#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xck n ALA 3 N 0.00 1.34 -2.31 0.00 0.00 -1.26 -4.96 120.51 113.32 1xck n ALA 3 Ca 0.00 0.45 -0.20 0.00 0.00 0.00 0.00 53.44 53.69 1xck n ALA 3 Cb 0.00 -2.35 -0.02 0.00 0.00 0.00 0.00 19.45 17.08 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 0.89 2.77 -0.21 0.00 -0.14 -1.26 -3.14 119.74 118.65 1xck s LYS 4 Ca 0.79 -1.30 0.00 0.00 -1.36 0.00 0.00 55.97 54.10 1xck s LYS 4 Cb -0.68 -2.58 0.02 0.00 -1.68 0.00 0.00 37.83 32.92 1xck s LYS 4 CO 0.38 -0.07 -0.14 0.34 -0.76 0.00 0.00 175.35 175.09 1xck s ASP 5 N -4.15 3.70 -0.17 2.83 -1.08 0.90 -4.77 116.67 113.93 1xck s ASP 5 Ca 0.47 -0.78 -0.02 0.00 -0.52 0.00 0.00 52.55 51.69 1xck s ASP 5 Cb -0.07 -1.56 -0.02 0.00 -1.46 0.00 0.00 42.92 39.82 1xck s ASP 5 CO 0.29 -0.06 -0.07 -0.69 0.52 0.00 0.00 175.17 175.16 1xck s VAL 6 N 1.29 3.38 0.08 1.11 1.01 -1.26 -2.02 120.40 123.98 1xck s VAL 6 Ca 0.02 -0.52 0.08 0.00 0.00 0.00 0.00 61.98 61.56 1xck s VAL 6 Cb -0.15 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 1xck s VAL 6 CO -0.09 0.48 -0.17 -0.54 0.00 0.00 0.00 175.10 174.77 1xck s LYS 7 N 0.80 1.97 0.36 2.72 1.02 -0.55 -4.98 119.74 121.07 1xck s LYS 7 Ca -0.03 -1.06 0.09 0.00 0.02 0.00 0.00 55.97 54.99 1xck s LYS 7 Cb -0.15 -2.17 -0.07 0.00 -0.52 0.00 0.00 37.83 34.92 1xck s LYS 7 CO 0.01 0.51 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.84 1xck s PHE 8 N -1.04 2.44 0.00 3.18 0.08 -1.26 -1.30 117.98 120.08 1xck s PHE 8 Ca 0.16 -0.54 0.00 0.00 0.12 0.00 0.00 56.93 56.67 1xck s PHE 8 Cb -0.11 -1.50 0.00 0.00 -0.57 0.00 0.00 43.02 40.85 1xck s PHE 8 CO 0.08 0.54 0.00 0.41 -0.10 0.00 0.00 175.22 176.15 1xck n GLY 9 N -0.85 0.76 0.31 4.36 0.00 0.78 -1.57 105.19 108.98 1xck n GLY 9 Ca -0.05 0.10 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 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 0.81 -0.50 1.61 -0.73 -1.93 -0.90 115.58 113.94 1xck h ASN 10 Ca 0.00 0.01 0.06 0.00 1.87 0.00 0.00 56.30 58.24 1xck h ASN 10 Cb 0.00 -0.16 -0.05 0.00 0.27 0.00 0.00 38.32 38.37 1xck h ASN 10 CO 0.00 0.54 0.22 -0.78 -0.37 0.00 0.00 177.43 177.03 1xck h ASP 11 N 0.95 0.27 -0.33 1.15 -0.00 -1.81 -1.43 116.42 115.22 1xck h ASP 11 Ca 0.34 0.05 -0.03 0.00 -0.00 0.00 0.00 57.03 57.39 1xck h ASP 11 Cb 0.10 0.01 -0.01 0.00 -0.00 0.00 0.00 39.33 39.42 1xck h ASP 11 CO -0.15 0.18 0.09 0.00 -0.00 0.00 0.00 179.24 179.36 1xck h ALA 12 N 1.31 0.44 -0.55 -0.78 0.00 -0.57 -3.07 119.26 116.04 1xck h ALA 12 Ca 0.23 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1xck h ALA 12 Cb 0.21 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1xck h ALA 12 CO -0.21 0.10 0.09 0.00 0.00 0.00 0.00 179.25 179.23 1xck h ARG 13 N 0.39 0.88 -0.32 0.00 3.08 -0.70 -2.26 114.38 115.44 1xck h ARG 13 Ca 0.11 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 59.86 1xck h ARG 13 Cb 0.29 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1xck h ARG 13 CO 0.00 0.82 -0.18 -0.39 -1.07 0.00 0.00 179.97 179.15 1xck h VAL 14 N 0.83 1.26 -0.08 2.04 -1.51 -1.28 -0.82 116.25 116.70 1xck h VAL 14 Ca 0.17 -1.20 0.00 0.00 -1.23 0.00 0.00 66.70 64.45 1xck h VAL 14 Cb 0.38 1.21 -0.00 0.00 -2.13 0.00 0.00 31.29 30.74 1xck h VAL 14 CO 0.01 0.39 0.05 0.11 -1.23 0.00 0.00 177.57 176.90 1xck h LYS 15 N 0.53 0.10 -0.20 5.19 1.79 -1.39 0.12 116.57 122.72 1xck h LYS 15 Ca 0.09 -0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.56 1xck h LYS 15 Cb 0.62 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.23 1xck h LYS 15 CO 0.04 0.07 0.10 0.52 -1.08 0.00 0.00 179.45 179.10 1xck h MET 16 N 0.10 0.21 -0.15 3.15 2.86 -1.09 -1.06 114.93 118.95 1xck h MET 16 Ca 0.03 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.68 1xck h MET 16 Cb -0.01 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 1xck h MET 16 CO -0.01 0.14 -0.01 1.25 1.06 0.00 0.00 176.91 179.34 1xck h LEU 17 N 0.22 -0.08 -1.11 1.22 5.85 -0.89 0.54 115.31 121.06 1xck h LEU 17 Ca 0.08 0.03 0.15 0.00 0.84 0.00 0.00 57.88 58.98 1xck h LEU 17 Cb 0.01 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.02 1xck h LEU 17 CO -0.05 -0.02 0.61 -0.09 -0.34 0.00 0.00 178.44 178.56 1xck h ARG 18 N 0.04 0.81 -0.06 1.25 9.65 -0.51 0.48 114.38 126.04 1xck h ARG 18 Ca 0.07 -0.05 -0.02 0.00 -1.10 0.00 0.00 59.98 58.88 1xck h ARG 18 Cb 0.09 -0.18 -0.00 0.00 -1.39 0.00 0.00 29.97 28.48 1xck h ARG 18 CO -0.12 0.54 -0.04 0.78 2.80 0.00 0.00 179.97 183.93 1xck h GLY 19 N 0.84 0.14 2.00 2.80 0.00 0.12 -2.89 103.07 106.08 1xck h GLY 19 Ca 0.50 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.69 1xck h GLY 19 CO -0.27 0.11 -0.09 -0.39 0.00 0.00 0.00 176.54 175.90 1xck h VAL 20 N -0.28 0.28 -0.31 4.60 -1.51 -0.17 -2.73 116.25 116.15 1xck h VAL 20 Ca 0.01 -0.65 -0.08 0.00 -1.23 0.00 0.00 66.70 64.75 1xck h VAL 20 Cb 0.49 1.51 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 1xck h VAL 20 CO 0.01 0.09 -0.12 0.78 -1.23 0.00 0.00 177.57 177.10 1xck h ASN 21 N 0.00 0.64 -0.15 4.19 2.35 -0.82 0.28 115.58 122.07 1xck h ASN 21 Ca -0.00 -0.39 0.03 0.00 -0.55 0.00 0.00 56.30 55.38 1xck h ASN 21 Cb 0.50 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 1xck h ASN 21 CO 0.01 0.89 -0.01 0.58 -1.65 0.00 0.00 177.43 177.25 1xck h VAL 22 N 0.38 0.88 0.43 2.81 2.07 -1.28 0.25 116.25 121.80 1xck h VAL 22 Ca 0.07 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 1xck h VAL 22 Cb 0.63 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1xck h VAL 22 CO 0.04 0.01 -0.34 0.25 0.02 0.00 0.00 177.57 177.54 1xck h LEU 23 N 0.03 -0.90 -0.11 2.57 5.85 -1.34 -2.24 115.31 119.17 1xck h LEU 23 Ca 0.07 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1xck h LEU 23 Cb 0.10 0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 1xck h LEU 23 CO -0.13 -0.50 0.02 0.00 -0.34 0.00 0.00 178.44 177.48 1xck h ALA 24 N -0.33 0.11 -0.34 1.25 0.00 -0.23 -1.99 119.26 117.74 1xck h ALA 24 Ca -0.04 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1xck h ALA 24 Cb 0.66 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1xck h ALA 24 CO -0.01 -0.43 0.16 -0.44 0.00 0.00 0.00 179.25 178.53 1xck h ASP 25 N 0.07 0.41 -0.08 0.00 3.32 -0.49 0.21 116.42 119.85 1xck h ASP 25 Ca 0.05 -0.03 -0.19 0.00 0.02 0.00 0.00 57.03 56.88 1xck h ASP 25 Cb 0.04 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1xck h ASP 25 CO -0.07 0.35 -0.65 0.00 -1.72 0.00 0.00 179.24 177.16 1xck h ALA 26 N 1.72 0.50 0.08 3.45 0.00 -1.13 -3.32 119.26 120.55 1xck h ALA 26 Ca 0.12 -0.56 -0.15 0.00 0.00 0.00 0.00 54.91 54.32 1xck h ALA 26 Cb 0.05 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 17.80 1xck h ALA 26 CO -0.02 0.70 -0.63 0.28 0.00 0.00 0.00 179.25 179.58 1xck h VAL 27 N 0.51 1.52 0.00 0.00 2.07 -0.81 -3.36 116.25 116.18 1xck h VAL 27 Ca -0.01 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.15 1xck h VAL 27 Cb 1.24 3.03 0.00 0.00 -1.52 0.00 0.00 31.29 34.05 1xck h VAL 27 CO 0.13 0.66 0.00 2.29 0.02 0.00 0.00 177.57 180.67 1xck n LYS 28 N -4.23 0.16 0.02 1.57 2.85 0.68 -2.10 118.16 117.12 1xck n LYS 28 Ca -0.12 0.52 0.09 0.00 -1.05 0.00 0.00 58.31 57.74 1xck n LYS 28 Cb 0.72 -1.89 0.38 0.00 -0.65 0.00 0.00 35.03 33.59 1xck n LYS 28 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 1xck n VAL 29 N -2.21 0.84 0.42 0.58 0.24 -1.25 -2.25 118.33 114.70 1xck n VAL 29 Ca 0.00 0.20 0.11 0.00 -2.04 0.00 0.00 64.34 62.62 1xck n VAL 29 Cb 0.13 -0.95 0.03 0.00 -1.47 0.00 0.00 33.84 31.58 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 -1.63 0.29 -1.61 3.34 -2.24 -0.89 -0.07 114.28 111.47 1xck n THR 30 Ca 0.04 -0.34 -0.46 0.00 -2.27 0.00 0.00 64.05 61.03 1xck n THR 30 Cb 0.21 0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.42 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 -2.17 2.15 0.00 3.22 7.94 -0.95 -4.11 117.00 123.07 1xck n LEU 31 Ca 0.01 1.16 0.01 0.00 -1.11 0.00 0.00 56.01 56.09 1xck n LEU 31 Cb 0.47 -1.31 -0.00 0.00 0.53 0.00 0.00 43.42 43.10 1xck n LEU 31 CO 0.40 -1.10 -0.01 0.61 -1.11 0.00 0.00 177.39 176.17 1xck n GLY 32 N 1.59 -1.98 0.15 -3.96 0.00 -1.26 -3.82 105.19 95.91 1xck n GLY 32 Ca 0.11 -1.38 0.01 0.00 0.00 0.00 0.00 46.02 44.75 1xck n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xck h PRO 33 N 0.00 0.00 -0.84 1.61 0.13 -1.91 -3.20 132.00 127.79 1xck h PRO 33 Ca 0.00 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.79 1xck h PRO 33 Cb 0.07 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 31.00 1xck h PRO 33 CO 0.00 0.55 0.42 1.63 -0.23 0.00 0.00 178.00 180.37 1xck n LYS 34 N -3.73 3.12 -1.68 0.86 4.76 -1.26 -5.00 118.16 115.22 1xck n LYS 34 Ca -0.01 -3.07 -0.38 0.00 -2.87 0.00 0.00 58.31 51.98 1xck n LYS 34 Cb 0.59 -2.20 0.05 0.00 -1.84 0.00 0.00 35.03 31.63 1xck n LYS 34 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xck n GLY 35 N -0.57 0.23 3.98 0.72 0.00 -1.21 -4.62 105.19 103.72 1xck n GLY 35 Ca 0.49 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 46.20 1xck n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xck s ARG 36 N -2.93 2.20 0.07 1.61 1.81 0.90 -4.93 118.95 117.69 1xck s ARG 36 Ca 0.76 -0.90 -0.09 0.00 -1.72 0.00 0.00 55.73 53.78 1xck s ARG 36 Cb -0.41 -2.42 -0.06 0.00 -0.45 0.00 0.00 34.95 31.61 1xck s ARG 36 CO 0.46 -1.01 0.37 -0.80 -0.68 0.00 0.00 175.30 173.64 1xck s ASN 37 N -4.55 6.60 -0.07 0.23 -0.87 -1.26 -4.40 114.94 110.63 1xck s ASN 37 Ca 0.61 0.73 0.06 0.00 -1.57 0.00 0.00 52.86 52.69 1xck s ASN 37 Cb -0.08 -2.16 -0.01 0.00 -0.02 0.00 0.00 41.25 38.98 1xck s ASN 37 CO 0.41 0.18 -0.25 -0.69 -2.57 0.00 0.00 177.10 174.19 1xck s VAL 38 N -1.39 2.07 -0.27 1.60 1.01 0.43 -4.94 120.40 118.92 1xck s VAL 38 Ca 0.32 -1.05 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 1xck s VAL 38 Cb -0.14 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 1xck s VAL 38 CO 0.18 0.57 0.15 -0.69 0.00 0.00 0.00 175.10 175.31 1xck s VAL 39 N -0.05 5.01 -0.29 2.92 1.01 -1.26 -1.04 120.40 126.70 1xck s VAL 39 Ca -0.07 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 1xck s VAL 39 Cb -0.15 -3.37 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 1xck s VAL 39 CO 0.05 0.29 0.11 -0.76 0.00 0.00 0.00 175.10 174.78 1xck s LEU 40 N 1.65 3.86 0.43 3.92 1.43 0.18 -4.91 118.68 125.24 1xck s LEU 40 Ca 0.07 -0.51 -0.23 0.00 -1.03 0.00 0.00 54.13 52.42 1xck s LEU 40 Cb -0.16 -1.94 -0.08 0.00 0.03 0.00 0.00 46.19 44.04 1xck s LEU 40 CO 0.08 -0.16 1.09 -0.62 0.23 0.00 0.00 176.35 176.97 1xck s ASP 41 N 1.57 6.50 -0.07 2.29 2.15 -1.26 0.11 116.67 127.97 1xck s ASP 41 Ca 0.04 2.11 0.02 0.00 0.43 0.00 0.00 52.55 55.16 1xck s ASP 41 Cb -0.17 -2.59 0.01 0.00 -0.30 0.00 0.00 42.92 39.88 1xck s ASP 41 CO 0.04 -0.68 -0.12 -0.54 -0.17 0.00 0.00 175.17 173.70 1xck s LYS 42 N -2.66 1.71 0.32 4.34 1.02 -1.26 -4.88 119.74 118.33 1xck s LYS 42 Ca 0.61 -0.41 0.09 0.00 0.02 0.00 0.00 55.97 56.28 1xck s LYS 42 Cb -0.23 -1.42 0.95 0.00 -0.52 0.00 0.00 37.83 36.60 1xck s LYS 42 CO 0.29 0.02 1.64 0.66 -0.92 0.00 0.00 175.35 177.04 1xck h SER 43 N 6.99 0.21 -3.51 2.83 4.64 -1.96 -3.36 113.55 119.38 1xck h SER 43 Ca -0.31 0.21 -0.66 0.00 -0.47 0.00 0.00 61.79 60.56 1xck h SER 43 Cb 1.19 0.23 -0.27 0.00 -0.31 0.00 0.00 62.40 63.24 1xck h SER 43 CO 0.47 -0.20 -0.68 -0.36 -0.87 0.00 0.00 176.83 175.20 1xck s PHE 44 N -5.78 3.05 0.00 4.77 0.08 -1.26 -5.03 117.98 113.80 1xck s PHE 44 Ca -0.11 -0.94 0.00 0.00 0.12 0.00 0.00 56.93 56.01 1xck s PHE 44 Cb 0.29 -2.17 0.00 0.00 -0.57 0.00 0.00 43.02 40.57 1xck s PHE 44 CO 0.78 -0.55 0.00 0.41 -0.10 0.00 0.00 175.22 175.77 1xck n GLY 45 N 4.82 -1.66 3.85 4.36 0.00 -1.26 -4.96 105.19 110.34 1xck n GLY 45 Ca -0.17 -1.88 -0.32 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.85 3.24 0.95 4.61 0.00 -1.26 -4.80 121.76 122.66 1xck s ALA 46 Ca 0.00 0.10 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 1xck s ALA 46 Cb 0.00 -2.87 0.17 0.00 0.00 0.00 0.00 23.12 20.42 1xck s ALA 46 CO 0.00 0.20 1.11 -2.14 0.00 0.00 0.00 175.76 174.93 1xck s PRO 47 N -3.23 0.73 -0.20 0.00 0.02 -1.26 -4.65 135.00 126.41 1xck s PRO 47 Ca 0.56 1.28 -0.10 0.00 0.02 0.00 0.00 61.00 62.76 1xck s PRO 47 Cb -0.10 -1.71 -0.05 0.00 0.02 0.00 0.00 34.50 32.66 1xck s PRO 47 CO 0.19 -2.74 0.13 0.99 -0.33 0.00 0.00 177.00 175.24 1xck s THR 48 N -2.66 5.41 -0.19 0.99 2.01 0.12 -4.92 115.64 116.40 1xck s THR 48 Ca 0.66 0.20 -0.06 0.00 0.31 0.00 0.00 61.69 62.80 1xck s THR 48 Cb -0.22 -3.47 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 1xck s THR 48 CO 0.59 0.44 0.03 -0.63 -0.69 0.00 0.00 174.62 174.37 1xck s ILE 49 N 0.34 4.39 0.12 1.82 1.01 -1.26 0.51 121.20 128.12 1xck s ILE 49 Ca 0.08 -0.17 -0.06 0.00 0.00 0.00 0.00 60.65 60.50 1xck s ILE 49 Cb -0.11 -2.98 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 1xck s ILE 49 CO -0.02 0.44 0.17 0.28 0.00 0.00 0.00 174.94 175.81 1xck s THR 50 N 0.71 0.12 -0.00 2.92 -1.32 -0.20 -4.96 115.64 112.90 1xck s THR 50 Ca 0.02 -1.48 0.00 0.00 -1.21 0.00 0.00 61.69 59.02 1xck s THR 50 Cb -0.14 -1.68 0.00 0.00 -1.51 0.00 0.00 72.50 69.18 1xck s THR 50 CO 0.02 -0.54 0.91 0.29 -2.21 0.00 0.00 174.62 173.09 1xck n LYS 51 N -0.10 2.41 -2.98 7.08 5.02 -1.26 -0.43 118.16 127.90 1xck n LYS 51 Ca -0.10 -1.33 -0.43 0.00 -2.02 0.00 0.00 58.31 54.43 1xck n LYS 51 Cb 0.63 -0.91 -0.05 0.00 -0.02 0.00 0.00 35.03 34.67 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 -0.84 6.33 0.58 4.39 2.15 -1.26 -4.82 116.67 123.21 1xck s ASP 52 Ca 0.00 -0.40 0.28 0.00 0.43 0.00 0.00 52.55 52.87 1xck s ASP 52 Cb 0.00 -2.37 1.66 0.00 -0.30 0.00 0.00 42.92 41.91 1xck s ASP 52 CO 0.00 -1.00 2.13 1.23 -0.17 0.00 0.00 175.17 177.36 1xck h GLY 53 N 10.28 0.00 1.36 2.66 0.00 -1.94 -1.54 103.07 113.89 1xck h GLY 53 Ca -0.26 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.87 1xck h GLY 53 CO 1.00 0.00 -0.71 -2.08 0.00 0.00 0.00 176.54 174.75 1xck h VAL 54 N 0.00 1.32 -0.29 4.60 2.07 -1.96 -0.96 116.25 121.02 1xck h VAL 54 Ca 0.07 -1.98 -0.03 0.00 0.82 0.00 0.00 66.70 65.58 1xck h VAL 54 Cb 0.39 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 1xck h VAL 54 CO -0.00 0.62 0.06 0.28 0.02 0.00 0.00 177.57 178.54 1xck h SER 55 N 0.45 0.45 0.41 0.57 0.02 -1.72 -2.17 113.55 111.56 1xck h SER 55 Ca -0.03 -0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 60.65 1xck h SER 55 Cb 1.30 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1xck h SER 55 CO 0.14 0.59 -0.20 0.58 -1.14 0.00 0.00 176.83 176.80 1xck h VAL 56 N 0.30 0.60 -0.97 2.27 2.07 -1.37 -2.86 116.25 116.29 1xck h VAL 56 Ca 0.09 -0.06 0.17 0.00 0.82 0.00 0.00 66.70 67.72 1xck h VAL 56 Cb 0.32 0.63 -0.10 0.00 -1.52 0.00 0.00 31.29 30.62 1xck h VAL 56 CO 0.00 0.01 0.57 0.00 0.02 0.00 0.00 177.57 178.18 1xck h ALA 57 N 0.01 1.55 -0.97 1.67 0.00 -1.14 -0.44 119.26 119.94 1xck h ALA 57 Ca -0.06 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.05 1xck h ALA 57 Cb 0.44 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.06 1xck h ALA 57 CO 0.09 -0.01 0.61 -0.09 0.00 0.00 0.00 179.25 179.85 1xck h ARG 58 N 0.77 0.89 0.00 0.00 2.43 -1.16 -1.90 114.38 115.41 1xck h ARG 58 Ca 0.54 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.66 1xck h ARG 58 Cb 0.78 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1xck h ARG 58 CO -0.36 0.59 0.00 0.93 -1.51 0.00 0.00 179.97 179.62 1xck h GLU 59 N 0.91 0.00 -6.23 0.20 4.39 -1.00 -3.46 114.58 109.40 1xck h GLU 59 Ca 0.48 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.62 1xck h GLU 59 Cb 0.54 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.16 1xck h GLU 59 CO -0.24 0.00 0.80 0.42 -1.16 0.00 0.00 179.01 178.82 1xck s ILE 60 N -3.19 4.29 -0.22 3.13 -1.09 -0.72 -4.99 121.20 118.41 1xck s ILE 60 Ca 0.08 1.58 -0.09 0.00 -2.23 0.00 0.00 60.65 60.00 1xck s ILE 60 Cb 0.11 -4.02 0.09 0.00 -1.58 0.00 0.00 42.46 37.06 1xck s ILE 60 CO 0.56 -0.07 0.49 -0.70 -1.23 0.00 0.00 174.94 173.99 1xck s GLU 61 N 2.84 0.43 0.09 2.79 2.12 -1.26 -4.92 118.70 120.79 1xck s GLU 61 Ca 0.55 1.08 -0.01 0.00 0.36 0.00 0.00 54.97 56.94 1xck s GLU 61 Cb -0.23 0.33 -0.04 0.00 0.26 0.00 0.00 34.13 34.44 1xck s GLU 61 CO 0.18 -0.21 0.26 -0.51 -0.54 0.00 0.00 175.26 174.45 1xck s LEU 62 N 2.27 4.33 0.11 2.70 1.43 -1.26 -5.03 118.68 123.22 1xck s LEU 62 Ca -0.05 0.37 -0.15 0.00 -1.03 0.00 0.00 54.13 53.27 1xck s LEU 62 Cb -0.10 -3.07 -0.07 0.00 0.03 0.00 0.00 46.19 42.98 1xck s LEU 62 CO -0.15 0.13 1.45 -0.08 0.23 0.00 0.00 176.35 177.93 1xck h GLU 63 N 2.97 0.72 -6.27 1.70 4.81 -2.00 -3.41 114.58 113.10 1xck h GLU 63 Ca -0.45 -0.35 -0.56 0.00 -0.13 0.00 0.00 59.36 57.86 1xck h GLU 63 Cb 1.16 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1xck h GLU 63 CO 0.75 0.96 1.15 0.34 -0.73 0.00 0.00 179.01 181.48 1xck s ASP 64 N -6.50 6.35 0.30 1.04 -1.08 -1.26 -4.89 116.67 110.63 1xck s ASP 64 Ca -0.12 1.74 0.06 0.00 -0.52 0.00 0.00 52.55 53.71 1xck s ASP 64 Cb 0.09 -2.53 0.77 0.00 -1.46 0.00 0.00 42.92 39.79 1xck s ASP 64 CO 0.83 -1.26 1.74 0.11 0.52 0.00 0.00 175.17 177.10 1xck h LYS 65 N 10.87 0.58 -0.02 4.34 1.79 -1.94 0.10 116.57 132.29 1xck h LYS 65 Ca -0.35 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.08 1xck h LYS 65 Cb 1.16 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 31.68 1xck h LYS 65 CO 0.99 0.38 -0.01 0.74 -1.08 0.00 0.00 179.45 180.47 1xck h PHE 66 N 0.60 0.04 -0.92 -1.35 0.04 -1.94 -2.03 116.94 111.39 1xck h PHE 66 Ca 0.59 -0.01 0.04 0.00 2.80 0.00 0.00 57.97 61.39 1xck h PHE 66 Cb 1.04 -0.01 -0.06 0.00 2.20 0.00 0.00 35.95 39.12 1xck h PHE 66 CO -0.04 0.48 0.59 0.93 -0.60 0.00 0.00 178.31 179.67 1xck h GLU 67 N -0.41 1.09 -0.68 1.51 5.08 -1.55 -1.84 114.58 117.79 1xck h GLU 67 Ca 0.00 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xck h GLU 67 Cb 0.48 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1xck h GLU 67 CO 0.00 0.72 0.40 -0.97 -1.00 0.00 0.00 179.01 178.17 1xck h ASN 68 N 1.12 0.82 -0.80 1.42 -1.24 -0.93 -1.61 115.58 114.35 1xck h ASN 68 Ca 0.38 -0.07 