#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ikh s ARG 2 N 0.00 2.19 -0.21 1.96 3.52 -1.26 -4.49 118.95 120.65 3ikh s ARG 2 Ca 0.00 -0.89 -0.06 0.00 -0.13 0.00 0.00 55.73 54.64 3ikh s ARG 2 Cb 0.00 -2.02 -0.03 0.00 -1.56 0.00 0.00 34.95 31.34 3ikh s ARG 2 CO 0.00 0.48 0.04 0.08 -0.81 0.00 0.00 175.30 175.10 3ikh s VAL 3 N -0.44 4.31 -0.15 7.11 1.01 -0.42 -1.28 120.40 130.54 3ikh s VAL 3 Ca 0.05 -0.19 -0.06 0.00 0.00 0.00 0.00 61.98 61.79 3ikh s VAL 3 Cb -0.11 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3ikh s VAL 3 CO 0.01 0.40 0.05 -0.31 0.00 0.00 0.00 175.10 175.25 3ikh s TYR 4 N 1.06 3.26 -0.19 5.22 2.02 0.11 -1.26 117.35 127.57 3ikh s TYR 4 Ca 0.03 0.13 0.00 0.00 -0.37 0.00 0.00 57.07 56.87 3ikh s TYR 4 Cb -0.14 -1.99 0.04 0.00 -0.40 0.00 0.00 41.96 39.47 3ikh s TYR 4 CO 0.03 0.29 -0.08 0.08 -1.57 0.00 0.00 175.55 174.30 3ikh s VAL 5 N -0.09 1.42 -0.32 0.71 1.01 -0.24 -0.56 120.40 122.33 3ikh s VAL 5 Ca 0.06 -0.89 -0.12 0.00 0.00 0.00 0.00 61.98 61.04 3ikh s VAL 5 Cb -0.12 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 3ikh s VAL 5 CO 0.01 0.12 0.21 0.42 0.00 0.00 0.00 175.10 175.86 3ikh s THR 6 N 1.49 5.14 0.00 3.92 -4.23 -1.00 -0.28 115.64 120.68 3ikh s THR 6 Ca -0.01 -0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.35 3ikh s THR 6 Cb -0.16 -3.58 0.00 0.00 1.34 0.00 0.00 72.50 70.10 3ikh s THR 6 CO -0.08 0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 3ikh n GLY 7 N 5.07 2.27 3.76 3.99 0.00 -0.88 -4.29 105.19 115.10 3ikh n GLY 7 Ca -0.13 -0.44 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 3ikh n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ikh s ASN 8 N 2.00 4.55 -0.09 1.61 4.22 -1.26 -4.25 114.94 121.72 3ikh s ASN 8 Ca 0.00 -0.99 -0.07 0.00 -2.14 0.00 0.00 52.86 49.66 3ikh s ASN 8 Cb 0.00 -0.52 0.03 0.00 1.28 0.00 0.00 41.25 42.03 3ikh s ASN 8 CO 0.00 -0.53 0.22 -0.51 -2.04 0.00 0.00 177.10 174.25 3ikh s ILE 9 N -2.56 -0.01 0.32 0.54 2.07 -1.26 -1.37 121.20 118.93 3ikh s ILE 9 Ca 0.42 0.03 0.07 0.00 -1.41 0.00 0.00 60.65 59.76 3ikh s ILE 9 Cb 0.02 -0.33 -0.03 0.00 0.13 0.00 0.00 42.46 42.26 3ikh s ILE 9 CO 0.23 0.01 0.29 0.35 -1.91 0.00 0.00 174.94 173.91 3ikh n THR 10 N 3.20 0.00 -4.06 4.00 -2.24 0.25 -4.59 114.28 110.84 3ikh n THR 10 Ca -0.15 -2.31 -0.33 0.00 -2.27 0.00 0.00 64.05 58.99 3ikh n THR 10 Cb 0.57 1.17 -0.15 0.00 -2.10 0.00 0.00 70.33 69.82 3ikh n THR 10 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3ikh s VAL 11 N -3.27 2.34 -0.36 2.28 1.01 -1.14 -0.49 120.40 120.77 3ikh s VAL 11 Ca 0.38 -1.13 -0.17 0.00 0.00 0.00 0.00 61.98 61.05 3ikh s VAL 11 Cb 0.02 -2.15 -0.00 0.00 0.00 0.00 0.00 36.38 34.25 3ikh s VAL 11 CO 0.27 0.30 0.46 -1.81 0.00 0.00 0.00 175.10 174.31 3ikh s ASP 12 N 1.25 6.25 -0.25 3.32 1.01 0.12 -1.41 116.67 126.97 3ikh s ASP 12 Ca 0.00 -0.21 -0.10 0.00 0.71 0.00 0.00 52.55 52.96 3ikh s ASP 12 Cb -0.16 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.49 3ikh s ASP 12 CO -0.08 -0.47 0.14 -1.61 0.21 0.00 0.00 175.17 173.36 3ikh s GLU 13 N 2.26 3.91 -0.31 8.23 2.02 0.93 -1.91 118.70 133.82 3ikh s GLU 13 Ca 0.16 -0.35 -0.13 0.00 0.02 0.00 0.00 54.97 54.67 3ikh s GLU 13 Cb -0.16 -3.50 -0.03 0.00 0.10 0.00 0.00 34.13 30.54 3ikh s GLU 13 CO 0.13 -0.08 0.26 0.99 0.02 0.00 0.00 175.26 176.59 3ikh s THR 14 N 1.40 5.26 0.12 3.63 2.01 -0.43 0.11 115.64 127.73 3ikh s THR 14 Ca 0.06 0.06 0.08 0.00 0.31 0.00 0.00 61.69 62.20 3ikh s THR 14 Cb -0.15 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 3ikh s THR 14 CO 0.06 0.09 -0.12 0.26 -0.69 0.00 0.00 174.62 174.23 3ikh s TRP 15 N 1.83 2.68 -0.13 4.92 0.52 0.77 0.01 118.94 129.54 3ikh s TRP 15 Ca 0.08 -0.19 0.03 0.00 0.02 0.00 0.00 56.10 56.04 3ikh s TRP 15 Cb -0.17 -1.39 0.00 0.00 -1.15 0.00 0.00 33.47 30.76 3ikh s TRP 15 CO 0.11 0.43 -0.21 0.45 0.02 0.00 0.00 176.95 177.75 3ikh s SER 16 N -2.28 3.25 0.05 2.95 0.15 0.16 -1.12 113.70 116.86 3ikh s SER 16 Ca 0.21 -0.55 -0.07 0.00 0.70 0.00 0.00 55.95 56.24 3ikh s SER 16 Cb -0.11 -1.46 -0.01 0.00 -1.71 0.00 0.00 66.02 62.73 3ikh s SER 16 CO 0.13 0.11 0.13 0.27 1.20 0.00 0.00 173.24 175.08 3ikh s ILE 17 N 0.62 0.14 0.16 6.45 -4.36 -0.45 -0.78 121.20 122.99 3ikh s ILE 17 Ca -0.11 -1.17 -0.16 0.00 -0.26 0.00 0.00 60.65 58.94 3ikh s ILE 17 Cb -0.16 -1.11 0.04 0.00 1.25 0.00 0.00 42.46 42.48 3ikh s ILE 17 CO 0.03 -0.65 1.72 -0.65 0.24 0.00 0.00 174.94 175.63 3ikh h PRO 18 N 3.28 0.17 -1.25 0.37 0.11 -1.84 -2.67 132.00 130.18 3ikh h PRO 18 Ca -0.33 -0.01 0.26 0.00 0.11 0.00 0.00 66.00 66.03 3ikh h PRO 18 Cb 1.18 -0.04 -0.22 0.00 0.11 0.00 0.00 31.00 32.04 3ikh h PRO 18 CO 0.54 0.11 0.88 0.16 -0.21 0.00 0.00 178.00 179.48 3ikh s ASP 19 N -5.30 -0.09 -0.06 -2.05 -4.77 -1.26 -0.51 116.67 102.63 3ikh s ASP 19 Ca -0.13 0.04 -0.37 0.00 -3.30 0.00 0.00 52.55 48.78 3ikh s ASP 19 Cb 0.13 0.09 -0.15 0.00 -1.09 0.00 0.00 42.92 41.89 3ikh s ASP 19 CO 0.71 -0.13 1.57 -0.38 0.70 0.00 0.00 175.17 177.64 3ikh n ILE 20 N 0.14 0.17 -2.51 2.11 5.41 -1.26 -4.93 119.36 118.50 3ikh n ILE 20 Ca 0.01 -0.03 -0.34 0.00 1.00 0.00 0.00 62.75 63.39 3ikh n ILE 20 Cb 0.58 -1.16 -0.03 0.00 -0.71 0.00 0.00 39.64 38.32 3ikh n ILE 20 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3ikh s PRO 21 N 2.03 3.77 0.66 0.38 0.04 -1.26 -5.05 135.00 135.57 3ikh s PRO 21 Ca 0.90 1.40 -0.08 0.00 0.04 0.00 0.00 61.00 63.26 3ikh s PRO 21 Cb -0.94 -2.11 0.03 0.00 0.04 0.00 0.00 34.50 31.52 3ikh s PRO 21 CO 0.53 -0.46 0.99 0.15 0.04 0.00 0.00 177.00 178.25 3ikh s LYS 22 N -3.20 2.63 0.43 4.56 1.02 -1.26 -4.94 119.74 118.99 3ikh s LYS 22 Ca 0.67 0.02 -0.26 0.00 0.02 0.00 0.00 55.97 56.43 3ikh s LYS 22 Cb -0.18 -2.17 -0.09 0.00 -0.52 0.00 0.00 37.83 34.87 3ikh s LYS 22 CO 0.21 -0.99 1.40 1.63 -0.92 0.00 0.00 175.35 176.69 3ikh n LYS 23 N -2.82 2.24 0.00 1.68 5.02 -1.26 -0.92 118.16 122.11 3ikh n LYS 23 Ca 0.06 0.80 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 3ikh n LYS 23 Cb 0.59 -2.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.02 3ikh n LYS 23 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ikh n GLY 24 N 0.61 2.97 3.83 0.72 0.00 -1.26 -4.99 105.19 107.06 3ikh n GLY 24 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 3ikh n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ikh s ALA 25 N -1.61 3.09 -0.06 4.61 0.00 -0.09 -5.07 121.76 122.63 3ikh s ALA 25 Ca 0.00 0.32 -0.01 0.00 0.00 0.00 0.00 51.96 52.27 3ikh s ALA 25 Cb 0.00 -3.08 0.03 0.00 0.00 0.00 0.00 23.12 20.07 3ikh s ALA 25 CO 0.00 0.14 0.01 0.45 0.00 0.00 0.00 175.76 176.36 3ikh s SER 26 N -2.26 1.31 0.27 0.00 0.15 -1.26 -4.80 113.70 107.11 3ikh s SER 26 Ca 0.60 -0.05 0.02 0.00 0.70 0.00 0.00 55.95 57.22 3ikh s SER 26 Cb -0.09 -0.36 -0.05 0.00 -1.71 0.00 0.00 66.02 63.81 3ikh s SER 26 CO 0.15 -0.18 0.11 0.27 1.20 0.00 0.00 173.24 174.79 3ikh s ILE 27 N 1.80 0.53 0.15 6.45 -5.25 -1.26 -5.15 121.20 118.48 3ikh s ILE 27 Ca 0.02 -2.00 -0.00 0.00 -0.99 0.00 0.00 60.65 57.68 3ikh s ILE 27 Cb -0.13 -2.61 -0.04 0.00 2.95 0.00 0.00 42.46 42.63 3ikh s ILE 27 CO -0.04 0.00 0.32 -1.00 -1.79 0.00 0.00 174.94 172.43 3ikh s HIS 28 N -3.70 3.49 0.30 1.37 3.76 -1.26 -5.11 115.29 114.14 3ikh s HIS 28 Ca 0.37 0.28 -0.05 0.00 -0.15 0.00 0.00 55.06 55.51 3ikh s HIS 28 Cb 0.07 -1.79 -0.01 0.00 1.11 0.00 0.00 32.58 31.96 3ikh s HIS 28 CO 0.14 0.47 0.42 0.20 -0.85 0.00 0.00 174.74 175.13 3ikh s GLY 29 N -2.98 1.26 -0.13 -2.22 0.00 -1.26 -4.70 107.32 97.29 3ikh s GLY 29 Ca 0.37 -1.39 0.00 0.00 0.00 0.00 0.00 44.72 43.70 3ikh s GLY 29 CO 0.28 -0.97 -0.12 0.14 0.00 0.00 0.00 173.10 172.43 3ikh s VAL 30 N -3.46 1.35 -1.05 1.40 1.01 0.04 -4.96 120.40 114.74 3ikh s VAL 30 Ca 0.30 -0.50 -0.22 0.00 0.00 0.00 0.00 61.98 61.56 3ikh s VAL 30 Cb 0.01 -1.29 0.05 0.00 0.00 0.00 0.00 36.38 35.14 3ikh s VAL 30 CO 0.16 0.42 1.50 -0.75 0.00 0.00 0.00 175.10 176.43 3ikh s LYS 31 N 1.51 3.61 0.04 2.72 2.20 -1.26 0.40 119.74 128.96 3ikh s LYS 31 Ca 0.04 -1.21 -0.15 0.00 -0.36 0.00 0.00 55.97 54.28 3ikh s LYS 31 Cb -0.13 -5.38 -0.07 0.00 -1.51 0.00 0.00 37.83 30.74 3ikh s LYS 31 CO -0.09 -2.24 1.24 0.28 -0.36 0.00 0.00 175.35 174.18 3ikh h VAL 32 N 6.66 0.00 -3.88 4.02 2.07 -0.74 -3.48 116.25 120.90 3ikh h VAL 32 Ca 0.23 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.56 3ikh h VAL 32 Cb 0.99 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 3ikh h VAL 32 CO 1.43 0.00 -0.12 -0.94 0.02 0.00 0.00 177.57 177.95 3ikh s SER 33 N -3.25 0.55 -0.01 0.57 1.04 -1.00 -5.00 113.70 106.60 3ikh s SER 33 Ca -0.07 -1.31 -0.01 0.00 0.48 0.00 0.00 55.95 55.03 3ikh s SER 33 Cb 0.02 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.81 3ikh s SER 33 CO 0.26 -1.30 0.02 -1.58 0.98 0.00 0.00 173.24 171.62 3ikh s GLN 34 N -3.20 0.02 0.06 4.02 0.74 -1.26 -1.32 119.66 118.72 3ikh s GLN 34 Ca 0.27 0.04 -0.09 0.00 0.05 0.00 0.00 55.36 55.64 3ikh s GLN 34 Cb -0.01 -0.01 -0.00 0.00 1.10 0.00 0.00 33.01 34.09 3ikh s GLN 34 CO 0.16 -0.02 0.18 -0.51 -0.55 0.00 0.00 175.29 174.55 3ikh s ASP 35 N 0.10 0.09 0.20 6.67 1.01 -0.80 -4.98 116.67 118.96 3ikh s ASP 35 Ca -0.01 -0.50 -0.30 0.00 0.71 0.00 0.00 52.55 52.45 3ikh s ASP 35 Cb -0.01 0.30 -0.08 0.00 1.01 0.00 0.00 42.92 44.14 3ikh s ASP 35 CO -0.00 -0.62 1.05 -0.63 0.21 0.00 0.00 175.17 175.18 3ikh s ILE 36 N -3.08 3.94 0.00 0.77 1.01 -1.26 0.13 121.20 122.71 3ikh s ILE 36 Ca -0.01 1.75 0.00 0.00 0.00 0.00 0.00 60.65 62.39 3ikh s ILE 36 Cb 0.01 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.36 3ikh s ILE 36 CO -0.07 0.34 0.00 0.61 0.00 0.00 0.00 174.94 175.82 3ikh n GLY 