.42 118.33 1xck h ASP 291 Ca 0.04 0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.23 1xck h ASP 291 Cb 0.91 0.34 -0.03 0.00 0.22 0.00 0.00 39.33 40.77 1xck h ASP 291 CO 0.08 -0.21 0.35 0.40 -1.72 0.00 0.00 179.24 178.14 1xck h ILE 292 N -0.09 1.17 0.16 0.35 2.04 -1.06 -1.01 117.51 119.08 1xck h ILE 292 Ca 0.20 -0.36 0.02 0.00 1.00 0.00 0.00 64.86 65.71 1xck h ILE 292 Cb 0.40 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 1xck h ILE 292 CO -0.47 0.17 -0.37 0.00 0.00 0.00 0.00 178.15 177.48 1xck h ALA 293 N 1.17 -0.67 -0.21 1.87 0.00 -0.06 0.10 119.26 121.47 1xck h ALA 293 Ca 0.20 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.10 1xck h ALA 293 Cb -0.03 0.60 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 1xck h ALA 293 CO -0.04 -0.93 -0.24 1.15 0.00 0.00 0.00 179.25 179.19 1xck h THR 294 N -0.63 0.41 -0.92 0.00 2.02 -0.54 0.26 112.91 113.51 1xck h THR 294 Ca 0.02 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.30 1xck h THR 294 Cb 0.64 0.41 -0.08 0.00 -1.74 0.00 0.00 68.15 67.38 1xck h THR 294 CO -0.19 0.00 0.56 0.25 0.37 0.00 0.00 175.52 176.52 1xck h LEU 295 N -0.26 0.84 -2.34 2.58 7.12 -0.73 -2.03 115.31 120.48 1xck h LEU 295 Ca 0.13 0.04 0.00 0.00 0.13 0.00 0.00 57.88 58.18 1xck h LEU 295 Cb 0.45 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 40.46 1xck h LEU 295 CO -0.36 0.47 0.00 0.35 -0.13 0.00 0.00 178.44 178.77 1xck n THR 296 N -4.65 0.78 -3.20 1.05 -2.24 0.32 -1.51 114.28 104.82 1xck n THR 296 Ca 0.16 -0.83 -0.23 0.00 -2.27 0.00 0.00 64.05 60.88 1xck n THR 296 Cb 0.29 0.54 0.04 0.00 -2.10 0.00 0.00 70.33 69.11 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 1.52 -0.53 0.34 3.38 0.00 0.63 -0.46 105.19 110.08 1xck n GLY 297 Ca 0.21 0.16 -0.02 0.00 0.00 0.00 0.00 46.02 46.37 1xck n GLY 297 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xck n GLY 298 N -1.60 2.96 2.90 -0.02 0.00 0.41 -4.60 105.19 105.24 1xck n GLY 298 Ca -0.07 -2.18 -0.20 0.00 0.00 0.00 0.00 46.02 43.56 1xck n GLY 298 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xck s THR 299 N -0.18 0.56 0.01 2.61 2.01 0.48 -4.51 115.64 116.62 1xck s THR 299 Ca 0.03 -0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.59 1xck s THR 299 Cb -0.00 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 1xck s THR 299 CO 0.02 0.23 1.16 -0.69 -0.69 0.00 0.00 174.62 174.65 1xck s VAL 300 N 0.91 4.27 -0.93 3.82 1.01 -1.26 -4.49 120.40 123.73 1xck s VAL 300 Ca -0.11 1.62 -0.13 0.00 0.00 0.00 0.00 61.98 63.36 1xck s VAL 300 Cb -0.14 -4.04 0.24 0.00 0.00 0.00 0.00 36.38 32.43 1xck s VAL 300 CO 0.00 0.08 0.89 -0.63 0.00 0.00 0.00 175.10 175.45 1xck s ILE 301 N 1.45 5.71 -0.13 2.22 1.01 -0.10 -4.96 121.20 126.41 1xck s ILE 301 Ca 0.56 -2.75 -0.12 0.00 0.00 0.00 0.00 60.65 58.34 1xck s ILE 301 Cb -0.26 -4.53 -0.05 0.00 0.01 0.00 0.00 42.46 37.63 1xck s ILE 301 CO 0.26 -1.10 0.26 -0.94 0.00 0.00 0.00 174.94 173.42 1xck s SER 302 N 1.94 6.46 0.24 3.58 1.04 -1.26 -2.45 113.70 123.25 1xck s SER 302 Ca 0.23 0.54 -0.05 0.00 0.48 0.00 0.00 55.95 57.15 1xck s SER 302 Cb -0.10 -2.16 0.25 0.00 0.10 0.00 0.00 66.02 64.11 1xck s SER 302 CO -0.09 0.22 1.76 -0.33 0.98 0.00 0.00 173.24 175.78 1xck h GLU 303 N 5.97 0.98 -0.69 4.02 5.08 -1.76 -2.67 114.58 125.50 1xck h GLU 303 Ca -0.46 -0.23 0.07 0.00 -1.00 0.00 0.00 59.36 57.74 1xck h GLU 303 Cb 1.19 -0.13 -0.10 0.00 0.50 0.00 0.00 28.75 30.21 1xck h GLU 303 CO 0.69 0.89 -0.53 0.93 -1.00 0.00 0.00 179.01 179.99 1xck h GLU 304 N 0.93 -0.14 0.00 2.33 5.08 -1.91 1.87 114.58 122.74 1xck h GLU 304 Ca 0.19 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1xck h GLU 304 Cb 0.37 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1xck h GLU 304 CO 0.00 -0.09 0.00 -0.89 -1.00 0.00 0.00 179.01 177.03 1xck n ILE 305 N -5.09 1.27 -1.16 3.13 5.41 -1.19 -4.81 119.36 116.92 1xck n ILE 305 Ca -0.00 0.32 0.00 0.00 1.00 0.00 0.00 62.75 64.06 1xck n ILE 305 Cb 0.27 -1.25 0.00 0.00 -0.71 0.00 0.00 39.64 37.95 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 -1.01 0.85 3.88 7.39 0.00 0.64 -5.07 105.19 111.86 1xck n GLY 306 Ca 0.02 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.58 3.74 -0.03 1.61 -1.94 -1.01 -5.00 119.30 114.09 1xck s MET 307 Ca 0.00 0.32 0.05 0.00 -1.71 0.00 0.00 55.69 54.35 1xck s MET 307 Cb 0.00 -2.48 -0.01 0.00 2.01 0.00 0.00 34.83 34.35 1xck s MET 307 CO 0.00 0.07 -0.18 -1.21 -0.01 0.00 0.00 175.02 173.68 1xck s GLU 308 N -3.67 1.75 0.52 2.03 2.02 -1.26 -4.36 118.70 115.73 1xck s GLU 308 Ca 0.49 -0.66 0.18 0.00 0.02 0.00 0.00 54.97 55.00 1xck s GLU 308 Cb -0.10 -1.57 1.31 0.00 0.10 0.00 0.00 34.13 33.86 1xck s GLU 308 CO 0.30 0.32 2.14 -0.07 0.02 0.00 0.00 175.26 177.96 1xck h LEU 309 N 6.02 0.00 -1.17 1.80 3.38 -1.93 -1.27 115.31 122.14 1xck h LEU 309 Ca -0.35 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.57 1xck h LEU 309 Cb 1.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 1xck h LEU 309 CO 0.48 0.03 0.02 -0.33 0.09 0.00 0.00 178.44 178.73 1xck h GLU 310 N 0.00 0.59 -0.60 1.13 3.07 -1.94 -2.00 114.58 114.83 1xck h GLU 310 Ca -0.00 -0.13 0.00 0.00 -0.50 0.00 0.00 59.36 58.73 1xck h GLU 310 Cb 0.06 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 1xck h GLU 310 CO 0.00 0.60 0.00 1.63 -1.40 0.00 0.00 179.01 179.85 1xck n LYS 311 N -4.27 2.31 -3.00 2.33 5.02 -0.49 -4.80 118.16 115.26 1xck n LYS 311 Ca 0.02 -1.30 -0.40 0.00 -2.02 0.00 0.00 58.31 54.61 1xck n LYS 311 Cb 0.25 -1.59 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 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 -1.69 3.34 0.27 7.82 0.00 -0.75 -4.97 121.76 125.78 1xck s ALA 312 Ca 0.23 0.16 0.08 0.00 0.00 0.00 0.00 51.96 52.43 1xck s ALA 312 Cb 0.15 -3.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 1xck s ALA 312 CO 0.10 -0.18 0.11 0.95 0.00 0.00 0.00 175.76 176.74 1xck s THR 313 N 0.98 3.88 0.60 0.00 -4.23 -1.26 -4.48 115.64 111.14 1xck s THR 313 Ca 0.39 -1.65 0.29 0.00 -1.18 0.00 0.00 61.69 59.54 1xck s THR 313 Cb -0.18 -3.12 0.39 0.00 1.34 0.00 0.00 72.50 70.93 1xck s THR 313 CO 0.18 -0.34 1.71 -0.07 -0.54 0.00 0.00 174.62 175.56 1xck h LEU 314 N 1.66 0.00 -0.23 4.79 3.38 -1.93 0.30 115.31 123.28 1xck h LEU 314 Ca -0.46 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.45 1xck h LEU 314 Cb 1.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1xck h LEU 314 CO 0.61 0.00 -0.28 -0.08 0.09 0.00 0.00 178.44 178.77 1xck h GLU 315 N 0.00 0.00 0.00 1.13 4.81 -2.00 -3.03 114.58 115.49 1xck h GLU 315 Ca 0.30 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.47 1xck h GLU 315 Cb 1.73 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.10 1xck h GLU 315 CO -0.00 0.28 -0.31 -0.44 -0.73 0.00 0.00 179.01 177.81 1xck h ASP 316 N 0.00 0.00 -4.02 1.04 3.32 -0.76 -3.43 116.42 112.57 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 1.13 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.77 1xck h ASP 316 CO 0.04 0.31 0.52 -0.76 -1.72 0.00 0.00 179.24 177.63 1xck s LEU 317 N -7.08 3.95 0.73 1.55 1.02 -1.15 0.18 118.68 117.88 1xck s LEU 317 Ca -0.00 2.45 -0.03 0.00 0.02 0.00 0.00 54.13 56.57 1xck s LEU 317 Cb 0.11 -4.26 0.12 0.00 0.02 0.00 0.00 46.19 42.18 1xck s LEU 317 CO 0.67 -1.14 1.01 -0.83 0.02 0.00 0.00 176.35 176.08 1xck s GLY 318 N -1.24 1.76 -0.18 -3.19 0.00 0.15 -4.31 107.32 100.31 1xck s GLY 318 Ca 0.66 -1.53 -0.25 0.00 0.00 0.00 0.00 44.72 43.60 1xck s GLY 318 CO 0.39 -0.99 0.66 1.62 0.00 0.00 0.00 173.10 174.78 1xck s GLN 319 N -5.21 0.86 0.01 2.90 0.74 0.39 -0.10 119.66 119.26 1xck s GLN 319 Ca 0.66 0.69 -0.20 0.00 0.05 0.00 0.00 55.36 56.56 1xck s GLN 319 Cb -0.06 0.41 0.04 0.00 1.10 0.00 0.00 33.01 34.50 1xck s GLN 319 CO 0.45 -0.16 0.45 0.00 -0.55 0.00 0.00 175.29 175.47 1xck s ALA 320 N -0.15 -1.13 0.58 1.58 0.00 -1.21 -1.29 121.76 120.14 1xck s ALA 320 Ca -0.04 0.54 0.28 0.00 0.00 0.00 0.00 51.96 52.74 1xck s ALA 320 Cb -0.03 0.22 1.73 0.00 0.00 0.00 0.00 23.12 25.03 1xck s ALA 320 CO 0.04 -0.40 