0.05 0.00 0.71 0.00 0.00 56.30 57.37 1xck h ASN 68 Cb 0.06 -0.21 -0.05 0.00 0.73 0.00 0.00 38.32 38.85 1xck h ASN 68 CO -0.14 0.64 0.53 0.24 -1.29 0.00 0.00 177.43 177.41 1xck h MET 69 N 0.92 0.91 -0.21 6.67 2.86 -0.59 0.33 114.93 125.83 1xck h MET 69 Ca 0.24 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.81 1xck h MET 69 Cb -0.02 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.43 1xck h MET 69 CO -0.04 0.60 0.07 0.78 1.06 0.00 0.00 176.91 179.38 1xck h GLY 70 N 0.94 0.34 0.90 8.32 0.00 -0.77 -0.74 103.07 112.05 1xck h GLY 70 Ca 0.33 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.44 1xck h GLY 70 CO -0.11 0.19 0.08 0.00 0.00 0.00 0.00 176.54 176.70 1xck h ALA 71 N 0.89 0.38 -0.64 3.60 0.00 -0.49 -2.93 119.26 120.08 1xck h ALA 71 Ca 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xck h ALA 71 Cb 0.22 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1xck h ALA 71 CO -0.00 0.03 0.39 1.96 0.00 0.00 0.00 179.25 181.62 1xck h GLN 72 N 0.31 0.86 0.49 0.00 1.08 -0.28 -0.28 115.11 117.30 1xck h GLN 72 Ca 0.09 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.20 1xck h GLN 72 Cb 0.26 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1xck h GLN 72 CO -0.00 0.61 -0.24 0.52 -0.95 0.00 0.00 178.83 178.77 1xck h MET 73 N 0.88 -0.64 -0.05 1.46 2.86 -0.95 -0.42 114.93 118.08 1xck h MET 73 Ca 0.23 0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.78 1xck h MET 73 Cb -0.03 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1xck h MET 73 CO -0.04 -0.40 -0.58 -0.24 1.06 0.00 0.00 176.91 176.70 1xck h VAL 74 N -0.71 1.39 -0.95 -2.22 3.04 -1.45 -2.64 116.25 112.72 1xck h VAL 74 Ca -0.07 -1.96 0.09 0.00 -1.01 0.00 0.00 66.70 63.75 1xck h VAL 74 Cb 0.53 2.01 -0.07 0.00 -2.01 0.00 0.00 31.29 31.75 1xck h VAL 74 CO 0.11 0.57 0.59 0.50 -1.01 0.00 0.00 177.57 178.33 1xck h LYS 75 N 0.11 0.98 0.44 4.17 3.64 -0.90 0.13 116.57 125.14 1xck h LYS 75 Ca -0.00 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1xck h LYS 75 Cb 1.06 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1xck h LYS 75 CO 0.08 0.65 -0.21 1.49 -2.27 0.00 0.00 179.45 179.19 1xck h GLU 76 N 1.01 -0.57 0.00 1.90 4.81 -0.71 -2.82 114.58 118.20 1xck h GLU 76 Ca 0.44 0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.64 1xck h GLU 76 Cb 0.32 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1xck h GLU 76 CO -0.22 -0.28 -0.31 -0.39 -0.73 0.00 0.00 179.01 177.08 1xck h VAL 77 N -1.01 0.99 -0.73 0.32 -1.51 -1.41 -2.53 116.25 110.36 1xck h VAL 77 Ca -0.06 -1.17 -0.06 0.00 -1.23 0.00 0.00 66.70 64.19 1xck h VAL 77 Cb 0.56 1.67 -0.03 0.00 -2.13 0.00 0.00 31.29 31.36 1xck h VAL 77 CO 0.10 0.31 0.23 0.00 -1.23 0.00 0.00 177.57 176.98 1xck h ALA 78 N 1.69 1.03 -0.30 5.19 0.00 -0.79 -2.36 119.26 123.71 1xck h ALA 78 Ca -0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1xck h ALA 78 Cb 0.65 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1xck h ALA 78 CO 0.04 0.65 0.06 0.66 0.00 0.00 0.00 179.25 180.67 1xck h SER 79 N 1.09 0.39 -0.23 0.00 4.64 -1.18 -1.46 113.55 116.80 1xck h SER 79 Ca 0.24 -0.05 0.07 0.00 -0.47 0.00 0.00 61.79 61.57 1xck h SER 79 Cb 0.29 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1xck h SER 79 CO -0.01 0.41 0.20 0.11 -0.87 0.00 0.00 176.83 176.67 1xck h LYS 80 N 0.43 0.00 -0.19 4.77 1.57 -1.34 0.60 116.57 122.41 1xck h LYS 80 Ca 0.10 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1xck h LYS 80 Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1xck h LYS 80 CO -0.00 0.00 -0.07 0.00 -0.57 0.00 0.00 179.45 178.81 1xck h ALA 81 N 1.81 0.26 -0.71 3.86 0.00 -1.28 -1.94 119.26 121.27 1xck h ALA 81 Ca 0.11 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1xck h ALA 81 Cb 0.51 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1xck h ALA 81 CO -0.00 0.07 0.22 -0.97 0.00 0.00 0.00 179.25 178.56 1xck h ASN 82 N 0.08 1.02 -0.75 0.00 -1.24 -1.00 -1.28 115.58 112.42 1xck h ASN 82 Ca 0.04 -0.19 -0.03 0.00 0.71 0.00 0.00 56.30 56.84 1xck h ASN 82 Cb 0.54 -0.27 -0.04 0.00 0.73 0.00 0.00 38.32 39.29 1xck h ASN 82 CO 0.02 0.95 0.37 0.44 -1.29 0.00 0.00 177.43 177.93 1xck h ASP 83 N 1.05 0.99 0.48 1.15 3.32 -1.04 0.62 116.42 122.99 1xck h ASP 83 Ca 0.23 -0.11 -0.26 0.00 0.02 0.00 0.00 57.03 56.91 1xck h ASP 83 Cb 0.30 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 39.60 1xck h ASP 83 CO -0.01 0.83 -1.15 0.00 -1.72 0.00 0.00 179.24 177.19 1xck h ALA 84 N 1.32 0.17 0.00 3.45 0.00 -0.93 -3.39 119.26 119.88 1xck h ALA 84 Ca 0.26 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1xck h ALA 84 Cb 0.11 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1xck h ALA 84 CO -0.03 0.88 0.00 0.00 0.00 0.00 0.00 179.25 180.10 1xck n ALA 85 N -2.55 1.65 -1.00 0.00 0.00 -0.52 -5.00 120.51 113.09 1xck n ALA 85 Ca -0.09 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1xck n ALA 85 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.41 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 -0.10 0.38 3.63 0.00 0.00 0.22 -4.55 105.19 104.76 1xck n GLY 86 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.01 -0.14 0.00 1.61 2.15 -1.24 -4.93 116.67 112.12 1xck s ASP 87 Ca 0.00 -0.15 0.00 0.00 0.43 0.00 0.00 52.55 52.83 1xck s ASP 87 Cb 0.00 0.25 0.00 0.00 -0.30 0.00 0.00 42.92 42.87 1xck s ASP 87 CO 0.00 -0.45 0.00 0.61 -0.17 0.00 0.00 175.17 175.16 1xck n GLY 88 N -0.37 0.81 0.22 2.66 0.00 -1.26 -3.96 105.19 103.29 1xck n GLY 88 Ca -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 1xck n GLY 88 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xck h THR 89 N 0.00 1.27 -0.35 2.61 2.02 -1.89 0.14 112.91 116.71 1xck h THR 89 Ca 0.00 -1.10 -0.08 0.00 0.77 0.00 0.00 66.41 66.00 1xck h THR 89 Cb 0.00 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1xck h THR 89 CO 0.00 0.37 -0.11 0.74 0.37 0.00 0.00 175.52 176.89 1xck h THR 90 N 0.53 1.28 -0.15 3.16 2.02 -1.90 -1.71 112.91 116.13 1xck h THR 90 Ca 0.10 -1.19 0.03 0.00 0.77 0.00 0.00 66.41 66.13 1xck h THR 90 Cb 0.55 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 68.26 1xck h THR 90 CO 0.03 0.39 -0.04 0.74 0.37 0.00 0.00 175.52 177.01 1xck h THR 91 N 0.47 0.84 -0.99 3.16 2.02 -1.96 -0.69 112.91 115.77 1xck h THR 91 Ca 0.08 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.37 1xck h THR 91 Cb 0.62 0.84 -0.08 0.00 -1.74 0.00 0.00 68.15 67.80 1xck h THR 91 CO 0.04 0.00 0.63 0.00 0.37 0.00 0.00 175.52 176.56 1xck h ALA 92 N 1.15 1.51 -0.12 6.16 0.00 -0.85 -0.21 119.26 126.90 1xck h ALA 92 Ca 0.07 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1xck h ALA 92 Cb 0.12 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1xck h ALA 92 CO -0.16 0.27 0.01 1.15 0.00 0.00 0.00 179.25 180.52 1xck h THR 93 N 1.02 1.24 0.00 0.00 2.02 -0.33 0.49 112.91 117.36 1xck h THR 93 Ca 0.47 -0.76 -0.08 0.00 0.77 0.00 0.00 66.41 66.81 1xck h THR 93 Cb 0.40 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 1xck h THR 93 CO -0.23 0.22 -0.37 -0.37 0.37 0.00 0.00 175.52 175.14 1xck h VAL 94 N -0.04 1.22 -0.25 3.16 -1.51 -0.64 -0.97 116.25 117.22 1xck h VAL 94 Ca 0.04 -1.29 -0.05 0.00 -1.23 0.00 0.00 66.70 64.17 1xck h VAL 94 Cb 0.33 1.70 -0.01 0.00 -2.13 0.00 0.00 31.29 31.19 1xck h VAL 94 CO 0.00 0.36 -0.04 -0.07 -1.23 0.00 0.00 177.57 176.60 1xck h LEU 95 N 0.00 0.47 -0.69 4.19 3.38 -0.84 -1.65 115.31 120.17 1xck h LEU 95 Ca -0.00 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1xck h LEU 95 Cb 0.67 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1xck h LEU 95 CO 0.05 0.71 0.45 0.00 0.09 0.00 0.00 178.44 179.73 1xck h ALA 96 N 0.78 0.87 -0.50 1.53 0.00 -0.48 -0.69 119.26 120.76 1xck h ALA 96 Ca 0.07 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1xck h ALA 96 Cb 0.49 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1xck h ALA 96 CO 0.02 0.30 0.30 0.37 0.00 0.00 0.00 179.25 180.24 1xck h GLN 97 N 0.93 0.57 -0.15 0.00 4.15 -1.03 0.11 115.11 119.70 1xck h GLN 97 Ca 0.25 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.63 1xck h GLN 97 Cb -0.09 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.46 1xck h GLN 97 CO -0.05 0.38 0.08 0.00 -1.93 0.00 0.00 178.83 177.31 1xck h ALA 98 N 1.23 0.19 -0.16 3.38 0.00 -0.71 -0.37 119.26 122.81 1xck h ALA 98 Ca 0.20 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 98 Cb 0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1xck h ALA 98 CO -0.10 -0.27 0.04 0.82 0.00 0.00 0.00 179.25 179.74 1xck h ILE 99 N 0.14 1.20 -0.45 0.00 2.04 -0.90 -2.84 117.51 116.70 1xck h ILE 99 Ca 0.05 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.30 1xck h ILE 99 Cb 0.08 1.32 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 1xck h ILE 99 CO -0.01 0.19 0.24 0.40 0.00 0.00 0.00 178.15 178.97 1xck h ILE 100 N 0.07 0.98 0.72 -0.67 2.04 -0.65 0.25 117.51 120.25 1xck h ILE 100 Ca 0.05 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 1xck h ILE 100 Cb 0.26 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1xck h ILE 100 CO 0.00 0.09 -0.46 0.74 0.00 0.00 0.00 178.15 178.52 1xck h THR 101 N 0.47 0.08 -0.68 -0.27 2.02 -1.02 -0.08 112.91 113.43 1xck h THR 101 Ca 0.19 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.33 1xck h THR 101 Cb 0.08 0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.54 1xck h THR 101 CO -0.13 0.00 0.25 -0.33 0.37 0.00 0.00 175.52 175.68 1xck h GLU 102 N -1.11 1.02 -0.31 6.66 4.39 -1.45 -1.94 114.58 121.84 1xck h GLU 102 Ca -0.09 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.42 1xck h GLU 102 Cb 0.90 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 29.37 1xck h GLU 102 CO 0.08 0.85 0.20 0.78 -1.16 0.00 0.00 179.01 179.76 1xck h GLY 103 N 1.07 0.45 1.82 -3.84 0.00 -0.80 -1.51 103.07 100.25 1xck h GLY 103 Ca 0.23 -0.18 -0.06 0.00 0.00 0.00 0.00 47.33 47.32 1xck h GLY 103 CO -0.02 0.17 -0.19 1.41 0.00 0.00 0.00 176.54 177.92 1xck h LEU 104 N 0.41 0.21 -0.22 3.11 3.38 -0.77 0.11 115.31 121.55 1xck h LEU 104 Ca 0.11 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1xck h LEU 104 Cb -0.01 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1xck h LEU 104 CO -0.02 0.42 0.14 0.11 0.09 0.00 0.00 178.44 179.18 1xck h LYS 105 N 0.21 0.29 -0.49 1.13 1.57 -0.77 -0.70 116.57 117.80 1xck h LYS 105 Ca 0.04 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1xck h LYS 105 Cb 0.46 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 1xck h LYS 105 CO 0.03 0.20 0.29 0.00 -0.57 0.00 0.00 179.45 179.40 1xck h ALA 106 N 1.07 0.62 -0.97 3.86 0.00 -0.57 -0.84 119.26 122.45 1xck h ALA 106 Ca 0.08 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1xck h ALA 106 Cb -0.02 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.51 1xck h ALA 106 CO -0.02 0.12 0.62 0.28 0.00 0.00 0.00 179.25 180.25 1xck h VAL 107 N 0.65 1.12 -0.04 0.00 2.07 -0.56 -0.67 116.25 118.83 1xck h VAL 107 Ca 0.18 -0.40 -0.10 0.00 0.82 0.00 0.00 66.70 67.19 1xck h VAL 107 Cb -0.00 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 29.60 1xck h VAL 107 CO -0.03 0.21 -0.46 0.00 0.02 0.00 0.00 177.57 177.31 1xck h ALA 108 N 1.42 1.16 0.00 1.67 0.00 -0.65 -1.51 119.26 121.34 1xck h ALA 108 Ca 0.40 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1xck h ALA 108 Cb 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1xck h ALA 108 CO -0.15 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.70 1xck n ALA 109 N -2.46 2.19 -0.31 0.00 0.00 -0.34 -4.84 120.51 114.76 1xck n ALA 109 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1xck n ALA 109 Cb 0.50 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 0.32 0.84 3.84 0.00 0.00 -0.57 -5.07 105.19 104.55 1xck n GLY 110 Ca 0.13 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.68 4.03 -0.08 1.61 1.00 -0.69 -4.99 119.30 119.50 1xck s MET 111 Ca 0.00 0.96 -0.30 0.00 0.00 0.00 0.00 55.69 56.36 1xck s MET 111 Cb 0.00 -2.18 -0.04 0.00 0.00 0.00 0.00 34.83 32.61 1xck s MET 111 CO 0.00 -0.16 1.51 1.21 0.00 0.00 0.00 175.02 177.58 1xck s ASN 112 N -2.76 6.77 0.16 3.03 3.84 -1.26 -4.43 114.94 120.29 1xck s ASN 112 Ca 0.59 2.06 -0.17 0.00 0.21 0.00 0.00 52.86 55.55 1xck s ASN 112 Cb -0.10 -2.54 0.07 0.00 -0.55 0.00 0.00 41.25 38.14 1xck s ASN 112 CO 0.25 -0.85 1.70 -0.65 -2.79 0.00 0.00 177.10 174.76 1xck h PRO 113 N 8.93 0.08 -0.71 0.43 0.11 -1.94 -0.49 132.00 138.40 1xck h PRO 113 Ca -0.35 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 1xck h PRO 113 Cb 1.15 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 1xck h PRO 113 CO 0.95 0.05 0.42 0.52 -0.21 0.00 0.00 178.00 179.73 1xck h MET 114 N 0.08 0.97 -0.26 1.05 2.86 -1.91 -1.04 114.93 116.68 1xck h MET 114 Ca 0.17 -0.09 -0.19 0.00 -2.06 0.00 0.00 59.70 57.53 1xck h MET 114 Cb 0.24 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.70 1xck h MET 114 CO -0.30 0.69 -0.58 -0.44 1.06 0.00 0.00 176.91 177.35 1xck h ASP 115 N 0.98 0.91 -0.93 1.22 3.32 -1.77 -1.81 116.42 118.34 1xck h ASP 115 Ca 0.26 -0.50 0.02 0.00 0.02 0.00 0.00 57.03 56.83 1xck h ASP 115 Cb -0.02 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.22 1xck h ASP 115 CO -0.05 1.29 0.61 -0.07 -1.72 0.00 0.00 179.24 179.31 1xck h LEU 116 N 0.62 1.04 -0.30 1.55 3.38 -0.67 -0.55 115.31 120.37 1xck h LEU 116 Ca 0.01 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1xck h LEU 116 Cb 1.18 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1xck h LEU 116 CO 0.12 0.73 0.04 0.50 0.09 0.00 0.00 178.44 179.92 1xck h LYS 117 N 1.22 0.50 -0.82 1.13 3.64 -1.03 -1.51 116.57 119.70 1xck h LYS 117 Ca 0.36 -0.14 -0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1xck h LYS 117 Cb -0.06 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.66 1xck h LYS 117 CO -0.10 0.62 0.49 -0.09 -2.27 0.00 0.00 179.45 178.10 1xck h ARG 118 N 0.32 1.11 -0.49 1.90 2.43 -0.84 0.40 114.38 119.20 1xck h ARG 118 Ca 0.09 -0.10 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1xck h ARG 118 Cb 0.37 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 1xck h ARG 118 CO 0.01 0.78 -0.06 0.78 -1.51 0.00 0.00 179.97 179.96 1xck h GLY 119 N 1.15 0.99 0.92 2.80 0.00 -0.97 -0.48 103.07 107.48 1xck h GLY 119 Ca 0.29 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 1xck h GLY 119 CO -0.06 0.71 0.09 -2.22 0.00 0.00 0.00 176.54 175.07 1xck h ILE 120 N 0.77 1.12 -0.59 2.60 2.04 -0.67 -1.67 117.51 121.11 1xck h ILE 120 Ca 0.13 -0.35 0.01 0.00 1.00 0.00 0.00 64.86 65.65 1xck h ILE 120 Cb 0.60 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1xck h ILE 120 CO 0.04 0.12 0.39 0.44 0.00 0.00 0.00 178.15 179.14 1xck h ASP 121 N 0.18 0.67 -0.12 1.72 3.32 -0.81 -0.18 116.42 121.19 1xck h ASP 121 Ca 0.06 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.11 1xck h ASP 121 Cb 0.11 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1xck h ASP 121 CO -0.01 0.48 0.02 0.50 -1.72 0.00 0.00 179.24 178.52 1xck h LYS 122 N 0.79 0.07 -0.57 3.56 3.64 -0.87 0.46 116.57 123.66 1xck h LYS 122 Ca 0.22 -0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.66 1xck h LYS 122 Cb -0.08 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.67 1xck h LYS 122 CO -0.05 0.05 0.26 0.00 -2.27 0.00 0.00 179.45 177.43 1xck h ALA 123 N 1.09 0.73 -0.20 5.00 0.00 -0.90 -0.80 119.26 124.18 1xck h ALA 123 Ca 0.05 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xck h ALA 123 Cb 0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1xck h ALA 123 CO -0.08 -0.12 0.10 0.28 0.00 0.00 0.00 179.25 179.43 1xck h VAL 124 N 0.48 1.13 -0.30 0.00 2.07 -0.47 0.28 116.25 119.43 1xck h VAL 124 Ca 0.27 -0.39 0.06 0.00 0.82 0.00 0.00 66.70 67.46 1xck h VAL 124 Cb 0.25 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 1xck h VAL 124 CO -0.22 0.13 -0.08 0.74 0.02 0.00 0.00 177.57 178.16 1xck h THR 125 N 0.19 0.69 -0.91 2.57 2.02 -0.46 0.15 112.91 117.15 1xck h THR 125 Ca 0.07 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 1xck h THR 125 Cb 0.12 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 67.18 1xck h THR 125 CO -0.01 0.00 0.51 0.00 0.37 0.00 0.00 175.52 176.39 1xck h ALA 126 N 1.30 1.17 -0.70 6.16 0.00 -0.93 -2.60 119.26 123.66 1xck h ALA 126 Ca 0.15 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1xck h ALA 126 Cb 0.22 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1xck h ALA 126 CO -0.31 0.67 0.31 0.00 0.00 0.00 0.00 179.25 179.91 1xck h ALA 127 N 1.28 0.91 -0.50 0.00 0.00 0.99 -1.39 119.26 120.55 1xck h ALA 127 Ca 0.32 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 127 Cb 0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1xck h ALA 127 CO -0.05 0.50 0.17 0.28 0.00 0.00 0.00 179.25 180.14 1xck h VAL 128 N 0.99 1.20 -0.16 0.00 2.07 -0.43 0.13 116.25 120.04 1xck h VAL 128 Ca 0.24 -0.65 -0.07 0.00 0.82 0.00 0.00 66.70 67.04 1xck h VAL 128 Cb 0.16 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1xck h VAL 128 CO -0.02 0.25 -0.17 -0.33 0.02 0.00 0.00 177.57 177.31 1xck h GLU 129 N 0.71 0.40 -0.11 1.57 4.39 -1.11 -2.17 114.58 118.26 1xck h GLU 129 Ca 0.17 -0.21 0.03 0.00 0.34 0.00 0.00 59.36 59.69 1xck h GLU 129 Cb 0.19 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1xck h GLU 129 CO -0.01 0.78 0.10 1.49 -1.16 0.00 0.00 179.01 180.20 1xck h GLU 130 N 0.04 0.00 -0.02 2.33 4.57 -0.76 -0.45 114.58 120.28 1xck h GLU 130 Ca 0.02 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.01 1xck h GLU 130 Cb 0.71 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.29 1xck h GLU 130 CO 0.04 0.00 -0.84 1.25 -1.18 0.00 0.00 179.01 178.28 1xck h LEU 131 N 0.00 0.40 -0.63 1.64 5.85 -0.32 -2.45 115.31 119.80 1xck h LEU 131 Ca 0.05 -0.30 -0.15 0.00 0.84 0.00 0.00 57.88 58.33 1xck h LEU 131 Cb 0.25 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1xck h LEU 131 CO -0.00 1.07 -0.53 0.11 -0.34 0.00 0.00 178.44 178.76 1xck h LYS 132 N 0.19 0.43 -0.54 1.25 1.57 -0.48 -2.29 116.57 116.70 1xck h LYS 132 Ca -0.05 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.38 1xck h LYS 132 Cb 1.45 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.77 1xck h LYS 132 CO 0.14 0.85 -0.03 0.00 -0.57 0.00 0.00 179.45 179.83 1xck h ALA 133 N 1.10 0.73 0.00 3.86 0.00 -1.35 -2.71 119.26 120.90 1xck h ALA 133 Ca 0.01 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 1xck h ALA 133 Cb 1.