37 N 1.82 4.67 0.00 6.18 0.00 0.36 -2.81 105.19 115.42 3ikh n GLY 37 Ca 0.01 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.46 3ikh n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ikh n GLY 38 N 0.24 1.72 0.32 -0.02 0.00 -1.26 -0.58 105.19 105.61 3ikh n GLY 38 Ca 0.00 -1.39 0.04 0.00 0.00 0.00 0.00 46.02 44.67 3ikh n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ikh h LYS 39 N 0.00 0.83 0.32 1.61 1.57 -1.97 0.33 116.57 119.26 3ikh h LYS 39 Ca 0.00 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3ikh h LYS 39 Cb 0.00 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.13 3ikh h LYS 39 CO 0.00 0.55 -0.15 0.78 -0.57 0.00 0.00 179.45 180.06 3ikh h GLY 40 N 0.86 -0.45 0.94 3.86 0.00 -1.89 -1.03 103.07 105.35 3ikh h GLY 40 Ca 0.42 0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.91 3ikh h GLY 40 CO -0.25 -0.16 0.13 0.00 0.00 0.00 0.00 176.54 176.26 3ikh h ALA 41 N 0.20 0.32 -0.15 3.60 0.00 -0.76 -0.23 119.26 122.24 3ikh h ALA 41 Ca -0.04 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.83 3ikh h ALA 41 Cb 0.36 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3ikh h ALA 41 CO 0.07 -0.13 -0.18 -0.91 0.00 0.00 0.00 179.25 178.10 3ikh h ASN 42 N 0.28 -0.56 -0.38 0.00 2.35 -0.29 0.18 115.58 117.15 3ikh h ASN 42 Ca 0.09 0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.89 3ikh h ASN 42 Cb 0.10 0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.72 3ikh h ASN 42 CO -0.01 -0.23 0.07 1.56 -1.65 0.00 0.00 177.43 177.17 3ikh h GLN 43 N -0.22 0.63 -0.51 0.81 4.20 -1.07 -2.41 115.11 116.53 3ikh h GLN 43 Ca 0.10 -0.16 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 3ikh h GLN 43 Cb 0.37 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 3ikh h GLN 43 CO -0.28 0.68 0.13 0.00 -0.67 0.00 0.00 178.83 178.69 3ikh h ALA 44 N 0.92 0.68 -0.42 3.87 0.00 -0.73 -1.52 119.26 122.05 3ikh h ALA 44 Ca 0.12 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3ikh h ALA 44 Cb 0.35 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3ikh h ALA 44 CO 0.01 0.37 0.13 0.82 0.00 0.00 0.00 179.25 180.57 3ikh h ILE 45 N 0.71 1.22 -0.54 0.00 2.04 -0.62 -1.05 117.51 119.26 3ikh h ILE 45 Ca 0.16 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.27 3ikh h ILE 45 Cb 0.32 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 3ikh h ILE 45 CO 0.00 0.26 0.22 0.40 0.00 0.00 0.00 178.15 179.02 3ikh h ILE 46 N 0.54 1.22 -0.43 -0.67 2.04 -1.38 0.08 117.51 118.92 3ikh h ILE 46 Ca 0.14 -0.69 0.06 0.00 1.00 0.00 0.00 64.86 65.37 3ikh h ILE 46 Cb 0.26 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 3ikh h ILE 46 CO -0.00 0.26 0.13 -0.07 0.00 0.00 0.00 178.15 178.47 3ikh h LEU 47 N 0.74 0.11 -1.09 1.44 3.38 -1.07 -1.77 115.31 117.04 3ikh h LEU 47 Ca 0.18 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 3ikh h LEU 47 Cb 0.20 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3ikh h LEU 47 CO -0.01 0.09 0.11 0.77 0.09 0.00 0.00 178.44 179.49 3ikh h SER 48 N 0.28 0.70 0.58 -0.43 4.64 -0.64 -1.79 113.55 116.89 3ikh h SER 48 Ca 0.20 -0.12 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 3ikh h SER 48 Cb 0.22 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3ikh h SER 48 CO -0.23 0.70 -0.12 0.03 -0.87 0.00 0.00 176.83 176.34 3ikh h ARG 49 N 0.73 0.00 -0.00 4.77 3.08 -0.26 -1.05 114.38 121.64 3ikh h ARG 49 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3ikh h ARG 49 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3ikh h ARG 49 CO -0.00 0.12 -0.03 0.00 -1.07 0.00 0.00 179.97 178.98 3ikh n GLY 51 N 1.29 0.88 3.72 0.00 0.00 -0.40 -4.94 105.19 105.74 3ikh n GLY 51 Ca 0.14 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 3ikh n GLY 51 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ikh s ILE 52 N -2.00 5.14 -0.23 -0.61 -1.09 -1.04 -4.99 121.20 116.38 3ikh s ILE 52 Ca 0.00 1.12 -0.29 0.00 -2.23 0.00 0.00 60.65 59.26 3ikh s ILE 52 Cb 0.00 -3.90 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 3ikh s ILE 52 CO 0.00 0.29 1.88 -0.70 -1.23 0.00 0.00 174.94 175.18 3ikh s GLU 53 N 0.74 3.49 0.02 2.79 2.12 -1.26 -4.15 118.70 122.46 3ikh s GLU 53 Ca 0.30 1.78 0.05 0.00 0.36 0.00 0.00 54.97 57.46 3ikh s GLU 53 Cb -0.16 -4.20 -0.02 0.00 0.26 0.00 0.00 34.13 30.01 3ikh s GLU 53 CO 0.13 -1.67 -0.15 0.99 -0.54 0.00 0.00 175.26 174.01 3ikh s THR 54 N 6.56 1.23 -0.10 -1.70 2.01 -1.26 -1.30 115.64 121.07 3ikh s THR 54 Ca 0.84 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.96 3ikh s THR 54 Cb -0.28 -1.07 0.02 0.00 0.01 0.00 0.00 72.50 71.18 3ikh s THR 54 CO 0.34 0.16 -0.10 -0.13 -0.69 0.00 0.00 174.62 174.20 3ikh s ARG 55 N -0.84 1.68 -0.22 4.92 0.52 -0.39 -4.67 118.95 119.95 3ikh s ARG 55 Ca 0.04 -0.35 -0.09 0.00 -0.52 0.00 0.00 55.73 54.81 3ikh s ARG 55 Cb -0.07 -1.57 -0.04 0.00 0.52 0.00 0.00 34.95 33.78 3ikh s ARG 55 CO 0.01 -0.14 0.12 -1.17 0.02 0.00 0.00 175.30 174.13 3ikh s LEU 56 N 1.26 3.96 -0.45 2.53 2.96 -1.26 -1.08 118.68 126.59 3ikh s LEU 56 Ca -0.03 0.08 -0.07 0.00 -0.22 0.00 0.00 54.13 53.89 3ikh s LEU 56 Cb -0.14 -2.04 0.12 0.00 0.50 0.00 0.00 46.19 44.62 3ikh s LEU 56 CO -0.04 0.10 0.30 -0.63 -1.32 0.00 0.00 176.35 174.76 3ikh s ILE 57 N 0.85 3.91 -0.00 6.68 1.01 0.62 -0.69 121.20 133.58 3ikh s ILE 57 Ca 0.06 -1.86 -0.15 0.00 0.00 0.00 0.00 60.65 58.70 3ikh s ILE 57 Cb -0.13 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.76 3ikh s ILE 57 CO 0.03 -0.74 0.32 0.00 0.00 0.00 0.00 174.94 174.55 3ikh s ALA 58 N 1.29 -0.80 0.01 9.38 0.00 -0.68 -2.08 121.76 128.88 3ikh s ALA 58 Ca 0.06 0.29 -0.11 0.00 0.00 0.00 0.00 51.96 52.21 3ikh s ALA 58 Cb -0.25 0.13 -0.05 0.00 0.00 0.00 0.00 23.12 22.95 3ikh s ALA 58 CO -0.02 -0.30 0.34 0.00 0.00 0.00 0.00 175.76 175.78 3ikh s ALA 59 N -1.62 3.76 0.13 0.00 0.00 -1.26 -4.25 121.76 118.53 3ikh s ALA 59 Ca -0.11 -0.40 0.05 0.00 0.00 0.00 0.00 51.96 51.50 3ikh s ALA 59 Cb -0.04 -2.23 -0.04 0.00 0.00 0.00 0.00 23.12 20.81 3ikh s ALA 59 CO 0.03 0.56 -0.13 0.95 0.00 0.00 0.00 175.76 177.17 3ikh s THR 60 N -1.21 1.26 0.38 0.00 -4.23 -1.26 -4.56 115.64 106.01 3ikh s THR 60 Ca 0.26 -1.81 0.04 0.00 -1.18 0.00 0.00 61.69 59.01 3ikh s THR 60 Cb -0.14 -1.60 0.07 0.00 1.34 0.00 0.00 72.50 72.17 3ikh s THR 60 CO 0.14 -0.52 0.53 0.61 -0.54 0.00 0.00 174.62 174.84 3ikh n GLY 61 N 0.33 1.56 2.51 3.99 0.00 -1.26 -0.15 105.19 112.17 3ikh n GLY 61 Ca -0.14 -2.13 -0.36 0.00 0.00 0.00 0.00 46.02 43.39 3ikh n GLY 61 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3ikh n ASN 62 N -2.70 7.54 -3.72 1.61 6.94 0.51 -4.40 115.26 121.04 3ikh n ASN 62 Ca 0.10 -3.80 -0.22 0.00 -0.02 0.00 0.00 54.58 50.64 3ikh n ASN 62 Cb 0.36 -0.98 -0.05 0.00 -2.36 0.00 0.00 39.78 36.75 3ikh n ASN 62 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 3ikh n ASP 63 N -0.79 2.55 -0.09 0.53 5.75 -1.26 -4.99 116.55 118.25 3ikh n ASP 63 Ca 0.59 -2.57 -0.07 0.00 -0.01 0.00 0.00 54.79 52.74 3ikh n ASP 63 Cb 0.53 0.37 -0.00 0.00 -1.03 0.00 0.00 41.12 40.99 3ikh n ASP 63 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 3ikh h SER 64 N 0.93 -0.77 0.27 -1.12 0.87 -1.92 -0.84 113.55 110.97 3ikh h SER 64 Ca -0.28 0.16 -0.04 0.00 -1.23 0.00 0.00 61.79 60.40 3ikh h SER 64 Cb 0.89 0.39 -0.01 0.00 -0.44 0.00 0.00 62.40 63.23 3ikh h SER 64 CO 0.46 -0.26 -0.18 0.78 -0.53 0.00 0.00 176.83 177.10 3ikh h ASN 65 N -0.19 0.00 0.34 6.23 2.35 -1.95 -2.70 115.58 119.66 3ikh h ASN 65 Ca 0.17 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 3ikh h ASN 65 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 3ikh h ASN 65 CO -0.46 0.18 -0.16 1.23 -1.65 0.00 0.00 177.43 176.57 3ikh h GLY 66 N 0.72 -0.47 1.34 2.83 0.00 -1.37 -0.49 103.07 105.63 3ikh h GLY 66 Ca -0.00 0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.47 3ikh h GLY 66 CO 0.02 -0.17 0.25 0.00 0.00 0.00 0.00 176.54 176.64 3ikh h ALA 67 N -0.06 1.33 -0.10 3.60 0.00 -1.42 -1.28 119.26 121.33 3ikh h ALA 67 Ca -0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3ikh h ALA 67 Cb 0.46 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3ikh h ALA 67 CO 0.08 0.51 0.05 2.35 0.00 0.00 0.00 179.25 182.24 3ikh h TRP 68 N 0.84 0.13 0.46 0.00 7.01 -1.37 0.90 115.95 123.92 3ikh h TRP 68 Ca 0.20 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.19 3ikh h TRP 68 Cb 0.15 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 27.15 3ikh h TRP 68 CO 0.01 0.16 -0.34 0.82 -2.79 0.00 0.00 178.44 176.30 3ikh h ILE 69 N 0.06 0.29 -0.49 2.65 2.04 -0.67 0.35 117.51 121.75 3ikh h ILE 69 Ca 0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.99 3ikh h ILE 69 Cb 0.07 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 3ikh h ILE 69 CO -0.01 0.00 0.34 0.03 0.00 0.00 0.00 178.15 178.51 3ikh h ARG 70 N -0.79 0.22 -0.01 2.37 3.08 -1.19 -0.02 114.38 118.04 3ikh h ARG 70 Ca -0.05 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 3ikh h ARG 70 Cb 0.67 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.67 3ikh h ARG 70 CO 0.01 0.15 -0.02 0.37 -1.07 0.00 0.00 179.97 179.41 3ikh h GLN 71 N 0.23 0.03 -0.69 0.04 4.15 -0.12 -3.27 115.11 115.47 3ikh h GLN 71 Ca 0.23 -0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.56 3ikh h GLN 71 Cb 0.60 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.27 3ikh h GLN 71 CO -0.04 0.60 0.17 1.96 -1.93 0.00 0.00 178.83 179.59 3ikh h GLN 72 N -0.54 1.10 0.00 1.69 1.08 0.52 -2.90 115.11 116.05 3ikh h GLN 72 Ca 0.00 -0.26 0.00 0.00 -1.45 0.00 0.00 58.65 56.94 3ikh h GLN 72 Cb 0.60 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.88 3ikh h GLN 72 CO 0.00 0.97 0.00 0.97 -0.95 