#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kj5 h LEU 14 N 0.00 0.62 -1.13 1.08 3.38 -2.02 0.46 115.31 117.70 3kj5 h LEU 14 Ca 0.00 -0.16 0.37 0.00 0.09 0.00 0.00 57.88 58.18 3kj5 h LEU 14 Cb 0.00 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 40.49 3kj5 h LEU 14 CO 0.00 0.61 0.75 1.17 0.09 0.00 0.00 178.44 181.06 3kj5 n LYS 15 N -4.60 -0.02 -0.03 1.13 3.00 -1.26 -0.91 118.16 115.47 3kj5 n LYS 15 Ca 0.01 0.91 -0.21 0.00 -0.00 0.00 0.00 58.31 59.02 3kj5 n LYS 15 Cb 0.15 -1.85 -0.13 0.00 0.00 0.00 0.00 35.03 33.19 3kj5 n LYS 15 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3kj5 n ASN 16 N -4.03 2.07 0.03 3.14 4.13 0.13 -4.02 115.26 116.71 3kj5 n ASN 16 Ca 0.31 0.22 0.08 0.00 1.68 0.00 0.00 54.58 56.87 3kj5 n ASN 16 Cb 1.25 -0.84 0.35 0.00 -1.54 0.00 0.00 39.78 39.00 3kj5 n ASN 16 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3kj5 n GLN 17 N -3.64 0.04 -3.49 3.52 1.13 -0.09 -2.74 117.38 112.11 3kj5 n GLN 17 Ca -0.34 0.29 -0.41 0.00 -1.94 0.00 0.00 57.00 54.60 3kj5 n GLN 17 Cb 0.98 -1.59 -0.04 0.00 0.11 0.00 0.00 30.24 29.71 3kj5 n GLN 17 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 3kj5 s ILE 18 N -3.07 5.07 0.00 5.09 1.01 -0.95 -3.42 121.20 124.93 3kj5 s ILE 18 Ca 0.06 -3.41 0.00 0.00 0.00 0.00 0.00 60.65 57.30 3kj5 s ILE 18 Cb 0.09 -4.11 0.00 0.00 0.01 0.00 0.00 42.46 38.45 3kj5 s ILE 18 CO 0.29 -1.09 0.00 -2.11 0.00 0.00 0.00 174.94 172.03 3kj5 n ARG 19 N 2.82 0.00 0.07 2.79 -4.01 -1.24 -4.70 116.66 112.39 3kj5 n ARG 19 Ca 0.20 0.00 0.05 0.00 -1.04 0.00 0.00 57.85 57.05 3kj5 n ARG 19 Cb 0.39 0.00 -0.04 0.00 -3.04 0.00 0.00 32.46 29.78 3kj5 n ARG 19 CO 0.00 0.00 0.00 0.22 -3.04 0.00 0.00 177.63 174.81 3kj5 h ASP 20 N 0.00 0.00 0.65 2.89 3.58 -1.69 -2.94 116.42 118.92 3kj5 h ASP 20 Ca 0.00 0.00 -0.27 0.00 0.42 0.00 0.00 57.03 57.18 3kj5 h ASP 20 Cb 0.00 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 3kj5 h ASP 20 CO 0.00 0.35 -1.25 0.00 -2.88 0.00 0.00 179.24 175.46 3kj5 h ALA 21 N 1.65 0.15 -0.61 -0.78 0.00 -1.76 -3.34 119.26 114.57 3kj5 h ALA 21 Ca -0.09 -0.92 0.11 0.00 0.00 0.00 0.00 54.91 54.01 3kj5 h ALA 21 Cb 1.35 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 19.08 3kj5 h ALA 21 CO 0.03 1.03 0.18 -0.09 0.00 0.00 0.00 179.25 180.40 3kj5 h ARG 22 N 0.06 0.32 -0.69 0.00 9.65 -1.78 -1.71 114.38 120.23 3kj5 h ARG 22 Ca -0.13 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.73 3kj5 h ARG 22 Cb 1.96 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 30.46 3kj5 h ARG 22 CO 0.19 0.21 0.00 0.36 2.80 0.00 0.00 179.97 183.53 3kj5 n LYS 23 N -5.07 3.34 0.14 0.20 2.85 -1.22 -2.98 118.16 115.42 3kj5 n LYS 23 Ca 0.09 -2.76 0.03 0.00 -1.05 0.00 0.00 58.31 54.62 3kj5 n LYS 23 Cb 0.31 -1.77 0.02 0.00 -0.65 0.00 0.00 35.03 32.94 3kj5 n LYS 23 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3kj5 h ALA 24 N 4.23 0.68 -0.34 0.58 0.00 -1.43 -3.22 119.26 119.76 3kj5 h ALA 24 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3kj5 h ALA 24 Cb 1.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3kj5 h ALA 24 CO 0.15 0.61 0.00 0.00 0.00 0.00 0.00 179.25 180.01 3kj5 h ALA 26 N 4.16 0.39 0.00 0.00 0.00 -1.57 -3.44 119.26 118.80 3kj5 h ALA 26 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3kj5 h ALA 26 Cb 0.93 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3kj5 h ALA 26 CO 0.00 0.05 0.00 -3.47 0.00 0.00 0.00 179.25 175.83 3kj5 n ASP 27 N -4.68 0.00 -3.51 0.00 2.03 -1.26 -4.63 116.55 104.51 3kj5 n ASP 27 Ca -0.02 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.18 3kj5 n ASP 27 Cb 0.18 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.56 3kj5 n ASP 27 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3kj5 s ALA 28 N 0.00 -1.53 0.38 -1.67 0.00 -1.26 -5.16 121.76 112.51 3kj5 s ALA 28 Ca 0.00 0.35 -0.26 0.00 0.00 0.00 0.00 51.96 52.05 3kj5 s ALA 28 Cb 0.00 0.87 -0.09 0.00 0.00 0.00 0.00 23.12 23.90 3kj5 s ALA 28 CO 0.00 -0.82 1.16 0.99 0.00 0.00 0.00 175.76 177.09 3kj5 s THR 29 N -3.77 3.23 -1.31 0.00 2.01 -1.26 -4.88 115.64 109.65 3kj5 s THR 29 Ca 0.03 1.06 0.12 0.00 0.31 0.00 0.00 61.69 63.21 3kj5 s THR 29 Cb -0.02 -3.61 0.18 0.00 0.01 0.00 0.00 72.50 69.06 3kj5 s THR 29 CO -0.09 0.12 1.32 -0.11 -0.69 0.00 0.00 174.62 175.17 3kj5 n LEU 30 N 0.26 0.00 0.02 4.42 7.94 -1.26 -0.67 117.00 127.71 3kj5 n LEU 30 Ca 0.03 0.34 -0.20 0.00 -1.11 0.00 0.00 56.01 55.08 3kj5 n LEU 30 Cb 0.46 -0.34 -0.14 0.00 0.53 0.00 0.00 43.42 43.93 3kj5 n LEU 30 CO 0.51 -0.21 -0.71 0.28 -1.11 0.00 0.00 177.39 176.15 3kj5 h SER 31 N 0.00 0.41 0.00 1.96 0.02 -1.89 -3.33 113.55 110.71 3kj5 h SER 31 Ca 0.00 -0.84 0.00 0.00 -0.84 0.00 0.00 61.79 60.11 3kj5 h SER 31 Cb 0.14 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.55 3kj5 h SER 31 CO 0.00 1.74 0.07 1.56 -1.14 0.00 0.00 176.83 179.06 3kj5 h GLN 32 N 0.07 0.00 -0.02 3.45 4.20 -1.24 -1.03 115.11 120.53 3kj5 h GLN 32 Ca -0.39 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.32 3kj5 h GLN 32 Cb 2.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.82 3kj5 h GLN 32 CO 0.11 0.00 -0.11 0.44 -0.67 0.00 0.00 178.83 178.59 3kj5 n ILE 33 N -2.32 0.00 -0.00 2.54 -6.64 -1.12 -4.49 119.36 107.32 3kj5 n ILE 33 Ca -0.02 -0.44 0.00 0.00 -1.77 0.00 0.00 62.75 60.52 3kj5 n ILE 33 Cb 0.10 1.40 0.00 0.00 -1.44 0.00 0.00 39.64 39.70 3kj5 n ILE 33 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 3kj5 n THR 34 N 0.89 0.00 -0.80 7.28 -2.24 -1.09 -4.82 114.28 113.50 3kj5 n THR 34 Ca 0.12 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.55 3kj5 n THR 34 Cb 0.51 0.01 -0.06 0.00 -2.10 0.00 0.00 70.33 68.69 3kj5 n THR 34 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3kj5 n ASN 35 N 0.00 2.35 0.00 3.42 5.15 -0.41 0.43 115.26 126.20 3kj5 n ASN 35 Ca 0.00 -2.50 0.00 0.00 -0.60 0.00 0.00 54.58 51.48 3kj5 n ASN 35 Cb 0.00 -0.90 0.00 0.00 -0.53 0.00 0.00 39.78 38.35 3kj5 n ASN 35 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 3kj5 n ASN 36 N 6.93 0.00 -2.55 1.20 4.05 -1.26 -4.91 115.26 118.72 3kj5 n ASN 36 Ca 0.43 -0.52 -0.07 0.00 0.45 0.00 0.00 54.58 54.86 3kj5 n ASN 36 Cb 0.31 0.00 0.04 0.00 1.23 0.00 0.00 39.78 41.37 3kj5 n ASN 36 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 3kj5 n ILE 37 N 0.00 0.00 -4.23 -1.44 -6.64 1.48 -5.04 119.36 103.50 3kj5 n ILE 37 Ca 0.00 -0.31 -0.26 0.00 -1.77 0.00 0.00 62.75 60.41 3kj5 n ILE 37 Cb 0.13 -1.62 -0.17 0.00 -1.44 0.00 0.00 39.64 36.54 3kj5 n ILE 37 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 3kj5 s ASP 38 N -2.16 2.03 0.31 7.28 -1.08 -1.26 -5.06 116.67 116.74 3kj5 s ASP 38 Ca 0.18 -0.31 -0.25 0.00 -0.52 0.00 0.00 52.55 51.64 3kj5 s ASP 38 Cb -0.01 -0.86 -0.15 0.00 -1.46 0.00 0.00 42.92 40.44 3kj5 s ASP 38 CO 0.13 -0.04 0.56 -2.65 0.52 0.00 0.00 175.17 173.68 3kj5 n PRO 39 N 4.41 0.44 -0.01 4.34 -0.02 -1.26 -4.88 135.00 138.01 3kj5 n PRO 39 Ca -0.18 0.16 -0.13 0.00 -2.02 0.00 0.00 63.50 61.33 3kj5 n PRO 39 Cb 0.51 -1.32 -0.09 0.00 -0.02 0.00 0.00 33.50 32.58 3kj5 n PRO 39 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3kj5 h VAL 40 N 1.04 1.34 0.00 -1.45 2.07 -1.99 -3.50 116.25 113.76 3kj5 h VAL 40 Ca -0.35 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.15 3kj5 h VAL 40 Cb 1.41 1.98 0.00 0.00 -1.52 0.00 0.00 31.29 33.16 3kj5 h VAL 40 CO 0.55 0.27 0.00 0.61 0.02 0.00 0.00 177.57 179.02 3kj5 n GLY 41 N 0.05 4.33 3.75 2.17 0.00 -1.26 -5.05 105.19 109.18 3kj5 n GLY 41 Ca -0.08 -0.86 -0.36 0.00 0.00 0.00 0.00 46.02 44.72 3kj5 n GLY 41 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3kj5 s ARG 42 N -3.21 2.86 -0.23 1.61 3.52 -1.26 -4.75 118.95 117.49 3kj5 s ARG 42 Ca 0.00 1.86 -0.03 0.00 -0.13 0.00 0.00 55.73 57.43 3kj5 s ARG 42 Cb 0.00 -1.91 0.11 0.00 -1.56 0.00 0.00 34.95 31.59 3kj5 s ARG 42 CO 0.00 -1.30 0.26 0.42 -0.81 0.00 0.00 175.30 173.87 3kj5 s ILE 43 N -1.59 -0.38 -0.19 4.11 -1.09 0.20 -5.00 121.20 117.25 3kj5 s ILE 43 Ca 0.78 -0.20 -0.16 0.00 -2.23 0.00 0.00 60.65 58.84 3kj5 s ILE 43 Cb -0.31 -0.78 -0.04 0.00 -1.58 0.00 0.00 42.46 39.75 3kj5 s ILE 43 CO 0.35 -0.26 0.40 -1.10 -1.23 0.00 0.00 174.94 173.10 3kj5 s GLN 44 N 2.37 4.19 -0.12 2.79 -1.52 -1.26 -4.45 119.66 121.65 3kj5 s GLN 44 Ca 0.08 0.22 -0.00 0.00 -1.95 0.00 0.00 55.36 53.71 3kj5 s GLN 44 Cb -0.15 -3.53 -0.02 0.00 -0.22 0.00 0.00 33.01 29.09 3kj5 s GLN 44 CO -0.18 -0.02 -0.11 -1.64 -0.25 0.00 0.00 175.29 173.09 3kj5 s MET 45 N 1.23 3.32 0.39 2.91 -1.94 -1.26 -5.05 119.30 118.90 3kj5 s MET 45 Ca 0.19 -0.65 0.02 0.00 -1.71 0.00 0.00 55.69 53.54 3kj5 s MET 45 Cb -0.15 -2.65 -0.01 0.00 2.01 0.00 0.00 34.83 34.03 3kj5 s MET 45 CO 0.08 0.28 0.58 0.50 -0.01 0.00 0.00 175.02 176.45 3kj5 s ARG 46 N 0.19 3.19 -1.18 2.03 6.06 -1.26 -4.88 118.95 123.10 3kj5 s ARG 46 Ca -0.07 -0.59 -0.05 0.00 -2.50 0.00 0.00 55.73 52.53 3kj5 s ARG 46 Cb -0.15 -2.66 0.23 0.00 0.06 0.00 0.00 34.95 32.43 3kj5 s ARG 46 CO 0.05 -0.06 1.93 -2.37 -2.50 0.00 0.00 175.30 172.34 3kj5 n THR 47 N -1.88 5.31 -0.02 4.11 5.66 -1.26 -2.60 114.28 123.59 3kj5 n THR 47 Ca -0.01 -5.14 -0.11 0.00 -3.05 0.00 0.00 64.05 55.74 3kj5 n THR 47 Cb 0.57 -2.00 -0.05 0.00 -1.55 0.00 0.00 70.33 67.30 3kj5 n THR 47 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 3kj5 h ARG 48 N 4.93 0.19 -4.47 1.09 -0.00 -1.04 -3.44 114.38 111.64 3kj5 h ARG 48 Ca 0.48 -0.03 -0.41 0.00 -0.50 0.00 0.00 59.98 59.53 3kj5 h ARG 48 Cb 0.45 -0.04 -0.31 0.00 0.00 0.00 0.00 29.97 30.07 3kj5 h ARG 48 CO 1.40 0.23 -0.78 0.50 0.00 0.00 0.00 179.97 181.32 3kj5 s ARG 49 N -5.78 0.84 -0.41 0.04 6.06 -1.13 -4.99 118.95 113.58 3kj5 s ARG 49 Ca -0.13 -0.26 0.02 0.00 -2.50 0.00 0.00 55.73 52.86 3kj5 s ARG 49 Cb 0.07 -0.80 0.11 0.00 0.06 0.00 0.00 34.95 34.39 3kj5 s ARG 49 CO 0.69 0.09 0.15 0.99 -2.50 0.00 0.00 175.30 174.72 3kj5 s THR 50 N 0.23 2.65 -0.58 4.11 2.01 -1.26 -0.45 115.64 122.35 3kj5 s THR 50 Ca -0.03 -2.53 -0.24 0.00 0.31 0.00 0.00 61.69 59.19 3kj5 s THR 50 Cb -0.08 -2.88 0.04 0.00 0.01 0.00 0.00 72.50 69.59 3kj5 s THR 50 CO 0.00 -0.68 0.98 -0.76 -0.69 0.00 0.00 174.62 173.47 3kj5 s LEU 51 N 0.64 4.05 0.07 4.42 1.43 0.12 -4.95 118.68 124.45 3kj5 s LEU 51 Ca 0.12 -0.41 0.04 0.00 -1.03 0.00 0.00 54.13 52.85 3kj5 s LEU 51 Cb -0.21 -2.