#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bk5 s LYS 4 N 0.00 4.18 0.38 1.20 -0.14 -1.26 0.72 119.74 124.82 2bk5 s LYS 4 Ca 0.00 0.16 -0.09 0.00 -1.36 0.00 0.00 55.97 54.68 2bk5 s LYS 4 Cb 0.00 -3.39 0.03 0.00 -1.68 0.00 0.00 37.83 32.79 2bk5 s LYS 4 CO 0.00 0.31 0.66 0.00 -0.76 0.00 0.00 175.35 175.56 2bk5 h ASP 6 N 2.03 0.19 -3.45 0.00 3.32 -1.18 -3.30 116.42 114.04 2bk5 h ASP 6 Ca -0.31 -0.96 -0.36 0.00 0.02 0.00 0.00 57.03 55.42 2bk5 h ASP 6 Cb 1.24 -0.06 -0.35 0.00 0.22 0.00 0.00 39.33 40.38 2bk5 h ASP 6 CO 0.41 1.19 -0.75 -0.69 -1.72 0.00 0.00 179.24 177.67 2bk5 s VAL 7 N -2.31 0.19 -0.17 -1.35 1.01 -1.00 -1.06 120.40 115.71 2bk5 s VAL 7 Ca -0.17 0.11 -0.15 0.00 0.00 0.00 0.00 61.98 61.76 2bk5 s VAL 7 Cb -0.01 -0.31 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 2bk5 s VAL 7 CO 0.74 0.17 0.37 -0.69 0.00 0.00 0.00 175.10 175.69 2bk5 s VAL 8 N 1.24 5.24 -0.24 2.92 1.01 -0.84 -2.02 120.40 127.71 2bk5 s VAL 8 Ca -0.07 0.69 -0.08 0.00 0.00 0.00 0.00 61.98 62.53 2bk5 s VAL 8 Cb -0.13 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2bk5 s VAL 8 CO -0.02 0.32 0.08 -0.69 0.00 0.00 0.00 175.10 174.78 2bk5 s VAL 9 N 0.88 4.43 -0.42 2.92 1.01 0.29 -0.77 120.40 128.73 2bk5 s VAL 9 Ca 0.19 -0.14 -0.19 0.00 0.00 0.00 0.00 61.98 61.84 2bk5 s VAL 9 Cb -0.14 -3.06 0.02 0.00 0.00 0.00 0.00 36.38 33.19 2bk5 s VAL 9 CO 0.07 0.35 0.56 -0.69 0.00 0.00 0.00 175.10 175.39 2bk5 s VAL 10 N 1.46 4.94 0.00 2.92 1.01 0.66 -0.61 120.40 130.78 2bk5 s VAL 10 Ca 0.06 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.07 2bk5 s VAL 10 Cb -0.15 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.12 2bk5 s VAL 10 CO 0.04 -0.47 0.00 0.61 0.00 0.00 0.00 175.10 175.28 2bk5 n GLY 11 N 5.00 2.32 2.20 4.51 0.00 -0.04 -0.56 105.19 118.63 2bk5 n GLY 11 Ca -0.04 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.44 2bk5 n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bk5 n GLY 12 N 1.88 6.14 1.79 -0.02 0.00 -1.26 -4.03 105.19 109.68 2bk5 n GLY 12 Ca 0.00 -2.52 -0.14 0.00 0.00 0.00 0.00 46.02 43.36 2bk5 n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bk5 n GLY 13 N -0.78 -1.51 0.37 -0.02 0.00 -1.26 -1.02 105.19 100.97 2bk5 n GLY 13 Ca 0.52 -1.66 0.08 0.00 0.00 0.00 0.00 46.02 44.96 2bk5 n GLY 13 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2bk5 h ILE 14 N -1.47 0.92 -0.01 -0.61 2.04 -1.94 -0.53 117.51 115.91 2bk5 h ILE 14 Ca -0.20 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 2bk5 h ILE 14 Cb 0.56 -0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2bk5 h ILE 14 CO 0.14 0.16 -0.00 -1.28 0.00 0.00 0.00 178.15 177.17 2bk5 h SER 15 N 0.90 0.01 -0.63 1.72 0.87 -1.90 0.83 113.55 115.35 2bk5 h SER 15 Ca 0.46 -0.36 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 2bk5 h SER 15 Cb 0.50 -0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.43 2bk5 h SER 15 CO -0.22 0.37 0.37 1.23 -0.53 0.00 0.00 176.83 178.05 2bk5 h GLY 16 N -0.35 0.92 0.94 5.77 0.00 -1.65 -0.99 103.07 107.71 2bk5 h GLY 16 Ca 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 2bk5 h GLY 16 CO 0.00 0.38 0.14 -0.33 0.00 0.00 0.00 176.54 176.73 2bk5 h MET 17 N 0.85 0.60 -0.81 4.80 2.07 -1.05 0.10 114.93 121.49 2bk5 h MET 17 Ca 0.22 -0.12 -0.00 0.00 -2.07 0.00 0.00 59.70 57.73 2bk5 h MET 17 Cb 0.00 -0.09 -0.04 0.00 -1.87 0.00 0.00 31.60 29.60 2bk5 h MET 17 CO -0.04 0.59 0.49 0.00 1.07 0.00 0.00 176.91 179.02 2bk5 h ALA 18 N 0.99 1.04 -0.19 6.32 0.00 -0.67 0.43 119.26 127.18 2bk5 h ALA 18 Ca 0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2bk5 h ALA 18 Cb 0.22 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2bk5 h ALA 18 CO -0.01 0.50 0.03 0.00 0.00 0.00 0.00 179.25 179.77 2bk5 h ALA 19 N 1.26 0.25 -0.80 0.00 0.00 -0.95 -2.16 119.26 116.86 2bk5 h ALA 19 Ca 0.29 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2bk5 h ALA 19 Cb -0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2bk5 h ALA 19 CO -0.05 -0.08 0.44 0.00 0.00 0.00 0.00 179.25 179.55 2bk5 h ALA 20 N 0.83 1.02 -0.35 0.00 0.00 -0.56 -1.73 119.26 118.46 2bk5 h ALA 20 Ca 0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2bk5 h ALA 20 Cb 0.31 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2bk5 h ALA 20 CO 0.00 0.53 0.14 -0.22 0.00 0.00 0.00 179.25 179.70 2bk5 h LYS 21 N 1.11 0.53 -0.16 0.00 3.64 -0.85 0.35 116.57 121.19 2bk5 h LYS 21 Ca 0.28 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2bk5 h LYS 21 Cb 0.03 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2bk5 h LYS 21 CO -0.05 0.53 0.08 1.25 -2.27 0.00 0.00 179.45 178.99 2bk5 h LEU 22 N 0.42 0.13 -0.34 5.20 6.46 -1.10 0.18 115.31 126.27 2bk5 h LEU 22 Ca 0.12 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.87 2bk5 h LEU 22 Cb 0.20 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.09 2bk5 h LEU 22 CO -0.01 0.10 0.16 -0.07 -0.62 0.00 0.00 178.44 178.00 2bk5 h LEU 23 N 0.18 0.44 -0.25 2.25 3.38 -1.22 -1.35 115.31 118.73 2bk5 h LEU 23 Ca 0.06 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 57.94 2bk5 h LEU 23 Cb 0.00 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 2bk5 h LEU 23 CO -0.04 0.44 0.03 -0.74 0.09 0.00 0.00 178.44 178.23 2bk5 h HIS 24 N 0.41 0.04 0.00 1.13 2.76 -0.73 -1.69 115.15 117.07 2bk5 h HIS 24 Ca 0.12 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.29 2bk5 h HIS 24 Cb 0.12 0.02 -0.00 0.00 1.55 0.00 0.00 27.41 29.10 2bk5 h HIS 24 CO -0.02 -0.01 -0.03 -0.44 -1.30 0.00 0.00 177.93 176.13 2bk5 h ASP 25 N 0.12 0.00 0.32 3.26 3.32 -0.40 -1.26 116.42 121.77 2bk5 h ASP 25 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2bk5 h ASP 25 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2bk5 h ASP 25 CO -0.18 0.03 -0.27 -1.54 -1.72 0.00 0.00 179.24 175.57 2bk5 n SER 26 N -3.45 0.82 0.00 6.45 3.41 -0.53 -4.94 113.62 115.38 2bk5 n SER 26 Ca -0.02 -0.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.88 2bk5 n SER 26 Cb 0.15 0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 2bk5 n SER 26 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bk5 n GLY 27 N 1.36 0.94 3.88 5.00 0.00 -0.48 -5.08 105.19 110.81 2bk5 n GLY 27 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2bk5 n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bk5 s LEU 28 N 0.00 4.02 -0.38 0.99 1.43 -0.81 -5.02 118.68 118.92 2bk5 s LEU 28 Ca 0.00 0.98 -0.25 0.00 -1.03 0.00 0.00 54.13 53.83 2bk5 s LEU 28 Cb 0.00 -3.80 0.01 0.00 0.03 0.00 0.00 46.19 42.43 2bk5 s LEU 28 CO 0.00 -0.23 0.86 0.20 0.23 0.00 0.00 176.35 177.41 2bk5 s ASN 29 N -2.83 6.60 0.13 2.29 0.01 -1.26 -4.17 114.94 115.71 2bk5 s ASN 29 Ca 0.49 0.42 0.09 0.00 -0.71 0.00 0.00 52.86 53.15 2bk5 s ASN 29 Cb -0.11 -2.43 -0.04 0.00 0.41 0.00 0.00 41.25 39.08 2bk5 s ASN 29 CO 0.26 -0.82 -0.19 0.68 -1.51 0.00 0.00 177.10 175.52 2bk5 s VAL 30 N 3.33 2.77 -0.03 1.60 -7.23 -1.26 -0.68 120.40 118.91 2bk5 s VAL 30 Ca 0.35 -1.58 0.03 0.00 -1.81 0.00 0.00 61.98 58.96 2bk5 s VAL 30 Cb -0.12 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.54 2bk5 s VAL 30 CO 0.19 0.07 -0.11 -0.69 -0.31 0.00 0.00 175.10 174.25 2bk5 s VAL 31 N -1.22 0.92 -0.24 1.32 1.01 -0.85 -4.80 120.40 116.53 2bk5 s VAL 31 Ca 0.18 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.66 2bk5 s VAL 31 Cb -0.10 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 2bk5 s VAL 31 CO 0.10 0.28 0.05 -0.69 0.00 0.00 0.00 175.10 174.84 2bk5 s VAL 32 N 0.15 4.16 -0.38 2.92 1.01 0.07 -0.55 120.40 127.77 2bk5 s VAL 32 Ca -0.03 -0.23 -0.13 0.00 0.00 0.00 0.00 61.98 61.59 2bk5 s VAL 32 Cb -0.09 -2.93 0.01 0.00 0.00 0.00 0.00 36.38 33.37 2bk5 s VAL 32 CO 0.01 0.36 0.26 -0.76 0.00 0.00 0.00 175.10 174.97 2bk5 s LEU 33 N 1.53 4.85 -0.15 3.92 1.43 0.22 -0.28 118.68 130.20 2bk5 s LEU 33 Ca 0.06 -0.82 -0.01 0.00 -1.03 0.00 0.00 54.13 52.33 2bk5 s LEU 33 Cb -0.15 -2.11 -0.01 0.00 0.03 0.00 0.00 46.19 43.95 2bk5 s LEU 33 CO 0.02 -0.38 -0.12 -0.70 0.23 0.00 0.00 176.35 175.41 2bk5 s GLU 34 N 1.65 3.37 0.20 1.70 2.56 -0.29 -0.86 118.70 127.03 2bk5 s GLU 34 Ca 0.04 -0.68 -0.07 0.00 0.00 0.00 0.00 54.97 54.26 2bk5 s GLU 34 Cb -0.19 -2.71 0.14 0.00 2.00 0.00 0.00 34.13 33.37 2bk5 s GLU 34 CO 0.09 0.11 1.67 0.00 -0.56 0.00 0.00 175.26 176.57 2bk5 h ALA 35 N 7.05 0.90 -2.43 6.30 0.00 -1.85 0.19 119.26 129.43 2bk5 h ALA 35 Ca -0.30 -0.30 -0.46 0.00 0.00 0.00 0.00 54.91 53.85 2bk5 h ALA 35 Cb 1.20 -0.22 0.10 0.00 0.00 0.00 0.00 17.79 18.87 2bk5 h ALA 35 CO 0.57 0.65 0.35 1.03 0.00 0.00 0.00 179.25 181.85 2bk5 s ARG 36 N -5.02 1.90 -0.03 0.00 0.52 -1.26 -3.71 118.95 111.35 2bk5 s ARG 36 Ca -0.11 -0.09 0.03 0.00 -0.52 0.00 0.00 55.73 55.05 2bk5 s ARG 36 Cb 0.14 -2.02 0.15 0.00 0.52 0.00 0.00 34.95 33.74 2bk5 s ARG 36 CO 0.85 -1.56 0.89 -0.40 0.02 0.00 0.00 175.30 175.09 2bk5 n ASP 37 N -3.23 1.49 -3.74 0.23 5.75 -1.26 -0.56 116.55 115.24 2bk5 n ASP 37 Ca 0.09 -2.11 -0.10 0.00 -0.01 0.00 0.00 54.79 52.66 2bk5 n ASP 37 Cb 0.61 -0.37 -0.06 0.00 -1.03 0.00 0.00 41.12 40.27 2bk5 n ASP 37 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bk5 s ARG 38 N -1.53 0.99 0.58 0.11 1.70 -1.26 -4.93 118.95 114.62 2bk5 s ARG 38 Ca 0.10 -0.83 0.02 0.00 -0.47 0.00 0.00 55.73 54.55 2bk5 s ARG 38 Cb 0.07 0.42 0.06 0.00 -0.57 0.00 0.00 34.95 34.93 2bk5 s ARG 38 CO 0.04 -0.36 0.81 0.14 -1.08 0.00 0.00 175.30 174.86 2bk5 s VAL 39 N -3.83 2.52 0.00 4.99 -7.23 -1.26 -4.73 120.40 110.86 2bk5 s VAL 39 Ca 0.04 -0.70 0.00 0.00 -1.81 0.00 0.00 61.98 59.52 2bk5 s VAL 39 Cb 0.03 -2.83 0.00 0.00 0.56 0.00 0.00 36.38 34.14 2bk5 s VAL 39 CO -0.11 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.29 2bk5 n GLY 40 N -2.42 1.67 7.00 2.32 0.00 -0.19 -4.90 105.19 108.68 2bk5 n GLY 40 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2bk5 n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bk5 n GLY 41 N -0.01 2.51 0.00 -0.02 0.00 -1.26 -0.93 105.19 105.48 2bk5 n GLY 41 Ca 0.00 0.31 0.14 0.00 0.00 0.00 0.00 46.02 46.47 2bk5 n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bk5 n ARG 42 N 5.42 0.63 -3.96 1.61 1.74 -1.26 -4.50 116.66 116.34 2bk5 n ARG 42 Ca 0.00 0.02 -0.36 0.00 -0.77 0.00 0.00 57.85 56.73 2bk5 n ARG 42 Cb 0.00 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 29.87 2bk5 n ARG 42 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2bk5 s THR 43 N -2.28 5.24 -0.25 0.55 -4.23 -0.10 -1.21 115.64 113.37 2bk5 s THR 43 Ca 0.34 0.11 -0.06 0.00 -1.18 0.00 0.00 61.69 60.90 2bk5 s THR 43 Cb 0.19 -3.28 0.12 0.00 1.34 0.00 0.00 72.50 70.86 2bk5 s THR 43 CO 0.36 0.59 0.49 -0.47 -0.54 0.00 0.00 174.62 175.06 2bk5 s TYR 44 N -0.80 -1.05 -0.29 3.99 5.04 -1.26 -4.53 117.35 118.45 2bk5 s TYR 44 Ca 0.13 1.64 -0.08 0.00 -2.44 0.00 0.00 57.07 56.32 2bk5 s TYR 44 Cb -0.12 0.42 -0.00 0.00 0.35 0.00 0.00 41.96 42.61 2bk5 s TYR 44 CO 0.03 -0.62 0.11 0.99 -1.34 0.00 0.00 175.55 174.71 2bk5 s THR 45 N 2.71 4.25 -0.05 4.34 2.01 -1.26 -0.61 115.64 127.02 2bk5 s THR 45 Ca 0.03 -0.52 -0.19 0.00 0.31 0.00 0.00 61.69 61.32 2bk5 s THR 45 Cb -0.13 -3.15 -0.05 0.00 0.01 0.00 0.00 72.50 69.18 2bk5 s THR 45 CO -0.16 0.11 0.54 -0.22 -0.69 0.00 0.00 174.62 174.21 2bk5 s LEU 46 N 1.56 4.37 -0.12 4.42 2.96 0.06 -4.88 118.68 127.05 2bk5 s LEU 46 Ca 0.04 1.02 0.01 0.00 -0.22 0.00 0.00 54.13 54.98 2bk5 s LEU 46 Cb -0.17 -2.82 -0.01 0.00 0.50 0.00 0.00 46.19 43.69 2bk5 s LEU 46 CO 0.04 0.07 -0.17 -0.13 -1.32 0.00 0.00 176.35 174.85 2bk5 s ARG 47 N 0.08 3.27 0.33 1.98 3.00 -1.26 -0.66 118.95 125.69 2bk5 s ARG 47 Ca 0.29 -0.75 -0.16 0.00 0.00 0.00 0.00 55.73 55.11 2bk5 s ARG 47 Cb -0.17 -2.53 0.03 0.00 0.00 0.00 0.00 34.95 32.28 2bk5 s ARG 47 CO 0.14 0.19 0.70 0.54 0.00 0.00 0.00 175.30 176.87 2bk5 s ASN 48 N 0.39 -0.01 0.22 0.23 2.20 -1.12 -5.01 114.94 111.84 2bk5 s ASN 48 Ca -0.13 -0.97 -0.08 0.00 -0.94 0.00 0.00 52.86 50.74 2bk5 s ASN 48 Cb -0.16 0.76 0.24 0.00 -2.00 0.00 0.00 41.25 40.09 2bk5 s ASN 48 CO 0.06 -1.47 1.85 1.56 -2.94 0.00 0.00 177.10 176.16 2bk5 h GLN 49 N 2.04 0.89 -0.02 3.55 1.08 -1.99 0.16 115.11 120.82 2bk5 h GLN 49 Ca -0.26 -0.05 -0.15 0.00 -1.45 0.00 0.00 58.65 56.74 2bk5 h GLN 49 Cb 1.25 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 28.46 2bk5 h GLN 49 CO 0.34 0.59 -0.67 0.87 -0.95 0.00 0.00 178.83 179.00 2bk5 h LYS 50 N 0.91 0.09 0.00 1.46 1.79 -2.02 -3.30 116.57 115.50 2bk5 h LYS 50 Ca 0.32 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.72 2bk5 h LYS 50 Cb 0.07 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 2bk5 h LYS 50 CO -0.13 0.72 -0.85 1.33 -1.08 0.00 