#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6h n LYS 2 N 0.00 3.03 -3.65 3.17 2.85 -1.26 -4.75 118.16 117.54 2k6h n LYS 2 Ca 0.00 -2.05 -0.06 0.00 -1.05 0.00 0.00 58.31 55.15 2k6h n LYS 2 Cb 0.00 -2.79 -0.02 0.00 -0.65 0.00 0.00 35.03 31.57 2k6h n LYS 2 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 2k6h s ARG 3 N 2.82 1.13 -0.31 -1.58 3.03 -1.26 -2.85 118.95 119.91 2k6h s ARG 3 Ca 0.58 -0.55 -0.02 0.00 2.03 0.00 0.00 55.73 57.77 2k6h s ARG 3 Cb 0.15 0.43 0.11 0.00 -1.03 0.00 0.00 34.95 34.61 2k6h s ARG 3 CO -0.05 -0.51 0.14 -1.50 -1.13 0.00 0.00 175.30 172.26 2k6h s ILE 4 N -3.32 0.24 0.10 4.99 -1.16 -1.26 -5.01 121.20 115.77 2k6h s ILE 4 Ca 0.09 -1.17 -0.31 0.00 -0.51 0.00 0.00 60.65 58.75 2k6h s ILE 4 Cb -0.02 -1.20 -0.08 0.00 0.61 0.00 0.00 42.46 41.78 2k6h s ILE 4 CO -0.02 -0.78 1.39 0.54 -2.81 0.00 0.00 174.94 173.26 2k6h s VAL 5 N 1.71 3.37 0.79 4.00 0.11 -1.26 -4.88 120.40 124.23 2k6h s VAL 5 Ca 0.11 0.96 -0.15 0.00 -2.93 0.00 0.00 61.98 59.97 2k6h s VAL 5 Cb -0.18 -3.61 -0.00 0.00 -1.53 0.00 0.00 36.38 31.05 2k6h s VAL 5 CO -0.25 0.06 0.62 -2.65 -3.33 0.00 0.00 175.10 169.55 2k6h n PRO 6 N 4.15 0.17 0.12 1.54 -0.02 -1.26 -4.95 135.00 134.75 2k6h n PRO 6 Ca 0.12 0.11 -0.03 0.00 -2.02 0.00 0.00 63.50 61.68 2k6h n PRO 6 Cb 0.43 -1.94 0.11 0.00 -0.02 0.00 0.00 33.50 32.08 2k6h n PRO 6 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2k6h h LYS 7 N -0.69 0.03 -4.09 -0.52 6.56 -1.94 -3.46 116.57 112.46 2k6h h LYS 7 Ca -0.45 -0.03 -0.11 0.00 -1.06 0.00 0.00 60.65 59.00 2k6h h LYS 7 Cb 1.33 0.01 -0.14 0.00 -0.57 0.00 0.00 32.23 32.85 2k6h h LYS 7 CO 0.41 0.71 -0.55 0.12 -2.06 0.00 0.00 179.45 178.08 2k6h s PHE 8 N -3.47 0.43 -0.34 -1.35 5.36 -1.26 -5.14 117.98 112.21 2k6h s PHE 8 Ca -0.01 -0.91 -0.01 0.00 -0.96 0.00 0.00 56.93 55.04 2k6h s PHE 8 Cb 0.12 -0.27 0.12 0.00 -0.34 0.00 0.00 43.02 42.65 2k6h s PHE 8 CO 0.78 -0.47 0.17 0.99 -1.46 0.00 0.00 175.22 175.23 2k6h s THR 9 N -3.92 0.34 0.85 0.12 2.01 -1.26 -4.47 115.64 109.30 2k6h s THR 9 Ca 0.09 -1.48 -0.10 0.00 0.31 0.00 0.00 61.69 60.50 2k6h s THR 9 Cb 0.07 -1.26 0.11 0.00 0.01 0.00 0.00 72.50 71.42 2k6h s THR 9 CO -0.08 -0.85 1.12 -1.83 -0.69 0.00 0.00 174.62 172.28 2k6h s GLU 10 N 1.37 1.58 -0.02 4.92 1.03 -1.20 -4.82 118.70 121.57 2k6h s GLU 10 Ca 0.14 1.35 0.04 0.00 0.03 0.00 0.00 54.97 56.53 2k6h s GLU 10 Cb -0.20 -1.81 -0.01 0.00 -0.80 0.00 0.00 34.13 31.31 2k6h s GLU 10 CO -0.14 -2.18 -0.14 0.42 -1.33 0.00 0.00 175.26 171.89 2k6h s ILE 11 N -2.77 1.12 -0.30 1.83 1.01 -1.26 -0.70 121.20 120.12 2k6h s ILE 11 Ca 0.64 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.71 2k6h s ILE 11 Cb -0.20 -0.95 0.09 0.00 0.01 0.00 0.00 42.46 41.41 2k6h s ILE 11 CO 0.57 0.32 0.05 0.12 0.00 0.00 0.00 174.94 176.00 2k6h s PHE 12 N -0.20 2.59 -0.27 3.97 5.36 -0.13 -4.95 117.98 124.36 2k6h s PHE 12 Ca 0.03 -2.19 -0.29 0.00 -0.96 0.00 0.00 56.93 53.52 2k6h s PHE 12 Cb -0.07 -2.12 -0.02 0.00 -0.34 0.00 0.00 43.02 40.47 2k6h s PHE 12 CO 0.00 -0.88 1.61 -1.25 -1.46 0.00 0.00 175.22 173.24 2k6h s PRO 13 N 1.31 3.70 0.05 10.12 0.04 -1.26 -2.07 135.00 146.89 2k6h s PRO 13 Ca 0.07 1.52 0.03 0.00 0.04 0.00 0.00 61.00 62.65 2k6h s PRO 13 Cb -0.18 -4.05 -0.25 0.00 0.04 0.00 0.00 34.50 30.06 2k6h s PRO 13 CO -0.15 -1.41 1.04 0.28 0.04 0.00 0.00 177.00 176.80 2k6h h VAL 14 N 6.29 1.39 -0.09 -0.36 2.07 -1.38 -3.37 116.25 120.80 2k6h h VAL 14 Ca -0.32 -3.07 -0.19 0.00 0.82 0.00 0.00 66.70 63.93 2k6h h VAL 14 Cb 1.15 2.78 -0.00 0.00 -1.52 0.00 0.00 31.29 33.69 2k6h h VAL 14 CO 1.02 0.84 -0.74 1.05 0.02 0.00 0.00 177.57 179.76 2k6h h GLU 15 N 0.03 0.47 -4.89 1.57 9.09 -1.91 -3.40 114.58 115.55 2k6h h GLU 15 Ca -0.14 -0.39 -0.70 0.00 0.05 0.00 0.00 59.36 58.19 2k6h h GLU 15 Cb 1.91 0.08 -0.19 0.00 -1.65 0.00 0.00 28.75 28.91 2k6h h GLU 15 CO 0.15 1.02 0.62 0.34 0.05 0.00 0.00 179.01 181.19 2k6h s ASP 16 N -7.00 6.54 -1.19 3.06 2.15 -1.26 -4.96 116.67 114.01 2k6h s ASP 16 Ca -0.06 -1.93 -0.22 0.00 0.43 0.00 0.00 52.55 50.77 2k6h s ASP 16 Cb 0.10 -2.37 -0.07 0.00 -0.30 0.00 0.00 42.92 40.28 2k6h s ASP 16 CO 0.85 -1.05 1.91 0.00 -0.17 0.00 0.00 175.17 176.71 2k6h n ALA 17 N 6.34 2.07 0.00 3.66 0.00 -1.26 -4.53 120.51 126.79 2k6h n ALA 17 Ca 0.15 -3.13 -0.01 0.00 0.00 0.00 0.00 53.44 50.46 2k6h n ALA 17 Cb 0.48 -3.50 -0.00 0.00 0.00 0.00 0.00 19.45 16.42 2k6h n ALA 17 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k6h n ASN 18 N 13.52 0.68 -4.55 0.00 5.15 -1.26 -5.06 115.26 123.73 2k6h n ASN 18 Ca 0.46 0.10 -0.31 0.00 -0.60 0.00 0.00 54.58 54.22 2k6h n ASN 18 Cb 0.46 -0.31 -0.11 0.00 -0.53 0.00 0.00 39.78 39.30 2k6h n ASN 18 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 2k6h s TYR 19 N -1.64 2.77 0.76 1.20 1.13 -1.26 -5.14 117.35 115.17 2k6h s TYR 19 Ca -0.04 -0.12 -0.08 0.00 -1.41 0.00 0.00 57.07 55.41 2k6h s TYR 19 Cb 0.01 -1.54 0.09 0.00 -1.10 0.00 0.00 41.96 39.42 2k6h s TYR 19 CO 0.06 0.34 1.08 -1.25 -2.51 0.00 0.00 175.55 173.28 2k6h s PRO 20 N -1.53 1.86 0.38 -3.49 0.04 -1.26 -4.99 135.00 126.01 2k6h s PRO 20 Ca 0.17 -0.33 0.06 0.00 0.04 0.00 0.00 61.00 60.95 2k6h s PRO 20 Cb -0.11 -2.11 0.79 0.00 0.04 0.00 0.00 34.50 33.11 2k6h s PRO 20 CO 0.08 -1.50 2.01 1.88 0.04 0.00 0.00 177.00 179.51 2k6h h TYR 21 N -0.82 0.65 -0.58 0.56 0.05 -1.93 -2.98 116.97 111.93 2k6h h TYR 21 Ca -0.44 0.02 0.11 0.00 0.05 0.00 0.00 58.73 58.47 2k6h h TYR 21 Cb 1.30 -0.22 -0.11 0.00 1.01 0.00 0.00 36.73 38.71 2k6h h TYR 21 CO 0.03 0.38 -0.21 1.03 -1.05 0.00 0.00 178.16 178.34 2k6h h SER 22 N 0.68 -0.75 -0.46 3.88 0.87 -1.94 0.51 113.55 116.34 2k6h h SER 22 Ca 0.24 0.19 -0.02 0.00 -1.23 0.00 0.00 61.79 60.97 2k6h h SER 22 Cb 0.10 0.43 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 2k6h h SER 22 CO -0.06 -0.24 0.19 0.00 -0.53 0.00 0.00 176.83 176.19 2k6h h ALA 23 N 1.38 0.59 0.34 6.23 0.00 -1.92 -0.30 119.26 125.59 2k6h h ALA 23 Ca 0.27 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2k6h h ALA 23 Cb 0.49 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2k6h h ALA 23 CO -0.63 0.19 -0.16 0.35 0.00 0.00 0.00 179.25 178.99 2k6h h PHE 24 N 0.59 -0.42 -0.51 0.00 3.57 -1.35 -1.44 116.94 117.37 2k6h h PHE 24 Ca 0.15 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.64 2k6h h PHE 24 Cb 0.17 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2k6h h PHE 24 CO -0.00 -0.20 0.32 0.82 -2.23 0.00 0.00 178.31 177.03 2k6h h ILE 25 N -0.55 1.14 -0.40 1.41 1.08 -0.88 -1.54 117.51 117.77 2k6h h ILE 25 Ca -0.05 -0.30 0.03 0.00 -0.39 0.00 0.00 64.86 64.16 2k6h h ILE 25 Cb 0.41 0.42 -0.03 0.00 -3.07 0.00 0.00 36.82 34.55 2k6h h ILE 25 CO 0.08 0.14 0.20 0.00 -0.69 0.00 0.00 178.15 177.88 2k6h h ALA 26 N 1.17 0.50 0.48 1.87 0.00 -0.97 0.98 119.26 123.29 2k6h h ALA 26 Ca 0.19 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2k6h h ALA 26 Cb -0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2k6h h ALA 26 CO -0.04 -0.15 -0.30 1.03 0.00 0.00 0.00 179.25 179.79 2k6h h SER 27 N 0.42 -0.74 -0.70 0.00 0.87 -0.79 -0.10 113.55 112.51 2k6h h SER 27 Ca 0.17 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 2k6h h SER 27 Cb 0.07 0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.22 2k6h h SER 27 CO -0.12 -0.47 0.41 0.58 -0.53 0.00 0.00 176.83 176.71 2k6h h VAL 28 N -0.74 1.20 0.44 2.23 2.07 -1.14 -1.31 116.25 119.00 2k6h h VAL 28 Ca -0.05 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 2k6h h VAL 28 Cb 0.60 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 2k6h h VAL 28 CO 0.05 0.21 -0.31 -0.09 0.02 0.00 0.00 177.57 177.45 2k6h h ARG 29 N 0.95 -0.71 -0.73 1.57 2.43 -0.64 -0.59 114.38 116.67 2k6h h ARG 29 Ca 0.25 0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.49 2k6h h ARG 29 Cb -0.02 0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.65 2k6h h ARG 29 CO -0.05 -0.47 0.48 0.87 -1.51 0.00 0.00 179.97 179.29 2k6h h LYS 30 N -0.74 0.91 0.10 0.20 1.79 -0.82 -2.85 116.57 115.15 2k6h h LYS 30 Ca -0.04 -0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2k6h h LYS 30 Cb 0.62 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 2k6h h LYS 30 CO 0.02 0.60 -0.05 0.22 -1.08 0.00 0.00 179.45 179.16 2k6h h ASP 31 N 0.93 -0.11 0.86 0.86 3.58 -0.90 -3.28 116.42 118.36 2k6h h ASP 31 Ca 0.28 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2k6h h ASP 31 Cb -0.03 0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2k6h h ASP 31 CO -0.07 0.22 0.00 1.62 -2.88 0.00 0.00 179.24 178.13 2k6h h VAL 32 N -0.45 