#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kc2 h LYS 13 N 0.00 0.84 -2.33 1.97 1.57 -1.94 -1.92 116.57 114.76 3kc2 h LYS 13 Ca 0.00 -0.52 -0.08 0.00 -1.87 0.00 0.00 60.65 58.19 3kc2 h LYS 13 Cb 0.00 0.05 -0.20 0.00 0.08 0.00 0.00 32.23 32.16 3kc2 h LYS 13 CO 0.00 1.15 0.02 -1.50 -0.57 0.00 0.00 179.45 178.55 3kc2 s ILE 14 N -4.17 0.01 0.08 1.86 2.07 -1.26 -2.54 121.20 117.25 3kc2 s ILE 14 Ca -0.11 -0.11 0.02 0.00 -1.41 0.00 0.00 60.65 59.04 3kc2 s ILE 14 Cb 0.10 -0.86 -0.04 0.00 0.13 0.00 0.00 42.46 41.79 3kc2 s ILE 14 CO 0.88 -0.06 -0.07 0.00 -1.91 0.00 0.00 174.94 173.78 3kc2 s ALA 15 N -0.77 0.86 0.03 1.50 0.00 -0.86 -4.30 121.76 118.22 3kc2 s ALA 15 Ca -0.08 -1.16 0.07 0.00 0.00 0.00 0.00 51.96 50.79 3kc2 s ALA 15 Cb -0.02 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.18 3kc2 s ALA 15 CO 0.06 -0.16 -0.17 -0.06 0.00 0.00 0.00 175.76 175.43 3kc2 s PHE 16 N -2.86 2.59 -0.24 0.00 0.08 -0.86 -1.05 117.98 115.63 3kc2 s PHE 16 Ca 0.05 -0.24 0.02 0.00 0.12 0.00 0.00 56.93 56.88 3kc2 s PHE 16 Cb 0.00 -1.48 0.05 0.00 -0.57 0.00 0.00 43.02 41.02 3kc2 s PHE 16 CO -0.03 0.25 -0.11 0.00 -0.10 0.00 0.00 175.22 175.24 3kc2 s ALA 17 N -0.92 2.35 -0.18 5.36 0.00 -0.04 -1.39 121.76 126.94 3kc2 s ALA 17 Ca 0.15 -1.55 -0.13 0.00 0.00 0.00 0.00 51.96 50.43 3kc2 s ALA 17 Cb -0.11 -1.47 -0.05 0.00 0.00 0.00 0.00 23.12 21.50 3kc2 s ALA 17 CO 0.05 -1.04 0.24 -0.06 0.00 0.00 0.00 175.76 174.95 3kc2 s PHE 18 N 1.22 3.43 0.77 0.00 0.08 0.06 -0.72 117.98 122.83 3kc2 s PHE 18 Ca -0.06 0.50 -0.12 0.00 0.12 0.00 0.00 56.93 57.37 3kc2 s PHE 18 Cb -0.18 -2.29 0.06 0.00 -0.57 0.00 0.00 43.02 40.04 3kc2 s PHE 18 CO -0.07 0.24 1.13 0.34 -0.10 0.00 0.00 175.22 176.76 3kc2 s ASP 19 N 0.48 4.18 -0.07 1.36 2.15 -0.17 -0.46 116.67 124.13 3kc2 s ASP 19 Ca 0.14 2.06 -0.08 0.00 0.43 0.00 0.00 52.55 55.10 3kc2 s ASP 19 Cb -0.12 -2.55 -0.03 0.00 -0.30 0.00 0.00 42.92 39.92 3kc2 s ASP 19 CO 0.02 -2.26 -0.15 -0.38 -0.17 0.00 0.00 175.17 172.23 3kc2 n ILE 20 N -3.30 0.71 -2.09 4.11 5.41 -1.26 -3.94 119.36 118.99 3kc2 n ILE 20 Ca 0.11 0.32 -0.42 0.00 1.00 0.00 0.00 62.75 63.75 3kc2 n ILE 20 Cb 0.52 -1.85 -0.03 0.00 -0.71 0.00 0.00 39.64 37.58 3kc2 n ILE 20 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 3kc2 s ASP 21 N -4.97 6.72 0.00 4.38 1.01 -1.26 -0.69 116.67 121.87 3kc2 s ASP 21 Ca -0.13 2.13 0.00 0.00 0.71 0.00 0.00 52.55 55.26 3kc2 s ASP 21 Cb 0.02 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.41 3kc2 s ASP 21 CO 0.19 -0.89 0.00 0.61 0.21 0.00 0.00 175.17 175.28 3kc2 n GLY 22 N 4.03 0.80 1.33 0.21 0.00 0.16 -4.69 105.19 107.03 3kc2 n GLY 22 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3kc2 n GLY 22 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3kc2 n VAL 23 N -2.09 0.80 -0.07 1.61 0.31 -0.69 -3.17 118.33 115.04 3kc2 n VAL 23 Ca 0.00 0.27 -0.09 0.00 -0.01 0.00 0.00 64.34 64.51 3kc2 n VAL 23 Cb 0.00 -1.26 -0.15 0.00 -0.91 0.00 0.00 33.84 31.52 3kc2 n VAL 23 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3kc2 n LEU 24 N -3.45 0.32 -3.99 7.52 4.77 0.14 -4.57 117.00 117.75 3kc2 n LEU 24 Ca 0.00 0.15 -0.09 0.00 -0.03 0.00 0.00 56.01 56.05 3kc2 n LEU 24 Cb 0.03 0.37 -0.11 0.00 -2.33 0.00 0.00 43.42 41.38 3kc2 n LEU 24 CO 0.00 0.44 -0.33 -0.36 -1.33 0.00 0.00 177.39 175.81 3kc2 s PHE 25 N -2.55 0.28 -0.26 -1.77 0.08 -0.86 -0.66 117.98 112.23 3kc2 s PHE 25 Ca -0.08 -0.59 0.03 0.00 0.12 0.00 0.00 56.93 56.40 3kc2 s PHE 25 Cb 0.07 -0.21 0.06 0.00 -0.57 0.00 0.00 43.02 42.37 3kc2 s PHE 25 CO 0.83 -0.25 -0.10 1.03 -0.10 0.00 0.00 175.22 176.63 3kc2 s ARG 26 N -2.00 2.23 7.49 0.44 0.52 -0.12 -0.66 118.95 126.85 3kc2 s ARG 26 Ca -0.11 -1.36 0.00 0.00 -0.52 0.00 0.00 55.73 53.74 3kc2 s ARG 26 Cb -0.06 -2.92 0.00 0.00 0.52 0.00 0.00 34.95 32.49 3kc2 s ARG 26 CO -0.03 -0.58 0.00 0.41 0.02 0.00 0.00 175.30 175.12 3kc2 n GLY 27 N 4.44 2.79 0.25 -3.53 0.00 -1.26 -1.94 105.19 105.94 3kc2 n GLY 27 Ca -0.13 -0.24 0.13 0.00 0.00 0.00 0.00 46.02 45.77 3kc2 n GLY 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kc2 n LYS 28 N 13.44 0.90 -3.57 1.61 5.02 -1.26 -4.88 118.16 129.43 3kc2 n LYS 28 Ca 0.00 -0.50 -0.38 0.00 -2.02 0.00 0.00 58.31 55.41 3kc2 n LYS 28 Cb 0.00 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.42 3kc2 n LYS 28 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3kc2 s LYS 29 N -2.45 4.03 0.42 1.97 2.20 -0.82 -5.05 119.74 120.04 3kc2 s LYS 29 Ca 0.26 -0.19 -0.26 0.00 -0.36 0.00 0.00 55.97 55.42 3kc2 s LYS 29 Cb 0.20 -3.60 -0.10 0.00 -1.51 0.00 0.00 37.83 32.82 3kc2 s LYS 29 CO 0.49 -0.09 1.32 -2.30 -0.36 0.00 0.00 175.35 174.41 3kc2 n PRO 30 N 4.75 2.06 -2.47 4.03 -0.02 -1.26 -0.94 135.00 141.14 3kc2 n PRO 30 Ca -0.13 0.73 -0.40 0.00 -2.02 0.00 0.00 63.50 61.68 3kc2 n PRO 30 Cb 0.52 -2.45 -0.04 0.00 -0.02 0.00 0.00 33.50 31.50 3kc2 n PRO 30 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3kc2 s ILE 31 N -1.19 3.51 0.18 4.25 1.01 0.17 -4.78 121.20 124.35 3kc2 s ILE 31 Ca 0.60 1.50 -0.33 0.00 0.00 0.00 0.00 60.65 62.42 3kc2 s ILE 31 Cb -0.50 -3.95 -0.14 0.00 0.01 0.00 0.00 42.46 37.88 3kc2 s ILE 31 CO 0.59 0.35 1.56 0.00 0.00 0.00 0.00 174.94 177.43 3kc2 n ALA 32 N 1.31 1.45 0.00 9.38 0.00 -1.26 -1.21 120.51 130.18 3kc2 n ALA 32 Ca -0.01 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3kc2 n ALA 32 Cb 0.45 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.54 3kc2 n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kc2 n GLY 33 N 3.22 1.96 0.12 0.00 0.00 -1.26 -4.81 105.19 104.41 3kc2 n GLY 33 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.07 3kc2 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kc2 h ALA 34 N 0.00 0.28 -0.43 4.61 0.00 -1.47 0.55 119.26 122.80 3kc2 h ALA 34 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3kc2 h ALA 34 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3kc2 h ALA 34 CO 0.00 -0.14 0.22 1.03 0.00 0.00 0.00 179.25 180.37 3kc2 h SER 35 N 0.19 0.55 -0.81 0.00 0.87 -1.84 -2.65 113.55 109.86 3kc2 h SER 35 Ca 0.07 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 3kc2 h SER 35 Cb 0.17 -0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 61.95 3kc2 h SER 35 CO -0.01 0.50 0.48 0.44 -0.53 0.00 0.00 176.83 177.72 3kc2 h ASP 36 N 0.56 0.99 -0.22 6.23 3.32 -1.84 -0.98 116.42 124.48 3kc2 h ASP 36 Ca 0.15 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 3kc2 h ASP 36 Cb 0.08 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3kc2 h ASP 36 CO -0.02 0.77 0.12 0.00 -1.72 0.00 0.00 179.24 178.39 3kc2 h ALA 37 N 1.40 0.28 -0.55 3.45 0.00 -0.57 0.63 119.26 123.90 3kc2 h ALA 37 Ca 0.29 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 3kc2 h ALA 37 Cb -0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3kc2 h ALA 37 CO -0.05 -0.19 -0.08 -0.07 0.00 0.00 0.00 179.25 178.86 3kc2 h LEU 38 N 0.25 1.01 -0.90 0.00 3.38 -1.24 -1.82 115.31 115.99 3kc2 h LEU 38 Ca 0.08 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 3kc2 h LEU 38 Cb 0.06 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 3kc2 h LEU 38 CO -0.01 1.10 0.37 0.11 0.09 0.00 0.00 178.44 180.10 3kc2 h LYS 39 N 0.91 1.16 -0.51 1.13 1.57 -1.02 -0.47 116.57 119.34 3kc2 h LYS 39 Ca 0.15 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3kc2 h LYS 39 Cb 0.64 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.71 3kc2 h LYS 39 CO 0.04 0.91 0.33 1.25 -0.57 0.00 0.00 179.45 181.41 3kc2 h LEU 40 N 1.15 0.60 -0.48 2.94 5.85 -0.63 0.24 115.31 124.98 3kc2 h LEU 40 Ca 0.27 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 3kc2 h LEU 40 Cb 0.14 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 3kc2 h LEU 40 CO -0.03 0.46 0.22 -0.07 -0.34 0.00 0.00 178.44 178.68 3kc2 h LEU 41 N 0.69 0.63 -1.05 2.25 3.38 -0.84 -2.62 115.31 117.75 3kc2 h LEU 41 Ca 0.19 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3kc2 h LEU 41 Cb -0.05 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3kc2 h LEU 41 CO -0.04 0.59 0.09 0.78 0.09 0.00 0.00 178.44 179.95 3kc2 h ASN 42 N 0.63 0.72 0.03 -0.43 2.35 -0.75 0.07 115.58 118.19 3kc2 h ASN 42 Ca 0.16 -0.13 -0.04 0.00 -0.55 0.00 0.00 56.30 55.74 3kc2 h ASN 42 Cb 0.13 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 3kc2 h ASN 42 CO -0.02 0.73 -0.11 0.03 -1.65 0.00 0.00 177.43 176.41 3kc2 h ARG 43 N 0.74 0.19 -0.10 0.81 3.08 -0.74 -2.69 114.38 115.66 3kc2 h ARG 43 Ca 0.16 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.17 3kc2 h ARG 43 Cb 0.32 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3kc2 h ARG 43 CO 0.00 0.31 0.00 0.09 -1.07 0.00 0.00 179.97 179.30 3kc2 n ASN 44 N -4.31 2.38 -3.34 7.04 4.13 -0.71 -4.95 115.26 115.49 3kc2 n ASN 44 Ca -0.01 -1.79 -0.24 0.00 1.68 0.00 0.00 54.58 54.22 3kc2 n ASN 44 Cb 0.24 -0.05 0.04 0.00 -1.54 0.00 0.00 39.78 38.46 3kc2 n ASN 44 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3kc2 n LYS 45 N 0.83 -5.36 -3.50 3.52 4.01 -0.15 -4.97 118.16 112.55 3kc2 n LYS 45 Ca 0.17 0.76 -0.38 0.00 -0.51 0.00 0.00 58.31 58.35 3kc2 n LYS 45 Cb 0.48 -5.65 -0.10 0.00 -0.51 0.00 0.00 35.03 29.26 3kc2 n LYS 45 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3kc2 s ILE 46 N -3.18 5.25 0.56 -0.18 1.01 -0.26 -5.02 121.20 119.38 3kc2 s ILE 46 Ca 0.44 0.39 -0.17 0.00 0.00 0.00 0.00 60.65 61.31 3kc2 s ILE 46 Cb -0.21 -3.62 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 3kc2 s ILE 46 CO 0.54 0.22 1.04 -2.16 0.00 0.00 0.00 174.94 174.59 3kc2 s PRO 47 N 1.77 3.50 0.09 2.79 0.04 -1.26 -4.50 135.00 137.42 3kc2 s PRO 47 Ca 0.12 1.20 -0.08 0.00 0.04 0.00 0.00 61.00 62.27 3kc2 s PRO 47 Cb -0.15 -2.06 -0.00 0.00 0.04 0.00 0.00 34.50 32.32 3kc2 s PRO 47 CO 0.09 -0.67 0.17 1.52 0.04 0.00 0.00 177.00 178.16 3kc2 s TYR 48 N -2.39 0.18 0.27 0.56 -0.85 -1.26 -2.02 117.35 111.84 3kc2 s TYR 48 Ca 0.64 -0.62 0.07 0.00 -0.52 0.00 0.00 57.07 56.64 3kc2 s TYR 48 Cb -0.15 -0.08 -0.06 0.00 0.38 0.00 0.00 41.96 42.05 3kc2 s TYR 48 CO 0.33 -0.53 -0.09 0.96 -1.52 0.00 0.00 175.55 174.70 3kc2 s ILE 49 N -3.87 1.75 -0.17 -3.49 -4.36 -0.49 -4.94 121.20 105.64 3kc2 s ILE 49 Ca 0.05 -2.17 -0.05 0.00 -0.26 0.00 0.00 60.65 58.23 3kc2 s ILE 49 Cb 0.05 -2.37 -0.03 0.00 1.25 0.00 0.00 42.46 41.36 3kc2 s ILE 49 CO -0.11 -0.36 -0.01 -0.76 0.24 0.00 0.00 174.94 173.94 3kc2 s LEU 50 N -3.43 3.32 -0.28 0.37 1.43 0.36 -0.76 118.68 119.69 3kc2 s LEU 50 Ca 0.28 -0.13 -0.00 0.00 -1.03 0.00 0.00 54.13 53.25 3kc2 s LEU 50 Cb 0.02 -1.82 0.09 0.00 0.03 0.00 0.00 46.19 44.51 3kc2 s LEU 50 CO 0.11 0.14 0.05 -0.22 0.23 0.00 0.00 176.35 176.66 3kc2 s LEU 51 N 0.57 2.43 0.04 1.79 2.96 0.39 -0.58 118.68 126.28 3kc2 s LEU 51 Ca -0.02 -1.48 0.08 0.00 -0.22 0.00 0.00 54.13 52.49 3kc2 s LEU 51 Cb -0.14 -0.97 -0.03 0.00 0.50 0.00 0.00 46.19 45.55 3kc2 s LEU 51 CO 0.02 -0.36 -0.22 0.28 -1.32 0.00 0.00 176.35 174.75 3kc2 s THR 52 N 1.53 1.77 -2.27 3.68 -1.32 -0.17 -3.94 115.64 114.93 3kc2 s THR 52 Ca 0.05 -1.23 0.26 0.00 -1.21 0.00 0.00 61.69 59.56 3kc2 s THR 52 Cb -0.18 -1.53 0.61 0.00 -1.51 0.00 0.00 72.50 69.89 3kc2 s THR 52 CO -0.17 0.25 1.81 0.59 -2.21 0.00 0.00 174.62 174.89 3kc2 n ASN 53 N 1.85 1.00 -4.53 8.08 3.02 -1.26 -2.30 115.26 121.13 3kc2 n ASN 53 Ca -0.17 -1.42 -0.29 0.00 -0.03 0.00 0.00 54.58 52.67 3kc2 n ASN 53 Cb 0.53 -0.02 0.14 0.00 -0.61 0.00 0.00 39.78 39.82 3kc2 n ASN 53 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3kc2 s GLY 54 N -1.85 1.66 0.00 7.41 0.00 -1.26 -4.33 107.32 108.94 3kc2 s GLY 54 Ca 0.38 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 44.25 3kc2 s GLY 54 CO 0.31 -0.22 0.00 0.61 0.00 0.00 0.00 173.10 173.81 3kc2 n GLY 55 N -3.11 -1.71 0.00 0.20 0.00 -1.26 -1.18 105.19 98.14 3kc2 n GLY 55 Ca 0.11 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 45.03 3kc2 n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kc2 n GLY 56 N -0.30 4.43 3.78 -0.02 0.00 -1.26 -4.89 105.19 106.93 3kc2 n GLY 56 Ca 0.00 -0.84 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 3kc2 n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kc2 s PHE 57 N 0.00 2.76 0.90 1.61 0.08 -1.26 -3.50 117.98 118.57 3kc2 s PHE 57 Ca 0.00 -0.38 -0.10 0.00 0.12 0.00 0.00 56.93 56.57 3kc2 s PHE 57 Cb 0.00 -1.75 0.14 0.00 -0.57 0.00 0.00 43.02 40.84 3kc2 s PHE 57 CO 0.00 0.25 1.14 -1.54 -0.10 0.00 0.00 175.22 174.97 3kc2 s SER 58 N -3.92 3.03 0.32 1.36 1.04 -1.26 -4.75 113.70 109.52 3kc2 s SER 58 Ca 0.40 2.16 -0.00 0.00 0.48 0.00 0.00 55.95 58.99 3kc2 s SER 58 Cb -0.03 -2.56 0.51 0.00 0.10 0.00 0.00 66.02 64.04 3kc2 s SER 58 CO 0.24 -3.03 1.96 -0.33 0.98 0.00 0.00 173.24 173.07 3kc2 h GLU 59 N -1.82 0.95 0.06 4.02 3.07 -1.97 -0.07 114.58 118.82 3kc2 h GLU 59 Ca -0.43 -0.08 -0.00 0.00 -0.50 0.00 0.00 59.36 58.35 3kc2 h GLU 59 Cb 1.27 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.97 3kc2 h GLU 59 CO 0.42 0.66 -0.03 -0.09 -1.40 0.00 0.00 179.01 178.57 3kc2 h ARG 60 N 0.97 -0.08 -0.81 2.33 2.43 -1.90 -1.76 114.38 115.57 3kc2 h ARG 60 Ca 0.26 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.41 3kc2 h ARG 60 Cb -0.06 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.47 3kc2 h ARG 60 CO -0.05 0.14 0.43 0.00 -1.51 0.00 0.00 179.97 178.99 3kc2 h ALA 61 N 0.63 1.04 -0.23 2.80 0.00 -1.81 -0.28 119.26 121.41 3kc2 h ALA 61 Ca -0.01 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3kc2 h ALA 61 Cb 0.26 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3kc2 h ALA 61 CO 0.01 0.56 0.04 -0.09 0.00 0.00 0.00 179.25 179.77 3kc2 h ARG 62 N 1.13 0.38 -0.02 0.00 9.65 -0.99 -1.99 114.38 122.54 3kc2 h ARG 62 Ca 0.28 -0.10 -0.08 0.00 -1.10 0.00 0.00 59.98 58.98 3kc2 h ARG 62 Cb 0.05 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.57 3kc2 h ARG 62 CO -0.04 0.52 -0.36 1.79 2.80 0.00 0.00 179.97 184.68 3kc2 h THR 63 N 0.19 1.27 -0.43 0.20 1.35 -1.17 -1.22 112.91 113.10 3kc2 h THR 63 Ca 0.07 -1.28 -0.00 0.00 -0.55 0.00 0.00 66.41 64.65 3kc2 h THR 63 Cb 0.33 1.66 -0.02 0.00 -1.73 0.00 0.00 68.15 68.39 3kc2 h THR 63 CO 0.00 0.37 0.26 -0.33 -0.25 0.00 0.00 175.52 175.57 3kc2 h GLU 64 N 0.04 0.58 -0.11 4.72 5.08 -0.84 0.65 114.58 124.70 3kc2 h GLU 64 Ca 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3kc2 h GLU 64 Cb 0.66 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 3kc2 h GLU 64 CO 0.05 0.43 0.03 0.35 -1.00 0.00 0.00 179.01 178.86 3kc2 h PHE 65 N 0.57 0.18 -0.69 4.33 3.57 -1.06 -1.91 116.94 121.93 3kc2 h PHE 65 Ca 0.15 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 3kc2 h PHE 65 Cb -0.00 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 3kc2 h PHE 65 CO -0.03 0.33 0.36 0.82 -2.23 0.00 0.00 178.31 177.56 3kc2 h ILE 66 N -0.03 1.22 -0.40 1.41 2.04 -1.15 -1.43 117.51 119.17 3kc2 h ILE 66 Ca 0.03 -0.57 0.06 0.00 1.00 0.00 0.00 64.86 65.38 3kc2 h ILE 66 Cb 0.25 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.61 3kc2 h ILE 66 CO 0.00 0.25 0.08 0.28 0.00 0.00 0.00 178.15 178.76 3kc2 h SER 67 N 0.95 0.02 -0.42 1.72 0.02 -0.77 -0.03 113.55 115.04 3kc2 h SER 67 Ca 0.24 0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 61.22 3kc2 h SER 67 Cb 0.07 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 3kc2 h SER 67 CO -0.04 0.05 0.12 0.28 -1.14 0.00 0.00 176.83 176.10 3kc2 h SER 68 N 0.21 0.61 0.51 3.07 0.02 -0.93 -0.20 113.55 116.84 3kc2 h SER 68 Ca 0.19 -0.21 -0.18 0.00 -0.84 0.00 0.00 61.79 60.75 3kc2 h SER 68 Cb 0.22 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 3kc2 h SER 68 CO -0.25 0.66 -0.79 0.11 -1.14 0.00 0.00 176.83 175.43 3kc2 h LYS 69 N 0.53 0.21 -0.02 3.45 1.79 -0.94 -3.24 116.57 118.36 3kc2 h LYS 69 Ca 0.13 -0.20 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3kc2 h LYS 69 Cb 0.27 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 3kc2 h LYS 69 CO -0.00 0.89 -0.23 1.28 -1.08 0.00 0.00 179.45 180.31 3kc2 n LEU 70 N -3.73 1.92 -3.87 2.94 4.77 -0.05 -4.89 117.00 114.09 3kc2 n LEU 70 Ca -0.03 -0.65 -0.28 0.00 -0.03 0.00 0.00 56.01 55.02 3kc2 n LEU 70 Cb 0.74 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.83 3kc2 n LEU 70 CO 0.47 0.34 0.08 -0.67 -1.33 0.00 0.00 177.39 176.28 3kc2 n ASP 71 N 0.18 -4.18 -4.20 -1.43 2.03 -0.11 -4.71 116.55 104.14 3kc2 n ASP 71 Ca 0.13 -0.78 -0.13 0.00 0.52 0.00 0.00 54.79 54.53 3kc2 n ASP 71 Cb 0.45 -3.95 -0.10 0.00 -0.72 0.00 0.00 41.12 36.80 3kc2 n ASP 71 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3kc2 s VAL 72 N -3.38 0.92 -0.60 5.18 -7.23 -1.08 -5.04 120.40 109.18 3kc2 s VAL 72 Ca 0.54 -1.87 -0.21 0.00 -1.81 0.00 0.00 61.98 58.63 3kc2 s VAL 72 Cb -0.27 -1.62 0.08 0.00 0.56 0.00 0.00 36.38 35.13 3kc2 s VAL 72 CO 0.82 -0.73 0.81 -0.62 -0.31 0.00 0.00 175.10 175.08 3kc2 s ASP 73 N -2.88 6.20 -0.27 4.85 2.15 -1.26 -4.25 116.67 121.21 3kc2 s ASP 73 Ca 0.11 -1.05 -0.11 0.00 0.43 0.00 0.00 52.55 51.93 3kc2 s ASP 73 Cb 0.02 -2.36 -0.05 0.00 -0.30 0.00 0.00 42.92 40.23 3kc2 s ASP 73 CO -0.02 -1.21 0.18 -0.69 -0.17 0.00 0.00 175.17 173.27 3kc2 s VAL 74 N 3.33 5.29 0.38 1.11 1.01 -1.26 -5.07 120.40 125.18 3kc2 s VAL 74 Ca 0.18 0.16 -0.25 0.00 0.00 0.00 0.00 61.98 62.08 3kc2 s VAL 74 Cb -0.19 -3.51 -0.09 0.00 0.00 0.00 0.00 36.38 32.58 3kc2 s VAL 74 CO 0.10 0.26 1.04 -0.55 0.00 0.00 0.00 175.10 175.96 3kc2 s SER 75 N 1.67 6.87 0.29 3.32 0.15 -1.26 -4.70 113.70 120.05 3kc2 s SER 75 Ca 0.07 2.03 0.19 0.00 0.70 0.00 0.00 55.95 58.94 3kc2 s SER 75 Cb -0.16 -2.59 1.03 0.00 -1.71 0.00 0.00 66.02 62.60 3kc2 s SER 75 CO 0.10 -0.41 1.57 -2.65 1.20 0.00 0.00 173.24 173.05 3kc2 n PRO 76 N 0.11 0.12 -0.02 5.44 -0.02 -1.26 -1.39 135.00 137.98 3kc2 n PRO 76 Ca 0.04 0.62 0.13 0.00 -2.02 0.00 0.00 63.50 62.27 3kc2 n PRO 76 Cb 0.49 -1.93 0.57 0.00 -0.02 0.00 0.00 33.50 32.61 3kc2 n PRO 76 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3kc2 n LEU 77 N -2.17 1.04 -0.87 2.45 4.77 -1.26 -3.98 117.00 116.98 3kc2 n LEU 77 Ca -0.01 -0.38 0.08 0.00 -0.03 0.00 0.00 56.01 55.66 3kc2 n LEU 77 Cb 0.06 -0.03 0.19 0.00 -2.33 0.00 0.00 43.42 41.31 3kc2 n LEU 77 CO 0.08 0.19 0.65 0.00 -1.33 0.00 0.00 177.39 176.99 3kc2 n GLN 78 N -0.15 2.49 -4.81 3.23 6.02 -0.49 -4.78 117.38 118.89 3kc2 n GLN 78 Ca 0.19 -2.13 -0.25 0.00 -0.01 0.00 0.00 57.00 54.80 3kc2 n GLN 78 Cb 0.26 -1.37 -0.16 0.00 1.02 0.00 0.00 30.24 29.99 3kc2 n GLN 78 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 3kc2 s ILE 79 N -1.07 1.36 -0.17 5.09 2.07 -1.26 -0.48 121.20 126.73 3kc2 s ILE 79 Ca 0.31 -0.71 0.01 0.00 -1.41 0.00 0.00 60.65 58.85 3kc2 s ILE 79 Cb 0.17 -1.15 0.02 0.00 0.13 0.00 0.00 42.46 41.63 3kc2 s ILE 79 CO 0.22 0.39 -0.18 -0.63 -1.91 0.00 0.00 174.94 172.84 3kc2 s ILE 80 N -0.20 1.89 0.50 2.00 1.09 0.26 -4.97 121.20 121.77 3kc2 s ILE 80 Ca 0.02 -0.86 0.08 0.00 -1.10 0.00 0.00 60.65 58.80 3kc2 s ILE 80 Cb -0.09 -1.74 0.04 0.00 -1.06 0.00 0.00 42.46 39.61 3kc2 s ILE 80 CO 0.00 0.49 0.59 -1.10 -0.10 0.00 0.00 174.94 174.82 3kc2 s GLN 81 N 1.35 2.47 0.21 2.79 -0.21 -1.26 -1.00 119.66 124.01 3kc2 s GLN 81 Ca 0.05 -1.59 -0.10 0.00 0.02 0.00 0.00 55.36 53.73 3kc2 s GLN 81 Cb -0.13 -2.52 0.28 0.00 1.00 0.00 0.00 33.01 31.64 3kc2 s GLN 81 CO -0.12 -0.54 1.73 0.66 -2.12 0.00 0.00 175.29 174.90 3kc2 h SER 82 N 0.56 0.14 0.17 5.90 4.64 -0.72 -2.19 113.55 122.05 3kc2 h SER 82 Ca -0.36 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3kc2 h SER 82 Cb 1.28 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 3kc2 h SER 82 CO 0.48 0.08 -0.15 0.00 -0.87 0.00 0.00 176.83 176.38 3kc2 n HIS 83 N -5.05 0.00 -0.37 4.77 -0.00 -1.26 -4.31 115.22 108.99 3kc2 n HIS 83 Ca 0.09 0.00 0.02 0.00 -0.00 0.00 0.00 57.72 57.82 3kc2 n HIS 83 Cb 0.29 -0.09 0.16 0.00 -0.00 0.00 0.00 29.99 30.36 3kc2 n HIS 83 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.34 177.49 3kc2 h THR 84 N 1.44 1.13 0.00 0.61 2.02 -1.78 -0.52 112.91 115.81 3kc2 h THR 84 Ca 0.00 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.76 3kc2 h THR 84 Cb 0.47 -0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 3kc2 h THR 84 CO 0.00 0.22 0.00 -2.65 0.37 0.00 0.00 175.52 173.46 3kc2 n PRO 85 N -4.47 0.06 0.13 6.66 -0.02 -1.26 -2.23 135.00 133.86 3kc2 n PRO 85 Ca 0.15 0.23 0.10 0.00 -2.02 0.00 0.00 63.50 61.95 3kc2 n PRO 85 Cb 0.15 -1.50 0.48 0.00 -0.02 0.00 0.00 33.50 32.60 3kc2 n PRO 85 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3kc2 n TYR 86 N -1.44 0.62 -0.07 6.00 4.01 -0.20 -1.72 117.16 124.37 3kc2 n TYR 86 Ca 0.04 0.30 0.23 0.00 -0.16 0.00 0.00 57.90 58.32 3kc2 n TYR 86 Cb 0.15 -0.98 0.70 0.00 -0.31 0.00 0.00 39.34 38.90 3kc2 n TYR 86 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 3kc2 h LYS 87 N 0.00 0.00 0.00 -0.72 1.57 -1.62 -1.16 116.57 114.64 3kc2 h LYS 87 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3kc2 h LYS 87 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 3kc2 h LYS 87 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.75 3kc2 n SER 88 N -4.32 0.33 -0.88 0.86 3.41 -0.70 -3.35 113.62 108.97 3kc2 n SER 88 Ca 0.13 0.57 0.11 0.00 -0.26 0.00 0.00 58.87 59.42 3kc2 n SER 88 Cb 0.75 -0.64 0.09 0.00 -0.26 0.00 0.00 64.21 64.14 3kc2 n SER 88 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kc2 n LEU 89 N -1.85 2.83 0.21 1.04 4.77 -0.44 -4.61 117.00 118.95 3kc2 n LEU 89 Ca 0.03 -1.00 0.06 0.00 -0.03 0.00 0.00 56.01 55.08 3kc2 n LEU 89 Cb 0.23 0.00 0.48 0.00 -2.33 0.00 0.00 43.42 41.80 3kc2 n LEU 89 CO 0.19 0.48 0.82 0.58 -1.33 0.00 0.00 177.39 178.12 3kc2 h VAL 90 N 4.30 1.01 -0.29 4.08 2.07 -1.66 -1.51 116.25 124.25 3kc2 h VAL 90 Ca 0.00 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.53 3kc2 h VAL 90 Cb 0.91 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 3kc2 h VAL 90 CO 0.00 0.26 0.00 0.59 0.02 0.00 0.00 177.57 178.44 3kc2 n ASN 91 N -3.95 2.85 -0.05 0.57 3.02 -1.26 -4.26 115.26 112.18 3kc2 n ASN 91 Ca -0.02 -1.90 -0.19 0.00 -0.03 0.00 0.00 54.58 52.43 3kc2 n ASN 91 Cb 0.34 -0.18 -0.13 0.00 -0.61 0.00 0.00 39.78 39.20 3kc2 n ASN 91 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3kc2 n LYS 92 N 1.11 0.71 -3.87 3.52 0.00 -0.58 -4.92 118.16 114.12 3kc2 n LYS 92 Ca 0.18 0.21 -0.27 0.00 0.00 0.00 0.00 58.31 58.43 3kc2 n LYS 92 Cb 0.52 -1.63 -0.17 0.00 0.00 0.00 0.00 35.03 33.75 3kc2 n LYS 92 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 3kc2 s TYR 93 N -2.54 1.41 -0.04 5.64 2.02 -1.15 -5.05 117.35 117.64 3kc2 s TYR 93 Ca -0.27 -0.77 -0.16 0.00 -0.37 0.00 0.00 57.07 55.50 3kc2 s TYR 93 Cb 0.08 -1.19 -0.10 0.00 -0.40 0.00 0.00 41.96 40.35 3kc2 s TYR 93 CO 0.70 -0.52 0.68 1.03 -1.57 0.00 0.00 175.55 175.87 3kc2 h SER 94 N 8.19 -0.42 -3.48 2.29 0.87 -1.91 -3.43 113.55 115.65 3kc2 h SER 94 Ca -0.26 -0.04 -0.63 0.00 -1.23 0.00 0.00 61.79 59.63 3kc2 h SER 94 Cb 1.12 0.11 -0.17 0.00 -0.44 0.00 0.00 62.40 63.02 3kc2 h SER 94 CO 0.38 0.02 -0.56 -0.60 -0.53 0.00 0.00 176.83 175.54 3kc2 s ARG 95 N -3.38 3.91 0.05 2.24 3.52 -1.26 -2.10 118.95 121.94 3kc2 s ARG 95 Ca -0.09 -0.36 0.09 0.00 -0.13 0.00 0.00 55.73 55.24 3kc2 s ARG 95 Cb 0.01 -3.33 -0.03 0.00 -1.56 0.00 0.00 34.95 30.03 3kc2 s ARG 95 CO 0.28 0.09 -0.26 0.96 -0.81 0.00 0.00 175.30 175.56 3kc2 s ILE 96 N 0.91 2.10 -0.51 4.11 -4.36 -0.70 -0.54 121.20 122.20 3kc2 s ILE 96 Ca 0.05 -1.40 -0.24 0.00 -0.26 0.00 0.00 60.65 58.80 3kc2 s ILE 96 Cb -0.14 -1.80 0.04 0.00 1.25 0.00 0.00 42.46 41.81 3kc2 s ILE 96 CO 0.03 0.33 0.91 -0.22 0.24 0.00 0.00 174.94 176.22 3kc2 s LEU 97 N -1.30 4.12 -0.56 0.37 2.96 -0.35 -1.34 118.68 122.58 3kc2 s LEU 97 Ca 0.11 -0.20 -0.19 0.00 -0.22 0.00 0.00 54.13 53.63 3kc2 s LEU 97 Cb -0.10 -2.94 0.09 0.00 0.50 0.00 0.00 46.19 43.75 3kc2 s LEU 97 CO 0.02 -1.12 0.66 0.00 -1.32 0.00 0.00 176.35 174.59 3kc2 s ALA 98 N 3.76 3.42 -0.10 5.97 0.00 0.48 -0.86 121.76 134.44 3kc2 s ALA 98 Ca 0.32 -2.12 -0.15 0.00 0.00 0.00 0.00 51.96 50.01 3kc2 s ALA 98 Cb -0.12 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 3kc2 s ALA 98 CO 0.21 -2.22 0.39 0.08 0.00 0.00 0.00 175.76 174.22 3kc2 s VAL 99 N 2.58 5.19 -5.00 0.00 1.01 -0.19 -3.99 120.40 119.99 3kc2 s VAL 99 Ca 0.12 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.86 3kc2 s VAL 99 Cb -0.23 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.44 3kc2 s VAL 99 CO 0.07 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.21 3kc2 n GLY 100 N 2.84 -0.75 3.71 4.51 0.00 -1.26 -0.25 105.19 114.00 3kc2 n GLY 100 Ca -0.11 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.29 3kc2 n GLY 100 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kc2 s THR 101 N -2.91 2.46 0.55 2.61 -4.23 -1.25 -4.55 115.64 108.32 3kc2 s THR 101 Ca 0.00 0.17 0.27 0.00 -1.18 0.00 0.00 61.69 60.95 3kc2 s THR 101 Cb 0.00 -2.46 0.40 0.00 1.34 0.00 0.00 72.50 71.78 3kc2 s THR 101 CO 0.00 -0.17 1.98 -0.65 -0.54 0.00 0.00 174.62 175.23 3kc2 h PRO 102 N -1.22 0.00 0.00 3.99 0.11 -1.95 -0.23 132.00 132.71 3kc2 h PRO 102 Ca -0.44 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 3kc2 h PRO 102 Cb 1.27 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 3kc2 h PRO 102 CO 0.46 0.00 -0.01 0.66 -0.21 0.00 0.00 178.00 178.91 3kc2 h SER 103 N 0.00 0.00 0.85 -2.05 4.64 -1.90 -2.53 113.55 112.57 3kc2 h SER 103 Ca 0.25 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3kc2 h SER 103 Cb 1.08 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3kc2 h SER 103 CO -0.00 0.01 -0.02 -0.37 -0.87 0.00 0.00 176.83 175.57 3kc2 h VAL 104 N 0.00 0.06 -0.06 0.95 -1.51 -1.07 -2.77 116.25 111.86 3kc2 h VAL 104 Ca -0.00 -0.49 0.03 0.00 -1.23 0.00 0.00 66.70 65.01 3kc2 h VAL 104 Cb 0.08 1.45 -0.03 0.00 -2.13 0.00 0.00 31.29 30.67 3kc2 h VAL 104 CO 0.00 0.02 -0.12 -0.09 -1.23 0.00 0.00 177.57 176.15 3kc2 h ARG 105 N 0.00 -0.17 -0.42 5.19 2.43 -1.65 -0.35 114.38 119.41 3kc2 h ARG 105 Ca -0.00 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 3kc2 h ARG 105 Cb 0.45 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 3kc2 h ARG 105 CO 0.00 -0.11 -0.03 0.78 -1.51 0.00 0.00 179.97 179.10 3kc2 h GLY 106 N -0.18 0.74 0.83 2.80 0.00 -1.70 -0.87 103.07 104.69 3kc2 h GLY 106 Ca 0.06 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 3kc2 h GLY 106 CO -0.16 0.46 0.01 -2.08 0.00 0.00 0.00 176.54 174.77 3kc2 h VAL 107 N 0.65 1.24 -0.53 4.60 2.07 -1.24 0.11 116.25 123.15 3kc2 h VAL 107 Ca 0.13 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 3kc2 h VAL 107 Cb 0.45 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 3kc2 h VAL 107 CO 0.02 0.25 0.30 0.00 0.02 0.00 0.00 177.57 178.16 3kc2 h ALA 108 N 0.80 0.68 -0.71 1.67 0.00 -0.87 -1.25 119.26 119.58 3kc2 h ALA 108 Ca 0.06 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3kc2 h ALA 108 Cb 0.36 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3kc2 h ALA 108 CO 0.01 0.19 0.24 0.93 0.00 0.00 0.00 179.25 180.62 3kc2 h GLU 109 N 0.71 1.09 -0.50 0.00 5.08 -1.07 -2.47 114.58 117.41 3kc2 h GLU 109 Ca 0.19 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 3kc2 h GLU 109 Cb 0.04 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 3kc2 h GLU 109 CO -0.03 0.91 0.19 0.78 -1.00 0.00 0.00 179.01 179.86 3kc2 h GLY 110 N 1.10 0.78 2.00 -3.84 0.00 -0.32 -2.10 103.07 100.69 3kc2 h GLY 110 Ca 0.23 -0.39 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 3kc2 h GLY 110 CO -0.01 0.37 -0.22 -0.97 0.00 0.00 0.00 176.54 175.71 3kc2 h TYR 111 N 0.72 0.00 0.00 5.60 0.05 -0.79 -3.47 116.97 119.08 3kc2 h TYR 111 Ca 0.17 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.95 3kc2 h TYR 111 Cb 0.17 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.91 3kc2 h TYR 111 CO 0.01 0.22 0.00 0.41 -1.05 0.00 0.00 178.16 177.74 3kc2 n GLY 112 N -0.25 1.16 3.70 3.88 0.00 -0.79 -4.97 105.19 107.93 3kc2 n GLY 112 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 3kc2 n GLY 112 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3kc2 n PHE 113 N -0.29 2.53 -0.12 1.61 3.72 -1.05 -4.89 117.46 118.97 3kc2 n PHE 113 Ca 0.00 0.25 -0.08 0.00 -0.05 0.00 0.00 57.45 57.57 3kc2 n PHE 113 Cb 0.00 -2.57 0.08 0.00 -0.94 0.00 0.00 39.48 36.05 3kc2 n PHE 113 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 3kc2 h GLN 114 N 5.38 0.87 -1.81 -1.08 4.20 -1.83 -3.42 115.11 117.43 3kc2 h GLN 114 Ca -0.45 -0.32 -0.30 0.00 0.06 0.00 0.00 58.65 57.64 3kc2 h GLN 114 Cb 1.24 -0.06 -0.29 0.00 0.30 0.00 0.00 27.48 28.67 3kc2 h GLN 114 CO 0.85 0.96 -0.63 0.34 -0.67 0.00 0.00 178.83 179.67 3kc2 s ASP 115 N -6.70 0.76 -0.20 1.46 -1.08 -0.89 -5.03 116.67 104.99 3kc2 s ASP 115 Ca -0.10 -1.27 -0.12 0.00 -0.52 0.00 0.00 52.55 50.53 3kc2 s ASP 115 Cb 0.13 0.80 -0.05 0.00 -1.46 0.00 0.00 42.92 42.35 3kc2 s ASP 115 CO 0.84 -0.27 0.23 -0.69 0.52 0.00 0.00 175.17 175.81 3kc2 s VAL 116 N 1.69 5.33 -0.12 1.11 1.01 -1.26 -1.73 120.40 126.43 3kc2 s VAL 116 Ca 0.15 0.38 0.03 0.00 0.00 0.00 0.00 61.98 62.54 3kc2 s VAL 116 Cb -0.13 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.67 3kc2 s VAL 116 CO -0.09 0.36 -0.22 -0.69 0.00 0.00 0.00 175.10 174.46 3kc2 s VAL 117 N 0.81 2.23 0.19 2.92 1.01 -0.45 -4.99 120.40 122.13 3kc2 s VAL 117 Ca 0.12 -0.95 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 3kc2 s VAL 117 Cb -0.13 -1.88 -0.06 0.00 0.00 0.00 0.00 36.38 34.31 3kc2 s VAL 117 CO 0.04 0.55 0.45 -2.28 0.00 0.00 0.00 175.10 173.85 3kc2 s HIS 118 N 0.48 3.46 0.49 5.22 2.46 -1.26 -0.38 115.29 125.76 3kc2 s HIS 118 Ca -0.14 0.63 0.14 0.00 0.47 0.00 0.00 55.06 56.15 3kc2 s HIS 118 Cb -0.17 -2.07 1.17 0.00 -0.13 0.00 0.00 32.58 31.39 3kc2 s HIS 118 CO 0.06 0.35 2.12 -0.56 -2.47 0.00 0.00 174.74 174.23 3kc2 h GLN 119 N 2.50 0.13 0.00 2.88 -0.00 -1.91 -0.61 115.11 118.10 3kc2 h GLN 119 Ca -0.47 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.17 3kc2 h GLN 119 Cb 1.17 -0.03 -0.00 0.00 -0.00 0.00 0.00 27.48 28.62 3kc2 h GLN 119 CO 0.70 0.09 -0.02 1.79 -0.00 0.00 0.00 178.83 181.40 3kc2 h THR 120 N 0.14 0.05 -0.15 1.86 1.35 -1.94 -2.11 112.91 112.12 3kc2 h THR 120 Ca 0.05 -0.41 -0.07 0.00 -0.55 0.00 0.00 66.41 65.44 3kc2 h THR 120 Cb 0.04 1.38 -0.01 0.00 -1.73 0.00 0.00 68.15 67.83 3kc2 h THR 120 CO -0.01 0.02 -0.20 0.44 -0.25 0.00 0.00 175.52 175.51 3kc2 h ASP 121 N 0.00 0.24 0.05 5.36 3.32 -1.38 -0.80 116.42 123.21 3kc2 h ASP 121 Ca -0.00 -0.06 -0.23 0.00 0.02 0.00 0.00 57.03 56.76 3kc2 h ASP 121 Cb 0.38 -0.07 0.02 0.00 0.22 0.00 0.00 39.33 39.89 3kc2 h ASP 121 CO 0.00 0.47 -0.91 0.40 -1.72 0.00 0.00 179.24 177.47 3kc2 h ILE 122 N 0.23 1.36 -0.68 0.35 2.04 -1.47 -1.93 117.51 117.40 3kc2 h ILE 122 Ca 0.04 -2.27 0.04 0.00 1.00 0.00 0.00 64.86 63.67 3kc2 h ILE 122 Cb 0.50 2.62 -0.05 0.00 -0.74 0.00 0.00 36.82 39.16 3kc2 h ILE 122 CO 0.03 0.68 0.42 0.58 0.00 0.00 0.00 178.15 179.86 3kc2 h VAL 123 N 0.11 1.06 -0.71 1.67 2.07 -1.33 -1.92 116.25 117.20 3kc2 h VAL 123 Ca -0.13 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 3kc2 h VAL 123 Cb 1.61 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 3kc2 h VAL 123 CO 0.18 0.15 0.37 -0.09 0.02 0.00 0.00 177.57 178.19 3kc2 h ARG 124 N 0.81 1.01 -0.54 1.57 1.12 -1.13 -2.69 114.38 114.52 3kc2 h ARG 124 Ca 0.28 -0.13 0.06 0.00 -1.11 0.00 0.00 59.98 59.08 3kc2 h ARG 124 Cb 0.06 -0.19 -0.05 0.00 -0.01 0.00 0.00 29.97 29.78 3kc2 h ARG 124 CO -0.12 0.77 0.26 -0.92 -3.11 0.00 0.00 179.97 176.85 3kc2 h TYR 125 N 0.98 0.47 -1.55 2.20 3.20 -1.01 -3.40 116.97 117.86 3kc2 h TYR 125 Ca 0.25 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.05 3kc2 h TYR 125 Cb 0.08 -0.13 -0.27 0.00 1.54 0.00 0.00 36.73 37.95 3kc2 h TYR 125 CO 0.00 0.21 -0.44 1.21 -1.64 0.00 0.00 178.16 177.50 3kc2 s ASN 126 N -5.48 -0.27 0.53 -2.11 3.84 -0.75 -5.01 114.94 105.68 3kc2 s ASN 126 Ca -0.13 0.20 0.25 0.00 0.21 0.00 0.00 52.86 53.39 3kc2 s ASN 126 Cb 0.15 1.44 1.46 0.00 -0.55 0.00 0.00 41.25 43.75 3kc2 s ASN 126 CO 0.74 -0.31 2.12 0.03 -2.79 0.00 0.00 177.10 176.89 3kc2 h ARG 127 N 8.12 0.00 0.00 0.43 2.47 -1.72 -1.56 114.38 122.12 3kc2 h ARG 127 Ca -0.15 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.57 3kc2 h ARG 127 Cb 1.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.47 3kc2 h ARG 127 CO 0.26 0.09 0.00 -0.25 0.56 0.00 0.00 179.97 180.62 3kc2 n ASP 128 N -3.90 0.04 -0.01 7.04 8.00 -1.26 -1.86 116.55 124.60 3kc2 n ASP 128 Ca -0.02 0.51 -0.00 0.00 0.71 0.00 0.00 54.79 55.98 3kc2 n ASP 128 Cb 0.18 -0.51 0.29 0.00 -0.02 0.00 0.00 41.12 41.05 3kc2 n ASP 128 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3kc2 h ILE 129 N 0.00 1.20 -2.77 0.53 2.04 -1.63 -3.36 117.51 113.53 3kc2 h ILE 129 Ca 0.00 -0.81 -0.61 0.00 1.00 0.00 0.00 64.86 64.44 3kc2 h ILE 129 Cb 0.35 0.95 -0.41 0.00 -0.74 0.00 0.00 36.82 36.97 3kc2 h ILE 129 CO 0.00 0.28 -0.70 0.00 0.00 0.00 0.00 178.15 177.73 3kc2 n ALA 130 N -2.48 3.31 0.30 1.87 0.00 -0.77 -4.87 120.51 117.86 3kc2 n ALA 130 Ca 0.02 -4.15 0.17 0.00 0.00 0.00 0.00 53.44 49.47 3kc2 n ALA 130 Cb 0.25 -0.94 0.95 0.00 0.00 0.00 0.00 19.45 19.71 3kc2 n ALA 130 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3kc2 h PRO 131 N 5.26 0.00 -0.35 0.00 0.13 -1.72 -1.51 132.00 133.81 3kc2 h PRO 131 Ca 0.18 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.25 3kc2 h PRO 131 Cb 0.79 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.88 3kc2 h PRO 131 CO 0.63 0.02 0.02 1.19 -0.23 0.00 0.00 178.00 179.64 3kc2 n PHE 132 N -3.59 1.21 -1.80 1.56 3.72 -1.26 -4.98 117.46 112.32 3kc2 n PHE 132 Ca -0.03 -1.04 -0.41 0.00 -0.05 0.00 0.00 57.45 55.92 3kc2 n PHE 132 Cb 0.12 -0.40 -0.01 0.00 -0.94 0.00 0.00 39.48 38.24 3kc2 n PHE 132 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3kc2 s SER 133 N -1.89 6.37 0.00 4.37 0.15 -0.57 -4.51 113.70 117.62 3kc2 s SER 133 Ca 0.45 2.99 0.22 0.00 0.70 0.00 0.00 55.95 60.31 3kc2 s SER 133 Cb 0.37 -2.65 0.73 0.00 -1.71 0.00 0.00 66.02 62.75 3kc2 s SER 133 CO 0.08 -0.89 1.54 0.61 1.20 0.00 0.00 173.24 175.79 3kc2 n GLY 134 N 1.29 0.45 3.72 9.45 0.00 -1.26 -4.97 105.19 113.87 3kc2 n GLY 