0.00 179.45 179.44 2bk5 n VAL 51 N -3.78 0.00 0.00 0.50 0.24 -1.16 -4.96 118.33 109.17 2bk5 n VAL 51 Ca -0.02 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.03 2bk5 n VAL 51 Cb 0.66 0.71 0.00 0.00 -1.47 0.00 0.00 33.84 33.74 2bk5 n VAL 51 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2bk5 n LYS 52 N -1.47 0.00 -3.86 7.34 4.81 0.56 -4.60 118.16 120.95 2bk5 n LYS 52 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.33 2bk5 n LYS 52 Cb 0.19 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.14 2bk5 n LYS 52 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 2bk5 s TYR 53 N 0.00 0.02 -0.11 5.64 -0.85 -1.26 -2.79 117.35 117.99 2bk5 s TYR 53 Ca 0.00 -0.09 -0.08 0.00 -0.52 0.00 0.00 57.07 56.38 2bk5 s TYR 53 Cb 0.00 -0.03 0.04 0.00 0.38 0.00 0.00 41.96 42.35 2bk5 s TYR 53 CO 0.00 -0.31 0.29 0.54 -1.52 0.00 0.00 175.55 174.55 2bk5 s VAL 54 N -1.43 -0.02 -0.38 -3.49 0.11 0.17 -4.97 120.40 110.39 2bk5 s VAL 54 Ca -0.14 0.07 -0.28 0.00 -2.93 0.00 0.00 61.98 58.69 2bk5 s VAL 54 Cb -0.07 -0.42 0.02 0.00 -1.53 0.00 0.00 36.38 34.38 2bk5 s VAL 54 CO 0.02 0.03 1.06 -1.81 -3.33 0.00 0.00 175.10 171.07 2bk5 s ASP 55 N 0.72 6.79 0.06 3.54 1.01 -1.26 -0.76 116.67 126.78 2bk5 s ASP 55 Ca -0.05 0.78 0.23 0.00 0.71 0.00 0.00 52.55 54.23 2bk5 s ASP 55 Cb -0.06 -2.53 0.04 0.00 1.01 0.00 0.00 42.92 41.38 2bk5 s ASP 55 CO -0.05 -0.98 1.01 0.18 0.21 0.00 0.00 175.17 175.54 2bk5 n LEU 56 N 7.13 0.60 0.00 1.23 4.77 0.22 -4.92 117.00 126.03 2bk5 n LEU 56 Ca 0.11 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2bk5 n LEU 56 Cb 0.48 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2bk5 n LEU 56 CO 0.63 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 2bk5 n GLY 57 N 1.34 4.16 3.62 -0.72 0.00 -1.21 -4.74 105.19 107.64 2bk5 n GLY 57 Ca 0.01 -1.69 -0.47 0.00 0.00 0.00 0.00 46.02 43.88 2bk5 n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bk5 n GLY 58 N 5.00 0.35 0.72 -0.02 0.00 -0.35 -4.82 105.19 106.07 2bk5 n GLY 58 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.52 2bk5 n GLY 58 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2bk5 n SER 59 N 1.99 0.30 -4.81 1.61 2.88 -1.26 -4.66 113.62 109.67 2bk5 n SER 59 Ca 0.13 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.29 2bk5 n SER 59 Cb 0.28 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.68 2bk5 n SER 59 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2bk5 s TYR 60 N -1.46 3.79 0.15 0.66 1.51 -1.26 -4.19 117.35 116.55 2bk5 s TYR 60 Ca 0.00 1.32 0.04 0.00 -1.01 0.00 0.00 57.07 57.42 2bk5 s TYR 60 Cb 0.00 -2.54 -0.04 0.00 -0.11 0.00 0.00 41.96 39.27 2bk5 s TYR 60 CO 0.00 0.54 -0.08 0.14 -1.11 0.00 0.00 175.55 175.04 2bk5 s VAL 61 N -1.19 1.06 0.35 0.71 -7.23 0.10 -4.89 120.40 109.31 2bk5 s VAL 61 Ca 0.32 -2.04 -0.17 0.00 -1.81 0.00 0.00 61.98 58.28 2bk5 s VAL 61 Cb -0.19 -1.87 0.05 0.00 0.56 0.00 0.00 36.38 34.92 2bk5 s VAL 61 CO 0.20 -0.72 0.80 -0.83 -0.31 0.00 0.00 175.10 174.25 2bk5 s GLY 62 N -3.16 0.26 0.41 2.32 0.00 -1.25 -0.56 107.32 105.34 2bk5 s GLY 62 Ca 0.17 -0.63 -0.25 0.00 0.00 0.00 0.00 44.72 44.01 2bk5 s GLY 62 CO 0.01 -0.04 1.05 -1.55 0.00 0.00 0.00 173.10 172.57 2bk5 n PRO 63 N -0.53 1.44 -0.22 2.90 -0.04 -1.26 -1.93 135.00 135.35 2bk5 n PRO 63 Ca -0.07 0.51 0.00 0.00 -0.04 0.00 0.00 63.50 63.90 2bk5 n PRO 63 Cb 0.60 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 2bk5 n PRO 63 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2bk5 n THR 64 N -0.37 0.00 -2.37 0.52 -2.24 -1.26 -4.79 114.28 103.77 2bk5 n THR 64 Ca 0.09 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.46 2bk5 n THR 64 Cb 0.38 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.62 2bk5 n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bk5 n GLN 65 N -2.00 4.58 0.16 -0.78 6.02 -0.82 -4.81 117.38 119.74 2bk5 n GLN 65 Ca 0.00 -3.92 0.02 0.00 -0.01 0.00 0.00 57.00 53.09 2bk5 n GLN 65 Cb 0.00 -2.64 0.25 0.00 1.02 0.00 0.00 30.24 28.87 2bk5 n GLN 65 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 2bk5 h ASN 66 N 4.87 0.00 -0.06 1.08 2.35 -1.90 -2.95 115.58 118.97 2bk5 h ASN 66 Ca 0.52 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 56.24 2bk5 h ASN 66 Cb 0.42 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 2bk5 h ASN 66 CO 1.42 0.50 -0.08 0.03 -1.65 0.00 0.00 177.43 177.66 2bk5 h ARG 67 N 0.00 0.17 -0.57 0.81 3.08 -1.90 -0.76 114.38 115.20 2bk5 h ARG 67 Ca -0.01 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 59.89 2bk5 h ARG 67 Cb 1.00 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.03 2bk5 h ARG 67 CO 0.07 0.62 0.09 0.97 -1.07 0.00 0.00 179.97 180.65 2bk5 h ILE 68 N -0.29 1.24 -0.69 2.04 6.09 -1.83 -0.97 117.51 123.11 2bk5 h ILE 68 Ca 0.01 -0.94 -0.05 0.00 -1.37 0.00 0.00 64.86 62.51 2bk5 h ILE 68 Cb 0.60 0.71 -0.03 0.00 0.47 0.00 0.00 36.82 38.57 2bk5 h ILE 68 CO 0.02 0.35 0.25 -0.07 -3.07 0.00 0.00 178.15 175.63 2bk5 h LEU 69 N 0.87 0.97 -0.21 2.19 3.38 -1.49 -0.40 115.31 120.63 2bk5 h LEU 69 Ca 0.18 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 2bk5 h LEU 69 Cb 0.38 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2bk5 h LEU 69 CO 0.01 0.90 -0.20 -0.09 0.09 0.00 0.00 178.44 179.15 2bk5 h ARG 70 N 0.99 0.50 -0.24 1.13 1.12 -0.85 -1.35 114.38 115.68 2bk5 h ARG 70 Ca 0.23 -0.26 -0.00 0.00 -1.11 0.00 0.00 59.98 58.83 2bk5 h ARG 70 Cb 0.25 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.20 2bk5 h ARG 70 CO -0.01 0.84 0.13 1.25 -3.11 0.00 0.00 179.97 179.07 2bk5 h LEU 71 N 0.18 0.30 -0.50 3.80 5.85 -1.11 -1.33 115.31 122.50 2bk5 h LEU 71 Ca 0.03 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 2bk5 h LEU 71 Cb 0.74 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 2bk5 h LEU 71 CO 0.05 0.30 0.29 0.00 -0.34 0.00 0.00 178.44 178.74 2bk5 h ALA 72 N 1.01 0.64 -0.39 1.25 0.00 -1.07 -2.12 119.26 118.59 2bk5 h ALA 72 Ca 0.09 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2bk5 h ALA 72 Cb 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2bk5 h ALA 72 CO -0.01 0.14 0.22 -0.22 0.00 0.00 0.00 179.25 179.38 2bk5 h LYS 73 N 0.67 0.44 -0.73 0.00 3.64 -1.10 -0.99 116.57 118.50 2bk5 h LYS 73 Ca 0.18 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.60 2bk5 h LYS 73 Cb 0.02 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.69 2bk5 h LYS 73 CO -0.03 0.29 0.48 1.49 -2.27 0.00 0.00 179.45 179.41 2bk5 h GLU 74 N 0.45 0.73 0.00 1.90 4.81 -1.01 0.03 114.58 121.49 2bk5 h GLU 74 Ca 0.16 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2bk5 h GLU 74 Cb 0.02 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.24 2bk5 h GLU 74 CO -0.08 0.49 0.00 1.28 -0.73 0.00 0.00 179.01 179.96 2bk5 n LEU 75 N -4.48 0.00 0.00 1.64 4.77 -0.74 -4.89 117.00 113.31 2bk5 n LEU 75 Ca 0.11 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2bk5 n LEU 75 Cb 0.23 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 2bk5 n LEU 75 CO 0.34 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 2bk5 n GLY 76 N 1.00 0.70 3.90 -0.72 0.00 -0.00 -5.05 105.19 105.02 2bk5 n GLY 76 Ca 0.23 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 2bk5 n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bk5 s LEU 77 N 0.00 3.98 0.18 0.99 1.43 -0.45 -5.01 118.68 119.80 2bk5 s LEU 77 Ca 0.00 0.77 0.07 0.00 -1.03 0.00 0.00 54.13 53.95 2bk5 s LEU 77 Cb 0.00 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.56 2bk5 s LEU 77 CO 0.00 -0.27 -0.15 -1.61 0.23 0.00 0.00 176.35 174.55 2bk5 s GLU 78 N -3.78 1.26 0.31 1.70 2.02 -1.26 -4.22 118.70 114.73 2bk5 s GLU 78 Ca 0.45 -1.49 0.08 0.00 0.02 0.00 0.00 54.97 54.03 2bk5 s GLU 78 Cb -0.10 -1.10 -0.04 0.00 0.10 0.00 0.00 34.13 32.99 2bk5 s GLU 78 CO 0.32 0.19 0.15 0.95 0.02 0.00 0.00 175.26 176.89 2bk5 s THR 79 N -2.68 3.36 0.09 3.63 -4.23 -1.26 -0.73 115.64 113.81 2bk5 s THR 79 Ca 0.19 -1.65 0.00 0.00 -1.18 0.00 0.00 61.69 59.05 2bk5 s THR 79 Cb -0.02 -3.04 -0.04 0.00 1.34 0.00 0.00 72.50 70.74 2bk5 s THR 79 CO 0.06 -0.24 -0.04 -0.72 -0.54 0.00 0.00 174.62 173.14 2bk5 s TYR 80 N -2.35 0.75 0.02 3.99 -0.85 -0.31 -4.79 117.35 113.82 2bk5 s TYR 80 Ca 0.36 -1.01 -0.24 0.00 -0.52 0.00 0.00 57.07 55.66 2bk5 s TYR 80 Cb -0.04 -0.47 -0.05 0.00 0.38 0.00 0.00 41.96 41.77 2bk5 s TYR 80 CO 0.23 -0.28 0.73 0.15 -1.52 0.00 0.00 175.55 174.87 2bk5 s LYS 81 N -3.89 4.46 0.33 -3.49 1.02 -1.26 -1.37 119.74 115.54 2bk5 s LYS 81 Ca 0.11 0.99 -0.29 0.00 0.02 0.00 0.00 55.97 56.81 2bk5 s LYS 81 Cb 0.07 -3.37 -0.11 0.00 -0.52 0.00 0.00 37.83 33.89 2bk5 s LYS 81 CO -0.06 0.26 1.51 0.08 -0.92 0.00 0.00 175.35 176.22 2bk5 s VAL 82 N 0.06 2.16 -0.13 3.17 1.01 0.20 -4.89 120.40 121.98 2bk5 s VAL 82 Ca 0.37 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 62.21 2bk5 s VAL 82 Cb -0.20 -3.10 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 2bk5 s VAL 82 CO 0.21 0.03 1.86 0.21 0.00 0.00 0.00 175.10 177.42 2bk5 s ASN 83 N 0.11 6.21 -0.07 3.32 2.47 -1.26 -4.81 114.94 120.92 2bk5 s ASN 83 Ca 0.57 2.05 0.23 0.00 0.42 0.00 0.00 52.86 56.14 2bk5 s ASN 83 Cb -0.46 -2.53 0.44 0.00 -1.45 0.00 0.00 41.25 37.25 2bk5 s ASN 83 CO 0.55 -1.33 1.17 1.21 -3.72 0.00 0.00 177.10 174.98 2bk5 n GLU 84 N 7.82 0.51 -0.04 0.43 2.13 -1.26 -4.67 120.64 125.56 2bk5 n GLU 84 Ca 0.21 -2.41 -0.13 0.00 0.66 0.00 0.00 57.16 55.50 2bk5 n GLU 84 Cb 0.44 -0.46 -0.08 0.00 0.27 0.00 0.00 31.44 31.61 2bk5 n GLU 84 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2bk5 h VAL 85 N 6.00 1.33 -2.82 6.31 2.07 -1.92 -3.46 116.25 123.76 2bk5 h VAL 85 Ca -0.18 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.24 2bk5 h VAL 85 Cb 1.70 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 33.32 2bk5 h VAL 85 CO 0.11 0.31 0.00 -0.62 0.02 0.00 0.00 177.57 177.40 2bk5 n GLU 86 N -4.71 1.02 -2.73 1.57 4.71 -1.26 -4.99 120.64 114.24 2bk5 n GLU 86 Ca -0.07 0.00 -0.38 0.00 -0.01 0.00 0.00 57.16 56.70 2bk5 n GLU 86 Cb 0.28 0.00 -0.06 0.00 -1.01 0.00 0.00 31.44 30.65 2bk5 n GLU 86 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2bk5 s ARG 87 N -1.22 4.67 0.68 3.49 0.52 -0.44 -4.20 118.95 122.45 2bk5 s ARG 87 Ca 0.00 1.44 -0.11 0.00 -0.52 0.00 0.00 55.73 56.54 2bk5 s ARG 87 Cb 0.00 -3.00 -0.00 0.00 0.52 0.00 0.00 34.95 32.46 2bk5 s ARG 87 CO 0.00 0.34 1.06 -0.51 0.02 0.00 0.00 175.30 176.21 2bk5 s LEU 88 N -1.70 3.07 -0.08 2.53 1.02 0.25 -0.85 118.68 122.92 2bk5 s LEU 88 Ca 0.47 1.41 0.03 0.00 0.02 0.00 0.00 54.13 56.06 2bk5 s LEU 88 Cb -0.23 -4.32 0.00 0.00 0.02 0.00 0.00 46.19 41.67 2bk5 s LEU 88 CO 0.29 -1.24 -0.19 -0.63 0.02 0.00 0.00 176.35 174.59 2bk5 s ILE 89 N -3.17 1.67 -0.27 -0.59 1.01 -0.51 -0.26 121.20 119.08 2bk5 s ILE 89 Ca 0.57 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 60.35 2bk5 s ILE 89 Cb -0.12 -1.46 -0.02 0.00 0.01 0.00 0.00 42.46 40.87 2bk5 s ILE 89 CO 0.54 0.47 0.08 -2.28 0.00 0.00 0.00 174.94 173.75 2bk5 s HIS 90 N 0.45 3.10 -0.31 3.97 5.65 -0.52 -0.18 115.29 127.45 2bk5 s HIS 90 Ca -0.16 -0.60 -0.10 0.00 0.25 0.00 0.00 55.06 54.45 2bk5 s HIS 90 Cb -0.17 -2.25 -0.01 0.00 -1.18 0.00 0.00 32.58 28.97 2bk5 s HIS 90 CO 0.07 -0.43 0.17 -1.58 -0.65 0.00 0.00 174.74 172.31 2bk5 s HIS 91 N 1.58 3.19 -0.03 3.88 2.46 0.62 -0.12 115.29 126.87 2bk5 s HIS 91 Ca 0.05 -0.48 0.00 0.00 0.47 0.00 0.00 55.06 55.11 2bk5 s HIS 91 Cb -0.16 -2.37 0.03 0.00 -0.13 0.00 0.00 32.58 29.95 2bk5 s HIS 91 CO 0.03 -0.42 -0.00 0.54 -2.47 0.00 0.00 174.74 172.42 2bk5 s VAL 92 N 1.64 0.18 -1.48 0.89 0.11 0.40 -1.68 120.40 120.46 2bk5 s VAL 92 Ca 0.05 0.08 -0.01 0.00 -2.93 0.00 0.00 61.98 59.17 2bk5 s VAL 92 Cb -0.17 -0.27 0.01 0.00 -1.53 0.00 0.00 36.38 34.42 2bk5 s VAL 92 CO 0.07 0.14 0.27 0.29 -3.33 0.00 0.00 175.10 172.55 2bk5 n LYS 93 N 4.11 -2.36 -1.03 1.54 5.02 -1.26 -1.77 118.16 122.42 2bk5 n LYS 93 Ca -0.27 0.28 -0.01 0.00 -2.02 0.00 0.00 58.31 56.29 2bk5 n LYS 93 Cb 0.50 -4.19 -0.00 0.00 -0.02 0.00 0.00 35.03 31.32 2bk5 n LYS 93 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bk5 n GLY 94 N -2.18 0.49 2.93 0.72 0.00 -1.26 -5.01 105.19 100.88 2bk5 n GLY 94 Ca -0.30 -0.42 -0.16 0.00 0.00 0.00 0.00 46.02 45.14 2bk5 n GLY 94 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bk5 s LYS 95 N -1.05 0.37 -0.11 1.61 2.20 -0.73 -5.08 119.74 116.96 2bk5 s LYS 95 Ca 0.00 -0.14 -0.16 0.00 -0.36 0.00 0.00 55.97 55.31 2bk5 s LYS 95 Cb 0.00 -0.37 -0.05 0.00 -1.51 0.00 0.00 37.83 35.90 2bk5 s LYS 95 CO 0.00 0.07 0.39 -1.12 -0.36 0.00 0.00 175.35 174.34 2bk5 s SER 96 N 0.01 6.62 -0.32 1.43 0.01 -1.26 -0.46 113.70 