0.00 -0.78 2.25 3.04 -0.89 -2.96 116.25 116.45 2k6h h VAL 32 Ca -0.01 -0.41 0.20 0.00 -1.01 0.00 0.00 66.70 65.47 2k6h h VAL 32 Cb 0.38 1.35 -0.04 0.00 -2.01 0.00 0.00 31.29 30.97 2k6h h VAL 32 CO 0.02 0.00 0.55 0.40 -1.01 0.00 0.00 177.57 177.53 2k6h h ILE 33 N 0.00 0.66 -0.42 3.17 2.04 -1.58 0.24 117.51 121.62 2k6h h ILE 33 Ca 0.00 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 65.89 2k6h h ILE 33 Cb 0.43 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 2k6h h ILE 33 CO 0.00 0.03 0.29 0.11 0.00 0.00 0.00 178.15 178.58 2k6h h LYS 34 N 0.16 0.16 -0.01 2.37 1.57 -1.75 -2.17 116.57 116.91 2k6h h LYS 34 Ca 0.39 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 2k6h h LYS 34 Cb 1.27 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2k6h h LYS 34 CO -0.07 0.11 -0.49 1.58 -0.57 0.00 0.00 179.45 180.01 2k6h n HIS 35 N -4.45 0.00 -1.93 -1.35 -0.00 0.04 -4.96 115.22 102.57 2k6h n HIS 35 Ca 0.06 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.95 2k6h n HIS 35 Cb 0.38 0.00 0.17 0.00 -0.12 0.00 0.00 29.99 30.42 2k6h n HIS 35 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2k6h s THR 37 N -3.84 2.61 0.39 0.00 2.01 0.56 -4.94 115.64 112.43 2k6h s THR 37 Ca 0.72 -0.81 -0.24 0.00 0.31 0.00 0.00 61.69 61.68 2k6h s THR 37 Cb -0.05 -2.08 -0.09 0.00 0.01 0.00 0.00 72.50 70.29 2k6h s THR 37 CO 0.52 0.53 1.01 -0.62 -0.69 0.00 0.00 174.62 175.37 2k6h s ASP 38 N 0.56 6.91 0.03 3.53 2.15 -1.26 -1.50 116.67 127.09 2k6h s ASP 38 Ca -0.10 1.94 0.02 0.00 0.43 0.00 0.00 52.55 54.83 2k6h s ASP 38 Cb -0.16 -2.58 -0.02 0.00 -0.30 0.00 0.00 42.92 39.86 2k6h s ASP 38 CO 0.04 -0.38 -0.06 -2.28 -0.17 0.00 0.00 175.17 172.31 2k6h s HIS 39 N -1.73 0.54 0.50 -5.34 5.65 -1.26 -4.97 115.29 108.68 2k6h s HIS 39 Ca 0.57 -0.43 -0.23 0.00 0.25 0.00 0.00 55.06 55.22 2k6h s HIS 39 Cb -0.19 -0.33 -0.06 0.00 -1.18 0.00 0.00 32.58 30.81 2k6h s HIS 39 CO 0.24 -0.09 1.36 0.15 -0.65 0.00 0.00 174.74 175.76 2k6h s LYS 40 N -1.29 3.39 0.00 2.88 1.02 -1.26 -3.41 119.74 121.06 2k6h s LYS 40 Ca -0.09 2.26 0.00 0.00 0.02 0.00 0.00 55.97 58.16 2k6h s LYS 40 Cb -0.08 -2.41 0.00 0.00 -0.52 0.00 0.00 37.83 34.81 2k6h s LYS 40 CO 0.00 -1.00 0.00 0.41 -0.92 0.00 0.00 175.35 173.84 2k6h n GLY 41 N 0.66 0.44 3.24 -3.33 0.00 -1.26 -4.86 105.19 100.08 2k6h n GLY 41 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 2k6h n GLY 41 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k6h s ILE 42 N -2.33 3.06 0.13 -0.61 1.01 -1.22 -4.20 121.20 117.05 2k6h s ILE 42 Ca 0.00 -0.81 -0.16 0.00 0.00 0.00 0.00 60.65 59.68 2k6h s ILE 42 Cb 0.00 -2.48 -0.01 0.00 0.01 0.00 0.00 42.46 39.97 2k6h s ILE 42 CO 0.00 0.29 1.63 0.15 0.00 0.00 0.00 174.94 177.02 2k6h h PHE 43 N 8.06 0.66 -3.86 3.97 3.57 -1.92 -3.43 116.94 123.98 2k6h h PHE 43 Ca -0.37 -0.07 -0.52 0.00 3.53 0.00 0.00 57.97 60.54 2k6h h PHE 43 Cb 1.13 -0.19 0.06 0.00 2.79 0.00 0.00 35.95 39.75 2k6h h PHE 43 CO 0.57 0.63 0.64 -0.65 -2.23 0.00 0.00 178.31 177.27 2k6h s GLN 44 N -5.33 4.35 0.75 1.11 1.11 -1.26 -5.02 119.66 115.36 2k6h s GLN 44 Ca -0.13 2.22 -0.13 0.00 0.01 0.00 0.00 55.36 57.33 2k6h s GLN 44 Cb 0.10 -3.07 0.05 0.00 -1.01 0.00 0.00 33.01 29.07 2k6h s GLN 44 CO 0.77 -0.20 1.14 -1.25 0.01 0.00 0.00 175.29 175.75 2k6h s PRO 45 N -1.73 2.20 -0.10 2.91 0.04 -1.26 -4.81 135.00 132.25 2k6h s PRO 45 Ca 0.49 1.46 0.03 0.00 0.04 0.00 0.00 61.00 63.02 2k6h s PRO 45 Cb -0.40 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.26 2k6h s PRO 45 CO 0.53 -1.73 -0.20 0.08 0.04 0.00 0.00 177.00 175.72 2k6h s VAL 46 N -2.44 2.43 0.74 -0.36 1.01 -0.56 -2.89 120.40 118.32 2k6h s VAL 46 Ca 0.67 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 2k6h s VAL 46 Cb -0.22 -1.95 0.04 0.00 0.00 0.00 0.00 36.38 34.24 2k6h s VAL 46 CO 0.49 0.55 1.08 -1.48 0.00 0.00 0.00 175.10 175.74 2k6h s LEU 47 N 0.21 3.11 0.74 3.92 0.05 -1.09 -0.33 118.68 125.29 2k6h s LEU 47 Ca -0.13 1.78 -0.11 0.00 0.05 0.00 0.00 54.13 55.73 2k6h s LEU 47 Cb -0.16 -4.52 0.03 0.00 -2.05 0.00 0.00 46.19 39.49 2k6h s LEU 47 CO 0.07 -1.81 1.07 -2.16 -0.55 0.00 0.00 176.35 172.97 2k6h s PRO 48 N -4.85 2.58 0.48 1.48 0.04 -1.26 -4.00 135.00 129.47 2k6h s PRO 48 Ca 0.61 0.98 -0.22 0.00 0.04 0.00 0.00 61.00 62.41 2k6h s PRO 48 Cb -0.16 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.34 2k6h s PRO 48 CO 0.54 -1.36 0.90 -2.30 0.04 0.00 0.00 177.00 174.81 2k6h n PRO 49 N -3.31 1.07 -2.50 0.56 -0.02 -1.26 -4.74 135.00 124.80 2k6h n PRO 49 Ca 0.08 0.39 -0.43 0.00 -2.02 0.00 0.00 63.50 61.52 2k6h n PRO 49 Cb 0.54 -1.98 -0.02 0.00 -0.02 0.00 0.00 33.50 32.02 2k6h n PRO 49 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2k6h s GLU 50 N -2.15 4.22 0.18 -0.52 2.02 -1.26 -4.95 118.70 116.24 2k6h s GLU 50 Ca 0.67 1.53 0.04 0.00 0.02 0.00 0.00 54.97 57.22 2k6h s GLU 50 Cb -0.51 -3.73 -0.05 0.00 0.10 0.00 0.00 34.13 29.94 2k6h s GLU 50 CO 0.54 -0.71 -0.05 0.15 0.02 0.00 0.00 175.26 175.21 2k6h s LYS 51 N 3.45 1.18 0.00 1.61 1.02 -1.26 -5.06 119.74 120.68 2k6h s LYS 51 Ca 0.51 -1.55 0.24 0.00 0.02 0.00 0.00 55.97 55.18 2k6h s LYS 51 Cb -0.19 -0.58 0.96 0.00 -0.52 0.00 0.00 37.83 37.50 2k6h s LYS 51 CO 0.12 -0.02 1.67 1.63 -0.92 0.00 0.00 175.35 177.84 2k6h n LYS 52 N -0.30 1.58 -3.40 1.68 5.02 -1.26 -4.39 118.16 117.09 2k6h n LYS 52 Ca -0.08 -0.86 -0.26 0.00 -2.02 0.00 0.00 58.31 55.09 2k6h n LYS 52 Cb 0.62 -1.42 -0.09 0.00 -0.02 0.00 0.00 35.03 34.13 2k6h n LYS 52 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2k6h n VAL 53 N 0.06 0.46 -1.73 -0.18 0.24 -1.26 -5.08 118.33 110.84 2k6h n VAL 53 Ca 0.17 -4.39 -0.42 0.00 -2.04 0.00 0.00 64.34 57.67 2k6h n VAL 53 Cb 0.29 -1.98 -0.02 0.00 -1.47 0.00 0.00 33.84 30.67 2k6h n VAL 53 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2k6h n PRO 54 N 1.60 2.69 -0.07 7.34 -0.02 -1.26 -4.93 135.00 140.35 2k6h n PRO 54 Ca 0.25 0.96 -0.14 0.00 -2.02 0.00 0.00 63.50 62.55 2k6h n PRO 54 Cb 0.46 -2.76 -0.06 0.00 -0.02 0.00 0.00 33.50 31.12 2k6h n PRO 54 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2k6h h GLU 55 N 5.37 0.65 -4.15 -0.52 4.22 -1.99 -3.47 114.58 114.70 2k6h h GLU 55 Ca -0.46 -0.40 -0.15 0.00 0.08 0.00 0.00 59.36 58.44 2k6h h GLU 55 Cb 1.22 0.04 -0.13 0.00 0.50 0.00 0.00 28.75 30.38 2k6h h GLU 55 CO 0.84 1.01 -0.42 -0.48 -2.18 0.00 0.00 179.01 177.78 2k6h s LEU 56 N -8.85 1.00 0.31 1.64 0.05 -1.26 -4.98 118.68 106.58 2k6h s LEU 56 Ca -0.12 -1.11 -0.19 0.00 0.05 0.00 0.00 54.13 52.75 2k6h s LEU 56 Cb 0.08 0.92 0.04 0.00 -2.05 0.00 0.00 46.19 45.17 2k6h s LEU 56 CO 0.83 -0.91 0.77 -1.66 -0.55 0.00 0.00 176.35 174.83 2k6h s TRP 57 N -4.06 -0.06 -0.00 3.48 1.48 -1.26 -4.78 118.94 113.74 2k6h s TRP 57 Ca 0.27 -0.47 -0.01 0.00 -1.06 0.00 0.00 56.10 54.83 2k6h s TRP 57 Cb 0.04 0.76 -0.04 0.00 -1.16 0.00 0.00 33.47 33.07 2k6h s TRP 57 CO 0.06 -1.34 0.09 -0.51 -4.06 0.00 0.00 176.95 171.20 2k6h s LEU 58 N -2.99 3.95 -0.35 -4.66 2.01 -1.02 -4.65 118.68 110.97 2k6h s LEU 58 Ca 0.13 0.16 0.03 0.00 0.01 0.00 0.00 54.13 54.47 2k6h s LEU 58 Cb -0.05 -2.33 0.16 0.00 0.01 0.00 0.00 46.19 43.98 2k6h s LEU 58 CO 0.08 0.27 0.42 -0.47 1.01 0.00 0.00 176.35 177.65 2k6h s TYR 59 N -1.22 -0.71 -0.18 0.29 5.04 -1.26 -1.14 117.35 118.16 2k6h s TYR 59 Ca 0.24 -0.31 -0.20 0.00 -2.44 0.00 0.00 57.07 54.35 2k6h s TYR 59 Cb -0.12 -0.24 -0.03 0.00 0.35 0.00 0.00 41.96 41.92 2k6h s TYR 59 CO 0.15 -1.00 0.60 0.99 -1.34 0.00 0.00 175.55 174.95 2k6h s THR 60 N 1.86 5.05 -0.66 4.34 2.01 0.05 -3.25 115.64 125.04 2k6h s THR 60 Ca 0.14 1.15 -0.27 0.00 0.31 0.00 0.00 61.69 63.02 2k6h s THR 60 Cb -0.13 -3.92 -0.00 0.00 0.01 0.00 0.00 72.50 68.46 2k6h s THR 60 CO -0.13 0.15 1.64 -1.61 -0.69 0.00 0.00 174.62 173.97 2k6h s GLU 61 N 1.70 2.85 -0.06 4.92 0.41 0.12 -0.83 118.70 127.81 2k6h s GLU 61 Ca 0.28 0.29 -0.28 0.00 -0.41 0.00 0.00 54.97 54.86 2k6h s GLU 61 Cb -0.16 -4.31 -0.03 0.00 -1.78 0.00 0.00 34.13 27.86 2k6h s GLU 61 CO 0.11 -2.50 0.90 -1.17 -0.49 0.00 0.00 175.26 172.10 2k6h s LEU 62 N 7.79 4.31 -0.00 1.80 2.96 0.07 -0.95 118.68 134.66 2k6h s LEU 62 Ca 0.55 1.45 0.04 0.00 -0.22 0.00 0.00 54.13 55.95 2k6h s LEU 62 Cb -0.11 -3.40 -0.01 0.00 0.50 0.00 0.00 46.19 43.17 2k6h s LEU 62 CO 0.19 -0.28 -0.11 -0.75 -1.32 0.00 0.00 176.35 174.08 2k6h s LYS 63 N 1.29 0.89 0.42 1.98 2.20 -0.88 -1.50 119.74 124.14 2k6h s LYS 63 Ca 0.46 -0.45 0.03 0.00 -0.36 0.00 0.00 55.97 55.65 2k6h s LYS 63 Cb -0.19 -0.86 -0.03 0.00 -1.51 0.00 0.00 37.83 35.24 2k6h s LYS 63 CO 0.22 0.23 0.09 0.95 -0.36 0.00 0.00 175.35 176.48 2k6h s THR 64 N -0.37 0.85 0.60 3.43 -4.23 0.21 -0.83 115.64 115.30 2k6h s THR 64 Ca 0.04 -2.00 0.37 0.00 -1.18 0.00 0.00 61.69 58.91 2k6h s THR 64 Cb -0.05 -2.39 0.40 0.00 1.34 0.00 0.00 72.50 71.79 2k6h s THR 64 CO -0.00 0.00 2.29 0.08 -0.54 0.00 0.00 174.62 176.45 2k6h h ARG 65 N 1.74 0.00 0.00 3.99 0.11 -1.99 -3.29 114.38 114.94 2k6h h ARG 65 Ca -0.38 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 59.42 2k6h h ARG 65 Cb 1.28 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.31 2k6h h ARG 65 CO 0.63 0.01 -1.98 0.25 0.10 0.00 0.00 179.97 178.98 2k6h n THR 66 N -3.44 0.98 -4.03 0.08 -2.24 -1.26 -5.09 114.28 99.28 2k6h n THR 66 Ca -0.03 -0.33 -0.10 0.00 -2.27 0.00 0.00 64.05 61.33 2k6h n THR 66 Cb 0.10 -1.35 -0.08 0.00 -2.10 0.00 0.00 70.33 66.90 2k6h n THR 66 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2k6h s SER 67 N -6.02 0.10 0.10 3.42 0.01 -1.24 -5.12 113.70 104.95 2k6h s SER 67 Ca -0.24 -1.00 -0.04 0.00 1.31 0.00 0.00 55.95 55.97 2k6h s SER 67 Cb 0.07 0.41 -0.02 0.00 0.21 0.00 0.00 66.02 66.69 2k6h s SER 67 CO 0.36 -0.87 0.11 -0.44 0.41 0.00 0.00 173.24 172.81 2k6h s SER 68 N -3.01 0.27 0.03 2.44 0.01 -1.26 -0.62 113.70 111.56 2k6h s SER 68 Ca 0.21 -0.95 -0.04 0.00 1.31 0.00 0.00 55.95 56.48 2k6h s SER 68 Cb 0.04 0.31 -0.01 0.00 0.21 0.00 0.00 66.02 66.57 2k6h s SER 68 CO 0.02 -0.72 0.07 0.27 0.41 0.00 0.00 173.24 173.29 2k6h s ILE 69 N -3.95 0.12 -0.54 1.44 -4.36 -0.56 -4.33 121.20 109.02 2k6h s ILE 69 Ca 0.13 -1.02 -0.03 0.00 -0.26 0.00 0.00 60.65 59.47 2k6h s ILE 69 Cb 0.06 -0.69 0.14 0.00 1.25 0.00 0.00 42.46 43.22 2k6h s ILE 69 CO -0.05 -0.56 0.36 -0.89 0.24 0.00 0.00 174.94 174.04 2k6h s THR 70 N -2.18 3.62 -0.08 8.37 2.01 -0.72 -0.75 115.64 125.91 2k6h s THR 70 Ca -0.09 -2.58 -0.14 0.00 0.31 0.00 0.00 61.69 59.20 2k6h s THR 70 Cb -0.04 -3.40 -0.05 0.00 0.01 0.00 0.00 72.50 69.02 2k6h s THR 70 CO -0.03 -0.81 0.35 -1.48 -0.69 0.00 0.00 174.62 171.96 2k6h s LEU 71 N 0.44 4.37 -0.28 4.42 2.34 -0.01 -0.88 118.68 129.07 2k6h s LEU 71 Ca 0.13 0.74 -0.09 0.00 0.06 0.00 0.00 54.13 54.97 2k6h s LEU 71 Cb -0.21 -2.47 -0.02 0.00 -0.56 0.00 0.00 46.19 42.92 2k6h s LEU 71 CO -0.04 0.22 0.14 0.00 -1.06 0.00 0.00 176.35 175.61 2k6h s ALA 72 N -0.37 3.30 -0.42 1.48 0.00 -0.23 -0.77 121.76 124.74 2k6h s ALA 72 Ca 0.21 -1.23 -0.15 0.00 0.00 0.00 0.00 51.96 50.79 2k6h s ALA 72 Cb -0.15 -2.31 0.03 0.00 0.00 0.00 0.00 23.12 20.70 2k6h s ALA 72 CO 0.09 -0.68 0.31 0.42 0.00 0.00 0.00 175.76 175.90 2k6h s ILE 73 N 1.65 5.18 -0.23 0.00 -1.09 -0.29 -2.58 121.20 123.84 2k6h s ILE 73 Ca 0.06 -0.78 -0.29 0.00 -2.23 0.00 0.00 60.65 57.41 2k6h s ILE 73 Cb -0.16 -3.94 -0.02 0.00 -1.58 0.00 0.00 42.46 36.77 2k6h s ILE 73 CO 0.07 -0.37 1.43 -0.60 -1.23 0.00 0.00 174.94 174.24 2k6h s ARG 74 N 1.66 3.95 0.46 2.79 3.52 -0.71 -2.44 118.95 128.18 2k6h s ARG 74 Ca 0.04 1.53 0.20 0.00 -0.13 0.00 0.00 55.73 57.38 2k6h s ARG 74 Cb -0.20 -3.92 1.18 0.00 -1.56 0.00 0.00 34.95 30.45 2k6h s ARG 74 CO 0.09 -1.09 1.93 0.00 -0.81 0.00 0.00 175.30 175.42 2k6h h MET 75 N 9.63 0.26 -0.72 5.12 -0.00 -1.89 0.79 114.93 128.12 2k6h h MET 75 Ca -0.30 -0.02 0.03 0.00 -0.00 0.00 0.00 59.70 59.42 2k6h h MET 75 Cb 1.12 -0.06 -0.04 0.00 -0.00 0.00 0.00 31.60 32.62 2k6h h MET 75 CO 1.01 0.17 0.47 -0.44 -0.00 0.00 0.00 176.91 178.12 2k6h h ASP 76 N 0.27 0.74 0.00 -0.10 5.19 -1.90 -3.15 116.42 117.47 2k6h h ASP 76 Ca 0.35 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.75 2k6h h ASP 76 Cb 0.98 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.32 2k6h h ASP 76 CO -0.08 0.51 -0.49 -3.20 -3.12 0.00 0.00 179.24 172.86 2k6h n ASN 77 N -4.46 0.96 -4.19 6.45 2.85 -0.57 -4.69 115.26 111.61 2k6h n ASN 77 Ca 0.09 -0.51 -0.32 0.00 -0.11 0.00 0.00 54.58 53.73 2k6h n ASN 77 Cb 0.13 1.06 -0.08 0.00 1.24 0.00 0.00 39.78 42.13 2k6h n ASN 77 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2k6h n LEU 78 N -1.26 -0.77 -4.17 1.20 4.77 0.17 -4.97 117.00 111.96 2k6h n LEU 78 Ca 0.01 -1.21 -0.12 0.00 -0.03 0.00 0.00 56.01 54.66 2k6h n LEU 78 Cb 0.11 -1.50 -0.10 0.00 -2.33 0.00 0.00 43.42 39.60 2k6h n LEU 78 CO 0.13 0.50 -0.40 -0.47 -1.33 0.00 0.00 177.39 175.82 2k6h s TYR 79 N -4.19 0.95 -1.06 -1.77 5.04 -1.23 -4.87 117.35 110.21 2k6h s TYR 79 Ca 0.08 -0.80 -0.19 0.00 -2.44 0.00 0.00 57.07 53.71 2k6h s TYR 79 Cb -0.04 -0.53 0.10 0.00 0.35 0.00 0.00 41.96 41.83 2k6h s TYR 79 CO 0.94 -0.08 1.39 -1.17 -1.34 0.00 0.00 175.55 175.28 2k6h s LEU 80 N -2.80 4.32 0.36 6.97 0.20 -1.26 -1.73 118.68 124.74 2k6h s LEU 80 Ca 0.09 -2.05 0.16 0.00 0.69 0.00 0.00 54.13 53.02 2k6h s LEU 80 Cb 0.02 -2.49 0.68 0.00 -0.43 0.00 0.00 46.19 43.97 2k6h s LEU 80 CO -0.03 -1.19 1.76 -0.37 -0.29 0.00 0.00 176.35 176.24 2k6h h VAL 81 N 5.94 1.10 -1.72 1.68 -1.51 -1.89 -3.44 116.25 116.41 2k6h h VAL 81 Ca 0.24 -1.51 0.36 0.00 -1.23 0.00 0.00 66.70 64.56 2k6h h VAL 81 Cb 0.97 1.86 -0.10 0.00 -2.13 0.00 0.00 31.29 31.90 2k6h h VAL 81 CO 1.30 0.40 0.91 -0.83 -1.23 0.00 0.00 177.57 178.12 2k6h s GLY 82 N -4.36 -0.29 0.08 5.19 0.00 -1.26 -1.56 107.32 105.13 2k6h s GLY 82 Ca -0.01 0.40 -0.08 0.00 0.00 0.00 0.00 44.72 45.03 2k6h s GLY 82 CO 0.71 3.22 0.17 -0.11 0.00 0.00 0.00 173.10 177.09 2k6h s PHE 83 N -2.14 0.16 0.05 1.90 -0.71 -0.57 -1.07 117.98 115.60 2k6h s PHE 83 Ca 0.23 -0.56 0.02 0.00 -1.04 0.00 0.00 56.93 55.57 2k6h s PHE 83 Cb 0.03 -0.08 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 2k6h s PHE 83 CO -0.03 -0.51 0.09 0.50 -1.34 0.00 0.00 175.22 173.93 2k6h s ARG 84 N -3.61 2.98 0.03 1.99 3.52 -0.06 -0.15 118.95 123.65 2k6h s ARG 84 Ca 0.03 -0.60 -0.05 0.00 -0.13 0.00 0.00 55.73 54.99 2k6h s ARG 84 Cb 0.04 -2.79 -0.05 0.00 -1.56 0.00 0.00 34.95 30.59 2k6h s ARG 84 CO -0.10 0.60 0.26 0.95 -0.81 0.00 0.00 175.30 176.20 2k6h s THR 85 N -1.32 5.32 0.30 4.11 -4.23 -1.17 -1.75 115.64 116.92 2k6h s THR 85 Ca 0.27 0.01 -0.29 0.00 -1.18 0.00 0.00 61.69 60.50 2k6h s THR 85 Cb -0.12 -3.58 -0.13 0.00 1.34 0.00 0.00 72.50 70.02 2k6h s THR 85 CO 0.19 0.29 1.31 -2.65 -0.54 0.00 0.00 174.62 173.22 2k6h n PRO 86 N 0.85 2.05 -3.86 3.99 -0.02 -1.26 -2.52 135.00 134.23 2k6h n PRO 86 Ca -0.09 0.72 -0.28 0.00 -2.02 0.00 0.00 63.50 61.83 2k6h n PRO 86 Cb 0.52 -2.32 0.03 0.00 -0.02 0.00 0.00 33.50 31.71 2k6h n PRO 86 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k6h n GLY 87 N 1.27 -0.43 3.55 -1.23 0.00 -1.26 -4.94 105.19 102.15 2k6h n GLY 87 Ca 0.07 0.17 -0.09 0.00 0.00 0.00 0.00 46.02 46.18 2k6h n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6h n GLY 88 N -1.67 1.10 4.02 -0.02 0.00 -1.05 -5.07 105.19 102.49 2k6h n GLY 88 Ca -0.06 -1.27 -0.21 0.00 0.00 0.00 0.00 46.02 44.48 2k6h n GLY 88 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k6h s VAL 89 N -2.19 2.15 0.42 1.61 -7.23 -1.26 -4.66 120.40 109.24 2k6h s VAL 89 Ca 0.16 -0.82 -0.19 0.00 -1.81 0.00 0.00 61.98 59.31 2k6h s VAL 89 Cb -0.04 -2.33 -0.10 0.00 0.56 0.00 0.00 36.38 34.46 2k6h s VAL 89 CO 0.12 0.00 0.91 0.26 -0.31 0.00 0.00 175.10 176.08 2k6h s TRP 90 N -2.87 3.34 -0.18 2.82 0.51 -1.26 -3.02 118.94 118.27 2k6h s TRP 90 Ca 0.64 1.52 0.01 0.00 -2.12 0.00 0.00 56.10 56.14 2k6h s TRP 90 Cb -0.06 -2.78 0.03 0.00 -0.81 0.00 0.00 33.47 29.86 2k6h s TRP 90 CO 0.41 -0.10 -0.14 -1.58 -0.51 0.00 0.00 176.95 175.03 2k6h s TRP 91 N -2.20 2.49 -0.14 -1.98 0.52 0.79 -0.93 118.94 117.49 2k6h s TRP 91 Ca 0.60 -1.55 -0.10 0.00 0.02 0.00 0.00 56.10 55.07 2k6h s TRP 91 Cb -0.09 -1.71 -0.05 0.00 -1.15 0.00 0.00 33.47 30.47 2k6h s TRP 91 CO 0.16 -0.75 0.18 -2.00 0.02 0.00 0.00 176.95 174.57 2k6h s GLU 92 N 1.38 3.86 -0.62 4.98 2.12 0.38 -1.51 118.70 129.28 2k6h s GLU 92 Ca 0.01 -0.08 -0.26 0.00 0.36 0.00 0.00 54.97 55.00 2k6h s GLU 92 Cb -0.15 -3.31 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 2k6h s GLU 92 CO -0.10 0.53 2.04 -0.06 -0.54 0.00 0.00 175.26 177.13 2k6h s PHE 93 N -0.34 1.50 -2.82 5.30 0.40 -0.60 -1.28 117.98 120.14 2k6h s PHE 93 Ca 0.14 1.03 0.00 0.00 -0.60 0.00 0.00 56.93 57.50 2k6h s PHE 93 Cb -0.12 -3.92 0.00 0.00 0.51 0.00 0.00 43.02 39.49 2k6h s PHE 93 CO 0.03 -2.27 0.00 0.41 0.70 0.00 0.00 175.22 174.08 2k6h n GLY 94 N 5.95 -1.63 3.38 4.36 0.00 -1.26 -4.97 105.19 111.01 2k6h n GLY 94 Ca 0.28 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 2k6h n GLY 94 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k6h s LYS 95 N -1.46 1.33 -0.06 1.61 -2.85 -1.26 -0.96 119.74 116.09 2k6h s LYS 95 Ca 0.00 -1.41 -0.06 0.00 -1.00 