2.20 0.87 0.00 0.00 0.00 175.76 178.47 1xck h LYS 321 N 3.20 0.00 -1.51 0.00 1.57 -1.03 -3.15 116.57 115.65 1xck h LYS 321 Ca -0.30 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.57 1xck h LYS 321 Cb 1.19 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.25 1xck h LYS 321 CO 0.41 0.00 0.58 0.50 -0.57 0.00 0.00 179.45 180.37 1xck s ARG 322 N -4.68 0.51 0.01 3.15 3.52 -0.93 -0.76 118.95 119.77 1xck s ARG 322 Ca -0.05 0.22 0.01 0.00 -0.13 0.00 0.00 55.73 55.78 1xck s ARG 322 Cb 0.15 0.24 -0.01 0.00 -1.56 0.00 0.00 34.95 33.78 1xck s ARG 322 CO 0.56 -0.14 -0.04 0.14 -0.81 0.00 0.00 175.30 175.01 1xck s VAL 323 N -0.81 0.30 -0.06 7.11 -7.23 -0.84 0.59 120.40 119.46 1xck s VAL 323 Ca 0.00 -0.50 0.02 0.00 -1.81 0.00 0.00 61.98 59.69 1xck s VAL 323 Cb -0.01 -0.32 0.02 0.00 0.56 0.00 0.00 36.38 36.62 1xck s VAL 323 CO -0.01 -0.14 -0.09 -0.69 -0.31 0.00 0.00 175.10 173.86 1xck s VAL 324 N -0.64 0.90 -0.10 1.32 1.01 -0.63 -2.09 120.40 120.18 1xck s VAL 324 Ca -0.05 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.63 1xck s VAL 324 Cb -0.05 -0.85 0.00 0.00 0.00 0.00 0.00 36.38 35.48 1xck s VAL 324 CO -0.00 0.30 -0.24 -0.63 0.00 0.00 0.00 175.10 174.54 1xck s ILE 325 N 0.76 2.02 0.00 2.22 1.01 -0.08 -1.02 121.20 126.11 1xck s ILE 325 Ca -0.13 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.52 1xck s ILE 325 Cb -0.15 -1.75 0.00 0.00 0.01 0.00 0.00 42.46 40.57 1xck s ILE 325 CO 0.02 0.55 0.00 0.59 0.00 0.00 0.00 174.94 176.10 1xck n ASN 326 N 3.52 0.00 0.08 3.58 3.02 0.30 -1.30 115.26 124.46 1xck n ASN 326 Ca -0.19 -0.53 -0.07 0.00 -0.03 0.00 0.00 54.58 53.76 1xck n ASN 326 Cb 0.53 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.76 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 0.26 0.00 3.52 3.64 -1.93 -2.08 116.57 119.98 1xck h LYS 327 Ca 0.00 -0.21 -0.12 0.00 -1.27 0.00 0.00 60.65 59.05 1xck h LYS 327 Cb 0.00 0.05 -0.25 0.00 -0.41 0.00 0.00 32.23 31.61 1xck h LYS 327 CO 0.00 0.87 -0.82 -0.40 -2.27 0.00 0.00 179.45 176.82 1xck n ASP 328 N -3.80 0.59 -3.75 4.20 5.68 -1.26 -3.82 116.55 114.39 1xck n ASP 328 Ca -0.03 -1.98 -0.12 0.00 -0.50 0.00 0.00 54.79 52.16 1xck n ASP 328 Cb 0.69 -0.24 -0.11 0.00 -1.14 0.00 0.00 41.12 40.32 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 0.00 -0.01 -0.12 2.12 2.01 -1.08 -3.00 115.64 115.56 1xck s THR 329 Ca 0.22 0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.28 1xck s THR 329 Cb 0.25 -0.44 0.02 0.00 0.01 0.00 0.00 72.50 72.33 1xck s THR 329 CO -0.11 0.02 -0.15 -0.89 -0.69 0.00 0.00 174.62 172.80 1xck s THR 330 N 0.58 1.55 -0.16 -0.82 2.01 -0.40 0.11 115.64 118.52 1xck s THR 330 Ca -0.03 -0.66 -0.00 0.00 0.31 0.00 0.00 61.69 61.31 1xck s THR 330 Cb -0.05 -1.43 0.04 0.00 0.01 0.00 0.00 72.50 71.07 1xck s THR 330 CO -0.03 0.45 -0.08 0.28 -0.69 0.00 0.00 174.62 174.55 1xck s THR 331 N 1.13 1.25 -0.30 -0.82 -1.32 -0.19 -1.45 115.64 113.95 1xck s THR 331 Ca -0.03 -0.63 -0.20 0.00 -1.21 0.00 0.00 61.69 59.61 1xck s THR 331 Cb -0.14 -1.34 -0.01 0.00 -1.51 0.00 0.00 72.50 69.50 1xck s THR 331 CO -0.04 0.23 0.64 -0.63 -2.21 0.00 0.00 174.62 172.61 1xck s ILE 332 N 1.58 4.93 -0.24 5.08 1.01 0.27 -1.60 121.20 132.24 1xck s ILE 332 Ca 0.02 0.90 -0.08 0.00 0.00 0.00 0.00 60.65 61.49 1xck s ILE 332 Cb -0.15 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 1xck s ILE 332 CO -0.08 -0.14 0.09 -0.63 0.00 0.00 0.00 174.94 174.18 1xck s ILE 333 N 2.63 4.60 -0.42 2.92 1.01 0.20 -1.82 121.20 130.31 1xck s ILE 333 Ca 0.26 -0.08 -0.13 0.00 0.00 0.00 0.00 60.65 60.70 1xck s ILE 333 Cb -0.15 -3.14 0.02 0.00 0.01 0.00 0.00 42.46 39.20 1xck s ILE 333 CO 0.12 0.35 0.56 -0.67 0.00 0.00 0.00 174.94 175.30 1xck n ASP 334 N 4.61 -7.48 -4.85 3.58 2.03 0.14 -2.19 116.55 112.39 1xck n ASP 334 Ca -0.16 0.44 -0.31 0.00 0.52 0.00 0.00 54.79 55.28 1xck n ASP 334 Cb 0.52 -5.05 0.01 0.00 -0.72 0.00 0.00 41.12 35.88 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 -2.53 1.73 0.19 0.27 0.00 0.09 -1.61 107.32 105.47 1xck s GLY 335 Ca 0.21 0.00 0.24 0.00 0.00 0.00 0.00 44.72 45.17 1xck s GLY 335 CO 0.71 0.28 1.39 -2.08 0.00 0.00 0.00 173.10 173.40 1xck h VAL 336 N -0.25 0.00 -1.78 1.40 2.07 -1.21 -3.45 116.25 113.03 1xck h VAL 336 Ca -0.44 -0.65 -0.66 0.00 0.82 0.00 0.00 66.70 65.77 1xck h VAL 336 Cb 1.20 1.35 0.09 0.00 -1.52 0.00 0.00 31.29 32.40 1xck h VAL 336 CO 0.61 0.00 0.08 0.61 0.02 0.00 0.00 177.57 178.89 1xck n GLY 337 N 1.27 -0.35 3.77 2.17 0.00 -0.57 -4.75 105.19 106.73 1xck n GLY 337 Ca 0.03 0.48 -0.40 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.66 4.06 0.32 1.61 0.41 -1.26 -4.80 118.70 118.38 1xck s GLU 338 Ca 0.71 2.34 0.05 0.00 -0.41 0.00 0.00 54.97 57.65 1xck s GLU 338 Cb -0.88 -2.88 0.68 0.00 -1.78 0.00 0.00 34.13 29.27 1xck s GLU 338 CO 0.55 -0.48 1.86 0.93 -0.49 0.00 0.00 175.26 177.63 1xck h GLU 339 N 2.89 0.83 0.01 1.61 5.08 -1.98 0.36 114.58 123.38 1xck h GLU 339 Ca -0.50 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 57.84 1xck h GLU 339 Cb 1.24 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 30.26 1xck h GLU 339 CO 0.63 0.55 -0.34 0.00 -1.00 0.00 0.00 179.01 178.85 1xck h ALA 340 N 1.57 -0.51 0.92 3.43 0.00 -1.97 0.54 119.26 123.22 1xck h ALA 340 Ca 0.46 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.30 1xck h ALA 340 Cb 0.56 0.60 0.01 0.00 0.00 0.00 0.00 17.79 18.95 1xck h ALA 340 CO -0.22 -0.86 -0.44 0.00 0.00 0.00 0.00 179.25 177.73 1xck h ALA 341 N 0.18 -1.30 -0.90 0.00 0.00 -1.47 -1.44 119.26 114.32 1xck h ALA 341 Ca 0.06 -0.27 0.17 0.00 0.00 0.00 0.00 54.91 54.87 1xck h ALA 341 Cb 0.58 0.48 -0.10 0.00 0.00 0.00 0.00 17.79 18.74 1xck h ALA 341 CO -0.27 -1.21 0.48 0.82 0.00 0.00 0.00 179.25 179.06 1xck h ILE 342 N -1.26 0.67 0.00 0.00 2.04 -0.93 0.53 117.51 118.57 1xck h ILE 342 Ca -0.13 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 1xck h ILE 342 Cb 0.94 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1xck h ILE 342 CO 0.21 0.11 -0.13 -0.61 0.00 0.00 0.00 178.15 177.73 1xck h GLN 343 N 0.61 0.00 0.00 2.37 5.75 0.18 -1.88 115.11 122.14 1xck h GLN 343 Ca 0.52 0.00 -0.21 0.00 -0.15 0.00 0.00 58.65 58.81 1xck h GLN 343 Cb 0.81 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.33 1xck h GLN 343 CO -0.40 0.13 -1.08 0.78 -2.65 0.00 0.00 178.83 175.60 1xck h GLY 344 N 2.74 0.00 0.81 2.39 0.00 0.16 -2.24 103.07 106.94 1xck h GLY 344 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1xck h GLY 344 CO 0.02 0.00 -0.20 -0.09 0.00 0.00 0.00 176.54 176.26 1xck h ARG 345 N 0.00 0.45 -0.86 4.80 9.65 -0.93 -0.61 114.38 126.88 1xck h ARG 345 Ca -0.07 -0.25 0.04 0.00 -1.10 0.00 0.00 59.98 58.60 1xck h ARG 345 Cb 1.76 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 30.30 1xck h ARG 345 CO 0.11 0.82 0.55 0.28 2.80 0.00 0.00 179.97 184.54 1xck h VAL 346 N 0.10 1.13 -0.56 0.20 2.07 -1.37 -1.42 116.25 116.40 1xck h VAL 346 Ca 0.03 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1xck h VAL 346 Cb 0.75 -0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 1xck h VAL 346 CO 0.05 0.20 0.37 0.00 0.02 0.00 0.00 177.57 178.20 1xck h ALA 347 N 1.36 0.71 0.40 1.67 0.00 -1.11 -0.80 119.26 121.50 1xck h ALA 347 Ca 0.35 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1xck h ALA 347 Cb 0.02 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1xck h ALA 347 CO -0.12 0.16 -0.23 1.96 0.00 0.00 0.00 179.25 181.01 1xck h GLN 348 N 0.76 -0.56 -0.86 0.00 4.20 -0.11 -2.47 115.11 116.07 1xck h GLN 348 Ca 0.21 0.04 0.21 0.00 0.06 0.00 0.00 58.65 59.17 1xck h GLN 348 Cb -0.08 0.13 -0.13 0.00 0.30 0.00 0.00 27.48 27.70 1xck h GLN 348 CO -0.04 -0.38 0.31 0.82 -0.67 0.00 0.00 178.83 178.87 1xck h ILE 349 N -0.58 0.44 0.00 2.54 2.04 -1.30 0.21 117.51 120.85 1xck h ILE 349 Ca -0.05 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1xck h ILE 349 Cb 0.46 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 1xck h ILE 349 CO 0.06 0.06 -0.08 -0.09 0.00 0.00 0.00 178.15 178.10 1xck h ARG 350 N 0.32 0.00 0.12 2.37 2.43 -1.04 -1.75 114.38 116.83 1xck h ARG 350 Ca 0.53 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 59.41 1xck h ARG 350 Cb 1.01 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.56 1xck h ARG 350 CO -0.56 0.08 -1.44 0.37 -1.51 0.00 0.00 179.97 176.92 1xck h GLN 351 N 0.00 0.25 0.00 0.20 4.15 -0.15 -3.20 115.11 116.37 1xck h GLN 351 Ca -0.00 -0.44 -0.00 0.00 0.77 0.00 0.00 58.65 58.98 1xck h GLN 351 Cb 0.16 0.16 -0.00 0.00 0.21 0.00 0.00 27.48 28.01 1xck h GLN 351 CO 0.01 1.14 -0.01 1.96 -1.93 0.00 0.00 178.83 180.00 1xck h GLN 352 N 0.07 0.00 0.00 1.69 4.20 -0.47 0.25 115.11 120.85 1xck h GLN 352 Ca -0.21 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.47 1xck h GLN 352 Cb 2.00 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.78 1xck h GLN 352 CO 0.18 0.01 -0.18 0.82 -0.67 0.00 0.00 178.83 178.99 1xck h ILE 353 N 0.00 0.41 0.28 2.54 2.04 -1.37 -1.03 117.51 120.38 1xck h ILE 353 Ca -0.00 -1.08 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 1xck h ILE 353 Cb 0.16 1.