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 3kj5 s LEU 51 CO -0.05 -1.30 0.01 -0.13 0.23 0.00 0.00 176.35 175.10 3kj5 s ARG 52 N 4.12 2.64 0.00 1.70 0.52 -1.26 -0.91 118.95 125.76 3kj5 s ARG 52 Ca 0.30 -0.77 0.00 0.00 -0.52 0.00 0.00 55.73 54.75 3kj5 s ARG 52 Cb -0.13 -2.59 0.00 0.00 0.52 0.00 0.00 34.95 32.75 3kj5 s ARG 52 CO 0.18 0.56 0.00 0.41 0.02 0.00 0.00 175.30 176.48 3kj5 n GLY 53 N 0.77 -0.40 3.33 -3.53 0.00 -1.26 -5.04 105.19 99.06 3kj5 n GLY 53 Ca -0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.58 3kj5 n GLY 53 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3kj5 s HIS 54 N 0.00 2.78 0.12 1.61 3.76 -1.26 -5.04 115.29 117.26 3kj5 s HIS 54 Ca 0.00 -0.79 0.02 0.00 -0.15 0.00 0.00 55.06 54.14 3kj5 s HIS 54 Cb 0.00 -1.85 -0.16 0.00 1.11 0.00 0.00 32.58 31.68 3kj5 s HIS 54 CO 0.00 -0.30 1.27 -0.07 -0.85 0.00 0.00 174.74 174.79 3kj5 h LEU 55 N 6.89 0.24 0.00 0.89 4.07 -1.96 -3.45 115.31 121.99 3kj5 h LEU 55 Ca -0.27 -0.23 -0.08 0.00 0.08 0.00 0.00 57.88 57.38 3kj5 h LEU 55 Cb 1.21 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.85 3kj5 h LEU 55 CO 0.55 1.12 -0.07 0.00 -1.08 0.00 0.00 178.44 178.96 3kj5 n ALA 56 N -2.45 0.09 -0.25 1.53 0.00 -1.26 -4.97 120.51 113.19 3kj5 n ALA 56 Ca -0.04 -0.36 -0.11 0.00 0.00 0.00 0.00 53.44 52.93 3kj5 n ALA 56 Cb 0.92 0.29 -0.09 0.00 0.00 0.00 0.00 19.45 20.57 3kj5 n ALA 56 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3kj5 h LYS 57 N 0.00 -0.16 -2.26 0.00 1.57 -1.84 -3.35 116.57 110.53 3kj5 h LYS 57 Ca -0.05 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3kj5 h LYS 57 Cb 0.23 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 3kj5 h LYS 57 CO 0.07 -0.11 -0.04 -0.89 -0.57 0.00 0.00 179.45 177.91 3kj5 n ILE 58 N -5.04 -2.54 0.66 1.86 5.41 -1.16 -3.11 119.36 115.44 3kj5 n ILE 58 Ca -0.01 0.10 0.07 0.00 1.00 0.00 0.00 62.75 63.91 3kj5 n ILE 58 Cb 0.27 -3.19 -0.09 0.00 -0.71 0.00 0.00 39.64 35.92 3kj5 n ILE 58 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 3kj5 n TYR 59 N 0.06 0.00 -3.80 1.39 4.02 1.04 -4.48 117.16 115.39 3kj5 n TYR 59 Ca -0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.76 3kj5 n TYR 59 Cb 0.00 -0.02 -0.11 0.00 -0.02 0.00 0.00 39.34 39.19 3kj5 n TYR 59 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3kj5 s ALA 60 N -2.43 -0.58 -0.09 -0.72 0.00 -1.21 -4.39 121.76 112.34 3kj5 s ALA 60 Ca 0.05 0.49 -0.12 0.00 0.00 0.00 0.00 51.96 52.38 3kj5 s ALA 60 Cb 0.11 -0.25 0.03 0.00 0.00 0.00 0.00 23.12 23.01 3kj5 s ALA 60 CO 0.61 -0.15 0.32 0.00 0.00 0.00 0.00 175.76 176.54 3kj5 s MET 61 N -0.33 0.48 0.11 0.00 0.23 -1.19 0.19 119.30 118.79 3kj5 s MET 61 Ca -0.04 0.23 0.06 0.00 -1.03 0.00 0.00 55.69 54.90 3kj5 s MET 61 Cb -0.03 0.22 -0.04 0.00 -1.53 0.00 0.00 34.83 33.46 3kj5 s MET 61 CO 0.01 -0.09 -0.14 -1.58 -2.03 0.00 0.00 175.02 171.19 3kj5 s HIS 62 N -0.35 1.34 -0.25 3.16 2.46 0.12 -4.76 115.29 117.02 3kj5 s HIS 62 Ca -0.05 -0.54 -0.05 0.00 0.47 0.00 0.00 55.06 54.90 3kj5 s HIS 62 Cb -0.03 -0.72 -0.00 0.00 -0.13 0.00 0.00 32.58 31.70 3kj5 s HIS 62 CO 0.02 0.11 0.00 -1.58 -2.47 0.00 0.00 174.74 170.82 3kj5 s TRP 63 N -1.95 3.04 0.64 3.88 0.52 -1.26 -1.43 118.94 122.38 3kj5 s TRP 63 Ca 0.06 -0.96 -0.17 0.00 0.02 0.00 0.00 56.10 55.05 3kj5 s TRP 63 Cb -0.06 -2.16 -0.04 0.00 -1.15 0.00 0.00 33.47 30.06 3kj5 s TRP 63 CO 0.03 -0.55 0.79 0.41 0.02 0.00 0.00 176.95 177.64 3kj5 n GLY 64 N 4.81 -0.81 0.34 0.98 0.00 0.51 -4.79 105.19 106.23 3kj5 n GLY 64 Ca -0.17 -0.23 -0.05 0.00 0.00 0.00 0.00 46.02 45.57 3kj5 n GLY 64 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3kj5 h THR 65 N 0.11 1.26 -0.77 2.61 1.35 -1.88 0.34 112.91 115.94 3kj5 h THR 65 Ca -0.47 -0.70 -0.04 0.00 -0.55 0.00 0.00 66.41 64.64 3kj5 h THR 65 Cb 1.36 0.19 -0.03 0.00 -1.73 0.00 0.00 68.15 67.93 3kj5 h THR 65 CO 0.48 0.30 0.32 -2.24 -0.25 0.00 0.00 175.52 174.13 3kj5 h ASP 66 N 1.18 1.04 0.00 5.36 2.03 -1.89 -3.44 116.42 120.70 3kj5 h ASP 66 Ca 0.29 -0.15 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 3kj5 h ASP 66 Cb 0.10 -0.27 0.00 0.00 -0.83 0.00 0.00 39.33 38.34 3kj5 h ASP 66 CO -0.04 0.91 0.00 -1.20 -1.03 0.00 0.00 179.24 177.88 3kj5 n SER 67 N -4.29 -0.99 -0.28 4.15 7.64 0.12 -4.88 113.62 115.09 3kj5 n SER 67 Ca 0.07 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.89 3kj5 n SER 67 Cb 0.17 -0.17 0.06 0.00 -1.01 0.00 0.00 64.21 63.27 3kj5 n SER 67 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 3kj5 h ARG 68 N 2.63 1.16 -4.86 1.43 2.47 -1.89 -3.45 114.38 111.87 3kj5 h ARG 68 Ca 0.00 -0.21 -0.32 0.00 -1.26 0.00 0.00 59.98 58.19 3kj5 h ARG 68 Cb 0.00 -0.19 -0.21 0.00 -1.65 0.00 0.00 29.97 27.92 3kj5 h ARG 68 CO 0.00 0.94 -0.75 -0.51 0.56 0.00 0.00 179.97 180.21 3kj5 s LEU 69 N -9.72 2.28 0.03 3.04 1.43 -1.26 -3.58 118.68 110.91 3kj5 s LEU 69 Ca -0.12 -0.61 -0.00 0.00 -1.03 0.00 0.00 54.13 52.37 3kj5 s LEU 69 Cb 0.15 -0.29 -0.03 0.00 0.03 0.00 0.00 46.19 46.06 3kj5 s LEU 69 CO 0.83 -0.17 -0.03 -1.48 0.23 0.00 0.00 176.35 175.73 3kj5 s LEU 70 N -1.74 2.31 -0.13 1.79 2.34 -0.13 -0.36 118.68 122.76 3kj5 s LEU 70 Ca -0.05 -0.65 0.01 0.00 0.06 0.00 0.00 54.13 53.50 3kj5 s LEU 70 Cb -0.09 0.10 -0.01 0.00 -0.56 0.00 0.00 46.19 45.64 3kj5 s LEU 70 CO 0.01 -0.38 -0.17 0.68 -1.06 0.00 0.00 176.35 175.43 3kj5 s VAL 71 N -2.15 2.62 -0.11 1.48 -7.23 -0.52 0.18 120.40 114.67 3kj5 s VAL 71 Ca -0.09 -0.81 0.03 0.00 -1.81 0.00 0.00 61.98 59.30 3kj5 s VAL 71 Cb -0.05 -2.07 -0.01 0.00 0.56 0.00 0.00 36.38 34.81 3kj5 s VAL 71 CO -0.03 0.53 -0.20 -0.94 -0.31 0.00 0.00 175.10 174.15 3kj5 s SER 72 N 0.47 3.41 -0.13 4.85 1.04 -1.24 -0.70 113.70 121.39 3kj5 s SER 72 Ca -0.12 -0.48 -0.07 0.00 0.48 0.00 0.00 55.95 55.77 3kj5 s SER 72 Cb -0.16 -1.46 -0.04 0.00 0.10 0.00 0.00 66.02 64.46 3kj5 s SER 72 CO 0.05 0.17 0.11 0.00 0.98 0.00 0.00 173.24 174.55 3kj5 s ALA 73 N 0.32 3.73 0.20 5.32 0.00 0.51 -3.67 121.76 128.18 3kj5 s ALA 73 Ca -0.16 -0.68 0.09 0.00 0.00 0.00 0.00 51.96 51.21 3kj5 s ALA 73 Cb -0.17 -1.92 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 3kj5 s ALA 73 CO 0.08 0.52 -0.08 0.45 0.00 0.00 0.00 175.76 176.73 3kj5 s SER 74 N -0.72 4.30 0.41 0.00 0.15 -1.23 0.34 113.70 116.95 3kj5 s SER 74 Ca 0.13 -0.61 0.13 0.00 0.70 0.00 0.00 55.95 56.30 3kj5 s SER 74 Cb -0.12 -0.74 0.86 0.00 -1.71 0.00 0.00 66.02 64.31 3kj5 s SER 74 CO 0.03 0.08 1.91 -0.61 1.20 0.00 0.00 173.24 175.84 3kj5 h GLN 75 N 2.64 0.02 -0.86 5.44 4.15 -1.83 -3.10 115.11 121.56 3kj5 h GLN 75 Ca -0.46 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 58.94 3kj5 h GLN 75 Cb 1.22 -0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.86 3kj5 h GLN 75 CO 0.56 0.28 0.49 0.38 -1.93 0.00 0.00 178.83 178.61 3kj5 h ASP 76 N 0.01 1.06 0.00 -0.69 2.03 -1.81 -3.43 116.42 113.60 3kj5 h ASP 76 Ca 0.00 -0.09 0.00 0.00 -0.73 0.00 0.00 57.03 56.21 3kj5 h ASP 76 Cb 0.48 -0.27 0.00 0.00 -0.83 0.00 0.00 39.33 38.71 3kj5 h ASP 76 CO 0.04 0.84 0.00 0.61 -1.03 0.00 0.00 179.24 179.70 3kj5 n GLY 77 N -1.15 -0.93 3.00 7.15 0.00 -1.17 -4.86 105.19 107.24 3kj5 n GLY 77 Ca 0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 3kj5 n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kj5 s LYS 78 N 0.00 0.76 -0.26 1.61 1.02 -1.26 -2.38 119.74 119.23 3kj5 s LYS 78 Ca 0.00 -0.29 -0.02 0.00 0.02 0.00 0.00 55.97 55.68 3kj5 s LYS 78 Cb 0.00 -0.73 0.03 0.00 -0.52 0.00 0.00 37.83 36.61 3kj5 s LYS 78 CO 0.00 0.15 -0.03 -0.48 -0.92 0.00 0.00 175.35 174.07 3kj5 s LEU 79 N -0.05 3.42 -0.14 3.17 0.05 -0.61 -3.58 118.68 120.95 3kj5 s LEU 79 Ca 0.01 -0.95 0.01 0.00 0.05 0.00 0.00 54.13 53.25 3kj5 s LEU 79 Cb -0.05 -1.70 -0.00 0.00 -2.05 0.00 0.00 46.19 42.39 3kj5 s LEU 79 CO -0.00 -0.16 -0.17 -0.63 -0.55 0.00 0.00 176.35 174.83 3kj5 s ILE 80 N 1.33 2.57 0.32 1.48 1.01 -1.24 -1.74 121.20 124.93 3kj5 s ILE 80 Ca -0.01 -0.82 -0.29 0.00 0.00 0.00 0.00 60.65 59.54 3kj5 s ILE 80 Cb -0.17 -2.06 -0.10 0.00 0.01 0.00 0.00 42.46 40.13 3kj5 s ILE 80 CO -0.03 0.53 1.40 -0.63 0.00 0.00 0.00 174.94 176.21 3kj5 s ILE 81 N 0.60 2.49 -0.18 2.92 1.09 -0.90 -3.82 121.20 123.40 3kj5 s ILE 81 Ca -0.10 0.47 -0.01 0.00 -1.10 0.00 0.00 60.65 59.91 3kj5 s ILE 81 Cb -0.16 -3.30 -0.00 0.00 -1.06 0.00 0.00 42.46 37.94 3kj5 s ILE 81 CO 0.03 0.10 -0.12 0.26 -0.10 0.00 0.00 174.94 175.11 3kj5 s TRP 82 N -0.78 2.85 -0.71 3.97 0.52 0.47 -1.63 118.94 123.62 3kj5 s TRP 82 Ca 0.53 -1.09 -0.19 0.00 0.02 0.00 0.00 56.10 55.38 3kj5 s TRP 82 Cb -0.42 -1.96 0.12 0.00 -1.15 0.00 0.00 33.47 30.05 3kj5 s TRP 82 CO 0.53 -0.54 0.84 0.34 0.02 0.00 0.00 176.95 178.14 3kj5 s ASP 83 N 1.09 6.37 0.37 2.95 -1.08 -1.04 -0.95 116.67 124.37 3kj5 s ASP 83 Ca 0.00 -1.71 0.07 0.00 -0.52 0.00 0.00 52.55 50.39 3kj5 s ASP 83 Cb -0.14 -2.32 0.73 0.00 -1.46 0.00 0.00 42.92 39.73 3kj5 s ASP 83 CO -0.03 -1.06 1.93 0.77 0.52 0.00 0.00 175.17 177.29 3kj5 h SER 84 N 8.95 0.37 0.42 -0.34 4.64 -1.85 0.13 113.55 125.86 3kj5 h SER 84 Ca -0.13 -0.06 -0.02 0.00 -0.47 0.00 0.00 61.79 61.11 3kj5 h SER 84 Cb 1.06 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 3kj5 h SER 84 CO 1.06 0.44 -0.20 1.88 -0.87 0.00 0.00 176.83 179.14 3kj5 h TYR 85 N 0.39 -0.52 -0.01 4.77 -1.99 -1.91 -3.08 116.97 114.63 3kj5 h TYR 85 Ca 0.09 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.81 3kj5 h TYR 85 Cb 0.27 0.17 0.00 0.00 2.00 0.00 0.00 36.73 39.17 3kj5 h TYR 85 CO 0.01 -0.31 -0.34 0.25 -0.00 0.00 0.00 178.16 177.76 3kj5 n THR 86 N -5.32 0.00 -3.45 -2.88 -2.24 -1.22 -4.95 114.28 94.22 3kj5 n THR 86 Ca -0.11 -0.14 -0.25 0.00 -2.27 0.00 0.00 64.05 61.29 3kj5 n THR 86 Cb 0.25 0.55 0.05 0.00 -2.10 0.00 0.00 70.33 69.08 3kj5 n THR 86 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3kj5 n THR 87 N -0.64 -2.31 -4.74 4.28 -2.24 0.40 -4.99 114.28 104.05 3kj5 n THR 87 Ca 0.11 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.59 3kj5 n THR 87 Cb 0.37 -3.42 -0.17 0.00 -2.10 0.00 0.00 70.33 65.01 3kj5 n THR 87 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3kj5 s ASN 88 N -3.06 2.63 0.27 3.42 2.47 -0.93 -4.97 114.94 114.78 3kj5 s ASN 88 Ca 0.49 -0.47 -0.29 0.00 0.42 0.00 0.00 52.86 53.00 3kj5 s ASN 88 Cb -0.23 -1.20 -0.10 0.00 -1.45 0.00 0.00 41.25 38.27 3kj5 s ASN 88 CO 0.61 0.07 1.36 -0.54 -3.72 0.00 0.00 177.10 174.89 3kj5 s LYS 89 N 0.71 4.32 0.06 0.43 1.02 -1.26 -2.51 119.74 122.51 3kj5 s LYS 89 Ca -0.12 2.23 -0.17 0.00 0.02 0.00 0.00 55.97 57.93 3kj5 s LYS 89 Cb -0.16 -3.11 -0.14 0.00 -0.52 0.00 0.00 37.83 33.90 3kj5 s LYS 89 CO 0.02 -0.30 1.32 0.28 -0.92 0.00 0.00 175.35 175.75 3kj5 h VAL 90 N 3.37 1.34 -2.33 3.17 2.07 -1.66 -3.47 116.25 118.74 3kj5 h VAL 90 Ca -0.47 -1.59 -0.04 0.00 0.82 0.00 0.00 66.70 65.42 3kj5 h VAL 90 Cb 1.22 1.93 -0.24 0.00 -1.52 0.00 0.00 31.29 32.67 3kj5 h VAL 90 CO 0.73 0.48 -0.20 -1.00 0.02 0.00 0.00 177.57 177.60 3kj5 s HIS 91 N -4.04 -0.91 -0.20 1.57 3.76 -1.25 -4.98 115.29 109.24 3kj5 s HIS 91 Ca -0.13 1.76 -0.02 0.00 -0.15 0.00 0.00 55.06 56.52 3kj5 s HIS 91 Cb 0.06 0.47 -0.00 0.00 1.11 0.00 0.00 32.58 34.22 3kj5 s HIS 91 CO 0.81 -0.48 -0.09 0.00 -0.85 0.00 0.00 174.74 174.13 3kj5 s ALA 92 N 2.01 2.67 -0.14 -1.40 0.00 -1.26 -2.12 121.76 121.52 3kj5 s ALA 92 Ca -0.07 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 50.74 3kj5 s ALA 92 Cb -0.09 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.50 3kj5 s ALA 92 CO -0.16 -0.34 -0.15 0.42 0.00 0.00 0.00 175.76 175.53 3kj5 s ILE 93 N 1.32 2.76 0.12 0.00 1.01 -0.71 -4.96 121.20 120.74 3kj5 s ILE 93 Ca 0.04 -0.75 -0.30 0.00 0.00 0.00 0.00 60.65 59.64 3kj5 s ILE 93 Cb -0.14 -2.16 -0.06 0.00 0.01 0.00 0.00 42.46 40.11 3kj5 s ILE 93 CO -0.05 0.52 1.00 -2.16 0.00 0.00 0.00 174.94 174.25 3kj5 s PRO 94 N 0.60 4.66 -0.27 2.79 0.04 -1.26 -1.57 135.00 139.99 3kj5 s PRO 94 Ca -0.09 1.51 -0.11 0.00 0.04 0.00 0.00 61.00 62.36 3kj5 s PRO 94 Cb -0.16 -3.36 -0.05 0.00 0.04 0.00 0.00 34.50 30.97 3kj5 s PRO 94 CO 0.03 0.16 0.17 -0.51 0.04 0.00 0.00 177.00 176.89 3kj5 s LEU 95 N 0.01 4.00 0.00 -3.56 1.43 -1.00 -4.91 118.68 114.66 3kj5 s LEU 95 Ca 0.48 0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.54 3kj5 s LEU 95 Cb -0.25 -2.10 -0.22 0.00 0.03 0.00 0.00 46.19 43.65 3kj5 s LEU 95 CO 0.31 -0.02 3.09 -2.11 0.23 0.00 0.00 176.35 177.85 3kj5 n ARG 96 N 4.86 1.66 -3.51 1.70 0.00 -1.26 -4.43 116.66 115.68 3kj5 n ARG 96 Ca -0.14 -0.83 -0.13 0.00 -0.00 0.00 0.00 57.85 56.75 3kj5 n ARG 96 Cb 0.52 -1.91 -0.04 0.00 -0.00 0.00 0.00 32.46 31.03 3kj5 n ARG 96 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 3kj5 s SER 97 N 2.17 -0.52 0.00 2.89 0.01 -1.26 -5.09 113.70 111.90 3kj5 s SER 97 Ca 0.55 0.34 0.00 0.00 1.31 0.00 0.00 55.95 58.16 3kj5 s SER 97 Cb 0.26 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.97 3kj5 s SER 97 CO 0.00 -0.64 0.10 -0.24 0.41 0.00 0.00 173.24 172.87 3kj5 n SER 98 N 0.34 0.19 -0.86 2.44 2.88 -1.26 -4.68 113.62 112.67 3kj5 n SER 98 Ca -0.15 -0.52 0.06 0.00 -1.33 0.00 0.00 58.87 56.94 3kj5 n SER 98 Cb 0.60 0.44 0.24 0.00 -0.75 0.00 0.00 64.21 64.74 3kj5 n SER 98 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 3kj5 n TRP 99 N -0.44 0.88 -2.12 0.66 8.01 -1.26 -4.58 117.44 118.59 3kj5 n TRP 99 Ca 0.00 -1.01 -0.41 0.00 -1.31 0.00 0.00 57.50 54.77 3kj5 n TRP 99 Cb 0.03 -0.33 -0.02 0.00 -2.01 0.00 0.00 31.31 28.97 3kj5 n TRP 99 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.69 176.82 3kj5 s VAL 100 N -2.91 2.78 -1.48 -0.99 -7.23 -1.26 -4.01 120.40 105.30 3kj5 s VAL 100 Ca 0.42 0.75 0.12 0.00 -1.81 0.00 0.00 61.98 61.46 3kj5 s VAL 100 Cb 0.35 -3.48 0.14 0.00 0.56 0.00 0.00 36.38 33.95 3kj5 s VAL 100 CO 0.07 0.16 0.96 0.23 -0.31 0.00 0.00 175.10 176.22 3kj5 n MET 101 N 1.22 1.11 -4.04 4.82 0.00 -0.13 -4.77 117.12 115.32 3kj5 n MET 101 Ca 0.02 -1.40 -0.12 0.00 0.00 0.00 0.00 57.70 56.20 3kj5 n MET 101 Cb 0.42 -1.25 -0.11 0.00 0.00 0.00 0.00 33.22 32.27 3kj5 n MET 101 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 175.97 175.89 3kj5 s THR 102 N -1.04 0.42 0.06 2.03 -1.32 -0.21 -4.44 115.64 111.13 3kj5 s THR 102 Ca 0.17 -1.01 -0.09 0.00 -1.21 0.00 0.00 61.69 59.55 3kj5 s THR 102 Cb 0.11 -0.50 0.00 0.00 -1.51 0.00 0.00 72.50 70.60 3kj5 s THR 102 CO 0.16 -0.40 0.19 0.00 -2.21 0.00 0.00 174.62 172.36 3kj5 s ALA 104 N -2.98 0.44 -0.18 0.00 0.00 0.96 -4.71 121.76 115.28 3kj5 s ALA 104 Ca -0.02 -1.28 -0.05 0.00 0.00 0.00 0.00 51.96 50.61 3kj5 s ALA 104 Cb 0.01 1.19 0.06 0.00 0.00 0.00 0.00 23.12 24.39 3kj5 s ALA 104 CO -0.06 -0.76 0.09 -0.47 0.00 0.00 0.00 175.76 174.56 3kj5 s TYR 105 N -3.85 0.27 0.13 0.00 6.14 -1.26 -3.24 117.35 115.53 3kj5 s TYR 105 Ca 0.30 -0.41 -0.31 0.00 0.64 0.00 0.00 57.07 57.29 3kj5 s TYR 105 Cb 0.02 -0.74 -0.11 0.00 0.42 0.00 0.00 41.96 41.55 3kj5 s TYR 105 CO 0.13 -0.55 1.82 0.00 0.64 0.00 0.00 175.55 177.59 3kj5 s ALA 106 N 2.11 3.79 0.26 3.97 0.00 0.19 -4.82 121.76 127.26 3kj5 s ALA 106 Ca 0.02 1.47 0.15 0.00 0.00 0.00 0.00 51.96 53.60 3kj5 s ALA 106 Cb -0.16 -3.76 0.94 0.00 0.00 0.00 0.00 23.12 20.15 3kj5 s ALA 106 CO -0.12 -1.20 1.10 -2.30 0.00 0.00 0.00 175.76 173.25 3kj5 n PRO 107 N 5.50 -0.04 -0.17 0.00 -0.02 -1.26 0.19 135.00 139.20 3kj5 n PRO 107 Ca 0.18 0.96 -0.03 0.00 -2.02 0.00 0.00 63.50 62.59 3kj5 n PRO 107 Cb 0.38 -1.73 0.17 0.00 -0.02 0.00 0.00 33.50 32.29 3kj5 n PRO 107 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3kj5 h SER 108 N 0.00 0.86 0.00 2.55 0.02 -1.92 -3.43 113.55 111.63 3kj5 h SER 108 Ca 0.59 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 3kj5 h SER 108 Cb 1.58 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.89 3kj5 h SER 108 CO -0.54 0.80 0.00 0.61 -1.14 0.00 0.00 176.83 176.56 3kj5 n GLY 109 N -0.91 1.94 0.31 -3.77 0.00 0.51 -4.92 105.19 98.35 3kj5 n GLY 109 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.02 3kj5 n GLY 109 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3kj5 h ASN 110 N 0.00 0.93 -4.27 1.61 -0.26 -1.90 -3.44 115.58 108.25 3kj5 h ASN 110 Ca 0.00 -0.20 -0.69 0.00 -0.56 0.00 0.00 56.30 54.85 3kj5 h ASN 110 Cb 0.00 -0.25 -0.26 0.00 -1.06 0.00 0.00 38.32 36.75 3kj5 h ASN 110 CO 0.00 0.92 -0.82 -0.31 -1.06 0.00 0.00 177.43 176.16 3kj5 s TYR 111 N -5.21 2.54 -0.05 1.19 2.02 -1.26 -1.59 117.35 115.00 3kj5 s TYR 111 Ca -0.11 -0.28 0.02 0.00 -0.37 0.00 0.00 57.07 56.33 3kj5 s TYR 111 Cb 0.15 -1.58 0.01 0.00 -0.40 0.00 0.00 41.96 40.14 3kj5 s TYR 111 CO 0.83 0.09 -0.10 0.08 -1.57 0.00 0.00 175.55 174.88 3kj5 s VAL 112 N -0.67 0.91 -0.08 0.71 1.01 -1.12 0.53 120.40 121.69 3kj5 s VAL 112 Ca 0.11 -0.38 0.04 0.00 0.00 0.00 0.00 61.98 61.75 3kj5 s VAL 112 Cb -0.10 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.44 3kj5 s VAL 112 CO -0.00 0.29 -0.19 0.00 0.00 0.00 0.00 175.10 175.20 3kj5 s ALA 113 N 0.52 1.79 -0.05 5.51 0.00 -1.20 -1.30 121.76 127.03 3kj5 s ALA 113 Ca -0.10 -0.76 0.03 0.00 0.00 0.00 0.00 51.96 51.14 3kj5 s ALA 113 Cb -0.13 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.32 3kj5 s ALA 113 CO 0.02 0.25 -0.15 0.00 0.00 0.00 0.00 175.76 175.88 3kj5 s GLY 115 N 0.26 1.35 0.19 0.00 0.00 -0.58 -2.51 107.32 106.03 3kj5 s GLY 115 Ca -0.07 -0.96 0.00 0.00 0.00 0.00 0.00 44.72 43.68 3kj5 s GLY 115 CO 0.03 -0.31 0.07 -0.32 0.00 0.00 0.00 173.10 172.56 3kj5 s GLY 116 N 0.35 1.34 0.00 0.20 0.00 -1.26 -0.96 107.32 106.98 3kj5 s GLY 116 Ca -0.18 -1.65 -0.03 0.00 0.00 0.00 0.00 44.72 42.85 3kj5 s GLY 116 CO 0.09 -1.47 2.37 1.47 0.00 0.00 0.00 173.10 175.55 3kj5 n LEU 117 N -0.26 3.73 -0.97 0.66 -0.00 -1.26 0.17 117.00 119.08 3kj5 n LEU 117 Ca -0.03 -2.21 0.12 0.00 -0.00 0.00 0.00 56.01 53.89 3kj5 n LEU 117 Cb 0.65 -0.95 0.19 0.00 -0.00 0.00 0.00 43.42 43.31 3kj5 n LEU 117 CO 0.34 0.97 0.68 -0.90 -0.00 0.00 0.00 177.39 178.48 3kj5 n ASP 118 N 2.38 2.96 -3.73 1.45 5.75 -1.26 -4.96 116.55 119.14 3kj5 n ASP 118 Ca 0.22 -1.94 -0.29 0.00 -0.01 0.00 0.00 54.79 52.78 3kj5 n ASP 118 Cb 0.57 -0.09 -0.00 0.00 -1.03 0.00 0.00 41.12 40.56 3kj5 n ASP 118 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3kj5 n ASN 119 N 1.24 -3.84 -3.64 -1.12 4.13 0.45 -4.92 115.26 107.57 3kj5 n ASN 119 Ca 0.16 -0.65 -0.05 0.00 1.68 0.00 0.00 54.58 55.73 3kj5 n ASN 119 Cb 0.57 -3.14 -0.06 0.00 -1.54 0.00 0.00 39.78 35.61 3kj5 n ASN 119 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 3kj5 s ILE 120 N -3.10 -0.42 -0.17 2.41 -4.36 -1.24 -4.40 121.20 109.91 3kj5 s ILE 120 Ca 0.56 0.00 -0.24 0.00 -0.26 0.00 0.00 60.65 60.71 3kj5 s ILE 120 Cb -0.30 -0.99 -0.02 0.00 1.25 0.00 0.00 42.46 42.40 3kj5 s ILE 120 CO 0.69 0.00 0.77 0.00 0.24 0.00 0.00 174.94 176.64 3kj5 s SER 122 N 1.15 5.34 -0.47 0.00 0.01 -1.04 0.05 113.70 118.73 3kj5 s SER 122 Ca 0.35 -0.41 -0.17 0.00 1.31 0.00 0.00 55.95 57.03 3kj5 s SER 122 Cb -0.16 -1.96 0.05 0.00 0.21 0.00 0.00 66.02 64.16 3kj5 s SER 122 CO 0.12 -0.13 0.48 -0.63 0.41 0.00 0.00 173.24 173.50 3kj5 s ILE 123 N 1.60 5.07 0.25 1.44 -1.09 -1.12 -2.75 121.20 124.60 3kj5 s ILE 123 Ca 0.05 -0.66 -0.17 0.00 -2.23 0.00 0.00 60.65 57.64 3kj5 s ILE 123 Cb -0.16 -4.16 -0.08 0.00 -1.58 0.00 0.00 42.46 36.48 3kj5 s ILE 123 CO 0.05 -0.61 0.70 -0.31 -1.23 0.00 0.00 174.94 173.54 3kj5 s TYR 124 N 2.12 3.52 -0.32 3.97 2.02 -0.42 -4.06 117.35 124.19 3kj5 s TYR 124 Ca 0.10 1.26 -0.12 0.00 -0.37 0.00 0.00 57.07 57.95 3kj5 s TYR 124 Cb -0.20 -2.54 -0.02 0.00 -0.40 0.00 0.00 41.96 38.79 3kj5 s TYR 124 CO 0.10 0.25 0.20 1.21 -1.57 0.00 0.00 175.55 175.74 3kj5 s ASN 125 N -1.94 5.90 -0.02 2.29 3.84 -1.24 -2.80 114.94 120.97 3kj5 s ASN 125 Ca 0.47 -0.35 0.12 0.00 0.21 0.00 0.00 52.86 53.31 3kj5 s ASN 125 Cb -0.14 -2.10 0.39 0.00 -0.55 0.00 0.00 41.25 38.86 3kj5 s ASN 125 CO 0.19 -0.18 1.30 0.18 -2.79 0.00 0.00 177.10 175.80 3kj5 n LEU 126 N 5.06 2.51 -2.25 3.21 4.77 -0.62 -3.91 117.00 125.77 3kj5 n LEU 126 Ca -0.13 -1.26 -0.32 0.00 -0.03 0.00 0.00 56.01 54.27 3kj5 n LEU 126 Cb 0.50 -0.34 0.06 0.00 -2.33 0.00 0.00 43.42 41.32 3kj5 n LEU 126 CO 0.35 0.55 1.11 0.29 -1.33 0.00 0.00 177.39 178.36 3kj5 n LYS 127 N 0.68 2.94 -1.97 3.23 4.76 -1.26 -4.98 118.16 121.57 3kj5 n LYS 127 Ca 0.14 -3.53 -0.03 0.00 -2.87 0.00 0.00 58.31 52.02 3kj5 n LYS 127 Cb 0.43 -2.29 -0.00 0.00 -1.84 0.00 0.00 35.03 31.33 3kj5 n LYS 127 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3kj5 n GLY 131 N -0.86 2.50 3.87 0.72 0.00 -1.26 -4.98 105.19 105.18 3kj5 n GLY 131 Ca 0.58 -1.31 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 3kj5 n GLY 131 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3kj5 s ASN 132 N -1.50 6.54 0.22 1.61 3.04 -1.26 -5.03 114.94 118.55 3kj5 s ASN 132 Ca 0.06 1.17 -0.32 0.00 0.04 0.00 0.00 52.86 53.81 3kj5 s ASN 132 Cb -0.01 -2.34 -0.13 0.00 -1.54 0.00 0.00 41.25 37.24 3kj5 s ASN 132 CO 0.04 -0.41 1.56 0.52 -3.04 0.00 0.00 177.10 175.77 3kj5 n VAL 133 N -1.30 0.51 -3.79 -5.21 0.31 -1.25 -4.93 118.33 102.67 3kj5 n VAL 133 Ca 0.03 -0.13 -0.10 0.00 -0.01 0.00 0.00 64.34 64.13 3kj5 n VAL 133 Cb 0.54 -1.69 -0.06 0.00 -0.91 0.00 0.00 33.84 31.72 3kj5 n VAL 133 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3kj5 s ARG 134 N 0.25 1.07 -0.92 5.55 0.52 -1.26 -4.97 118.95 119.18 3kj5 s ARG 134 Ca 0.72 -0.91 -0.21 0.00 -0.52 0.00 0.00 55.73 54.80 3kj5 s ARG 134 Cb -0.60 0.42 0.09 0.00 0.52 0.00 0.00 34.95 35.38 3kj5 s ARG 134 CO 0.43 -0.40 1.25 0.08 0.02 0.00 0.00 175.30 176.68 3kj5 s VAL 135 N -3.87 4.29 0.19 3.52 1.01 -1.26 -3.71 120.40 120.57 3kj5 s VAL 135 Ca 0.08 -0.99 -0.09 0.00 0.00 0.00 0.00 61.98 60.98 3kj5 s VAL 135 Cb 0.03 -4.89 0.10 0.00 0.00 0.00 0.00 36.38 31.62 3kj5 s VAL 135 CO -0.08 -1.70 1.71 0.77 0.00 0.00 0.00 175.10 175.80 3kj5 h SER 136 N 9.38 1.03 -4.23 3.32 4.64 -1.97 -3.45 113.55 122.28 3kj5 h SER 136 Ca 0.10 -0.23 -0.49 0.00 -0.47 0.00 0.00 61.79 60.70 3kj5 h SER 136 Cb 1.03 -0.27 -0.21 0.00 -0.31 0.00 0.00 62.40 62.63 3kj5 h SER 136 CO 1.26 0.99 -0.80 -0.13 -0.87 0.00 0.00 176.83 177.28 3kj5 s ARG 137 N -5.32 1.01 -0.04 4.77 1.81 -1.26 -5.09 118.95 114.83 3kj5 s ARG 137 Ca -0.12 -1.11 -0.02 0.00 -1.72 0.00 0.00 55.73 52.76 3kj5 s ARG 137 Cb 0.14 -1.12 0.03 0.00 -0.45 0.00 0.00 34.95 33.55 3kj5 s ARG 137 CO 0.84 0.25 0.09 -1.83 -0.68 0.00 0.00 175.30 173.97 3kj5 s GLU 138 N -2.00 0.04 -0.47 3.54 -1.05 -1.26 -2.81 118.70 114.69 3kj5 s GLU 138 Ca 0.04 0.25 -0.15 0.00 -0.15 0.00 0.00 54.97 54.97 3kj5 s GLU 138 Cb -0.09 -0.16 0.08 0.00 -0.44 0.00 0.00 34.13 33.51 3kj5 s GLU 138 CO 0.04 -0.14 0.39 -0.51 0.95 0.00 0.00 175.26 175.98 3kj5 s LEU 139 N 0.92 5.61 -0.37 1.83 1.43 0.11 -4.92 118.68 123.28 3kj5 s LEU 139 Ca -0.07 -1.38 0.04 0.00 -1.03 0.00 0.00 54.13 51.68 3kj5 s LEU 139 Cb -0.10 -2.16 0.11 0.00 0.03 0.00 0.00 46.19 44.07 3kj5 s LEU 139 CO -0.04 -0.65 0.09 0.00 0.23 0.00 0.00 176.35 175.99 3kj5 s ALA 140 N 1.61 2.90 0.00 4.21 0.00 -1.26 -2.00 121.76 127.22 3kj5 s ALA 140 Ca 0.04 -2.63 0.00 0.00 0.00 0.00 0.00 51.96 49.37 3kj5 s ALA 140 Cb -0.25 -1.99 0.00 0.00 0.00 0.00 0.00 23.12 20.89 3kj5 s ALA 140 CO 0.06 -1.75 0.00 0.41 0.00 0.00 0.00 175.76 174.48 3kj5 n GLY 141 N 4.07 0.58 3.18 0.00 0.00 -1.26 -5.10 105.19 106.65 3kj5 n GLY 141 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3kj5 n GLY 141 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3kj5 s HIS 142 N -1.04 3.50 0.35 1.61 3.76 -1.26 -4.97 115.29 117.24 3kj5 s HIS 142 Ca 0.00 -2.31 0.16 0.00 -0.15 0.00 0.00 55.06 52.76 3kj5 s HIS 142 Cb 0.00 -3.41 1.19 0.00 1.11 0.00 0.00 32.58 31.48 3kj5 s HIS 142 CO 0.00 -0.93 1.58 1.79 -0.85 0.00 0.00 174.74 176.34 3kj5 h THR 143 N 5.51 0.03 -4.30 1.30 1.35 -1.96 -3.42 112.91 111.42 3kj5 h THR 143 Ca -0.06 -0.01 -0.51 0.00 -0.55 0.00 0.00 66.41 65.29 3kj5 h THR 143 Cb 1.01 -0.00 0.09 0.00 -1.73 0.00 0.00 68.15 67.52 3kj5 h THR 143 CO 0.76 0.00 0.36 -0.83 -0.25 0.00 0.00 175.52 175.57 3kj5 s GLY 144 N -4.45 1.79 0.61 5.82 0.00 -1.26 -4.83 107.32 105.00 3kj5 s GLY 144 Ca -0.10 0.20 -0.18 0.00 0.00 0.00 0.00 44.72 44.64 3kj5 s GLY 144 CO 0.78 0.52 1.20 -2.52 0.00 0.00 0.00 173.10 173.08 3kj5 s TYR 145 N -2.86 2.37 -0.53 1.90 1.13 -1.26 -3.39 117.35 114.70 3kj5 s TYR 145 Ca 0.60 1.52 -0.18 0.00 -1.41 0.00 0.00 57.07 57.61 3kj5 s TYR 145 Cb -0.15 -3.47 0.09 0.00 -1.10 0.00 0.00 41.96 37.33 3kj5 s TYR 145 CO 0.50 -2.23 0.57 -1.17 -2.51 0.00 0.00 175.55 170.71 3kj5 s LEU 146 N -4.19 5.53 0.16 -3.49 0.20 -1.25 0.45 118.68 116.09 3kj5 s LEU 146 Ca 0.77 -1.38 -0.12 0.00 0.69 0.00 0.00 54.13 54.09 3kj5 s LEU 146 Cb -0.30 -2.29 0.04 0.00 -0.43 0.00 0.00 46.19 43.21 3kj5 s LEU 146 CO 0.34 -0.90 1.65 0.77 -0.29 0.00 0.00 176.35 177.92 3kj5 h SER 147 N 8.98 0.82 -4.95 3.68 4.64 -1.79 -3.36 113.55 121.57 3kj5 h SER 147 Ca -0.29 -0.25 0.06 0.00 -0.47 0.00 0.00 61.79 60.84 3kj5 h SER 147 Cb 1.10 -0.22 -0.11 0.00 -0.31 0.00 0.00 62.40 62.86 3kj5 h SER 147 CO 1.01 0.86 0.33 0.00 -0.87 0.00 0.00 176.83 178.16 3kj5 s ARG 150 N 0.11 2.08 0.47 0.00 1.81 0.34 -4.69 118.95 119.08 3kj5 s ARG 150 Ca -0.00 -0.54 -0.19 0.00 -1.72 0.00 0.00 55.73 53.28 3kj5 s ARG 150 Cb -0.01 -1.69 -0.09 0.00 -0.45 0.00 0.00 34.95 32.70 3kj5 s ARG 150 CO 0.00 0.04 0.98 -0.06 -0.68 0.00 0.00 175.30 175.58 3kj5 s PHE 151 N 0.68 3.27 0.00 -0.53 0.08 -1.26 0.14 117.98 120.35 3kj5 s PHE 151 Ca -0.14 1.56 0.00 0.00 0.12 0.00 0.00 56.93 58.48 3kj5 s PHE 151 Cb -0.16 -2.89 0.00 0.00 -0.57 0.00 0.00 43.02 39.40 3kj5 s PHE 151 CO 0.04 -0.37 0.00 1.28 -0.10 0.00 0.00 175.22 176.07 3kj5 n LEU 152 N -1.02 0.00 -3.49 -0.37 4.32 0.12 -4.84 117.00 111.71 3kj5 n LEU 152 Ca 0.07 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.97 3kj5 n LEU 152 Cb 0.54 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.32 3kj5 n LEU 152 CO 0.40 0.00 0.64 1.51 -1.22 0.00 0.00 177.39 178.73 3kj5 s ASP 153 N -1.85 -0.40 0.19 -1.43 -4.77 -1.21 -5.02 116.67 102.19 3kj5 s ASP 153 Ca 0.00 -0.00 -0.33 0.00 -3.30 0.00 0.00 52.55 48.92 3kj5 s ASP 153 Cb 0.00 0.42 -0.13 0.00 -1.09 0.00 0.00 42.92 42.12 3kj5 s ASP 153 CO 0.00 -0.68 1.56 0.47 0.70 0.00 0.00 175.17 177.22 3kj5 n ASP 154 N -0.27 3.17 0.00 2.11 9.92 -1.26 -1.28 116.55 128.94 3kj5 n ASP 154 Ca -0.10 1.10 0.00 0.00 -0.53 0.00 0.00 54.79 55.26 3kj5 n ASP 154 Cb 0.62 -1.46 0.00 0.00 -0.64 0.00 0.00 41.12 39.65 3kj5 n ASP 154 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3kj5 n ASN 155 N 3.10 -2.39 -3.81 -2.24 3.02 -1.26 -5.01 115.26 106.67 3kj5 n ASN 155 Ca 0.15 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.57 3kj5 n ASN 155 Cb 0.31 -0.40 -0.13 0.00 -0.61 0.00 0.00 39.78 38.95 3kj5 n ASN 155 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3kj5 s GLN 156 N -0.21 0.15 -0.01 3.52 -0.21 -0.40 0.14 119.66 122.64 3kj5 s GLN 156 Ca 0.00 0.24 -0.20 0.00 0.02 0.00 0.00 55.36 55.42 3kj5 s GLN 156 Cb 0.00 0.02 0.04 0.00 1.00 0.00 0.00 33.01 34.07 3kj5 s GLN 156 CO 0.00 -0.05 0.43 -1.50 -2.12 0.00 0.00 175.29 172.05 3kj5 s ILE 157 N 0.33 0.04 -0.15 1.08 2.07 -1.03 0.16 121.20 123.70 3kj5 s ILE 157 Ca -0.02 -0.34 -0.01 0.00 -1.41 0.00 0.00 60.65 58.87 3kj5 s ILE 157 Cb -0.03 -0.78 -0.02 0.00 0.13 0.00 0.00 42.46 41.76 3kj5 s ILE 157 CO -0.01 -0.19 -0.10 -0.69 -1.91 0.00 0.00 174.94 172.04 3kj5 s VAL 158 N -1.48 3.26 -0.02 4.00 1.01 0.37 -1.86 120.40 125.68 3kj5 s VAL 158 Ca -0.11 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.36 3kj5 s VAL 158 Cb -0.03 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 3kj5 s VAL 158 CO 0.05 0.51 -0.24 0.42 0.00 0.00 0.00 175.10 175.83 3kj5 s THR 159 N 0.48 1.91 0.61 3.92 -4.23 -1.00 0.13 115.64 117.46 3kj5 s THR 159 Ca -0.07 -1.03 -0.08 0.00 -1.18 0.00 0.00 61.69 59.33 3kj5 s THR 159 Cb -0.15 -1.59 -0.00 0.00 1.34 0.00 0.00 72.50 72.10 3kj5 s THR 159 CO 0.04 0.54 0.96 -0.94 -0.54 0.00 0.00 174.62 174.68 3kj5 s SER 160 N -0.51 5.71 0.08 3.99 1.04 -0.21 -0.97 113.70 122.84 3kj5 s SER 160 Ca 0.08 0.95 0.01 0.00 0.48 0.00 0.00 55.95 57.47 3kj5 s SER 160 Cb -0.10 -1.94 -0.04 0.00 0.10 0.00 0.00 66.02 64.05 3kj5 s SER 160 CO -0.00 -1.06 -0.06 -0.55 0.98 0.00 0.00 173.24 172.55 3kj5 s SER 161 N -4.28 0.94 0.18 7.02 0.15 -0.73 -3.86 113.70 113.12 3kj5 s SER 161 Ca 0.54 -0.98 -0.13 0.00 0.70 0.00 0.00 55.95 56.08 3kj5 s SER 161 Cb -0.11 0.12 0.10 0.00 -1.71 0.00 0.00 66.02 64.42 3kj5 s SER 161 CO 0.48 -0.49 1.82 1.23 1.20 0.00 0.00 173.24 177.49 3kj5 h GLY 162 N 3.09 0.76 -2.67 9.45 0.00 0.97 -3.18 103.07 111.48 3kj5 h GLY 162 Ca -0.35 -0.25 -0.55 0.00 0.00 0.00 0.00 47.33 46.18 3kj5 h GLY 162 CO 0.64 0.22 0.59 -0.35 0.00 0.00 0.00 176.54 177.64 3kj5 s ASP 163 N -5.63 5.19 -0.97 0.19 -1.08 -1.26 -4.21 116.67 108.90 3kj5 s ASP 163 Ca -0.13 2.73 -0.24 0.00 -0.52 0.00 0.00 52.55 54.40 3kj5 s ASP 163 Cb 0.13 -2.63 -0.01 0.00 -1.46 0.00 0.00 42.92 38.94 3kj5 s ASP 163 CO 0.74 -1.62 1.78 0.42 0.52 0.00 0.00 175.17 177.01 3kj5 s THR 164 N -1.32 3.64 -0.29 1.71 -4.23 -1.26 -4.34 115.64 109.54 3kj5 s THR 164 Ca 0.73 -0.59 -0.33 0.00 -1.18 0.00 0.00 61.69 60.32 3kj5 s THR 164 Cb -0.40 -4.43 0.18 0.00 1.34 0.00 0.00 72.50 69.19 3kj5 s THR 164 CO 0.46 -1.32 1.39 0.28 -0.54 0.00 0.00 174.62 174.89 3kj5 s THR 165 N 8.25 0.00 -0.09 3.99 -1.32 -1.26 -4.50 115.64 120.70 3kj5 s THR 165 Ca 0.61 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 61.10 3kj5 s THR 165 Cb -0.04 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.93 3kj5 s THR 165 CO -0.03 0.00 -0.10 0.00 -2.21 0.00 0.00 174.62 172.28 3kj5 s ALA 167 N -0.28 2.20 0.16 0.00 0.00 -0.14 -2.69 121.76 121.02 3kj5 s ALA 167 Ca 0.03 -1.04 -0.30 0.00 0.00 0.00 0.00 51.96 50.65 3kj5 s ALA 167 Cb -0.13 -0.93 -0.07 0.00 0.00 0.00 0.00 23.12 21.99 3kj5 s ALA 167 CO 0.03 0.07 1.15 -1.17 0.00 0.00 0.00 175.76 175.84 3kj5 s LEU 168 N 0.66 4.45 -0.12 0.00 2.96 -0.67 -2.36 118.68 123.61 3kj5 s LEU 168 Ca -0.11 2.13 0.02 0.00 -0.22 0.00 0.00 54.13 55.96 3kj5 s LEU 168 Cb -0.16 -3.60 0.01 0.00 0.50 0.00 0.00 46.19 42.94 3kj5 s LEU 168 CO 0.02 -0.32 -0.19 0.26 -1.32 0.00 0.00 176.35 174.79 3kj5 s TRP 169 N 0.04 2.36 -0.63 5.38 0.52 -0.78 0.93 118.94 126.77 3kj5 s TRP 169 Ca 0.52 -1.13 -0.26 0.00 0.02 0.00 0.00 56.10 55.25 3kj5 s TRP 169 Cb -0.31 -1.64 0.04 0.00 -1.15 0.00 0.00 33.47 30.42 3kj5 s TRP 169 CO 0.35 -0.53 1.10 0.34 0.02 0.00 0.00 176.95 178.23 3kj5 s ASP 170 N 0.82 6.29 0.17 2.95 2.15 -1.12 -2.46 116.67 125.47 3kj5 s ASP 170 Ca -0.08 -0.38 -0.14 0.00 0.43 0.00 0.00 52.55 52.37 3kj5 s ASP 170 Cb -0.16 -2.50 0.06 0.00 -0.30 0.00 0.00 42.92 40.03 3kj5 s ASP 170 CO -0.00 -1.50 1.81 0.40 -0.17 0.00 0.00 175.17 175.70 3kj5 h ILE 171 N 6.05 1.16 -2.67 4.11 2.04 0.94 0.23 117.51 129.37 3kj5 h ILE 171 Ca -0.27 -0.37 -0.56 0.00 1.00 0.00 0.00 64.86 64.66 3kj5 h ILE 171 Cb 1.06 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 3kj5 h ILE 171 CO 1.18 0.17 1.13 -0.70 0.00 0.00 0.00 178.15 179.93 3kj5 s GLU 172 N -5.99 3.91 -1.57 2.37 2.12 -1.22 -1.34 118.70 116.99 3kj5 s GLU 172 Ca -0.13 1.88 -0.06 0.00 0.36 0.00 0.00 54.97 57.01 3kj5 s GLU 172 Cb 0.12 -4.03 0.06 0.00 0.26 0.00 0.00 34.13 30.54 3kj5 s GLU 172 CO 0.75 -1.16 0.38 -2.37 -0.54 0.00 0.00 175.26 172.33 3kj5 n THR 173 N 6.11 -1.66 -1.71 -1.70 5.66 -1.26 -4.54 114.28 115.18 3kj5 n THR 173 Ca 0.19 -0.34 -0.43 0.00 -3.05 0.00 0.00 64.05 60.41 3kj5 n THR 173 Cb 0.44 -1.70 -0.02 0.00 -1.55 0.00 0.00 70.33 67.50 3kj5 n THR 173 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3kj5 n GLY 174 N -1.95 1.19 3.50 1.09 0.00 0.79 -4.95 105.19 104.86 3kj5 n GLY 174 Ca -0.19 0.53 -0.28 0.00 0.00 0.00 0.00 46.02 46.08 3kj5 n GLY 174 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3kj5 s GLN 175 N 0.01 1.79 -0.02 1.61 1.11 -1.04 -4.82 119.66 118.30 3kj5 s GLN 175 Ca 0.69 -1.32 -0.30 0.00 0.01 0.00 0.00 55.36 54.45 3kj5 s GLN 175 Cb -0.57 -2.05 -0.08 0.00 -1.01 0.00 0.00 33.01 29.31 3kj5 s GLN 175 CO 0.44 0.44 1.95 -0.65 0.01 0.00 0.00 175.29 177.48 3kj5 s GLN 176 N -2.53 3.98 0.05 2.91 -0.21 -1.26 -2.77 119.66 119.82 3kj5 s GLN 176 Ca 0.21 2.43 -0.20 0.00 0.02 0.00 0.00 55.36 57.83 3kj5 s GLN 176 Cb -0.09 -4.17 -0.13 0.00 1.00 0.00 0.00 33.01 29.62 3kj5 s GLN 176 CO 0.12 -1.13 1.36 1.15 -2.12 0.00 0.00 175.29 174.67 3kj5 h THR 177 N 5.87 1.34 -3.81 -0.19 2.02 0.22 -3.46 112.91 114.89 3kj5 h THR 177 Ca -0.46 -1.31 -0.21 0.00 0.77 0.00 0.00 66.41 65.20 3kj5 h THR 177 Cb 1.23 1.82 -0.26 0.00 -1.74 0.00 0.00 68.15 69.20 3kj5 h THR 177 CO 0.95 0.39 -0.71 -0.89 0.37 0.00 0.00 175.52 175.62 3kj5 s THR 178 N -4.33 0.04 -0.15 3.16 2.01 -1.08 -4.92 115.64 110.37 3kj5 s THR 178 Ca -0.14 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 61.57 3kj5 s THR 178 Cb 0.06 -0.09 -0.00 