119.73 2bk5 s SER 96 Ca 0.00 0.73 0.03 0.00 1.31 0.00 0.00 55.95 58.03 2bk5 s SER 96 Cb -0.03 -2.24 0.10 0.00 0.21 0.00 0.00 66.02 64.06 2bk5 s SER 96 CO -0.00 0.11 0.04 -0.31 0.41 0.00 0.00 173.24 173.49 2bk5 s TYR 97 N 0.19 3.26 0.45 2.43 1.51 0.84 -4.97 117.35 121.05 2bk5 s TYR 97 Ca 0.22 -2.65 -0.23 0.00 -1.01 0.00 0.00 57.07 53.40 2bk5 s TYR 97 Cb -0.15 -2.56 -0.08 0.00 -0.11 0.00 0.00 41.96 39.07 2bk5 s TYR 97 CO 0.09 -0.92 1.16 -2.14 -1.11 0.00 0.00 175.55 172.63 2bk5 s PRO 98 N 1.08 3.81 0.25 -1.71 0.02 -1.26 -1.43 135.00 135.75 2bk5 s PRO 98 Ca 0.09 1.78 -0.17 0.00 0.02 0.00 0.00 61.00 62.72 2bk5 s PRO 98 Cb -0.19 -2.45 0.01 0.00 0.02 0.00 0.00 34.50 31.90 2bk5 s PRO 98 CO -0.11 -0.51 0.57 -0.59 -0.33 0.00 0.00 177.00 176.02 2bk5 s PHE 99 N -1.53 0.07 0.19 6.54 -0.12 0.64 -4.93 117.98 118.84 2bk5 s PHE 99 Ca 0.62 -0.46 0.08 0.00 -0.05 0.00 0.00 56.93 57.12 2bk5 s PHE 99 Cb -0.29 0.40 -0.04 0.00 -0.63 0.00 0.00 43.02 42.46 2bk5 s PHE 99 CO 0.35 -1.06 -0.15 1.03 -0.05 0.00 0.00 175.22 175.34 2bk5 s ARG 100 N -3.95 1.29 0.00 1.99 0.52 -1.26 -0.58 118.95 116.95 2bk5 s ARG 100 Ca 0.16 -1.52 0.00 0.00 -0.52 0.00 0.00 55.73 53.85 2bk5 s ARG 100 Cb -0.02 -1.14 0.00 0.00 0.52 0.00 0.00 34.95 34.30 2bk5 s ARG 100 CO 0.06 0.20 0.00 0.41 0.02 0.00 0.00 175.30 175.99 2bk5 n GLY 101 N -0.15 -0.09 0.18 -3.53 0.00 -1.26 -4.79 105.19 95.56 2bk5 n GLY 101 Ca -0.10 -1.78 -0.04 0.00 0.00 0.00 0.00 46.02 44.10 2bk5 n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bk5 h PRO 102 N 0.00 0.26 -6.25 1.61 0.13 -1.96 -3.45 132.00 122.34 2bk5 h PRO 102 Ca 0.00 -0.16 -0.69 0.00 -0.87 0.00 0.00 66.00 64.28 2bk5 h PRO 102 Cb 0.00 0.02 -0.26 0.00 0.13 0.00 0.00 31.00 30.89 2bk5 h PRO 102 CO 0.00 0.73 -0.80 -0.06 -0.23 0.00 0.00 178.00 177.64 2bk5 s PHE 103 N -3.90 2.62 0.21 1.56 0.40 -1.26 -4.90 117.98 112.70 2bk5 s PHE 103 Ca -0.04 -0.32 -0.31 0.00 -0.60 0.00 0.00 56.93 55.67 2bk5 s PHE 103 Cb 0.12 -1.62 -0.10 0.00 0.51 0.00 0.00 43.02 41.93 2bk5 s PHE 103 CO 0.79 0.06 1.48 -2.14 0.70 0.00 0.00 175.22 176.11 2bk5 s PRO 104 N -0.54 4.26 0.59 0.24 0.02 -1.26 -4.94 135.00 133.37 2bk5 s PRO 104 Ca 0.07 2.30 -0.18 0.00 0.02 0.00 0.00 61.00 63.21 2bk5 s PRO 104 Cb -0.11 -3.14 -0.03 0.00 0.02 0.00 0.00 34.50 31.24 2bk5 s PRO 104 CO 0.01 -0.48 1.17 -2.14 -0.33 0.00 0.00 177.00 175.23 2bk5 s PRO 105 N 0.24 3.03 -0.02 5.54 0.02 -1.26 -5.06 135.00 137.49 2bk5 s PRO 105 Ca 0.63 1.69 0.05 0.00 0.02 0.00 0.00 61.00 63.40 2bk5 s PRO 105 Cb -0.42 -1.95 -0.01 0.00 0.02 0.00 0.00 34.50 32.14 2bk5 s PRO 105 CO 0.38 -1.12 -0.18 0.08 -0.33 0.00 0.00 177.00 175.83 2bk5 s VAL 106 N -1.77 1.46 -0.17 3.83 1.01 -1.26 -5.07 120.40 118.43 2bk5 s VAL 106 Ca 0.74 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.96 2bk5 s VAL 106 Cb -0.27 -1.22 -0.11 0.00 0.00 0.00 0.00 36.38 34.78 2bk5 s VAL 106 CO 0.33 0.41 -0.15 0.79 0.00 0.00 0.00 175.10 176.48 2bk5 n TRP 107 N 2.77 0.00 -1.68 5.22 7.02 -1.26 -4.73 117.44 124.78 2bk5 n TRP 107 Ca -0.16 0.00 -0.46 0.00 -1.02 0.00 0.00 57.50 55.86 2bk5 n TRP 107 Cb 0.53 -0.64 -0.04 0.00 -2.42 0.00 0.00 31.31 28.74 2bk5 n TRP 107 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2bk5 n ASN 108 N -3.03 3.36 -0.24 -0.99 2.85 -1.26 -4.85 115.26 111.09 2bk5 n ASN 108 Ca -0.30 1.04 -0.06 0.00 -0.11 0.00 0.00 54.58 55.15 2bk5 n ASN 108 Cb 0.81 -1.44 0.05 0.00 1.24 0.00 0.00 39.78 40.44 2bk5 n ASN 108 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2bk5 h PRO 109 N 7.15 0.97 -0.41 1.20 0.13 -1.99 0.30 132.00 139.36 2bk5 h PRO 109 Ca -0.46 -0.14 -0.08 0.00 -0.87 0.00 0.00 66.00 64.45 2bk5 h PRO 109 Cb 1.25 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 2bk5 h PRO 109 CO 0.91 0.77 -0.07 0.82 -0.23 0.00 0.00 178.00 180.20 2bk5 h ILE 110 N 0.94 1.27 -0.77 -3.56 1.08 -2.00 -1.83 117.51 112.65 2bk5 h ILE 110 Ca 0.23 -1.14 -0.05 0.00 -0.39 0.00 0.00 64.86 63.51 2bk5 h ILE 110 Cb 0.11 1.19 -0.03 0.00 -3.07 0.00 0.00 36.82 35.01 2bk5 h ILE 110 CO -0.03 0.38 0.28 0.74 -0.69 0.00 0.00 178.15 178.83 2bk5 h THR 111 N 0.58 1.26 -0.37 -0.27 2.02 -1.84 -1.38 112.91 112.91 2bk5 h THR 111 Ca 0.11 -0.86 0.03 0.00 0.77 0.00 0.00 66.41 66.46 2bk5 h THR 111 Cb 0.58 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.33 2bk5 h THR 111 CO 0.03 0.34 0.17 0.22 0.37 0.00 0.00 175.52 176.66 2bk5 h TYR 112 N 1.13 0.31 -0.91 3.16 5.03 -0.18 -0.10 116.97 125.42 2bk5 h TYR 112 Ca 0.25 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.57 2bk5 h TYR 112 Cb 0.25 -0.09 -0.04 0.00 1.55 0.00 0.00 36.73 38.40 2bk5 h TYR 112 CO 0.02 0.16 0.51 -0.07 -1.32 0.00 0.00 178.16 177.46 2bk5 h LEU 113 N 0.36 1.13 -0.09 2.82 3.38 -1.04 -0.52 115.31 121.34 2bk5 h LEU 113 Ca 0.16 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2bk5 h LEU 113 Cb 0.09 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2bk5 h LEU 113 CO -0.13 0.89 -0.01 -0.78 0.09 0.00 0.00 178.44 178.50 2bk5 h ASP 114 N 1.27 0.16 -0.14 -0.43 3.58 -0.79 -0.57 116.42 119.51 2bk5 h ASP 114 Ca 0.32 -0.35 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2bk5 h ASP 114 Cb 0.00 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 2bk5 h ASP 114 CO -0.05 0.47 0.08 0.45 -2.88 0.00 0.00 179.24 177.30 2bk5 h HIS 115 N -0.15 0.14 -0.41 0.28 3.86 -0.96 -1.36 115.15 116.56 2bk5 h HIS 115 Ca 0.02 0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.29 2bk5 h HIS 115 Cb 0.40 -0.05 -0.05 0.00 1.06 0.00 0.00 27.41 28.78 2bk5 h HIS 115 CO 0.05 0.09 0.14 -0.97 0.86 0.00 0.00 177.93 178.09 2bk5 h ASN 116 N 0.16 0.15 -0.30 2.45 -0.73 -1.03 -2.37 115.58 113.90 2bk5 h ASN 116 Ca 0.05 0.05 -0.06 0.00 1.87 0.00 0.00 56.30 58.21 2bk5 h ASN 116 Cb -0.00 0.03 -0.02 0.00 0.27 0.00 0.00 38.32 38.60 2bk5 h ASN 116 CO -0.03 0.12 -0.01 -1.13 -0.37 0.00 0.00 177.43 176.01 2bk5 h ASN 117 N 0.30 0.62 0.42 1.15 -0.73 -0.96 -2.45 115.58 113.93 2bk5 h ASN 117 Ca 0.19 -0.14 -0.02 0.00 1.87 0.00 0.00 56.30 58.20 2bk5 h ASN 117 Cb 0.18 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 38.61 2bk5 h ASN 117 CO -0.20 0.69 -0.20 0.15 -0.37 0.00 0.00 177.43 177.51 2bk5 h PHE 118 N 0.61 -0.53 -0.57 0.67 3.57 -0.72 0.16 116.94 120.14 2bk5 h PHE 118 Ca 0.12 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 2bk5 h PHE 118 Cb 0.40 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 2bk5 h PHE 118 CO 0.02 -0.27 0.35 -1.49 -2.23 0.00 0.00 178.31 174.68 2bk5 h TRP 119 N -0.67 0.75 -0.42 0.41 4.06 -1.51 -1.64 115.95 116.92 2bk5 h TRP 119 Ca -0.06 -0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.90 2bk5 h TRP 119 Cb 0.49 -0.25 -0.03 0.00 -1.00 0.00 0.00 29.16 28.38 2bk5 h TRP 119 CO -0.02 0.51 0.26 -0.09 -3.56 0.00 0.00 178.44 175.54 2bk5 h ARG 120 N 0.77 0.51 -0.60 0.49 2.43 -1.36 -2.48 114.38 114.14 2bk5 h ARG 120 Ca 0.21 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.26 2bk5 h ARG 120 Cb -0.02 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 2bk5 h ARG 120 CO -0.04 0.34 0.04 1.15 -1.51 0.00 0.00 179.97 179.95 2bk5 h THR 121 N 0.53 1.26 -0.53 0.20 2.02 -0.42 0.14 112.91 116.11 2bk5 h THR 121 Ca 0.16 -1.10 0.08 0.00 0.77 0.00 0.00 66.41 66.32 2bk5 h THR 121 Cb -0.02 0.78 -0.06 0.00 -1.74 0.00 0.00 68.15 67.11 2bk5 h THR 121 CO -0.06 0.40 0.18 0.24 0.37 0.00 0.00 175.52 176.65 2bk5 h MET 122 N 0.94 0.35 -0.31 6.66 2.86 -1.10 0.35 114.93 124.69 2bk5 h MET 122 Ca 0.18 -0.02 -0.18 0.00 -2.06 0.00 0.00 59.70 57.62 2bk5 h MET 122 Cb 0.51 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.09 2bk5 h MET 122 CO 0.02 0.23 -0.51 -0.44 1.06 0.00 0.00 176.91 177.27 2bk5 h ASP 123 N 0.36 0.97 -0.36 1.22 3.32 -1.13 -1.64 116.42 119.16 2bk5 h ASP 123 Ca 0.26 -0.50 0.05 0.00 0.02 0.00 0.00 57.03 56.85 2bk5 h ASP 123 Cb 0.30 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 2bk5 h ASP 123 CO -0.27 1.30 0.11 0.44 -1.72 0.00 0.00 179.24 179.10 2bk5 h ASP 124 N 0.69 0.10 -0.67 6.45 3.32 -0.30 -1.98 116.42 124.01 2bk5 h ASP 124 Ca 0.03 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 2bk5 h ASP 124 Cb 1.11 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.68 2bk5 h ASP 124 CO 0.12 0.09 0.24 0.24 -1.72 0.00 0.00 179.24 178.20 2bk5 h MET 125 N 0.25 1.03 -0.51 3.56 2.86 -0.92 -2.83 114.93 118.37 2bk5 h MET 125 Ca 0.17 -0.21 0.05 0.00 -2.06 0.00 0.00 59.70 57.65 2bk5 h MET 125 Cb 0.16 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 2bk5 h MET 125 CO -0.19 0.88 0.34 0.78 1.06 0.00 0.00 176.91 179.78 2bk5 h GLY 126 N 0.97 0.60 2.00 8.32 0.00 -0.80 -1.95 103.07 112.22 2bk5 h GLY 126 Ca 0.22 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2bk5 h GLY 126 CO -0.01 0.16 0.00 3.21 0.00 0.00 0.00 176.54 179.90 2bk5 h ARG 127 N 0.51 0.00 -0.09 4.80 3.08 -1.11 -1.01 114.38 120.55 2bk5 h ARG 127 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2bk5 h ARG 127 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2bk5 h ARG 127 CO -0.06 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.23 2bk5 n GLU 128 N -2.94 1.88 -3.77 0.04 -0.58 -0.73 -4.83 120.64 109.70 2bk5 n GLU 128 Ca -0.02 -1.29 -0.37 0.00 -0.42 0.00 0.00 57.16 55.06 2bk5 n GLU 128 Cb 0.14 -1.46 -0.13 0.00 -0.57 0.00 0.00 31.44 29.43 2bk5 n GLU 128 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2bk5 s ILE 129 N -1.89 3.69 0.21 -3.67 1.01 -0.38 -4.17 121.20 115.98 2bk5 s ILE 129 Ca 0.35 -1.13 -0.31 0.00 0.00 0.00 0.00 60.65 59.56 2bk5 s ILE 129 Cb 0.20 -3.08 -0.11 0.00 0.01 0.00 0.00 42.46 39.49 2bk5 s ILE 129 CO 0.31 -0.14 1.62 -2.84 0.00 0.00 0.00 174.94 173.88 2bk5 s PRO 130 N 1.39 4.17 0.26 2.79 0.02 -1.26 -4.90 135.00 137.47 2bk5 s PRO 130 Ca -0.02 2.48 -0.04 0.00 0.02 0.00 0.00 61.00 63.44 2bk5 s PRO 130 Cb -0.19 -3.10 0.34 0.00 0.02 0.00 0.00 34.50 31.57 2bk5 s PRO 130 CO 0.02 -0.65 1.90 0.77 -0.33 0.00 0.00 177.00 178.71 2bk5 h SER 131 N 6.38 1.08 -0.06 2.53 0.02 -1.94 -2.11 113.55 119.45 2bk5 h SER 131 Ca -0.44 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2bk5 h SER 131 Cb 1.21 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.50 2bk5 h SER 131 CO 0.90 0.73 0.00 -0.90 -1.14 0.00 0.00 176.83 176.42 2bk5 n ASP 132 N -4.46 1.60 -2.72 3.07 5.75 -1.26 -4.54 116.55 113.99 2bk5 n ASP 132 Ca 0.14 -1.57 -0.07 0.00 -0.01 0.00 0.00 54.79 53.28 2bk5 n ASP 132 Cb 0.11 -0.03 0.07 0.00 -1.03 0.00 0.00 41.12 40.25 2bk5 n ASP 132 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bk5 n ALA 133 N 0.25 -1.76 0.19 2.12 0.00 -0.94 -5.02 120.51 115.35 2bk5 n ALA 133 Ca 0.18 -1.13 0.13 0.00 0.00 0.00 0.00 53.44 52.62 2bk5 n ALA 133 Cb 0.36 -1.78 0.71 0.00 0.00 0.00 0.00 19.45 18.73 2bk5 n ALA 133 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2bk5 h PRO 134 N 3.35 0.00 0.00 0.00 0.13 -1.63 0.80 132.00 134.65 2bk5 h PRO 134 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 2bk5 h PRO 134 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2bk5 h PRO 134 CO 0.15 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.25 2bk5 n TRP 135 N -4.32 0.00 0.93 1.56 2.14 -1.26 -1.71 117.44 114.78 2bk5 n TRP 135 Ca 0.01 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.70 2bk5 n TRP 135 Cb 0.26 -0.47 0.29 0.00 -0.81 0.00 0.00 31.31 30.58 2bk5 n TRP 135 CO 0.00 0.00 0.00 1.63 2.07 0.00 0.00 177.69 181.39 2bk5 n LYS 136 N -1.47 2.09 -1.71 -2.67 5.02 0.28 -4.77 118.16 114.92 2bk5 n LYS 136 Ca 0.01 -1.62 -0.42 0.00 -2.02 0.00 0.00 58.31 54.26 2bk5 n LYS 136 Cb 0.05 -1.46 -0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2bk5 n LYS 136 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bk5 n ALA 137 N 0.88 1.53 -0.35 7.82 0.00 -0.70 -4.88 120.51 124.82 2bk5 n ALA 137 Ca 0.17 0.35 0.13 0.00 0.00 0.00 0.00 53.44 54.09 2bk5 n ALA 137 Cb 0.48 -2.29 0.33 0.00 0.00 0.00 0.00 19.45 17.97 2bk5 n ALA 137 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2bk5 h PRO 138 N 2.60 0.74 -0.72 0.00 0.11 -1.92 -1.12 132.00 131.69 2bk5 h PRO 138 Ca -0.47 -0.04 -0.40 0.00 0.11 0.00 0.00 66.00 65.19 2bk5 h PRO 138 Cb 1.28 -0.17 -0.23 0.00 0.11 0.00 0.00 31.00 31.99 2bk5 h PRO 138 CO 0.63 0.49 0.30 1.28 -0.21 0.00 0.00 178.00 180.48 2bk5 n LEU 139 N -4.74 5.69 -0.14 2.35 4.77 -1.26 -4.79 117.00 118.87 2bk5 n LEU 139 Ca 0.23 -3.82 -0.04 0.00 -0.03 0.00 0.00 56.01 52.35 2bk5 n LEU 139 Cb 0.57 -0.75 0.02 0.00 -2.33 0.00 0.00 43.42 40.93 2bk5 n LEU 139 CO 0.22 1.24 0.77 0.00 -1.33 0.00 0.00 177.39 178.30 2bk5 h ALA 140 N 1.17 0.29 -0.18 -1.18 0.00 -1.50 -0.54 119.26 117.31 2bk5 h ALA 140 Ca 0.45 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.50 