134 Ca 0.04 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 3kc2 n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kc2 s LEU 135 N -1.63 4.37 0.72 0.99 1.43 -1.26 -5.00 118.68 118.30 3kc2 s LEU 135 Ca 0.34 2.68 -0.11 0.00 -1.03 0.00 0.00 54.13 56.00 3kc2 s LEU 135 Cb 0.19 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.83 3kc2 s LEU 135 CO 0.28 -0.86 1.08 -0.94 0.23 0.00 0.00 176.35 176.14 3kc2 s SER 136 N 1.16 5.27 0.31 2.29 1.04 -1.26 -4.88 113.70 117.63 3kc2 s SER 136 Ca 0.71 1.27 -0.00 0.00 0.48 0.00 0.00 55.95 58.42 3kc2 s SER 136 Cb -0.45 -2.10 0.52 0.00 0.10 0.00 0.00 66.02 64.09 3kc2 s SER 136 CO 0.31 -1.47 1.96 0.44 0.98 0.00 0.00 173.24 175.46 3kc2 h ASP 137 N -0.74 0.89 -0.65 7.02 3.32 -1.99 -0.49 116.42 123.77 3kc2 h ASP 137 Ca -0.45 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 56.50 3kc2 h ASP 137 Cb 1.24 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 3kc2 h ASP 137 CO 0.61 0.62 0.07 -0.33 -1.72 0.00 0.00 179.24 178.49 3kc2 h GLU 138 N 1.03 1.10 -0.54 3.56 3.07 -2.02 -2.84 114.58 117.95 3kc2 h GLU 138 Ca 0.32 -0.32 -0.08 0.00 -0.50 0.00 0.00 59.36 58.78 3kc2 h GLU 138 Cb -0.00 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.77 3kc2 h GLU 138 CO -0.09 1.03 0.02 1.96 -1.40 0.00 0.00 179.01 180.53 3kc2 h GLN 139 N 1.02 0.94 -0.64 2.33 4.20 -1.68 -1.15 115.11 120.14 3kc2 h GLN 139 Ca 0.19 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.61 3kc2 h GLN 139 Cb 0.49 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.18 3kc2 h GLN 139 CO 0.02 0.95 0.00 0.28 -0.67 0.00 0.00 178.83 179.41 3kc2 n VAL 140 N -4.29 0.00 0.00 -0.54 0.31 -0.28 -0.48 118.33 113.05 3kc2 n VAL 140 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 3kc2 n VAL 140 Cb 0.32 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 33.10 3kc2 n VAL 140 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3kc2 n GLU 142 N 0.62 0.00 -0.08 5.55 2.13 -0.43 -1.77 120.64 126.65 3kc2 n GLU 142 Ca 0.00 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.68 3kc2 n GLU 142 Cb 0.00 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 31.57 3kc2 n GLU 142 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3kc2 n TYR 143 N 0.00 0.39 -2.92 4.31 4.01 0.37 -5.02 117.16 118.30 3kc2 n TYR 143 Ca 0.00 0.11 -0.19 0.00 -0.16 0.00 0.00 57.90 57.66 3kc2 n TYR 143 Cb 0.00 -1.06 0.02 0.00 -0.31 0.00 0.00 39.34 37.99 3kc2 n TYR 143 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3kc2 s SER 144 N -6.12 5.56 0.02 7.72 1.04 -0.73 -4.90 113.70 116.29 3kc2 s SER 144 Ca -0.17 -0.19 -0.00 0.00 0.48 0.00 0.00 55.95 56.06 3kc2 s SER 144 Cb 0.07 -0.86 -0.02 0.00 0.10 0.00 0.00 66.02 65.31 3kc2 s SER 144 CO 0.76 -0.86 -0.02 -0.13 0.98 0.00 0.00 173.24 173.96 3kc2 s ARG 145 N -4.50 0.35 0.09 4.02 1.81 -1.26 -5.01 118.95 114.46 3kc2 s ARG 145 Ca 0.54 -0.67 -0.31 0.00 -1.72 0.00 0.00 55.73 53.58 3kc2 s ARG 145 Cb -0.10 0.13 -0.07 0.00 -0.45 0.00 0.00 34.95 34.46 3kc2 s ARG 145 CO 0.35 -0.06 1.25 0.34 -0.68 0.00 0.00 175.30 176.50 3kc2 s ASP 146 N -1.62 7.01 -0.23 0.23 2.15 -1.26 -4.70 116.67 118.25 3kc2 s ASP 146 Ca -0.13 2.13 -0.00 0.00 0.43 0.00 0.00 52.55 54.97 3kc2 s ASP 146 Cb -0.08 -2.59 0.03 0.00 -0.30 0.00 0.00 42.92 39.99 3kc2 s ASP 146 CO -0.02 -0.50 -0.10 -0.63 -0.17 0.00 0.00 175.17 173.75 3kc2 s ILE 147 N 0.90 2.59 0.11 4.11 -1.09 -1.26 -5.08 121.20 121.48 3kc2 s ILE 147 Ca 0.59 -1.10 -0.35 0.00 -2.23 0.00 0.00 60.65 57.57 3kc2 s ILE 147 Cb -0.32 -2.30 -0.15 0.00 -1.58 0.00 0.00 42.46 38.11 3kc2 s ILE 147 CO 0.31 0.24 1.52 -2.65 -1.23 0.00 0.00 174.94 173.12 3kc2 n PRO 148 N 4.62 1.78 -2.59 2.79 -0.02 -1.26 -2.31 135.00 138.01 3kc2 n PRO 148 Ca -0.17 0.64 -0.20 0.00 -2.02 0.00 0.00 63.50 61.76 3kc2 n PRO 148 Cb 0.47 -2.37 0.01 0.00 -0.02 0.00 0.00 33.50 31.58 3kc2 n PRO 148 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3kc2 n ASP 149 N 3.34 -5.62 -0.33 2.55 8.00 -1.26 -4.88 116.55 118.36 3kc2 n ASP 149 Ca 0.18 -0.11 0.06 0.00 0.71 0.00 0.00 54.79 55.62 3kc2 n ASP 149 Cb 0.25 -4.58 0.21 0.00 -0.02 0.00 0.00 41.12 36.99 3kc2 n ASP 149 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3kc2 h LEU 150 N -0.50 0.82 -1.20 0.64 5.85 -1.80 -2.83 115.31 116.28 3kc2 h LEU 150 Ca -0.47 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3kc2 h LEU 150 Cb 1.34 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.26 3kc2 h LEU 150 CO 0.53 0.44 -0.19 0.35 -0.34 0.00 0.00 178.44 179.23 3kc2 n THR 151 N -4.68 0.00 -0.38 1.05 -2.24 -1.26 -4.38 114.28 102.39 3kc2 n THR 151 Ca 0.17 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3kc2 n THR 151 Cb 0.34 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.59 3kc2 n THR 151 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3kc2 n THR 152 N 0.35 0.45 -4.15 4.28 -2.24 -1.09 -4.77 114.28 107.10 3kc2 n THR 152 Ca 0.13 -0.53 -0.19 0.00 -2.27 0.00 0.00 64.05 61.19 3kc2 n THR 152 Cb 0.47 0.88 -0.16 0.00 -2.10 0.00 0.00 70.33 69.42 3kc2 n THR 152 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3kc2 s LYS 153 N -0.45 0.70 0.58 -0.78 2.20 -1.09 -5.07 119.74 115.83 3kc2 s LYS 153 Ca 0.00 -0.11 -0.18 0.00 -0.36 0.00 0.00 55.97 55.33 3kc2 s LYS 153 Cb 0.00 -0.72 -0.04 0.00 -1.51 0.00 0.00 37.83 35.56 3kc2 s LYS 153 CO 0.00 -0.04 1.10 -1.59 -0.36 0.00 0.00 175.35 174.46 3kc2 s LYS 154 N 0.71 3.24 0.16 4.03 -2.85 -1.26 -4.77 119.74 118.99 3kc2 s LYS 154 Ca -0.09 1.44 -0.25 0.00 -1.00 0.00 0.00 55.97 56.07 3kc2 s LYS 154 Cb -0.12 -2.00 -0.08 0.00 -2.06 0.00 0.00 37.83 33.57 3kc2 s LYS 154 CO -0.00 -0.91 0.76 -0.06 0.10 0.00 0.00 175.35 175.24 3kc2 s PHE 155 N -2.09 3.90 -0.08 1.78 0.08 -0.17 -4.67 117.98 116.74 3kc2 s PHE 155 Ca 0.69 1.61 0.20 0.00 0.12 0.00 0.00 56.93 59.54 3kc2 s PHE 155 Cb -0.21 -2.75 -0.30 0.00 -0.57 0.00 0.00 43.02 39.20 3kc2 s PHE 155 CO 0.32 0.52 0.35 -0.25 -0.10 0.00 0.00 175.22 176.06 3kc2 n ASP 156 N 1.62 0.21 -3.47 1.36 8.00 0.30 -4.43 116.55 120.14 3kc2 n ASP 156 Ca -0.06 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.34 3kc2 n ASP 156 Cb 0.49 1.68 -0.02 0.00 -0.02 0.00 0.00 41.12 43.24 3kc2 n ASP 156 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kc2 s ALA 157 N -3.17 -1.73 -0.21 2.24 0.00 -1.17 -4.14 121.76 113.57 3kc2 s ALA 157 Ca -0.08 0.83 -0.05 0.00 0.00 0.00 0.00 51.96 52.65 3kc2 s ALA 157 Cb 0.11 0.56 -0.02 0.00 0.00 0.00 0.00 23.12 23.77 3kc2 s ALA 157 CO 0.85 -0.70 0.00 0.08 0.00 0.00 0.00 175.76 176.00 3kc2 s VAL 158 N -3.24 3.91 -0.24 0.00 1.01 -0.05 -1.21 120.40 120.58 3kc2 s VAL 158 Ca 0.02 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.70 3kc2 s VAL 158 Cb -0.01 -2.78 0.05 0.00 0.00 0.00 0.00 36.38 33.63 3kc2 s VAL 158 CO -0.10 0.41 -0.13 -0.76 0.00 0.00 0.00 175.10 174.53 3kc2 s LEU 159 N 1.19 3.04 -0.39 3.92 1.02 -0.04 -0.81 118.68 126.61 3kc2 s LEU 159 Ca 0.03 -1.13 -0.23 0.00 0.02 0.00 0.00 54.13 52.82 3kc2 s LEU 159 Cb -0.14 -1.54 0.01 0.00 0.02 0.00 0.00 46.19 44.54 3kc2 s LEU 159 CO 0.01 -0.13 0.80 -0.69 0.02 0.00 0.00 176.35 176.37 3kc2 s VAL 160 N 1.18 4.69 -0.11 -1.59 1.01 -0.19 -1.03 120.40 124.36 3kc2 s VAL 160 Ca -0.04 0.82 -0.16 0.00 0.00 0.00 0.00 61.98 62.59 3kc2 s VAL 160 Cb -0.18 -4.25 -0.26 0.00 0.00 0.00 0.00 36.38 31.69 3kc2 s VAL 160 CO -0.07 -0.52 0.52 -0.26 0.00 0.00 0.00 175.10 174.77 3kc2 h PHE 161 N 8.61 0.39 -2.83 5.22 -1.00 -0.94 -3.18 116.94 123.21 3kc2 h PHE 161 Ca -0.25 -0.28 -0.07 0.00 2.81 0.00 0.00 57.97 60.18 3kc2 h PHE 161 Cb 1.09 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.63 3kc2 h PHE 161 CO 0.80 1.54 0.09 0.27 -1.61 0.00 0.00 178.31 179.40 3kc2 n ASN 162 N -3.97 -1.27 -4.67 2.17 6.94 -1.22 -4.25 115.26 109.00 3kc2 n ASN 162 Ca -0.25 -2.07 -0.43 0.00 -0.02 0.00 0.00 54.58 51.81 3kc2 n ASN 162 Cb 0.87 2.17 -0.02 0.00 -2.36 0.00 0.00 39.78 40.44 3kc2 n ASN 162 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3kc2 s ASP 163 N -2.33 6.91 0.86 0.53 1.01 -1.26 -4.11 116.67 118.29 3kc2 s ASP 163 Ca 0.13 1.84 -0.12 0.00 0.71 0.00 0.00 52.55 55.11 3kc2 s ASP 163 Cb -0.02 -2.54 0.11 0.00 1.01 0.00 0.00 42.92 41.47 3kc2 s ASP 163 CO 0.09 -0.75 1.15 -2.16 0.21 0.00 0.00 175.17 173.71 3kc2 s PRO 164 N 3.20 1.52 -0.31 8.23 0.04 -1.26 -3.92 135.00 142.51 3kc2 s PRO 164 Ca 0.59 0.26 0.07 0.00 0.04 0.00 0.00 61.00 61.95 3kc2 s PRO 164 Cb -0.25 -1.89 0.46 0.00 0.04 0.00 0.00 34.50 32.86 3kc2 s PRO 164 CO 0.20 -1.93 1.23 0.72 0.04 0.00 0.00 177.00 177.26 3kc2 n HIS 165 N -3.58 2.65 -2.78 0.56 8.25 -1.26 -4.75 115.22 114.31 3kc2 n HIS 165 Ca 0.07 -2.23 -0.10 0.00 -0.26 0.00 0.00 57.72 55.21 3kc2 n HIS 165 Cb 0.60 -0.39 0.07 0.00 1.12 0.00 0.00 29.99 31.38 3kc2 n HIS 165 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3kc2 n ASP 166 N -0.74 -2.25 0.22 0.41 2.03 -1.26 -5.00 116.55 109.97 3kc2 n ASP 166 Ca 0.44 -3.51 0.05 0.00 0.52 0.00 0.00 54.79 52.29 3kc2 n ASP 166 Cb 0.94 1.67 0.51 0.00 -0.72 0.00 0.00 41.12 43.53 3kc2 n ASP 166 CO 0.00 0.00 0.00 -0.50 -1.92 0.00 0.00 177.20 174.78 3kc2 h TRP 167 N 3.34 0.00 -0.90 -0.67 4.06 -1.93 -0.50 115.95 119.35 3kc2 h TRP 167 Ca -0.10 -0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.87 3kc2 h TRP 167 Cb 1.06 -0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 29.18 3kc2 h TRP 167 CO 0.24 0.17 0.60 0.00 -3.56 0.00 0.00 178.44 175.89 3kc2 h ALA 168 N 1.83 1.37 -0.02 1.49 0.00 -1.97 -0.03 119.26 121.93 3kc2 h ALA 168 Ca -0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3kc2 h ALA 168 Cb 0.30 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3kc2 h ALA 168 CO 0.02 0.58 -0.11 0.00 0.00 0.00 0.00 179.25 179.73 3kc2 h ALA 169 N 1.45 0.05 -0.28 0.00 0.00 -1.37 -2.80 119.26 116.30 3kc2 h ALA 169 Ca 0.33 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 54.90 3kc2 h ALA 169 Cb -0.12 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3kc2 h ALA 169 CO -0.08 -0.04 0.11 -0.44 0.00 0.00 0.00 179.25 178.80 3kc2 h ASP 170 N -0.48 0.14 -0.28 0.00 3.32 -1.08 0.44 116.42 118.49 3kc2 h ASP 170 Ca -0.01 0.02 -0.08 0.00 0.02 0.00 0.00 57.03 56.98 3kc2 h ASP 170 Cb 0.77 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 3kc2 h ASP 170 CO 0.02 0.11 -0.15 0.40 -1.72 0.00 0.00 179.24 177.90 3kc2 h ILE 171 N 0.24 1.30 -0.45 0.35 2.04 -1.13 -0.21 117.51 119.65 3kc2 h ILE 171 Ca 0.12 -1.26 0.06 0.00 1.00 0.00 0.00 64.86 64.78 3kc2 h ILE 171 Cb 0.07 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.62 3kc2 h ILE 171 CO -0.11 0.40 0.14 -0.61 0.00 0.00 0.00 178.15 177.97 3kc2 h GLN 172 N 0.33 0.29 -0.32 2.37 5.75 -1.26 -0.24 115.11 122.04 3kc2 h GLN 172 Ca 0.06 -0.02 -0.13 0.00 -0.15 0.00 0.00 58.65 58.41 3kc2 h GLN 172 Cb 0.68 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.15 3kc2 h GLN 172 CO 0.04 0.19 -0.31 0.82 -2.65 0.00 0.00 178.83 176.93 3kc2 h ILE 173 N 0.30 1.29 -0.31 2.39 2.04 -0.78 -0.12 117.51 122.32 3kc2 h ILE 173 Ca 0.22 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.60 3kc2 h ILE 173 Cb 0.23 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3kc2 h ILE 173 CO -0.24 0.48 0.20 0.40 0.00 0.00 0.00 178.15 178.99 3kc2 h ILE 174 N 0.53 1.09 -0.69 -0.67 2.04 -0.94 -2.05 117.51 116.82 3kc2 h ILE 174 Ca 0.05 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.77 3kc2 h ILE 174 Cb 