#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kc2 s ILE 14 N 0.00 1.66 0.13 -0.18 2.07 -1.26 -0.09 121.20 123.52 3kc2 s ILE 14 Ca 0.00 -1.66 0.02 0.00 -1.41 0.00 0.00 60.65 57.60 3kc2 s ILE 14 Cb 0.00 -1.61 -0.04 0.00 0.13 0.00 0.00 42.46 40.94 3kc2 s ILE 14 CO 0.00 -0.19 -0.05 0.00 -1.91 0.00 0.00 174.94 172.78 3kc2 s ALA 15 N -1.56 1.16 0.11 1.50 0.00 -0.76 -4.40 121.76 117.81 3kc2 s ALA 15 Ca 0.09 -1.44 0.10 0.00 0.00 0.00 0.00 51.96 50.71 3kc2 s ALA 15 Cb -0.08 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 3kc2 s ALA 15 CO 0.05 -0.24 -0.25 -0.06 0.00 0.00 0.00 175.76 175.26 3kc2 s PHE 16 N -3.59 2.15 -0.24 0.00 0.08 -0.86 -1.34 117.98 114.18 3kc2 s PHE 16 Ca 0.16 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.82 3kc2 s PHE 16 Cb 0.05 -1.19 0.07 0.00 -0.57 0.00 0.00 43.02 41.38 3kc2 s PHE 16 CO -0.01 0.28 -0.02 0.00 -0.10 0.00 0.00 175.22 175.36 3kc2 s ALA 17 N -1.05 1.79 -0.18 5.36 0.00 -0.12 -1.48 121.76 126.07 3kc2 s ALA 17 Ca 0.12 -1.31 -0.17 0.00 0.00 0.00 0.00 51.96 50.59 3kc2 s ALA 17 Cb -0.10 -1.43 -0.04 0.00 0.00 0.00 0.00 23.12 21.56 3kc2 s ALA 17 CO 0.05 -1.25 0.45 -0.06 0.00 0.00 0.00 175.76 174.94 3kc2 s PHE 18 N 1.48 3.41 0.90 0.00 0.08 -0.19 -0.47 117.98 123.19 3kc2 s PHE 18 Ca -0.03 0.73 -0.10 0.00 0.12 0.00 0.00 56.93 57.64 3kc2 s PHE 18 Cb -0.18 -2.56 0.14 0.00 -0.57 0.00 0.00 43.02 39.84 3kc2 s PHE 18 CO -0.08 0.02 1.12 0.34 -0.10 0.00 0.00 175.22 176.52 3kc2 s ASP 19 N 0.94 3.12 -0.05 1.36 2.15 -0.11 -0.76 116.67 123.31 3kc2 s ASP 19 Ca 0.22 2.00 -0.06 0.00 0.43 0.00 0.00 52.55 55.14 3kc2 s ASP 19 Cb -0.15 -2.51 -0.02 0.00 -0.30 0.00 0.00 42.92 39.94 3kc2 s ASP 19 CO 0.09 -2.94 -0.12 -0.38 -0.17 0.00 0.00 175.17 171.65 3kc2 n ILE 20 N -4.12 0.57 -2.01 4.11 5.41 -1.26 -4.00 119.36 118.06 3kc2 n ILE 20 Ca 0.10 0.33 -0.42 0.00 1.00 0.00 0.00 62.75 63.75 3kc2 n ILE 20 Cb 0.53 -1.74 -0.03 0.00 -0.71 0.00 0.00 39.64 37.69 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 -4.85 6.64 0.00 4.38 1.01 -1.26 -0.85 116.67 121.74 3kc2 s ASP 21 Ca -0.10 2.19 0.00 0.00 0.71 0.00 0.00 52.55 55.36 3kc2 s ASP 21 Cb 0.01 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.41 3kc2 s ASP 21 CO 0.14 -0.95 0.00 0.61 0.21 0.00 0.00 175.17 175.18 3kc2 n GLY 22 N 4.17 0.96 1.08 0.21 0.00 0.07 -4.69 105.19 106.98 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 -2.00 0.86 -0.09 1.61 0.31 -0.62 -3.13 118.33 115.27 3kc2 n VAL 23 Ca 0.00 0.29 -0.10 0.00 -0.01 0.00 0.00 64.34 64.51 3kc2 n VAL 23 Cb 0.00 -1.52 -0.15 0.00 -0.91 0.00 0.00 33.84 31.26 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 -3.36 0.33 -4.05 7.52 4.77 -0.03 -4.50 117.00 117.67 3kc2 n LEU 24 Ca 0.00 0.05 -0.11 0.00 -0.03 0.00 0.00 56.01 55.93 3kc2 n LEU 24 Cb 0.13 0.35 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 3kc2 n LEU 24 CO 0.00 0.51 -0.38 -0.36 -1.33 0.00 0.00 177.39 175.83 3kc2 s PHE 25 N -2.51 0.55 -0.28 -1.77 0.08 -0.91 -0.72 117.98 112.42 3kc2 s PHE 25 Ca -0.11 -0.61 0.00 0.00 0.12 0.00 0.00 56.93 56.33 3kc2 s PHE 25 Cb 0.06 -0.34 0.05 0.00 -0.57 0.00 0.00 43.02 42.22 3kc2 s PHE 25 CO 0.82 -0.16 -0.05 1.03 -0.10 0.00 0.00 175.22 176.76 3kc2 s ARG 26 N -2.04 2.38 7.97 0.44 1.81 -0.34 -0.75 118.95 128.42 3kc2 s ARG 26 Ca -0.08 -1.28 0.00 0.00 -1.72 0.00 0.00 55.73 52.65 3kc2 s ARG 26 Cb -0.06 -3.03 0.00 0.00 -0.45 0.00 0.00 34.95 31.40 3kc2 s ARG 26 CO -0.02 -0.58 0.00 0.41 -0.68 0.00 0.00 175.30 174.43 3kc2 n GLY 27 N 4.54 3.93 0.22 -3.53 0.00 -1.26 -2.19 105.19 106.91 3kc2 n GLY 27 Ca -0.14 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.02 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 13.95 0.74 -3.48 1.61 5.02 -1.26 -4.89 118.16 129.85 3kc2 n LYS 28 Ca 0.00 -0.45 -0.38 0.00 -2.02 0.00 0.00 58.31 55.46 3kc2 n LYS 28 Cb 0.00 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.43 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 -2.57 4.10 0.51 1.97 2.20 -0.93 -5.05 119.74 119.96 3kc2 s LYS 29 Ca 0.22 0.00 -0.23 0.00 -0.36 0.00 0.00 55.97 55.60 3kc2 s LYS 29 Cb 0.19 -3.57 -0.06 0.00 -1.51 0.00 0.00 37.83 32.88 3kc2 s LYS 29 CO 0.55 -0.07 1.39 -2.14 -0.36 0.00 0.00 175.35 174.72 3kc2 s PRO 30 N 1.44 3.33 0.26 4.03 0.02 -1.26 -1.20 135.00 141.61 3kc2 s PRO 30 Ca 0.14 2.33 -0.29 0.00 0.02 0.00 0.00 61.00 63.20 3kc2 s PRO 30 Cb -0.15 -2.41 -0.09 0.00 0.02 0.00 0.00 34.50 31.88 3kc2 s PRO 30 CO 0.08 -1.07 0.97 0.42 -0.33 0.00 0.00 177.00 177.06 3kc2 s ILE 31 N -1.26 3.98 0.22 2.83 1.01 0.10 -4.77 121.20 123.30 3kc2 s ILE 31 Ca 0.68 1.95 -0.31 0.00 0.00 0.00 0.00 60.65 62.96 3kc2 s ILE 31 Cb -0.42 -4.22 -0.11 0.00 0.01 0.00 0.00 42.46 37.71 3kc2 s ILE 31 CO 0.52 0.43 1.66 0.00 0.00 0.00 0.00 174.94 177.55 3kc2 s ALA 32 N -1.23 3.86 0.00 9.38 0.00 -1.26 -1.41 121.76 131.11 3kc2 s ALA 32 Ca 0.43 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.92 3kc2 s ALA 32 Cb -0.26 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.19 3kc2 s ALA 32 CO 0.33 -0.90 0.00 0.41 0.00 0.00 0.00 175.76 175.60 3kc2 n GLY 33 N 3.55 2.94 0.16 0.00 0.00 -1.26 -4.77 105.19 105.81 3kc2 n GLY 33 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 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 0.34 -0.08 4.61 0.00 -1.54 -0.40 119.26 122.19 3kc2 h ALA 34 Ca 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 3kc2 h ALA 34 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3kc2 h ALA 34 CO 0.00 0.12 0.04 1.03 0.00 0.00 0.00 179.25 180.44 3kc2 h SER 35 N 0.23 0.10 -0.60 0.00 0.87 -1.83 -2.56 113.55 109.76 3kc2 h SER 35 Ca 0.07 -0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.57 3kc2 h SER 35 Cb 0.48 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.38 3kc2 h SER 35 CO 0.02 0.16 0.40 0.44 -0.53 0.00 0.00 176.83 177.31 3kc2 h ASP 36 N 0.04 0.63 -0.08 6.23 3.32 -1.88 -1.14 116.42 123.54 3kc2 h ASP 36 Ca 0.03 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 3kc2 h ASP 36 Cb 0.08 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 3kc2 h ASP 36 CO -0.00 0.44 0.05 0.00 -1.72 0.00 0.00 179.24 178.00 3kc2 h ALA 37 N 1.65 0.10 -0.14 3.45 0.00 -0.68 0.38 119.26 124.02 3kc2 h ALA 37 Ca 0.23 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.94 3kc2 h ALA 37 Cb 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3kc2 h ALA 37 CO -0.06 -0.38 -0.62 -0.07 0.00 0.00 0.00 179.25 178.12 3kc2 h LEU 38 N 0.06 0.56 -0.87 0.00 3.38 -1.17 -2.32 115.31 114.95 3kc2 h LEU 38 Ca 0.03 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 3kc2 h LEU 38 Cb 0.04 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3kc2 h LEU 38 CO -0.01 1.04 0.32 0.11 0.09 0.00 0.00 178.44 180.00 3kc2 h LYS 39 N 0.37 1.14 -0.28 1.13 1.57 -1.06 -0.45 116.57 118.99 3kc2 h LYS 39 Ca -0.01 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 3kc2 h LYS 39 Cb 1.17 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 3kc2 h LYS 39 CO 0.11 0.92 0.14 1.25 -0.57 0.00 0.00 179.45 181.29 3kc2 h LEU 40 N 1.12 0.37 -0.67 2.94 5.85 -0.81 0.08 115.31 124.19 3kc2 h LEU 40 Ca 0.26 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 3kc2 h LEU 40 Cb 0.19 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3kc2 h LEU 40 CO -0.02 0.39 0.41 -0.07 -0.34 0.00 0.00 178.44 178.81 3kc2 h LEU 41 N 0.32 0.79 -0.53 2.25 3.38 -1.07 -2.02 115.31 118.44 3kc2 h LEU 41 Ca 0.10 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 3kc2 h LEU 41 Cb 0.12 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3kc2 h LEU 41 CO -0.01 0.61 0.10 0.78 0.09 0.00 0.00 178.44 180.01 3kc2 h ASN 42 N 0.91 0.83 -0.91 -0.43 2.35 -0.85 0.21 115.58 117.68 3kc2 h ASN 42 Ca 0.24 -0.25 0.11 0.00 -0.55 0.00 0.00 56.30 55.85 3kc2 h ASN 42 Cb -0.04 -0.22 -0.08 0.00 0.05 0.00 0.00 38.32 38.03 3kc2 h ASN 42 CO -0.05 0.86 0.55 0.03 -1.65 0.00 0.00 177.43 177.18 3kc2 h ARG 43 N 0.75 0.86 -0.08 0.81 3.08 -0.72 -1.96 114.38 117.12 3kc2 h ARG 43 Ca 0.16 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.16 3kc2 h ARG 43 Cb 0.38 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3kc2 h ARG 43 CO 0.01 0.57 0.00 0.09 -1.07 0.00 0.00 179.97 179.57 3kc2 n ASN 44 N -4.69 1.37 -3.49 7.04 4.13 -0.78 -4.94 115.26 113.91 3kc2 n ASN 44 Ca 0.16 -1.55 -0.25 0.00 1.68 0.00 0.00 54.58 54.62 3kc2 n ASN 44 Cb 0.32 -0.05 0.04 0.00 -1.54 0.00 0.00 39.78 38.55 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 0.10 -5.66 -3.48 3.52 4.76 -0.26 -4.97 118.16 112.16 3kc2 n LYS 45 Ca 0.18 0.73 -0.38 0.00 -2.87 0.00 0.00 58.31 55.97 3kc2 n LYS 45 Cb 0.31 -5.63 -0.09 0.00 -1.84 0.00 0.00 35.03 27.78 3kc2 n LYS 45 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3kc2 s ILE 46 N -3.21 5.24 0.42 -0.18 1.01 -0.10 -5.02 121.20 119.36 3kc2 s ILE 46 Ca 0.50 0.45 -0.24 0.00 0.00 0.00 0.00 60.65 61.36 3kc2 s ILE 46 Cb -0.24 -3.63 -0.08 0.00 0.01 0.00 0.00 42.46 38.52 3kc2 s ILE 46 CO 0.62 0.24 1.14 -2.16 0.00 0.00 0.00 174.94 174.78 3kc2 s PRO 47 N 1.61 3.98 0.04 2.79 0.04 -1.26 -4.51 135.00 137.68 3kc2 s PRO 47 Ca 0.13 1.75 -0.03 0.00 0.04 0.00 0.00 61.00 62.89 3kc2 s PRO 47 Cb -0.15 -2.56 -0.02 0.00 0.04 0.00 0.00 34.50 31.81 3kc2 s PRO 47 CO 0.08 -0.36 0.02 1.52 0.04 0.00 0.00 177.00 178.31 3kc2 s TYR 48 N -1.51 0.35 0.26 0.56 -0.85 -1.26 -2.04 117.35 112.86 3kc2 s TYR 48 Ca 0.59 -0.76 0.08 0.00 -0.52 0.00 0.00 57.07 56.46 3kc2 s TYR 48 Cb -0.28 -0.25 -0.05 0.00 0.38 0.00 0.00 41.96 41.75 3kc2 s TYR 48 CO 0.35 -0.35 -0.10 0.96 -1.52 0.00 0.00 175.55 174.89 3kc2 s ILE 49 N -3.03 1.81 -0.18 -3.49 -4.36 -0.55 -4.92 121.20 106.49 3kc2 s ILE 49 Ca -0.01 -2.19 -0.06 0.00 -0.26 0.00 0.00 60.65 58.12 3kc2 s ILE 49 Cb 0.01 -2.33 -0.04 0.00 1.25 0.00 0.00 42.46 41.36 3kc2 s ILE 49 CO -0.07 -0.39 0.03 -0.76 0.24 0.00 0.00 174.94 174.00 3kc2 s LEU 50 N -3.43 3.62 -0.30 0.37 1.43 0.13 -1.03 118.68 119.47 3kc2 s LEU 50 Ca 0.28 -0.00 0.00 0.00 -1.03 0.00 0.00 54.13 53.38 3kc2 s LEU 50 Cb 0.01 -1.91 0.09 0.00 0.03 0.00 0.00 46.19 44.42 3kc2 s LEU 50 CO 0.11 0.16 0.07 -0.22 0.23 0.00 0.00 176.35 176.70 3kc2 s LEU 51 N 0.46 2.72 0.03 1.79 2.96 0.06 -0.52 118.68 126.17 3kc2 s LEU 51 Ca 0.01 -1.64 0.08 0.00 -0.22 0.00 0.00 54.13 52.36 3kc2 s LEU 51 Cb -0.13 -1.04 -0.02 0.00 0.50 0.00 0.00 46.19 45.50 3kc2 s LEU 51 CO 0.01 -0.38 -0.23 0.28 -1.32 0.00 0.00 176.35 174.71 3kc2 s THR 52 N 1.46 1.85 -2.34 3.68 -1.32 -0.15 -3.88 115.64 114.95 3kc2 s THR 52 Ca 0.08 -1.19 0.29 0.00 -1.21 0.00 0.00 61.69 59.66 3kc2 s THR 52 Cb -0.18 -1.58 0.65 0.00 -1.51 0.00 0.00 72.50 69.89 3kc2 s THR 52 CO -0.19 0.35 1.88 0.59 -2.21 0.00 0.00 174.62 175.05 3kc2 n ASN 53 N 2.03 1.04 -4.49 8.08 3.02 -1.26 -2.12 115.26 121.56 3kc2 n ASN 53 Ca -0.17 -1.36 -0.29 0.00 -0.03 0.00 0.00 54.58 52.74 3kc2 n