#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k6m s LYS 2 N 0.00 3.95 -0.01 -2.82 2.20 -0.46 -4.98 119.74 117.61 3k6m s LYS 2 Ca 0.00 -0.35 -0.12 0.00 -0.36 0.00 0.00 55.97 55.14 3k6m s LYS 2 Cb 0.00 -3.32 -0.05 0.00 -1.51 0.00 0.00 37.83 32.95 3k6m s LYS 2 CO 0.00 0.15 0.35 -0.06 -0.36 0.00 0.00 175.35 175.43 3k6m s PHE 3 N 0.74 3.68 0.07 4.03 0.40 -1.26 -0.92 117.98 124.73 3k6m s PHE 3 Ca 0.05 0.87 0.07 0.00 -0.60 0.00 0.00 56.93 57.32 3k6m s PHE 3 Cb -0.13 -2.20 -0.03 0.00 0.51 0.00 0.00 43.02 41.17 3k6m s PHE 3 CO 0.02 0.65 -0.19 0.71 0.70 0.00 0.00 175.22 177.10 3k6m s TYR 4 N -1.12 1.68 -0.13 0.36 1.51 0.04 -4.92 117.35 114.78 3k6m s TYR 4 Ca 0.23 -0.40 0.05 0.00 -1.01 0.00 0.00 57.07 55.95 3k6m s TYR 4 Cb -0.15 -0.96 -0.23 0.00 -0.11 0.00 0.00 41.96 40.50 3k6m s TYR 4 CO 0.12 0.14 0.32 2.41 -1.11 0.00 0.00 175.55 177.43 3k6m n THR 5 N 1.45 1.61 -3.59 -0.71 -1.04 -1.26 -4.07 114.28 106.67 3k6m n THR 5 Ca -0.19 -0.73 -0.40 0.00 -2.04 0.00 0.00 64.05 60.70 3k6m n THR 5 Cb 0.54 -1.23 -0.11 0.00 -1.82 0.00 0.00 70.33 67.71 3k6m n THR 5 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3k6m s ASP 6 N -6.37 5.79 0.34 8.00 3.68 -1.26 -4.81 116.67 122.04 3k6m s ASP 6 Ca -0.16 -0.55 0.05 0.00 2.13 0.00 0.00 52.55 54.02 3k6m s ASP 6 Cb 0.07 -2.06 0.69 0.00 -1.45 0.00 0.00 42.92 40.17 3k6m s ASP 6 CO 0.77 -0.24 1.91 0.00 0.13 0.00 0.00 175.17 177.74 3k6m h ALA 7 N 8.43 1.67 -0.89 3.66 0.00 -1.92 -1.64 119.26 128.56 3k6m h ALA 7 Ca -0.31 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 3k6m h ALA 7 Cb 1.15 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 3k6m h ALA 7 CO 0.63 0.16 0.47 0.28 0.00 0.00 0.00 179.25 180.79 3k6m h VAL 8 N 0.84 1.26 -0.29 0.00 2.07 -1.91 -1.92 116.25 116.30 3k6m h VAL 8 Ca 0.39 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 3k6m h VAL 8 Cb 0.39 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 3k6m h VAL 8 CO -0.16 0.30 0.10 -0.33 0.02 0.00 0.00 177.57 177.51 3k6m h GLU 9 N 1.25 0.41 0.00 1.57 4.39 -1.73 0.33 114.58 120.80 3k6m h GLU 9 Ca 0.31 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.92 3k6m h GLU 9 Cb 0.06 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 3k6m h GLU 9 CO -0.05 0.36 -0.20 0.00 -1.16 0.00 0.00 179.01 177.96 3k6m h ALA 10 N 1.71 1.01 -0.03 3.43 0.00 -1.14 -3.25 119.26 120.99 3k6m h ALA 10 Ca 0.10 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3k6m h ALA 10 Cb 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3k6m h ALA 10 CO -0.01 0.25 0.00 1.33 0.00 0.00 0.00 179.25 180.82 3k6m n VAL 11 N -3.34 0.68 0.30 0.00 0.24 -0.77 -4.81 118.33 110.63 3k6m n VAL 11 Ca 0.00 -0.84 0.17 0.00 -2.04 0.00 0.00 64.34 61.64 3k6m n VAL 11 Cb 0.42 0.67 0.77 0.00 -1.47 0.00 0.00 33.84 34.23 3k6m n VAL 11 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 3k6m h LYS 12 N 0.25 0.00 -0.69 7.34 2.10 -1.00 -2.78 116.57 121.80 3k6m h LYS 12 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3k6m h LYS 12 Cb 0.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 3k6m h LYS 12 CO 0.00 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.05 3k6m n ASP 13 N -2.89 4.00 -4.67 7.07 3.85 -1.26 -4.90 116.55 117.74 3k6m n ASP 13 Ca -0.00 -2.13 -0.42 0.00 -0.71 0.00 0.00 54.79 51.53 3k6m n ASP 13 Cb 0.22 -0.50 -0.03 0.00 -1.35 0.00 0.00 41.12 39.47 3k6m n ASP 13 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 3k6m s ILE 14 N -1.30 3.78 0.53 2.12 1.01 -1.05 -4.98 121.20 121.31 3k6m s ILE 14 Ca 0.47 1.06 -0.13 0.00 0.00 0.00 0.00 60.65 62.06 3k6m s ILE 14 Cb 0.27 -3.68 -0.06 0.00 0.01 0.00 0.00 42.46 38.99 3k6m s ILE 14 CO 0.29 -0.05 0.95 -2.16 0.00 0.00 0.00 174.94 173.97 3k6m s PRO 15 N 3.13 3.78 0.34 2.79 0.04 -1.26 -4.91 135.00 138.90 3k6m s PRO 15 Ca 0.65 0.75 -0.28 0.00 0.04 0.00 0.00 61.00 62.16 3k6m s PRO 15 Cb -0.30 -2.18 -0.12 0.00 0.04 0.00 0.00 34.50 31.94 3k6m s PRO 15 CO 0.25 -0.32 1.28 0.09 0.04 0.00 0.00 177.00 178.33 3k6m n ASN 16 N -1.97 2.69 0.00 6.66 3.02 -1.26 -2.25 115.26 122.15 3k6m n ASN 16 Ca 0.05 1.21 0.00 0.00 -0.03 0.00 0.00 54.58 55.81 3k6m n ASN 16 Cb 0.54 -1.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.24 3k6m n ASN 16 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k6m n GLY 17 N 0.79 0.84 3.69 7.41 0.00 -0.22 -4.99 105.19 112.70 3k6m n GLY 17 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 3k6m n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k6m n ALA 18 N -0.11 0.78 -2.65 4.61 0.00 -0.96 -4.51 120.51 117.67 3k6m n ALA 18 Ca 0.00 -0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.05 3k6m n ALA 18 Cb 0.00 -2.24 -0.08 0.00 0.00 0.00 0.00 19.45 17.12 3k6m n ALA 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3k6m s THR 19 N -1.44 5.22 -0.11 0.00 2.01 -1.26 -1.21 115.64 118.85 3k6m s THR 19 Ca 0.81 0.59 0.01 0.00 0.31 0.00 0.00 61.69 63.41 3k6m s THR 19 Cb -0.39 -3.69 0.02 0.00 0.01 0.00 0.00 72.50 68.45 3k6m s THR 19 CO 0.42 0.24 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.77 3k6m s VAL 20 N 1.49 1.34 -0.04 3.82 1.01 0.14 -0.42 120.40 127.73 3k6m s VAL 20 Ca 0.16 -0.53 -0.22 0.00 0.00 0.00 0.00 61.98 61.39 3k6m s VAL 20 Cb -0.15 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 3k6m s VAL 20 CO 0.08 0.41 0.63 -0.76 0.00 0.00 0.00 175.10 175.46 3k6m s LEU 21 N 1.14 4.36 -0.17 3.92 1.43 0.15 -1.02 118.68 128.49 3k6m s LEU 21 Ca -0.04 1.14 0.01 0.00 -1.03 0.00 0.00 54.13 54.20 3k6m s LEU 21 Cb -0.14 -2.97 0.03 0.00 0.03 0.00 0.00 46.19 43.13 3k6m s LEU 21 CO -0.03 -0.01 -0.15 -0.69 0.23 0.00 0.00 176.35 175.70 3k6m s VAL 22 N 0.34 1.75 0.94 -1.59 1.01 0.13 0.01 120.40 122.99 3k6m s VAL 22 Ca 0.33 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 3k6m s VAL 22 Cb -0.18 -1.67 0.15 0.00 0.00 0.00 0.00 36.38 34.68 3k6m s VAL 22 CO 0.17 0.40 1.09 -0.83 0.00 0.00 0.00 175.10 175.92 3k6m s GLY 23 N 1.40 1.60 0.00 4.51 0.00 -0.50 -4.38 107.32 109.95 3k6m s GLY 23 Ca 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.62 3k6m s GLY 23 CO -0.11 0.40 0.00 0.61 0.00 0.00 0.00 173.10 174.01 3k6m n GLY 24 N -0.99 3.35 2.91 0.20 0.00 -1.19 -4.41 105.19 105.06 3k6m n GLY 24 Ca 0.06 -1.82 -0.28 0.00 0.00 0.00 0.00 46.02 43.99 3k6m n GLY 24 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3k6m s PHE 25 N -2.29 1.75 0.00 1.61 5.36 -0.55 -4.42 117.98 119.44 3k6m s PHE 25 Ca 0.00 -1.06 0.00 0.00 -0.96 0.00 0.00 56.93 54.91 3k6m s PHE 25 Cb 0.00 -1.35 0.00 0.00 -0.34 0.00 0.00 43.02 41.33 3k6m s PHE 25 CO 0.00 -0.61 0.00 0.41 -1.46 0.00 0.00 175.22 173.56 3k6m n GLY 26 N 4.87 3.90 1.27 13.12 0.00 -1.26 -0.60 105.19 126.49 3k6m n GLY 26 Ca -0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.98 3k6m n GLY 26 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k6m n LEU 27 N 0.00 4.17 -4.59 0.99 4.77 -1.26 -4.58 117.00 116.50 3k6m n LEU 27 Ca 0.00 -2.37 -0.40 0.00 -0.03 0.00 0.00 56.01 53.21 3k6m n LEU 27 Cb 0.00 -0.49 -0.08 0.00 -2.33 0.00 0.00 43.42 40.52 3k6m n LEU 27 CO 0.00 0.80 0.20 0.00 -1.33 0.00 0.00 177.39 177.06 3k6m n GLY 29 N 4.62 0.12 3.83 0.00 0.00 -1.26 -1.48 105.19 111.01 3k6m n GLY 29 Ca -0.05 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 3k6m n GLY 29 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k6m s ILE 30 N -3.14 4.99 -1.27 -0.61 -4.36 -1.26 -3.15 121.20 112.41 3k6m s ILE 30 Ca 0.30 0.90 -0.18 0.00 -0.26 0.00 0.00 60.65 61.41 3k6m s ILE 30 Cb -0.13 -3.74 0.01 0.00 1.25 0.00 0.00 42.46 39.84 3k6m s ILE 30 CO 0.38 0.56 1.97 -0.81 0.24 0.00 0.00 174.94 177.28 3k6m n PRO 31 N 1.90 2.62 -0.04 0.37 -0.04 -1.26 -4.79 135.00 133.76 3k6m n PRO 31 Ca -0.13 -2.73 -0.06 0.00 -0.04 0.00 0.00 63.50 60.54 3k6m n PRO 31 Cb 0.52 -3.37 0.13 0.00 -0.04 0.00 0.00 33.50 30.74 3k6m n PRO 31 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 3k6m h GLU 32 N 7.34 0.64 -0.18 0.54 4.11 -1.94 -0.79 114.58 124.31 3k6m h GLU 32 Ca 0.46 -0.26 -0.14 0.00 0.07 0.00 0.00 59.36 59.48 3k6m h GLU 32 Cb 0.77 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 3k6m h GLU 32 CO 1.65 0.84 -0.49 -0.91 0.07 0.00 0.00 179.01 180.17 3k6m h ASN 33 N 0.56 0.52 0.07 3.06 2.35 -1.86 -1.47 115.58 118.81 3k6m h ASN 33 Ca 0.08 -0.26 -0.21 0.00 -0.55 0.00 0.00 56.30 55.36 3k6m h ASN 33 Cb 0.73 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.96 3k6m h ASN 33 CO 0.06 0.93 -0.79 -0.07 -1.65 0.00 0.00 177.43 175.90 3k6m h LEU 34 N 0.38 0.72 -0.53 1.61 3.38 -1.88 -1.03 115.31 117.95 3k6m h LEU 34 Ca 0.02 -0.49 0.02 0.00 0.09 0.00 0.00 57.88 57.52 3k6m h LEU 34 Cb 1.00 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 3k6m h LEU 34 CO 0.09 1.26 0.34 0.40 0.09 0.00 0.00 178.44 180.62 3k6m h ILE 35 N 0.40 1.09 -0.90 1.22 2.04 -1.15 -1.70 117.51 118.50 3k6m h ILE 35 Ca -0.05 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.63 3k6m h ILE 35 Cb 1.40 0.36 -0.06 0.00 -0.74 0.00 0.00 36.82 37.79 3k6m h ILE 35 CO 0.15 0.12 0.59 1.23 0.00 0.00 0.00 178.15 180.24 3k6m h GLY 36 N 0.67 1.30 1.09 5.37 0.00 -1.02 -1.88 103.07 108.61 3k6m h GLY 36 Ca 0.21 -0.43 -0.11 0.00 0.00 0.00 0.00 47.33 47.00 3k6m h GLY 36 CO -0.07 0.34 -0.08 0.00 0.00 0.00 0.00 176.54 176.72 3k6m h ALA 37 N 1.49 0.77 -0.34 3.60 0.00 -0.68 -2.50 119.26 121.60 3k6m h ALA 37 Ca 0.37 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3k6m h ALA 37 Cb 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3k6m h ALA 37 CO -0.13 0.67 0.09 -0.07 0.00 0.00 0.00 179.25 179.81 3k6m h LEU 38 N 0.93 0.44 -1.24 0.00 3.38 -0.58 -1.21 115.31 117.03 3k6m h LEU 38 Ca 0.15 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 3k6m h LEU 38 Cb 0.65 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3k6m h LEU 38 CO 0.05 0.44 0.13 -0.07 0.09 0.00 0.00 178.44 179.08 3k6m h LEU 39 N 0.48 0.60 -0.20 1.67 3.38 -0.94 -0.93 115.31 119.38 3k6m h LEU 39 Ca 0.12 -0.08 -0.19 0.00 0.09 0.00 0.00 57.88 57.81 3k6m h LEU 39 Cb 0.18 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.78 3k6m h LEU 39 CO -0.01 0.58 -0.63 0.11 0.09 0.00 0.00 178.44 178.59 3k6m h LYS 40 N 0.64 0.77 0.00 1.13 1.57 -0.99 -3.25 116.57 116.44 3k6m h LYS 40 Ca 0.15 -0.57 -0.12 0.00 -1.87 0.00 0.00 60.65 58.24 3k6m h LYS 40 Cb 0.21 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 3k6m h LYS 40 CO -0.01 1.19 -0.56 1.79 -0.57 0.00 0.00 179.45 181.29 3k6m h THR 41 N 0.51 1.23 -0.08 -0.16 1.35 -1.06 -3.47 112.91 111.24 3k6m h THR 41 Ca -0.02 -2.05 -0.03 0.00 -0.55 0.00 0.00 66.41 63.76 3k6m h THR 41 Cb 1.25 2.16 -0.01 0.00 -1.73 0.00 0.00 68.15 69.81 3k6m h THR 41 CO 0.13 0.55 -0.03 0.61 -0.25 0.00 0.00 175.52 176.53 3k6m n GLY 42 N 0.42 0.49 3.66 5.82 0.00 -0.37 -4.98 105.19 110.22 3k6m n GLY 42 Ca -0.00 -0.21 -0.44 0.00 0.00 0.00 0.00 46.02 45.37 3k6m n GLY 42 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3k6m n VAL 43 N -2.75 1.87 -4.31 1.61 3.14 -1.25 -4.96 118.33 111.68 3k6m n VAL 43 Ca -0.02 -0.47 -0.18 0.00 -2.96 0.00 0.00 64.34 60.72 3k6m n VAL 43 Cb 0.16 -1.36 -0.06 0.00 -1.06 0.00 0.00 33.84 31.52 3k6m n VAL 43 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 3k6m n LYS 44 N 0.78 0.48 -2.84 1.45 2.85 -1.26 -4.77 118.16 114.85 3k6m n LYS 44 Ca 0.07 -2.71 -0.21 0.00 -1.05 0.00 0.00 58.31 54.41 3k6m n LYS 44 Cb 0.34 1.86 0.01 0.00 -0.65 0.00 0.00 35.03 36.59 3k6m n LYS 44 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3k6m n GLU 45 N -0.62 -3.55 -2.36 -1.58 1.02 -0.91 -1.06 120.64 111.59 3k6m n GLU 45 Ca 0.01 0.84 -0.38 0.00 -0.02 0.00 0.00 57.16 57.61 3k6m n GLU 45 Cb 0.49 -5.60 -0.03 0.00 -0.02 0.00 0.00 31.44 26.28 3k6m n GLU 45 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3k6m s LEU 46 N -6.37 4.22 -0.38 -4.62 1.43 -0.22 -3.61 118.68 109.12 3k6m s LEU 46 Ca 0.20 2.27 -0.17 0.00 -1.03 0.00 0.00 54.13 55.41 3k6m s LEU 46 Cb -0.09 -4.02 0.00 0.00 0.03 0.00 0.00 46.19 42.11 3k6m s LEU 46 CO 0.25 -0.58 0.43 -0.89 0.23 0.00 0.00 176.35 175.78 3k6m s THR 47 N -1.44 5.10 -0.28 5.49 2.01 -0.35 -0.58 115.64 125.59 3k6m s THR 47 Ca 0.56 -0.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.38 3k6m s THR 47 Cb -0.29 -3.95 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 3k6m s THR 47 CO 0.36 -0.27 0.16 0.00 -0.69 0.00 0.00 174.62 174.19 3k6m s ALA 48 N 2.15 3.42 -0.42 7.40 0.00 0.04 -0.69 121.76 133.67 3k6m s ALA 48 Ca 0.13 -1.13 -0.17 0.00 0.00 0.00 0.00 51.96 50.80 3k6m s ALA 48 Cb -0.16 -2.38 0.02 0.00 0.00 0.00 0.00 23.12 20.60 3k6m s ALA 48 CO 0.13 -0.57 0.40 0.08 0.00 0.00 0.00 175.76 175.80 3k6m s VAL 49 N 1.72 5.14 -0.17 0.00 1.01 -0.19 -1.08 120.40 126.82 3k6m s VAL 49 Ca 0.07 -0.47 -0.08 0.00 0.00 0.00 0.00 61.98 61.49 3k6m s VAL 49 Cb -0.16 -4.02 0.07 0.00 0.00 0.00 0.00 36.38 32.27 3k6m s VAL 49 CO 0.09 -0.40 0.40 -0.55 0.00 0.00 0.00 175.10 174.64 3k6m s SER 50 N 1.81 -0.42 0.23 3.32 0.15 -0.41 -0.69 113.70 117.70 3k6m s SER 50 Ca 0.10 0.89 -0.06 0.00 0.70 0.00 0.00 55.95 57.58 3k6m s SER 50 Cb -0.18 0.89 0.35 0.00 -1.71 0.00 0.00 66.02 65.37 3k6m s SER 50 CO 0.12 -0.20 1.80 -1.13 1.20 0.00 0.00 173.24 175.03 3k6m h ASN 51 N 7.41 0.61 -2.25 5.45 -1.24 -1.77 -3.33 115.58 120.47 3k6m h ASN 51 Ca -0.31 0.05 -0.61 0.00 0.71 0.00 0.00 56.30 56.14 3k6m h ASN 51 Cb 1.16 -0.07 -0.13 0.00 0.73 0.00 0.00 38.32 40.01 3k6m h ASN 51 CO 0.25 0.36 -0.50 0.20 -1.29 0.00 0.00 177.43 176.45 3k6m s ASN 52 N -5.59 3.27 -0.28 1.15 -0.87 -1.26 -1.17 114.94 110.18 3k6m s ASN 52 Ca -0.12 -1.70 0.12 0.00 -1.57 0.00 0.00 52.86 49.58 3k6m s ASN 52 Cb 0.18 0.58 0.68 0.00 -0.02 0.00 0.00 41.25 42.67 3k6m s ASN 52 CO 0.77 -0.94 1.68 0.00 -2.57 0.00 0.00 177.10 176.04 3k6m n ALA 53 N -1.05 4.17 -0.94 0.60 0.00 -1.25 -4.86 120.51 117.18 3k6m n ALA 53 Ca -0.11 -2.41 0.00 0.00 0.00 0.00 0.00 53.44 50.92 3k6m n ALA 53 Cb 0.65 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 19.04 3k6m n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k6m n GLY 54 N -0.29 2.96 3.47 0.00 0.00 -1.26 -2.99 105.19 107.08 3k6m n GLY 54 Ca 0.35 -0.33 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 3k6m n GLY 54 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k6m s VAL 55 N 0.00 0.58 0.29 1.61 -7.23 -0.92 -4.67 120.40 110.06 3k6m s VAL 55 Ca 0.00 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.21 3k6m s VAL 55 Cb 0.00 -2.41 0.29 0.00 0.56 0.00 0.00 36.38 34.82 3k6m s VAL 55 CO 0.00 0.00 1.78 0.44 -0.31 0.00 0.00 175.10 177.01 3k6m h ASP 56 N 1.88 0.74 -0.16 4.85 5.19 -1.85 -2.69 116.42 124.38 3k6m h ASP 56 Ca -0.35 0.09 -0.06 0.00 -0.62 0.00 0.00 57.03 56.09 3k6m h ASP 56 Cb 1.27 -0.04 -0.04 0.00 0.18 0.00 0.00 39.33 40.70 3k6m h ASP 56 CO 0.56 0.28 -0.17 -0.46 -3.12 0.00 0.00 179.24 176.33 3k6m n ASN 57 N -4.78 2.44 -3.49 6.45 6.94 -1.26 -4.06 115.26 117.50 3k6m n ASN 57 Ca 0.22 -3.55 -0.14 0.00 -0.02 0.00 0.00 54.58 51.08 3k6m n ASN 57 Cb 0.52 -0.55 -0.04 0.00 -2.36 0.00 0.00 39.78 37.36 3k6m n ASN 57 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 3k6m s PHE 58 N -3.10 -0.54 0.00 -2.53 5.36 -1.02 -4.78 117.98 111.37 3k6m s PHE 58 Ca 0.40 0.56 0.00 0.00 -0.96 0.00 0.00 56.93 56.93 3k6m s PHE 58 Cb 0.36 0.46 0.00 0.00 -0.34 0.00 0.00 43.02 43.50 3k6m s PHE 58 CO -0.00 -0.74 0.00 0.41 -1.46 0.00 0.00 175.22 173.43 3k6m n GLY 59 N 0.14 2.57 0.33 13.12 0.00 -1.26 -2.17 105.19 117.92 3k6m n GLY 59 Ca -0.18 -0.44 0.16 0.00 0.00 0.00 0.00 46.02 45.56 3k6m n GLY 59 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3k6m h LEU 60 N 0.00 0.00 -1.42 0.99 5.85 -1.88 -1.93 115.31 116.93 3k6m h LEU 60 Ca 0.00 0.00 0.18 0.00 0.84 0.00 0.00 57.88 58.90 3k6m h LEU 60 Cb 0.00 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 40.96 3k6m h LEU 60 CO 0.00 0.00 0.58 1.23 -0.34 0.00 0.00 178.44 179.91 3k6m h GLY 61 N 0.00 1.01 1.52 3.75 0.00 -1.41 -1.04 