#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kbs n ASN 2 N 0.00 0.16 -2.86 3.17 2.85 -1.26 -5.08 115.26 112.25 3kbs n ASN 2 Ca 0.00 -0.76 -0.27 0.00 -0.11 0.00 0.00 54.58 53.44 3kbs n ASN 2 Cb 0.00 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 40.99 3kbs n ASN 2 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 3kbs n TYR 3 N -0.69 3.91 -2.81 1.20 4.02 -1.26 -5.08 117.16 116.45 3kbs n TYR 3 Ca 0.00 -3.78 -0.42 0.00 -0.01 0.00 0.00 57.90 53.69 3kbs n TYR 3 Cb 0.00 -0.42 -0.03 0.00 -0.02 0.00 0.00 39.34 38.86 3kbs n TYR 3 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 3kbs s GLN 4 N -3.51 4.30 0.54 -0.72 -0.44 -1.26 -4.70 119.66 113.86 3kbs s GLN 4 Ca 0.49 1.15 -0.19 0.00 -2.50 0.00 0.00 55.36 54.30 3kbs s GLN 4 Cb 0.30 -3.59 -0.06 0.00 -1.64 0.00 0.00 33.01 28.02 3kbs s GLN 4 CO -0.15 -0.41 1.09 -1.25 0.50 0.00 0.00 175.29 175.07 3kbs s PRO 5 N 2.42 3.46 0.21 1.67 0.04 -1.26 -5.07 135.00 136.46 3kbs s PRO 5 Ca 0.41 1.46 0.09 0.00 0.04 0.00 0.00 61.00 63.00 3kbs s PRO 5 Cb -0.16 -2.04 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 3kbs s PRO 5 CO 0.11 -0.73 -0.18 0.95 0.04 0.00 0.00 177.00 177.19 3kbs s THR 6 N -1.98 2.00 0.62 1.26 -4.23 -1.26 -4.63 115.64 107.41 3kbs s THR 6 Ca 0.69 -2.13 0.29 0.00 -1.18 0.00 0.00 61.69 59.36 3kbs s THR 6 Cb -0.20 -2.03 0.34 0.00 1.34 0.00 0.00 72.50 71.95 3kbs s THR 6 CO 0.27 -0.40 1.90 -0.65 -0.54 0.00 0.00 174.62 175.20 3kbs h PRO 7 N 2.82 0.00 0.00 3.99 0.11 -1.78 0.18 132.00 137.31 3kbs h PRO 7 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3kbs h PRO 7 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3kbs h PRO 7 CO 0.56 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.28 3kbs h GLU 8 N 0.00 0.00 0.00 1.05 3.07 -1.94 -2.34 114.58 114.42 3kbs h GLU 8 Ca 0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 3kbs h GLU 8 Cb 0.98 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.89 3kbs h GLU 8 CO -0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 3kbs n ASP 9 N -2.83 0.00 -2.00 1.42 10.43 0.62 -4.91 116.55 119.28 3kbs n ASP 9 Ca 0.01 0.29 -0.14 0.00 2.57 0.00 0.00 54.79 57.52 3kbs n ASP 9 Cb 0.25 -0.42 0.03 0.00 1.84 0.00 0.00 41.12 42.81 3kbs n ASP 9 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3kbs n ARG 10 N -1.42 -3.32 -2.81 -1.24 5.12 -0.88 -4.69 116.66 107.41 3kbs n ARG 10 Ca 0.08 0.54 -0.42 0.00 -1.93 0.00 0.00 57.85 56.13 3kbs n ARG 10 Cb 0.26 -4.64 -0.03 0.00 -1.16 0.00 0.00 32.46 26.89 3kbs n ARG 10 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 3kbs s PHE 11 N -2.97 3.46 0.28 -1.55 0.08 -1.26 -0.85 117.98 115.16 3kbs s PHE 11 Ca 0.22 1.38 0.09 0.00 0.12 0.00 0.00 56.93 58.74 3kbs s PHE 11 Cb -0.09 -3.08 -0.06 0.00 -0.57 0.00 0.00 43.02 39.22 3kbs s PHE 11 CO 0.27 -0.23 -0.13 0.95 -0.10 0.00 0.00 175.22 175.98 3kbs s THR 12 N 2.09 2.09 -0.01 0.64 -4.23 0.36 0.25 115.64 116.83 3kbs s THR 12 Ca 0.42 -2.25 -0.01 0.00 -1.18 0.00 0.00 61.69 58.67 3kbs s THR 12 Cb -0.17 -2.38 0.00 0.00 1.34 0.00 0.00 72.50 71.29 3kbs s THR 12 CO 0.14 -0.36 0.02 -0.36 -0.54 0.00 0.00 174.62 173.52 3kbs s PHE 13 N -2.74 -0.02 0.34 3.99 0.08 -0.92 -1.65 117.98 117.07 3kbs s PHE 13 Ca 0.29 0.05 -0.22 0.00 0.12 0.00 0.00 56.93 57.17 3kbs s PHE 13 Cb -0.00 -0.00 -0.10 0.00 -0.57 0.00 0.00 43.02 42.35 3kbs s PHE 13 CO 0.13 -0.01 0.88 0.20 -0.10 0.00 0.00 175.22 176.32 3kbs s GLY 14 N 0.04 2.58 0.43 4.36 0.00 -1.24 -1.53 107.32 111.96 3kbs s GLY 14 Ca -0.00 0.36 0.19 0.00 0.00 0.00 0.00 44.72 45.27 3kbs s GLY 14 CO -0.00 0.71 1.88 1.41 0.00 0.00 0.00 173.10 177.10 3kbs h LEU 15 N 2.69 0.36 0.00 0.66 3.38 -1.26 -1.13 115.31 120.01 3kbs h LEU 15 Ca -0.48 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3kbs h LEU 15 Cb 1.19 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3kbs h LEU 15 CO 0.64 0.15 0.00 -2.67 0.09 0.00 0.00 178.44 176.65 3kbs n TRP 16 N -4.48 0.00 0.00 1.13 2.14 -1.26 -2.18 117.44 112.79 3kbs n TRP 16 Ca 0.18 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.75 3kbs n TRP 16 Cb 0.68 -0.38 0.00 0.00 -0.81 0.00 0.00 31.31 30.80 3kbs n TRP 16 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 3kbs n THR 17 N -1.38 0.00 0.32 -1.67 -2.24 -0.43 -2.26 114.28 106.62 3kbs n THR 17 Ca 0.10 0.38 0.21 0.00 -2.27 0.00 0.00 64.05 62.48 3kbs n THR 17 Cb 0.26 -1.16 1.03 0.00 -2.10 0.00 0.00 70.33 68.37 3kbs n THR 17 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 3kbs h VAL 18 N 0.00 0.00 -0.01 2.28 -1.51 -1.72 -0.73 116.25 114.56 3kbs h VAL 18 Ca 0.00 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.28 3kbs h VAL 18 Cb 0.00 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 30.34 3kbs h VAL 18 CO 0.00 0.00 -0.02 0.61 -1.23 0.00 0.00 177.57 176.93 3kbs n GLY 19 N -0.67 -0.43 3.68 5.19 0.00 -0.92 -4.89 105.19 107.14 3kbs n GLY 19 Ca -0.02 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 3kbs n GLY 19 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3kbs n TRP 20 N -0.34 2.57 1.81 1.61 -0.00 -0.28 -4.70 117.44 118.11 3kbs n TRP 20 Ca 0.20 -0.25 0.15 0.00 -0.00 0.00 0.00 57.50 57.60 3kbs n TRP 20 Cb 0.27 -2.77 0.78 0.00 -0.00 0.00 0.00 31.31 29.59 3kbs n TRP 20 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 3kbs n GLN 21 N 6.54 1.25 -1.15 5.87 6.02 -1.26 -4.89 117.38 129.76 3kbs n GLN 21 Ca 0.19 -0.37 -0.01 0.00 -0.01 0.00 0.00 57.00 56.81 3kbs n GLN 21 Cb 0.39 -1.49 -0.00 0.00 1.02 0.00 0.00 30.24 30.16 3kbs n GLN 21 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kbs n GLY 22 N 1.06 0.42 3.71 1.08 0.00 -1.26 -1.38 105.19 108.82 3kbs n GLY 22 Ca 0.22 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 3kbs n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kbs s ARG 23 N -2.32 4.44 0.39 1.61 0.52 -1.26 -4.27 118.95 118.06 3kbs s ARG 23 Ca 0.00 1.76 0.03 0.00 -0.52 0.00 0.00 55.73 57.00 3kbs s ARG 23 Cb 0.00 -3.34 -0.01 0.00 0.52 0.00 0.00 34.95 32.11 3kbs s ARG 23 CO 0.00 -0.23 0.12 -0.40 0.02 0.00 0.00 175.30 174.81 3kbs n ASP 24 N 3.84 1.38 0.30 0.23 3.85 -0.58 -4.98 116.55 120.59 3kbs n ASP 24 Ca 0.08 -3.02 0.13 0.00 -0.71 0.00 0.00 54.79 51.27 3kbs n ASP 24 Cb 0.46 0.91 0.69 0.00 -1.35 0.00 0.00 41.12 41.83 3kbs n ASP 24 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.20 175.54 3kbs h PRO 25 N 0.00 0.00 0.00 0.11 0.11 -2.02 -2.85 132.00 127.35 3kbs h PRO 25 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3kbs h PRO 25 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3kbs h PRO 25 CO 0.48 0.00 -0.13 1.19 -0.21 0.00 0.00 178.00 179.34 3kbs n PHE 26 N -2.69 0.00 -3.56 0.65 3.72 -1.26 -5.08 117.46 109.24 3kbs n PHE 26 Ca -0.02 -0.66 -0.10 0.00 -0.05 0.00 0.00 57.45 56.63 3kbs n PHE 26 Cb 0.39 -0.11 -0.04 0.00 -0.94 0.00 0.00 39.48 38.78 3kbs n PHE 26 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3kbs s GLY 27 N -2.10 -0.31 0.94 1.37 0.00 -1.08 -5.16 107.32 100.98 3kbs s GLY 27 Ca 0.19 1.79 -0.12 0.00 0.00 0.00 0.00 44.72 46.58 3kbs s GLY 27 CO 0.02 0.85 1.11 0.99 0.00 0.00 0.00 173.10 176.07 3kbs s ASP 28 N -1.47 3.21 0.38 1.64 1.01 -1.26 -1.53 116.67 118.65 3kbs s ASP 28 Ca 0.00 1.10 -0.28 0.00 0.71 0.00 0.00 52.55 54.08 3kbs s ASP 28 Cb -0.01 -1.72 -0.11 0.00 1.01 0.00 0.00 42.92 42.09 3kbs s ASP 28 CO -0.01 -2.75 1.49 0.00 0.21 0.00 0.00 175.17 174.10 3kbs s ALA 29 N -3.13 3.56 -0.82 5.23 0.00 -1.26 -4.28 121.76 121.06 3kbs s ALA 29 Ca 0.64 1.57 0.15 0.00 0.00 0.00 0.00 51.96 54.32 3kbs s ALA 29 Cb -0.16 -3.61 -0.14 0.00 0.00 0.00 0.00 23.12 19.21 3kbs s ALA 29 CO 0.55 -1.07 0.66 0.25 0.00 0.00 0.00 175.76 176.16 3kbs n THR 30 N 0.42 0.00 -4.38 0.00 -2.24 -0.48 -4.94 114.28 102.66 3kbs n THR 30 Ca 0.01 -0.18 -0.21 0.00 -2.27 0.00 0.00 64.05 61.41 3kbs n THR 30 Cb 0.39 1.03 -0.13 0.00 -2.10 0.00 0.00 70.33 69.52 3kbs n THR 30 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3kbs s ARG 31 N -2.32 0.98 0.64 -0.78 0.52 -0.99 -5.00 118.95 111.99 3kbs s ARG 31 Ca 0.07 -0.76 -0.15 0.00 -0.52 0.00 0.00 55.73 54.36 3kbs s ARG 31 Cb 0.11 -0.99 -0.01 0.00 0.52 0.00 0.00 34.95 34.58 3kbs s ARG 31 CO 0.58 0.25 1.09 -0.98 0.02 0.00 0.00 175.30 176.25 3kbs s ARG 32 N -1.11 2.96 0.33 3.54 1.70 -1.26 -4.73 118.95 120.37 3kbs s ARG 32 Ca 0.02 1.31 -0.29 0.00 -0.47 0.00 0.00 55.73 56.30 3kbs s ARG 32 Cb -0.08 -1.98 -0.11 0.00 -0.57 0.00 0.00 34.95 32.22 3kbs s ARG 32 CO 0.01 -1.12 1.40 0.00 -1.08 0.00 0.00 175.30 174.52 3kbs s ALA 33 N -2.42 3.56 -0.11 7.88 0.00 -1.26 -4.92 121.76 124.49 3kbs s ALA 33 Ca 0.65 1.39 -0.09 0.00 0.00 0.00 0.00 51.96 53.91 3kbs s ALA 33 Cb -0.19 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.34 3kbs s ALA 33 CO 0.41 -0.81 0.20 -0.51 0.00 0.00 0.00 175.76 175.05 3kbs s LEU 34 N -1.54 4.37 0.06 0.00 1.43 -1.26 -5.07 118.68 116.67 3kbs s LEU 34 Ca 0.53 0.53 -0.31 0.00 -1.03 0.00 0.00 54.13 53.85 3kbs s LEU 34 Cb -0.43 -2.19 -0.06 0.00 0.03 0.00 0.00 46.19 43.55 3kbs s LEU 34 CO 0.54 0.34 1.25 -0.62 0.23 0.00 0.00 176.35 178.09 3kbs s ASP 35 N -0.74 7.01 0.41 2.29 3.68 -1.26 -4.92 116.67 123.14 3kbs s ASP 35 Ca 0.16 2.07 0.18 0.00 2.13 0.00 0.00 52.55 57.09 3kbs s ASP 35 Cb -0.13 -2.58 1.10 0.00 -1.45 0.00 0.00 42.92 39.86 3kbs s ASP 35 CO 0.05 -0.53 1.82 -0.65 0.13 0.00 0.00 175.17 175.99 3kbs h PRO 36 N 6.90 0.39 -0.31 4.34 0.11 -1.96 0.26 132.00 141.73 3kbs h PRO 36 Ca -0.41 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.58 3kbs h PRO 36 Cb 1.21 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 3kbs h PRO 36 CO 0.83 0.26 -0.20 -0.39 -0.21 0.00 0.00 178.00 178.29 3kbs h VAL 37 N 0.40 1.26 -0.51 3.15 -1.51 -1.91 -0.27 116.25 116.85 3kbs h VAL 37 Ca 0.52 -1.20 -0.08 0.00 -1.23 0.00 0.00 66.70 64.71 3kbs h VAL 37 Cb 1.32 1.24 -0.02 0.00 -2.13 0.00 0.00 31.29 31.70 3kbs h VAL 37 CO -0.22 0.39 0.01 -0.08 -1.23 0.00 0.00 177.57 176.44 3kbs h GLU 38 N 0.51 0.90 -0.56 5.19 4.81 -0.89 -2.37 114.58 122.16 3kbs h GLU 38 Ca 0.08 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 59.02 3kbs h GLU 38 Cb 0.62 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 3kbs h GLU 38 CO 0.04 0.92 0.34 0.77 -0.73 0.00 0.00 179.01 180.35 3kbs h SER 39 N 0.77 0.67 -0.65 1.04 0.02 -0.80 0.11 113.55 114.70 3kbs h SER 39 Ca 0.15 -0.06 0.04 0.00 -0.84 0.00 0.00 61.79 61.08 3kbs h SER 39 Cb 0.51 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.84 3kbs h SER 39 CO 0.02 0.53 0.39 0.58 -1.14 0.00 0.00 176.83 177.21 3kbs h VAL 40 N 0.75 1.05 -0.14 2.27 2.07 -1.00 0.13 116.25 121.38 3kbs h VAL 40 Ca 0.20 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 3kbs h VAL 40 Cb -0.02 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 3kbs h VAL 40 CO -0.04 0.14 0.04 0.03 0.02 0.00 0.00 177.57 177.76 3kbs h ARG 41 N 0.75 0.22 -0.63 1.57 3.08 -0.97 -1.93 114.38 116.48 3kbs h ARG 41 Ca 0.27 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.19 3kbs h ARG 41 Cb 0.06 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 3kbs h ARG 41 CO -0.12 0.36 0.10 0.00 -1.07 0.00 0.00 179.97 179.23 3kbs h ARG 42 N 0.05 1.04 -0.45 0.04 2.47 -0.57 -2.53 114.38 114.42 3kbs h ARG 42 Ca 0.05 -0.27 -0.12 0.00 -1.26 0.00 0.00 59.98 58.37 3kbs h ARG 42 Cb 0.23 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.41 3kbs h ARG 42 CO -0.00 0.96 -0.21 -0.07 0.56 0.00 0.00 179.97 181.21 3kbs h LEU 43 N 0.97 0.91 -0.99 3.04 3.38 -0.69 -2.65 115.31 119.30 3kbs h LEU 43 Ca 0.19 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.86 3kbs h LEU 43 Cb 0.43 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 3kbs h LEU 43 CO 0.01 1.09 0.65 0.00 0.09 0.00 0.00 178.44 180.28 3kbs h ALA 44 N 0.98 1.29 0.00 1.53 0.00 -1.16 0.07 119.26 121.97 3kbs h ALA 44 Ca 0.11 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3kbs h ALA 44 Cb 0.75 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3kbs h ALA 44 CO 0.06 0.57 -0.09 0.93 0.00 0.00 0.00 179.25 180.72 3kbs h GLU 45 N 1.28 0.00 -0.00 0.00 5.08 -1.17 -0.92 114.58 118.85 3kbs h GLU 45 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3kbs h GLU 45 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 3kbs h GLU 45 CO -0.11 0.09 -0.10 1.28 -1.00 0.00 0.00 179.01 179.18 3kbs n LEU 46 N -4.15 0.12 0.00 1.33 4.77 -0.06 -4.92 117.00 114.10 3kbs n LEU 46 Ca -0.03 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 3kbs n LEU 46 Cb 0.18 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 3kbs n LEU 46 CO 0.33 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 3kbs n GLY 47 N 1.46 0.98 3.75 -0.72 0.00 -0.35 -4.70 105.19 105.61 3kbs n GLY 47 Ca 0.08 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3kbs n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbs s ALA 48 N -2.00 2.29 -0.11 4.61 0.00 -0.80 -3.22 121.76 122.53 3kbs s ALA 48 Ca 0.00 0.65 0.16 0.00 0.00 0.00 0.00 51.96 52.77 3kbs s ALA 48 Cb 0.00 -3.37 -0.22 0.00 0.00 0.00 0.00 23.12 19.53 3kbs s ALA 48 CO 0.00 -1.57 0.50 1.58 0.00 0.00 0.00 175.76 176.26 3kbs n HIS 49 N -2.65 0.59 -3.94 0.00 -0.00 0.14 -4.53 115.22 104.83 3kbs n HIS 49 Ca 0.11 0.21 0.01 0.00 -0.00 0.00 0.00 57.72 58.05 3kbs n HIS 49 Cb 0.51 -1.05 0.01 0.00 -0.00 0.00 0.00 29.99 29.47 3kbs n HIS 49 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3kbs n GLY 50 N 1.56 0.41 3.22 1.57 0.00 -1.13 -2.10 105.19 108.71 3kbs n GLY 50 Ca -0.19 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.65 3kbs n GLY 50 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kbs s VAL 51 N -2.07 