0.00 0.00 55.97 53.51 2k6h s LYS 95 Cb 0.00 0.37 0.01 0.00 -2.06 0.00 0.00 37.83 36.14 2k6h s LYS 95 CO 0.00 -0.49 0.09 -3.47 0.10 0.00 0.00 175.35 171.58 2k6h n ASP 96 N -0.30 -1.07 0.00 0.03 2.03 -1.26 -4.62 116.55 111.35 2k6h n ASP 96 Ca -0.01 -0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 2k6h n ASP 96 Cb 0.64 -0.29 0.00 0.00 -0.72 0.00 0.00 41.12 40.74 2k6h n ASP 96 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k6h n GLY 97 N 0.14 0.85 3.76 0.27 0.00 -1.26 -5.11 105.19 103.83 2k6h n GLY 97 Ca -0.01 -0.58 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 2k6h n GLY 97 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2k6h n ASP 98 N 0.00 3.18 -4.88 1.61 5.75 -1.26 -5.04 116.55 115.91 2k6h n ASP 98 Ca 0.00 1.09 -0.22 0.00 -0.01 0.00 0.00 54.79 55.65 2k6h n ASP 98 Cb 0.00 -1.60 0.06 0.00 -1.03 0.00 0.00 41.12 38.56 2k6h n ASP 98 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2k6h s THR 99 N -1.21 2.45 -1.92 2.12 -4.23 -1.26 -5.01 115.64 106.59 2k6h s THR 99 Ca 0.63 -0.65 0.32 0.00 -1.18 0.00 0.00 61.69 60.81 2k6h s THR 99 Cb -0.45 -2.80 0.85 0.00 1.34 0.00 0.00 72.50 71.45 2k6h s THR 99 CO 0.56 0.00 2.20 0.00 -0.54 0.00 0.00 174.62 176.84 2k6h n HIS 100 N -2.51 0.00 -0.95 3.99 1.44 -1.26 -4.51 115.22 111.42 2k6h n HIS 100 Ca 0.11 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.50 2k6h n HIS 100 Cb 0.60 -0.04 0.13 0.00 0.12 0.00 0.00 29.99 30.81 2k6h n HIS 100 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2k6h s LEU 101 N -2.08 2.95 0.00 2.39 2.01 -1.26 -2.36 118.68 120.33 2k6h s LEU 101 Ca 0.45 2.08 0.00 0.00 0.01 0.00 0.00 54.13 56.67 2k6h s LEU 101 Cb 0.22 -4.55 0.00 0.00 0.01 0.00 0.00 46.19 41.86 2k6h s LEU 101 CO 0.38 -2.68 0.00 0.18 1.01 0.00 0.00 176.35 175.25 2k6h n LEU 102 N -3.86 0.41 0.00 1.79 7.99 -1.26 -4.55 117.00 117.51 2k6h n LEU 102 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.11 2k6h n LEU 102 Cb 0.52 -0.67 0.00 0.00 -0.11 0.00 0.00 43.42 43.16 2k6h n LEU 102 CO 0.50 -0.20 0.00 0.61 -1.51 0.00 0.00 177.39 176.79 2k6h n GLY 103 N -2.00 1.17 3.78 -0.72 0.00 -1.00 -4.89 105.19 101.54 2k6h n GLY 103 Ca 0.00 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.28 2k6h n GLY 103 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k6h s ASP 104 N -4.00 3.51 -0.19 1.61 -1.08 -1.13 -4.40 116.67 110.99 2k6h s ASP 104 Ca 0.00 0.98 -0.29 0.00 -0.52 0.00 0.00 52.55 52.73 2k6h s ASP 104 Cb 0.00 -1.57 -0.05 0.00 -1.46 0.00 0.00 42.92 39.85 2k6h s ASP 104 CO 0.00 -2.55 2.01 0.20 0.52 0.00 0.00 175.17 175.35 2k6h s ASN 105 N -4.00 5.85 0.89 -0.34 -0.87 -1.26 -4.87 114.94 110.33 2k6h s ASN 105 Ca 0.64 1.88 -0.12 0.00 -1.57 0.00 0.00 52.86 53.68 2k6h s ASN 105 Cb -0.15 -2.52 0.12 0.00 -0.02 0.00 0.00 41.25 38.68 2k6h s ASN 105 CO 0.53 -1.65 1.13 -2.16 -2.57 0.00 0.00 177.10 172.38 2k6h s PRO 106 N 5.64 1.36 0.13 -0.60 0.04 -1.26 -4.79 135.00 135.51 2k6h s PRO 106 Ca 0.90 0.39 -0.12 0.00 0.04 0.00 0.00 61.00 62.21 2k6h s PRO 106 Cb -0.31 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.31 2k6h s PRO 106 CO 0.35 -2.07 0.49 1.03 0.04 0.00 0.00 177.00 176.84 2k6h s ARG 107 N -5.23 3.88 0.40 4.56 0.52 -0.10 -4.83 118.95 118.13 2k6h s ARG 107 Ca 0.63 0.34 -0.09 0.00 -0.52 0.00 0.00 55.73 56.10 2k6h s ARG 107 Cb -0.15 -2.94 -0.06 0.00 0.52 0.00 0.00 34.95 32.33 2k6h s ARG 107 CO 0.54 0.50 0.73 1.67 0.02 0.00 0.00 175.30 178.76 2k6h s TRP 108 N -1.47 3.48 -0.22 -0.53 1.48 -1.26 -0.47 118.94 119.96 2k6h s TRP 108 Ca 0.37 0.94 0.19 0.00 -1.06 0.00 0.00 56.10 56.54 2k6h s TRP 108 Cb -0.14 -2.36 0.03 0.00 -1.16 0.00 0.00 33.47 29.84 2k6h s TRP 108 CO 0.19 -0.08 1.16 -0.07 -4.06 0.00 0.00 176.95 174.09 2k6h h LEU 109 N 1.18 0.00 0.00 -4.66 3.38 -0.98 -3.45 115.31 110.78 2k6h h LEU 109 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2k6h h LEU 109 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2k6h h LEU 109 CO 0.64 0.28 0.00 0.61 0.09 0.00 0.00 178.44 180.06 2k6h n GLY 110 N 1.24 3.04 3.03 0.83 0.00 -0.13 -4.93 105.19 108.27 2k6h n GLY 110 Ca -0.02 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.21 2k6h n GLY 110 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k6h s PHE 111 N -1.39 -0.33 -0.42 1.61 0.08 -1.26 -4.63 117.98 111.65 2k6h s PHE 111 Ca 0.00 0.79 0.02 0.00 0.12 0.00 0.00 56.93 57.85 2k6h s PHE 111 Cb 0.00 0.02 0.25 0.00 -0.57 0.00 0.00 43.02 42.72 2k6h s PHE 111 CO 0.00 -0.25 1.03 0.41 -0.10 0.00 0.00 175.22 176.31 2k6h n GLY 112 N 4.41 -0.85 0.00 4.36 0.00 -1.26 -4.91 105.19 106.94 2k6h n GLY 112 Ca -0.22 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.39 2k6h n GLY 112 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6h n GLY 113 N 1.77 -0.04 1.62 -0.02 0.00 -1.26 -4.79 105.19 102.47 2k6h n GLY 113 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 2k6h n GLY 113 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k6h n ARG 114 N 0.00 0.45 -0.29 1.61 0.00 -1.26 -5.04 116.66 112.13 2k6h n ARG 114 Ca 0.00 -1.07 0.31 0.00 -0.00 0.00 0.00 57.85 57.09 2k6h n ARG 114 Cb 0.00 1.23 0.68 0.00 -0.00 0.00 0.00 32.46 34.37 2k6h n ARG 114 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.63 177.73 2k6h h TYR 115 N 1.44 0.17 -0.50 2.89 -0.00 -2.00 0.28 116.97 119.26 2k6h h TYR 115 Ca -0.14 0.01 0.09 0.00 -0.00 0.00 0.00 58.73 58.68 2k6h h TYR 115 Cb 0.54 -0.05 -0.03 0.00 -0.00 0.00 0.00 36.73 37.20 2k6h h TYR 115 CO 0.00 0.02 0.34 0.37 -0.00 0.00 0.00 178.16 178.89 2k6h h GLN 116 N 0.10 0.30 -0.02 0.10 4.15 -1.95 -0.29 115.11 117.50 2k6h h GLN 116 Ca 0.54 -0.02 -0.18 0.00 0.77 0.00 0.00 58.65 59.76 2k6h h GLN 116 Cb 1.96 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 29.57 2k6h h GLN 116 CO -0.08 0.20 -0.80 0.22 -1.93 0.00 0.00 178.83 176.43 2k6h h ASP 117 N 0.31 0.25 0.31 -0.69 3.58 -1.26 -2.54 116.42 116.38 2k6h h ASP 117 Ca 0.23 -0.18 -0.02 0.00 0.42 0.00 0.00 57.03 57.48 2k6h h ASP 117 Cb 0.50 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.48 2k6h h ASP 117 CO -0.05 0.95 -0.15 -0.07 -2.88 0.00 0.00 179.24 177.04 2k6h h LEU 118 N 0.12 -0.35 -0.19 2.28 3.38 -1.15 -3.43 115.31 115.97 2k6h h LEU 118 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2k6h h LEU 118 Cb 1.40 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.24 2k6h h LEU 118 CO 0.12 -0.15 0.00 2.30 0.09 0.00 0.00 178.44 180.80 2k6h n ILE 119 N -3.69 0.00 0.00 1.22 -0.00 -0.70 -5.11 119.36 111.08 2k6h n ILE 119 Ca -0.05 -0.10 0.00 0.00 -0.00 0.00 0.00 62.75 62.59 2k6h n ILE 119 Cb 0.16 1.73 0.00 0.00 -0.00 0.00 0.00 39.64 41.53 2k6h n ILE 119 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2k6h n GLY 120 N 0.02 2.06 0.14 3.28 0.00 -0.96 -4.35 105.19 105.38 2k6h n GLY 120 Ca 0.00 -0.12 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 2k6h n GLY 120 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2k6h h ASN 121 N 0.00 0.53 0.20 1.61 -0.73 -1.88 -3.35 115.58 111.95 2k6h h ASN 121 Ca 0.00 -0.83 -0.01 0.00 1.87 0.00 0.00 56.30 57.33 2k6h h ASN 121 Cb 0.00 -0.17 0.00 0.00 0.27 0.00 0.00 38.32 38.42 2k6h h ASN 121 CO 0.00 1.71 -0.10 0.11 -0.37 0.00 0.00 177.43 178.78 2k6h h LYS 122 N 0.09 -0.26 0.00 6.67 6.56 -1.95 -3.50 116.57 124.18 2k6h h LYS 122 Ca -0.34 0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.27 2k6h h LYS 122 Cb 2.07 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 33.79 2k6h h LYS 122 CO 0.16 -0.18 0.00 0.41 -2.06 0.00 0.00 179.45 177.78 2k6h n GLY 123 N -1.21 2.96 0.00 3.86 0.00 -1.26 -4.89 105.19 104.65 2k6h n GLY 123 Ca -0.09 -1.86 0.11 0.00 0.00 0.00 0.00 46.02 44.19 2k6h n GLY 123 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2k6h n LEU 124 N 0.00 0.00 0.22 0.99 -0.00 -1.26 -3.97 117.00 112.98 2k6h n LEU 124 Ca 0.00 0.19 0.15 0.00 -0.00 0.00 0.00 56.01 56.35 2k6h n LEU 124 Cb 0.00 -0.19 0.77 0.00 -0.00 0.00 0.00 43.42 44.01 2k6h n LEU 124 CO 0.00 -0.05 0.95 1.05 -0.00 0.00 0.00 177.39 179.35 2k6h h GLU 125 N 0.00 0.00 0.00 1.47 -0.00 -1.87 -2.66 114.58 111.52 2k6h h GLU 125 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.34 2k6h h GLU 125 Cb 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 28.89 2k6h h GLU 125 CO 0.00 0.00 -0.07 1.79 -0.00 0.00 0.00 179.01 180.73 2k6h h THR 126 N 0.00 0.45 -3.46 -1.06 1.35 -1.86 -3.35 112.91 104.97 2k6h h THR 126 Ca 0.00 -0.37 -0.54 0.00 -0.55 0.00 0.00 66.41 64.95 2k6h h THR 126 Cb 0.09 1.25 -0.03 0.00 -1.73 0.00 0.00 68.15 67.73 2k6h h THR 126 CO 0.00 0.07 0.20 0.54 -0.25 0.00 0.00 175.52 176.09 