0.00 0.01 0.00 0.00 72.50 72.47 3kj5 s THR 178 CO 0.76 -0.16 -0.15 -0.89 -0.69 0.00 0.00 174.62 173.49 3kj5 s THR 179 N -0.48 2.74 -0.13 -0.82 2.01 -1.26 -1.66 115.64 116.04 3kj5 s THR 179 Ca -0.05 -0.75 0.02 0.00 0.31 0.00 0.00 61.69 61.22 3kj5 s THR 179 Cb -0.03 -2.15 -0.00 0.00 0.01 0.00 0.00 72.50 70.32 3kj5 s THR 179 CO -0.00 0.51 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.89 3kj5 s PHE 180 N 0.75 2.69 -0.58 4.92 0.40 -1.09 -4.92 117.98 120.13 3kj5 s PHE 180 Ca -0.06 -1.00 0.06 0.00 -0.60 0.00 0.00 56.93 55.32 3kj5 s PHE 180 Cb -0.15 -1.80 0.22 0.00 0.51 0.00 0.00 43.02 41.79 3kj5 s PHE 180 CO 0.01 -0.42 0.59 0.25 0.70 0.00 0.00 175.22 176.35 3kj5 n THR 181 N 3.74 1.14 -0.08 0.64 -2.24 -1.26 -3.64 114.28 112.59 3kj5 n THR 181 Ca -0.19 -4.68 -0.15 0.00 -2.27 0.00 0.00 64.05 56.77 3kj5 n THR 181 Cb 0.52 -2.04 -0.06 0.00 -2.10 0.00 0.00 70.33 66.65 3kj5 n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kj5 n GLY 182 N 1.50 -0.23 3.80 3.38 0.00 -1.26 -5.07 105.19 107.30 3kj5 n GLY 182 Ca 0.26 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 3kj5 n GLY 182 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3kj5 s HIS 183 N -2.28 2.95 -1.60 1.61 3.76 -1.26 -4.98 115.29 113.48 3kj5 s HIS 183 Ca -0.21 1.50 0.16 0.00 -0.15 0.00 0.00 55.06 56.36 3kj5 s HIS 183 Cb 0.07 -3.01 0.31 0.00 1.11 0.00 0.00 32.58 31.07 3kj5 s HIS 183 CO 0.29 -1.24 1.22 0.25 -0.85 0.00 0.00 174.74 174.41 3kj5 n THR 184 N -2.35 0.60 -4.21 1.30 -2.24 -1.26 -4.84 114.28 101.28 3kj5 n THR 184 Ca 0.09 -0.80 -0.12 0.00 -2.27 0.00 0.00 64.05 60.94 3kj5 n THR 184 Cb 0.53 0.83 -0.10 0.00 -2.10 0.00 0.00 70.33 69.49 3kj5 n THR 184 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3kj5 s GLY 185 N -1.13 1.00 0.31 3.38 0.00 -1.26 -4.88 107.32 104.75 3kj5 s GLY 185 Ca 0.27 -1.47 -0.29 0.00 0.00 0.00 0.00 44.72 43.23 3kj5 s GLY 185 CO 0.22 -1.51 1.47 0.99 0.00 0.00 0.00 173.10 174.27 3kj5 s ASP 186 N -3.12 6.51 -0.54 1.64 1.01 -1.26 -4.25 116.67 116.66 3kj5 s ASP 186 Ca 0.18 2.86 -0.20 0.00 0.71 0.00 0.00 52.55 56.09 3kj5 s ASP 186 Cb 0.05 -2.64 0.06 0.00 1.01 0.00 0.00 42.92 41.40 3kj5 s ASP 186 CO -0.00 -0.78 0.73 -0.69 0.21 0.00 0.00 175.17 174.64 3kj5 s VAL 187 N -0.53 4.72 0.17 -1.27 1.01 -1.20 -0.25 120.40 123.04 3kj5 s VAL 187 Ca 0.57 -0.38 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 3kj5 s VAL 187 Cb -0.44 -4.41 0.06 0.00 0.00 0.00 0.00 36.38 31.59 3kj5 s VAL 187 CO 0.52 -0.97 1.66 0.24 0.00 0.00 0.00 175.10 176.55 3kj5 h MET 188 N 9.13 0.97 -4.33 2.72 2.86 -0.92 -3.40 114.93 121.96 3kj5 h MET 188 Ca -0.28 -0.27 -0.15 0.00 -2.06 0.00 0.00 59.70 56.95 3kj5 h MET 188 Cb 1.09 -0.11 -0.15 0.00 0.06 0.00 0.00 31.60 32.49 3kj5 h MET 188 CO 1.03 0.93 -0.68 0.45 1.06 0.00 0.00 176.91 179.70 3kj5 s SER 189 N -6.37 0.56 -0.02 1.22 0.15 0.25 -4.59 113.70 104.89 3kj5 s SER 189 Ca -0.12 -1.03 -0.22 0.00 0.70 0.00 0.00 55.95 55.28 3kj5 s SER 189 Cb 0.13 0.20 0.04 0.00 -1.71 0.00 0.00 66.02 64.68 3kj5 s SER 189 CO 0.83 -0.60 0.46 -1.48 1.20 0.00 0.00 173.24 173.65 3kj5 s LEU 190 N -2.96 0.22 0.24 3.45 0.05 -1.25 0.28 118.68 118.70 3kj5 s LEU 190 Ca 0.10 0.33 -0.04 0.00 0.05 0.00 0.00 54.13 54.58 3kj5 s LEU 190 Cb 0.08 1.81 -0.03 0.00 -2.05 0.00 0.00 46.19 46.00 3kj5 s LEU 190 CO -0.07 -0.53 0.27 -0.55 -0.55 0.00 0.00 176.35 174.92 3kj5 s SER 191 N -1.32 0.29 -0.03 1.48 0.15 0.72 -4.75 113.70 110.26 3kj5 s SER 191 Ca -0.12 -1.30 -0.01 0.00 0.70 0.00 0.00 55.95 55.22 3kj5 s SER 191 Cb -0.03 0.48 0.03 0.00 -1.71 0.00 0.00 66.02 64.79 3kj5 s SER 191 CO 0.06 -0.99 0.04 -0.22 1.20 0.00 0.00 173.24 173.33 3kj5 s LEU 192 N -3.15 0.76 0.30 3.45 0.20 -1.26 -0.31 118.68 118.67 3kj5 s LEU 192 Ca 0.34 0.06 -0.29 0.00 0.69 0.00 0.00 54.13 54.92 3kj5 s LEU 192 Cb 0.04 -0.08 -0.13 0.00 -0.43 0.00 0.00 46.19 45.58 3kj5 s LEU 192 CO 0.13 -0.17 1.31 0.00 -0.29 0.00 0.00 176.35 177.34 3kj5 n ALA 193 N 4.56 1.12 0.00 5.97 0.00 0.23 -4.65 120.51 127.74 3kj5 n ALA 193 Ca -0.20 0.38 -0.12 0.00 0.00 0.00 0.00 53.44 53.50 3kj5 n ALA 193 Cb 0.50 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.63 3kj5 n ALA 193 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3kj5 h PRO 194 N 3.12 0.07 -3.14 0.00 0.11 -1.91 1.21 132.00 131.47 3kj5 h PRO 194 Ca -0.45 -0.01 -0.75 0.00 0.11 0.00 0.00 66.00 64.89 3kj5 h PRO 194 Cb 1.28 -0.01 -0.14 0.00 0.11 0.00 0.00 31.00 32.24 3kj5 h PRO 194 CO 0.67 0.24 2.15 -0.40 -0.21 0.00 0.00 178.00 180.45 3kj5 n ASP 195 N -4.95 6.28 -4.64 -2.05 5.68 -1.26 -4.92 116.55 110.68 3kj5 n ASP 195 Ca -0.07 -3.13 -0.42 0.00 -0.50 0.00 0.00 54.79 50.67 3kj5 n ASP 195 Cb 0.12 -1.43 -0.03 0.00 -1.14 0.00 0.00 41.12 38.65 3kj5 n ASP 195 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3kj5 s THR 196 N -0.30 3.08 0.00 2.12 -1.32 0.42 -4.65 115.64 114.98 3kj5 s THR 196 Ca 0.45 0.09 0.00 0.00 -1.21 0.00 0.00 61.69 61.02 3kj5 s THR 196 Cb 0.13 -3.07 0.00 0.00 -1.51 0.00 0.00 72.50 68.05 3kj5 s THR 196 CO -0.03 -0.02 0.02 0.54 -2.21 0.00 0.00 174.62 172.92 3kj5 n ARG 197 N 7.92 2.75 -4.07 7.08 1.74 -1.26 -4.84 116.66 125.98 3kj5 n ARG 197 Ca 0.23 -0.02 -0.09 0.00 -0.77 0.00 0.00 57.85 57.20 3kj5 n ARG 197 Cb 0.43 -0.27 -0.11 0.00 -1.02 0.00 0.00 32.46 31.49 3kj5 n ARG 197 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3kj5 s LEU 198 N -0.80 2.38 0.09 0.55 1.43 -1.26 -1.53 118.68 119.55 3kj5 s LEU 198 Ca 0.00 -0.78 -0.05 0.00 -1.03 0.00 0.00 54.13 52.27 3kj5 s LEU 198 Cb 0.00 0.06 -0.02 0.00 0.03 0.00 0.00 46.19 46.26 3kj5 s LEU 198 CO 0.00 -0.42 0.11 0.72 0.23 0.00 0.00 176.35 176.98 3kj5 s PHE 199 N -2.73 0.45 -0.11 0.29 -0.71 -0.57 0.77 117.98 115.37 3kj5 s PHE 199 Ca -0.02 -0.90 0.01 0.00 -1.04 0.00 0.00 56.93 54.99 3kj5 s PHE 199 Cb -0.01 -0.25 -0.01 0.00 -1.21 0.00 0.00 43.02 41.54 3kj5 s PHE 199 CO -0.05 -0.51 -0.16 0.14 -1.34 0.00 0.00 175.22 173.30 3kj5 s VAL 200 N -3.93 2.81 -0.09 -2.49 -7.23 0.58 -2.21 120.40 107.84 3kj5 s VAL 200 Ca 0.11 -0.76 0.05 0.00 -1.81 0.00 0.00 61.98 59.57 3kj5 s VAL 200 Cb 0.06 -2.15 -0.00 0.00 0.56 0.00 0.00 36.38 34.85 3kj5 s VAL 200 CO -0.07 0.54 -0.24 -0.94 -0.31 0.00 0.00 175.10 174.08 3kj5 s SER 201 N 0.20 3.10 -0.24 4.85 1.04 -0.65 -0.20 113.70 121.81 3kj5 s SER 201 Ca -0.10 -0.54 -0.06 0.00 0.48 0.00 0.00 55.95 55.73 3kj5 s SER 201 Cb -0.16 -1.21 -0.02 0.00 0.10 0.00 0.00 66.02 64.73 3kj5 s SER 201 CO 0.06 0.19 0.03 -0.83 0.98 0.00 0.00 173.24 173.67 3kj5 s GLY 202 N 0.16 1.71 0.15 7.32 0.00 0.14 -2.03 107.32 114.78 3kj5 s GLY 202 Ca -0.13 -1.13 0.07 0.00 0.00 0.00 0.00 44.72 43.53 3kj5 s GLY 202 CO 0.07 0.47 -0.14 0.00 0.00 0.00 0.00 173.10 173.50 3kj5 s ALA 203 N 1.51 1.71 -1.20 3.20 0.00 -1.26 -0.53 121.76 125.19 3kj5 s ALA 203 Ca 0.06 -1.44 -0.08 0.00 0.00 0.00 0.00 51.96 50.50 3kj5 s ALA 203 Cb -0.15 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 3kj5 s ALA 203 CO 0.01 0.09 2.91 0.00 0.00 0.00 0.00 175.76 178.77 3kj5 n ASP 205 N 2.71 0.47 0.00 0.00 5.75 -1.26 -4.41 116.55 119.81 3kj5 n ASP 205 Ca 0.67 -0.85 0.00 0.00 -0.01 0.00 0.00 54.79 54.59 3kj5 n ASP 205 Cb 0.37 0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 3kj5 n ASP 205 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3kj5 n ALA 206 N -0.12 0.00 -2.84 2.12 0.00 -0.53 -4.97 120.51 114.16 3kj5 n ALA 206 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 3kj5 n ALA 206 Cb 0.08 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.39 3kj5 n ALA 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3kj5 s SER 207 N -2.94 0.21 0.51 0.00 1.04 -1.25 -3.95 113.70 107.33 3kj5 s SER 207 Ca 0.00 -0.07 -0.20 0.00 0.48 0.00 0.00 55.95 56.16 3kj5 s SER 207 Cb 0.00 -0.01 -0.07 0.00 0.10 0.00 0.00 66.02 66.03 3kj5 s SER 207 CO 0.00 -0.01 1.07 0.00 0.98 0.00 0.00 173.24 175.28 3kj5 s ALA 208 N -0.16 2.80 -0.07 5.32 0.00 -0.49 -4.10 121.76 125.06 3kj5 s ALA 208 Ca -0.01 0.67 0.03 0.00 0.00 0.00 0.00 51.96 52.65 3kj5 s ALA 208 Cb -0.01 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.82 3kj5 s ALA 208 CO -0.00 -0.50 -0.17 0.15 0.00 0.00 0.00 175.76 175.24 3kj5 s LYS 209 N -3.30 2.17 -0.19 0.00 1.02 -0.86 -0.87 119.74 117.70 3kj5 s LYS 209 Ca 0.69 -0.60 -0.05 0.00 0.02 0.00 0.00 55.97 56.03 3kj5 s LYS 209 Cb -0.19 -1.73 -0.03 0.00 -0.52 0.00 0.00 37.83 35.37 3kj5 s LYS 209 CO 0.23 0.11 -0.00 -1.17 -0.92 0.00 0.00 175.35 173.60 3kj5 s LEU 210 N 0.45 3.27 0.03 3.17 2.96 -0.21 -1.63 118.68 126.72 3kj5 s LEU 210 Ca -0.14 -0.18 -0.04 0.00 -0.22 0.00 0.00 54.13 53.55 3kj5 s LEU 210 Cb -0.16 -1.82 -0.02 0.00 0.50 0.00 0.00 46.19 44.69 3kj5 s LEU 210 CO 0.05 0.08 0.05 0.26 -1.32 0.00 0.00 176.35 175.48 3kj5 s TRP 211 N 0.89 0.25 -0.18 5.38 0.52 -0.94 -1.85 118.94 123.00 3kj5 s TRP 211 Ca 0.01 -0.56 -0.14 0.00 0.02 0.00 0.00 56.10 55.43 3kj5 s TRP 211 Cb -0.14 -0.18 -0.04 0.00 -1.15 0.00 0.00 33.47 31.95 3kj5 s TRP 211 CO 0.02 -0.32 0.30 0.34 0.02 0.00 0.00 176.95 177.31 3kj5 s ASP 212 N -2.00 6.39 0.21 2.95 2.15 -1.17 -1.51 116.67 123.69 3kj5 s ASP 212 Ca -0.07 0.45 -0.08 0.00 0.43 0.00 0.00 52.55 53.28 3kj5 s ASP 212 Cb -0.03 -2.18 0.15 0.00 -0.30 0.00 0.00 42.92 40.56 3kj5 s ASP 212 CO -0.04 0.05 1.77 0.58 -0.17 0.00 0.00 175.17 177.36 3kj5 h VAL 213 N 4.82 1.26 0.02 1.11 2.07 -1.64 2.64 116.25 126.53 3kj5 h VAL 213 Ca -0.39 -0.85 -0.20 0.00 0.82 0.00 0.00 66.70 66.08 3kj5 h VAL 213 Cb 1.16 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 3kj5 h VAL 213 CO 0.73 0.34 -0.92 0.03 0.02 0.00 0.00 177.57 177.78 3kj5 h ARG 214 N 1.14 0.11 -0.09 1.57 -0.00 -1.95 -3.35 114.38 111.82 3kj5 h ARG 214 Ca 0.26 -0.14 -0.17 0.00 -0.50 0.00 0.00 59.98 59.42 3kj5 h ARG 214 Cb 0.24 0.05 0.01 0.00 0.00 0.00 0.00 29.97 30.27 3kj5 h ARG 214 CO -0.02 0.95 -0.62 0.93 0.00 0.00 0.00 179.97 181.21 3kj5 h GLU 215 N 0.05 0.58 -1.17 0.04 4.39 -1.75 -3.48 114.58 113.24 3kj5 h GLU 215 Ca -0.04 -0.50 -0.34 0.00 0.34 0.00 0.00 59.36 58.82 3kj5 h GLU 215 Cb 1.59 0.12 -0.10 0.00 -0.10 0.00 0.00 28.75 30.25 3kj5 h GLU 215 CO 0.13 1.13 -0.33 0.41 -1.16 0.00 0.00 179.01 179.19 3kj5 n GLY 216 N 0.80 1.17 3.05 -3.84 0.00 0.88 -4.95 105.19 102.29 3kj5 n GLY 216 Ca -0.09 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 3kj5 n GLY 216 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3kj5 s MET 217 N -3.75 0.49 -0.53 1.61 -1.94 -1.25 -4.81 119.30 109.12 3kj5 s MET 217 Ca 0.00 -0.71 -0.27 0.00 -1.71 0.00 0.00 55.69 53.00 3kj5 s MET 217 Cb 0.00 -0.24 0.03 0.00 2.01 0.00 0.00 34.83 36.63 3kj5 s MET 217 CO 0.00 0.04 1.05 0.00 -0.01 0.00 0.00 175.02 176.10 3kj5 h ARG 219 N 9.33 1.08 -3.16 0.00 3.08 -1.75 -3.46 114.38 119.50 3kj5 h ARG 219 Ca -0.25 -0.21 -0.05 0.00 0.07 0.00 