103.07 106.90 3k6m h GLY 61 Ca 0.13 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 3k6m h GLY 61 CO -0.00 0.03 0.29 1.41 0.00 0.00 0.00 176.54 178.27 3k6m h LEU 62 N 0.51 0.56 0.00 3.11 3.38 -1.49 -0.56 115.31 120.83 3k6m h LEU 62 Ca 0.46 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.40 3k6m h LEU 62 Cb 0.97 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3k6m h LEU 62 CO -0.19 0.42 -0.10 -0.07 0.09 0.00 0.00 178.44 178.59 3k6m h LEU 63 N 0.65 0.00 0.06 1.67 3.38 -1.37 -2.60 115.31 117.11 3k6m h LEU 63 Ca 0.17 -0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.85 3k6m h LEU 63 Cb -0.04 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.74 3k6m h LEU 63 CO -0.03 0.00 -1.17 -0.07 0.09 0.00 0.00 178.44 177.25 3k6m h LEU 64 N 0.00 0.86 -1.52 1.67 3.38 -1.13 -0.20 115.31 118.37 3k6m h LEU 64 Ca 0.00 -0.76 -0.00 0.00 0.09 0.00 0.00 57.88 57.21 3k6m h LEU 64 Cb 0.97 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 3k6m h LEU 64 CO 0.00 1.56 0.24 1.56 0.09 0.00 0.00 178.44 181.89 3k6m h GLN 65 N 0.30 0.56 -0.06 1.13 4.20 -0.90 -0.69 115.11 119.66 3k6m h GLN 65 Ca -0.16 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.50 3k6m h GLN 65 Cb 1.84 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.50 3k6m h GLN 65 CO 0.22 0.41 0.00 -1.13 -0.67 0.00 0.00 178.83 177.66 3k6m n SER 66 N -4.44 1.43 -3.56 1.46 3.41 -1.00 -4.95 113.62 105.97 3k6m n SER 66 Ca 0.03 -1.53 -0.25 0.00 -0.26 0.00 0.00 58.87 56.86 3k6m n SER 66 Cb 0.09 -0.03 0.05 0.00 -0.26 0.00 0.00 64.21 64.06 3k6m n SER 66 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3k6m n LYS 67 N 0.13 -6.40 0.00 4.33 4.76 -0.27 -4.90 118.16 115.81 3k6m n LYS 67 Ca 0.18 0.76 0.12 0.00 -2.87 0.00 0.00 58.31 56.50 3k6m n LYS 67 Cb 0.33 -5.71 0.17 0.00 -1.84 0.00 0.00 35.03 27.98 3k6m n LYS 67 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3k6m n GLN 68 N -4.65 0.20 -4.35 1.97 6.02 -0.11 -4.69 117.38 111.77 3k6m n GLN 68 Ca -0.01 -0.13 -0.34 0.00 -0.01 0.00 0.00 57.00 56.51 3k6m n GLN 68 Cb 0.56 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 30.21 3k6m n GLN 68 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3k6m s ILE 69 N -2.89 4.11 -0.25 5.09 1.01 -1.23 -1.06 121.20 125.98 3k6m s ILE 69 Ca 0.13 -0.29 0.03 0.00 0.00 0.00 0.00 60.65 60.51 3k6m s ILE 69 Cb 0.17 -2.79 -0.17 0.00 0.01 0.00 0.00 42.46 39.69 3k6m s ILE 69 CO 0.70 0.52 -0.21 1.17 0.00 0.00 0.00 174.94 177.12 3k6m n LYS 70 N 3.17 0.64 -3.87 2.79 4.81 0.25 -4.81 118.16 121.14 3k6m n LYS 70 Ca -0.17 0.14 -0.12 0.00 -0.87 0.00 0.00 58.31 57.29 3k6m n LYS 70 Cb 0.53 -1.51 -0.14 0.00 0.02 0.00 0.00 35.03 33.93 3k6m n LYS 70 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 3k6m s ARG 71 N -2.51 0.01 0.14 1.64 3.52 -1.00 -1.39 118.95 119.36 3k6m s ARG 71 Ca -0.33 -0.00 0.09 0.00 -0.13 0.00 0.00 55.73 55.35 3k6m s ARG 71 Cb 0.09 -0.00 -0.04 0.00 -1.56 0.00 0.00 34.95 33.43 3k6m s ARG 71 CO 0.60 0.00 -0.20 -1.64 -0.81 0.00 0.00 175.30 173.25 3k6m s MET 72 N -0.00 1.22 -0.15 5.12 -1.94 -0.20 -0.78 119.30 122.57 3k6m s MET 72 Ca -0.00 -1.31 -0.00 0.00 -1.71 0.00 0.00 55.69 52.66 3k6m s MET 72 Cb -0.00 -1.38 0.03 0.00 2.01 0.00 0.00 34.83 35.50 3k6m s MET 72 CO -0.00 0.30 -0.08 0.42 -0.01 0.00 0.00 175.02 175.65 3k6m s ILE 73 N -1.67 1.23 0.14 2.53 1.01 -0.24 -1.27 121.20 122.93 3k6m s ILE 73 Ca 0.12 -0.59 -0.17 0.00 0.00 0.00 0.00 60.65 60.01 3k6m s ILE 73 Cb -0.08 -1.31 0.04 0.00 0.01 0.00 0.00 42.46 41.12 3k6m s ILE 73 CO 0.06 0.25 0.44 -0.44 0.00 0.00 0.00 174.94 175.24 3k6m s SER 74 N 1.60 -0.27 -0.10 3.58 0.01 -0.93 -1.29 113.70 116.29 3k6m s SER 74 Ca 0.02 -0.32 0.15 0.00 1.31 0.00 0.00 55.95 57.11 3k6m s SER 74 Cb -0.14 0.50 -0.22 0.00 0.21 0.00 0.00 66.02 66.37 3k6m s SER 74 CO -0.08 -0.90 0.18 -1.54 0.41 0.00 0.00 173.24 171.31 3k6m n SER 75 N -0.26 1.22 -3.68 2.44 3.41 -0.32 -0.42 113.62 116.01 3k6m n SER 75 Ca -0.15 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.37 3k6m n SER 75 Cb 0.64 1.23 -0.10 0.00 -0.26 0.00 0.00 64.21 65.72 3k6m n SER 75 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3k6m s TYR 76 N -2.68 -0.74 -0.09 7.33 5.04 -1.08 -0.95 117.35 124.17 3k6m s TYR 76 Ca -0.07 1.50 0.13 0.00 -2.44 0.00 0.00 57.07 56.19 3k6m s TYR 76 Cb 0.07 0.34 0.26 0.00 0.35 0.00 0.00 41.96 42.98 3k6m s TYR 76 CO 0.65 -0.42 1.13 1.33 -1.34 0.00 0.00 175.55 176.90 3k6m n VAL 77 N 4.61 1.20 -1.32 3.14 0.24 0.45 -3.83 118.33 122.82 3k6m n VAL 77 Ca -0.19 -1.70 -0.29 0.00 -2.04 0.00 0.00 64.34 60.13 3k6m n VAL 77 Cb 0.54 0.13 0.18 0.00 -1.47 0.00 0.00 33.84 33.22 3k6m n VAL 77 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3k6m s GLY 78 N -2.34 1.59 -1.50 7.63 0.00 -1.26 -4.27 107.32 107.18 3k6m s GLY 78 Ca 0.25 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.33 3k6m s GLY 78 CO -0.03 0.04 0.00 1.18 0.00 0.00 0.00 173.10 174.30 3k6m n GLU 79 N -4.17 -1.29 -3.49 2.90 4.71 -1.26 -4.78 120.64 113.26 3k6m n GLU 79 Ca 0.08 0.87 -0.24 0.00 -0.01 0.00 0.00 57.16 57.86 3k6m n GLU 79 Cb 0.59 -5.24 -0.13 0.00 -1.01 0.00 0.00 31.44 25.64 3k6m n GLU 79 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 3k6m s ASN 80 N -2.38 2.81 0.28 1.62 3.84 -1.26 -4.01 114.94 115.85 3k6m s ASN 80 Ca 0.00 -1.09 0.03 0.00 0.21 0.00 0.00 52.86 52.01 3k6m s ASN 80 Cb 0.00 -0.02 0.42 0.00 -0.55 0.00 0.00 41.25 41.10 3k6m s ASN 80 CO 0.00 -0.42 1.72 0.00 -2.79 0.00 0.00 177.10 175.61 3k6m h ALA 81 N 8.34 1.11 -0.47 1.71 0.00 -1.93 -2.67 119.26 125.35 3k6m h ALA 81 Ca -0.17 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 3k6m h ALA 81 Cb 1.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3k6m h ALA 81 CO 0.40 0.56 0.22 1.49 0.00 0.00 0.00 179.25 181.91 3k6m h GLU 82 N 0.39 0.69 -0.27 0.00 4.57 -1.95 -1.25 114.58 116.76 3k6m h GLU 82 Ca 0.06 -0.11 0.06 0.00 -1.18 0.00 0.00 59.36 58.19 3k6m h GLU 82 Cb 0.68 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 29.09 3k6m h GLU 82 CO 0.05 0.60 -0.15 0.35 -1.18 0.00 0.00 179.01 178.68 3k6m h PHE 83 N 0.62 -0.36 -0.28 0.92 3.57 -1.90 -1.71 116.94 117.80 3k6m h PHE 83 Ca 0.16 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.70 3k6m h PHE 83 Cb 0.14 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 3k6m h PHE 83 CO -0.00 -0.22 0.16 1.49 -2.23 0.00 0.00 178.31 177.51 3k6m h GLU 84 N -0.12 0.33 -0.43 1.11 4.81 -1.14 -0.23 114.58 118.90 3k6m h GLU 84 Ca 0.14 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 3k6m h GLU 84 Cb 0.33 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 3k6m h GLU 84 CO -0.34 0.22 0.25 -0.09 -0.73 0.00 0.00 179.01 178.32 3k6m h ARG 85 N 0.33 0.50 -0.42 1.92 2.43 -1.06 -0.67 114.38 117.41 3k6m h ARG 85 Ca 0.11 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 3k6m h ARG 85 Cb -0.01 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 3k6m h ARG 85 CO -0.05 0.33 0.01 1.96 -1.51 0.00 0.00 179.97 180.71 3k6m h GLN 86 N 0.51 0.74 -0.12 0.20 4.20 -1.00 -1.65 115.11 118.01 3k6m h GLN 86 Ca 0.17 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 3k6m h GLN 86 Cb 0.01 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 3k6m h GLN 86 CO -0.08 0.81 0.03 -0.92 -0.67 0.00 0.00 178.83 178.01 3k6m h TYR 87 N 0.58 0.19 0.00 2.96 3.20 -0.92 -0.26 116.97 122.72 3k6m h TYR 87 Ca 0.12 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 3k6m h TYR 87 Cb 0.47 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 3k6m h TYR 87 CO 0.04 0.34 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.66 3k6m h LEU 88 N -0.01 0.00 -0.04 2.82 3.38 -1.04 -2.24 115.31 118.18 3k6m h LEU 88 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3k6m h LEU 88 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3k6m h LEU 88 CO -0.00 0.16 -0.09 0.00 0.09 0.00 0.00 178.44 178.60 3k6m n ALA 89 N -2.45 2.61 -1.06 1.53 0.00 -0.63 -4.83 120.51 115.67 3k6m n ALA 89 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.25 3k6m n ALA 89 Cb 0.23 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.28 3k6m n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k6m n GLY 90 N 1.42 0.46 0.08 0.00 0.00 -0.84 -3.98 105.19 102.33 3k6m n GLY 90 Ca 0.09 -0.95 0.10 0.00 0.00 0.00 0.00 46.02 45.26 3k6m n GLY 90 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k6m n GLU 91 N -2.55 0.19 -4.10 1.61 -0.58 -0.15 -4.79 120.64 110.28 3k6m n GLU 91 Ca 0.00 -0.16 -0.18 0.00 -0.42 0.00 0.00 57.16 56.40 3k6m n GLU 91 Cb 0.08 -1.50 -0.16 0.00 -0.57 0.00 0.00 31.44 29.30 3k6m n GLU 91 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 3k6m s LEU 92 N -2.92 1.41 -0.03 -4.62 2.96 -1.18 -4.85 118.68 109.45 3k6m s LEU 92 Ca 0.10 -0.09 -0.16 0.00 -0.22 0.00 0.00 54.13 53.75 3k6m s LEU 92 Cb 0.16 -0.35 -0.05 0.00 0.50 0.00 0.00 46.19 46.45 3k6m s LEU 92 CO 0.82 -0.04 0.44 -0.70 -1.32 0.00 0.00 176.35 175.55 3k6m s GLU 93 N 0.74 4.09 -0.06 1.98 2.12 -0.48 -4.63 118.70 122.45 3k6m s GLU 93 Ca -0.09 0.44 -0.03 0.00 0.36 0.00 0.00 54.97 55.66 3k6m s GLU 93 Cb -0.12 -3.29 0.04 0.00 0.26 0.00 0.00 34.13 31.02 3k6m s GLU 93 CO -0.00 0.51 0.12 0.08 -0.54 0.00 0.00 175.26 175.43 3k6m s VAL 94 N -0.53 -0.15 -0.39 3.70 1.01 0.24 -1.03 120.40 123.25 3k6m s VAL 94 Ca 0.25 0.31 -0.10 0.00 0.00 0.00 0.00 61.98 62.43 3k6m s VAL 94 Cb -0.16 -0.23 0.04 0.00 0.00 0.00 0.00 36.38 36.04 3k6m s VAL 94 CO 0.13 0.13 0.21 -1.61 0.00 0.00 0.00 175.10 173.96 3k6m s GLU 95 N 1.83 2.74 -0.14 2.72 2.02 -0.40 -4.45 118.70 123.02 3k6m s GLU 95 Ca -0.01 -1.21 -0.29 0.00 0.02 0.00 0.00 54.97 53.48 3k6m s GLU 95 Cb -0.12 -3.73 -0.01 0.00 0.10 0.00 0.00 34.13 30.38 3k6m s GLU 95 CO -0.05 -0.78 1.04 -0.51 0.02 0.00 0.00 175.26 174.98 3k6m s LEU 96 N 1.50 4.21 -0.03 1.80 1.43 -1.26 -2.20 118.68 124.13 3k6m s LEU 96 Ca 0.02 1.52 0.04 0.00 -1.03 0.00 0.00 54.13 54.67 3k6m s LEU 96 Cb -0.20 -3.55 -0.00 0.00 0.03 0.00 0.00 46.19 42.46 3k6m s LEU 96 CO 0.05 -0.53 -0.15 -0.89 0.23 0.00 0.00 176.35 175.07 3k6m s THR 97 N 2.39 1.22 0.39 5.49 2.01 0.44 -4.97 115.64 122.61 3k6m s THR 97 Ca 0.48 -0.60 -0.26 0.00 0.31 0.00 0.00 61.69 61.61 3k6m s THR 97 Cb -0.18 -1.05 -0.11 0.00 0.01 0.00 0.00 72.50 71.17 3k6m s THR 97 CO 0.15 0.36 1.24 -2.65 -0.69 0.00 0.00 174.62 173.02 3k6m n PRO 98 N 3.15 1.90 -0.23 4.92 -0.02 -1.26 -3.67 135.00 139.78 3k6m n PRO 98 Ca -0.18 0.67 -0.04 0.00 -2.02 0.00 0.00 63.50 61.94 3k6m n PRO 98 Cb 0.53 -2.31 0.07 0.00 -0.02 0.00 0.00 33.50 31.78 3k6m n PRO 98 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3k6m h GLN 99 N 2.15 0.77 -0.55 -0.52 4.15 -1.51 0.27 115.11 119.86 3k6m h GLN 99 Ca -0.47 -0.05 -0.10 0.00 0.77 0.00 0.00 58.65 58.81 3k6m h GLN 99 Cb 1.30 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.79 3k6m h GLN 99 CO 0.60 0.51 -0.04 0.78 -1.93 0.00 0.00 178.83 178.75 3k6m h GLY 100 N 0.79 1.05 0.97 2.39 0.00 -1.89 -1.19 103.07 105.19 3k6m h GLY 100 Ca 0.27 -0.78 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 3k6m h GLY 100 CO -0.11 0.72 0.23 -0.84 0.00 0.00 0.00 176.54 176.54 3k6m h THR 101 N 0.89 1.18 -0.33 4.70 2.02 -1.65 -1.48 112.91 118.23 3k6m h THR 101 Ca 0.15 -0.51 0.05 0.00 0.77 0.00 0.00 66.41 66.87 3k6m h THR 101 Cb 0.57 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 3k6m h THR 101 CO 0.03 0.20 0.07 0.25 0.37 0.00 0.00 175.52 176.44 3k6m h LEU 102 N 0.61 0.02 -0.59 2.58 5.85 -0.28 0.97 115.31 124.48 3k6m h LEU 102 Ca 0.16 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 3k6m h LEU 102 Cb 0.11 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 3k6m h LEU 102 CO -0.02 0.05 0.27 0.00 -0.34 0.00 0.00 178.44 178.39 3k6m h ALA 103 N 1.25 0.76 -0.06 1.25 0.00 -1.10 -1.62 119.26 119.73 3k6m h ALA 103 Ca 0.16 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.75 3k6m h ALA 103 Cb 0.17 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3k6m h ALA 103 CO -0.20 0.34 -0.71 1.49 0.00 0.00 0.00 179.25 180.16 3k6m h GLU 104 N 0.80 0.31 -0.59 0.00 4.57 -1.02 -0.72 114.58 117.92 3k6m h GLU 104 Ca 0.20 -0.25 -0.10 0.00 -1.18 0.00 0.00 59.36 58.03 3k6m h GLU 104 Cb 0.15 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 3k6m h GLU 104 CO -0.02 0.89 -0.03 0.00 -1.18 0.00 0.00 179.01 178.67 3k6m h ARG 105 N 0.21 1.06 -0.21 1.92 3.08 -0.59 0.48 114.38 120.32 3k6m h ARG 105 Ca -0.02 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.66 3k6m h ARG 105 Cb 1.27 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.22 3k6m h ARG 105 CO 0.12 1.05 0.06 0.82 -1.07 0.00 0.00 179.97 180.95 3k6m h ILE 106 N 0.96 1.19 -0.57 2.04 2.04 -1.17 -0.99 117.51 121.01 3k6m h ILE 106 Ca 0.16 -0.62 0.07 0.00 1.00 0.00 0.00 64.86 65.48 3k6m h ILE 106 Cb 0.59 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.81 3k6m h ILE 106 CO 0.04 0.20 0.25 -0.09 0.00 0.00 0.00 178.15 178.54 3k6m h ARG 107 N 0.17 0.45 -0.91 2.37 2.43 -0.95 -1.54 114.38 116.40 3k6m h ARG 107 Ca 0.07 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3k6m h ARG 107 Cb 0.24 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.64 3k6m h ARG 107 CO -0.00 0.30 0.60 0.00 -1.51 0.00 0.00 179.97 179.36 3k6m h ALA 108 N 1.36 1.39 0.00 2.80 0.00 -0.77 -1.82 119.26 122.22 3k6m h ALA 108 Ca 0.27 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 3k6m h ALA 108 Cb 0.27 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3k6m h ALA 108 CO -0.24 0.53 -0.16 0.78 0.00 0.00 0.00 179.25 180.17 3k6m h GLY 109 N 1.18 0.00 1.14 0.00 0.00 -0.42 -1.90 103.07 103.07 3k6m h GLY 109 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 3k6m h GLY 109 CO -0.10 0.00 -0.55 0.61 0.00 0.00 0.00 176.54 176.50 3k6m n GLY 110 N -0.59 -1.35 0.60 4.60 0.00 -0.75 -4.45 105.19 103.25 3k6m n GLY 110 Ca -0.02 -0.28 0.05 0.00 0.00 0.00 0.00 46.02 45.78 3k6m n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k6m n ALA 111 N -1.69 2.21 -1.51 4.61 0.00 -0.75 -4.86 120.51 118.53 3k6m n ALA 111 Ca 0.04 -1.07 -0.09 0.00 0.00 0.00 0.00 53.44 52.32 3k6m n ALA 111 Cb 0.39 -0.42 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 3k6m n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k6m n GLY 112 N 0.51 0.79 3.29 0.00 0.00 -1.11 -5.02 105.19 103.66 3k6m n GLY 112 Ca 0.11 -0.59 -0.37 0.00 0.00 0.00 0.00 46.02 45.17 3k6m n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k6m s VAL 113 N -2.37 3.68 -0.19 1.61 1.01 -1.00 -4.99 120.40 118.15 3k6m s VAL 113 Ca 0.00 -0.91 0.24 0.00 0.00 0.00 0.00 61.98 61.31 3k6m s VAL 113 Cb 0.00 -2.96 0.30 0.00 0.00 0.00 0.00 36.38 33.71 3k6m s VAL 113 CO 0.00 0.01 1.71 1.55 0.00 0.00 0.00 175.10 178.37 3k6m h PRO 114 N 8.18 0.00 -1.84 2.72 0.13 -1.95 -3.38 132.00 135.85 3k6m h PRO 114 Ca -0.29 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.89 3k6m h PRO 114 Cb 1.11 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.03 3k6m h PRO 114 CO 0.59 0.11 0.43 0.00 -0.23 0.00 0.00 178.00 178.90 3k6m s ALA 115 N -3.34 -1.86 0.19 -0.56 0.00 -1.26 -1.03 121.76 113.90 3k6m s ALA 115 Ca 0.04 1.39 -0.10 0.00 0.00 0.00 0.00 51.96 53.29 3k6m s ALA 115 Cb 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 3k6m s ALA 115 CO 0.65 -0.40 0.35 -0.59 0.00 0.00 0.00 175.76 175.76 3k6m s PHE 116 N -1.52 0.42 -0.03 0.00 -0.12 -0.46 -4.98 117.98 111.28 3k6m s PHE 116 Ca -0.03 -0.77 -0.01 0.00 -0.05 0.00 0.00 56.93 56.06 3k6m s PHE 116 Cb -0.00 0.00 -0.04 0.00 -0.63 0.00 0.00 43.02 42.35 3k6m s PHE 116 CO 0.02 -0.81 0.07 0.71 -0.05 0.00 0.00 175.22 175.16 3k6m s TYR 117 N -3.99 3.30 -0.01 3.49 1.51 -1.26 -0.97 117.35 119.42 3k6m s TYR 117 Ca 0.20 0.24 -0.10 0.00 -1.01 0.00 0.00 57.07 56.40 3k6m s TYR 117 Cb 0.02 -1.77 0.01 0.00 -0.11 0.00 0.00 41.96 40.11 3k6m s TYR 117 CO 0.04 0.56 0.20 -0.08 -1.11 0.00 0.00 175.55 175.15 3k6m s THR 118 N -1.11 0.07 0.07 -0.71 -1.32 -0.52 -4.93 