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1xck h ALA 133 CO 0.09 0.58 -0.35 1.25 0.00 0.00 0.00 179.25 180.82 1xck h LEU 134 N 0.85 0.00 -9.81 0.00 7.12 -1.30 -3.45 115.31 108.71 1xck h LEU 134 Ca 0.15 0.00 -0.56 0.00 0.13 0.00 0.00 57.88 57.60 1xck h LEU 134 Cb 0.58 0.00 0.11 0.00 -0.53 0.00 0.00 40.66 40.82 1xck h LEU 134 CO 0.03 0.35 0.62 -0.24 -0.13 0.00 0.00 178.44 179.07 1xck n SER 135 N -3.90 3.17 -4.38 1.25 2.88 -0.88 -4.88 113.62 106.88 1xck n SER 135 Ca -0.02 1.21 -0.33 0.00 -1.33 0.00 0.00 58.87 58.40 1xck n SER 135 Cb 0.41 -1.54 -0.14 0.00 -0.75 0.00 0.00 64.21 62.20 1xck n SER 135 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1xck s VAL 136 N -1.02 3.21 0.72 2.46 1.01 -0.12 -4.91 120.40 121.75 1xck s VAL 136 Ca 0.55 -0.60 -0.15 0.00 0.00 0.00 0.00 61.98 61.79 1xck s VAL 136 Cb -0.54 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 33.51 1xck s VAL 136 CO 0.62 0.51 1.19 -2.84 0.00 0.00 0.00 175.10 174.58 1xck s PRO 137 N 0.46 2.21 -0.39 2.72 0.02 -1.26 -0.70 135.00 138.06 1xck s PRO 137 Ca -0.08 1.70 0.01 0.00 0.02 0.00 0.00 61.00 62.66 1xck s PRO 137 Cb -0.15 -1.85 0.15 0.00 0.02 0.00 0.00 34.50 32.67 1xck s PRO 137 CO 0.04 -1.77 0.26 0.00 -0.33 0.00 0.00 177.00 175.20 1xck n SER 139 N 3.60 1.07 -4.71 0.00 7.64 -1.26 -4.18 113.62 115.78 1xck n SER 139 Ca 0.16 0.15 -0.39 0.00 1.01 0.00 0.00 58.87 59.80 1xck n SER 139 Cb 0.39 -0.35 0.04 0.00 -1.01 0.00 0.00 64.21 63.28 1xck n SER 139 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1xck n ASP 140 N -3.56 2.34 0.09 6.43 5.75 -1.26 -4.74 116.55 121.60 1xck n ASP 140 Ca -0.03 0.98 0.07 0.00 -0.01 0.00 0.00 54.79 55.80 1xck n ASP 140 Cb 0.17 -1.53 0.35 0.00 -1.03 0.00 0.00 41.12 39.08 1xck n ASP 140 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1xck n SER 141 N -0.68 0.33 -0.07 -1.12 3.41 -1.26 -1.15 113.62 113.08 1xck n SER 141 Ca 0.10 0.64 -0.13 0.00 -0.26 0.00 0.00 58.87 59.21 1xck n SER 141 Cb 0.44 -0.69 -0.01 0.00 -0.26 0.00 0.00 64.21 63.69 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 0.83 -0.14 4.33 3.64 -2.00 -1.86 116.57 121.37 1xck h LYS 142 Ca 0.00 -0.50 -0.10 0.00 -1.27 0.00 0.00 60.65 58.78 1xck h LYS 142 Cb 0.08 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1xck h LYS 142 CO 0.00 1.13 -0.31 0.00 -2.27 0.00 0.00 179.45 178.00 1xck h ALA 143 N 0.77 0.22 -0.91 5.00 0.00 -1.48 -2.69 119.26 120.17 1xck h ALA 143 Ca 0.03 -0.42 0.14 0.00 0.00 0.00 0.00 54.91 54.66 1xck h ALA 143 Cb 1.10 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 1xck h ALA 143 CO 0.11 0.26 0.58 0.82 0.00 0.00 0.00 179.25 181.02 1xck h ILE 144 N 0.06 0.84 -0.18 0.00 2.04 -1.32 -0.50 117.51 118.45 1xck h ILE 144 Ca -0.00 -0.25 -0.07 0.00 1.00 0.00 0.00 64.86 65.54 1xck h ILE 144 Cb 0.92 0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.04 1xck h ILE 144 CO 0.07 0.13 -0.18 0.00 0.00 0.00 0.00 178.15 178.17 1xck h ALA 145 N 1.59 0.26 -0.53 1.87 0.00 -1.27 -2.26 119.26 118.92 1xck h ALA 145 Ca 0.46 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 145 Cb 0.71 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1xck h ALA 145 CO -0.22 0.17 0.34 1.96 0.00 0.00 0.00 179.25 181.50 1xck h GLN 146 N 0.09 0.67 0.11 0.00 4.20 -0.88 0.20 115.11 119.49 1xck h GLN 146 Ca 0.03 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1xck h GLN 146 Cb 0.71 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.35 1xck h GLN 146 CO 0.04 0.44 -0.05 0.28 -0.67 0.00 0.00 178.83 178.87 1xck h VAL 147 N 0.69 0.97 -0.80 -0.54 2.07 -1.19 -0.42 116.25 117.03 1xck h VAL 147 Ca 0.20 -0.30 0.07 0.00 0.82 0.00 0.00 66.70 67.49 1xck h VAL 147 Cb -0.04 1.16 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 1xck h VAL 147 CO -0.06 0.07 0.53 1.23 0.02 0.00 0.00 177.57 179.35 1xck h GLY 148 N -0.28 1.11 1.06 2.17 0.00 -1.14 0.25 103.07 106.23 1xck h GLY 148 Ca -0.02 -0.35 -0.11 0.00 0.00 0.00 0.00 47.33 46.86 1xck h GLY 148 CO 0.02 0.26 -0.11 -0.84 0.00 0.00 0.00 176.54 175.87 1xck h THR 149 N 0.87 1.27 -0.50 4.70 2.02 -0.24 0.70 112.91 121.73 1xck h THR 149 Ca 0.35 -1.24 -0.11 0.00 0.77 0.00 0.00 66.41 66.17 1xck h THR 149 Cb 0.24 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1xck h THR 149 CO -0.12 0.43 -0.14 0.40 0.37 0.00 0.00 175.52 176.46 1xck h ILE 150 N 0.80 1.27 -0.03 3.11 2.04 -0.31 0.50 117.51 124.89 1xck h ILE 150 Ca 0.13 -1.29 -0.12 0.00 1.00 0.00 0.00 64.86 64.58 1xck h ILE 150 Cb 0.66 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1xck h ILE 150 CO 0.05 0.45 -0.54 0.28 0.00 0.00 0.00 178.15 178.38 1xck h SER 151 N 0.84 0.09 -0.08 1.72 0.02 -0.84 -2.63 113.55 112.67 1xck h SER 151 Ca 0.13 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1xck h SER 151 Cb 0.69 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.21 1xck h SER 151 CO 0.05 0.62 0.00 0.00 -1.14 0.00 0.00 176.83 176.36 1xck n ALA 152 N -2.45 2.52 -2.88 3.77 0.00 0.23 -4.52 120.51 117.18 1xck n ALA 152 Ca -0.02 -0.16 -0.08 0.00 0.00 0.00 0.00 53.44 53.18 1xck n ALA 152 Cb 0.56 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 19.04 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 -0.19 -3.51 -0.43 0.00 5.15 -0.99 -3.57 115.26 111.73 1xck n ASN 153 Ca 0.03 -0.19 -0.05 0.00 -0.60 0.00 0.00 54.58 53.77 1xck n ASN 153 Cb 0.13 -2.11 -0.02 0.00 -0.53 0.00 0.00 39.78 37.25 1xck n ASN 153 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1xck n SER 154 N -0.16 -3.21 -4.40 1.20 7.64 0.17 -5.00 113.62 109.87 1xck n SER 154 Ca -0.00 0.09 -0.44 0.00 1.01 0.00 0.00 58.87 59.53 1xck n SER 154 Cb 0.52 -1.54 -0.04 0.00 -1.01 0.00 0.00 64.21 62.15 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 -2.90 6.20 0.53 6.43 -1.08 -1.10 -4.89 116.67 119.86 1xck s ASP 155 Ca 0.00 -1.33 0.21 0.00 -0.52 0.00 0.00 52.55 50.91 1xck s ASP 155 Cb 0.00 -2.34 1.35 0.00 -1.46 0.00 0.00 42.92 40.47 1xck s ASP 155 CO 0.00 -1.21 2.09 -0.33 0.52 0.00 0.00 175.17 176.23 1xck h GLU 156 N 9.29 0.00 -0.23 4.34 5.08 -1.94 -2.27 114.58 128.84 1xck h GLU 156 Ca -0.28 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.11 1xck h GLU 156 Cb 1.08 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.30 1xck h GLU 156 CO 1.12 0.00 0.07 1.15 -1.00 0.00 0.00 179.01 180.36 1xck h THR 157 N 0.00 0.93 -0.67 1.13 2.02 -1.97 -0.29 112.91 114.06 1xck h THR 157 Ca 0.11 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.20 1xck h THR 157 Cb 0.44 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 1xck h THR 157 CO -0.00 0.03 0.31 0.58 0.37 0.00 0.00 175.52 176.81 1xck h VAL 158 N 0.18 1.23 -0.41 3.16 2.07 -1.77 0.81 116.25 121.51 1xck h VAL 158 Ca 0.10 -0.66 0.04 0.00 0.82 0.00 0.00 66.70 67.00 1xck h VAL 158 Cb 0.07 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1xck h VAL 158 CO -0.11 0.27 0.20 1.23 0.02 0.00 0.00 177.57 179.18 1xck h GLY 159 N 0.93 0.56 0.89 2.17 0.00 -1.27 -0.03 103.07 106.32 1xck h GLY 159 Ca 0.23 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 1xck h GLY 159 CO -0.03 0.09 -0.42 1.70 0.00 0.00 0.00 176.54 177.88 1xck h LYS 160 N 0.40 -1.05 -0.66 4.80 3.64 -0.65 0.29 116.57 123.33 1xck h LYS 160 Ca 0.18 0.07 0.10 0.00 -1.27 0.00 0.00 60.65 59.73 1xck h LYS 160 Cb 0.10 0.24 -0.12 0.00 -0.41 0.00 0.00 32.23 32.05 1xck h LYS 160 CO -0.14 -0.70 -0.43 -0.07 -2.27 0.00 0.00 179.45 175.84 1xck h LEU 161 N -1.09 -1.49 -0.59 5.20 3.38 -0.57 0.24 115.31 120.38 1xck h LEU 161 Ca -0.10 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1xck h LEU 161 Cb 0.87 0.70 -0.03 0.00 0.09 0.00 0.00 40.66 42.28 1xck h LEU 161 CO 0.12 -0.32 0.38 0.40 0.09 0.00 0.00 178.44 179.11 1xck h ILE 162 N -0.17 1.16 -0.39 1.22 2.04 -0.90 -0.15 117.51 120.32 1xck h ILE 162 Ca 0.21 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1xck h ILE 162 Cb 0.56 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1xck h ILE 162 CO -0.74 0.16 0.26 0.00 0.00 0.00 0.00 178.15 177.82 1xck h ALA 163 N 1.20 0.50 -0.41 1.87 0.00 0.49 -0.74 119.26 122.17 1xck h ALA 163 Ca 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1xck h ALA 163 Cb -0.07 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1xck h ALA 163 CO -0.04 -0.04 0.18 0.93 0.00 0.00 0.00 179.25 180.28 1xck h GLU 164 N 0.53 0.61 -0.84 0.00 5.08 -0.27 -1.44 114.58 118.26 1xck h GLU 164 Ca 0.14 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1xck h GLU 164 Cb -0.05 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 1xck h GLU 164 CO -0.03 0.55 0.49 0.00 -1.00 0.00 0.00 179.01 179.01 1xck h ALA 165 N 1.03 1.07 0.00 3.43 0.00 -0.75 -1.73 119.26 122.30 1xck h ALA 165 Ca 0.14 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1xck h ALA 165 Cb 0.16 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1xck h ALA 165 CO -0.01 0.55 -0.41 0.52 0.00 0.00 0.00 179.25 179.90 1xck h MET 166 N 1.15 0.00 -0.28 0.00 2.86 -0.94 -2.43 114.93 115.30 1xck h MET 166 Ca 0.30 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.81 1xck h MET 166 Cb -0.01 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1xck h MET 166 CO -0.05 0.41 -0.34 0.22 1.06 0.00 0.00 176.91 178.20 1xck h ASP 167 N 0.00 0.64 0.13 1.22 3.58 -0.53 0.39 116.42 121.85 1xck h ASP 167 Ca -0.00 -0.26 -0.01 0.00 0.42 0.00 0.00 57.03 57.18 1xck h ASP 167 Cb 0.76 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.63 1xck h ASP 167 CO 0.05 0.93 -0.06 0.11 -2.88 0.00 0.00 179.24 177.39 1xck h LYS 168 N 0.52 -0.17 -0.01 0.28 1.79 -0.87 -3.35 116.57 114.76 1xck h LYS 168 Ca 0.06 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1xck h LYS 168 Cb 0.84 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.53 1xck h LYS 168 CO 0.07 0.18 -0.74 1.33 -1.08 0.00 0.00 179.45 179.21 1xck n VAL 169 N -5.00 0.00 0.00 0.50 0.24 -1.02 -5.10 118.33 107.95 1xck n VAL 169 Ca -0.09 -0.13 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 1xck n VAL 169 Cb 0.22 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.72 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 1.45 0.31 0.38 7.63 0.00 0.14 -3.18 105.19 111.92 1xck n GLY 170 Ca 0.06 -1.85 -0.00 0.00 0.00 0.00 0.00 46.02 44.23 1xck n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xck h LYS 171 N 0.00 1.26 -0.01 1.61 1.79 -1.95 -1.99 116.57 117.27 1xck h LYS 171 Ca 0.00 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1xck h LYS 171 Cb 0.00 -0.28 0.00 0.00 -1.58 0.00 0.00 32.23 30.37 1xck h LYS 171 CO 0.00 0.83 -0.01 0.39 -1.08 0.00 0.00 179.45 179.58 1xck n GLU 172 N -4.42 1.51 -1.04 3.15 -0.58 -1.26 -4.96 120.64 113.03 1xck n GLU 172 Ca 0.13 -0.77 -0.29 0.00 -0.42 0.00 0.00 57.16 55.81 1xck n GLU 172 Cb 0.07 -1.48 0.17 0.00 -0.57 0.00 0.00 31.44 29.62 1xck n GLU 172 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1xck s GLY 173 N -2.03 1.60 -0.27 0.62 0.00 -0.75 -5.01 107.32 101.48 1xck s GLY 173 Ca 0.39 -0.06 -0.13 0.00 0.00 0.00 0.00 44.72 44.92 1xck s GLY 173 CO 0.35 0.48 0.28 0.14 0.00 0.00 0.00 173.10 174.35 1xck s VAL 174 N -2.83 5.25 -0.09 1.40 1.01 -1.26 -4.95 120.40 118.92 1xck s VAL 174 Ca 0.65 0.37 0.02 0.00 0.00 0.00 0.00 61.98 63.03 1xck s VAL 174 Cb -0.20 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 1xck s VAL 174 CO 0.58 0.22 -0.17 -0.63 0.00 0.00 0.00 175.10 175.11 1xck s ILE 175 N 1.81 2.78 0.26 2.22 1.01 -1.26 -0.18 121.20 127.84 1xck s ILE 175 Ca 0.11 -0.78 0.12 0.00 0.00 0.00 0.00 60.65 60.10 1xck s ILE 175 Cb -0.16 -2.12 -0.05 0.00 0.01 0.00 0.00 42.46 40.15 1xck s ILE 175 CO 0.10 0.55 -0.20 -0.89 0.00 0.00 0.00 174.94 174.50 1xck s THR 176 N -0.01 2.48 -0.04 2.92 2.01 0.11 -4.96 115.64 118.15 1xck s THR 176 Ca -0.05 -2.33 0.02 0.00 0.31 0.00 0.00 61.69 59.64 1xck s THR 176 Cb -0.14 -2.28 0.01 0.00 0.01 0.00 0.00 72.50 70.10 1xck s THR 176 CO 0.04 -0.35 -0.07 -0.69 -0.69 0.00 0.00 174.62 172.87 1xck s VAL 177 N -2.35 0.67 0.18 3.82 1.01 -1.26 -1.03 120.40 121.45 1xck s VAL 177 Ca 0.28 -0.24 -0.00 0.00 0.00 0.00 0.00 61.98 62.02 1xck s VAL 177 Cb -0.06 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 1xck s VAL 177 CO 0.14 0.24 0.09 -1.61 0.00 0.00 0.00 175.10 173.96 1xck s GLU 178 N 0.63 1.13 0.61 2.72 2.02 -0.21 -4.95 118.70 120.65 1xck s GLU 178 Ca -0.09 -1.58 -0.19 0.00 0.02 0.00 0.00 54.97 53.13 1xck s GLU 178 Cb -0.13 0.12 -0.03 0.00 0.10 0.00 0.00 34.13 34.20 1xck s GLU 178 CO 0.01 -0.30 1.28 -0.51 0.02 0.00 0.00 175.26 175.75 1xck s ASP 179 N -3.15 4.92 0.42 -0.19 1.01 -1.26 -1.86 116.67 116.57 1xck s ASP 179 Ca 0.32 2.58 -0.08 0.00 0.71 0.00 0.00 52.55 56.08 1xck s ASP 179 Cb 0.07 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.33 1xck s ASP 179 CO 0.08 -1.79 0.76 -0.83 0.21 0.00 0.00 175.17 173.60 1xck s GLY 180 N -1.37 1.76 0.44 0.21 0.00 -0.49 -4.42 107.32 103.46 1xck s GLY 180 Ca 0.79 -0.36 0.24 0.00 0.00 0.00 0.00 44.72 45.39 1xck s GLY 180 CO 0.39 -0.18 1.70 -0.91 0.00 0.00 0.00 173.10 174.10 1xck h THR 181 N 0.77 0.23 0.00 0.90 1.35 -1.87 -3.48 112.91 110.81 1xck h THR 181 Ca -0.47 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.28 1xck h THR 181 Cb 1.19 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 69.54 1xck h THR 181 CO 0.63 0.12 0.00 0.61 -0.25 0.00 0.00 175.52 176.63 1xck n GLY 182 N 0.73 -0.80 3.77 5.82 0.00 -1.26 -5.12 105.19 108.33 1xck n GLY 182 Ca 0.02 -0.28 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 1xck n GLY 182 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xck s LEU 183 N 0.00 4.38 0.00 0.99 1.98 -1.15 -2.56 118.68 122.32 1xck s LEU 183 Ca 0.00 2.15 0.00 0.00 -2.89 0.00 0.00 54.13 53.39 1xck s LEU 183 Cb 0.00 -3.87 0.00 0.00 0.66 0.00 0.00 46.19 42.98 1xck s LEU 183 CO 0.00 -0.28 0.00 0.00 -1.89 0.00 0.00 176.35 174.18 1xck n GLN 184 N 0.66 0.00 -0.94 1.98 6.02 -1.26 -4.77 117.38 119.07 1xck n GLN 184 Ca 0.01 0.18 -0.29 0.00 -0.01 0.00 0.00 57.00 56.90 1xck n GLN 184 Cb 0.47 0.00 0.22 0.00 1.02 0.00 0.00 30.24 31.95 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 -0.08 1.48 -0.13 1.08 1.01 -1.26 -4.12 116.67 114.66 1xck s ASP 185 Ca 0.00 1.09 -0.12 0.00 0.71 0.00 0.00 52.55 54.24 1xck s ASP 185 Cb 0.00 -1.68 0.04 0.00 1.01 0.00 0.00 42.92 42.29 1xck s ASP 185 CO 0.00 -3.83 0.35 -1.61 0.21 0.00 0.00 175.17 170.29 1xck s GLU 186 N -4.95 0.40 -0.01 8.23 2.02 -0.37 -4.88 118.70 119.14 1xck s GLU 186 Ca 0.68 0.50 0.02 0.00 0.02 0.00 0.00 54.97 56.19 1xck s GLU 186 Cb -0.18 0.17 0.00 0.00 0.10 0.00 0.00 34.13 34.23 1xck s GLU 186 CO 0.59 -0.06 -0.06 -1.17 0.02 0.00 0.00 175.26 174.58 1xck s LEU 187 N 0.29 1.84 -0.29 1.80 2.96 -1.26 -0.18 118.68 123.85 1xck s LEU 187 Ca -0.01 -0.13 -0.18 0.00 -0.22 0.00 0.00 54.13 53.59 1xck s LEU 187 Cb -0.03 -0.38 0.16 0.00 0.50 0.00 0.00 46.19 46.44 1xck s LEU 187 CO -0.01 0.05 1.10 1.51 -1.32 0.00 0.00 176.35 177.68 1xck s ASP 188 N 0.10 -0.35 -0.16 3.68 -4.77 -1.09 -4.99 116.67 109.09 1xck s ASP 188 Ca -0.01 0.58 -0.26 0.00 -3.30 0.00 0.00 52.55 49.57 1xck s ASP 188 Cb -0.06 1.01 -0.02 0.00 -1.09 0.00 0.00 42.92 42.77 1xck s ASP 188 CO -0.00 -0.09 0.84 -0.69 0.70 0.00 0.00 175.17 175.92 1xck s VAL 189 N 0.98 4.88 0.30 2.11 1.01 -1.26 -1.95 120.40 126.47 1xck s VAL 189 Ca -0.05 1.66 0.00 0.00 0.00 0.00 0.00 61.98 63.59 1xck s VAL 189 Cb -0.04 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.19 1xck s VAL 189 CO -0.12 0.04 0.01 1.33 0.00 0.00 0.00 175.10 176.36 1xck n VAL 190 N 4.65 0.00 -2.31 2.92 0.24 -0.51 -4.88 118.33 118.44 1xck n VAL 190 Ca 0.04 -1.47 -0.43 0.00 -2.04 0.00 0.00 64.34 60.44 1xck n VAL 190 Cb 0.49 0.33 -0.02 0.00 -1.47 0.00 0.00 33.84 33.17 1xck n VAL 190 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1xck s GLU 191 N -3.10 4.08 0.03 7.34 0.41 -1.26 -0.87 118.70 125.33 1xck s GLU 191 Ca 0.02 1.65 -0.29 0.00 -0.41 0.00 0.00 54.97 55.94 1xck s GLU 191 Cb 0.00 -3.87 0.10 0.00 -1.78 0.00 0.00 34.13 28.59 1xck s GLU 191 CO 0.01 -0.92 1.20 0.20 -0.49 0.00 0.00 175.26 175.27 1xck s GLY 192 N 2.74 -0.34 0.20 -1.39 0.00 -1.26 0.30 107.32 107.57 1xck s GLY 192 Ca 0.61 0.49 -0.19 0.00 0.00 0.00 0.00 44.72 45.63 1xck s GLY 192 CO 0.21 0.42 0.57 -0.29 0.00 0.00 0.00 173.10 174.01 1xck s MET 193 N -2.60 1.43 -0.11 2.90 1.75 -0.40 -3.90 119.30 118.37 1xck s MET 193 Ca 0.15 -0.83 -0.05 0.00 -1.25 0.00 0.00 55.69 53.71 1xck s MET 193 Cb 0.03 0.55 0.05 0.00 2.84 0.00 0.00 34.83 38.30 1xck s MET 193 CO -0.02 -0.62 0.26 -1.14 -0.65 0.00 0.00 175.02 172.85 1xck s GLN 194 N -3.86 0.20 0.31 4.11 0.74 -1.26 -0.13 119.66 119.76 1xck s GLN 194 Ca 0.08 0.60 0.11 0.00 0.05 0.00 0.00 55.36 56.20 1xck s GLN 194 Cb -0.02 -0.09 -0.05 0.00 1.10 0.00 0.00 33.01 33.94 1xck s GLN 194 CO -0.03 -0.20 -0.12 -0.59 -0.55 0.00 0.00 175.29 173.81 1xck s PHE 195 N 1.60 2.40 -1.26 1.67 -0.71 -0.33 -5.00 117.98 116.36 1xck s PHE 195 Ca -0.06 -0.39 -0.13 0.00 -1.04 0.00 0.00 56.93 55.31 1xck s PHE 195 Cb -0.11 -1.21 0.15 0.00 -1.21 0.00 0.00 43.02 40.65 1xck s PHE 195 CO -0.09 0.63 1.65 -0.25 -1.34 0.00 0.00 175.22 175.82 1xck n ASP 196 N -0.75 5.08 -3.69 1.98 8.00 -1.26 -1.66 116.55 124.24 1xck n ASP 196 Ca -0.05 -3.00 -0.11 0.00 0.71 0.00 0.00 54.79 52.33 1xck n ASP 196 Cb 0.61 -1.57 -0.12 0.00 -0.02 0.00 0.00 41.12 40.03 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 1.59 0.28 0.45 -1.24 1.81 -1.16 -4.85 118.95 115.82 1xck s ARG 197 Ca 0.43 0.75 0.05 0.00 -1.72 0.00 0.00 55.73 55.24 1xck s ARG 197 Cb 0.03 0.01 0.08 0.00 -0.45 0.00 0.00 34.95 34.61 1xck s ARG 197 CO 0.01 -0.20 0.62 0.41 -0.68 0.00 0.00 175.30 175.45 1xck n GLY 198 N 4.68 1.59 3.75 -3.53 0.00 -1.25 -1.76 105.19 108.67 1xck n GLY 198 Ca -0.18 -2.14 -0.42 0.00 0.00 0.00 0.00 46.02 43.28 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 -2.06 2.89 