0.88 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 3kc2 h ILE 174 CO 0.08 0.09 0.41 -1.28 0.00 0.00 0.00 178.15 177.45 3kc2 h SER 175 N 0.41 0.64 -0.51 1.72 0.87 -0.82 -1.29 113.55 114.57 3kc2 h SER 175 Ca 0.11 0.02 0.07 0.00 -1.23 0.00 0.00 61.79 60.76 3kc2 h SER 175 Cb -0.02 -0.11 -0.06 0.00 -0.44 0.00 0.00 62.40 61.76 3kc2 h SER 175 CO -0.02 0.42 0.20 0.44 -0.53 0.00 0.00 176.83 177.34 3kc2 h ASP 176 N 0.77 0.22 -0.47 6.23 3.32 -0.79 -1.97 116.42 123.74 3kc2 h ASP 176 Ca 0.30 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.36 3kc2 h ASP 176 Cb 0.12 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 3kc2 h ASP 176 CO -0.15 0.15 0.13 0.00 -1.72 0.00 0.00 179.24 177.65 3kc2 h ALA 177 N 1.33 0.61 -0.00 3.45 0.00 -0.61 -1.37 119.26 122.67 3kc2 h ALA 177 Ca 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3kc2 h ALA 177 Cb 0.25 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3kc2 h ALA 177 CO -0.24 0.28 -0.10 0.44 0.00 0.00 0.00 179.25 179.64 3kc2 n ILE 178 N -4.52 0.00 -0.07 0.00 -5.35 -0.57 -2.69 119.36 106.16 3kc2 n ILE 178 Ca 0.01 -0.03 0.03 0.00 -0.27 0.00 0.00 62.75 62.49 3kc2 n ILE 178 Cb 0.20 -0.25 0.08 0.00 -1.74 0.00 0.00 39.64 37.93 3kc2 n ILE 178 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3kc2 n ASN 179 N -1.20 2.45 -4.44 7.28 4.13 -0.76 -0.77 115.26 121.94 3kc2 n ASN 179 Ca 0.12 -1.95 -0.29 0.00 1.68 0.00 0.00 54.58 54.14 3kc2 n ASN 179 Cb 0.28 -0.12 0.17 0.00 -1.54 0.00 0.00 39.78 38.57 3kc2 n ASN 179 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 3kc2 s SER 180 N -0.97 2.87 -0.80 6.41 1.04 -0.53 -0.96 113.70 120.76 3kc2 s SER 180 Ca 0.13 0.75 -0.23 0.00 0.48 0.00 0.00 55.95 57.07 3kc2 s SER 180 Cb 0.07 -1.14 0.07 0.00 0.10 0.00 0.00 66.02 65.11 3kc2 s SER 180 CO 0.09 -2.93 1.18 -0.70 0.98 0.00 0.00 173.24 171.85 3kc2 s GLU 181 N -5.43 3.31 -1.63 4.02 2.56 -1.26 -3.85 118.70 116.43 3kc2 s GLU 181 Ca 0.67 -0.88 -0.11 0.00 0.00 0.00 0.00 54.97 54.65 3kc2 s GLU 181 Cb -0.11 -4.55 0.10 0.00 2.00 0.00 0.00 34.13 31.56 3kc2 s GLU 181 CO 0.54 -1.98 0.51 -1.71 -0.56 0.00 0.00 175.26 172.06 3kc2 n ASN 182 N 8.20 -1.46 -1.12 -1.70 5.15 -1.26 -4.90 115.26 118.18 3kc2 n ASN 182 Ca 0.10 -1.10 0.00 0.00 -0.60 0.00 0.00 54.58 52.98 3kc2 n ASN 182 Cb 0.48 -2.43 0.00 0.00 -0.53 0.00 0.00 39.78 37.30 3kc2 n ASN 182 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3kc2 n GLY 183 N -1.73 -2.16 3.46 8.20 0.00 -1.26 -4.63 105.19 107.07 3kc2 n GLY 183 Ca -0.10 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 3kc2 n GLY 183 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kc2 s LEU 185 N 0.00 2.60 -0.86 0.99 2.96 -1.26 -1.00 118.68 122.11 3kc2 s LEU 185 Ca 0.00 -0.63 0.00 0.00 -0.22 0.00 0.00 54.13 53.28 3kc2 s LEU 185 Cb 0.00 -1.44 0.00 0.00 0.50 0.00 0.00 46.19 45.25 3kc2 s LEU 185 CO 0.00 0.17 0.00 0.59 -1.32 0.00 0.00 176.35 175.79 3kc2 n ASN 186 N 0.74 -3.79 -4.32 3.68 3.02 -1.26 -5.01 115.26 108.31 3kc2 n ASN 186 Ca -0.16 0.16 -0.17 0.00 -0.03 0.00 0.00 54.58 54.39 3kc2 n ASN 186 Cb 0.53 -2.29 -0.10 0.00 -0.61 0.00 0.00 39.78 37.31 3kc2 n ASN 186 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3kc2 s THR 187 N -2.34 1.22 -0.07 3.41 -4.23 -1.26 -5.08 115.64 107.28 3kc2 s THR 187 Ca 0.00 -2.07 -0.03 0.00 -1.18 0.00 0.00 61.69 58.41 3kc2 s THR 187 Cb 0.00 -2.16 0.04 0.00 1.34 0.00 0.00 72.50 71.72 3kc2 s THR 187 CO 0.00 -0.49 0.14 -0.22 -0.54 0.00 0.00 174.62 173.52 3kc2 s LEU 188 N -3.28 0.19 0.70 4.79 2.96 -1.26 -4.18 118.68 118.61 3kc2 s LEU 188 Ca 0.24 0.30 -0.13 0.00 -0.22 0.00 0.00 54.13 54.32 3kc2 s LEU 188 Cb 0.04 0.26 0.02 0.00 0.50 0.00 0.00 46.19 47.00 3kc2 s LEU 188 CO 0.06 -0.22 1.09 0.00 -1.32 0.00 0.00 176.35 175.97 3kc2 s ARG 189 N 1.94 2.64 0.06 1.98 1.70 -0.13 -4.62 118.95 122.52 3kc2 s ARG 189 Ca -0.00 1.22 0.03 0.00 -0.47 0.00 0.00 55.73 56.51 3kc2 s ARG 189 Cb -0.12 -1.94 -0.24 0.00 -0.57 0.00 0.00 34.95 32.07 3kc2 s ARG 189 CO -0.05 -1.35 1.08 -0.91 -1.08 0.00 0.00 175.30 172.98 3kc2 h ASN 190 N -0.51 0.19 -3.48 -2.89 2.35 -1.93 -3.47 115.58 105.84 3kc2 h ASN 190 Ca -0.45 -0.23 -0.51 0.00 -0.55 0.00 0.00 56.30 54.57 3kc2 h ASN 190 Cb 1.23 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 39.54 3kc2 h ASN 190 CO 0.54 1.18 -0.00 -1.83 -1.65 0.00 0.00 177.43 175.66 3kc2 s GLU 191 N -2.66 3.73 -0.11 0.81 1.03 -1.26 -5.07 118.70 115.17 3kc2 s GLU 191 Ca -0.03 0.27 -0.03 0.00 0.03 0.00 0.00 54.97 55.21 3kc2 s GLU 191 Cb 0.08 -2.51 -0.03 0.00 -0.80 0.00 0.00 34.13 30.86 3kc2 s GLU 191 CO 0.84 0.10 0.03 0.15 -1.33 0.00 0.00 175.26 175.05 3kc2 s LYS 192 N -3.62 3.20 0.14 -4.83 1.02 -1.26 -5.08 119.74 109.31 3kc2 s LYS 192 Ca 0.48 -0.37 -0.24 0.00 0.02 0.00 0.00 55.97 55.87 3kc2 s LYS 192 Cb -0.11 -2.90 0.07 0.00 -0.52 0.00 0.00 37.83 34.37 3kc2 s LYS 192 CO 0.29 0.64 0.62 0.45 -0.92 0.00 0.00 175.35 176.43 3kc2 s SER 193 N -0.69 -0.57 0.51 2.83 0.15 -1.26 -5.00 113.70 109.66 3kc2 s SER 193 Ca 0.11 0.06 0.30 0.00 0.70 0.00 0.00 55.95 57.12 3kc2 s SER 193 Cb -0.12 0.59 1.08 0.00 -1.71 0.00 0.00 66.02 65.86 3kc2 s SER 193 CO 0.02 -0.93 1.88 1.23 1.20 0.00 0.00 173.24 176.65 3kc2 h GLY 194 N 2.08 0.00 -6.22 9.45 0.00 -1.84 -3.44 103.07 103.11 3kc2 h GLY 194 Ca -0.33 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.40 3kc2 h GLY 194 CO 0.38 0.00 0.28 1.25 0.00 0.00 0.00 176.54 178.45 3kc2 s LYS 195 N -3.56 4.12 0.73 4.80 2.20 -1.26 -0.84 119.74 125.94 3kc2 s LYS 195 Ca 0.02 0.68 -0.11 0.00 -0.36 0.00 0.00 55.97 56.20 3kc2 s LYS 195 Cb 0.08 -3.65 0.04 0.00 -1.51 0.00 0.00 37.83 32.78 3kc2 s LYS 195 CO 0.58 -0.47 1.09 -1.25 -0.36 0.00 0.00 175.35 174.94 3kc2 s PRO 196 N 2.64 2.51 0.33 4.03 0.04 -1.26 -4.92 135.00 138.36 3kc2 s PRO 196 Ca 0.29 1.16 0.02 0.00 0.04 0.00 0.00 61.00 62.52 3kc2 s PRO 196 Cb -0.15 -1.93 0.61 0.00 0.04 0.00 0.00 34.50 33.07 3kc2 s PRO 196 CO 0.08 -1.45 1.95 0.77 0.04 0.00 0.00 177.00 178.39 3kc2 h SER 197 N -0.82 0.80 -4.42 6.66 0.02 -1.20 -3.41 113.55 111.19 3kc2 h SER 197 Ca -0.44 -0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.21 3kc2 h SER 197 Cb 1.23 -0.18 -0.17 0.00 0.14 0.00 0.00 62.40 63.42 3kc2 h SER 197 CO 0.53 0.54 -0.72 0.27 -1.14 0.00 0.00 176.83 176.30 3kc2 s ILE 198 N -5.80 0.87 0.55 3.27 -4.36 -1.26 -4.55 121.20 109.91 3kc2 s ILE 198 Ca -0.11 -1.71 -0.21 0.00 -0.26 0.00 0.00 60.65 58.36 3kc2 s ILE 198 Cb 0.19 -1.43 -0.05 0.00 1.25 0.00 0.00 42.46 42.42 3kc2 s ILE 198 CO 0.78 -0.64 1.29 -2.16 0.24 0.00 0.00 174.94 174.45 3kc2 s PRO 199 N -3.05 3.18 -0.05 0.37 0.04 -1.26 -4.80 135.00 129.43 3kc2 s PRO 199 Ca 0.07 2.06 0.03 0.00 0.04 0.00 0.00 61.00 63.20 3kc2 s PRO 199 Cb -0.01 -2.20 0.01 0.00 0.04 0.00 0.00 34.50 32.34 3kc2 s PRO 199 CO -0.01 -1.11 -0.13 -1.50 0.04 0.00 0.00 177.00 174.29 3kc2 s ILE 200 N -1.40 1.17 -0.07 0.56 2.07 -1.26 -0.87 121.20 121.40 3kc2 s ILE 200 Ca 0.72 -0.54 0.05 0.00 -1.41 0.00 0.00 60.65 59.47 3kc2 s ILE 200 Cb -0.36 -1.04 -0.01 0.00 0.13 0.00 0.00 42.46 41.17 3kc2 s ILE 200 CO 0.42 0.36 -0.21 -0.31 -1.91 0.00 0.00 174.94 173.28 3kc2 s TYR 201 N 0.37 2.55 -0.07 3.50 2.02 0.01 -1.28 117.35 124.46 3kc2 s TYR 201 Ca -0.09 -0.63 0.02 0.00 -0.37 0.00 0.00 57.07 56.00 3kc2 s TYR 201 Cb -0.13 -1.65 -0.03 0.00 -0.40 0.00 0.00 41.96 39.75 3kc2 s TYR 201 CO 0.03 -0.15 -0.10 -0.06 -1.57 0.00 0.00 175.55 173.69 3kc2 s PHE 202 N -0.16 2.83 -2.71 2.71 0.08 -0.21 -1.02 117.98 119.49 3kc2 s PHE 202 Ca -0.03 -0.12 0.24 0.00 0.12 0.00 0.00 56.93 57.15 3kc2 s PHE 202 Cb -0.14 -1.69 0.20 0.00 -0.57 0.00 0.00 43.02 40.82 3kc2 s PHE 202 CO 0.04 0.22 1.25 -1.13 -0.10 0.00 0.00 175.22 175.49 3kc2 n SER 203 N 2.40 2.64 -3.63 1.36 3.41 -1.20 -0.74 113.62 117.86 3kc2 n SER 203 Ca -0.18 -1.83 -0.03 0.00 -0.26 0.00 0.00 58.87 56.57 3kc2 n SER 203 Cb 0.53 0.12 -0.05 0.00 -0.26 0.00 0.00 64.21 64.54 3kc2 n SER 203 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3kc2 s ASN 204 N -2.13 -0.99 -0.27 4.04 2.47 -1.18 -2.87 114.94 114.01 3kc2 s ASN 204 Ca 0.26 1.45 0.12 0.00 0.42 0.00 0.00 52.86 55.12 3kc2 s ASN 204 Cb 0.20 1.83 0.71 0.00 -1.45 0.00 0.00 41.25 42.54 3kc2 s ASN 204 CO 0.37 -0.21 1.69 0.00 -3.72 0.00 0.00 177.10 175.23 3kc2 n GLN 205 N 4.86 3.74 -1.99 0.43 6.02 -1.26 -3.02 117.38 126.16 3kc2 n GLN 205 Ca -0.15 -3.07 -0.43 0.00 -0.01 0.00 0.00 57.00 53.34 3kc2 n GLN 205 Cb 0.54 -2.13 -0.03 0.00 1.02 0.00 0.00 30.24 29.64 3kc2 n GLN 205 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3kc2 s ASP 206 N -1.28 6.24 0.18 1.08 1.11 -1.26 -4.13 116.67 118.61 3kc2 s ASP 206 Ca 0.52 1.75 -0.10 0.00 0.18 0.00 0.00 52.55 54.90 3kc2 s ASP 206 Cb 0.41 -2.53 0.07 0.00 1.07 0.00 0.00 42.92 41.94 3kc2 s ASP 206 CO 0.12 -1.35 1.67 0.25 1.18 0.00 0.00 175.17 177.04 3kc2 h LEU 207 N 12.12 0.97 -8.60 1.23 5.85 -1.87 0.68 115.31 125.68 3kc2 h LEU 207 Ca -0.36 -0.26 -0.40 0.00 0.84 0.00 0.00 57.88 57.69 3kc2 h LEU 207 Cb 1.17 -0.26 -0.18 0.00 0.37 0.00 0.00 40.66 41.77 3kc2 h LEU 207 CO 0.99 0.98 -0.75 -0.76 -0.34 0.00 0.00 178.44 178.56 3kc2 s LEU 208 N -9.49 2.41 0.21 2.25 1.43 -1.26 -1.23 118.68 113.01 3kc2 s LEU 208 Ca -0.12 -0.83 -0.13 0.00 -1.03 0.00 0.00 54.13 52.02 3kc2 s LEU 208 Cb 0.13 -0.52 0.00 0.00 0.03 0.00 0.00 46.19 45.83 3kc2 s LEU 208 CO 0.83 -0.16 0.42 -1.66 0.23 0.00 0.00 176.35 176.01 3kc2 s TRP 209 N -2.25 0.26 -0.27 0.29 1.48 0.33 -4.76 118.94 114.02 3kc2 s TRP 209 Ca 0.09 -0.62 -0.05 0.00 -1.06 0.00 0.00 56.10 54.46 3kc2 s TRP 209 Cb -0.04 0.15 0.01 0.00 -1.16 0.00 0.00 33.47 32.42 3kc2 s TRP 209 CO 0.03 -0.88 0.03 0.00 -4.06 0.00 0.00 176.95 172.08 3kc2 s ALA 210 N -3.97 2.97 0.00 2.67 0.00 -1.26 -1.45 121.76 120.72 3kc2 s ALA 210 Ca 0.17 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.76 3kc2 s ALA 210 Cb 0.01 -1.99 0.00 0.00 0.00 0.00 0.00 23.12 21.13 3kc2 s ALA 210 CO 0.03 -0.79 0.00 0.27 0.00 0.00 0.00 175.76 175.27 3kc2 n ASN 211 N 4.83 1.38 0.30 0.00 6.94 -1.26 -3.96 115.26 123.48 3kc2 n ASN 211 Ca -0.16 -0.43 0.18 0.00 -0.02 0.00 0.00 54.58 54.15 3kc2 n ASN 211 Cb 0.49 0.00 0.90 0.00 -2.36 0.00 0.00 39.78 38.80 3kc2 n ASN 211 CO 0.00 0.00 0.00 -0.65 -1.03 0.00 0.00 177.26 175.58 3kc2 h PRO 212 N 0.00 0.00 -7.02 -0.53 0.11 -1.96 -3.43 132.00 119.17 3kc2 h PRO 212 Ca 0.00 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.63 3kc2 h PRO 212 Cb 0.00 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.14 3kc2 h PRO 212 CO 0.00 0.03 0.41 -0.47 -0.21 0.00 0.00 178.00 177.76 3kc2 s TYR 213 N -3.98 3.05 0.08 0.65 5.04 -1.26 -4.95 117.35 115.98 3kc2 s TYR 213 Ca -0.02 1.59 0.28 0.00 -2.44 0.00 0.00 57.07 56.48 3kc2 s TYR 213 Cb 0.12 -3.15 1.07 0.00 0.35 0.00 0.00 41.96 40.34 3kc2 s TYR 213 CO 0.51 -0.90 1.88 1.57 -1.34 0.00 0.00 175.55 177.26 3kc2 h LYS 214 N 1.94 0.00 -5.70 4.97 2.10 -2.03 -3.43 116.57 114.42 3kc2 h LYS 214 Ca -0.49 0.00 -0.64 0.00 -2.00 0.00 0.00 60.65 57.52 3kc2 h LYS 214 Cb 1.23 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.48 3kc2 h LYS 214 CO 0.60 0.11 -0.39 -0.51 -2.00 0.00 0.00 179.45 177.26 3kc2 s LEU 215 N -6.48 4.39 0.35 7.07 1.43 -1.26 -5.06 118.68 119.12 3kc2 s LEU 215 Ca 0.01 0.59 -0.28 0.00 -1.03 0.00 0.00 54.13 53.42 3kc2 s LEU 215 Cb 0.09 -2.23 -0.12 0.00 0.03 0.00 0.00 46.19 43.96 3kc2 s LEU 215 CO 