0.00 59.98 59.54 3kj5 h ARG 219 Cb 1.07 -0.17 -0.14 0.00 0.08 0.00 0.00 29.97 30.81 3kj5 h ARG 219 CO 1.11 0.90 0.02 -0.65 -1.07 0.00 0.00 179.97 180.29 3kj5 s GLN 220 N -5.49 1.10 -0.06 0.04 -0.21 -1.14 -5.04 119.66 108.86 3kj5 s GLN 220 Ca -0.12 -0.54 0.04 0.00 0.02 0.00 0.00 55.36 54.75 3kj5 s GLN 220 Cb 0.14 0.50 0.00 0.00 1.00 0.00 0.00 33.01 34.65 3kj5 s GLN 220 CO 0.83 -0.44 -0.17 0.99 -2.12 0.00 0.00 175.29 174.38 3kj5 s THR 221 N -3.45 1.44 -0.08 -0.19 2.01 -1.26 -1.04 115.64 113.06 3kj5 s THR 221 Ca 0.00 -0.70 0.03 0.00 0.31 0.00 0.00 61.69 61.34 3kj5 s THR 221 Cb 0.01 -1.25 -0.02 0.00 0.01 0.00 0.00 72.50 71.25 3kj5 s THR 221 CO -0.10 0.42 -0.18 -0.36 -0.69 0.00 0.00 174.62 173.71 3kj5 s PHE 222 N 0.23 2.65 0.00 4.92 0.40 -0.05 -5.01 117.98 121.12 3kj5 s PHE 222 Ca -0.08 -0.53 0.00 0.00 -0.60 0.00 0.00 56.93 55.71 3kj5 s PHE 222 Cb -0.13 -1.70 0.00 0.00 0.51 0.00 0.00 43.02 41.70 3kj5 s PHE 222 CO 0.03 -0.10 0.00 0.25 0.70 0.00 0.00 175.22 176.11 3kj5 n THR 223 N 2.97 0.00 -0.08 0.64 -2.24 -1.26 -1.40 114.28 112.90 3kj5 n THR 223 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 3kj5 n THR 223 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 3kj5 n THR 223 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kj5 n GLY 224 N 4.28 0.95 3.89 3.38 0.00 -1.26 -4.93 105.19 111.51 3kj5 n GLY 224 Ca 0.00 -0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 3kj5 n GLY 224 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3kj5 s HIS 225 N -2.00 3.56 -2.31 1.61 3.76 -1.25 -5.01 115.29 113.64 3kj5 s HIS 225 Ca 0.00 0.48 0.23 0.00 -0.15 0.00 0.00 55.06 55.62 3kj5 s HIS 225 Cb 0.00 -1.92 0.11 0.00 1.11 0.00 0.00 32.58 31.88 3kj5 s HIS 225 CO 0.00 0.62 1.17 0.39 -0.85 0.00 0.00 174.74 176.07 3kj5 n GLU 226 N 0.97 1.52 -4.10 1.40 1.02 -1.26 -4.84 120.64 115.35 3kj5 n GLU 226 Ca -0.10 -1.24 -0.10 0.00 -0.02 0.00 0.00 57.16 55.70 3kj5 n GLU 226 Cb 0.53 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 30.38 3kj5 n GLU 226 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3kj5 s SER 227 N -2.34 0.15 0.55 1.62 0.15 -1.26 -5.02 113.70 107.55 3kj5 s SER 227 Ca 0.22 -1.15 -0.22 0.00 0.70 0.00 0.00 55.95 55.51 3kj5 s SER 227 Cb 0.19 0.39 -0.05 0.00 -1.71 0.00 0.00 66.02 64.84 3kj5 s SER 227 CO 0.49 -0.85 1.33 -1.81 1.20 0.00 0.00 173.24 173.60 3kj5 s ASP 228 N -3.06 5.30 -0.15 5.45 1.01 -1.26 -4.45 116.67 119.51 3kj5 s ASP 228 Ca 0.27 2.71 -0.07 0.00 0.71 0.00 0.00 52.55 56.17 3kj5 s ASP 228 Cb 0.05 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 3kj5 s ASP 228 CO 0.05 -1.54 0.08 -0.63 0.21 0.00 0.00 175.17 173.34 3kj5 s ILE 229 N -1.34 4.97 0.00 0.77 1.01 -1.23 -2.04 121.20 123.34 3kj5 s ILE 229 Ca 0.72 0.02 0.00 0.00 0.00 0.00 0.00 60.65 61.39 3kj5 s ILE 229 Cb -0.39 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 38.88 3kj5 s ILE 229 CO 0.46 0.52 0.00 0.59 0.00 0.00 0.00 174.94 176.51 3kj5 n ASN 230 N 2.93 3.05 -4.31 3.58 3.02 -1.21 -3.87 115.26 118.44 3kj5 n ASN 230 Ca -0.18 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.05 3kj5 n ASN 230 Cb 0.53 0.50 -0.15 0.00 -0.61 0.00 0.00 39.78 40.05 3kj5 n ASN 230 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kj5 s ALA 231 N -1.36 2.47 -0.03 5.41 0.00 -1.26 -4.08 121.76 122.90 3kj5 s ALA 231 Ca 0.00 -0.93 0.05 0.00 0.00 0.00 0.00 51.96 51.07 3kj5 s ALA 231 Cb 0.00 -1.09 -0.01 0.00 0.00 0.00 0.00 23.12 22.02 3kj5 s ALA 231 CO 0.00 0.22 -0.18 -1.50 0.00 0.00 0.00 175.76 174.31 3kj5 s ILE 232 N 0.41 1.44 0.07 0.00 2.07 -1.26 -0.48 121.20 123.45 3kj5 s ILE 232 Ca -0.13 -0.75 0.04 0.00 -1.41 0.00 0.00 60.65 58.40 3kj5 s ILE 232 Cb -0.16 -1.23 -0.03 0.00 0.13 0.00 0.00 42.46 41.17 3kj5 s ILE 232 CO 0.06 0.41 -0.11 0.00 -1.91 0.00 0.00 174.94 173.39 3kj5 s PHE 234 N -1.57 3.16 0.71 0.00 2.19 -1.26 0.73 117.98 121.94 3kj5 s PHE 234 Ca -0.03 0.10 -0.11 0.00 0.33 0.00 0.00 56.93 57.22 3kj5 s PHE 234 Cb -0.08 -1.86 0.02 0.00 -1.31 0.00 0.00 43.02 39.79 3kj5 s PHE 234 CO 0.01 0.35 1.07 0.12 1.83 0.00 0.00 175.22 178.60 3kj5 s PHE 235 N -0.51 3.05 0.20 10.12 5.36 0.41 -4.85 117.98 131.75 3kj5 s PHE 235 Ca 0.09 1.40 -0.10 0.00 -0.96 0.00 0.00 56.93 57.35 3kj5 s PHE 235 Cb -0.12 -2.92 0.13 0.00 -0.34 0.00 0.00 43.02 39.77 3kj5 s PHE 235 CO 0.02 -1.33 1.80 -1.35 -1.46 0.00 0.00 175.22 172.90 3kj5 h PRO 236 N -0.79 1.01 -0.50 10.12 0.11 -1.87 -0.01 132.00 140.06 3kj5 h PRO 236 Ca -0.44 -0.14 -0.06 0.00 0.11 0.00 0.00 66.00 65.47 3kj5 h PRO 236 Cb 1.22 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 3kj5 h PRO 236 CO 0.57 0.78 0.06 -0.91 -0.21 0.00 0.00 178.00 178.28 3kj5 h ASN 237 N 0.98 0.76 0.00 -2.05 -0.26 -1.93 -3.45 115.58 109.64 3kj5 h ASN 237 Ca 0.25 -0.16 0.00 0.00 -0.56 0.00 0.00 56.30 55.82 3kj5 h ASN 237 Cb 0.09 -0.20 0.00 0.00 -1.06 0.00 0.00 38.32 37.14 3kj5 h ASN 237 CO -0.03 0.80 0.00 0.61 -1.06 0.00 0.00 177.43 177.74 3kj5 n GLY 238 N -0.74 0.94 0.31 2.83 0.00 -0.02 -4.89 105.19 103.63 3kj5 n GLY 238 Ca 0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.00 3kj5 n GLY 238 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3kj5 h ASN 239 N 0.00 0.92 -4.48 1.61 -0.26 -1.88 -3.44 115.58 108.05 3kj5 h ASN 239 Ca 0.00 -0.19 -0.67 0.00 -0.56 0.00 0.00 56.30 54.88 3kj5 h ASN 239 Cb 0.00 -0.24 -0.30 0.00 -1.06 0.00 0.00 38.32 36.72 3kj5 h ASN 239 CO 0.00 0.90 -0.88 0.00 -1.06 0.00 0.00 177.43 176.39 3kj5 s ALA 240 N -5.23 2.04 -0.08 -0.83 0.00 -1.26 -0.09 121.76 116.31 3kj5 s ALA 240 Ca -0.11 -1.05 0.05 0.00 0.00 0.00 0.00 51.96 50.85 3kj5 s ALA 240 Cb 0.15 -0.54 -0.00 0.00 0.00 0.00 0.00 23.12 22.73 3kj5 s ALA 240 CO 0.82 0.49 -0.23 -0.59 0.00 0.00 0.00 175.76 176.25 3kj5 s PHE 241 N -0.51 2.35 0.53 0.00 -0.12 -0.26 0.15 117.98 120.13 3kj5 s PHE 241 Ca 0.08 -0.85 -0.20 0.00 -0.05 0.00 0.00 56.93 55.91 3kj5 s PHE 241 Cb -0.10 -1.57 -0.06 0.00 -0.63 0.00 0.00 43.02 40.66 3kj5 s PHE 241 CO -0.00 -0.32 1.12 0.00 -0.05 0.00 0.00 175.22 175.97 3kj5 s ALA 242 N 0.17 2.72 0.04 1.99 0.00 0.22 -2.56 121.76 124.34 3kj5 s ALA 242 Ca -0.12 0.80 0.05 0.00 0.00 0.00 0.00 51.96 52.68 3kj5 s ALA 242 Cb -0.16 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 3kj5 s ALA 242 CO 0.06 -0.70 -0.13 0.99 0.00 0.00 0.00 175.76 175.98 3kj5 s THR 243 N -1.80 1.04 -0.08 0.00 2.01 -0.98 -1.66 115.64 114.17 3kj5 s THR 243 Ca 0.72 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 61.77 3kj5 s THR 243 Cb -0.23 -0.95 0.00 0.00 0.01 0.00 0.00 72.50 71.33 3kj5 s THR 243 CO 0.26 -0.03 -0.21 -0.83 -0.69 0.00 0.00 174.62 173.12 3kj5 s GLY 244 N -1.15 1.16 0.11 4.40 0.00 0.37 -2.97 107.32 109.23 3kj5 s GLY 244 Ca 0.01 -0.82 0.03 0.00 0.00 0.00 0.00 44.72 43.93 3kj5 s GLY 244 CO 0.01 -0.26 -0.09 -0.45 0.00 0.00 0.00 173.10 172.32 3kj5 s SER 245 N 0.34 1.39 0.37 1.64 0.15 -1.20 -3.34 113.70 113.04 3kj5 s SER 245 Ca -0.15 -0.93 0.04 0.00 0.70 0.00 0.00 55.95 55.61 3kj5 s SER 245 Cb -0.16 0.04 0.71 0.00 -1.71 0.00 0.00 66.02 64.89 3kj5 s SER 245 CO 0.07 -0.36 2.01 0.44 1.20 0.00 0.00 173.24 176.60 3kj5 h ASP 246 N 3.17 0.66 -3.72 5.45 3.32 -1.63 -3.36 116.42 120.31 3kj5 h ASP 246 Ca -0.36 -0.01 -0.57 0.00 0.02 0.00 0.00 57.03 56.11 3kj5 h ASP 246 Cb 1.18 -0.16 0.16 0.00 0.22 0.00 0.00 39.33 40.73 3kj5 h ASP 246 CO 0.60 0.47 0.28 0.47 -1.72 0.00 0.00 179.24 179.34 3kj5 n ASP 247 N -4.45 1.36 -0.28 6.45 8.00 -1.26 -4.57 116.55 121.79 3kj5 n ASP 247 Ca 0.07 0.85 0.02 0.00 0.71 0.00 0.00 54.79 56.44 3kj5 n ASP 247 Cb 0.08 -1.45 0.23 0.00 -0.02 0.00 0.00 41.12 39.96 3kj5 n ASP 247 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kj5 h ALA 248 N 0.70 1.47 -2.35 2.24 0.00 -1.80 -3.41 119.26 116.12 3kj5 h ALA 248 Ca -0.49 -0.04 -0.54 0.00 0.00 0.00 0.00 54.91 53.84 3kj5 h ALA 248 Cb 1.35 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 18.85 3kj5 h ALA 248 CO 0.53 0.44 1.07 0.95 0.00 0.00 0.00 179.25 182.23 3kj5 s THR 249 N -5.91 3.29 0.73 0.00 -4.23 -1.25 -4.72 115.64 103.55 3kj5 s THR 249 Ca -0.11 0.52 -0.16 0.00 -1.18 0.00 0.00 61.69 60.76 3kj5 s THR 249 Cb 0.19 -3.34 -0.05 0.00 1.34 0.00 0.00 72.50 70.65 3kj5 s THR 249 CO 0.80 -0.03 0.44 0.00 -0.54 0.00 0.00 174.62 175.29 3kj5 s ARG 251 N -2.68 1.85 -0.09 0.00 0.52 -1.16 -2.20 118.95 115.20 3kj5 s ARG 251 Ca 0.64 -2.09 -0.01 0.00 -0.52 0.00 0.00 55.73 53.75 3kj5 s ARG 251 Cb -0.35 -0.94 0.03 0.00 0.52 0.00 0.00 34.95 34.21 3kj5 s ARG 251 CO 0.60 -0.30 -0.03 -1.17 0.02 0.00 0.00 175.30 174.42 3kj5 s LEU 252 N -3.60 0.83 -0.10 2.53 0.20 0.17 -2.32 118.68 116.40 3kj5 s LEU 252 Ca 0.28 -0.18 -0.01 0.00 0.69 0.00 0.00 54.13 54.91 3kj5 s LEU 252 Cb 0.06 -0.60 -0.03 0.00 -0.43 0.00 0.00 46.19 45.18 3kj5 s LEU 252 CO 0.14 -0.16 -0.04 -0.36 -0.29 0.00 0.00 176.35 175.64 3kj5 s PHE 253 N 1.86 3.04 -0.10 5.38 0.40 -1.06 0.18 117.98 127.68 3kj5 s PHE 253 Ca 0.05 0.01 -0.05 0.00 -0.60 0.00 0.00 56.93 56.33 3kj5 s PHE 253 Cb -0.12 -1.80 -0.04 0.00 0.51 0.00 0.00 43.02 41.57 3kj5 s PHE 253 CO -0.06 0.29 0.10 0.34 0.70 0.00 0.00 175.22 176.58 3kj5 s ASP 254 N -0.54 6.04 0.11 1.36 -1.08 -1.05 -1.11 116.67 120.40 3kj5 s ASP 254 Ca 0.09 0.36 -0.18 0.00 -0.52 0.00 0.00 52.55 52.30 3kj5 s ASP 254 Cb -0.12 -1.88 -0.05 0.00 -1.46 0.00 0.00 42.92 39.40 3kj5 s ASP 254 CO 0.02 0.39 1.62 -0.07 0.52 0.00 0.00 175.17 177.65 3kj5 h LEU 255 N 4.97 0.43 -0.32 -1.34 3.38 -0.84 -0.60 115.31 121.00 3kj5 h LEU 255 Ca -0.53 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.18 3kj5 h LEU 255 Cb 1.22 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 3kj5 h LEU 255 CO 0.57 0.52 0.01 0.03 0.09 0.00 0.00 178.44 179.67 3kj5 h ARG 256 N 0.32 0.56 -0.42 1.13 -0.00 -1.98 -3.13 114.38 110.86 3kj5 h ARG 256 Ca 0.10 -0.17 -0.03 0.00 -0.50 0.00 0.00 59.98 59.37 3kj5 h ARG 256 Cb 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 29.97 30.15 3kj5 h ARG 256 CO -0.00 0.68 0.14 0.00 0.00 0.00 0.00 179.97 180.79 3kj5 h ALA 257 N 0.85 0.55 -3.85 0.04 0.00 -1.96 -3.48 119.26 111.41 3kj5 h ALA 257 Ca 0.09 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 3kj5 h ALA 257 Cb 0.43 -0.16 0.09 0.00 0.00 0.00 0.00 17.79 18.14 3kj5 h ALA 257 CO 0.01 0.19 -0.39 -3.47 0.00 0.00 0.00 179.25 175.59 3kj5 n ASP 258 N -4.59 -2.30 -2.50 0.00 2.03 -0.24 -4.95 116.55 104.00 3kj5 n ASP 258 Ca 0.00 -0.31 -0.04 0.00 0.52 0.00 0.00 54.79 54.96 3kj5 n ASP 258 Cb 0.17 -2.79 0.02 0.00 -0.72 0.00 0.00 41.12 37.80 3kj5 n ASP 258 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3kj5 n GLN 259 N -2.52 0.63 -3.02 -0.67 6.02 -1.22 -4.93 117.38 111.68 3kj5 n GLN 259 Ca -0.13 -1.32 -0.44 0.00 -0.01 0.00 0.00 57.00 55.10 3kj5 n GLN 259 Cb 0.58 1.71 0.00 0.00 1.02 0.00 0.00 30.24 33.56 3kj5 n