0.00 0.00 178.83 179.82 3ikh h ILE 73 N 1.05 0.00 0.00 2.54 2.10 -1.12 -2.00 117.51 120.07 3ikh h ILE 73 Ca 0.22 -0.22 -0.01 0.00 1.08 0.00 0.00 64.86 65.94 3ikh h ILE 73 Cb 0.36 1.02 -0.00 0.00 -1.09 0.00 0.00 36.82 37.11 3ikh h ILE 73 CO 0.00 0.00 -0.03 0.11 -1.08 0.00 0.00 178.15 177.15 3ikh h LYS 74 N 0.00 0.00 -0.00 2.19 1.57 -1.56 -0.55 116.57 118.22 3ikh h LYS 74 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3ikh h LYS 74 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3ikh h LYS 74 CO 0.00 0.03 -0.06 0.09 -0.57 0.00 0.00 179.45 178.94 3ikh n ASN 75 N -3.25 0.24 -4.71 0.86 3.02 -0.75 -4.82 115.26 105.86 3ikh n ASN 75 Ca -0.02 -0.39 -0.34 0.00 -0.03 0.00 0.00 54.58 53.80 3ikh n ASN 75 Cb 0.19 -0.16 -0.09 0.00 -0.61 0.00 0.00 39.78 39.11 3ikh n ASN 75 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3ikh s GLU 76 N -2.51 2.96 0.00 3.52 0.41 -0.22 -5.00 118.70 117.87 3ikh s GLU 76 Ca 0.29 -0.46 -0.01 0.00 -0.41 0.00 0.00 54.97 54.37 3ikh s GLU 76 Cb 0.20 -2.79 -0.07 0.00 -1.78 0.00 0.00 34.13 29.70 3ikh s GLU 76 CO 0.47 0.68 1.92 -0.35 -0.49 0.00 0.00 175.26 177.48 3ikh n PRO 77 N 1.77 0.98 0.00 0.39 -0.04 -1.26 -5.02 135.00 131.82 3ikh n PRO 77 Ca -0.17 -0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.05 3ikh n PRO 77 Cb 0.53 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 3ikh n PRO 77 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 3ikh n LEU 78 N 1.97 0.00 -3.64 1.53 7.94 -1.26 -4.68 117.00 118.86 3ikh n LEU 78 Ca 0.11 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 54.95 3ikh n LEU 78 Cb 0.47 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.36 3ikh n LEU 78 CO 0.05 0.00 0.39 -0.22 -1.11 0.00 0.00 177.39 176.50 3ikh s LEU 80 N 0.00 -0.91 0.03 -1.96 2.96 -1.26 -4.97 118.68 112.56 3ikh s LEU 80 Ca 0.00 1.42 0.05 0.00 -0.22 0.00 0.00 54.13 55.38 3ikh s LEU 80 Cb 0.00 2.28 -0.02 0.00 0.50 0.00 0.00 46.19 48.95 3ikh s LEU 80 CO 0.00 -0.22 -0.15 -0.76 -1.32 0.00 0.00 176.35 173.90 3ikh s LEU 81 N 1.78 2.13 0.91 -0.68 1.43 0.13 -4.42 118.68 119.97 3ikh s LEU 81 Ca -0.09 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 52.46 3ikh s LEU 81 Cb -0.06 -0.66 0.15 0.00 0.03 0.00 0.00 46.19 45.65 3ikh s LEU 81 CO -0.19 0.08 1.22 -2.16 0.23 0.00 0.00 176.35 175.53 3ikh s PRO 82 N -0.93 1.11 -0.04 1.29 0.04 -1.26 -1.68 135.00 133.53 3ikh s PRO 82 Ca 0.03 -0.07 -0.26 0.00 0.04 0.00 0.00 61.00 60.74 3ikh s PRO 82 Cb -0.07 -1.87 -0.21 0.00 0.04 0.00 0.00 34.50 32.39 3ikh s PRO 82 CO 0.01 -2.15 1.17 -0.44 0.04 0.00 0.00 177.00 175.63 3ikh h ASP 83 N -1.45 -0.01 -1.31 6.66 3.32 -1.98 -3.46 116.42 118.19 3ikh h ASP 83 Ca -0.46 -0.56 -0.00 0.00 0.02 0.00 0.00 57.03 56.02 3ikh h ASP 83 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 3ikh h ASP 83 CO 0.53 0.56 -0.00 0.61 -1.72 0.00 0.00 179.24 179.22 3ikh n GLY 84 N 0.46 -2.99 3.18 2.75 0.00 -1.26 -5.09 105.19 102.25 3ikh n GLY 84 Ca -0.09 -1.36 -0.23 0.00 0.00 0.00 0.00 46.02 44.35 3ikh n GLY 84 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3ikh n HIS 85 N -2.75 -0.08 0.00 1.61 1.44 -1.26 -4.82 115.22 109.36 3ikh n HIS 85 Ca 0.00 -2.55 0.00 0.00 -2.01 0.00 0.00 57.72 53.16 3ikh n HIS 85 Cb 0.01 0.06 0.00 0.00 0.12 0.00 0.00 29.99 30.18 3ikh n HIS 85 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 3ikh n PHE 86 N -0.82 0.00 0.00 -1.40 3.01 0.78 -4.88 117.46 114.15 3ikh n PHE 86 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 3ikh n PHE 86 Cb 0.58 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.05 3ikh n PHE 86 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3ikh n ASN 87 N 0.00 0.00 0.23 4.37 4.13 -1.26 -0.36 115.26 122.37 3ikh n ASN 87 Ca 0.00 0.00 -0.15 0.00 1.68 0.00 0.00 54.58 56.11 3ikh n ASN 87 Cb 0.00 0.00 -0.08 0.00 -1.54 0.00 0.00 39.78 38.16 3ikh n ASN 87 CO 0.00 0.00 0.00 -0.61 0.28 0.00 0.00 177.26 176.93 3ikh h GLN 88 N 0.00 -0.54 0.00 3.52 5.75 -1.94 -1.16 115.11 120.73 3ikh h GLN 88 Ca 0.00 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 3ikh h GLN 88 Cb 0.00 0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.67 3ikh h GLN 88 CO 0.00 -0.30 0.00 1.58 -2.65 0.00 0.00 178.83 177.46 3ikh n HIS 89 N -5.29 0.00 -2.20 3.99 -0.00 -1.26 -4.58 115.22 105.88 3ikh n HIS 89 Ca -0.11 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.19 3ikh n HIS 89 Cb 0.26 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.22 3ikh n HIS 89 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 3ikh s SER 90 N 0.00 6.86 0.15 0.26 0.01 -1.26 -4.88 113.70 114.84 3ikh s SER 90 Ca 0.00 2.32 -0.24 0.00 1.31 0.00 0.00 55.95 59.34 3ikh s SER 90 Cb 0.00 -2.59 0.06 0.00 0.21 0.00 0.00 66.02 63.70 3ikh s SER 90 CO 0.00 -0.61 0.78 1.51 0.41 0.00 0.00 173.24 175.33 3ikh s ASP 91 N 0.90 -0.35 -0.01 2.44 1.47 -1.24 -2.87 116.67 117.01 3ikh s ASP 91 Ca 0.62 -0.25 0.06 0.00 1.18 0.00 0.00 52.55 54.16 3ikh s ASP 91 Cb -0.36 0.56 -0.02 0.00 -0.34 0.00 0.00 42.92 42.76 3ikh s ASP 91 CO 0.32 -0.97 -0.19 0.28 0.68 0.00 0.00 175.17 175.29 3ikh s THR 92 N -3.54 1.51 -0.27 2.11 -1.32 -0.50 -1.46 115.64 112.17 3ikh s THR 92 Ca 0.07 -0.84 -0.09 0.00 -1.21 0.00 0.00 61.69 59.62 3ikh s THR 92 Cb -0.02 -1.26 -0.03 0.00 -1.51 0.00 0.00 72.50 69.68 3ikh s THR 92 CO -0.03 0.41 0.12 -0.55 -2.21 0.00 0.00 174.62 172.35 3ikh s SER 93 N -0.50 5.44 -0.44 8.08 0.15 0.48 -0.05 113.70 126.85 3ikh s SER 93 Ca 0.07 -0.27 -0.14 0.00 0.70 0.00 0.00 55.95 56.31 3ikh s SER 93 Cb -0.07 -1.99 0.06 0.00 -1.71 0.00 0.00 66.02 62.30 3ikh s SER 93 CO -0.01 -0.09 0.34 -0.63 1.20 0.00 0.00 173.24 174.05 3ikh s ILE 94 N 1.64 5.05 -0.55 6.45 1.01 0.29 -2.06 121.20 133.03 3ikh s ILE 94 Ca 0.06 -0.99 -0.20 0.00 0.00 0.00 0.00 60.65 59.52 3ikh s ILE 94 Cb -0.16 -3.95 0.07 0.00 0.01 0.00 0.00 42.46 38.43 3ikh s ILE 94 CO 0.06 -0.47 0.71 -0.63 0.00 0.00 0.00 174.94 174.61 3ikh s ILE 95 N 1.61 4.77 -0.36 2.92 1.01 1.00 -0.17 121.20 131.98 3ikh s ILE 95 Ca 0.04 -0.57 -0.22 0.00 0.00 0.00 0.00 60.65 59.90 3ikh s ILE 95 Cb -0.22 -4.41 0.01 0.00 0.01 0.00 0.00 42.46 37.84 3ikh s ILE 95 CO 0.07 -0.99 0.70 -0.22 0.00 0.00 0.00 174.94 174.50 3ikh s LEU 96 N 2.89 4.21 0.53 2.97 2.96 -0.28 -0.83 118.68 131.12 3ikh s LEU 96 Ca 0.16 0.22 -0.09 0.00 -0.22 0.00 0.00 54.13 54.20 3ikh s LEU 96 Cb -0.20 -2.88 -0.05 0.00 0.50 0.00 0.00 46.19 43.56 3ikh s LEU 96 CO 0.11 -0.66 0.89 0.20 -1.32 0.00 0.00 176.35 175.57 3ikh s ASN 97 N 1.82 6.32 0.08 3.68 -0.87 -1.26 -1.34 114.94 123.36 3ikh s ASN 97 Ca 0.27 1.20 -0.17 0.00 -1.57 0.00 0.00 52.86 52.59 3ikh s ASN 97 Cb -0.14 -2.36 -0.11 0.00 -0.02 0.00 0.00 41.25 38.61 3ikh s ASN 97 CO 0.16 -0.66 1.38 0.77 -2.57 0.00 0.00 177.10 176.17 3ikh h SER 98 N 0.22 0.64 -3.51 -1.22 4.64 -0.43 -3.47 113.55 110.42 3ikh h SER 98 Ca -0.46 -0.50 -0.61 0.00 -0.47 0.00 0.00 61.79 59.76 3ikh h SER 98 Cb 1.20 -0.18 -0.12 0.00 -0.31 0.00 0.00 62.40 62.99 3ikh h SER 98 CO 0.62 1.01 -0.14 0.00 -0.87 0.00 0.00 176.83 177.45 3ikh s ALA 99 N -4.25 3.56 0.99 5.18 0.00 -1.25 -5.10 121.76 120.89 3ikh s ALA 99 Ca -0.13 -0.54 -0.12 0.00 0.00 0.00 0.00 51.96 51.18 3ikh s ALA 99 Cb 0.07 -2.71 0.18 0.00 0.00 0.00 0.00 23.12 20.66 3ikh s ALA 99 CO 0.81 -0.42 1.08 -0.51 0.00 0.00 0.00 175.76 176.72 3ikh s ASP 102 N 1.19 2.65 0.72 0.00 1.01 -1.26 -5.03 116.67 115.95 3ikh s ASP 102 Ca 0.20 1.37 -0.16 0.00 0.71 0.00 0.00 52.55 54.67 3ikh s ASP 102 Cb -0.15 -2.05 0.03 0.00 1.01 0.00 0.00 42.92 41.76 3ikh s ASP 102 CO 0.09 -3.14 1.21 0.59 0.21 0.00 0.00 175.17 174.13 3ikh n ASN 103 N -4.20 1.46 -4.14 0.27 3.02 -1.26 -4.55 115.26 105.86 3ikh n ASN 103 Ca 0.06 0.72 -0.30 0.00 -0.03 0.00 0.00 54.58 55.02 3ikh n ASN 103 Cb 0.56 -1.52 -0.17 0.00 -0.61 0.00 0.00 39.78 38.04 3ikh n ASN 103 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ikh s ALA 104 N -1.72 1.97 0.01 5.41 0.00 -0.01 -4.96 121.76 122.45 3ikh s ALA 104 Ca 0.78 -0.88 0.07 0.00 0.00 0.00 0.00 51.96 51.93 3ikh s ALA 104 Cb -0.34 -0.84 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 3ikh s ALA 104 CO 0.45 0.08 -0.21 0.42 0.00 0.00 0.00 175.76 176.51 3ikh s ILE 105 N 0.68 2.52 -0.07 0.00 1.09 -1.26 -0.00 121.20 124.15 3ikh s ILE 105 Ca -0.12 -1.12 0.01 0.00 -1.10 0.00 0.00 60.65 58.33 3ikh s ILE 105 Cb -0.16 -1.98 0.02 0.00 -1.06 0.00 0.00 42.46 39.27 3ikh s ILE 105 CO 0.03 0.46 -0.09 -0.63 -0.10 0.00 0.00 174.94 174.60 3ikh s ILE 106 N -0.78 0.93 0.01 2.92 1.01 -0.87 -4.98 121.20 119.43 3ikh s ILE 106 Ca 0.12 -0.33 0.04 0.00 0.00 0.00 0.00 60.65 60.48 3ikh s ILE 106 Cb -0.10 -0.89 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 3ikh s ILE 106 CO 0.02 0.32 -0.13 -0.89 0.00 0.00 0.00 174.94 174.25 3ikh s THR 107 N 0.94 1.06 0.15 2.92 2.01 -1.26 -0.39 115.64 121.06 3ikh s THR 107 Ca -0.10 -0.71 0.06 0.00 0.31 0.00 0.00 61.69 61.25 3ikh s THR 107 Cb -0.15 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 3ikh s THR 107 CO 0.01 0.19 0.03 0.42 -0.69 0.00 0.00 174.62 174.58 3ikh s THR 108 N -0.50 3.99 -0.00 -0.82 -4.23 -0.54 -5.00 115.64 108.54 3ikh s THR 108 Ca 0.04 -1.22 0.00 0.00 -1.18 0.00 0.00 61.69 59.33 3ikh s THR 108 Cb -0.06 -2.99 0.00 0.00 1.34 0.00 0.00 72.50 70.80 3ikh s THR 108 CO 0.00 -0.05 0.60 0.35 -0.54 0.00 0.00 174.62 174.99 3ikh n THR 109 N 0.02 0.09 -0.27 3.99 -2.24 -1.26 -3.66 114.28 110.95 3ikh n THR 109 Ca -0.10 -0.09 0.07 0.00 -2.27 0.00 0.00 64.05 61.66 3ikh n THR 109 Cb 0.54 0.89 0.21 0.00 -2.10 0.00 0.00 70.33 69.87 3ikh n THR 109 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ikh h ALA 110 N 0.00 1.12 0.18 6.98 0.00 -1.96 0.12 119.26 