1.08 1.61 0.18 -0.67 -4.44 117.16 115.74 1xck n TYR 199 Ca 0.12 0.29 0.00 0.00 1.88 0.00 0.00 57.90 60.19 1xck n TYR 199 Cb 0.43 -2.59 0.00 0.00 -0.38 0.00 0.00 39.34 36.80 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 1.82 0.25 0.00 -3.48 4.77 -0.13 -4.69 117.00 115.53 1xck n LEU 200 Ca 0.07 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1xck n LEU 200 Cb 0.37 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1xck n LEU 200 CO 0.64 0.06 0.00 -0.24 -1.33 0.00 0.00 177.39 176.52 1xck n SER 201 N -0.25 0.00 -3.06 -1.43 2.88 -1.26 -5.07 113.62 105.43 1xck n SER 201 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1xck n SER 201 Cb 0.06 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 1xck n SER 201 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1xck n PRO 202 N -0.55 2.37 0.00 -1.46 -0.02 -1.26 -3.66 135.00 130.42 1xck n PRO 202 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1xck n PRO 202 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1xck n PRO 202 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1xck n TYR 203 N 0.00 0.00 0.24 6.00 4.01 -1.26 -4.28 117.16 121.87 1xck n TYR 203 Ca 0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 1xck n TYR 203 Cb 0.00 0.00 0.35 0.00 -0.31 0.00 0.00 39.34 39.38 1xck n TYR 203 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1xck n PHE 204 N 0.00 0.41 -2.17 -0.72 3.72 -1.24 -4.62 117.46 112.84 1xck n PHE 204 Ca 0.00 0.19 -0.42 0.00 -0.05 0.00 0.00 57.45 57.17 1xck n PHE 204 Cb 0.00 -0.80 -0.03 0.00 -0.94 0.00 0.00 39.48 37.71 1xck n PHE 204 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1xck s ILE 205 N -3.24 3.60 -0.06 4.37 1.01 -1.26 -4.61 121.20 121.00 1xck s ILE 205 Ca 0.02 0.99 0.01 0.00 0.00 0.00 0.00 60.65 61.66 1xck s ILE 205 Cb 0.06 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.89 1xck s ILE 205 CO 0.20 -0.00 0.34 -0.46 0.00 0.00 0.00 174.94 175.02 1xck n ASN 206 N 5.43 0.68 -3.37 3.58 0.23 -1.10 -4.74 115.26 115.98 1xck n ASN 206 Ca 0.14 -0.84 -0.26 0.00 -0.53 0.00 0.00 54.58 53.08 1xck n ASN 206 Cb 0.43 0.36 -0.08 0.00 -2.08 0.00 0.00 39.78 38.42 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 -0.34 2.25 -0.20 -3.83 4.76 -0.91 -4.95 118.16 114.94 1xck n LYS 207 Ca 0.00 -4.44 0.29 0.00 -2.87 0.00 0.00 58.31 51.30 1xck n LYS 207 Cb 0.01 -2.08 0.73 0.00 -1.84 0.00 0.00 35.03 31.85 1xck n LYS 207 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1xck h PRO 208 N 4.10 0.00 -0.59 1.97 0.13 -1.85 0.68 132.00 136.44 1xck h PRO 208 Ca 0.18 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.22 1xck h PRO 208 Cb 0.69 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.80 1xck h PRO 208 CO 0.77 0.00 0.05 0.93 -0.23 0.00 0.00 178.00 179.52 1xck h GLU 209 N 0.00 1.01 0.00 0.86 3.07 -1.94 -2.64 114.58 114.94 1xck h GLU 209 Ca 0.44 -0.30 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 1xck h GLU 209 Cb 1.79 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 29.59 1xck h GLU 209 CO -0.00 0.98 -0.80 2.41 -1.40 0.00 0.00 179.01 180.19 1xck n THR 210 N -4.26 0.26 -2.05 1.13 -1.04 -0.12 -4.94 114.28 103.26 1xck n THR 210 Ca 0.03 -0.25 -0.17 0.00 -2.04 0.00 0.00 64.05 61.62 1xck n THR 210 Cb 0.31 0.03 -0.03 0.00 -1.82 0.00 0.00 70.33 68.82 1xck n THR 210 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xck n GLY 211 N 1.36 0.31 3.61 3.41 0.00 0.22 -4.98 105.19 109.11 1xck n GLY 211 Ca 0.03 -0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.76 3.23 -0.09 4.61 0.00 -1.08 -4.62 121.76 121.05 1xck s ALA 212 Ca 0.00 -1.53 -0.02 0.00 0.00 0.00 0.00 51.96 50.40 1xck s ALA 212 Cb 0.00 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.41 1xck s ALA 212 CO 0.00 -0.17 0.01 0.08 0.00 0.00 0.00 175.76 175.68 1xck s VAL 213 N -2.96 4.38 -0.17 0.00 1.01 -0.33 -2.13 120.40 120.20 1xck s VAL 213 Ca 0.25 -0.22 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 1xck s VAL 213 Cb 0.06 -2.85 0.05 0.00 0.00 0.00 0.00 36.38 33.65 1xck s VAL 213 CO 0.13 0.60 0.03 -0.70 0.00 0.00 0.00 175.10 175.16 1xck s GLU 214 N -0.85 0.66 -0.09 2.72 2.12 -1.26 -1.73 118.70 120.26 1xck s GLU 214 Ca 0.13 -0.31 0.03 0.00 0.36 0.00 0.00 54.97 55.18 1xck s GLU 214 Cb -0.11 -1.88 -0.02 0.00 0.26 0.00 0.00 34.13 32.38 1xck s GLU 214 CO 0.02 -0.57 -0.17 -0.51 -0.54 0.00 0.00 175.26 173.50 1xck s LEU 215 N 1.88 2.55 -0.16 2.70 1.43 -0.83 -4.96 118.68 121.28 1xck s LEU 215 Ca 0.00 -0.33 -0.04 0.00 -1.03 0.00 0.00 54.13 52.73 1xck s LEU 215 Cb -0.16 -1.53 -0.03 0.00 0.03 0.00 0.00 46.19 44.50 1xck s LEU 215 CO -0.07 0.24 -0.03 -1.61 0.23 0.00 0.00 176.35 175.11 1xck s GLU 216 N -0.13 3.68 -1.49 1.70 2.02 -1.26 -1.58 118.70 121.64 1xck s GLU 216 Ca -0.02 -0.51 -0.10 0.00 0.02 0.00 0.00 54.97 54.36 1xck s GLU 216 Cb -0.14 -2.96 0.07 0.00 0.10 0.00 0.00 34.13 31.20 1xck s GLU 216 CO 0.04 0.21 0.87 0.43 0.02 0.00 0.00 175.26 176.82 1xck n SER 217 N 3.64 -3.55 -4.89 -0.19 7.64 0.33 -4.60 113.62 112.01 1xck n SER 217 Ca -0.17 -0.82 -0.29 0.00 1.01 0.00 0.00 58.87 58.59 1xck n SER 217 Cb 0.52 -3.78 0.04 0.00 -1.01 0.00 0.00 64.21 59.99 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 -6.50 2.84 -0.03 1.43 0.04 -1.19 -4.55 135.00 127.05 1xck s PRO 218 Ca 0.47 0.35 -0.07 0.00 0.04 0.00 0.00 61.00 61.80 1xck s PRO 218 Cb -0.24 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.18 1xck s PRO 218 CO 0.84 -0.98 0.23 -0.06 0.04 0.00 0.00 177.00 177.07 1xck s PHE 219 N -3.29 3.59 -0.18 0.56 0.08 -0.10 -3.21 117.98 115.43 1xck s PHE 219 Ca 0.57 0.56 -0.01 0.00 0.12 0.00 0.00 56.93 58.17 1xck s PHE 219 Cb -0.11 -1.97 -0.00 0.00 -0.57 0.00 0.00 43.02 40.36 1xck s PHE 219 CO 0.50 0.65 -0.11 0.42 -0.10 0.00 0.00 175.22 176.59 1xck s ILE 220 N -1.22 2.94 -0.26 0.64 1.01 0.65 -0.69 121.20 124.26 1xck s ILE 220 Ca 0.24 -0.66 -0.15 0.00 0.00 0.00 0.00 60.65 60.09 1xck s ILE 220 Cb -0.13 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 1xck s ILE 220 CO 0.13 0.48 0.36 -0.22 0.00 0.00 0.00 174.94 175.69 1xck s LEU 221 N 1.10 4.05 -0.45 2.97 2.96 0.56 -0.11 118.68 129.76 1xck s LEU 221 Ca 0.00 0.29 -0.10 0.00 -0.22 0.00 0.00 54.13 54.10 1xck s LEU 221 Cb -0.14 -2.40 0.10 0.00 0.50 0.00 0.00 46.19 44.25 1xck s LEU 221 CO -0.03 -0.16 0.32 -0.76 -1.32 0.00 0.00 176.35 174.41 1xck s LEU 222 N 1.94 5.50 -0.19 -0.68 1.43 -1.26 -0.42 118.68 124.99 1xck s LEU 222 Ca 0.15 -1.73 0.01 0.00 -1.03 0.00 0.00 54.13 51.53 1xck s LEU 222 Cb -0.16 -2.01 0.03 0.00 0.03 0.00 0.00 46.19 44.08 1xck s LEU 222 CO 0.10 -0.64 -0.18 0.00 0.23 0.00 0.00 176.35 175.86 1xck s ALA 223 N 1.40 2.35 -1.17 4.21 0.00 -0.98 -0.30 121.76 127.29 1xck s ALA 223 Ca 0.04 -1.30 -0.15 0.00 0.00 0.00 0.00 51.96 50.55 1xck s ALA 223 Cb -0.25 -1.24 0.16 0.00 0.00 0.00 0.00 23.12 21.78 1xck s ALA 223 CO 0.01 -0.50 1.41 0.34 0.00 0.00 0.00 175.76 177.02 1xck s ASP 224 N 1.27 6.98 0.00 0.00 2.15 -0.72 -2.75 116.67 123.59 1xck s ASP 224 Ca 0.03 -2.79 0.00 0.00 0.43 0.00 0.00 52.55 50.22 1xck s ASP 224 Cb -0.14 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.06 1xck s ASP 224 CO -0.12 -0.84 0.00 2.29 -0.17 0.00 0.00 175.17 176.34 1xck n LYS 225 N 6.03 0.00 -2.37 4.34 -0.00 -1.26 -4.00 118.16 120.90 1xck n LYS 225 Ca 0.35 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 58.25 1xck n LYS 225 Cb 0.44 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.44 1xck n LYS 225 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1xck s LYS 226 N -2.00 4.46 -0.28 -1.58 1.02 -1.26 -2.89 119.74 117.20 1xck s LYS 226 Ca 0.00 1.86 -0.06 0.00 0.02 0.00 0.00 55.97 57.78 1xck s LYS 226 Cb 0.00 -3.28 0.00 0.00 -0.52 0.00 0.00 37.83 34.04 1xck s LYS 226 CO 0.00 -0.17 0.06 0.42 -0.92 0.00 0.00 175.35 174.74 1xck s ILE 227 N 0.42 3.87 -0.01 2.17 1.01 0.90 -4.93 121.20 124.63 1xck s ILE 227 Ca 0.56 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 60.60 1xck s ILE 227 Cb -0.32 -2.96 -0.05 0.00 0.01 0.00 0.00 42.46 39.14 1xck s ILE 227 CO 0.33 0.14 0.08 -1.20 0.00 0.00 0.00 174.94 174.29 1xck n SER 228 N 4.85 4.19 -4.07 3.58 7.64 -1.26 -0.10 113.62 128.46 1xck n SER 228 Ca -0.15 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.43 1xck n SER 228 Cb 0.48 1.15 -0.17 0.00 -1.01 0.00 0.00 64.21 64.67 1xck n SER 228 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1xck s ASN 229 N -2.42 2.68 0.00 6.43 0.01 -1.26 -0.52 114.94 119.86 1xck s ASN 229 Ca -0.01 -0.49 0.00 0.00 -0.71 0.00 0.00 52.86 51.64 1xck s ASN 229 Cb 0.02 -1.21 0.00 0.00 0.41 0.00 0.00 41.25 40.47 1xck s ASN 229 CO 0.15 0.00 0.47 0.00 -1.51 0.00 0.00 177.10 176.21 1xck n ILE 230 N 4.38 0.25 0.06 0.60 3.06 -1.26 -3.23 119.36 123.22 1xck n ILE 230 Ca -0.19 0.00 -0.17 0.00 -2.50 0.00 0.00 62.75 59.89 1xck n ILE 230 Cb 0.51 -0.52 -0.14 0.00 0.54 0.00 0.00 39.64 40.02 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 0.44 0.25 0.00 9.51 2.43 -1.98 -3.22 114.38 121.81 1xck h ARG 231 Ca 0.00 -0.43 -0.11 0.00 -0.81 0.00 0.00 59.98 58.64 1xck h ARG 231 Cb 0.47 0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 1xck h ARG 231 CO 0.00 1.11 -0.50 0.93 -1.51 0.00 0.00 179.97 180.00 1xck h GLU 232 N 0.07 0.00 -0.33 0.20 5.08 -1.95 -3.26 114.58 114.39 1xck h GLU 232 Ca -0.25 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.03 1xck h GLU 232 Cb 2.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.26 1xck h GLU 232 CO 0.16 0.50 -0.12 0.52 -1.00 0.00 0.00 179.01 179.08 1xck h MET 233 N 0.00 0.66 -0.53 2.33 2.86 -1.77 -3.30 114.93 115.18 1xck h MET 233 Ca -0.01 -0.27 0.06 0.00 -2.06 0.00 0.00 59.70 57.42 1xck h MET 233 Cb 1.04 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 32.61 1xck h MET 233 CO 0.07 0.85 -0.29 1.28 1.06 0.00 0.00 176.91 179.88 1xck n LEU 234 N -4.40 -0.51 -0.25 1.22 4.77 -1.22 0.32 117.00 116.94 1xck n LEU 234 Ca -0.03 0.94 0.08 0.00 -0.03 0.00 0.00 56.01 56.97 1xck n LEU 234 Cb 0.36 -0.14 0.33 0.00 -2.33 0.00 0.00 43.42 41.64 1xck n LEU 234 CO 0.42 -0.78 1.23 1.55 -1.33 0.00 0.00 177.39 178.47 1xck h PRO 235 N 0.00 0.78 0.00 3.23 0.13 -1.82 -0.31 132.00 134.01 1xck h PRO 235 Ca 0.11 -0.05 -0.21 0.00 -0.87 0.00 0.00 66.00 64.98 1xck h PRO 235 Cb 0.24 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 31.16 1xck h PRO 235 CO -0.50 0.52 -1.28 0.28 -0.23 0.00 0.00 178.00 176.78 1xck h VAL 236 N 0.81 0.98 0.00 1.56 2.07 -0.41 -3.12 116.25 118.14 1xck h VAL 236 Ca 0.39 -2.64 -0.10 0.00 0.82 0.00 0.00 66.70 65.17 1xck h VAL 236 Cb 0.44 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 1xck h VAL 236 CO -0.16 0.56 -0.50 -0.07 0.02 0.00 0.00 177.57 177.42 1xck h LEU 237 N 0.00 0.00 0.09 2.57 3.38 0.41 -2.73 115.31 119.03 1xck h LEU 237 Ca -0.14 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.55 1xck h LEU 237 Cb 1.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.50 1xck h LEU 237 CO 0.08 0.50 -1.29 -0.33 0.09 0.00 0.00 178.44 177.48 1xck h GLU 238 N 0.00 0.20 0.00 1.13 5.08 -1.18 -1.89 114.58 117.92 1xck h GLU 238 Ca -0.00 -0.34 -0.03 0.00 -1.00 0.00 0.00 59.36 57.98 1xck h GLU 238 Cb 1.10 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 1xck h GLU 238 CO 0.06 1.11 -0.16 0.00 -1.00 0.00 0.00 179.01 179.03 1xck h ALA 239 N 0.66 1.23 0.00 3.43 0.00 -1.47 -1.67 119.26 121.43 1xck h ALA 239 Ca -0.15 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 1xck h ALA 239 Cb 1.95 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.69 1xck h ALA 239 CO 0.17 0.20 -1.24 0.28 0.00 0.00 0.00 179.25 178.66 1xck h VAL 240 N 0.00 0.49 0.00 0.00 2.07 -1.46 -3.25 116.25 114.10 1xck h VAL 240 Ca -0.00 -1.90 -0.07 0.00 0.82 0.00 0.00 66.70 65.55 1xck h VAL 240 Cb 0.44 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 1xck h VAL 240 CO 0.02 0.28 -0.33 0.00 0.02 0.00 0.00 177.57 177.56 1xck h ALA 241 N 1.50 1.13 -2.29 1.67 0.00 -0.47 -3.12 119.26 117.68 1xck h ALA 241 Ca -0.12 -0.30 -0.49 0.00 0.00 0.00 0.00 54.91 54.00 1xck h ALA 241 Cb 1.49 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 1xck h ALA 241 CO 0.04 0.41 0.15 0.15 0.00 0.00 0.00 179.25 180.01 1xck s LYS 242 N -3.84 3.86 0.00 0.00 1.02 -0.84 -3.11 119.74 116.82 1xck s LYS 242 Ca -0.01 0.59 0.00 0.00 0.02 0.00 0.00 55.97 56.57 1xck s LYS 242 Cb 0.12 -2.36 0.00 0.00 -0.52 0.00 0.00 37.83 35.07 1xck s LYS 242 CO 0.68 -0.03 0.00 0.00 -0.92 0.00 0.00 175.35 175.08 1xck n ALA 243 N -1.13 0.00 -3.97 5.17 0.00 -1.26 -4.23 120.51 115.08 1xck n ALA 243 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.15 1xck n ALA 243 Cb 0.54 -0.27 -0.02 0.00 0.00 0.00 0.00 19.45 19.70 1xck n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 244 N -2.00 -0.43 3.47 0.00 0.00 -1.18 -4.96 105.19 100.10 1xck n GLY 244 Ca 0.00 0.21 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 1xck n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xck s LYS 245 N -6.73 1.69 0.86 1.61 1.02 -1.18 -5.08 119.74 111.93 1xck s LYS 245 Ca 0.24 -1.55 -0.12 0.00 0.02 0.00 0.00 55.97 54.56 1xck s LYS 245 Cb -0.13 -1.89 0.11 0.00 -0.52 0.00 0.00 37.83 35.40 1xck s LYS 245 CO 0.76 0.38 1.10 -1.25 -0.92 0.00 0.00 175.35 175.43 1xck s PRO 246 N -2.99 1.56 -0.04 -1.68 0.04 -1.26 -4.71 135.00 125.92 1xck s PRO 246 Ca 0.25 0.62 0.01 0.00 0.04 0.00 0.00 61.00 61.92 1xck s PRO 246 Cb -0.07 -1.86 0.02 0.00 0.04 0.00 0.00 34.50 32.63 1xck s PRO 246 CO 0.13 -1.98 -0.02 -1.17 0.04 0.00 0.00 177.00 173.99 1xck s LEU 247 N -6.00 1.22 -0.27 -3.56 2.96 0.42 -0.92 118.68 112.53 1xck s LEU 247 Ca 0.62 -0.08 -0.06 0.00 -0.22 0.00 0.00 54.13 54.39 1xck s LEU 247 Cb -0.16 -0.35 -0.00 0.00 0.50 0.00 0.00 46.19 46.19 1xck s LEU 247 CO 0.55 -0.08 0.05 -0.22 -1.32 0.00 0.00 176.35 175.33 1xck s LEU 248 N 1.02 3.55 -0.33 -0.68 2.96 0.13 -1.06 118.68 124.28 1xck s LEU 248 Ca -0.10 -0.56 -0.18 0.00 -0.22 0.00 0.00 54.13 53.08 1xck s LEU 248 Cb -0.14 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 1xck s LEU 248 CO -0.01 -0.13 0.49 -0.63 -1.32 0.00 0.00 176.35 174.76 1xck s ILE 249 N 1.51 5.05 -0.67 6.68 -1.09 0.11 -0.33 121.20 132.46 1xck s ILE 249 Ca 0.04 0.44 0.00 0.00 -2.23 0.00 0.00 60.65 58.90 1xck s ILE 249 Cb -0.16 -3.91 0.17 0.00 -1.58 0.00 0.00 42.46 36.98 1xck s ILE 249 CO 0.01 -0.12 0.48 -0.63 -1.23 0.00 0.00 174.94 173.45 1xck s ILE 250 N 2.33 3.45 0.53 2.92 1.01 0.43 -0.88 121.20 130.99 1xck s ILE 250 Ca 0.18 -3.49 0.02 0.00 0.00 0.00 0.00 60.65 57.37 1xck s ILE 250 Cb -0.16 -3.25 0.02 0.00 0.01 0.00 0.00 42.46 39.09 1xck s ILE 250 CO 0.12 -0.93 0.19 0.00 0.00 0.00 0.00 174.94 174.32 1xck n ALA 251 N 2.87 0.62 -0.20 9.38 0.00 -1.15 -2.31 120.51 129.72 1xck n ALA 251 Ca 0.12 -2.26 0.00 0.00 0.00 0.00 0.00 53.44 51.30 1xck n ALA 251 Cb 0.36 1.10 0.24 0.00 0.00 0.00 0.00 19.45 21.15 1xck n ALA 251 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1xck h GLU 252 N 0.00 0.96 -1.07 0.00 4.81 -1.38 0.87 114.58 118.77 1xck h GLU 252 Ca -0.39 -0.07 0.29 0.00 -0.13 0.00 0.00 59.36 59.05 1xck h GLU 252 Cb 1.28 -0.21 -0.24 0.00 0.63 0.00 0.00 28.75 30.21 1xck h GLU 252 CO 0.63 0.66 0.96 0.34 -0.73 0.00 0.00 179.01 180.88 1xck s ASP 253 N -6.40 -0.03 -0.21 1.04 -1.08 -1.26 -4.39 116.67 104.35 1xck s ASP 253 Ca -0.11 0.02 0.01 0.00 -0.52 0.00 0.00 52.55 51.94 1xck s ASP 253 Cb 0.17 0.03 0.05 0.00 -1.46 0.00 0.00 42.92 41.71 1xck s ASP 253 CO 0.78 -0.04 -0.08 -0.69 0.52 0.00 0.00 175.17 175.67 1xck s VAL 254 N -1.57 1.51 0.26 1.11 1.01 -1.26 -0.07 120.40 121.39 1xck s VAL 254 Ca 0.10 -1.02 0.08 0.00 0.00 0.00 0.00 61.98 61.15 1xck s VAL 254 Cb -0.01 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 1xck s VAL 254 CO -0.05 0.06 0.10 -1.61 0.00 0.00 0.00 175.10 173.60 1xck s GLU 255 N 1.44 2.62 0.00 2.72 2.02 0.86 -4.61 118.70 123.75 1xck s GLU 255 Ca -0.03 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 53.73 1xck s GLU 255 Cb -0.17 -2.37 0.00 0.00 0.10 0.00 0.00 34.13 31.69 1xck s GLU 255 CO -0.07 0.38 0.00 0.41 0.02 0.00 0.00 175.26 175.99 1xck n GLY 256 N -1.05 0.00 0.33 -1.39 0.00 -1.26 -2.06 105.19 99.76 1xck n GLY 256 Ca -0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.33 0.06 1.61 0.00 -1.19 0.72 120.64 121.51 1xck n GLU 257 Ca 0.00 1.21 -0.13 0.00 0.00 0.00 0.00 57.16 58.24 1xck n GLU 257 Cb 0.00 -1.78 -0.09 0.00 0.00 0.00 0.00 31.44 29.58 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 0.50 -0.16 -0.67 4.31 0.00 -0.21 -2.35 119.26 120.67 1xck h ALA 258 Ca 0.15 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1xck h ALA 258 Cb 0.35 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1xck h ALA 258 CO -0.76 -0.43 0.38 1.25 0.00 0.00 0.00 179.25 179.70 1xck h LEU 259 N -0.49 0.56 -0.34 0.00 5.85 -0.92 -0.69 115.31 119.29 1xck h LEU 259 Ca -0.02 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1xck h LEU 259 Cb 0.39 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1xck h LEU 259 CO 0.03 0.36 0.08 0.00 -0.34 0.00 0.00 178.44 178.57 1xck h ALA 260 N 1.35 0.45 -0.36 1.25 0.00 0.26 -0.42 119.26 121.80 1xck h ALA 260 Ca 0.30 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1xck h ALA 260 Cb 0.19 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1xck h ALA 260 CO -0.18 0.11 0.16 1.15 0.00 0.00 0.00 179.25 180.49 1xck h THR 261 N 0.39 1.13 -0.07 0.00 2.02 -0.92 -1.45 112.91 114.00 1xck h THR 261 Ca 0.11 -0.37 -0.09 0.00 0.77 0.00 0.00 66.41 66.83 1xck h THR 261 Cb 0.30 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1xck h THR 261 CO 0.00 0.15 -0.32 -0.07 0.37 0.00 0.00 175.52 175.65 1xck h LEU 262 N 0.49 0.41 -1.92 2.58 3.38 -0.85 -1.50 115.31 117.90 1xck h LEU 262 Ca 0.13 -0.64 0.12 0.00 0.09 0.00 0.00 57.88 57.57 1xck h LEU 262 Cb 0.06 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1xck h LEU 262 CO -0.02 0.98 0.33 0.58 0.09 0.00 0.00 178.44 180.40 1xck h VAL 263 N -0.14 0.81 0.00 1.22 2.07 -0.55 -2.42 116.25 117.24 1xck h VAL 263 Ca -0.02 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1xck h VAL 263 Cb 0.97 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1xck h VAL 263 CO 0.07 0.02 -0.01 0.58 0.02 0.00 0.00 177.57 178.24 1xck h VAL 264 N 0.09 0.00 -0.99 2.57 2.07 -1.21 -3.12 116.25 115.66 1xck h VAL 264 Ca 0.22 -0.09 0.31 0.00 0.82 0.00 0.00 66.70 67.95 1xck h VAL 264 Cb 0.75 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 30.34 1xck h VAL 264 CO -0.02 0.00 0.16 0.78 0.02 0.00 0.00 177.57 178.51 1xck h ASN 265 N -0.09 -0.27 0.50 0.57 -0.26 -1.26 0.64 115.58 115.42 1xck h ASN 265 Ca 0.00 0.27 -0.16 0.00 -0.56 0.00 0.00 56.30 55.85 1xck h ASN 265 Cb 0.01 0.43 -0.01 0.00 -1.06 0.00 0.00 38.32 37.68 1xck h ASN 265 CO 0.00 -0.37 -0.70 0.71 -1.06 0.00 0.00 177.43 176.01 1xck h THR 266 N 0.01 1.44 0.00 2.81 1.35 -1.55 -0.99 112.91 115.99 1xck h THR 266 Ca 0.66 -2.24 0.00 0.00 -0.55 0.00 0.00 66.41 64.28 1xck h THR 266 Cb 1.49 2.19 0.00 0.00 -1.73 0.00 0.00 68.15 70.10 1xck h THR 266 CO -0.88 0.65 0.00 0.80 -0.25 0.00 0.00 175.52 175.84 1xck n MET 267 N -3.78 0.86 0.00 4.72 0.00 0.22 -2.37 117.12 116.78 1xck n MET 267 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.68 1xck n MET 267 Cb 0.68 -1.05 0.00 0.00 0.00 0.00 0.00 33.22 32.85 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 -0.55 1.52 -0.87 2.12 1.74 -0.84 -4.99 116.66 114.78 1xck n ARG 268 Ca 0.02 -1.