2bk5 h ALA 140 Cb 2.09 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 20.22 2bk5 h ALA 140 CO 0.85 -0.45 -0.03 0.93 0.00 0.00 0.00 179.25 180.54 2bk5 h GLU 141 N -0.01 0.34 -0.43 0.00 5.08 -1.87 0.17 114.58 117.87 2bk5 h GLU 141 Ca 0.22 -0.13 0.08 0.00 -1.00 0.00 0.00 59.36 58.53 2bk5 h GLU 141 Cb 0.34 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.50 2bk5 h GLU 141 CO -0.47 0.59 0.04 1.49 -1.00 0.00 0.00 179.01 179.67 2bk5 h GLU 142 N 0.06 0.15 -0.02 2.33 4.81 -1.86 -0.93 114.58 119.14 2bk5 h GLU 142 Ca 0.05 -0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 59.10 2bk5 h GLU 142 Cb 0.46 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 2bk5 h GLU 142 CO 0.02 0.10 -0.75 -1.49 -0.73 0.00 0.00 179.01 176.15 2bk5 h TRP 143 N 0.16 0.19 0.00 0.92 6.55 -0.98 -3.13 115.95 119.66 2bk5 h TRP 143 Ca 0.21 -0.09 -0.04 0.00 0.95 0.00 0.00 58.89 59.92 2bk5 h TRP 143 Cb 0.29 -0.03 -0.01 0.00 -0.86 0.00 0.00 29.16 28.56 2bk5 h TRP 143 CO -0.25 0.84 -0.21 0.22 -1.05 0.00 0.00 178.44 177.99 2bk5 h ASP 144 N 0.09 0.00 -0.19 -3.49 3.58 -0.33 -2.07 116.42 114.00 2bk5 h ASP 144 Ca -0.02 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2bk5 h ASP 144 Cb 1.32 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.37 2bk5 h ASP 144 CO 0.11 0.21 0.00 0.59 -2.88 0.00 0.00 179.24 177.27 2bk5 n ASN 145 N -3.27 1.62 -4.29 2.28 3.02 -0.38 -0.45 115.26 113.80 2bk5 n ASN 145 Ca 0.01 -1.75 -0.24 0.00 -0.03 0.00 0.00 54.58 52.57 2bk5 n ASN 145 Cb 0.48 -0.12 -0.12 0.00 -0.61 0.00 0.00 39.78 39.41 2bk5 n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bk5 s MET 146 N -1.75 1.13 0.65 3.52 0.23 -1.20 -4.90 119.30 116.98 2bk5 s MET 146 Ca 0.30 -1.18 -0.09 0.00 -1.03 0.00 0.00 55.69 53.69 2bk5 s MET 146 Cb 0.16 -1.37 0.01 0.00 -1.53 0.00 0.00 34.83 32.10 2bk5 s MET 146 CO 0.24 0.31 1.01 0.95 -2.03 0.00 0.00 175.02 175.51 2bk5 s THR 147 N -1.25 3.58 0.50 3.16 -4.23 -1.26 -0.82 115.64 115.31 2bk5 s THR 147 Ca 0.07 0.28 0.16 0.00 -1.18 0.00 0.00 61.69 61.03 2bk5 s THR 147 Cb -0.10 -3.47 0.24 0.00 1.34 0.00 0.00 72.50 70.52 2bk5 s THR 147 CO 0.04 -0.57 2.10 0.24 -0.54 0.00 0.00 174.62 175.90 2bk5 h MET 148 N -0.44 0.00 -0.20 3.99 2.86 -0.45 -2.29 114.93 118.40 2bk5 h MET 148 Ca -0.45 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.19 2bk5 h MET 148 Cb 1.25 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.90 2bk5 h MET 148 CO 0.62 0.07 0.12 -0.22 1.06 0.00 0.00 176.91 178.56 2bk5 h LYS 149 N 0.00 0.27 -0.72 1.72 3.64 -1.52 0.02 116.57 119.97 2bk5 h LYS 149 Ca -0.00 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2bk5 h LYS 149 Cb 0.12 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.85 2bk5 h LYS 149 CO 0.01 0.21 0.47 0.93 -2.27 0.00 0.00 179.45 178.80 2bk5 h GLU 150 N 0.24 0.92 -0.28 1.90 5.08 -1.76 -0.25 114.58 120.42 2bk5 h GLU 150 Ca 0.07 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2bk5 h GLU 150 Cb 0.01 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 2bk5 h GLU 150 CO -0.01 0.61 0.16 1.25 -1.00 0.00 0.00 179.01 180.01 2bk5 h LEU 151 N 0.95 0.36 -0.72 1.33 5.85 -1.12 -1.81 115.31 120.15 2bk5 h LEU 151 Ca 0.27 -0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 2bk5 h LEU 151 Cb -0.07 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 2bk5 h LEU 151 CO -0.08 0.34 0.28 -0.07 -0.34 0.00 0.00 178.44 178.58 2bk5 h LEU 152 N 0.34 0.99 -1.26 2.25 3.38 -0.76 0.18 115.31 120.44 2bk5 h LEU 152 Ca 0.10 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 57.94 2bk5 h LEU 152 Cb 0.06 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 2bk5 h LEU 152 CO -0.02 0.89 0.52 0.44 0.09 0.00 0.00 178.44 180.37 2bk5 h ASP 153 N 1.03 0.81 -0.08 -0.43 3.32 -0.87 0.56 116.42 120.76 2bk5 h ASP 153 Ca 0.24 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.21 2bk5 h ASP 153 Cb 0.21 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2bk5 h ASP 153 CO -0.02 0.55 -0.22 0.11 -1.72 0.00 0.00 179.24 177.94 2bk5 h LYS 154 N 0.94 0.29 0.16 3.56 1.57 -0.77 -3.39 116.57 118.93 2bk5 h LYS 154 Ca 0.33 -0.21 -0.30 0.00 -1.87 0.00 0.00 60.65 58.60 2bk5 h LYS 154 Cb 0.12 0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.47 2bk5 h LYS 154 CO -0.10 0.82 -1.39 -0.07 -0.57 0.00 0.00 179.45 178.14 2bk5 h LEU 155 N -0.18 0.52 -8.62 2.94 3.38 -0.68 -3.44 115.31 109.22 2bk5 h LEU 155 Ca -0.00 -0.59 -0.65 0.00 0.09 0.00 0.00 57.88 56.72 2bk5 h LEU 155 Cb 0.83 -0.17 -0.15 0.00 0.09 0.00 0.00 40.66 41.27 2bk5 h LEU 155 CO 0.05 1.47 0.14 0.00 0.09 0.00 0.00 178.44 180.19 2bk5 n TRP 157 N 6.25 0.00 -4.53 0.00 7.02 -1.26 -4.84 117.44 120.08 2bk5 n TRP 157 Ca -0.01 0.00 -0.27 0.00 -1.02 0.00 0.00 57.50 56.19 2bk5 n TRP 157 Cb 0.48 -0.31 -0.13 0.00 -2.42 0.00 0.00 31.31 28.92 2bk5 n TRP 157 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2bk5 s THR 158 N -2.88 2.00 0.31 -0.99 -4.23 -1.26 -5.03 115.64 103.56 2bk5 s THR 158 Ca 0.16 -1.52 0.03 0.00 -1.18 0.00 0.00 61.69 59.18 2bk5 s THR 158 Cb 0.19 -1.76 0.14 0.00 1.34 0.00 0.00 72.50 72.40 2bk5 s THR 158 CO 0.59 0.14 1.83 -0.33 -0.54 0.00 0.00 174.62 176.31 2bk5 h GLU 159 N 4.31 0.56 -0.11 3.99 4.39 -1.99 -2.23 114.58 123.51 2bk5 h GLU 159 Ca -0.47 -0.14 0.05 0.00 0.34 0.00 0.00 59.36 59.13 2bk5 h GLU 159 Cb 1.16 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 29.69 2bk5 h GLU 159 CO 0.41 0.62 -0.27 1.03 -1.16 0.00 0.00 179.01 179.64 2bk5 h SER 160 N 0.53 -0.82 -0.42 1.42 0.87 -1.99 0.97 113.55 114.11 2bk5 h SER 160 Ca 0.11 0.13 -0.04 0.00 -1.23 0.00 0.00 61.79 60.76 2bk5 h SER 160 Cb 0.41 0.36 -0.02 0.00 -0.44 0.00 0.00 62.40 62.70 2bk5 h SER 160 CO 0.02 -0.32 0.12 0.00 -0.53 0.00 0.00 176.83 176.13 2bk5 h ALA 161 N 0.55 0.55 -0.86 6.23 0.00 -1.87 -2.38 119.26 121.47 2bk5 h ALA 161 Ca 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2bk5 h ALA 161 Cb 0.49 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2bk5 h ALA 161 CO -0.31 0.20 0.47 -0.22 0.00 0.00 0.00 179.25 179.40 2bk5 h LYS 162 N 0.54 1.20 -0.37 0.00 3.64 -1.11 0.15 116.57 120.62 2bk5 h LYS 162 Ca 0.13 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2bk5 h LYS 162 Cb 0.27 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2bk5 h LYS 162 CO -0.00 0.88 0.13 1.96 -2.27 0.00 0.00 179.45 180.15 2bk5 h GLN 163 N 1.21 0.56 -0.43 1.90 4.20 -0.69 -0.21 115.11 121.65 2bk5 h GLN 163 Ca 0.30 -0.12 -0.09 0.00 0.06 0.00 0.00 58.65 58.81 2bk5 h GLN 163 Cb 0.03 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 2bk5 h GLN 163 CO -0.05 0.57 -0.07 1.25 -0.67 0.00 0.00 178.83 179.86 2bk5 h LEU 164 N 0.45 0.80 -1.08 1.46 5.85 -1.10 -2.14 115.31 119.54 2bk5 h LEU 164 Ca 0.12 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 2bk5 h LEU 164 Cb 0.23 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2bk5 h LEU 164 CO -0.01 0.96 0.51 0.00 -0.34 0.00 0.00 178.44 179.57 2bk5 h ALA 165 N 0.87 1.32 -0.25 1.25 0.00 -0.63 0.29 119.26 122.11 2bk5 h ALA 165 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2bk5 h ALA 165 Cb 0.59 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2bk5 h ALA 165 CO 0.04 0.59 0.05 1.15 0.00 0.00 0.00 179.25 181.07 2bk5 h THR 166 N 1.16 1.22 -0.58 0.00 2.02 -0.93 -1.75 112.91 114.05 2bk5 h THR 166 Ca 0.30 -0.75 0.04 0.00 0.77 0.00 0.00 66.41 66.78 2bk5 h THR 166 Cb -0.06 1.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.55 2bk5 h THR 166 CO -0.06 0.24 0.34 0.25 0.37 0.00 0.00 175.52 176.66 2bk5 h LEU 167 N 0.22 0.53 -0.47 2.58 6.46 -1.02 -0.60 115.31 123.01 2bk5 h LEU 167 Ca 0.08 0.01 0.06 0.00 -0.12 0.00 0.00 57.88 57.91 2bk5 h LEU 167 Cb 0.31 -0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 40.10 2bk5 h LEU 167 CO 0.00 0.36 0.18 0.15 -0.62 0.00 0.00 178.44 178.51 2bk5 h PHE 168 N 0.65 0.32 0.11 1.25 3.57 -0.73 0.14 116.94 122.26 2bk5 h PHE 168 Ca 0.24 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 2bk5 h PHE 168 Cb 0.08 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.75 2bk5 h PHE 168 CO -0.07 0.12 -0.06 0.28 -2.23 0.00 0.00 178.31 176.35 2bk5 h VAL 169 N 0.36 0.96 -0.87 1.41 2.07 -0.93 -0.91 116.25 118.35 2bk5 h VAL 169 Ca 0.22 -0.29 0.11 0.00 0.82 0.00 0.00 66.70 67.56 2bk5 h VAL 169 Cb 0.22 1.15 -0.08 0.00 -1.52 0.00 0.00 31.29 31.06 2bk5 h VAL 169 CO -0.22 0.07 0.50 0.78 0.02 0.00 0.00 177.57 178.72 2bk5 h ASN 170 N -0.29 0.70 -0.10 0.57 -0.26 -0.65 -1.72 115.58 113.83 2bk5 h ASN 170 Ca -0.02 0.06 -0.18 0.00 -0.56 0.00 0.00 56.30 55.60 2bk5 h ASN 170 Cb 0.23 -0.08 0.01 0.00 -1.06 0.00 0.00 38.32 37.43 2bk5 h ASN 170 CO 0.03 0.38 -0.63 0.25 -1.06 0.00 0.00 177.43 176.39 2bk5 h LEU 171 N 0.80 0.73 -0.50 1.61 5.85 -0.63 -0.70 115.31 122.48 2bk5 h LEU 171 Ca 0.43 -0.65 -0.13 0.00 0.84 0.00 0.00 57.88 58.37 2bk5 h LEU 171 Cb 0.45 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2bk5 h LEU 171 CO -0.28 1.27 -0.22 0.00 -0.34 0.00 0.00 178.44 178.88 2bk5 n VAL 173 N -4.11 0.67 -4.32 0.00 0.24 -0.68 -4.96 118.33 105.18 2bk5 n VAL 173 Ca 0.00 -0.75 -0.37 0.00 -2.04 0.00 0.00 64.34 61.19 2bk5 n VAL 173 Cb 0.46 0.51 -0.05 0.00 -1.47 0.00 0.00 33.84 33.29 2bk5 n VAL 173 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2bk5 n THR 174 N -0.43 -0.91 -3.86 3.34 -2.24 -0.27 -4.57 114.28 105.34 2bk5 n THR 174 Ca 0.03 -0.13 -0.09 0.00 -2.27 0.00 0.00 64.05 61.59 2bk5 n THR 174 Cb 0.49 -1.30 -0.08 0.00 -2.10 0.00 0.00 70.33 67.34 2bk5 n THR 174 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bk5 s ALA 175 N -3.51 -0.22 0.49 6.98 0.00 -1.25 -1.42 121.76 122.84 2bk5 s ALA 175 Ca 0.59 -0.57 -0.20 0.00 0.00 0.00 0.00 51.96 51.78 2bk5 s ALA 175 Cb -0.33 0.43 -0.08 0.00 0.00 0.00 0.00 23.12 23.14 2bk5 s ALA 175 CO 0.97 -0.47 1.02 -1.21 0.00 0.00 0.00 175.76 176.07 2bk5 s GLU 176 N -3.59 3.82 0.44 0.00 0.41 -1.26 -3.69 118.70 114.82 2bk5 s GLU 176 Ca 0.03 1.29 0.10 0.00 -0.41 0.00 0.00 54.97 55.98 2bk5 s GLU 176 Cb 0.04 -2.10 0.97 0.00 -1.78 0.00 0.00 34.13 31.25 2bk5 s GLU 176 CO -0.10 -0.41 2.07 1.79 -0.49 0.00 0.00 175.26 178.12 2bk5 h THR 177 N 1.46 1.05 0.00 3.63 1.35 -1.94 -0.81 112.91 117.65 2bk5 h THR 177 Ca -0.49 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 2bk5 h THR 177 Cb 1.21 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 2bk5 h THR 177 CO 0.59 0.08 0.00 0.00 -0.25 0.00 0.00 175.52 175.94 2bk5 n HIS 178 N -4.49 0.42 0.09 4.73 1.44 -1.26 -1.43 115.22 114.73 2bk5 n HIS 178 Ca 0.03 0.13 -0.01 0.00 -2.01 0.00 0.00 57.72 55.86 2bk5 n HIS 178 Cb 0.11 -0.71 -0.04 0.00 0.12 0.00 0.00 29.99 29.47 2bk5 n HIS 178 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 2bk5 h GLU 179 N 0.00 0.00 -6.37 -1.40 5.08 -1.51 -3.47 114.58 106.91 2bk5 h GLU 179 Ca 0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 2bk5 h GLU 179 Cb 0.55 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.62 2bk5 h GLU 179 CO 0.00 0.54 -0.73 0.14 -1.00 0.00 0.00 179.01 177.96 2bk5 s VAL 180 N -2.88 3.45 0.31 3.13 -7.23 -1.21 -4.15 120.40 111.82 2bk5 s VAL 180 Ca 0.01 -0.89 -0.29 0.00 -1.81 0.00 0.00 61.98 59.00 2bk5 s VAL 180 Cb 0.08 -2.50 -0.11 0.00 0.56 0.00 0.00 36.38 34.41 2bk5 s VAL 180 CO 0.78 0.36 1.51 -0.55 -0.31 0.00 0.00 175.10 176.90 2bk5 s SER 181 N -1.47 6.45 0.14 4.85 0.15 -0.03 -1.30 113.70 122.49 2bk5 s SER 181 Ca 0.17 2.91 -0.14 0.00 0.70 0.00 0.00 55.95 59.58 2bk5 s SER 181 Cb -0.11 -2.64 0.01 0.00 -1.71 0.00 0.00 66.02 61.57 2bk5 s SER 181 CO 0.07 -0.84 1.65 0.00 1.20 0.00 0.00 173.24 175.33 2bk5 h ALA 182 N 4.26 0.59 -0.23 5.45 0.00 -0.96 -1.23 119.26 127.15 2bk5 h ALA 182 Ca -0.48 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.27 2bk5 h ALA 182 Cb 1.23 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2bk5 h ALA 182 CO 0.74 0.26 0.04 1.25 0.00 0.00 0.00 179.25 181.53 2bk5 h LEU 183 N 0.59 -0.00 -0.35 0.00 5.85 -1.62 -0.12 115.31 119.66 2bk5 h LEU 183 Ca 0.14 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 2bk5 h LEU 183 Cb 0.29 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2bk5 h LEU 183 CO -0.00 0.03 0.19 -0.25 -0.34 0.00 0.00 178.44 178.06 2bk5 h TRP 184 N 0.12 0.48 -0.54 1.25 7.01 -1.84 -0.53 115.95 121.90 2bk5 h TRP 184 Ca 0.10 -0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.04 2bk5 h TRP 184 Cb 0.11 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 26.99 2bk5 h TRP 184 CO -0.16 0.39 0.16 0.35 -2.79 0.00 0.00 178.44 176.39 2bk5 h PHE 185 N 0.43 0.88 -0.88 2.65 3.57 -0.91 0.12 116.94 122.80 2bk5 h PHE 185 Ca 0.12 -0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 2bk5 h PHE 185 Cb 0.07 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.52 2bk5 h PHE 185 CO -0.03 0.75 0.45 -0.07 -2.23 0.00 0.00 178.31 177.19 2bk5 h LEU 186 N 0.75 1.13 -0.33 0.59 3.38 -0.89 -1.30 115.31 118.63 2bk5 h LEU 186 Ca 0.17 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2bk5 h LEU 186 Cb 0.29 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2bk5 h LEU 186 CO -0.00 0.92 0.21 -0.25 0.09 0.00 0.00 178.44 179.40 2bk5 h TRP 187 N 1.24 0.43 -0.62 1.13 7.01 -0.74 -1.76 115.95 122.65 2bk5 h TRP 187 Ca 0.31 0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.36 2bk5 h TRP 187 Cb 0.07 -0.14 -0.05 0.00 -2.10 0.00 0.00 29.16 26.94 2bk5 h TRP 187 CO 0.01 0.31 0.34 -0.92 -2.79 0.00 0.00 178.44 175.39 2bk5 h TYR 188 N 0.44 0.62 -0.16 2.65 3.20 -0.06 0.11 116.97 123.77 2bk5 h TYR 188 Ca 0.12 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 2bk5 h TYR 188 Cb -0.00 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.07 2bk5 h TYR 188 CO -0.04 0.30 -0.07 0.28 -1.64 0.00 0.00 178.16 176.99 2bk5 h VAL 189 N 0.63 1.31 -1.00 1.81 2.07 -1.23 -3.08 116.25 116.76 2bk5 h VAL 189 Ca 0.27 -1.09 0.02 0.00 0.82 0.00 0.00 66.70 66.73 2bk5 h VAL 189 Cb 0.17 1.