1.07 0.21 1.61 -7.23 -0.51 -2.15 120.40 111.33 3kbs s VAL 51 Ca 0.23 -1.90 0.05 0.00 -1.81 0.00 0.00 61.98 58.55 3kbs s VAL 51 Cb -0.01 -1.67 -0.05 0.00 0.56 0.00 0.00 36.38 35.21 3kbs s VAL 51 CO 0.01 -0.68 -0.07 0.42 -0.31 0.00 0.00 175.10 174.46 3kbs s THR 52 N -3.01 1.34 -0.02 5.32 -4.23 -0.58 -4.08 115.64 110.37 3kbs s THR 52 Ca 0.12 -2.10 -0.15 0.00 -1.18 0.00 0.00 61.69 58.38 3kbs s THR 52 Cb 0.01 -2.15 0.03 0.00 1.34 0.00 0.00 72.50 71.73 3kbs s THR 52 CO 0.00 -0.51 0.33 0.72 -0.54 0.00 0.00 174.62 174.62 3kbs s PHE 53 N -3.22 -0.21 0.33 3.99 -0.12 -1.25 -0.63 117.98 116.87 3kbs s PHE 53 Ca 0.24 0.34 -0.26 0.00 -0.05 0.00 0.00 56.93 57.20 3kbs s PHE 53 Cb 0.03 0.11 -0.10 0.00 -0.63 0.00 0.00 43.02 42.43 3kbs s PHE 53 CO 0.06 -0.39 0.96 -1.01 -0.05 0.00 0.00 175.22 174.80 3kbs s HIS 54 N -1.23 3.62 0.16 3.49 3.76 -1.26 -1.43 115.29 122.41 3kbs s HIS 54 Ca -0.13 1.76 -0.27 0.00 -0.15 0.00 0.00 55.06 56.27 3kbs s HIS 54 Cb -0.05 -2.96 0.01 0.00 1.11 0.00 0.00 32.58 30.69 3kbs s HIS 54 CO 0.04 0.06 1.56 0.38 -0.85 0.00 0.00 174.74 175.94 3kbs h ASP 55 N 3.08 -1.58 0.40 1.40 2.03 -1.78 0.86 116.42 120.82 3kbs h ASP 55 Ca -0.47 0.25 0.00 0.00 -0.73 0.00 0.00 57.03 56.08 3kbs h ASP 55 Cb 1.20 0.71 0.00 0.00 -0.83 0.00 0.00 39.33 40.40 3kbs h ASP 55 CO 0.65 -0.34 0.00 0.47 -1.03 0.00 0.00 179.24 178.98 3kbs n ASP 56 N -5.40 0.00 0.07 4.15 8.00 -1.26 -1.41 116.55 120.71 3kbs n ASP 56 Ca 0.01 0.30 -0.09 0.00 0.71 0.00 0.00 54.79 55.71 3kbs n ASP 56 Cb 0.34 -0.40 0.01 0.00 -0.02 0.00 0.00 41.12 41.06 3kbs n ASP 56 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3kbs h ASP 57 N 0.00 0.36 0.05 -2.24 3.45 -1.21 -3.39 116.42 113.44 3kbs h ASP 57 Ca 0.00 -0.27 -0.31 0.00 0.43 0.00 0.00 57.03 56.89 3kbs h ASP 57 Cb 0.20 -0.11 -0.03 0.00 -0.56 0.00 0.00 39.33 38.83 3kbs h ASP 57 CO 0.00 1.03 -1.69 -0.11 -1.57 0.00 0.00 179.24 176.90 3kbs n LEU 58 N -3.75 2.23 -4.00 1.55 7.94 -0.63 -4.82 117.00 115.52 3kbs n LEU 58 Ca -0.04 0.31 -0.31 0.00 -1.11 0.00 0.00 56.01 54.86 3kbs n LEU 58 Cb 0.76 -1.02 -0.15 0.00 0.53 0.00 0.00 43.42 43.54 3kbs n LEU 58 CO 0.48 0.56 -0.44 -0.63 -1.11 0.00 0.00 177.39 176.24 3kbs s ILE 59 N -2.46 1.83 0.28 1.96 1.01 -0.50 -4.87 121.20 118.45 3kbs s ILE 59 Ca -0.27 -1.39 -0.30 0.00 0.00 0.00 0.00 60.65 58.69 3kbs s ILE 59 Cb 0.07 -2.01 -0.11 0.00 0.01 0.00 0.00 42.46 40.42 3kbs s ILE 59 CO 0.66 -0.04 1.62 -2.84 0.00 0.00 0.00 174.94 174.33 3kbs s PRO 60 N 1.26 4.12 -0.03 2.79 0.02 -1.26 -4.00 135.00 137.89 3kbs s PRO 60 Ca -0.07 2.59 -0.39 0.00 0.02 0.00 0.00 61.00 63.16 3kbs s PRO 60 Cb -0.19 -3.03 -0.17 0.00 0.02 0.00 0.00 34.50 31.13 3kbs s PRO 60 CO -0.06 -0.66 1.39 0.34 -0.33 0.00 0.00 177.00 177.68 3kbs n PHE 61 N 2.45 1.48 -0.49 6.54 7.35 -1.26 -1.52 117.46 132.00 3kbs n PHE 61 Ca 0.09 0.72 0.00 0.00 -0.76 0.00 0.00 57.45 57.51 3kbs n PHE 61 Cb 0.37 -2.31 0.00 0.00 0.35 0.00 0.00 39.48 37.89 3kbs n PHE 61 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3kbs n GLY 62 N 2.75 0.75 3.77 7.13 0.00 -1.26 -5.04 105.19 113.29 3kbs n GLY 62 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3kbs n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kbs s SER 63 N -2.53 6.18 0.50 1.61 0.01 -0.58 -4.98 113.70 113.91 3kbs s SER 63 Ca 0.00 2.95 -0.19 0.00 1.31 0.00 0.00 55.95 60.03 3kbs s SER 63 Cb 0.00 -2.66 -0.08 0.00 0.21 0.00 0.00 66.02 63.49 3kbs s SER 63 CO 0.00 -0.97 1.00 -0.94 0.41 0.00 0.00 173.24 172.74 3kbs s SER 64 N -0.35 6.49 0.31 2.44 1.04 -1.26 -4.80 113.70 117.56 3kbs s SER 64 Ca 0.56 1.75 0.04 0.00 0.48 0.00 0.00 55.95 58.78 3kbs s SER 64 Cb -0.44 -2.54 0.81 0.00 0.10 0.00 0.00 66.02 63.95 3kbs s SER 64 CO 0.59 -0.68 1.61 0.44 0.98 0.00 0.00 173.24 176.18 3kbs h ASP 65 N 1.29 -0.12 1.33 7.02 5.19 -1.99 1.36 116.42 130.51 3kbs h ASP 65 Ca -0.48 0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.16 3kbs h ASP 65 Cb 1.20 0.34 0.00 0.00 0.18 0.00 0.00 39.33 41.05 3kbs h ASP 65 CO 0.60 -0.26 0.00 -1.54 -3.12 0.00 0.00 179.24 174.92 3kbs n SER 66 N -5.32 0.61 0.09 6.45 3.41 -1.26 -1.50 113.62 116.10 3kbs n SER 66 Ca 0.24 0.56 -0.19 0.00 -0.26 0.00 0.00 58.87 59.22 3kbs n SER 66 Cb 0.79 -0.72 -0.15 0.00 -0.26 0.00 0.00 64.21 63.87 3kbs n SER 66 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3kbs h GLU 67 N 0.00 0.34 -0.13 4.33 5.08 0.13 -3.15 114.58 121.18 3kbs h GLU 67 Ca 0.00 -0.59 0.04 0.00 -1.00 0.00 0.00 59.36 57.82 3kbs h GLU 67 Cb 0.66 0.22 -0.05 0.00 0.50 0.00 0.00 28.75 30.08 3kbs h GLU 67 CO 0.00 1.24 -0.17 -0.09 -1.00 0.00 0.00 179.01 179.00 3kbs h ARG 68 N 0.09 -0.20 -0.43 2.33 2.43 -0.36 -0.79 114.38 117.44 3kbs h ARG 68 Ca -0.24 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.03 3kbs h ARG 68 Cb 2.06 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 31.57 3kbs h ARG 68 CO 0.20 -0.13 -0.12 1.49 -1.51 0.00 0.00 179.97 179.90 3kbs h GLU 69 N -0.21 -0.01 -0.55 0.20 4.57 -1.38 -0.12 114.58 117.08 3kbs h GLU 69 Ca 0.10 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.30 3kbs h GLU 69 Cb 0.35 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.90 3kbs h GLU 69 CO -0.25 -0.01 0.33 0.93 -1.18 0.00 0.00 179.01 178.83 3kbs h GLU 70 N -0.01 0.64 -0.39 1.92 4.39 -1.34 -0.57 114.58 119.21 3kbs h GLU 70 Ca 0.21 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.79 3kbs h GLU 70 Cb 0.33 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 3kbs h GLU 70 CO -0.45 0.42 -0.08 0.45 -1.16 0.00 0.00 179.01 178.19 3kbs h HIS 71 N 0.66 0.83 0.41 4.33 3.86 -0.39 -2.68 115.15 122.18 3kbs h HIS 71 Ca 0.22 -0.17 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 3kbs h HIS 71 Cb 0.02 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.29 3kbs h HIS 71 CO -0.06 0.87 -0.20 0.28 0.86 0.00 0.00 177.93 179.68 3kbs h VAL 72 N 0.56 0.58 -0.25 2.45 2.07 -0.83 -1.63 116.25 119.19 3kbs h VAL 72 Ca 0.10 -0.31 0.06 0.00 0.82 0.00 0.00 66.70 67.38 3kbs h VAL 72 Cb 0.59 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 31.01 3kbs h VAL 72 CO 0.04 0.06 -0.28 0.11 0.02 0.00 0.00 177.57 177.51 3kbs h LYS 73 N -0.74 -0.27 -0.81 1.57 1.57 -1.08 0.56 116.57 117.36 3kbs h LYS 73 Ca -0.06 0.02 0.15 0.00 -1.87 0.00 0.00 60.65 58.89 3kbs h LYS 73 Cb 0.52 0.06 -0.10 0.00 0.08 0.00 0.00 32.23 32.79 3kbs h LYS 73 CO 0.09 -0.18 0.37 0.00 -0.57 0.00 0.00 179.45 179.16 3kbs h ARG 74 N -0.28 0.50 -0.56 3.15 3.08 -1.54 0.21 114.38 118.94 3kbs h ARG 74 Ca 0.14 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 60.05 3kbs h ARG 74 Cb 0.50 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 3kbs h ARG 74 CO -0.41 0.33 -0.04 0.35 -1.07 0.00 0.00 179.97 179.13 3kbs h PHE 75 N 0.52 1.13 -0.31 3.04 3.57 0.35 -2.34 116.94 122.90 3kbs h PHE 75 Ca 0.45 -0.21 0.02 0.00 3.53 0.00 0.00 57.97 61.76 3kbs h PHE 75 Cb 0.68 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 3kbs h PHE 75 CO -0.13 1.02 0.15 -0.09 -2.23 0.00 0.00 178.31 177.03 3kbs h ARG 76 N 0.91 0.31 -0.97 1.11 9.65 0.12 -1.97 114.38 123.53 3kbs h ARG 76 Ca 0.15 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 3kbs h ARG 76 Cb 0.60 -0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 29.07 3kbs h ARG 76 CO 0.04 0.20 0.62 0.37 2.80 0.00 0.00 179.97 184.00 3kbs h GLN 77 N 0.32 1.30 -0.51 0.20 5.75 -0.54 -0.06 115.11 121.56 3kbs h GLN 77 Ca 0.13 -0.10 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 3kbs h GLN 77 Cb 0.05 -0.28 -0.02 0.00 1.07 0.00 0.00 27.48 28.29 3kbs h GLN 77 CO -0.09 0.88 0.24 0.00 -2.65 0.00 0.00 178.83 177.21 3kbs h ALA 78 N 1.35 0.66 -0.10 3.38 0.00 -1.02 0.52 119.26 124.06 3kbs h ALA 78 Ca 0.35 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 3kbs h ALA 78 Cb -0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3kbs h ALA 78 CO -0.07 0.23 -0.30 -0.07 0.00 0.00 0.00 179.25 179.04 3kbs h LEU 79 N 0.69 0.19 -0.36 0.00 3.38 -1.03 -1.68 115.31 116.49 3kbs h LEU 79 Ca 0.18 -0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.91 3kbs h LEU 79 Cb 0.13 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3kbs h LEU 79 CO -0.02 0.49 -0.54 0.44 0.09 0.00 0.00 178.44 178.89 3kbs h ASP 80 N 0.17 0.89 0.96 -0.43 3.45 -0.69 -2.13 116.42 118.63 3kbs h ASP 80 Ca 0.02 -0.47 0.00 0.00 0.43 0.00 0.00 57.03 57.01 3kbs h ASP 80 Cb 0.62 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 39.14 3kbs h ASP 80 CO 0.05 1.25 0.00 0.44 -1.57 0.00 0.00 179.24 179.41 3kbs h ASP 81 N 0.61 0.00 -0.00 6.45 3.32 -0.31 -3.29 116.42 123.20 3kbs h ASP 81 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3kbs h ASP 81 Cb 1.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.69 3kbs h ASP 81 CO 0.12 0.00 -0.10 0.35 -1.72 0.00 0.00 179.24 177.89 3kbs n THR 82 N -2.92 0.00 -0.74 0.35 -2.24 -0.69 -4.98 114.28 103.06 3kbs n THR 82 Ca 0.01 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 3kbs n THR 82 Cb 0.29 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 3kbs n THR 82 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kbs n GLY 83 N 0.89 1.45 3.77 3.38 0.00 -0.81 -5.02 105.19 108.85 3kbs n GLY 83 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 3kbs n GLY 83 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3kbs s MET 84 N -0.03 3.87 0.45 1.61 -1.94 -1.22 -4.97 119.30 117.08 3kbs s MET 84 Ca 0.00 1.92 0.07 0.00 -1.71 0.00 0.00 55.69 55.97 3kbs s MET 84 Cb 0.00 -2.58 -0.01 0.00 2.01 0.00 0.00 34.83 34.25 3kbs s MET 84 CO 0.00 -0.50 0.33 0.15 -0.01 0.00 0.00 175.02 174.99 3kbs s LYS 85 N -2.46 2.36 -0.54 2.03 -0.14 -0.89 -4.80 119.74 115.29 3kbs s LYS 85 Ca 0.60 -1.77 0.04 0.00 -1.36 0.00 0.00 55.97 53.48 3kbs s LYS 85 Cb -0.32 -2.18 0.16 0.00 -1.68 0.00 0.00 37.83 33.81 3kbs s LYS 85 CO 0.40 -0.30 0.36 0.08 -0.76 0.00 0.00 175.35 175.14 3kbs s VAL 86 N -2.60 1.85 -0.11 3.17 1.01 -1.26 -1.42 120.40 121.03 3kbs s VAL 86 Ca 0.42 -3.32 0.22 0.00 0.00 0.00 0.00 61.98 59.30 3kbs s VAL 86 Cb -0.01 -2.25 0.22 0.00 0.00 0.00 0.00 36.38 34.35 3kbs s VAL 86 CO 0.24 -1.01 1.66 -0.65 0.00 0.00 0.00 175.10 175.35 3kbs h PRO 87 N 5.94 0.00 -4.11 2.72 0.11 -1.83 -2.80 132.00 132.02 3kbs h PRO 87 Ca 0.11 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.06 3kbs h PRO 87 Cb 0.85 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 31.78 3kbs h PRO 87 CO 0.57 0.23 -0.69 1.41 -0.21 0.00 0.00 178.00 179.30 3kbs s MET 88 N -3.32 0.44 0.21 1.05 -2.45 -1.26 -1.60 119.30 112.37 3kbs s MET 88 Ca 0.03 -0.86 -0.07 0.00 -1.25 0.00 0.00 55.69 53.55 3kbs s MET 88 Cb 0.08 0.13 -0.02 0.00 1.25 0.00 0.00 34.83 36.26 3kbs s MET 88 CO 0.67 -0.07 0.28 0.00 1.05 0.00 0.00 175.02 176.95 3kbs s ALA 89 N -2.43 0.44 0.26 4.11 0.00 -0.93 -3.75 121.76 119.46 3kbs s ALA 89 Ca -0.07 -1.25 -0.17 0.00 0.00 0.00 0.00 51.96 50.48 3kbs s ALA 89 Cb -0.03 1.14 0.01 0.00 0.00 0.00 0.00 23.12 24.24 3kbs s ALA 89 CO -0.04 -0.69 0.59 -0.08 0.00 0.00 0.00 175.76 175.54 3kbs s THR 90 N -4.07 0.00 -0.05 0.00 -1.32 -0.51 -0.90 115.64 108.79 3kbs s THR 90 Ca 0.28 -1.22 0.01 0.00 -1.21 0.00 0.00 61.69 59.55 3kbs s THR 90 Cb 0.04 -2.11 -0.03 0.00 -1.51 0.00 0.00 72.50 68.89 3kbs s THR 90 CO 0.08 -0.00 -0.04 -0.89 -2.21 0.00 0.00 174.62 171.56 3kbs s THR 91 N -3.97 3.90 -0.57 5.08 2.01 -1.26 -2.20 115.64 118.63 3kbs s THR 91 Ca 0.17 -0.49 -0.25 0.00 0.31 0.00 0.00 61.69 61.43 3kbs s THR 91 Cb -0.03 -2.64 0.04 0.00 0.01 0.00 0.00 72.50 69.88 3kbs s THR 91 CO 0.08 0.53 0.98 0.21 -0.69 0.00 0.00 174.62 175.74 3kbs s ASN 92 N -1.04 6.34 -0.39 3.53 3.84 -1.26 -4.84 114.94 121.12 3kbs s ASN 92 Ca 0.14 -0.34 0.06 0.00 0.21 0.00 0.00 52.86 52.93 3kbs s ASN 92 Cb -0.11 -2.45 0.44 0.00 -0.55 0.00 0.00 41.25 38.57 3kbs s ASN 92 CO 0.04 -1.29 1.17 0.18 -2.79 0.00 0.00 177.10 174.42 3kbs n LEU 93 N 7.65 4.90 0.00 3.21 4.77 -1.26 -4.74 117.00 131.53 3kbs n LEU 93 Ca 0.02 -5.01 0.00 0.00 -0.03 0.00 0.00 56.01 51.00 3kbs n LEU 93 Cb 0.48 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3kbs n LEU 93 CO 0.65 2.17 0.00 2.22 -1.33 0.00 0.00 177.39 181.09 3kbs n PHE 94 N -0.58 0.00 -0.03 -1.77 1.16 -1.26 -4.47 117.46 110.51 3kbs n PHE 94 Ca 0.42 0.00 -0.16 0.00 -1.87 0.00 0.00 57.45 55.84 3kbs n PHE 94 Cb 0.78 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 38.51 3kbs n PHE 94 CO 0.00 0.00 0.00 1.15 -1.87 0.00 0.00 176.76 176.04 3kbs h THR 95 N 0.00 1.70 -3.72 1.97 2.02 -1.93 -3.46 112.91 109.48 3kbs h THR 95 Ca 0.00 -2.41 -0.53 0.00 0.77 0.00 0.00 66.41 64.24 3kbs h THR 95 Cb 0.00 3.33 0.07 0.00 -1.74 0.00 0.00 68.15 69.81 3kbs h THR 95 CO 0.00 0.64 0.72 -2.28 0.37 0.00 0.00 175.52 174.98 3kbs s HIS 96 N -2.29 2.90 0.60 3.16 2.46 -1.26 -4.86 115.29 116.00 3kbs s HIS 96 Ca -0.17 1.20 0.29 0.00 0.47 0.00 0.00 55.06 56.85 3kbs s HIS 96 Cb -0.02 -3.83 1.51 0.00 -0.13 0.00 0.00 32.58 30.11 3kbs s HIS 96 CO 0.74 -2.49 1.91 -1.35 -2.47 0.00 0.00 174.74 171.08 3kbs h PRO 97 N 3.83 0.00 0.00 2.88 0.11 -2.02 -0.23 132.00 136.57 3kbs h PRO 97 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 3kbs h PRO 97 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3kbs h PRO 97 CO 0.69 0.00 -0.08 -0.24 -0.21 0.00 0.00 178.00 178.16 3kbs h VAL 98 N 0.00 0.46 -0.37 3.15 3.04 -1.96 -2.15 116.25 118.41 3kbs h VAL 98 Ca 0.16 -0.40 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 3kbs h VAL 98 Cb 1.03 1.27 0.00 0.00 -2.01 0.00 0.00 31.29 31.58 3kbs h VAL 98 CO -0.00 0.08 0.00 0.49 -1.01 0.00 0.00 177.57 177.13 3kbs n PHE 99 N -3.57 1.26 0.31 3.17 0.99 -0.10 -4.60 117.46 114.92 3kbs n PHE 99 Ca -0.02 -0.44 0.19 0.00 -0.00 0.00 0.00 57.45 57.18 3kbs n PHE 99 Cb 0.20 -0.33 1.00 0.00 -1.00 0.00 0.00 39.48 39.34 3kbs n PHE 99 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.76 178.33 3kbs h LYS 100 N 2.53 0.00 -0.17 -1.08 2.10 -1.54 -0.10 116.57 118.31 3kbs h LYS 100 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3kbs h LYS 100 Cb 1.