115.64 107.19 3k6m s THR 118 Ca 0.20 -0.58 0.16 0.00 -1.21 0.00 0.00 61.69 60.26 3k6m s THR 118 Cb -0.12 -0.49 0.06 0.00 -1.51 0.00 0.00 72.50 70.44 3k6m s THR 118 CO 0.10 -0.32 1.58 -1.28 -2.21 0.00 0.00 174.62 172.50 3k6m h SER 119 N 4.21 0.00 -2.45 8.08 0.87 -1.87 0.32 113.55 122.71 3k6m h SER 119 Ca -0.30 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 59.73 3k6m h SER 119 Cb 1.19 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 63.17 3k6m h SER 119 CO 0.40 0.50 1.17 -0.89 -0.53 0.00 0.00 176.83 177.49 3k6m s THR 120 N -3.30 2.88 0.00 2.23 2.01 -1.26 -1.88 115.64 116.32 3k6m s THR 120 Ca 0.01 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.10 3k6m s THR 120 Cb 0.10 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.55 3k6m s THR 120 CO 0.73 -0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.26 3k6m n GLY 121 N 4.39 1.63 3.72 4.40 0.00 -1.26 -4.83 105.19 113.24 3k6m n GLY 121 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3k6m n GLY 121 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3k6m n TYR 122 N -2.00 2.59 -0.99 1.61 9.36 -0.79 -2.12 117.16 124.82 3k6m n TYR 122 Ca 0.00 0.41 0.00 0.00 3.32 0.00 0.00 57.90 61.63 3k6m n TYR 122 Cb 0.00 -2.51 0.00 0.00 -0.63 0.00 0.00 39.34 36.20 3k6m n TYR 122 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3k6m n GLY 123 N 1.46 0.63 3.75 2.98 0.00 -1.26 -4.43 105.19 108.32 3k6m n GLY 123 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3k6m n GLY 123 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k6m s THR 124 N -2.59 1.03 0.62 2.61 -4.23 -0.90 -4.76 115.64 107.42 3k6m s THR 124 Ca 0.00 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 58.82 3k6m s THR 124 Cb 0.00 -2.11 0.36 0.00 1.34 0.00 0.00 72.50 72.10 3k6m s THR 124 CO 0.00 0.00 2.09 -0.07 -0.54 0.00 0.00 174.62 176.10 3k6m h LEU 125 N 1.35 0.00 -0.40 4.79 3.38 -1.83 -0.99 115.31 121.61 3k6m h LEU 125 Ca -0.43 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.52 3k6m h LEU 125 Cb 1.32 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 3k6m h LEU 125 CO 0.72 0.00 0.17 0.58 0.09 0.00 0.00 178.44 180.00 3k6m h VAL 126 N 0.00 1.19 -0.15 1.22 2.07 -1.93 -0.41 116.25 118.23 3k6m h VAL 126 Ca 0.07 -0.56 -0.10 0.00 0.82 0.00 0.00 66.70 66.92 3k6m h VAL 126 Cb 0.50 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3k6m h VAL 126 CO -0.00 0.21 -0.30 -0.61 0.02 0.00 0.00 177.57 176.89 3k6m h GLN 127 N 0.51 0.47 -0.15 1.57 4.15 -1.17 -3.34 115.11 117.15 3k6m h GLN 127 Ca 0.14 -0.30 -0.15 0.00 0.77 0.00 0.00 58.65 59.10 3k6m h GLN 127 Cb 0.16 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 3k6m h GLN 127 CO -0.01 0.91 -0.55 0.93 -1.93 0.00 0.00 178.83 178.18 3k6m h GLU 128 N 0.09 0.44 0.00 1.69 5.08 -1.23 -0.72 114.58 119.93 3k6m h GLU 128 Ca 0.01 -0.28 0.05 0.00 -1.00 0.00 0.00 59.36 58.14 3k6m h GLU 128 Cb 0.89 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 3k6m h GLU 128 CO 0.07 0.87 -0.07 0.41 -1.00 0.00 0.00 179.01 179.29 3k6m n GLY 129 N 0.21 -2.09 0.95 -3.84 0.00 -0.17 -4.16 105.19 96.09 3k6m n GLY 129 Ca -0.03 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.57 3k6m n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k6m n GLY 130 N -1.07 0.70 3.78 -0.02 0.00 0.25 -4.90 105.19 103.94 3k6m n GLY 130 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3k6m n GLY 130 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k6m s SER 131 N -2.94 7.15 0.03 1.61 0.01 -1.26 -4.63 113.70 113.67 3k6m s SER 131 Ca 0.00 1.88 -0.30 0.00 1.31 0.00 0.00 55.95 58.84 3k6m s SER 131 Cb 0.00 -2.58 -0.08 0.00 0.21 0.00 0.00 66.02 63.57 3k6m s SER 131 CO 0.00 -0.21 1.86 -2.84 0.41 0.00 0.00 173.24 172.47 3k6m s PRO 132 N -2.27 4.15 -0.08 12.44 0.02 -1.26 -0.19 135.00 147.81 3k6m s PRO 132 Ca 0.53 2.50 0.13 0.00 0.02 0.00 0.00 61.00 64.18 3k6m s PRO 132 Cb -0.19 -4.02 -0.23 0.00 0.02 0.00 0.00 34.50 30.07 3k6m s PRO 132 CO 0.24 -0.90 0.53 -0.89 -0.33 0.00 0.00 177.00 175.64 3k6m n ILE 133 N 5.39 1.57 -3.77 2.83 5.41 0.44 -4.88 119.36 126.35 3k6m n ILE 133 Ca 0.19 -0.80 -0.13 0.00 1.00 0.00 0.00 62.75 63.01 3k6m n ILE 133 Cb 0.41 -0.95 -0.13 0.00 -0.71 0.00 0.00 39.64 38.27 3k6m n ILE 133 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 3k6m s LYS 134 N -2.57 0.21 0.36 0.38 2.20 -0.93 -0.59 119.74 118.80 3k6m s LYS 134 Ca -0.07 0.37 0.02 0.00 -0.36 0.00 0.00 55.97 55.94 3k6m s LYS 134 Cb 0.08 0.01 -0.02 0.00 -1.51 0.00 0.00 37.83 36.38 3k6m s LYS 134 CO 0.82 -0.09 0.54 0.71 -0.36 0.00 0.00 175.35 176.97 3k6m s TYR 135 N 0.60 3.32 0.49 4.03 2.02 -1.26 -0.48 117.35 126.07 3k6m s TYR 135 Ca -0.04 0.13 0.01 0.00 -0.37 0.00 0.00 57.07 56.80 3k6m s TYR 135 Cb -0.05 -1.99 0.01 0.00 -0.40 0.00 0.00 41.96 39.53 3k6m s TYR 135 CO -0.03 -0.00 0.71 -0.80 -1.57 0.00 0.00 175.55 173.86 3k6m s ASN 136 N -4.11 5.60 0.53 2.29 0.01 0.73 -4.15 114.94 115.84 3k6m s ASN 136 Ca 0.43 0.16 0.27 0.00 -0.71 0.00 0.00 52.86 53.00 3k6m s ASN 136 Cb -0.10 -1.25 1.51 0.00 0.41 0.00 0.00 41.25 41.82 3k6m s ASN 136 CO 0.34 -0.89 2.11 0.50 -1.51 0.00 0.00 177.10 177.65 3k6m h LYS 137 N 0.26 0.00 -0.01 -0.60 1.63 -1.88 -0.79 116.57 115.19 3k6m h LYS 137 Ca -0.44 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.36 3k6m h LYS 137 Cb 1.27 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 3k6m h LYS 137 CO 0.55 0.10 -0.00 -0.40 -3.45 0.00 0.00 179.45 176.24 3k6m n ASP 138 N -3.73 0.73 0.00 4.20 3.85 -1.26 -4.91 116.55 115.43 3k6m n ASP 138 Ca -0.02 -1.24 0.00 0.00 -0.71 0.00 0.00 54.79 52.82 3k6m n ASP 138 Cb 0.20 -0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.97 3k6m n ASP 138 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3k6m n GLY 139 N 1.09 0.65 3.73 6.12 0.00 -0.30 -5.07 105.19 111.41 3k6m n GLY 139 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 3k6m n GLY 139 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k6m s SER 140 N -2.67 3.64 -0.16 1.61 1.04 -1.26 -4.78 113.70 111.12 3k6m s SER 140 Ca 0.00 1.49 -0.21 0.00 0.48 0.00 0.00 55.95 57.71 3k6m s SER 140 Cb 0.00 -2.18 -0.03 0.00 0.10 0.00 0.00 66.02 63.91 3k6m s SER 140 CO 0.00 -2.54 0.64 -0.63 0.98 0.00 0.00 173.24 171.69 3k6m s ILE 141 N -2.95 5.04 -0.15 -1.02 1.01 -1.26 -0.19 121.20 121.66 3k6m s ILE 141 Ca 0.63 1.23 -0.12 0.00 0.00 0.00 0.00 60.65 62.39 3k6m s ILE 141 Cb -0.18 -3.96 -0.23 0.00 0.01 0.00 0.00 42.46 38.10 3k6m s ILE 141 CO 0.57 0.16 0.30 0.00 0.00 0.00 0.00 174.94 175.96 3k6m n ALA 142 N 4.67 0.85 -3.67 9.38 0.00 0.36 -4.79 120.51 127.31 3k6m n ALA 142 Ca -0.02 -0.56 -0.16 0.00 0.00 0.00 0.00 53.44 52.70 3k6m n ALA 142 Cb 0.50 -0.63 -0.16 0.00 0.00 0.00 0.00 19.45 19.17 3k6m n ALA 142 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3k6m s ILE 143 N -2.49 0.08 0.13 0.00 1.01 -0.88 -4.96 121.20 114.08 3k6m s ILE 143 Ca -0.25 0.13 0.08 0.00 0.00 0.00 0.00 60.65 60.61 3k6m s ILE 143 Cb 0.06 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.31 3k6m s ILE 143 CO 0.70 0.11 -0.11 0.00 0.00 0.00 0.00 174.94 175.64 3k6m s ALA 144 N 0.96 2.90 0.58 9.38 0.00 -1.26 -0.42 121.76 133.89 3k6m s ALA 144 Ca -0.09 -1.33 -0.19 0.00 0.00 0.00 0.00 51.96 50.35 3k6m s ALA 144 Cb -0.12 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.16 3k6m s ALA 144 CO -0.02 0.58 1.20 -1.54 0.00 0.00 0.00 175.76 175.98 3k6m s SER 145 N -2.38 5.30 0.23 0.00 1.04 0.73 -4.81 113.70 113.82 3k6m s SER 145 Ca 0.22 2.38 -0.11 0.00 0.48 0.00 0.00 55.95 58.91 3k6m s SER 145 Cb -0.10 -2.60 -0.07 0.00 0.10 0.00 0.00 66.02 63.34 3k6m s SER 145 CO 0.13 -1.52 0.59 -0.54 0.98 0.00 0.00 173.24 172.88 3k6m s LYS 146 N -3.28 3.87 0.92 4.02 1.02 -1.26 -0.58 119.74 124.45 3k6m s LYS 146 Ca 0.76 0.39 -0.11 0.00 0.02 0.00 0.00 55.97 57.03 3k6m s LYS 146 Cb -0.30 -2.65 0.14 0.00 -0.52 0.00 0.00 37.83 34.50 3k6m s LYS 146 CO 0.33 0.31 1.11 -2.14 -0.92 0.00 0.00 175.35 174.04 3k6m s PRO 147 N -2.71 1.03 -0.06 -1.68 0.02 -1.26 -4.33 135.00 126.01 3k6m s PRO 147 Ca 0.47 1.22 0.00 0.00 0.02 0.00 0.00 61.00 62.71 3k6m s PRO 147 Cb -0.12 -1.75 -0.03 0.00 0.02 0.00 0.00 34.50 32.62 3k6m s PRO 147 CO 0.20 -2.52 -0.04 1.03 -0.33 0.00 0.00 177.00 175.35 3k6m s ARG 148 N -4.73 2.83 0.42 5.54 1.81 -0.28 -4.93 118.95 119.61 3k6m s ARG 148 Ca 0.65 -0.51 -0.26 0.00 -1.72 0.00 0.00 55.73 53.90 3k6m s ARG 148 Cb -0.21 -2.67 -0.08 0.00 -0.45 0.00 0.00 34.95 31.54 3k6m s ARG 148 CO 0.58 0.67 1.31 -1.21 -0.68 0.00 0.00 175.30 175.98 3k6m s GLU 149 N -0.94 3.90 0.07 3.54 2.02 -1.26 -4.82 118.70 121.21 3k6m s GLU 149 Ca 0.14 2.16 0.03 0.00 0.02 0.00 0.00 54.97 57.32 3k6m s GLU 149 Cb -0.11 -2.71 -0.04 0.00 0.10 0.00 0.00 34.13 31.37 3k6m s GLU 149 CO 0.03 -0.55 0.03 0.14 0.02 0.00 0.00 175.26 174.93 3k6m s VAL 150 N -1.27 4.27 -0.17 2.63 -7.23 -1.26 -1.21 120.40 116.16 3k6m s VAL 150 Ca 0.58 -0.82 -0.20 0.00 -1.81 0.00 0.00 61.98 59.73 3k6m s VAL 150 Cb -0.38 -3.02 0.05 0.00 0.56 0.00 0.00 36.38 33.59 3k6m s VAL 150 CO 0.49 0.17 0.54 -0.60 -0.31 0.00 0.00 175.10 175.38 3k6m s ARG 151 N -2.21 0.68 -0.11 4.82 3.52 -0.10 -4.97 118.95 120.57 3k6m s ARG 151 Ca 0.26 0.63 -0.14 0.00 -0.13 0.00 0.00 55.73 56.35 3k6m s ARG 151 Cb -0.12 0.33 -0.05 0.00 -1.56 0.00 0.00 34.95 33.55 3k6m s ARG 151 CO 0.18 -0.11 0.34 -2.00 -0.81 0.00 0.00 175.30 172.90 3k6m s GLU 152 N 0.01 4.11 -0.03 5.12 2.12 -1.26 -1.35 118.70 127.42 3k6m s GLU 152 Ca -0.02 0.21 0.02 0.00 0.36 0.00 0.00 54.97 55.54 3k6m s GLU 152 Cb -0.04 -3.35 0.01 0.00 0.26 0.00 0.00 34.13 31.01 3k6m s GLU 152 CO 0.02 0.39 -0.08 -0.06 -0.54 0.00 0.00 175.26 174.99 3k6m s PHE 153 N -0.04 0.88 -1.64 5.30 0.40 -0.30 -4.88 117.98 117.70 3k6m s PHE 153 Ca 0.20 -0.24 -0.17 0.00 -0.60 0.00 0.00 56.93 56.13 3k6m s PHE 153 Cb -0.14 -0.67 0.13 0.00 0.51 0.00 0.00 43.02 42.85 3k6m s PHE 153 CO 0.07 -0.13 0.86 0.09 0.70 0.00 0.00 175.22 176.81 3k6m n ASN 154 N 3.53 -3.83 -0.33 1.36 3.02 -1.26 -1.08 115.26 116.66 3k6m n ASN 154 Ca -0.20 -0.93 -0.04 0.00 -0.03 0.00 0.00 54.58 53.38 3k6m n ASN 154 Cb 0.53 -3.18 -0.02 0.00 -0.61 0.00 0.00 39.78 36.50 3k6m n ASN 154 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k6m n GLY 155 N -1.51 0.69 3.15 7.41 0.00 -1.26 -5.02 105.19 108.64 3k6m n GLY 155 Ca 0.06 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.51 3k6m n GLY 155 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k6m s GLN 156 N -1.81 0.78 -0.07 1.61 0.74 -0.24 -5.15 119.66 115.51 3k6m s GLN 156 Ca 0.00 -1.01 -0.10 0.00 0.05 0.00 0.00 55.36 54.30 3k6m s GLN 156 Cb 0.00 -0.61 -0.05 0.00 1.10 0.00 0.00 33.01 33.46 3k6m s GLN 156 CO 0.00 0.12 0.24 -1.01 -0.55 0.00 0.00 175.29 174.09 3k6m s HIS 157 N -1.80 3.65 0.10 1.67 3.76 -1.26 -1.15 115.29 120.25 3k6m s HIS 157 Ca -0.00 0.70 0.03 0.00 -0.15 0.00 0.00 55.06 55.64 3k6m s HIS 157 Cb -0.07 -2.07 -0.04 0.00 1.11 0.00 0.00 32.58 31.51 3k6m s HIS 157 CO 0.01 0.70 -0.08 -0.06 -0.85 0.00 0.00 174.74 174.46 3k6m s PHE 158 N -1.06 0.97 0.12 1.40 0.40 -0.45 -4.63 117.98 114.73 3k6m s PHE 158 Ca 0.19 -0.78 0.10 0.00 -0.60 0.00 0.00 56.93 55.83 3k6m s PHE 158 Cb -0.14 -0.54 -0.04 0.00 0.51 0.00 0.00 43.02 42.81 3k6m s PHE 158 CO 0.08 -0.07 -0.25 0.96 0.70 0.00 0.00 175.22 176.64 3k6m s ILE 159 N -3.07 2.41 -0.17 0.64 -4.36 0.10 -0.92 121.20 115.84 3k6m s ILE 159 Ca 0.09 -1.67 -0.24 0.00 -0.26 0.00 0.00 60.65 58.57 3k6m s ILE 159 Cb 0.01 -2.07 -0.02 0.00 1.25 0.00 0.00 42.46 41.63 3k6m s ILE 159 CO -0.02 0.11 0.78 -0.22 0.24 0.00 0.00 174.94 175.83 3k6m s LEU 160 N -2.03 4.18 0.08 0.37 2.96 -0.35 -1.43 118.68 122.46 3k6m s LEU 160 Ca 0.15 1.11 0.10 0.00 -0.22 0.00 0.00 54.13 55.26 3k6m s LEU 160 Cb -0.10 -3.16 -0.03 0.00 0.50 0.00 0.00 46.19 43.40 3k6m s LEU 160 CO 0.07 -0.36 -0.26 -1.61 -1.32 0.00 0.00 176.35 172.88 3k6m s GLU 161 N 2.01 1.55 0.14 1.98 0.41 -0.14 -4.44 118.70 120.22 3k6m s GLU 161 Ca 0.36 -1.18 0.05 0.00 -0.41 0.00 0.00 54.97 53.79 3k6m s GLU 161 Cb -0.16 -1.85 -0.04 0.00 -1.78 0.00 0.00 34.13 30.30 3k6m s GLU 161 CO 0.12 0.46 0.10 -1.21 -0.49 0.00 0.00 175.26 174.24 3k6m s GLU 162 N -1.58 2.80 0.62 1.61 2.02 -1.26 -1.35 118.70 121.55 3k6m s GLU 162 Ca 0.12 -0.87 -0.19 0.00 0.02 0.00 0.00 54.97 54.05 3k6m s GLU 162 Cb -0.10 -2.61 -0.02 0.00 0.10 0.00 0.00 34.13 31.49 3k6m s GLU 162 CO 0.04 0.50 1.29 0.00 0.02 0.00 0.00 175.26 177.10 3k6m n ALA 163 N -0.11 1.21 -3.04 5.21 0.00 -0.20 -4.81 120.51 118.78 3k6m n ALA 163 Ca -0.09 0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 3k6m n ALA 163 Cb 0.54 -2.32 -0.14 0.00 0.00 0.00 0.00 19.45 17.54 3k6m n ALA 163 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3k6m s ILE 164 N -1.36 3.34 0.14 0.00 1.01 -0.46 -4.89 121.20 118.98 3k6m s ILE 164 Ca 0.79 -0.56 0.07 0.00 0.00 0.00 0.00 60.65 60.95 3k6m s ILE 164 Cb -0.39 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 3k6m s ILE 164 CO 0.43 0.51 -0.15 -0.13 0.00 0.00 0.00 174.94 175.60 3k6m s ARG 165 N 0.36 1.12 0.30 2.79 0.52 -1.26 -3.99 118.95 118.79 3k6m s ARG 165 Ca -0.09 -1.32 0.10 0.00 -0.52 0.00 0.00 55.73 53.90 3k6m s ARG 165 Cb -0.15 -1.04 -0.05 0.00 0.52 0.00 0.00 34.95 34.22 3k6m s ARG 165 CO 0.05 0.20 -0.07 0.20 0.02 0.00 0.00 175.30 175.70 3k6m s GLY 166 N -2.60 1.89 0.16 -3.53 0.00 -0.31 -4.97 107.32 97.97 3k6m s GLY 166 Ca 0.12 -1.85 -0.10 0.00 0.00 0.00 0.00 44.72 42.90 3k6m s GLY 166 CO 0.04 -1.88 1.55 -0.55 0.00 0.00 0.00 173.10 172.26 3k6m h ASP 167 N 2.00 1.00 -4.75 1.64 3.32 -1.07 -1.74 116.42 116.82 3k6m h ASP 167 Ca -0.42 -0.39 -0.24 0.00 0.02 0.00 0.00 57.03 56.00 3k6m h ASP 167 Cb 1.25 -0.28 -0.18 0.00 0.22 0.00 0.00 39.33 40.34 3k6m h ASP 167 CO 0.63 1.18 -0.71 -0.36 -1.72 0.00 0.00 179.24 178.26 3k6m s PHE 168 N -4.63 0.72 -0.04 4.55 0.40 -0.98 -1.84 117.98 116.16 3k6m s PHE 168 Ca -0.11 -0.70 0.05 0.00 -0.60 0.00 0.00 56.93 55.57 3k6m s PHE 168 Cb 0.12 -0.43 -0.01 0.00 0.51 0.00 0.00 43.02 43.21 3k6m s PHE 168 CO 0.87 -0.14 -0.19 0.00 0.70 0.00 0.00 175.22 176.46 3k6m s ALA 169 N -2.42 1.68 -0.33 5.36 0.00 -0.51 -0.67 121.76 124.87 3k6m s ALA 169 Ca -0.01 -0.80 -0.05 0.00 0.00 0.00 0.00 51.96 51.10 3k6m s ALA 169 Cb -0.03 -0.52 0.05 0.00 0.00 0.00 0.00 23.12 22.62 3k6m s ALA 169 CO -0.02 0.33 0.09 -0.51 0.00 0.00 0.00 175.76 175.65 3k6m s LEU 170 N -0.12 4.27 -0.05 0.00 1.43 0.10 -0.63 118.68 123.68 3k6m s LEU 170 Ca -0.01 -1.23 0.06 0.00 -1.03 0.00 0.00 54.13 51.92 3k6m s LEU 170 Cb -0.11 -1.83 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 3k6m s LEU 170 CO 0.02 -0.33 -0.23 -0.69 0.23 0.00 0.00 176.35 175.35 3k6m s VAL 171 N 1.35 1.88 -0.19 -1.59 1.01 -0.15 -1.42 120.40 121.31 3k6m s VAL 171 Ca -0.02 -0.97 -0.09 0.00 0.00 0.00 0.00 61.98 60.89 3k6m s VAL 171 Cb -0.20 -1.60 -0.05 0.00 0.00 0.00 0.00 36.38 34.53 3k6m s VAL 171 CO 0.01 0.53 0.13 -0.75 0.00 0.00 0.00 175.10 175.02 3k6m s LYS 172 N -0.10 4.06 0.35 2.72 2.47 -1.26 -0.86 119.74 127.12 3k6m s LYS 172 Ca -0.04 -0.20 0.05 0.00 -1.56 0.00 0.00 55.97 54.22 3k6m s LYS 172 Cb -0.13 -3.38 -0.03 0.00 -1.46 0.00 0.00 37.83 32.83 3k6m s LYS 172 CO 0.03 0.38 0.20 0.00 0.16 0.00 0.00 175.35 176.13 3k6m s ALA 173 N 0.12 2.23 -0.11 3.13 0.00 0.36 -4.89 121.76 122.61 3k6m s ALA 173 Ca 0.09 -1.70 -0.07 0.00 0.00 0.00 0.00 51.96 50.28 3k6m s ALA 173 Cb -0.11 1.16 -0.02 0.00 0.00 0.00 0.00 23.12 24.15 3k6m s ALA 173 CO -0.01 -0.52 -0.13 2.35 0.00 0.00 0.00 175.76 177.45 3k6m h TRP 174 N 2.04 0.00 -3.98 0.00 7.01 -1.22 -3.28 115.95 116.53 3k6m h TRP 174 Ca -0.30 0.00 -0.43 0.00 2.11 0.00 0.00 58.89 60.27 3k6m h TRP 174 Cb 1.25 0.00 -0.23 0.00 -2.10 0.00 0.00 29.16 28.08 3k6m h TRP 174 CO 1.47 0.00 -0.79 0.15 -2.79 0.00 0.00 178.44 176.49 3k6m s LYS 175 N -1.95 0.87 0.07 2.65 1.02 -1.16 -1.24 119.74 120.00 3k6m s LYS 175 Ca -0.11 -0.89 0.09 0.00 0.02 0.00 0.00 