ASN 53 Cb 0.52 -0.00 0.16 0.00 -0.61 0.00 0.00 39.78 39.86 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 -1.98 1.61 0.00 7.41 0.00 -1.26 -4.31 107.32 108.79 3kc2 s GLY 54 Ca 0.41 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 44.40 3kc2 s GLY 54 CO 0.34 -0.07 0.00 0.61 0.00 0.00 0.00 173.10 173.98 3kc2 n GLY 55 N -2.27 -1.62 0.00 0.20 0.00 -1.26 -1.12 105.19 99.11 3kc2 n GLY 55 Ca 0.09 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.24 4.54 3.87 -0.02 0.00 -1.26 -4.90 105.19 107.18 3kc2 n GLY 56 Ca 0.00 -0.81 -0.21 0.00 0.00 0.00 0.00 46.02 45.00 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 3.07 0.88 1.61 0.08 -1.26 -3.48 117.98 118.88 3kc2 s PHE 57 Ca 0.00 -0.19 -0.12 0.00 0.12 0.00 0.00 56.93 56.74 3kc2 s PHE 57 Cb 0.00 -1.65 0.11 0.00 -0.57 0.00 0.00 43.02 40.91 3kc2 s PHE 57 CO 0.00 0.31 1.06 -1.13 -0.10 0.00 0.00 175.22 175.36 3kc2 n SER 58 N -1.34 0.23 -0.13 1.36 3.41 -1.26 -4.76 113.62 111.13 3kc2 n SER 58 Ca -0.05 0.47 0.03 0.00 -0.26 0.00 0.00 58.87 59.06 3kc2 n SER 58 Cb 0.59 -1.45 0.33 0.00 -0.26 0.00 0.00 64.21 63.42 3kc2 n SER 58 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3kc2 h GLU 59 N -1.50 0.78 0.00 4.33 3.07 -1.97 -0.49 114.58 118.80 3kc2 h GLU 59 Ca -0.44 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 58.37 3kc2 h GLU 59 Cb 1.28 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 3kc2 h GLU 59 CO 0.42 0.51 -0.00 -0.09 -1.40 0.00 0.00 179.01 178.45 3kc2 h ARG 60 N 0.80 -0.00 -0.50 2.33 2.43 -1.90 -1.79 114.38 115.75 3kc2 h ARG 60 Ca 0.24 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.32 3kc2 h ARG 60 Cb -0.03 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 3kc2 h ARG 60 CO -0.06 0.35 -0.02 0.00 -1.51 0.00 0.00 179.97 178.73 3kc2 h ALA 61 N 0.64 1.03 -0.25 2.80 0.00 -1.80 -0.81 119.26 120.86 3kc2 h ALA 61 Ca -0.00 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 3kc2 h ALA 61 Cb 0.36 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3kc2 h ALA 61 CO 0.00 0.60 -0.08 -0.09 0.00 0.00 0.00 179.25 179.68 3kc2 h ARG 62 N 0.78 0.49 0.00 0.00 9.65 -1.08 -2.36 114.38 121.87 3kc2 h ARG 62 Ca 0.15 -0.20 -0.07 0.00 -1.10 0.00 0.00 59.98 58.76 3kc2 h ARG 62 Cb 0.50 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.05 3kc2 h ARG 62 CO 0.03 0.73 -0.32 1.79 2.80 0.00 0.00 179.97 185.00 3kc2 h THR 63 N 0.23 1.04 -0.35 0.20 1.35 -1.22 -1.25 112.91 112.90 3kc2 h THR 63 Ca 0.06 -1.16 -0.06 0.00 -0.55 0.00 0.00 66.41 64.70 3kc2 h THR 63 Cb 0.56 1.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.63 3kc2 h THR 63 CO 0.03 0.31 -0.02 -0.33 -0.25 0.00 0.00 175.52 175.26 3kc2 h GLU 64 N 0.00 0.63 0.06 4.72 5.08 -0.98 -0.13 114.58 123.95 3kc2 h GLU 64 Ca -0.00 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.15 3kc2 h GLU 64 Cb 0.64 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3kc2 h GLU 64 CO 0.04 0.75 -0.03 0.35 -1.00 0.00 0.00 179.01 179.13 3kc2 h PHE 65 N 0.43 -0.07 -0.84 4.33 3.57 -1.22 -2.01 116.94 121.13 3kc2 h PHE 65 Ca 0.10 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 3kc2 h PHE 65 Cb 0.48 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 3kc2 h PHE 65 CO 0.04 0.02 0.50 0.82 -2.23 0.00 0.00 178.31 177.46 3kc2 h ILE 66 N -0.15 1.24 -0.48 1.41 2.04 -1.13 -1.86 117.51 118.58 3kc2 h ILE 66 Ca -0.01 -0.53 0.04 0.00 1.00 0.00 0.00 64.86 65.36 3kc2 h ILE 66 Cb 0.13 0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.23 3kc2 h ILE 66 CO 0.01 0.25 0.25 0.28 0.00 0.00 0.00 178.15 178.94 3kc2 h SER 67 N 1.15 0.37 -0.49 1.72 0.02 -0.93 -0.23 113.55 115.16 3kc2 h SER 67 Ca 0.30 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.25 3kc2 h SER 67 Cb -0.04 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 3kc2 h SER 67 CO -0.06 0.26 0.22 0.77 -1.14 0.00 0.00 176.83 176.89 3kc2 h SER 68 N 0.49 0.65 0.39 3.07 4.64 -0.94 -1.03 113.55 120.83 3kc2 h SER 68 Ca 0.21 -0.14 -0.20 0.00 -0.47 0.00 0.00 61.79 61.18 3kc2 h SER 68 Cb 0.10 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.02 3kc2 h SER 68 CO -0.14 0.61 -0.85 0.11 -0.87 0.00 0.00 176.83 175.69 3kc2 h LYS 69 N 0.65 0.34 -0.02 4.77 1.79 -0.91 -3.26 116.57 119.92 3kc2 h LYS 69 Ca 0.17 -0.33 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 3kc2 h LYS 69 Cb 0.14 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 3kc2 h LYS 69 CO -0.02 1.01 -0.08 1.28 -1.08 0.00 0.00 179.45 180.56 3kc2 n LEU 70 N -3.75 2.56 -3.86 2.94 4.77 -0.14 -4.90 117.00 114.63 3kc2 n LEU 70 Ca -0.05 -0.86 -0.29 0.00 -0.03 0.00 0.00 56.01 54.78 3kc2 n LEU 70 Cb 0.78 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.90 3kc2 n LEU 70 CO 0.49 0.43 0.11 -0.67 -1.33 0.00 0.00 177.39 176.42 3kc2 n ASP 71 N 0.89 -4.58 -4.10 -1.43 2.03 -0.40 -4.68 116.55 104.27 3kc2 n ASP 71 Ca 0.14 -0.76 -0.10 0.00 0.52 0.00 0.00 54.79 54.60 3kc2 n ASP 71 Cb 0.53 -4.04 -0.10 0.00 -0.72 0.00 0.00 41.12 36.79 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 -3.34 0.45 -0.64 5.18 -7.23 -1.13 -5.03 120.40 108.65 3kc2 s VAL 72 Ca 0.58 -1.64 -0.23 0.00 -1.81 0.00 0.00 61.98 58.88 3kc2 s VAL 72 Cb -0.29 -1.29 0.06 0.00 0.56 0.00 0.00 36.38 35.42 3kc2 s VAL 72 CO 0.82 -0.79 0.97 -0.62 -0.31 0.00 0.00 175.10 175.16 3kc2 s ASP 73 N -2.59 6.20 -0.27 4.85 2.15 -1.26 -4.26 116.67 121.50 3kc2 s ASP 73 Ca 0.04 -0.84 -0.13 0.00 0.43 0.00 0.00 52.55 52.04 3kc2 s ASP 73 Cb 0.02 -2.43 -0.04 0.00 -0.30 0.00 0.00 42.92 40.17 3kc2 s ASP 73 CO -0.05 -1.41 0.27 -0.69 -0.17 0.00 0.00 175.17 173.12 3kc2 s VAL 74 N 4.11 5.25 0.37 1.11 1.01 -1.26 -5.08 120.40 125.90 3kc2 s VAL 74 Ca 0.24 0.36 -0.24 0.00 0.00 0.00 0.00 61.98 62.33 3kc2 s VAL 74 Cb -0.16 -3.61 -0.10 0.00 0.00 0.00 0.00 36.38 32.52 3kc2 s VAL 74 CO 0.12 0.21 0.97 -0.55 0.00 0.00 0.00 175.10 175.85 3kc2 s SER 75 N 1.68 7.09 0.46 3.32 0.15 -1.26 -4.65 113.70 120.50 3kc2 s SER 75 Ca 0.11 1.86 0.27 0.00 0.70 0.00 0.00 55.95 58.89 3kc2 s SER 75 Cb -0.16 -2.57 1.49 0.00 -1.71 0.00 0.00 66.02 63.07 3kc2 s SER 75 CO 0.10 -0.25 1.82 -0.65 1.20 0.00 0.00 173.24 175.47 3kc2 h PRO 76 N 2.70 0.00 -0.04 5.44 0.11 -1.91 -1.04 132.00 137.27 3kc2 h PRO 76 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3kc2 h PRO 76 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3kc2 h PRO 76 CO 0.63 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.70 3kc2 n LEU 77 N -2.53 0.91 -0.73 2.35 4.77 -1.26 -3.89 117.00 116.61 3kc2 n LEU 77 Ca -0.02 -0.33 0.07 0.00 -0.03 0.00 0.00 56.01 55.71 3kc2 n LEU 77 Cb 0.15 -0.02 0.14 0.00 -2.33 0.00 0.00 43.42 41.36 3kc2 n LEU 77 CO 0.12 0.16 0.59 0.00 -1.33 0.00 0.00 177.39 176.93 3kc2 n GLN 78 N -0.26 2.02 -5.08 3.23 6.02 -0.39 -4.75 117.38 118.15 3kc2 n GLN 78 Ca 0.19 -1.84 -0.28 0.00 -0.01 0.00 0.00 57.00 55.06 3kc2 n GLN 78 Cb 0.24 -1.32 -0.16 0.00 1.02 0.00 0.00 30.24 30.02 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 -1.11 1.74 -0.15 5.09 2.07 -1.25 0.17 121.20 127.76 3kc2 s ILE 79 Ca 0.25 -0.93 0.01 0.00 -1.41 0.00 0.00 60.65 58.56 3kc2 s ILE 79 Cb 0.14 -1.46 0.02 0.00 0.13 0.00 0.00 42.46 41.30 3kc2 s ILE 79 CO 0.20 0.49 -0.16 -0.63 -1.91 0.00 0.00 174.94 172.93 3kc2 s ILE 80 N -0.41 1.72 0.49 2.00 1.09 0.32 -4.97 121.20 121.45 3kc2 s ILE 80 Ca 0.05 -0.74 0.07 0.00 -1.10 0.00 0.00 60.65 58.94 3kc2 s ILE 80 Cb -0.10 -1.58 0.02 0.00 -1.06 0.00 0.00 42.46 39.74 3kc2 s ILE 80 CO 0.00 0.48 0.47 -1.10 -0.10 0.00 0.00 174.94 174.69 3kc2 s GLN 81 N 1.28 2.40 0.22 2.79 -0.21 -1.26 -0.98 119.66 123.91 3kc2 s GLN 81 Ca 0.02 -1.72 -0.10 0.00 0.02 0.00 0.00 55.36 53.58 3kc2 s GLN 81 Cb -0.13 -2.34 0.32 0.00 1.00 0.00 0.00 33.01 31.85 3kc2 s GLN 81 CO -0.09 -0.47 1.65 0.66 -2.12 0.00 0.00 175.29 174.93 3kc2 h SER 82 N 0.76 -0.36 0.34 5.90 4.64 -0.58 -2.45 113.55 121.81 3kc2 h SER 82 Ca -0.38 0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 3kc2 h SER 82 Cb 1.28 0.32 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 3kc2 h SER 82 CO 0.54 -0.15 -0.17 0.00 -0.87 0.00 0.00 176.83 176.18 3kc2 n HIS 83 N -5.33 0.00 -0.36 4.77 1.44 -1.26 -4.34 115.22 110.14 3kc2 n HIS 83 Ca 0.10 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.82 3kc2 n HIS 83 Cb 0.38 -0.17 0.16 0.00 0.12 0.00 0.00 29.99 30.47 3kc2 n HIS 83 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 3kc2 h THR 84 N 0.74 1.11 0.00 0.61 2.02 -1.82 -0.25 112.91 115.33 3kc2 h THR 84 Ca 0.00 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 66.78 3kc2 h THR 84 Cb 0.42 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 3kc2 h THR 84 CO 0.00 0.21 0.00 -2.65 0.37 0.00 0.00 175.52 173.45 3kc2 n PRO 85 N -4.50 0.06 0.09 6.66 -0.02 -1.26 -2.21 135.00 133.81 3kc2 n PRO 85 Ca 0.14 0.25 0.08 0.00 -2.02 0.00 0.00 63.50 61.95 3kc2 n PRO 85 Cb 0.15 -1.50 0.38 0.00 -0.02 0.00 0.00 33.50 32.50 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 -1.43 0.45 -0.27 6.00 4.01 -0.10 -1.54 117.16 124.28 3kc2 n TYR 86 Ca 0.04 0.21 0.25 0.00 -0.16 0.00 0.00 57.90 58.24 3kc2 n TYR 86 Cb 0.13 -0.83 0.60 0.00 -0.31 0.00 0.00 39.34 38.92 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 0.24 0.00 -0.72 1.57 -1.62 -0.64 116.57 115.40 3kc2 h LYS 87 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3kc2 h LYS 87 Cb 0.14 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3kc2 h LYS 87 CO 0.00 0.16 0.00 -1.13 -0.57 0.00 0.00 179.45 177.91 3kc2 n SER 88 N -4.44 0.63 -0.58 0.86 3.41 -0.59 -3.22 113.62 109.68 3kc2 n SER 88 Ca 0.22 0.69 0.11 0.00 -0.26 0.00 0.00 58.87 59.63 3kc2 n SER 88 Cb 0.91 -0.81 0.02 0.00 -0.26 0.00 0.00 64.21 64.07 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 -2.24 2.20 -0.01 1.04 4.77 -0.25 -4.58 117.00 117.93 3kc2 n LEU 89 Ca 0.01 -0.82 0.02 0.00 -0.03 0.00 0.00 56.01 55.18 3kc2 n LEU 89 Cb 0.17 0.00 0.35 0.00 -2.33 0.00 0.00 43.42 41.61 3kc2 n LEU 89 CO 0.17 0.40 1.05 0.58 -1.33 0.00 0.00 177.39 178.25 3kc2 h VAL 90 N 2.87 1.16 -0.00 4.08 2.07 -1.64 -0.54 116.25 124.25 3kc2 h VAL 90 Ca 0.00 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3kc2 h VAL 90 Cb 0.77 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 3kc2 h VAL 90 CO 0.00 0.19 -0.17 0.59 0.02 0.00 0.00 177.57 178.20 3kc2 n ASN 91 N -4.37 0.62 0.02 0.57 3.02 -1.26 -4.18 115.26 109.68 3kc2 n ASN 91 Ca 0.03 -0.61 -0.17 0.00 -0.03 0.00 0.00 54.58 53.79 3kc2 n ASN 91 Cb 0.15 -0.01 -0.14 0.00 -0.61 0.00 0.00 39.78 39.17 3kc2 n ASN 91 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3kc2 h LYS 92 N 0.71 0.21 -4.18 3.52 3.64 -1.39 -3.46 116.57 115.61 3kc2 h LYS 92 Ca 0.00 -0.36 -0.55 0.00 -1.27 0.00 0.00 60.65 58.47 3kc2 h LYS 92 Cb 0.42 0.13 -0.38 0.00 -0.41 0.00 0.00 32.23 32.00 3kc2 h LYS 92 CO 0.00 1.03 -0.80 0.71 -2.27 0.00 0.00 179.45 178.13 3kc2 s