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 1xck h ILE 353 CO 0.00 0.18 -0.14 -0.33 0.00 0.00 0.00 178.15 177.86 1xck h GLU 354 N 0.00 -0.37 0.00 2.37 4.39 -0.63 -3.23 114.58 117.11 1xck h GLU 354 Ca -0.00 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1xck h GLU 354 Cb 0.78 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1xck h GLU 354 CO 0.02 -0.24 0.12 0.93 -1.16 0.00 0.00 179.01 178.68 1xck h GLU 355 N -1.01 0.00 -6.16 2.33 5.08 -1.44 -3.44 114.58 109.94 1xck h GLU 355 Ca -0.04 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.59 1xck h GLU 355 Cb 0.29 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.56 1xck h GLU 355 CO 0.06 0.00 0.92 0.00 -1.00 0.00 0.00 179.01 179.00 1xck n ALA 356 N -1.72 -0.08 -0.97 3.43 0.00 -0.40 -4.85 120.51 115.92 1xck n ALA 356 Ca -0.01 0.38 0.07 0.00 0.00 0.00 0.00 53.44 53.87 1xck n ALA 356 Cb 0.15 -2.25 0.33 0.00 0.00 0.00 0.00 19.45 17.68 1xck n ALA 356 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xck n THR 357 N 4.64 2.56 -3.67 0.00 -2.24 -1.26 -4.93 114.28 109.38 1xck n THR 357 Ca 0.26 -1.67 -0.10 0.00 -2.27 0.00 0.00 64.05 60.26 1xck n THR 357 Cb 0.15 -0.27 -0.09 0.00 -2.10 0.00 0.00 70.33 68.02 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 -1.38 -0.71 0.26 3.42 0.15 -1.26 -5.04 113.70 109.14 1xck s SER 358 Ca 0.49 1.22 -0.01 0.00 0.70 0.00 0.00 55.95 58.35 1xck s SER 358 Cb 0.38 1.14 0.49 0.00 -1.71 0.00 0.00 66.02 66.33 1xck s SER 358 CO 0.12 -0.21 1.81 0.44 1.20 0.00 0.00 173.24 176.60 1xck h ASP 359 N 6.43 0.77 0.41 5.45 3.32 -1.99 0.14 116.42 130.95 1xck h ASP 359 Ca -0.31 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.77 1xck h ASP 359 Cb 1.20 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.66 1xck h ASP 359 CO 0.19 0.41 -0.20 0.22 -1.72 0.00 0.00 179.24 178.14 1xck h TYR 360 N 0.86 -0.51 -0.89 4.55 3.20 -1.99 -1.19 116.97 121.00 1xck h TYR 360 Ca 0.46 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.37 1xck h TYR 360 Cb 0.47 0.17 -0.06 0.00 1.54 0.00 0.00 36.73 38.85 1xck h TYR 360 CO -0.04 -0.30 0.56 -0.44 -1.64 0.00 0.00 178.16 176.30 1xck h ASP 361 N -0.57 0.89 -0.28 -2.11 5.19 -1.83 -1.64 116.42 116.06 1xck h ASP 361 Ca -0.06 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 1xck h ASP 361 Cb 0.43 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.75 1xck h ASP 361 CO 0.09 0.58 0.18 -0.09 -3.12 0.00 0.00 179.24 176.88 1xck h ARG 362 N 1.03 0.38 -0.26 3.56 2.43 -0.77 -2.04 114.38 118.71 1xck h ARG 362 Ca 0.38 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1xck h ARG 362 Cb 0.14 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1xck h ARG 362 CO -0.16 0.27 0.17 0.93 -1.51 0.00 0.00 179.97 179.67 1xck h GLU 363 N 0.37 0.34 -0.87 0.20 5.08 -0.62 -0.79 114.58 118.29 1xck h GLU 363 Ca 0.10 -0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.52 1xck h GLU 363 Cb -0.01 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.09 1xck h GLU 363 CO -0.02 0.23 0.53 0.87 -1.00 0.00 0.00 179.01 179.62 1xck h LYS 364 N 0.35 0.91 -0.38 2.33 1.79 -1.15 -0.13 116.57 120.28 1xck h LYS 364 Ca 0.09 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.47 1xck h LYS 364 Cb -0.04 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.39 1xck h LYS 364 CO -0.02 0.60 0.08 -0.07 -1.08 0.00 0.00 179.45 178.96 1xck h LEU 365 N 0.94 0.59 -1.48 2.94 3.38 -0.97 -2.55 115.31 118.16 1xck h LEU 365 Ca 0.39 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 58.20 1xck h LEU 365 Cb 0.24 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1xck h LEU 365 CO -0.20 0.68 0.44 1.56 0.09 0.00 0.00 178.44 181.01 1xck h GLN 366 N 0.47 0.60 -0.00 1.13 4.20 0.07 -1.52 115.11 120.06 1xck h GLN 366 Ca 0.12 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1xck h GLN 366 Cb 0.33 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.97 1xck h GLN 366 CO 0.00 0.40 0.00 0.93 -0.67 0.00 0.00 178.83 179.49 1xck h GLU 367 N 0.62 0.00 0.02 1.46 5.08 -0.66 -2.30 114.58 118.79 1xck h GLU 367 Ca 0.30 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1xck h GLU 367 Cb 0.36 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1xck h GLU 367 CO -0.10 0.07 -0.01 0.00 -1.00 0.00 0.00 179.01 177.98 1xck h ARG 368 N -0.06 -0.02 -0.88 2.33 3.08 -1.05 -2.09 114.38 115.69 1xck h ARG 368 Ca 0.00 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.08 1xck h ARG 368 Cb 0.07 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 1xck h ARG 368 CO -0.00 0.07 0.58 -0.39 -1.07 0.00 0.00 179.97 179.16 1xck h VAL 369 N -0.11 1.16 -0.98 2.04 -1.51 -1.40 -0.94 116.25 114.51 1xck h VAL 369 Ca -0.00 -0.38 0.05 0.00 -1.23 0.00 0.00 66.70 65.14 1xck h VAL 369 Cb 0.10 -0.05 -0.06 0.00 -2.13 0.00 0.00 31.29 29.16 1xck h VAL 369 CO 0.00 0.20 0.64 0.00 -1.23 0.00 0.00 177.57 177.18 1xck h ALA 370 N 1.48 1.39 -0.04 5.19 0.00 -1.09 0.56 119.26 126.76 1xck h ALA 370 Ca 0.34 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1xck h ALA 370 Cb 0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1xck h ALA 370 CO -0.10 0.49 -0.04 0.87 0.00 0.00 0.00 179.25 180.48 1xck h LYS 371 N 1.20 0.09 0.43 0.00 1.57 -0.55 -0.13 116.57 119.18 1xck h LYS 371 Ca 0.40 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 59.11 1xck h LYS 371 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1xck h LYS 371 CO -0.14 0.55 -0.21 1.25 -0.57 0.00 0.00 179.45 180.34 1xck h LEU 372 N -0.37 -0.49 -0.91 2.94 5.85 -0.84 -3.08 115.31 118.43 1xck h LEU 372 Ca 0.01 -0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.56 1xck h LEU 372 Cb 0.54 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1xck h LEU 372 CO 0.01 -0.23 -0.31 0.00 -0.34 0.00 0.00 178.44 177.57 1xck h ALA 373 N -0.23 1.07 -0.39 1.25 0.00 0.01 -3.30 119.26 117.66 1xck h ALA 373 Ca -0.06 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1xck h ALA 373 Cb 0.52 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1xck h ALA 373 CO 0.10 0.57 0.22 0.78 0.00 0.00 0.00 179.25 180.92 1xck h GLY 374 N 1.06 0.58 0.00 0.00 0.00 -1.00 -3.49 103.07 100.22 1xck h GLY 374 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.12 1xck h GLY 374 CO 0.06 0.25 0.00 0.61 0.00 0.00 0.00 176.54 177.46 1xck n GLY 375 N -1.00 -1.92 2.82 4.60 0.00 -1.17 -4.90 105.19 103.63 1xck n GLY 375 Ca 0.00 -1.39 -0.21 0.00 0.00 0.00 0.00 46.02 44.43 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 0.39 0.29 1.61 1.01 -0.67 -4.27 120.40 118.76 1xck s VAL 376 Ca 0.00 0.03 -0.29 0.00 0.00 0.00 0.00 61.98 61.72 1xck s VAL 376 Cb 0.00 -0.49 -0.09 0.00 0.00 0.00 0.00 36.38 35.79 1xck s VAL 376 CO 0.00 0.22 1.06 0.00 0.00 0.00 0.00 175.10 176.39 1xck s ALA 377 N 1.40 3.34 -0.16 5.51 0.00 0.10 -1.80 121.76 130.15 1xck s ALA 377 Ca -0.04 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.74 1xck s ALA 377 Cb -0.13 -3.30 0.03 0.00 0.00 0.00 0.00 23.12 19.72 1xck s ALA 377 CO -0.03 -0.10 -0.11 0.08 