2k6h s VAL 127 N -4.23 4.66 0.49 6.82 0.11 -1.00 -5.04 120.40 122.20 2k6h s VAL 127 Ca -0.03 1.73 -0.19 0.00 -2.93 0.00 0.00 61.98 60.56 2k6h s VAL 127 Cb 0.13 -4.16 -0.09 0.00 -1.53 0.00 0.00 36.38 30.73 2k6h s VAL 127 CO 0.55 0.37 1.00 -0.89 -3.33 0.00 0.00 175.10 172.80 2k6h s THR 128 N -0.12 4.13 0.01 5.04 2.01 -1.26 -4.50 115.64 120.95 2k6h s THR 128 Ca 0.40 1.23 0.05 0.00 0.31 0.00 0.00 61.69 63.68 2k6h s THR 128 Cb -0.21 -3.54 -0.02 0.00 0.01 0.00 0.00 72.50 68.74 2k6h s THR 128 CO 0.25 -0.38 -0.15 -0.04 -0.69 0.00 0.00 174.62 173.60 2k6h s MET 129 N -3.47 1.13 0.00 4.92 -1.94 -0.22 -4.98 119.30 114.73 2k6h s MET 129 Ca 0.63 -0.63 0.00 0.00 -1.71 0.00 0.00 55.69 53.98 2k6h s MET 129 Cb -0.13 -1.12 0.00 0.00 2.01 0.00 0.00 34.83 35.60 2k6h s MET 129 CO 0.22 0.30 0.00 0.41 -0.01 0.00 0.00 175.02 175.93 2k6h n GLY 130 N 2.39 0.88 0.43 -0.03 0.00 -1.26 -0.70 105.19 106.90 2k6h n GLY 130 Ca -0.16 -1.08 -0.15 0.00 0.00 0.00 0.00 46.02 44.63 2k6h n GLY 130 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2k6h h ARG 131 N 0.00 -0.72 -0.52 1.61 0.11 -1.79 0.12 114.38 113.20 2k6h h ARG 131 Ca 0.00 0.05 -0.05 0.00 0.10 0.00 0.00 59.98 60.08 2k6h h ARG 131 Cb 0.00 0.16 -0.02 0.00 1.11 0.00 0.00 29.97 31.22 2k6h h ARG 131 CO 0.00 -0.48 0.11 0.00 0.10 0.00 0.00 179.97 179.70 2k6h h ALA 132 N -0.82 1.22 -0.09 0.08 0.00 -1.89 -2.25 119.26 115.50 2k6h h ALA 132 Ca -0.03 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 2k6h h ALA 132 Cb 0.70 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2k6h h ALA 132 CO -0.17 0.53 -0.30 1.49 0.00 0.00 0.00 179.25 180.80 2k6h h GLU 133 N 0.77 0.16 0.05 0.00 4.57 -1.77 0.00 114.58 118.37 2k6h h GLU 133 Ca 0.17 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2k6h h GLU 133 Cb 0.31 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.89 2k6h h GLU 133 CO 0.00 0.46 -0.03 1.98 -1.18 0.00 0.00 179.01 180.24 2k6h h MET 134 N 0.15 -0.07 -0.37 1.92 4.05 -0.22 -1.59 114.93 118.80 2k6h h MET 134 Ca 0.02 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.50 2k6h h MET 134 Cb 0.62 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 31.38 2k6h h MET 134 CO 0.04 0.32 0.06 1.15 0.23 0.00 0.00 176.91 178.72 2k6h h THR 135 N -0.48 0.80 -0.17 -0.77 2.02 -1.03 0.36 112.91 113.64 2k6h h THR 135 Ca -0.01 -0.06 0.05 0.00 0.77 0.00 0.00 66.41 67.16 2k6h h THR 135 Cb 0.43 0.60 -0.07 0.00 -1.74 0.00 0.00 68.15 67.37 2k6h h THR 135 CO 0.01 0.03 -0.31 0.03 0.37 0.00 0.00 175.52 175.65 2k6h h ARG 136 N 0.18 -0.35 0.43 6.66 3.08 -1.05 -1.76 114.38 121.58 2k6h h ARG 136 Ca 0.18 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 2k6h h ARG 136 Cb 0.21 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2k6h h ARG 136 CO -0.24 -0.23 -0.29 0.00 -1.07 0.00 0.00 179.97 178.14 2k6h h ALA 137 N 0.50 -0.69 -0.60 0.04 0.00 -0.20 -1.53 119.26 116.78 2k6h h ALA 137 Ca 0.11 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2k6h h ALA 137 Cb 0.53 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 2k6h h ALA 137 CO -0.38 -0.91 0.09 -0.24 0.00 0.00 0.00 179.25 177.82 2k6h h VAL 138 N -0.69 1.25 0.37 0.00 3.04 -0.93 0.01 116.25 119.30 2k6h h VAL 138 Ca -0.04 -0.99 -0.01 0.00 -1.01 0.00 0.00 66.70 64.64 2k6h h VAL 138 Cb 0.58 0.69 -0.00 0.00 -2.01 0.00 0.00 31.29 30.55 2k6h h VAL 138 CO 0.03 0.37 -0.21 0.78 -1.01 0.00 0.00 177.57 177.52 2k6h h ASN 139 N 0.92 -0.52 1.29 3.17 4.21 -1.19 -1.27 115.58 122.19 2k6h h ASN 139 Ca 0.19 0.03 -0.02 0.00 1.21 0.00 0.00 56.30 57.71 2k6h h ASN 139 Cb 0.41 0.15 -0.00 0.00 -1.12 0.00 0.00 38.32 37.76 2k6h h ASN 139 CO 0.01 -0.35 -0.08 0.44 -1.29 0.00 0.00 177.43 176.16 2k6h h ASP 140 N -0.55 0.00 0.59 5.81 3.32 -1.13 -2.64 116.42 121.82 2k6h h ASP 140 Ca -0.04 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.83 2k6h h ASP 140 Cb 0.45 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 2k6h h ASP 140 CO 0.06 0.08 -0.78 0.25 -1.72 0.00 0.00 179.24 177.12 2k6h h LEU 141 N 0.00 0.18 -0.22 1.55 5.85 -0.71 -3.29 115.31 118.67 2k6h h LEU 141 Ca -0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2k6h h LEU 141 Cb 0.75 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2k6h h LEU 141 CO 0.01 0.89 0.00 0.00 -0.34 0.00 0.00 178.44 179.00 2k6h h ALA 142 N 1.10 1.00 0.00 1.25 0.00 -0.87 -3.34 119.26 118.41 2k6h h ALA 142 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2k6h h ALA 142 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2k6h h ALA 142 CO 0.11 0.00 0.00 0.36 0.00 0.00 0.00 179.25 179.72 2k6h n LYS 143 N -2.69 0.01 -1.94 0.00 2.85 -1.17 -4.66 118.16 110.56 2k6h n LYS 143 Ca 0.04 0.28 -0.24 0.00 -1.05 0.00 0.00 58.31 57.34 2k6h n LYS 143 Cb 0.44 -1.50 -0.06 0.00 -0.65 0.00 0.00 35.03 33.26 2k6h n LYS 143 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2k6h s LYS 144 N -2.99 2.32 0.38 -1.58 1.02 -1.26 -4.70 119.74 112.94 2k6h s LYS 144 Ca 0.06 -0.23 0.20 0.00 0.02 0.00 0.00 55.97 56.03 2k6h s LYS 144 Cb 0.08 -5.02 0.52 0.00 -0.52 0.00 0.00 37.83 32.89 2k6h s LYS 144 CO 0.23 -3.72 1.65 -0.22 -0.92 0.00 0.00 175.35 172.37 2k6h h LYS 145 N 11.42 0.00 -4.02 1.68 1.63 -1.96 -3.46 116.57 121.85 2k6h h LYS 145 Ca 0.09 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.77 2k6h h LYS 145 Cb 1.00 0.00 -0.16 0.00 -0.60 0.00 0.00 32.23 32.47 2k6h h LYS 145 CO 1.16 0.30 -0.58 0.21 -3.45 0.00 0.00 179.45 177.09 2k6h s LYS 146 N -3.33 0.62 -0.21 1.90 2.20 -1.26 -5.03 119.74 114.63 2k6h s LYS 146 Ca 0.03 -0.99 -0.29 0.00 -0.36 0.00 0.00 55.97 54.36 2k6h s LYS 146 Cb 0.09 0.23 -0.04 0.00 -1.51 0.00 0.00 37.83 36.60 2k6h s LYS 146 CO 0.68 -0.14 1.84 0.00 -0.36 0.00 0.00 175.35 177.37 2k6h s MET 147 N -3.32 3.57 -0.01 4.03 0.00 -1.26 -4.98 119.30 117.33 2k6h s MET 147 Ca 0.01 1.81 0.02 0.00 0.00 0.00 0.00 55.69 57.53 2k6h s MET 147 Cb 0.03 -4.17 -0.00 0.00 0.00 0.00 0.00 34.83 30.69 2k6h s MET 147 CO -0.08 -1.58 -0.06 -1.17 0.00 0.00 0.00 175.02 172.13 2k6h s LEU 148 N 6.24 1.95 -0.74 0.18 2.96 -1.26 -4.91 118.68 123.10 2k6h s LEU 148 Ca 0.82 -0.11 -0.18 0.00 -0.22 0.00 0.00 54.13 54.44 2k6h s LEU 148 Cb -0.28 -0.33 0.03 0.00 0.50 0.00 0.00 46.19 46.10 2k6h s LEU 148 CO 0.33 0.07 0.43 -1.84 -1.32 0.00 0.00 176.35 174.02 2k6h n GLU 149 N 3.02 -0.60 0.00 1.98 0.28 -1.26 -4.85 120.64 119.21 2k6h n GLU 149 Ca -0.14 -0.01 0.03 0.00 -0.16 0.00 0.00 57.16 56.88 2k6h n GLU 149 Cb 0.57 -1.31 0.15 0.00 1.43 0.00 0.00 31.44 32.28 2k6h n GLU 149 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 2k6h n PRO 150 N -3.28 0.11 0.00 3.44 -0.02 -1.26 -2.22 135.00 131.76 2k6h n PRO 150 Ca -0.10 0.18 0.07 0.00 -2.02 0.00 0.00 63.50 61.63 2k6h n PRO 150 Cb 0.39 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.38 2k6h n PRO 150 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2k6h n GLN 151 N -1.22 1.65 0.00 -0.52 6.02 -1.26 -4.58 117.38 117.47 2k6h n GLN 151 Ca 0.03 -0.90 0.00 0.00 -0.01 0.00 0.00 57.00 56.12 2k6h n GLN 151 Cb 0.04 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.05 2k6h n GLN 151 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k6h n ALA 152 N 0.05 0.00 -0.32 -1.58 0.00 -0.94 -4.82 120.51 112.90 2k6h n ALA 152 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.48 2k6h n ALA 152 Cb 0.33 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.88 2k6h n ALA 152 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2k6h h ASP 153 N 0.00 0.96 -0.71 0.00 3.58 -1.95 -2.40 116.42 115.90 2k6h h ASP 153 Ca 0.00 -0.02 0.15 0.00 0.42 0.00 0.00 57.03 57.58 2k6h h ASP 153 Cb 0.00 -0.23 -0.10 0.00 1.72 0.00 0.00 39.33 40.72 2k6h h ASP 153 CO 0.00 0.68 0.16 0.71 -2.88 0.00 0.00 179.24 177.91 2k6h h THR 154 N 1.13 0.54 -0.05 2.25 1.35 -1.89 -2.24 112.91 113.99 2k6h h THR 154 Ca 0.33 -0.09 -0.00 0.00 -0.55 0.00 0.00 66.41 66.09 2k6h h THR 154 Cb -0.07 0.25 -0.00 0.00 -1.73 0.00 0.00 68.15 66.60 2k6h h THR 154 CO -0.09 0.05 0.02 0.11 -0.25 0.00 0.00 175.52 175.36 2k6h h LYS 155 N 0.27 0.08 -0.73 4.72 1.79 -1.68 0.10 116.57 121.12 2k6h h LYS 155 Ca 0.39 -0.02 0.07 0.00 -2.18 0.00 0.00 60.65 58.91 2k6h h LYS 155 Cb 0.65 -0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 31.23 2k6h h LYS 155 CO -0.49 0.22 0.42 1.03 -1.08 0.00 0.00 179.45 179.55 2k6h h SER 156 N -0.08 0.62 0.59 0.86 0.87 -1.44 -0.16 113.55 114.81 2k6h h SER 156 Ca 0.02 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.58 2k6h h SER 156 Cb 0.17 -0.09 0.01 0.00 -0.44 0.00 0.00 62.40 62.05 2k6h h SER 156 CO -0.00 0.39 -0.28 0.11 -0.53 