TYR 93 N -2.58 1.66 -0.01 1.91 2.02 -1.15 -5.04 117.35 114.16 3kc2 s TYR 93 Ca -0.15 -1.01 -0.24 0.00 -0.37 0.00 0.00 57.07 55.30 3kc2 s TYR 93 Cb 0.07 -1.30 -0.17 0.00 -0.40 0.00 0.00 41.96 40.15 3kc2 s TYR 93 CO 0.81 -0.60 1.16 1.03 -1.57 0.00 0.00 175.55 176.39 3kc2 h SER 94 N 8.13 -0.21 -3.32 2.29 0.87 -1.90 -3.43 113.55 115.98 3kc2 h SER 94 Ca -0.26 -0.30 -0.65 0.00 -1.23 0.00 0.00 61.79 59.36 3kc2 h SER 94 Cb 1.12 0.05 -0.25 0.00 -0.44 0.00 0.00 62.40 62.88 3kc2 h SER 94 CO 0.40 0.23 -0.72 -0.60 -0.53 0.00 0.00 176.83 175.61 3kc2 s ARG 95 N -4.28 3.50 0.06 2.24 3.52 -1.26 -2.41 118.95 120.32 3kc2 s ARG 95 Ca -0.14 -0.61 0.09 0.00 -0.13 0.00 0.00 55.73 54.94 3kc2 s ARG 95 Cb 0.02 -2.79 -0.03 0.00 -1.56 0.00 0.00 34.95 30.58 3kc2 s ARG 95 CO 0.56 0.18 -0.23 0.96 -0.81 0.00 0.00 175.30 175.96 3kc2 s ILE 96 N 0.48 2.43 -0.52 4.11 -4.36 -0.63 -0.64 121.20 122.06 3kc2 s ILE 96 Ca -0.06 -1.37 -0.23 0.00 -0.26 0.00 0.00 60.65 58.73 3kc2 s ILE 96 Cb -0.15 -2.00 0.04 0.00 1.25 0.00 0.00 42.46 41.60 3kc2 s ILE 96 CO 0.04 0.31 0.88 -0.22 0.24 0.00 0.00 174.94 176.18 3kc2 s LEU 97 N -1.46 4.23 -0.54 0.37 2.96 -0.32 -1.35 118.68 122.57 3kc2 s LEU 97 Ca 0.13 -0.35 -0.21 0.00 -0.22 0.00 0.00 54.13 53.48 3kc2 s LEU 97 Cb -0.10 -2.83 0.06 0.00 0.50 0.00 0.00 46.19 43.82 3kc2 s LEU 97 CO 0.04 -1.13 0.76 0.00 -1.32 0.00 0.00 176.35 174.70 3kc2 s ALA 98 N 3.67 3.29 -0.17 5.97 0.00 0.20 -0.63 121.76 134.10 3kc2 s ALA 98 Ca 0.29 -1.62 -0.11 0.00 0.00 0.00 0.00 51.96 50.52 3kc2 s ALA 98 Cb -0.13 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.41 3kc2 s ALA 98 CO 0.19 -2.21 0.21 0.08 0.00 0.00 0.00 175.76 174.03 3kc2 s VAL 99 N 3.17 5.36 -4.25 0.00 1.01 -0.39 -3.88 120.40 121.43 3kc2 s VAL 99 Ca 0.20 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.55 3kc2 s VAL 99 Cb -0.17 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.67 3kc2 s VAL 99 CO 0.14 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.29 3kc2 n GLY 100 N 3.26 -0.84 3.70 4.51 0.00 -1.26 -0.24 105.19 114.33 3kc2 n GLY 100 Ca -0.15 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.48 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 -3.00 2.65 0.55 2.61 -4.23 -1.25 -4.51 115.64 108.46 3kc2 s THR 101 Ca 0.00 0.21 0.25 0.00 -1.18 0.00 0.00 61.69 60.97 3kc2 s THR 101 Cb 0.00 -2.53 0.36 0.00 1.34 0.00 0.00 72.50 71.67 3kc2 s THR 101 CO 0.00 -0.28 2.06 -0.65 -0.54 0.00 0.00 174.62 175.21 3kc2 h PRO 102 N -1.61 0.00 0.00 3.99 0.11 -1.94 -0.64 132.00 131.91 3kc2 h PRO 102 Ca -0.47 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 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 0.50 0.00 -0.00 0.66 -0.21 0.00 0.00 178.00 178.94 3kc2 h SER 103 N 0.00 0.00 0.69 -2.05 4.64 -1.90 -2.77 113.55 112.16 3kc2 h SER 103 Ca 0.14 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.44 3kc2 h SER 103 Cb 0.64 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.73 3kc2 h SER 103 CO -0.00 0.00 -0.10 -0.37 -0.87 0.00 0.00 176.83 175.49 3kc2 h VAL 104 N 0.00 0.31 0.08 0.95 -1.51 -1.14 -2.54 116.25 112.40 3kc2 h VAL 104 Ca -0.00 -0.63 0.02 0.00 -1.23 0.00 0.00 66.70 64.87 3kc2 h VAL 104 Cb 0.18 1.47 -0.04 0.00 -2.13 0.00 0.00 31.29 30.77 3kc2 h VAL 104 CO 0.00 0.09 -0.28 -0.09 -1.23 0.00 0.00 177.57 176.07 3kc2 h ARG 105 N 0.00 -0.45 -0.59 5.19 2.43 -1.70 -0.64 114.38 118.63 3kc2 h ARG 105 Ca -0.00 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.16 3kc2 h ARG 105 Cb 0.47 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.09 3kc2 h ARG 105 CO 0.01 -0.30 0.20 0.78 -1.51 0.00 0.00 179.97 179.15 3kc2 h GLY 106 N -0.47 0.93 0.92 2.80 0.00 -1.67 -0.59 103.07 105.00 3kc2 h GLY 106 Ca 0.04 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 3kc2 h GLY 106 CO -0.19 0.47 0.05 -2.08 0.00 0.00 0.00 176.54 174.79 3kc2 h VAL 107 N 0.85 1.09 -0.61 4.60 2.07 -1.24 -0.09 116.25 122.92 3kc2 h VAL 107 Ca 0.20 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 3kc2 h VAL 107 Cb 0.22 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3kc2 h VAL 107 CO -0.01 0.08 0.36 0.00 0.02 0.00 0.00 177.57 178.02 3kc2 h ALA 108 N 0.94 0.78 -0.74 1.67 0.00 -0.74 -1.77 119.26 119.41 3kc2 h ALA 108 Ca 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3kc2 h ALA 108 Cb 0.09 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3kc2 h ALA 108 CO -0.00 0.27 0.32 0.93 0.00 0.00 0.00 179.25 180.77 3kc2 h GLU 109 N 0.83 1.07 -0.74 0.00 5.08 -0.96 -2.56 114.58 117.30 3kc2 h GLU 109 Ca 0.22 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3kc2 h GLU 109 Cb -0.01 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.02 3kc2 h GLU 109 CO -0.04 0.84 0.38 0.78 -1.00 0.00 0.00 179.01 179.97 3kc2 h GLY 110 N 1.10 1.11 2.00 -3.84 0.00 -0.48 -1.65 103.07 101.32 3kc2 h GLY 110 Ca 0.25 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 3kc2 h GLY 110 CO -0.03 0.49 -0.04 -0.97 0.00 0.00 0.00 176.54 176.00 3kc2 h TYR 111 N 1.04 0.00 0.00 5.60 0.05 -0.94 -3.46 116.97 119.25 3kc2 h TYR 111 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.04 3kc2 h TYR 111 Cb 0.07 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.81 3kc2 h TYR 111 CO 0.01 0.04 0.00 0.41 -1.05 0.00 0.00 178.16 177.57 3kc2 n GLY 112 N -0.50 1.23 3.72 3.88 0.00 -0.62 -4.95 105.19 107.96 3kc2 n GLY 112 Ca -0.01 0.00 -0.43 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 -1.08 2.64 -0.13 1.61 3.72 -1.05 -4.89 117.46 118.28 3kc2 n PHE 113 Ca 0.00 0.23 -0.12 0.00 -0.05 0.00 0.00 57.45 57.51 3kc2 n PHE 113 Cb 0.00 -2.59 -0.00 0.00 -0.94 0.00 0.00 39.48 35.95 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 5.30 0.94 -2.32 -1.08 4.20 -1.85 -3.42 115.11 116.89 3kc2 h GLN 114 Ca -0.45 -0.46 -0.32 0.00 0.06 0.00 0.00 58.65 57.48 3kc2 h GLN 114 Cb 1.23 -0.00 -0.34 0.00 0.30 0.00 0.00 27.48 28.66 3kc2 h GLN 114 CO 0.84 1.12 -0.63 0.34 -0.67 0.00 0.00 178.83 179.83 3kc2 s ASP 115 N -6.80 1.55 -0.18 1.46 -1.08 -1.01 -5.04 116.67 105.57 3kc2 s ASP 115 Ca -0.11 -0.49 -0.04 0.00 -0.52 0.00 0.00 52.55 51.39 3kc2 s ASP 115 Cb 0.12 0.45 -0.02 0.00 -1.46 0.00 0.00 42.92 42.01 3kc2 s ASP 115 CO 0.87 -0.36 -0.03 -0.69 0.52 0.00 0.00 175.17 175.48 3kc2 s VAL 116 N 2.35 3.75 -0.11 1.11 1.01 -1.26 -1.61 120.40 125.64 3kc2 s VAL 116 Ca 0.09 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.71 3kc2 s VAL 116 Cb -0.15 -2.67 -0.00 0.00 0.00 0.00 0.00 36.38 33.56 3kc2 s VAL 116 CO -0.23 0.46 -0.22 -0.69 0.00 0.00 0.00 175.10 174.42 3kc2 s VAL 117 N 0.79 2.27 0.27 2.92 1.01 -0.46 -4.99 120.40 122.22 3kc2 s VAL 117 Ca -0.01 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 60.98 3kc2 s VAL 117 Cb -0.14 -1.89 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 3kc2 s VAL 117 CO 0.02 0.55 0.54 -2.28 0.00 0.00 0.00 175.10 173.93 3kc2 s HIS 118 N 0.36 3.47 0.48 5.22 2.46 -1.26 -0.62 115.29 125.40 3kc2 s HIS 118 Ca -0.17 0.63 0.15 0.00 0.47 0.00 0.00 55.06 56.14 3kc2 s HIS 118 Cb -0.17 -2.09 1.12 0.00 -0.13 0.00 0.00 32.58 31.30 3kc2 s HIS 118 CO 0.08 0.20 2.07 -0.56 -2.47 0.00 0.00 174.74 174.06 3kc2 h GLN 119 N 1.80 0.03 0.00 2.88 -0.00 -1.91 -1.34 115.11 116.57 3kc2 h GLN 119 Ca -0.48 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.15 3kc2 h GLN 119 Cb 1.19 -0.01 -0.00 0.00 -0.00 0.00 0.00 27.48 28.66 3kc2 h GLN 119 CO 0.67 0.11 -0.09 1.79 -0.00 0.00 0.00 178.83 181.31 3kc2 h THR 120 N 0.03 0.33 0.00 1.86 1.35 -1.93 -2.13 112.91 112.42 3kc2 h THR 120 Ca 0.01 -0.56 -0.06 0.00 -0.55 0.00 0.00 66.41 65.26 3kc2 h THR 120 Cb 0.15 1.41 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 3kc2 h THR 120 CO 0.01 0.09 -0.27 0.44 -0.25 0.00 0.00 175.52 175.54 3kc2 h ASP 121 N 0.00 0.00 0.03 5.36 3.32 -1.52 -0.11 116.42 123.50 3kc2 h ASP 121 Ca -0.00 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.81 3kc2 h ASP 121 Cb 0.41 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.97 3kc2 h ASP 121 CO 0.01 0.27 -0.89 0.40 -1.72 0.00 0.00 179.24 177.31 3kc2 h ILE 122 N 0.00 1.31 -0.60 0.35 2.04 -1.48 -2.49 117.51 116.63 3kc2 h ILE 122 Ca -0.00 -2.16 -0.04 0.00 1.00 0.00 0.00 64.86 63.66 3kc2 h ILE 122 Cb 0.49 2.20 -0.03 0.00 -0.74 0.00 0.00 36.82 38.74 3kc2 h ILE 122 CO 0.03 0.67 0.24 0.58 0.00 0.00 0.00 178.15 179.67 3kc2 h VAL 123 N 0.41 1.23 -0.33 1.67 2.07 -1.43 -1.86 116.25 118.02 3kc2 h VAL 123 Ca -0.08 -0.73 0.04 0.00 0.82 0.00 0.00 66.70 66.75 3kc2 h VAL 123 Cb 1.52 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 3kc2 h VAL 123 CO 0.17 0.28 0.10 -0.09 0.02 0.00 0.00 177.57 178.06 3kc2 h ARG 124 N 0.84 0.23 -0.71 1.57 2.43 -1.00 -2.82 114.38 114.92 3kc2 h ARG 124 Ca 0.20 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.36 3kc2 h ARG 124 Cb 0.21 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.67 3kc2 h ARG 124 CO -0.02 0.15 0.47 -0.92 -1.51 0.00 0.00 179.97 178.15 3kc2 h TYR 125 N 0.24 0.89 -1.34 2.20 3.20 -1.17 -3.41 116.97 117.58 3kc2 h TYR 125 Ca 0.15 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.98 3kc2 h TYR 125 Cb 0.13 -0.30 -0.25 0.00 1.54 0.00 0.00 36.73 37.85 3kc2 h TYR 125 CO -0.15 0.56 -0.44 1.21 -1.64 0.00 0.00 178.16 177.70 3kc2 s ASN 126 N -5.84 -0.69 0.58 -2.11 3.84 -0.72 -5.01 114.94 104.99 3kc2 s ASN 126 Ca -0.13 0.03 0.28 0.00 0.21 0.00 0.00 52.86 53.25 3kc2 s ASN 126 Cb 0.14 1.62 1.75 0.00 -0.55 0.00 0.00 41.25 44.21 3kc2 s ASN 126 CO 0.77 -0.32 2.22 0.03 -2.79 0.00 0.00 177.10 177.02 3kc2 h ARG 127 N 8.08 0.00 0.00 0.43 -0.00 -1.75 -1.80 114.38 119.33 3kc2 h ARG 127 Ca -0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.41 3kc2 h ARG 127 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.13 3kc2 h ARG 127 CO 0.21 0.00 0.00 -0.25 0.00 0.00 0.00 179.97 179.93 3kc2 n ASP 128 N -3.91 0.51 0.08 7.04 8.00 -1.26 -1.70 116.55 125.31 3kc2 n ASP 128 Ca -0.02 0.63 0.01 0.00 0.71 0.00 0.00 54.79 56.11 3kc2 n ASP 128 Cb 0.12 -0.73 0.34 0.00 -0.02 0.00 0.00 41.12 40.83 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 -1.68 -3.35 117.51 113.48 3kc2 h ILE 129 Ca 0.00 -0.88 -0.61 0.00 1.00 0.00 0.00 64.86 64.37 3kc2 h ILE 129 Cb 0.34 1.19 -0.41 0.00 -0.74 0.00 0.00 36.82 37.20 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 3.29 0.29 1.87 0.00 -0.69 -4.87 120.51 117.92 3kc2 n ALA 130 Ca -0.00 -4.12 0.16 0.00 0.00 0.00 0.00 53.44 49.47 3kc2 n ALA 130 Cb 0.29 -0.93 0.87 0.00 0.00 0.00 0.00 19.45 19.67 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 5.29 0.00 -0.38 0.00 0.13 -1.71 -1.89 132.00 133.44 3kc2 h PRO 131 Ca 0.18 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.28 3kc2 h PRO 131 Cb 0.79 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.90 3kc2 h PRO 131 CO 0.62 0.06 0.02 1.19 -0.23 0.00 0.00 178.00 179.66 3kc2 n PHE 132 