0.00 0.00 0.00 175.76 175.60 1xck s VAL 378 N -1.26 1.49 -0.24 0.00 1.01 0.11 -0.03 120.40 121.48 1xck s VAL 378 Ca 0.46 -0.73 -0.10 0.00 0.00 0.00 0.00 61.98 61.62 1xck s VAL 378 Cb -0.29 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1xck s VAL 378 CO 0.37 0.31 0.13 -0.63 0.00 0.00 0.00 175.10 175.29 1xck s ILE 379 N 1.49 5.07 -0.30 2.22 1.01 0.55 -1.91 121.20 129.34 1xck s ILE 379 Ca 0.02 0.08 -0.06 0.00 0.00 0.00 0.00 60.65 60.70 1xck s ILE 379 Cb -0.14 -3.37 0.02 0.00 0.01 0.00 0.00 42.46 38.98 1xck s ILE 379 CO -0.09 0.34 0.07 -0.54 0.00 0.00 0.00 174.94 174.72 1xck s LYS 380 N 1.18 2.96 -0.37 2.79 1.02 -0.11 -0.54 119.74 126.68 1xck s LYS 380 Ca 0.06 -0.94 -0.26 0.00 0.02 0.00 0.00 55.97 54.85 1xck s LYS 380 Cb -0.14 -3.34 0.02 0.00 -0.52 0.00 0.00 37.83 33.84 1xck s LYS 380 CO 0.05 -0.48 0.95 0.08 -0.92 0.00 0.00 175.35 175.02 1xck s VAL 381 N 1.46 4.57 0.46 3.17 1.01 -0.84 -2.04 120.40 128.18 1xck s VAL 381 Ca 0.01 1.24 -0.02 0.00 0.00 0.00 0.00 61.98 63.21 1xck s VAL 381 Cb -0.18 -4.35 -0.01 0.00 0.00 0.00 0.00 36.38 31.84 1xck s VAL 381 CO 0.02 -0.55 0.71 -0.83 0.00 0.00 0.00 175.10 174.45 1xck s GLY 382 N 1.88 1.52 0.00 4.51 0.00 -1.22 -1.29 107.32 112.72 1xck s GLY 382 Ca 0.39 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 44.24 1xck s GLY 382 CO 0.19 -0.70 0.00 0.00 0.00 0.00 0.00 173.10 172.59 1xck n ALA 383 N -2.15 0.00 -1.82 3.20 0.00 -1.26 -4.33 120.51 114.14 1xck n ALA 383 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.45 1xck n ALA 383 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1xck n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xck n ALA 384 N -0.26 -3.13 0.00 0.00 0.00 -1.26 -4.69 120.51 111.17 1xck n ALA 384 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1xck n ALA 384 Cb 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.15 1xck n ALA 384 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xck n THR 385 N 0.16 0.00 -0.34 0.00 -2.24 -1.26 -4.75 114.28 105.84 1xck n THR 385 Ca 0.00 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 61.97 1xck n THR 385 Cb 0.01 0.00 0.41 0.00 -2.10 0.00 0.00 70.33 68.64 1xck n THR 385 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1xck h GLU 386 N 0.00 0.52 0.60 -0.78 4.81 -1.99 -2.13 114.58 115.61 1xck h GLU 386 Ca 0.00 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1xck h GLU 386 Cb 0.00 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.27 1xck h GLU 386 CO 0.00 0.34 -0.29 0.28 -0.73 0.00 0.00 179.01 178.61 1xck h VAL 387 N 0.53 0.41 -0.85 0.32 2.07 -1.99 0.15 116.25 116.89 1xck h VAL 387 Ca 0.66 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 68.21 1xck h VAL 387 Cb 1.31 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.45 1xck h VAL 387 CO -0.49 0.00 0.56 -0.33 0.02 0.00 0.00 177.57 177.33 1xck h GLU 388 N -0.82 0.99 0.24 1.57 5.08 -1.74 -0.35 114.58 119.55 1xck h GLU 388 Ca -0.08 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1xck h GLU 388 Cb 0.62 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1xck h GLU 388 CO 0.14 0.65 -0.11 1.98 -1.00 0.00 0.00 179.01 180.66 1xck h MET 389 N 1.02 -0.31 -0.85 2.33 4.05 -1.11 0.20 114.93 120.25 1xck h MET 389 Ca 0.35 0.02 0.01 0.00 -0.28 0.00 0.00 59.70 59.81 1xck h MET 389 Cb 0.11 0.07 -0.04 0.00 -0.80 0.00 0.00 31.60 30.93 1xck h MET 389 CO -0.11 -0.13 0.57 0.87 0.23 0.00 0.00 176.91 178.33 1xck h LYS 390 N -0.43 1.10 0.48 0.39 1.79 -0.20 -0.29 116.57 119.41 1xck h LYS 390 Ca -0.03 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 1xck h LYS 390 Cb 0.33 -0.25 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1xck h LYS 390 CO 0.05 0.73 -0.23 1.49 -1.08 0.00 0.00 179.45 180.41 1xck h GLU 391 N 1.14 -0.62 -1.01 3.15 4.22 -0.87 -2.67 114.58 117.92 1xck h GLU 391 Ca 0.32 0.04 0.04 0.00 0.08 0.00 0.00 59.36 59.84 1xck h GLU 391 Cb -0.10 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.23 1xck h GLU 391 CO -0.08 -0.33 0.66 -0.22 -2.18 0.00 0.00 179.01 176.87 1xck h LYS 392 N -0.87 1.24 -0.97 1.92 3.64 -0.79 -1.58 116.57 119.16 1xck h LYS 392 Ca -0.07 -0.07 0.10 0.00 -1.27 0.00 0.00 60.65 59.34 1xck h LYS 392 Cb 0.58 -0.28 -0.08 0.00 -0.41 0.00 0.00 32.23 32.04 1xck h LYS 392 CO 0.11 0.82 0.61 -0.22 -2.27 0.00 0.00 179.45 178.49 1xck h LYS 393 N 1.28 0.97 -0.35 1.90 3.64 -1.00 0.11 116.57 123.12 1xck h LYS 393 Ca 0.40 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.65 1xck h LYS 393 Cb 0.00 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 1xck h LYS 393 CO -0.13 0.64 -0.07 0.00 -2.27 0.00 0.00 179.45 177.63 1xck h ALA 394 N 1.50 0.48 -0.59 5.00 0.00 -0.95 -1.43 119.26 123.27 1xck h ALA 394 Ca 0.46 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1xck h ALA 394 Cb 0.39 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1xck h ALA 394 CO -0.24 0.31 0.24 0.00 0.00 0.00 0.00 179.25 179.56 1xck h ARG 395 N 0.45 0.85 -0.06 0.00 3.08 -0.71 -1.80 114.38 116.19 1xck h ARG 395 Ca 0.09 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1xck h ARG 395 Cb 0.57 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.46 1xck h ARG 395 CO 0.03 0.69 0.02 0.28 -1.07 0.00 0.00 179.97 179.92 1xck h VAL 396 N 0.84 1.19 -0.93 2.04 2.07 -0.62 -0.13 116.25 120.71 1xck h VAL 396 Ca 0.20 -0.58 0.10 0.00 0.82 0.00 0.00 66.70 67.24 1xck h VAL 396 Cb 0.15 1.46 -0.08 0.00 -1.52 0.00 0.00 31.29 31.31 1xck h VAL 396 CO -0.02 0.16 0.57 -0.33 0.02 0.00 0.00 177.57 177.98 1xck h GLU 397 N -0.12 0.93 0.40 1.57 5.08 -0.94 0.20 114.58 121.70 1xck h GLU 397 Ca 0.02 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1xck h GLU 397 Cb 0.24 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1xck h GLU 397 CO 0.00 0.62 -0.19 -0.44 -1.00 0.00 0.00 179.01 177.99 1xck h ASP 398 N 0.96 -0.45 -0.89 1.42 3.32 -1.15 -2.58 116.42 117.04 1xck h ASP 398 Ca 0.44 -0.12 0.16 0.00 0.02 0.00 0.00 57.03 57.53 1xck h ASP 398 Cb 0.37 0.12 -0.07 0.00 0.22 0.00 0.00 39.33 39.96 1xck h ASP 398 CO -0.24 -0.06 0.58 0.00 -1.72 0.00 0.00 179.24 177.80 1xck h ALA 399 N -0.55 1.95 -0.09 3.45 0.00 -0.77 -0.65 119.26 122.61 1xck h ALA 399 Ca -0.05 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1xck h ALA 399 Cb 0.55 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xck h ALA 399 CO 0.09 -0.21 0.05 1.25 0.00 0.00 0.00 179.25 180.42 1xck h LEU 400 N 0.59 0.11 -0.99 0.00 5.85 -0.54 0.90 115.31 121.24 1xck h LEU 400 Ca 0.46 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 59.02 1xck h LEU 400 Cb 0.87 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 1xck h LEU 400 CO -0.21 0.19 0.13 -0.74 -0.34 0.00 0.00 178.44 177.47 1xck h HIS 401 N 0.03 0.89 -0.12 1.25 2.76 -0.88 -0.91 115.15 118.17 1xck h HIS 401 Ca 0.03 -0.09 -0.02 0.00 -2.20 0.00 0.00 60.37 58.09 1xck h HIS 401 Cb 0.10 -0.26 -0.00 0.00 1.55 0.00 0.00 27.41 28.80 1xck h HIS 401 CO -0.04 0.75 -0.02 0.00 -1.30 0.00 0.00 177.93 177.32 1xck h ALA 402 N 1.31 0.17 -0.44 5.26 0.00 -0.87 -2.75 119.26 121.95 1xck h ALA 402 Ca 0.18 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1xck h ALA 402 Cb 0.31 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1xck h ALA 402 CO 0.00 -0.11 -0.04 1.15 0.00 0.00 0.00 179.25 180.25 1xck h THR 403 N -0.07 1.24 -0.12 0.00 2.02 -0.68 -0.36 112.91 114.94 1xck h THR 403 Ca 0.03 -1.04 0.04 0.00 0.77 0.00 0.00 66.41 66.21 1xck h THR 403 Cb 0.42 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 67.74 1xck h THR 403 CO 0.01 0.36 -0.14 -0.09 0.37 0.00 0.00 175.52 176.03 1xck h ARG 404 N 0.69 -0.16 -0.70 6.66 1.12 -1.12 0.96 114.38 121.83 1xck h ARG 404 Ca 0.13 0.01 -0.04 0.00 -1.11 0.00 0.00 59.98 58.97 1xck h ARG 404 Cb 0.49 0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 30.45 1xck h ARG 404 CO 0.02 -0.11 0.27 0.00 -3.11 0.00 0.00 179.97 177.05 1xck h ALA 405 N 0.89 0.91 -0.72 2.80 0.00 -1.17 -2.48 119.26 119.49 1xck h ALA 405 Ca 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xck h ALA 405 Cb 0.30 