0.60 0.35 1.42 0.59 0.23 0.00 0.00 176.35 179.54 3kc2 n ASN 216 N 2.16 3.39 -4.65 2.29 3.02 -1.26 -4.85 115.26 115.36 3kc2 n ASN 216 Ca -0.18 1.21 -0.30 0.00 -0.03 0.00 0.00 54.58 55.29 3kc2 n ASN 216 Cb 0.54 -1.56 -0.09 0.00 -0.61 0.00 0.00 39.78 38.06 3kc2 n ASN 216 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3kc2 s ARG 217 N -1.86 2.39 0.39 3.52 1.81 -0.53 -4.88 118.95 119.78 3kc2 s ARG 217 Ca 0.55 -0.93 -0.27 0.00 -1.72 0.00 0.00 55.73 53.36 3kc2 s ARG 217 Cb -0.52 -2.44 -0.10 0.00 -0.45 0.00 0.00 34.95 31.44 3kc2 s ARG 217 CO 0.62 0.52 1.41 -0.06 -0.68 0.00 0.00 175.30 177.11 3kc2 s PHE 218 N -1.32 2.66 0.00 -0.53 0.08 -1.26 -0.51 117.98 117.10 3kc2 s PHE 218 Ca 0.24 1.27 0.00 0.00 0.12 0.00 0.00 56.93 58.56 3kc2 s PHE 218 Cb -0.11 -3.89 0.00 0.00 -0.57 0.00 0.00 43.02 38.45 3kc2 s PHE 218 CO 0.17 -2.66 0.00 0.41 -0.10 0.00 0.00 175.22 173.04 3kc2 n GLY 219 N 0.58 6.13 0.24 4.36 0.00 -0.36 -4.77 105.19 111.36 3kc2 n GLY 219 Ca 0.02 -2.09 0.09 0.00 0.00 0.00 0.00 46.02 44.04 3kc2 n GLY 219 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3kc2 h GLN 220 N 0.00 0.00 -0.94 1.61 4.15 -1.78 -0.54 115.11 117.60 3kc2 h GLN 220 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.48 3kc2 h GLN 220 Cb 0.00 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.63 3kc2 h GLN 220 CO 0.00 0.16 0.60 0.78 -1.93 0.00 0.00 178.83 178.44 3kc2 h GLY 221 N 0.68 1.43 0.86 2.39 0.00 -0.77 0.14 103.07 107.80 3kc2 h GLY 221 Ca -0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 3kc2 h GLY 221 CO 0.02 0.31 0.05 0.00 0.00 0.00 0.00 176.54 176.92 3kc2 h ALA 222 N 1.43 0.19 -0.52 3.60 0.00 -1.15 -1.35 119.26 121.47 3kc2 h ALA 222 Ca 0.41 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.30 3kc2 h ALA 222 Cb 0.16 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.82 3kc2 h ALA 222 CO -0.17 -0.20 0.04 0.35 0.00 0.00 0.00 179.25 179.26 3kc2 h PHE 223 N 0.06 0.04 -0.39 0.00 3.57 -1.13 -1.67 116.94 117.41 3kc2 h PHE 223 Ca 0.05 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.63 3kc2 h PHE 223 Cb 0.21 0.06 -0.05 0.00 2.79 0.00 0.00 35.95 38.97 3kc2 h PHE 223 CO -0.00 -0.09 0.11 -0.09 -2.23 0.00 0.00 178.31 176.01 3kc2 h ARG 224 N 0.16 0.25 -0.62 1.11 2.43 -0.60 -1.33 114.38 115.78 3kc2 h ARG 224 Ca 0.26 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.49 3kc2 h ARG 224 Cb 0.39 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 3kc2 h ARG 224 CO -0.40 0.17 0.41 -0.07 -1.51 0.00 0.00 179.97 178.56 3kc2 h LEU 225 N 0.26 0.51 -0.08 3.80 3.38 -0.56 -0.27 115.31 122.35 3kc2 h LEU 225 Ca 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 3kc2 h LEU 225 Cb 0.19 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3kc2 h LEU 225 CO -0.21 0.33 -0.06 -0.07 0.09 0.00 0.00 178.44 178.52 3kc2 h LEU 226 N 0.58 0.18 -0.41 1.67 3.38 -0.50 -0.18 115.31 120.03 3kc2 h LEU 226 Ca 0.27 -0.46 0.07 0.00 0.09 0.00 0.00 57.88 57.85 3kc2 h LEU 226 Cb 0.32 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 3kc2 h LEU 226 CO -0.08 0.61 0.07 0.58 0.09 0.00 0.00 178.44 179.71 3kc2 h VAL 227 N -0.23 0.78 -0.89 1.22 2.07 -1.05 -2.36 116.25 115.79 3kc2 h VAL 227 Ca 0.01 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 3kc2 h VAL 227 Cb 0.55 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 3kc2 h VAL 227 CO 0.02 0.04 0.52 0.03 0.02 0.00 0.00 177.57 178.19 3kc2 h ARG 228 N 0.20 1.22 -0.57 1.57 3.08 -0.98 -1.27 114.38 117.63 3kc2 h ARG 228 Ca 0.20 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 3kc2 h ARG 228 Cb 0.25 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3kc2 h ARG 228 CO -0.27 0.86 0.26 -0.09 -1.07 0.00 0.00 179.97 179.66 3kc2 h ARG 229 N 1.23 0.83 0.00 0.04 9.65 -0.53 -0.76 114.38 124.85 3kc2 h ARG 229 Ca 0.32 -0.13 -0.15 0.00 -1.10 0.00 0.00 59.98 58.91 3kc2 h ARG 229 Cb -0.03 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.38 3kc2 h ARG 229 CO -0.06 0.69 -0.72 -0.07 2.80 0.00 0.00 179.97 182.62 3kc2 h LEU 230 N 0.77 0.00 -0.26 3.80 3.38 -1.18 -1.36 115.31 120.47 3kc2 h LEU 230 Ca 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 3kc2 h LEU 230 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3kc2 h LEU 230 CO -0.02 0.72 0.11 0.22 0.09 0.00 0.00 178.44 179.56 3kc2 h TYR 231 N 0.00 0.39 -0.76 1.13 3.20 -1.01 -2.03 116.97 117.88 3kc2 h TYR 231 Ca -0.01 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.87 3kc2 h TYR 231 Cb 1.38 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 39.49 3kc2 h TYR 231 CO 0.00 0.39 0.48 1.25 -1.64 0.00 0.00 178.16 178.64 3kc2 h LEU 232 N 0.27 0.78 -0.74 2.82 5.85 -1.02 -0.63 115.31 122.64 3kc2 h LEU 232 Ca 0.09 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3kc2 h LEU 232 Cb 0.16 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 3kc2 h LEU 232 CO -0.01 0.53 0.44 -0.08 -0.34 0.00 0.00 178.44 178.98 3kc2 h GLU 233 N 0.92 1.01 0.00 1.25 4.57 -0.98 0.16 114.58 121.50 3kc2 h GLU 233 Ca 0.31 -0.10 -0.15 0.00 -1.18 0.00 0.00 59.36 58.25 3kc2 h GLU 233 Cb 0.05 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.41 3kc2 h GLU 233 CO -0.12 0.72 -0.71 -0.07 -1.18 0.00 0.00 179.01 177.65 3kc2 h LEU 234 N 1.01 0.00 0.00 1.64 3.38 -1.05 -3.39 115.31 116.90 3kc2 h LEU 234 Ca 0.26 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.17 3kc2 h LEU 234 Cb -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3kc2 h LEU 234 CO -0.05 0.71 -1.60 0.59 0.09 0.00 0.00 178.44 178.18 3kc2 n ASN 235 N -3.48 2.31 -0.14 -0.43 3.02 -0.27 -4.97 115.26 111.30 3kc2 n ASN 235 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.53 3kc2 n ASN 235 Cb 0.75 1.30 -0.01 0.00 -0.61 0.00 0.00 39.78 41.21 3kc2 n ASN 235 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kc2 n GLY 236 N 1.99 0.43 3.03 7.41 0.00 0.53 -4.31 105.19 114.27 3kc2 n GLY 236 Ca -0.07 -0.11 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 3kc2 n GLY 236 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kc2 s GLU 237 N -1.29 0.48 0.52 1.61 0.41 -1.26 -5.05 118.70 114.12 3kc2 s GLU 237 Ca 0.00 -0.64 -0.21 0.00 -0.41 0.00 0.00 54.97 53.71 3kc2 s GLU 237 Cb 0.00 -0.27 -0.06 0.00 -1.78 0.00 0.00 34.13 32.02 3kc2 s GLU 237 CO 0.00 0.05 1.16 -1.25 -0.49 0.00 0.00 175.26 174.74 3kc2 s PRO 238 N -1.30 3.44 0.14 0.39 0.04 -1.26 -4.13 135.00 132.32 3kc2 s PRO 238 Ca -0.08 1.73 -0.31 0.00 0.04 0.00 0.00 61.00 62.38 3kc2 s PRO 238 Cb -0.09 -2.16 -0.09 0.00 0.04 0.00 0.00 34.50 32.21 3kc2 s PRO 238 CO 0.00 -0.80 1.46 -1.17 0.04 0.00 0.00 177.00 176.53 3kc2 s LEU 239 N -3.53 4.37 -0.84 -3.56 2.96 -1.26 -4.51 118.68 112.31 3kc2 s LEU 239 Ca 0.70 2.45 -0.22 0.00 -0.22 0.00 0.00 54.13 56.84 3kc2 s LEU 239 Cb -0.27 -3.59 0.08 0.00 0.50 0.00 0.00 46.19 42.91 3kc2 s LEU 239 CO 0.32 -0.72 1.16 -1.10 -1.32 0.00 0.00 176.35 174.68 3kc2 s GLN 240 N 1.07 3.39 0.41 1.98 -0.21 -0.02 -5.01 119.66 121.28 3kc2 s GLN 240 Ca 0.67 -1.16 0.07 0.00 0.02 0.00 0.00 55.36 54.96 3kc2 s GLN 240 Cb -0.40 -4.70 -0.04 0.00 1.00 0.00 0.00 33.01 28.87 3kc2 s GLN 240 CO 0.31 -1.92 0.27 0.16 -2.12 0.00 0.00 175.29 171.99 3kc2 s ASP 241 N 3.94 4.71 -0.12 5.90 1.47 -1.26 -4.53 116.67 126.78 3kc2 s ASP 241 Ca 0.32 -0.92 -0.03 0.00 1.18 0.00 0.00 52.55 53.10 3kc2 s ASP 241 Cb -0.08 -0.53 -0.03 0.00 -0.34 0.00 0.00 42.92 41.94 3kc2 s ASP 241 CO -0.01 -0.59 -0.02 -0.31 0.68 0.00 0.00 175.17 174.93 3kc2 s TYR 242 N -2.54 3.09 -0.06 2.11 2.02 -0.40 -5.03 117.35 116.53 3kc2 s TYR 242 Ca 0.44 -0.02 0.02 0.00 -0.37 0.00 0.00 57.07 57.14 3kc2 s TYR 242 Cb 0.01 -1.87 0.01 0.00 -0.40 0.00 0.00 41.96 39.71 3kc2 s TYR 242 CO 0.25 0.23 -0.12 0.95 -1.57 0.00 0.00 175.55 175.29 3kc2 s THR 243 N -0.28 1.10 0.00 -0.71 -4.23 -1.26 -1.05 115.64 109.21 3kc2 s THR 243 Ca 0.06 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.11 3kc2 s THR 243 Cb -0.12 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.71 3kc2 s THR 243 CO 0.02 0.35 0.00 0.00 -0.54 0.00 0.00 174.62 174.45 3kc2 n LEU 244 N 3.82 0.00 0.00 4.79 -0.00 0.08 -4.97 117.00 120.72 3kc2 n LEU 244 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.78 3kc2 n LEU 244 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 3kc2 n LEU 244 CO 0.25 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.25 3kc2 n GLY 245 N 4.38 0.39 3.73 1.47 0.00 -1.14 -3.12 105.19 110.90 3kc2 n GLY 245 Ca 0.00 -1.76 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 3kc2 n GLY 245 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kc2 n LYS 246 N 0.50 2.32 -0.75 1.61 5.02 -1.26 -0.55 118.16 125.05 3kc2 n LYS 246 Ca 0.00 0.82 0.07 0.00 -2.02 0.00 0.00 58.31 57.17 3kc2 n LYS 246 Cb 0.00 -2.46 0.35 0.00 -0.02 0.00 0.00 35.03 32.90 3kc2 n LYS 246 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3kc2 n PRO 247 N 0.47 4.26 -2.22 1.97 -0.04 -1.26 -4.45 135.00 133.73 3kc2 n PRO 247 Ca 0.03 -2.75 -0.38 0.00 -0.04 0.00 0.00 63.50 60.37 3kc2 n PRO 247 Cb 0.37 -2.11 -0.01 0.00 -0.04 0.00 0.00 33.50 31.71 3kc2 n PRO 247 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3kc2 s THR 248 N -2.41 3.01 0.32 0.52 -4.23 0.29 -4.46 115.64 108.67 3kc2 s THR 248 Ca 0.48 0.80 0.03 0.00 -1.18 0.00 0.00 61.69 61.82 3kc2 s THR 248 Cb 0.35 -3.43 0.29 0.00 1.34 0.00 0.00 72.50 71.05 3kc2 s THR 248 CO 0.16 0.03 1.92 0.50 -0.54 0.00 0.00 174.62 176.69 3kc2 h LYS 249 N 2.28 0.91 -0.33 3.99 3.64 -1.94 -1.95 116.57 123.15 3kc2 h LYS 249 Ca -0.49 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 58.88 3kc2 h LYS 249 Cb 1.25 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 32.82 3kc2 h LYS 249 CO 0.61 0.60 0.06 1.25 -2.27 0.00 0.00 179.45 179.70 3kc2 h LEU 250 N 0.94 -0.01 -0.38 5.20 6.46 -1.91 0.53 115.31 126.13 3kc2 h LEU 250 Ca 0.37 0.06 -0.11 0.00 -0.12 0.00 0.00 57.88 58.08 3kc2 h LEU 250 Cb 0.24 0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.24 3kc2 h LEU 250 CO -0.14 0.03 -0.19 0.74 -0.62 0.00 0.00 178.44 178.27 3kc2 h THR 251 N 0.17 1.28 -0.79 1.05 2.02 -1.71 -0.86 112.91 114.07 3kc2 h THR 251 Ca 0.16 -1.32 -0.03 0.00 0.77 0.00 0.00 66.41 65.99 3kc2 h THR 251 Cb 0.18 1.33 -0.04 0.00 -1.74 0.00 0.00 68.15 67.88 3kc2 h THR 251 CO -0.22 0.44 0.36 1.88 0.37 0.00 0.00 175.52 178.35 3kc2 h TYR 252 N 0.59 1.15 -0.27 3.16 -1.99 -1.07 0.12 116.97 118.66 3kc2 h TYR 252 Ca 0.08 -0.06 0.01 0.00 2.00 0.00 0.00 58.73 60.76 3kc2 h TYR 252 Cb 0.74 -0.35 -0.01 0.00 2.00 0.00 0.00 36.73 39.10 3kc2 h TYR 252 CO 0.06 0.84 0.17 -0.44 -0.00 0.00 0.00 178.16 178.79 3kc2 h ASP 253 N 1.13 0.29 -0.34 3.88 3.32 -0.77 0.13 116.42 124.06 3kc2 h ASP 253 Ca 0.27 -0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.34 3kc2 h ASP 253 Cb 0.14 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 3kc2 h ASP 253 CO -0.03 0.21 0.18 0.15 -1.72 0.00 0.00 179.24 178.03 3kc2 h PHE 254 N 0.34 0.34 -0.78 4.55 3.57 -0.81 -1.08 116.94 123.07 3kc2 h PHE 254 Ca 0.10 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 3kc2 h PHE 254 Cb -0.03 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.58 3kc2 h PHE 254 CO -0.07 0.19 0.30 0.00 -2.23 0.00 0.00 178.31 176.50 3kc2 h ALA 255 N 1.17 1.05 -0.60 2.41 0.00 -0.56 -1.23 119.26 121.50 3kc2 h ALA 255 Ca 0.14 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.86 3kc2 h ALA 255 Cb 