N -3.49 1.35 -1.76 1.56 3.72 -1.26 -4.98 117.46 112.60 3kc2 n PHE 132 Ca -0.02 -0.93 -0.41 0.00 -0.05 0.00 0.00 57.45 56.04 3kc2 n PHE 132 Cb 0.18 -0.41 -0.01 0.00 -0.94 0.00 0.00 39.48 38.31 3kc2 n PHE 132 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3kc2 n SER 133 N -0.28 3.81 -0.95 4.37 2.88 -0.71 -4.50 113.62 118.24 3kc2 n SER 133 Ca 0.25 1.19 0.11 0.00 -1.33 0.00 0.00 58.87 59.09 3kc2 n SER 133 Cb 1.02 -1.61 0.27 0.00 -0.75 0.00 0.00 64.21 63.14 3kc2 n SER 133 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kc2 n GLY 134 N 1.26 1.27 3.70 0.46 0.00 -1.26 -4.97 105.19 105.64 3kc2 n GLY 134 Ca 0.05 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 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 -1.39 4.36 0.79 0.99 1.43 -1.26 -5.00 118.68 118.61 3kc2 s LEU 135 Ca 0.36 2.48 -0.11 0.00 -1.03 0.00 0.00 54.13 55.83 3kc2 s LEU 135 Cb 0.20 -3.57 0.07 0.00 0.03 0.00 0.00 46.19 42.92 3kc2 s LEU 135 CO 0.28 -0.84 1.09 -0.94 0.23 0.00 0.00 176.35 176.17 3kc2 s SER 136 N 1.98 4.47 0.27 2.29 1.04 -1.26 -4.81 113.70 117.69 3kc2 s SER 136 Ca 0.72 1.48 -0.00 0.00 0.48 0.00 0.00 55.95 58.63 3kc2 s SER 136 Cb -0.40 -2.23 0.52 0.00 0.10 0.00 0.00 66.02 64.00 3kc2 s SER 136 CO 0.31 -2.00 1.83 0.44 0.98 0.00 0.00 173.24 174.80 3kc2 h ASP 137 N -1.11 0.87 -0.73 7.02 3.32 -2.00 -0.25 116.42 123.55 3kc2 h ASP 137 Ca -0.46 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 56.57 3kc2 h ASP 137 Cb 1.25 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.65 3kc2 h ASP 137 CO 0.57 0.47 0.20 -0.33 -1.72 0.00 0.00 179.24 178.43 3kc2 h GLU 138 N 0.95 1.15 -0.51 3.56 5.08 -2.02 -2.91 114.58 119.88 3kc2 h GLU 138 Ca 0.47 -0.26 -0.09 0.00 -1.00 0.00 0.00 59.36 58.48 3kc2 h GLU 138 Cb 0.46 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3kc2 h GLU 138 CO -0.26 0.99 -0.03 1.96 -1.00 0.00 0.00 179.01 180.67 3kc2 h GLN 139 N 1.10 0.92 -0.49 2.33 4.20 -1.64 -1.51 115.11 120.01 3kc2 h GLN 139 Ca 0.23 -0.31 0.00 0.00 0.06 0.00 0.00 58.65 58.63 3kc2 h GLN 139 Cb 0.34 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3kc2 h GLN 139 CO -0.00 0.96 0.00 0.28 -0.67 0.00 0.00 178.83 179.40 3kc2 n VAL 140 N -4.28 0.00 0.00 -0.54 0.31 -0.20 -0.78 118.33 112.84 3kc2 n VAL 140 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 3kc2 n VAL 140 Cb 0.34 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.16 3kc2 n VAL 140 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3kc2 n GLU 142 N 0.53 0.00 0.06 5.55 1.02 -0.57 -2.02 120.64 125.22 3kc2 n GLU 142 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 3kc2 n GLU 142 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.29 3kc2 n GLU 142 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3kc2 h TYR 143 N 0.00 0.26 -1.76 -0.32 0.05 -1.22 -3.47 116.97 110.51 3kc2 h TYR 143 Ca 0.00 -0.19 -0.49 0.00 0.05 0.00 0.00 58.73 58.10 3kc2 h TYR 143 Cb 0.00 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 37.70 3kc2 h TYR 143 CO 0.00 1.18 -0.42 -1.54 -1.05 0.00 0.00 178.16 176.34 3kc2 s SER 144 N -6.83 5.30 0.12 3.88 1.04 -0.86 -4.91 113.70 111.45 3kc2 s SER 144 Ca -0.04 -0.52 0.06 0.00 0.48 0.00 0.00 55.95 55.92 3kc2 s SER 144 Cb 0.08 -0.89 -0.04 0.00 0.10 0.00 0.00 66.02 65.27 3kc2 s SER 144 CO 0.85 -0.44 -0.13 -0.13 0.98 0.00 0.00 173.24 174.36 3kc2 s ARG 145 N -4.05 1.01 -0.03 4.02 0.52 -1.26 -5.00 118.95 114.15 3kc2 s ARG 145 Ca 0.43 -1.24 -0.30 0.00 -0.52 0.00 0.00 55.73 54.10 3kc2 s ARG 145 Cb -0.06 -0.85 -0.03 0.00 0.52 0.00 0.00 34.95 34.54 3kc2 s ARG 145 CO 0.27 0.16 1.11 0.34 0.02 0.00 0.00 175.30 177.20 3kc2 s ASP 146 N -2.49 7.17 -0.33 0.23 2.15 -1.26 -4.71 116.67 117.43 3kc2 s ASP 146 Ca 0.09 1.76 0.02 0.00 0.43 0.00 0.00 52.55 54.85 3kc2 s ASP 146 Cb -0.04 -2.56 0.09 0.00 -0.30 0.00 0.00 42.92 40.10 3kc2 s ASP 146 CO 0.03 -0.45 0.04 -0.63 -0.17 0.00 0.00 175.17 173.98 3kc2 s ILE 147 N 1.64 2.49 0.01 4.11 -1.09 -1.26 -5.01 121.20 122.08 3kc2 s ILE 147 Ca 0.54 -2.08 0.32 0.00 -2.23 0.00 0.00 60.65 57.20 3kc2 s ILE 147 Cb -0.23 -2.71 0.37 0.00 -1.58 0.00 0.00 42.46 38.31 3kc2 s ILE 147 CO 0.24 -0.46 1.94 1.55 -1.23 0.00 0.00 174.94 176.98 3kc2 h PRO 148 N 7.75 0.00 -0.33 2.79 0.13 -2.03 -2.54 132.00 137.78 3kc2 h PRO 148 Ca -0.10 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.83 3kc2 h PRO 148 Cb 1.03 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.03 3kc2 h PRO 148 CO 0.54 0.00 -0.27 -0.40 -0.23 0.00 0.00 178.00 177.63 3kc2 n ASP 149 N -2.98 2.76 -0.19 1.44 5.75 -1.26 -4.74 116.55 117.33 3kc2 n ASP 149 Ca 0.01 -3.83 0.05 0.00 -0.01 0.00 0.00 54.79 51.01 3kc2 n ASP 149 Cb 0.30 -0.58 0.32 0.00 -1.03 0.00 0.00 41.12 40.14 3kc2 n ASP 149 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 3kc2 h LEU 150 N 1.20 0.72 -0.14 -2.12 5.85 -1.79 -2.46 115.31 116.57 3kc2 h LEU 150 Ca 0.19 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.91 3kc2 h LEU 150 Cb 1.41 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.29 3kc2 h LEU 150 CO 0.37 0.48 -0.89 0.35 -0.34 0.00 0.00 178.44 178.41 3kc2 n THR 151 N -4.47 0.00 0.05 1.05 -2.24 -1.26 -4.46 114.28 102.95 3kc2 n THR 151 Ca 0.10 -0.04 0.05 0.00 -2.27 0.00 0.00 64.05 61.89 3kc2 n THR 151 Cb 0.18 0.98 -0.07 0.00 -2.10 0.00 0.00 70.33 69.32 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 -1.30 0.00 -4.40 4.28 -2.24 -1.14 -4.63 114.28 104.86 3kc2 n THR 152 Ca 0.05 -0.22 -0.34 0.00 -2.27 0.00 0.00 64.05 61.27 3kc2 n THR 152 Cb 0.35 0.38 -0.12 0.00 -2.10 0.00 0.00 70.33 68.84 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 -2.55 3.65 0.56 -0.78 2.20 -0.94 -5.09 119.74 116.78 3kc2 s LYS 153 Ca -0.03 -0.51 -0.19 0.00 -0.36 0.00 0.00 55.97 54.88 3kc2 s LYS 153 Cb 0.06 -2.91 -0.05 0.00 -1.51 0.00 0.00 37.83 33.42 3kc2 s LYS 153 CO 0.39 0.27 1.12 -1.59 -0.36 0.00 0.00 175.35 175.18 3kc2 s LYS 154 N 0.30 3.29 0.24 4.03 -2.85 -1.26 -4.79 119.74 118.70 3kc2 s LYS 154 Ca -0.03 1.58 -0.25 0.00 -1.00 0.00 0.00 55.97 56.27 3kc2 s LYS 154 Cb -0.14 -2.00 -0.09 0.00 -2.06 0.00 0.00 37.83 33.54 3kc2 s LYS 154 CO 0.03 -0.89 0.84 -0.06 0.10 0.00 0.00 175.35 175.36 3kc2 s PHE 155 N -1.85 3.78 -0.04 1.78 0.08 -0.22 -4.67 117.98 116.84 3kc2 s PHE 155 Ca 0.72 1.65 0.18 0.00 0.12 0.00 0.00 56.93 59.60 3kc2 s PHE 155 Cb -0.23 -2.80 -0.28 0.00 -0.57 0.00 0.00 43.02 39.13 3kc2 s PHE 155 CO 0.29 0.36 0.41 -0.25 -0.10 0.00 0.00 175.22 175.93 3kc2 n ASP 156 N 1.01 0.85 -3.52 1.36 8.00 0.18 -4.43 116.55 120.02 3kc2 n ASP 156 Ca -0.02 -0.02 -0.09 0.00 0.71 0.00 0.00 54.79 55.37 3kc2 n ASP 156 Cb 0.50 1.81 -0.03 0.00 -0.02 0.00 0.00 41.12 43.38 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 -3.25 -1.84 -0.20 2.24 0.00 -1.16 -4.06 121.76 113.50 3kc2 s ALA 157 Ca -0.06 1.12 -0.05 0.00 0.00 0.00 0.00 51.96 52.96 3kc2 s ALA 157 Cb 0.12 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 3kc2 s ALA 157 CO 0.75 -0.61 0.01 0.08 0.00 0.00 0.00 175.76 175.99 3kc2 s VAL 158 N -2.69 4.01 -0.20 0.00 1.01 0.14 -1.17 120.40 121.49 3kc2 s VAL 158 Ca 0.03 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.73 3kc2 s VAL 158 Cb -0.01 -2.82 0.04 0.00 0.00 0.00 0.00 36.38 33.59 3kc2 s VAL 158 CO -0.06 0.42 -0.14 -0.76 0.00 0.00 0.00 175.10 174.56 3kc2 s LEU 159 N 1.00 2.42 -0.41 3.92 1.02 0.20 -0.72 118.68 126.12 3kc2 s LEU 159 Ca 0.02 -0.87 -0.21 0.00 0.02 0.00 0.00 54.13 53.08 3kc2 s LEU 159 Cb -0.14 -1.39 0.02 0.00 0.02 0.00 0.00 46.19 44.69 3kc2 s LEU 159 CO 0.02 -0.09 0.69 -0.69 0.02 0.00 0.00 176.35 176.29 3kc2 s VAL 160 N 1.30 4.80 -0.06 -1.59 1.01 -0.15 -1.26 120.40 124.44 3kc2 s VAL 160 Ca -0.00 0.42 -0.19 0.00 0.00 0.00 0.00 61.98 62.21 3kc2 s VAL 160 Cb -0.16 -4.19 -0.30 0.00 0.00 0.00 0.00 36.38 31.73 3kc2 s VAL 160 CO -0.10 -0.52 0.78 -0.26 0.00 0.00 0.00 175.10 175.01 3kc2 h PHE 161 N 8.73 0.55 -2.75 5.22 -1.00 -0.94 -3.16 116.94 123.60 3kc2 h PHE 161 Ca -0.25 -0.40 -0.06 0.00 2.81 0.00 0.00 57.97 60.07 3kc2 h PHE 161 Cb 1.10 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.63 3kc2 h PHE 161 CO 0.76 1.42 0.09 0.27 -1.61 0.00 0.00 178.31 179.24 3kc2 n ASN 162 N -4.02 -1.18 -4.65 2.17 6.94 -1.21 -4.20 115.26 109.11 3kc2 n ASN 162 Ca -0.18 -1.98 -0.43 0.00 -0.02 0.00 0.00 54.58 51.98 3kc2 n ASN 162 Cb 0.88 2.01 -0.02 0.00 -2.36 0.00 0.00 39.78 40.28 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 -2.22 6.76 0.85 0.53 1.01 -1.26 -4.16 116.67 118.19 3kc2 s ASP 163 Ca 0.11 1.79 -0.12 0.00 0.71 0.00 0.00 52.55 55.05 3kc2 s ASP 163 Cb -0.02 -2.54 0.10 0.00 1.01 0.00 0.00 42.92 41.48 3kc2 s ASP 163 CO 0.08 -0.91 1.11 -2.16 0.21 0.00 0.00 175.17 173.50 3kc2 s PRO 164 N 3.88 1.62 -0.34 8.23 0.04 -1.26 -3.97 135.00 143.20 3kc2 s PRO 164 Ca 0.63 0.56 0.07 0.00 0.04 0.00 0.00 61.00 62.29 3kc2 s PRO 164 Cb -0.25 -1.87 0.47 0.00 0.04 0.00 0.00 34.50 32.89 3kc2 s PRO 164 CO 0.22 -1.93 1.40 0.72 0.04 0.00 0.00 177.00 177.45 3kc2 n HIS 165 N -3.63 1.99 -2.83 0.56 8.25 -1.26 -4.73 115.22 113.56 3kc2 n HIS 165 Ca 0.07 -2.07 -0.11 0.00 -0.26 0.00 0.00 57.72 55.35 3kc2 n HIS 165 Cb 0.57 -0.54 0.05 0.00 1.12 0.00 0.00 29.99 31.20 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 -0.92 -1.83 0.21 0.41 2.03 -1.26 -5.00 116.55 110.19 3kc2 n ASP 166 Ca 0.41 -3.46 0.06 0.00 0.52 0.00 0.00 54.79 52.31 3kc2 n ASP 166 Cb 0.91 1.38 0.55 0.00 -0.72 0.00 0.00 41.12 43.24 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 3.26 0.06 -0.47 -0.67 4.06 -1.94 -0.32 115.95 119.94 3kc2 h TRP 167 Ca -0.07 -0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.81 3kc2 h TRP 167 Cb 1.05 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 29.17 3kc2 h TRP 167 CO 0.29 0.13 0.03 0.00 -3.56 0.00 0.00 178.44 175.32 3kc2 h ALA 168 N 1.88 1.17 -0.04 1.49 0.00 -1.97 0.30 119.26 122.09 3kc2 h ALA 168 Ca 0.01 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 3kc2 h ALA 168 Cb 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3kc2 h ALA 168 CO 0.01 0.54 -0.16 0.00 0.00 0.00 0.00 179.25 179.64 3kc2 h ALA 169 N 1.32 0.07 -0.46 0.00 0.00 -1.34 -2.90 119.26 115.95 3kc2 h ALA 169 Ca 0.15 -0.38 0.05 0.00 0.00 0.00 0.00 54.91 54.73 3kc2 h ALA 169 Cb 0.39 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 3kc2 h ALA 169 CO 0.01 0.01 0.20 -0.44 0.00 0.00 0.00 179.25 179.03 3kc2 h ASP 170 N -0.38 0.25 -0.35 0.00 3.32 -1.04 -0.42 116.42 117.80 3kc2 h ASP 170 Ca -0.01 0.04 -0.16 0.00 0.02 0.00 0.00 57.03 56.92 3kc2 h ASP 170 Cb 0.80 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 3kc2 h ASP 170 CO 0.03 0.18 -0.42 0.40 -1.72 0.00 0.00 179.24 177.72 3kc2 h ILE 171 N 0.40 1.27 -0.54 0.35 2.04 -1.06 -0.53 117.51 119.45 3kc2 h ILE 171 Ca 0.21 -1.59 -0.01 0.00 1.00 0.00 0.00 64.86 64.46 3kc2 h ILE 171 Cb 0.16 1.