125.70 3ikh h ALA 110 Ca 0.00 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.06 3ikh h ALA 110 Cb 1.02 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 3ikh h ALA 110 CO 0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 179.25 178.77 3ikh h ALA 111 N 1.60 -0.40 -0.56 0.00 0.00 -1.90 -1.75 119.26 116.24 3ikh h ALA 111 Ca 0.45 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 3ikh h ALA 111 Cb 0.74 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 3ikh h ALA 111 CO -0.46 -0.76 0.24 0.00 0.00 0.00 0.00 179.25 178.27 3ikh h ALA 112 N 0.32 0.73 -0.56 0.00 0.00 -1.69 -2.71 119.26 115.35 3ikh h ALA 112 Ca 0.01 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.80 3ikh h ALA 112 Cb 0.42 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3ikh h ALA 112 CO -0.07 0.33 0.37 -0.44 0.00 0.00 0.00 179.25 179.43 3ikh h ASP 113 N 0.77 0.56 -0.64 0.00 3.32 -0.52 -2.77 116.42 117.14 3ikh h ASP 113 Ca 0.19 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.23 3ikh h ASP 113 Cb 0.18 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3ikh h ASP 113 CO -0.02 0.38 0.00 0.35 -1.72 0.00 0.00 179.24 178.24 3ikh n THR 114 N -4.47 0.84 -2.58 0.35 -2.24 -0.68 -4.86 114.28 100.64 3ikh n THR 114 Ca 0.06 -0.92 -0.42 0.00 -2.27 0.00 0.00 64.05 60.50 3ikh n THR 114 Cb 0.14 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.00 3ikh n THR 114 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3ikh s PHE 115 N -1.16 2.55 0.48 4.78 5.36 -1.03 -5.00 117.98 123.96 3ikh s PHE 115 Ca 0.46 0.33 -0.18 0.00 -0.96 0.00 0.00 56.93 56.58 3ikh s PHE 115 Cb 0.25 -4.54 -0.09 0.00 -0.34 0.00 0.00 43.02 38.30 3ikh s PHE 115 CO 0.33 -1.68 0.97 -1.54 -1.46 0.00 0.00 175.22 171.85 3ikh s SER 116 N 3.10 6.75 0.25 6.13 1.04 -1.26 -4.97 113.70 124.75 3ikh s SER 116 Ca 0.41 1.62 -0.03 0.00 0.48 0.00 0.00 55.95 58.43 3ikh s SER 116 Cb -0.08 -2.52 0.44 0.00 0.10 0.00 0.00 66.02 63.97 3ikh s SER 116 CO 0.23 -0.49 1.79 -0.07 0.98 0.00 0.00 173.24 175.68 3ikh h LEU 117 N 1.32 0.63 -2.45 2.42 3.38 -1.98 0.31 115.31 118.94 3ikh h LEU 117 Ca -0.48 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.56 3ikh h LEU 117 Cb 1.18 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.88 3ikh h LEU 117 CO 0.61 0.33 0.00 0.44 0.09 0.00 0.00 178.44 179.91 3ikh h ASP 118 N 0.74 0.00 -0.77 -0.43 3.32 -2.02 0.34 116.42 117.59 3ikh h ASP 118 Ca 0.42 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 57.18 3ikh h ASP 118 Cb 0.46 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.83 3ikh h ASP 118 CO -0.28 0.00 0.37 -0.62 -1.72 0.00 0.00 179.24 176.99 3ikh n GLU 119 N -2.97 3.11 0.00 3.56 1.02 0.10 -4.43 120.64 121.03 3ikh n GLU 119 Ca -0.02 -2.82 0.00 0.00 -0.02 0.00 0.00 57.16 54.30 3ikh n GLU 119 Cb 0.12 -2.13 0.00 0.00 -0.02 0.00 0.00 31.44 29.41 3ikh n GLU 119 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3ikh n ILE 121 N -0.39 0.00 0.27 -3.67 5.41 0.11 -4.61 119.36 116.47 3ikh n ILE 121 Ca 0.44 0.00 0.13 0.00 1.00 0.00 0.00 62.75 64.31 3ikh n ILE 121 Cb 1.41 0.00 0.80 0.00 -0.71 0.00 0.00 39.64 41.14 3ikh n ILE 121 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 3ikh h PRO 122 N 0.00 0.00 -2.25 0.38 0.11 -1.81 -3.29 132.00 125.15 3ikh h PRO 122 Ca 0.00 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.91 3ikh h PRO 122 Cb 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.06 3ikh h PRO 122 CO 0.00 0.00 0.07 0.72 -0.21 0.00 0.00 178.00 178.58 3ikh n HIS 123 N -4.11 0.18 0.00 0.65 8.25 -1.26 -4.68 115.22 114.25 3ikh n HIS 123 Ca -0.02 -1.39 0.00 0.00 -0.26 0.00 0.00 57.72 56.05 3ikh n HIS 123 Cb 0.11 -1.48 0.00 0.00 1.12 0.00 0.00 29.99 29.74 3ikh n HIS 123 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ikh n ALA 125 N 2.69 0.00 -1.04 -1.41 0.00 -1.24 -4.90 120.51 114.60 3ikh n ALA 125 Ca 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.83 3ikh n ALA 125 Cb 0.72 0.00 0.31 0.00 0.00 0.00 0.00 19.45 20.49 3ikh n ALA 125 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3ikh n ASP 126 N 0.13 4.73 -4.82 0.00 2.03 -1.26 -4.99 116.55 112.38 3ikh n ASP 126 Ca 0.00 -3.17 -0.31 0.00 0.52 0.00 0.00 54.79 51.83 3ikh n ASP 126 Cb 0.00 -0.69 0.04 0.00 -0.72 0.00 0.00 41.12 39.75 3ikh n ASP 126 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ikh s ALA 127 N -2.94 2.69 0.05 -1.67 0.00 -1.26 -5.07 121.76 113.55 3ikh s ALA 127 Ca 0.52 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.66 3ikh s ALA 127 Cb 0.42 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 20.33 3ikh s ALA 127 CO 0.12 -1.15 -0.10 0.08 0.00 0.00 0.00 175.76 174.71 3ikh s VAL 128 N -2.94 0.77 0.22 0.00 1.01 -1.26 -5.07 120.40 113.13 3ikh s VAL 128 Ca 0.59 -1.10 -0.31 0.00 0.00 0.00 0.00 61.98 61.17 3ikh s VAL 128 Cb -0.14 -0.78 -0.15 0.00 0.00 0.00 0.00 36.38 35.31 3ikh s VAL 128 CO 0.52 -0.27 1.13 0.00 0.00 0.00 0.00 175.10 176.48 3ikh n ALA 129 N 1.53 -0.40 0.00 5.51 0.00 -1.21 -0.87 120.51 125.07 3ikh n ALA 129 Ca -0.21 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.66 3ikh n ALA 129 Cb 0.55 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.95 3ikh n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ikh n GLY 130 N 1.76 2.91 3.61 0.00 0.00 -0.50 -5.06 105.19 107.90 3ikh n GLY 130 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3ikh n GLY 130 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ikh s ASP 131 N 0.05 2.22 0.01 1.61 1.01 -0.05 -4.47 116.67 117.05 3ikh s ASP 131 Ca 0.00 1.61 0.06 0.00 0.71 0.00 0.00 52.55 54.93 3ikh s ASP 131 Cb 0.00 -2.27 -0.03 0.00 1.01 0.00 0.00 42.92 41.63 3ikh s ASP 131 CO 0.00 -3.45 -0.19 -0.63 0.21 0.00 0.00 175.17 171.12 3ikh s ILE 132 N -2.68 2.73 -0.20 0.77 1.01 -0.41 -0.28 121.20 122.14 3ikh s ILE 132 Ca 0.66 -1.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.23 3ikh s ILE 132 Cb -0.22 -2.10 0.00 0.00 0.01 0.00 0.00 42.46 40.15 3ikh s ILE 132 CO 0.60 0.43 -0.10 -0.22 0.00 0.00 0.00 174.94 175.66 3ikh s LEU 133 N -1.14 2.62 -0.15 2.97 2.96 0.04 0.10 118.68 126.08 3ikh s LEU 133 Ca 0.13 -0.48 -0.01 0.00 -0.22 0.00 0.00 54.13 53.55 3ikh s LEU 133 Cb -0.10 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.93 3ikh s LEU 133 CO 0.03 -0.01 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.73 3ikh s LEU 134 N 1.37 2.80 0.09 -0.68 2.96 0.28 -1.18 118.68 124.32 3ikh s LEU 134 Ca 0.05 -0.31 0.04 0.00 -0.22 0.00 0.00 54.13 53.69 3ikh s LEU 134 Cb -0.14 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 44.87 3ikh s LEU 134 CO -0.06 0.14 -0.11 -1.10 -1.32 0.00 0.00 176.35 173.89 3ikh s GLN 135 N 0.50 0.86 0.00 1.98 -0.21 -0.78 -2.38 119.66 119.64 3ikh s GLN 135 Ca -0.08 -1.12 0.00 0.00 0.02 0.00 0.00 55.36 54.18 3ikh s GLN 135 Cb -0.15 -0.64 0.00 0.00 1.00 0.00 0.00 33.01 33.21 3ikh s GLN 135 CO 0.04 0.11 0.00 1.04 -2.12 0.00 0.00 175.29 174.36 3ikh n GLN 136 N 0.72 3.99 -0.71 2.91 3.00 -1.26 -1.68 117.38 124.35 3ikh n GLN 136 Ca -0.17 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.81 3ikh n GLN 136 Cb 0.57 0.00 0.21 0.00 0.00 0.00 0.00 30.24 31.01 3ikh n GLN 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3ikh n GLY 137 N 5.00 4.82 0.89 1.08 0.00 -0.40 -4.67 105.19 111.92 3ikh n GLY 137 Ca 0.00 -1.21 0.06 0.00 0.00 0.00 0.00 46.02 44.87 3ikh n GLY 137 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ikh n ASN 138 N -1.07 2.56 -4.40 1.61 4.13 -1.26 -3.93 115.26 112.91 3ikh n ASN 138 Ca 0.30 -2.13 -0.21 0.00 1.68 0.00 0.00 54.58 54.22 3ikh n ASN 138 Cb 0.96 -0.36 -0.10 0.00 -1.54 0.00 0.00 39.78 38.75 3ikh n ASN 138 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3ikh s PHE 139 N -1.58 1.95 0.96 3.10 0.08 -1.26 -4.78 117.98 116.45 3ikh s PHE 139 Ca 0.28 -0.48 -0.11 0.00 0.12 0.00 0.00 56.93 56.74 3ikh s PHE 139 Cb 0.17 -0.89 0.17 0.00 -0.57 0.00 0.00 43.02 41.90 3ikh s PHE 139 CO 0.16 0.50 1.10 -1.54 -0.10 0.00 0.00 175.22 175.35 3ikh s SER 140 N -3.40 2.66 0.11 1.36 1.04 -1.26 -4.72 113.70 109.48 3ikh s SER 140 Ca 0.26 1.90 -0.22 0.00 0.48 0.00 0.00 55.95 58.38 3ikh s SER 140 Cb -0.02 -2.45 -0.09 0.00 0.10 0.00 0.00 66.02 63.55 3ikh s SER 140 CO 0.10 -3.22 1.73 0.25 0.98 0.00 0.00 173.24 173.08 3ikh h LEU 141 N -1.95 -0.06 -0.51 2.42 5.85 -1.98 -0.31 115.31 118.77 3ikh h LEU 141 Ca -0.48 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.30 3ikh h LEU 141 Cb 1.28 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 42.32 3ikh h LEU 141 CO 0.46 -0.01 0.28 0.44 -0.34 0.00 0.00 178.44 179.27 3ikh h ASP 142 N 0.02 0.42 -0.29 1.25 3.32 -1.99 0.43 116.42 119.58 3ikh h ASP 142 Ca 0.04 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 3ikh h ASP 142 Cb 0.06 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 3ikh h ASP 142 CO -0.08 0.29 -0.04 0.11 -1.72 0.00 0.00 179.24 177.80 3ikh h LYS 143 N 0.54 0.54 -0.20 3.56 1.57 -1.89 -0.78 116.57 119.91 3ikh h LYS 143 Ca 0.22 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3ikh h LYS 143 Cb 0.09 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3ikh h LYS 143 CO -0.13 0.72 0.10 1.15 -0.57 0.00 0.00 179.45 180.71 3ikh h THR 144 N 0.32 0.99 -0.53 -0.16 2.02 -0.77 -0.55 112.91 114.24 3ikh h THR 144 Ca 0.08 -0.07 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3ikh h THR 144 Cb 0.50 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 3ikh h THR 144 CO 0.02 0.04 0.16 -0.09 0.37 0.00 0.00 175.52 176.02 3ikh h ARG 145 N 0.21 0.82 -0.84 6.66 2.43 -0.89 -1.98 114.38 120.79 3ikh h ARG 145 Ca 0.08 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3ikh h ARG 145 Cb 0.02 