0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3kc2 h ALA 255 CO -0.09 0.66 0.39 1.25 0.00 0.00 0.00 179.25 181.47 3kc2 h HIS 256 N 1.14 0.74 -0.20 0.00 -0.00 -0.38 -0.43 115.15 116.02 3kc2 h HIS 256 Ca 0.26 0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 60.53 3kc2 h HIS 256 Cb 0.23 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.38 3kc2 h HIS 256 CO 0.02 0.45 -0.39 0.45 -0.00 0.00 0.00 177.93 178.47 3kc2 h HIS 257 N 0.79 0.51 -0.59 5.26 -0.00 -0.74 -0.09 115.15 120.29 3kc2 h HIS 257 Ca 0.23 -0.14 -0.02 0.00 -0.00 0.00 0.00 60.37 60.44 3kc2 h HIS 257 Cb -0.05 -0.11 -0.03 0.00 -0.00 0.00 0.00 27.41 27.21 3kc2 h HIS 257 CO -0.04 0.76 0.29 0.28 -0.00 0.00 0.00 177.93 179.23 3kc2 h VAL 258 N 0.37 1.21 -0.27 2.45 2.07 -0.83 -0.47 116.25 120.77 3kc2 h VAL 258 Ca 0.04 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3kc2 h VAL 258 Cb 0.84 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3kc2 h VAL 258 CO 0.07 0.23 0.14 0.25 0.02 0.00 0.00 177.57 178.28 3kc2 h LEU 259 N 0.80 0.35 -0.28 2.57 5.85 -0.79 0.19 115.31 124.00 3kc2 h LEU 259 Ca 0.20 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.85 3kc2 h LEU 259 Cb 0.10 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 3kc2 h LEU 259 CO -0.03 0.36 0.06 0.40 -0.34 0.00 0.00 178.44 178.89 3kc2 h ILE 260 N 0.31 0.88 -0.53 4.05 2.04 -0.83 0.56 117.51 124.00 3kc2 h ILE 260 Ca 0.09 -0.06 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 3kc2 h ILE 260 Cb 0.09 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 3kc2 h ILE 260 CO -0.01 0.03 0.03 0.44 0.00 0.00 0.00 178.15 178.64 3kc2 h ASP 261 N 0.17 0.84 -0.12 1.72 3.32 -0.84 -0.97 116.42 120.54 3kc2 h ASP 261 Ca 0.13 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 3kc2 h ASP 261 Cb 0.13 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 3kc2 h ASP 261 CO -0.16 0.89 0.01 -0.25 -1.72 0.00 0.00 179.24 178.00 3kc2 h TRP 262 N 0.82 0.22 -0.86 4.55 2.91 -0.54 -1.22 115.95 121.83 3kc2 h TRP 262 Ca 0.16 -0.04 0.07 0.00 1.13 0.00 0.00 58.89 60.22 3kc2 h TRP 262 Cb 0.44 -0.06 -0.07 0.00 -0.51 0.00 0.00 29.16 28.97 3kc2 h TRP 262 CO 0.03 0.43 0.53 1.49 -1.03 0.00 0.00 178.44 179.88 3kc2 h GLU 263 N -0.06 0.91 -0.74 2.65 4.57 -0.70 0.57 114.58 121.78 3kc2 h GLU 263 Ca 0.03 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3kc2 h GLU 263 Cb 0.34 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.69 3kc2 h GLU 263 CO 0.00 0.60 0.46 0.87 -1.18 0.00 0.00 179.01 179.77 3kc2 h LYS 264 N 0.93 0.99 -0.24 1.92 1.57 -1.01 0.82 116.57 121.55 3kc2 h LYS 264 Ca 0.39 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 59.08 3kc2 h LYS 264 Cb 0.24 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 3kc2 h LYS 264 CO -0.20 0.68 0.09 -0.09 -0.57 0.00 0.00 179.45 179.37 3kc2 h ARG 265 N 1.00 0.37 -0.69 3.15 2.43 -0.43 -0.93 114.38 119.28 3kc2 h ARG 265 Ca 0.27 -0.07 0.03 0.00 -0.81 0.00 0.00 59.98 59.40 3kc2 h ARG 265 Cb -0.07 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.38 3kc2 h ARG 265 CO -0.05 0.41 0.43 -0.07 -1.51 0.00 0.00 179.97 179.18 3kc2 h LEU 266 N 0.24 0.69 -0.74 3.80 3.38 -0.57 -2.93 115.31 119.18 3kc2 h LEU 266 Ca 0.08 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 3kc2 h LEU 266 Cb 0.19 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3kc2 h LEU 266 CO -0.01 0.47 -0.62 0.28 0.09 0.00 0.00 178.44 178.66 3kc2 h SER 267 N 0.83 0.06 0.00 -0.43 0.02 -0.66 -3.51 113.55 109.87 3kc2 h SER 267 Ca 0.28 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 3kc2 h SER 267 Cb 0.04 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3kc2 h SER 267 CO -0.12 0.66 0.00 0.61 -1.14 0.00 0.00 176.83 176.85 3kc2 n GLY 268 N 0.25 0.85 0.00 -3.77 0.00 -0.37 -5.09 105.19 97.07 3kc2 n GLY 268 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3kc2 n GLY 268 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kc2 n THR 283 N 0.71 0.00 -4.17 2.61 -2.24 -1.26 -4.98 114.28 104.95 3kc2 n THR 283 Ca 0.00 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.52 3kc2 n THR 283 Cb 0.20 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.37 3kc2 n THR 283 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3kc2 s LYS 284 N -2.46 2.60 0.26 -0.78 1.02 -1.26 -4.99 119.74 114.12 3kc2 s LYS 284 Ca 0.00 -1.05 -0.03 0.00 0.02 0.00 0.00 55.97 54.91 3kc2 s LYS 284 Cb 0.00 -2.45 0.45 0.00 -0.52 0.00 0.00 37.83 35.31 3kc2 s LYS 284 CO 0.00 0.45 1.81 -1.35 -0.92 0.00 0.00 175.35 175.34 3kc2 h PRO 285 N 2.43 0.78 0.00 -1.68 0.11 -1.98 -1.29 132.00 130.37 3kc2 h PRO 285 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3kc2 h PRO 285 Cb 1.21 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.14 3kc2 h PRO 285 CO 0.60 0.51 0.00 0.66 -0.21 0.00 0.00 178.00 179.57 3kc2 h SER 286 N 0.80 0.00 0.00 -2.05 4.64 -1.92 -3.26 113.55 111.76 3kc2 h SER 286 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 3kc2 h SER 286 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3kc2 h SER 286 CO -0.27 0.00 -0.61 0.35 -0.87 0.00 0.00 176.83 175.43 3kc2 n THR 287 N -2.75 0.00 -1.60 2.95 -2.24 -0.89 -4.90 114.28 104.85 3kc2 n THR 287 Ca 0.03 -0.22 -0.48 0.00 -2.27 0.00 0.00 64.05 61.11 3kc2 n THR 287 Cb 0.39 0.96 -0.04 0.00 -2.10 0.00 0.00 70.33 69.54 3kc2 n THR 287 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3kc2 n SER 288 N -1.31 1.70 -0.95 3.42 2.88 -0.54 -0.55 113.62 118.27 3kc2 n SER 288 Ca 0.02 1.14 0.06 0.00 -1.33 0.00 0.00 58.87 58.76 3kc2 n SER 288 Cb 0.19 -1.26 0.20 0.00 -0.75 0.00 0.00 64.21 62.59 3kc2 n SER 288 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3kc2 n PRO 289 N 1.92 2.40 -3.48 -1.46 -0.04 -1.26 -4.81 135.00 128.26 3kc2 n PRO 289 Ca 0.15 -1.60 -0.31 0.00 -0.04 0.00 0.00 63.50 61.70 3kc2 n PRO 289 Cb 0.26 -1.54 -0.05 0.00 -0.04 0.00 0.00 33.50 32.13 3kc2 n PRO 289 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3kc2 s PHE 290 N -1.63 3.45 0.26 0.54 0.08 0.29 -4.88 117.98 116.08 3kc2 s PHE 290 Ca 0.29 0.73 -0.04 0.00 0.12 0.00 0.00 56.93 58.03 3kc2 s PHE 290 Cb 0.18 -2.15 0.31 0.00 -0.57 0.00 0.00 43.02 40.79 3kc2 s PHE 290 CO 0.15 0.30 1.83 1.25 -0.10 0.00 0.00 175.22 178.66 3kc2 h HIS 291 N 2.46 1.03 -3.06 0.36 -0.00 -1.31 -3.38 115.15 111.25 3kc2 h HIS 291 Ca -0.47 -0.07 -0.14 0.00 -0.00 0.00 0.00 60.37 59.70 3kc2 h HIS 291 Cb 1.17 -0.31 -0.23 0.00 -0.00 0.00 0.00 27.41 28.04 3kc2 h HIS 291 CO 0.61 0.79 -0.34 0.00 -0.00 0.00 0.00 177.93 178.99 3kc2 s ALA 292 N -5.46 -0.72 -0.13 5.26 0.00 -1.05 -4.66 121.76 115.00 3kc2 s ALA 292 Ca -0.11 0.55 0.03 0.00 0.00 0.00 0.00 51.96 52.43 3kc2 s ALA 292 Cb 0.16 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.07 3kc2 s ALA 292 CO 0.82 -0.20 -0.22 0.08 0.00 0.00 0.00 175.76 176.24 3kc2 s VAL 293 N -0.57 2.00 0.00 0.00 1.01 -1.26 -2.02 120.40 119.56 3kc2 s VAL 293 Ca -0.07 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 60.96 3kc2 s VAL 293 Cb -0.04 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.58 3kc2 s VAL 293 CO 0.02 0.54 0.00 0.49 0.00 0.00 0.00 175.10 176.15 3kc2 n PHE 294 N 3.92 -1.55 -3.21 5.22 3.72 -0.22 -1.27 117.46 124.08 3kc2 n PHE 294 Ca -0.20 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.24 3kc2 n PHE 294 Cb 0.52 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.04 3kc2 n PHE 294 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3kc2 s VAL 296 N 0.65 -0.44 0.09 -4.37 1.01 0.10 -0.86 120.40 116.58 3kc2 s VAL 296 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 3kc2 s VAL 296 Cb 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 3kc2 s VAL 296 CO 0.00 0.00 0.03 -0.83 0.00 0.00 0.00 175.10 174.30 3kc2 s GLY 297 N 2.78 0.67 0.00 4.51 0.00 -0.54 -1.00 107.32 113.73 3kc2 s GLY 297 Ca 0.01 -1.27 0.14 0.00 0.00 0.00 0.00 44.72 43.60 3kc2 s GLY 297 CO -0.14 -1.29 0.67 2.09 0.00 0.00 0.00 173.10 174.43 3kc2 n ASP 298 N 0.00 0.97 -4.03 1.64 5.75 -1.26 -1.12 116.55 118.50 3kc2 n ASP 298 Ca -0.10 -0.98 -0.31 0.00 -0.01 0.00 0.00 54.79 53.38 3kc2 n ASP 298 Cb 0.62 0.81 -0.15 0.00 -1.03 0.00 0.00 41.12 41.37 3kc2 n ASP 298 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 3kc2 s ASN 299 N -2.12 4.58 0.37 -1.12 3.84 -1.26 -1.63 114.94 117.61 3kc2 s ASN 299 Ca 0.08 -1.82 0.15 0.00 0.21 0.00 0.00 52.86 51.48 3kc2 s ASN 299 Cb 0.11 -1.56 0.99 0.00 -0.55 0.00 0.00 41.25 40.25 3kc2 s ASN 299 CO 0.50 -0.30 1.79 -0.65 -2.79 0.00 0.00 177.10 175.65 3kc2 h PRO 300 N 7.70 0.49 0.00 0.43 0.11 -1.96 -1.66 132.00 137.10 3kc2 h PRO 300 Ca -0.11 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.98 3kc2 h PRO 300 Cb 1.03 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3kc2 h PRO 300 CO 0.49 0.32 0.00 0.00 -0.21 0.00 0.00 178.00 178.60 3kc2 n ALA 301 N -2.44 2.19 -0.01 -0.75 0.00 -1.26 -1.26 120.51 116.98 3kc2 n ALA 301 Ca 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.57 3kc2 n ALA 301 Cb 0.75 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.80 3kc2 n ALA 301 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3kc2 n SER 302 N -1.38 0.00 0.01 0.00 3.41 -0.87 -4.53 113.62 110.26 3kc2 n SER 302 Ca 0.09 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.60 3kc2 n SER 302 Cb 0.23 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.13 3kc2 n SER 302 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3kc2 h ASP 303 N 0.00 -0.13 0.00 4.04 3.32 -1.54 -1.64 116.42 120.47 3kc2 h ASP 303 Ca 0.00 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 3kc2 h ASP 303 Cb 0.00 0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3kc2 h ASP 303 CO 0.00 -0.05 -0.00 0.40 -1.72 0.00 0.00 179.24 177.87 3kc2 h ILE 304 N -0.03 1.28 -0.38 0.35 1.08 -1.53 -1.86 117.51 116.41 3kc2 h ILE 304 Ca 0.05 -1.95 -0.03 0.00 -0.39 0.00 0.00 64.86 62.54 3kc2 h ILE 304 Cb 0.10 2.41 -0.02 0.00 -3.07 0.00 0.00 36.82 36.24 3kc2 h ILE 304 CO -0.10 0.43 0.12 -0.29 -0.69 0.00 0.00 178.15 177.62 3kc2 h ILE 305 N -1.00 1.16 0.03 -0.67 6.09 -1.31 0.62 117.51 122.44 3kc2 h ILE 305 Ca -0.00 -0.56 -0.00 0.00 -1.37 0.00 0.00 64.86 62.93 3kc2 h ILE 305 Cb 0.71 0.75 0.00 0.00 0.47 0.00 0.00 36.82 38.75 3kc2 h ILE 305 CO 0.00 0.21 -0.02 1.23 -3.07 0.00 0.00 178.15 176.50 3kc2 h GLY 306 N 0.75 -0.05 0.91 8.18 0.00 -1.35 -0.27 103.07 111.24 3kc2 h GLY 306 Ca 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.47 3kc2 h GLY 306 CO -0.01 -0.02 0.08 0.00 0.00 0.00 0.00 176.54 176.59 3kc2 h ALA 307 N 0.83 0.21 -0.51 3.60 0.00 -0.94 -2.13 119.26 120.31 3kc2 h ALA 307 Ca -0.00 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.88 3kc2 h ALA 307 Cb 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 3kc2 h ALA 307 CO 0.01 -0.23 0.25 0.37 0.00 0.00 0.00 179.25 179.65 3kc2 h GLN 308 N 0.14 0.47 -0.05 0.00 4.15 -0.79 -0.57 115.11 118.46 3kc2 h GLN 308 Ca 0.06 -0.03 -0.10 0.00 0.77 0.00 0.00 58.65 59.35 3kc2 h GLN 308 Cb 0.12 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 3kc2 h GLN 308 CO -0.01 0.31 -0.43 -0.91 -1.93 0.00 0.00 178.83 175.87 3kc2 h ASN 309 N 0.48 0.10 1.37 -0.69 2.35 -0.96 -2.95 115.58 115.29 3kc2 h ASN 309 Ca 0.23 -0.04 -0.11 0.00 -0.55 0.00 0.00 56.30 55.83 3kc2 h ASN 309 Cb 0.15 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 3kc2 h ASN 309 CO -0.17 0.52 -0.51 0.22 -1.65 0.00 0.00 