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 3kc2 h ILE 171 CO -0.18 0.53 0.29 -0.61 0.00 0.00 0.00 178.15 178.18 3kc2 h GLN 172 N 0.74 0.75 -0.20 2.37 5.75 -1.28 -0.47 115.11 122.77 3kc2 h GLN 172 Ca 0.05 -0.09 -0.18 0.00 -0.15 0.00 0.00 58.65 58.28 3kc2 h GLN 172 Cb 1.01 -0.15 0.01 0.00 1.07 0.00 0.00 27.48 29.42 3kc2 h GLN 172 CO 0.10 0.59 -0.59 0.82 -2.65 0.00 0.00 178.83 177.10 3kc2 h ILE 173 N 0.72 1.30 -0.09 2.39 2.04 -0.95 -0.70 117.51 122.22 3kc2 h ILE 173 Ca 0.19 -1.81 0.01 0.00 1.00 0.00 0.00 64.86 64.25 3kc2 h ILE 173 Cb 0.06 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 3kc2 h ILE 173 CO -0.03 0.57 0.01 0.40 0.00 0.00 0.00 178.15 179.11 3kc2 h ILE 174 N 0.47 0.96 -0.94 -0.67 2.04 -1.05 -2.26 117.51 116.06 3kc2 h ILE 174 Ca -0.02 -0.02 0.07 0.00 1.00 0.00 0.00 64.86 65.89 3kc2 h ILE 174 Cb 1.21 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 38.13 3kc2 h ILE 174 CO 0.13 0.01 0.61 -1.28 0.00 0.00 0.00 178.15 177.62 3kc2 h SER 175 N 0.05 0.94 -0.45 1.72 0.87 -0.86 -1.46 113.55 114.37 3kc2 h SER 175 Ca 0.04 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3kc2 h SER 175 Cb 0.03 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 3kc2 h SER 175 CO -0.05 0.60 0.28 0.44 -0.53 0.00 0.00 176.83 177.56 3kc2 h ASP 176 N 1.06 0.53 -0.21 6.23 3.32 -0.86 -2.06 116.42 124.43 3kc2 h ASP 176 Ca 0.41 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.41 3kc2 h ASP 176 Cb 0.22 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3kc2 h ASP 176 CO -0.16 0.41 0.09 0.00 -1.72 0.00 0.00 179.24 177.86 3kc2 h ALA 177 N 1.14 0.28 -0.00 3.45 0.00 -0.77 -1.65 119.26 121.71 3kc2 h ALA 177 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3kc2 h ALA 177 Cb -0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3kc2 h ALA 177 CO -0.03 -0.14 -0.03 0.44 0.00 0.00 0.00 179.25 179.49 3kc2 n ILE 178 N -4.83 0.00 -0.04 0.00 -5.35 -0.63 -2.68 119.36 105.84 3kc2 n ILE 178 Ca -0.04 -0.04 0.02 0.00 -0.27 0.00 0.00 62.75 62.42 3kc2 n ILE 178 Cb 0.12 -0.28 0.05 0.00 -1.74 0.00 0.00 39.64 37.78 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 -0.91 2.20 -4.32 7.28 4.13 -0.79 -1.19 115.26 121.66 3kc2 n ASN 179 Ca 0.19 -1.91 -0.29 0.00 1.68 0.00 0.00 54.58 54.24 3kc2 n ASN 179 Cb 0.21 -0.07 0.18 0.00 -1.54 0.00 0.00 39.78 38.56 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 -0.93 2.63 -0.72 6.41 1.04 -0.63 -0.86 113.70 120.65 3kc2 s SER 180 Ca 0.07 0.68 -0.23 0.00 0.48 0.00 0.00 55.95 56.95 3kc2 s SER 180 Cb 0.04 -1.01 0.06 0.00 0.10 0.00 0.00 66.02 65.21 3kc2 s SER 180 CO 0.05 -3.07 1.08 -1.61 0.98 0.00 0.00 173.24 170.67 3kc2 s GLU 181 N -5.48 3.19 -1.38 4.02 0.41 -1.26 -3.99 118.70 114.20 3kc2 s GLU 181 Ca 0.69 -0.78 -0.07 0.00 -0.41 0.00 0.00 54.97 54.39 3kc2 s GLU 181 Cb -0.10 -4.33 0.04 0.00 -1.78 0.00 0.00 34.13 27.96 3kc2 s GLU 181 CO 0.54 -1.91 0.50 -1.71 -0.49 0.00 0.00 175.26 172.19 3kc2 n ASN 182 N 8.06 -4.70 -1.17 -0.19 4.05 -1.26 -4.91 115.26 115.15 3kc2 n ASN 182 Ca 0.02 -0.31 0.00 0.00 0.45 0.00 0.00 54.58 54.74 3kc2 n ASN 182 Cb 0.47 -3.84 0.00 0.00 1.23 0.00 0.00 39.78 37.63 3kc2 n ASN 182 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3kc2 n GLY 183 N -1.29 -2.25 3.53 8.20 0.00 -1.26 -4.61 105.19 107.51 3kc2 n GLY 183 Ca -0.06 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.27 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 2.85 -1.37 0.99 2.96 -1.26 -1.06 118.68 121.79 3kc2 s LEU 185 Ca 0.00 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 53.35 3kc2 s LEU 185 Cb 0.00 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 45.07 3kc2 s LEU 185 CO 0.00 0.15 0.00 0.59 -1.32 0.00 0.00 176.35 175.77 3kc2 n ASN 186 N 0.46 -4.61 -4.25 3.68 3.02 -1.26 -4.98 115.26 107.32 3kc2 n ASN 186 Ca -0.13 0.09 -0.16 0.00 -0.03 0.00 0.00 54.58 54.34 3kc2 n ASN 186 Cb 0.54 -3.66 -0.11 0.00 -0.61 0.00 0.00 39.78 35.94 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 -2.70 1.29 -0.07 3.41 -4.23 -1.26 -5.08 115.64 107.01 3kc2 s THR 187 Ca 0.00 -1.88 -0.03 0.00 -1.18 0.00 0.00 61.69 58.60 3kc2 s THR 187 Cb 0.00 -1.67 0.04 0.00 1.34 0.00 0.00 72.50 72.21 3kc2 s THR 187 CO 0.00 -0.56 0.12 -0.22 -0.54 0.00 0.00 174.62 173.42 3kc2 s LEU 188 N -2.78 0.09 0.72 4.79 2.96 -1.26 -4.16 118.68 119.04 3kc2 s LEU 188 Ca 0.13 0.24 -0.12 0.00 -0.22 0.00 0.00 54.13 54.16 3kc2 s LEU 188 Cb -0.02 0.13 0.03 0.00 0.50 0.00 0.00 46.19 46.83 3kc2 s LEU 188 CO 0.02 -0.24 1.09 0.00 -1.32 0.00 0.00 176.35 175.90 3kc2 s ARG 189 N 2.13 2.58 0.08 1.98 1.70 -0.04 -4.70 118.95 122.67 3kc2 s ARG 189 Ca 0.02 1.17 0.15 0.00 -0.47 0.00 0.00 55.73 56.61 3kc2 s ARG 189 Cb -0.12 -1.94 -0.13 0.00 -0.57 0.00 0.00 34.95 32.20 3kc2 s ARG 189 CO -0.05 -1.39 0.90 -0.91 -1.08 0.00 0.00 175.30 172.77 3kc2 h ASN 190 N -0.70 0.00 -3.57 -2.89 2.35 -1.94 -3.47 115.58 105.35 3kc2 h ASN 190 Ca -0.44 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 54.79 3kc2 h ASN 190 Cb 1.23 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.58 3kc2 h ASN 190 CO 0.53 0.65 0.38 -1.61 -1.65 0.00 0.00 177.43 175.73 3kc2 s GLU 191 N -2.87 4.69 -0.07 0.81 8.01 -1.26 -5.03 118.70 122.98 3kc2 s GLU 191 Ca -0.02 1.49 -0.12 0.00 0.01 0.00 0.00 54.97 56.33 3kc2 s GLU 191 Cb 0.08 -3.36 -0.05 0.00 -4.31 0.00 0.00 34.13 26.49 3kc2 s GLU 191 CO 0.81 0.21 0.30 0.15 0.01 0.00 0.00 175.26 176.73 3kc2 s LYS 192 N -0.08 3.82 -0.02 1.61 1.02 -1.26 -5.08 119.74 119.75 3kc2 s LYS 192 Ca 0.47 0.18 -0.29 0.00 0.02 0.00 0.00 55.97 56.35 3kc2 s LYS 192 Cb -0.24 -3.25 0.08 0.00 -0.52 0.00 0.00 37.83 33.90 3kc2 s LYS 192 CO 0.30 0.64 0.71 0.45 -0.92 0.00 0.00 175.35 176.54 3kc2 s SER 193 N -0.78 -0.59 0.51 2.83 0.15 -1.26 -5.02 113.70 109.54 3kc2 s SER 193 Ca 0.20 0.50 0.30 0.00 0.70 0.00 0.00 55.95 57.64 3kc2 s SER 193 Cb -0.14 0.52 1.06 0.00 -1.71 0.00 0.00 66.02 65.74 3kc2 s SER 193 CO 0.09 -0.65 1.87 1.23 1.20 0.00 0.00 173.24 176.97 3kc2 h GLY 194 N 2.69 0.00 -6.36 9.45 0.00 -1.83 -3.44 103.07 103.58 3kc2 h GLY 194 Ca -0.27 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.45 3kc2 h GLY 194 CO 0.37 0.00 0.23 1.25 0.00 0.00 0.00 176.54 178.40 3kc2 s LYS 195 N -3.52 4.07 0.83 4.80 2.20 -1.26 -0.98 119.74 125.88 3kc2 s LYS 195 Ca 0.03 0.57 -0.11 0.00 -0.36 0.00 0.00 55.97 56.11 3kc2 s LYS 195 Cb 0.08 -3.67 0.09 0.00 -1.51 0.00 0.00 37.83 32.82 3kc2 s LYS 195 CO 0.58 -0.48 1.10 -1.25 -0.36 0.00 0.00 175.35 174.93 3kc2 s PRO 196 N 2.62 1.78 0.34 4.03 0.04 -1.26 -4.91 135.00 137.63 3kc2 s PRO 196 Ca 0.28 1.18 0.02 0.00 0.04 0.00 0.00 61.00 62.52 3kc2 s PRO 196 Cb -0.15 -1.84 0.60 0.00 0.04 0.00 0.00 34.50 33.15 3kc2 s PRO 196 CO 0.09 -1.98 1.99 0.77 0.04 0.00 0.00 177.00 177.91 3kc2 h SER 197 N -1.38 0.78 -4.43 6.66 0.02 -1.39 -3.42 113.55 110.38 3kc2 h SER 197 Ca -0.45 -0.02 -0.26 0.00 -0.84 0.00 0.00 61.79 60.22 3kc2 h SER 197 Cb 1.25 -0.19 -0.16 0.00 0.14 0.00 0.00 62.40 63.45 3kc2 h SER 197 CO 0.50 0.55 -0.71 0.27 -1.14 0.00 0.00 176.83 176.30 3kc2 s ILE 198 N -5.77 0.83 0.56 3.27 -4.36 -1.26 -4.57 121.20 109.91 3kc2 s ILE 198 Ca -0.10 -1.87 -0.19 0.00 -0.26 0.00 0.00 60.65 58.22 3kc2 s ILE 198 Cb 0.18 -1.61 -0.05 0.00 1.25 0.00 0.00 42.46 42.23 3kc2 s ILE 198 CO 0.77 -0.77 1.16 -2.84 0.24 0.00 0.00 174.94 173.50 3kc2 s PRO 199 N -3.53 3.20 -0.04 0.37 0.02 -1.26 -4.79 135.00 128.96 3kc2 s PRO 199 Ca 0.11 1.69 0.02 0.00 0.02 0.00 0.00 61.00 62.84 3kc2 s PRO 199 Cb 0.03 -1.97 0.01 0.00 0.02 0.00 0.00 34.50 32.58 3kc2 s PRO 199 CO -0.03 -0.99 -0.09 -1.50 -0.33 0.00 0.00 177.00 174.06 3kc2 s ILE 200 N -1.72 0.87 -0.08 2.83 2.07 -1.26 -0.68 121.20 123.23 3kc2 s ILE 200 Ca 0.74 -0.37 0.04 0.00 -1.41 0.00 0.00 60.65 59.66 3kc2 s ILE 200 Cb -0.26 -0.80 -0.01 0.00 0.13 0.00 0.00 42.46 41.51 3kc2 s ILE 200 CO 0.30 0.28 -0.20 -0.31 -1.91 0.00 0.00 174.94 173.10 3kc2 s TYR 201 N 0.48 2.60 -0.08 3.50 1.51 0.11 -0.51 117.35 124.96 3kc2 s TYR 201 Ca -0.09 -0.63 0.01 0.00 -1.01 0.00 0.00 57.07 55.35 3kc2 s TYR 201 Cb -0.12 -1.68 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 3kc2 s TYR 201 CO 0.02 -0.16 -0.10 -0.06 -1.11 0.00 0.00 175.55 174.14 3kc2 s PHE 202 N -0.08 2.86 -2.75 2.71 0.08 -0.23 -0.98 117.98 119.59 3kc2 s PHE 202 Ca -0.04 -0.18 0.22 0.00 0.12 0.00 0.00 56.93 57.05 3kc2 s PHE 202 Cb -0.14 -1.74 0.19 0.00 -0.57 0.00 0.00 43.02 40.76 3kc2 s PHE 202 CO 0.04 0.16 1.22 -1.13 -0.10 0.00 0.00 175.22 175.41 3kc2 n SER 203 N 2.62 2.89 -3.58 1.36 3.41 -1.19 -0.60 113.62 118.53 3kc2 n SER 203 Ca -0.18 -1.93 -0.02 0.00 -0.26 0.00 0.00 58.87 56.48 3kc2 n SER 203 Cb 0.53 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.41 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 -1.83 -1.00 -0.19 4.04 2.47 -1.21 -3.09 114.94 114.14 3kc2 s ASN 204 Ca 0.27 1.37 0.14 0.00 0.42 0.00 0.00 52.86 55.06 3kc2 s ASN 204 Cb 0.19 2.11 0.75 0.00 -1.45 0.00 0.00 41.25 42.85 3kc2 s ASN 204 CO 0.28 -0.23 1.65 0.00 -3.72 0.00 0.00 177.10 175.09 3kc2 n GLN 205 N 5.44 4.39 -1.99 0.43 6.02 -1.26 -2.52 117.38 127.89 3kc2 n GLN 205 Ca -0.10 -2.91 -0.42 0.00 -0.01 0.00 0.00 57.00 53.56 3kc2 n GLN 205 Cb 0.49 -2.13 -0.03 0.00 1.02 0.00 0.00 30.24 29.60 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 -0.77 6.50 0.16 1.08 1.11 -1.26 -4.14 116.67 119.35 3kc2 s ASP 206 Ca 0.51 2.07 -0.10 0.00 0.18 0.00 0.00 52.55 55.20 3kc2 s ASP 206 Cb 0.37 -2.53 0.03 0.00 1.07 0.00 0.00 42.92 41.86 3kc2 s ASP 206 CO 0.17 -1.09 1.59 0.25 1.18 0.00 0.00 175.17 177.27 3kc2 h LEU 207 N 10.97 1.00 -8.56 1.23 5.85 -1.87 0.12 115.31 124.05 3kc2 h LEU 207 Ca -0.38 -0.34 -0.45 0.00 0.84 0.00 0.00 57.88 57.54 3kc2 h LEU 207 Cb 1.18 -0.27 -0.20 0.00 0.37 0.00 0.00 40.66 41.74 3kc2 h LEU 207 CO 0.97 1.10 -0.78 -0.76 -0.34 0.00 0.00 178.44 178.63 3kc2 s LEU 208 N -9.26 2.33 0.21 2.25 1.43 -1.26 -1.11 118.68 113.28 3kc2 s LEU 208 Ca -0.12 -0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 52.15 3kc2 s LEU 208 Cb 0.13 -0.63 -0.00 0.00 0.03 0.00 0.00 46.19 45.72 3kc2 s LEU 208 CO 0.85 -0.07 0.41 -1.66 0.23 0.00 0.00 176.35 176.12 3kc2 s TRP 209 N -1.57 0.32 -0.28 0.29 1.48 0.38 -4.74 118.94 114.81 3kc2 s TRP 209 Ca 0.04 -0.68 -0.06 0.00 -1.06 0.00 0.00 56.10 54.35 3kc2 s TRP 209 Cb -0.08 0.12 0.01 0.00 -1.16 0.00 0.00 33.47 32.36 3kc2 s TRP 209 CO 0.03 -0.89 0.06 0.00 -4.06 0.00 0.00 176.95 172.10 3kc2 s ALA 210 N -3.98 3.03 0.00 2.67 0.00 -1.26 -1.42 121.76 120.80 3kc2 s ALA 210 Ca 0.19 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.74 3kc2 s ALA 210 Cb 0.01 -2.09 0.00 0.00 0.00 0.00 0.00 23.12 21.04 3kc2 s ALA 210 CO 0.04 -0.85 0.00 0.27 0.00 0.00 0.00 175.76 175.22 3kc2 n ASN 211 N 4.85 1.43 0.31 0.00 6.94 -1.26 -3.93 115.26 123.60 3kc2 n ASN 211 Ca -0.15 -0.67 0.19 0.00 -0.02 0.00 0.00 54.58 53.93 3kc2 n ASN 211 Cb 0.48 0.00 1.02 0.00 -2.36 0.00 0.00 39.78 38.93 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 -7.10 -0.53 0.11 -1.96 -3.43 132.00 119.09 3kc2 h PRO 212 Ca 0.00 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.60 3kc2 h PRO 212 Cb 0.00 0.00 0.09 0.00 0.11 0.00 0.00 31.00 31.20 3kc2 h PRO 212 CO 0.00 0.02 0.44 -0.47 -0.21 0.00 0.00 178.00 177.78 3kc2 s TYR 213 N -4.20 2.57 0.13 0.65 5.04 -1.26 -4.93 117.35 115.34 3kc2 s TYR 213 Ca -0.04 1.54 0.32 0.00 -2.44 0.00 0.00 57.07 56.45 3kc2 s TYR 213 Cb 0.13 -3.35 1.33 0.00 0.35 0.00 0.00 41.96 40.43 3kc2 s TYR 213 CO 0.48 -1.81 1.98 1.57 -1.34 0.00 0.00 175.55 176.43 3kc2 h LYS 214 N 1.00 0.00 -5.99 4.97 2.10 -2.03 -3.43 116.57 113.19 3kc2 h LYS 214 Ca -0.50 0.00 -0.68 0.00 -2.00 0.00 0.00 60.65 57.47 3kc2 h LYS 214 Cb 1.27 0.00 -0.15 0.00 -0.90 0.00 0.00 32.23 32.46 3kc2 h LYS 214 CO 0.56 0.03 -0.62 -0.51 -2.00 0.00 0.00 179.45 176.91 3kc2 s LEU 215 N -6.29 3.58 0.32 7.07 1.43 -1.26 -5.09 118.68 118.45 3kc2 s LEU 215 Ca 0.01 0.13 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 3kc2 s LEU 215 Cb 0.09 -1.85 -0.12 0.00 0.03 0.00 0.00 46.19 44.34 3kc2 s LEU 215 CO 0.55 0.37 1.41 0.59 0.23 0.00 0.00 176.35 179.50 3kc2 n ASN 216 N 2.04 3.18 -4.79 2.29 3.02 -1.26 -4.83 115.26 114.91 3kc2 n ASN 216 Ca -0.18 1.19 -0.27 0.00 -0.03 0.00 0.00 54.58 55.29 3kc2 n ASN 216 Cb 0.53 -1.52 -0.06 0.00 -0.61 0.00 0.00 39.78 38.12 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 -1.44 2.87 0.33 3.52 1.81 -0.51 -4.89 118.95 120.64 3kc2 s ARG 217 Ca 0.59 -0.85 -0.29 0.00 -1.72 0.00 0.00 55.73 53.46 3kc2 s ARG 217 Cb -0.55 -2.65 -0.10 0.00 -0.45 0.00 0.00 34.95 31.20 3kc2 s ARG 217 CO 0.58 0.50 1.35 -0.06 -0.68 0.00 0.00 175.30 176.98 3kc2 s PHE 218 N -1.68 2.98 0.00 -0.53 0.08 -1.26 -0.47 117.98 117.10 3kc2 s PHE 218 Ca 0.30 1.34 0.00 0.00 0.12 0.00 0.00 56.93 58.69 3kc2 s PHE 218 Cb -0.10 -3.74 0.00 0.00 -0.57 0.00 0.00 43.02 38.60 3kc2 s PHE 218 CO 0.23 -2.10 0.00 0.41 -0.10 0.00 0.00 175.22 173.66 3kc2 n GLY 219 N 0.92 6.49 0.26 4.36 0.00 -0.27 -4.77 105.19 112.18 3kc2 n GLY 219 Ca 0.01 -2.04 0.12 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.93 1.61 4.15 -1.76 -0.26 115.11 117.91 3kc2 h GLN 220 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.45 3kc2 h GLN 220 Cb 0.00 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 27.64 3kc2 h GLN 220 CO 0.00 0.10 0.61 0.78 -1.93 0.00 0.00 178.83 178.39 3kc2 h GLY 221 N 0.52 1.35 0.89 2.39 0.00 -0.45 0.81 103.07 108.58 3kc2 h GLY 221 Ca -0.00 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 3kc2 h GLY 221 CO 0.01 0.43 0.09 0.00 0.00 0.00 0.00 176.54 177.06 3kc2 h ALA 222 N 1.37 0.32 -0.50 3.60 0.00 -1.10 -1.30 119.26 121.64 3kc2 h ALA 222 Ca 0.36 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.24 3kc2 h ALA 222 Cb -0.05 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.57 3kc2 h ALA 222 CO -0.10 -0.07 0.03 0.35 0.00 0.00 0.00 179.25 179.46 3kc2 h PHE 223 N 0.23 0.03 -0.47 0.00 3.57 -1.16 -1.76 116.94 117.38 3kc2 h PHE 223 Ca 0.08 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.65 3kc2 h PHE 223 Cb 0.21 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 3kc2 h PHE 223 CO -0.00 -0.08 0.24 -0.09 -2.23 0.00 0.00 178.31 176.15 3kc2 h ARG 224 N 0.15 0.47 -0.84 1.11 2.43 -0.68 -1.28 114.38 115.74 3kc2 h ARG 224 Ca 0.25 -0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.50 3kc2 h ARG 224 Cb 0.37 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.76 3kc2 h ARG 224 CO -0.39 0.31 0.55 -0.07 -1.51 0.00 0.00 179.97 178.85 3kc2 h LEU 225 N 0.48 0.70 -0.13 3.80 3.38 -0.45 -0.45 115.31 122.65 3kc2 h LEU 225 Ca 0.20 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.14 3kc2 h LEU 225 Cb 0.10 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3kc2 h LEU 225 CO -0.13 0.41 -0.14 -0.07 0.09 0.00 0.00 178.44 178.59 3kc2 h LEU 226 N 0.77 0.35 -0.57 1.67 3.38 -0.62 -0.89 115.31 119.41 3kc2 h LEU 226 Ca 0.39 -0.49 0.04 0.00 0.09 0.00 0.00 57.88 57.92 3kc2 h LEU 226 Cb 0.48 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 3kc2 h LEU 226 CO -0.16 0.77 0.31 0.58 0.09 0.00 0.00 178.44 180.03 3kc2 h VAL 227 N -0.06 0.99 -0.70 1.22 2.07 -0.89 -2.22 116.25 116.66 3kc2 h VAL 227 Ca 0.02 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 3kc2 h VAL 227 Cb 0.67 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3kc2 h VAL 227 CO 0.03 0.11 0.28 0.03 0.02 0.00 0.00 177.57 178.05 3kc2 h ARG 228 N 0.60 1.03 -0.49 1.57 3.08 -1.03 -1.35 114.38 117.80 3kc2 h ARG 228 Ca 0.24 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 60.07 3kc2 h ARG 228 Cb 0.11 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3kc2 h ARG 228 CO -0.14 0.84 0.09 -0.09 -1.07 0.00 0.00 179.97 179.59 3kc2 h ARG 229 N 1.01 0.80 0.00 0.04 9.65 -0.58 -0.98 114.38 124.32 3kc2 h ARG 229 Ca 0.24 -0.21 -0.15 0.00 -1.10 0.00 0.00 59.98 58.76 3kc2 h ARG 229 Cb 0.19 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.65 3kc2 h ARG 229 CO -0.02 0.80 -0.72 -0.07 2.80 0.00 0.00 179.97 182.76 3kc2 h LEU 230 N 0.67 0.00 -0.39 3.80 3.38 -1.21 -1.65 115.31 119.91 3kc2 h LEU 230 Ca 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3kc2 h LEU 230 Cb 0.38 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3kc2 h LEU 230 CO 0.01 0.72 0.16 0.22 0.09 0.00 0.00 178.44 179.63 3kc2 h TYR 231 N 0.00 0.60 -0.73 1.13 3.20 -0.99 -1.80 116.97 118.38 3kc2 h TYR 231 Ca -0.01 -0.05 0.02 0.00 3.14 0.00 0.00 58.73 61.83 3kc2 h TYR 231 Cb 1.30 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.35 3kc2 h TYR 231 CO 0.00 0.54 0.47 1.25 -1.64 0.00 0.00 178.16 178.78 3kc2 h LEU 232 N 0.49 0.80 -0.71 2.82 5.85 -1.10 -1.37 115.31 122.09 3kc2 h LEU 232 Ca 0.13 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 3kc2 h LEU 232 Cb 0.19 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 3kc2 h LEU 232 CO -0.01 0.57 0.43 -0.08 -0.34 0.00 0.00 178.44 179.02 3kc2 h GLU 233 N 0.95 0.96 -0.00 1.25 4.57 -1.04 0.14 114.58 121.40 3kc2 h GLU 233 Ca 0.28 -0.08 -0.16 0.00 -1.18 0.00 0.00 59.36 58.21 3kc2 h GLU 233 Cb -0.06 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.30 3kc2 h GLU 233 CO -0.08 0.68 -0.78 -0.07 -1.18 0.00 0.00 179.01 177.58 3kc2 h LEU 234 N 0.97 0.02 0.00 1.64 3.38 -1.06 -3.38 115.31 116.88 3kc2 h LEU 234 Ca 0.26 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 3kc2 h LEU 234 Cb -0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3kc2 h LEU 234 CO -0.05 0.79 -1.58 0.59 0.09 0.00 0.00 178.44 178.28 3kc2 n ASN 235 N -3.62 2.23 -0.58 -0.43 3.02 -0.54 -4.98 115.26 110.35 3kc2 n ASN 235 Ca -0.01 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.47 3kc2 n ASN 235 Cb 0.75 1.47 -0.03 0.00 -0.61 0.00 0.00 39.78 41.36 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 1.87 0.87 3.02 7.41 0.00 0.45 -4.37 105.19 114.44 3kc2 n GLY 236 Ca -0.04 -0.20 -0.15 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.34 0.52 0.52 1.61 0.41 -1.26 -5.05 118.70 113.12 3kc2 s GLU 237 Ca 0.00 -0.46 -0.20 0.00 -0.41 0.00 0.00 54.97 53.90 3kc2 s GLU 237 Cb 0.00 -0.43 -0.06 0.00 -1.78 0.00 0.00 34.13 31.86 3kc2 s GLU 237 CO 0.00 0.10 1.15 -1.25 -0.49 0.00 0.00 175.26 174.77 3kc2 s PRO 238 N -0.76 3.44 0.13 0.39 0.04 -1.26 -4.13 135.00 132.84 3kc2 s PRO 238 Ca -0.02 1.69 -0.31 0.00 0.04 0.00 0.00 61.00 62.39 3kc2 s PRO 238 Cb -0.06 -2.12 -0.08 0.00 0.04 0.00 0.00 34.50 32.28 3kc2 s PRO 238 CO 0.00 -0.80 1.42 -1.17 0.04 0.00 0.00 177.00 176.49 3kc2 s LEU 239 N -3.60 4.37 -1.12 -3.56 2.96 -1.26 -4.46 118.68 112.01 3kc2 s LEU 239 Ca 0.71 2.38 -0.15 0.00 -0.22 0.00 0.00 54.13 56.85 3kc2 s LEU 239 Cb -0.26 -3.59 0.17 0.00 0.50 0.00 0.00 46.19 43.01 3kc2 s LEU 239 CO 0.30 -0.68 1.32 -1.10 -1.32 0.00 0.00 176.35 174.87 3kc2 s GLN 240 N 1.05 3.95 0.49 1.98 -0.21 -0.15 -5.00 119.66 121.77 3kc2 s GLN 240 Ca 0.65 -2.39 0.06 0.00 0.02 0.00 0.00 55.36 53.70 3kc2 s GLN 240 Cb -0.38 -4.98 0.03 0.00 1.00 0.00 0.00 33.01 28.68 3kc2 s GLN 240 CO 0.31 -1.73 0.67 0.16 -2.12 0.00 0.00 175.29 172.58 3kc2 s ASP 241 N 2.95 5.43 0.01 5.90 1.47 -1.26 -4.58 116.67 126.59 3kc2 s ASP 241 Ca 0.39 -0.34 0.02 0.00 1.18 0.00 0.00 52.55 53.80 3kc2 s ASP 241 Cb -0.04 -0.60 -0.04 0.00 -0.34 0.00 0.00 42.92 41.91 3kc2 s ASP 241 CO -0.03 -0.98 -0.01 -0.31 0.68 0.00 0.00 175.17 174.51 3kc2 s TYR 242 N -2.54 3.03 -0.05 2.11 2.02 0.33 -5.01 117.35 117.23 3kc2 s TYR 242 Ca 0.57 0.04 0.02 0.00 -0.37 0.00 0.00 57.07 57.33 3kc2 s TYR 242 Cb -0.09 -1.64 0.02 0.00 -0.40 0.00 0.00 41.96 39.84 3kc2 s TYR 242 CO 0.36 0.44 -0.08 0.95 -1.57 0.00 0.00 175.55 175.65 3kc2 s THR 243 N -1.09 0.80 0.03 -0.71 -4.23 -1.26 -1.06 115.64 108.12 3kc2 s THR 243 Ca 0.20 -0.28 0.00 0.00 -1.18 0.00 0.00 61.69 60.43 3kc2 s THR 243 Cb -0.11 -0.77 -0.00 0.00 1.34 0.00 0.00 72.50 72.95 3kc2 s THR 243 CO 0.11 0.28 0.01 0.00 -0.54 0.00 0.00 174.62 174.48 3kc2 n LEU 244 N 3.94 0.00 0.00 4.79 -0.00 0.23 -4.96 117.00 121.00 3kc2 n LEU 244 Ca -0.24 -0.24 0.00 0.00 -0.00 0.00 0.00 56.01 55.53 3kc2 n LEU 244 Cb 0.51 0.07 0.00 0.00 -0.00 0.00 0.00 43.42 44.01 3kc2 n LEU 244 CO 0.24 -0.04 0.00 0.61 -0.00 0.00 0.00 177.39 178.21 3kc2 n GLY 245 N 2.35 0.24 3.69 1.47 0.00 -1.18 -3.29 105.19 108.48 3kc2 n GLY 245 Ca -0.01 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 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 0.36 1.92 -0.36 1.61 5.02 -1.26 -0.52 118.16 124.93 3kc2 n LYS 246 Ca 0.00 0.68 0.06 0.00 -2.02 0.00 0.00 58.31 57.03 3kc2 n LYS 246 Cb 0.00 -2.31 0.22 0.00 -0.02 0.00 0.00 35.03 32.92 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 0.24 2.59 -1.91 1.97 -0.04 -1.26 -4.45 135.00 132.14 3kc2 n PRO 247 Ca 0.06 -1.78 -0.39 0.00 -0.04 0.00 0.00 63.50 61.35 3kc2 n PRO 247 Cb 0.38 -1.60 0.01 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.66 2.33 0.31 0.52 -4.23 0.32 -4.45 115.64 108.78 3kc2 s THR 248 Ca 0.32 0.28 0.02 0.00 -1.18 0.00 0.00 61.69 61.13 3kc2 s THR 248 Cb 0.20 -3.16 0.28 0.00 1.34 0.00 0.00 72.50 71.17 3kc2 s THR 248 CO 0.17 0.03 1.91 0.50 -0.54 0.00 0.00 174.62 176.69 3kc2 h LYS 249 N 2.20 0.95 -0.38 3.99 3.64 -1.94 -2.17 116.57 122.86 3kc2 h LYS 249 Ca -0.50 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 58.87 3kc2 h LYS 249 Cb 1.27 -0.21 -0.05 0.00 -0.41 0.00 0.00 32.23 32.82 3kc2 h LYS 249 CO 0.61 0.63 0.09 1.25 -2.27 0.00 0.00 179.45 179.75 3kc2 h LEU 250 N 0.98 0.04 -0.72 5.20 6.46 -1.92 0.92 115.31 126.27 3kc2 h LEU 250 Ca 0.39 0.06 -0.10 0.00 -0.12 0.00 0.00 57.88 58.10 3kc2 h LEU 250 Cb 0.24 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.22 3kc2 h LEU 250 CO -0.15 0.06 -0.10 