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 2bk5 h VAL 189 CO -0.17 0.32 0.66 0.50 0.02 0.00 0.00 177.57 178.90 2bk5 h LYS 190 N -0.00 1.29 0.00 1.57 3.11 -0.72 -1.28 116.57 120.53 2bk5 h LYS 190 Ca 0.04 -0.08 0.00 0.00 -2.81 0.00 0.00 60.65 57.80 2bk5 h LYS 190 Cb 0.53 -0.29 0.00 0.00 -1.00 0.00 0.00 32.23 31.47 2bk5 h LYS 190 CO 0.02 0.85 0.00 0.00 -2.81 0.00 0.00 179.45 177.51 2bk5 n GLN 191 N -4.41 0.23 -0.10 1.90 -0.00 0.34 -1.25 117.38 114.10 2bk5 n GLN 191 Ca 0.12 0.06 0.12 0.00 -0.00 0.00 0.00 57.00 57.30 2bk5 n GLN 191 Cb 0.04 -1.50 0.27 0.00 -0.00 0.00 0.00 30.24 29.05 2bk5 n GLN 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2bk5 n GLY 193 N 1.33 0.81 0.00 0.00 0.00 -0.38 -4.38 105.19 102.57 2bk5 n GLY 193 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2bk5 n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bk5 n GLY 194 N -2.09 0.75 0.18 -0.02 0.00 -0.54 -4.49 105.19 98.97 2bk5 n GLY 194 Ca 0.00 -2.16 -0.09 0.00 0.00 0.00 0.00 46.02 43.77 2bk5 n GLY 194 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2bk5 h THR 195 N 0.00 1.17 -0.14 2.61 1.35 -1.90 -1.44 112.91 114.56 2bk5 h THR 195 Ca 0.00 -0.49 -0.00 0.00 -0.55 0.00 0.00 66.41 65.36 2bk5 h THR 195 Cb 0.00 0.81 -0.01 0.00 -1.73 0.00 0.00 68.15 67.22 2bk5 h THR 195 CO 0.00 0.18 0.07 0.74 -0.25 0.00 0.00 175.52 176.26 2bk5 h THR 196 N 0.46 1.12 -0.48 6.82 2.02 -1.96 -2.03 112.91 118.86 2bk5 h THR 196 Ca 0.13 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 2bk5 h THR 196 Cb 0.13 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2bk5 h THR 196 CO -0.02 0.11 0.21 -0.09 0.37 0.00 0.00 175.52 176.11 2bk5 h ARG 197 N 0.11 0.71 -0.07 6.66 9.65 -1.74 -1.16 114.38 128.54 2bk5 h ARG 197 Ca 0.05 -0.12 -0.11 0.00 -1.10 0.00 0.00 59.98 58.70 2bk5 h ARG 197 Cb 0.11 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 28.55 2bk5 h ARG 197 CO -0.01 0.61 -0.46 0.97 2.80 0.00 0.00 179.97 183.89 2bk5 h ILE 198 N 0.63 1.33 0.00 1.20 2.10 -1.23 -1.36 117.51 120.19 2bk5 h ILE 198 Ca 0.16 -1.62 0.00 0.00 1.08 0.00 0.00 64.86 64.49 2bk5 h ILE 198 Cb 0.15 1.78 0.00 0.00 -1.09 0.00 0.00 36.82 37.67 2bk5 h ILE 198 CO -0.02 0.48 -1.12 0.33 -1.08 0.00 0.00 178.15 176.73 2bk5 n PHE 199 N -3.99 0.20 -3.00 2.19 7.35 -0.77 -4.45 117.46 115.01 2bk5 n PHE 199 Ca -0.02 0.06 -0.36 0.00 -0.76 0.00 0.00 57.45 56.37 2bk5 n PHE 199 Cb 0.50 -0.39 -0.06 0.00 0.35 0.00 0.00 39.48 39.88 2bk5 n PHE 199 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2bk5 s SER 200 N -3.87 7.13 0.00 -2.13 0.01 -0.45 -4.95 113.70 109.43 2bk5 s SER 200 Ca 0.03 1.55 0.00 0.00 1.31 0.00 0.00 55.95 58.84 2bk5 s SER 200 Cb 0.15 -2.47 0.00 0.00 0.21 0.00 0.00 66.02 63.91 2bk5 s SER 200 CO 0.82 -0.02 0.00 0.41 0.41 0.00 0.00 173.24 174.86 2bk5 n THR 201 N 0.58 0.00 -1.68 1.44 -1.04 -1.26 -2.39 114.28 109.94 2bk5 n THR 201 Ca -0.00 0.03 -0.47 0.00 -2.04 0.00 0.00 64.05 61.56 2bk5 n THR 201 Cb 0.51 -0.31 -0.04 0.00 -1.82 0.00 0.00 70.33 68.67 2bk5 n THR 201 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2bk5 n THR 202 N -0.81 0.32 -1.61 12.58 -1.04 -1.26 -1.23 114.28 121.23 2bk5 n THR 202 Ca 0.00 -0.06 -0.15 0.00 -2.04 0.00 0.00 64.05 61.81 2bk5 n THR 202 Cb 0.00 -1.75 -0.05 0.00 -1.82 0.00 0.00 70.33 66.71 2bk5 n THR 202 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2bk5 n ASN 203 N 5.19 -4.71 -0.74 8.00 5.15 -1.26 -4.98 115.26 121.91 2bk5 n ASN 203 Ca 0.20 0.28 0.00 0.00 -0.60 0.00 0.00 54.58 54.46 2bk5 n ASN 203 Cb 0.30 -3.58 0.00 0.00 -0.53 0.00 0.00 39.78 35.96 2bk5 n ASN 203 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2bk5 n GLY 204 N -1.14 4.11 0.31 8.20 0.00 -0.37 -4.78 105.19 111.53 2bk5 n GLY 204 Ca -0.15 -1.53 0.18 0.00 0.00 0.00 0.00 46.02 44.52 2bk5 n GLY 204 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bk5 h GLY 205 N 0.00 0.00 -3.19 -0.02 0.00 -0.87 -2.51 103.07 96.48 2bk5 h GLY 205 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2bk5 h GLY 205 CO 0.00 0.00 0.03 -1.06 0.00 0.00 0.00 176.54 175.51 2bk5 n GLN 206 N -3.56 4.40 -0.17 4.80 3.00 -1.01 -3.57 117.38 121.28 2bk5 n GLN 206 Ca -0.03 -3.11 -0.07 0.00 -0.01 0.00 0.00 57.00 53.78 2bk5 n GLN 206 Cb 0.08 -2.18 0.09 0.00 0.00 0.00 0.00 30.24 28.22 2bk5 n GLN 206 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 2bk5 h GLU 207 N 3.42 0.95 -4.49 -1.09 4.81 -1.17 -3.42 114.58 113.59 2bk5 h GLU 207 Ca 0.03 -0.28 -0.18 0.00 -0.13 0.00 0.00 59.36 58.79 2bk5 h GLU 207 Cb 1.92 -0.10 -0.15 0.00 0.63 0.00 0.00 28.75 31.06 2bk5 h GLU 207 CO 0.47 0.94 -0.69 1.03 -0.73 0.00 0.00 179.01 180.03 2bk5 s ARG 208 N -5.00 0.76 0.22 1.92 0.52 0.28 -0.63 118.95 117.03 2bk5 s ARG 208 Ca -0.11 -1.30 0.05 0.00 -0.52 0.00 0.00 55.73 53.85 2bk5 s ARG 208 Cb 0.14 -0.02 -0.05 0.00 0.52 0.00 0.00 34.95 35.54 2bk5 s ARG 208 CO 0.84 -0.07 -0.07 0.15 0.02 0.00 0.00 175.30 176.17 2bk5 s LYS 209 N -3.88 1.34 -0.00 3.54 1.02 -0.47 -0.72 119.74 120.55 2bk5 s LYS 209 Ca 0.11 -1.64 -0.25 0.00 0.02 0.00 0.00 55.97 54.21 2bk5 s LYS 209 Cb 0.06 -0.87 -0.04 0.00 -0.52 0.00 0.00 37.83 36.47 2bk5 s LYS 209 CO -0.06 0.03 0.77 -0.06 -0.92 0.00 0.00 175.35 175.11 2bk5 s PHE 210 N -3.20 3.66 0.08 3.18 0.40 -1.26 -1.16 117.98 119.69 2bk5 s PHE 210 Ca 0.25 1.42 -0.31 0.00 -0.60 0.00 0.00 56.93 57.70 2bk5 s PHE 210 Cb 0.03 -2.86 -0.10 0.00 0.51 0.00 0.00 43.02 40.61 2bk5 s PHE 210 CO 0.07 0.16 1.89 0.08 0.70 0.00 0.00 175.22 178.13 2bk5 s VAL 211 N 0.43 2.77 0.00 -0.44 1.01 0.09 -1.46 120.40 122.79 2bk5 s VAL 211 Ca 0.40 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.42 2bk5 s VAL 211 Cb -0.19 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2bk5 s VAL 211 CO 0.22 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.93 2bk5 n GLY 212 N 4.38 1.45 0.00 4.51 0.00 -1.26 -4.67 105.19 109.60 2bk5 n GLY 212 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2bk5 n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bk5 n GLY 213 N -2.00 2.47 0.24 -0.02 0.00 -0.54 -4.77 105.19 100.58 2bk5 n GLY 213 Ca 0.00 -1.76 0.13 0.00 0.00 0.00 0.00 46.02 44.39 2bk5 n GLY 213 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bk5 h SER 214 N 0.00 0.00 -0.16 1.61 4.64 -1.83 -3.02 113.55 114.79 2bk5 h SER 214 Ca 0.00 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.37 2bk5 h SER 214 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2bk5 h SER 214 CO 0.00 0.12 0.21 1.23 -0.87 0.00 0.00 176.83 177.52 2bk5 h GLY 215 N 2.40 0.00 2.00 -0.77 0.00 -1.88 -1.30 103.07 103.52 2bk5 h GLY 215 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2bk5 h GLY 215 CO 0.02 0.00 -0.03 1.46 0.00 0.00 0.00 176.54 177.99 2bk5 h GLN 216 N 0.00 0.00 0.45 4.80 4.20 -1.83 -1.65 115.11 121.08 2bk5 h GLN 216 Ca 0.08 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2bk5 h GLN 216 Cb 0.49 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.27 2bk5 h GLN 216 CO -0.00 0.03 -0.22 0.28 -0.67 0.00 0.00 178.83 178.25 2bk5 h VAL 217 N 0.00 0.56 -0.32 -0.54 2.07 -1.47 0.35 116.25 116.90 2bk5 h VAL 217 Ca -0.00 -0.03 -0.15 0.00 0.82 0.00 0.00 66.70 67.34 2bk5 h VAL 217 Cb 0.06 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2bk5 h VAL 217 CO 0.00 0.01 -0.40 0.28 0.02 0.00 0.00 177.57 177.48 2bk5 h SER 218 N -0.62 0.83 -0.49 0.57 0.02 -1.67 -2.68 113.55 109.52 2bk5 h SER 218 Ca -0.06 -0.38 -0.01 0.00 -0.84 0.00 0.00 61.79 60.50 2bk5 h SER 218 Cb 0.47 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 2bk5 h SER 218 CO 0.10 1.13 0.27 -0.33 -1.14 0.00 0.00 176.83 176.86 2bk5 h GLU 219 N 0.64 0.68 -0.07 3.45 5.08 -1.25 -1.07 114.58 122.04 2bk5 h GLU 219 Ca 0.05 -0.08 -0.14 0.00 -1.00 0.00 0.00 59.36 58.19 2bk5 h GLU 219 Cb 0.96 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 2bk5 h GLU 219 CO 0.09 0.53 -0.59 0.00 -1.00 0.00 0.00 179.01 178.05 2bk5 h ARG 220 N 0.64 0.23 -0.43 2.33 3.08 -0.87 -0.52 114.38 118.83 2bk5 h ARG 220 Ca 0.17 -0.15 -0.12 0.00 0.07 0.00 0.00 59.98 59.95 2bk5 h ARG 220 Cb 0.05 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 2bk5 h ARG 220 CO -0.03 0.75 -0.19 0.82 -1.07 0.00 0.00 179.97 180.24 2bk5 h ILE 221 N 0.17 1.27 -0.90 2.04 2.04 -1.33 -2.02 117.51 118.78 2bk5 h ILE 221 Ca -0.00 -1.32 0.00 0.00 1.00 0.00 0.00 64.86 64.54 2bk5 h ILE 221 Cb 1.08 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 38.25 2bk5 h ILE 221 CO 0.09 0.45 0.57 -0.03 0.00 0.00 0.00 178.15 179.23 2bk5 h MET 222 N 0.75 1.20 -0.65 2.37 4.05 -0.66 -0.80 114.93 121.19 2bk5 h MET 222 Ca 0.11 -0.09 0.05 0.00 -0.28 0.00 0.00 59.70 59.48 2bk5 h MET 222 Cb 0.72 -0.26 -0.05 0.00 -0.80 0.00 0.00 31.60 31.21 2bk5 h MET 222 CO 0.06 0.82 0.37 -0.44 0.23 0.00 0.00 176.91 177.95 2bk5 h ASP 223 N 1.22 0.58 -0.56 1.39 3.32 -0.83 -0.76 116.42 120.78 2bk5 h ASP 223 Ca 0.33 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.34 2bk5 h ASP 223 Cb -0.10 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 2bk5 h ASP 223 CO -0.07 0.39 0.16 -0.07 -1.72 0.00 0.00 179.24 177.93 2bk5 h LEU 224 N 0.71 0.87 0.00 1.55 3.38 -0.79 -3.14 115.31 117.88 2bk5 h LEU 224 Ca 0.28 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2bk5 h LEU 224 Cb 0.12 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2bk5 h LEU 224 CO -0.15 0.83 -0.48 -0.07 0.09 0.00 0.00 178.44 178.66 2bk5 h LEU 225 N 0.89 0.00 0.00 1.67 3.38 -0.67 -3.49 115.31 117.09 2bk5 h LEU 225 Ca 0.20 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2bk5 h LEU 225 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2bk5 h LEU 225 CO -0.00 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.16 2bk5 n GLY 226 N 1.20 3.42 0.07 0.83 0.00 -0.33 -2.57 105.19 107.81 2bk5 n GLY 226 Ca 0.03 -0.11 0.07 0.00 0.00 0.00 0.00 46.02 46.00 2bk5 n GLY 226 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bk5 n ASP 227 N 6.26 0.22 0.26 1.61 5.68 -1.26 -3.07 116.55 126.24 2bk5 n ASP 227 Ca 0.00 -1.61 0.15 0.00 -0.50 0.00 0.00 54.79 52.83 2bk5 n ASP 227 Cb 0.00 -0.02 0.58 0.00 -1.14 0.00 0.00 41.12 40.55 2bk5 n ASP 227 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 2bk5 h ARG 228 N 0.28 0.00 -5.47 0.11 3.08 -1.81 -3.42 114.38 107.15 2bk5 h ARG 228 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 2bk5 h ARG 228 Cb 0.06 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.00 2bk5 h ARG 228 CO 0.00 0.07 0.08 0.08 -1.07 0.00 0.00 179.97 179.14 2bk5 s VAL 229 N -3.64 5.03 -0.37 2.04 1.01 -1.17 -0.75 120.40 122.54 2bk5 s VAL 229 Ca 0.01 1.04 -0.07 0.00 0.00 0.00 0.00 61.98 62.96 2bk5 s VAL 229 Cb 0.09 -3.89 0.06 0.00 0.00 0.00 0.00 36.38 32.64 2bk5 s VAL 229 CO 0.58 0.07 0.15 -0.54 0.00 0.00 0.00 175.10 175.36 2bk5 s LYS 230 N 2.32 2.55 0.38 2.72 -0.14 0.62 -4.96 119.74 123.24 2bk5 s LYS 230 Ca 0.24 -1.32 -0.13 0.00 -1.36 0.00 0.00 55.97 53.41 2bk5 s LYS 230 Cb -0.16 -3.55 -0.08 0.00 -1.68 0.00 0.00 37.83 32.37 2bk5 s LYS 230 CO 0.09 -0.78 0.78 -0.51 -0.76 0.00 0.00 175.35 174.16 2bk5 s LEU 231 N 1.38 3.90 -1.43 3.17 1.43 -1.26 -1.14 118.68 124.73 2bk5 s LEU 231 Ca 0.00 1.23 -0.11 0.00 -1.03 0.00 0.00 54.13 54.22 2bk5 s LEU 231 Cb -0.21 -4.08 0.04 0.00 0.03 0.00 0.00 46.19 41.97 2bk5 s LEU 231 CO 0.02 -0.34 1.09 -0.62 0.23 0.00 0.00 176.35 176.73 2bk5 n GLU 232 N -0.97 -6.99 -3.53 1.70 1.02 0.28 -4.92 120.64 107.23 2bk5 