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.09 1xck n ARG 268 Cb 0.01 -0.76 0.00 0.00 -1.02 0.00 0.00 32.46 30.69 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 -0.25 0.89 2.58 -0.13 0.00 -1.00 -4.90 105.19 102.38 1xck n GLY 269 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1xck n GLY 269 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xck n ILE 270 N -2.00 4.03 -0.50 -0.61 5.41 -0.41 -4.72 119.36 120.56 1xck n ILE 270 Ca 0.00 -3.18 0.00 0.00 1.00 0.00 0.00 62.75 60.57 1xck n ILE 270 Cb 0.00 -2.53 0.00 0.00 -0.71 0.00 0.00 39.64 36.40 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 4.04 -1.89 -2.40 1.39 0.31 -1.26 -4.35 118.33 114.16 1xck n VAL 271 Ca 0.60 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.51 1xck n VAL 271 Cb 0.32 -1.94 -0.03 0.00 -0.91 0.00 0.00 33.84 31.28 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 -2.94 4.34 0.01 5.55 3.01 -1.26 -3.89 119.74 124.55 1xck s LYS 272 Ca 0.00 1.74 -0.04 0.00 -1.01 0.00 0.00 55.97 56.66 1xck s LYS 272 Cb 0.00 -3.55 -0.01 0.00 -1.01 0.00 0.00 37.83 33.27 1xck s LYS 272 CO 0.00 -0.46 0.07 0.08 0.51 0.00 0.00 175.35 175.55 1xck s VAL 273 N 2.19 0.09 -0.12 3.17 1.01 -1.26 -0.43 120.40 125.04 1xck s VAL 273 Ca 0.58 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.76 1xck s VAL 273 Cb -0.26 -0.35 0.04 0.00 0.00 0.00 0.00 36.38 35.81 1xck s VAL 273 CO 0.23 -0.39 0.30 0.00 0.00 0.00 0.00 175.10 175.24 1xck s ALA 274 N -1.28 -0.72 0.08 5.51 0.00 -0.22 -4.88 121.76 120.25 1xck s ALA 274 Ca -0.14 0.94 0.09 0.00 0.00 0.00 0.00 51.96 52.85 1xck s ALA 274 Cb -0.08 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 1xck s ALA 274 CO 0.01 -0.16 -0.24 0.00 0.00 0.00 0.00 175.76 175.36 1xck s ALA 275 N 0.53 2.09 0.05 0.00 0.00 -1.26 0.07 121.76 123.24 1xck s ALA 275 Ca -0.03 -1.28 -0.10 0.00 0.00 0.00 0.00 51.96 50.55 1xck s ALA 275 Cb -0.05 -0.37 0.01 0.00 0.00 0.00 0.00 23.12 22.71 1xck s ALA 275 CO -0.03 0.47 0.22 0.14 0.00 0.00 0.00 175.76 176.56 1xck s VAL 276 N -0.95 0.11 0.44 0.00 -7.23 -0.06 -0.96 120.40 111.76 1xck s VAL 276 Ca 0.10 -0.90 -0.22 0.00 -1.81 0.00 0.00 61.98 59.15 1xck s VAL 276 Cb -0.10 -1.01 -0.09 0.00 0.56 0.00 0.00 36.38 35.74 1xck s VAL 276 CO 0.04 -0.50 1.02 -0.54 -0.31 0.00 0.00 175.10 174.81 1xck s LYS 277 N -2.87 4.02 0.58 4.82 1.02 -1.26 -2.94 119.74 123.11 1xck s LYS 277 Ca -0.03 1.37 -0.19 0.00 0.02 0.00 0.00 55.97 57.15 1xck s LYS 277 Cb 0.00 -2.28 -0.04 0.00 -0.52 0.00 0.00 37.83 34.99 1xck s LYS 277 CO -0.05 -0.24 1.16 0.00 -0.92 0.00 0.00 175.35 175.29 1xck s ALA 278 N -1.89 2.60 0.60 5.17 0.00 0.30 -4.84 121.76 123.70 1xck s ALA 278 Ca 0.63 0.87 -0.18 0.00 0.00 0.00 0.00 51.96 53.27 1xck s ALA 278 Cb -0.17 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 1xck s ALA 278 CO 0.21 -0.99 1.19 -1.25 0.00 0.00 0.00 175.76 174.93 1xck s PRO 279 N -3.40 2.95 1.28 0.00 0.04 -1.26 -4.86 135.00 129.75 1xck s PRO 279 Ca 0.74 1.78 0.00 0.00 0.04 0.00 0.00 61.00 63.56 1xck s PRO 279 Cb -0.26 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.35 1xck s PRO 279 CO 0.31 -1.21 0.00 0.41 0.04 0.00 0.00 177.00 176.55 1xck n GLY 280 N 0.41 -1.38 3.24 0.56 0.00 -1.26 -4.38 105.19 102.38 1xck n GLY 280 Ca 0.13 -1.09 -0.14 0.00 0.00 0.00 0.00 46.02 44.92 1xck n GLY 280 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1xck s PHE 281 N -0.84 1.30 0.00 1.61 -0.71 -1.26 -4.71 117.98 113.37 1xck s PHE 281 Ca 0.00 -1.33 0.00 0.00 -1.04 0.00 0.00 56.93 54.56 1xck s PHE 281 Cb 0.00 -0.67 0.00 0.00 -1.21 0.00 0.00 43.02 41.14 1xck s PHE 281 CO 0.00 -0.56 0.00 0.41 -1.34 0.00 0.00 175.22 173.73 1xck n GLY 282 N -0.35 3.24 0.08 1.99 0.00 -1.26 -2.73 105.19 106.15 1xck n GLY 282 Ca 0.02 -0.17 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 -0.04 -0.00 1.61 3.32 -2.00 -3.19 116.42 116.11 1xck h ASP 283 Ca 0.00 -0.59 0.00 0.00 0.02 0.00 0.00 57.03 56.46 1xck h ASP 283 Cb 0.00 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.56 1xck h ASP 283 CO 0.00 0.60 0.05 0.08 -1.72 0.00 0.00 179.24 178.25 1xck h ARG 284 N -0.72 0.00 -0.18 3.56 0.11 -1.97 -0.14 114.38 115.04 1xck h ARG 284 Ca -0.01 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.98 1xck h ARG 284 Cb 0.63 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.71 1xck h ARG 284 CO 0.01 0.00 -0.24 -0.09 0.10 0.00 0.00 179.97 179.75 1xck h ARG 285 N 0.00 0.49 -0.43 0.08 2.43 -1.50 -1.58 114.38 113.86 1xck h ARG 285 Ca 0.00 -0.28 -0.12 0.00 -0.81 0.00 0.00 59.98 58.78 1xck h ARG 285 Cb 0.10 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1xck h ARG 285 CO -0.00 0.87 -0.19 0.87 -1.51 0.00 0.00 179.97 180.00 1xck h LYS 286 N 0.14 0.85 -0.37 0.20 1.57 -1.10 -1.00 116.57 116.86 1xck h LYS 286 Ca 0.02 -0.34 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 1xck h LYS 286 Cb 0.80 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 1xck h LYS 286 CO 0.06 0.97 0.21 0.00 -0.57 0.00 0.00 179.45 180.11 1xck h ALA 287 N 1.03 0.47 -0.19 3.86 0.00 -1.14 -2.84 119.26 120.46 1xck h ALA 287 Ca 0.11 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1xck h ALA 287 Cb 0.72 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1xck h ALA 287 CO 0.06 -0.00 -0.35 0.52 0.00 0.00 0.00 179.25 179.47 1xck h MET 288 N 0.47 0.39 0.00 0.00 2.86 -1.13 -2.47 114.93 115.06 1xck h MET 288 Ca 0.13 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1xck h MET 288 Cb 0.05 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.70 1xck h MET 288 CO -0.02 0.69 -0.12 -0.07 1.06 0.00 0.00 176.91 178.46 1xck h LEU 289 N 0.33 0.00 -0.01 1.22 3.38 -0.96 -1.19 115.31 118.08 1xck h LEU 289 Ca 0.04 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.74 1xck h LEU 289 Cb 0.78 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.54 1xck h LEU 289 CO 0.06 0.12 -1.08 -0.61 0.09 0.00 0.00 178.44 177.02 1xck h GLN 290 N 0.00 0.58 -0.55 1.13 5.75 -1.24 -2.26 115.11 118.52 1xck h GLN 290 Ca -0.00 -0.67 0.07 0.00 -0.15 0.00 0.00 58.65 57.90 1xck h GLN 290 Cb 0.23 0.20 -0.06 0.00 1.07 0.00 0.00 27.48 28.92 1xck h GLN 290 CO 0.02 1.27 0.22 -0.44 -2.65 0.00 0.00 178.83 177.25 1xck h ASP 291 N 0.30 0.25 -0.50 -0.69 5.19 -0.82 0.43 116.42 120.58 1xck h ASP 291 Ca -0.13 0.06 -0.08 0.00 -0.62 0.00 0.00 57.03 56.26 1xck h ASP 291 Cb 1.74 0.03 -0.02 0.00 0.18 0.00 0.00 39.33 41.25 1xck h ASP 291 CO 0.20 0.16 0.04 0.40 -3.12 0.00 0.00 179.24 176.92 1xck h ILE 292 N 0.41 1.25 0.19 0.35 2.04 -1.31 -1.75 117.51 118.70 1xck h ILE 292 Ca 0.26 -1.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.10 1xck h ILE 292 Cb 0.28 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1xck h ILE 292 CO -0.25 0.37 -0.09 0.00 0.00 0.00 0.00 178.15 178.18 1xck h ALA 293 N 1.18 -0.26 -0.40 1.87 0.00 -0.60 -0.43 119.26 120.62 1xck h ALA 293 Ca 0.17 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 293 Cb 0.45 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1xck h ALA 293 CO 0.02 -0.61 0.13 1.15 0.00 0.00 0.00 179.25 179.94 1xck h THR 294 N -0.34 0.87 -0.72 0.00 2.02 -0.87 0.48 112.91 114.36 1xck h THR 294 Ca -0.03 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.02 1xck h THR 294 Cb 0.26 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 1xck h THR 294 CO 0.04 0.05 0.30 0.25 0.37 0.00 0.00 175.52 176.54 1xck h LEU 295 N 0.29 0.96 -1.09 2.58 7.12 -1.20 -2.98 115.31 120.99 1xck h LEU 295 Ca 0.19 -0.13 0.00 0.00 0.13 0.00 0.00 57.88 58.06 1xck h LEU 295 Cb 0.18 -0.25 0.00 0.00 -0.53 0.00 0.00 40.66 40.06 1xck h LEU 295 CO -0.20 0.84 -0.25 0.35 -0.13 0.00 0.00 178.44 179.06 1xck n THR 296 N -4.30 0.00 -3.02 1.05 -2.24 -0.18 -0.82 114.28 104.77 1xck n THR 296 Ca 0.07 -0.28 -0.12 0.00 -2.27 0.00 0.00 64.05 61.44 1xck n THR 296 Cb 0.17 1.00 0.05 0.00 -2.10 0.00 0.00 70.33 69.45 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 1.35 0.01 3.54 3.38 0.00 0.15 -0.35 105.19 113.27 1xck n GLY 297 Ca 0.12 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.25 3.39 3.21 -0.02 0.00 -0.10 -4.42 105.19 105.99 1xck n GLY 298 Ca -0.08 -2.24 -0.32 0.00 0.00 0.00 0.00 46.02 43.38 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 -2.98 2.03 -0.19 2.61 2.01 0.29 -4.48 115.64 114.93 1xck s THR 299 Ca 0.11 -1.00 -0.29 0.00 0.31 0.00 0.00 61.69 60.82 1xck s THR 299 Cb 0.01 -1.76 -0.01 0.00 0.01 0.00 0.00 72.50 70.75 1xck s THR 299 CO 0.08 0.55 1.18 -0.69 -0.69 0.00 0.00 174.62 175.04 1xck s VAL 300 N 0.42 4.44 -0.74 3.82 1.01 -1.26 -4.52 120.40 123.56 1xck s VAL 300 Ca -0.17 1.73 -0.21 0.00 0.00 0.00 0.00 61.98 63.33 1xck s VAL 300 Cb -0.18 -4.12 0.09 0.00 0.00 0.00 0.00 36.38 32.17 1xck s VAL 300 CO 0.07 -0.15 1.02 -0.63 0.00 0.00 0.00 175.10 175.41 1xck s ILE 301 N 3.34 4.43 -0.09 2.22 1.01 0.60 -4.94 121.20 127.76 1xck s ILE 301 Ca 0.51 -0.72 -0.02 0.00 0.00 0.00 0.00 60.65 60.41 1xck s ILE 301 Cb -0.19 -4.72 -0.03 0.00 0.01 0.00 0.00 42.46 37.53 1xck s ILE 301 CO 0.12 -1.48 0.01 -0.94 0.00 0.00 0.00 174.94 172.65 1xck s SER 302 N 3.72 5.33 0.39 3.58 1.04 -1.26 -1.76 113.70 124.73 1xck s SER 302 Ca 0.25 0.17 0.17 0.00 0.48 0.00 0.00 55.95 57.03 1xck s SER 302 Cb -0.13 -1.53 0.80 0.00 0.10 0.00 0.00 66.02 65.26 1xck s SER 302 CO 0.04 0.38 1.81 -0.33 0.98 0.00 0.00 173.24 176.12 1xck h GLU 303 N 5.17 0.00 0.11 4.02 5.08 -1.78 -2.39 114.58 124.79 1xck h GLU 303 Ca -0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1xck h GLU 303 Cb 1.19 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1xck h GLU 303 CO 0.55 0.35 -0.32 0.93 -1.00 0.00 0.00 179.01 179.52 1xck h GLU 304 N 0.00 -0.46 0.00 2.33 5.08 -1.91 0.27 114.58 119.88 1xck h GLU 304 Ca -0.00 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1xck h GLU 304 Cb 0.73 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1xck h GLU 304 CO 0.05 -0.31 0.00 -0.89 -1.00 0.00 0.00 179.01 176.86 1xck n ILE 305 N -4.27 0.17 -2.28 3.13 5.41 -1.23 -4.80 119.36 115.49 1xck n ILE 305 Ca -0.05 0.04 -0.03 0.00 1.00 0.00 0.00 62.75 63.71 1xck n ILE 305 Cb 0.25 -0.96 0.01 0.00 -0.71 0.00 0.00 39.64 38.24 1xck n ILE 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xck n GLY 306 N -0.69 0.40 3.85 7.39 0.00 0.94 -5.08 105.19 112.00 1xck n GLY 306 Ca 0.04 -0.43 -0.21 0.00 0.00 0.00 0.00 46.02 45.42 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 -4.36 2.81 -0.00 1.61 -1.94 -0.90 -5.01 119.30 111.50 1xck s MET 307 Ca 0.01 -1.20 0.02 0.00 -1.71 0.00 0.00 55.69 52.81 1xck s MET 307 Cb -0.01 -2.52 -0.01 0.00 2.01 0.00 0.00 34.83 34.31 1xck s MET 307 CO 0.10 0.20 -0.06 -1.21 -0.01 0.00 0.00 175.02 174.05 1xck s GLU 308 N -3.95 0.45 0.53 2.03 2.02 -1.26 -4.47 118.70 114.06 1xck s GLU 308 Ca 0.38 -0.22 0.30 0.00 0.02 0.00 0.00 54.97 55.45 1xck s GLU 308 Cb -0.07 -0.42 1.48 0.00 0.10 0.00 0.00 34.13 35.22 1xck s GLU 308 CO 0.26 0.12 2.06 -0.07 0.02 0.00 0.00 175.26 177.65 1xck h LEU 309 N 5.95 0.00 -1.00 1.80 3.38 -1.95 -1.83 115.31 121.65 1xck h LEU 309 Ca -0.28 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.59 1xck h LEU 309 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1xck h LEU 309 CO 0.50 0.10 -0.47 -0.33 0.09 0.00 0.00 178.44 178.33 1xck h GLU 310 N 0.00 0.00 -0.62 1.13 3.07 -1.94 -2.86 114.58 113.35 1xck h GLU 310 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xck h GLU 310 Cb 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 1xck h GLU 310 CO 0.01 0.47 0.00 1.63 -1.40 0.00 0.00 179.01 179.72 1xck n LYS 311 N -3.83 4.35 -3.42 2.33 5.02 -0.70 -4.81 118.16 117.10 1xck n LYS 311 Ca -0.01 -3.00 -0.38 0.00 -2.02 0.00 0.00 58.31 52.90 1xck n LYS 311 Cb 0.51 -2.10 -0.06 0.00 -0.02 0.00 0.00 35.03 33.36 1xck n LYS 311 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xck s ALA 312 N -2.33 3.56 0.43 7.82 0.00 -1.08 -4.96 121.76 125.20 1xck s ALA 312 Ca 0.53 -0.26 0.07 0.00 0.00 0.00 0.00 51.96 52.29 1xck s ALA 312 Cb 0.37 -2.51 -0.04 0.00 0.00 0.00 0.00 23.12 20.94 1xck s ALA 312 CO 0.20 0.15 0.20 0.95 0.00 0.00 0.00 175.76 177.26 1xck s THR 313 N 0.13 2.22 0.51 0.00 -4.23 -1.26 -4.44 115.64 108.58 1xck s THR 313 Ca 0.23 -1.68 0.28 0.00 -1.18 0.00 0.00 61.69 59.34 1xck s THR 313 Cb -0.15 -2.90 0.46 0.00 1.34 0.00 0.00 72.50 71.24 1xck s THR 313 CO 0.09 0.00 1.89 -0.07 -0.54 0.00 0.00 174.62 175.99 1xck h LEU 314 N 1.36 0.08 -2.24 4.79 3.38 -1.93 0.66 115.31 121.42 1xck h LEU 314 Ca -0.42 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.57 1xck h LEU 314 Cb 1.26 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1xck h LEU 314 CO 0.69 0.03 0.03 -0.08 0.09 0.00 0.00 178.44 179.20 1xck h GLU 315 N 0.08 0.00 0.00 1.13 4.81 -1.99 -1.30 114.58 117.31 1xck h GLU 315 Ca 0.42 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.58 1xck h GLU 315 Cb 1.55 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.91 1xck h GLU 315 CO -0.04 0.00 -0.72 -0.44 -0.73 0.00 0.00 179.01 177.08 1xck h ASP 316 N 0.00 0.00 -3.94 1.04 3.32 -1.23 -3.44 116.42 112.18 1xck h ASP 316 Ca 0.02 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.55 1xck h ASP 316 Cb 0.08 0.00 0.07 0.00 0.22 0.00 0.00 39.33 39.69 1xck h ASP 316 CO -0.00 0.30 0.56 -0.76 -1.72 0.00 0.00 179.24 177.62 1xck s LEU 317 N -6.00 4.22 0.81 1.55 1.02 -0.49 0.10 118.68 119.89 1xck s LEU 317 Ca 0.02 2.51 -0.09 0.00 0.02 0.00 0.00 54.13 56.59 1xck s LEU 317 Cb 0.08 -3.93 0.13 0.00 0.02 0.00 0.00 46.19 42.48 1xck s LEU 317 CO 0.75 -0.74 1.13 -0.83 0.02 0.00 0.00 176.35 176.69 1xck s GLY 318 N -0.90 1.74 -0.09 -3.19 0.00 0.84 -4.33 107.32 101.39 1xck s GLY 318 Ca 0.56 -1.22 -0.23 0.00 0.00 0.00 0.00 44.72 43.84 1xck s GLY 318 CO 0.44 -0.63 0.54 1.62 0.00 0.00 0.00 173.10 175.07 1xck s GLN 319 N -5.47 0.82 0.07 2.90 0.74 0.53 -0.25 119.66 118.99 1xck s GLN 319 Ca 0.67 0.30 -0.17 0.00 0.05 0.00 0.00 55.36 56.21 1xck s GLN 319 Cb -0.07 0.39 0.03 0.00 1.10 0.00 0.00 33.01 34.46 1xck s GLN 319 CO 0.48 -0.21 0.40 0.00 -0.55 0.00 0.00 175.29 175.41 1xck s ALA 320 N -0.76 -0.95 0.35 1.58 0.00 -1.20 -1.24 121.76 119.54 1xck s ALA 320 Ca -0.08 0.18 0.21 0.00 0.00 0.00 0.00 51.96 52.27 1xck s ALA 320 Cb -0.03 0.44 1.10 0.00 0.00 0.00 0.00 23.12 24.63 1xck s ALA 320 CO 0.05 -0.50 1.95 0.87 0.00 0.00 0.00 175.76 178.13 1xck h LYS 321 N 2.85 0.00 -1.48 0.00 1.57 -0.76 -3.14 116.57 115.62 1xck h LYS 321 Ca -0.32 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.56 1xck h LYS 321 Cb 1.22 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.26 1xck h LYS 321 CO 0.45 0.22 0.57 0.50 -0.57 0.00 0.00 179.45 180.62 1xck s ARG 322 N -4.12 0.43 0.02 3.15 3.52 -1.03 -0.51 118.95 120.41 1xck s ARG 322 Ca -0.02 0.38 0.03 0.00 -0.13 0.00 0.00 55.73 55.98 1xck s ARG 322 Cb 0.13 0.21 -0.02 0.00 -1.56 0.00 0.00 34.95 33.71 1xck s ARG 322 CO 0.64 -0.08 -0.09 0.14 -0.81 0.00 0.00 175.30 175.10 1xck s VAL 323 N -0.17 0.71 -0.07 7.11 -7.23 -0.61 -0.12 120.40 120.01 1xck s VAL 323 Ca 0.03 -0.74 0.01 0.00 -1.81 0.00 0.00 61.98 59.47 1xck s VAL 323 Cb -0.04 -0.67 0.02 0.00 0.56 0.00 0.00 36.38 36.26 1xck s VAL 323 CO -0.06 -0.06 -0.09 -0.69 -0.31 0.00 0.00 175.10 173.90 1xck s VAL 324 N -0.74 0.93 -0.10 1.32 1.01 -0.06 -1.97 120.40 120.79 1xck s VAL 324 Ca -0.02 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.68 1xck s VAL 324 Cb -0.06 -0.90 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 1xck s VAL 324 CO 0.00 0.32 -0.20 -0.63 0.00 0.00 0.00 175.10 174.59 1xck s ILE 325 N 1.06 2.42 0.00 2.22 1.01 -0.71 -0.74 121.20 126.46 1xck s ILE 325 Ca -0.08 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 59.67 1xck s ILE 325 Cb -0.14 -1.95 0.00 0.00 0.01 0.00 0.00 42.46 40.38 1xck s ILE 325 CO -0.01 0.55 0.00 0.59 0.00 0.00 0.00 174.94 176.08 1xck n ASN 326 N 3.32 0.27 0.13 3.58 3.02 0.41 -1.19 115.26 124.79 1xck n ASN 326 Ca -0.18 -0.28 -0.02 0.00 -0.03 0.00 0.00 54.58 54.07 1xck n ASN 326 Cb 0.53 0.00 0.17 0.00 -0.61 0.00 0.00 39.78 39.86 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 0.04 0.00 3.52 3.64 -1.94 -1.80 116.57 120.04 1xck h LYS 327 Ca 0.00 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.20 1xck h LYS 327 Cb 0.00 0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 31.53 1xck h LYS 327 CO 0.00 0.64 -0.84 -0.40 -2.27 0.00 0.00 179.45 176.58 1xck n ASP 328 N -3.83 0.55 -3.68 4.20 5.68 -1.26 -3.78 116.55 114.43 1xck n ASP 328 Ca -0.01 -1.97 -0.10 0.00 -0.50 0.00 0.00 54.79 52.20 1xck n ASP 328 Cb 0.61 -0.19 -0.10 0.00 -1.14 0.00 0.00 41.12 40.30 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 -0.12 -0.14 2.12 2.01 -1.16 -3.00 115.64 115.35 1xck s THR 329 Ca 0.24 0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.35 1xck s THR 329 Cb 0.28 -0.66 -0.00 0.00 0.01 0.00 0.00 72.50 72.12 