55.97 55.08 3k6m s LYS 175 Cb 0.02 -0.89 -0.03 0.00 -0.52 0.00 0.00 37.83 36.41 3k6m s LYS 175 CO 0.17 0.21 -0.23 0.00 -0.92 0.00 0.00 175.35 174.57 3k6m s ALA 176 N -1.11 2.01 0.72 5.17 0.00 -0.86 -1.30 121.76 126.39 3k6m s ALA 176 Ca -0.00 -1.21 -0.06 0.00 0.00 0.00 0.00 51.96 50.68 3k6m s ALA 176 Cb -0.09 -0.37 0.08 0.00 0.00 0.00 0.00 23.12 22.74 3k6m s ALA 176 CO 0.02 0.45 1.02 0.16 0.00 0.00 0.00 175.76 177.41 3k6m s ASP 177 N -1.45 4.63 0.00 0.00 1.47 -0.28 -0.56 116.67 120.48 3k6m s ASP 177 Ca 0.10 0.28 0.14 0.00 1.18 0.00 0.00 52.55 54.25 3k6m s ASP 177 Cb -0.10 -0.85 0.75 0.00 -0.34 0.00 0.00 42.92 42.38 3k6m s ASP 177 CO 0.03 -1.70 1.37 0.00 0.68 0.00 0.00 175.17 175.55 3k6m n GLN 178 N -2.94 0.25 0.04 2.11 6.02 -0.72 -1.51 117.38 120.64 3k6m n GLN 178 Ca 0.10 0.12 0.12 0.00 -0.01 0.00 0.00 57.00 57.33 3k6m n GLN 178 Cb 0.60 -1.50 0.16 0.00 1.02 0.00 0.00 30.24 30.52 3k6m n GLN 178 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3k6m n ALA 179 N -1.23 3.16 -0.07 -1.58 0.00 -1.26 -4.97 120.51 114.56 3k6m n ALA 179 Ca 0.08 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3k6m n ALA 179 Cb 0.10 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.43 3k6m n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k6m n GLY 180 N 1.38 0.81 3.77 0.00 0.00 -0.57 -4.61 105.19 105.98 3k6m n GLY 180 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 3k6m n GLY 180 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k6m s ASN 181 N -2.36 6.54 0.05 1.61 0.01 -1.26 -4.13 114.94 115.40 3k6m s ASN 181 Ca 0.00 2.24 0.05 0.00 -0.71 0.00 0.00 52.86 54.44 3k6m s ASN 181 Cb 0.00 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 39.03 3k6m s ASN 181 CO 0.00 -0.65 -0.13 -0.69 -1.51 0.00 0.00 177.10 174.11 3k6m s VAL 182 N -1.51 1.05 0.19 1.60 1.01 -0.30 -1.12 120.40 121.31 3k6m s VAL 182 Ca 0.58 -1.05 0.07 0.00 0.00 0.00 0.00 61.98 61.58 3k6m s VAL 182 Cb -0.28 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.09 3k6m s VAL 182 CO 0.34 -0.07 -0.14 0.42 0.00 0.00 0.00 175.10 175.65 3k6m s THR 183 N -0.96 1.65 0.11 3.92 -4.23 -0.42 -1.43 115.64 114.28 3k6m s THR 183 Ca -0.00 -2.13 0.09 0.00 -1.18 0.00 0.00 61.69 58.47 3k6m s THR 183 Cb -0.08 -1.96 -0.04 0.00 1.34 0.00 0.00 72.50 71.76 3k6m s THR 183 CO 0.01 -0.57 -0.22 -0.36 -0.54 0.00 0.00 174.62 172.95 3k6m s PHE 184 N -2.86 1.86 -0.20 3.99 0.40 -1.26 -0.76 117.98 119.15 3k6m s PHE 184 Ca 0.20 -0.42 -0.08 0.00 -0.60 0.00 0.00 56.93 56.04 3k6m s PHE 184 Cb -0.01 -1.01 -0.04 0.00 0.51 0.00 0.00 43.02 42.47 3k6m s PHE 184 CO 0.06 0.23 0.07 0.50 0.70 0.00 0.00 175.22 176.78 3k6m s ARG 185 N -2.00 3.89 3.43 0.44 3.52 -1.26 -4.89 118.95 122.07 3k6m s ARG 185 Ca 0.08 -0.38 0.00 0.00 -0.13 0.00 0.00 55.73 55.30 3k6m s ARG 185 Cb -0.10 -3.27 0.00 0.00 -1.56 0.00 0.00 34.95 30.03 3k6m s ARG 185 CO 0.05 0.13 0.00 1.63 -0.81 0.00 0.00 175.30 176.29 3k6m n LYS 186 N 3.99 0.00 -0.08 5.12 5.02 -1.26 -1.58 118.16 129.36 3k6m n LYS 186 Ca -0.16 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.21 3k6m n LYS 186 Cb 0.52 0.00 0.31 0.00 -0.02 0.00 0.00 35.03 35.84 3k6m n LYS 186 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3k6m n SER 187 N 1.79 1.17 0.00 4.39 3.41 -0.38 -3.88 113.62 120.12 3k6m n SER 187 Ca 0.00 -1.75 0.10 0.00 -0.26 0.00 0.00 58.87 56.96 3k6m n SER 187 Cb 0.00 -0.10 0.53 0.00 -0.26 0.00 0.00 64.21 64.38 3k6m n SER 187 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k6m n ALA 188 N 0.04 2.10 0.25 7.33 0.00 -0.62 -3.77 120.51 125.84 3k6m n ALA 188 Ca 0.13 -0.10 -0.10 0.00 0.00 0.00 0.00 53.44 53.36 3k6m n ALA 188 Cb 0.23 -1.34 -0.05 0.00 0.00 0.00 0.00 19.45 18.29 3k6m n ALA 188 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3k6m h ARG 189 N 0.00 -0.65 0.00 0.00 2.43 -1.73 -3.39 114.38 111.05 3k6m h ARG 189 Ca 0.00 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3k6m h ARG 189 Cb 0.18 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3k6m h ARG 189 CO 0.00 -0.43 0.00 0.27 -1.51 0.00 0.00 179.97 178.30 3k6m n ASN 190 N -4.64 0.00 0.09 -3.80 0.23 -1.25 -0.81 115.26 105.09 3k6m n ASN 190 Ca -0.08 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.09 3k6m n ASN 190 Cb 0.26 0.00 0.28 0.00 -2.08 0.00 0.00 39.78 38.25 3k6m n ASN 190 CO 0.00 0.00 0.00 -0.26 -0.93 0.00 0.00 177.26 176.07 3k6m h PHE 191 N 0.00 0.00 -0.81 -2.53 -1.00 -1.87 -0.70 116.94 110.03 3k6m h PHE 191 Ca 0.00 0.00 0.11 0.00 2.81 0.00 0.00 57.97 60.89 3k6m h PHE 191 Cb 0.00 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 39.48 3k6m h PHE 191 CO 0.00 0.00 0.44 -0.91 -1.61 0.00 0.00 178.31 176.23 3k6m h ASN 192 N 0.00 0.59 0.51 2.17 2.35 -1.25 -1.86 115.58 118.09 3k6m h ASN 192 Ca 0.00 0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 3k6m h ASN 192 Cb 0.77 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.09 3k6m h ASN 192 CO 0.00 0.32 -0.24 0.25 -1.65 0.00 0.00 177.43 176.11 3k6m h LEU 193 N 0.71 -0.58 -1.18 1.61 6.46 -1.68 -2.61 115.31 118.05 3k6m h LEU 193 Ca 0.40 -0.07 -0.05 0.00 -0.12 0.00 0.00 57.88 58.05 3k6m h LEU 193 Cb 0.43 0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.49 3k6m h LEU 193 CO -0.28 -0.23 0.07 1.55 -0.62 0.00 0.00 178.44 178.93 3k6m h PRO 194 N -0.95 0.64 0.00 5.25 0.13 -1.78 -2.30 132.00 132.98 3k6m h PRO 194 Ca -0.07 -0.13 -0.00 0.00 -0.87 0.00 0.00 66.00 64.93 3k6m h PRO 194 Cb 0.61 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.64 3k6m h PRO 194 CO 0.11 0.61 -0.00 0.52 -0.23 0.00 0.00 178.00 179.01 3k6m h MET 195 N 0.61 0.00 0.00 0.86 2.86 -1.33 -1.51 114.93 116.43 3k6m h MET 195 Ca 0.14 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 3k6m h MET 195 Cb 0.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.95 3k6m h MET 195 CO 0.00 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.97 3k6m n LYS 197 N -1.55 1.47 -0.06 0.00 5.02 -0.57 -4.70 118.16 117.78 3k6m n LYS 197 Ca 0.02 -0.95 0.08 0.00 -2.02 0.00 0.00 58.31 55.44 3k6m n LYS 197 Cb 0.13 -1.21 0.11 0.00 -0.02 0.00 0.00 35.03 34.04 3k6m n LYS 197 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k6m n ALA 198 N 0.20 2.20 -2.58 7.82 0.00 -1.12 -3.99 120.51 123.04 3k6m n ALA 198 Ca 0.06 -2.28 -0.17 0.00 0.00 0.00 0.00 53.44 51.06 3k6m n ALA 198 Cb 0.30 -0.30 -0.11 0.00 0.00 0.00 0.00 19.45 19.33 3k6m n ALA 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k6m s ALA 199 N -2.47 1.24 0.20 0.00 0.00 -1.26 -1.16 121.76 118.32 3k6m s ALA 199 Ca 0.25 -1.14 -0.11 0.00 0.00 0.00 0.00 51.96 50.97 3k6m s ALA 199 Cb 0.22 -0.05 0.19 0.00 0.00 0.00 0.00 23.12 23.48 3k6m s ALA 199 CO 0.02 0.09 1.81 1.49 0.00 0.00 0.00 175.76 179.17 3k6m h GLU 200 N 3.86 0.66 -4.27 0.00 4.57 -1.29 -3.40 114.58 114.71 3k6m h GLU 200 Ca -0.39 -0.04 -0.55 0.00 -1.18 0.00 0.00 59.36 57.19 3k6m h GLU 200 Cb 1.19 -0.15 -0.37 0.00 -0.16 0.00 0.00 28.75 29.26 3k6m h GLU 200 CO 0.47 0.44 -0.80 0.99 -1.18 0.00 0.00 179.01 178.93 3k6m s THR 201 N -6.11 1.16 -0.19 0.32 2.01 -0.77 -5.02 115.64 107.04 3k6m s THR 201 Ca -0.13 -0.52 -0.09 0.00 0.31 0.00 0.00 61.69 61.26 3k6m s THR 201 Cb 0.15 -1.24 -0.05 0.00 0.01 0.00 0.00 72.50 71.37 3k6m s THR 201 CO 0.75 0.26 0.10 0.42 -0.69 0.00 0.00 174.62 175.46 3k6m s THR 202 N 1.63 5.11 -0.16 -0.82 -4.23 -1.26 -1.43 115.64 114.47 3k6m s THR 202 Ca 0.03 0.08 0.01 0.00 -1.18 0.00 0.00 61.69 60.63 3k6m s THR 202 Cb -0.14 -3.32 0.02 0.00 1.34 0.00 0.00 72.50 70.40 3k6m s THR 202 CO -0.08 0.45 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.59 3k6m s VAL 203 N 0.36 1.79 -0.10 2.29 1.01 0.20 -1.57 120.40 124.38 3k6m s VAL 203 Ca 0.06 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.27 3k6m s VAL 203 Cb -0.12 -1.66 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 3k6m s VAL 203 CO -0.01 0.48 -0.16 -0.69 0.00 0.00 0.00 175.10 174.73 3k6m s VAL 204 N 1.39 2.86 -0.10 2.92 1.01 -0.39 -0.98 120.40 127.12 3k6m s VAL 204 Ca 0.05 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 3k6m s VAL 204 Cb -0.13 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 3k6m s VAL 204 CO -0.12 0.55 -0.05 -1.83 0.00 0.00 0.00 175.10 173.65 3k6m s GLU 205 N -0.02 3.07 0.21 2.72 -1.05 -0.04 -1.08 118.70 122.51 3k6m s GLU 205 Ca -0.04 -0.53 0.07 0.00 -0.15 0.00 0.00 54.97 54.32 3k6m s GLU 205 Cb -0.14 -2.71 -0.05 0.00 -0.44 0.00 0.00 34.13 30.79 3k6m s GLU 205 CO 0.04 0.53 -0.13 0.14 0.95 0.00 0.00 175.26 176.79 3k6m s VAL 206 N -0.44 1.70 0.07 1.83 -7.23 -0.70 -0.48 120.40 115.15 3k6m s VAL 206 Ca 0.07 -2.20 0.09 0.00 -1.81 0.00 0.00 61.98 58.12 3k6m s VAL 206 Cb -0.12 -2.08 -0.16 0.00 0.56 0.00 0.00 36.38 34.58 3k6m s VAL 206 CO 0.02 -0.57 1.30 -0.33 -0.31 0.00 0.00 175.10 175.22 3k6m h GLU 207 N 2.54 0.00 -2.97 4.82 5.08 -1.23 0.05 114.58 122.87 3k6m h GLU 207 Ca -0.38 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 57.83 3k6m h GLU 207 Cb 1.22 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.23 3k6m h GLU 207 CO 0.63 0.90 -0.34 -2.00 -1.00 0.00 0.00 179.01 177.20 3k6m s GLU 208 N -2.75 0.39 -0.17 2.33 2.12 -1.02 -4.83 118.70 114.76 3k6m s GLU 208 Ca 0.01 0.40 -0.06 0.00 0.36 0.00 0.00 54.97 55.68 3k6m s GLU 208 Cb 0.10 0.19 -0.03 0.00 0.26 0.00 0.00 34.13 34.64 3k6m s GLU 208 CO 0.81 -0.05 0.02 0.42 -0.54 0.00 0.00 175.26 175.91 3k6m s ILE 209 N 0.06 4.38 0.32 -3.70 1.01 -1.26 -2.02 121.20 119.99 3k6m s ILE 209 Ca -0.01 -0.18 0.11 0.00 0.00 0.00 0.00 60.65 60.57 3k6m s ILE 209 Cb -0.02 -2.96 -0.06 0.00 0.01 0.00 0.00 42.46 39.43 3k6m s ILE 209 CO 0.01 0.47 -0.14 0.68 0.00 0.00 0.00 174.94 175.96 3k6m s VAL 210 N 0.41 2.36 0.55 2.92 -7.23 0.27 -4.98 120.40 114.70 3k6m s VAL 210 Ca 0.00 -2.28 -0.21 0.00 -1.81 0.00 0.00 61.98 57.68 3k6m s VAL 210 Cb -0.13 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.25 3k6m s VAL 210 CO 0.01 -0.29 1.24 -1.81 -0.31 0.00 0.00 175.10 173.94 3k6m s ASP 211 N -3.57 5.47 0.25 4.85 1.01 -1.26 -1.76 116.67 121.66 3k6m s ASP 211 Ca 0.31 2.46 -0.31 0.00 0.71 0.00 0.00 52.55 55.73 3k6m s ASP 211 Cb -0.01 -2.61 -0.13 0.00 1.01 0.00 0.00 42.92 41.18 3k6m s ASP 211 CO 0.16 -1.41 1.38 -0.38 0.21 0.00 0.00 175.17 175.13 3k6m n ILE 212 N -1.15 1.12 -0.04 0.77 5.41 -1.26 -1.57 119.36 122.64 3k6m n ILE 212 Ca 0.11 -0.28 0.00 0.00 1.00 0.00 0.00 62.75 63.58 3k6m n ILE 212 Cb 0.48 -1.47 0.00 0.00 -0.71 0.00 0.00 39.64 37.94 3k6m n ILE 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3k6m n GLY 213 N 1.93 0.62 0.22 7.39 0.00 -1.26 -4.94 105.19 109.15 3k6m n GLY 213 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.21 3k6m n GLY 213 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3k6m h SER 214 N 0.00 0.00 -2.80 1.61 0.02 -1.65 -3.43 113.55 107.30 3k6m h SER 214 Ca 0.00 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 60.31 3k6m h SER 214 Cb 0.00 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.48 3k6m h SER 214 CO 0.00 0.26 -0.45 -0.36 -1.14 0.00 0.00 176.83 175.14 3k6m s PHE 215 N -3.77 3.57 0.22 3.45 2.99 -1.26 -5.08 117.98 118.11 3k6m s PHE 215 Ca -0.00 0.48 -0.30 0.00 0.00 0.00 0.00 56.93 57.10 3k6m s PHE 215 Cb 0.11 -1.91 -0.10 0.00 0.00 0.00 0.00 43.02 41.12 3k6m s PHE 215 CO 0.65 0.66 1.44 0.00 -0.00 0.00 0.00 175.22 177.96 3k6m s ALA 216 N -1.24 3.63 0.50 5.36 0.00 -1.26 -4.90 121.76 123.85 3k6m s ALA 216 Ca 0.24 1.29 0.26 0.00 0.00 0.00 0.00 51.96 53.76 3k6m s ALA 216 Cb -0.13 -3.55 1.54 0.00 0.00 0.00 0.00 23.12 20.98 3k6m s ALA 216 CO 0.14 -0.71 2.14 -1.00 0.00 0.00 0.00 175.76 176.33 3k6m h PRO 217 N 5.41 0.00 0.00 0.00 0.13 -1.98 -0.20 132.00 135.36 3k6m h PRO 217 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3k6m h PRO 217 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3k6m h PRO 217 CO 0.80 0.07 0.00 0.93 -0.23 0.00 0.00 178.00 179.57 3k6m h GLU 218 N 0.00 0.00 -0.17 0.86 3.07 -2.06 -3.28 114.58 113.00 3k6m h GLU 218 Ca -0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 3k6m h GLU 218 Cb 0.17 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.06 3k6m h GLU 218 CO 0.01 0.00 -0.08 -0.25 -1.40 0.00 0.00 179.01 177.29 3k6m n ASP 219 N -2.58 2.83 -4.61 1.42 8.00 -0.09 -4.92 116.55 116.59 3k6m n ASP 219 Ca 0.02 -3.33 -0.42 0.00 0.71 0.00 0.00 54.79 51.77 3k6m n ASP 219 Cb 0.30 -0.53 -0.04 0.00 -0.02 0.00 0.00 41.12 40.83 3k6m n ASP 219 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k6m s ILE 220 N -2.99 4.65 0.09 0.53 1.01 -1.22 -4.88 121.20 118.39 3k6m s ILE 220 Ca 0.39 1.22 -0.11 0.00 0.00 0.00 0.00 60.65 62.15 3k6m s ILE 220 Cb 0.34 -4.28 -0.22 0.00 0.01 0.00 0.00 42.46 38.31 3k6m s ILE 220 CO 0.03 -0.44 1.22 0.45 0.00 0.00 0.00 174.94 176.20 3k6m h HIS 221 N 8.33 0.91 -3.46 3.97 3.86 -1.74 -3.41 115.15 123.62 3k6m h HIS 221 Ca -0.23 -0.50 -0.59 0.00 -1.16 0.00 0.00 60.37 57.89 3k6m h HIS 221 Cb 1.08 -0.10 -0.39 0.00 1.06 0.00 0.00 27.41 29.06 3k6m h HIS 221 CO 0.81 1.34 -0.77 0.42 0.86 0.00 0.00 177.93 180.59 3k6m s ILE 222 N -3.28 1.22 0.66 2.45 -1.09 -0.51 -5.03 121.20 115.62 3k6m s ILE 222 Ca -0.09 -1.20 -0.17 0.00 -2.23 0.00 0.00 60.65 56.97 3k6m s ILE 222 Cb 0.07 -1.67 0.00 0.00 -1.58 0.00 0.00 42.46 39.29 3k6m s ILE 222 CO 0.91 -0.29 1.23 -2.84 -1.23 0.00 0.00 174.94 172.72 3k6m s PRO 223 N 1.51 2.52 0.64 2.79 0.02 -1.26 -1.15 135.00 140.06 3k6m s PRO 223 Ca -0.00 1.85 0.32 0.00 0.02 0.00 0.00 61.00 63.19 3k6m s PRO 223 Cb -0.18 -1.87 1.79 0.00 0.02 0.00 0.00 34.50 34.26 3k6m s PRO 223 CO -0.11 -1.57 2.06 1.57 -0.33 0.00 0.00 177.00 178.63 3k6m h LYS 224 N 0.29 0.00 0.00 5.54 2.10 -1.89 -2.02 116.57 120.59 3k6m h LYS 224 Ca -0.49 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.15 3k6m h LYS 224 Cb 1.31 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.64 3k6m h LYS 224 CO 0.52 0.00 -0.02 0.97 -2.00 0.00 0.00 179.45 178.92 3k6m h ILE 225 N 0.00 0.53 -0.00 0.07 2.10 -1.90 -1.61 117.51 116.70 3k6m h ILE 225 Ca 0.05 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.89 3k6m h ILE 225 Cb 0.54 1.06 0.00 0.00 -1.09 0.00 0.00 36.82 37.33 3k6m h ILE 225 CO -0.00 0.02 -0.65 -1.22 -1.08 0.00 0.00 178.15 175.22 3k6m n TYR 226 N -3.81 0.00 -3.51 2.19 0.53 -0.76 -4.79 117.16 107.02 3k6m n TYR 226 Ca -0.03 0.00 -0.42 0.00 -1.02 0.00 0.00 57.90 56.43 3k6m n TYR 226 Cb 0.11 -0.15 -0.06 0.00 -1.03 0.00 0.00 39.34 38.20 3k6m n TYR 226 CO 0.00 0.00 0.00 0.08 -1.02 0.00 0.00 176.86 175.92 3k6m s VAL 227 N -2.95 4.60 0.05 -0.72 1.01 -0.61 -4.70 120.40 117.09 3k6m s VAL 227 Ca 0.11 -2.31 -0.10 0.00 0.00 0.00 0.00 61.98 59.68 3k6m s VAL 227 Cb 0.17 -3.95 -0.32 0.00 0.00 0.00 0.00 36.38 32.29 3k6m s VAL 227 CO 0.74 -0.89 1.05 0.45 0.00 0.00 0.00 175.10 176.45 3k6m h HIS 228 N 7.87 0.74 -3.77 5.22 3.86 -1.79 -3.34 115.15 123.94 3k6m h HIS 228 Ca -0.06 -0.54 -0.33 0.00 -1.16 0.00 0.00 60.37 58.28 3k6m h HIS 228 Cb 1.03 -0.03 -0.30 0.00 1.06 0.00 0.00 27.41 29.17 3k6m h HIS 228 CO 0.79 1.43 -0.75 1.03 0.86 0.00 0.00 177.93 181.29 3k6m s ARG 229 N -2.63 0.41 -0.03 2.45 0.52 -0.61 -1.36 118.95 117.71 3k6m s ARG 229 Ca -0.07 -0.11 0.02 0.00 -0.52 0.00 0.00 55.73 55.04 3k6m s ARG 229 Cb 0.06 -0.43 0.01 0.00 0.52 0.00 0.00 34.95 35.11 3k6m s ARG 229 CO 0.91 0.04 -0.06 -1.17 0.02 0.00 0.00 175.30 175.04 3k6m s LEU 230 N 0.20 1.65 -0.01 2.53 1.98 -0.09 -1.26 118.68 123.68 3k6m s LEU 230 Ca -0.02 -0.13 0.01 0.00 -2.89 0.00 0.00 54.13 51.10 3k6m s LEU 230 Cb -0.05 -0.41 0.00 0.00 0.66 0.00 0.00 46.19 46.39 3k6m s LEU 230 CO -0.00 0.01 -0.02 0.54 -1.89 0.00 0.00 176.35 174.99 3k6m s VAL 231 N 0.40 0.22 -0.14 1.68 0.11 -0.24 -0.78 120.40 121.66 3k6m s VAL 231 Ca -0.05 -0.08 -0.28 0.00 -2.93 0.00 0.00 61.98 58.64 3k6m s VAL 231 Cb -0.09 -0.21 -0.01 0.00 -1.53 0.00 0.00 36.38 34.53 3k6m s VAL 231 CO 0.00 0.08 0.94 -0.75 -3.33 0.00 0.00 175.10 172.05 3k6m s LYS 232 N 