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1xck h ALA 405 CO -0.22 0.53 0.43 0.00 0.00 0.00 0.00 179.25 180.00 1xck h ALA 406 N 1.12 0.92 -0.10 0.00 0.00 -0.40 -1.73 119.26 119.07 1xck h ALA 406 Ca 0.23 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1xck h ALA 406 Cb 0.22 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1xck h ALA 406 CO -0.02 0.38 -0.19 0.28 0.00 0.00 0.00 179.25 179.71 1xck h VAL 407 N 0.98 1.19 0.10 0.00 2.07 -0.58 0.33 116.25 120.34 1xck h VAL 407 Ca 0.26 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 1xck h VAL 407 Cb -0.04 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1xck h VAL 407 CO -0.05 0.26 -0.05 -0.33 0.02 0.00 0.00 177.57 177.42 1xck h GLU 408 N 0.15 -0.14 0.00 1.57 5.08 -0.89 -3.41 114.58 116.96 1xck h GLU 408 Ca 0.03 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1xck h GLU 408 Cb 0.42 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1xck h GLU 408 CO 0.03 0.37 -0.11 0.39 -1.00 0.00 0.00 179.01 178.69 1xck n GLU 409 N -4.87 1.23 0.00 2.33 1.02 -0.77 -5.09 120.64 114.49 1xck n GLU 409 Ca -0.08 -1.73 0.00 0.00 -0.02 0.00 0.00 57.16 55.33 1xck n GLU 409 Cb 0.28 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 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 -0.73 -1.96 3.24 0.62 0.00 0.11 -4.44 105.19 102.04 1xck n GLY 410 Ca 0.07 -1.39 -0.18 0.00 0.00 0.00 0.00 46.02 44.52 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 1.32 0.18 1.61 -7.23 0.08 -0.84 120.40 115.51 1xck s VAL 411 Ca 0.00 -1.68 0.01 0.00 -1.81 0.00 0.00 61.98 58.50 1xck s VAL 411 Cb 0.00 -1.49 -0.04 0.00 0.56 0.00 0.00 36.38 35.41 1xck s VAL 411 CO 0.00 -0.39 0.05 0.68 -0.31 0.00 0.00 175.10 175.13 1xck s VAL 412 N -2.04 0.40 0.25 1.32 -7.23 -0.63 -0.62 120.40 111.85 1xck s VAL 412 Ca 0.08 -1.96 -0.31 0.00 -1.81 0.00 0.00 61.98 57.98 1xck s VAL 412 Cb -0.05 -2.23 -0.13 0.00 0.56 0.00 0.00 36.38 34.52 1xck s VAL 412 CO 0.03 -0.34 1.37 0.00 -0.31 0.00 0.00 175.10 175.86 1xck n ALA 413 N -0.24 1.02 -1.66 1.32 0.00 -1.26 -1.29 120.51 118.41 1xck n ALA 413 Ca -0.04 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1xck n ALA 413 Cb 0.64 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 1.97 1.22 2.42 0.00 0.00 0.62 -3.05 105.19 108.37 1xck n GLY 414 Ca 0.11 -1.85 -0.19 0.00 0.00 0.00 0.00 46.02 44.10 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 0.30 2.80 -0.02 0.00 -1.26 -1.58 105.19 110.43 1xck n GLY 415 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.75 0.50 0.08 -0.02 0.00 -1.26 -4.44 105.19 99.30 1xck n GLY 416 Ca -0.21 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 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 1.64 -0.53 1.61 -1.51 -1.49 -3.12 116.25 112.85 1xck h VAL 417 Ca 0.00 -3.27 0.04 0.00 -1.23 0.00 0.00 66.70 62.24 1xck h VAL 417 Cb 0.17 2.86 -0.04 0.00 -2.13 0.00 0.00 31.29 32.14 1xck h VAL 417 CO 0.00 0.94 0.28 0.00 -1.23 0.00 0.00 177.57 177.56 1xck h ALA 418 N 0.88 0.69 -0.74 5.19 0.00 -1.73 0.34 119.26 123.89 1xck h ALA 418 Ca -0.05 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1xck h ALA 418 Cb 1.81 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.48 1xck h ALA 418 CO 0.15 -0.06 0.32 -0.07 0.00 0.00 0.00 179.25 179.59 1xck h LEU 419 N 0.54 0.98 -0.28 0.00 3.38 -1.85 -0.07 115.31 118.01 1xck h LEU 419 Ca 0.23 -0.13 -0.21 0.00 0.09 0.00 0.00 57.88 57.87 1xck h LEU 419 Cb 0.13 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1xck h LEU 419 CO -0.16 0.86 -0.83 -0.29 0.09 0.00 0.00 178.44 178.11 1xck h ILE 420 N 1.06 1.38 0.07 1.22 2.10 -1.30 -1.91 117.51 120.14 1xck h ILE 420 Ca 0.25 -2.27 -0.00 0.00 1.08 0.00 0.00 64.86 63.92 1xck h ILE 420 Cb 0.16 2.24 0.00 0.00 -1.09 0.00 0.00 36.82 38.13 1xck h ILE 420 CO -0.03 0.68 -0.03 -0.09 -1.08 0.00 0.00 178.15 177.60 1xck h ARG 421 N 0.27 -0.09 -0.67 2.19 9.65 0.02 -1.26 114.38 124.49 1xck h ARG 421 Ca -0.05 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.83 1xck h ARG 421 Cb 1.43 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 30.00 1xck h ARG 421 CO 0.14 0.07 0.39 0.28 2.80 0.00 0.00 179.97 183.65 1xck h VAL 422 N -0.23 1.19 -0.41 0.20 2.07 -1.04 -2.41 116.25 115.62 1xck h VAL 422 Ca -0.01 -0.44 -0.08 0.00 0.82 0.00 0.00 66.70 66.99 1xck h VAL 422 Cb 0.20 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1xck h VAL 422 CO 0.02 0.21 -0.05 0.00 0.02 0.00 0.00 177.57 177.76 1xck h ALA 423 N 1.51 0.56 -0.01 1.67 0.00 -1.05 -2.72 119.26 119.21 1xck h ALA 423 Ca 0.24 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1xck h ALA 423 Cb -0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1xck h ALA 423 CO -0.04 0.39 0.01 0.66 0.00 0.00 0.00 179.25 180.27 1xck h SER 424 N 0.58 0.00 0.97 0.00 4.64 -0.74 -1.13 113.55 117.86 1xck h SER 424 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1xck h SER 424 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1xck h SER 424 CO 0.03 0.00 -0.15 0.29 -0.87 0.00 0.00 176.83 176.13 1xck n LYS 425 N -3.68 0.07 -0.78 4.77 5.02 -1.03 -3.90 118.16 118.62 1xck n LYS 425 Ca -0.03 0.04 -0.01 0.00 -2.02 0.00 0.00 58.31 56.30 1xck n LYS 425 Cb 0.09 -1.56 0.27 0.00 -0.02 0.00 0.00 35.03 33.81 1xck n LYS 425 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1xck n LEU 426 N -1.67 4.93 -0.31 -0.35 4.77 -0.43 -4.72 117.00 119.22 1xck n LEU 426 Ca 0.06 -3.28 0.08 0.00 -0.03 0.00 0.00 56.01 52.85 1xck n LEU 426 Cb 0.36 -0.66 0.30 0.00 -2.33 0.00 0.00 43.42 41.09 1xck n LEU 426 CO 0.30 0.86 1.23 0.00 -1.33 0.00 0.00 177.39 178.45 1xck h ALA 427 N 2.01 1.64 -0.01 -1.18 0.00 -1.68 -1.71 119.26 118.33 1xck h ALA 427 Ca 0.17 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1xck h ALA 427 Cb 1.89 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.50 1xck h ALA 427 CO 0.49 0.13 -0.05 -0.25 0.00 0.00 0.00 179.25 179.57 1xck n ASP 428 N -4.57 0.90 -4.72 0.00 8.00 -1.26 -4.90 116.55 109.99 1xck n ASP 428 Ca 0.17 -1.12 -0.42 0.00 0.71 0.00 0.00 54.79 54.13 1xck n ASP 428 Cb 0.37 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.44 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 -2.16 4.37 0.19 0.64 2.96 -0.65 -4.99 118.68 119.04 1xck s LEU 429 Ca 0.37 2.84 0.01 0.00 -0.22 0.00 0.00 54.13 57.13 1xck s LEU 429 Cb 0.21 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.25 1xck s LEU 429 CO 0.39 -0.95 0.04 -0.13 -1.32 0.00 0.00 176.35 174.39 1xck s ARG 430 N 1.01 1.17 0.00 1.98 1.81 -1.26 -4.97 118.95 118.70 1xck s ARG 430 Ca 0.73 -1.59 0.00 0.00 -1.72 0.00 0.00 55.73 53.15 1xck s ARG 430 Cb -0.49 -0.18 0.00 0.00 -0.45 0.00 0.00 34.95 33.83 1xck s ARG 430 CO 0.33 -0.20 0.00 0.41 -0.68 0.00 0.00 175.30 175.16 1xck n GLY 431 N -0.29 5.27 0.16 -3.53 0.00 -1.26 -5.01 105.19 100.54 1xck n GLY 431 Ca -0.04 -1.90 0.13 0.00 0.00 0.00 0.00 46.02 44.20 1xck n GLY 431 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xck n GLN 432 N 0.00 0.54 -3.76 1.61 6.02 -1.26 -4.91 117.38 115.62 1xck n GLN 432 Ca 0.00 -0.33 -0.05 0.00 -0.01 0.00 0.00 57.00 56.62 1xck n GLN 432 Cb 0.00 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 29.75 1xck n GLN 432 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1xck s ASN 433 N -2.68 -0.21 0.48 1.08 2.20 -1.26 -5.02 114.94 109.53 1xck s ASN 433 Ca 0.19 -0.43 0.15 0.00 -0.94 0.00 0.00 52.86 51.83 1xck s ASN 433 Cb 0.19 0.55 1.16 0.00 -2.00 0.00 0.00 41.25 41.14 1xck s ASN 433 CO 0.59 -1.01 2.07 -0.08 -2.94 0.00 0.00 177.10 175.73 1xck h GLU 434 N 2.00 0.19 -0.45 3.55 4.57 -1.99 -0.96 114.58 121.49 1xck h GLU 434 Ca -0.23 -0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 57.86 1xck h GLU 434 Cb 1.24 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.77 1xck h GLU 434 CO 0.25 0.13 -0.01 -0.44 -1.18 0.00 0.00 179.01 177.76 1xck h ASP 435 N 0.20 0.80 -0.06 1.04 3.32 -1.95 -1.51 116.42 118.25 1xck h ASP 435 Ca 0.12 -0.31 -0.10 0.00 0.02 0.00 0.00 57.03 56.76 1xck h ASP 435 Cb 0.25 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1xck h ASP 435 