GLN 259 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3kj5 n GLU 260 N -0.46 3.89 -0.22 -1.09 2.13 -1.26 -2.54 120.64 121.09 3kj5 n GLU 260 Ca -0.04 -4.29 0.03 0.00 0.66 0.00 0.00 57.16 53.53 3kj5 n GLU 260 Cb 0.43 -2.65 0.08 0.00 0.27 0.00 0.00 31.44 29.57 3kj5 n GLU 260 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3kj5 n LEU 261 N 2.71 -0.23 -3.65 4.31 7.99 0.47 -4.70 117.00 123.91 3kj5 n LEU 261 Ca 0.29 1.05 -0.08 0.00 -0.01 0.00 0.00 56.01 57.26 3kj5 n LEU 261 Cb 0.37 -0.31 -0.02 0.00 -0.11 0.00 0.00 43.42 43.35 3kj5 n LEU 261 CO 0.64 -1.00 0.55 -0.04 -1.51 0.00 0.00 177.39 176.03 3kj5 s MET 262 N -5.76 1.33 0.03 3.23 -1.94 -0.52 -4.43 119.30 111.24 3kj5 s MET 262 Ca -0.09 -0.64 0.07 0.00 -1.71 0.00 0.00 55.69 53.32 3kj5 s MET 262 Cb 0.16 0.51 -0.03 0.00 2.01 0.00 0.00 34.83 37.49 3kj5 s MET 262 CO 0.47 -0.60 -0.19 0.99 -0.01 0.00 0.00 175.02 175.68 3kj5 s THR 263 N -3.58 2.69 -0.49 2.05 2.01 -1.26 0.46 115.64 117.52 3kj5 s THR 263 Ca 0.07 -1.18 0.03 0.00 0.31 0.00 0.00 61.69 60.93 3kj5 s THR 263 Cb -0.03 -2.11 0.13 0.00 0.01 0.00 0.00 72.50 70.50 3kj5 s THR 263 CO -0.03 0.37 0.23 -0.31 -0.69 0.00 0.00 174.62 174.20 3kj5 s TYR 264 N -0.88 3.34 -0.01 4.92 1.51 -0.93 -4.98 117.35 120.32 3kj5 s TYR 264 Ca 0.14 -3.07 0.01 0.00 -1.01 0.00 0.00 57.07 53.14 3kj5 s TYR 264 Cb -0.10 -2.90 0.00 0.00 -0.11 0.00 0.00 41.96 38.85 3kj5 s TYR 264 CO 0.04 -0.80 -0.04 0.45 -1.11 0.00 0.00 175.55 174.09 3kj5 s SER 265 N 0.12 0.58 -0.01 2.29 0.15 -1.26 -3.70 113.70 111.87 3kj5 s SER 265 Ca 0.15 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.73 3kj5 s SER 265 Cb -0.24 -0.14 0.01 0.00 -1.71 0.00 0.00 66.02 63.94 3kj5 s SER 265 CO -0.02 0.02 -0.01 -2.28 1.20 0.00 0.00 173.24 172.15 3kj5 s HIS 266 N 0.19 0.13 0.58 3.44 5.04 -1.26 -5.05 115.29 118.35 3kj5 s HIS 266 Ca -0.02 -0.00 -0.19 0.00 -1.54 0.00 0.00 55.06 53.31 3kj5 s HIS 266 Cb -0.05 -0.13 -0.04 0.00 0.04 0.00 0.00 32.58 32.40 3kj5 s HIS 266 CO -0.00 -0.02 1.18 -0.51 -2.34 0.00 0.00 174.74 173.04 3kj5 s ASP 267 N 0.20 5.36 0.00 9.88 1.01 -1.26 -1.89 116.67 129.97 3kj5 s ASP 267 Ca -0.02 2.32 0.00 0.00 0.71 0.00 0.00 52.55 55.56 3kj5 s ASP 267 Cb -0.03 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.30 3kj5 s ASP 267 CO -0.01 -1.48 0.00 0.59 0.21 0.00 0.00 175.17 174.49 3kj5 n ASN 268 N -1.50 -0.68 -4.34 0.27 3.02 -1.26 -5.00 115.26 105.76 3kj5 n ASN 268 Ca 0.13 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.36 3kj5 n ASN 268 Cb 0.50 -0.11 -0.15 0.00 -0.61 0.00 0.00 39.78 39.41 3kj5 n ASN 268 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3kj5 s ILE 269 N -3.06 2.62 -0.35 2.41 1.01 -0.79 -5.06 121.20 117.98 3kj5 s ILE 269 Ca 0.00 -0.85 -0.03 0.00 0.00 0.00 0.00 60.65 59.77 3kj5 s ILE 269 Cb 0.00 -2.03 0.19 0.00 0.01 0.00 0.00 42.46 40.63 3kj5 s ILE 269 CO 0.00 0.56 0.88 -0.63 0.00 0.00 0.00 174.94 175.75 3kj5 s ILE 270 N -0.07 -0.52 0.00 2.92 1.09 -1.26 -4.84 121.20 118.52 3kj5 s ILE 270 Ca -0.04 0.00 0.00 0.00 -1.10 0.00 0.00 60.65 59.51 3kj5 s ILE 270 Cb -0.14 -0.06 0.00 0.00 -1.06 0.00 0.00 42.46 41.20 3kj5 s ILE 270 CO 0.04 0.00 0.00 0.00 -0.10 0.00 0.00 174.94 174.88 3kj5 n GLY 272 N 0.00 -3.67 0.00 0.00 0.00 -1.26 -4.47 105.19 95.79 3kj5 n GLY 272 Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.83 3kj5 n GLY 272 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3kj5 n ILE 273 N -5.61 0.09 -1.68 -0.61 2.08 -1.26 -3.07 119.36 109.30 3kj5 n ILE 273 Ca 0.13 -0.12 -0.49 0.00 0.56 0.00 0.00 62.75 62.84 3kj5 n ILE 273 Cb 0.55 1.23 -0.05 0.00 -0.75 0.00 0.00 39.64 40.62 3kj5 n ILE 273 CO 0.00 0.00 0.00 1.07 0.56 0.00 0.00 176.55 178.18 3kj5 n THR 274 N -0.05 0.52 -0.01 1.39 5.66 -1.22 -4.54 114.28 116.04 3kj5 n THR 274 Ca 0.00 -0.09 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 3kj5 n THR 274 Cb 0.39 -1.82 0.00 0.00 -1.55 0.00 0.00 70.33 67.35 3kj5 n THR 274 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 3kj5 n SER 275 N 6.33 -0.13 -4.22 1.09 3.41 -1.26 -3.85 113.62 115.00 3kj5 n SER 275 Ca 0.22 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.71 3kj5 n SER 275 Cb 0.29 0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 64.17 3kj5 n SER 275 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3kj5 s VAL 276 N -0.05 0.56 0.00 -3.33 -7.23 -1.26 -2.50 120.40 106.59 3kj5 s VAL 276 Ca 0.00 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.21 3kj5 s VAL 276 Cb 0.00 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 34.88 3kj5 s VAL 276 CO 0.00 -0.52 0.00 -1.20 -0.31 0.00 0.00 175.10 173.07 3kj5 n SER 277 N -0.19 0.00 -2.89 4.85 7.64 0.09 -4.71 113.62 118.42 3kj5 n SER 277 Ca -0.07 -0.85 -0.01 0.00 1.01 0.00 0.00 58.87 58.94 3kj5 n SER 277 Cb 0.63 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.84 3kj5 n SER 277 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3kj5 s PHE 278 N -7.56 -1.22 0.46 1.43 0.08 -1.25 -3.82 117.98 106.10 3kj5 s PHE 278 Ca 0.00 -0.13 -0.19 0.00 0.12 0.00 0.00 56.93 56.73 3kj5 s PHE 278 Cb 0.00 0.23 -0.15 0.00 -0.57 0.00 0.00 43.02 42.53 3kj5 s PHE 278 CO 0.00 -0.90 0.00 -1.13 -0.10 0.00 0.00 175.22 173.10 3kj5 n SER 279 N 3.46 -3.17 -4.50 1.36 3.41 -1.20 -4.30 113.62 108.68 3kj5 n SER 279 Ca 0.13 0.73 -0.45 0.00 -0.26 0.00 0.00 58.87 59.02 3kj5 n SER 279 Cb 0.59 -0.88 -0.01 0.00 -0.26 0.00 0.00 64.21 63.64 3kj5 n SER 279 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3kj5 n LYS 280 N 1.35 0.79 -0.79 4.33 4.81 -1.26 -1.24 118.16 126.15 3kj5 n LYS 280 Ca 0.09 0.28 0.00 0.00 -0.87 0.00 0.00 58.31 57.81 3kj5 n LYS 280 Cb 0.44 -1.53 0.00 0.00 0.02 0.00 0.00 35.03 33.96 3kj5 n LYS 280 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 3kj5 n SER 281 N 1.44 -0.69 -3.41 3.14 3.41 -1.26 -4.20 113.62 112.05 3kj5 n SER 281 Ca 0.12 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.49 3kj5 n SER 281 Cb 0.32 -0.11 0.04 0.00 -0.26 0.00 0.00 64.21 64.20 3kj5 n SER 281 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kj5 n GLY 282 N -2.23 -0.52 0.48 5.00 0.00 -0.37 -4.82 105.19 102.73 3kj5 n GLY 282 Ca 0.00 0.18 0.04 0.00 0.00 0.00 0.00 46.02 46.24 3kj5 n GLY 282 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3kj5 n ARG 283 N -4.41 2.83 -4.63 1.61 0.63 -1.23 -4.81 116.66 106.66 3kj5 n ARG 283 Ca -0.03 -1.90 -0.24 0.00 -0.92 0.00 0.00 57.85 54.76 3kj5 n ARG 283 Cb 0.57 -1.20 -0.16 0.00 0.45 0.00 0.00 32.46 32.12 3kj5 n ARG 283 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3kj5 s LEU 284 N -0.99 1.79 -0.27 6.15 1.43 -1.26 -3.52 118.68 122.00 3kj5 s LEU 284 Ca 0.17 -0.29 -0.08 0.00 -1.03 0.00 0.00 54.13 52.91 3kj5 s LEU 284 Cb 0.09 -0.80 -0.02 0.00 0.03 0.00 0.00 46.19 45.49 3kj5 s LEU 284 CO 0.12 0.09 0.10 -0.22 0.23 0.00 0.00 176.35 176.67 3kj5 s LEU 285 N 0.29 3.70 -0.45 1.79 2.96 0.93 -3.26 118.68 124.64 3kj5 s LEU 285 Ca -0.07 -0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 53.49 3kj5 s LEU 285 Cb -0.12 -1.95 0.12 0.00 0.50 0.00 0.00 46.19 44.73 3kj5 s LEU 285 CO 0.02 -0.09 0.24 -0.76 -1.32 0.00 0.00 176.35 174.44 3kj5 s LEU 286 N 1.61 5.18 -0.07 -0.68 2.01 -1.25 0.20 118.68 125.69 3kj5 s LEU 286 Ca 0.06 -2.22 0.03 0.00 0.01 0.00 0.00 54.13 52.00 3kj5 s LEU 286 Cb -0.16 -1.81 0.01 0.00 0.01 0.00 0.00 46.19 44.24 3kj5 s LEU 286 CO 0.05 -0.49 -0.17 0.00 1.01 0.00 0.00 176.35 176.75 3kj5 s ALA 287 N 0.86 1.61 0.76 4.21 0.00 -0.86 -0.73 121.76 127.61 3kj5 s ALA 287 Ca 0.10 -0.64 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 3kj5 s ALA 287 Cb -0.22 -0.65 0.14 0.00 0.00 0.00 0.00 23.12 22.39 3kj5 s ALA 287 CO -0.04 0.19 1.05 0.20 0.00 0.00 0.00 175.76 177.16 3kj5 s GLY 288 N 0.48 1.76 0.04 0.00 0.00 -1.04 -0.14 107.32 108.41 3kj5 s GLY 288 Ca -0.15 -1.62 0.02 0.00 0.00 0.00 0.00 44.72 42.97 3kj5 s GLY 288 CO 0.05 -1.03 -0.08 -0.19 0.00 0.00 0.00 173.10 171.86 3kj5 s TYR 289 N -3.26 0.66 0.17 1.90 1.51 -1.17 -3.37 117.35 113.78 3kj5 s TYR 289 Ca 0.67 -0.43 -0.14 0.00 -1.01 0.00 0.00 57.07 56.16 3kj5 s TYR 289 Cb -0.05 -0.40 0.12 0.00 -0.11 0.00 0.00 41.96 41.52 3kj5 s TYR 289 CO 0.46 -0.07 1.77 -0.44 -1.11 0.00 0.00 175.55 176.16 3kj5 h ASP 290 N 4.73 0.30 -2.37 2.29 5.19 -1.76 -3.29 116.42 121.50 3kj5 h ASP 290 Ca -0.35 0.03 -0.16 0.00 -0.62 0.00 0.00 57.03 55.93 3kj5 h ASP 290 Cb 1.20 -0.02 0.08 0.00 0.18 0.00 0.00 39.33 40.77 3kj5 h ASP 290 CO 0.42 0.21 0.08 -0.90 -3.12 0.00 0.00 179.24 175.93 3kj5 n ASP 291 N -4.92 -1.10 -0.37 6.45 5.68 -1.26 -4.44 116.55 116.58 3kj5 n ASP 291 Ca 0.04 -0.87 0.02 0.00 -0.50 0.00 0.00 54.79 53.48 3kj5 n ASP 291 Cb 0.14 -0.41 0.07 0.00 -1.14 0.00 0.00 41.12 39.78 3kj5 n ASP 291 CO 0.00 0.00 0.00 2.22 -1.33 0.00 0.00 177.20 178.09 3kj5 n PHE 292 N -3.30 0.25 -3.52 2.11 -1.74 -1.26 -4.24 117.46 105.76 3kj5 n PHE 292 Ca 0.06 -0.11 -0.11 0.00 -0.56 0.00 0.00 57.45 56.73 3kj5 n PHE 292 Cb 0.24 -0.03 -0.02 0.00 1.52 0.00 0.00 39.48 41.19 3kj5 n PHE 292 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 3kj5 s ASN 293 N -0.87 -0.49 0.34 5.98 4.22 -1.26 -4.15 114.94 118.71 3kj5 s ASN 293 Ca 0.11 -0.14 -0.27 0.00 -2.14 0.00 0.00 52.86 50.43 3kj5 s ASN 293 Cb 0.06 0.62 -0.09 0.00 1.28 0.00 0.00 41.25 43.12 3kj5 s ASN 293 CO 0.07 -1.04 1.08 0.00 -2.04 0.00 0.00 177.10 175.17 3kj5 s ASN 295 N -1.20 2.45 -0.05 0.00 0.01 0.80 -1.60 114.94 115.34 3kj5 s ASN 295 Ca 0.51 -0.41 -0.19 0.00 -0.71 0.00 0.00 52.86 52.06 3kj5 s ASN 295 Cb -0.28 -0.83 -0.05 0.00 0.41 0.00 0.00 41.25 40.51 3kj5 s ASN 295 CO 0.35 0.15 0.54 -0.69 -1.51 0.00 0.00 177.10 175.94 3kj5 s VAL 296 N 0.15 5.04 0.18 1.60 1.01 -1.11 -2.03 120.40 125.24 3kj5 s VAL 296 Ca -0.08 1.11 0.07 0.00 0.00 0.00 0.00 61.98 63.08 3kj5 s VAL 296 Cb -0.14 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 3kj5 s VAL 296 CO 0.04 0.39 -0.15 0.26 0.00 0.00 0.00 175.10 175.64 3kj5 s TRP 297 N 0.09 1.64 -0.48 5.22 0.52 0.55 -3.03 118.94 123.45 3kj5 s TRP 297 Ca 0.29 -0.56 -0.17 0.00 0.02 0.00 0.00 56.10 55.67 3kj5 s TRP 297 Cb -0.17 -0.79 0.06 0.00 -1.15 0.00 0.00 33.47 31.42 3kj5 s TRP 297 CO 0.14 0.30 0.51 0.34 0.02 0.00 0.00 176.95 178.26 3kj5 s ASP 298 N -3.03 6.19 0.23 2.95 -1.08 -0.76 0.31 116.67 121.49 3kj5 s ASP 298 Ca 0.18 -1.03 -0.06 0.00 -0.52 0.00 0.00 52.55 51.12 3kj5 s ASP 298 Cb -0.02 -2.24 0.22 0.00 -1.46 0.00 0.00 42.92 39.42 3kj5 s ASP 298 CO 0.06 -0.75 1.82 0.00 0.52 0.00 0.00 175.17 176.82 3kj5 h ALA 299 N 8.86 1.12 -0.61 3.66 0.00 -1.87 3.07 119.26 133.50 3kj5 h ALA 299 Ca -0.28 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 3kj5 h ALA 299 Cb 1.10 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 3kj5 h ALA 299 CO 0.90 0.65 0.17 -0.07 0.00 0.00 0.00 179.25 180.90 