0.15 4.36 0.30 1.54 2.20 -1.26 -1.71 119.74 125.33 3k6m s LYS 232 Ca -0.01 1.25 -0.29 0.00 -0.36 0.00 0.00 55.97 56.56 3k6m s LYS 232 Cb -0.04 -3.56 -0.10 0.00 -1.51 0.00 0.00 37.83 32.62 3k6m s LYS 232 CO -0.00 -0.34 1.33 0.20 -0.36 0.00 0.00 175.35 176.17 3k6m s GLY 233 N 1.12 2.82 0.17 5.54 0.00 0.01 -4.88 107.32 112.10 3k6m s GLY 233 Ca 0.44 1.25 -0.04 0.00 0.00 0.00 0.00 44.72 46.38 3k6m s GLY 233 CO 0.15 1.99 1.45 -2.09 0.00 0.00 0.00 173.10 174.59 3k6m h GLU 234 N 3.90 0.52 -3.50 2.90 4.81 -1.92 -3.46 114.58 117.83 3k6m h GLU 234 Ca -0.48 -0.38 -0.24 0.00 -0.13 0.00 0.00 59.36 58.13 3k6m h GLU 234 Cb 1.22 0.07 -0.30 0.00 0.63 0.00 0.00 28.75 30.37 3k6m h GLU 234 CO 0.69 1.00 -0.65 0.21 -0.73 0.00 0.00 179.01 179.53 3k6m s LYS 235 N -3.79 0.05 -0.19 1.92 2.20 -1.26 -5.13 119.74 113.55 3k6m s LYS 235 Ca -0.07 0.17 -0.01 0.00 -0.36 0.00 0.00 55.97 55.69 3k6m s LYS 235 Cb 0.11 -0.07 0.05 0.00 -1.51 0.00 0.00 37.83 36.41 3k6m s LYS 235 CO 0.85 -0.07 -0.01 0.71 -0.36 0.00 0.00 175.35 176.46 3k6m s TYR 236 N 0.49 1.54 -0.68 4.03 1.51 -1.26 -4.66 117.35 118.32 3k6m s TYR 236 Ca -0.04 -1.12 0.25 0.00 -1.01 0.00 0.00 57.07 55.16 3k6m s TYR 236 Cb -0.05 -1.23 0.64 0.00 -0.11 0.00 0.00 41.96 41.21 3k6m s TYR 236 CO -0.02 -0.64 1.64 0.93 -1.11 0.00 0.00 175.55 176.35 3k6m h GLU 237 N 8.14 0.00 -6.16 -0.62 5.08 -2.01 -3.47 114.58 115.54 3k6m h GLU 237 Ca -0.19 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.72 3k6m h GLU 237 Cb 1.11 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.37 3k6m h GLU 237 CO 0.37 0.00 -0.74 1.63 -1.00 0.00 0.00 179.01 179.27 3k6m n LYS 238 N -2.31 -6.26 -2.19 2.33 5.02 -1.26 -4.89 118.16 108.60 3k6m n LYS 238 Ca 0.05 0.67 -0.40 0.00 -2.02 0.00 0.00 58.31 56.60 3k6m n LYS 238 Cb 0.44 -5.60 -0.02 0.00 -0.02 0.00 0.00 35.03 29.83 3k6m n LYS 238 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3k6m s ARG 239 N -6.51 4.37 -0.17 1.97 0.52 -1.26 -4.80 118.95 113.06 3k6m s ARG 239 Ca 0.62 2.12 0.01 0.00 -0.52 0.00 0.00 55.73 57.96 3k6m s ARG 239 Cb -0.30 -3.05 0.02 0.00 0.52 0.00 0.00 34.95 32.14 3k6m s ARG 239 CO 0.80 -0.14 -0.18 0.42 0.02 0.00 0.00 175.30 176.22 3k6m s ILE 240 N -1.17 1.91 0.07 1.52 1.01 -1.26 -4.88 121.20 118.40 3k6m s ILE 240 Ca 0.49 -0.87 -0.16 0.00 0.00 0.00 0.00 60.65 60.12 3k6m s ILE 240 Cb -0.38 -1.75 -0.15 0.00 0.01 0.00 0.00 42.46 40.19 3k6m s ILE 240 CO 0.50 0.49 1.30 -0.08 0.00 0.00 0.00 174.94 177.16 3k6m h GLU 241 N 7.97 0.64 -3.37 2.79 4.81 -1.95 -3.42 114.58 122.05 3k6m h GLU 241 Ca -0.43 -0.46 -0.52 0.00 -0.13 0.00 0.00 59.36 57.82 3k6m h GLU 241 Cb 1.14 0.08 -0.40 0.00 0.63 0.00 0.00 28.75 30.19 3k6m h GLU 241 CO 0.60 1.08 -0.76 1.03 -0.73 0.00 0.00 179.01 180.23 3k6m s ARG 242 N -3.90 0.50 -0.60 1.92 0.52 -1.25 -5.09 118.95 111.05 3k6m s ARG 242 Ca -0.12 -0.47 -0.24 0.00 -0.52 0.00 0.00 55.73 54.38 3k6m s ARG 242 Cb 0.07 -1.94 0.05 0.00 0.52 0.00 0.00 34.95 33.65 3k6m s ARG 242 CO 0.85 -0.74 1.00 -1.17 0.02 0.00 0.00 175.30 175.26 3k6m s LEU 243 N 1.90 4.02 -0.28 2.53 2.96 -1.26 -2.61 118.68 125.93 3k6m s LEU 243 Ca 0.02 -0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 3k6m s LEU 243 Cb -0.17 -2.72 0.05 0.00 0.50 0.00 0.00 46.19 43.85 3k6m s LEU 243 CO -0.14 -1.37 -0.03 -0.44 -1.32 0.00 0.00 176.35 173.05 3k6m s SER 244 N 3.16 4.69 0.05 3.68 0.01 -1.26 -4.96 113.70 119.07 3k6m s SER 244 Ca 0.30 -1.20 0.05 0.00 1.31 0.00 0.00 55.95 56.41 3k6m s SER 244 Cb -0.13 -1.68 -0.02 0.00 0.21 0.00 0.00 66.02 64.40 3k6m s SER 244 CO 0.17 -0.22 -0.14 0.68 0.41 0.00 0.00 173.24 174.14 3k6m s VAL 245 N 1.25 1.14 0.13 3.43 -7.23 -1.26 -3.88 120.40 113.98 3k6m s VAL 245 Ca -0.05 -1.06 -0.10 0.00 -1.81 0.00 0.00 61.98 58.96 3k6m s VAL 245 Cb -0.19 -1.04 -0.06 0.00 0.56 0.00 0.00 36.38 35.64 3k6m s VAL 245 CO -0.02 -0.02 0.45 0.00 -0.31 0.00 0.00 175.10 175.19 3k6m s ARG 246 N -1.24 3.78 0.00 4.82 1.70 -0.30 -4.93 118.95 122.78 3k6m s ARG 246 Ca 0.01 0.20 0.00 0.00 -0.47 0.00 0.00 55.73 55.48 3k6m s ARG 246 Cb -0.08 -2.90 0.00 0.00 -0.57 0.00 0.00 34.95 31.40 3k6m s ARG 246 CO 0.01 0.49 0.00 -1.71 -1.08 0.00 0.00 175.30 173.01 3k6m n ASN 261 N 0.57 0.00 0.29 -2.89 2.85 -1.26 -4.61 115.26 110.21 3k6m n ASN 261 Ca -0.05 0.00 -0.16 0.00 -0.11 0.00 0.00 54.58 54.26 3k6m n ASN 261 Cb 0.52 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.46 3k6m n ASN 261 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 3k6m h VAL 262 N 0.00 0.41 -0.63 3.44 2.07 -2.00 -2.48 116.25 117.05 3k6m h VAL 262 Ca 0.00 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 3k6m h VAL 262 Cb 0.00 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 3k6m h VAL 262 CO 0.00 0.04 0.37 0.03 0.02 0.00 0.00 177.57 178.03 3k6m h ARG 263 N -0.90 0.87 -0.60 1.57 3.08 -2.01 -2.34 114.38 114.05 3k6m h ARG 263 Ca -0.07 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 3k6m h ARG 263 Cb 0.62 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 3k6m h ARG 263 CO 0.12 0.63 0.34 0.93 -1.07 0.00 0.00 179.97 180.92 3k6m h GLU 264 N 0.86 0.81 -0.38 0.04 5.08 -1.99 0.81 114.58 119.82 3k6m h GLU 264 Ca 0.23 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3k6m h GLU 264 Cb -0.01 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 3k6m h GLU 264 CO -0.04 0.58 0.24 0.00 -1.00 0.00 0.00 179.01 178.79 3k6m h ARG 265 N 0.82 0.51 -0.08 2.33 3.08 -0.95 0.16 114.38 120.25 3k6m h ARG 265 Ca 0.21 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 3k6m h ARG 265 Cb -0.00 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 3k6m h ARG 265 CO -0.04 0.36 0.01 0.82 -1.07 0.00 0.00 179.97 180.05 3k6m h ILE 266 N 0.51 1.22 -0.45 2.04 2.04 -0.96 -1.98 117.51 119.93 3k6m h ILE 266 Ca 0.14 -0.68 0.06 0.00 1.00 0.00 0.00 64.86 65.38 3k6m h ILE 266 Cb -0.03 1.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.53 3k6m h ILE 266 CO -0.03 0.19 0.16 0.40 0.00 0.00 0.00 178.15 178.87 3k6m h ILE 267 N -0.12 0.86 0.00 -0.67 2.04 -0.78 0.19 117.51 119.04 3k6m h ILE 267 Ca 0.02 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 3k6m h ILE 267 Cb 0.29 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3k6m h ILE 267 CO 0.00 0.06 -0.14 0.11 0.00 0.00 0.00 178.15 178.18 3k6m h LYS 268 N 0.34 0.00 0.16 2.37 1.57 -0.87 -1.22 116.57 118.92 3k6m h LYS 268 Ca 0.21 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.72 3k6m h LYS 268 Cb 0.20 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.53 3k6m h LYS 268 CO -0.21 0.14 -1.27 -0.09 -0.57 0.00 0.00 179.45 177.45 3k6m h ARG 269 N 0.00 0.34 -0.86 3.15 9.65 -0.75 -0.54 114.38 125.37 3k6m h ARG 269 Ca -0.00 -0.57 0.13 0.00 -1.10 0.00 0.00 59.98 58.44 3k6m h ARG 269 Cb 0.50 0.21 -0.07 0.00 -1.39 0.00 0.00 29.97 29.23 3k6m h ARG 269 CO 0.02 1.28 0.56 0.00 2.80 0.00 0.00 179.97 184.62 3k6m h ALA 270 N 0.05 1.85 -0.24 2.80 0.00 -0.41 -0.71 119.26 122.60 3k6m h ALA 270 Ca -0.25 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.74 3k6m h ALA 270 Cb 1.84 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 3k6m h ALA 270 CO 0.14 -0.07 0.21 0.00 0.00 0.00 0.00 179.25 179.53 3k6m h ALA 271 N 1.60 2.02 0.00 0.00 0.00 -1.36 -1.48 119.26 120.04 3k6m h ALA 271 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3k6m h ALA 271 Cb 0.68 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3k6m h ALA 271 CO -0.18 -0.33 0.00 1.28 0.00 0.00 0.00 179.25 180.02 3k6m n LEU 272 N -4.09 0.00 0.16 0.00 4.77 -0.27 -3.14 117.00 114.42 3k6m n LEU 272 Ca 0.03 0.11 0.12 0.00 -0.03 0.00 0.00 56.01 56.25 3k6m n LEU 272 Cb 0.35 -0.11 0.28 0.00 -2.33 0.00 0.00 43.42 41.61 3k6m n LEU 272 CO 0.31 -0.00 0.83 -0.33 -1.33 0.00 0.00 177.39 176.86 3k6m h GLU 273 N 0.00 0.00 -6.49 3.23 4.39 -1.39 -3.45 114.58 110.87 3k6m h GLU 273 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 3k6m h GLU 273 Cb 0.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 3k6m h GLU 273 CO 0.00 0.00 0.53 -0.06 -1.16 0.00 0.00 179.01 178.32 3k6m s PHE 274 N -3.16 3.48 0.19 4.33 0.40 -1.19 -5.05 117.98 116.98 3k6m s PHE 274 Ca 0.09 1.37 0.10 0.00 -0.60 0.00 0.00 56.93 57.89 3k6m s PHE 274 Cb 0.09 -3.37 -0.04 0.00 0.51 0.00 0.00 43.02 40.20 3k6m s PHE 274 CO 0.64 -1.07 -0.16 -1.21 0.70 0.00 0.00 175.22 174.11 3k6m s GLU 275 N 0.95 1.82 0.14 0.44 2.02 -1.26 -5.09 118.70 117.72 3k6m s GLU 275 Ca 0.57 -1.39 -0.31 0.00 0.02 0.00 0.00 54.97 53.86 3k6m s GLU 275 Cb -0.28 -2.02 -0.09 0.00 0.10 0.00 0.00 34.13 31.84 3k6m s GLU 275 CO 0.29 0.42 1.49 0.34 0.02 0.00 0.00 175.26 177.82 3k6m s ASP 276 N -2.77 6.69 0.00 -0.19 3.68 -1.26 -2.30 116.67 120.52 3k6m s ASP 276 Ca 0.23 2.49 0.00 0.00 2.13 0.00 0.00 52.55 57.40 3k6m s ASP 276 Cb -0.08 -2.59 0.00 0.00 -1.45 0.00 0.00 42.92 38.80 3k6m s ASP 276 CO 0.13 -0.75 0.00 0.61 0.13 0.00 0.00 175.17 175.29 3k6m n GLY 277 N 3.64 0.78 3.77 2.66 0.00 0.37 -4.92 105.19 111.50 3k6m n GLY 277 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 3k6m n GLY 277 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3k6m s MET 278 N -0.40 4.39 -0.24 1.61 0.00 -0.97 -4.83 119.30 118.85 3k6m s MET 278 Ca 0.00 1.74 -0.11 0.00 0.00 0.00 0.00 55.69 57.32 3k6m s MET 278 Cb 0.00 -2.91 -0.05 0.00 0.00 0.00 0.00 34.83 31.87 3k6m s MET 278 CO 0.00 0.01 0.19 0.71 0.00 0.00 0.00 175.02 175.93 3k6m s TYR 279 N -1.34 3.31 0.07 4.11 1.51 -1.26 -0.62 117.35 123.12 3k6m s TYR 279 Ca 0.51 0.25 0.04 0.00 -1.01 0.00 0.00 57.07 56.85 3k6m s TYR 279 Cb -0.29 -2.32 -0.03 0.00 -0.11 0.00 0.00 41.96 39.21 3k6m s TYR 279 CO 0.37 0.02 -0.11 0.00 -1.11 0.00 0.00 175.55 174.73 3k6m s ALA 280 N 1.20 0.96 -0.17 3.71 0.00 -0.51 -1.18 121.76 125.78 3k6m s ALA 280 Ca 0.09 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.06 3k6m s ALA 280 Cb -0.14 -0.01 0.02 0.00 0.00 0.00 0.00 23.12 22.99 3k6m s ALA 280 CO 0.06 0.03 -0.20 1.21 0.00 0.00 0.00 175.76 176.86 3k6m s ASN 281 N -1.95 3.15 -0.17 0.00 3.84 0.19 -0.61 114.94 119.39 3k6m s ASN 281 Ca -0.02 -0.63 -0.02 0.00 0.21 0.00 0.00 52.86 52.40 3k6m s ASN 281 Cb -0.07 -1.48 -0.01 0.00 -0.55 0.00 0.00 41.25 39.14 3k6m s ASN 281 CO 0.01 0.02 -0.08 -0.76 -2.79 0.00 0.00 177.10 173.50 3k6m s LEU 282 N 1.17 2.87 0.88 3.21 1.43 -1.26 -1.50 118.68 125.48 3k6m s LEU 282 Ca 0.02 -0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 52.67 3k6m s LEU 282 Cb -0.14 -1.69 0.12 0.00 0.03 0.00 0.00 46.19 44.51 3k6m s LEU 282 CO -0.10 0.09 1.13 -0.83 0.23 0.00 0.00 176.35 176.86 3k6m s GLY 283 N 0.84 1.59 0.41 -3.19 0.00 -0.42 -4.69 107.32 101.85 3k6m s GLY 283 Ca -0.02 -0.43 -0.27 0.00 0.00 0.00 0.00 44.72 43.99 3k6m s GLY 283 CO 0.01 0.09 1.47 -0.26 0.00 0.00 0.00 173.10 174.41 3k6m s ILE 284 N -3.24 2.04 0.00 0.90 -4.36 -1.26 -2.61 121.20 112.67 3k6m s ILE 284 Ca 0.63 0.04 0.00 0.00 -0.26 0.00 0.00 60.65 61.06 3k6m s ILE 284 Cb -0.15 -3.02 0.00 0.00 1.25 0.00 0.00 42.46 40.54 3k6m s ILE 284 CO 0.54 0.01 0.00 0.61 0.24 0.00 0.00 174.94 176.33 3k6m n GLY 285 N 0.50 0.91 0.21 6.27 0.00 -1.26 -4.53 105.19 107.29 3k6m n GLY 285 Ca 0.03 -1.09 -0.01 0.00 0.00 0.00 0.00 46.02 44.94 3k6m n GLY 285 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3k6m h ILE 286 N 0.00 0.67 -0.49 -0.61 2.04 -1.93 -1.52 117.51 115.67 3k6m h ILE 286 Ca 0.00 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.79 3k6m h ILE 286 Cb 0.00 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 3k6m h ILE 286 CO 0.00 0.04 0.32 -0.65 0.00 0.00 0.00 178.15 177.86 3k6m h PRO 287 N 0.22 0.65 -0.48 2.37 0.11 -1.80 -0.17 132.00 132.90 3k6m h PRO 287 Ca 0.27 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.29 3k6m h PRO 287 Cb 0.39 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 3k6m h PRO 287 CO -0.37 0.44 0.09 1.25 -0.21 0.00 0.00 178.00 179.19 3k6m h LEU 288 N 0.67 0.76 -1.53 2.35 5.85 -1.22 -2.27 115.31 119.91 3k6m h LEU 288 Ca 0.18 -0.25 0.05 0.00 0.84 0.00 0.00 57.88 58.70 3k6m h LEU 288 Cb -0.07 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 3k6m h LEU 288 CO -0.04 0.82 0.38 -0.07 -0.34 0.00 0.00 178.44 179.19 3k6m h LEU 289 N 0.67 0.51 -2.10 2.25 3.38 -1.03 -1.49 115.31 117.49 3k6m h LEU 289 Ca 0.15 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3k6m h LEU 289 Cb 0.38 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 3k6m h LEU 289 CO 0.01 0.34 -0.02 0.00 0.09 0.00 0.00 178.44 178.86 3k6m h ALA 290 N 1.68 1.82 0.00 1.53 0.00 -0.42 -2.55 119.26 121.33 3k6m h ALA 290 Ca 0.24 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3k6m h ALA 290 Cb 0.22 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3k6m h ALA 290 CO -0.07 0.02 -0.14 0.66 0.00 0.00 0.00 179.25 179.72 3k6m h SER 291 N 0.00 0.00 0.22 0.00 4.64 -1.20 -2.12 113.55 115.10 3k6m h SER 291 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3k6m h SER 291 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3k6m h SER 291 CO 0.00 0.14 0.00 0.59 -0.87 0.00 0.00 176.83 176.70 3k6m n ASN 292 N -3.57 0.22 -0.65 4.97 3.02 -0.96 -2.32 115.26 115.97 3k6m n ASN 292 Ca -0.01 0.58 0.06 0.00 -0.03 0.00 0.00 54.58 55.18 3k6m n ASN 292 Cb 0.28 -0.62 0.15 0.00 -0.61 0.00 0.00 39.78 38.98 3k6m n ASN 292 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3k6m n PHE 293 N -1.78 0.43 -0.09 3.10 3.72 -0.79 -5.19 117.46 116.87 3k6m n PHE 293 Ca 0.01 -0.44 0.00 0.00 -0.05 0.00 0.00 57.45 56.97 3k6m n PHE 293 Cb 0.08 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 3k6m n PHE 293 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3k6m n ILE 294 N 0.59 0.00 0.00 4.37 5.41 -0.98 -4.98 119.36 123.77 3k6m n ILE 294 Ca 0.12 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.87 3k6m n ILE 294 Cb 0.42 -0.45 0.00 0.00 -0.71 0.00 0.00 39.64 38.90 3k6m n ILE 294 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 3k6m n MET 298 N -0.67 0.00 -3.41 0.38 2.00 -1.26 -5.14 117.12 109.02 3k6m n MET 298 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 57.70 57.30 3k6m n MET 298 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 33.22 33.13 3k6m n MET 298 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 3k6m s THR 299 N -1.00 5.18 -0.10 2.03 2.01 -1.26 -4.98 115.64 117.52 3k6m s THR 299 Ca 0.00 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.19 3k6m s THR 299 Cb 0.00 -3.77 0.02 0.00 0.01 0.00 0.00 72.50 68.76 3k6m s THR 299 CO 0.00 -0.01 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.13 3k6m s VAL 300 N 2.02 1.14 -0.35 3.82 1.01 -1.26 0.14 120.40 126.92 3k6m s VAL 300 Ca 0.12 -0.41 -0.13 0.00 0.00 0.00 0.00 61.98 61.56 3k6m s VAL 300 Cb -0.16 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.11 3k6m s VAL 300 CO 0.11 0.38 0.24 -1.00 0.00 0.00 0.00 175.10 174.83 3k6m s HIS 301 N 1.26 3.23 -0.16 5.22 3.76 0.21 -4.99 115.29 123.81 3k6m s HIS 301 Ca -0.03 -0.32 -0.18 0.00 -0.15 0.00 0.00 55.06 54.38 3k6m s HIS 301 Cb -0.14 -2.49 -0.04 0.00 1.11 0.00 0.00 32.58 31.03 3k6m s HIS 301 CO -0.04 -0.42 0.48 -0.51 -0.85 0.00 0.00 174.74 173.40 3k6m s LEU 302 N 1.70 4.21 -0.05 0.89 1.43 -1.26 -1.42 118.68 124.18 3k6m s LEU 302 Ca 0.06 0.71 -0.04 0.00 -1.03 0.00 0.00 54.13 53.83 3k6m s LEU 302 Cb -0.18 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.34 3k6m s LEU 302 CO 0.10 -0.07 0.17 -1.58 0.23 0.00 0.00 176.35 175.20 3k6m s GLN 303 N 1.09 3.44 -0.13 1.70 -0.44 0.22 -0.35 119.66 125.20 3k6m s GLN 303 Ca 0.24 -0.24 0.02 0.00 -2.50 0.00 0.00 55.36 52.88 3k6m s GLN 303 Cb -0.15 -3.13 0.01 0.00 -1.64 0.00 0.00 33.01 28.10 3k6m s GLN 303 CO 0.09 0.72 -0.18 0.45 0.50 0.00 0.00 175.29 176.87 3k6m s SER 304 N -1.58 2.77 0.65 6.67 0.15 0.48 -4.47 113.70 118.37 3k6m s SER 304 Ca 0.23 -0.52 0.39 0.00 0.70 0.00 0.00 55.95 56.75 3k6m s SER 304 Cb -0.12 -1.27 2.18 0.00 -1.71 0.00 0.00 66.02 65.10 3k6m s SER 304 CO 0.13 0.04 2.27 1.05 