1xck s THR 329 CO -0.12 0.04 -0.17 -0.89 -0.69 0.00 0.00 174.62 172.79 1xck s THR 330 N 1.62 2.56 -0.09 -0.82 2.01 -0.66 0.15 115.64 120.41 1xck s THR 330 Ca -0.08 -0.82 -0.01 0.00 0.31 0.00 0.00 61.69 61.09 1xck s THR 330 Cb -0.09 -2.05 0.03 0.00 0.01 0.00 0.00 72.50 70.40 1xck s THR 330 CO -0.14 0.53 -0.05 0.28 -0.69 0.00 0.00 174.62 174.56 1xck s THR 331 N 0.61 0.75 -0.26 -0.82 -1.32 0.08 -1.18 115.64 113.49 1xck s THR 331 Ca -0.10 -0.13 -0.14 0.00 -1.21 0.00 0.00 61.69 60.11 1xck s THR 331 Cb -0.16 -0.81 -0.04 0.00 -1.51 0.00 0.00 72.50 69.98 1xck s THR 331 CO 0.03 0.32 0.34 -0.63 -2.21 0.00 0.00 174.62 172.46 1xck s ILE 332 N 1.70 5.21 -0.28 5.08 1.01 0.81 -0.88 121.20 133.84 1xck s ILE 332 Ca 0.03 0.51 -0.05 0.00 0.00 0.00 0.00 60.65 61.13 1xck s ILE 332 Cb -0.13 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.69 1xck s ILE 332 CO -0.06 0.19 0.04 -0.63 0.00 0.00 0.00 174.94 174.48 1xck s ILE 333 N 1.88 3.63 -0.31 2.92 1.01 0.82 -1.27 121.20 129.88 1xck s ILE 333 Ca 0.14 -0.80 -0.10 0.00 0.00 0.00 0.00 60.65 59.89 1xck s ILE 333 Cb -0.16 -2.86 0.01 0.00 0.01 0.00 0.00 42.46 39.46 1xck s ILE 333 CO 0.09 0.12 0.42 -0.67 0.00 0.00 0.00 174.94 174.90 1xck n ASP 334 N 4.80 -6.09 -4.83 3.58 2.03 0.15 -2.45 116.55 113.74 1xck n ASP 334 Ca -0.15 0.35 -0.34 0.00 0.52 0.00 0.00 54.79 55.17 1xck n ASP 334 Cb 0.48 -4.02 -0.06 0.00 -0.72 0.00 0.00 41.12 36.79 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 -2.13 2.47 0.00 0.27 0.00 -0.92 -1.06 107.32 105.94 1xck s GLY 335 Ca 0.16 0.13 0.17 0.00 0.00 0.00 0.00 44.72 45.18 1xck s GLY 335 CO 0.53 0.41 1.46 -0.62 0.00 0.00 0.00 173.10 174.88 1xck n VAL 336 N 0.09 0.22 -1.56 1.40 0.31 -0.38 -4.84 118.33 113.58 1xck n VAL 336 Ca 0.01 0.06 -0.44 0.00 -0.01 0.00 0.00 64.34 63.95 1xck n VAL 336 Cb 0.52 -0.78 -0.01 0.00 -0.91 0.00 0.00 33.84 32.66 1xck n VAL 336 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xck n GLY 337 N 0.11 -0.51 3.75 2.92 0.00 0.00 -4.71 105.19 106.75 1xck n GLY 337 Ca 0.11 0.29 -0.41 0.00 0.00 0.00 0.00 46.02 46.02 1xck n GLY 337 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xck s GLU 338 N -1.53 4.57 0.48 1.61 0.41 -1.26 -4.89 118.70 118.10 1xck s GLU 338 Ca 0.60 1.82 0.21 0.00 -0.41 0.00 0.00 54.97 57.18 1xck s GLU 338 Cb -0.71 -3.22 1.24 0.00 -1.78 0.00 0.00 34.13 29.65 1xck s GLU 338 CO 0.59 0.07 1.96 0.93 -0.49 0.00 0.00 175.26 178.32 1xck h GLU 339 N 4.58 0.19 0.62 1.61 4.39 -1.97 0.16 114.58 124.17 1xck h GLU 339 Ca -0.45 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.20 1xck h GLU 339 Cb 1.21 -0.04 0.01 0.00 -0.10 0.00 0.00 28.75 29.83 1xck h GLU 339 CO 0.71 0.12 -0.30 0.00 -1.16 0.00 0.00 179.01 178.38 1xck h ALA 340 N 1.69 -0.84 -0.08 3.43 0.00 -1.98 -1.33 119.26 120.16 1xck h ALA 340 Ca 0.31 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1xck h ALA 340 Cb 0.94 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 1xck h ALA 340 CO -0.06 -0.79 -0.28 0.00 0.00 0.00 0.00 179.25 178.12 1xck h ALA 341 N -1.14 -0.33 0.21 0.00 0.00 -1.60 0.19 119.26 116.59 1xck h ALA 341 Ca -0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xck h ALA 341 Cb 0.66 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1xck h ALA 341 CO 0.14 -0.76 -0.20 0.82 0.00 0.00 0.00 179.25 179.25 1xck h ILE 342 N -0.38 0.56 0.00 0.00 2.04 -0.83 0.24 117.51 119.14 1xck h ILE 342 Ca 0.08 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.93 1xck h ILE 342 Cb 0.51 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1xck h ILE 342 CO -0.29 0.00 -0.08 -0.61 0.00 0.00 0.00 178.15 177.16 1xck h GLN 343 N -0.44 0.00 -0.30 2.37 5.75 -1.08 -1.03 115.11 120.38 1xck h GLN 343 Ca -0.00 0.00 -0.19 0.00 -0.15 0.00 0.00 58.65 58.31 1xck h GLN 343 Cb 0.41 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.96 1xck h GLN 343 CO -0.04 0.08 -0.54 0.78 -2.65 0.00 0.00 178.83 176.46 1xck h GLY 344 N 0.54 0.97 1.58 2.39 0.00 0.40 -2.63 103.07 106.32 1xck h GLY 344 Ca -0.00 -1.12 -0.12 0.00 0.00 0.00 0.00 47.33 46.09 1xck h GLY 344 CO 0.01 1.01 -0.38 -0.09 0.00 0.00 0.00 176.54 177.09 1xck h ARG 345 N 0.68 0.47 -0.21 4.80 9.65 0.13 -2.46 114.38 127.44 1xck h ARG 345 Ca 0.02 -0.23 -0.04 0.00 -1.10 0.00 0.00 59.98 58.64 1xck h ARG 345 Cb 1.15 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.71 1xck h ARG 345 CO 0.12 0.78 -0.03 0.28 2.80 0.00 0.00 179.97 183.92 1xck h VAL 346 N 0.40 1.15 0.35 0.20 2.07 -1.14 -2.64 116.25 116.63 1xck h VAL 346 Ca 0.04 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 1xck h VAL 346 Cb 0.84 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1xck h VAL 346 CO 0.07 0.20 -0.17 0.00 0.02 0.00 0.00 177.57 177.69 1xck h ALA 347 N 1.67 -0.47 0.21 1.67 0.00 -1.06 -1.27 119.26 120.00 1xck h ALA 347 Ca 0.07 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1xck h ALA 347 Cb 0.26 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1xck h ALA 347 CO 0.01 -0.66 -0.38 1.96 0.00 0.00 0.00 179.25 180.17 1xck h GLN 348 N -0.67 -0.65 -0.80 0.00 4.20 -1.37 -0.10 115.11 115.73 1xck h GLN 348 Ca -0.05 0.04 0.15 0.00 0.06 0.00 0.00 58.65 58.86 1xck h GLN 348 Cb 0.47 0.15 -0.06 0.00 0.30 0.00 0.00 27.48 28.35 1xck h GLN 348 CO 0.08 -0.43 0.53 0.82 -0.67 0.00 0.00 178.83 179.16 1xck h ILE 349 N -0.67 0.79 0.00 2.54 2.04 -1.52 0.74 117.51 121.44 1xck h ILE 349 Ca 0.01 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1xck h ILE 349 Cb 0.66 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1xck h ILE 349 CO -0.17 0.09 -0.11 -0.09 0.00 0.00 0.00 178.15 177.86 1xck h ARG 350 N 0.48 0.00 0.15 2.37 2.43 -0.49 -2.78 114.38 116.53 1xck h ARG 350 Ca 0.40 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 59.34 1xck h ARG 350 Cb 0.85 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 30.43 1xck h ARG 350 CO -0.14 0.11 -0.99 1.96 -1.51 0.00 0.00 179.97 179.40 1xck h GLN 351 N 0.00 0.41 -0.99 0.20 1.08 0.22 -3.26 115.11 112.77 1xck h GLN 351 Ca -0.00 -0.64 0.14 0.00 -1.45 0.00 0.00 58.65 56.70 1xck h GLN 351 Cb 0.86 0.23 -0.09 0.00 -0.05 0.00 0.00 27.48 28.43 1xck h GLN 351 CO 0.01 1.29 0.62 1.96 -0.95 0.00 0.00 178.83 181.76 1xck h GLN 352 N -0.14 0.88 -0.55 1.46 1.08 -0.37 0.54 115.11 118.00 1xck h GLN 352 Ca -0.16 -0.05 0.08 0.00 -1.45 0.00 0.00 58.65 57.06 1xck h GLN 352 Cb 1.75 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 28.95 1xck h GLN 352 CO 0.19 0.58 0.37 0.82 -0.95 0.00 0.00 178.83 179.84 1xck h ILE 353 N 0.90 0.93 0.13 2.54 2.04 -1.53 -0.69 117.51 121.84 1xck h ILE 353 Ca 0.50 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 66.21 1xck h ILE 353 Cb 0.60 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1xck h ILE 353 CO -0.27 0.08 -0.06 -0.33 0.00 0.00 0.00 178.15 177.56 1xck h GLU 354 N 0.43 -0.17 0.00 2.37 4.39 -0.99 -3.11 114.58 117.49 1xck h GLU 354 Ca 0.25 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1xck h GLU 354 Cb 0.43 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1xck h GLU 354 CO -0.07 0.29 0.00 0.39 -1.16 0.00 0.00 179.01 178.47 1xck n GLU 355 N -4.91 0.50 -2.34 2.33 1.02 -0.91 -4.75 120.64 111.58 1xck n GLU 355 Ca -0.08 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.63 1xck n GLU 355 Cb 0.27 -1.05 -0.02 0.00 -0.02 0.00 0.00 31.44 30.62 1xck n GLU 355 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xck s ALA 356 N -2.00 3.45 -2.41 0.62 0.00 -0.31 -4.89 121.76 116.22 1xck s ALA 356 Ca 0.02 0.33 0.28 0.00 0.00 0.00 0.00 51.96 52.60 1xck s ALA 356 Cb 0.01 -3.74 1.03 0.00 0.00 0.00 0.00 23.12 20.42 1xck s ALA 356 CO 0.02 -1.60 1.73 0.25 0.00 0.00 0.00 175.76 176.16 1xck n THR 357 N 5.95 0.00 -4.13 0.00 -2.24 -1.26 -4.92 114.28 107.68 1xck n THR 357 Ca 0.15 -0.23 -0.10 0.00 -2.27 0.00 0.00 64.05 61.60 1xck n THR 357 Cb 0.46 0.48 -0.10 0.00 -2.10 0.00 0.00 70.33 69.06 1xck n THR 357 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xck s SER 358 N -2.06 0.28 -0.12 3.42 0.15 -1.26 -5.08 113.70 109.03 1xck s SER 358 Ca 0.37 -1.19 -0.23 0.00 0.70 0.00 0.00 55.95 55.60 1xck s SER 358 Cb 0.21 0.31 -0.20 0.00 -1.71 0.00 0.00 66.02 64.63 1xck s SER 358 CO 0.36 -0.75 0.66 0.44 1.20 0.00 0.00 173.24 175.15 1xck h ASP 359 N 2.82 -0.01 -0.57 5.45 3.32 -1.99 -3.07 116.42 122.37 1xck h ASP 359 Ca -0.35 -0.74 0.12 0.00 0.02 0.00 0.00 57.03 56.08 1xck h ASP 359 Cb 1.20 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.65 1xck h ASP 359 CO 0.58 0.84 -0.09 0.22 -1.72 0.00 0.00 179.24 179.07 1xck h TYR 360 N -0.96 -0.20 0.00 4.55 3.20 -1.99 0.33 116.97 121.89 1xck h TYR 360 Ca -0.00 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1xck h TYR 360 Cb 0.75 0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.20 1xck h TYR 360 CO 0.20 -0.21 -0.04 -0.44 -1.64 0.00 0.00 178.16 176.04 1xck h ASP 361 N 0.04 0.00 0.01 -2.11 5.19 -2.00 -1.86 116.42 115.70 1xck h ASP 361 Ca 0.28 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.56 1xck h ASP 361 Cb 0.44 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.96 1xck h ASP 361 CO -0.55 0.04 -0.54 -0.09 -3.12 0.00 0.00 179.24 174.98 1xck h ARG 362 N 0.00 0.34 0.09 3.56 2.43 -0.42 -2.87 114.38 117.51 1xck h ARG 362 Ca -0.00 -0.38 0.02 0.00 -0.81 0.00 0.00 59.98 58.81 1xck h ARG 362 Cb 0.07 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 1xck h ARG 362 CO 0.00 1.08 -0.28 0.93 -1.51 0.00 0.00 179.97 180.19 1xck h GLU 363 N -0.23 -0.46 -0.90 0.20 4.39 -0.14 -1.18 114.58 116.25 1xck h GLU 363 Ca -0.07 0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.76 1xck h GLU 363 Cb 1.28 0.11 -0.07 0.00 -0.10 0.00 0.00 28.75 29.96 1xck h GLU 363 CO 0.10 -0.31 0.58 0.87 -1.16 0.00 0.00 179.01 179.10 1xck h LYS 364 N -0.48 0.87 -0.37 2.33 1.79 -1.45 -0.91 116.57 118.35 1xck h LYS 364 Ca 0.04 -0.05 -0.15 0.00 -2.18 0.00 0.00 60.65 58.30 1xck h LYS 364 Cb 0.52 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 1xck h LYS 364 CO -0.18 0.58 -0.37 -0.07 -1.08 0.00 0.00 179.45 178.32 1xck h LEU 365 N 0.90 0.93 -1.20 2.94 3.38 -1.22 -2.79 115.31 118.25 1xck h LEU 365 Ca 0.42 -0.42 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1xck h LEU 365 Cb 0.40 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1xck h LEU 365 CO -0.18 1.19 0.04 1.56 0.09 0.00 0.00 178.44 181.15 1xck h GLN 366 N 0.72 0.59 -0.49 1.13 1.08 -0.36 -2.27 115.11 115.51 1xck h GLN 366 Ca 0.06 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 1xck h GLN 366 Cb 0.95 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.27 1xck h GLN 366 CO 0.09 0.59 0.28 0.93 -0.95 0.00 0.00 178.83 179.76 1xck h GLU 367 N 0.57 0.67 -0.63 1.46 5.08 -0.96 -1.45 114.58 119.33 1xck h GLU 367 Ca 0.13 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.35 1xck h GLU 367 Cb 0.30 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1xck h GLU 367 CO 0.01 0.51 0.14 0.00 -1.00 0.00 0.00 179.01 178.67 1xck h ARG 368 N 0.65 1.00 -0.19 2.33 3.08 -1.17 -1.96 114.38 118.11 1xck h ARG 368 Ca 0.17 -0.23 -0.19 0.00 0.07 0.00 0.00 59.98 59.80 1xck h ARG 368 Cb 0.03 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 29.94 1xck h ARG 368 CO -0.03 0.89 -0.65 -0.39 -1.07 0.00 0.00 179.97 178.72 1xck h VAL 369 N 0.95 1.30 -0.37 2.04 -1.51 -1.34 -2.35 116.25 114.96 1xck h VAL 369 Ca 0.20 -1.88 0.06 0.00 -1.23 0.00 0.00 66.70 63.85 1xck h VAL 369 Cb 0.36 1.84 -0.06 0.00 -2.13 0.00 0.00 31.29 31.30 1xck h VAL 369 CO 0.00 0.60 0.03 0.00 -1.23 0.00 0.00 177.57 176.97 1xck h ALA 370 N 0.73 0.36 0.51 5.19 0.00 -0.97 0.93 119.26 126.02 1xck h ALA 370 Ca -0.02 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1xck h ALA 370 Cb 1.25 0.15 0.01 0.00 0.00 0.00 0.00 17.79 19.20 1xck h ALA 370 CO 0.13 -0.37 -0.25 0.87 0.00 0.00 0.00 179.25 179.63 1xck h LYS 371 N 0.14 -0.67 0.79 0.00 1.57 -1.33 0.34 116.57 117.41 1xck h LYS 371 Ca 0.18 0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.97 1xck h LYS 371 Cb 0.24 0.15 0.01 0.00 0.08 0.00 0.00 32.23 32.71 1xck h LYS 371 CO -0.28 -0.42 -0.39 1.25 -0.57 0.00 0.00 179.45 179.04 1xck h LEU 372 N -0.75 -0.94 -0.91 2.94 5.85 -1.03 -2.96 115.31 117.51 1xck h LEU 372 Ca -0.07 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.57 1xck h LEU 372 Cb 0.56 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 1xck h LEU 372 CO 0.12 -0.66 -0.53 0.00 -0.34 0.00 0.00 178.44 177.03 1xck h ALA 373 N -0.87 1.10 -0.66 1.25 0.00 0.79 -3.29 119.26 117.59 1xck h ALA 373 Ca -0.11 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 54.25 1xck h ALA 373 Cb 0.83 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1xck h ALA 373 CO 0.17 0.67 0.14 0.78 0.00 0.00 0.00 179.25 181.01 1xck h GLY 374 N 1.58 1.15 0.00 0.00 0.00 -0.28 -3.49 103.07 102.02 1xck h GLY 374 Ca -0.00 -0.74 0.00 0.00 0.00 0.00 0.00 47.33 46.59 1xck h GLY 374 CO 0.07 0.68 0.00 0.61 0.00 0.00 0.00 176.54 177.90 1xck n GLY 375 N -0.62 -0.97 3.17 4.60 0.00 -1.12 -4.90 105.19 105.35 1xck n GLY 375 Ca 0.04 -1.27 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 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 -0.36 0.32 1.61 1.01 -0.05 -4.55 120.40 118.38 1xck s VAL 376 Ca 0.00 0.18 -0.28 0.00 0.00 0.00 0.00 61.98 61.88 1xck s VAL 376 Cb 0.00 -0.56 -0.10 0.00 0.00 0.00 0.00 36.38 35.73 1xck s VAL 376 CO 0.00 0.07 1.16 0.00 0.00 0.00 0.00 175.10 176.33 1xck s ALA 377 N 2.09 3.37 -0.18 5.51 0.00 0.75 -1.43 121.76 131.87 1xck s ALA 377 Ca -0.04 0.99 -0.00 0.00 0.00 0.00 0.00 51.96 52.91 1xck s ALA 377 Cb -0.11 -3.37 0.04 0.00 0.00 0.00 0.00 23.12 19.69 1xck s ALA 377 CO -0.11 -0.34 -0.06 0.08 0.00 0.00 0.00 175.76 175.33 1xck s VAL 378 N -1.23 1.23 -0.36 0.00 1.01 -0.82 -0.71 120.40 119.52 1xck s VAL 378 Ca 0.48 -0.77 -0.15 0.00 0.00 0.00 0.00 61.98 61.55 1xck s VAL 378 Cb -0.33 -1.42 -0.00 0.00 0.00 0.00 0.00 36.38 34.63 1xck s VAL 378 CO 0.43 0.09 0.32 -0.63 0.00 0.00 0.00 175.10 175.31 1xck s ILE 379 N 1.57 5.21 -0.33 2.22 1.01 -0.19 -2.69 121.20 128.00 1xck s ILE 379 Ca -0.01 -0.21 -0.13 0.00 0.00 0.00 0.00 60.65 60.31 1xck s ILE 379 Cb -0.16 -3.83 -0.02 0.00 0.01 0.00 0.00 42.46 38.45 1xck s ILE 379 CO -0.08 -0.14 0.23 -0.54 0.00 0.00 0.00 174.94 174.41 1xck s LYS 380 N 1.88 3.60 -0.17 2.79 1.02 0.75 -1.04 119.74 128.56 1xck s LYS 380 Ca 0.09 -0.57 -0.29 0.00 0.02 0.00 0.00 55.97 55.22 1xck s LYS 380 Cb -0.17 -3.78 -0.00 0.00 -0.52 0.00 0.00 37.83 33.36 1xck s LYS 380 CO 0.11 -0.39 0.99 0.08 -0.92 0.00 0.00 175.35 175.23 1xck s VAL 381 N 1.74 4.75 0.33 3.17 1.01 -0.78 -1.23 120.40 129.39 1xck s VAL 381 Ca 0.06 1.97 0.02 0.00 0.00 0.00 0.00 61.98 64.03 1xck s VAL 381 Cb -0.17 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 31.90 1xck s VAL 381 CO 0.11 -0.07 0.51 -0.83 0.00 0.00 0.00 175.10 174.81 1xck s GLY 382 N 1.16 1.33 0.02 4.51 0.00 -1.26 -1.39 107.32 111.69 1xck s GLY 382 Ca 0.45 -1.00 -0.29 0.00 0.00 0.00 0.00 44.72 43.88 1xck s GLY 382 CO 0.12 -0.95 1.14 0.00 0.00 0.00 0.00 173.10 173.40 1xck s ALA 383 N -2.25 -1.99 0.13 3.20 0.00 -1.06 -4.56 121.76 115.24 1xck s ALA 383 Ca 0.39 0.62 0.07 0.00 0.00 0.00 0.00 51.96 53.04 1xck s ALA 383 Cb -0.09 0.41 -0.16 0.00 0.00 0.00 0.00 23.12 23.28 1xck s ALA 383 CO 0.34 -0.98 1.31 0.00 0.00 0.00 0.00 175.76 176.44 1xck h ALA 384 N 2.00 0.40 -2.37 0.00 0.00 -1.95 -3.04 119.26 114.30 1xck h ALA 384 Ca -0.25 -0.88 -0.32 0.00 0.00 0.00 0.00 54.91 53.46 1xck h ALA 384 Cb 1.21 -0.15 -0.15 0.00 0.00 0.00 0.00 17.79 18.70 1xck h ALA 384 CO 0.27 1.19 -0.72 0.95 0.00 0.00 0.00 179.25 180.95 1xck s THR 385 N -2.80 1.07 0.24 0.00 -4.23 -1.26 -4.95 115.64 103.71 1xck s THR 385 Ca 0.01 -1.94 -0.07 0.00 -1.18 0.00 0.00 61.69 58.51 1xck s THR 385 Cb 0.10 -1.71 0.23 0.00 1.34 0.00 0.00 72.50 72.47 1xck s THR 385 CO 0.82 -0.71 1.91 -0.08 -0.54 0.00 0.00 174.62 176.02 1xck h GLU 386 N 3.01 1.26 0.33 3.99 4.81 -1.99 -1.27 114.58 124.71 1xck h GLU 386 Ca -0.37 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1xck h GLU 386 Cb 1.19 -0.28 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 1xck h GLU 386 CO 0.61 0.84 -0.32 0.28 -0.73 0.00 0.00 179.01 179.69 1xck h VAL 387 N 1.29 0.33 -0.73 0.32 2.07 -1.99 0.76 116.25 118.30 1xck h VAL 387 Ca 0.35 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.90 1xck h VAL 387 Cb -0.13 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 29.92 1xck h VAL 387 CO -0.07 0.00 0.46 -0.33 0.02 0.00 0.00 177.57 177.65 1xck h GLU 388 N -0.68 0.87 0.25 1.57 5.08 -1.94 -1.10 114.58 118.64 1xck h GLU 388 Ca -0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xck h GLU 388 Cb 0.62 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 1xck h GLU 388 CO -0.06 0.57 -0.26 1.98 -1.00 0.00 0.00 179.01 180.25 1xck h MET 389 N 0.89 -0.53 -0.77 2.33 4.05 -0.84 0.14 114.93 120.21 1xck h MET 389 Ca 0.29 0.04 0.04 0.00 -0.28 0.00 0.00 59.70 59.79 1xck h MET 389 Cb 0.02 0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 30.90 1xck h MET 389 CO -0.11 -0.35 0.51 0.87 0.23 0.00 0.00 176.91 178.05 1xck h LYS 390 N -0.55 0.90 0.47 0.39 1.79 -0.60 0.01 116.57 118.98 1xck h LYS 390 Ca -0.01 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.39 1xck h LYS 390 Cb 0.51 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1xck h LYS 390 CO -0.06 0.60 -0.23 1.49 -1.08 0.00 0.00 179.45 180.17 1xck h GLU 391 N 0.93 -0.61 -0.34 3.15 4.22 -0.58 -2.64 114.58 118.72 1xck h GLU 391 Ca 0.31 0.04 0.05 0.00 0.08 0.00 0.00 59.36 59.84 1xck h GLU 391 Cb 0.07 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1xck h GLU 391 CO -0.09 -0.31 0.23 -0.22 -2.18 0.00 0.00 179.01 176.44 1xck h LYS 392 N -0.88 0.25 -0.49 1.92 3.64 -0.49 -0.92 116.57 119.61 1xck h LYS 392 Ca -0.06 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1xck h LYS 392 Cb 0.58 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 1xck h LYS 392 CO 0.11 0.17 0.31 -0.22 -2.27 0.00 0.00 179.45 177.55 1xck h LYS 393 N 0.26 0.62 -0.66 1.90 3.64 -0.83 0.79 116.57 122.29 1xck h LYS 393 Ca 0.15 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 