0.00 0.00 176.83 176.52 2k6h h LYS 157 N 0.75 -0.76 0.34 2.24 6.56 -1.26 -3.12 116.57 121.32 2k6h h LYS 157 Ca 0.33 0.05 -0.00 0.00 -1.06 0.00 0.00 60.65 59.97 2k6h h LYS 157 Cb 0.22 0.17 -0.02 0.00 -0.57 0.00 0.00 32.23 32.04 2k6h h LYS 157 CO -0.20 -0.46 -0.28 1.25 -2.06 0.00 0.00 179.45 177.71 2k6h h LEU 158 N -0.95 -0.75 -1.16 2.94 5.85 -0.22 -2.93 115.31 118.09 2k6h h LEU 158 Ca -0.08 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 2k6h h LEU 158 Cb 0.66 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 2k6h h LEU 158 CO 0.13 -0.42 -0.36 0.58 -0.34 0.00 0.00 178.44 178.03 2k6h h VAL 159 N -0.63 1.01 -0.07 1.05 2.07 -1.18 -2.09 116.25 116.42 2k6h h VAL 159 Ca -0.02 -1.37 0.03 0.00 0.82 0.00 0.00 66.70 66.16 2k6h h VAL 159 Cb 0.56 1.79 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 2k6h h VAL 159 CO -0.02 0.36 -0.10 0.50 0.02 0.00 0.00 177.57 178.32 2k6h h LYS 160 N 0.00 -0.13 -0.49 1.57 3.64 -1.44 -0.69 116.57 119.03 2k6h h LYS 160 Ca -0.00 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2k6h h LYS 160 Cb 0.76 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.59 2k6h h LYS 160 CO 0.05 -0.09 0.18 -0.07 -2.27 0.00 0.00 179.45 177.25 2k6h h LEU 161 N -0.14 0.68 -0.46 5.20 4.07 -1.29 0.05 115.31 123.42 2k6h h LEU 161 Ca 0.06 -0.18 -0.07 0.00 0.08 0.00 0.00 57.88 57.77 2k6h h LEU 161 Cb 0.22 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.77 2k6h h LEU 161 CO -0.15 0.67 -0.00 1.62 -1.08 0.00 0.00 178.44 179.50 2k6h h VAL 162 N 0.65 1.26 -0.53 1.22 3.04 -1.19 0.41 116.25 121.10 2k6h h VAL 162 Ca 0.16 -1.06 -0.10 0.00 -1.01 0.00 0.00 66.70 64.70 2k6h h VAL 162 Cb 0.21 1.03 -0.02 0.00 -2.01 0.00 0.00 31.29 30.50 2k6h h VAL 162 CO -0.01 0.37 -0.05 0.58 -1.01 0.00 0.00 177.57 177.45 2k6h h VAL 163 N 0.67 1.26 0.19 1.51 2.07 -0.99 0.28 116.25 121.24 2k6h h VAL 163 Ca 0.13 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.48 2k6h h VAL 163 Cb 0.50 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2k6h h VAL 163 CO 0.02 0.41 -0.09 -0.03 0.02 0.00 0.00 177.57 177.90 2k6h h MET 164 N 0.86 -0.25 0.00 1.57 -1.53 -0.68 -3.25 114.93 111.64 2k6h h MET 164 Ca 0.15 0.02 -0.04 0.00 -3.44 0.00 0.00 59.70 56.39 2k6h h MET 164 Cb 0.57 0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 31.67 2k6h h MET 164 CO 0.03 -0.17 -0.29 0.28 0.14 0.00 0.00 176.91 176.91 2k6h h VAL 165 N -0.42 0.79 0.33 -5.77 2.07 -1.02 -3.10 116.25 109.13 2k6h h VAL 165 Ca -0.03 -1.68 -0.02 0.00 0.82 0.00 0.00 66.70 65.80 2k6h h VAL 165 Cb 0.20 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2k6h h VAL 165 CO 0.04 0.27 -0.16 0.00 0.02 0.00 0.00 177.57 177.74 2k6h h GLU 167 N -0.94 0.60 -0.08 0.00 4.39 -1.08 -1.20 114.58 116.25 2k6h h GLU 167 Ca -0.05 -0.08 0.02 0.00 0.34 0.00 0.00 59.36 59.60 2k6h h GLU 167 Cb 0.52 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.05 2k6h h GLU 167 CO 0.07 0.49 0.10 0.78 -1.16 0.00 0.00 179.01 179.29 2k6h h GLY 168 N 0.74 0.00 2.00 -3.84 0.00 -1.44 0.34 103.07 100.87 2k6h h GLY 168 Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.40 2k6h h GLY 168 CO -0.02 0.00 -0.36 -2.00 0.00 0.00 0.00 176.54 174.16 2k6h h LEU 169 N 0.00 0.00 0.00 3.11 5.85 -0.53 -3.35 115.31 120.39 2k6h h LEU 169 Ca 0.04 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2k6h h LEU 169 Cb 0.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.26 2k6h h LEU 169 CO -0.00 0.36 -1.31 -2.11 -0.34 0.00 0.00 178.44 175.05 2k6h n ARG 170 N -3.44 0.47 -4.07 1.25 1.85 -0.17 -4.64 116.66 107.92 2k6h n ARG 170 Ca 0.00 -0.07 -0.32 0.00 -1.00 0.00 0.00 57.85 56.46 2k6h n ARG 170 Cb 0.53 -1.17 -0.15 0.00 -1.05 0.00 0.00 32.46 30.62 2k6h n ARG 170 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2k6h s PHE 171 N -2.50 3.20 0.41 2.89 0.40 0.10 -0.74 117.98 121.73 2k6h s PHE 171 Ca -0.03 -2.21 0.09 0.00 -0.60 0.00 0.00 56.93 54.19 2k6h s PHE 171 Cb 0.05 -1.94 0.86 0.00 0.51 0.00 0.00 43.02 42.51 2k6h s PHE 171 CO 0.33 -0.87 1.98 -0.91 0.70 0.00 0.00 175.22 176.46 2k6h h ASN 172 N 7.81 0.27 0.26 1.36 2.35 -0.98 -3.14 115.58 123.51 2k6h h ASN 172 Ca -0.23 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.47 2k6h h ASN 172 Cb 1.06 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.35 2k6h h ASN 172 CO 0.49 0.33 -0.15 0.74 -1.65 0.00 0.00 177.43 177.19 2k6h h THR 173 N 0.30 0.69 -0.29 2.81 2.02 -1.82 0.42 112.91 117.03 2k6h h THR 173 Ca 0.07 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.13 2k6h h THR 173 Cb 0.20 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 2k6h h THR 173 CO 0.00 0.00 -0.33 1.62 0.37 0.00 0.00 175.52 177.18 2k6h h VAL 174 N -0.38 1.29 0.02 3.16 3.04 -1.88 0.03 116.25 121.52 2k6h h VAL 174 Ca -0.03 -1.46 -0.00 0.00 -1.01 0.00 0.00 66.70 64.20 2k6h h VAL 174 Cb 0.31 1.42 0.00 0.00 -2.01 0.00 0.00 31.29 31.01 2k6h h VAL 174 CO 0.04 0.47 -0.01 0.77 -1.01 0.00 0.00 177.57 177.83 2k6h h SER 175 N 0.53 -0.03 -0.53 3.17 4.64 -1.49 -2.08 113.55 117.76 2k6h h SER 175 Ca 0.06 -0.04 0.04 0.00 -0.47 0.00 0.00 61.79 61.37 2k6h h SER 175 Cb 0.83 0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.90 2k6h h SER 175 CO 0.07 0.02 0.35 -0.09 -0.87 0.00 0.00 176.83 176.31 2k6h h ARG 176 N -0.08 0.57 0.25 4.77 9.65 -0.52 0.21 114.38 129.24 2k6h h ARG 176 Ca -0.00 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.83 2k6h h ARG 176 Cb 0.07 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 2k6h h ARG 176 CO 0.01 0.38 -0.12 1.15 2.80 0.00 0.00 179.97 184.18 2k6h h THR 177 N 0.58 0.79 0.00 0.20 2.02 -0.63 -1.82 112.91 114.05 2k6h h THR 177 Ca 0.21 -0.27 -0.08 0.00 0.77 0.00 0.00 66.41 67.04 2k6h h THR 177 Cb 0.13 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 2k6h h THR 177 CO -0.06 0.06 -0.39 1.62 0.37 0.00 0.00 175.52 177.13 2k6h h VAL 178 N -0.48 1.08 -0.13 3.16 3.04 -0.80 -2.74 116.25 119.37 2k6h h VAL 178 Ca -0.03 -1.42 0.02 0.00 -1.01 0.00 0.00 66.70 64.26 2k6h h VAL 178 Cb 0.36 1.81 -0.02 0.00 -2.01 0.00 0.00 31.29 31.43 2k6h h VAL 178 CO 0.06 0.38 -0.01 -0.78 -1.01 0.00 0.00 177.57 176.21 2k6h h ASP 179 N 0.00 -0.06 0.14 3.17 1.82 -0.37 0.41 116.42 121.53 2k6h h ASP 179 Ca -0.00 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 2k6h h ASP 179 Cb 0.78 0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.85 2k6h h ASP 179 CO 0.05 -0.01 0.00 0.00 -1.61 0.00 0.00 179.24 177.67 2k6h n ALA 180 N -2.25 2.08 -0.07 -0.78 0.00 -0.71 -3.02 120.51 115.76 2k6h n ALA 180 Ca -0.04 -0.10 -0.08 0.00 0.00 0.00 0.00 53.44 53.22 2k6h n ALA 180 Cb 0.08 -1.29 -0.10 0.00 0.00 0.00 0.00 19.45 18.14 2k6h n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6h n GLY 181 N 0.17 -0.54 0.14 0.00 0.00 0.11 -4.02 105.19 101.04 2k6h n GLY 181 Ca 0.11 -0.19 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 2k6h n GLY 181 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2k6h h PHE 182 N 0.00 0.25 -0.00 1.61 3.57 -0.25 -2.52 116.94 119.60 2k6h h PHE 182 Ca -0.37 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.00 2k6h h PHE 182 Cb 1.77 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.47 2k6h h PHE 182 CO 0.01 0.88 -0.08 0.27 -2.23 0.00 0.00 178.31 177.15 2k6h n ASN 183 N -3.72 0.57 -4.88 0.41 0.23 -1.17 -4.48 115.26 102.22 2k6h n ASN 183 Ca -0.03 -0.78 -0.30 0.00 -0.53 0.00 0.00 54.58 52.95 2k6h n ASN 183 Cb 0.74 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.39 2k6h n ASN 183 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 2k6h s SER 184 N -2.34 6.26 0.08 0.53 0.15 -0.95 -5.02 113.70 112.41 2k6h s SER 184 Ca 0.33 1.22 -0.03 0.00 0.70 0.00 0.00 55.95 58.16 2k6h s SER 184 Cb 0.20 -2.38 -0.27 0.00 -1.71 0.00 0.00 66.02 61.86 2k6h s SER 184 CO 0.44 -0.73 1.16 0.06 1.20 0.00 0.00 173.24 175.37 2k6h h GLN 185 N -0.03 0.24 0.00 5.44 3.07 -1.87 -3.40 115.11 118.56 2k6h h GLN 185 Ca -0.45 -0.41 -0.36 0.00 0.09 0.00 0.00 58.65 57.52 2k6h h GLN 185 Cb 1.20 0.15 -0.07 0.00 0.08 0.00 0.00 27.48 28.84 2k6h h GLN 185 CO 0.62 1.19 -2.37 0.72 0.09 0.00 0.00 178.83 179.08 2k6h n HIS 186 N -3.51 0.00 0.00 0.06 8.25 -1.26 -4.79 115.22 113.97 2k6h n HIS 186 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 2k6h n HIS 186 Cb 1.01 -0.95 0.00 0.00 1.12 0.00 0.00 29.99 31.18 2k6h n HIS 186 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k6h n GLY 187 N 2.14 -0.97 3.42 -1.41 0.00 -1.25 -4.70 105.19 102.42 2k6h n GLY 187 Ca -0.39 -2.18 -0.10 0.00 0.00 0.00 0.00 46.02 43.36 2k6h n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6h