1.20 0.00 0.00 173.24 177.93 3k6m h GLU 305 N 7.41 0.00 -0.01 5.44 4.11 -1.95 0.39 114.58 129.97 3k6m h GLU 305 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.11 3k6m h GLU 305 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3k6m h GLU 305 CO 0.52 0.00 0.00 0.27 0.07 0.00 0.00 179.01 179.87 3k6m n ASN 306 N -3.21 0.10 0.00 3.06 6.94 -1.26 -4.76 115.26 116.13 3k6m n ASN 306 Ca -0.02 -1.33 0.00 0.00 -0.02 0.00 0.00 54.58 53.21 3k6m n ASN 306 Cb 0.14 -0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.56 3k6m n ASN 306 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3k6m n GLY 307 N 0.87 0.97 3.08 4.83 0.00 0.08 -4.33 105.19 110.69 3k6m n GLY 307 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 3k6m n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k6m s ILE 308 N -1.74 1.00 -0.11 -0.61 1.01 -0.94 -1.48 121.20 118.33 3k6m s ILE 308 Ca 0.00 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 60.14 3k6m s ILE 308 Cb 0.00 -0.84 0.01 0.00 0.01 0.00 0.00 42.46 41.64 3k6m s ILE 308 CO 0.00 0.29 -0.17 -0.22 0.00 0.00 0.00 174.94 174.83 3k6m s LEU 309 N -0.21 1.84 0.00 2.97 2.96 -0.10 -0.39 118.68 125.75 3k6m s LEU 309 Ca 0.03 -0.47 0.00 0.00 -0.22 0.00 0.00 54.13 53.47 3k6m s LEU 309 Cb -0.06 -1.18 0.00 0.00 0.50 0.00 0.00 46.19 45.45 3k6m s LEU 309 CO -0.00 0.05 0.00 0.61 -1.32 0.00 0.00 176.35 175.69 3k6m n GLY 310 N 4.05 1.06 3.65 7.98 0.00 0.52 -1.32 105.19 121.13 3k6m n GLY 310 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 3k6m n GLY 310 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k6m n LEU 311 N 0.00 2.98 0.00 0.99 4.77 -0.84 -0.63 117.00 124.27 3k6m n LEU 311 Ca 0.00 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.12 3k6m n LEU 311 Cb 0.00 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 39.68 3k6m n LEU 311 CO 0.00 -0.97 0.00 0.61 -1.33 0.00 0.00 177.39 175.70 3k6m n GLY 312 N 0.98 6.20 3.70 -0.72 0.00 0.23 -4.55 105.19 111.05 3k6m n GLY 312 Ca 0.07 -2.11 -0.29 0.00 0.00 0.00 0.00 46.02 43.70 3k6m n GLY 312 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k6m s PRO 313 N -0.35 0.21 0.60 1.61 0.04 -1.26 -4.27 135.00 131.58 3k6m s PRO 313 Ca 0.00 0.23 -0.19 0.00 0.04 0.00 0.00 61.00 61.08 3k6m s PRO 313 Cb 0.00 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.77 3k6m s PRO 313 CO 0.00 -2.82 1.25 0.71 0.04 0.00 0.00 177.00 176.19 3k6m s TYR 314 N -3.13 2.30 0.60 0.56 4.12 -1.26 -2.12 117.35 118.42 3k6m s TYR 314 Ca 0.67 1.49 -0.16 0.00 0.02 0.00 0.00 57.07 59.09 3k6m s TYR 314 Cb -0.14 -3.59 -0.03 0.00 -1.52 0.00 0.00 41.96 36.68 3k6m s TYR 314 CO 0.56 -2.50 1.07 -1.25 0.02 0.00 0.00 175.55 173.46 3k6m s PRO 315 N -3.26 3.20 0.74 -1.71 0.04 -1.25 -4.33 135.00 128.42 3k6m s PRO 315 Ca 0.78 1.28 -0.11 0.00 0.04 0.00 0.00 61.00 62.99 3k6m s PRO 315 Cb -0.34 -2.01 0.04 0.00 0.04 0.00 0.00 34.50 32.23 3k6m s PRO 315 CO 0.37 -0.92 1.08 -0.51 0.04 0.00 0.00 177.00 177.07 3k6m s LEU 316 N -4.52 3.11 0.30 -3.56 1.43 -1.26 -1.15 118.68 113.04 3k6m s LEU 316 Ca 0.65 1.79 0.06 0.00 -1.03 0.00 0.00 54.13 55.60 3k6m s LEU 316 Cb -0.18 -4.52 0.75 0.00 0.03 0.00 0.00 46.19 42.27 3k6m s LEU 316 CO 0.37 -1.82 1.75 -0.61 0.23 0.00 0.00 176.35 176.28 3k6m h GLN 317 N -0.85 0.65 -0.00 1.70 5.75 -1.97 0.22 115.11 120.61 3k6m h GLN 317 Ca -0.44 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.02 3k6m h GLN 317 Cb 1.23 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 29.63 3k6m h GLN 317 CO 0.53 0.43 -0.00 0.09 -2.65 0.00 0.00 178.83 177.23 3k6m n ASN 318 N -4.84 0.41 -0.33 -0.69 3.02 -1.26 -2.86 115.26 108.71 3k6m n ASN 318 Ca 0.23 -1.13 0.11 0.00 -0.03 0.00 0.00 54.58 53.76 3k6m n ASN 318 Cb 0.61 -0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.83 3k6m n ASN 318 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3k6m n GLU 319 N -0.68 0.84 -1.91 3.52 1.02 0.76 -4.99 120.64 119.21 3k6m n GLU 319 Ca 0.23 -0.66 -0.42 0.00 -0.02 0.00 0.00 57.16 56.29 3k6m n GLU 319 Cb 0.18 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.08 3k6m n GLU 319 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3k6m s VAL 320 N -2.61 2.50 -0.06 2.62 1.01 -1.14 -4.89 120.40 117.82 3k6m s VAL 320 Ca 0.17 0.37 -0.03 0.00 0.00 0.00 0.00 61.98 62.49 3k6m s VAL 320 Cb 0.18 -3.24 0.04 0.00 0.00 0.00 0.00 36.38 33.36 3k6m s VAL 320 CO 0.63 0.04 0.12 -0.62 0.00 0.00 0.00 175.10 175.27 3k6m s ASP 321 N 0.95 0.69 0.62 3.32 -1.08 -1.26 -5.03 116.67 114.88 3k6m s ASP 321 Ca 0.68 0.24 0.33 0.00 -0.52 0.00 0.00 52.55 53.28 3k6m s ASP 321 Cb -0.45 0.12 1.91 0.00 -1.46 0.00 0.00 42.92 43.04 3k6m s ASP 321 CO 0.35 -0.22 2.20 0.00 0.52 0.00 0.00 175.17 178.01 3k6m h ALA 322 N 8.15 1.47 -0.02 3.66 0.00 -1.91 -1.21 119.26 129.40 3k6m h ALA 322 Ca -0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3k6m h ALA 322 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3k6m h ALA 322 CO 0.21 -0.14 0.00 -0.25 0.00 0.00 0.00 179.25 179.07 3k6m n ASP 323 N -3.54 0.80 -3.66 0.00 8.00 -1.26 -4.68 116.55 112.22 3k6m n ASP 323 Ca -0.01 -1.31 -0.29 0.00 0.71 0.00 0.00 54.79 53.88 3k6m n ASP 323 Cb 0.19 -0.01 -0.14 0.00 -0.02 0.00 0.00 41.12 41.14 3k6m n ASP 323 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3k6m s LEU 324 N -1.94 1.79 0.21 0.64 2.96 -0.46 -1.25 118.68 120.63 3k6m s LEU 324 Ca 0.41 -1.78 0.06 0.00 -0.22 0.00 0.00 54.13 52.60 3k6m s LEU 324 Cb 0.21 -0.72 -0.05 0.00 0.50 0.00 0.00 46.19 46.12 3k6m s LEU 324 CO 0.33 -0.39 -0.08 0.27 -1.32 0.00 0.00 176.35 175.17 3k6m s ILE 325 N 1.47 1.38 0.59 6.68 -4.36 -1.26 -2.29 121.20 123.41 3k6m s ILE 325 Ca 0.12 -2.11 -0.01 0.00 -0.26 0.00 0.00 60.65 58.39 3k6m s ILE 325 Cb -0.19 -2.14 0.12 0.00 1.25 0.00 0.00 42.46 41.50 3k6m s ILE 325 CO -0.21 -0.51 0.81 -0.46 0.24 0.00 0.00 174.94 174.81 3k6m n ASN 326 N -0.38 1.00 0.28 4.36 0.23 0.05 -4.86 115.26 115.94 3k6m n ASN 326 Ca -0.07 -1.87 0.17 0.00 -0.53 0.00 0.00 54.58 52.28 3k6m n ASN 326 Cb 0.62 -0.53 0.70 0.00 -2.08 0.00 0.00 39.78 38.49 3k6m n ASN 326 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3k6m h ALA 327 N -0.66 1.01 -0.08 -2.53 0.00 -1.94 -0.37 119.26 114.68 3k6m h ALA 327 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3k6m h ALA 327 Cb 0.96 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3k6m h ALA 327 CO 0.28 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.96 3k6m n GLY 328 N -0.02 -0.54 2.30 0.00 0.00 -1.26 -4.90 105.19 100.76 3k6m n GLY 328 Ca 0.00 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 3k6m n GLY 328 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k6m n LYS 329 N -0.30 -0.88 -3.68 1.61 5.02 -0.15 -5.01 118.16 114.78 3k6m n LYS 329 Ca 0.08 0.78 -0.36 0.00 -2.02 0.00 0.00 58.31 56.80 3k6m n LYS 329 Cb 0.12 -4.85 -0.06 0.00 -0.02 0.00 0.00 35.03 30.22 3k6m n LYS 329 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3k6m s GLU 330 N -3.64 3.68 0.28 1.97 2.02 -1.26 -3.88 118.70 117.87 3k6m s GLU 330 Ca 0.00 0.08 -0.30 0.00 0.02 0.00 0.00 54.97 54.77 3k6m s GLU 330 Cb 0.00 -3.10 -0.12 0.00 0.10 0.00 0.00 34.13 31.01 3k6m s GLU 330 CO 0.00 0.65 1.57 0.25 0.02 0.00 0.00 175.26 177.75 3k6m n THR 331 N 1.30 1.00 -4.31 3.63 -2.24 -1.07 -0.77 114.28 111.83 3k6m n THR 331 Ca -0.12 -0.25 -0.20 0.00 -2.27 0.00 0.00 64.05 61.21 3k6m n THR 331 Cb 0.53 -1.88 -0.08 0.00 -2.10 0.00 0.00 70.33 66.79 3k6m n THR 331 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3k6m s VAL 332 N -0.00 0.05 0.40 2.28 -7.23 -0.97 -4.41 120.40 110.51 3k6m s VAL 332 Ca 0.65 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.86 3k6m s VAL 332 Cb -0.52 -2.48 -0.06 0.00 0.56 0.00 0.00 36.38 33.88 3k6m s VAL 332 CO 0.49 0.00 0.04 0.42 -0.31 0.00 0.00 175.10 175.74 3k6m s THR 333 N -3.41 1.41 0.17 5.32 -4.23 -0.90 -4.59 115.64 109.41 3k6m s THR 333 Ca 0.39 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 59.00 3k6m s THR 333 Cb 0.02 -2.71 -0.04 0.00 1.34 0.00 0.00 72.50 71.11 3k6m s THR 333 CO 0.27 0.00 -0.21 0.68 -0.54 0.00 0.00 174.62 174.82 3k6m s VAL 334 N -3.00 2.00 0.61 2.29 -7.23 -1.26 -0.60 120.40 113.21 3k6m s VAL 334 Ca 0.29 -1.91 -0.02 0.00 -1.81 0.00 0.00 61.98 58.54 3k6m s VAL 334 Cb 0.07 -1.91 0.04 0.00 0.56 0.00 0.00 36.38 35.15 3k6m s VAL 334 CO 0.14 -0.20 0.87 -0.76 -0.31 0.00 0.00 175.10 174.83 3k6m s LEU 335 N -2.56 3.10 0.38 1.32 1.43 0.19 -4.68 118.68 117.87 3k6m s LEU 335 Ca 0.16 0.17 -0.26 0.00 -1.03 0.00 0.00 54.13 53.17 3k6m s LEU 335 Cb -0.07 -2.96 -0.11 0.00 0.03 0.00 0.00 46.19 43.07 3k6m s LEU 335 CO 0.07 -1.31 1.24 -2.65 0.23 0.00 0.00 176.35 173.93 3k6m n PRO 336 N -2.56 1.92 -1.12 1.29 -0.02 -1.26 -2.30 135.00 130.93 3k6m n PRO 336 Ca 0.08 0.68 -0.04 0.00 -2.02 0.00 0.00 63.50 62.19 3k6m n PRO 336 Cb 0.60 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.76 3k6m n PRO 336 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k6m n GLY 337 N 0.85 0.70 3.74 -1.23 0.00 -1.26 -5.04 105.19 102.96 3k6m n GLY 337 Ca 0.06 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 3k6m n GLY 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k6m s ALA 338 N -2.10 1.85 0.04 4.61 0.00 -0.97 -4.93 121.76 120.26 3k6m s ALA 338 Ca 0.00 0.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.98 3k6m s ALA 338 Cb 0.00 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 3k6m s ALA 338 CO 0.00 -2.10 0.05 -1.54 0.00 0.00 0.00 175.76 172.17 3k6m s SER 339 N -3.43 0.25 0.10 0.00 1.04 -0.44 -4.99 113.70 106.23 3k6m s SER 339 Ca 0.62 -0.62 0.10 0.00 0.48 0.00 0.00 55.95 56.54 3k6m s SER 339 Cb -0.17 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 66.11 3k6m s SER 339 CO 0.56 -0.49 -0.27 -0.31 0.98 0.00 0.00 173.24 173.72 3k6m s TYR 340 N -2.68 2.29 0.28 5.02 1.51 -1.26 -0.92 117.35 121.58 3k6m s TYR 340 Ca -0.04 -0.39 -0.20 0.00 -1.01 0.00 0.00 57.07 55.43 3k6m s TYR 340 Cb -0.01 -1.28 0.02 0.00 -0.11 0.00 0.00 41.96 40.58 3k6m s TYR 340 CO -0.05 0.27 0.69 -0.59 -1.11 0.00 0.00 175.55 174.76 3k6m s PHE 341 N -0.99 -0.11 0.78 2.71 -0.12 -0.55 -5.00 117.98 114.70 3k6m s PHE 341 Ca 0.13 -0.33 -0.12 0.00 -0.05 0.00 0.00 56.93 56.56 3k6m s PHE 341 Cb -0.10 0.64 0.06 0.00 -0.63 0.00 0.00 43.02 42.99 3k6m s PHE 341 CO 0.05 -1.20 1.14 -1.54 -0.05 0.00 0.00 175.22 173.62 3k6m s SER 342 N -2.93 4.73 0.21 1.98 1.04 -1.26 -4.36 113.70 113.10 3k6m s SER 342 Ca 0.13 0.95 -0.07 0.00 0.48 0.00 0.00 55.95 57.44 3k6m s SER 342 Cb -0.05 -1.57 0.15 0.00 0.10 0.00 0.00 66.02 64.65 3k6m s SER 342 CO 0.07 -1.78 1.71 0.28 0.98 0.00 0.00 173.24 174.50 3k6m h SER 343 N -0.97 1.01 -0.71 7.02 0.02 -1.40 0.17 113.55 118.69 3k6m h SER 343 Ca -0.46 -0.24 -0.04 0.00 -0.84 0.00 0.00 61.79 60.21 3k6m h SER 343 Cb 1.30 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 63.54 3k6m h SER 343 CO 0.64 1.02 0.29 -2.24 -1.14 0.00 0.00 176.83 175.40 3k6m h ASP 344 N 0.99 0.97 -0.38 3.07 2.03 -1.84 -1.75 116.42 119.51 3k6m h ASP 344 Ca 0.19 -0.17 -0.16 0.00 -0.73 0.00 0.00 57.03 56.17 3k6m h ASP 344 Cb 0.44 -0.25 -0.01 0.00 -0.83 0.00 0.00 39.33 38.68 3k6m h ASP 344 CO 0.01 0.87 -0.38 -0.33 -1.03 0.00 0.00 179.24 178.39 3k6m h GLU 345 N 1.01 0.92 -0.58 4.15 4.39 -1.84 -0.85 114.58 121.78 3k6m h GLU 345 Ca 0.24 -0.49 0.04 0.00 0.34 0.00 0.00 59.36 59.49 3k6m h GLU 345 Cb 0.20 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.82 3k6m h GLU 345 CO -0.02 1.14 0.32 1.03 -1.16 0.00 0.00 179.01 180.33 3k6m h SER 346 N 0.74 0.49 1.76 1.42 0.87 -0.47 -1.68 113.55 116.69 3k6m h SER 346 Ca 0.06 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.61 3k6m h SER 346 Cb 0.97 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.85 3k6m h SER 346 CO 0.09 0.34 -0.24 -0.26 -0.53 0.00 0.00 176.83 176.23 3k6m h PHE 347 N 0.62 0.00 -0.62 2.24 -1.00 -1.23 -1.88 116.94 115.06 3k6m h PHE 347 Ca 0.25 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.01 3k6m h PHE 347 Cb 0.11 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.64 3k6m h PHE 347 CO -0.08 0.14 0.30 0.00 -1.61 0.00 0.00 178.31 177.05 3k6m h ALA 348 N 1.86 0.80 -0.73 2.45 0.00 -0.97 0.33 119.26 123.02 3k6m h ALA 348 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3k6m h ALA 348 Cb 1.11 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 3k6m h ALA 348 CO 0.02 0.37 0.45 1.98 0.00 0.00 0.00 179.25 182.07 3k6m h MET 349 N 0.86 0.97 0.01 0.00 1.85 -0.99 -0.56 114.93 117.08 3k6m h MET 349 Ca 0.21 -0.08 -0.00 0.00 -0.61 0.00 0.00 59.70 59.23 3k6m h MET 349 Cb 0.12 -0.21 0.00 0.00 0.43 0.00 0.00 31.60 31.94 3k6m h MET 349 CO -0.03 0.67 -0.01 0.82 -0.40 0.00 0.00 176.91 177.97 3k6m h ILE 350 N 0.99 1.52 -0.10 1.77 2.04 -1.27 -2.38 117.51 120.07 3k6m h ILE 350 Ca 0.26 -1.70 -0.07 0.00 1.00 0.00 0.00 64.86 64.35 3k6m h ILE 350 Cb -0.06 2.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 3k6m h ILE 350 CO -0.05 0.43 -0.27 0.03 0.00 0.00 0.00 178.15 178.29 3k6m h ARG 351 N -0.76 0.18 0.00 2.37 3.08 -0.31 -2.05 114.38 116.88 3k6m h ARG 351 Ca -0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3k6m h ARG 351 Cb 0.72 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.76 3k6m h ARG 351 CO 0.00 0.44 0.00 0.41 -1.07 0.00 0.00 179.97 179.75 3k6m n GLY 352 N -0.58 -0.91 2.08 0.04 0.00 -0.22 -4.63 105.19 100.97 3k6m n GLY 352 Ca -0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 46.02 45.83 3k6m n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k6m n GLY 353 N 0.74 0.49 0.18 -0.02 0.00 -0.77 -4.95 105.19 100.87 3k6m n GLY 353 Ca 0.18 -0.86 0.06 0.00 0.00 0.00 0.00 46.02 45.40 3k6m n GLY 353 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3k6m h HIS 354 N 0.00 0.00 -3.46 1.61 3.86 -1.63 -3.41 115.15 112.12 3k6m h HIS 354 Ca -0.07 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.61 3k6m h HIS 354 Cb 0.51 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 3k6m h HIS 354 CO 0.09 0.33 0.41 0.08 0.86 0.00 0.00 177.93 179.71 3k6m s VAL 355 N -3.20 4.44 0.07 2.45 1.01 -1.26 -4.91 120.40 118.99 3k6m s VAL 355 Ca 0.04 1.90 -0.14 0.00 0.00 0.00 0.00 61.98 63.78 3k6m s VAL 355 Cb 0.08 -4.21 -0.26 0.00 0.00 0.00 0.00 36.38 31.98 3k6m s VAL 355 CO 0.70 0.23 1.15 0.78 0.00 0.00 0.00 175.10 177.95 3k6m h ASN 356 N 6.08 0.87 -3.30 3.32 -0.26 -1.42 -3.40 115.58 117.47 3k6m h ASN 356 Ca -0.42 -0.76 -0.44 0.00 -0.56 0.00 0.00 56.30 54.12 3k6m h ASN 356 Cb 1.21 -0.27 -0.37 0.00 -1.06 0.00 0.00 38.32 37.83 3k6m h ASN 356 CO 0.74 1.57 -0.77 -0.22 -1.06 0.00 0.00 177.43 177.69 3k6m s LEU 357 N -7.94 0.82 -0.22 1.61 2.96 -0.94 -1.27 118.68 113.70 3k6m s LEU 357 Ca -0.09 -0.11 -0.05 0.00 -0.22 0.00 0.00 54.13 53.65 3k6m s LEU 357 Cb 0.06 -0.47 -0.02 0.00 0.50 0.00 0.00 46.19 46.26 3k6m s LEU 357 CO 0.93 -0.15 0.00 -0.89 -1.32 0.00 0.00 176.35 174.92 3k6m s THR 358 N 1.68 3.83 -0.07 3.68 2.01 0.26 -0.64 115.64 126.39 3k6m s THR 358 Ca 0.01 -0.34 0.03 0.00 0.31 0.00 0.00 61.69 61.70 3k6m s THR 358 Cb -0.13 -2.75 -0.02 0.00 0.01 0.00 0.00 72.50 69.61 3k6m s THR 358 CO -0.04 0.40 -0.16 -0.32 -0.69 0.00 0.00 174.62 173.80 3k6m s MET 359 N 1.39 2.71 0.15 4.92 1.75 -0.56 -1.10 119.30 128.56 3k6m s MET 359 Ca 0.05 -0.74 -0.21 0.00 -1.25 0.00 0.00 55.69 53.54 3k6m s MET 359 Cb -0.15 -2.39 0.06 0.00 2.84 0.00 0.00 34.83 35.20 3k6m s MET 359 CO 0.00 0.48 0.54 -0.48 -0.65 0.00 0.00 175.02 174.91 3k6m s LEU 360 N -0.36 -0.27 0.70 4.11 0.05 -0.50 -1.30 118.68 121.11 3k6m s LEU 360 Ca 0.03 -0.09 -0.11 0.00 0.05 0.00 0.00 54.13 54.02 3k6m s LEU 360 Cb -0.12 2.36 0.02 0.00 -2.05 0.00 0.00 46.19 46.40 3k6m s LEU 360 CO 0.02 -0.93 1.09 -0.83 -0.55 0.00 0.00 176.35 175.15 3k6m s GLY 361 N -2.74 1.62 0.04 -3.48 0.00 -1.26 -0.94 107.32 100.56 3k6m s GLY 361 Ca 0.01 -0.39 -0.15 0.00 0.00 0.00 0.00 44.72 44.20 3k6m s GLY 361 CO -0.12 -0.02 0.33 