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.70 3kbs h LYS 100 CO 0.29 0.02 0.00 -3.47 -2.00 0.00 0.00 179.45 174.29 3kbs n ASP 101 N -3.29 2.41 0.00 7.07 4.64 -1.26 -5.05 116.55 121.07 3kbs n ASP 101 Ca -0.02 -1.95 0.00 0.00 -1.38 0.00 0.00 54.79 51.44 3kbs n ASP 101 Cb 0.15 -0.11 0.00 0.00 -1.04 0.00 0.00 41.12 40.12 3kbs n ASP 101 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3kbs n GLY 102 N 0.04 1.50 0.00 0.27 0.00 -0.05 -3.88 105.19 103.07 3kbs n GLY 102 Ca 0.06 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.90 3kbs n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kbs n GLY 103 N -1.24 -0.08 0.27 -0.02 0.00 -1.26 -4.27 105.19 98.59 3kbs n GLY 103 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 3kbs n GLY 103 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3kbs h PHE 104 N 0.00 0.00 0.00 1.61 0.04 -1.90 -3.16 116.94 113.53 3kbs h PHE 104 Ca 0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 3kbs h PHE 104 Cb 0.00 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 3kbs h PHE 104 CO 0.00 0.08 -0.17 0.25 -0.60 0.00 0.00 178.31 177.88 3kbs n THR 105 N -3.39 1.64 -1.86 -1.55 -2.24 -1.26 -4.44 114.28 101.18 3kbs n THR 105 Ca -0.01 -2.08 -0.37 0.00 -2.27 0.00 0.00 64.05 59.32 3kbs n THR 105 Cb 0.25 -0.11 0.04 0.00 -2.10 0.00 0.00 70.33 68.41 3kbs n THR 105 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kbs s ALA 106 N -2.47 2.63 0.32 6.98 0.00 -1.19 -4.82 121.76 123.20 3kbs s ALA 106 Ca 0.29 1.19 0.04 0.00 0.00 0.00 0.00 51.96 53.48 3kbs s ALA 106 Cb 0.26 -3.52 0.55 0.00 0.00 0.00 0.00 23.12 20.40 3kbs s ALA 106 CO 0.01 -1.34 1.82 -0.91 0.00 0.00 0.00 175.76 175.34 3kbs h ASN 107 N 1.08 0.47 -2.85 0.00 4.21 -1.93 -3.42 115.58 113.15 3kbs h ASN 107 Ca -0.51 -0.11 -0.56 0.00 1.21 0.00 0.00 56.30 56.33 3kbs h ASN 107 Cb 1.31 -0.13 -0.03 0.00 -1.12 0.00 0.00 38.32 38.35 3kbs h ASN 107 CO 0.56 0.61 0.96 -1.81 -1.29 0.00 0.00 177.43 176.45 3kbs s ASP 108 N -6.77 6.85 0.30 5.81 -0.00 -1.26 -4.92 116.67 116.68 3kbs s ASP 108 Ca -0.07 1.79 -0.01 0.00 -0.00 0.00 0.00 52.55 54.26 3kbs s ASP 108 Cb 0.15 -2.54 0.47 0.00 -0.00 0.00 0.00 42.92 41.00 3kbs s ASP 108 CO 0.77 -0.83 1.92 -0.09 -0.00 0.00 0.00 175.17 176.94 3kbs h ARG 109 N 8.63 0.92 0.00 8.23 2.43 -2.01 -2.45 114.38 130.14 3kbs h ARG 109 Ca -0.29 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 58.72 3kbs h ARG 109 Cb 1.12 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 3kbs h ARG 109 CO 0.97 0.69 -0.24 0.38 -1.51 0.00 0.00 179.97 180.26 3kbs h ASP 110 N 0.93 0.00 -0.15 -3.80 -0.00 -1.95 -2.23 116.42 109.21 3kbs h ASP 110 Ca 0.23 0.00 -0.18 0.00 -0.00 0.00 0.00 57.03 57.08 3kbs h ASP 110 Cb 0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.38 3kbs h ASP 110 CO -0.03 0.24 -0.56 0.58 -0.00 0.00 0.00 179.24 179.46 3kbs h VAL 111 N 0.00 1.29 -0.36 4.15 2.07 -1.81 -2.70 116.25 118.89 3kbs h VAL 111 Ca -0.00 -1.78 -0.05 0.00 0.82 0.00 0.00 66.70 65.70 3kbs h VAL 111 Cb 0.72 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 3kbs h VAL 111 CO 0.03 0.57 0.02 0.03 0.02 0.00 0.00 177.57 178.24 3kbs h ARG 112 N 0.57 0.55 -0.24 1.57 3.08 -1.29 -1.64 114.38 116.99 3kbs h ARG 112 Ca 0.01 -0.11 -0.19 0.00 0.07 0.00 0.00 59.98 59.76 3kbs h ARG 112 Cb 1.15 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.12 3kbs h ARG 112 CO 0.12 0.56 -0.58 0.00 -1.07 0.00 0.00 179.97 179.00 3kbs h ARG 113 N 0.53 0.81 -0.86 0.04 3.08 -1.28 -2.69 114.38 114.01 3kbs h ARG 113 Ca 0.12 -0.55 0.04 0.00 0.07 0.00 0.00 59.98 59.65 3kbs h ARG 113 Cb 0.31 0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.39 3kbs h ARG 113 CO 0.01 1.18 0.55 -0.92 -1.07 0.00 0.00 179.97 179.72 3kbs h TYR 114 N 0.56 1.03 -0.82 3.04 3.20 -1.20 -1.19 116.97 121.59 3kbs h TYR 114 Ca -0.00 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 3kbs h TYR 114 Cb 1.19 -0.34 -0.04 0.00 1.54 0.00 0.00 36.73 39.08 3kbs h TYR 114 CO 0.08 0.59 0.36 0.00 -1.64 0.00 0.00 178.16 177.54 3kbs h ALA 115 N 1.36 1.08 -0.10 1.82 0.00 -1.26 0.33 119.26 122.49 3kbs h ALA 115 Ca 0.34 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3kbs h ALA 115 Cb 0.02 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 3kbs h ALA 115 CO -0.12 0.67 0.03 -0.07 0.00 0.00 0.00 179.25 179.76 3kbs h LEU 116 N 1.19 0.16 -1.02 0.00 3.38 -1.09 -0.84 115.31 117.09 3kbs h LEU 116 Ca 0.28 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3kbs h LEU 116 Cb 0.18 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 3kbs h LEU 116 CO -0.03 0.34 0.38 0.03 0.09 0.00 0.00 178.44 179.25 3kbs h ARG 117 N -0.04 1.07 -0.09 1.13 2.47 -0.92 0.16 114.38 118.17 3kbs h ARG 117 Ca 0.03 -0.14 -0.15 0.00 -1.26 0.00 0.00 59.98 58.47 3kbs h ARG 117 Cb 0.25 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.35 3kbs h ARG 117 CO 0.00 0.81 -0.59 -0.22 0.56 0.00 0.00 179.97 180.54 3kbs h LYS 118 N 1.07 0.28 -0.15 0.04 3.64 -0.20 -2.63 116.57 118.62 3kbs h LYS 118 Ca 0.26 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 3kbs h LYS 118 Cb 0.08 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3kbs h LYS 118 CO -0.04 0.79 -0.00 1.15 -2.27 0.00 0.00 179.45 179.08 3kbs h THR 119 N 0.21 1.25 -0.33 1.00 2.02 -0.56 -2.90 112.91 113.61 3kbs h THR 119 Ca -0.00 -0.84 0.02 0.00 0.77 0.00 0.00 66.41 66.35 3kbs h THR 119 Cb 1.09 1.52 -0.02 0.00 -1.74 0.00 0.00 68.15 68.99 3kbs h THR 119 CO 0.09 0.25 0.18 0.40 0.37 0.00 0.00 175.52 176.81 3kbs h ILE 120 N 0.00 1.01 -0.83 3.11 2.04 -0.65 -1.01 117.51 121.19 3kbs h ILE 120 Ca 0.04 -0.13 0.19 0.00 1.00 0.00 0.00 64.86 65.96 3kbs h ILE 120 Cb 0.38 0.61 -0.12 0.00 -0.74 0.00 0.00 36.82 36.95 3kbs h ILE 120 CO 0.01 0.07 0.31 -0.09 0.00 0.00 0.00 178.15 178.44 3kbs h ARG 121 N 0.37 0.36 0.00 2.37 2.43 -1.50 -1.46 114.38 116.94 3kbs h ARG 121 Ca 0.13 -0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 59.15 3kbs h ARG 121 Cb 0.03 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 3kbs h ARG 121 CO -0.08 0.24 -0.64 -0.97 -1.51 0.00 0.00 179.97 177.01 3kbs h ASN 122 N 0.37 0.00 -0.55 -3.80 -1.24 -1.01 -2.98 115.58 106.36 3kbs h ASN 122 Ca 0.49 0.00 -0.04 0.00 0.71 0.00 0.00 56.30 57.46 3kbs h ASN 122 Cb 0.87 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.89 3kbs h ASN 122 CO -0.51 0.64 0.19 0.40 -1.29 0.00 0.00 177.43 176.86 3kbs h ILE 123 N 0.00 1.23 -0.60 2.57 2.04 -0.16 0.18 117.51 122.76 3kbs h ILE 123 Ca -0.01 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.06 3kbs h ILE 123 Cb 1.28 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 3kbs h ILE 123 CO 0.08 0.30 0.28 0.44 0.00 0.00 0.00 178.15 179.25 3kbs h ASP 124 N 0.87 0.80 -0.22 1.72 3.32 -1.39 -1.38 116.42 120.14 3kbs h ASP 124 Ca 0.20 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 3kbs h ASP 124 Cb 0.24 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3kbs h ASP 124 CO -0.01 0.71 0.13 0.25 -1.72 0.00 0.00 179.24 178.60 3kbs h LEU 125 N 0.83 0.27 -0.04 1.55 5.85 -1.27 -2.18 115.31 120.32 3kbs h LEU 125 Ca 0.21 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.88 3kbs h LEU 125 Cb 0.13 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3kbs h LEU 125 CO -0.02 0.26 -0.11 0.00 -0.34 0.00 0.00 178.44 178.23 3kbs h ALA 126 N 1.02 -0.08 -0.71 1.25 0.00 -0.22 -1.07 119.26 119.45 3kbs h ALA 126 Ca 0.08 0.02 0.16 0.00 0.00 0.00 0.00 54.91 55.17 3kbs h ALA 126 Cb 0.05 0.20 -0.12 0.00 0.00 0.00 0.00 17.79 17.92 3kbs h ALA 126 CO -0.01 -0.59 0.04 0.28 0.00 0.00 0.00 179.25 178.97 3kbs h VAL 127 N -0.16 0.42 -0.85 0.00 2.07 -1.24 -0.92 116.25 115.57 3kbs h VAL 127 Ca 0.05 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.59 3kbs h VAL 127 Cb 0.24 0.27 -0.06 0.00 -1.52 0.00 0.00 31.29 30.22 3kbs h VAL 127 CO -0.14 0.03 0.52 -0.08 0.02 0.00 0.00 177.57 177.92 3kbs h GLU 128 N 0.14 0.93 -0.07 1.57 4.81 -0.64 -2.03 114.58 119.30 3kbs h GLU 128 Ca 0.39 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 3kbs h GLU 128 Cb 0.66 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.83 3kbs h GLU 128 CO -0.59 0.61 0.00 1.28 -0.73 0.00 0.00 179.01 179.58 3kbs n LEU 129 N -4.63 1.74 0.00 1.64 4.77 -0.50 -4.93 117.00 115.09 3kbs n LEU 129 Ca 0.12 -0.62 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 3kbs n LEU 129 Cb 0.17 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3kbs n LEU 129 CO 0.31 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 3kbs n GLY 130 N 1.19 1.09 3.80 -0.72 0.00 -0.46 -4.46 105.19 105.64 3kbs n GLY 130 Ca 0.18 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 3kbs n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbs s ALA 131 N -2.00 2.93 -0.27 4.61 0.00 -0.58 -4.66 121.76 121.78 3kbs s ALA 131 Ca 0.00 0.58 0.18 0.00 0.00 0.00 0.00 51.96 52.72 3kbs s ALA 131 Cb 0.00 -3.23 -0.25 0.00 0.00 0.00 0.00 23.12 19.63 3kbs s ALA 131 CO 0.00 -0.21 0.50 0.39 0.00 0.00 0.00 175.76 176.45 3kbs n GLU 132 N -0.77 0.76 -4.76 0.00 1.02 -0.62 -4.58 120.64 111.68 3kbs n GLU 132 Ca 0.08 -0.11 -0.24 0.00 -0.02 0.00 0.00 57.16 56.86 3kbs n GLU 132 Cb 0.52 -1.40 -0.15 0.00 -0.02 0.00 0.00 31.44 30.40 3kbs n GLU 132 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3kbs s THR 133 N -3.07 1.41 -0.23 2.62 2.01 -0.99 -2.37 115.64 115.02 3kbs s THR 133 Ca -0.02 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 61.15 3kbs s THR 133 Cb 0.12 -1.19 0.05 0.00 0.01 0.00 0.00 72.50 71.49 3kbs s THR 133 CO 0.74 0.32 -0.11 -0.47 -0.69 0.00 0.00 174.62 174.42 3kbs s TYR 134 N -0.52 2.82 0.24 4.92 5.04 0.30 -2.20 117.35 127.96 3kbs s TYR 134 Ca 0.06 -1.94 -0.20 0.00 -2.44 0.00 0.00 57.07 52.55 3kbs s TYR 134 Cb -0.07 -1.79 -0.08 0.00 0.35 0.00 0.00 41.96 40.37 3kbs s TYR 134 CO -0.00 -0.82 0.75 0.08 -1.34 0.00 0.00 175.55 174.22 3kbs s VAL 135 N 1.26 4.54 -0.19 3.14 1.01 -0.08 -1.48 120.40 128.60 3kbs s VAL 135 Ca -0.05 1.31 -0.00 0.00 0.00 0.00 0.00 61.98 63.24 3kbs s VAL 135 Cb -0.18 -3.85 0.05 0.00 0.00 0.00 0.00 36.38 32.40 3kbs s VAL 135 CO -0.07 0.16 -0.06 0.00 0.00 0.00 0.00 175.10 175.13 3kbs s ALA 136 N -1.58 1.64 -0.37 5.51 0.00 -0.52 -4.16 121.76 122.28 3kbs s ALA 136 Ca 0.45 -0.99 -0.01 0.00 0.00 0.00 0.00 51.96 51.40 3kbs s ALA 136 Cb -0.16 -1.21 0.09 0.00 0.00 0.00 0.00 23.12 21.84 3kbs s ALA 136 CO 0.21 -0.89 0.12 -0.46 0.00 0.00 0.00 175.76 174.74 3kbs s TRP 137 N 1.56 3.55 -1.52 0.00 -0.00 -1.26 -0.46 118.94 120.81 3kbs s TRP 137 Ca -0.01 -2.40 -0.10 0.00 -0.00 0.00 0.00 56.10 53.59 3kbs s TRP 137 Cb -0.16 -2.90 -0.01 0.00 -0.00 0.00 0.00 33.47 30.40 3kbs s TRP 137 CO -0.08 -0.93 2.65 0.41 -0.00 0.00 0.00 176.95 179.01 3kbs n GLY 138 N 4.53 4.50 0.33 5.86 0.00 -1.26 -4.74 105.19 114.41 3kbs n GLY 138 Ca -0.04 -1.66 0.22 0.00 0.00 0.00 0.00 46.02 44.54 3kbs n GLY 138 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3kbs h GLY 139 N 7.34 0.00 -1.43 -0.02 0.00 -1.93 -1.77 103.07 105.26 3kbs h GLY 139 Ca 0.76 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.09 3kbs h GLY 139 CO 1.74 0.00 0.00 0.54 0.00 0.00 0.00 176.54 178.82 3kbs n ARG 140 N -3.05 1.69 -2.74 4.80 5.12 -1.26 -3.95 116.66 117.27 3kbs n ARG 140 Ca -0.03 -1.70 -0.43 0.00 -1.93 0.00 0.00 57.85 53.77 3kbs n ARG 140 Cb 0.09 -1.33 -0.03 0.00 -1.16 0.00 0.00 32.46 30.03 3kbs n ARG 140 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3kbs s GLU 141 N -1.21 3.64 0.00 5.56 0.41 -0.67 -3.25 118.70 123.17 3kbs s GLU 141 Ca 0.23 0.36 0.00 0.00 -0.41 0.00 0.00 54.97 55.15 3kbs s GLU 141 Cb 0.14 -3.90 0.00 0.00 -1.78 0.00 0.00 34.13 28.59 3kbs s GLU 141 CO 0.20 -1.25 0.00 0.41 -0.49 0.00 0.00 175.26 174.14 3kbs n GLY 142 N 4.83 -0.35 3.55 -1.39 0.00 -1.26 -1.08 105.19 109.49 3kbs n GLY 142 Ca 0.08 -0.73 -0.06 0.00 0.00 0.00 0.00 46.02 45.30 3kbs n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbs s ALA 143 N -1.00 -1.90 -0.51 4.61 0.00 -0.71 -4.88 121.76 117.37 3kbs s ALA 143 Ca 0.00 1.11 0.18 0.00 0.00 0.00 0.00 51.96 53.25 3kbs s ALA 143 Cb 0.00 0.27 -0.23 0.00 0.00 0.00 0.00 23.12 23.17 3kbs s ALA 143 CO 0.00 -0.70 0.60 0.39 0.00 0.00 0.00 175.76 176.05 3kbs n GLU 144 N -0.23 0.95 -3.90 0.00 4.71 -1.26 -1.68 120.64 119.24 3kbs n GLU 144 Ca -0.06 -0.07 -0.09 0.00 -0.01 0.00 0.00 57.16 56.93 3kbs n GLU 144 Cb 0.61 -1.37 -0.08 0.00 -1.01 0.00 0.00 31.44 29.59 3kbs n GLU 144 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3kbs s SER 145 N -3.22 0.15 0.20 1.62 1.04 -1.26 -4.94 113.70 107.28 3kbs s SER 145 Ca 0.01 -0.58 -0.03 0.00 0.48 0.00 0.00 55.95 55.84 3kbs s SER 145 Cb 0.13 0.28 0.13 0.00 0.10 0.00 0.00 66.02 66.66 3kbs s SER 145 CO 0.73 -0.61 1.51 1.23 0.98 0.00 0.00 173.24 177.08 3kbs h GLY 146 N 3.22 0.59 2.00 7.32 0.00 -1.95 -3.17 103.07 111.08 3kbs h GLY 146 Ca -0.33 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 46.32 3kbs h GLY 146 CO 0.54 0.61 0.00 -1.33 0.00 0.00 0.00 176.54 176.36 3kbs h GLY 147 N 1.08 0.00 2.00 4.60 0.00 -2.03 -3.33 103.07 105.39 3kbs h GLY 147 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.27 3kbs h GLY 147 CO 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 176.54 176.32 3kbs h ALA 148 N 2.22 1.15 -3.25 3.60 0.00 -1.98 -3.41 119.26 117.58 3kbs h ALA 148 Ca 0.00 -0.30 -0.43 0.00 0.00 0.00 0.00 54.91 54.19 3kbs h ALA 148 Cb 0.85 -0.05 -0.39 0.00 0.00 0.00 0.00 17.79 18.20 3kbs h ALA 148 CO 0.00 0.41 -0.75 0.21 0.00 0.00 0.00 179.25 179.11 3kbs s LYS 149 N -3.87 0.30 -0.40 0.00 2.47 -1.25 -5.00 119.74 111.98 3kbs s LYS 149 Ca -0.01 0.12 -0.27 0.00 -1.56 0.00 0.00 55.97 54.24 3kbs s LYS 149 Cb 0.12 -1.06 0.02 0.00 -1.46 0.00 0.00 37.83 35.45 3kbs s LYS 149 CO 0.68 -0.40 1.00 0.34 0.16 0.00 0.00 175.35 177.13 3kbs s ASP 150 N 2.05 6.68 0.35 1.43 3.68 -1.26 -4.94 116.67 124.67 3kbs s ASP 150 Ca 0.04 0.55 0.18 0.00 2.13 0.00 0.00 52.55 55.45 3kbs s ASP 150 Cb -0.13 -2.50 0.58 0.00 -1.45 0.00 0.00 42.92 39.43 3kbs s ASP 150 CO -0.05 -0.99 1.69 0.58 0.13 0.00 0.00 175.17 176.53 3kbs h VAL 151 N 5.95 0.94 -0.32 1.11 2.07 -1.99 -1.39 116.25 122.62 3kbs h VAL 151 Ca -0.23 -1.66 -0.04 0.00 0.82 0.00 0.00 66.70 65.59 3kbs h VAL 151 Cb 1.07 2.