s VAL 188 N -0.11 0.02 0.10 1.61 0.11 0.13 -4.94 120.40 117.32 2k6h s VAL 188 Ca 0.00 -1.50 0.09 0.00 -2.93 0.00 0.00 61.98 57.63 2k6h s VAL 188 Cb 0.00 -2.12 -0.04 0.00 -1.53 0.00 0.00 36.38 32.70 2k6h s VAL 188 CO 0.00 -0.11 -0.19 0.42 -3.33 0.00 0.00 175.10 171.89 2k6h s THR 189 N -4.02 2.76 0.59 5.04 -4.23 -1.26 -1.06 115.64 113.46 2k6h s THR 189 Ca 0.23 -1.47 -0.07 0.00 -1.18 0.00 0.00 61.69 59.21 2k6h s THR 189 Cb 0.02 -2.24 0.13 0.00 1.34 0.00 0.00 72.50 71.75 2k6h s THR 189 CO 0.06 0.15 0.80 0.00 -0.54 0.00 0.00 174.62 175.09 2k6h n LEU 190 N 0.97 0.00 -4.51 4.79 -0.00 -1.26 -5.04 117.00 111.95 2k6h n LEU 190 Ca -0.16 -1.11 -0.24 0.00 -0.00 0.00 0.00 56.01 54.50 2k6h n LEU 190 Cb 0.53 -0.59 -0.11 0.00 -0.00 0.00 0.00 43.42 43.25 2k6h n LEU 190 CO 0.27 -1.02 -0.29 0.28 -0.00 0.00 0.00 177.39 176.63 2k6h s THR 191 N -2.59 1.56 0.21 1.47 -1.32 -1.26 -4.75 115.64 108.96 2k6h s THR 191 Ca 0.48 -2.02 -0.09 0.00 -1.21 0.00 0.00 61.69 58.85 2k6h s THR 191 Cb -0.02 -2.81 0.15 0.00 -1.51 0.00 0.00 72.50 68.31 2k6h s THR 191 CO 0.33 -0.05 1.76 0.58 -2.21 0.00 0.00 174.62 175.03 2k6h h VAL 192 N 2.02 0.81 -0.57 5.08 2.07 -1.94 -1.82 116.25 121.90 2k6h h VAL 192 Ca -0.42 -0.16 0.08 0.00 0.82 0.00 0.00 66.70 67.01 2k6h h VAL 192 Cb 1.24 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 2k6h h VAL 192 CO 0.73 0.09 0.23 0.74 0.02 0.00 0.00 177.57 179.38 2k6h h THR 193 N 0.48 0.83 -0.02 2.57 2.02 -1.96 0.68 112.91 117.51 2k6h h THR 193 Ca 0.32 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.35 2k6h h THR 193 Cb 0.36 0.36 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 2k6h h THR 193 CO -0.29 0.08 0.00 1.56 0.37 0.00 0.00 175.52 177.24 2k6h h GLN 194 N 0.43 0.03 -0.27 6.66 4.20 -1.70 -2.20 115.11 122.25 2k6h h GLN 194 Ca 0.28 -0.01 0.07 0.00 0.06 0.00 0.00 58.65 59.04 2k6h h GLN 194 Cb 0.30 -0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.00 2k6h h GLN 194 CO -0.26 0.29 -0.22 0.78 -0.67 0.00 0.00 178.83 178.75 2k6h h GLY 195 N -0.24 -0.10 0.95 3.46 0.00 -0.57 -1.29 103.07 105.28 2k6h h GLY 195 Ca 0.00 0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.61 2k6h h GLY 195 CO 0.00 -0.19 0.08 0.50 0.00 0.00 0.00 176.54 176.92 2k6h h LYS 196 N -0.21 0.18 -0.65 4.80 1.57 -0.86 -1.76 116.57 119.63 2k6h h LYS 196 Ca 0.15 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 2k6h h LYS 196 Cb 0.44 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 2k6h h LYS 196 CO -0.40 0.18 0.13 -0.56 -0.57 0.00 0.00 179.45 178.23 2k6h h GLN 197 N 0.13 1.06 -0.20 3.15 3.07 -1.10 -2.70 115.11 118.53 2k6h h GLN 197 Ca 0.05 -0.27 -0.09 0.00 0.09 0.00 0.00 58.65 58.43 2k6h h GLN 197 Cb 0.05 -0.13 -0.01 0.00 0.08 0.00 0.00 27.48 27.46 2k6h h GLN 197 CO -0.01 0.97 -0.25 -0.39 0.09 0.00 0.00 178.83 179.23 2k6h h VAL 198 N 0.98 1.26 0.00 1.86 -1.51 -1.04 -2.41 116.25 115.39 2k6h h VAL 198 Ca 0.20 -1.21 0.00 0.00 -1.23 0.00 0.00 66.70 64.46 2k6h h VAL 198 Cb 0.40 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 30.95 2k6h h VAL 198 CO 0.01 0.38 0.00 1.67 -1.23 0.00 0.00 177.57 178.39 2k6h n GLN 199 N -4.14 0.08 -2.62 5.19 -0.06 -0.68 -3.59 117.38 111.56 2k6h n GLN 199 Ca -0.01 0.15 -0.20 0.00 -2.00 0.00 0.00 57.00 54.94 2k6h n GLN 199 Cb 0.39 -1.50 0.01 0.00 -4.06 0.00 0.00 30.24 25.07 2k6h n GLN 199 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 2k6h n LYS 200 N -1.44 2.49 0.17 3.69 4.76 -0.91 -4.84 118.16 122.09 2k6h n LYS 200 Ca 0.06 -4.05 0.11 0.00 -2.87 0.00 0.00 58.31 51.56 2k6h n LYS 200 Cb 0.20 -1.87 0.64 0.00 -1.84 0.00 0.00 35.03 32.16 2k6h n LYS 200 CO 0.00 0.00 0.00 2.35 -1.37 0.00 0.00 177.40 178.38 2k6h h TRP 201 N 2.78 0.04 -0.58 2.13 7.01 -1.62 0.03 115.95 125.74 2k6h h TRP 201 Ca 0.14 0.00 0.10 0.00 2.11 0.00 0.00 58.89 61.24 2k6h h TRP 201 Cb 0.98 -0.01 -0.08 0.00 -2.10 0.00 0.00 29.16 27.95 2k6h h TRP 201 CO 0.69 0.02 0.16 0.22 -2.79 0.00 0.00 178.44 176.75 2k6h h ASP 202 N 0.04 0.09 -0.48 2.65 3.58 -1.92 0.81 116.42 121.19 2k6h h ASP 202 Ca 0.08 0.09 -0.11 0.00 0.42 0.00 0.00 57.03 57.52 2k6h h ASP 202 Cb 0.26 0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 2k6h h ASP 202 CO -0.00 0.06 -0.11 -0.09 -2.88 0.00 0.00 179.24 176.21 2k6h h ARG 203 N 0.31 0.93 -0.41 0.28 2.43 -1.41 -1.92 114.38 114.59 2k6h h ARG 203 Ca 0.30 -0.35 0.04 0.00 -0.81 0.00 0.00 59.98 59.16 2k6h h ARG 203 Cb 0.41 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.86 2k6h h ARG 203 CO -0.35 1.01 0.17 0.82 -1.51 0.00 0.00 179.97 180.11 2k6h h ILE 204 N 0.78 0.91 -0.58 1.20 5.03 -0.95 -2.00 117.51 121.91 2k6h h ILE 204 Ca 0.12 -0.12 -0.04 0.00 -0.12 0.00 0.00 64.86 64.71 2k6h h ILE 204 Cb 0.67 0.53 -0.03 0.00 -3.03 0.00 0.00 36.82 34.96 2k6h h ILE 204 CO 0.05 0.06 0.22 0.28 -0.68 0.00 0.00 178.15 178.08 2k6h h SER 205 N 0.35 0.81 -0.58 1.72 0.02 -0.31 0.65 113.55 116.21 2k6h h SER 205 Ca 0.18 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 2k6h h SER 205 Cb 0.14 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2k6h h SER 205 CO -0.17 0.77 0.34 0.07 -1.14 0.00 0.00 176.83 176.71 2k6h h LYS 206 N 0.80 0.80 -0.73 3.45 2.10 -1.27 -2.64 116.57 119.08 2k6h h LYS 206 Ca 0.19 -0.08 -0.02 0.00 -2.00 0.00 0.00 60.65 58.75 2k6h h LYS 206 Cb 0.23 -0.16 -0.03 0.00 -0.90 0.00 0.00 32.23 31.36 2k6h h LYS 206 CO -0.01 0.58 0.38 0.00 -2.00 0.00 0.00 179.45 178.40 2k6h h ALA 207 N 1.17 0.93 -0.10 0.07 0.00 -0.56 0.07 119.26 120.85 2k6h h ALA 207 Ca 0.21 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2k6h h ALA 207 Cb -0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2k6h h ALA 207 CO -0.04 0.47 -0.01 0.00 0.00 0.00 0.00 179.25 179.66 2k6h h ALA 208 N 1.19 0.07 -0.52 0.00 0.00 -0.75 0.33 119.26 119.58 2k6h h ALA 208 Ca 0.25 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 2k6h h ALA 208 Cb 0.07 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2k6h h ALA 208 CO -0.04 -0.48 0.08 0.35 0.00 0.00 0.00 179.25 179.17 2k6h h PHE 209 N 0.01 0.91 -0.40 0.00 3.57 -1.16 -1.89 116.94 117.98 2k6h h PHE 209 Ca 0.05 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.42 2k6h h PHE 209 Cb 0.06 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 2k6h h PHE 209 CO -0.14 0.82 0.25 1.49 -2.23 0.00 0.00 178.31 178.50 2k6h h GLU 210 N 0.73 0.54 0.00 1.11 4.81 -0.73 -1.00 114.58 120.05 2k6h h GLU 210 Ca 0.16 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2k6h h GLU 210 Cb 0.40 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2k6h h GLU 210 CO 0.01 0.38 0.00 0.91 -0.73 0.00 0.00 179.01 179.58 2k6h n TRP 211 N -4.78 0.48 -0.02 0.92 8.01 0.08 -2.44 117.44 119.68 2k6h n TRP 211 Ca 0.00 0.19 -0.13 0.00 -1.31 0.00 0.00 57.50 56.26 2k6h n TRP 211 Cb 0.04 -0.81 -0.11 0.00 -2.01 0.00 0.00 31.31 28.43 2k6h n TRP 211 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2k6h h ALA 212 N 2.33 -0.03 -0.19 6.99 0.00 -0.33 -3.13 119.26 124.90 2k6h h ALA 212 Ca 0.00 -0.32 -0.21 0.00 0.00 0.00 0.00 54.91 54.37 2k6h h ALA 212 Cb 0.29 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.10 2k6h h ALA 212 CO 0.00 -0.18 -0.72 0.22 0.00 0.00 0.00 179.25 178.58 2k6h h ASP 213 N -0.71 0.97 -2.91 0.00 3.58 -1.39 -3.41 116.42 112.55 2k6h h ASP 213 Ca -0.00 -0.60 -0.56 0.00 0.42 0.00 0.00 57.03 56.28 2k6h h ASP 213 Cb 0.66 -0.28 -0.40 0.00 1.72 0.00 0.00 39.33 41.03 2k6h h ASP 213 CO 0.00 1.40 -0.78 -1.00 -2.88 0.00 0.00 179.24 175.99 2k6h s HIS 214 N -3.86 0.93 0.18 0.28 3.76 -1.02 -5.01 115.29 110.55 2k6h s HIS 214 Ca -0.10 -1.40 0.28 0.00 -0.15 0.00 0.00 55.06 53.69 2k6h s HIS 214 Cb 0.09 -1.21 1.19 0.00 1.11 0.00 0.00 32.58 33.76 2k6h s HIS 214 CO 0.90 -0.84 1.93 -1.00 -0.85 0.00 0.00 174.74 174.89 2k6h h PRO 215 N 7.91 0.00 0.00 8.40 0.13 -1.77 -3.20 132.00 143.46 2k6h h PRO 215 Ca -0.12 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.98 2k6h h PRO 215 Cb 1.