0.00 0.00 0.00 0.00 173.10 173.28 3k6m s ALA 362 N -3.34 -0.75 -0.14 3.20 0.00 -1.26 -4.84 121.76 114.62 3k6m s ALA 362 Ca 0.58 0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.62 3k6m s ALA 362 Cb -0.11 0.33 -0.23 0.00 0.00 0.00 0.00 23.12 23.10 3k6m s ALA 362 CO 0.51 -0.42 0.26 -1.33 0.00 0.00 0.00 175.76 174.78 3k6m n MET 363 N 0.56 0.71 -3.90 0.00 2.81 -0.55 -4.86 117.12 111.88 3k6m n MET 363 Ca -0.19 0.22 -0.10 0.00 -1.81 0.00 0.00 57.70 55.82 3k6m n MET 363 Cb 0.60 -1.67 -0.10 0.00 -0.71 0.00 0.00 33.22 31.34 3k6m n MET 363 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3k6m s GLN 364 N -2.55 0.49 -0.01 0.03 -0.21 -1.02 -4.74 119.66 111.64 3k6m s GLN 364 Ca -0.21 -0.51 0.02 0.00 0.02 0.00 0.00 55.36 54.68 3k6m s GLN 364 Cb 0.07 0.20 -0.00 0.00 1.00 0.00 0.00 33.01 34.28 3k6m s GLN 364 CO 0.75 -0.11 -0.08 0.08 -2.12 0.00 0.00 175.29 173.81 3k6m s VAL 365 N -1.68 0.65 0.55 1.09 1.01 -0.51 -1.63 120.40 119.87 3k6m s VAL 365 Ca -0.13 -0.32 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 3k6m s VAL 365 Cb -0.06 -0.57 0.02 0.00 0.00 0.00 0.00 36.38 35.77 3k6m s VAL 365 CO -0.00 0.20 0.80 -0.94 0.00 0.00 0.00 175.10 175.16 3k6m s SER 366 N 0.03 5.50 0.43 3.32 1.04 0.16 -1.91 113.70 122.27 3k6m s SER 366 Ca -0.00 0.35 0.18 0.00 0.48 0.00 0.00 55.95 56.96 3k6m s SER 366 Cb -0.06 -1.36 1.10 0.00 0.10 0.00 0.00 66.02 65.79 3k6m s SER 366 CO -0.00 -1.02 1.87 0.50 0.98 0.00 0.00 173.24 175.56 3k6m h LYS 367 N 0.03 0.38 -0.32 4.02 3.64 -1.29 -0.58 116.57 122.45 3k6m h LYS 367 Ca -0.45 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 3k6m h LYS 367 Cb 1.27 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 3k6m h LYS 367 CO 0.57 0.25 0.00 0.66 -2.27 0.00 0.00 179.45 178.66 3k6m n TYR 368 N -4.49 0.42 -0.04 1.91 4.02 -1.26 -3.59 117.16 114.12 3k6m n TYR 368 Ca 0.18 -0.29 0.00 0.00 -0.01 0.00 0.00 57.90 57.79 3k6m n TYR 368 Cb 0.68 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.99 3k6m n TYR 368 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3k6m n GLY 369 N 1.05 1.06 3.76 2.72 0.00 -0.23 -3.92 105.19 109.63 3k6m n GLY 369 Ca 0.15 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3k6m n GLY 369 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3k6m s ASP 370 N -2.03 5.40 -0.06 1.61 1.01 -1.26 -0.71 116.67 120.63 3k6m s ASP 370 Ca 0.00 2.30 0.03 0.00 0.71 0.00 0.00 52.55 55.59 3k6m s ASP 370 Cb 0.00 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.34 3k6m s ASP 370 CO 0.00 -1.44 -0.15 -0.22 0.21 0.00 0.00 175.17 173.56 3k6m s LEU 371 N -3.97 1.81 -0.25 1.23 2.96 -0.45 -0.66 118.68 119.35 3k6m s LEU 371 Ca 0.75 -0.35 0.03 0.00 -0.22 0.00 0.00 54.13 54.34 3k6m s LEU 371 Cb -0.28 -0.94 0.06 0.00 0.50 0.00 0.00 46.19 45.53 3k6m s LEU 371 CO 0.31 0.09 -0.11 0.00 -1.32 0.00 0.00 176.35 175.32 3k6m s ALA 372 N 0.38 2.47 0.00 5.97 0.00 -0.64 0.37 121.76 130.31 3k6m s ALA 372 Ca -0.11 -1.67 0.07 0.00 0.00 0.00 0.00 51.96 50.26 3k6m s ALA 372 Cb -0.14 -1.53 0.12 0.00 0.00 0.00 0.00 23.12 21.57 3k6m s ALA 372 CO 0.04 -1.11 0.94 0.27 0.00 0.00 0.00 175.76 175.90 3k6m n ASN 373 N 4.48 0.12 0.00 0.00 6.94 -1.26 -1.48 115.26 124.05 3k6m n ASN 373 Ca -0.14 -1.79 0.00 0.00 -0.02 0.00 0.00 54.58 52.62 3k6m n ASN 373 Cb 0.43 -0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.74 3k6m n ASN 373 CO 0.00 0.00 0.00 -2.67 -1.03 0.00 0.00 177.26 173.56 3k6m n TRP 374 N 0.14 0.00 -3.71 -2.53 4.27 -1.26 -4.88 117.44 109.47 3k6m n TRP 374 Ca -0.03 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.45 3k6m n TRP 374 Cb 0.78 0.00 -0.13 0.00 -1.36 0.00 0.00 31.31 30.60 3k6m n TRP 374 CO 0.00 0.00 0.00 1.41 -2.29 0.00 0.00 177.69 176.81 3k6m s MET 375 N -0.87 0.19 -0.23 -2.67 0.00 -1.26 -4.55 119.30 109.91 3k6m s MET 375 Ca 0.00 0.60 -0.01 0.00 0.00 0.00 0.00 55.69 56.28 3k6m s MET 375 Cb 0.00 -0.10 0.02 0.00 0.00 0.00 0.00 34.83 34.75 3k6m s MET 375 CO 0.00 -0.20 -0.09 0.96 0.00 0.00 0.00 175.02 175.69 3k6m s ILE 376 N 1.63 2.74 0.64 10.11 -4.36 -1.26 -4.29 121.20 126.41 3k6m s ILE 376 Ca -0.06 -0.94 0.15 0.00 -0.26 0.00 0.00 60.65 59.54 3k6m s ILE 376 Cb -0.11 -2.33 0.19 0.00 1.25 0.00 0.00 42.46 41.46 3k6m s ILE 376 CO -0.09 0.30 1.37 -0.65 0.24 0.00 0.00 174.94 176.12 3k6m h PRO 377 N 8.00 0.00 -1.42 0.37 0.11 -1.99 -3.44 132.00 133.63 3k6m h PRO 377 Ca -0.37 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.60 3k6m h PRO 377 Cb 1.12 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.16 3k6m h PRO 377 CO 0.59 0.00 0.19 0.41 -0.21 0.00 0.00 178.00 178.97 3k6m n GLY 378 N -1.48 2.99 3.07 -0.55 0.00 -1.26 -5.23 105.19 102.73 3k6m n GLY 378 Ca 0.05 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 3k6m n GLY 378 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k6m s VAL 381 N -0.99 -0.52 0.00 1.61 1.01 -1.26 -5.20 120.40 115.05 3k6m s VAL 381 Ca 0.15 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.29 3k6m s VAL 381 Cb 0.12 -0.59 0.00 0.00 0.00 0.00 0.00 36.38 35.90 3k6m s VAL 381 CO 0.01 0.04 0.00 0.29 0.00 0.00 0.00 175.10 175.44 3k6m n LYS 382 N 5.37 2.38 0.00 2.72 5.02 -1.26 -4.86 118.16 127.53 3k6m n LYS 382 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 3k6m n LYS 382 Cb 0.50 -0.79 0.00 0.00 -0.02 0.00 0.00 35.03 34.72 3k6m n LYS 382 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k6m n GLY 383 N 1.76 2.21 0.00 0.72 0.00 -1.26 -0.41 105.19 108.21 3k6m n GLY 383 Ca 0.00 -2.06 0.11 0.00 0.00 0.00 0.00 46.02 44.07 3k6m n GLY 383 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3k6m n MET 384 N 0.22 0.04 0.00 1.61 0.00 -1.04 -4.87 117.12 113.08 3k6m n MET 384 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 3k6m n MET 384 Cb 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 33.22 31.71 3k6m n MET 384 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3k6m n GLY 385 N 1.48 2.97 1.03 3.17 0.00 -0.13 -1.71 105.19 112.01 3k6m n GLY 385 Ca 0.05 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 45.95 3k6m n GLY 385 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k6m n GLY 386 N 0.00 1.52 0.32 -0.02 0.00 -1.26 -1.28 105.19 104.47 3k6m n GLY 386 Ca 0.00 -0.64 -0.06 0.00 0.00 0.00 0.00 46.02 45.32 3k6m n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k6m h ALA 387 N 4.24 0.99 -0.35 4.61 0.00 -1.75 -1.24 119.26 125.76 3k6m h ALA 387 Ca 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 3k6m h ALA 387 Cb 0.81 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3k6m h ALA 387 CO 0.00 0.57 -0.15 0.52 0.00 0.00 0.00 179.25 180.18 3k6m h MET 388 N 1.08 0.62 -0.32 0.00 2.86 -1.79 -2.73 114.93 114.65 3k6m h MET 388 Ca 0.26 -0.21 -0.12 0.00 -2.06 0.00 0.00 59.70 57.57 3k6m h MET 388 Cb 0.14 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 3k6m h MET 388 CO -0.03 0.75 -0.30 -0.44 1.06 0.00 0.00 176.91 177.95 3k6m h ASP 389 N 0.56 0.70 0.52 1.22 3.32 -1.73 -3.15 116.42 117.87 3k6m h ASP 389 Ca 0.09 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 56.82 3k6m h ASP 389 Cb 0.59 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3k6m h ASP 389 CO 0.04 0.95 -0.22 -0.07 -1.72 0.00 0.00 179.24 178.22 3k6m h LEU 390 N 0.57 0.00 -3.02 1.55 3.38 -0.94 -2.26 115.31 114.60 3k6m h LEU 390 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3k6m h LEU 390 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3k6m h LEU 390 CO 0.07 0.22 0.00 1.33 0.09 0.00 0.00 178.44 180.15 3k6m n VAL 391 N -3.69 1.51 0.50 1.22 0.24 -1.16 -4.66 118.33 112.29 3k6m n VAL 391 Ca -0.01 -1.23 0.12 0.00 -2.04 0.00 0.00 64.34 61.18 3k6m n VAL 391 Cb 0.34 0.24 0.24 0.00 -1.47 0.00 0.00 33.84 33.19 3k6m n VAL 391 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3k6m h SER 392 N 2.91 0.00 -3.31 -1.34 4.64 -1.36 -3.45 113.55 111.64 3k6m h SER 392 Ca 0.00 -0.09 -0.64 0.00 -0.47 0.00 0.00 61.79 60.60 3k6m h SER 392 Cb 1.13 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.00 3k6m h SER 392 CO 0.12 0.04 -0.66 -0.55 -0.87 0.00 0.00 176.83 174.91 3k6m s SER 393 N -4.70 4.83 0.27 4.97 0.15 -1.26 -4.78 113.70 113.18 3k6m s SER 393 Ca 0.07 -0.12 0.23 0.00 0.70 0.00 0.00 55.95 56.83 3k6m s SER 393 Cb 0.12 -1.79 1.01 0.00 -1.71 0.00 0.00 66.02 63.64 3k6m s SER 393 CO 0.67 0.16 1.69 0.00 1.20 0.00 0.00 173.24 176.97 3k6m n ALA 394 N 3.57 1.52 0.22 5.45 0.00 -1.26 -2.95 120.51 127.06 3k6m n ALA 394 Ca -0.17 0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.49 3k6m n ALA 394 Cb 0.52 -1.37 0.27 0.00 0.00 0.00 0.00 19.45 18.88 3k6m n ALA 394 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3k6m h LYS 395 N 0.00 0.00 -5.62 0.00 1.57 -1.94 -3.43 116.57 107.15 3k6m h LYS 395 Ca 0.00 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 3k6m h LYS 395 Cb 0.28 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.51 3k6m h LYS 395 CO 0.00 0.09 -0.32 0.99 -0.57 0.00 0.00 179.45 179.64 3k6m s THR 396 N -3.30 5.28 -0.06 -0.16 2.01 -1.15 -4.91 115.64 113.34 3k6m s THR 396 Ca 0.05 0.56 -0.30 0.00 0.31 0.00 0.00 61.69 62.31 3k6m s THR 396 Cb 0.07 -3.61 -0.03 0.00 0.01 0.00 0.00 72.50 68.93 3k6m s THR 396 CO 0.65 0.46 1.24 -0.75 -0.69 0.00 0.00 174.62 175.54 3k6m s LYS 397 N -0.06 4.32 -0.25 4.92 2.20 -0.39 -4.89 119.74 125.59 3k6m s LYS 397 Ca 0.18 1.72 -0.06 0.00 -0.36 0.00 0.00 55.97 57.45 3k6m s LYS 397 Cb -0.14 -3.59 -0.01 0.00 -1.51 0.00 0.00 37.83 32.58 3k6m s LYS 397 CO 0.06 -0.51 0.03 0.08 -0.36 0.00 0.00 175.35 174.65 3k6m s VAL 398 N 2.44 3.90 -0.16 4.02 1.01 -1.26 -0.57 120.40 129.77 3k6m s VAL 398 Ca 0.57 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 62.18 3k6m s VAL 398 Cb -0.25 -2.83 0.01 0.00 0.00 0.00 0.00 36.38 33.30 3k6m s VAL 398 CO 0.22 0.33 -0.17 -0.69 0.00 0.00 0.00 175.10 174.79 3k6m s VAL 399 N 1.54 2.44 -0.14 2.92 1.01 -0.26 -0.97 120.40 126.94 3k6m s VAL 399 Ca 0.06 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.07 3k6m s VAL 399 Cb -0.15 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.16 3k6m s VAL 399 CO 0.01 0.52 0.26 -0.69 0.00 0.00 0.00 175.10 175.20 3k6m s VAL 400 N 0.95 5.32 -0.22 2.92 1.01 -0.04 -1.41 120.40 128.94 3k6m s VAL 400 Ca -0.03 0.48 0.02 0.00 0.00 0.00 0.00 61.98 62.45 3k6m s VAL 400 Cb -0.15 -3.58 0.04 0.00 0.00 0.00 0.00 36.38 32.68 3k6m s VAL 400 CO -0.03 0.45 -0.16 0.42 0.00 0.00 0.00 175.10 175.78 3k6m s THR 401 N 0.09 2.12 0.08 3.92 -4.23 -0.12 -0.28 115.64 117.23 3k6m s THR 401 Ca 0.16 -1.24 -0.22 0.00 -1.18 0.00 0.00 61.69 59.20 3k6m s THR 401 Cb -0.13 -2.05 0.06 0.00 1.34 0.00 0.00 72.50 71.72 3k6m s THR 401 CO 0.04 0.29 0.53 0.00 -0.54 0.00 0.00 174.62 174.94 3k6m s MET 402 N 1.21 1.11 0.43 3.99 0.23 -0.68 -4.17 119.30 121.41 3k6m s MET 402 Ca -0.01 -0.34 -0.25 0.00 -1.03 0.00 0.00 55.69 54.05 3k6m s MET 402 Cb -0.16 0.51 -0.08 0.00 -1.53 0.00 0.00 34.83 33.56 3k6m s MET 402 CO -0.09 -0.43 1.33 -2.00 -2.03 0.00 0.00 175.02 171.80 3k6m s GLU 403 N -2.94 3.83 0.14 3.16 2.12 -1.26 -4.03 118.70 119.72 3k6m s GLU 403 Ca -0.03 2.22 -0.16 0.00 0.36 0.00 0.00 54.97 57.36 3k6m s GLU 403 Cb -0.00 -2.68 0.01 0.00 0.26 0.00 0.00 34.13 31.71 3k6m s GLU 403 CO -0.06 -0.63 1.74 1.25 -0.54 0.00 0.00 175.26 177.02 3k6m h HIS 404 N 2.47 0.57 -3.42 5.30 -0.00 -1.94 -3.45 115.15 114.69 3k6m h HIS 404 Ca -0.50 -0.02 -0.35 0.00 -0.00 0.00 0.00 60.37 59.50 3k6m h HIS 404 Cb 1.25 -0.18 -0.16 0.00 -0.00 0.00 0.00 27.41 28.33 3k6m h HIS 404 CO 0.52 0.45 -0.73 -1.12 -0.00 0.00 0.00 177.93 177.05 3k6m s SER 405 N -5.73 1.84 0.44 3.26 0.01 -1.26 -3.97 113.70 108.28 3k6m s SER 405 Ca -0.13 -0.95 0.00 0.00 1.31 0.00 0.00 55.95 56.18 3k6m s SER 405 Cb 0.10 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.31 3k6m s SER 405 CO 0.74 -0.28 0.00 0.00 0.41 0.00 0.00 173.24 174.11 3k6m n ALA 406 N 0.01 0.00 -1.56 1.44 0.00 0.38 -4.90 120.51 115.89 3k6m n ALA 406 Ca -0.12 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 52.80 3k6m n ALA 406 Cb 0.60 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.99 3k6m n ALA 406 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3k6m n LYS 407 N -0.98 0.81 -1.54 0.00 2.85 -1.26 -2.05 118.16 115.99 3k6m n LYS 407 Ca 0.00 0.29 -0.09 0.00 -1.05 0.00 0.00 58.31 57.46 3k6m n LYS 407 Cb 0.00 -1.83 -0.03 0.00 -0.65 0.00 0.00 35.03 32.52 3k6m n LYS 407 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3k6m n GLY 408 N 2.12 0.72 2.57 2.58 0.00 -1.26 -2.47 105.19 109.45 3k6m n GLY 408 Ca 0.18 -0.61 -0.17 0.00 0.00 0.00 0.00 46.02 45.42 3k6m n GLY 408 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3k6m n ASN 409 N 0.52 -4.88 -4.74 1.61 5.15 -0.87 -4.96 115.26 107.09 3k6m n ASN 409 Ca -0.09 0.01 -0.42 0.00 -0.60 0.00 0.00 54.58 53.49 3k6m n ASN 409 Cb 0.38 -4.08 -0.03 0.00 -0.53 0.00 0.00 39.78 35.52 3k6m n ASN 409 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3k6m s ALA 410 N -2.86 3.64 0.40 5.20 0.00 -1.03 -4.80 121.76 122.31 3k6m s ALA 410 Ca 0.07 1.29 -0.26 0.00 0.00 0.00 0.00 51.96 53.06 3k6m s ALA 410 Cb -0.03 -3.56 -0.09 0.00 0.00 0.00 0.00 23.12 19.44 3k6m s ALA 410 CO 0.08 -0.71 1.28 -1.01 0.00 0.00 0.00 175.76 175.40 3k6m s HIS 411 N 0.36 2.87 -0.08 0.00 0.09 -1.26 -0.47 115.29 116.80 3k6m s HIS 411 Ca 0.62 1.44 0.05 0.00 -0.00 0.00 0.00 55.06 57.17 3k6m s HIS 411 Cb -0.41 -3.62 -0.09 0.00 -0.00 0.00 0.00 32.58 28.46 3k6m s HIS 411 CO 0.39 -1.94 -0.00 1.63 -0.00 0.00 0.00 174.74 174.82 3k6m n LYS 412 N 0.13 2.06 -3.39 1.40 5.02 -1.25 -4.75 118.16 117.38 3k6m n LYS 412 Ca 0.04 0.01 -0.39 0.00 -2.02 0.00 0.00 58.31 55.95 3k6m n LYS 412 Cb 0.44 -1.20 -0.09 0.00 -0.02 0.00 0.00 35.03 34.16 3k6m n LYS 412 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3k6m s ILE 413 N -2.19 5.18 0.25 -0.18 1.01 -1.26 -1.43 121.20 122.58 3k6m s ILE 413 Ca -0.06 0.59 -0.10 0.00 0.00 0.00 0.00 60.65 61.08 3k6m s ILE 413 Cb 0.03 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 38.83 3k6m s ILE 413 CO 0.29 0.17 0.52 1.15 0.00 0.00 0.00 174.94 177.07 3k6m n MET 414 N 5.24 0.73 -0.08 2.79 0.00 -0.80 -0.18 117.12 124.82 3k6m n MET 414 Ca -0.08 -1.43 -0.09 0.00 0.00 0.00 0.00 57.70 56.09 3k6m n MET 414 Cb 0.51 1.79 -0.02 0.00 0.00 0.00 0.00 33.22 35.50 3k6m n MET 414 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 3k6m h GLU 415 N 0.00 0.35 -3.58 3.17 4.57 -1.80 -1.16 114.58 116.13 3k6m h GLU 415 Ca -0.22 -0.02 -0.23 0.00 -1.18 0.00 0.00 59.36 57.71 3k6m h GLU 415 Cb 0.81 -0.08 -0.28 0.00 -0.16 0.00 0.00 28.75 29.03 3k6m h GLU 415 CO 0.28 0.23 -0.66 0.21 -1.18 0.00 0.00 179.01 177.88 3k6m s LYS 416 N -6.17 0.05 0.51 1.92 2.20 -1.26 -3.73 119.74 113.26 3k6m s LYS 416 Ca -0.13 0.10 -0.22 0.00 -0.36 0.00 0.00 55.97 55.36 3k6m s LYS 416 Cb 0.10 -0.01 -0.06 0.00 -1.51 0.00 0.00 37.83 36.34 3k6m s LYS 416 CO 0.70 -0.03 1.21 0.00 -0.36 0.00 0.00 175.35 176.87 3k6m n THR 418 N -0.85 0.00 -3.42 0.00 -2.24 -1.26 -5.00 114.28 101.51 3k6m n THR 418 Ca 0.09 -0.33 -0.24 0.00 -2.27 0.00 0.00 64.05 61.30 3k6m n THR 418 Cb 0.48 0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.99 3k6m n THR 418 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3k6m s LEU 419 N -3.90 4.04 0.27 3.22 1.43 -1.26 -5.03 118.68 117.45 3k6m s LEU 419 Ca -0.04 0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 53.20 3k6m s LEU 419 Cb 0.11 -3.29 -0.13 0.00 0.03 0.00 0.00 46.19 42.91 3k6m s LEU 419 CO 0.71 -0.27 1.39 -2.65 0.23 0.00 0.00 176.35 175.77 3k6m n PRO 420 N -1.67 2.11 -2.53 1.29 -0.02 -1.26 -4.84 135.00 128.08 3k6m n PRO 420 Ca -0.05 0.75 -0.40 0.00 -2.02 0.00 0.00 63.50 61.78 3k6m n PRO 420 Cb 0.56 -2.39 -0.05 0.00 -0.02 0.00 0.00 33.50 31.60 3k6m n PRO 420 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3k6m s LEU 421 N -0.23 4.49 -0.00 2.45 1.43 -1.26 -4.31 118.68 121.24 3k6m s LEU 421 Ca 0.64 2.17 