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.83 3kbs h VAL 151 CO 1.03 0.41 0.04 0.03 0.02 0.00 0.00 177.57 179.10 3kbs h ARG 152 N 0.00 0.53 -0.60 1.57 3.08 -1.99 -0.27 114.38 116.70 3kbs h ARG 152 Ca -0.00 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 3kbs h ARG 152 Cb 0.97 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.93 3kbs h ARG 152 CO 0.05 0.63 0.29 -0.44 -1.07 0.00 0.00 179.97 179.44 3kbs h ASP 153 N 0.35 0.76 -0.56 7.04 3.45 -1.90 -1.16 116.42 124.41 3kbs h ASP 153 Ca 0.10 -0.07 -0.11 0.00 0.43 0.00 0.00 57.03 57.37 3kbs h ASP 153 Cb 0.36 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.92 3kbs h ASP 153 CO 0.01 0.65 -0.08 0.00 -1.57 0.00 0.00 179.24 178.24 3kbs h ALA 154 N 1.48 0.76 -0.62 3.45 0.00 -0.96 0.14 119.26 123.51 3kbs h ALA 154 Ca 0.21 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 3kbs h ALA 154 Cb 0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3kbs h ALA 154 CO -0.03 0.66 0.04 -0.07 0.00 0.00 0.00 179.25 179.85 3kbs h LEU 155 N 0.92 1.04 -0.61 0.00 3.38 -0.87 0.32 115.31 119.49 3kbs h LEU 155 Ca 0.15 -0.29 0.07 0.00 0.09 0.00 0.00 57.88 57.89 3kbs h LEU 155 Cb 0.65 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 3kbs h LEU 155 CO 0.05 1.07 0.30 0.44 0.09 0.00 0.00 178.44 180.39 3kbs h ASP 156 N 0.97 0.42 -0.27 -0.43 3.45 -0.76 0.14 116.42 119.93 3kbs h ASP 156 Ca 0.18 0.04 -0.13 0.00 0.43 0.00 0.00 57.03 57.55 3kbs h ASP 156 Cb 0.52 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 39.24 3kbs h ASP 156 CO 0.02 0.27 -0.29 0.03 -1.57 0.00 0.00 179.24 177.70 3kbs h ARG 157 N 0.56 0.78 -0.33 3.56 2.47 -0.53 -1.01 114.38 119.89 3kbs h ARG 157 Ca 0.28 -0.35 0.01 0.00 -1.26 0.00 0.00 59.98 58.66 3kbs h ARG 157 Cb 0.24 -0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.52 3kbs h ARG 157 CO -0.21 0.98 0.21 1.98 0.56 0.00 0.00 179.97 183.48 3kbs h MET 158 N 0.66 0.41 -0.33 0.04 4.05 0.01 -0.45 114.93 119.33 3kbs h MET 158 Ca 0.08 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.45 3kbs h MET 158 Cb 0.83 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 3kbs h MET 158 CO 0.07 0.27 0.13 -0.22 0.23 0.00 0.00 176.91 177.40 3kbs h LYS 159 N 0.42 0.49 -0.76 0.39 3.64 -0.84 -1.02 116.57 118.89 3kbs h LYS 159 Ca 0.12 -0.09 0.15 0.00 -1.27 0.00 0.00 60.65 59.57 3kbs h LYS 159 Cb -0.03 -0.08 -0.10 0.00 -0.41 0.00 0.00 32.23 31.61 3kbs h LYS 159 CO -0.04 0.48 0.26 1.49 -2.27 0.00 0.00 179.45 179.38 3kbs h GLU 160 N 0.38 0.36 -0.32 1.90 4.81 -1.00 0.38 114.58 121.10 3kbs h GLU 160 Ca 0.11 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 3kbs h GLU 160 Cb 0.17 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3kbs h GLU 160 CO -0.01 0.24 -0.03 0.00 -0.73 0.00 0.00 179.01 178.48 3kbs h ALA 161 N 1.58 0.43 -0.19 2.92 0.00 -0.42 -1.69 119.26 121.89 3kbs h ALA 161 Ca 0.42 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 3kbs h ALA 161 Cb 0.69 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3kbs h ALA 161 CO -0.45 0.22 -0.48 0.74 0.00 0.00 0.00 179.25 179.29 3kbs h PHE 162 N 0.37 0.62 -0.18 0.00 -1.00 -0.21 -2.09 116.94 114.46 3kbs h PHE 162 Ca 0.09 -0.20 -0.00 0.00 2.81 0.00 0.00 57.97 60.66 3kbs h PHE 162 Cb 0.50 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 39.93 3kbs h PHE 162 CO 0.04 0.89 0.10 -0.44 -1.61 0.00 0.00 178.31 177.29 3kbs h ASP 163 N 0.40 0.22 -0.95 2.17 3.45 -0.21 -1.38 116.42 120.13 3kbs h ASP 163 Ca 0.02 -0.08 0.10 0.00 0.43 0.00 0.00 57.03 57.51 3kbs h ASP 163 Cb 0.99 -0.06 -0.08 0.00 -0.56 0.00 0.00 39.33 39.63 3kbs h ASP 163 CO 0.09 0.23 0.59 -0.07 -1.57 0.00 0.00 179.24 178.51 3kbs h LEU 164 N 0.19 0.88 -0.69 1.55 3.38 -1.18 0.72 115.31 120.15 3kbs h LEU 164 Ca 0.06 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3kbs h LEU 164 Cb 0.06 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 3kbs h LEU 164 CO -0.01 0.50 0.35 -0.07 0.09 0.00 0.00 178.44 179.30 3kbs h LEU 165 N 0.97 0.89 -0.61 1.67 3.38 -0.94 -0.62 115.31 120.06 3kbs h LEU 165 Ca 0.45 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 58.20 3kbs h LEU 165 Cb 0.38 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3kbs h LEU 165 CO -0.24 0.76 -0.02 1.23 0.09 0.00 0.00 178.44 180.25 3kbs h GLY 166 N 0.95 1.16 1.02 0.83 0.00 -0.60 -0.50 103.07 105.94 3kbs h GLY 166 Ca 0.24 -0.87 -0.05 0.00 0.00 0.00 0.00 47.33 46.65 3kbs h GLY 166 CO -0.03 0.80 0.24 -2.09 0.00 0.00 0.00 176.54 175.46 3kbs h GLU 167 N 0.98 1.03 0.22 4.80 4.81 -0.65 -1.33 114.58 124.45 3kbs h GLU 167 Ca 0.17 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3kbs h GLU 167 Cb 0.59 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 3kbs h GLU 167 CO 0.04 0.88 -0.16 -0.92 -0.73 0.00 0.00 179.01 178.12 3kbs h TYR 168 N 0.97 -0.42 -0.50 0.92 3.20 -0.61 -1.98 116.97 118.56 3kbs h TYR 168 Ca 0.22 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.17 3kbs h TYR 168 Cb 0.26 0.15 -0.07 0.00 1.54 0.00 0.00 36.73 38.61 3kbs h TYR 168 CO 0.02 -0.25 0.10 0.28 -1.64 0.00 0.00 178.16 176.67 3kbs h VAL 169 N -0.38 0.73 -0.21 1.81 2.07 -1.01 -1.43 116.25 117.82 3kbs h VAL 169 Ca -0.01 -0.08 -0.18 0.00 0.82 0.00 0.00 66.70 67.25 3kbs h VAL 169 Cb 0.34 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 3kbs h VAL 169 CO 0.00 0.04 -0.58 0.71 0.02 0.00 0.00 177.57 177.76 3kbs h THR 170 N 0.24 1.30 0.00 2.57 1.35 -0.97 -2.06 112.91 115.34 3kbs h THR 170 Ca 0.25 -1.82 -0.03 0.00 -0.55 0.00 0.00 66.41 64.26 3kbs h THR 170 Cb 0.33 1.76 -0.00 0.00 -1.73 0.00 0.00 68.15 68.51 3kbs h THR 170 CO -0.32 0.57 -0.15 0.77 -0.25 0.00 0.00 175.52 176.15 3kbs h SER 171 N 0.52 0.00 0.48 5.36 4.64 -1.05 -0.29 113.55 123.21 3kbs h SER 171 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kbs h SER 171 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3kbs h SER 171 CO 0.12 0.15 -0.27 0.00 -0.87 0.00 0.00 176.83 175.96 3kbs n GLN 172 N -4.26 0.37 -2.42 4.77 1.13 -0.57 -4.93 117.38 111.48 3kbs n GLN 172 Ca -0.02 -0.17 -0.16 0.00 -1.94 0.00 0.00 57.00 54.70 3kbs n GLN 172 Cb 0.22 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.07 3kbs n GLN 172 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3kbs n GLY 173 N 1.41 -0.27 3.83 1.08 0.00 -0.12 -5.00 105.19 106.11 3kbs n GLY 173 Ca 0.10 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 3kbs n GLY 173 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kbs s TYR 174 N -2.84 3.29 -2.24 1.61 4.12 -0.83 -4.96 117.35 115.49 3kbs s TYR 174 Ca 0.05 1.47 0.27 0.00 0.02 0.00 0.00 57.07 58.88 3kbs s TYR 174 Cb -0.02 -2.86 0.85 0.00 -1.52 0.00 0.00 41.96 38.40 3kbs s TYR 174 CO 0.06 -0.68 1.62 -3.47 0.02 0.00 0.00 175.55 173.10 3kbs n ASP 175 N -1.88 1.44 -4.79 2.29 2.03 -1.26 -4.83 116.55 109.55 3kbs n ASP 175 Ca 0.07 -1.31 -0.36 0.00 0.52 0.00 0.00 54.79 53.71 3kbs n ASP 175 Cb 0.54 0.07 -0.05 0.00 -0.72 0.00 0.00 41.12 40.95 3kbs n ASP 175 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3kbs s ILE 176 N -2.20 4.04 0.32 5.18 2.07 -1.26 -5.00 121.20 124.34 3kbs s ILE 176 Ca 0.32 1.51 0.10 0.00 -1.41 0.00 0.00 60.65 61.17 3kbs s ILE 176 Cb 0.20 -3.76 -0.05 0.00 0.13 0.00 0.00 42.46 38.98 3kbs s ILE 176 CO 0.41 -0.03 -0.03 -0.13 -1.91 0.00 0.00 174.94 173.24 3kbs s ARG 177 N -2.54 2.03 -0.07 3.50 0.52 -1.00 -4.99 118.95 116.40 3kbs s ARG 177 Ca 0.57 -1.70 -0.04 0.00 -0.52 0.00 0.00 55.73 54.04 3kbs s ARG 177 Cb -0.18 -1.93 -0.04 0.00 0.52 0.00 0.00 34.95 33.33 3kbs s ARG 177 CO 0.23 0.21 0.10 -0.06 0.02 0.00 0.00 175.30 175.79 3kbs s PHE 178 N -2.49 3.41 -0.13 -0.53 0.40 0.26 -0.54 117.98 118.37 3kbs s PHE 178 Ca 0.33 0.35 0.00 0.00 -0.60 0.00 0.00 56.93 57.01 3kbs s PHE 178 Cb -0.02 -1.84 0.02 0.00 0.51 0.00 0.00 43.02 41.69 3kbs s PHE 178 CO 0.19 0.62 -0.11 0.00 0.70 0.00 0.00 175.22 176.62 3kbs s ALA 179 N -1.07 1.55 -0.05 5.36 0.00 -0.55 -0.81 121.76 126.20 3kbs s ALA 179 Ca 0.18 -0.69 -0.20 0.00 0.00 0.00 0.00 51.96 51.25 3kbs s ALA 179 Cb -0.12 -0.96 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 3kbs s ALA 179 CO 0.08 -0.38 0.56 0.42 0.00 0.00 0.00 175.76 176.43 3kbs s ILE 180 N 1.57 5.02 -0.27 0.00 1.01 -0.13 -1.44 121.20 126.95 3kbs s ILE 180 Ca 0.04 1.15 -0.08 0.00 0.00 0.00 0.00 60.65 61.76 3kbs s ILE 180 Cb -0.13 -3.89 -0.02 0.00 0.01 0.00 0.00 42.46 38.43 3kbs s ILE 180 CO -0.09 0.38 0.10 -0.70 0.00 0.00 0.00 174.94 174.63 3kbs s GLU 181 N 0.10 3.48 0.38 2.79 2.12 0.40 -1.08 118.70 126.88 3kbs s GLU 181 Ca 0.30 -0.60 -0.18 0.00 0.36 0.00 0.00 54.97 54.84 3kbs s GLU 181 Cb -0.17 -3.41 -0.10 0.00 0.26 0.00 0.00 34.13 30.72 3kbs s GLU 181 CO 0.15 -0.29 0.85 -2.14 -0.54 0.00 0.00 175.26 173.28 3kbs s PRO 182 N 1.60 4.10 -0.17 4.30 0.02 -1.26 -4.45 135.00 139.14 3kbs s PRO 182 Ca 0.05 0.89 -0.13 0.00 0.02 0.00 0.00 61.00 61.83 3kbs s PRO 182 Cb -0.16 -2.30 0.05 0.00 0.02 0.00 0.00 34.50 32.11 3kbs s PRO 182 CO 0.04 0.05 0.43 0.21 -0.33 0.00 0.00 177.00 177.40 3kbs s LYS 183 N -3.14 0.47 0.14 5.54 2.20 -1.24 -4.64 119.74 119.06 3kbs s LYS 183 Ca 0.58 0.69 0.04 0.00 -0.36 0.00 0.00 55.97 56.92 3kbs s LYS 183 Cb -0.10 0.15 -0.11 0.00 -1.51 0.00 0.00 37.83 36.26 3kbs s LYS 183 CO 0.16 -0.10 1.31 -1.00 -0.36 0.00 0.00 175.35 175.37 3kbs h PRO 184 N 6.09 0.11 -2.61 4.03 0.13 -1.69 -3.38 132.00 134.68 3kbs h PRO 184 Ca -0.31 -0.15 0.13 0.00 -0.87 0.00 0.00 66.00 64.80 3kbs h PRO 184 Cb 1.18 0.05 -0.06 0.00 0.13 0.00 0.00 31.00 32.31 3kbs h PRO 184 CO 0.25 0.99 0.41 0.54 -0.23 0.00 0.00 178.00 179.96 3kbs s ASN 185 N -6.87 -0.15 0.03 1.44 4.22 -1.26 -2.01 114.94 110.33 3kbs s ASN 185 Ca -0.01 -0.58 0.00 0.00 -2.14 0.00 0.00 52.86 50.13 3kbs s ASN 185 Cb 0.10 0.59 0.00 0.00 1.28 0.00 0.00 41.25 43.22 3kbs s ASN 185 CO 0.83 -1.12 0.00 1.21 -2.04 0.00 0.00 177.10 175.98 3kbs n GLU 186 N -0.51 -1.37 0.04 3.55 2.13 -1.26 -4.86 120.64 118.36 3kbs n GLU 186 Ca -0.05 1.35 0.12 0.00 0.66 0.00 0.00 57.16 59.24 3kbs n GLU 186 Cb 0.60 -1.33 0.25 0.00 0.27 0.00 0.00 31.44 31.23 3kbs n GLU 186 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3kbs n PRO 187 N 0.47 0.18 -2.47 5.31 -0.04 -1.26 -5.00 135.00 132.19 3kbs n PRO 187 Ca 0.00 0.06 -0.32 0.00 -0.04 0.00 0.00 63.50 63.20 3kbs n PRO 187 Cb 0.00 -1.62 -0.03 0.00 -0.04 0.00 0.00 33.50 31.81 3kbs n PRO 187 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3kbs s ARG 188 N -3.10 3.89 0.25 0.54 1.81 -1.25 -4.97 118.95 116.13 3kbs s ARG 188 Ca 0.09 0.84 -0.04 0.00 -1.72 0.00 0.00 55.73 54.90 3kbs s ARG 188 Cb 0.15 -2.19 0.38 0.00 -0.45 0.00 0.00 34.95 32.84 3kbs s ARG 188 CO 0.69 -0.23 1.86 0.78 -0.68 0.00 0.00 175.30 177.72 3kbs h GLY 189 N 0.93 1.41 -5.29 -3.53 0.00 -1.89 -3.41 103.07 91.29 3kbs h GLY 189 Ca -0.47 -0.42 -0.20 0.00 0.00 0.00 0.00 47.33 46.24 3kbs h GLY 189 CO 0.62 0.28 -0.67 0.99 0.00 0.00 0.00 176.54 177.76 3kbs s ASP 190 N -5.81 0.06 0.01 0.19 1.11 -0.68 -4.71 116.67 106.84 3kbs s ASP 190 Ca -0.12 -0.14 0.07 0.00 0.18 0.00 0.00 52.55 52.53 3kbs s ASP 190 Cb 0.19 0.09 -0.03 0.00 1.07 0.00 0.00 42.92 44.24 3kbs s ASP 190 CO 0.80 -0.13 -0.19 -0.63 1.18 0.00 0.00 175.17 176.19 3kbs s ILE 191 N -0.58 2.67 0.51 0.77 1.01 -0.85 -1.73 121.20 123.01 3kbs s ILE 191 Ca -0.06 -1.07 -0.20 0.00 0.00 0.00 0.00 60.65 59.32 3kbs s ILE 191 Cb -0.04 -2.07 -0.07 0.00 0.01 0.00 0.00 42.46 40.29 3kbs s ILE 191 CO -0.00 0.45 1.08 -0.76 0.00 0.00 0.00 174.94 175.71 3kbs s LEU 192 N -1.09 3.79 -0.95 2.97 1.43 -0.24 -3.64 118.68 120.96 3kbs s LEU 192 Ca 0.13 2.03 -0.09 0.00 -1.03 0.00 0.00 54.13 55.17 3kbs s LEU 192 Cb -0.10 -4.57 -0.01 0.00 0.03 0.00 0.00 46.19 41.54 3kbs s LEU 192 CO 0.03 -0.99 0.74 0.18 0.23 0.00 0.00 176.35 176.54 3kbs n LEU 193 N -1.14 -3.99 0.11 1.79 4.77 -1.26 -4.81 117.00 112.47 3kbs n LEU 193 Ca 0.10 -0.71 0.13 0.00 -0.03 0.00 0.00 56.01 55.50 3kbs n LEU 193 Cb 0.52 -2.55 0.44 0.00 -2.33 0.00 0.00 43.42 39.50 3kbs n LEU 193 CO 0.41 -0.03 0.88 -0.81 -1.33 0.00 0.00 177.39 176.50 3kbs n PRO 194 N -3.08 0.23 -4.10 3.23 -0.04 -1.24 -3.81 135.00 126.18 3kbs n PRO 194 Ca -0.11 0.29 -0.10 0.00 -0.04 0.00 0.00 63.50 63.54 3kbs n PRO 194 Cb 0.59 -1.82 -0.09 0.00 -0.04 0.00 0.00 33.50 32.14 3kbs n PRO 194 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3kbs s THR 195 N -3.18 0.04 0.25 0.52 -4.23 -1.26 -2.30 115.64 105.48 3kbs s THR 195 Ca 0.08 -1.76 -0.04 0.00 -1.18 0.00 0.00 61.69 58.79 3kbs s THR 195 Cb 0.11 -2.19 0.25 0.00 1.34 0.00 0.00 72.50 72.01 3kbs s THR 195 CO 0.51 -0.19 1.67 0.58 -0.54 0.00 