CO -0.02 0.92 -0.28 1.56 -1.72 0.00 0.00 179.24 179.69 1xck h GLN 436 N 0.65 0.51 -0.48 3.56 4.20 -1.45 -1.80 115.11 120.31 1xck h GLN 436 Ca 0.13 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 1xck h GLN 436 Cb 0.52 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1xck h GLN 436 CO 0.03 0.74 0.13 -0.91 -0.67 0.00 0.00 178.83 178.15 1xck h ASN 437 N 0.44 0.66 -0.28 1.46 2.35 -0.89 -0.21 115.58 119.11 1xck h ASN 437 Ca 0.06 -0.10 -0.11 0.00 -0.55 0.00 0.00 56.30 55.60 1xck h ASN 437 Cb 0.72 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.92 1xck h ASN 437 CO 0.06 0.64 -0.25 0.58 -1.65 0.00 0.00 177.43 176.81 1xck h VAL 438 N 0.69 1.30 -0.85 2.81 2.07 -1.00 -2.03 116.25 119.24 1xck h VAL 438 Ca 0.16 -1.40 0.09 0.00 0.82 0.00 0.00 66.70 66.36 1xck h VAL 438 Cb 0.24 1.59 -0.07 0.00 -1.52 0.00 0.00 31.29 31.53 1xck h VAL 438 CO -0.00 0.45 0.51 1.23 0.02 0.00 0.00 177.57 179.77 1xck h GLY 439 N 0.39 1.32 0.94 2.17 0.00 -0.66 0.36 103.07 107.60 1xck h GLY 439 Ca 0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 1xck h GLY 439 CO 0.06 0.17 0.13 -2.22 0.00 0.00 0.00 176.54 174.68 1xck h ILE 440 N 0.86 1.13 -0.25 2.60 2.04 -0.83 -1.80 117.51 121.25 1xck h ILE 440 Ca 0.40 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.86 1xck h ILE 440 Cb 0.33 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1xck h ILE 440 CO -0.23 0.12 -0.11 0.11 0.00 0.00 0.00 178.15 178.04 1xck h LYS 441 N 0.29 0.42 -0.55 2.37 1.79 -0.51 -0.50 116.57 119.87 1xck h LYS 441 Ca 0.09 -0.11 -0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1xck h LYS 441 Cb 0.08 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.65 1xck h LYS 441 CO -0.01 0.54 0.34 0.28 -1.08 0.00 0.00 179.45 179.51 1xck h VAL 442 N 0.39 1.16 -0.22 0.50 2.07 0.12 -0.15 116.25 120.12 1xck h VAL 442 Ca 0.08 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 1xck h VAL 442 Cb 0.44 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1xck h VAL 442 CO 0.02 0.16 -0.06 0.00 0.02 0.00 0.00 177.57 177.72 1xck h ALA 443 N 1.17 0.30 -0.91 1.67 0.00 -0.77 -1.36 119.26 119.37 1xck h ALA 443 Ca 0.20 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xck h ALA 443 Cb -0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1xck h ALA 443 CO -0.04 0.09 0.54 -0.07 0.00 0.00 0.00 179.25 179.77 1xck h LEU 444 N 0.15 1.10 -0.24 0.00 3.38 -0.92 -1.79 115.31 116.99 1xck h LEU 444 Ca 0.05 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1xck h LEU 444 Cb 0.52 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1xck h LEU 444 CO 0.02 0.85 0.03 0.03 0.09 0.00 0.00 178.44 179.46 1xck h ARG 445 N 1.26 0.40 -0.75 1.13 3.08 -0.94 -2.94 114.38 115.61 1xck h ARG 445 Ca 0.32 -0.11 0.14 0.00 0.07 0.00 0.00 59.98 60.40 1xck h ARG 445 Cb -0.04 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 29.92 1xck h ARG 445 CO -0.06 0.54 0.50 0.00 -1.07 0.00 0.00 179.97 179.88 1xck h ALA 446 N 0.84 2.03 0.00 0.04 0.00 -0.74 -1.00 119.26 120.43 1xck h ALA 446 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1xck h ALA 446 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1xck h ALA 446 CO 0.01 -0.23 0.00 -1.33 0.00 0.00 0.00 179.25 177.70 1xck n MET 447 N -4.49 0.02 0.03 0.00 2.81 -0.72 -0.74 117.12 114.03 1xck n MET 447 Ca 0.14 0.37 0.11 0.00 -1.81 0.00 0.00 57.70 56.51 1xck n MET 447 Cb 0.48 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.52 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 -1.43 0.30 -0.06 0.03 1.02 -0.38 -3.77 120.64 116.35 1xck n GLU 448 Ca 0.01 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.03 1xck n GLU 448 Cb 0.04 -1.60 -0.07 0.00 -0.02 0.00 0.00 31.44 29.80 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 2.52 -0.60 -0.15 0.62 0.00 -1.05 -1.58 119.26 119.02 1xck h ALA 449 Ca 0.00 0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1xck h ALA 449 Cb 0.74 0.90 -0.07 0.00 0.00 0.00 0.00 17.79 19.36 1xck h ALA 449 CO 0.00 -0.94 -0.44 -1.35 0.00 0.00 0.00 179.25 176.51 1xck h PRO 450 N -0.44 -0.48 0.12 0.00 0.11 -1.79 0.59 132.00 130.12 1xck h PRO 450 Ca 0.09 0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.25 1xck h PRO 450 Cb 0.62 0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.82 1xck h PRO 450 CO -0.49 -0.32 -0.17 1.25 -0.21 0.00 0.00 178.00 178.05 1xck h LEU 451 N -0.50 -0.48 -0.70 2.35 6.46 -1.71 -0.49 115.31 120.24 1xck h LEU 451 Ca 0.07 0.05 0.13 0.00 -0.12 0.00 0.00 57.88 58.02 1xck h LEU 451 Cb 0.63 0.18 -0.09 0.00 -0.73 0.00 0.00 40.66 40.65 1xck h LEU 451 CO -0.42 -0.26 0.22 0.03 -0.62 0.00 0.00 178.44 177.39 1xck h ARG 452 N -0.35 0.34 -0.23 1.25 3.08 -0.97 0.12 114.38 117.61 1xck h ARG 452 Ca 0.02 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1xck h ARG 452 Cb 0.36 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1xck h ARG 452 CO -0.08 0.22 0.12 0.37 -1.07 0.00 0.00 179.97 179.53 1xck h GLN 453 N 0.35 0.33 -0.20 0.04 5.75 -0.34 0.19 115.11 121.22 1xck h GLN 453 Ca 0.38 -0.04 0.04 0.00 -0.15 0.00 0.00 58.65 58.88 1xck h GLN 453 Cb 0.58 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.03 1xck h GLN 453 CO -0.42 0.32 -0.08 0.82 -2.65 0.00 0.00 178.83 176.82 1xck h ILE 454 N 0.25 0.73 -0.97 2.39 2.04 0.00 0.15 117.51 122.11 1xck h ILE 454 Ca 0.08 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.96 1xck h ILE 454 Cb 0.10 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 1xck h ILE 454 CO -0.01 0.00 0.64 0.58 0.00 0.00 0.00 178.15 179.36 1xck h VAL 455 N -0.04 1.21 -0.19 1.67 2.07 -0.51 -2.26 116.25 118.21 1xck h VAL 455 Ca 0.10 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 1xck h VAL 455 Cb 0.20 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 29.78 1xck h VAL 455 CO -0.23 0.23 0.11 0.25 0.02 0.00 0.00 177.57 177.95 1xck h LEU 456 N 1.28 0.23 -2.56 2.57 5.85 0.42 -1.42 115.31 121.67 1xck h LEU 456 Ca 0.37 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.04 1xck h LEU 456 Cb -0.08 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 1xck h LEU 456 CO -0.10 0.21 0.01 0.78 -0.34 0.00 0.00 178.44 179.01 1xck h ASN 457 N 0.22 0.00 0.69 1.25 2.35 -0.27 0.13 115.58 119.94 1xck h ASN 457 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1xck h ASN 457 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.40 1xck h ASN 457 CO -0.01 0.00 -0.18 0.00 -1.65 0.00 0.00 177.43 175.59 1xck n GLY 459 N 1.44 0.46 3.82 0.00 0.00 0.44 -5.06 105.19 106.29 1xck n GLY 459 Ca 0.09 -0.93 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.47 2.44 -0.51 1.61 0.41 -0.88 -5.04 118.70 114.27 1xck s GLU 460 Ca 0.00 -1.61 -0.27 0.00 -0.41 0.00 0.00 54.97 52.68 1xck s GLU 460 Cb 0.00 -2.24 0.03 0.00 -1.78 0.00 0.00 34.13 30.14 1xck s GLU 460 CO 0.00 -0.11 1.06 -1.21 -0.49 0.00 0.00 175.26 174.51 1xck s GLU 461 N -4.02 3.57 0.16 1.61 2.02 -1.26 -4.30 118.70 116.48 1xck s GLU 461 Ca 0.44 0.26 -0.21 0.00 0.02 0.00 0.00 54.97 55.49 1xck s GLU 461 Cb -0.01 -3.96 0.07 0.00 0.10 0.00 0.00 34.13 30.33 1xck s GLU 461 CO 0.26 -1.41 1.63 -1.35 0.02 0.00 0.00 175.26 174.40 1xck h PRO 462 N 9.27 -0.17 -0.46 0.39 0.11 -1.87 -1.79 132.00 137.47 1xck h PRO 462 Ca -0.24 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.94 1xck h PRO 462 Cb 1.07 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1xck h PRO 462 CO 1.11 -0.12 0.31 0.66 -0.21 0.00 0.00 178.00 179.75 1xck h SER 463 N -0.18 0.33 0.14 -2.05 4.64 -1.94 0.36 113.55 114.85 1xck h SER 463 Ca 0.17 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 1xck h SER 463 Cb 0.45 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1xck h SER 463 CO -0.46 0.22 -0.07 0.58 -0.87 0.00 0.00 176.83 176.23 1xck h VAL 464 N 0.38 1.00 -0.30 0.95 2.07 -1.75 -1.28 116.25 117.32 1xck h VAL 464 Ca 0.20 -1.09 0.01 0.00 0.82 0.00 0.00 66.70 66.64 1xck h VAL 464 Cb 0.32 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1xck h VAL 464 CO -0.05 0.24 0.18 0.58 0.02 0.00 0.00 177.57 178.54 1xck h VAL 465 N -0.75 1.05 -0.34 2.57 