1xck h LYS 393 Cb 0.26 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1xck h LYS 393 CO -0.03 0.41 0.25 0.00 -2.27 0.00 0.00 179.45 177.81 1xck h ALA 394 N 1.19 0.85 -0.21 5.00 0.00 -0.82 -0.51 119.26 124.77 1xck h ALA 394 Ca 0.18 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1xck h ALA 394 Cb -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1xck h ALA 394 CO -0.05 0.49 -0.26 0.00 0.00 0.00 0.00 179.25 179.43 1xck h ARG 395 N 0.93 0.39 -0.19 0.00 3.08 -0.92 -1.76 114.38 115.91 1xck h ARG 395 Ca 0.22 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 1xck h ARG 395 Cb 0.23 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1xck h ARG 395 CO -0.01 0.62 -0.09 0.28 -1.07 0.00 0.00 179.97 179.70 1xck h VAL 396 N 0.35 1.31 -0.77 2.04 2.07 -0.46 -0.62 116.25 120.17 1xck h VAL 396 Ca 0.05 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.48 1xck h VAL 396 Cb 0.64 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 32.01 1xck h VAL 396 CO 0.05 0.34 0.47 -0.33 0.02 0.00 0.00 177.57 178.12 1xck h GLU 397 N 0.09 0.85 0.23 1.57 5.08 -0.93 0.43 114.58 121.90 1xck h GLU 397 Ca 0.04 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1xck h GLU 397 Cb 0.57 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1xck h GLU 397 CO 0.03 0.57 -0.11 -0.44 -1.00 0.00 0.00 179.01 178.05 1xck h ASP 398 N 0.88 -0.26 -0.41 1.42 3.32 -1.25 -2.82 116.42 117.31 1xck h ASP 398 Ca 0.32 -0.24 0.12 0.00 0.02 0.00 0.00 57.03 57.25 1xck h ASP 398 Cb 0.11 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1xck h ASP 398 CO -0.15 0.14 0.32 0.00 -1.72 0.00 0.00 179.24 177.83 1xck h ALA 399 N -0.08 2.30 0.21 3.45 0.00 -0.96 -1.64 119.26 122.55 1xck h ALA 399 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1xck h ALA 399 Cb 0.49 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1xck h ALA 399 CO 0.05 -0.52 -0.10 1.25 0.00 0.00 0.00 179.25 179.93 1xck h LEU 400 N 0.00 -0.24 -0.68 0.00 5.85 -0.77 -1.61 115.31 117.87 1xck h LEU 400 Ca 0.19 -0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1xck h LEU 400 Cb 0.82 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.86 1xck h LEU 400 CO -0.00 0.15 0.38 0.45 -0.34 0.00 0.00 178.44 179.08 1xck h HIS 401 N -0.68 0.69 0.32 1.25 3.86 -1.10 0.58 115.15 120.07 1xck h HIS 401 Ca -0.03 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1xck h HIS 401 Cb 0.48 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.71 1xck h HIS 401 CO 0.04 0.33 -0.32 0.00 0.86 0.00 0.00 177.93 178.84 1xck h ALA 402 N 1.35 -0.68 -0.70 2.45 0.00 -1.32 -1.54 119.26 118.82 1xck h ALA 402 Ca 0.30 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1xck h ALA 402 Cb 0.19 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1xck h ALA 402 CO -0.18 -0.92 0.42 1.15 0.00 0.00 0.00 179.25 179.71 1xck h THR 403 N -0.67 1.20 -0.74 0.00 2.02 -0.97 -0.04 112.91 113.71 1xck h THR 403 Ca -0.02 -0.44 0.05 0.00 0.77 0.00 0.00 66.41 66.77 1xck h THR 403 Cb 0.61 0.22 -0.05 0.00 -1.74 0.00 0.00 68.15 67.18 1xck h THR 403 CO -0.06 0.21 0.45 -0.09 0.37 0.00 0.00 175.52 176.40 1xck h ARG 404 N 0.96 0.82 -0.01 6.66 1.12 -0.55 0.13 114.38 123.52 1xck h ARG 404 Ca 0.25 -0.05 -0.18 0.00 -1.11 0.00 0.00 59.98 58.89 1xck h ARG 404 Cb -0.03 -0.19 -0.02 0.00 -0.01 0.00 0.00 29.97 29.73 1xck h ARG 404 CO -0.05 0.54 -0.81 0.00 -3.11 0.00 0.00 179.97 176.55 1xck h ALA 405 N 1.35 0.63 -0.40 2.80 0.00 -0.52 -2.94 119.26 120.18 1xck h ALA 405 Ca 0.31 -0.69 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 1xck h ALA 405 Cb 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1xck h ALA 405 CO -0.15 0.91 -0.22 0.00 0.00 0.00 0.00 179.25 179.79 1xck h ALA 406 N 1.09 0.56 -0.12 0.00 0.00 -0.34 -2.21 119.26 118.23 1xck h ALA 406 Ca -0.03 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.46 1xck h ALA 406 Cb 1.41 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1xck h ALA 406 CO 0.12 0.53 -0.12 0.28 0.00 0.00 0.00 179.25 180.06 1xck h VAL 407 N 0.65 1.16 -0.02 0.00 2.07 -0.77 0.36 116.25 119.70 1xck h VAL 407 Ca 0.08 -0.70 -0.26 0.00 0.82 0.00 0.00 66.70 66.64 1xck h VAL 407 Cb 0.78 1.21 0.02 0.00 -1.52 0.00 0.00 31.29 31.78 1xck h VAL 407 CO 0.06 0.22 -1.01 -0.33 0.02 0.00 0.00 177.57 176.53 1xck h GLU 408 N 0.18 0.70 0.00 1.57 5.08 -1.30 -3.42 114.58 117.40 1xck h GLU 408 Ca 0.04 -0.73 0.00 0.00 -1.00 0.00 0.00 59.36 57.67 1xck h GLU 408 Cb 0.34 0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1xck h GLU 408 CO 0.02 1.31 -0.09 0.39 -1.00 0.00 0.00 179.01 179.64 1xck n GLU 409 N -3.86 0.00 0.00 2.33 1.02 -0.86 -5.08 120.64 114.20 1xck n GLU 409 Ca -0.10 -0.58 0.00 0.00 -0.02 0.00 0.00 57.16 56.46 1xck n GLU 409 Cb 0.87 -0.49 0.00 0.00 -0.02 0.00 0.00 31.44 31.80 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 0.00 -1.90 3.23 0.62 0.00 0.12 -4.46 105.19 102.80 1xck n GLY 410 Ca 0.00 -1.42 -0.14 0.00 0.00 0.00 0.00 46.02 44.46 1xck n GLY 410 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xck s VAL 411 N 0.00 1.10 0.26 1.61 -7.23 0.12 -0.44 120.40 115.81 1xck s VAL 411 Ca 0.00 -1.98 0.02 0.00 -1.81 0.00 0.00 61.98 58.21 1xck s VAL 411 Cb 0.00 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 35.15 1xck s VAL 411 CO 0.00 -0.72 0.17 0.68 -0.31 0.00 0.00 175.10 174.91 1xck s VAL 412 N -3.20 0.12 0.27 1.32 -7.23 -0.48 -0.95 120.40 110.25 1xck s VAL 412 Ca 0.14 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 58.01 1xck s VAL 412 Cb 0.02 -2.51 -0.12 0.00 0.56 0.00 0.00 36.38 34.33 1xck s VAL 412 CO -0.00 0.00 1.64 0.00 -0.31 0.00 0.00 175.10 176.43 1xck n ALA 413 N -0.43 2.69 -1.54 1.32 0.00 -1.26 -1.50 120.51 119.78 1xck n ALA 413 Ca 0.03 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1xck n ALA 413 Cb 0.65 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.61 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 2.73 1.03 2.69 0.00 0.00 0.07 -2.96 105.19 108.75 1xck n GLY 414 Ca 0.11 -1.79 -0.15 0.00 0.00 0.00 0.00 46.02 44.19 1xck n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xck n GLY 415 N 5.00 1.45 2.27 -0.02 0.00 -1.26 -1.76 105.19 110.86 1xck n GLY 415 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.13 0.39 0.14 -0.02 0.00 -1.26 -4.44 105.19 99.87 1xck n GLY 416 Ca -0.15 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.91 1xck n GLY 416 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1xck h VAL 417 N 0.00 0.59 -0.22 1.61 -1.51 -1.53 -3.23 116.25 111.95 1xck h VAL 417 Ca 0.00 -1.88 0.00 0.00 -1.23 0.00 0.00 66.70 63.59 1xck h VAL 417 Cb 0.23 2.21 -0.01 0.00 -2.13 0.00 0.00 31.29 31.59 1xck h VAL 417 CO 0.00 0.33 0.15 0.00 -1.23 0.00 0.00 177.57 176.82 1xck h ALA 418 N 1.60 0.28 -0.72 5.19 0.00 -1.71 0.43 119.26 124.33 1xck h ALA 418 Ca -0.03 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1xck h ALA 418 Cb 1.33 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 1xck h ALA 418 CO 0.05 -0.24 0.28 -0.07 0.00 0.00 0.00 179.25 179.27 1xck h LEU 419 N 0.30 0.98 -0.72 0.00 3.38 -1.85 -0.64 115.31 116.77 1xck h LEU 419 Ca 0.08 -0.15 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 1xck h LEU 419 Cb -0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1xck h LEU 419 CO -0.02 0.88 -0.51 -0.29 0.09 0.00 0.00 178.44 178.59 1xck h ILE 420 N 1.05 1.34 -0.05 1.22 2.10 -1.50 -1.65 117.51 120.02 1xck h ILE 420 Ca 0.24 -1.77 -0.01 0.00 1.08 0.00 0.00 64.86 64.41 1xck h ILE 420 Cb 0.20 1.82 -0.00 0.00 -1.09 0.00 0.00 36.82 37.75 1xck h ILE 420 CO -0.02 0.53 -0.00 -0.09 -1.08 0.00 0.00 178.15 177.49 1xck h ARG 421 N 0.26 0.09 -0.83 2.19 9.65 -0.48 -1.55 114.38 123.71 1xck h ARG 421 Ca 0.01 -0.03 0.03 0.00 -1.10 0.00 0.00 59.98 58.89 1xck h ARG 421 Cb 1.00 -0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 29.52 1xck h ARG 421 CO 0.08 0.37 0.53 0.28 2.80 0.00 0.00 179.97 184.04 1xck h VAL 422 N -0.21 1.14 -0.39 0.20 2.07 -1.06 -2.54 116.25 115.45 1xck h VAL 422 Ca 0.01 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 1xck h VAL 422 Cb 0.33 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 1xck h VAL 422 CO 0.00 0.19 0.13 0.00 0.02 0.00 0.00 177.57 177.91 1xck h ALA 423 N 1.34 0.51 -0.21 1.67 0.00 -1.18 -2.49 119.26 118.90 1xck h ALA 423 Ca 0.33 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1xck h ALA 423 Cb -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1xck h ALA 423 CO -0.11 0.16 0.22 0.66 0.00 0.00 0.00 179.25 180.17 1xck h SER 424 N 0.49 0.00 1.41 0.00 4.64 -0.87 0.11 113.55 119.33 1xck h SER 424 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1xck h SER 424 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1xck h SER 424 CO -0.00 0.00 -0.21 0.11 -0.87 0.00 0.00 176.83 175.86 1xck h LYS 425 N 0.00 0.00 -0.67 4.77 1.57 -1.19 -3.32 116.57 117.72 1xck h LYS 425 Ca 0.10 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.79 1xck h LYS 425 Cb 0.53 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 1xck h LYS 425 CO -0.00 0.00 0.12 1.28 -0.57 0.00 0.00 179.45 180.27 1xck n LEU 426 N -2.42 5.77 -0.19 2.94 4.77 0.02 -4.61 117.00 123.28 1xck n LEU 426 Ca 0.04 -2.96 0.13 0.00 -0.03 0.00 0.00 56.01 53.19 1xck n LEU 426 Cb 0.46 -0.71 0.44 0.00 -2.33 0.00 0.00 43.42 41.28 1xck n LEU 426 CO 0.33 0.69 1.21 0.00 -1.33 0.00 0.00 177.39 178.29 1xck h ALA 427 N 3.41 1.96 -0.24 -1.18 0.00 -1.67 -1.54 119.26 120.00 1xck h ALA 427 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1xck h ALA 427 Cb 2.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.78 1xck h ALA 427 CO 0.58 -0.15 0.00 -0.25 0.00 0.00 0.00 179.25 179.43 1xck n ASP 428 N -4.50 2.24 -4.73 0.00 8.00 -1.26 -4.92 116.55 111.38 1xck n ASP 428 Ca 0.14 -1.81 -0.42 0.00 0.71 0.00 0.00 54.79 53.41 1xck n ASP 428 Cb 0.45 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.37 1xck n ASP 428 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xck s LEU 429 N -1.53 4.38 0.16 0.64 2.96 -0.58 -5.01 118.68 119.70 1xck s LEU 429 Ca 0.34 2.52 0.02 0.00 -0.22 0.00 0.00 54.13 56.79 1xck s LEU 429 Cb 0.19 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.23 1xck s LEU 429 CO 0.28 -0.69 -0.03 -0.13 -1.32 0.00 0.00 176.35 174.45 1xck s ARG 430 N 0.46 1.07 0.00 1.98 1.81 -1.26 -4.96 118.95 118.04 1xck s ARG 430 Ca 0.63 -1.49 0.00 0.00 -1.72 0.00 0.00 55.73 53.15 1xck s ARG 430 Cb -0.40 -0.34 0.00 0.00 -0.45 0.00 0.00 34.95 33.75 1xck s ARG 430 CO 0.36 -0.07 0.00 0.41 -0.68 0.00 0.00 175.30 175.32 1xck n GLY 431 N -0.21 6.11 0.19 -3.53 0.00 -1.26 -5.01 105.19 101.48 1xck n GLY 431 Ca -0.08 -2.05 0.08 0.00 0.00 0.00 0.00 46.02 43.97 1xck n GLY 431 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1xck h GLN 432 N 0.00 0.00 -3.89 1.61 4.20 -1.99 -3.47 115.11 111.57 1xck h GLN 432 Ca 0.00 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.52 1xck h GLN 432 Cb 0.00 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.71 1xck h GLN 432 CO 0.00 0.23 -0.13 0.54 -0.67 0.00 0.00 178.83 178.80 1xck s ASN 433 N -6.28 0.55 0.21 1.46 2.20 -1.26 -5.05 114.94 106.78 1xck s ASN 433 Ca 0.05 -1.31 -0.08 0.00 -0.94 0.00 0.00 52.86 50.57 1xck s ASN 433 Cb 0.07 0.66 0.16 0.00 -2.00 0.00 0.00 41.25 40.14 1xck s ASN 433 CO 0.69 -1.30 1.79 -0.08 -2.94 0.00 0.00 177.10 175.26 1xck h GLU 434 N 2.14 1.18 -0.47 3.55 4.57 -1.99 -1.66 114.58 121.90 1xck h GLU 434 Ca -0.28 -0.19 0.03 0.00 -1.18 0.00 0.00 59.36 57.73 1xck h GLU 434 Cb 1.24 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 29.60 1xck h GLU 434 CO 0.39 0.93 0.26 -0.44 -1.18 0.00 0.00 179.01 178.97 1xck h ASP 435 N 1.16 0.41 -0.56 1.04 3.32 -1.95 -0.10 116.42 119.73 1xck h ASP 435 Ca 0.27 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.31 1xck h ASP 435 Cb 0.16 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1xck h ASP 435 CO -0.03 0.29 0.24 1.56 -1.72 0.00 0.00 179.24 179.58 1xck h GLN 436 N 0.52 0.86 -0.68 3.56 4.20 -1.61 -0.33 115.11 121.63 1xck h GLN 436 Ca 0.20 -0.13 0.01 0.00 0.06 0.00 0.00 58.65 58.78 1xck h GLN 436 Cb 0.06 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.65 1xck h GLN 436 CO -0.11 0.70 0.45 -0.91 -0.67 0.00 0.00 178.83 178.29 1xck h ASN 437 N 0.85 0.78 -0.67 1.46 2.35 -0.28 0.97 115.58 121.04 1xck h ASN 437 Ca 0.20 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 1xck h ASN 437 Cb 0.16 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 1xck h ASN 437 CO -0.02 0.57 0.35 0.58 -1.65 0.00 0.00 177.43 177.26 1xck h VAL 438 N 0.92 1.22 -0.63 2.81 2.07 -0.38 -1.84 116.25 120.42 1xck h VAL 438 Ca 0.25 -0.58 0.05 0.00 0.82 0.00 0.00 66.70 67.24 1xck h VAL 438 Cb -0.11 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 29.98 1xck h VAL 438 CO -0.05 0.25 0.35 1.23 0.02 0.00 0.00 177.57 179.36 1xck h GLY 439 N 0.92 0.91 1.00 2.17 0.00 0.10 0.23 103.07 108.40 1xck h GLY 439 Ca 0.23 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 1xck h GLY 439 CO -0.03 0.16 0.40 -2.22 0.00 0.00 0.00 176.54 174.85 1xck h ILE 440 N 0.66 1.19 -0.28 2.60 2.04 -0.37 -1.98 117.51 121.38 1xck h ILE 440 Ca 0.28 -0.43 -0.10 0.00 1.00 0.00 0.00 64.86 65.61 1xck h ILE 440 Cb 0.15 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 1xck h ILE 440 CO -0.16 0.20 -0.24 0.11 0.00 0.00 0.00 178.15 178.06 1xck h LYS 441 N 0.90 0.53 -0.34 2.37 1.79 -0.51 -1.25 116.57 120.07 1xck h LYS 441 Ca 0.24 -0.20 0.01 0.00 -2.18 0.00 0.00 60.65 58.52 1xck h LYS 441 Cb -0.02 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.57 1xck h LYS 441 CO -0.04 0.73 0.20 0.28 -1.08 0.00 0.00 179.45 179.54 1xck h VAL 442 N 0.47 1.04 -0.12 0.50 2.07 -0.10 -0.10 116.25 120.01 1xck h VAL 442 Ca 0.07 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1xck h VAL 442 Cb 0.67 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1xck h VAL 442 CO 0.05 0.07 0.02 0.00 0.02 0.00 0.00 177.57 177.73 1xck h ALA 443 N 1.15 0.16 -0.72 1.67 0.00 -1.11 -1.46 119.26 118.95 1xck h ALA 443 Ca 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xck h ALA 443 Cb -0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1xck h ALA 443 CO -0.06 -0.19 0.45 -0.07 0.00 0.00 0.00 179.25 179.38 1xck h LEU 444 N -0.03 0.84 -0.47 0.00 3.38 -1.10 -1.44 115.31 116.49 1xck h LEU 444 Ca 0.04 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1xck h LEU 444 Cb 0.29 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1xck h LEU 444 CO 0.00 0.63 0.01 -0.09 0.09 0.00 0.00 178.44 179.08 1xck h ARG 445 N 0.98 0.82 -0.13 1.13 2.43 -0.89 -2.82 114.38 115.90 1xck h ARG 445 Ca 0.26 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1xck h ARG 445 Cb -0.07 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1xck h ARG 445 CO -0.05 0.87 -0.11 0.00 -1.51 0.00 0.00 179.97 179.17 1xck h ALA 446 N 0.92 1.59 0.00 2.80 0.00 -0.46 -2.29 119.26 121.82 1xck h ALA 446 Ca 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1xck h ALA 446 Cb 0.49 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1xck h ALA 446 CO 0.02 0.30 0.00 -1.33 0.00 0.00 0.00 179.25 178.24 1xck n MET 447 N -4.31 0.03 0.04 0.00 2.81 -0.62 -0.52 117.12 114.55 1xck n MET 447 Ca -0.01 0.33 0.11 0.00 -1.81 0.00 0.00 57.70 56.32 1xck n MET 447 Cb 0.24 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.27 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 -1.38 0.37 -0.06 0.03 1.02 -0.86 -3.70 120.64 116.06 1xck n GLU 448 Ca 0.02 0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.06 1xck n GLU 448 Cb 0.04 -1.63 -0.04 0.00 -0.02 0.00 0.00 31.44 29.79 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 2.41 -0.36 0.00 0.62 0.00 -0.94 -1.88 119.26 119.11 1xck h ALA 449 Ca 0.00 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1xck h ALA 449 Cb 0.80 0.72 -0.06 0.00 0.00 0.00 0.00 17.79 19.25 1xck h ALA 449 CO 0.00 -0.81 -0.52 -1.35 0.00 0.00 0.00 179.25 176.57 1xck h PRO 450 N -0.35 -0.64 -0.00 0.00 0.11 -1.79 0.14 132.00 129.46 1xck h PRO 450 Ca 0.12 0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.31 1xck h PRO 450 Cb 0.57 0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.78 1xck h PRO 450 CO -0.46 -0.43 -0.22 1.25 -0.21 0.00 0.00 178.00 177.94 1xck h LEU 451 N -0.67 -0.64 -0.61 2.35 6.46 -1.69 -0.72 115.31 119.79 1xck h LEU 451 Ca 0.02 0.09 0.12 0.00 -0.12 0.00 0.00 57.88 57.99 1xck h LEU 451 Cb 0.72 0.26 -0.09 0.00 -0.73 0.00 0.00 40.66 40.82 1xck h LEU 451 CO -0.35 -0.28 0.11 0.03 -0.62 0.00 0.00 178.44 177.33 1xck h ARG 452 N -0.34 0.23 -0.40 1.25 3.08 -1.02 0.59 114.38 117.77 1xck h ARG 452 Ca 0.06 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 1xck h ARG 452 Cb 0.42 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1xck h ARG 452 CO -0.20 0.15 0.23 0.37 -1.07 0.00 0.00 179.97 179.45 1xck h GLN 453 N 0.24 0.55 -0.31 0.04 5.75 -0.20 0.75 115.11 121.93 1xck h GLN 453 Ca 0.32 -0.06 0.05 0.00 -0.15 0.00 0.00 58.65 58.82 1xck h GLN 453 Cb 0.49 -0.11 -0.05 0.00 1.07 0.00 0.00 27.48 28.89 1xck h GLN 453 CO -0.43 0.43 0.02 0.82 -2.65 0.00 0.00 178.83 177.01 1xck h ILE 454 N 0.52 0.79 -0.50 2.39 2.04 0.33 0.90 117.51 124.00 1xck h ILE 454 Ca 0.14 -0.04 -0.05 0.00 1.00 0.00 0.00 64.86 65.91 1xck h ILE 454 Cb 0.02 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1xck h ILE 454 CO -0.03 0.02 0.10 0.58 0.00 0.00 0.00 178.15 178.82 1xck h VAL 455 N 0.11 1.22 -0.46 1.67 2.07 -0.65 -2.18 116.25 118.04 1xck h VAL 455 Ca 0.15 -0.81 -0.04 0.00 0.82 0.00 0.00 66.70 66.82 1xck h VAL 455 Cb 0.19 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1xck h VAL 455 CO -0.23 0.30 0.14 0.25 0.02 0.00 0.00 177.57 178.04 1xck h LEU 456 N 0.73 0.67 -1.81 2.57 5.85 0.13 -1.66 115.31 121.79 1xck h LEU 456 Ca 0.16 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1xck h LEU 456 Cb 0.30 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1xck h LEU 456 CO 0.00 0.71 -0.11 0.78 -0.34 0.00 0.00 178.44 179.48 1xck h ASN 457 N 0.61 0.00 0.93 1.25 2.35 -0.51 -0.32 115.58 119.88 1xck h ASN 457 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1xck