0.74 -0.62 0.00 0.00 178.44 178.37 3kc2 h THR 251 N 0.22 1.26 -0.37 1.05 2.02 -1.69 -1.46 112.91 113.94 3kc2 h THR 251 Ca 0.18 -1.20 -0.13 0.00 0.77 0.00 0.00 66.41 66.03 3kc2 h THR 251 Cb 0.20 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 3kc2 h THR 251 CO -0.22 0.42 -0.30 1.88 0.37 0.00 0.00 175.52 177.66 3kc2 h TYR 252 N 0.79 0.93 -0.66 3.16 -1.99 -0.89 0.36 116.97 118.67 3kc2 h TYR 252 Ca 0.13 -0.24 -0.04 0.00 2.00 0.00 0.00 58.73 60.58 3kc2 h TYR 252 Cb 0.61 -0.21 -0.03 0.00 2.00 0.00 0.00 36.73 39.11 3kc2 h TYR 252 CO 0.04 1.00 0.25 -0.44 -0.00 0.00 0.00 178.16 179.01 3kc2 h ASP 253 N 0.68 0.92 -0.17 3.88 3.32 -0.65 0.22 116.42 124.62 3kc2 h ASP 253 Ca 0.08 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.95 3kc2 h ASP 253 Cb 0.84 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 3kc2 h ASP 253 CO 0.07 0.85 0.11 0.15 -1.72 0.00 0.00 179.24 178.70 3kc2 h PHE 254 N 0.93 0.22 -0.71 4.55 3.57 -0.97 -1.46 116.94 123.08 3kc2 h PHE 254 Ca 0.22 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3kc2 h PHE 254 Cb 0.22 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 3kc2 h PHE 254 CO 0.01 0.16 0.46 0.00 -2.23 0.00 0.00 178.31 176.71 3kc2 h ALA 255 N 1.04 0.90 -0.57 2.41 0.00 -0.70 -1.30 119.26 121.03 3kc2 h ALA 255 Ca 0.06 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3kc2 h ALA 255 Cb 0.00 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3kc2 h ALA 255 CO -0.01 0.34 0.34 1.25 0.00 0.00 0.00 179.25 181.17 3kc2 h HIS 256 N 0.96 0.75 -0.60 0.00 -0.00 -0.32 0.45 115.15 116.40 3kc2 h HIS 256 Ca 0.26 -0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.58 3kc2 h HIS 256 Cb -0.09 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.05 3kc2 h HIS 256 CO -0.02 0.52 0.21 0.45 -0.00 0.00 0.00 177.93 179.08 3kc2 h HIS 257 N 0.77 0.95 -0.64 5.26 -0.00 -0.91 -0.77 115.15 119.81 3kc2 h HIS 257 Ca 0.20 -0.09 0.03 0.00 -0.00 0.00 0.00 60.37 60.52 3kc2 h HIS 257 Cb -0.01 -0.28 -0.04 0.00 -0.00 0.00 0.00 27.41 27.07 3kc2 h HIS 257 CO -0.02 0.78 0.39 0.28 -0.00 0.00 0.00 177.93 179.35 3kc2 h VAL 258 N 0.85 1.05 -0.36 2.45 2.07 -0.79 -1.17 116.25 120.36 3kc2 h VAL 258 Ca 0.20 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 3kc2 h VAL 258 Cb 0.26 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3kc2 h VAL 258 CO -0.01 0.14 0.16 0.25 0.02 0.00 0.00 177.57 178.13 3kc2 h LEU 259 N 0.75 0.48 -0.39 2.57 5.85 -0.65 0.15 115.31 124.07 3kc2 h LEU 259 Ca 0.26 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.88 3kc2 h LEU 259 Cb 0.06 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 3kc2 h LEU 259 CO -0.12 0.49 0.18 0.40 -0.34 0.00 0.00 178.44 179.05 3kc2 h ILE 260 N 0.44 0.95 -0.36 4.05 1.08 -0.99 0.73 117.51 123.41 3kc2 h ILE 260 Ca 0.12 -0.13 -0.09 0.00 -0.39 0.00 0.00 64.86 64.38 3kc2 h ILE 260 Cb 0.14 0.55 -0.02 0.00 -3.07 0.00 0.00 36.82 34.43 3kc2 h ILE 260 CO -0.01 0.07 -0.13 0.44 -0.69 0.00 0.00 178.15 177.82 3kc2 h ASP 261 N 0.37 0.64 -0.32 1.72 3.32 -1.04 -1.63 116.42 119.47 3kc2 h ASP 261 Ca 0.17 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 3kc2 h ASP 261 Cb 0.10 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 3kc2 h ASP 261 CO -0.13 0.79 0.00 -0.25 -1.72 0.00 0.00 179.24 177.93 3kc2 h TRP 262 N 0.59 0.61 -0.96 4.55 2.91 -0.60 -0.88 115.95 122.15 3kc2 h TRP 262 Ca 0.10 -0.11 0.02 0.00 1.13 0.00 0.00 58.89 60.03 3kc2 h TRP 262 Cb 0.57 -0.16 -0.05 0.00 -0.51 0.00 0.00 29.16 29.01 3kc2 h TRP 262 CO 0.02 0.68 0.64 1.49 -1.03 0.00 0.00 178.44 180.24 3kc2 h GLU 263 N 0.36 1.24 -0.63 2.65 4.22 -0.61 0.12 114.58 121.92 3kc2 h GLU 263 Ca 0.09 -0.07 -0.09 0.00 0.08 0.00 0.00 59.36 59.36 3kc2 h GLU 263 Cb 0.44 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3kc2 h GLU 263 CO 0.02 0.82 0.04 0.87 -2.18 0.00 0.00 179.01 178.58 3kc2 h LYS 264 N 1.28 1.09 0.00 1.92 1.57 -1.15 -2.33 116.57 118.95 3kc2 h LYS 264 Ca 0.36 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 3kc2 h LYS 264 Cb -0.10 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 3kc2 h LYS 264 CO -0.09 1.04 -0.14 -0.09 -0.57 0.00 0.00 179.45 179.59 3kc2 h ARG 265 N 1.00 0.00 -0.02 3.15 2.43 -0.42 -1.90 114.38 118.62 3kc2 h ARG 265 Ca 0.18 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 59.13 3kc2 h ARG 265 Cb 0.52 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 3kc2 h ARG 265 CO 0.02 0.14 -0.91 -0.07 -1.51 0.00 0.00 179.97 177.65 3kc2 h LEU 266 N 0.00 0.58 0.00 3.80 3.38 -0.79 -3.51 115.31 118.77 3kc2 h LEU 266 Ca -0.00 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3kc2 h LEU 266 Cb 0.69 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3kc2 h LEU 266 CO 0.02 1.24 0.00 -1.20 0.09 0.00 0.00 178.44 178.59 3kc2 n SER 267 N -3.78 0.00 0.00 -0.43 7.64 -0.72 -5.10 113.62 111.23 3kc2 n SER 267 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.81 3kc2 n SER 267 Cb 0.82 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.02 3kc2 n SER 267 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3kc2 n PRO 289 N -0.19 0.00 -3.72 1.43 -0.04 -1.26 -5.06 135.00 126.16 3kc2 n PRO 289 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 3kc2 n PRO 289 Cb 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 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 -1.42 3.51 0.25 0.54 0.08 -1.26 -4.96 117.98 114.72 3kc2 s PHE 290 Ca 0.00 0.52 0.03 0.00 0.12 0.00 0.00 56.93 57.60 3kc2 s PHE 290 Cb 0.00 -1.97 0.31 0.00 -0.57 0.00 0.00 43.02 40.79 3kc2 s PHE 290 CO 0.00 0.49 1.62 1.25 -0.10 0.00 0.00 175.22 178.49 3kc2 h HIS 291 N 3.11 0.44 -2.52 0.36 -0.00 -0.89 -3.46 115.15 112.19 3kc2 h HIS 291 Ca -0.47 -0.13 -0.09 0.00 -0.00 0.00 0.00 60.37 59.68 3kc2 h HIS 291 Cb 1.17 -0.09 -0.22 0.00 -0.00 0.00 0.00 27.41 28.27 3kc2 h HIS 291 CO 0.63 0.76 -0.09 0.00 -0.00 0.00 0.00 177.93 179.23 3kc2 s ALA 292 N -4.09 -1.26 -0.11 5.26 0.00 -1.11 -5.04 121.76 115.41 3kc2 s ALA 292 Ca -0.06 1.17 0.03 0.00 0.00 0.00 0.00 51.96 53.10 3kc2 s ALA 292 Cb 0.13 -0.47 -0.00 0.00 0.00 0.00 0.00 23.12 22.77 3kc2 s ALA 292 CO 0.80 -0.27 -0.21 0.08 0.00 0.00 0.00 175.76 176.16 3kc2 s VAL 293 N -0.38 2.34 0.00 0.00 1.01 -1.26 -1.82 120.40 120.28 3kc2 s VAL 293 Ca -0.05 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.01 3kc2 s VAL 293 Cb -0.03 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.43 3kc2 s VAL 293 CO 0.03 0.55 0.00 0.49 0.00 0.00 0.00 175.10 176.17 3kc2 n PHE 294 N 3.53 -1.23 -3.27 5.22 3.72 -0.45 -0.69 117.46 124.29 3kc2 n PHE 294 Ca -0.19 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.25 3kc2 n PHE 294 Cb 0.53 0.00 -0.03 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 0.70 -0.52 0.13 -4.37 1.01 0.38 -0.95 120.40 116.77 3kc2 s VAL 296 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.95 3kc2 s VAL 296 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 3kc2 s VAL 296 CO 0.00 0.00 0.11 -0.83 0.00 0.00 0.00 175.10 174.38 3kc2 s GLY 297 N 2.72 0.73 0.00 4.51 0.00 -0.69 -0.94 107.32 113.66 3kc2 s GLY 297 Ca 0.02 -1.23 0.12 0.00 0.00 0.00 0.00 44.72 43.63 3kc2 s GLY 297 CO -0.16 -1.19 0.65 2.09 0.00 0.00 0.00 173.10 174.50 3kc2 n ASP 298 N -0.09 1.12 -4.03 1.64 5.75 -1.26 -1.14 116.55 118.53 3kc2 n ASP 298 Ca -0.08 -1.06 -0.31 0.00 -0.01 0.00 0.00 54.79 53.33 3kc2 n ASP 298 Cb 0.63 0.63 -0.15 0.00 -1.03 0.00 0.00 41.12 41.20 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 -1.73 4.42 0.30 -1.12 3.84 -1.26 -1.69 114.94 117.70 3kc2 s ASN 299 Ca 0.08 -1.54 0.06 0.00 0.21 0.00 0.00 52.86 51.68 3kc2 s ASN 299 Cb 0.10 -1.50 0.75 0.00 -0.55 0.00 0.00 41.25 40.05 3kc2 s ASN 299 CO 0.36 -0.24 1.76 -0.65 -2.79 0.00 0.00 177.10 175.54 3kc2 h PRO 300 N 7.77 0.69 0.00 0.43 0.11 -1.96 -1.43 132.00 137.61 3kc2 h PRO 300 Ca -0.15 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.91 3kc2 h PRO 300 Cb 1.04 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.99 3kc2 h PRO 300 CO 0.47 0.46 0.00 0.00 -0.21 0.00 0.00 178.00 178.71 3kc2 n ALA 301 N -2.34 2.00 0.02 -0.75 0.00 -1.26 -1.38 120.51 116.80 3kc2 n ALA 301 Ca 0.24 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.62 3kc2 n ALA 301 Cb 0.60 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.66 0.32 0.04 0.00 3.41 -0.91 -4.52 113.62 110.29 3kc2 n SER 302 Ca 0.05 0.06 -0.12 0.00 -0.26 0.00 0.00 58.87 58.59 3kc2 n SER 302 Cb 0.27 -0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 64.06 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 -0.01 0.01 4.04 3.32 -1.48 -1.60 116.42 120.70 3kc2 h ASP 303 Ca 0.00 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 56.93 3kc2 h ASP 303 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 3kc2 h ASP 303 CO 0.00 0.07 -0.19 0.40 -1.72 0.00 0.00 179.24 177.81 3kc2 h ILE 304 N -0.10 1.69 -0.89 0.35 1.08 -1.51 -2.12 117.51 116.00 3kc2 h ILE 304 Ca -0.00 -2.35 0.04 0.00 -0.39 0.00 0.00 64.86 62.16 3kc2 h ILE 304 Cb 0.10 3.27 -0.05 0.00 -3.07 0.00 0.00 36.82 37.06 3kc2 h ILE 304 CO 0.00 0.59 0.58 0.40 -0.69 0.00 0.00 178.15 179.04 3kc2 h ILE 305 N -0.95 1.13 -0.02 -0.67 1.08 -1.37 0.48 117.51 117.20 3kc2 h ILE 305 Ca -0.04 -0.37 0.00 0.00 -0.39 0.00 0.00 64.86 64.05 3kc2 h ILE 305 Cb 1.08 -0.06 -0.00 0.00 -3.07 0.00 0.00 36.82 34.77 3kc2 h ILE 305 CO -0.01 0.20 -0.00 1.23 -0.69 0.00 0.00 178.15 178.88 3kc2 h GLY 306 N 1.09 0.02 0.78 5.37 0.00 -1.32 -0.50 103.07 108.51 3kc2 h GLY 306 Ca 0.36 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.68 3kc2 h GLY 306 CO -0.11 -0.00 0.01 0.00 0.00 0.00 0.00 176.54 176.43 3kc2 h ALA 307 N 1.02 0.13 -0.41 3.60 0.00 -0.97 -2.22 119.26 120.40 3kc2 h ALA 307 Ca 0.01 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.80 3kc2 h ALA 307 Cb 0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3kc2 h ALA 307 CO -0.02 -0.22 0.21 0.37 0.00 0.00 0.00 179.25 179.59 3kc2 h GLN 308 N -0.08 0.41 -0.63 0.00 4.15 -0.82 0.19 115.11 118.32 3kc2 h GLN 308 Ca 0.03 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 3kc2 h GLN 308 Cb 0.30 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.86 3kc2 h GLN 308 CO 0.00 0.27 0.33 -0.91 -1.93 0.00 0.00 178.83 176.59 3kc2 h ASN 309 N 0.42 0.78 1.14 -0.69 2.35 -1.04 -2.65 115.58 115.89 3kc2 h ASN 309 Ca 0.18 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 3kc2 h ASN 309 Cb 0.08 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.25 3kc2 h ASN 309 CO -0.12 0.64 -0.01 0.00 -1.65 0.00 0.00 177.43 176.28 3kc2 n TYR 310 N -4.37 0.29 -0.55 1.19 9.36 -0.77 -4.92 117.16 117.39 3kc2 n TYR 310 Ca 0.06 0.08 0.00 0.00 3.32 0.00 0.00 57.90 61.36 3kc2 n TYR 310 Cb 0.11 -0.63 0.00 0.00 -0.63 0.00 0.00 39.34 38.19 3kc2 n TYR 310 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3kc2 n GLY 