n GLU 232 Ca 0.03 0.75 -0.27 0.00 -0.02 0.00 0.00 57.16 57.65 2bk5 n GLU 232 Cb 0.54 -5.74 -0.09 0.00 -0.02 0.00 0.00 31.44 26.13 2bk5 n GLU 232 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2bk5 n ARG 233 N -4.86 2.39 -2.05 3.49 3.00 0.54 -4.71 116.66 114.46 2bk5 n ARG 233 Ca 0.02 -4.64 -0.42 0.00 -0.01 0.00 0.00 57.85 52.80 2bk5 n ARG 233 Cb 0.55 -2.27 -0.03 0.00 0.00 0.00 0.00 32.46 30.71 2bk5 n ARG 233 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 2bk5 s PRO 234 N -2.25 4.27 0.03 5.56 0.02 -1.26 -3.82 135.00 137.55 2bk5 s PRO 234 Ca 0.36 2.21 -0.30 0.00 0.02 0.00 0.00 61.00 63.30 2bk5 s PRO 234 Cb 0.10 -3.23 -0.04 0.00 0.02 0.00 0.00 34.50 31.36 2bk5 s PRO 234 CO -0.05 -0.53 1.03 0.08 -0.33 0.00 0.00 177.00 177.20 2bk5 s VAL 235 N 1.21 4.62 -0.06 3.83 1.01 -1.26 0.01 120.40 129.77 2bk5 s VAL 235 Ca 0.67 1.91 0.04 0.00 0.00 0.00 0.00 61.98 64.61 2bk5 s VAL 235 Cb -0.40 -4.23 -0.05 0.00 0.00 0.00 0.00 36.38 31.70 2bk5 s VAL 235 CO 0.31 0.17 0.11 2.30 0.00 0.00 0.00 175.10 177.98 2bk5 n ILE 236 N 3.75 0.00 -3.65 2.22 -5.35 -0.09 -4.52 119.36 111.71 2bk5 n ILE 236 Ca 0.06 -0.18 -0.08 0.00 -0.27 0.00 0.00 62.75 62.28 2bk5 n ILE 236 Cb 0.50 0.58 -0.08 0.00 -1.74 0.00 0.00 39.64 38.90 2bk5 n ILE 236 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2bk5 s TYR 237 N -2.00 -0.98 -0.10 4.28 5.04 -1.12 -0.55 117.35 121.91 2bk5 s TYR 237 Ca -0.01 1.98 0.01 0.00 -2.44 0.00 0.00 57.07 56.62 2bk5 s TYR 237 Cb 0.03 0.57 0.02 0.00 0.35 0.00 0.00 41.96 42.92 2bk5 s TYR 237 CO 0.16 -0.49 -0.12 0.42 -1.34 0.00 0.00 175.55 174.18 2bk5 s ILE 238 N 1.59 1.26 -0.20 3.14 1.01 -0.79 -0.58 121.20 126.63 2bk5 s ILE 238 Ca -0.10 -0.48 0.01 0.00 0.00 0.00 0.00 60.65 60.08 2bk5 s ILE 238 Cb -0.06 -1.19 0.03 0.00 0.01 0.00 0.00 42.46 41.25 2bk5 s ILE 238 CO -0.19 0.40 -0.17 -0.62 0.00 0.00 0.00 174.94 174.37 2bk5 s ASP 239 N 1.22 3.54 -0.16 3.58 -1.08 0.37 -1.28 116.67 122.84 2bk5 s ASP 239 Ca -0.03 -0.83 0.17 0.00 -0.52 0.00 0.00 52.55 51.35 2bk5 s ASP 239 Cb -0.14 -1.51 0.46 0.00 -1.46 0.00 0.00 42.92 40.26 2bk5 s ASP 239 CO -0.04 -0.05 1.34 0.00 0.52 0.00 0.00 175.17 176.94 2bk5 n GLN 240 N 4.58 2.42 0.08 4.34 6.02 0.12 -0.92 117.38 134.03 2bk5 n GLN 240 Ca -0.19 -2.77 0.13 0.00 -0.01 0.00 0.00 57.00 54.16 2bk5 n GLN 240 Cb 0.48 -1.74 0.41 0.00 1.02 0.00 0.00 30.24 30.41 2bk5 n GLN 240 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2bk5 n THR 241 N -0.80 0.44 -4.09 5.09 -2.24 -1.26 -4.85 114.28 106.58 2bk5 n THR 241 Ca 0.20 -0.23 -0.27 0.00 -2.27 0.00 0.00 64.05 61.48 2bk5 n THR 241 Cb 0.82 -0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 68.54 2bk5 n THR 241 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2bk5 n ARG 242 N -2.09 0.73 -0.26 -0.78 1.74 -1.26 -5.05 116.66 109.69 2bk5 n ARG 242 Ca 0.06 -3.38 -0.05 0.00 -0.77 0.00 0.00 57.85 53.70 2bk5 n ARG 242 Cb 0.41 0.51 0.05 0.00 -1.02 0.00 0.00 32.46 32.41 2bk5 n ARG 242 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2bk5 h GLU 243 N 0.00 0.98 -6.16 5.56 4.81 -1.97 -3.41 114.58 114.39 2bk5 h GLU 243 Ca -0.35 -0.10 -0.66 0.00 -0.13 0.00 0.00 59.36 58.11 2bk5 h GLU 243 Cb 1.23 -0.20 -0.14 0.00 0.63 0.00 0.00 28.75 30.27 2bk5 h GLU 243 CO 0.56 0.72 -0.64 -0.80 -0.73 0.00 0.00 179.01 178.12 2bk5 s ASN 244 N -6.00 5.12 0.21 1.04 0.01 -1.26 -4.98 114.94 109.08 2bk5 s ASN 244 Ca -0.13 -0.01 -0.30 0.00 -0.71 0.00 0.00 52.86 51.71 2bk5 s ASN 244 Cb 0.14 -1.33 -0.08 0.00 0.41 0.00 0.00 41.25 40.39 2bk5 s ASN 244 CO 0.79 0.27 1.21 -0.69 -1.51 0.00 0.00 177.10 177.18 2bk5 s VAL 245 N -1.10 3.44 -0.18 1.60 1.01 0.63 -4.84 120.40 120.95 2bk5 s VAL 245 Ca 0.20 1.24 -0.04 0.00 0.00 0.00 0.00 61.98 63.38 2bk5 s VAL 245 Cb -0.12 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2bk5 s VAL 245 CO 0.11 0.21 -0.02 -0.76 0.00 0.00 0.00 175.10 174.64 2bk5 s LEU 246 N -0.43 3.23 -0.19 3.92 1.43 -0.09 -1.39 118.68 125.17 2bk5 s LEU 246 Ca 0.52 -0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2bk5 s LEU 246 Cb -0.34 -1.80 0.02 0.00 0.03 0.00 0.00 46.19 44.10 2bk5 s LEU 246 CO 0.38 0.10 -0.18 -0.69 0.23 0.00 0.00 176.35 176.20 2bk5 s VAL 247 N 0.79 2.23 -0.06 -1.59 1.01 0.97 -0.48 120.40 123.27 2bk5 s VAL 247 Ca -0.00 -0.91 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 2bk5 s VAL 247 Cb -0.14 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 2bk5 s VAL 247 CO 0.02 0.50 -0.01 -0.70 0.00 0.00 0.00 175.10 174.92 2bk5 s GLU 248 N 1.31 2.90 0.31 2.72 2.12 0.26 -0.17 118.70 128.14 2bk5 s GLU 248 Ca 0.05 -0.48 0.07 0.00 0.36 0.00 0.00 54.97 54.97 2bk5 s GLU 248 Cb -0.13 -2.73 -0.03 0.00 0.26 0.00 0.00 34.13 31.49 2bk5 s GLU 248 CO -0.11 0.68 0.28 0.95 -0.54 0.00 0.00 175.26 176.51 2bk5 s THR 249 N -0.93 3.88 0.27 -1.70 -4.23 -0.61 -0.92 115.64 111.40 2bk5 s THR 249 Ca 0.15 -1.35 -0.03 0.00 -1.18 0.00 0.00 61.69 59.28 2bk5 s THR 249 Cb -0.11 -3.28 0.18 0.00 1.34 0.00 0.00 72.50 70.63 2bk5 s THR 249 CO 0.04 -0.23 1.85 0.25 -0.54 0.00 0.00 174.62 176.00 2bk5 h LEU 250 N 1.29 0.90 -1.24 4.79 5.85 -0.73 -2.31 115.31 123.86 2bk5 h LEU 250 Ca -0.46 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.14 2bk5 h LEU 250 Cb 1.25 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.05 2bk5 h LEU 250 CO 0.59 0.79 0.00 -0.46 -0.34 0.00 0.00 178.44 179.02 2bk5 n ASN 251 N -4.31 1.48 -2.36 1.25 6.94 -1.26 -4.86 115.26 112.14 2bk5 n ASN 251 Ca 0.06 -2.00 -0.13 0.00 -0.02 0.00 0.00 54.58 52.49 2bk5 n ASN 251 Cb 0.16 -0.50 0.05 0.00 -2.36 0.00 0.00 39.78 37.13 2bk5 n ASN 251 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2bk5 n HIS 252 N 0.12 -1.58 -4.32 -2.53 8.25 -0.87 -5.04 115.22 109.25 2bk5 n HIS 252 Ca 0.00 0.59 -0.29 0.00 -0.26 0.00 0.00 57.72 57.76 2bk5 n HIS 252 Cb 0.31 -3.52 -0.11 0.00 1.12 0.00 0.00 29.99 27.79 2bk5 n HIS 252 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2bk5 s GLU 253 N -5.47 1.76 -0.07 -0.41 2.02 -1.25 -4.98 118.70 110.28 2bk5 s GLU 253 Ca 0.24 -1.23 0.05 0.00 0.02 0.00 0.00 54.97 54.05 2bk5 s GLU 253 Cb -0.11 -2.08 -0.01 0.00 0.10 0.00 0.00 34.13 32.04 2bk5 s GLU 253 CO 0.43 0.47 -0.25 1.41 0.02 0.00 0.00 175.26 177.34 2bk5 s MET 254 N -2.25 2.73 -0.02 1.61 -2.45 -1.26 -1.57 119.30 116.08 2bk5 s MET 254 Ca 0.19 -0.90 0.08 0.00 -1.25 0.00 0.00 55.69 53.81 2bk5 s MET 254 Cb -0.10 -2.21 -0.02 0.00 1.25 0.00 0.00 34.83 33.75 2bk5 s MET 254 CO 0.10 0.31 -0.25 0.71 1.05 0.00 0.00 175.02 176.94 2bk5 s TYR 255 N 0.01 2.28 -0.09 4.11 1.51 0.76 -4.12 117.35 121.81 2bk5 s TYR 255 Ca -0.09 -0.44 0.04 0.00 -1.01 0.00 0.00 57.07 55.57 2bk5 s TYR 255 Cb -0.15 -1.47 -0.00 0.00 -0.11 0.00 0.00 41.96 40.23 2bk5 s TYR 255 CO 0.06 -0.05 -0.24 -2.00 -1.11 0.00 0.00 175.55 172.21 2bk5 s GLU 256 N -0.57 2.93 0.16 -0.62 2.12 0.22 -0.02 118.70 122.91 2bk5 s GLU 256 Ca 0.09 -0.87 -0.10 0.00 0.36 0.00 0.00 54.97 54.45 2bk5 s GLU 256 Cb -0.10 -2.25 -0.00 0.00 0.26 0.00 0.00 34.13 32.04 2bk5 s GLU 256 CO -0.01 0.21 0.30 0.00 -0.54 0.00 0.00 175.26 175.22 2bk5 s ALA 257 N 0.26 -0.15 0.11 6.30 0.00 -0.48 -0.74 121.76 127.05 2bk5 s ALA 257 Ca -0.16 -0.76 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 2bk5 s ALA 257 Cb -0.17 0.81 -0.18 0.00 0.00 0.00 0.00 23.12 23.58 2bk5 s ALA 257 CO 0.08 -0.64 1.23 0.87 0.00 0.00 0.00 175.76 177.30 2bk5 h LYS 258 N 2.53 0.35 -4.01 0.00 1.57 -1.16 0.18 116.57 116.03 2bk5 h LYS 258 Ca -0.32 -0.46 -0.11 0.00 -1.87 0.00 0.00 60.65 57.89 2bk5 h LYS 258 Cb 1.23 0.15 -0.14 0.00 0.08 0.00 0.00 32.23 33.55 2bk5 h LYS 258 CO 0.48 1.16 -0.50 0.71 -0.57 0.00 0.00 179.45 180.73 2bk5 s TYR 259 N -3.00 0.35 -0.01 -1.35 1.51 -0.97 -4.65 117.35 109.23 2bk5 s TYR 259 Ca -0.05 -0.82 0.05 0.00 -1.01 0.00 0.00 57.07 55.24 2bk5 s TYR 259 Cb 0.08 -0.21 -0.01 0.00 -0.11 0.00 0.00 41.96 41.71 2bk5 s TYR 259 CO 0.88 -0.49 -0.16 0.08 -1.11 0.00 0.00 175.55 174.74 2bk5 s VAL 260 N -3.90 1.25 -0.21 0.71 1.01 -0.34 -1.98 120.40 116.94 2bk5 s VAL 260 Ca 0.08 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.32 2bk5 s VAL 260 Cb 0.06 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 2bk5 s VAL 260 CO -0.09 0.34 -0.01 -0.63 0.00 0.00 0.00 175.10 174.71 2bk5 s ILE 261 N -0.39 3.79 -0.48 2.22 1.01 0.05 -0.40 121.20 127.00 2bk5 s ILE 261 Ca 0.06 -0.36 -0.21 0.00 0.00 0.00 0.00 60.65 60.13 2bk5 s ILE 261 Cb -0.06 -2.72 0.03 0.00 0.01 0.00 0.00 42.46 39.73 2bk5 s ILE 261 CO -0.01 0.42 0.72 -0.55 0.00 0.00 0.00 174.94 175.53 2bk5 s SER 262 N 1.13 6.32 -0.44 3.58 0.15 0.44 -0.24 113.70 124.64 2bk5 s SER 262 Ca 0.02 -0.42 0.04 0.00 0.70 0.00 0.00 55.95 56.30 2bk5 s SER 262 Cb -0.14 -2.35 0.44 0.00 -1.71 0.00 0.00 66.02 62.26 2bk5 s SER 262 CO 0.01 -0.91 1.42 0.00 1.20 0.00 0.00 173.24 174.95 2bk5 n ALA 263 N 6.56 5.43 -2.45 5.45 0.00 0.28 -0.95 120.51 134.83 2bk5 n ALA 263 Ca -0.01 -3.86 -0.26 0.00 0.00 0.00 0.00 53.44 49.31 2bk5 n ALA 263 Cb 0.47 -0.80 -0.11 0.00 0.00 0.00 0.00 19.45 19.01 2bk5 n ALA 263 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2bk5 s ILE 264 N -4.87 2.41 0.25 0.00 -4.36 -1.25 -4.54 121.20 108.84 2bk5 s ILE 264 Ca 0.53 -2.21 -0.29 0.00 -0.26 0.00 0.00 60.65 58.42 2bk5 s ILE 264 Cb 0.43 -2.21 -0.15 0.00 1.25 0.00 0.00 42.46 41.79 2bk5 s ILE 264 CO -0.05 -0.25 1.03 -2.65 0.24 0.00 0.00 174.94 173.26 2bk5 n PRO 265 N -0.14 1.23 -0.25 0.37 -0.02 -1.26 -4.79 135.00 130.13 2bk5 n PRO 265 Ca -0.09 0.43 0.06 0.00 -2.02 0.00 0.00 63.50 61.88 2bk5 n PRO 265 Cb 0.58 -1.82 0.17 0.00 -0.02 0.00 0.00 33.50 32.41 2bk5 n PRO 265 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2bk5 h PRO 266 N 2.35 0.16 0.00 0.52 0.11 -1.94 -0.09 132.00 133.12 2bk5 h PRO 266 Ca -0.40 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.66 2bk5 h PRO 266 Cb 1.35 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 2bk5 h PRO 266 CO 0.63 0.11 -0.19 0.00 -0.21 0.00 0.00 178.00 178.34 2bk5 h THR 267 N 0.17 0.80 0.00 -1.15 1.03 -1.76 -1.84 112.91 110.16 2bk5 h THR 267 Ca 0.42 -0.75 0.00 0.00 -0.01 0.00 0.00 66.41 66.07 2bk5 h THR 267 Cb 0.73 1.45 0.00 0.00 -1.07 0.00 0.00 68.15 69.26 2bk5 h THR 267 CO -0.60 0.19 0.00 0.18 -0.01 0.00 0.00 175.52 175.28 2bk5 n LEU 268 N -3.82 0.06 0.26 0.00 4.77 -0.05 -1.35 117.00 116.87 2bk5 n LEU 268 Ca -0.02 0.51 0.18 0.00 -0.03 0.00 0.00 56.01 56.65 2bk5 n LEU 268 Cb 0.29 -0.50 0.91 0.00 -2.33 0.00 0.00 43.42 41.78 2bk5 n LEU 268 CO 0.33 -0.25 1.15 1.23 -1.33 0.00 0.00 177.39 178.52 2bk5 h GLY 269 N 2.70 0.00 2.00 -0.72 0.00 -1.34 -1.81 103.07 103.90 2bk5 h GLY 269 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2bk5 h GLY 269 CO 0.00 0.00 -0.06 -0.33 0.00 0.00 0.00 176.54 176.15 2bk5 h MET 270 N 0.00 0.00 0.00 4.80 2.86 -1.41 -2.30 114.93 118.88 2bk5 h MET 270 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2bk5 h MET 270 Cb 0.