0.01 0.00 -1.03 0.00 0.00 54.13 55.93 3k6m s LEU 421 Cb -0.62 -3.73 -0.26 0.00 0.03 0.00 0.00 46.19 41.61 3k6m s LEU 421 CO 0.53 -0.16 0.82 0.74 0.23 0.00 0.00 176.35 178.51 3k6m h THR 422 N 2.94 1.11 -2.24 5.49 2.02 -0.44 -3.42 112.91 118.36 3k6m h THR 422 Ca -0.47 -2.80 0.07 0.00 0.77 0.00 0.00 66.41 63.97 3k6m h THR 422 Cb 1.21 2.68 -0.17 0.00 -1.74 0.00 0.00 68.15 70.13 3k6m h THR 422 CO 0.66 0.78 0.43 -0.83 0.37 0.00 0.00 175.52 176.92 3k6m s GLY 423 N -5.02 -0.47 -0.18 2.16 0.00 -1.18 -4.52 107.32 98.12 3k6m s GLY 423 Ca -0.08 1.15 -0.09 0.00 0.00 0.00 0.00 44.72 45.70 3k6m s GLY 423 CO 0.84 0.50 0.11 1.25 0.00 0.00 0.00 173.10 175.79 3k6m s LYS 424 N -2.65 4.01 -1.33 2.90 2.20 -1.26 -1.34 119.74 122.27 3k6m s LYS 424 Ca 0.01 -0.26 -0.07 0.00 -0.36 0.00 0.00 55.97 55.30 3k6m s LYS 424 Cb -0.01 -3.31 -0.00 0.00 -1.51 0.00 0.00 37.83 33.00 3k6m s LYS 424 CO -0.06 0.35 0.53 1.04 -0.36 0.00 0.00 175.35 176.85 3k6m n GLN 425 N 3.33 -2.65 -0.00 4.03 6.02 -1.21 -4.84 117.38 122.07 3k6m n GLN 425 Ca -0.17 0.40 0.00 0.00 -0.01 0.00 0.00 57.00 57.23 3k6m n GLN 425 Cb 0.52 -4.34 -0.00 0.00 1.02 0.00 0.00 30.24 27.45 3k6m n GLN 425 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3k6m s VAL 427 N -1.94 4.92 -0.10 0.00 1.01 -0.53 -4.51 120.40 119.26 3k6m s VAL 427 Ca -0.00 1.54 0.20 0.00 0.00 0.00 0.00 61.98 63.72 3k6m s VAL 427 Cb 0.00 -4.08 -0.29 0.00 0.00 0.00 0.00 36.38 32.01 3k6m s VAL 427 CO 0.00 0.29 0.30 0.59 0.00 0.00 0.00 175.10 176.29 3k6m n ASN 428 N 3.41 0.15 -3.72 3.32 4.13 -0.15 -4.64 115.26 117.77 3k6m n ASN 428 Ca -0.01 0.00 -0.14 0.00 1.68 0.00 0.00 54.58 56.11 3k6m n ASN 428 Cb 0.51 1.57 -0.09 0.00 -1.54 0.00 0.00 39.78 40.23 3k6m n ASN 428 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 3k6m s ARG 429 N -3.07 0.62 -0.13 3.52 3.52 -1.04 -0.98 118.95 121.41 3k6m s ARG 429 Ca -0.09 0.27 0.03 0.00 -0.13 0.00 0.00 55.73 55.82 3k6m s ARG 429 Cb 0.10 0.29 0.01 0.00 -1.56 0.00 0.00 34.95 33.79 3k6m s ARG 429 CO 0.85 -0.13 -0.23 0.42 -0.81 0.00 0.00 175.30 175.40 3k6m s ILE 430 N -0.49 2.06 -0.19 4.11 1.01 0.14 -0.86 121.20 126.98 3k6m s ILE 430 Ca -0.06 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.59 3k6m s ILE 430 Cb -0.03 -1.81 0.00 0.00 0.01 0.00 0.00 42.46 40.63 3k6m s ILE 430 CO 0.03 0.55 -0.12 -0.63 0.00 0.00 0.00 174.94 174.77 3k6m s ILE 431 N 0.68 2.76 0.40 2.92 1.01 0.62 -1.02 121.20 128.56 3k6m s ILE 431 Ca -0.11 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.84 3k6m s ILE 431 Cb -0.16 -2.21 -0.00 0.00 0.01 0.00 0.00 42.46 40.10 3k6m s ILE 431 CO 0.01 0.48 0.01 0.35 0.00 0.00 0.00 174.94 175.79 3k6m n THR 432 N 4.58 0.00 0.47 2.92 -2.24 0.08 -1.69 114.28 118.41 3k6m n THR 432 Ca -0.19 -1.89 0.12 0.00 -2.27 0.00 0.00 64.05 59.82 3k6m n THR 432 Cb 0.51 0.40 0.47 0.00 -2.10 0.00 0.00 70.33 69.60 3k6m n THR 432 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 3k6m n GLU 433 N -0.98 0.22 -0.06 -0.78 0.00 -1.26 -3.65 120.64 114.13 3k6m n GLU 433 Ca -0.16 0.36 -0.05 0.00 0.00 0.00 0.00 57.16 57.31 3k6m n GLU 433 Cb 0.51 -1.85 -0.11 0.00 0.00 0.00 0.00 31.44 29.98 3k6m n GLU 433 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3k6m n LYS 434 N -2.26 1.59 -3.53 3.44 5.02 -1.26 -4.73 118.16 116.44 3k6m n LYS 434 Ca 0.03 -0.02 -0.14 0.00 -2.02 0.00 0.00 58.31 56.16 3k6m n LYS 434 Cb 0.30 -1.35 -0.05 0.00 -0.02 0.00 0.00 35.03 33.91 3k6m n LYS 434 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k6m s ALA 435 N -2.42 -1.46 -0.12 7.82 0.00 -1.24 -0.83 121.76 123.51 3k6m s ALA 435 Ca -0.07 0.71 0.01 0.00 0.00 0.00 0.00 51.96 52.62 3k6m s ALA 435 Cb 0.05 0.42 -0.01 0.00 0.00 0.00 0.00 23.12 23.58 3k6m s ALA 435 CO 0.57 -0.54 -0.17 0.08 0.00 0.00 0.00 175.76 175.70 3k6m s VAL 436 N -2.49 2.63 -0.07 0.00 1.01 -0.56 -0.74 120.40 120.19 3k6m s VAL 436 Ca -0.05 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.16 3k6m s VAL 436 Cb -0.01 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 3k6m s VAL 436 CO -0.02 0.54 -0.18 -0.36 0.00 0.00 0.00 175.10 175.08 3k6m s PHE 437 N 0.41 2.62 0.26 5.22 0.40 -0.19 -1.21 117.98 125.49 3k6m s PHE 437 Ca -0.13 -0.44 -0.22 0.00 -0.60 0.00 0.00 56.93 55.53 3k6m s PHE 437 Cb -0.17 -1.66 -0.09 0.00 0.51 0.00 0.00 43.02 41.62 3k6m s PHE 437 CO 0.06 -0.03 0.81 -0.51 0.70 0.00 0.00 175.22 176.25 3k6m s ASP 438 N -0.33 7.17 -0.07 1.36 -0.00 -0.09 -0.68 116.67 124.02 3k6m s ASP 438 Ca 0.02 1.58 0.04 0.00 -0.00 0.00 0.00 52.55 54.19 3k6m s ASP 438 Cb -0.13 -2.48 0.00 0.00 -0.00 0.00 0.00 42.92 40.31 3k6m s ASP 438 CO 0.02 -0.01 -0.18 -0.69 -0.00 0.00 0.00 175.17 174.31 3k6m s VAL 439 N -1.57 1.59 -0.03 -1.27 1.01 -0.15 -1.23 120.40 118.75 3k6m s VAL 439 Ca 0.46 -0.77 0.04 0.00 0.00 0.00 0.00 61.98 61.71 3k6m s VAL 439 Cb -0.17 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 3k6m s VAL 439 CO 0.22 0.46 -0.16 -0.62 0.00 0.00 0.00 175.10 174.99 3k6m s ASP 440 N 0.32 2.03 0.26 3.32 2.15 0.35 -4.54 116.67 120.56 3k6m s ASP 440 Ca -0.12 -0.33 -0.03 0.00 0.43 0.00 0.00 52.55 52.51 3k6m s ASP 440 Cb -0.15 -0.46 0.40 0.00 -0.30 0.00 0.00 42.92 42.41 3k6m s ASP 440 CO 0.05 0.16 1.88 0.08 -0.17 0.00 0.00 175.17 177.17 3k6m h ARG 441 N 6.10 1.13 0.07 4.34 0.11 -1.86 -0.22 114.38 124.05 3k6m h ARG 441 Ca -0.34 -0.07 -0.37 0.00 0.10 0.00 0.00 59.98 59.30 3k6m h ARG 441 Cb 1.17 -0.26 -0.04 0.00 1.11 0.00 0.00 29.97 31.95 3k6m h ARG 441 CO 0.48 0.75 -2.17 1.63 0.10 0.00 0.00 179.97 180.77 3k6m n LYS 442 N -4.51 0.71 0.07 0.08 5.02 -1.26 -4.56 118.16 113.70 3k6m n LYS 442 Ca 0.15 0.22 0.12 0.00 -2.02 0.00 0.00 58.31 56.77 3k6m n LYS 442 Cb 0.18 -1.64 0.06 0.00 -0.02 0.00 0.00 35.03 33.62 3k6m n LYS 442 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3k6m n LYS 443 N -3.36 0.41 0.00 1.97 5.02 -1.20 -5.06 118.16 115.94 3k6m n LYS 443 Ca -0.36 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.00 3k6m n LYS 443 Cb 1.03 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 34.33 3k6m n LYS 443 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k6m n GLY 444 N 1.29 0.11 3.90 0.72 0.00 -0.10 -4.90 105.19 106.20 3k6m n GLY 444 Ca 0.02 -1.37 -0.33 0.00 0.00 0.00 0.00 46.02 44.33 3k6m n GLY 444 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k6m s LEU 445 N 0.00 4.36 -0.08 0.99 1.43 -1.24 -0.49 118.68 123.65 3k6m s LEU 445 Ca 0.00 0.46 -0.01 0.00 -1.03 0.00 0.00 54.13 53.55 3k6m s LEU 445 Cb 0.00 -2.75 0.03 0.00 0.03 0.00 0.00 46.19 43.50 3k6m s LEU 445 CO 0.00 0.23 -0.03 -0.89 0.23 0.00 0.00 176.35 175.89 3k6m s THR 446 N -1.37 0.62 -0.27 5.49 2.01 -0.37 -0.67 115.64 121.09 3k6m s THR 446 Ca 0.30 -0.04 -0.29 0.00 0.31 0.00 0.00 61.69 61.97 3k6m s THR 446 Cb -0.13 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.66 3k6m s THR 446 CO 0.19 0.30 1.35 -0.22 -0.69 0.00 0.00 174.62 175.54 3k6m s LEU 447 N 1.80 3.93 -0.01 4.42 2.96 0.97 -0.91 118.68 131.84 3k6m s LEU 447 Ca 0.04 1.34 0.08 0.00 -0.22 0.00 0.00 54.13 55.37 3k6m s LEU 447 Cb -0.12 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 42.91 3k6m s LEU 447 CO -0.06 -1.06 0.23 2.30 -1.32 0.00 0.00 176.35 176.44 3k6m n ILE 448 N 6.12 0.00 -3.84 6.68 -5.35 -0.35 -1.28 119.36 121.34 3k6m n ILE 448 Ca 0.15 -0.23 -0.12 0.00 -0.27 0.00 0.00 62.75 62.29 3k6m n ILE 448 Cb 0.46 0.53 -0.10 0.00 -1.74 0.00 0.00 39.64 38.79 3k6m n ILE 448 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 3k6m s GLU 449 N -2.32 0.49 -0.03 6.28 2.02 -1.16 -3.12 118.70 120.85 3k6m s GLU 449 Ca -0.01 -0.26 -0.01 0.00 0.02 0.00 0.00 54.97 54.71 3k6m s GLU 449 Cb 0.06 0.21 0.03 0.00 0.10 0.00 0.00 34.13 34.52 3k6m s GLU 449 CO 0.34 -0.12 0.04 -1.17 0.02 0.00 0.00 175.26 174.37 3k6m s LEU 450 N -1.17 0.73 0.16 1.80 2.96 -0.53 -1.50 118.68 121.13 3k6m s LEU 450 Ca -0.12 0.04 -0.33 0.00 -0.22 0.00 0.00 54.13 53.50 3k6m s LEU 450 Cb -0.06 -0.12 -0.12 0.00 0.50 0.00 0.00 46.19 46.38 3k6m s LEU 450 CO 0.02 -0.17 1.71 1.87 -1.32 0.00 0.00 176.35 178.46 3k6m n TRP 451 N 4.62 2.55 -1.70 5.38 -0.00 -0.01 -0.41 117.44 127.88 3k6m n TRP 451 Ca -0.18 0.07 -0.43 0.00 -0.00 0.00 0.00 57.50 56.95 3k6m n TRP 451 Cb 0.50 -2.65 -0.02 0.00 -0.00 0.00 0.00 31.31 29.15 3k6m n TRP 451 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 3k6m n GLU 452 N 4.30 2.22 0.00 5.87 4.07 -1.26 -1.42 120.64 134.43 3k6m n GLU 452 Ca 0.17 0.79 0.00 0.00 -0.06 0.00 0.00 57.16 58.06 3k6m n GLU 452 Cb 0.33 -2.46 0.00 0.00 -0.06 0.00 0.00 31.44 29.25 3k6m n GLU 452 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3k6m n GLY 453 N 1.80 3.01 3.86 8.31 0.00 -1.26 -5.06 105.19 115.84 3k6m n GLY 453 Ca 0.09 -0.37 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 3k6m n GLY 453 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k6m s LEU 454 N 0.00 3.33 0.33 0.99 1.43 -0.51 -5.09 118.68 119.17 3k6m s LEU 454 Ca 0.00 1.49 0.08 0.00 -1.03 0.00 0.00 54.13 54.67 3k6m s LEU 454 Cb 0.00 -4.48 -0.04 0.00 0.03 0.00 0.00 46.19 41.70 3k6m s LEU 454 CO 0.00 -0.85 0.15 0.42 0.23 0.00 0.00 176.35 176.30 3k6m s THR 455 N -3.00 3.18 0.32 5.49 -4.23 -1.26 -4.89 115.64 111.26 3k6m s THR 455 Ca 0.57 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.42 3k6m s THR 455 Cb -0.11 -3.01 0.25 0.00 1.34 0.00 0.00 72.50 70.97 3k6m s THR 455 CO 0.48 -0.20 1.98 0.58 -0.54 0.00 0.00 174.62 176.91 3k6m h VAL 456 N 1.53 1.19 -0.14 2.29 2.07 -1.99 -2.21 116.25 118.99 3k6m h VAL 456 Ca -0.44 -0.38 -0.08 0.00 0.82 0.00 0.00 66.70 66.63 3k6m h VAL 456 Cb 1.25 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3k6m h VAL 456 CO 0.62 0.19 -0.26 -0.78 0.02 0.00 0.00 177.57 177.36 3k6m h ASP 457 N 0.96 0.25 -0.50 0.57 3.58 -1.98 0.51 116.42 119.81 3k6m h ASP 457 Ca 0.26 -0.07 0.01 0.00 0.42 0.00 0.00 57.03 57.64 3k6m h ASP 457 Cb -0.08 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 3k6m h ASP 457 CO -0.05 0.51 0.33 0.44 -2.88 0.00 0.00 179.24 177.59 3k6m h ASP 458 N 0.23 0.57 -0.50 2.28 3.32 -1.81 -1.63 116.42 118.89 3k6m h ASP 458 Ca 0.04 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 3k6m h ASP 458 Cb 0.58 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 3k6m h ASP 458 CO 0.04 0.41 0.15 0.40 -1.72 0.00 0.00 179.24 178.52 3k6m h ILE 459 N 0.67 1.23 -0.89 0.35 1.08 -1.12 -2.61 117.51 116.22 3k6m h ILE 459 Ca 0.18 -0.79 0.09 0.00 -0.39 0.00 0.00 64.86 63.95 3k6m h ILE 459 Cb -0.08 0.80 -0.07 0.00 -3.07 0.00 0.00 36.82 34.40 3k6m h ILE 459 CO -0.04 0.29 0.54 0.11 -0.69 0.00 0.00 178.15 178.36 3k6m h LYS 460 N 0.68 0.90 0.00 2.37 1.57 -0.70 -1.81 116.57 119.58 3k6m h LYS 460 Ca 0.16 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 3k6m h LYS 460 Cb 0.29 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 3k6m h LYS 460 CO -0.00 0.60 -0.03 0.87 -0.57 0.00 0.00 179.45 180.31 3k6m h LYS 461 N 0.93 0.00 -0.44 3.15 1.57 -1.06 -3.05 116.57 117.68 3k6m h LYS 461 Ca 0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.19 3k6m h LYS 461 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 3k6m h LYS 461 CO -0.22 0.03 0.00 0.43 -0.57 0.00 0.00 179.45 179.12 3k6m n SER 462 N -3.12 3.59 -3.98 0.86 7.64 -0.75 -4.95 113.62 112.91 3k6m n SER 462 Ca 0.02 -2.27 -0.22 0.00 1.01 0.00 0.00 58.87 57.40 3k6m n SER 462 Cb 0.40 -0.39 -0.16 0.00 -1.01 0.00 0.00 64.21 63.05 3k6m n SER 462 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3k6m s THR 463 N -1.50 0.87 -0.42 0.44 2.01 -0.76 -4.70 115.64 111.58 3k6m s THR 463 Ca 0.35 -0.34 0.06 0.00 0.31 0.00 0.00 61.69 62.07 3k6m s THR 463 Cb 0.22 -0.82 0.45 0.00 0.01 0.00 0.00 72.50 72.36 3k6m s THR 463 CO 0.18 0.29 1.39 0.61 -0.69 0.00 0.00 174.62 176.41 3k6m n GLY 464 N 3.80 2.90 3.68 4.40 0.00 0.74 -4.84 105.19 115.87 3k6m n GLY 464 Ca -0.23 -0.60 -0.08 0.00 0.00 0.00 0.00 46.02 45.11 3k6m n GLY 464 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k6m s ASP 466 N -2.94 5.15 0.04 0.00 -0.00 -1.26 -5.01 116.67 112.65 3k6m s ASP 466 Ca 0.14 1.40 -0.14 0.00 -0.00 0.00 0.00 52.55 53.94 3k6m s ASP 466 Cb -0.03 -2.23 0.02 0.00 -0.00 0.00 0.00 42.92 40.69 3k6m s ASP 466 CO 0.05 -1.56 0.32 0.72 -0.00 0.00 0.00 175.17 174.70 3k6m s PHE 467 N -3.15 -0.13 0.48 4.23 -0.12 -1.26 -4.61 117.98 113.41 3k6m s PHE 467 Ca 0.59 0.02 -0.17 0.00 -0.05 0.00 0.00 56.93 57.32 3k6m s PHE 467 Cb -0.13 0.12 -0.08 0.00 -0.63 0.00 0.00 43.02 42.29 3k6m s PHE 467 CO 0.54 -0.51 0.95 0.00 -0.05 0.00 0.00 175.22 176.15 3k6m s ALA 468 N -2.49 3.09 -0.17 1.99 0.00 0.16 -4.91 121.76 119.43 3k6m s ALA 468 Ca -0.05 0.19 -0.02 0.00 0.00 0.00 0.00 51.96 52.08 3k6m s ALA 468 Cb -0.01 -3.08 -0.01 0.00 0.00 0.00 0.00 23.12 20.02 3k6m s ALA 468 CO -0.03 -0.13 -0.10 0.08 0.00 0.00 0.00 175.76 175.58 3k6m s VAL 469 N -2.50 3.15 0.34 0.00 1.01 -1.26 -0.02 120.40 121.11 3k6m s VAL 469 Ca 0.59 -0.60 -0.29 0.00 0.00 0.00 0.00 61.98 61.68 3k6m s VAL 469 Cb -0.10 -2.37 -0.11 0.00 0.00 0.00 0.00 36.38 33.80 3k6m s VAL 469 CO 0.27 0.49 1.48 -0.55 0.00 0.00 0.00 175.10 176.79 3k6m s SER 470 N 0.85 6.43 0.61 3.32 0.15 -0.41 -4.89 113.70 119.77 3k6m s SER 470 Ca -0.03 2.95 0.33 0.00 0.70 0.00 0.00 55.95 59.91 3k6m s SER 470 Cb -0.15 -2.65 1.96 0.00 -1.71 0.00 0.00 66.02 63.47 3k6m s SER 470 CO 0.01 -0.83 2.27 -0.65 1.20 0.00 0.00 173.24 175.24 3k6m h PRO 471 N 3.63 0.00 -0.83 5.44 0.11 -1.99 -2.47 132.00 135.89 3k6m h PRO 471 Ca -0.49 0.00 -0.42 0.00 0.11 0.00 0.00 66.00 65.20 3k6m h PRO 471 Cb 1.23 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 32.09 3k6m h PRO 471 CO 0.69 0.00 0.46 1.17 -0.21 0.00 0.00 178.00 180.11 3k6m n LYS 472 N -3.64 2.30 -1.67 1.05 4.81 -1.26 -5.02 118.16 114.73 3k6m n LYS 472 Ca -0.03 -3.06 -0.44 0.00 -0.87 0.00 0.00 58.31 53.91 3k6m n LYS 472 Cb 0.10 -2.10 -0.02 0.00 0.02 0.00 0.00 35.03 33.02 3k6m n LYS 472 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3k6m n LEU 473 N -1.05 3.10 -4.25 3.14 7.94 -0.93 -4.98 117.00 119.96 3k6m n LEU 473 Ca 0.52 1.16 -0.14 0.00 -1.11 0.00 0.00 56.01 56.44 3k6m n LEU 473 Cb 1.51 -1.43 -0.10 0.00 0.53 0.00 0.00 43.42 43.93 3k6m n LEU 473 CO 0.50 -0.56 -0.39 0.27 -1.11 0.00 0.00 177.39 176.11 3k6m s ILE 474 N -0.35 1.03 0.57 1.96 -4.36 -1.18 -5.02 121.20 113.85 3k6m s ILE 474 Ca 0.65 -2.03 -0.21 0.00 -0.26 0.00 0.00 60.65 58.80 3k6m s ILE 474 Cb -0.64 -1.94 -0.04 0.00 1.25 0.00 0.00 42.46 41.10 3k6m s ILE 474 CO 0.53 -0.67 1.33 -2.84 0.24 0.00 0.00 174.94 173.53 3k6m s PRO 475 N -3.80 2.99 0.19 0.37 0.02 -1.26 -1.46 135.00 132.06 3k6m s PRO 475 Ca 0.19 2.16 -0.32 0.00 0.02 0.00 0.00 61.00 63.05 3k6m s PRO 475 Cb 0.04 -2.13 -0.11 0.00 0.02 0.00 0.00 34.50 32.31 3k6m s PRO 475 CO 0.02 -1.28 1.68 1.41 -0.33 0.00 0.00 177.00 178.49 3k6m s MET 476 N -3.05 4.15 0.53 5.54 1.75 0.45 -4.59 119.30 124.08 3k6m s MET 476 Ca 0.75 2.53 -0.19 0.00 -1.25 0.00 0.00 55.69 57.53 3k6m s MET 476 Cb -0.39 -3.11 -0.07 0.00 2.84 0.00 0.00 34.83 34.10 3k6m s MET 476 CO 0.45 -0.71 1.05 -0.65 -0.65 0.00 0.00 175.02 174.51 3k6m s GLN 477 N 1.20 3.60 -0.03 4.11 -0.21 -1.26 -4.79 119.66 122.28 3k6m s GLN 477 Ca 0.73 1.33 0.01 0.00 0.02 0.00 0.00 55.36 57.45 3k6m s GLN 477 Cb -0.48 -2.07 0.02 0.00 1.00 0.00 0.00 33.01 31.49 3k6m s GLN 477 CO 0.32 -0.60 -0.01 -0.65 -2.12 0.00 0.00 175.29 172.23 3k6m s GLN 478 N -3.52 0.34 0.26 2.91 -1.52 -1.26 -4.22 119.66 112.66 3k6m s GLN 478 Ca 0.67 0.05 -0.31 0.00 -1.95 0.00 0.00 55.36 53.82 3k6m s GLN 478 Cb -0.17 -0.50 -0.11 0.00 -0.22 0.00 0.00 33.01 32.01 3k6m s GLN 478 CO 0.26 -0.12 1.62 0.54 -0.25 0.00 0.00 175.29 177.35 3k6m s VAL 479 N 0.94 2.10 -2.00 1.09 0.11 -0.21 -5.00 120.40 117.43 3k6m s VAL 479 Ca -0.10 0.08 0.18 0.00 -2.93 0.00 0.00 61.98 59.22 3k6m s VAL 479 Cb -0.13 -3.05 0.53 0.00 -1.53 0.00 0.00 36.38 32.19 3k6m s VAL 479 CO -0.01 0.01 1.50 0.35 -3.33 0.00 0.00 175.10 173.62