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.41 3ikh h ARG 145 CO -0.06 0.76 0.49 0.00 -1.51 0.00 0.00 179.97 179.65 3ikh h ALA 146 N 1.03 1.28 -0.41 2.80 0.00 -0.86 0.16 119.26 123.26 3ikh h ALA 146 Ca 0.17 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3ikh h ALA 146 Cb 0.28 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3ikh h ALA 146 CO -0.01 0.60 -0.08 -0.07 0.00 0.00 0.00 179.25 179.70 3ikh h LEU 147 N 1.16 0.79 -0.71 0.00 3.38 -0.85 -1.19 115.31 117.89 3ikh h LEU 147 Ca 0.30 -0.35 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 3ikh h LEU 147 Cb -0.02 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 3ikh h LEU 147 CO -0.05 0.96 -0.06 -0.26 0.09 0.00 0.00 178.44 179.11 3ikh h PHE 148 N 0.61 1.02 -0.67 1.13 0.05 -0.98 -1.63 116.94 116.46 3ikh h PHE 148 Ca 0.11 -0.18 -0.03 0.00 3.82 0.00 0.00 57.97 61.68 3ikh h PHE 148 Cb 0.60 -0.26 -0.03 0.00 2.00 0.00 0.00 35.95 38.26 3ikh h PHE 148 CO 0.05 0.94 0.30 1.96 -0.18 0.00 0.00 178.31 181.38 3ikh h GLN 149 N 0.84 0.99 -0.26 1.51 4.20 -0.81 -0.77 115.11 120.81 3ikh h GLN 149 Ca 0.15 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3ikh h GLN 149 Cb 0.58 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 3ikh h GLN 149 CO 0.04 0.80 0.09 -0.92 -0.67 0.00 0.00 178.83 178.16 3ikh h TYR 150 N 0.94 0.40 -0.77 2.96 3.20 -1.01 -1.62 116.97 121.07 3ikh h TYR 150 Ca 0.23 -0.04 0.10 0.00 3.14 0.00 0.00 58.73 62.16 3ikh h TYR 150 Cb 0.16 -0.12 -0.08 0.00 1.54 0.00 0.00 36.73 38.23 3ikh h TYR 150 CO 0.01 0.44 0.40 0.00 -1.64 0.00 0.00 178.16 177.37 3ikh h ALA 151 N 0.92 1.09 -0.86 1.82 0.00 -1.00 -0.19 119.26 121.03 3ikh h ALA 151 Ca 0.08 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.08 3ikh h ALA 151 Cb 0.21 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 3ikh h ALA 151 CO -0.00 -0.01 0.55 -0.09 0.00 0.00 0.00 179.25 179.70 3ikh h ARG 152 N 0.66 1.03 0.00 0.00 9.65 -0.75 -1.18 114.38 123.79 3ikh h ARG 152 Ca 0.38 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 59.19 3ikh h ARG 152 Cb 0.41 -0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 28.76 3ikh h ARG 152 CO -0.28 0.68 -0.07 0.66 2.80 0.00 0.00 179.97 183.76 3ikh h SER 153 N 1.06 0.00 -0.08 -3.80 4.64 -0.09 -1.41 113.55 113.87 3ikh h SER 153 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3ikh h SER 153 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3ikh h SER 153 CO -0.13 0.07 0.00 0.54 -0.87 0.00 0.00 176.83 176.44 3ikh n ARG 154 N -3.24 1.88 -2.10 4.77 5.12 -0.51 -5.11 116.66 117.48 3ikh n ARG 154 Ca -0.00 -1.29 -0.02 0.00 -1.93 0.00 0.00 57.85 54.61 3ikh n ARG 154 Cb 0.30 -1.46 0.00 0.00 -1.16 0.00 0.00 32.46 30.15 3ikh n ARG 154 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3ikh n GLY 155 N 1.23 -2.36 3.15 -0.13 0.00 -0.54 -3.33 105.19 103.21 3ikh n GLY 155 Ca 0.17 0.29 -0.26 0.00 0.00 0.00 0.00 46.02 46.22 3ikh n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ikh s THR 157 N -1.22 1.46 -0.11 2.61 2.01 0.62 -1.41 115.64 119.58 3ikh s THR 157 Ca 0.05 -0.74 -0.02 0.00 0.31 0.00 0.00 61.69 61.29 3ikh s THR 157 Cb -0.02 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 71.22 3ikh s THR 157 CO 0.36 0.42 -0.03 0.42 -0.69 0.00 0.00 174.62 175.11 3ikh s THR 158 N -0.03 4.03 -0.06 -0.82 -4.23 -1.26 -0.78 115.64 112.49 3ikh s THR 158 Ca -0.02 -0.33 0.03 0.00 -1.18 0.00 0.00 61.69 60.19 3ikh s THR 158 Cb -0.11 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 71.01 3ikh s THR 158 CO 0.02 0.55 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.79 3ikh s VAL 159 N -0.30 1.45 -0.05 2.29 1.01 -0.33 -1.73 120.40 122.74 3ikh s VAL 159 Ca 0.05 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.36 3ikh s VAL 159 Cb -0.12 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 34.99 3ikh s VAL 159 CO 0.02 0.42 -0.10 0.12 0.00 0.00 0.00 175.10 175.56 3ikh s PHE 160 N 0.33 1.24 -0.60 5.22 5.36 -0.22 -1.86 117.98 127.45 3ikh s PHE 160 Ca -0.11 -0.42 0.04 0.00 -0.96 0.00 0.00 56.93 55.49 3ikh s PHE 160 Cb -0.14 -0.93 0.16 0.00 -0.34 0.00 0.00 43.02 41.77 3ikh s PHE 160 CO 0.04 -0.23 0.42 1.21 -1.46 0.00 0.00 175.22 175.20 3ikh s ASN 161 N 0.62 3.95 -0.26 6.13 2.47 -0.68 -1.23 114.94 125.94 3ikh s ASN 161 Ca -0.12 -3.49 -0.10 0.00 0.42 0.00 0.00 52.86 49.57 3ikh s ASN 161 Cb -0.14 -1.32 -0.11 0.00 -1.45 0.00 0.00 41.25 38.23 3ikh s ASN 161 CO 0.02 -0.13 1.44 -0.81 -3.72 0.00 0.00 177.10 173.91 3ikh n PRO 162 N 2.41 0.57 -3.69 0.43 -0.04 -1.26 -3.00 135.00 130.42 3ikh n PRO 162 Ca 0.19 -0.94 -0.17 0.00 -0.04 0.00 0.00 63.50 62.54 3ikh n PRO 162 Cb 0.37 -2.29 -0.17 0.00 -0.04 0.00 0.00 33.50 31.38 3ikh n PRO 162 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3ikh s SER 163 N 5.10 0.70 0.40 3.54 0.15 -1.26 -3.38 113.70 118.95 3ikh s SER 163 Ca 0.29 0.18 -0.26 0.00 0.70 0.00 0.00 55.95 56.85 3ikh s SER 163 Cb 0.07 0.03 -0.11 0.00 -1.71 0.00 0.00 66.02 64.31 3ikh s SER 163 CO 0.08 -0.22 1.26 -2.65 1.20 0.00 0.00 173.24 172.91 3ikh n PRO 164 N 5.00 1.96 -2.45 5.44 -0.02 -1.25 -1.27 135.00 142.40 3ikh n PRO 164 Ca -0.10 0.69 -0.41 0.00 -2.02 0.00 0.00 63.50 61.66 3ikh n PRO 164 Cb 0.50 -2.35 -0.04 0.00 -0.02 0.00 0.00 33.50 31.60 3ikh n PRO 164 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3ikh s VAL 165 N -1.17 3.57 -0.17 -1.45 0.11 -1.22 -4.46 120.40 115.62 3ikh s VAL 165 Ca 0.59 1.46 -0.00 0.00 -2.93 0.00 0.00 61.98 61.10 3ikh s VAL 165 Cb -0.53 -3.93 0.04 0.00 -1.53 0.00 0.00 36.38 30.43 3ikh s VAL 165 CO 0.59 0.30 -0.05 0.21 -3.33 0.00 0.00 175.10 172.82 3ikh s ASN 166 N -0.46 2.87 0.53 3.54 3.84 -1.26 -5.02 114.94 118.97 3ikh s ASN 166 Ca 0.48 -0.68 0.33 0.00 0.21 0.00 0.00 52.86 53.20 3ikh s ASN 166 Cb -0.32 -0.92 1.50 0.00 -0.55 0.00 0.00 41.25 40.96 3ikh s ASN 166 CO 0.39 -0.19 1.84 1.55 -2.79 0.00 0.00 177.10 177.90 3ikh h PRO 167 N 8.11 0.02 0.00 0.43 0.13 -1.95 0.17 132.00 138.91 3ikh h PRO 167 Ca -0.24 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 3ikh h PRO 167 Cb 1.11 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3ikh h PRO 167 CO 0.40 0.02 0.00 -0.25 -0.23 0.00 0.00 178.00 177.94 3ikh n ASP 168 N -4.24 0.00 0.30 1.44 8.00 -1.26 -2.75 116.55 118.03 3ikh n ASP 168 Ca 0.22 0.47 0.19 0.00 0.71 0.00 0.00 54.79 56.39 3ikh n ASP 168 Cb 1.10 -0.49 0.89 0.00 -0.02 0.00 0.00 41.12 42.60 3ikh n ASP 168 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 3ikh h PHE 169 N 0.00 0.00 -0.05 1.24 0.04 -1.08 -2.92 116.94 114.17 3ikh h PHE 169 Ca 0.00 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.78 3ikh h PHE 169 Cb 0.27 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.42 3ikh h PHE 169 CO 0.00 0.00 0.11 0.00 -0.60 0.00 0.00 178.31 177.82 3ikh n HIS 171 N -3.37 0.00 1.06 0.00 8.25 -1.10 -3.94 115.22 116.12 3ikh n HIS 171 Ca -0.02 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.57 3ikh n HIS 171 Cb 0.20 -0.22 0.26 0.00 1.12 0.00 0.00 29.99 31.35 3ikh n HIS 171 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3ikh n LEU 172 N -1.04 0.66 -0.28 2.41 4.32 -0.02 -4.52 117.00 118.54 3ikh n LEU 172 Ca 0.13 -0.09 0.19 0.00 -0.02 0.00 0.00 56.01 56.22 3ikh n LEU 172 Cb 0.29 -0.21 0.49 0.00 -1.62 0.00 0.00 43.42 42.37 3ikh n LEU 172 CO 0.25 0.15 1.22 -0.50 -1.22 0.00 0.00 177.39 177.29 3ikh h TRP 173 N 0.32 0.63 0.00 -1.77 -0.00 -1.71 -0.96 115.95 112.46 3ikh h TRP 173 Ca 0.00 0.02 -0.00 0.00 -0.00 0.00 0.00 58.89 58.91 3ikh h TRP 173 Cb 0.50 -0.19 -0.00 0.00 -0.00 0.00 0.00 29.16 29.47 3ikh h TRP 173 CO 0.00 0.13 -0.01 -1.35 -0.00 0.00 0.00 178.44 177.22 3ikh h PRO 174 N 0.45 0.00 -0.01 0.49 0.11 -1.87 -0.94 132.00 130.23 3ikh h PRO 174 Ca 0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.63 3ikh h PRO 174 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3ikh h PRO 174 CO -0.23 0.01 -0.12 1.28 -0.21 0.00 0.00 178.00 178.73 3ikh n LEU 175 N -3.73 0.73 -4.65 2.35 4.77 -0.36 -4.91 117.00 111.20 3ikh n LEU 175 Ca -0.03 -0.14 -0.35 0.00 -0.03 0.00 0.00 56.01 55.46 3ikh n LEU 175 Cb 0.09 -0.12 -0.10 0.00 -2.33 0.00 0.00 43.42 40.96 3ikh n LEU 175 CO 0.26 0.13 -0.29 -0.63 -1.33 0.00 0.00 177.39 175.53 3ikh s ILE 176 N -2.36 4.43 -0.21 -0.08 -1.09 -0.36 -4.73 121.20 116.80 3ikh s ILE 176 Ca 0.31 -0.18 -0.10 0.00 -2.23 0.00 0.00 60.65 58.44 3ikh s ILE 176 Cb 0.20 -2.92 -0.19 0.00 -1.58 0.00 0.00 42.46 37.97 3ikh s ILE 176 CO 0.45 0.55 0.05 0.47 -1.23 0.00 0.00 174.94 175.23 3ikh n ASP 177 N 2.73 1.99 -4.04 3.58 8.00 -0.78 -4.50 116.55 123.52 3ikh n ASP 177 Ca -0.18 0.22 -0.30 0.00 0.71 0.00 0.00 54.79 55.24 3ikh n ASP 177 Cb 0.53 -0.79 -0.17 0.00 -0.02 0.00 0.00 41.12 40.68 3ikh n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ikh s ILE 178 N -2.49 1.57 -0.09 0.53 1.01 -0.71 -2.01 121.20 119.02 3ikh s ILE 178 Ca -0.30 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 59.70 3ikh s ILE 178 Cb 0.09 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 41.08 3ikh s ILE 178 CO 0.63 0.46 -0.08 0.00 0.00 0.00 0.00 174.94 175.94 3ikh s ALA 179 N 1.30 2.89 -0.14 9.38 0.00 0.54 -1.05 121.76 134.67 3ikh s ALA 179 Ca 0.01 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.07 3ikh s ALA 179 Cb -0.14 -1.25 0.04 0.00 0.00 0.00 0.00 23.12 21.77 3ikh s ALA 179 CO -0.07 0.46 -0.02 0.08 0.00 0.00 0.00 175.76 176.20 3ikh s VAL 180 N -0.43 0.80 0.07 0.00 1.01 -0.37 -0.14 120.40 121.35 3ikh s VAL 180 Ca 0.06 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 3ikh s VAL 180 Cb -0.12 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 3ikh s VAL 180 CO 0.02 0.11 -0.01 0.68 0.00 0.00 0.00 175.10 