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.06 2bk5 h MET 270 CO -0.00 0.06 0.00 1.63 1.06 0.00 0.00 176.91 179.66 2bk5 n LYS 271 N -3.83 0.38 -4.55 1.72 5.02 -0.68 -4.68 118.16 111.53 2bk5 n LYS 271 Ca -0.03 0.07 -0.33 0.00 -2.02 0.00 0.00 58.31 56.00 2bk5 n LYS 271 Cb 0.15 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.53 2bk5 n LYS 271 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2bk5 s ILE 272 N -2.46 3.59 -0.12 -0.18 1.01 -0.87 -4.58 121.20 117.58 2bk5 s ILE 272 Ca 0.23 -0.47 -0.21 0.00 0.00 0.00 0.00 60.65 60.20 2bk5 s ILE 272 Cb 0.15 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 2bk5 s ILE 272 CO 0.31 0.51 0.59 -1.00 0.00 0.00 0.00 174.94 175.36 2bk5 s HIS 273 N 0.27 3.50 -0.11 3.97 3.76 0.28 -4.93 115.29 122.04 2bk5 s HIS 273 Ca -0.05 1.02 -0.03 0.00 -0.15 0.00 0.00 55.06 55.85 2bk5 s HIS 273 Cb -0.15 -2.70 -0.03 0.00 1.11 0.00 0.00 32.58 30.81 2bk5 s HIS 273 CO 0.04 0.05 -0.00 -0.06 -0.85 0.00 0.00 174.74 173.91 2bk5 s PHE 274 N 1.03 3.14 -0.12 1.40 0.40 -1.26 -1.88 117.98 120.69 2bk5 s PHE 274 Ca 0.31 0.09 -0.01 0.00 -0.60 0.00 0.00 56.93 56.72 2bk5 s PHE 274 Cb -0.16 -1.84 0.04 0.00 0.51 0.00 0.00 43.02 41.56 2bk5 s PHE 274 CO 0.13 0.35 -0.02 1.21 0.70 0.00 0.00 175.22 177.59 2bk5 s ASN 275 N -0.56 2.23 1.03 1.36 2.47 -0.41 -3.41 114.94 117.65 2bk5 s ASN 275 Ca 0.09 -0.39 -0.12 0.00 0.42 0.00 0.00 52.86 52.86 2bk5 s ASN 275 Cb -0.12 -0.66 0.20 0.00 -1.45 0.00 0.00 41.25 39.23 2bk5 s ASN 275 CO 0.02 -0.20 1.09 -2.16 -3.72 0.00 0.00 177.10 172.13 2bk5 s PRO 276 N 1.82 0.20 0.81 0.43 0.04 -1.26 0.16 135.00 137.21 2bk5 s PRO 276 Ca 0.03 0.53 -0.14 0.00 0.04 0.00 0.00 61.00 61.47 2bk5 s PRO 276 Cb -0.14 -1.71 0.06 0.00 0.04 0.00 0.00 34.50 32.76 2bk5 s PRO 276 CO -0.07 -2.89 1.04 -2.30 0.04 0.00 0.00 177.00 172.82 2bk5 n PRO 277 N -4.29 0.13 -1.34 0.56 -0.02 -1.22 -4.95 135.00 123.88 2bk5 n PRO 277 Ca 0.05 0.12 -0.34 0.00 -2.02 0.00 0.00 63.50 61.31 2bk5 n PRO 277 Cb 0.57 -2.30 0.10 0.00 -0.02 0.00 0.00 33.50 31.85 2bk5 n PRO 277 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2bk5 s LEU 278 N -4.52 3.24 0.73 2.45 1.43 -1.26 -4.97 118.68 115.78 2bk5 s LEU 278 Ca 0.71 2.28 -0.16 0.00 -1.03 0.00 0.00 54.13 55.93 2bk5 s LEU 278 Cb -0.29 -4.58 0.03 0.00 0.03 0.00 0.00 46.19 41.38 2bk5 s LEU 278 CO 0.54 -2.33 1.16 -2.65 0.23 0.00 0.00 176.35 173.29 2bk5 n PRO 279 N -2.96 0.59 -0.25 1.29 -0.02 -1.26 -4.66 135.00 127.72 2bk5 n PRO 279 Ca 0.13 0.26 0.04 0.00 -2.02 0.00 0.00 63.50 61.92 2bk5 n PRO 279 Cb 0.51 -2.41 0.15 0.00 -0.02 0.00 0.00 33.50 31.73 2bk5 n PRO 279 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 2bk5 h MET 280 N -0.24 0.11 -0.34 -0.52 1.85 -1.99 -0.62 114.93 113.19 2bk5 h MET 280 Ca -0.48 -0.01 -0.04 0.00 -0.61 0.00 0.00 59.70 58.56 2bk5 h MET 280 Cb 1.32 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 33.31 2bk5 h MET 280 CO 0.48 0.07 0.06 0.52 -0.40 0.00 0.00 176.91 177.64 2bk5 h MET 281 N 0.11 0.55 -0.40 0.39 2.86 -2.00 -1.63 114.93 114.82 2bk5 h MET 281 Ca 0.40 -0.15 -0.13 0.00 -2.06 0.00 0.00 59.70 57.76 2bk5 h MET 281 Cb 0.69 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 2bk5 h MET 281 CO -0.63 0.63 -0.28 -0.09 1.06 0.00 0.00 176.91 177.60 2bk5 h ARG 282 N 0.39 0.86 -0.57 1.72 2.43 -1.84 0.64 114.38 118.00 2bk5 h ARG 282 Ca 0.10 -0.39 0.11 0.00 -0.81 0.00 0.00 59.98 59.00 2bk5 h ARG 282 Cb 0.35 -0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 29.79 2bk5 h ARG 282 CO 0.01 1.03 0.03 -0.97 -1.51 0.00 0.00 179.97 178.55 2bk5 h ASN 283 N 0.73 -0.19 0.58 -3.80 -1.24 -0.77 -2.13 115.58 108.76 2bk5 h ASN 283 Ca 0.08 0.13 -0.28 0.00 0.71 0.00 0.00 56.30 56.94 2bk5 h ASN 283 Cb 0.84 0.22 0.01 0.00 0.73 0.00 0.00 38.32 40.11 2bk5 h ASN 283 CO 0.07 -0.07 -1.29 1.56 -1.29 0.00 0.00 177.43 176.41 2bk5 h GLN 284 N 0.15 0.30 -0.70 6.67 4.20 -1.23 -3.35 115.11 121.15 2bk5 h GLN 284 Ca 0.29 -0.51 0.11 0.00 0.06 0.00 0.00 58.65 58.61 2bk5 h GLN 284 Cb 0.46 0.19 -0.08 0.00 0.30 0.00 0.00 27.48 28.35 2bk5 h GLN 284 CO -0.46 1.23 0.29 1.98 -0.67 0.00 0.00 178.83 181.21 2bk5 h MET 285 N 0.08 0.47 0.00 1.46 4.05 -0.41 -1.86 114.93 118.72 2bk5 h MET 285 Ca -0.16 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.24 2bk5 h MET 285 Cb 2.00 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 32.69 2bk5 h MET 285 CO 0.21 0.31 0.00 0.44 0.23 0.00 0.00 176.91 178.10 2bk5 n ILE 286 N -4.96 0.21 0.91 1.77 -5.35 -0.84 -0.99 119.36 110.11 2bk5 n ILE 286 Ca 0.12 0.05 0.11 0.00 -0.27 0.00 0.00 62.75 62.76 2bk5 n ILE 286 Cb 0.33 -0.75 0.09 0.00 -1.74 0.00 0.00 39.64 37.57 2bk5 n ILE 286 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 2bk5 n THR 287 N -1.13 0.00 -0.04 7.28 -2.24 -0.70 -4.34 114.28 113.11 2bk5 n THR 287 Ca 0.12 -0.50 0.02 0.00 -2.27 0.00 0.00 64.05 61.42 2bk5 n THR 287 Cb 0.10 1.46 0.05 0.00 -2.10 0.00 0.00 70.33 69.84 2bk5 n THR 287 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2bk5 n ARG 288 N 1.23 2.60 -3.48 -0.78 1.74 -0.16 -4.89 116.66 112.92 2bk5 n ARG 288 Ca 0.13 -1.59 -0.27 0.00 -0.77 0.00 0.00 57.85 55.36 2bk5 n ARG 288 Cb 0.55 -1.09 -0.10 0.00 -1.02 0.00 0.00 32.46 30.80 2bk5 n ARG 288 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2bk5 n VAL 289 N -0.12 0.05 -1.57 1.55 0.24 -1.24 -4.48 118.33 112.76 2bk5 n VAL 289 Ca 0.04 -4.13 -0.30 0.00 -2.04 0.00 0.00 64.34 57.91 2bk5 n VAL 289 Cb 0.29 -1.90 0.08 0.00 -1.47 0.00 0.00 33.84 30.83 2bk5 n VAL 289 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2bk5 s PRO 290 N -0.89 2.30 0.24 7.34 0.04 -1.25 -4.31 135.00 138.46 2bk5 s PRO 290 Ca 0.32 0.70 0.05 0.00 0.04 0.00 0.00 61.00 62.11 2bk5 s PRO 290 Cb 0.06 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.63 2bk5 s PRO 290 CO -0.15 -1.48 0.35 -0.51 0.04 0.00 0.00 177.00 175.25 2bk5 s LEU 291 N -5.71 4.30 0.00 -3.56 1.02 -1.26 -0.87 118.68 112.60 2bk5 s LEU 291 Ca 0.60 0.07 -0.18 0.00 0.02 0.00 0.00 54.13 54.64 2bk5 s LEU 291 Cb -0.14 -2.85 0.26 0.00 0.02 0.00 0.00 46.19 43.48 2bk5 s LEU 291 CO 0.54 -0.06 1.04 0.61 0.02 0.00 0.00 176.35 178.50 2bk5 n GLY 292 N -1.36 -2.45 3.01 -3.19 0.00 -0.76 -4.78 105.19 95.67 2bk5 n GLY 292 Ca -0.09 -1.54 -0.26 0.00 0.00 0.00 0.00 46.02 44.13 2bk5 n GLY 292 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bk5 s SER 293 N -4.45 2.08 -0.19 1.61 0.01 -0.51 -1.96 113.70 110.30 2bk5 s SER 293 Ca 0.65 -0.34 -0.23 0.00 1.31 0.00 0.00 55.95 57.34 2bk5 s SER 293 Cb -0.05 -0.92 0.06 0.00 0.21 0.00 0.00 66.02 65.32 2bk5 s SER 293 CO 0.49 -0.00 0.61 0.54 0.41 0.00 0.00 173.24 175.29 2bk5 s VAL 294 N 0.97 0.00 -0.18 3.43 0.11 -1.26 -0.00 120.40 123.47 2bk5 s VAL 294 Ca -0.08 -0.03 -0.02 0.00 -2.93 0.00 0.00 61.98 58.92 2bk5 s VAL 294 Cb -0.15 -0.87 -0.01 0.00 -1.53 0.00 0.00 36.38 33.82 2bk5 s VAL 294 CO -0.00 -0.02 -0.09 -0.63 -3.33 0.00 0.00 175.10 171.03 2bk5 s ILE 295 N -0.06 3.15 -0.22 7.04 1.01 -0.48 -2.05 121.20 129.60 2bk5 s ILE 295 Ca -0.03 -0.59 -0.15 0.00 0.00 0.00 0.00 60.65 59.89 2bk5 s ILE 295 Cb -0.04 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 2bk5 s ILE 295 CO 0.03 0.47 0.34 -0.75 0.00 0.00 0.00 174.94 175.03 2bk5 s LYS 296 N 1.04 4.13 -0.05 2.79 2.20 -0.42 -0.87 119.74 128.56 2bk5 s LYS 296 Ca -0.00 0.08 0.03 0.00 -0.36 0.00 0.00 55.97 55.72 2bk5 s LYS 296 Cb -0.15 -3.55 0.00 0.00 -1.51 0.00 0.00 37.83 32.63 2bk5 s LYS 296 CO -0.01 -0.04 -0.15 0.00 -0.36 0.00 0.00 175.35 174.79 2bk5 s ILE 298 N 0.31 1.40 -0.21 0.00 1.09 0.76 0.13 121.20 124.68 2bk5 s ILE 298 Ca -0.09 -0.84 -0.09 0.00 -1.10 0.00 0.00 60.65 58.53 2bk5 s ILE 298 Cb -0.13 -1.52 -0.05 0.00 -1.06 0.00 0.00 42.46 39.70 2bk5 s ILE 298 CO 0.03 0.15 0.11 -0.69 -0.10 0.00 0.00 174.94 174.44 2bk5 s VAL 299 N 1.50 5.10 -0.02 2.92 1.01 -0.55 -1.42 120.40 128.95 2bk5 s VAL 299 Ca -0.00 0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.04 2bk5 s VAL 299 Cb -0.16 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 2bk5 s VAL 299 CO -0.08 0.41 0.12 -0.31 0.00 0.00 0.00 175.10 175.24 2bk5 s TYR 300 N 0.65 3.39 0.16 5.22 1.51 -0.25 -0.65 117.35 127.37 2bk5 s TYR 300 Ca 0.06 0.28 0.02 0.00 -1.01 0.00 0.00 57.07 56.42 2bk5 s TYR 300 Cb -0.13 -1.79 -0.05 0.00 -0.11 0.00 0.00 41.96 39.89 2bk5 s TYR 300 CO 0.01 0.60 -0.03 0.71 -1.11 0.00 0.00 175.55 175.73 2bk5 s TYR 301 N -1.21 1.16 0.20 2.71 1.51 -0.07 -0.45 117.35 121.20 2bk5 s TYR 301 Ca 0.23 -0.96 -0.12 0.00 -1.01 0.00 0.00 57.07 55.22 2bk5 s TYR 301 Cb -0.12 -0.65 0.13 0.00 -0.11 0.00 0.00 41.96 41.20 2bk5 s TYR 301 CO 0.14 -0.15 1.87 -0.22 -1.11 0.00 0.00 175.55 176.08 2bk5 h LYS 302 N 2.76 0.90 -4.34 -0.62 3.64 -1.85 -3.31 116.57 113.73 2bk5 h LYS 302 Ca -0.36 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 58.79 2bk5 h LYS 302 Cb 1.19 -0.20 -0.16 0.00 -0.41 0.00 0.00 32.23 32.65 2bk5 h LYS 302 CO 0.63 0.59 -0.69 -1.21 -2.27 0.00 0.00 179.45 176.51 2bk5 s GLU 303 N -6.14 0.62 -1.25 1.90 2.02 -1.26 -4.67 118.70 109.92 2bk5 s GLU 303 Ca -0.13 -1.13 -0.14 0.00 0.02 0.00 0.00 54.97 53.59 2bk5 s GLU 303 Cb 0.14 0.04 -0.05 0.00 0.10 0.00 0.00 34.13 34.36 2bk5 s GLU 303 CO 0.77 -0.06 2.30 -0.35 0.02 0.00 0.00 175.26 177.93 2bk5 n PRO 304 N 0.38 2.60 0.21 0.39 -0.04 -1.26 -4.75 135.00 132.54 2bk5 n PRO 304 Ca -0.16 -2.16 0.16 0.00 -0.04 0.00 0.00 63.50 61.30 2bk5 n PRO 304 Cb 0.60 -2.97 0.82 0.00 -0.04 0.00 0.00 33.50 31.91 2bk5 n PRO 304 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2bk5 h PHE 305 N 6.28 0.00 -0.23 0.54 -0.00 -1.97 -1.61 116.94 119.96 2bk5 h PHE 305 Ca 0.59 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 58.53 2bk5 h PHE 305 Cb 0.50 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.43 2bk5 h PHE 305 CO 1.58 0.00 0.02 0.11 -0.00 0.00 0.00 178.31 180.02 2bk5 h TRP 306 N 0.00 0.33 -0.23 6.09 0.09 -1.85 -2.36 115.95 118.02 2bk5 h TRP 306 Ca 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 58.89 59.04 2bk5 h TRP 306 Cb 0.38 -0.10 -0.01 0.00 0.08 0.00 0.00 29.16 29.51 2bk5 h TRP 306 CO 0.00 0.32 0.15 0.00 0.09 0.00 0.00 178.44 179.00 2bk5 h ARG 307 N 0.32 0.30 0.00 0.12 3.08 -1.12 -1.38 114.38 115.70 2bk5 h ARG 307 Ca 0.08 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 2bk5 h ARG 307 Cb 0.18 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 2bk5 h ARG 307 CO 0.00 0.20 -0.09 0.87 -1.07 0.00 0.00 179.97 179.87 2bk5 h LYS 308 N 0.30 0.00 -0.66 0.04 1.57 -1.59 -1.39 116.57 114.85 2bk5 h LYS 308 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2bk5 h LYS 308 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2bk5 h LYS 308 CO -0.02 0.09 0.00 1.63 -0.57 0.00 0.00 179.45 180.59 2bk5 n LYS 309 N -3.62 3.03 -3.28 3.15 5.02 -0.60 -4.93 118.16 116.94 2bk5 n LYS 309 Ca -0.02 -2.51 -0.21 0.00 -2.02 0.00 0.00 58.31 53.54 2bk5 n LYS 309 Cb 0.21 -1.69 0.06 0.00 -0.02 0.00 0.00 35.03 33.60 2bk5 n LYS 309 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2bk5 n ASP 310 N 1.24 -5.95 -4.50 4.39 2.03 -0.52 -4.99 116.55 108.24 2bk5 n ASP 310 Ca 0.23 -0.40 -0.33 0.00 0.52 0.00 0.00 54.79 54.81 2bk5 n ASP 310 Cb 0.70 -4.66 -0.13 0.00 -0.72 0.00 0.00 41.12 36.31 2bk5 n ASP 310 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2bk5 s TYR 311 N -3.23 2.83 -0.42 -0.67 4.12 -0.75 -1.33 117.35 117.91 2bk5 s TYR 311 Ca 0.43 -0.18 0.23 0.00 0.02 0.00 0.00 57.07 57.57 2bk5 s TYR 311 Cb -0.19 -1.72 0.30 0.00 -1.52 0.00 0.00 41.96 38.83 2bk5 s TYR 311 CO 0.54 0.16 1.50 0.00 0.02 0.00 0.00 175.55 177.76 2bk5 n GLY 313 N 1.13 0.91 3.69 0.00 0.00 -1.26 -4.37 105.19 105.29 2bk5 n GLY 313 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2bk5 n GLY 313 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bk5 s THR 314 N -2.00 4.47 -0.07 2.61 2.01 -1.26 -3.86 115.64 117.55 2bk5 s THR 314 Ca 0.00 1.77 0.01 0.00 0.31 0.00 0.00 61.69 63.78 2bk5 s THR 314 Cb 0.00 -4.14 0.02 0.00 0.01 0.00 0.00 72.50 68.39 2bk5 s THR 314 CO 0.00 0.03 -0.08 -0.04 -0.69 0.00 0.00 174.62 173.84 2bk5 s MET 315 N 1.90 1.33 -0.31 4.92 1.00 -1.11 -1.42 119.30 125.61 2bk5 s MET 315 Ca 0.53 -0.26 -0.05 0.00 0.00 0.00 0.00 55.69 55.92 2bk5 s MET 315 Cb -0.23 -1.23 0.03 0.00 0.00 0.00 0.00 34.83 33.41 2bk5 s MET 315 CO 0.22 -0.07 0.05 0.42 0.00 0.00 0.00 175.02 175.64 2bk5 s ILE 316 N 0.98 3.50 -0.28 2.53 1.01 0.74 -1.41 121.20 128.28 2bk5 s ILE 316 Ca -0.09 -1.08 0.03 0.00 0.00 0.00 0.00 60.65 59.51 2bk5 s ILE 316 Cb -0.15 -2.92 0.07 0.00 0.01 0.00 0.00 42.46 39.47 2bk5 s ILE 316 CO 0.00 -0.05 -0.06 -0.63 0.00 0.00 0.00 174.94 174.20 2bk5 s ILE 317 N 1.38 2.24 0.62 2.92 1.01 0.31 -0.27 121.20 129.40 2bk5 s ILE 317 Ca -0.01 -1.83 -0.14 0.00 0.00 0.00 0.00 60.65 58.67 2bk5 s ILE 317 Cb -0.19 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 2bk5 s ILE 317 CO 0.01 -0.19 1.04 -1.81 0.00 0.00 0.00 174.94 173.99 2bk5 s ASP 318 N 1.06 5.81 0.00 3.58 1.11 -0.68 -4.46 116.67 123.10 2bk5 s ASP 318 Ca -0.03 1.68 0.00 0.00 0.18 0.00 0.00 52.55 54.38 2bk5 s ASP 318 Cb -0.20 -2.51 0.00 0.00 1.07 0.00 0.00 42.92 41.28 2bk5 s ASP 318 CO -0.06 -1.15 0.00 0.61 1.18 0.00 0.00 175.17 175.76 2bk5 n GLY 319 N -1.55 2.62 0.24 0.21 0.00 -1.26 -4.70 105.19 100.75 2bk5 n GLY 319 Ca 0.08 -1.78 -0.04 0.00 0.00 0.00 0.00 46.02 44.27 2bk5 n GLY 319 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2bk5 h GLU 320 N 0.00 0.51 -0.09 1.61 4.57 -2.03 -3.26 114.58 115.89 2bk5 h GLU 320 Ca 0.00 -0.19 -0.12 0.00 -1.18 0.00 0.00 59.36 57.86 2bk5 h GLU 320 Cb 0.00 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 2bk5 h GLU 320 CO 0.00 0.72 -0.50 0.93 -1.18 0.00 0.00 179.01 178.98 2bk5 h GLU 321 N 0.45 0.23 -6.31 1.92 3.07 -2.00 -3.43 114.58 108.51 2bk5 h GLU 321 Ca 0.06 -0.13 -0.55 0.00 -0.50 0.00 0.00 59.36 58.25 2bk5 h GLU 321 Cb 0.68 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.59 2bk5 h GLU 321 CO 0.05 0.68 0.94 0.00 -1.40 0.00 0.00 179.01 179.28 2bk5 s ALA 322 N -3.96 3.62 0.32 3.43 0.00 -1.23 -4.90 121.76 119.03 2bk5 s ALA 322 Ca -0.04 0.86 0.03 0.00 0.00 0.00 0.00 51.96 52.80 2bk5 s ALA 322 Cb 0.13 -3.66 0.54 0.00 0.00 0.00 0.00 23.12 20.13 2bk5 s ALA 322 CO 0.78 -1.13 1.85 -1.00 0.00 0.00 0.00 175.76 176.26 2bk5 h PRO 323 N 8.47 0.58 -5.22 0.00 0.13 -1.90 -3.42 132.00 130.65 2bk5 h PRO 323 