0.00 174.62 176.66 3kbs h VAL 196 N 2.61 0.47 -0.05 2.29 2.07 -1.91 -1.50 116.25 120.22 3kbs h VAL 196 Ca -0.33 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.13 3kbs h VAL 196 Cb 1.23 0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 3kbs h VAL 196 CO 0.51 0.04 -0.15 1.23 0.02 0.00 0.00 177.57 179.22 3kbs h GLY 197 N 0.25 -0.15 0.59 2.17 0.00 -1.96 0.12 103.07 104.08 3kbs h GLY 197 Ca 0.44 0.18 0.06 0.00 0.00 0.00 0.00 47.33 48.01 3kbs h GLY 197 CO -0.55 -0.15 0.23 0.45 0.00 0.00 0.00 176.54 176.52 3kbs h HIS 198 N -0.23 0.41 -0.20 5.60 -0.00 -1.76 -1.48 115.15 117.50 3kbs h HIS 198 Ca 0.07 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.46 3kbs h HIS 198 Cb 0.32 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.62 3kbs h HIS 198 CO -0.23 0.16 0.10 0.00 -0.00 0.00 0.00 177.93 177.96 3kbs h ALA 199 N 1.33 0.26 -0.72 2.45 0.00 -0.99 -1.60 119.26 119.99 3kbs h ALA 199 Ca 0.25 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3kbs h ALA 199 Cb 0.23 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 3kbs h ALA 199 CO -0.22 -0.19 0.47 -0.07 0.00 0.00 0.00 179.25 179.24 3kbs h LEU 200 N 0.20 0.83 -0.57 0.00 3.38 -0.38 -2.27 115.31 116.49 3kbs h LEU 200 Ca 0.07 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 3kbs h LEU 200 Cb 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3kbs h LEU 200 CO -0.01 0.60 -0.62 0.00 0.09 0.00 0.00 178.44 178.51 3kbs h ALA 201 N 1.55 0.77 -0.36 1.53 0.00 -0.90 -2.95 119.26 118.89 3kbs h ALA 201 Ca 0.26 -0.55 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 3kbs h ALA 201 Cb -0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3kbs h ALA 201 CO -0.06 0.73 0.01 0.35 0.00 0.00 0.00 179.25 180.28 3kbs h PHE 202 N 0.25 0.67 -0.66 0.00 3.04 -1.09 -2.78 116.94 116.37 3kbs h PHE 202 Ca -0.01 -0.11 0.10 0.00 3.98 0.00 0.00 57.97 61.93 3kbs h PHE 202 Cb 1.14 -0.18 -0.04 0.00 2.56 0.00 0.00 35.95 39.43 3kbs h PHE 202 CO 0.03 0.71 0.44 0.82 -2.02 0.00 0.00 178.31 178.29 3kbs h ILE 203 N 0.44 0.91 0.00 1.41 2.04 -1.25 0.74 117.51 121.80 3kbs h ILE 203 Ca 0.10 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.79 3kbs h ILE 203 Cb 0.44 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 3kbs h ILE 203 CO 0.02 0.09 0.00 -0.62 0.00 0.00 0.00 178.15 177.64 3kbs n GLU 204 N -4.48 0.03 -0.02 2.37 -0.58 -1.05 -1.33 120.64 115.58 3kbs n GLU 204 Ca 0.11 0.29 0.12 0.00 -0.42 0.00 0.00 57.16 57.27 3kbs n GLU 204 Cb 0.36 -1.56 0.23 0.00 -0.57 0.00 0.00 31.44 29.90 3kbs n GLU 204 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3kbs n ARG 205 N -1.61 2.15 -1.99 3.49 5.12 0.25 -4.98 116.66 119.08 3kbs n ARG 205 Ca 0.03 -1.68 -0.30 0.00 -1.93 0.00 0.00 57.85 53.98 3kbs n ARG 205 Cb 0.17 -1.47 0.03 0.00 -1.16 0.00 0.00 32.46 30.03 3kbs n ARG 205 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3kbs s LEU 206 N -1.93 3.10 0.12 0.55 1.43 -0.44 -4.98 118.68 116.52 3kbs s LEU 206 Ca 0.32 1.17 -0.22 0.00 -1.03 0.00 0.00 54.13 54.36 3kbs s LEU 206 Cb 0.20 -4.07 -0.06 0.00 0.03 0.00 0.00 46.19 42.29 3kbs s LEU 206 CO 0.31 -1.09 1.69 -0.33 0.23 0.00 0.00 176.35 177.16 3kbs h GLU 207 N -0.42 -0.12 -2.83 1.70 4.39 -1.93 -3.34 114.58 112.03 3kbs h GLU 207 Ca -0.45 0.01 -0.61 0.00 0.34 0.00 0.00 59.36 58.65 3kbs h GLU 207 Cb 1.23 0.03 -0.40 0.00 -0.10 0.00 0.00 28.75 29.50 3kbs h GLU 207 CO 0.63 -0.08 -0.76 1.03 -1.16 0.00 0.00 179.01 178.67 3kbs s ARG 208 N -6.17 1.52 0.60 2.33 0.52 -1.26 -4.95 118.95 111.54 3kbs s ARG 208 Ca -0.14 -2.43 0.30 0.00 -0.52 0.00 0.00 55.73 52.94 3kbs s ARG 208 Cb 0.09 -2.38 1.62 0.00 0.52 0.00 0.00 34.95 34.80 3kbs s ARG 208 CO 0.67 -1.26 2.01 -1.35 0.02 0.00 0.00 175.30 175.39 3kbs h PRO 209 N 6.02 0.00 0.00 3.54 0.11 -1.80 -1.42 132.00 138.45 3kbs h PRO 209 Ca 0.12 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 3kbs h PRO 209 Cb 0.87 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 3kbs h PRO 209 CO 0.52 0.00 -0.01 1.05 -0.21 0.00 0.00 178.00 179.35 3kbs h GLU 210 N 0.00 0.00 0.00 1.05 9.09 -1.93 -1.70 114.58 121.09 3kbs h GLU 210 Ca 0.11 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.52 3kbs h GLU 210 Cb 0.74 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.84 3kbs h GLU 210 CO -0.00 0.01 0.00 1.28 0.05 0.00 0.00 179.01 180.35 3kbs n LEU 211 N -3.11 0.00 -4.15 3.06 4.77 -0.53 -4.86 117.00 112.18 3kbs n LEU 211 Ca 0.00 0.40 -0.24 0.00 -0.03 0.00 0.00 56.01 56.15 3kbs n LEU 211 Cb 0.29 -0.40 -0.15 0.00 -2.33 0.00 0.00 43.42 40.83 3kbs n LEU 211 CO 0.27 -0.01 -0.49 -0.31 -1.33 0.00 0.00 177.39 175.51 3kbs s TYR 212 N -2.81 1.48 0.00 -1.77 2.02 -0.64 -0.57 117.35 115.06 3kbs s TYR 212 Ca 0.20 -0.28 0.00 0.00 -0.37 0.00 0.00 57.07 56.61 3kbs s TYR 212 Cb 0.19 -0.95 0.00 0.00 -0.40 0.00 0.00 41.96 40.80 3kbs s TYR 212 CO 0.48 -0.02 0.00 0.41 -1.57 0.00 0.00 175.55 174.85 3kbs n GLY 213 N 2.62 4.90 3.41 0.71 0.00 0.01 -4.97 105.19 111.88 3kbs n GLY 213 Ca -0.15 -1.34 -0.28 0.00 0.00 0.00 0.00 46.02 44.25 3kbs n GLY 213 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kbs s VAL 214 N -1.26 2.34 -0.69 1.61 -7.23 -0.66 -0.95 120.40 113.56 3kbs s VAL 214 Ca 0.00 -1.91 0.05 0.00 -1.81 0.00 0.00 61.98 58.31 3kbs s VAL 214 Cb 0.00 -2.09 0.18 0.00 0.56 0.00 0.00 36.38 35.03 3kbs s VAL 214 CO 0.00 -0.03 0.51 -3.20 -0.31 0.00 0.00 175.10 172.07 3kbs n ASN 215 N 0.52 2.91 -4.78 4.85 5.15 -0.25 -3.09 115.26 120.58 3kbs n ASN 215 Ca -0.15 -3.19 -0.35 0.00 -0.60 0.00 0.00 54.58 50.29 3kbs n ASN 215 Cb 0.55 -0.74 -0.01 0.00 -0.53 0.00 0.00 39.78 39.05 3kbs n ASN 215 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 3kbs s PRO 216 N -1.49 3.52 -0.09 1.20 0.02 -1.26 -4.31 135.00 132.60 3kbs s PRO 216 Ca 0.27 1.61 0.02 0.00 0.02 0.00 0.00 61.00 62.92 3kbs s PRO 216 Cb -0.02 -2.12 -0.02 0.00 0.02 0.00 0.00 34.50 32.36 3kbs s PRO 216 CO -0.16 -0.71 -0.13 -2.00 -0.33 0.00 0.00 177.00 173.67 3kbs s GLU 217 N -3.13 2.93 0.15 5.54 2.12 -1.26 -0.73 118.70 124.32 3kbs s GLU 217 Ca 0.70 -0.68 -0.23 0.00 0.36 0.00 0.00 54.97 55.11 3kbs s GLU 217 Cb -0.24 -2.51 0.02 0.00 0.26 0.00 0.00 34.13 31.66 3kbs s GLU 217 CO 0.28 0.43 1.63 0.28 -0.54 0.00 0.00 175.26 177.34 3kbs h VAL 218 N 4.83 0.38 -0.28 3.70 2.07 -1.75 -2.41 116.25 122.80 3kbs h VAL 218 Ca -0.37 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.10 3kbs h VAL 218 Cb 1.18 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 3kbs h VAL 218 CO 0.53 0.00 -0.07 1.23 0.02 0.00 0.00 177.57 179.28 3kbs h GLY 219 N -0.27 0.47 0.88 2.17 0.00 -1.86 -3.04 103.07 101.43 3kbs h GLY 219 Ca 0.13 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 47.08 3kbs h GLY 219 CO -0.38 0.27 -0.15 0.45 0.00 0.00 0.00 176.54 176.74 3kbs h HIS 220 N 0.42 0.66 -0.05 5.60 3.86 -1.77 -0.81 115.15 123.07 3kbs h HIS 220 Ca 0.09 -0.17 -0.06 0.00 -1.16 0.00 0.00 60.37 59.07 3kbs h HIS 220 Cb 0.38 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 3kbs h HIS 220 CO 0.01 0.83 -0.24 0.93 0.86 0.00 0.00 177.93 180.33 3kbs h GLU 221 N 0.30 0.08 0.00 2.45 4.39 -1.50 -2.48 114.58 117.82 3kbs h GLU 221 Ca 0.06 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 3kbs h GLU 221 Cb 0.67 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.31 3kbs h GLU 221 CO 0.04 0.32 -0.08 1.96 -1.16 0.00 0.00 179.01 180.10 3kbs h GLN 222 N 0.08 0.00 0.00 2.33 4.20 -1.34 -1.90 115.11 118.48 3kbs h GLN 222 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3kbs h GLN 222 Cb 0.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.25 3kbs h GLN 222 CO 0.03 0.08 0.00 -1.33 -0.67 0.00 0.00 178.83 176.94 3kbs n MET 223 N -3.15 0.17 -0.30 1.46 2.81 -0.35 -1.60 117.12 116.17 3kbs n MET 223 Ca 0.02 0.48 0.07 0.00 -1.81 0.00 0.00 57.70 56.46 3kbs n MET 223 Cb 0.46 -1.88 0.22 0.00 -0.71 0.00 0.00 33.22 31.31 3kbs n MET 223 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3kbs n ALA 224 N -1.76 2.45 -1.52 3.04 0.00 -0.79 -4.72 120.51 117.20 3kbs n ALA 224 Ca 0.01 -1.42 -0.15 0.00 0.00 0.00 0.00 53.44 51.88 3kbs n ALA 224 Cb 0.17 -0.61 -0.06 0.00 0.00 0.00 0.00 19.45 18.95 3kbs n ALA 224 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kbs n GLY 225 N 0.53 1.39 3.91 0.00 0.00 -0.63 -5.00 105.19 105.39 3kbs n GLY 225 Ca 0.16 -0.30 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 3kbs n GLY 225 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kbs s LEU 226 N -3.55 3.38 -0.49 0.99 1.43 -0.78 -4.98 118.68 114.67 3kbs s LEU 226 Ca 0.00 0.84 -0.27 0.00 -1.03 0.00 0.00 54.13 53.67 3kbs s LEU 226 Cb 0.00 -3.73 0.03 0.00 0.03 0.00 0.00 46.19 42.52 3kbs s LEU 226 CO 0.00 -0.87 1.06 0.21 0.23 0.00 0.00 176.35 176.98 3kbs s ASN 227 N -4.22 6.54 0.01 2.29 3.84 -1.26 -4.33 114.94 117.80 3kbs s ASN 227 Ca 0.52 0.24 -0.24 0.00 0.21 0.00 0.00 52.86 53.59 3kbs s ASN 227 Cb -0.10 -2.51 -0.18 0.00 -0.55 0.00 0.00 41.25 37.91 3kbs s ASN 227 CO 0.46 -1.22 1.33 0.15 -2.79 0.00 0.00 177.10 175.03 3kbs h PHE 228 N 9.24 0.16 -0.89 0.43 3.04 -1.92 -1.18 116.94 125.81 3kbs h PHE 228 Ca -0.24 -0.04 0.19 0.00 3.98 0.00 0.00 57.97 61.86 3kbs h PHE 228 Cb 1.07 -0.03 -0.07 0.00 2.56 0.00 0.00 35.95 39.47 3kbs h PHE 228 CO 0.95 0.55 0.59 -1.35 -2.02 0.00 0.00 178.31 177.02 3kbs h PRO 229 N -0.28 0.45 -0.31 6.41 0.11 -1.93 0.19 132.00 136.64 3kbs h PRO 229 Ca 0.01 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.04 3kbs h PRO 229 Cb 0.51 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 3kbs h PRO 229 CO 0.01 0.30 -0.02 0.45 -0.21 0.00 0.00 178.00 178.53 3kbs h HIS 230 N 0.46 0.61 -0.68 0.65 3.86 -1.89 0.77 115.15 118.93 3kbs h HIS 230 Ca 0.46 -0.11 -0.05 0.00 -1.16 0.00 0.00 60.37 59.51 3kbs h HIS 230 Cb 1.07 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 29.35 3kbs h HIS 230 CO -0.00 0.70 0.23 0.78 0.86 0.00 0.00 177.93 180.50 3kbs h GLY 231 N 0.35 1.10 1.29 2.45 0.00 0.25 -2.01 103.07 106.51 3kbs h GLY 231 Ca 0.09 -0.62 -0.06 0.00 0.00 0.00 0.00 47.33 46.74 3kbs h GLY 231 CO 0.02 0.58 0.12 -2.22 0.00 0.00 0.00 176.54 175.04 3kbs h ILE 232 N 1.00 1.24 -0.42 2.60 1.08 -0.45 -1.73 117.51 120.82 3kbs h ILE 232 Ca 0.22 -0.88 -0.09 0.00 -0.39 0.00 0.00 64.86 63.72 3kbs h ILE 232 Cb 0.26 0.68 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 3kbs h ILE 232 CO -0.01 0.33 -0.10 0.00 -0.69 0.00 0.00 178.15 177.67 3kbs h ALA 233 N 1.28 1.02 -0.47 1.87 0.00 -0.44 0.29 119.26 122.81 3kbs h ALA 233 Ca 0.18 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 3kbs h ALA 233 Cb 0.34 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3kbs h ALA 233 CO 0.00 0.59 -0.11 0.37 0.00 0.00 0.00 179.25 180.10 3kbs h GLN 234 N 0.69 0.86 -0.83 0.00 4.15 -0.88 0.74 115.11 119.84 3kbs h GLN 234 Ca 0.12 -0.30 -0.03 0.00 0.77 0.00 0.00 58.65 59.21 3kbs h GLN 234 Cb 0.57 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.16 3kbs h GLN 234 CO 0.04 0.93 0.38 0.00 -1.93 0.00 0.00 178.83 178.25 3kbs h ALA 235 N 1.10 1.07 -0.12 3.38 0.00 -0.95 -1.71 119.26 122.02 3kbs h ALA 235 Ca 0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3kbs h ALA 235 Cb 0.62 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3kbs h ALA 235 CO 0.04 0.65 -0.03 -0.07 0.00 0.00 0.00 179.25 179.84 3kbs h LEU 236 N 1.18 0.24 -0.96 0.00 3.38 -0.51 -0.58 115.31 118.06 3kbs h LEU 236 Ca 0.28 -0.37 0.20 0.00 0.09 0.00 0.00 57.88 58.09 3kbs h LEU 236 Cb 0.14 -0.06 -0.11 0.00 0.09 0.00 0.00 40.66 40.72 3kbs h LEU 236 CO -0.03 0.55 0.54 -0.25 0.09 0.00 0.00 178.44 179.34 3kbs h TRP 237 N -0.08 0.94 0.00 1.13 7.01 -0.76 0.51 115.95 124.70 3kbs h TRP 237 Ca 0.03 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.07 3kbs h TRP 237 Cb 0.44 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 27.23 3kbs h TRP 237 CO 0.05 0.14 0.00 0.00 -2.79 0.00 0.00 178.44 175.84 3kbs n ALA 238 N -2.37 2.40 -1.82 2.65 0.00 -0.65 -4.90 120.51 115.81 3kbs n ALA 238 Ca 0.23 -0.13 -0.13 0.00 0.00 0.00 0.00 53.44 53.40 3kbs n ALA 238 Cb 0.61 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 3kbs n ALA 238 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kbs n GLY 239 N 1.06 0.61 0.58 0.00 0.00 0.17 -4.92 105.19 102.69 3kbs n GLY 239 Ca 0.14 -0.37 0.06 0.00 0.00 0.00 0.00 46.02 45.85 3kbs n GLY 239 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kbs n LYS 240 N -2.44 1.98 -2.72 1.61 4.76 -0.28 -4.88 118.16 116.20 3kbs n LYS 240 Ca -0.14 -1.72 -0.42 0.00 -2.87 0.00 0.00 58.31 53.15 3kbs n LYS 240 Cb 0.53 -1.25 -0.03 0.00 -1.84 0.00 0.00 35.03 32.43 3kbs n LYS 240 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3kbs s LEU 241 N -0.98 4.10 0.13 -0.35 2.96 -1.20 -1.66 118.68 121.69 3kbs s LEU 241 Ca 0.20 -1.50 0.11 0.00 -0.22 0.00 0.00 54.13 52.73 3kbs s LEU 241 Cb 0.11 -2.49 -0.12 0.00 0.50 0.00 0.00 46.19 44.19 3kbs s LEU 241 CO 0.15 -1.38 1.18 -0.26 -1.32 0.00 0.00 176.35 174.72 3kbs h PHE 242 N 9.47 0.00 -2.64 5.38 -1.00 -1.88 -3.48 116.94 122.78 3kbs h PHE 242 Ca 0.08 0.00 0.08 0.00 2.81 0.00 0.00 57.97 60.94 3kbs h PHE 242 Cb 1.03 0.00 -0.10 0.00 3.61 0.00 0.00 35.95 40.48 3kbs h PHE 242 CO 1.19 0.80 0.36 -1.58 -1.61 0.00 0.00 178.31 177.47 3kbs s HIS 243 N -2.79 -0.31 -0.06 -0.55 2.46 -1.21 -4.84 115.29 107.99 3kbs s HIS 243 Ca 0.01 0.05 -0.10 0.00 0.47 0.00 0.00 55.06 55.48 3kbs s HIS 243 Cb 0.09 0.61 0.02 0.00 -0.13 0.00 0.00 32.58 33.16 3kbs s HIS 243 CO 0.80 -0.84 0.25 -1.50 -2.47 0.00 0.00 174.74 170.97 3kbs s ILE 244 N -3.50 0.03 -0.22 0.89 2.07 -1.26 -4.06 121.20 115.15 3kbs s ILE 