175.90 3ikh s VAL 181 N 1.77 0.23 0.56 2.92 -7.23 -0.12 -4.15 120.40 114.38 3ikh s VAL 181 Ca 0.02 -1.84 0.04 0.00 -1.81 0.00 0.00 61.98 58.38 3ikh s VAL 181 Cb -0.15 -1.66 0.05 0.00 0.56 0.00 0.00 36.38 35.19 3ikh s VAL 181 CO -0.07 -0.87 0.77 0.54 -0.31 0.00 0.00 175.10 175.17 3ikh s ASN 182 N -2.96 5.15 0.26 4.85 2.20 -1.26 -0.64 114.94 122.55 3ikh s ASN 182 Ca 0.11 -0.30 -0.01 0.00 -0.94 0.00 0.00 52.86 51.72 3ikh s ASN 182 Cb 0.08 -0.48 0.55 0.00 -2.00 0.00 0.00 41.25 39.40 3ikh s ASN 182 CO -0.07 -1.23 1.75 1.05 -2.94 0.00 0.00 177.10 175.66 3ikh h GLU 183 N 0.10 0.54 -0.05 3.55 9.09 -1.75 0.41 114.58 126.46 3ikh h GLU 183 Ca -0.39 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 58.99 3ikh h GLU 183 Cb 1.29 -0.12 -0.00 0.00 -1.65 0.00 0.00 28.75 28.26 3ikh h GLU 183 CO 0.46 0.36 0.02 1.03 0.05 0.00 0.00 179.01 180.94 3ikh h SER 184 N 0.56 0.04 0.07 3.06 0.87 -1.94 -2.20 113.55 114.00 3ikh h SER 184 Ca 0.47 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.95 3ikh h SER 184 Cb 0.71 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 3ikh h SER 184 CO -0.39 0.03 -0.24 -0.33 -0.53 0.00 0.00 176.83 175.37 3ikh h GLU 185 N 0.05 0.30 -0.72 2.24 5.08 -1.74 -0.56 114.58 119.23 3ikh h GLU 185 Ca 0.02 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3ikh h GLU 185 Cb 0.00 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 3ikh h GLU 185 CO -0.01 0.52 0.42 0.00 -1.00 0.00 0.00 179.01 178.94 3ikh h ALA 186 N 1.49 0.93 0.03 3.43 0.00 -0.54 0.87 119.26 125.47 3ikh h ALA 186 Ca 0.04 -0.10 -0.25 0.00 0.00 0.00 0.00 54.91 54.61 3ikh h ALA 186 Cb 0.57 -0.29 0.02 0.00 0.00 0.00 0.00 17.79 18.09 3ikh h ALA 186 CO 0.04 0.41 -0.98 1.49 0.00 0.00 0.00 179.25 180.21 3ikh h GLU 187 N 0.99 0.60 -0.38 0.00 4.81 -1.08 -1.65 114.58 117.89 3ikh h GLU 187 Ca 0.26 -0.69 -0.14 0.00 -0.13 0.00 0.00 59.36 58.65 3ikh h GLU 187 Cb -0.01 0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 3ikh h GLU 187 CO -0.05 1.29 -0.34 1.25 -0.73 0.00 0.00 179.01 180.43 3ikh h LEU 188 N 0.22 0.90 -0.44 1.64 5.85 -0.97 -3.31 115.31 119.20 3ikh h LEU 188 Ca -0.13 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.20 3ikh h LEU 188 Cb 1.66 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.44 3ikh h LEU 188 CO 0.19 1.15 -0.68 0.18 -0.34 0.00 0.00 178.44 178.94 3ikh n LEU 189 N -4.07 1.35 -3.89 2.25 4.77 0.29 -4.97 117.00 112.73 3ikh n LEU 189 Ca -0.01 -0.62 -0.34 0.00 -0.03 0.00 0.00 56.01 55.01 3ikh n LEU 189 Cb 0.51 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.61 3ikh n LEU 189 CO 0.47 0.28 -0.18 0.00 -1.33 0.00 0.00 177.39 176.64 3ikh n GLN 190 N -0.81 -0.71 -1.76 3.23 1.13 -0.62 -4.63 117.38 113.21 3ikh n GLN 190 Ca 0.06 0.24 -0.41 0.00 -1.94 0.00 0.00 57.00 54.94 3ikh n GLN 190 Cb 0.35 -1.96 -0.00 0.00 0.11 0.00 0.00 30.24 28.74 3ikh n GLN 190 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 3ikh n PRO 191 N -3.70 2.62 -3.73 -1.09 -0.04 -1.26 -5.00 135.00 122.79 3ikh n PRO 191 Ca -0.17 0.92 -0.13 0.00 -0.04 0.00 0.00 63.50 64.09 3ikh n PRO 191 Cb 0.53 -2.65 -0.08 0.00 -0.04 0.00 0.00 33.50 31.27 3ikh n PRO 191 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3ikh s TYR 192 N -0.91 -0.18 0.00 0.54 -0.85 -1.26 -4.90 117.35 109.79 3ikh s TYR 192 Ca 0.55 0.17 0.00 0.00 -0.52 0.00 0.00 57.07 57.27 3ikh s TYR 192 Cb -0.49 0.13 0.00 0.00 0.38 0.00 0.00 41.96 41.98 3ikh s TYR 192 CO 0.61 -0.47 0.00 0.41 -1.52 0.00 0.00 175.55 174.57 3ikh n GLY 193 N 0.85 0.38 3.75 5.49 0.00 -1.26 -4.79 105.19 109.61 3ikh n GLY 193 Ca -0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 3ikh n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ikh s VAL 194 N -2.04 4.66 0.13 1.61 1.01 -1.26 -4.98 120.40 119.54 3ikh s VAL 194 Ca 0.00 1.66 -0.19 0.00 0.00 0.00 0.00 61.98 63.45 3ikh s VAL 194 Cb 0.00 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 3ikh s VAL 194 CO 0.00 0.39 1.73 0.11 0.00 0.00 0.00 175.10 177.34 3ikh h LYS 195 N 5.43 0.14 -4.94 2.72 1.57 -1.75 -3.41 116.57 116.32 3ikh h LYS 195 Ca -0.44 -0.01 -0.63 0.00 -1.87 0.00 0.00 60.65 57.70 3ikh h LYS 195 Cb 1.21 -0.03 -0.35 0.00 0.08 0.00 0.00 32.23 33.14 3ikh h LYS 195 CO 0.70 0.09 -0.85 0.99 -0.57 0.00 0.00 179.45 179.81 3ikh s THR 196 N -6.18 1.78 -0.12 -0.16 2.01 -0.85 -4.15 115.64 107.97 3ikh s THR 196 Ca -0.13 -0.80 0.02 0.00 0.31 0.00 0.00 61.69 61.09 3ikh s THR 196 Cb 0.10 -1.61 0.01 0.00 0.01 0.00 0.00 72.50 71.02 3ikh s THR 196 CO 0.69 0.50 -0.16 -0.22 -0.69 0.00 0.00 174.62 174.73 3ikh s LEU 197 N 1.02 1.79 -0.16 4.42 2.96 -0.58 -0.34 118.68 127.78 3ikh s LEU 197 Ca -0.04 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.41 3ikh s LEU 197 Cb -0.15 -1.16 -0.00 0.00 0.50 0.00 0.00 46.19 45.39 3ikh s LEU 197 CO -0.04 0.02 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.17 3ikh s VAL 198 N 0.97 2.65 -0.31 1.68 1.01 0.80 -0.28 120.40 126.92 3ikh s VAL 198 Ca -0.06 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 3ikh s VAL 198 Cb -0.15 -2.12 0.07 0.00 0.00 0.00 0.00 36.38 34.18 3ikh s VAL 198 CO -0.02 0.51 0.02 -0.63 0.00 0.00 0.00 175.10 174.98 3ikh s ILE 199 N 0.83 2.83 0.24 2.22 1.01 -0.40 -0.94 121.20 127.00 3ikh s ILE 199 Ca -0.05 -1.62 -0.15 0.00 0.00 0.00 0.00 60.65 58.82 3ikh s ILE 199 Cb -0.15 -2.73 -0.08 0.00 0.01 0.00 0.00 42.46 39.51 3ikh s ILE 199 CO -0.00 -0.23 0.67 0.42 0.00 0.00 0.00 174.94 175.79 3ikh s THR 200 N 1.18 4.72 -0.33 2.92 -4.23 0.19 -0.51 115.64 119.58 3ikh s THR 200 Ca -0.02 0.95 0.16 0.00 -1.18 0.00 0.00 61.69 61.61 3ikh s THR 200 Cb -0.20 -3.71 0.46 0.00 1.34 0.00 0.00 72.50 70.39 3ikh s THR 200 CO -0.03 0.03 1.01 0.00 -0.54 0.00 0.00 174.62 175.10 3ikh n GLN 201 N 0.22 1.71 0.00 3.99 6.02 0.97 -2.05 117.38 128.24 3ikh n GLN 201 Ca -0.00 -3.53 0.00 0.00 -0.01 0.00 0.00 57.00 53.46 3ikh n GLN 201 Cb 0.52 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 30.27 3ikh n GLN 201 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ikh n GLY 202 N -0.25 2.54 0.31 1.08 0.00 -1.25 -1.60 105.19 106.02 3ikh n GLY 202 Ca 0.15 -0.18 0.19 0.00 0.00 0.00 0.00 46.02 46.18 3ikh n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ikh h ALA 203 N -0.46 1.09 0.47 4.61 0.00 -2.00 -2.66 119.26 120.32 3ikh h ALA 203 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3ikh h ALA 203 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3ikh h ALA 203 CO 0.00 -0.09 -0.23 0.00 0.00 0.00 0.00 179.25 178.93 3ikh h ALA 204 N 1.79 -0.68 0.00 0.00 0.00 -1.71 -3.40 119.26 115.26 3ikh h ALA 204 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3ikh h ALA 204 Cb 0.20 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3ikh h ALA 204 CO 0.00 -0.63 0.00 0.41 0.00 0.00 0.00 179.25 179.03 3ikh n GLY 205 N 0.06 -0.32 3.35 0.00 0.00 -1.01 -2.37 105.19 104.90 3ikh n GLY 205 Ca -0.08 -0.82 -0.14 0.00 0.00 0.00 0.00 46.02 44.98 3ikh n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ikh s ALA 206 N -1.00 -1.14 -0.04 4.61 0.00 -0.06 -0.02 121.76 124.12 3ikh s ALA 206 Ca 0.00 0.56 -0.00 0.00 0.00 0.00 0.00 51.96 52.51 3ikh s ALA 206 Cb 0.00 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 3ikh s ALA 206 CO 0.00 -0.39 0.01 -1.58 0.00 0.00 0.00 175.76 173.80 3ikh s TRP 207 N -1.88 3.14 -0.19 0.00 0.52 0.33 0.21 118.94 121.07 3ikh s TRP 207 Ca -0.09 0.15 -0.01 0.00 0.02 0.00 0.00 56.10 56.17 3ikh s TRP 207 Cb -0.02 -1.73 0.00 0.00 -1.15 0.00 0.00 33.47 30.58 3ikh s TRP 207 CO 0.02 0.48 -0.12 -1.17 0.02 0.00 0.00 176.95 176.17 3ikh s LEU 208 N -1.29 2.52 -0.23 2.99 2.96 0.16 -1.27 118.68 124.51 3ikh s LEU 208 Ca 0.17 -0.51 0.02 0.00 -0.22 0.00 0.00 54.13 53.59 3ikh s LEU 208 Cb -0.11 -1.61 0.04 0.00 0.50 0.00 0.00 46.19 45.01 3ikh s LEU 208 CO 0.07 0.00 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.27 3ikh s VAL 209 N 1.31 2.15 -0.06 1.68 1.01 0.62 -0.97 120.40 126.14 3ikh s VAL 209 Ca 0.04 -1.36 -0.00 0.00 0.00 0.00 0.00 61.98 60.65 3ikh s VAL 209 Cb -0.14 -2.13 0.03 0.00 0.00 0.00 0.00 36.38 34.14 3ikh s VAL 209 CO -0.07 0.19 -0.01 -1.10 0.00 0.00 0.00 175.10 174.10 3ikh s GLN 210 N 1.18 0.67 -1.14 2.72 -0.21 -0.75 -1.53 119.66 120.59 3ikh s GLN 210 Ca -0.04 0.03 -0.22 0.00 0.02 0.00 0.00 55.36 55.16 3ikh s GLN 210 Cb -0.17 -0.91 0.03 0.00 1.00 0.00 0.00 33.01 32.96 3ikh s GLN 210 CO -0.08 -0.22 0.41 -0.85 -2.12 0.00 0.00 175.29 172.43 3ikh n GLU 211 N 4.73 -0.50 0.00 2.91 -0.00 -1.26 -0.94 120.64 125.58 3ikh n GLU 211 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.02 3ikh n GLU 211 Cb 0.50 -2.32 0.00 0.00 -0.00 0.00 0.00 31.44 29.62 3ikh n GLU 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3ikh n GLY 212 N -2.09 2.71 3.72 -1.84 0.00 -1.26 -5.00 105.19 101.43 3ikh n GLY 212 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 3ikh n GLY 212 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ikh s GLN 213 N -0.04 4.60 -0.06 1.61 -1.52 -0.12 -5.04 119.66 119.09 3ikh s GLN 213 Ca 0.00 1.40 0.02 0.00 -1.95 0.00 0.00 55.36 54.83 3ikh s GLN 213 Cb 0.00 -3.43 -0.03 0.00 -0.22 0.00 0.00 33.01 29.33 3ikh s GLN 213 CO 0.00 0.05 -0.11 1.03 -0.25 0.00 0.00 175.29 176.01 3ikh s ARG 214 N 0.63 2.62 -0.02 2.91 0.52 -1.26 -1.81 118.95 122.54 3ikh s ARG 214 Ca 0.49 -0.63 0.00 0.00 -0.52 0.00 0.00 55.73 55.08 3ikh s ARG 214 Cb -0.22 -2.48 0.02 0.00 0.52 0.00 0.00 34.95 32.80 3ikh s ARG 214 CO 0.28 0.64 0.01 -0.65 0.02 0.00 0.00 175.30 175.60 3ikh s GLN 215 N -0.75 0.15 -0.11 3.54 -0.21 -0.15 -4.98 119.66 117.16 3ikh s GLN 215 Ca 0.12 0.10 -0.02 0.00 0.02 0.00 0.00 55.36 55.57 3ikh s GLN 215 Cb -0.11 -0.35 -0.03 