h ASN 457 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 1xck h ASN 457 CO -0.00 0.11 0.00 0.00 -1.65 0.00 0.00 177.43 175.89 1xck n GLY 459 N 1.30 0.42 3.72 0.00 0.00 -0.13 -5.07 105.19 105.44 1xck n GLY 459 Ca 0.07 -0.87 -0.26 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 -3.83 2.16 -0.55 1.61 0.41 -0.69 -5.04 118.70 112.77 1xck s GLU 460 Ca 0.00 -1.98 -0.25 0.00 -0.41 0.00 0.00 54.97 52.33 1xck s GLU 460 Cb 0.00 -1.86 0.04 0.00 -1.78 0.00 0.00 34.13 30.53 1xck s GLU 460 CO 0.00 -0.16 0.98 -1.21 -0.49 0.00 0.00 175.26 174.38 1xck s GLU 461 N -3.88 3.38 0.24 1.61 2.02 -1.26 -4.28 118.70 116.53 1xck s GLU 461 Ca 0.35 -0.13 -0.07 0.00 0.02 0.00 0.00 54.97 55.15 1xck s GLU 461 Cb 0.05 -4.03 0.42 0.00 0.10 0.00 0.00 34.13 30.66 1xck s GLU 461 CO 0.19 -1.49 1.67 -1.35 0.02 0.00 0.00 175.26 174.30 1xck h PRO 462 N 9.33 0.18 -0.55 0.39 0.11 -1.86 -1.84 132.00 137.76 1xck h PRO 462 Ca -0.26 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.87 1xck h PRO 462 Cb 1.07 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 1xck h PRO 462 CO 1.10 0.12 0.33 0.77 -0.21 0.00 0.00 178.00 180.11 1xck h SER 463 N 0.19 0.53 0.24 -2.05 0.02 -1.95 0.30 113.55 110.83 1xck h SER 463 Ca 0.39 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.34 1xck h SER 463 Cb 0.67 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1xck h SER 463 CO -0.55 0.37 -0.12 0.58 -1.14 0.00 0.00 176.83 175.97 1xck h VAL 464 N 0.65 0.81 -0.33 2.27 2.07 -1.77 -0.15 116.25 119.81 1xck h VAL 464 Ca 0.22 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1xck h VAL 464 Cb 0.03 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1xck h VAL 464 CO -0.10 0.09 0.19 0.58 0.02 0.00 0.00 177.57 178.35 1xck h VAL 465 N -0.54 1.13 -0.64 2.57 2.07 -1.32 -0.58 116.25 118.94 1xck h VAL 465 Ca -0.03 -0.32 0.07 0.00 0.82 0.00 0.00 66.70 67.24 1xck h VAL 465 Cb 0.40 0.74 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 1xck h VAL 465 CO 0.05 0.13 0.32 0.00 0.02 0.00 0.00 177.57 178.09 1xck h ALA 466 N 1.06 0.85 0.30 1.67 0.00 -0.39 0.23 119.26 122.98 1xck h ALA 466 Ca 0.12 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1xck h ALA 466 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1xck h ALA 466 CO -0.02 -0.05 -0.14 -0.97 0.00 0.00 0.00 179.25 178.07 1xck h ASN 467 N 0.57 -0.34 -0.27 0.00 -1.24 -0.64 -1.13 115.58 112.54 1xck h ASN 467 Ca 0.30 -0.01 0.03 0.00 0.71 0.00 0.00 56.30 57.34 1xck h ASN 467 Cb 0.26 0.09 -0.03 0.00 0.73 0.00 0.00 38.32 39.37 1xck h ASN 467 CO -0.22 -0.22 0.07 0.74 -1.29 0.00 0.00 177.43 176.51 1xck h THR 468 N -0.43 0.90 -0.59 -3.57 2.02 -0.71 -2.04 112.91 108.49 1xck h THR 468 Ca -0.04 -0.06 0.03 0.00 0.77 0.00 0.00 66.41 67.11 1xck h THR 468 Cb 0.33 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 1xck h THR 468 CO 0.07 0.03 0.36 0.58 0.37 0.00 0.00 175.52 176.93 1xck h VAL 469 N 0.18 1.06 -0.14 3.16 2.07 -0.86 -1.00 116.25 120.73 1xck h VAL 469 Ca 0.12 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.42 1xck h VAL 469 Cb 0.11 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1xck h VAL 469 CO -0.15 0.13 0.10 0.11 0.02 0.00 0.00 177.57 177.78 1xck h LYS 470 N 0.71 0.10 -0.18 1.57 1.57 -0.73 -1.86 116.57 117.76 1xck h LYS 470 Ca 0.24 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.93 1xck h LYS 470 Cb 0.03 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1xck h LYS 470 CO -0.10 0.07 -0.25 0.78 -0.57 0.00 0.00 179.45 179.38 1xck h GLY 471 N 0.11 0.35 0.00 3.86 0.00 -0.48 -3.45 103.07 103.45 1xck h GLY 471 Ca 0.06 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.12 1xck h GLY 471 CO -0.01 0.24 0.00 0.61 0.00 0.00 0.00 176.54 177.39 1xck n GLY 472 N -0.51 -1.76 3.18 4.60 0.00 -0.70 -5.11 105.19 104.90 1xck n GLY 472 Ca -0.01 -1.52 -0.11 0.00 0.00 0.00 0.00 46.02 44.38 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 -1.29 0.31 0.61 1.61 1.01 -1.26 -5.02 116.67 112.64 1xck s ASP 473 Ca 0.00 -1.30 0.00 0.00 0.71 0.00 0.00 52.55 51.96 1xck s ASP 473 Cb 0.00 0.32 0.00 0.00 1.01 0.00 0.00 42.92 44.25 1xck s ASP 473 CO 0.00 -0.78 0.00 0.61 0.21 0.00 0.00 175.17 175.21 1xck n GLY 474 N -0.20 2.35 1.54 0.21 0.00 -1.26 -1.47 105.19 106.37 1xck n GLY 474 Ca -0.02 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 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 0.41 3.34 -4.70 1.61 4.13 -1.26 -4.87 115.26 113.91 1xck n ASN 475 Ca 0.00 -2.72 -0.42 0.00 1.68 0.00 0.00 54.58 53.11 1xck n ASN 475 Cb 0.00 -0.65 -0.03 0.00 -1.54 0.00 0.00 39.78 37.56 1xck n ASN 475 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1xck s TYR 476 N -1.53 3.58 0.00 3.10 5.04 -0.54 0.08 117.35 127.07 1xck s TYR 476 Ca 0.26 1.64 0.00 0.00 -2.44 0.00 0.00 57.07 56.53 1xck s TYR 476 Cb 0.22 -3.16 0.00 0.00 0.35 0.00 0.00 41.96 39.37 1xck s TYR 476 CO 0.05 -0.13 0.00 0.41 -1.34 0.00 0.00 175.55 174.54 1xck n GLY 477 N 3.01 3.95 3.22 8.97 0.00 0.12 -4.67 105.19 119.79 1xck n GLY 477 Ca 0.08 -0.93 -0.34 0.00 0.00 0.00 0.00 46.02 44.83 1xck n GLY 477 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1xck s TYR 478 N -1.64 2.83 -0.86 1.61 5.04 -1.26 -1.98 117.35 121.08 1xck s TYR 478 Ca 0.00 -1.23 -0.23 0.00 -2.44 0.00 0.00 57.07 53.17 1xck s TYR 478 Cb 0.00 -1.96 0.06 0.00 0.35 0.00 0.00 41.96 40.42 1xck s TYR 478 CO 0.00 -0.61 1.25 1.21 -1.34 0.00 0.00 175.55 176.06 1xck s ASN 479 N 1.17 6.38 0.45 4.32 3.84 -0.07 -4.85 114.94 126.17 1xck s ASN 479 Ca 0.01 -1.23 0.17 0.00 0.21 0.00 0.00 52.86 52.03 1xck s ASN 479 Cb -0.14 -2.51 1.12 0.00 -0.55 0.00 0.00 41.25 39.17 1xck s ASN 479 CO -0.06 -1.49 1.94 0.00 -2.79 0.00 0.00 177.10 174.70 1xck h ALA 480 N 9.62 2.19 -0.34 1.71 0.00 -1.94 0.45 119.26 130.94 1xck h ALA 480 Ca -0.02 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1xck h ALA 480 Cb 1.03 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1xck h ALA 480 CO 1.28 -0.38 -0.17 0.00 0.00 0.00 0.00 179.25 179.99 1xck h ALA 481 N 1.66 1.07 -0.01 0.00 0.00 -1.96 -3.31 119.26 116.72 1xck h ALA 481 Ca 0.34 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1xck h ALA 481 Cb 0.87 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1xck h ALA 481 CO -0.09 0.57 -0.01 0.25 0.00 0.00 0.00 179.25 179.96 1xck n THR 482 N -4.15 0.00 -2.11 0.00 -2.24 -0.74 -4.99 114.28 100.05 1xck n THR 482 Ca 0.01 -0.49 -0.21 0.00 -2.27 0.00 0.00 64.05 61.08 1xck n THR 482 Cb 0.37 1.09 -0.04 0.00 -2.10 0.00 0.00 70.33 69.65 1xck n THR 482 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xck n GLU 483 N 0.18 -1.60 -4.54 -0.78 1.02 0.15 -4.98 120.64 110.09 1xck n GLU 483 Ca 0.03 1.10 -0.34 0.00 -0.02 0.00 0.00 57.16 57.92 1xck n GLU 483 Cb 0.11 -5.66 -0.11 0.00 -0.02 0.00 0.00 31.44 25.75 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 -4.58 3.10 0.16 3.49 0.41 -1.18 -4.91 118.70 115.19 1xck s GLU 484 Ca 0.00 -0.53 -0.08 0.00 -0.41 0.00 0.00 54.97 53.95 1xck s GLU 484 Cb 0.00 -2.72 -0.06 0.00 -1.78 0.00 0.00 34.13 29.57 1xck s GLU 484 CO 0.00 0.51 0.46 0.71 -0.49 0.00 0.00 175.26 176.45 1xck s TYR 485 N -0.39 3.49 -2.38 1.61 1.51 -1.26 -0.89 117.35 119.03 1xck s TYR 485 Ca 0.06 0.75 0.00 0.00 -1.01 0.00 0.00 57.07 56.87 1xck s TYR 485 Cb -0.12 -2.15 0.00 0.00 -0.11 0.00 0.00 41.96 39.57 1xck s TYR 485 CO 0.02 0.39 0.00 0.41 -1.11 0.00 0.00 175.55 175.26 1xck n GLY 486 N 0.21 -0.73 3.63 0.71 0.00 -0.84 -4.96 105.19 103.22 1xck n GLY 486 Ca -0.03 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.68 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 6.87 0.21 1.61 3.84 -1.26 0.14 114.94 122.35 1xck s ASN 487 Ca 0.00 0.94 -0.09 0.00 0.21 0.00 0.00 52.86 53.92 1xck s ASN 487 Cb 0.00 -2.53 0.29 0.00 -0.55 0.00 0.00 41.25 38.46 1xck s ASN 487 CO 0.00 -0.90 1.77 0.24 -2.79 0.00 0.00 177.10 175.42 1xck h MET 488 N 8.22 0.51 -0.41 0.43 2.86 -0.66 -1.09 114.93 124.79 1xck h MET 488 Ca -0.21 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.39 1xck h MET 488 Cb 1.06 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.59 1xck h MET 488 CO 1.03 0.34 0.22 0.82 1.06 0.00 0.00 176.91 180.38 1xck h ILE 489 N 0.53 1.15 -0.86 -1.22 1.08 -1.75 0.08 117.51 116.52 1xck h ILE 489 Ca 0.32 -0.39 -0.02 0.00 -0.39 0.00 0.00 64.86 64.38 1xck h ILE 489 Cb 0.33 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 34.71 1xck h ILE 489 CO -0.26 0.16 0.46 0.44 -0.69 0.00 0.00 178.15 178.26 1xck h ASP 490 N 0.53 1.08 0.00 1.72 3.32 -1.81 -0.14 116.42 121.11 1xck h ASP 490 Ca 0.14 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1xck h ASP 490 Cb 0.06 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.33 1xck h ASP 490 CO -0.02 0.87 0.00 0.23 -1.72 0.00 0.00 179.24 178.60 1xck n MET 491 N -4.33 0.84 -2.03 3.56 2.81 -0.46 -4.86 117.12 112.65 1xck n MET 491 Ca 0.09 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.86 1xck n MET 491 Cb 0.10 -1.23 -0.02 0.00 -0.71 0.00 0.00 33.22 31.37 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 0.49 0.19 3.04 3.03 0.00 -0.06 -4.98 105.19 106.90 1xck n GLY 492 Ca 0.09 -0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.55 3.15 0.29 -0.61 1.01 -0.03 -5.01 121.20 117.44 1xck s ILE 493 Ca 0.00 -2.91 0.03 0.00 0.00 0.00 0.00 60.65 57.77 1xck s ILE 493 Cb 0.00 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.31 1xck s ILE 493 CO 0.00 -0.80 0.15 -1.48 0.00 0.00 0.00 174.94 172.81 1xck s LEU 494 N 0.10 1.62 0.00 2.97 0.05 -1.26 -0.75 118.68 121.41 1xck s LEU 494 Ca 0.15 -1.53 -0.01 0.00 0.05 0.00 0.00 54.13 52.80 1xck s LEU 494 Cb -0.22 0.21 -0.01 0.00 -2.05 0.00 0.00 46.19 44.12 1xck s LEU 494 CO -0.03 -0.87 0.01 -1.81 -0.55 0.00 0.00 176.35 173.10 1xck s ASP 495 N -3.34 0.08 0.19 1.48 1.01 -0.56 -4.49 116.67 111.02 1xck s ASP 495 Ca 0.36 -0.17 -0.32 0.00 0.71 0.00 0.00 52.55 53.14 1xck s ASP 495 Cb 0.05 0.07 -0.11 0.00 1.01 0.00 0.00 42.92 43.95 1xck s ASP 495 CO 0.17 -0.13 1.62 -2.84 0.21 0.00 0.00 175.17 174.20 1xck s PRO 496 N -0.58 4.18 0.51 8.23 0.02 -1.26 -1.38 135.00 144.72 1xck s PRO 496 Ca -0.06 2.45 0.33 0.00 0.02 0.00 0.00 61.00 63.73 1xck s PRO 496 Cb -0.04 -3.12 1.45 0.00 0.02 0.00 0.00 34.50 32.81 1xck s PRO 496 CO -0.00 -0.65 1.79 1.15 -0.33 0.00 0.00 177.00 178.95 1xck h THR 497 N 3.91 0.42 -0.58 0.99 2.02 -0.97 0.11 112.91 118.81 1xck h THR 497 Ca -0.43 -0.03 -0.06 0.00 0.77 0.00 0.00 66.41 66.66 1xck h THR 497 Cb 1.20 0.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.91 1xck h THR 497 CO 0.92 0.02 0.12 0.50 0.37 0.00 0.00 175.52 177.45 1xck h LYS 498 N 0.09 0.91 -0.26 6.66 3.64 -1.80 -1.17 116.57 124.64 1xck h LYS 498 Ca 0.58 -0.20 -0.17 0.00 -1.27 0.00 0.00 60.65 59.59 1xck h LYS 498 Cb 2.13 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.82 1xck h LYS 498 CO -0.09 0.83 -0.49 -0.39 -2.27 0.00 0.00 179.45 177.04 1xck h VAL 499 N 0.87 1.29 -0.03 2.00 -1.51 -1.11 -0.81 116.25 116.95 1xck h VAL 499 Ca 0.18 -1.68 -0.00 0.00 -1.23 0.00 0.00 66.70 63.97 1xck h VAL 499 Cb 0.35 1.71 -0.00 0.00 -2.13 0.00 0.00 31.29 31.22 1xck h VAL 499 CO 0.00 0.54 0.01 0.74 -1.23 0.00 0.00 177.57 177.63 1xck h THR 500 N 0.53 1.15 -0.38 7.19 2.02 -1.46 0.12 112.91 122.08 1xck h THR 500 Ca 0.01 -0.43 0.06 0.00 0.77 0.00 0.00 66.41 66.82 1xck h THR 500 Cb 1.09 1.38 -0.05 0.00 -1.74 0.00 0.00 68.15 68.84 1xck h THR 500 CO 0.11 0.12 0.08 -0.09 0.37 0.00 0.00 175.52 176.10 1xck h ARG 501 N -0.13 0.20 0.22 6.66 2.43 -1.22 -1.36 114.38 121.19 1xck h ARG 501 Ca 0.01 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1xck h ARG 501 Cb 0.18 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1xck h ARG 501 CO -0.00 0.13 -0.11 0.77 -1.51 0.00 0.00 179.97 179.25 1xck h SER 502 N 0.20 -0.25 -0.47 -3.80 0.02 -0.94 -1.26 113.55 107.05 1xck h SER 502 Ca 0.18 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 61.22 1xck h SER 502 Cb 0.21 0.07 -0.08 0.00 0.14 0.00 0.00 62.40 62.74 1xck h SER 502 CO -0.23 -0.18 0.01 0.00 -1.14 0.00 0.00 176.83 175.29 1xck h ALA 503 N 0.48 0.45 0.38 3.77 0.00 -0.53 0.70 119.26 124.52 1xck h ALA 503 Ca -0.03 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1xck h ALA 503 Cb 0.23 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xck h ALA 503 CO 0.05 -0.38 -0.18 1.25 0.00 0.00 0.00 179.25 179.99 1xck h LEU 504 N 0.13 -0.44 -0.49 0.00 5.85 -1.07 -1.47 115.31 117.81 1xck h LEU 504 Ca 0.24 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.94 1xck h LEU 504 Cb 0.35 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 1xck h LEU 504 CO -0.38 -0.21 0.24 1.56 -0.34 0.00 0.00 178.44 179.31 1xck h GLN 505 N -0.65 0.46 -0.66 1.25 4.20 -0.95 0.60 115.11 119.36 1xck h GLN 505 Ca -0.05 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.56 1xck h GLN 505 Cb 0.47 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 1xck h GLN 505 CO 0.09 0.30 0.15 1.88 -0.67 0.00 0.00 178.83 180.58 1xck h TYR 506 N 0.47 1.12 0.39 2.96 0.05 -0.87 -0.72 116.97 120.38 1xck h TYR 506 Ca 0.22 -0.14 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 1xck h TYR 506 Cb 0.13 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 37.56 1xck h TYR 506 CO -0.11 0.93 -0.19 0.00 -1.05 0.00 0.00 178.16 177.74 1xck h ALA 507 N 1.06 -0.53 -0.38 3.88 0.00 -0.79 -2.45 119.26 120.05 1xck h ALA 507 Ca 0.21 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1xck h ALA 507 Cb 0.38 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1xck h ALA 507 CO 0.00 -0.73 0.27 0.00 0.00 0.00 0.00 179.25 178.79 1xck h ALA 508 N -0.10 2.33 0.52 0.00 0.00 -0.81 -0.52 119.26 120.69 1xck h ALA 508 Ca -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1xck h ALA 508 Cb 0.48 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.29 1xck h ALA 508 CO 0.09 -0.44 -0.25 1.03 0.00 0.00 0.00 179.25 179.68 1xck h SER 509 N 0.02 -0.60 -0.13 0.00 0.87 -0.67 -0.01 113.55 113.03 1xck h SER 509 Ca 0.18 -0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.59 1xck h SER 509 Cb 0.69 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.79 1xck h SER 509 CO -0.01 -0.23 -0.19 1.62 -0.53 0.00 0.00 176.83 177.49 1xck h VAL 510 N -1.01 1.25 -0.60 2.23 3.04 -1.24 -2.16 116.25 117.76 1xck h VAL 510 Ca -0.07 -1.17 -0.03 0.00 -1.01 0.00 0.00 66.70 64.42 1xck h VAL 510 Cb 0.62 1.23 -0.03 0.00 -2.01 0.00 0.00 31.29 31.10 1xck h VAL 510 CO 0.12 0.38 0.27 0.00 -1.01 0.00 0.00 177.57 177.33 1xck h ALA 511 N 1.31 0.78 -0.61 3.17 0.00 -1.09 -1.46 119.26 121.36 1xck h ALA 511 Ca 0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1xck h ALA 511 Cb 0.60 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1xck h ALA 511 CO 0.04 0.36 0.29 0.78 0.00 0.00 0.00 179.25 180.73 1xck h GLY 512 N 0.83 0.93 0.88 0.00 0.00 -0.61 -1.81 103.07 103.28 1xck h GLY 512 Ca 0.20 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 47.06 1xck h GLY 512 CO -0.02 0.41 0.02 1.41 0.00 0.00 0.00 176.54 178.36 1xck h LEU 513 N 0.86 0.48 -0.20 3.11 3.38 -0.76 -2.82 115.31 119.36 1xck h LEU 513 Ca 0.21 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1xck h LEU 513 Cb 0.09 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1xck h LEU 513 CO -0.03 0.65 0.06 0.24 0.09 0.00 0.00 178.44 179.45 1xck h MET 514 N 0.30 0.31 -0.43 1.13 2.86 -1.05 -2.41 114.93 115.64 1xck h MET 514 Ca 0.08 -0.07 0.13 0.00 -2.06 0.00 0.00 59.70 57.78 1xck h MET 514 Cb 0.39 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1xck h MET 514 CO 0.01 0.41 0.34 0.82 1.06 0.00 0.00 176.91 179.55 1xck h ILE 515 N 0.16 0.67 -0.75 -1.22 2.04 -1.33 -0.56 117.51 116.51 1xck h ILE 515 Ca 0.07 0.00 -0.34 0.00 1.00 0.00 0.00 64.86 65.59 1xck h ILE 515 Cb 0.23 0.75 -0.20 0.00 -0.74 0.00 0.00 36.82 36.86 1xck h ILE 515 CO -0.00 0.00 0.36 0.35 0.00 0.00 0.00 178.15 178.86 1xck n THR 516 N -4.22 2.95 -3.91 -0.27 -2.24 -0.93 -4.81 114.28 100.85 1xck n THR 516 Ca 0.07 -2.02 -0.35 0.00 -2.27 0.00 0.00 64.05 59.48 1xck n THR 516 Cb 0.54 -0.40 -0.09 0.00 -2.10 0.00 0.00 70.33 68.28 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 5.04 -0.07 4.28 2.01 -0.22 -4.97 115.64 118.53 1xck s THR 517 Ca 0.53 0.05 0.07 0.00 0.31 0.00 0.00 61.69 62.65 1xck s THR 517 Cb 0.45 -3.27 -0.09 0.00 0.01 0.00 0.00 72.50 69.59 1xck s THR 517 CO 0.09 0.47 0.17 -0.62 -0.69 0.00 0.00 174.62 174.04 1xck n GLU 518 N 3.40 1.16 -3.84 4.92 -0.58 -1.26 -4.82 120.64 119.63 1xck n GLU 518 Ca -0.17 -0.05 -0.12 0.00 -0.42 0.00 0.00 57.16 56.41 1xck n GLU 518 Cb 0.52 -1.08 -0.11 0.00 -0.57 0.00 0.00 31.44 30.20 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 -0.67 1.03 -0.14 0.00 -1.94 -0.42 -5.00 119.30 112.16 1xck s MET 520 Ca -0.08 -0.21 0.02 0.00 -1.71 0.00 0.00 55.69 53.71 1xck s MET 520 Cb -0.04 -0.96 0.01 0.00 2.01 0.00 0.00 34.83 35.85 1xck s MET 520 CO 0.01 -0.01 -0.20 0.08 -0.01 0.00 0.00 175.02 174.89 1xck s VAL 521 N 0.68 1.90 0.24 -6.03 1.01 -1.26 -1.49 120.40 115.46 1xck s VAL 521 Ca -0.11 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 1xck s VAL 521 Cb -0.13 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1xck s VAL 521 CO 0.01 0.52 0.23 0.28 0.00 0.00 0.00 175.10 176.14 1xck s THR 522 N 0.99 0.00 0.66 3.92 -1.32 -0.86 -4.98 115.64 114.05 1xck s THR 522 Ca -0.04 -1.89 -0.12 0.00 -1.21 0.00 0.00 61.69 58.43 1xck s THR 522 Cb -0.15 -2.47 -0.01 0.00 -1.51 0.00 0.00 72.50 68.36 1xck s THR 522 CO -0.05 0.00 1.05 -1.81 -2.21 0.00 0.00 174.62 171.61 1xck s ASP 523 N -3.19 5.63 0.10 8.08 1.11 -1.26 -0.07 116.67 127.06 1xck s ASP 523 Ca 0.37 1.64 -0.30 0.00 0.18 0.00 0.00 52.55 54.43 1xck s ASP 523 Cb 0.05 -2.50 -0.06 0.00 1.07 0.00 0.00 42.92 41.47 1xck s ASP 523 CO 0.15 -1.28 1.09 -0.22 1.18 0.00 0.00 175.17 176.10 1xck s LEU 524 N -5.20 4.43 0.00 1.23 2.96 -1.19 -4.50 118.68 116.41 1xck s LEU 524 Ca 0.59 1.96 0.00 0.00 -0.22 0.00 0.00 54.13 56.46 1xck s LEU 524 Cb -0.14 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 42.96 1xck s LEU 524 CO 0.50 -0.29 0.26 -0.81 -1.32 0.00 0.00 176.35 174.69