311 N 1.44 0.71 3.89 2.98 0.00 -0.52 -5.08 105.19 108.60 3kc2 n GLY 311 Ca 0.07 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 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 3.48 0.82 1.61 0.52 -0.06 -4.92 118.94 118.38 3kc2 s TRP 312 Ca 0.00 0.85 -0.12 0.00 0.02 0.00 0.00 56.10 56.85 3kc2 s TRP 312 Cb 0.00 -2.28 0.09 0.00 -1.15 0.00 0.00 33.47 30.13 3kc2 s TRP 312 CO 0.00 0.01 1.18 -0.80 0.02 0.00 0.00 176.95 177.37 3kc2 s ASN 313 N -3.21 4.40 -0.04 2.95 0.01 0.14 -3.87 114.94 115.31 3kc2 s ASN 313 Ca 0.48 0.71 -0.20 0.00 -0.71 0.00 0.00 52.86 53.14 3kc2 s ASN 313 Cb -0.10 -1.17 0.04 0.00 0.41 0.00 0.00 41.25 40.43 3kc2 s ASN 313 CO 0.31 -1.96 0.45 -0.94 -1.51 0.00 0.00 177.10 173.45 3kc2 s SER 314 N -4.60 -0.38 -0.20 -1.22 1.04 -1.26 -4.26 113.70 102.81 3kc2 s SER 314 Ca 0.63 0.40 -0.00 0.00 0.48 0.00 0.00 55.95 57.46 3kc2 s SER 314 Cb -0.10 0.46 0.05 0.00 0.10 0.00 0.00 66.02 66.53 3kc2 s SER 314 CO 0.49 -0.47 -0.05 0.00 0.98 0.00 0.00 173.24 174.19 3kc2 s LEU 316 N 1.52 4.07 0.46 0.00 2.96 -0.14 -1.70 118.68 125.85 3kc2 s LEU 316 Ca -0.02 0.71 0.04 0.00 -0.22 0.00 0.00 54.13 54.63 3kc2 s LEU 316 Cb -0.17 -2.84 0.01 0.00 0.50 0.00 0.00 46.19 43.69 3kc2 s LEU 316 CO -0.07 -0.35 0.64 0.68 -1.32 0.00 0.00 176.35 175.93 3kc2 s VAL 317 N 2.42 3.26 -0.99 1.68 -7.23 -0.30 -0.76 120.40 118.49 3kc2 s VAL 317 Ca 0.26 -0.79 0.10 0.00 -1.81 0.00 0.00 61.98 59.75 3kc2 s VAL 317 Cb -0.16 -3.16 0.26 0.00 0.56 0.00 0.00 36.38 33.88 3kc2 s VAL 317 CO 0.09 -0.09 1.17 0.29 -0.31 0.00 0.00 175.10 176.25 3kc2 n LYS 318 N -2.03 2.44 -0.07 4.82 5.02 -0.48 -4.59 118.16 123.27 3kc2 n LYS 318 Ca 0.05 -1.87 0.10 0.00 -2.02 0.00 0.00 58.31 54.57 3kc2 n LYS 318 Cb 0.59 -1.25 0.40 0.00 -0.02 0.00 0.00 35.03 34.75 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 0.51 0.17 0.00 -0.18 -2.24 -1.23 -4.78 114.28 106.54 3kc2 n THR 319 Ca 0.10 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3kc2 n THR 319 Cb 0.39 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 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 1.08 4.37 0.20 3.38 0.00 -1.18 -4.70 105.19 108.34 3kc2 n GLY 320 Ca 0.16 -0.58 -0.03 0.00 0.00 0.00 0.00 46.02 45.57 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 0.86 -3.50 1.61 2.07 -1.88 -3.42 116.25 111.99 3kc2 h VAL 321 Ca 0.00 -0.14 -0.52 0.00 0.82 0.00 0.00 66.70 66.86 3kc2 h VAL 321 Cb 0.00 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 3kc2 h VAL 321 CO 0.00 0.07 0.45 -0.47 0.02 0.00 0.00 177.57 177.64 3kc2 s TYR 322 N -6.13 3.64 -0.03 1.57 5.04 -0.68 -4.99 117.35 115.77 3kc2 s TYR 322 Ca -0.13 1.62 0.07 0.00 -2.44 0.00 0.00 57.07 56.19 3kc2 s TYR 322 Cb 0.15 -3.22 -0.02 0.00 0.35 0.00 0.00 41.96 39.21 3kc2 s TYR 322 CO 0.73 -0.43 -0.22 -0.80 -1.34 0.00 0.00 175.55 173.49 3kc2 s ASN 323 N 0.19 3.38 0.21 4.32 0.01 -1.26 -4.53 114.94 117.25 3kc2 s ASN 323 Ca 0.50 -0.39 -0.32 0.00 -0.71 0.00 0.00 52.86 51.94 3kc2 s ASN 323 Cb -0.27 -0.50 -0.14 0.00 0.41 0.00 0.00 41.25 40.75 3kc2 s ASN 323 CO 0.32 0.33 1.42 1.21 -1.51 0.00 0.00 177.10 178.87 3kc2 n GLU 324 N 2.36 1.94 0.00 -0.60 4.07 -1.26 -1.05 120.64 126.10 3kc2 n GLU 324 Ca -0.16 0.69 0.00 0.00 -0.06 0.00 0.00 57.16 57.63 3kc2 n GLU 324 Cb 0.51 -2.36 0.00 0.00 -0.06 0.00 0.00 31.44 29.53 3kc2 n GLU 324 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3kc2 n GLY 325 N 2.43 2.92 3.76 8.31 0.00 -1.26 -5.08 105.19 116.27 3kc2 n GLY 325 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.85 5.40 -0.01 1.61 1.01 -0.22 -4.90 116.67 118.72 3kc2 s ASP 326 Ca 0.00 2.35 -0.30 0.00 0.71 0.00 0.00 52.55 55.31 3kc2 s ASP 326 Cb 0.00 -2.60 -0.07 0.00 1.01 0.00 0.00 42.92 41.26 3kc2 s ASP 326 CO 0.00 -1.45 1.80 -0.62 0.21 0.00 0.00 175.17 175.11 3kc2 s ASP 327 N -1.58 6.57 0.00 0.27 -1.08 -1.26 -4.85 116.67 114.73 3kc2 s ASP 327 Ca 0.75 2.44 0.27 0.00 -0.52 0.00 0.00 52.55 55.49 3kc2 s ASP 327 Cb -0.29 -2.53 0.81 0.00 -1.46 0.00 0.00 42.92 39.45 3kc2 s ASP 327 CO 0.32 -0.98 1.61 0.18 0.52 0.00 0.00 175.17 176.83 3kc2 n LEU 328 N 7.25 0.52 0.00 -1.34 4.77 -1.26 -4.99 117.00 121.95 3kc2 n LEU 328 Ca 0.18 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 3kc2 n LEU 328 Cb 0.42 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3kc2 n LEU 328 CO 0.65 0.11 0.00 0.29 -1.33 0.00 0.00 177.39 177.11 3kc2 n LYS 329 N -1.22 0.00 -0.36 3.23 5.02 -1.26 -1.74 118.16 121.82 3kc2 n LYS 329 Ca 0.09 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.46 3kc2 n LYS 329 Cb 0.33 0.00 0.23 0.00 -0.02 0.00 0.00 35.03 35.56 3kc2 n LYS 329 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3kc2 n GLU 330 N 14.00 2.88 -2.99 1.97 -0.58 -1.26 -4.94 120.64 129.72 3kc2 n GLU 330 Ca 0.00 -2.62 -0.35 0.00 -0.42 0.00 0.00 57.16 53.77 3kc2 n GLU 330 Cb 0.00 -1.68 -0.06 0.00 -0.57 0.00 0.00 31.44 29.12 3kc2 n GLU 330 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3kc2 s LYS 332 N -2.55 1.31 0.50 0.00 1.02 -1.26 -4.92 119.74 113.84 3kc2 s LYS 332 Ca 0.52 -2.06 -0.23 0.00 0.02 0.00 0.00 55.97 54.22 3kc2 s LYS 332 Cb -0.13 -2.32 -0.06 0.00 -0.52 0.00 0.00 37.83 34.80 3kc2 s LYS 332 CO 0.19 -1.18 1.35 -1.25 -0.92 0.00 0.00 175.35 173.54 3kc2 s PRO 333 N 0.27 3.39 0.16 -1.68 0.05 -1.26 -4.90 135.00 131.02 3kc2 s PRO 333 Ca 0.19 2.22 -0.15 0.00 0.05 0.00 0.00 61.00 63.30 3kc2 s PRO 333 Cb -0.22 -2.40 0.04 0.00 0.05 0.00 0.00 34.50 31.98 3kc2 s PRO 333 CO -0.02 -0.99 1.81 1.15 0.05 0.00 0.00 177.00 179.00 3kc2 h THR 334 N 1.76 1.07 -3.95 1.26 2.02 -1.48 -3.44 112.91 110.15 3kc2 h THR 334 Ca -0.51 -0.18 -0.29 0.00 0.77 0.00 0.00 66.41 66.20 3kc2 h THR 334 Cb 1.28 0.49 -0.23 0.00 -1.74 0.00 0.00 68.15 67.95 3kc2 h THR 334 CO 0.59 0.10 -0.74 -0.76 0.37 0.00 0.00 175.52 175.07 3kc2 s LEU 335 N -10.19 2.20 -0.14 2.58 1.43 -0.73 -5.02 118.68 108.81 3kc2 s LEU 335 Ca -0.13 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.55 3kc2 s LEU 335 Cb 0.11 -0.21 0.01 0.00 0.03 0.00 0.00 46.19 46.14 3kc2 s LEU 335 CO 0.73 -0.14 -0.22 -0.63 0.23 0.00 0.00 176.35 176.33 3kc2 s ILE 336 N -1.08 2.13 0.16 -0.59 1.01 -1.26 -0.97 121.20 120.59 3kc2 s ILE 336 Ca -0.07 -0.96 -0.02 0.00 0.00 0.00 0.00 60.65 59.60 3kc2 s ILE 336 Cb -0.08 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 3kc2 s ILE 336 CO 0.00 0.55 0.10 0.68 0.00 0.00 0.00 174.94 176.28 3kc2 s VAL 337 N 0.75 0.07 -0.02 2.92 -7.23 0.06 -4.96 120.40 111.98 3kc2 s VAL 337 Ca -0.08 -1.88 -0.23 0.00 -1.81 0.00 0.00 61.98 57.97 3kc2 s VAL 337 Cb -0.16 -2.16 -0.17 0.00 0.56 0.00 0.00 36.38 34.46 3kc2 s VAL 337 CO -0.00 -0.31 1.08 0.78 -0.31 0.00 0.00 175.10 176.33 3kc2 h ASN 338 N 2.76 -0.21 -5.59 4.85 2.35 -1.94 -2.80 115.58 115.00 3kc2 h ASN 338 Ca -0.35 -0.31 -0.28 0.00 -0.55 0.00 0.00 56.30 54.81 3kc2 h ASN 338 Cb 1.22 0.05 -0.12 0.00 0.05 0.00 0.00 38.32 39.52 3kc2 h ASN 338 CO 0.56 0.26 -0.39 1.51 -1.65 0.00 0.00 177.43 177.73 3kc2 s ASP 339 N -5.37 0.69 0.43 5.81 1.47 -1.26 -1.39 116.67 117.05 3kc2 s ASP 339 Ca -0.14 -1.43 0.10 0.00 1.18 0.00 0.00 52.55 52.26 3kc2 s ASP 339 Cb 0.01 0.54 0.95 0.00 -0.34 0.00 0.00 42.92 44.08 3kc2 s ASP 339 CO 0.54 -1.07 2.04 1.62 0.68 0.00 0.00 175.17 178.97 3kc2 h VAL 340 N 2.30 1.02 -0.23 2.11 3.04 -1.87 -0.43 116.25 122.19 3kc2 h VAL 340 Ca -0.30 -0.16 -0.14 0.00 -1.01 0.00 0.00 66.70 65.10 3kc2 h VAL 340 Cb 1.24 0.52 -0.01 0.00 -2.01 0.00 0.00 31.29 31.04 3kc2 h VAL 340 CO 0.42 0.08 -0.43 0.15 -1.01 0.00 0.00 177.57 176.78 3kc2 h PHE 341 N 0.46 0.68 -0.80 3.17 3.57 -1.86 -1.71 116.94 120.44 3kc2 h PHE 341 Ca 0.18 -0.20 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 3kc2 h PHE 341 Cb 0.16 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 3kc2 h PHE 341 CO -0.00 0.90 0.34 -0.44 -2.23 0.00 0.00 178.31 176.88 3kc2 h ASP 342 N 0.46 1.09 -0.07 0.41 3.32 -1.71 -1.13 116.42 118.78 3kc2 h ASP 342 Ca 0.03 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.93 3kc2 h ASP 342 Cb 0.94 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 3kc2 h ASP 342 CO 0.08 0.95 0.04 0.00 -1.72 0.00 0.00 179.24 178.59 3kc2 h ALA 343 N 1.21 0.09 -0.10 3.45 0.00 -0.71 0.59 119.26 123.79 3kc2 h ALA 343 Ca 0.27 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 3kc2 h ALA 343 Cb 0.18 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3kc2 h ALA 343 CO -0.03 -0.43 -0.05 0.28 0.00 0.00 0.00 179.25 179.03 3kc2 h VAL 344 N 0.09 1.32 -0.37 0.00 2.07 -1.23 -1.43 116.25 116.70 3kc2 h VAL 344 Ca 0.03 -1.08 -0.10 0.00 0.82 0.00 0.00 66.70 66.37 3kc2 h VAL 344 Cb -0.00 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 3kc2 h VAL 344 CO -0.01 0.30 -0.16 0.71 0.02 0.00 0.00 177.57 178.44 3kc2 h THR 345 N -0.16 1.28 -0.14 2.57 1.35 -1.12 -0.13 112.91 116.57 3kc2 h THR 345 Ca 0.02 -1.27 -0.12 0.00 -0.55 0.00 0.00 66.41 64.50 3kc2 h THR 345 Cb 0.50 1.33 -0.01 0.00 -1.73 0.00 0.00 68.15 68.24 3kc2 h THR 345 CO 0.01 0.42 -0.43 0.11 -0.25 0.00 0.00 175.52 175.39 3kc2 h LYS 346 N 0.55 0.32 -0.08 4.72 1.57 -0.94 -1.72 116.57 120.98 3kc2 h LYS 346 Ca 0.08 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 3kc2 h LYS 346 Cb 0.69 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 3kc2 h LYS 346 CO 0.05 0.69 -0.14 1.15 -0.57 0.00 0.00 179.45 180.63 3kc2 h THR 347 N 0.26 1.39 -0.57 -0.16 2.02 -1.02 -2.41 112.91 112.43 3kc2 h THR 347 Ca 0.02 -1.39 0.01 0.00 0.77 0.00 0.00 66.41 65.81 3kc2 h THR 347 Cb 0.86 2.11 -0.03 0.00 -1.74 0.00 0.00 68.15 69.36 3kc2 h THR 347 CO 0.07 0.39 0.38 -0.07 0.37 0.00 0.00 175.52 176.66 3kc2 h LEU 348 N -0.21 0.65 -0.59 2.58 3.38 -0.97 0.16 115.31 120.31 3kc2 h LEU 348 Ca 0.01 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3kc2 h LEU 348 Cb 0.70 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 3kc2 h LEU 348 CO 0.03 0.47 0.33 -0.08 0.09 0.00 0.00 178.44 179.28 3kc2 h GLU 349 N 0.77 0.82 0.05 1.13 4.22 -1.31 -1.55 114.58 118.71 3kc2 h GLU 349 Ca 0.21 -0.09 -0.26 0.00 0.08 0.00 0.00 59.36 59.29 3kc2 h GLU 349 Cb -0.08 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 28.98 3kc2 h GLU 349 CO -0.05 0.63 -1.35 -0.22 -2.18 0.00 0.00 179.01 175.84 3kc2 h LYS 350 N 0.80 0.10 0.00 1.92 3.64 -1.24 -3.42 116.57 118.37 3kc2 h LYS 350 Ca 0.21 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3kc2 h LYS 350 Cb 0.04 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3kc2 h LYS 350 CO -0.03 0.93 -0.09 0.66 -2.27 0.00 0.00 179.45 178.65 3kc2 n TYR 351 N -3.32 0.00 0.15 1.91 4.02 0.55 -5.09 117.16 115.37 3kc2 n TYR 351 Ca -0.10 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.81 3kc2 n TYR 351 Cb 1.00 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 40.34 3kc2 n TYR 351 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85