0.00 1.00 0.00 0.00 33.01 33.52 3ikh s GLN 215 CO 0.01 -0.12 -0.03 0.12 -2.12 0.00 0.00 175.29 173.15 3ikh s PHE 216 N 0.89 3.06 -0.22 0.91 5.36 -1.26 0.37 117.98 127.09 3ikh s PHE 216 Ca -0.08 -0.03 0.02 0.00 -0.96 0.00 0.00 56.93 55.88 3ikh s PHE 216 Cb -0.12 -1.84 0.04 0.00 -0.34 0.00 0.00 43.02 40.76 3ikh s PHE 216 CO -0.02 0.25 -0.15 0.00 -1.46 0.00 0.00 175.22 173.83 3ikh s PRO 218 N 1.20 2.94 0.66 0.00 0.02 -1.26 -0.88 135.00 137.68 3ikh s PRO 218 Ca -0.02 1.76 -0.12 0.00 0.02 0.00 0.00 61.00 62.64 3ikh s PRO 218 Cb -0.16 -1.93 -0.01 0.00 0.02 0.00 0.00 34.50 32.41 3ikh s PRO 218 CO -0.09 -1.22 1.05 0.00 -0.33 0.00 0.00 177.00 176.42 3ikh s ALA 219 N -1.70 2.77 -0.16 -1.55 0.00 -1.00 -4.83 121.76 115.29 3ikh s ALA 219 Ca 0.76 0.11 -0.22 0.00 0.00 0.00 0.00 51.96 52.61 3ikh s ALA 219 Cb -0.29 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 3ikh s ALA 219 CO 0.34 -1.02 0.68 0.08 0.00 0.00 0.00 175.76 175.83 3ikh s VAL 220 N -2.95 5.00 0.15 0.00 1.01 -1.26 -4.96 120.40 117.39 3ikh s VAL 220 Ca 0.58 1.32 -0.34 0.00 0.00 0.00 0.00 61.98 63.54 3ikh s VAL 220 Cb -0.14 -4.00 -0.16 0.00 0.00 0.00 0.00 36.38 32.09 3ikh s VAL 220 CO 0.51 0.13 1.33 -2.65 0.00 0.00 0.00 175.10 174.42 3ikh n PRO 221 N 4.77 1.42 -3.65 2.72 -0.02 -1.26 -4.81 135.00 134.18 3ikh n PRO 221 Ca -0.00 0.51 -0.12 0.00 -2.02 0.00 0.00 63.50 61.86 3ikh n PRO 221 Cb 0.50 -2.13 -0.06 0.00 -0.02 0.00 0.00 33.50 31.79 3ikh n PRO 221 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ikh s ALA 222 N 0.26 -1.01 -0.39 3.55 0.00 -1.26 -5.05 121.76 117.87 3ikh s ALA 222 Ca 0.78 0.23 -0.23 0.00 0.00 0.00 0.00 51.96 52.75 3ikh s ALA 222 Cb -0.84 0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.73 3ikh s ALA 222 CO 0.47 -0.51 0.76 -2.00 0.00 0.00 0.00 175.76 174.49 3ikh s GLU 223 N -2.81 3.64 -1.30 0.00 2.56 -1.26 -4.99 118.70 114.55 3ikh s GLU 223 Ca -0.03 0.15 -0.17 0.00 0.00 0.00 0.00 54.97 54.92 3ikh s GLU 223 Cb -0.00 -3.84 0.08 0.00 2.00 0.00 0.00 34.13 32.37 3ikh s GLU 223 CO -0.05 -0.90 1.74 0.00 -0.56 0.00 0.00 175.26 175.49 3ikh n ALA 224 N 6.43 3.75 0.02 6.30 0.00 -1.26 -3.65 120.51 132.09 3ikh n ALA 224 Ca 0.02 -3.91 -0.17 0.00 0.00 0.00 0.00 53.44 49.38 3ikh n ALA 224 Cb 0.48 -3.53 -0.07 0.00 0.00 0.00 0.00 19.45 16.33 3ikh n ALA 224 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3ikh h LEU 225 N 11.99 0.84 -6.36 0.00 3.38 -1.53 -3.44 115.31 120.19 3ikh h LEU 225 Ca 0.44 -0.61 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 3ikh h LEU 225 Cb 0.85 -0.25 -0.26 0.00 0.09 0.00 0.00 40.66 41.09 3ikh h LEU 225 CO 1.47 1.41 -0.37 -0.62 0.09 0.00 0.00 178.44 180.41 3ikh s ASP 226 N -7.16 -0.49 0.00 -0.43 -1.08 -0.70 -4.95 116.67 101.86 3ikh s ASP 226 Ca -0.09 0.60 0.27 0.00 -0.52 0.00 0.00 52.55 52.81 3ikh s ASP 226 Cb 0.08 1.59 1.28 0.00 -1.46 0.00 0.00 42.92 44.41 3ikh s ASP 226 CO 0.90 -0.28 1.90 0.41 0.52 0.00 0.00 175.17 178.63 3ikh n THR 227 N 5.40 0.14 -1.68 1.71 -1.04 -1.26 -3.98 114.28 113.56 3ikh n THR 227 Ca -0.03 0.03 -0.54 0.00 -2.04 0.00 0.00 64.05 61.47 3ikh n THR 227 Cb 0.50 -0.58 -0.06 0.00 -1.82 0.00 0.00 70.33 68.37 3ikh n THR 227 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 3ikh n THR 228 N -1.38 0.30 -1.01 12.58 -1.04 -1.26 -1.65 114.28 120.82 3ikh n THR 228 Ca 0.10 -0.05 -0.00 0.00 -2.04 0.00 0.00 64.05 62.05 3ikh n THR 228 Cb 0.26 -1.32 -0.00 0.00 -1.82 0.00 0.00 70.33 67.44 3ikh n THR 228 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ikh n GLY 229 N 3.91 0.46 0.23 3.41 0.00 -1.26 -4.82 105.19 107.11 3ikh n GLY 229 Ca 0.24 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 3ikh n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ikh h ALA 230 N 0.00 0.60 -0.70 4.61 0.00 -1.67 -0.43 119.26 121.68 3ikh h ALA 230 Ca -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3ikh h ALA 230 Cb 0.15 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3ikh h ALA 230 CO 0.01 0.33 0.39 0.78 0.00 0.00 0.00 179.25 180.76 3ikh h GLY 231 N 0.61 1.03 1.02 0.00 0.00 -1.91 -0.41 103.07 103.42 3ikh h GLY 231 Ca 0.14 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 3ikh h GLY 231 CO 0.01 0.45 0.19 -0.55 0.00 0.00 0.00 176.54 176.64 3ikh h ASP 232 N 0.95 0.91 -0.18 0.19 3.32 -1.90 -1.93 116.42 117.80 3ikh h ASP 232 Ca 0.25 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 3ikh h ASP 232 Cb 0.03 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 3ikh h ASP 232 CO -0.04 0.88 0.09 0.74 -1.72 0.00 0.00 179.24 179.19 3ikh h THR 233 N 0.90 1.12 -0.18 0.35 2.02 -0.69 -1.80 112.91 114.63 3ikh h THR 233 Ca 0.20 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 67.09 3ikh h THR 233 Cb 0.30 1.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 3ikh h THR 233 CO -0.01 0.11 -0.06 0.15 0.37 0.00 0.00 175.52 176.08 3ikh h PHE 234 N 0.17 -0.15 0.15 3.16 3.57 -0.89 -1.38 116.94 121.57 3ikh h PHE 234 Ca 0.06 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 3ikh h PHE 234 Cb 0.10 0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.93 3ikh h PHE 234 CO -0.03 -0.11 -0.07 1.25 -2.23 0.00 0.00 178.31 177.12 3ikh h LEU 235 N -0.03 -0.17 -0.23 0.59 6.46 -1.29 -3.17 115.31 117.47 3ikh h LEU 235 Ca 0.09 -0.06 0.05 0.00 -0.12 0.00 0.00 57.88 57.85 3ikh h LEU 235 Cb 0.17 0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 40.09 3ikh h LEU 235 CO -0.20 -0.05 -0.13 0.00 -0.62 0.00 0.00 178.44 177.44 3ikh h ALA 236 N 0.57 0.05 0.00 1.25 0.00 -1.18 -0.94 119.26 119.02 3ikh h ALA 236 Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ikh h ALA 236 Cb 0.21 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3ikh h ALA 236 CO 0.03 -0.54 0.00 0.28 0.00 0.00 0.00 179.25 179.02 3ikh n VAL 237 N -5.29 0.57 0.00 0.00 0.31 -0.53 -0.76 118.33 112.62 3ikh n VAL 237 Ca -0.01 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 3ikh n VAL 237 Cb 0.21 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.31 3ikh n VAL 237 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 3ikh n LEU 239 N 0.92 0.00 -0.11 7.52 7.94 -0.36 -0.62 117.00 132.29 3ikh n LEU 239 Ca 0.00 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.82 3ikh n LEU 239 Cb 0.24 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.19 3ikh n LEU 239 CO 0.00 0.00 1.02 0.00 -1.11 0.00 0.00 177.39 177.30 3ikh h ALA 240 N 0.00 0.46 -0.20 1.96 0.00 -1.18 0.53 119.26 120.83 3ikh h ALA 240 Ca 0.00 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3ikh h ALA 240 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3ikh h ALA 240 CO 0.00 -0.10 0.01 1.03 0.00 0.00 0.00 179.25 180.19 3ikh h SER 241 N 0.47 -0.06 -0.62 0.00 0.87 -1.12 0.29 113.55 113.38 3ikh h SER 241 Ca 0.14 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.69 3ikh h SER 241 Cb -0.03 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 61.98 3ikh h SER 241 CO -0.05 -0.00 0.20 0.00 -0.53 0.00 0.00 176.83 176.45 3ikh h ALA 242 N 1.17 0.82 -0.08 6.23 0.00 -1.76 -2.58 119.26 123.06 3ikh h ALA 242 Ca 0.10 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ikh h ALA 242 Cb 0.11 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3ikh h ALA 242 CO -0.15 0.48 0.05 -0.07 0.00 0.00 0.00 179.25 179.56 3ikh h LEU 243 N 0.89 0.11 -2.43 0.00 4.07 -0.40 -0.69 115.31 116.87 3ikh h LEU 243 Ca 0.20 -0.08 -0.00 0.00 0.08 0.00 0.00 57.88 58.08 3ikh h LEU 243 Cb 0.29 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.00 3ikh h LEU 243 CO -0.01 0.15 -0.01 -0.07 -1.08 0.00 0.00 178.44 177.42 3ikh h LEU 244 N 0.05 0.00 -2.01 1.67 3.38 -0.33 -2.13 115.31 115.95 3ikh h LEU 244 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3ikh h LEU 244 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3ikh h LEU 244 CO -0.00 0.01 0.00 0.54 0.09 0.00 0.00 178.44 179.08 3ikh n ARG 245 N -3.16 1.69 -2.72 1.13 1.74 -0.98 -4.99 116.66 109.36 3ikh n ARG 245 Ca -0.02 -1.69 -0.17 0.00 -0.77 0.00 0.00 57.85 55.21 3ikh n ARG 245 Cb 0.16 -1.32 0.02 0.00 -1.02 0.00 0.00 32.46 30.30 3ikh n ARG 245 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ikh n GLY 246 N 0.86 -0.23 3.34 -0.13 0.00 -0.50 -5.03 105.19 103.51 3ikh n GLY 246 Ca 0.11 -0.13 -0.17 0.00 0.00 0.00 0.00 46.02 45.83 3ikh n GLY 246 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ikh s VAL 247 N -2.97 0.80 0.67 1.61 -7.23 -0.39 -5.03 120.40 107.87 3ikh s VAL 247 Ca 0.18 -2.01 -0.11 0.00 -1.81 0.00 0.00 61.98 58.24 3ikh s VAL 247 Cb -0.08 -2.54 -0.01 0.00 0.56 0.00 0.00 36.38 34.31 3ikh s VAL 247 CO 0.23 -0.13 1.05 0.00 -0.31 0.00 0.00 175.10 175.93 3ikh s ALA 248 N -3.58 2.83 0.09 1.32 0.00 -1.26 -4.26 121.76 116.91 3ikh s ALA 248 Ca 0.34 0.00 -0.37 0.00 0.00 0.00 0.00 51.96 51.94 3ikh s ALA 248 Cb 0.07 -3.14 -0.17 0.00 0.00 0.00 0.00 23.12 19.89 3ikh s ALA 248 CO 0.12 -1.03 1.30 -2.30 0.00 0.00 0.00 175.76 173.84 3ikh n PRO 249 N -2.99 1.06 -3.89 0.00 -0.02 -1.26 -4.90 135.00 122.99 3ikh n PRO 249 Ca 0.07 0.38 -0.19 0.00 -2.02 0.00 0.00 63.50 61.74 3ikh n PRO 249 Cb 0.54 -2.00 -0.06 0.00 -0.02 0.00 0.00 33.50 31.96 3ikh n PRO 249 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3ikh n ASP 250 N 2.39 0.51 -0.28 2.55 5.68 -1.26 -5.01 116.55 121.14 3ikh n ASP 250 Ca 0.18 -2.76 0.03 0.00 -0.50 0.00 0.00 54.79 51.74 3ikh n ASP 250 Cb 0.19 1.03 0.17 0.00 -1.14 0.00 0.00 41.12 41.37 3ikh n ASP 250 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ikh h ALA 251 N 1.67 1.14 -0.49 2.12 0.00 -1.99 -1.28 119.26 120.43 3ikh h ALA 251 Ca -0.23 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 3ikh h ALA 251 Cb 0.98 