177.43 175.84 3kc2 h TYR 310 N 0.08 0.00 0.00 1.19 3.20 -0.67 -3.48 116.97 117.29 3kc2 h TYR 310 Ca 0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3kc2 h TYR 310 Cb 0.79 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.06 3kc2 h TYR 310 CO 0.01 0.51 0.00 0.41 -1.64 0.00 0.00 178.16 177.45 3kc2 n GLY 311 N 1.08 0.86 3.88 1.82 0.00 -0.38 -4.73 105.19 107.72 3kc2 n GLY 311 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 3kc2 n GLY 311 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3kc2 s TRP 312 N -2.00 3.51 0.83 1.61 0.51 -0.36 -4.87 118.94 118.17 3kc2 s TRP 312 Ca 0.00 1.09 -0.12 0.00 -2.12 0.00 0.00 56.10 54.95 3kc2 s TRP 312 Cb 0.00 -2.50 0.09 0.00 -0.81 0.00 0.00 33.47 30.25 3kc2 s TRP 312 CO 0.00 -0.25 1.16 -0.80 -0.51 0.00 0.00 176.95 176.55 3kc2 s ASN 313 N -3.46 4.27 -0.08 2.95 0.01 -0.40 -3.94 114.94 114.30 3kc2 s ASN 313 Ca 0.52 0.87 -0.16 0.00 -0.71 0.00 0.00 52.86 53.38 3kc2 s ASN 313 Cb -0.10 -1.41 0.04 0.00 0.41 0.00 0.00 41.25 40.18 3kc2 s ASN 313 CO 0.37 -2.06 0.40 -0.94 -1.51 0.00 0.00 177.10 173.35 3kc2 s SER 314 N -4.39 -0.35 -0.14 -1.22 1.04 -1.26 -4.32 113.70 103.06 3kc2 s SER 314 Ca 0.62 0.50 0.02 0.00 0.48 0.00 0.00 55.95 57.58 3kc2 s SER 314 Cb -0.12 0.59 0.01 0.00 0.10 0.00 0.00 66.02 66.59 3kc2 s SER 314 CO 0.51 -0.33 -0.22 0.00 0.98 0.00 0.00 173.24 174.18 3kc2 s LEU 316 N 0.86 4.05 0.40 0.00 2.96 -0.02 -1.47 118.68 125.47 3kc2 s LEU 316 Ca -0.06 0.03 0.05 0.00 -0.22 0.00 0.00 54.13 53.93 3kc2 s LEU 316 Cb -0.15 -2.12 0.00 0.00 0.50 0.00 0.00 46.19 44.42 3kc2 s LEU 316 CO -0.03 -0.02 0.57 0.68 -1.32 0.00 0.00 176.35 176.23 3kc2 s VAL 317 N 1.55 3.62 -1.06 1.68 -7.23 -0.28 -1.20 120.40 117.49 3kc2 s VAL 317 Ca 0.07 -0.86 0.12 0.00 -1.81 0.00 0.00 61.98 59.50 3kc2 s VAL 317 Cb -0.15 -3.27 0.33 0.00 0.56 0.00 0.00 36.38 33.85 3kc2 s VAL 317 CO 0.09 -0.13 1.27 0.29 -0.31 0.00 0.00 175.10 176.31 3kc2 n LYS 318 N -1.87 2.77 -0.14 4.82 5.02 -0.48 -4.56 118.16 123.73 3kc2 n LYS 318 Ca 0.03 -2.08 0.09 0.00 -2.02 0.00 0.00 58.31 54.33 3kc2 n LYS 318 Cb 0.58 -1.30 0.28 0.00 -0.02 0.00 0.00 35.03 34.58 3kc2 n LYS 318 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3kc2 n THR 319 N 0.64 0.36 0.00 -0.18 -2.24 -1.22 -4.85 114.28 106.79 3kc2 n THR 319 Ca 0.13 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 3kc2 n THR 319 Cb 0.44 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 3kc2 n THR 319 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kc2 n GLY 320 N 1.15 4.56 0.18 3.38 0.00 -1.19 -4.69 105.19 108.58 3kc2 n GLY 320 Ca 0.15 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.46 3kc2 n GLY 320 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3kc2 h VAL 321 N 0.00 1.20 -3.47 1.61 2.07 -1.88 -3.43 116.25 112.36 3kc2 h VAL 321 Ca 0.00 -0.62 -0.52 0.00 0.82 0.00 0.00 66.70 66.38 3kc2 h VAL 321 Cb 0.00 0.94 0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3kc2 h VAL 321 CO 0.00 0.22 0.51 -0.47 0.02 0.00 0.00 177.57 177.85 3kc2 s TYR 322 N -5.49 3.51 0.05 1.57 5.04 -0.64 -4.98 117.35 116.40 3kc2 s TYR 322 Ca -0.13 1.49 0.07 0.00 -2.44 0.00 0.00 57.07 56.06 3kc2 s TYR 322 Cb 0.09 -3.35 -0.03 0.00 0.35 0.00 0.00 41.96 39.03 3kc2 s TYR 322 CO 0.75 -0.90 -0.18 -0.80 -1.34 0.00 0.00 175.55 173.08 3kc2 s ASN 323 N 0.20 3.81 0.16 4.32 0.01 -1.26 -4.59 114.94 117.59 3kc2 s ASN 323 Ca 0.52 -0.43 -0.34 0.00 -0.71 0.00 0.00 52.86 51.90 3kc2 s ASN 323 Cb -0.30 -0.61 -0.15 0.00 0.41 0.00 0.00 41.25 40.60 3kc2 s ASN 323 CO 0.34 0.25 1.37 1.21 -1.51 0.00 0.00 177.10 178.76 3kc2 n GLU 324 N 1.50 1.57 -0.25 -0.60 2.13 -1.26 -1.14 120.64 122.60 3kc2 n GLU 324 Ca -0.16 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.22 3kc2 n GLU 324 Cb 0.52 -2.21 0.00 0.00 0.27 0.00 0.00 31.44 30.03 3kc2 n GLU 324 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3kc2 n GLY 325 N 2.55 1.38 3.76 8.31 0.00 -1.26 -5.05 105.19 114.88 3kc2 n GLY 325 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 3kc2 n GLY 325 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kc2 s ASP 326 N -3.11 5.47 0.07 1.61 1.01 -0.29 -4.94 116.67 116.48 3kc2 s ASP 326 Ca 0.00 2.42 -0.30 0.00 0.71 0.00 0.00 52.55 55.38 3kc2 s ASP 326 Cb 0.00 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.27 3kc2 s ASP 326 CO 0.00 -1.41 1.14 -1.81 0.21 0.00 0.00 175.17 173.30 3kc2 s ASP 327 N -1.44 7.17 0.00 0.27 -0.00 -1.26 -4.91 116.67 116.50 3kc2 s ASP 327 Ca 0.73 1.96 0.28 0.00 -0.00 0.00 0.00 52.55 55.51 3kc2 s ASP 327 Cb -0.31 -2.58 1.07 0.00 -0.00 0.00 0.00 42.92 41.09 3kc2 s ASP 327 CO 0.35 -0.38 1.75 0.18 -0.00 0.00 0.00 175.17 177.08 3kc2 n LEU 328 N 3.65 0.99 0.00 1.23 4.77 -1.26 -5.00 117.00 121.38 3kc2 n LEU 328 Ca 0.07 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 3kc2 n LEU 328 Cb 0.47 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 3kc2 n LEU 328 CO 0.54 0.17 0.00 2.29 -1.33 0.00 0.00 177.39 179.07 3kc2 n LYS 329 N -0.44 0.00 0.00 3.23 -0.00 -1.26 -0.64 118.16 119.05 3kc2 n LYS 329 Ca 0.16 0.00 0.13 0.00 -0.00 0.00 0.00 58.31 58.60 3kc2 n LYS 329 Cb 0.31 0.00 0.40 0.00 -0.00 0.00 0.00 35.03 35.75 3kc2 n LYS 329 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 3kc2 n GLU 330 N 14.00 0.81 -2.60 -1.58 -0.00 -1.26 -4.91 120.64 125.10 3kc2 n GLU 330 Ca 0.00 -0.46 -0.42 0.00 -0.00 0.00 0.00 57.16 56.29 3kc2 n GLU 330 Cb 0.00 -1.49 -0.04 0.00 -0.00 0.00 0.00 31.44 29.91 3kc2 n GLU 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3kc2 s LYS 332 N 0.46 1.88 0.59 0.00 1.02 -1.26 -4.86 119.74 117.57 3kc2 s LYS 332 Ca 0.52 -2.59 -0.20 0.00 0.02 0.00 0.00 55.97 53.72 3kc2 s LYS 332 Cb -0.25 -3.08 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 3kc2 s LYS 332 CO 0.30 -1.15 1.25 -2.30 -0.92 0.00 0.00 175.35 172.53 3kc2 n PRO 333 N 3.02 1.32 -0.25 -1.68 -0.02 -1.26 -4.89 135.00 131.23 3kc2 n PRO 333 Ca 0.09 0.50 -0.07 0.00 -2.02 0.00 0.00 63.50 62.00 3kc2 n PRO 333 Cb 0.33 -2.47 0.04 0.00 -0.02 0.00 0.00 33.50 31.39 3kc2 n PRO 333 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3kc2 h THR 334 N 0.91 1.24 -3.73 3.45 2.02 -1.53 -3.45 112.91 111.82 3kc2 h THR 334 Ca -0.50 -0.78 -0.16 0.00 0.77 0.00 0.00 66.41 65.74 3kc2 h THR 334 Cb 1.33 0.47 -0.21 0.00 -1.74 0.00 0.00 68.15 68.00 3kc2 h THR 334 CO 0.54 0.31 -0.60 -0.76 0.37 0.00 0.00 175.52 175.38 3kc2 s LEU 335 N -9.72 1.89 -0.14 2.58 1.02 -0.92 -5.01 118.68 108.37 3kc2 s LEU 335 Ca -0.13 -0.33 0.02 0.00 0.02 0.00 0.00 54.13 53.72 3kc2 s LEU 335 Cb 0.14 0.38 0.01 0.00 0.02 0.00 0.00 46.19 46.74 3kc2 s LEU 335 CO 0.82 -0.32 -0.21 -0.63 0.02 0.00 0.00 176.35 176.02 3kc2 s ILE 336 N -1.34 2.02 0.17 -0.59 1.01 -1.26 -0.84 121.20 120.37 3kc2 s ILE 336 Ca -0.14 -0.95 -0.02 0.00 0.00 0.00 0.00 60.65 59.54 3kc2 s ILE 336 Cb -0.08 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 3kc2 s ILE 336 CO 0.00 0.54 0.11 0.68 0.00 0.00 0.00 174.94 176.27 3kc2 s VAL 337 N 0.85 0.05 0.04 2.92 -7.23 -0.34 -4.97 120.40 111.71 3kc2 s VAL 337 Ca -0.06 -1.93 -0.20 0.00 -1.81 0.00 0.00 61.98 57.97 3kc2 s VAL 337 Cb -0.15 -2.27 -0.15 0.00 0.56 0.00 0.00 36.38 34.37 3kc2 s VAL 337 CO -0.02 -0.22 1.32 0.78 -0.31 0.00 0.00 175.10 176.65 3kc2 h ASN 338 N 2.72 0.39 -5.21 4.85 2.35 -1.94 -2.79 115.58 115.95 3kc2 h ASN 338 Ca -0.35 -0.50 -0.10 0.00 -0.55 0.00 0.00 56.30 54.79 3kc2 h ASN 338 Cb 1.23 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 39.44 3kc2 h ASN 338 CO 0.55 0.82 0.06 1.51 -1.65 0.00 0.00 177.43 178.72 3kc2 s ASP 339 N -6.17 0.28 0.25 5.81 1.47 -1.26 -1.39 116.67 115.67 3kc2 s ASP 339 Ca -0.14 -1.19 -0.03 0.00 1.18 0.00 0.00 52.55 52.37 3kc2 s ASP 339 Cb 0.05 0.74 0.31 0.00 -0.34 0.00 0.00 42.92 43.68 3kc2 s ASP 339 CO 0.76 -1.46 1.77 1.62 0.68 0.00 0.00 175.17 178.54 3kc2 h VAL 340 N 2.07 1.24 -0.54 2.11 3.04 -1.88 -0.40 116.25 121.89 3kc2 h VAL 340 Ca -0.29 -0.94 -0.09 0.00 -1.01 0.00 0.00 66.70 64.36 3kc2 h VAL 340 Cb 1.25 0.75 -0.02 0.00 -2.01 0.00 0.00 31.29 31.25 3kc2 h VAL 340 CO 0.38 0.34 -0.03 0.15 -1.01 0.00 0.00 177.57 177.40 3kc2 h PHE 341 N 0.83 1.06 -0.79 3.17 3.57 -1.88 -1.22 116.94 121.68 3kc2 h PHE 341 Ca 0.17 -0.19 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 3kc2 h PHE 341 Cb 0.39 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.82 3kc2 h PHE 341 CO 0.02 0.98 0.39 -0.44 -2.23 0.00 0.00 178.31 177.03 3kc2 h ASP 342 N 0.84 1.02 -0.25 0.41 3.32 -1.85 -0.65 116.42 119.25 3kc2 h ASP 342 Ca 0.15 -0.11 0.03 0.00 0.02 0.00 0.00 57.03 57.11 3kc2 h ASP 342 Cb 0.57 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 3kc2 h ASP 342 CO 0.03 0.85 0.09 0.00 -1.72 0.00 0.00 179.24 178.49 3kc2 h ALA 343 N 1.31 0.28 -0.02 3.45 0.00 -0.69 0.16 119.26 123.75 3kc2 h ALA 343 Ca 0.27 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 3kc2 h ALA 343 Cb 0.09 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3kc2 h ALA 343 CO -0.04 -0.32 -0.00 0.28 0.00 0.00 0.00 179.25 179.17 3kc2 h VAL 344 N 0.20 1.28 -0.27 0.00 2.07 -0.98 -1.58 116.25 116.96 3kc2 h VAL 344 Ca 0.11 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 3kc2 h VAL 344 Cb 0.08 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 3kc2 h VAL 344 CO -0.11 0.22 0.12 0.71 0.02 0.00 0.00 177.57 178.53 3kc2 h THR 345 N -0.30 1.16 -0.17 2.57 1.35 -1.04 -1.07 112.91 115.41 3kc2 h THR 345 Ca 0.01 -0.47 -0.13 0.00 -0.55 0.00 0.00 66.41 65.26 3kc2 h THR 345 Cb 0.36 0.97 -0.01 0.00 -1.73 0.00 0.00 68.15 67.73 3kc2 h THR 345 CO 0.00 0.16 -0.45 0.11 -0.25 0.00 0.00 175.52 175.10 3kc2 h LYS 346 N 0.30 0.41 -0.40 4.72 1.57 -1.01 -2.08 116.57 120.08 3kc2 h LYS 346 Ca 0.09 -0.21 -0.07 0.00 -1.87 0.00 0.00 60.65 58.59 3kc2 h LYS 346 Cb 0.15 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 3kc2 h LYS 346 CO -0.01 0.78 -0.03 1.15 -0.57 0.00 0.00 179.45 180.77 3kc2 h THR 347 N 0.33 1.27 -0.74 -0.16 2.02 -1.08 -2.42 112.91 112.12 3kc2 h THR 347 Ca 0.02 -1.06 -0.06 0.00 0.77 0.00 0.00 66.41 66.08 3kc2 h THR 347 Cb 0.92 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.46 3kc2 h THR 347 CO 0.08 0.36 0.24 -0.07 0.37 0.00 0.00 175.52 176.49 3kc2 h LEU 348 N 0.54 1.07 -0.64 2.58 3.38 -1.12 0.52 115.31 121.65 3kc2 h LEU 348 Ca 0.11 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3kc2 h LEU 348 Cb 0.52 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3kc2 h LEU 348 CO 0.03 0.99 0.42 -0.33 0.09 0.00 0.00 178.44 179.63 3kc2 h GLU 349 N 1.10 0.85 0.06 1.13 5.08 -1.27 -2.14 114.58 119.39 3kc2 h GLU 349 Ca 0.24 -0.06 -0.31 0.00 -1.00 0.00 0.00 59.36 58.24 3kc2 h GLU 349 Cb 0.30 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 3kc2 h GLU 349 CO -0.01 0.57 -1.68 1.63 -1.00 0.00 0.00 179.01 178.52 3kc2 n LYS 350 N -4.63 0.66 0.00 2.33 5.02 -0.92 -4.67 118.16 115.95 3kc2 n LYS 350 Ca 0.05 0.41 0.07 0.00 -2.02 0.00 0.00 58.31 56.82 3kc2 n LYS 350 Cb 0.02 -1.72 -0.03 0.00 -0.02 0.00 0.00 35.03 33.29 3kc2 n LYS 350 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3kc2 n TYR 351 N -3.96 0.00 0.81 2.13 4.02 0.18 -5.10 117.16 115.24 3kc2 n TYR 351 Ca -0.33 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.65 3kc2 n TYR 351 Cb 0.87 0.00 0.08 0.00 -0.02 0.00 0.00 39.34 40.27 3kc2 n TYR 351 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85