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 2k6h h PRO 215 CO 0.42 0.13 -0.17 0.00 -0.23 0.00 0.00 178.00 178.15 2k6h h THR 216 N 0.00 0.58 -2.92 1.56 1.03 -1.95 -3.43 112.91 107.79 2k6h h THR 216 Ca -0.00 -0.80 -0.56 0.00 -0.01 0.00 0.00 66.41 65.03 2k6h h THR 216 Cb 0.59 1.53 -0.04 0.00 -1.07 0.00 0.00 68.15 69.15 2k6h h THR 216 CO 0.02 0.17 1.17 0.00 -0.01 0.00 0.00 175.52 176.87 2k6h s ALA 217 N -3.96 2.89 -0.59 0.00 0.00 -1.21 -4.96 121.76 113.93 2k6h s ALA 217 Ca -0.01 -0.08 -0.28 0.00 0.00 0.00 0.00 51.96 51.59 2k6h s ALA 217 Cb 0.12 -4.01 0.02 0.00 0.00 0.00 0.00 23.12 19.25 2k6h s ALA 217 CO 0.61 -2.64 1.39 0.08 0.00 0.00 0.00 175.76 175.20 2k6h s VAL 218 N 6.30 3.78 -0.11 0.00 1.01 -1.26 -4.93 120.40 125.19 2k6h s VAL 218 Ca 0.68 0.64 -0.29 0.00 0.00 0.00 0.00 61.98 63.00 2k6h s VAL 218 Cb -0.17 -4.51 -0.04 0.00 0.00 0.00 0.00 36.38 31.66 2k6h s VAL 218 CO 0.32 -1.27 1.61 -0.63 0.00 0.00 0.00 175.10 175.12 2k6h s ILE 219 N 6.04 3.68 0.12 2.22 1.01 -1.26 -4.93 121.20 128.08 2k6h s ILE 219 Ca 0.50 0.81 -0.19 0.00 0.00 0.00 0.00 60.65 61.77 2k6h s ILE 219 Cb -0.10 -3.57 -0.06 0.00 0.01 0.00 0.00 42.46 38.74 2k6h s ILE 219 CO 0.23 -0.12 1.74 -0.65 0.00 0.00 0.00 174.94 176.14 2k6h h PRO 220 N 9.75 0.32 0.00 2.79 0.11 -1.97 -3.24 132.00 139.76 2k6h h PRO 220 Ca -0.36 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 2k6h h PRO 220 Cb 1.16 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2k6h h PRO 220 CO 0.97 0.27 -0.04 0.38 -0.21 0.00 0.00 178.00 179.36 2k6h h ASP 221 N 0.29 0.00 0.48 -2.05 3.04 -1.98 -2.38 116.42 113.82 2k6h h ASP 221 Ca 0.08 0.00 -0.14 0.00 -3.24 0.00 0.00 57.03 53.74 2k6h h ASP 221 Cb 0.03 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 38.30 2k6h h ASP 221 CO -0.02 0.04 -1.63 0.80 -2.04 0.00 0.00 179.24 176.39 2k6h n MET 222 N -3.69 0.64 -0.01 4.15 1.56 -1.23 -4.25 117.12 114.29 2k6h n MET 222 Ca -0.02 0.08 0.04 0.00 -0.27 0.00 0.00 57.70 57.52 2k6h n MET 222 Cb 0.14 -1.70 0.41 0.00 2.15 0.00 0.00 33.22 34.22 2k6h n MET 222 CO 0.00 0.00 0.00 1.96 -0.73 0.00 0.00 175.97 177.20 2k6h h GLN 223 N 0.00 0.56 0.00 2.12 4.20 -1.35 -1.15 115.11 119.49 2k6h h GLN 223 Ca -0.16 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.51 2k6h h GLN 223 Cb 1.47 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.13 2k6h h GLN 223 CO 0.03 0.38 0.00 0.87 -0.67 0.00 0.00 178.83 179.44 2k6h h LYS 224 N 0.58 0.00 -0.01 1.46 1.57 -1.74 -0.60 116.57 117.83 2k6h h LYS 224 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2k6h h LYS 224 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2k6h h LYS 224 CO -0.03 0.00 -0.09 1.28 -0.57 0.00 0.00 179.45 180.04 2k6h n LEU 225 N -2.64 1.02 0.00 2.94 7.99 -0.45 -4.95 117.00 120.92 2k6h n LEU 225 Ca 0.02 -0.29 0.00 0.00 -0.01 0.00 0.00 56.01 55.73 2k6h n LEU 225 Cb 0.30 -0.07 0.00 0.00 -0.11 0.00 0.00 43.42 43.54 2k6h n LEU 225 CO 0.25 0.18 0.00 0.61 -1.51 0.00 0.00 177.39 176.92 2k6h n GLY 226 N 1.22 2.34 3.51 -0.72 0.00 -0.23 -4.63 105.19 106.68 2k6h n GLY 226 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2k6h n GLY 226 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k6h s ILE 227 N -2.25 4.95 -0.32 -0.61 1.01 -1.19 -4.93 121.20 117.85 2k6h s ILE 227 Ca 0.00 -0.00 0.22 0.00 0.00 0.00 0.00 60.65 60.87 2k6h s ILE 227 Cb 0.00 -4.11 -0.17 0.00 0.01 0.00 0.00 42.46 38.20 2k6h s ILE 227 CO 0.00 -0.47 0.84 2.29 0.00 0.00 0.00 174.94 177.60 2k6h n LYS 228 N 5.95 0.49 -3.96 2.79 0.00 -1.26 -3.07 118.16 119.10 2k6h n LYS 228 Ca -0.04 -0.04 -0.09 0.00 -0.00 0.00 0.00 58.31 58.14 2k6h n LYS 228 Cb 0.48 -1.63 -0.08 0.00 -0.00 0.00 0.00 35.03 33.80 2k6h n LYS 228 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 2k6h s ASP 229 N -4.49 0.14 0.33 -5.58 1.47 -1.26 -4.55 116.67 102.73 2k6h s ASP 229 Ca -0.01 -0.85 0.16 0.00 1.18 0.00 0.00 52.55 53.03 2k6h s ASP 229 Cb 0.13 0.37 0.48 0.00 -0.34 0.00 0.00 42.92 43.56 2k6h s ASP 229 CO 0.84 -0.79 1.64 0.07 0.68 0.00 0.00 175.17 177.61 2k6h h LYS 230 N 2.71 0.00 -0.24 2.11 2.10 -1.95 -1.33 116.57 119.97 2k6h h LYS 230 Ca -0.33 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.13 2k6h h LYS 230 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 2k6h h LYS 230 CO 0.54 0.47 -0.61 -0.91 -2.00 0.00 0.00 179.45 176.94 2k6h h ASN 231 N 0.00 0.94 -0.49 7.07 4.21 -1.98 -0.02 115.58 125.31 2k6h h ASN 231 Ca -0.00 -0.57 0.03 0.00 1.21 0.00 0.00 56.30 56.97 2k6h h ASN 231 Cb 1.06 -0.27 -0.03 0.00 -1.12 0.00 0.00 38.32 37.95 2k6h h ASN 231 CO 0.06 1.34 0.28 -0.08 -1.29 0.00 0.00 177.43 177.74 2k6h h GLU 232 N 0.59 0.54 -0.42 0.81 4.81 -1.94 -1.40 114.58 117.57 2k6h h GLU 232 Ca -0.01 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.25 2k6h h GLU 232 Cb 1.22 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.43 2k6h h GLU 232 CO 0.13 0.36 0.11 0.00 -0.73 0.00 0.00 179.01 178.88 2k6h h ALA 233 N 1.23 0.47 -0.38 2.92 0.00 -1.05 -0.85 119.26 121.60 2k6h h ALA 233 Ca 0.20 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 2k6h h ALA 233 Cb 0.05 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2k6h h ALA 233 CO -0.10 -0.29 0.12 0.00 0.00 0.00 0.00 179.25 178.98 2k6h h ALA 234 N 1.30 1.50 0.01 0.00 0.00 -0.31 -0.30 119.26 121.46 2k6h h ALA 234 Ca 0.20 -0.13 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 2k6h h ALA 234 Cb 0.22 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2k6h h ALA 234 CO -0.24 0.38 -0.95 0.07 0.00 0.00 0.00 179.25 178.51 2k6h h ARG 235 N 0.54 0.04 -0.06 0.00 0.11 -0.97 -3.37 114.38 110.67 2k6h h ARG 235 Ca 0.13 -0.05 -0.22 0.00 0.10 0.00 0.00 59.98 59.94 2k6h h ARG 235 Cb 0.16 0.02 0.01 0.00 1.11 0.00 0.00 29.97 31.27 2k6h h ARG 235 CO -0.01 0.95 -0.82 0.82 0.10 0.00 0.00 179.97 181.02 2k6h h ILE 236 N 0.01 1.31 -3.88 0.08 2.04 -0.15 -3.42 117.51 113.50 2k6h h ILE 236 Ca -0.02 -2.07 -0.68 0.00 1.00 0.00 0.00 64.86 63.08 2k6h h ILE 236 Cb 1.66 2.26 -0.21 0.00 -0.74 0.00 0.00 36.82 39.79 2k6h h ILE 236 CO 0.13 0.64 -0.77 0.68 0.00 0.00 0.00 178.15 178.83 2k6h s VAL 237 N -3.49 3.08 -0.08 1.67 -7.23 -0.22 -0.47 120.40 113.66 2k6h s VAL 237 Ca -0.11 -0.98 -0.14 0.00 -1.81 0.00 0.00 61.98 58.94 2k6h s VAL 237 Cb 0.07 -2.30 -0.28 0.00 0.56 0.00 0.00 36.38 34.43 2k6h s VAL 237 CO 0.89 0.40 0.59 0.00 -0.31 0.00 0.00 175.10 176.67 2k6h h ALA 238 N 4.68 0.18 -2.38 1.32 0.00 -1.22 -3.43 119.26 118.40 2k6h h ALA 238 Ca -0.48 -1.12 -0.19 0.00 0.00 0.00 0.00 54.91 53.13 2k6h h ALA 238 Cb 1.16 0.48 -0.15 0.00 0.00 0.00 0.00 17.79 19.28 2k6h h ALA 238 CO 0.50 0.92 -0.65 -0.51 0.00 0.00 0.00 179.25 179.50 2k6h s LEU 239 N -7.44 1.92 0.14 0.00 1.02 -1.24 -4.18 118.68 108.90 2k6h s LEU 239 Ca -0.19 -1.17 0.04 0.00 0.02 0.00 0.00 54.13 52.83 2k6h s LEU 239 Cb 0.05 0.24 -0.04 0.00 0.02 0.00 0.00 46.19 46.46 2k6h s LEU 239 CO 0.80 -0.69 -0.10 0.68 0.02 0.00 0.00 176.35 177.06 2k6h s VAL 240 N -3.98 1.13 0.80 -1.59 -7.23 -1.14 -4.89 120.40 103.49 2k6h s VAL 240 Ca 0.21 -2.01 -0.12 0.00 -1.81 0.00 0.00 61.98 58.26 2k6h s VAL 240 Cb 0.07 -1.79 0.08 0.00 0.56 0.00 0.00 36.38 35.31 2k6h s VAL 240 CO 0.00 -0.73 1.15 -0.75 -0.31 0.00 0.00 175.10 174.46 2k6h s LYS 241 N -3.64 1.82 0.31 4.82 2.20 -1.26 -2.67 119.74 121.32 2k6h s LYS 241 Ca 0.15 1.50 -0.30 0.00 -0.36 0.00 0.00 55.97 56.96 2k6h s LYS 241 Cb 0.02 -1.82 -0.11 0.00 -1.51 0.00 0.00 37.83 34.40 2k6h s LYS 241 CO 0.00 -2.02 1.59 1.21 -0.36 0.00 0.00 175.35 175.76 2k6h s ASN 242 N -2.66 6.35 -0.32 1.43 3.84 -1.26 -4.67 114.94 117.65 2k6h s ASN 242 Ca 0.67 2.99 -0.02 0.00 0.21 0.00 0.00 52.86 56.72 2k6h s ASN 242 Cb -0.23 -2.64 0.11 0.00 -0.55 0.00 0.00 41.25 37.94 2k6h s ASN 242 CO 0.52 -0.92 0.13 -1.10 -2.79 0.00 0.00 177.10 172.94 2k6h s GLN 243 N -0.79 0.54 0.62 0.43 -1.52 -1.26 -5.06 119.66 112.62 2k6h s GLN 243 Ca 0.62 -0.96 -0.19 0.00 -1.95 0.00 0.00 55.36 52.88 2k6h s GLN 243 Cb -0.48 -1.62 -0.03 0.00 -0.22 0.00 0.00 33.01 30.66 2k6h s GLN 243 CO 0.51 -1.04 1.14 2.41 -0.25 0.00 0.00 175.29 178.07 2k6h n THR 244 N 4.82 4.26 -1.85 -0.19 -1.04 -1.26 -4.87 114.28 114.16 2k6h n THR 244 Ca -0.01 -0.50 -0.26 0.00 -2.04 0.00 0.00 64.05 61.24 2k6h n THR 244 Cb 0.41 -1.34 -0.05 0.00 -1.82 0.00 0.00 70.33 67.52 2k6h n THR 244 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2k6h s THR 245 N -1.43 3.25 -0.48 12.58 2.01 -1.26 -4.91 115.64 125.40 2k6h s THR 245 Ca 0.78 -0.12 -0.27 0.00 0.31 0.00 0.00 61.69 62.39 2k6h s THR 245 Cb -0.40 -3.59 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 2k6h s THR 245 CO 0.44 -0.56 1.90 0.00 -0.69 0.00 0.00 174.62 175.71 2k6h s ALA 246 N 11.56 2.41 -0.90 7.40 0.00 -1.26 -4.93 121.76 136.03 2k6h s ALA 246 Ca 0.79 -0.18 -0.24 0.00 0.00 0.00 0.00 51.96 52.33 2k6h s ALA 246 Cb -0.11 -4.19 -0.00 0.00 0.00 0.00 0.00 23.12 18.82 2k6h s ALA 246 CO 0.09 -3.42 1.70 0.00 0.00 0.00 0.00 175.76 174.12 2k6h s ALA 247 N 8.51 2.19 0.00 0.00 0.00 -1.26 -5.23 121.76 125.97 2k6h s ALA 247 Ca 0.76 -1.68 0.00 0.00 0.00 0.00 0.00 51.96 51.04 2k6h s ALA 247 Cb -0.17 -4.50 0.00 0.00 0.00 0.00 0.00 23.12 18.45 2k6h s ALA 247 CO 0.27 -4.16 0.02 0.00 0.00 0.00 0.00 175.76 171.89