244 Ca 0.07 -0.24 -0.05 0.00 -1.41 0.00 0.00 60.65 59.02 3kbs s ILE 244 Cb -0.02 -0.43 -0.02 0.00 0.13 0.00 0.00 42.46 42.12 3kbs s ILE 244 CO -0.04 -0.13 -0.02 -1.81 -1.91 0.00 0.00 174.94 171.03 3kbs s ASP 245 N -0.49 4.58 -0.12 4.50 -0.00 0.09 -3.50 116.67 121.74 3kbs s ASP 245 Ca -0.06 -0.30 -0.02 0.00 -0.00 0.00 0.00 52.55 52.16 3kbs s ASP 245 Cb -0.04 -1.79 -0.03 0.00 -0.00 0.00 0.00 42.92 41.06 3kbs s ASP 245 CO 0.01 0.01 -0.02 -0.76 -0.00 0.00 0.00 175.17 174.41 3kbs s LEU 246 N 1.31 3.40 0.00 1.23 1.43 0.50 -2.22 118.68 124.34 3kbs s LEU 246 Ca 0.04 0.01 -0.02 0.00 -1.03 0.00 0.00 54.13 53.13 3kbs s LEU 246 Cb -0.14 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.29 3kbs s LEU 246 CO -0.00 0.28 0.10 -0.46 0.23 0.00 0.00 176.35 176.49 3kbs n ASN 247 N 2.79 -0.14 -4.25 2.29 0.23 -1.26 -2.13 115.26 112.79 3kbs n ASN 247 Ca -0.18 -1.07 -0.25 0.00 -0.53 0.00 0.00 54.58 52.56 3kbs n ASN 247 Cb 0.53 0.23 -0.14 0.00 -2.08 0.00 0.00 39.78 38.33 3kbs n ASN 247 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 3kbs s GLY 248 N -2.17 1.10 -0.11 4.83 0.00 0.32 -4.47 107.32 106.82 3kbs s GLY 248 Ca 0.02 -1.06 -0.07 0.00 0.00 0.00 0.00 44.72 43.61 3kbs s GLY 248 CO 0.00 -1.01 0.26 1.62 0.00 0.00 0.00 173.10 173.98 3kbs s GLN 249 N -1.28 0.25 -1.05 2.90 2.00 -1.26 -1.26 119.66 119.97 3kbs s GLN 249 Ca 0.07 0.50 -0.11 0.00 -2.00 0.00 0.00 55.36 53.81 3kbs s GLN 249 Cb -0.09 -0.03 0.25 0.00 0.80 0.00 0.00 33.01 33.94 3kbs s GLN 249 CO 0.02 -0.12 1.06 -0.80 -0.50 0.00 0.00 175.29 174.95 3kbs s ASN 250 N 0.91 7.13 0.58 6.67 0.01 -1.26 -3.56 114.94 125.42 3kbs s ASN 250 Ca -0.06 -3.25 0.00 0.00 -0.71 0.00 0.00 52.86 48.84 3kbs s ASN 250 Cb -0.07 -2.24 0.00 0.00 0.41 0.00 0.00 41.25 39.35 3kbs s ASN 250 CO -0.06 -0.44 0.00 0.61 -1.51 0.00 0.00 177.10 175.70 3kbs n GLY 251 N 3.28 0.28 3.50 0.66 0.00 -1.26 -4.65 105.19 106.99 3kbs n GLY 251 Ca 0.23 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 3kbs n GLY 251 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kbs s ILE 252 N 0.00 4.64 0.00 -0.61 1.01 -1.26 -4.34 121.20 120.64 3kbs s ILE 252 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.68 3kbs s ILE 252 Cb 0.00 -4.39 0.00 0.00 0.01 0.00 0.00 42.46 38.08 3kbs s ILE 252 CO 0.00 -0.89 0.00 2.29 0.00 0.00 0.00 174.94 176.34 3kbs n LYS 253 N 6.79 0.00 -1.16 2.79 2.85 -1.26 -5.09 118.16 123.07 3kbs n LYS 253 Ca -0.01 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.89 3kbs n LYS 253 Cb 0.47 0.00 0.07 0.00 -0.65 0.00 0.00 35.03 34.92 3kbs n LYS 253 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 3kbs n TYR 254 N 0.00 -1.31 -1.98 5.58 0.18 -1.26 -4.84 117.16 113.53 3kbs n TYR 254 Ca 0.00 0.31 -0.40 0.00 1.88 0.00 0.00 57.90 59.69 3kbs n TYR 254 Cb 0.00 -1.85 -0.03 0.00 -0.38 0.00 0.00 39.34 37.08 3kbs n TYR 254 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 3kbs s ASP 255 N -1.51 5.42 0.11 9.48 3.68 -1.26 -4.88 116.67 127.70 3kbs s ASP 255 Ca 0.62 0.75 -0.01 0.00 2.13 0.00 0.00 52.55 56.04 3kbs s ASP 255 Cb -0.32 -2.53 -0.20 0.00 -1.45 0.00 0.00 42.92 38.42 3kbs s ASP 255 CO 0.62 -2.18 1.23 1.56 0.13 0.00 0.00 175.17 176.52 3kbs h GLN 256 N 14.63 0.22 -6.65 4.34 4.20 -1.88 -3.48 115.11 126.49 3kbs h GLN 256 Ca -0.28 -0.33 -0.53 0.00 0.06 0.00 0.00 58.65 57.56 3kbs h GLN 256 Cb 1.17 0.12 -0.10 0.00 0.30 0.00 0.00 27.48 28.97 3kbs h GLN 256 CO 1.15 1.12 -0.90 -0.25 -0.67 0.00 0.00 178.83 179.28 3kbs n ASP 257 N -3.54 -0.35 -4.76 1.46 10.43 -1.24 -4.67 116.55 113.88 3kbs n ASP 257 Ca -0.06 -1.06 -0.30 0.00 2.57 0.00 0.00 54.79 55.94 3kbs n ASP 257 Cb 0.95 -2.72 0.11 0.00 1.84 0.00 0.00 41.12 41.30 3kbs n ASP 257 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3kbs s LEU 258 N -7.08 2.55 0.59 0.64 1.43 -0.39 0.24 118.68 116.66 3kbs s LEU 258 Ca 0.08 1.50 -0.20 0.00 -1.03 0.00 0.00 54.13 54.48 3kbs s LEU 258 Cb -0.04 -4.05 -0.03 0.00 0.03 0.00 0.00 46.19 42.09 3kbs s LEU 258 CO 0.92 -2.25 1.33 0.00 0.23 0.00 0.00 176.35 176.58 3kbs s ARG 259 N -5.00 2.86 0.25 1.70 1.70 -1.26 -0.53 118.95 118.67 3kbs s ARG 259 Ca 0.62 2.16 -0.30 0.00 -0.47 0.00 0.00 55.73 57.74 3kbs s ARG 259 Cb -0.16 -2.06 -0.10 0.00 -0.57 0.00 0.00 34.95 32.05 3kbs s ARG 259 CO 0.56 -1.39 1.48 0.12 -1.08 0.00 0.00 175.30 174.99 3kbs s PHE 260 N -1.34 2.97 0.00 5.89 5.36 -1.26 -1.75 117.98 127.84 3kbs s PHE 260 Ca 0.77 0.96 0.00 0.00 -0.96 0.00 0.00 56.93 57.70 3kbs s PHE 260 Cb -0.39 -3.87 0.00 0.00 -0.34 0.00 0.00 43.02 38.42 3kbs s PHE 260 CO 0.44 -2.88 0.00 0.41 -1.46 0.00 0.00 175.22 171.73 3kbs n GLY 261 N 2.27 2.13 3.78 13.12 0.00 -1.26 -4.35 105.19 120.87 3kbs n GLY 261 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 3kbs n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbs s ALA 262 N -2.21 2.17 0.00 4.61 0.00 -0.72 -4.29 121.76 121.32 3kbs s ALA 262 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.97 3kbs s ALA 262 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.93 3kbs s ALA 262 CO 0.00 -1.78 0.00 0.41 0.00 0.00 0.00 175.76 174.39 3kbs n GLY 263 N -1.61 1.28 3.49 0.00 0.00 -1.26 -3.99 105.19 103.10 3kbs n GLY 263 Ca 0.08 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 3kbs n GLY 263 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kbs s ASP 264 N -4.00 6.53 0.25 1.61 -1.08 -1.23 -4.89 116.67 113.85 3kbs s ASP 264 Ca 0.00 -1.69 -0.05 0.00 -0.52 0.00 0.00 52.55 50.29 3kbs s ASP 264 Cb 0.00 -2.46 0.30 0.00 -1.46 0.00 0.00 42.92 39.29 3kbs s ASP 264 CO 0.00 -1.28 1.90 0.25 0.52 0.00 0.00 175.17 176.56 3kbs h LEU 265 N 11.40 1.04 -0.73 -1.34 5.85 -1.82 -1.89 115.31 127.81 3kbs h LEU 265 Ca 0.12 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.69 3kbs h LEU 265 Cb 1.02 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 3kbs h LEU 265 CO 1.23 0.72 -0.56 0.03 -0.34 0.00 0.00 178.44 179.51 3kbs h ARG 266 N 1.21 0.22 -0.81 1.25 2.47 -1.94 -1.57 114.38 115.20 3kbs h ARG 266 Ca 0.38 -0.14 0.00 0.00 -1.26 0.00 0.00 59.98 58.96 3kbs h ARG 266 Cb -0.01 0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 28.29 3kbs h ARG 266 CO -0.12 0.72 0.51 0.00 0.56 0.00 0.00 179.97 181.64 3kbs h ALA 267 N 1.25 1.37 -0.05 0.04 0.00 -1.91 -1.29 119.26 118.68 3kbs h ALA 267 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3kbs h ALA 267 Cb 1.04 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 3kbs h ALA 267 CO 0.09 0.56 0.04 0.00 0.00 0.00 0.00 179.25 179.93 3kbs h ALA 268 N 1.45 0.07 -0.20 0.00 0.00 -0.50 -0.72 119.26 119.36 3kbs h ALA 268 Ca 0.29 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.23 3kbs h ALA 268 Cb -0.08 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3kbs h ALA 268 CO -0.06 -0.44 0.03 0.35 0.00 0.00 0.00 179.25 179.14 3kbs h PHE 269 N 0.07 0.06 0.00 0.00 3.04 -0.86 -1.37 116.94 117.88 3kbs h PHE 269 Ca 0.02 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.93 3kbs h PHE 269 Cb -0.01 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.50 3kbs h PHE 269 CO -0.08 0.02 -0.26 -1.49 -2.02 0.00 0.00 178.31 174.48 3kbs h TRP 270 N 0.11 0.00 -0.17 0.41 4.06 -0.98 -0.65 115.95 118.74 3kbs h TRP 270 Ca 0.09 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.98 3kbs h TRP 270 Cb 0.09 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.24 3kbs h TRP 270 CO -0.14 0.26 -0.14 1.25 -3.56 0.00 0.00 178.44 176.11 3kbs h LEU 271 N 0.00 0.41 -0.58 -4.49 5.85 -0.52 -1.39 115.31 114.58 3kbs h LEU 271 Ca -0.00 -0.46 -0.05 0.00 0.84 0.00 0.00 57.88 58.21 3kbs h LEU 271 Cb 0.56 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 3kbs h LEU 271 CO 0.03 0.78 0.16 0.58 -0.34 0.00 0.00 178.44 179.65 3kbs h VAL 272 N 0.05 1.25 -0.47 1.05 2.07 -0.83 0.26 116.25 119.63 3kbs h VAL 272 Ca 0.03 -0.87 0.10 0.00 0.82 0.00 0.00 66.70 66.77 3kbs h VAL 272 Cb 0.65 0.70 -0.10 0.00 -1.52 0.00 0.00 31.29 31.03 3kbs h VAL 272 CO 0.04 0.33 -0.23 -0.78 0.02 0.00 0.00 177.57 176.95 3kbs h ASP 273 N 0.84 -0.78 -0.38 0.57 -0.00 -1.10 -0.07 116.42 115.50 3kbs h ASP 273 Ca 0.19 0.18 -0.10 0.00 -0.00 0.00 0.00 57.03 57.29 3kbs h ASP 273 Cb 0.33 0.42 -0.01 0.00 -0.00 0.00 0.00 39.33 40.06 3kbs h ASP 273 CO -0.00 -0.25 -0.17 0.25 -0.00 0.00 0.00 179.24 179.07 3kbs h LEU 274 N -0.12 0.80 -0.59 2.28 5.85 -0.06 0.33 115.31 123.80 3kbs h LEU 274 Ca 0.22 -0.40 -0.12 0.00 0.84 0.00 0.00 57.88 58.43 3kbs h LEU 274 Cb 0.47 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 3kbs h LEU 274 CO -0.55 1.02 -0.14 -0.07 -0.34 0.00 0.00 178.44 178.36 3kbs h LEU 275 N 0.58 0.98 -0.67 2.25 3.38 0.04 -0.99 115.31 120.89 3kbs h LEU 275 Ca 0.09 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 57.62 3kbs h LEU 275 Cb 0.71 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3kbs h LEU 275 CO 0.05 1.11 -0.05 -0.33 0.09 0.00 0.00 178.44 179.31 3kbs h GLU 276 N 0.86 0.98 0.00 1.13 4.39 -1.01 -1.08 114.58 119.85 3kbs h GLU 276 Ca 0.13 -0.32 -0.13 0.00 0.34 0.00 0.00 59.36 59.37 3kbs h GLU 276 Cb 0.70 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 3kbs h GLU 276 CO 0.05 0.99 -0.70 0.66 -1.16 0.00 0.00 179.01 178.85 3kbs h SER 277 N 0.89 0.00 1.75 1.42 4.64 -0.35 -3.18 113.55 118.72 3kbs h SER 277 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3kbs h SER 277 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3kbs h SER 277 CO 0.04 0.61 0.00 0.00 -0.87 0.00 0.00 176.83 176.60 3kbs h ALA 278 N 1.39 1.00 -0.15 5.18 0.00 -1.17 -3.47 119.26 122.04 3kbs h ALA 278 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3kbs h ALA 278 Cb 1.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3kbs h ALA 278 CO 0.08 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.74 3kbs n GLY 279 N 0.87 0.80 3.68 0.00 0.00 -0.97 -5.00 105.19 104.56 3kbs n GLY 279 Ca 0.03 -0.65 -0.46 0.00 0.00 0.00 0.00 46.02 44.95 3kbs n GLY 279 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3kbs n TYR 280 N -3.02 2.39 -0.07 1.61 9.36 -0.45 -4.87 117.16 122.10 3kbs n TYR 280 Ca 0.00 0.09 0.00 0.00 3.32 0.00 0.00 57.90 61.31 3kbs n TYR 280 Cb 0.38 -2.62 0.00 0.00 -0.63 0.00 0.00 39.34 36.47 3kbs n TYR 280 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 3kbs n SER 281 N 4.82 1.63 -3.79 2.98 3.41 -1.26 -4.88 113.62 116.53 3kbs n SER 281 Ca 0.19 -1.70 -0.30 0.00 -0.26 0.00 0.00 58.87 56.80 3kbs n SER 281 Cb 0.31 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.50 3kbs n SER 281 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3kbs s GLY 282 N -0.70 1.63 0.48 5.00 0.00 -1.26 -5.01 107.32 107.47 3kbs s GLY 282 Ca 0.00 -1.06 -0.23 0.00 0.00 0.00 0.00 44.72 43.43 3kbs s GLY 282 CO 0.00 -0.17 1.25 -4.14 0.00 0.00 0.00 173.10 170.04 3kbs s PRO 283 N -5.55 3.56 -0.79 2.90 0.02 -1.26 -4.97 135.00 128.90 3kbs s PRO 283 Ca 0.72 1.99 -0.17 0.00 0.02 0.00 0.00 61.00 63.56 3kbs s PRO 283 Cb -0.07 -2.40 0.15 0.00 0.02 0.00 0.00 34.50 32.20 3kbs s PRO 283 CO 0.55 -0.78 0.88 1.03 -0.33 0.00 0.00 177.00 178.35 3kbs s ARG 284 N -2.71 3.43 -0.23 5.54 3.00 -0.03 -4.33 118.95 123.62 3kbs s ARG 284 Ca 0.66 -1.86 -0.10 0.00 0.00 0.00 0.00 55.73 54.43 3kbs s ARG 284 Cb -0.34 -4.55 -0.05 0.00 0.00 0.00 0.00 34.95 30.01 3kbs s ARG 284 CO 0.41 -1.54 0.13 -1.58 0.00 0.00 0.00 175.30 172.72 3kbs s HIS 285 N 1.84 3.30 -0.25 -0.53 2.46 -1.23 -0.49 115.29 120.39 3kbs s HIS 285 Ca 0.21 0.16 -0.17 0.00 0.47 0.00 0.00 55.06 55.74 3kbs s HIS 285 Cb -0.12 -2.22 -0.03 0.00 -0.13 0.00 0.00 32.58 30.07 3kbs s HIS 285 CO -0.05 0.07 0.48 -0.06 -2.47 0.00 0.00 174.74 172.72 3kbs s PHE 286 N 0.91 3.29 -0.72 3.88 0.08 -0.66 0.19 117.98 124.95 3kbs s PHE 286 Ca 0.07 0.61 -0.05 0.00 0.12 0.00 0.00 56.93 57.68 3kbs s PHE 286 Cb -0.13 -2.66 0.18 0.00 -0.57 0.00 0.00 43.02 39.84 3kbs s PHE 286 CO 0.03 -0.21 0.57 0.34 -0.10 0.00 0.00 175.22 175.85 3kbs s ASP 287 N 1.44 5.70 0.17 1.36 -1.08 -0.90 -3.68 116.67 119.67 3kbs s ASP 287 Ca 0.20 -2.98 0.01 0.00 -0.52 0.00 0.00 52.55 49.27 3kbs s ASP 287 Cb -0.16 -1.94 -0.04 0.00 -1.46 0.00 0.00 42.92 39.32 3kbs s ASP 287 CO 0.09 -0.38 0.02 0.72 0.52 0.00 0.00 175.17 176.15 3kbs s PHE 288 N -0.25 1.13 -0.22 -5.34 -0.71 -1.26 -4.64 117.98 106.69 3kbs s PHE 288 Ca 0.19 -1.09 0.02 0.00 -1.04 0.00 0.00 56.93 55.00 3kbs s PHE 288 Cb -0.16 -0.64 0.05 0.00 -1.21 0.00 0.00 43.02 41.05 3kbs s PHE 288 CO -0.06 -0.31 -0.12 0.15 -1.34 0.00 0.00 175.22 173.54 3kbs s LYS 289 N -3.96 2.24 0.17 1.99 1.02 0.14 -4.44 119.74 116.90 3kbs s LYS 289 Ca 0.25 -1.04 -0.32 0.00 0.02 0.00 0.00 55.97 54.88 3kbs s LYS 289 Cb 0.07 -2.64 -0.11 0.00 -0.52 0.00 0.00 37.83 34.63 3kbs s LYS 289 CO 0.04 -0.46 1.72 -2.14 -0.92 0.00 0.00 175.35 173.59 3kbs s PRO 290 N 1.27 4.15 0.63 -1.68 0.02 -1.26 -4.67 135.00 133.46 3kbs s PRO 290 Ca -0.03 2.54 -0.17 0.00 0.02 0.00 0.00 61.00 63.35 3kbs s PRO 290 Cb -0.17 -3.26 -0.06 0.00 0.02 0.00 0.00 34.50 31.02 3kbs s PRO 290 CO -0.08 -0.75 0.62 -2.30 -0.33 0.00 0.00 177.00 174.17 3kbs n PRO 291 N 4.55 0.51 0.00 5.54 -0.02 -1.26 -4.82 135.00 139.49 3kbs n PRO 291 Ca 0.16 0.21 0.12 0.00 -2.02 0.00 0.00 63.50 61.96 3kbs n PRO 291 Cb 0.37 -1.85 0.57 0.00 -0.02 0.00 0.00 33.50 32.57 3kbs n PRO 291 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 3kbs n ARG 292 N -0.52 0.22 0.23 -0.52 1.85 -1.26 -1.58 116.66 115.08 3kbs n ARG 292 Ca 0.12 0.07 0.16 0.00 -1.00 0.00 0.00 57.85 57.20 3kbs n ARG 292 Cb 0.48 -1.50 0.74 0.00 -1.05 0.00 0.00 32.46 31.13 3kbs n ARG 292 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 3kbs h