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 3ikh h ALA 251 CO 0.36 0.01 0.06 1.25 0.00 0.00 0.00 179.25 180.93 3ikh h LEU 252 N 0.69 0.73 -0.80 0.00 5.85 -1.99 -1.59 115.31 118.20 3ikh h LEU 252 Ca 0.40 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 3ikh h LEU 252 Cb 0.43 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 3ikh h LEU 252 CO -0.28 0.76 0.49 0.00 -0.34 0.00 0.00 178.44 179.07 3ikh h ALA 253 N 1.33 1.02 -0.03 1.25 0.00 -1.63 -0.46 119.26 120.74 3ikh h ALA 253 Ca 0.16 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 3ikh h ALA 253 Cb 0.36 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3ikh h ALA 253 CO 0.01 0.49 -0.54 -0.07 0.00 0.00 0.00 179.25 179.13 3ikh h LEU 254 N 1.10 0.11 0.02 0.00 4.07 -1.08 -1.39 115.31 118.13 3ikh h LEU 254 Ca 0.29 -0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.19 3ikh h LEU 254 Cb -0.05 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.66 3ikh h LEU 254 CO -0.06 0.63 -0.01 0.00 -1.08 0.00 0.00 178.44 177.93 3ikh h ALA 255 N 1.37 -0.02 -0.33 1.53 0.00 -0.38 0.78 119.26 122.22 3ikh h ALA 255 Ca -0.00 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.82 3ikh h ALA 255 Cb 0.98 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 3ikh h ALA 255 CO 0.08 -0.40 0.15 0.45 0.00 0.00 0.00 179.25 179.53 3ikh h HIS 256 N -0.25 0.27 -0.82 0.00 3.86 -1.05 -2.02 115.15 115.14 3ikh h HIS 256 Ca -0.00 0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.26 3ikh h HIS 256 Cb 0.24 -0.07 -0.05 0.00 1.06 0.00 0.00 27.41 28.60 3ikh h HIS 256 CO 0.00 0.14 0.54 0.00 0.86 0.00 0.00 177.93 179.47 3ikh h ALA 257 N 1.19 1.50 -0.47 2.45 0.00 -1.07 -1.35 119.26 121.52 3ikh h ALA 257 Ca 0.14 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 3ikh h ALA 257 Cb 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3ikh h ALA 257 CO -0.12 0.42 -0.13 0.77 0.00 0.00 0.00 179.25 180.19 3ikh h SER 258 N 1.01 0.86 -0.54 0.00 0.02 -0.28 -0.65 113.55 113.97 3ikh h SER 258 Ca 0.32 -0.28 -0.12 0.00 -0.84 0.00 0.00 61.79 60.88 3ikh h SER 258 Cb 0.04 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.32 3ikh h SER 258 CO -0.09 1.00 -0.13 0.03 -1.14 0.00 0.00 176.83 176.50 3ikh h ARG 259 N 0.77 1.04 -0.37 3.45 3.08 -0.69 -1.85 114.38 119.82 3ikh h ARG 259 Ca 0.12 -0.39 -0.07 0.00 0.07 0.00 0.00 59.98 59.71 3ikh h ARG 259 Cb 0.65 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 3ikh h ARG 259 CO 0.05 1.08 -0.06 0.00 -1.07 0.00 0.00 179.97 179.97 3ikh h ALA 260 N 0.93 0.50 -0.15 0.04 0.00 -1.05 -2.89 119.26 116.64 3ikh h ALA 260 Ca 0.14 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 3ikh h ALA 260 Cb 0.70 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3ikh h ALA 260 CO 0.05 0.33 -0.11 0.00 0.00 0.00 0.00 179.25 179.52 3ikh h ALA 261 N 0.84 1.55 -0.78 0.00 0.00 -1.06 -2.09 119.26 117.71 3ikh h ALA 261 Ca 0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3ikh h ALA 261 Cb 0.56 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 3ikh h ALA 261 CO 0.03 0.33 0.37 0.00 0.00 0.00 0.00 179.25 179.98 3ikh h ALA 262 N 1.68 1.01 -0.01 0.00 0.00 -1.13 -1.17 119.26 119.63 3ikh h ALA 262 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ikh h ALA 262 Cb 0.34 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3ikh h ALA 262 CO 0.02 0.58 0.01 0.82 0.00 0.00 0.00 179.25 180.67 3ikh h ILE 263 N 1.11 1.01 -0.64 0.00 2.04 -1.26 -2.36 117.51 117.41 3ikh h ILE 263 Ca 0.27 -0.03 0.03 0.00 1.00 0.00 0.00 64.86 66.13 3ikh h ILE 263 Cb 0.13 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 3ikh h ILE 263 CO -0.03 0.01 0.39 0.74 0.00 0.00 0.00 178.15 179.26 3ikh h THR 264 N 0.01 1.07 0.00 -0.27 2.02 -1.07 -2.14 112.91 112.52 3ikh h THR 264 Ca 0.00 -0.26 -0.05 0.00 0.77 0.00 0.00 66.41 66.87 3ikh h THR 264 Cb 0.01 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 3ikh h THR 264 CO -0.00 0.14 -0.23 -0.37 0.37 0.00 0.00 175.52 175.42 3ikh h VAL 265 N 0.77 0.69 -0.00 3.16 -1.51 -1.12 -2.54 116.25 115.69 3ikh h VAL 265 Ca 0.26 -1.02 0.00 0.00 -1.23 0.00 0.00 66.70 64.71 3ikh h VAL 265 Cb 0.03 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 30.84 3ikh h VAL 265 CO -0.11 0.23 -0.06 -1.54 -1.23 0.00 0.00 177.57 174.86 3ikh n SER 266 N -3.57 0.52 -4.38 4.19 3.41 -0.83 -1.49 113.62 111.48 3ikh n SER 266 Ca -0.01 -0.83 -0.28 0.00 -0.26 0.00 0.00 58.87 57.49 3ikh n SER 266 Cb 0.38 -0.05 -0.13 0.00 -0.26 0.00 0.00 64.21 64.15 3ikh n SER 266 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3ikh s ARG 267 N -2.27 1.37 0.17 4.33 0.52 -0.96 -4.66 118.95 117.44 3ikh s ARG 267 Ca 0.35 -1.34 -0.10 0.00 -0.52 0.00 0.00 55.73 54.12 3ikh s ARG 267 Cb 0.21 -1.80 -0.07 0.00 0.52 0.00 0.00 34.95 33.81 3ikh s ARG 267 CO 0.42 0.42 0.49 1.03 0.02 0.00 0.00 175.30 177.69 3ikh s ARG 268 N -2.13 3.81 0.00 3.54 0.52 -1.26 -4.11 118.95 119.32 3ikh s ARG 268 Ca 0.14 0.25 0.00 0.00 -0.52 0.00 0.00 55.73 55.60 3ikh s ARG 268 Cb -0.10 -2.81 0.00 0.00 0.52 0.00 0.00 34.95 32.56 3ikh s ARG 268 CO 0.06 0.42 0.00 0.41 0.02 0.00 0.00 175.30 176.22 3ikh n GLY 269 N 0.32 -1.17 0.00 -3.53 0.00 -1.26 -3.80 105.19 95.75 3ikh n GLY 269 Ca -0.03 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.87 3ikh n GLY 269 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ikh n THR 270 N 0.00 0.00 -0.25 2.61 -1.04 -1.26 -4.51 114.28 109.84 3ikh n THR 270 Ca 0.00 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.12 3ikh n THR 270 Cb 0.00 -0.05 0.38 0.00 -1.82 0.00 0.00 70.33 68.85 3ikh n THR 270 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3ikh h LEU 271 N 0.00 0.63 -1.00 -4.42 5.85 -1.87 0.41 115.31 114.91 3ikh h LEU 271 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3ikh h LEU 271 Cb 0.00 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.93 3ikh h LEU 271 CO 0.00 0.34 0.00 0.77 -0.34 0.00 0.00 178.44 179.21 3ikh h SER 272 N 0.68 0.00 0.62 1.25 4.64 -1.88 -2.52 113.55 116.35 3ikh h SER 272 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 3ikh h SER 272 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3ikh h SER 272 CO -0.18 0.00 -0.85 0.00 -0.87 0.00 0.00 176.83 174.93 3ikh n ALA 273 N -1.82 3.18 -1.80 5.18 0.00 0.13 -4.91 120.51 120.47 3ikh n ALA 273 Ca 0.01 -0.33 -0.34 0.00 0.00 0.00 0.00 53.44 52.78 3ikh n ALA 273 Cb 0.20 -1.06 -0.05 0.00 0.00 0.00 0.00 19.45 18.54 3ikh n ALA 273 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3ikh s PHE 274 N -3.18 3.13 0.53 0.00 0.08 -0.95 -4.04 117.98 113.55 3ikh s PHE 274 Ca 0.05 1.60 -0.22 0.00 0.12 0.00 0.00 56.93 58.48 3ikh s PHE 274 Cb 0.14 -3.00 -0.05 0.00 -0.57 0.00 0.00 43.02 39.54 3ikh s PHE 274 CO 0.76 -0.57 1.30 -1.25 -0.10 0.00 0.00 175.22 175.37 3ikh s PRO 275 N -3.14 3.25 0.76 0.24 0.04 -1.26 -5.00 135.00 129.90 3ikh s PRO 275 Ca 0.65 2.09 -0.08 0.00 0.04 0.00 0.00 61.00 63.70 3ikh s PRO 275 Cb -0.14 -2.25 0.10 0.00 0.04 0.00 0.00 34.50 32.24 3ikh s PRO 275 CO 0.18 -1.05 1.08 0.20 0.04 0.00 0.00 177.00 177.45 3ikh s GLY 276 N -1.11 1.71 0.22 0.56 0.00 -1.26 -4.83 107.32 102.62 3ikh s GLY 276 Ca 0.70 -1.10 -0.07 0.00 0.00 0.00 0.00 44.72 44.25 3ikh s GLY 276 CO 0.43 -0.59 1.78 1.76 0.00 0.00 0.00 173.10 176.48 3ikh h SER 277 N -0.81 0.44 -0.15 1.64 0.02 -1.96 0.37 113.55 113.10 3ikh h SER 277 Ca -0.43 0.06 -0.15 0.00 -0.84 0.00 0.00 61.79 60.43 3ikh h SER 277 Cb 1.29 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 3ikh h SER 277 CO 0.53 0.25 -0.43 0.03 -1.14 0.00 0.00 176.83 176.07 3ikh h ARG 278 N 0.58 0.70 -0.69 3.45 3.08 -1.94 -0.24 114.38 119.32 3ikh h ARG 278 Ca 0.34 -0.38 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 3ikh h ARG 278 Cb 0.37 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 3ikh h ARG 278 CO -0.27 0.99 0.20 0.93 -1.07 0.00 0.00 179.97 180.75 3ikh h GLU 279 N 0.56 1.09 0.23 0.04 5.08 -1.79 -1.27 114.58 118.52 3ikh h GLU 279 Ca 0.04 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 3ikh h GLU 279 Cb 0.98 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.08 3ikh h GLU 279 CO 0.09 0.95 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.87 3ikh h LEU 280 N 1.02 -0.26 -0.39 1.33 4.07 -0.72 -1.82 115.31 118.54 3ikh h LEU 280 Ca 0.22 -0.12 0.08 0.00 0.08 0.00 0.00 57.88 58.13 3ikh h LEU 280 Cb 0.32 0.07 -0.07 0.00 1.08 0.00 0.00 40.66 42.06 3ikh h LEU 280 CO -0.00 -0.03 -0.07 0.00 -1.08 0.00 0.00 178.44 177.25 3ikh h ALA 281 N 0.23 0.28 -0.87 1.53 0.00 -0.94 0.25 119.26 119.74 3ikh h ALA 281 Ca -0.03 0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.07 3ikh h ALA 281 Cb 0.37 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 3ikh h ALA 281 CO 0.05 -0.44 0.55 0.00 0.00 0.00 0.00 179.25 179.41 3ikh h ALA 282 N 1.38 1.17 0.00 0.00 0.00 -1.16 -2.53 119.26 118.12 3ikh h ALA 282 Ca 0.19 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 3ikh h ALA 282 Cb 0.28 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3ikh h ALA 282 CO -0.38 0.34 -0.64 1.37 0.00 0.00 0.00 179.25 179.94 3ikh h LEU 283 N 1.03 0.00 0.00 0.00 -0.00 -0.52 -3.27 115.31 112.55 3ikh h LEU 283 Ca 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.24 3ikh h LEU 283 Cb 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.75 3ikh h LEU 283 CO -0.15 0.64 0.00 0.18 -0.00 0.00 0.00 178.44 179.11 3ikh n LEU 284 N -3.27 0.00 0.00 0.17 4.77 0.81 -4.91 117.00 114.57 3ikh n LEU 284 Ca 0.01 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.47 3ikh n LEU 284 Cb 0.79 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 3ikh n LEU 284 CO 0.42 -0.03 0.14 1.07 -1.33 0.00 0.00 177.39 177.66