2.07 -1.09 -1.01 116.25 118.75 1xck h VAL 465 Ca -0.02 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.44 1xck h VAL 465 Cb 0.53 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 1xck h VAL 465 CO 0.03 0.07 -0.05 0.00 0.02 0.00 0.00 177.57 177.64 1xck h ALA 466 N 1.12 0.26 -0.47 1.67 0.00 -0.35 -0.43 119.26 121.06 1xck h ALA 466 Ca 0.11 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.18 1xck h ALA 466 Cb -0.02 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1xck h ALA 466 CO -0.04 -0.44 0.25 -0.97 0.00 0.00 0.00 179.25 178.04 1xck h ASN 467 N 0.03 0.37 0.04 0.00 -1.24 -0.77 -1.67 115.58 112.35 1xck h ASN 467 Ca 0.17 0.02 -0.00 0.00 0.71 0.00 0.00 56.30 57.19 1xck h ASN 467 Cb 0.25 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.24 1xck h ASN 467 CO -0.33 0.26 -0.02 0.74 -1.29 0.00 0.00 177.43 176.80 1xck h THR 468 N 0.49 1.07 -0.92 -3.57 2.02 -0.61 -2.60 112.91 108.79 1xck h THR 468 Ca 0.20 -0.36 0.10 0.00 0.77 0.00 0.00 66.41 67.12 1xck h THR 468 Cb 0.09 1.32 -0.07 0.00 -1.74 0.00 0.00 68.15 67.75 1xck h THR 468 CO -0.13 0.09 0.59 0.58 0.37 0.00 0.00 175.52 177.03 1xck h VAL 469 N -0.21 0.97 -0.78 3.16 2.07 -0.90 0.01 116.25 120.58 1xck h VAL 469 Ca -0.01 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 1xck h VAL 469 Cb 0.19 -0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.88 1xck h VAL 469 CO 0.01 0.17 0.39 0.11 0.02 0.00 0.00 177.57 178.27 1xck h LYS 470 N 0.94 1.10 0.00 1.57 1.57 -1.14 -2.33 116.57 118.28 1xck h LYS 470 Ca 0.43 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1xck h LYS 470 Cb 0.39 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1xck h LYS 470 CO -0.19 0.84 0.00 0.78 -0.57 0.00 0.00 179.45 180.31 1xck h GLY 471 N 1.14 0.00 0.00 3.86 0.00 -0.60 -3.44 103.07 104.03 1xck h GLY 471 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1xck h GLY 471 CO -0.04 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.11 1xck n GLY 472 N -0.85 0.31 3.23 4.60 0.00 -0.88 -5.12 105.19 106.49 1xck n GLY 472 Ca -0.02 -1.81 -0.13 0.00 0.00 0.00 0.00 46.02 44.06 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 -1.00 0.52 0.45 1.61 1.01 -1.26 -5.02 116.67 112.97 1xck s ASP 473 Ca 0.00 -1.37 0.00 0.00 0.71 0.00 0.00 52.55 51.89 1xck s ASP 473 Cb 0.00 0.30 0.00 0.00 1.01 0.00 0.00 42.92 44.23 1xck s ASP 473 CO 0.00 -0.79 0.00 0.61 0.21 0.00 0.00 175.17 175.20 1xck n GLY 474 N -0.31 2.75 2.04 0.21 0.00 -1.26 -1.02 105.19 107.60 1xck n GLY 474 Ca 0.00 0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 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 2.33 4.03 -4.73 1.61 4.13 -1.26 -4.92 115.26 116.45 1xck n ASN 475 Ca 0.00 -3.37 -0.41 0.00 1.68 0.00 0.00 54.58 52.48 1xck n ASN 475 Cb 0.00 -0.81 -0.04 0.00 -1.54 0.00 0.00 39.78 37.39 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 -2.80 3.67 0.09 3.10 5.04 -0.19 -0.22 117.35 126.04 1xck s TYR 476 Ca 0.48 1.66 -0.08 0.00 -2.44 0.00 0.00 57.07 56.69 1xck s TYR 476 Cb 0.40 -3.18 0.03 0.00 0.35 0.00 0.00 41.96 39.56 1xck s TYR 476 CO 0.08 -0.26 0.38 0.41 -1.34 0.00 0.00 175.55 174.81 1xck n GLY 477 N 2.45 1.18 3.74 8.97 0.00 0.45 -4.73 105.19 117.24 1xck n GLY 477 Ca 0.04 -1.03 -0.36 0.00 0.00 0.00 0.00 46.02 44.67 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 -4.97 3.45 -0.77 1.61 5.04 -1.26 -1.28 117.35 119.17 1xck s TYR 478 Ca 0.08 0.52 -0.17 0.00 -2.44 0.00 0.00 57.07 55.06 1xck s TYR 478 Cb -0.01 -2.27 0.16 0.00 0.35 0.00 0.00 41.96 40.18 1xck s TYR 478 CO 0.03 0.28 0.83 1.21 -1.34 0.00 0.00 175.55 176.56 1xck s ASN 479 N 0.35 6.52 0.42 4.32 3.84 -0.02 -4.91 114.94 125.46 1xck s ASN 479 Ca 0.14 -2.09 0.20 0.00 0.21 0.00 0.00 52.86 51.32 1xck s ASN 479 Cb -0.12 -2.29 1.13 0.00 -0.55 0.00 0.00 41.25 39.42 1xck s ASN 479 CO 0.02 -0.88 1.80 0.00 -2.79 0.00 0.00 177.10 175.25 1xck h ALA 480 N 8.55 2.30 -0.48 1.71 0.00 -1.94 0.54 119.26 129.93 1xck h ALA 480 Ca -0.02 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1xck h ALA 480 Cb 1.05 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1xck h ALA 480 CO 0.97 -0.66 0.16 0.00 0.00 0.00 0.00 179.25 179.72 1xck h ALA 481 N 1.60 0.63 -0.01 0.00 0.00 -1.95 -3.27 119.26 116.25 1xck h ALA 481 Ca 0.55 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1xck h ALA 481 Cb 1.46 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1xck h ALA 481 CO -0.23 0.27 -0.13 0.25 0.00 0.00 0.00 179.25 179.41 1xck n THR 482 N -4.53 0.00 -2.25 0.00 -2.24 -0.70 -4.98 114.28 99.58 1xck n THR 482 Ca 0.01 -0.44 -0.20 0.00 -2.27 0.00 0.00 64.05 61.15 1xck n THR 482 Cb 0.18 1.25 -0.02 0.00 -2.10 0.00 0.00 70.33 69.64 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 0.40 -1.59 -5.06 -0.78 1.02 0.18 -4.98 120.64 109.83 1xck n GLU 483 Ca 0.07 1.03 -0.32 0.00 -0.02 0.00 0.00 57.16 57.93 1xck n GLU 483 Cb 0.34 -5.62 -0.15 0.00 -0.02 0.00 0.00 31.44 25.99 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 -4.79 2.47 0.43 3.49 0.41 -1.18 -4.90 118.70 114.63 1xck s GLU 484 Ca 0.00 -0.79 -0.06 0.00 -0.41 0.00 0.00 54.97 53.71 1xck s GLU 484 Cb 0.00 -2.27 -0.04 0.00 -1.78 0.00 0.00 34.13 30.04 1xck s GLU 484 CO 0.00 0.53 0.73 0.71 -0.49 0.00 0.00 175.26 176.74 1xck s TYR 485 N -0.51 3.53 -5.00 1.61 1.51 -1.26 -0.84 117.35 116.38 1xck s TYR 485 Ca 0.07 0.79 0.00 0.00 -1.01 0.00 0.00 57.07 56.91 1xck s TYR 485 Cb -0.11 -2.26 0.00 0.00 -0.11 0.00 0.00 41.96 39.48 1xck s TYR 485 CO 0.01 -0.14 0.00 0.41 -1.11 0.00 0.00 175.55 174.72 1xck n GLY 486 N -1.85 -0.74 3.61 0.71 0.00 -0.41 -4.93 105.19 101.58 1xck n GLY 486 Ca 0.00 -1.15 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 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 6.71 0.30 1.61 3.84 -1.26 -0.41 114.94 121.73 1xck s ASN 487 Ca 0.00 0.62 0.02 0.00 0.21 0.00 0.00 52.86 53.72 1xck s ASN 487 Cb 0.00 -2.50 0.59 0.00 -0.55 0.00 0.00 41.25 38.79 1xck s ASN 487 CO 0.00 -0.96 1.86 0.24 -2.79 0.00 0.00 177.10 175.45 1xck h MET 488 N 8.59 0.93 -0.14 0.43 2.86 -0.90 -0.59 114.93 126.11 1xck h MET 488 Ca -0.23 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.31 1xck h MET 488 Cb 1.07 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 32.52 1xck h MET 488 CO 1.03 0.61 -0.12 0.82 1.06 0.00 0.00 176.91 180.31 1xck h ILE 489 N 0.96 1.34 -0.64 -1.22 1.08 -1.76 0.16 117.51 117.43 1xck h ILE 489 Ca 0.46 -1.25 0.05 0.00 -0.39 0.00 0.00 64.86 63.73 1xck h ILE 489 Cb 0.46 1.87 -0.05 0.00 -3.07 0.00 0.00 36.82 36.03 1xck h ILE 489 CO -0.23 0.37 0.36 0.44 -0.69 0.00 0.00 178.15 178.40 1xck h ASP 490 N -0.05 0.55 0.00 1.72 3.32 -1.83 0.14 116.42 120.28 1xck h ASP 490 Ca 0.02 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1xck h ASP 490 Cb 0.63 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1xck h ASP 490 CO 0.03 0.37 0.00 0.23 -1.72 0.00 0.00 179.24 178.15 1xck n MET 491 N -4.78 0.68 -2.34 3.56 2.81 -0.27 -4.86 117.12 111.92 1xck n MET 491 Ca 0.07 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.84 1xck n MET 491 Cb 0.14 -1.33 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 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 0.29 -0.11 3.01 3.03 0.00 0.49 -4.98 105.19 106.91 1xck n GLY 492 Ca 0.11 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.68 2.92 0.28 -0.61 1.01 0.53 -5.02 121.20 117.64 1xck s ILE 493 Ca 0.04 -3.08 0.02 0.00 0.00 0.00 0.00 60.65 57.63 1xck s ILE 493 Cb -0.02 -2.99 -0.05 0.00 0.01 0.00 0.00 42.46 39.42 1xck s ILE 493 CO 0.05 -0.80 0.11 -1.48 0.00 0.00 0.00 174.94 172.82 1xck s LEU 494 N -0.07 1.69 0.00 2.97 0.05 -1.26 -0.28 118.68 121.79 1xck s LEU 494 Ca 0.16 -1.45 0.00 0.00 0.05 0.00 0.00 54.13 52.90 1xck s LEU 494 Cb -0.23 0.04 -0.00 0.00 -2.05 0.00 0.00 46.19 43.94 1xck s LEU 494 CO -0.02 -0.78 -0.01 -1.81 -0.55 0.00 0.00 176.35 173.18 1xck s ASP 495 N -3.36 0.12 0.20 1.48 1.01 -0.41 -4.56 116.67 111.16 1xck s ASP 495 Ca 0.36 -0.10 -0.31 0.00 0.71 0.00 0.00 52.55 53.21 1xck s ASP 495 Cb 0.07 0.01 -0.11 0.00 1.01 0.00 