THR 293 N 0.00 0.00 -2.79 8.89 1.35 -1.97 -3.45 112.91 114.94 3kbs h THR 293 Ca 0.00 -0.22 -0.54 0.00 -0.55 0.00 0.00 66.41 65.10 3kbs h THR 293 Cb 0.29 1.05 -0.02 0.00 -1.73 0.00 0.00 68.15 67.74 3kbs h THR 293 CO 0.00 0.00 -0.37 -1.61 -0.25 0.00 0.00 175.52 173.29 3kbs s GLU 294 N -3.66 3.50 0.19 4.72 0.41 -0.62 -5.10 118.70 118.14 3kbs s GLU 294 Ca -0.00 -0.40 0.01 0.00 -0.41 0.00 0.00 54.97 54.17 3kbs s GLU 294 Cb 0.09 -2.88 0.04 0.00 -1.78 0.00 0.00 34.13 29.60 3kbs s GLU 294 CO 0.41 0.44 0.26 -0.40 -0.49 0.00 0.00 175.26 175.48 3kbs n ASP 295 N -0.56 0.46 0.16 -0.19 3.85 -1.26 -4.87 116.55 114.14 3kbs n ASP 295 Ca -0.05 -1.36 0.04 0.00 -0.71 0.00 0.00 54.79 52.70 3kbs n ASP 295 Cb 0.54 -0.16 0.44 0.00 -1.35 0.00 0.00 41.12 40.59 3kbs n ASP 295 CO 0.00 0.00 0.00 -0.26 -1.01 0.00 0.00 177.20 175.93 3kbs h PHE 296 N -0.27 0.16 -0.64 2.11 -1.00 -1.99 -1.31 116.94 113.99 3kbs h PHE 296 Ca -0.09 -0.01 -0.08 0.00 2.81 0.00 0.00 57.97 60.60 3kbs h PHE 296 Cb 0.35 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.84 3kbs h PHE 296 CO 0.00 0.29 0.09 -0.44 -1.61 0.00 0.00 178.31 176.63 3kbs h ASP 297 N 0.15 1.04 0.47 2.17 3.32 -2.00 -2.17 116.42 119.40 3kbs h ASP 297 Ca 0.03 -0.27 -0.08 0.00 0.02 0.00 0.00 57.03 56.73 3kbs h ASP 297 Cb 0.32 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3kbs h ASP 297 CO 0.02 1.05 -0.38 1.23 -1.72 0.00 0.00 179.24 179.44 3kbs h GLY 298 N 0.99 0.00 0.93 2.75 0.00 -1.67 -1.98 103.07 104.10 3kbs h GLY 298 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3kbs h GLY 298 CO 0.02 0.00 -0.06 -2.08 0.00 0.00 0.00 176.54 174.42 3kbs h VAL 299 N 0.00 0.87 -0.04 4.60 2.07 -0.64 0.18 116.25 123.29 3kbs h VAL 299 Ca -0.00 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.40 3kbs h VAL 299 Cb 0.72 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 3kbs h VAL 299 CO 0.05 0.00 -0.52 -0.50 0.02 0.00 0.00 177.57 176.62 3kbs h TRP 300 N -0.13 0.15 -0.14 1.57 -0.00 -1.42 -0.37 115.95 115.62 3kbs h TRP 300 Ca 0.00 -0.05 -0.00 0.00 -0.00 0.00 0.00 58.89 58.84 3kbs h TRP 300 Cb 0.12 -0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 29.25 3kbs h TRP 300 CO -0.10 0.62 0.07 0.00 -0.00 0.00 0.00 178.44 179.03 3kbs h ALA 301 N 1.37 0.18 -0.57 1.49 0.00 -1.18 -0.79 119.26 119.77 3kbs h ALA 301 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3kbs h ALA 301 Cb 0.96 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 3kbs h ALA 301 CO 0.07 -0.26 0.23 1.03 0.00 0.00 0.00 179.25 180.32 3kbs h SER 302 N 0.10 0.79 -0.34 0.00 0.87 -0.28 -1.95 113.55 112.73 3kbs h SER 302 Ca 0.05 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.43 3kbs h SER 302 Cb 0.12 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.86 3kbs h SER 302 CO -0.01 0.74 0.16 0.00 -0.53 0.00 0.00 176.83 177.19 3kbs h ALA 303 N 1.08 0.44 -0.87 6.23 0.00 -0.98 -2.70 119.26 122.47 3kbs h ALA 303 Ca 0.19 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.10 3kbs h ALA 303 Cb 0.20 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 3kbs h ALA 303 CO -0.02 0.00 0.56 0.00 0.00 0.00 0.00 179.25 179.80 3kbs h ALA 304 N 1.01 1.70 -0.67 0.00 0.00 -1.05 -2.58 119.26 117.68 3kbs h ALA 304 Ca 0.12 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3kbs h ALA 304 Cb 0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3kbs h ALA 304 CO -0.01 0.12 0.26 0.78 0.00 0.00 0.00 179.25 180.40 3kbs h GLY 305 N 0.82 1.05 -0.04 0.00 0.00 -1.04 -0.26 103.07 103.60 3kbs h GLY 305 Ca 0.41 -0.55 0.09 0.00 0.00 0.00 0.00 47.33 47.27 3kbs h GLY 305 CO -0.17 0.52 -0.22 0.00 0.00 0.00 0.00 176.54 176.67 3kbs h MET 307 N -0.15 0.83 -0.20 0.00 2.86 -1.44 -2.71 114.93 114.12 3kbs h MET 307 Ca 0.20 -0.54 -0.00 0.00 -2.06 0.00 0.00 59.70 57.29 3kbs h MET 307 Cb 0.46 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 3kbs h MET 307 CO -0.50 1.17 0.12 -0.09 1.06 0.00 0.00 176.91 178.67 3kbs h ARG 308 N 0.60 0.27 -0.83 1.72 2.43 -0.69 -1.67 114.38 116.20 3kbs h ARG 308 Ca 0.01 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3kbs h ARG 308 Cb 1.15 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.61 3kbs h ARG 308 CO 0.12 0.23 0.38 -0.91 -1.51 0.00 0.00 179.97 178.28 3kbs h ASN 309 N 0.24 1.11 -0.21 -3.80 2.35 -0.78 -0.40 115.58 114.09 3kbs h ASN 309 Ca 0.07 -0.14 0.05 0.00 -0.55 0.00 0.00 56.30 55.73 3kbs h ASN 309 Cb 0.03 -0.28 -0.05 0.00 0.05 0.00 0.00 38.32 38.06 3kbs h ASN 309 CO -0.01 0.94 -0.14 0.22 -1.65 0.00 0.00 177.43 176.79 3kbs h TYR 310 N 1.19 -0.35 -0.77 1.19 3.20 -1.29 0.06 116.97 120.20 3kbs h TYR 310 Ca 0.28 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.14 3kbs h TYR 310 Cb 0.15 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 3kbs h TYR 310 CO 0.02 -0.21 0.34 -0.07 -1.64 0.00 0.00 178.16 176.59 3kbs h LEU 311 N -0.14 1.03 -0.29 2.82 3.38 -0.33 0.18 115.31 121.96 3kbs h LEU 311 Ca 0.12 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3kbs h LEU 311 Cb 0.32 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3kbs h LEU 311 CO -0.29 0.90 0.12 0.40 0.09 0.00 0.00 178.44 179.66 3kbs h ILE 312 N 1.10 1.17 -0.86 1.22 2.04 -0.83 -1.04 117.51 120.31 3kbs h ILE 312 Ca 0.26 -0.51 0.06 0.00 1.00 0.00 0.00 64.86 65.67 3kbs h ILE 312 Cb 0.17 0.96 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 3kbs h ILE 312 CO -0.03 0.18 0.53 -0.07 0.00 0.00 0.00 178.15 178.76 3kbs h LEU 313 N 0.33 0.84 -0.64 1.44 4.07 -0.62 -0.54 115.31 120.18 3kbs h LEU 313 Ca 0.10 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 58.04 3kbs h LEU 313 Cb 0.16 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 3kbs h LEU 313 CO -0.01 0.54 0.27 0.50 -1.08 0.00 0.00 178.44 178.66 3kbs h LYS 314 N 0.97 0.95 -0.42 1.13 3.64 -0.04 -0.28 116.57 122.51 3kbs h LYS 314 Ca 0.37 -0.16 -0.08 0.00 -1.27 0.00 0.00 60.65 59.51 3kbs h LYS 314 Cb 0.17 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3kbs h LYS 314 CO -0.17 0.79 -0.05 1.49 -2.27 0.00 0.00 179.45 179.24 3kbs h GLU 315 N 0.89 0.77 -0.17 1.90 4.81 -0.59 -2.26 114.58 119.93 3kbs h GLU 315 Ca 0.21 -0.27 -0.09 0.00 -0.13 0.00 0.00 59.36 59.09 3kbs h GLU 315 Cb 0.18 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 3kbs h GLU 315 CO -0.02 0.87 -0.28 0.00 -0.73 0.00 0.00 179.01 178.84 3kbs h ARG 316 N 0.59 0.32 0.01 1.92 2.47 -0.55 -2.07 114.38 117.07 3kbs h ARG 316 Ca 0.11 -0.12 -0.20 0.00 -1.26 0.00 0.00 59.98 58.52 3kbs h ARG 316 Cb 0.55 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.84 3kbs h ARG 316 CO 0.03 0.58 -0.89 0.00 0.56 0.00 0.00 179.97 180.25 3kbs h ALA 317 N 1.43 0.51 -0.60 0.04 0.00 -0.99 -1.74 119.26 117.91 3kbs h ALA 317 Ca 0.04 -0.74 -0.10 0.00 0.00 0.00 0.00 54.91 54.11 3kbs h ALA 317 Cb 0.65 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3kbs h ALA 317 CO 0.05 0.95 -0.02 0.00 0.00 0.00 0.00 179.25 180.22 3kbs h ALA 318 N 0.99 0.84 -0.59 0.00 0.00 -1.21 -2.26 119.26 117.02 3kbs h ALA 318 Ca -0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 3kbs h ALA 318 Cb 1.53 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 3kbs h ALA 318 CO 0.13 0.67 0.25 0.00 0.00 0.00 0.00 179.25 180.30 3kbs h ALA 319 N 1.00 0.76 0.33 0.00 0.00 -1.24 -1.53 119.26 118.57 3kbs h ALA 319 Ca 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3kbs h ALA 319 Cb 0.58 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3kbs h ALA 319 CO 0.03 0.36 -0.22 0.35 0.00 0.00 0.00 179.25 179.77 3kbs h PHE 320 N 0.81 -0.58 -0.40 0.00 3.57 -1.09 -2.33 116.94 116.92 3kbs h PHE 320 Ca 0.20 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 3kbs h PHE 320 Cb 0.18 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 3kbs h PHE 320 CO 0.01 -0.34 0.19 0.00 -2.23 0.00 0.00 178.31 175.93 3kbs h ARG 321 N -0.54 0.56 0.00 1.11 2.47 -1.33 -2.63 114.38 114.02 3kbs h ARG 321 Ca -0.03 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.63 3kbs h ARG 321 Cb 0.46 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.67 3kbs h ARG 321 CO 0.02 0.44 -0.21 0.00 0.56 0.00 0.00 179.97 180.78 3kbs n ALA 322 N -2.47 2.57 -2.36 0.04 0.00 -0.58 -4.69 120.51 113.01 3kbs n ALA 322 Ca 0.03 -0.12 -0.43 0.00 0.00 0.00 0.00 53.44 52.92 3kbs n ALA 322 Cb 0.12 -1.36 -0.02 0.00 0.00 0.00 0.00 19.45 18.19 3kbs n ALA 322 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3kbs s ASP 323 N -4.05 6.93 0.36 0.00 -1.08 -0.89 -4.92 116.67 113.03 3kbs s ASP 323 Ca 0.10 1.86 0.03 0.00 -0.52 0.00 0.00 52.55 54.03 3kbs s ASP 323 Cb 0.14 -2.55 0.68 0.00 -1.46 0.00 0.00 42.92 39.73 3kbs s ASP 323 CO 0.63 -0.71 2.00 -0.65 0.52 0.00 0.00 175.17 176.95 3kbs h PRO 324 N 8.02 0.72 -0.42 4.34 0.11 -1.89 0.10 132.00 142.99 3kbs h PRO 324 Ca -0.32 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.67 3kbs h PRO 324 Cb 1.14 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 3kbs h PRO 324 CO 0.93 0.51 0.04 1.49 -0.21 0.00 0.00 178.00 180.76 3kbs h GLU 325 N 0.74 0.66 -0.08 1.05 4.81 -1.95 -0.74 114.58 119.07 3kbs h GLU 325 Ca 0.19 -0.14 -0.18 0.00 -0.13 0.00 0.00 59.36 59.10 3kbs h GLU 325 Cb -0.02 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.28 3kbs h GLU 325 CO -0.04 0.65 -0.64 0.28 -0.73 0.00 0.00 179.01 178.53 3kbs h VAL 326 N 0.63 1.35 -0.86 0.32 2.07 -1.16 -2.64 116.25 115.96 3kbs h VAL 326 Ca 0.13 -1.95 0.07 0.00 0.82 0.00 0.00 66.70 65.77 3kbs h VAL 326 Cb 0.34 2.25 -0.06 0.00 -1.52 0.00 0.00 31.29 32.30 3kbs h VAL 326 CO 0.01 0.59 0.56 1.56 0.02 0.00 0.00 177.57 180.31 3kbs h GLN 327 N 0.19 0.92 -0.49 1.57 4.20 -0.72 0.63 115.11 121.40 3kbs h GLN 327 Ca -0.06 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.52 3kbs h GLN 327 Cb 1.29 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.85 3kbs h GLN 327 CO 0.13 0.61 0.01 1.49 -0.67 0.00 0.00 178.83 180.40 3kbs h GLU 328 N 0.94 0.86 -0.64 1.46 4.81 -1.10 -2.28 114.58 118.64 3kbs h GLU 328 Ca 0.37 -0.27 -0.05 0.00 -0.13 0.00 0.00 59.36 59.28 3kbs h GLU 328 Cb 0.24 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 3kbs h GLU 328 CO -0.14 0.89 0.18 0.00 -0.73 0.00 0.00 179.01 179.22 3kbs h ALA 329 N 0.94 1.11 -0.77 2.92 0.00 -0.95 0.13 119.26 122.65 3kbs h ALA 329 Ca 0.14 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.85 3kbs h ALA 329 Cb 0.50 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 3kbs h ALA 329 CO 0.02 0.60 0.51 -0.07 0.00 0.00 0.00 179.25 180.31 3kbs h LEU 330 N 0.95 0.86 -0.61 0.00 3.38 -0.69 0.46 115.31 119.67 3kbs h LEU 330 Ca 0.21 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 3kbs h LEU 330 Cb 0.30 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3kbs h LEU 330 CO -0.01 0.61 -0.27 0.03 0.09 0.00 0.00 178.44 178.90 3kbs h ARG 331 N 1.01 0.81 -0.22 1.13 3.08 -0.64 -1.51 114.38 118.03 3kbs h ARG 331 Ca 0.29 -0.36 0.02 0.00 0.07 0.00 0.00 59.98 60.01 3kbs h ARG 331 Cb -0.07 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 3kbs h ARG 331 CO -0.07 0.98 0.15 0.00 -1.07 0.00 0.00 179.97 179.96 3kbs h ALA 332 N 1.00 1.94 -0.02 0.04 0.00 0.92 -0.91 119.26 122.23 3kbs h ALA 332 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3kbs h ALA 332 Cb 0.80 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3kbs h ALA 332 CO 0.07 0.03 -0.10 0.43 0.00 0.00 0.00 179.25 179.68 3kbs n SER 333 N -4.50 1.97 -1.02 0.00 7.64 -0.02 -4.76 113.62 112.94 3kbs n SER 333 Ca 0.01 -1.57 -0.09 0.00 1.01 0.00 0.00 58.87 58.23 3kbs n SER 333 Cb 0.14 0.08 -0.01 0.00 -1.01 0.00 0.00 64.21 63.41 3kbs n SER 333 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3kbs n ARG 334 N 0.40 -0.74 0.04 1.43 3.00 -0.35 -4.89 116.66 115.56 3kbs n ARG 334 Ca 0.15 0.52 0.02 0.00 -0.01 0.00 0.00 57.85 58.53 3kbs n ARG 334 Cb 0.45 -4.52 0.39 0.00 0.00 0.00 0.00 32.46 28.77 3kbs n ARG 334 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 3kbs h LEU 335 N 0.00 0.40 -1.02 0.55 -0.00 -1.62 0.59 115.31 114.21 3kbs h LEU 335 Ca -0.22 -0.05 0.02 0.00 -0.00 0.00 0.00 57.88 57.64 3kbs h LEU 335 Cb 1.08 -0.10 -0.05 0.00 -0.00 0.00 0.00 40.66 41.58 3kbs h LEU 335 CO 0.27 0.41 0.66 -2.24 -0.00 0.00 0.00 178.44 177.53 3kbs h ASP 336 N 0.43 1.13 0.33 -0.43 -0.00 -1.89 -1.95 116.42 114.04 3kbs h ASP 336 Ca 0.10 -0.02 -0.10 0.00 -0.00 0.00 0.00 57.03 57.01 3kbs h ASP 336 Cb 0.17 -0.27 -0.01 0.00 -0.00 0.00 0.00 39.33 39.21 3kbs h ASP 336 CO -0.00 0.80 -0.43 -0.33 -0.00 0.00 0.00 179.24 179.27 3kbs h GLU 337 N 1.32 0.13 -0.76 4.15 5.08 -1.29 -2.70 114.58 120.51 3kbs h GLU 337 Ca 0.38 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.72 3kbs h GLU 337 Cb -0.09 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 3kbs h GLU 337 CO -0.10 0.54 0.50 1.25 -1.00 0.00 0.00 179.01 180.20 3kbs h LEU 338 N 0.11 0.77 -0.15 1.33 5.85 -0.51 -2.63 115.31 120.08 3kbs h LEU 338 Ca 0.01 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3kbs h LEU 338 Cb 0.81 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.67 3kbs h LEU 338 CO 0.06 0.52 -0.06 0.00 -0.34 0.00 0.00 178.44 178.62 3kbs n ALA 339 N -2.43 2.66 -2.37 1.25 0.00 -1.02 -4.80 120.51 113.80 3kbs n ALA 339 Ca 0.10 -0.22 -0.34 0.00 0.00 0.00 0.00 53.44 52.97 3kbs n ALA 339 Cb 0.15 -1.40 -0.06 0.00 0.00 0.00 0.00 19.45 18.14 3kbs n ALA 339 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3kbs s ARG 340 N -2.43 3.93 0.39 0.00 0.52 -0.99 -5.04 118.95 115.33 3kbs s ARG 340 Ca 0.32 0.44 -0.27 0.00 -0.52 0.00 0.00 55.73 55.69 3kbs s ARG 340 Cb 0.20 -2.86 -0.11 0.00 0.52 0.00 0.00 34.95 32.71 3kbs s ARG 340 CO 0.45 