3kj5 h LEU 300 N 1.15 0.88 -0.38 0.00 3.38 -1.88 -3.31 115.31 115.17 3kj5 h LEU 300 Ca 0.27 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3kj5 h LEU 300 Cb 0.15 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3kj5 h LEU 300 CO -0.03 0.84 -0.18 0.29 0.09 0.00 0.00 178.44 179.45 3kj5 n LYS 301 N -4.27 3.56 -3.40 1.13 4.76 -0.89 -4.82 118.16 114.23 3kj5 n LYS 301 Ca 0.05 -0.27 -0.24 0.00 -2.87 0.00 0.00 58.31 54.98 3kj5 n LYS 301 Cb 0.23 -0.87 0.05 0.00 -1.84 0.00 0.00 35.03 32.59 3kj5 n LYS 301 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3kj5 n ALA 302 N -0.68 -1.15 -3.22 7.82 0.00 1.02 -4.95 120.51 119.36 3kj5 n ALA 302 Ca 0.02 0.30 -0.31 0.00 0.00 0.00 0.00 53.44 53.45 3kj5 n ALA 302 Cb 0.11 -4.46 -0.17 0.00 0.00 0.00 0.00 19.45 14.93 3kj5 n ALA 302 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kj5 s ASP 303 N -3.01 2.88 -0.41 0.00 1.01 -1.22 -4.87 116.67 111.06 3kj5 s ASP 303 Ca 0.47 -0.52 -0.21 0.00 0.71 0.00 0.00 52.55 53.00 3kj5 s ASP 303 Cb -0.22 -1.27 0.02 0.00 1.01 0.00 0.00 42.92 42.46 3kj5 s ASP 303 CO 0.58 0.15 0.67 0.00 0.21 0.00 0.00 175.17 176.78 3kj5 s ARG 304 N 0.35 3.43 0.00 8.23 1.70 -1.26 -1.82 118.95 129.57 3kj5 s ARG 304 Ca -0.17 -0.18 0.12 0.00 -0.47 0.00 0.00 55.73 55.03 3kj5 s ARG 304 Cb -0.17 -3.90 0.30 0.00 -0.57 0.00 0.00 34.95 30.60 3kj5 s ARG 304 CO 0.08 -0.95 1.20 0.00 -1.08 0.00 0.00 175.30 174.55 3kj5 n ALA 305 N 6.29 2.27 -2.99 7.88 0.00 -1.17 -5.02 120.51 127.78 3kj5 n ALA 305 Ca -0.01 -1.03 -0.10 0.00 0.00 0.00 0.00 53.44 52.30 3kj5 n ALA 305 Cb 0.48 -0.49 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 3kj5 n ALA 305 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3kj5 s GLY 306 N -1.02 -0.26 -0.22 0.00 0.00 -1.21 -0.63 107.32 103.98 3kj5 s GLY 306 Ca 0.24 -0.06 -0.10 0.00 0.00 0.00 0.00 44.72 44.80 3kj5 s GLY 306 CO 0.18 -0.31 0.51 -1.34 0.00 0.00 0.00 173.10 172.13 3kj5 s VAL 307 N -3.76 -0.34 -0.37 1.40 -7.23 -1.26 -2.73 120.40 106.11 3kj5 s VAL 307 Ca 0.03 0.08 -0.08 0.00 -1.81 0.00 0.00 61.98 60.19 3kj5 s VAL 307 Cb 0.02 -0.77 0.04 0.00 0.56 0.00 0.00 36.38 36.23 3kj5 s VAL 307 CO -0.12 0.03 0.17 -0.76 -0.31 0.00 0.00 175.10 174.12 3kj5 s LEU 308 N 2.01 4.64 -0.35 1.32 1.43 -0.63 -4.77 118.68 122.33 3kj5 s LEU 308 Ca -0.07 -1.18 0.07 0.00 -1.03 0.00 0.00 54.13 51.92 3kj5 s LEU 308 Cb -0.09 -1.95 0.59 0.00 0.03 0.00 0.00 46.19 44.78 3kj5 s LEU 308 CO -0.15 -0.39 1.68 0.00 0.23 0.00 0.00 176.35 177.71 3kj5 n ALA 309 N 4.89 4.80 -0.26 4.21 0.00 -1.26 -3.02 120.51 129.88 3kj5 n ALA 309 Ca -0.12 -2.95 -0.06 0.00 0.00 0.00 0.00 53.44 50.32 3kj5 n ALA 309 Cb 0.45 -1.07 0.05 0.00 0.00 0.00 0.00 19.45 18.88 3kj5 n ALA 309 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3kj5 h GLY 310 N 1.17 1.08 -4.58 0.00 0.00 -1.94 -3.46 103.07 95.34 3kj5 h GLY 310 Ca 0.38 -0.51 -0.52 0.00 0.00 0.00 0.00 47.33 46.68 3kj5 h GLY 310 CO 0.70 0.49 0.90 0.30 0.00 0.00 0.00 176.54 178.93 3kj5 s HIS 311 N -5.77 3.01 0.19 5.60 3.76 -1.26 -4.93 115.29 115.90 3kj5 s HIS 311 Ca -0.13 0.60 -0.21 0.00 -0.15 0.00 0.00 55.06 55.17 3kj5 s HIS 311 Cb 0.14 -3.97 0.12 0.00 1.11 0.00 0.00 32.58 29.98 3kj5 s HIS 311 CO 0.80 -3.58 1.45 -0.25 -0.85 0.00 0.00 174.74 172.32 3kj5 n ASP 312 N 3.78 -0.75 -2.94 1.40 8.00 -1.26 -4.67 116.55 120.11 3kj5 n ASP 312 Ca 0.14 1.65 -0.10 0.00 0.71 0.00 0.00 54.79 57.18 3kj5 n ASP 312 Cb 0.38 -0.32 -0.02 0.00 -0.02 0.00 0.00 41.12 41.14 3kj5 n ASP 312 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3kj5 s ASN 313 N -5.39 -0.65 0.00 -2.24 2.47 -1.26 -4.93 114.94 102.94 3kj5 s ASN 313 Ca -0.12 -2.08 0.00 0.00 0.42 0.00 0.00 52.86 51.08 3kj5 s ASN 313 Cb 0.16 1.26 0.00 0.00 -1.45 0.00 0.00 41.25 41.22 3kj5 s ASN 313 CO 0.64 -0.09 0.00 -1.14 -3.72 0.00 0.00 177.10 172.79 3kj5 n ARG 314 N 2.96 0.00 -1.67 0.43 0.63 -1.26 -3.09 116.66 114.65 3kj5 n ARG 314 Ca 0.21 0.49 -0.43 0.00 -0.92 0.00 0.00 57.85 57.20 3kj5 n ARG 314 Cb 0.54 -0.97 -0.03 0.00 0.45 0.00 0.00 32.46 32.45 3kj5 n ARG 314 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3kj5 s VAL 315 N 0.00 3.06 -0.03 5.15 1.01 -1.24 -2.02 120.40 126.33 3kj5 s VAL 315 Ca 0.00 0.07 -0.22 0.00 0.00 0.00 0.00 61.98 61.83 3kj5 s VAL 315 Cb 0.00 -3.07 -0.23 0.00 0.00 0.00 0.00 36.38 33.08 3kj5 s VAL 315 CO 0.00 -0.03 1.07 0.77 0.00 0.00 0.00 175.10 176.90 3kj5 h SER 316 N 13.29 0.36 -4.94 3.32 4.64 -0.20 -3.39 113.55 126.62 3kj5 h SER 316 Ca -0.43 -0.76 -0.13 0.00 -0.47 0.00 0.00 61.79 60.00 3kj5 h SER 316 Cb 1.23 -0.11 -0.20 0.00 -0.31 0.00 0.00 62.40 63.01 3kj5 h SER 316 CO 0.96 1.07 -0.34 0.00 -0.87 0.00 0.00 176.83 177.64 3kj5 s LEU 318 N -1.29 2.28 0.03 0.00 0.05 -1.25 0.28 118.68 118.77 3kj5 s LEU 318 Ca -0.13 -0.58 0.03 0.00 0.05 0.00 0.00 54.13 53.50 3kj5 s LEU 318 Cb -0.06 -0.11 -0.02 0.00 -2.05 0.00 0.00 46.19 43.95 3kj5 s LEU 318 CO 0.03 -0.24 -0.10 -0.83 -0.55 0.00 0.00 176.35 174.66 3kj5 s GLY 319 N -1.69 0.57 -0.13 -3.48 0.00 0.77 -4.84 107.32 98.53 3kj5 s GLY 319 Ca -0.09 -0.70 -0.01 0.00 0.00 0.00 0.00 44.72 43.92 3kj5 s GLY 319 CO -0.00 -0.70 -0.09 0.14 0.00 0.00 0.00 173.10 172.44 3kj5 s VAL 320 N -0.95 3.42 0.30 1.40 1.01 -1.26 0.41 120.40 124.72 3kj5 s VAL 320 Ca -0.03 -0.54 -0.30 0.00 0.00 0.00 0.00 61.98 61.11 3kj5 s VAL 320 Cb -0.08 -2.45 -0.11 0.00 0.00 0.00 0.00 36.38 33.75 3kj5 s VAL 320 CO 0.01 0.53 1.50 0.42 0.00 0.00 0.00 175.10 177.55 3kj5 s THR 321 N 0.15 2.31 0.43 3.92 -4.23 0.45 -4.86 115.64 113.81 3kj5 s THR 321 Ca -0.05 0.28 0.14 0.00 -1.18 0.00 0.00 61.69 60.88 3kj5 s THR 321 Cb -0.14 -3.18 0.16 0.00 1.34 0.00 0.00 72.50 70.68 3kj5 s THR 321 CO 0.04 0.05 1.95 0.44 -0.54 0.00 0.00 174.62 176.56 3kj5 h ASP 322 N 4.48 0.02 0.52 3.99 5.19 -1.83 1.30 116.42 130.07 3kj5 h ASP 322 Ca -0.47 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.93 3kj5 h ASP 322 Cb 1.22 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.73 3kj5 h ASP 322 CO 0.75 0.24 0.00 -0.90 -3.12 0.00 0.00 179.24 176.21 3kj5 n ASP 323 N -4.27 0.43 0.00 6.45 5.68 -1.26 -4.80 116.55 118.78 3kj5 n ASP 323 Ca -0.02 0.62 0.00 0.00 -0.50 0.00 0.00 54.79 54.89 3kj5 n ASP 323 Cb 0.28 -0.71 0.00 0.00 -1.14 0.00 0.00 41.12 39.55 3kj5 n ASP 323 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kj5 n GLY 324 N -0.28 0.76 0.22 6.12 0.00 0.45 -4.97 105.19 107.49 3kj5 n GLY 324 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 3kj5 n GLY 324 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3kj5 h MET 325 N 2.62 0.73 -3.84 1.61 2.86 -1.87 -3.45 114.93 113.59 3kj5 h MET 325 Ca 0.00 -0.22 -0.10 0.00 -2.06 0.00 0.00 59.70 57.33 3kj5 h MET 325 Cb 0.00 -0.08 -0.15 0.00 0.06 0.00 0.00 31.60 31.44 3kj5 h MET 325 CO 0.00 0.79 -0.43 0.00 1.06 0.00 0.00 176.91 178.33 3kj5 s ALA 326 N -5.09 -0.12 -0.16 6.32 0.00 -1.26 -4.57 121.76 116.88 3kj5 s ALA 326 Ca -0.13 -0.66 -0.06 0.00 0.00 0.00 0.00 51.96 51.10 3kj5 s ALA 326 Cb 0.10 0.41 -0.04 0.00 0.00 0.00 0.00 23.12 23.60 3kj5 s ALA 326 CO 0.79 -0.46 0.06 0.08 0.00 0.00 0.00 175.76 176.23 3kj5 s VAL 327 N -3.64 4.76 -0.17 0.00 1.01 -0.78 0.17 120.40 121.74 3kj5 s VAL 327 Ca 0.03 -0.05 -0.05 0.00 0.00 0.00 0.00 61.98 61.91 3kj5 s VAL 327 Cb 0.04 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 3kj5 s VAL 327 CO -0.10 0.50 0.01 0.00 0.00 0.00 0.00 175.10 175.51 3kj5 s ALA 328 N 0.04 3.16 -0.10 5.51 0.00 1.35 0.00 121.76 131.73 3kj5 s ALA 328 Ca 0.05 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.22 3kj5 s ALA 328 Cb -0.12 -1.73 -0.01 0.00 0.00 0.00 0.00 23.12 21.26 3kj5 s ALA 328 CO 0.01 0.15 -0.17 0.95 0.00 0.00 0.00 175.76 176.69 3kj5 s THR 329 N 0.46 2.70 -0.21 0.00 -4.23 0.56 0.27 115.64 115.19 3kj5 s THR 329 Ca -0.01 -0.80 -0.05 0.00 -1.18 0.00 0.00 61.69 59.64 3kj5 s THR 329 Cb -0.14 -2.09 -0.02 0.00 1.34 0.00 0.00 72.50 71.59 3kj5 s THR 329 CO 0.02 0.55 0.01 -0.83 -0.54 0.00 0.00 174.62 173.83 3kj5 s GLY 330 N 0.11 1.73 0.16 3.99 0.00 0.80 -2.10 107.32 112.01 3kj5 s GLY 330 Ca -0.08 -1.01 0.10 0.00 0.00 0.00 0.00 44.72 43.73 3kj5 s GLY 330 CO 0.05 0.28 -0.23 -0.45 0.00 0.00 0.00 173.10 172.76 3kj5 s SER 331 N 1.09 3.11 0.62 1.64 0.15 -1.26 0.54 113.70 119.58 3kj5 s SER 331 Ca 0.03 -0.82 0.41 0.00 0.70 0.00 0.00 55.95 56.26 3kj5 s SER 331 Cb -0.14 -0.21 2.10 0.00 -1.71 0.00 0.00 66.02 66.06 3kj5 s SER 331 CO 0.02 0.08 2.24 -0.50 1.20 0.00 0.00 173.24 176.28 3kj5 h TRP 332 N 3.44 0.00 0.00 3.44 4.06 -1.34 1.67 115.95 127.22 3kj5 h TRP 332 Ca -0.46 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.48 3kj5 h TRP 332 Cb 1.20 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.36 3kj5 h TRP 332 CO 0.66 0.00 -0.05 0.38 -3.56 0.00 0.00 178.44 175.87 3kj5 h ASP 333 N 0.00 0.00 0.00 -3.49 3.04 -1.79 -3.34 116.42 110.84 3kj5 h ASP 333 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 3kj5 h ASP 333 Cb 0.12 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.41 3kj5 h ASP 333 CO 0.00 0.05 0.00 -1.54 -2.04 0.00 0.00 179.24 175.71 3kj5 n SER 334 N -4.06 -2.61 -4.30 4.15 3.41 0.57 -4.82 113.62 105.96 3kj5 n SER 334 Ca -0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.25 3kj5 n SER 334 Cb 0.13 -0.44 -0.15 0.00 -0.26 0.00 0.00 64.21 63.50 3kj5 n SER 334 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3kj5 s PHE 335 N -2.00 2.75 0.24 7.33 0.08 -1.26 -4.10 117.98 121.03 3kj5 s PHE 335 Ca 0.00 -0.90 -0.30 0.00 0.12 0.00 0.00 56.93 55.86 3kj5 s PHE 335 Cb 0.00 -1.84 -0.09 0.00 -0.57 0.00 0.00 43.02 40.52 3kj5 s PHE 335 CO 0.00 -0.37 1.03 -0.51 -0.10 0.00 0.00 175.22 175.27 3kj5 s LEU 336 N 0.57 4.58 -0.00 -0.37 1.43 -0.09 -4.16 118.68 120.63 3kj5 s LEU 336 Ca -0.10 2.09 0.06 0.00 -1.03 0.00 0.00 54.13 55.15 3kj5 s LEU 336 Cb -0.16 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.43 3kj5 s LEU 336 CO 0.04 -0.02 -0.19 -0.75 0.23 0.00 0.00 176.35 175.66 3kj5 s LYS 337 N -1.13 1.46 -0.13 1.70 2.47 -0.89 -0.70 119.74 122.52 3kj5 s LYS 337 Ca 0.44 -0.70 0.02 0.00 -1.56 0.00 0.00 55.97 54.16 3kj5 s LYS 337 Cb -0.29 -1.43 0.02 0.00 -1.46 0.00 0.00 37.83 34.66 3kj5 s LYS 337 CO 0.36 0.39 -0.17 0.42 0.16 0.00 0.00 175.35 176.51 3kj5 s ILE 338 N -0.50 1.68 -0.20 5.43 1.01 0.40 -0.33 121.20 128.69 3kj5 s ILE 338 Ca 0.07 -0.73 -0.09 0.00 0.00 0.00 0.00 60.65 59.89 3kj5 s ILE 338 Cb -0.07 -1.52 -0.05 0.00 0.01 0.00 0.00 42.46 40.82 3kj5 s ILE 338 CO -0.00 0.48 0.11 0.26 0.00 0.00 0.00 174.94 175.78 3kj5 s TRP 339 N 1.08 3.34 -0.02 3.97 0.52 0.10 -0.34 118.94 127.60 3kj5 s TRP 339 Ca -0.03 0.22 0.00 0.00 0.02 0.00 0.00 56.10 56.31 3kj5 s TRP 339 Cb -0.14 -2.15 0.00 0.00 -1.15 0.00 0.00 33.47 30.03 3kj5 s TRP 339 CO -0.04 0.21 0.00 0.27 0.02 0.00 0.00 176.95 177.41