0.00 42.92 43.90 1xck s ASP 495 CO 0.15 -0.05 1.59 -2.84 0.21 0.00 0.00 175.17 174.23 1xck s PRO 496 N -0.28 4.19 0.47 8.23 0.02 -1.26 -1.60 135.00 144.76 1xck s PRO 496 Ca -0.03 2.44 0.27 0.00 0.02 0.00 0.00 61.00 63.70 1xck s PRO 496 Cb -0.02 -3.11 1.32 0.00 0.02 0.00 0.00 34.50 32.70 1xck s PRO 496 CO -0.00 -0.62 1.80 1.15 -0.33 0.00 0.00 177.00 179.00 1xck h THR 497 N 3.81 0.49 -0.99 0.99 2.02 -1.20 0.24 112.91 118.27 1xck h THR 497 Ca -0.44 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 66.68 1xck h THR 497 Cb 1.21 0.27 -0.05 0.00 -1.74 0.00 0.00 68.15 67.84 1xck h THR 497 CO 0.89 0.04 0.63 0.50 0.37 0.00 0.00 175.52 177.95 1xck h LYS 498 N 0.20 1.31 -0.17 6.66 3.64 -1.82 0.19 116.57 126.58 1xck h LYS 498 Ca 0.56 -0.09 -0.19 0.00 -1.27 0.00 0.00 60.65 59.65 1xck h LYS 498 Cb 1.80 -0.29 0.00 0.00 -0.41 0.00 0.00 32.23 33.33 1xck h LYS 498 CO -0.15 0.88 -0.67 -0.39 -2.27 0.00 0.00 179.45 176.85 1xck h VAL 499 N 1.34 1.31 -0.26 2.00 -1.51 -0.84 -0.99 116.25 117.30 1xck h VAL 499 Ca 0.36 -1.93 -0.05 0.00 -1.23 0.00 0.00 66.70 63.85 1xck h VAL 499 Cb -0.12 1.90 -0.01 0.00 -2.13 0.00 0.00 31.29 30.92 1xck h VAL 499 CO -0.07 0.60 -0.05 0.74 -1.23 0.00 0.00 177.57 177.56 1xck h THR 500 N 0.47 1.28 -0.35 7.19 2.02 -1.31 -0.26 112.91 121.96 1xck h THR 500 Ca -0.02 -1.05 0.03 0.00 0.77 0.00 0.00 66.41 66.15 1xck h THR 500 Cb 1.26 1.44 -0.03 0.00 -1.74 0.00 0.00 68.15 69.07 1xck h THR 500 CO 0.13 0.33 0.14 -0.09 0.37 0.00 0.00 175.52 176.40 1xck h ARG 501 N 0.24 0.30 -0.30 6.66 2.43 -0.93 -2.29 114.38 120.49 1xck h ARG 501 Ca 0.07 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1xck h ARG 501 Cb 0.51 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1xck h ARG 501 CO 0.02 0.20 0.15 0.77 -1.51 0.00 0.00 179.97 179.60 1xck h SER 502 N 0.30 0.39 -0.57 -3.80 0.02 -1.06 -1.14 113.55 107.70 1xck h SER 502 Ca 0.15 -0.11 0.08 0.00 -0.84 0.00 0.00 61.79 61.07 1xck h SER 502 Cb 0.10 -0.10 -0.07 0.00 0.14 0.00 0.00 62.40 62.48 1xck h SER 502 CO -0.14 0.39 0.21 0.00 -1.14 0.00 0.00 176.83 176.16 1xck h ALA 503 N 1.01 0.72 0.06 3.77 0.00 -0.89 -0.17 119.26 123.77 1xck h ALA 503 Ca 0.10 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1xck h ALA 503 Cb 0.10 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1xck h ALA 503 CO -0.01 -0.19 -0.03 1.25 0.00 0.00 0.00 179.25 180.27 1xck h LEU 504 N 0.40 -0.07 -0.79 0.00 5.85 -1.20 -1.68 115.31 117.82 1xck h LEU 504 Ca 0.28 -0.32 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 1xck h LEU 504 Cb 0.32 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1xck h LEU 504 CO -0.27 0.29 0.48 1.56 -0.34 0.00 0.00 178.44 180.16 1xck h GLN 505 N -0.44 1.06 -0.28 1.25 4.20 -0.98 -0.26 115.11 119.65 1xck h GLN 505 Ca -0.01 -0.09 -0.09 0.00 0.06 0.00 0.00 58.65 58.52 1xck h GLN 505 Cb 0.39 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1xck h GLN 505 CO 0.01 0.74 -0.17 1.88 -0.67 0.00 0.00 178.83 180.62 1xck h TYR 506 N 1.07 0.72 -0.08 2.96 0.05 -1.07 -0.66 116.97 119.95 1xck h TYR 506 Ca 0.28 -0.19 0.02 0.00 0.05 0.00 0.00 58.73 58.89 1xck h TYR 506 Cb -0.06 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 37.50 1xck h TYR 506 CO -0.01 0.88 -0.03 0.00 -1.05 0.00 0.00 178.16 177.95 1xck h ALA 507 N 0.73 0.05 -0.39 3.88 0.00 -1.08 -1.67 119.26 120.78 1xck h ALA 507 Ca 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1xck h ALA 507 Cb 0.71 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1xck h ALA 507 CO 0.05 -0.50 0.22 0.00 0.00 0.00 0.00 179.25 179.02 1xck h ALA 508 N 1.07 1.64 0.45 0.00 0.00 -1.01 -1.25 119.26 120.16 1xck h ALA 508 Ca 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1xck h ALA 508 Cb 0.08 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1xck h ALA 508 CO -0.10 0.30 -0.21 1.03 0.00 0.00 0.00 179.25 180.27 1xck h SER 509 N 0.54 -0.51 0.22 0.00 0.87 -0.21 0.49 113.55 114.96 1xck h SER 509 Ca 0.14 -0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.57 1xck h SER 509 Cb 0.01 0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 1xck h SER 509 CO -0.02 -0.30 -0.39 1.62 -0.53 0.00 0.00 176.83 177.21 1xck h VAL 510 N -0.69 1.30 -0.55 2.23 3.04 -1.25 -2.37 116.25 117.95 1xck h VAL 510 Ca -0.06 -1.47 -0.08 0.00 -1.01 0.00 0.00 66.70 64.08 1xck h VAL 510 Cb 0.51 1.65 -0.02 0.00 -2.01 0.00 0.00 31.29 31.42 1xck h VAL 510 CO 0.10 0.44 0.03 0.00 -1.01 0.00 0.00 177.57 177.13 1xck h ALA 511 N 1.40 0.74 -0.85 3.17 0.00 -1.13 -1.87 119.26 120.72 1xck h ALA 511 Ca 0.02 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1xck h ALA 511 Cb 0.78 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1xck h ALA 511 CO 0.06 0.54 0.41 0.78 0.00 0.00 0.00 179.25 181.05 1xck h GLY 512 N 0.84 1.30 0.99 0.00 0.00 -0.63 -0.90 103.07 104.67 1xck h GLY 512 Ca 0.16 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.79 1xck h GLY 512 CO 0.02 0.61 0.10 1.41 0.00 0.00 0.00 176.54 178.68 1xck h LEU 513 N 1.21 0.80 -0.34 3.11 3.38 -1.08 -2.67 115.31 119.72 1xck h LEU 513 Ca 0.29 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1xck h LEU 513 Cb 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1xck h LEU 513 CO -0.04 0.85 -0.12 0.24 0.09 0.00 0.00 178.44 179.46 1xck h MET 514 N 0.72 0.67 -0.35 1.13 2.86 -1.09 -2.66 114.93 116.21 1xck h MET 514 Ca 0.16 -0.28 0.08 0.00 -2.06 0.00 0.00 59.70 57.60 1xck h MET 514 Cb 0.38 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1xck h MET 514 CO 0.01 0.86 0.25 0.82 1.06 0.00 0.00 176.91 179.90 1xck h ILE 515 N 0.45 0.89 -0.85 -1.22 2.04 -1.13 -1.56 117.51 116.14 1xck h ILE 515 Ca 0.08 -0.05 -0.38 0.00 1.00 0.00 0.00 64.86 65.52 1xck h ILE 515 Cb 0.63 0.74 -0.22 0.00 -0.74 0.00 0.00 36.82 37.23 1xck h ILE 515 CO 0.04 0.03 0.45 0.35 0.00 0.00 0.00 178.15 179.02 1xck n THR 516 N -4.46 3.05 -3.73 -0.27 -2.24 -1.01 -4.82 114.28 100.81 1xck n THR 516 Ca 0.05 -1.88 -0.36 0.00 -2.27 0.00 0.00 64.05 59.59 1xck n THR 516 Cb 0.33 -0.42 -0.07 0.00 -2.10 0.00 0.00 70.33 68.07 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 -3.18 5.40 -0.02 4.28 2.01 -0.59 -4.96 115.64 118.58 1xck s THR 517 Ca 0.55 0.28 0.02 0.00 0.31 0.00 0.00 61.69 62.85 1xck s THR 517 Cb 0.46 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 1xck s THR 517 CO 0.11 0.48 0.05 -0.62 -0.69 0.00 0.00 174.62 173.95 1xck n GLU 518 N 3.07 1.53 -3.86 4.92 -0.58 -1.26 -4.81 120.64 119.64 1xck n GLU 518 Ca -0.16 -0.01 -0.11 0.00 -0.42 0.00 0.00 57.16 56.45 1xck n GLU 518 Cb 0.53 -0.94 -0.11 0.00 -0.57 0.00 0.00 31.44 30.35 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 -0.84 0.78 -0.09 0.00 -1.94 -0.07 -4.99 119.30 112.16 1xck s MET 520 Ca -0.09 -0.13 0.04 0.00 -1.71 0.00 0.00 55.69 53.80 1xck s MET 520 Cb -0.05 -0.78 -0.00 0.00 2.01 0.00 0.00 34.83 36.00 1xck s MET 520 CO 0.01 -0.04 -0.23 0.08 -0.01 0.00 0.00 175.02 174.82 1xck s VAL 521 N 0.73 1.99 0.26 -6.03 1.01 -1.26 -1.30 120.40 115.79 1xck s VAL 521 Ca -0.10 -0.99 -0.13 0.00 0.00 0.00 0.00 61.98 60.76 1xck s VAL 521 Cb -0.13 -1.71 -0.00 0.00 0.00 0.00 0.00 36.38 34.54 1xck s VAL 521 CO 0.00 0.55 0.51 0.28 0.00 0.00 0.00 175.10 176.44 1xck s THR 522 N 0.22 0.00 0.62 3.92 -1.32 -0.90 -4.97 115.64 113.21 1xck s THR 522 Ca -0.14 -1.37 -0.16 0.00 -1.21 0.00 0.00 61.69 58.81 1xck s THR 522 Cb -0.17 -2.21 -0.02 0.00 -1.51 0.00 0.00 72.50 68.60 1xck s THR 522 CO 0.07 0.00 1.10 -1.81 -2.21 0.00 0.00 174.62 171.77 1xck s ASP 523 N -3.02 5.39 0.19 8.08 1.01 -1.26 0.49 116.67 127.55 1xck s ASP 523 Ca 0.21 1.99 -0.30 0.00 0.71 0.00 0.00 52.55 55.17 1xck s ASP 523 Cb -0.01 -2.55 -0.08 0.00 1.01 0.00 0.00 42.92 41.28 1xck s ASP 523 CO 0.09 -1.44 1.18 -0.22 0.21 0.00 0.00 175.17 174.99 1xck s LEU 524 N -4.57 4.46 0.00 1.23 2.96 -1.17 -4.53 118.68 117.07 1xck s LEU 524 Ca 0.67 2.22 0.00 0.00 -0.22 0.00 0.00 54.13 56.80 1xck s LEU 524 Cb -0.20 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.88 1xck s LEU 524 CO 0.37 -0.34 0.41 -0.81 -1.32 0.00 0.00 176.35 174.67