0.44 1.36 -2.30 0.02 0.00 0.00 175.30 175.27 3kbs n PRO 341 N 0.57 2.23 -0.07 3.54 -0.02 -1.26 -4.94 135.00 135.05 3kbs n PRO 341 Ca -0.04 0.79 -0.13 0.00 -2.02 0.00 0.00 63.50 62.10 3kbs n PRO 341 Cb 0.52 -2.48 -0.06 0.00 -0.02 0.00 0.00 33.50 31.46 3kbs n PRO 341 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3kbs h THR 342 N 2.47 1.32 -1.76 3.45 2.02 -1.94 -3.40 112.91 115.09 3kbs h THR 342 Ca -0.48 -1.27 -0.49 0.00 0.77 0.00 0.00 66.41 64.93 3kbs h THR 342 Cb 1.27 1.74 -0.36 0.00 -1.74 0.00 0.00 68.15 69.06 3kbs h THR 342 CO 0.62 0.38 -1.07 0.00 0.37 0.00 0.00 175.52 175.82 3kbs n ALA 343 N -2.42 1.83 0.12 6.16 0.00 -1.26 -4.91 120.51 120.03 3kbs n ALA 343 Ca -0.05 -3.17 0.03 0.00 0.00 0.00 0.00 53.44 50.25 3kbs n ALA 343 Cb 0.36 -0.91 0.42 0.00 0.00 0.00 0.00 19.45 19.32 3kbs n ALA 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kbs h ALA 344 N 3.54 1.58 0.00 0.00 0.00 -1.99 -0.85 119.26 121.54 3kbs h ALA 344 Ca 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3kbs h ALA 344 Cb 0.94 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3kbs h ALA 344 CO 0.45 0.30 0.00 0.38 0.00 0.00 0.00 179.25 180.38 3kbs h ASP 345 N 0.25 0.00 -4.81 0.00 -0.00 -1.95 -3.48 116.42 106.43 3kbs h ASP 345 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.09 3kbs h ASP 345 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.60 3kbs h ASP 345 CO 0.01 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.86 3kbs n GLY 346 N -1.13 1.25 0.16 7.15 0.00 -0.33 -4.34 105.19 107.95 3kbs n GLY 346 Ca -0.02 -1.82 -0.06 0.00 0.00 0.00 0.00 46.02 44.12 3kbs n GLY 346 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kbs h LEU 347 N 0.00 0.02 -0.38 0.99 6.46 -1.93 -0.92 115.31 119.55 3kbs h LEU 347 Ca 0.00 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.81 3kbs h LEU 347 Cb 0.00 0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 39.99 3kbs h LEU 347 CO 0.00 0.04 0.21 -0.61 -0.62 0.00 0.00 178.44 177.47 3kbs h GLN 348 N 0.20 0.53 -0.55 1.25 5.75 -1.99 0.15 115.11 120.44 3kbs h GLN 348 Ca 0.17 -0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.56 3kbs h GLN 348 Cb 0.20 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.62 3kbs h GLN 348 CO -0.23 0.43 0.14 0.00 -2.65 0.00 0.00 178.83 176.52 3kbs h ALA 349 N 1.07 1.20 -0.60 3.38 0.00 -1.60 -2.08 119.26 120.63 3kbs h ALA 349 Ca 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3kbs h ALA 349 Cb 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3kbs h ALA 349 CO -0.02 0.55 0.37 1.25 0.00 0.00 0.00 179.25 181.40 3kbs h LEU 350 N 0.82 0.72 -1.36 0.00 5.85 -0.22 -1.55 115.31 119.57 3kbs h LEU 350 Ca 0.18 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 3kbs h LEU 350 Cb 0.29 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3kbs h LEU 350 CO -0.00 0.56 -0.14 -0.07 -0.34 0.00 0.00 178.44 178.44 3kbs h LEU 351 N 0.82 0.23 0.00 2.25 3.38 -0.66 -2.72 115.31 118.62 3kbs h LEU 351 Ca 0.22 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3kbs h LEU 351 Cb -0.03 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3kbs h LEU 351 CO -0.04 0.40 -0.50 0.44 0.09 0.00 0.00 178.44 178.83 3kbs h ASP 352 N 0.23 0.00 -3.05 -0.43 3.45 -0.92 -3.45 116.42 112.25 3kbs h ASP 352 Ca 0.05 -0.03 -0.57 0.00 0.43 0.00 0.00 57.03 56.91 3kbs h ASP 352 Cb 0.40 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.13 3kbs h ASP 352 CO 0.02 0.01 1.05 -0.62 -1.57 0.00 0.00 179.24 178.14 3kbs s ASP 353 N -5.45 6.47 0.41 6.45 3.68 -0.62 -4.87 116.67 122.73 3kbs s ASP 353 Ca 0.04 1.23 0.22 0.00 2.13 0.00 0.00 52.55 56.17 3kbs s ASP 353 Cb 0.09 -2.54 0.64 0.00 -1.45 0.00 0.00 42.92 39.66 3kbs s ASP 353 CO 0.72 -1.25 1.70 0.03 0.13 0.00 0.00 175.17 176.51 3kbs h ARG 354 N 10.22 0.00 0.00 4.34 3.08 -1.87 -2.91 114.38 127.24 3kbs h ARG 354 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.76 3kbs h ARG 354 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.17 3kbs h ARG 354 CO 1.04 0.24 0.00 -1.13 -1.07 0.00 0.00 179.97 179.05 3kbs n SER 355 N -3.27 0.51 -0.11 7.04 3.41 -1.26 0.16 113.62 120.09 3kbs n SER 355 Ca 0.01 0.58 0.12 0.00 -0.26 0.00 0.00 58.87 59.33 3kbs n SER 355 Cb 0.52 -0.71 0.31 0.00 -0.26 0.00 0.00 64.21 64.07 3kbs n SER 355 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kbs n ALA 356 N -1.69 3.32 -0.77 7.33 0.00 -1.10 -3.90 120.51 123.70 3kbs n ALA 356 Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.11 3kbs n ALA 356 Cb 0.30 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.62 3kbs n ALA 356 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3kbs n PHE 357 N -1.10 -0.35 -0.30 0.00 -0.00 -1.05 -4.82 117.46 109.85 3kbs n PHE 357 Ca 0.09 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.66 3kbs n PHE 357 Cb 0.34 0.12 0.29 0.00 -0.00 0.00 0.00 39.48 40.22 3kbs n PHE 357 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 3kbs h GLU 358 N 0.00 0.27 -0.11 -4.13 3.07 -1.74 -0.87 114.58 111.07 3kbs h GLU 358 Ca 0.00 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3kbs h GLU 358 Cb 0.00 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 27.85 3kbs h GLU 358 CO 0.00 0.18 -0.01 0.39 -1.40 0.00 0.00 179.01 178.17 3kbs n GLU 359 N -5.15 1.92 -2.39 2.33 1.02 0.42 -4.96 120.64 113.83 3kbs n GLU 359 Ca 0.21 -2.71 -0.42 0.00 -0.02 0.00 0.00 57.16 54.21 3kbs n GLU 359 Cb 0.66 -1.64 -0.03 0.00 -0.02 0.00 0.00 31.44 30.41 3kbs n GLU 359 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 3kbs s PHE 360 N -2.88 2.98 -1.10 -0.32 5.36 -0.34 -4.84 117.98 116.85 3kbs s PHE 360 Ca 0.36 1.05 -0.19 0.00 -0.96 0.00 0.00 56.93 57.19 3kbs s PHE 360 Cb 0.31 -3.51 0.09 0.00 -0.34 0.00 0.00 43.02 39.58 3kbs s PHE 360 CO 0.05 -1.72 1.44 0.34 -1.46 0.00 0.00 175.22 173.87 3kbs s ASP 361 N 1.77 6.71 0.26 6.13 3.68 -1.26 -4.88 116.67 129.07 3kbs s ASP 361 Ca 0.57 -2.09 -0.04 0.00 2.13 0.00 0.00 52.55 53.12 3kbs s ASP 361 Cb -0.25 -2.50 0.32 0.00 -1.45 0.00 0.00 42.92 39.04 3kbs s ASP 361 CO 0.21 -1.19 1.91 -0.37 0.13 0.00 0.00 175.17 175.85 3kbs h VAL 362 N 5.92 1.19 -0.42 1.11 -1.51 -1.95 -2.81 116.25 117.77 3kbs h VAL 362 Ca 0.27 -0.44 -0.11 0.00 -1.23 0.00 0.00 66.70 65.19 3kbs h VAL 362 Cb 0.96 -0.22 -0.02 0.00 -2.13 0.00 0.00 31.29 29.89 3kbs h VAL 362 CO 1.33 0.24 -0.17 0.44 -1.23 0.00 0.00 177.57 178.17 3kbs h ASP 363 N 1.29 0.81 -0.24 4.19 3.32 -1.98 0.24 116.42 124.05 3kbs h ASP 363 Ca 0.40 -0.28 -0.16 0.00 0.02 0.00 0.00 57.03 57.01 3kbs h ASP 363 Cb -0.02 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 3kbs h ASP 363 CO -0.12 0.98 -0.44 0.00 -1.72 0.00 0.00 179.24 177.94 3kbs h ALA 364 N 1.08 0.63 -0.72 3.45 0.00 -1.93 -2.18 119.26 119.60 3kbs h ALA 364 Ca 0.11 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 3kbs h ALA 364 Cb 0.68 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3kbs h ALA 364 CO 0.05 0.67 0.28 0.00 0.00 0.00 0.00 179.25 180.26 3kbs h ALA 365 N 0.86 0.93 -0.21 0.00 0.00 -1.26 -1.32 119.26 118.26 3kbs h ALA 365 Ca 0.04 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.82 3kbs h ALA 365 Cb 1.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3kbs h ALA 365 CO 0.10 0.56 0.15 0.00 0.00 0.00 0.00 179.25 180.06 3kbs h ALA 366 N 1.14 2.19 0.00 0.00 0.00 -0.38 -2.69 119.26 119.51 3kbs h ALA 366 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3kbs h ALA 366 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3kbs h ALA 366 CO -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 179.25 178.99 3kbs h ALA 367 N 1.89 1.00 -2.21 0.00 0.00 -0.58 -3.44 119.26 115.92 3kbs h ALA 367 Ca 0.10 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.45 3kbs h ALA 367 Cb 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3kbs h ALA 367 CO -0.00 0.00 1.01 1.03 0.00 0.00 0.00 179.25 181.29 3kbs s ARG 368 N -3.23 4.19 0.47 0.00 0.52 -1.02 -5.00 118.95 114.88 3kbs s ARG 368 Ca 0.07 1.95 -0.23 0.00 -0.52 0.00 0.00 55.73 57.00 3kbs s ARG 368 Cb 0.08 -3.90 -0.07 0.00 0.52 0.00 0.00 34.95 31.58 3kbs s ARG 368 CO 0.62 -0.80 1.21 0.20 0.02 0.00 0.00 175.30 176.54 3kbs s GLY 369 N 2.80 2.81 0.33 -3.53 0.00 -1.26 -4.96 107.32 103.51 3kbs s GLY 369 Ca 0.66 1.03 0.22 0.00 0.00 0.00 0.00 44.72 46.63 3kbs s GLY 369 CO 0.23 1.50 1.35 -0.33 0.00 0.00 0.00 173.10 175.85 3kbs h MET 370 N 1.97 0.00 -3.03 2.90 0.00 -1.94 -3.48 114.93 111.34 3kbs h MET 370 Ca -0.50 0.00 -0.38 0.00 0.00 0.00 0.00 59.70 58.82 3kbs h MET 370 Cb 1.26 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 32.86 3kbs h MET 370 CO 0.60 0.03 -0.50 0.00 0.00 0.00 0.00 176.91 177.03 3kbs n ALA 371 N -2.15 -0.63 0.16 6.32 0.00 -1.26 -4.01 120.51 118.95 3kbs n ALA 371 Ca 0.02 0.18 0.03 0.00 0.00 0.00 0.00 53.44 53.67 3kbs n ALA 371 Cb 0.55 -2.40 0.23 0.00 0.00 0.00 0.00 19.45 17.84 3kbs n ALA 371 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3kbs h PHE 372 N -0.28 0.00 0.11 0.00 0.04 -1.96 -3.01 116.94 111.84 3kbs h PHE 372 Ca -0.46 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.04 3kbs h PHE 372 Cb 1.34 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.49 3kbs h PHE 372 CO 0.50 0.47 -1.19 0.93 -0.60 0.00 0.00 178.31 178.42 3kbs h GLU 373 N 0.00 0.27 -0.52 1.51 4.39 -1.98 0.12 114.58 118.37 3kbs h GLU 373 Ca -0.00 -0.44 -0.05 0.00 0.34 0.00 0.00 59.36 59.21 3kbs h GLU 373 Cb 1.06 0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 29.85 3kbs h GLU 373 CO 0.06 1.19 0.11 -0.09 -1.16 0.00 0.00 179.01 179.13 3kbs h ARG 374 N 0.08 0.83 -0.14 2.33 2.43 -1.98 -1.35 114.38 116.59 3kbs h ARG 374 Ca -0.12 -0.21 0.01 0.00 -0.81 0.00 0.00 59.98 58.85 3kbs h ARG 374 Cb 1.92 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 31.35 3kbs h ARG 374 CO 0.20 0.80 0.08 1.25 -1.51 0.00 0.00 179.97 180.79 3kbs h LEU 375 N 0.72 0.12 -1.76 3.80 5.85 -1.42 -1.51 115.31 121.12 3kbs h LEU 375 Ca 0.16 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 3kbs h LEU 375 Cb 0.35 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.36 3kbs h LEU 375 CO 0.00 0.09 -0.16 -0.78 -0.34 0.00 0.00 178.44 177.26 3kbs h ASP 376 N 0.17 0.00 0.43 1.25 1.82 -0.62 -0.78 116.42 118.69 3kbs h ASP 376 Ca 0.05 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.53 3kbs h ASP 376 Cb -0.00 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.00 3kbs h ASP 376 CO -0.03 0.16 -0.68 -0.61 -1.61 0.00 0.00 179.24 176.47 3kbs h GLN 377 N 0.00 0.22 -0.39 0.28 5.75 -0.78 -0.24 115.11 119.95 3kbs h GLN 377 Ca -0.00 -0.17 -0.06 0.00 -0.15 0.00 0.00 58.65 58.26 3kbs h GLN 377 Cb 0.34 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.90 3kbs h GLN 377 CO 0.02 0.82 -0.00 -0.07 -2.65 0.00 0.00 178.83 176.95 3kbs h LEU 378 N 0.15 0.59 -0.66 -2.39 3.38 -0.16 0.25 115.31 116.48 3kbs h LEU 378 Ca -0.02 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 3kbs h LEU 378 Cb 1.22 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 3kbs h LEU 378 CO 0.10 0.67 -0.06 0.00 0.09 0.00 0.00 178.44 179.24 3kbs h ALA 379 N 1.41 0.86 0.40 1.53 0.00 -0.84 -1.29 119.26 121.33 3kbs h ALA 379 Ca 0.12 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3kbs h ALA 379 Cb 0.38 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3kbs h ALA 379 CO 0.01 0.65 -0.21 1.98 0.00 0.00 0.00 179.25 181.69 3kbs h MET 380 N 0.89 -0.55 -0.59 0.00 1.85 -0.34 -0.94 114.93 115.25 3kbs h MET 380 Ca 0.15 0.04 0.11 0.00 -0.61 0.00 0.00 59.70 59.39 3kbs h MET 380 Cb 0.60 0.12 -0.09 0.00 0.43 0.00 0.00 31.60 32.67 3kbs h MET 380 CO 0.04 -0.36 0.10 -0.44 -0.40 0.00 0.00 176.91 175.84 3kbs h ASP 381 N -0.57 -0.06 -0.32 1.39 3.45 -0.45 -1.18 116.42 118.69 3kbs h ASP 381 Ca -0.05 0.12 -0.03 0.00 0.43 0.00 0.00 57.03 57.50 3kbs h ASP 381 Cb 0.44 0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 39.38 3kbs h ASP 381 CO 0.08 -0.02 0.09 0.45 -1.57 0.00 0.00 179.24 178.27 3kbs h HIS 382 N 0.22 0.53 -0.42 4.55 3.86 -0.95 -0.59 115.15 122.36 3kbs h HIS 382 Ca 0.31 -0.06 0.07 0.00 -1.16 0.00 0.00 60.37 59.54 3kbs h HIS 382 Cb 0.47 -0.15 -0.06 0.00 1.06 0.00 0.00 27.41 28.73 3kbs h HIS 382 CO -0.27 0.55 0.03 1.25 0.86 0.00 0.00 177.93 180.34 3kbs h LEU 383 N 0.36 -0.12 -0.01 2.43 5.85 -0.62 -2.38 115.31 120.81 3kbs h LEU 383 Ca 0.10 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.91 3kbs h LEU 383 Cb 0.28 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.46 3kbs h LEU 383 CO -0.00 -0.02 -0.02 0.18 -0.34 0.00 0.00 178.44 178.24 3kbs n LEU 384 N -5.17 0.03 -1.46 2.25 4.77 -0.50 -4.93 117.00 112.00 3kbs n LEU 384 Ca 0.03 0.36 -0.08 0.00 -0.03 0.00 0.00 56.01 56.29 3kbs n LEU 384 Cb 0.21 -0.37 0.02 0.00 -2.33 0.00 0.00 43.42 40.95 3kbs n LEU 384 CO 0.20 0.01 0.06 0.61 -1.33 0.00 0.00 177.39 176.94 3kbs n GLY 385 N 1.38 0.41 1.84 -0.72 0.00 -0.39 -4.94 105.19 102.77 3kbs n GLY 385 Ca 0.11 -0.39 -0.04 0.00 0.00 0.00 0.00 46.02 45.70 3kbs n GLY 385 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbs n ALA 386 N -3.12 3.39 -2.25 4.61 0.00 -0.37 -5.04 120.51 117.73 3kbs n ALA 386 Ca -0.01 -3.04 -0.42 0.00 0.00 0.00 0.00 53.44 49.96 3kbs n ALA 386 Cb 0.53 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.36 3kbs n ALA 386 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3kbs s ARG 387 N -2.74 4.24 0.00 0.00 1.81 -1.25 -4.89 118.95 116.12 3kbs s ARG 387 Ca 0.37 1.89 0.00 0.00 -1.72 0.00 0.00 55.73 56.27 3kbs s ARG 387 Cb 0.37 -3.77 0.00 0.00 -0.45 0.00 0.00 34.95 31.10 3kbs s ARG 387 CO -0.06 -0.70 0.00 0.41 -0.68 0.00 0.00 175.30 174.27