Ca -0.37 -0.13 -0.66 0.00 -0.87 0.00 0.00 66.00 63.97 2bk5 h PRO 323 Cb 1.17 -0.08 -0.29 0.00 0.13 0.00 0.00 31.00 31.93 2bk5 h PRO 323 CO 0.93 0.61 -0.79 0.08 -0.23 0.00 0.00 178.00 178.60 2bk5 s VAL 324 N -4.96 2.81 -0.62 1.56 1.01 -1.26 -4.33 120.40 114.61 2bk5 s VAL 324 Ca -0.08 -0.72 0.22 0.00 0.00 0.00 0.00 61.98 61.40 2bk5 s VAL 324 Cb 0.15 -2.19 -0.16 0.00 0.00 0.00 0.00 36.38 34.18 2bk5 s VAL 324 CO 0.78 0.51 0.95 0.00 0.00 0.00 0.00 175.10 177.33 2bk5 n ALA 325 N 3.96 3.59 -3.50 5.51 0.00 -1.20 -4.71 120.51 124.16 2bk5 n ALA 325 Ca -0.19 -0.45 -0.12 0.00 0.00 0.00 0.00 53.44 52.68 2bk5 n ALA 325 Cb 0.52 -0.91 -0.10 0.00 0.00 0.00 0.00 19.45 18.96 2bk5 n ALA 325 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2bk5 s TYR 326 N -3.19 -0.57 0.10 0.00 5.04 -1.26 -0.53 117.35 116.94 2bk5 s TYR 326 Ca 0.03 1.30 0.03 0.00 -2.44 0.00 0.00 57.07 55.99 2bk5 s TYR 326 Cb 0.15 0.24 -0.04 0.00 0.35 0.00 0.00 41.96 42.65 2bk5 s TYR 326 CO 0.82 -0.30 -0.08 0.95 -1.34 0.00 0.00 175.55 175.61 2bk5 s THR 327 N 0.78 0.78 0.04 4.34 -4.23 -0.50 -2.23 115.64 114.63 2bk5 s THR 327 Ca -0.04 -1.79 0.01 0.00 -1.18 0.00 0.00 61.69 58.68 2bk5 s THR 327 Cb -0.05 -1.51 -0.03 0.00 1.34 0.00 0.00 72.50 72.25 2bk5 s THR 327 CO -0.06 -0.74 -0.05 -0.76 -0.54 0.00 0.00 174.62 172.47 2bk5 s LEU 328 N -2.76 2.31 0.05 4.79 1.43 -0.16 -2.76 118.68 121.56 2bk5 s LEU 328 Ca 0.09 -0.63 -0.30 0.00 -1.03 0.00 0.00 54.13 52.25 2bk5 s LEU 328 Cb 0.01 0.01 -0.08 0.00 0.03 0.00 0.00 46.19 46.16 2bk5 s LEU 328 CO -0.03 -0.32 1.75 -0.62 0.23 0.00 0.00 176.35 177.36 2bk5 s ASP 329 N -1.85 6.55 -0.12 2.29 -1.08 -1.25 -0.42 116.67 120.80 2bk5 s ASP 329 Ca -0.08 2.52 0.15 0.00 -0.52 0.00 0.00 52.55 54.62 2bk5 s ASP 329 Cb -0.06 -2.55 0.50 0.00 -1.46 0.00 0.00 42.92 39.35 2bk5 s ASP 329 CO -0.02 -0.95 1.41 -0.67 0.52 0.00 0.00 175.17 175.46 2bk5 n ASP 330 N 6.32 3.79 -4.77 -0.34 2.03 0.35 -4.49 116.55 119.45 2bk5 n ASP 330 Ca 0.17 -2.61 -0.40 0.00 0.52 0.00 0.00 54.79 52.47 2bk5 n ASP 330 Cb 0.41 -0.46 0.02 0.00 -0.72 0.00 0.00 41.12 40.37 2bk5 n ASP 330 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2bk5 s THR 331 N -2.11 2.03 0.71 5.18 2.01 -1.20 -4.58 115.64 117.67 2bk5 s THR 331 Ca 0.38 0.03 -0.15 0.00 0.31 0.00 0.00 61.69 62.26 2bk5 s THR 331 Cb 0.27 -3.02 0.03 0.00 0.01 0.00 0.00 72.50 69.79 2bk5 s THR 331 CO 0.13 0.00 1.17 -0.54 -0.69 0.00 0.00 174.62 174.70 2bk5 s LYS 332 N -2.40 2.34 0.51 4.92 -0.14 -0.79 -4.89 119.74 119.29 2bk5 s LYS 332 Ca 0.60 1.63 0.19 0.00 -1.36 0.00 0.00 55.97 57.02 2bk5 s LYS 332 Cb -0.45 -1.87 1.27 0.00 -1.68 0.00 0.00 37.83 35.10 2bk5 s LYS 332 CO 0.58 -1.65 2.06 -1.00 -0.76 0.00 0.00 175.35 174.58 2bk5 h PRO 333 N -0.21 0.08 0.00 -1.68 0.13 -1.94 0.89 132.00 129.27 2bk5 h PRO 333 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2bk5 h PRO 333 Cb 1.28 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2bk5 h PRO 333 CO 0.51 0.06 0.00 0.93 -0.23 0.00 0.00 178.00 179.27 2bk5 h GLU 334 N 0.09 0.00 0.00 0.86 3.07 -2.02 -3.46 114.58 113.12 2bk5 h GLU 334 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 2bk5 h GLU 334 Cb 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2bk5 h GLU 334 CO -0.01 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.01 2bk5 n GLY 335 N -0.13 0.56 3.98 -3.84 0.00 0.31 -5.08 105.19 100.97 2bk5 n GLY 335 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2bk5 n GLY 335 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bk5 s ASN 336 N -2.69 4.84 -1.45 1.61 2.20 -1.26 -4.54 114.94 113.65 2bk5 s ASN 336 Ca 0.00 -1.08 -0.05 0.00 -0.94 0.00 0.00 52.86 50.80 2bk5 s ASN 336 Cb 0.00 0.45 0.03 0.00 -2.00 0.00 0.00 41.25 39.73 2bk5 s ASN 336 CO 0.00 -1.28 0.59 -1.22 -2.94 0.00 0.00 177.10 172.24 2bk5 n TYR 337 N -2.05 -1.78 -1.60 1.54 4.02 -1.26 -1.88 117.16 114.15 2bk5 n TYR 337 Ca 0.08 0.79 -0.47 0.00 -0.01 0.00 0.00 57.90 58.29 2bk5 n TYR 337 Cb 0.63 -3.76 -0.03 0.00 -0.02 0.00 0.00 39.34 36.17 2bk5 n TYR 337 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2bk5 n ALA 338 N -4.41 -0.27 -3.51 -0.72 0.00 -1.25 -4.13 120.51 106.22 2bk5 n ALA 338 Ca -0.21 0.43 -0.15 0.00 0.00 0.00 0.00 53.44 53.51 2bk5 n ALA 338 Cb 0.64 -2.07 -0.05 0.00 0.00 0.00 0.00 19.45 17.97 2bk5 n ALA 338 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bk5 s ALA 339 N -0.45 -1.77 -0.16 0.00 0.00 -1.26 -0.89 121.76 117.23 2bk5 s ALA 339 Ca 0.68 1.17 -0.00 0.00 0.00 0.00 0.00 51.96 53.80 2bk5 s ALA 339 Cb -0.77 0.09 -0.00 0.00 0.00 0.00 0.00 23.12 22.44 2bk5 s ALA 339 CO 0.54 -0.47 -0.13 0.42 0.00 0.00 0.00 175.76 176.12 2bk5 s ILE 340 N -1.84 2.80 -0.12 0.00 -1.09 0.17 -0.49 121.20 120.63 2bk5 s ILE 340 Ca -0.06 -0.72 -0.17 0.00 -2.23 0.00 0.00 60.65 57.47 2bk5 s ILE 340 Cb -0.00 -2.20 -0.04 0.00 -1.58 0.00 0.00 42.46 38.63 2bk5 s ILE 340 CO 0.02 0.50 0.43 -0.32 -1.23 0.00 0.00 174.94 174.35 2bk5 s MET 341 N 0.88 4.31 0.06 2.79 -2.45 0.44 -1.48 119.30 123.85 2bk5 s MET 341 Ca -0.04 0.37 0.03 0.00 -1.25 0.00 0.00 55.69 54.81 2bk5 s MET 341 Cb -0.15 -3.43 -0.03 0.00 1.25 0.00 0.00 34.83 32.48 2bk5 s MET 341 CO -0.01 0.20 -0.10 0.20 1.05 0.00 0.00 175.02 176.36 2bk5 s GLY 342 N 0.52 0.69 -0.14 2.11 0.00 0.12 -0.99 107.32 109.63 2bk5 s GLY 342 Ca 0.24 -0.93 -0.03 0.00 0.00 0.00 0.00 44.72 44.00 2bk5 s GLY 342 CO 0.09 -0.98 -0.04 -1.36 0.00 0.00 0.00 173.10 170.82 2bk5 s PHE 343 N -1.57 3.03 -0.37 1.90 2.99 -0.95 -0.76 117.98 122.25 2bk5 s PHE 343 Ca -0.04 -0.22 -0.15 0.00 0.00 0.00 0.00 56.93 56.52 2bk5 s PHE 343 Cb -0.08 -1.92 -0.00 0.00 0.00 0.00 0.00 43.02 41.02 2bk5 s PHE 343 CO 0.01 0.05 0.34 0.42 -0.00 0.00 0.00 175.22 176.04 2bk5 s ILE 344 N 0.12 5.20 -0.08 0.64 1.01 -0.05 -3.22 121.20 124.82 2bk5 s ILE 344 Ca -0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 60.65 60.38 2bk5 s ILE 344 Cb -0.14 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 2bk5 s ILE 344 CO 0.03 -0.18 0.05 -0.76 0.00 0.00 0.00 174.94 174.08 2bk5 s LEU 345 N 1.91 3.83 0.00 2.97 1.43 -1.26 -1.39 118.68 126.17 2bk5 s LEU 345 Ca 0.09 0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 2bk5 s LEU 345 Cb -0.17 -1.94 0.00 0.00 0.03 0.00 0.00 46.19 44.11 2bk5 s LEU 345 CO 0.11 0.37 0.00 0.00 0.23 0.00 0.00 176.35 177.07 2bk5 n ALA 346 N 1.97 0.00 0.12 4.21 0.00 1.00 -1.69 120.51 126.13 2bk5 n ALA 346 Ca -0.18 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.42 2bk5 n ALA 346 Cb 0.54 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.70 2bk5 n ALA 346 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 2bk5 h HIS 347 N 0.00 0.00 -0.07 0.00 2.07 -1.90 0.12 115.15 115.37 2bk5 h HIS 347 Ca 0.00 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.43 2bk5 h HIS 347 Cb 0.00 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.97 2bk5 h HIS 347 CO 0.00 0.00 -0.37 0.87 -3.07 0.00 0.00 177.93 175.36 2bk5 h LYS 348 N 0.00 0.14 -0.84 5.12 1.57 -1.68 0.84 116.57 121.72 2bk5 h LYS 348 Ca 0.14 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 2bk5 h LYS 348 Cb 0.59 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.86 2bk5 h LYS 348 CO -0.00 0.49 0.39 0.00 -0.57 0.00 0.00 179.45 179.76 2bk5 h ALA 349 N 1.51 1.08 -0.10 3.86 0.00 -1.01 0.54 119.26 125.14 2bk5 h ALA 349 Ca 0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2bk5 h ALA 349 Cb 0.71 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2bk5 h ALA 349 CO 0.05 0.65 -0.07 0.00 0.00 0.00 0.00 179.25 179.88 2bk5 h ARG 350 N 1.19 0.23 -0.26 0.00 -0.00 -1.33 -2.76 114.38 111.45 2bk5 h ARG 350 Ca 0.29 -0.11 -0.01 0.00 -0.50 0.00 0.00 59.98 59.65 2bk5 h ARG 350 Cb 0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.09 2bk5 h ARG 350 CO -0.03 0.61 0.14 -0.22 0.00 0.00 0.00 179.97 180.47 2bk5 h LYS 351 N -0.16 0.36 -0.01 0.04 3.64 -0.67 -3.23 116.57 116.54 2bk5 h LYS 351 Ca 0.02 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2bk5 h LYS 351 Cb 0.56 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 2bk5 h LYS 351 CO 0.02 0.33 -0.27 1.28 -2.27 0.00 0.00 179.45 178.54 2bk5 n LEU 352 N -4.84 0.95 0.23 5.20 4.77 0.17 -3.88 117.00 119.59 2bk5 n LEU 352 Ca -0.03 -0.22 0.07 0.00 -0.03 0.00 0.00 56.01 55.80 2bk5 n LEU 352 Cb 0.08 -0.14 0.56 0.00 -2.33 0.00 0.00 43.42 41.59 2bk5 n LEU 352 CO 0.35 0.18 0.91 0.00 -1.33 0.00 0.00 177.39 177.49 2bk5 h ALA 353 N 3.62 1.55 0.00 -1.18 0.00 -1.50 -2.58 119.26 119.16 2bk5 h ALA 353 Ca 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2bk5 h ALA 353 Cb 0.50 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2bk5 h ALA 353 CO 0.00 0.23 -0.13 0.00 0.00 0.00 0.00 179.25 179.35 2bk5 h ARG 354 N 0.00 0.00 -7.32 0.00 3.08 -1.77 -3.44 114.38 104.93 2bk5 h ARG 354 Ca -0.00 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.56 2bk5 h ARG 354 Cb 0.35 0.00 0.15 0.00 0.08 0.00 0.00 29.97 30.56 2bk5 h ARG 354 CO 0.02 0.13 0.24 -0.51 -1.07 0.00 0.00 179.97 178.78 2bk5 s LEU 355 N -8.64 2.26 0.67 3.04 1.43 -0.98 -5.05 118.68 111.42 2bk5 s LEU 355 Ca -0.04 1.54 -0.11 0.00 -1.03 0.00 0.00 54.13 54.49 2bk5 s LEU 355 Cb 0.16 -3.95 0.00 0.00 0.03 0.00 0.00 46.19 42.43 2bk5 s LEU 355 CO 0.68 -2.70 1.06 0.42 0.23 0.00 0.00 176.35 176.03 2bk5 s THR 356 N -2.90 3.74 0.23 5.49 -4.23 -1.26 -4.90 115.64 111.81 2bk5 s THR 356 Ca 0.64 0.48 -0.07 0.00 -1.18 0.00 0.00 61.69 61.56 2bk5 s THR 356 Cb -0.18 -3.55 0.18 0.00 1.34 0.00 0.00 72.50 70.29 2bk5 s THR 356 CO 0.57 -0.70 1.81 0.50 -0.54 0.00 0.00 174.62 176.26 2bk5 h LYS 357 N -0.52 0.71 -0.53 3.99 3.64 -1.96 -1.16 116.57 120.74 2bk5 h LYS 357 Ca -0.45 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 58.81 2bk5 h LYS 357 Cb 1.24 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 2bk5 h LYS 357 CO 0.63 0.47 0.02 0.93 -2.27 0.00 0.00 179.45 179.23 2bk5 h GLU 358 N 0.73 0.88 -0.47 1.90 3.07 -1.99 -0.92 114.58 117.78 2bk5 h GLU 358 Ca 0.35 -0.24 -0.07 0.00 -0.50 0.00 0.00 59.36 58.89 2bk5 h GLU 358 Cb 0.28 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.07 2bk5 h GLU 358 CO -0.22 0.87 0.02 0.93 -1.40 0.00 0.00 179.01 179.21 2bk5 h GLU 359 N 0.82 0.83 -0.54 2.33 5.08 -1.79 -1.72 114.58 119.58 2bk5 h GLU 359 Ca 0.16 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 2bk5 h GLU 359 Cb 0.46 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 2bk5 h GLU 359 CO 0.02 0.86 0.17 0.00 -1.00 0.00 0.00 179.01 179.07 2bk5 h ARG 360 N 0.68 0.83 -0.45 2.33 3.08 -1.06 -2.19 114.38 117.61 2bk5 h ARG 360 Ca 0.14 -0.18 0.06 0.00 0.07 0.00 0.00 59.98 60.07 2bk5 h ARG 360 Cb 0.48 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.36 2bk5 h ARG 360 CO 0.02 0.76 0.16 1.25 -1.07 0.00 0.00 179.97 181.09 2bk5 h LEU 361 N 0.74 0.16 -0.27 3.04 5.85 -0.99 -0.65 115.31 123.19 2bk5 h LEU 361 Ca 0.17 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.95 2bk5 h LEU 361 Cb 0.27 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2bk5 h LEU 361 CO -0.01 0.12 0.18 0.50 -0.34 0.00 0.00 178.44 178.90 2bk5 h LYS 362 N 0.33 0.36 -0.82 1.25 3.64 -1.18 -0.78 116.57 119.37 2bk5 h LYS 362 Ca 0.21 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2bk5 h LYS 362 Cb 0.21 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 2bk5 h LYS 362 CO -0.22 0.24 0.49 0.87 -2.27 0.00 0.00 179.45 178.56 2bk5 h LYS 363 N 0.36 1.11 -0.21 1.90 1.57 -0.99 -1.60 116.57 118.71 2bk5 h LYS 363 Ca 0.10 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2bk5 h LYS 363 Cb -0.04 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.03 2bk5 h LYS 363 CO -0.02 0.78 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.56 2bk5 h LEU 364 N 1.12 0.37 -0.70 2.94 4.07 -0.86 -1.65 115.31 120.61 2bk5 h LEU 364 Ca 0.29 -0.32 0.02 0.00 0.08 0.00 0.00 57.88 57.95 2bk5 h LEU 364 Cb -0.04 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 41.56 2bk5 h LEU 364 CO -0.05 0.61 0.45 0.00 -1.08 0.00 0.00 178.44 178.36 2bk5 h GLU 366 N 0.91 1.06 0.08 0.00 5.08 -1.27 0.18 114.58 120.63 2bk5 h GLU 366 Ca 0.26 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2bk5 h GLU 366 Cb -0.06 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2bk5 h GLU 366 CO -0.07 0.99 -0.04 1.25 -1.00 0.00 0.00 179.01 180.13 2bk5 h LEU 367 N 0.98 -0.10 -1.11 1.33 5.85 -0.92 -2.53 115.31 118.81 2bk5 h LEU 367 Ca 0.19 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 2bk5 h LEU 367 Cb 0.44 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2bk5 h LEU 367 CO 0.01 -0.06 0.22 1.88 -0.34 0.00 0.00 178.44 180.15 2bk5 h TYR 368 N -0.12 0.85 -0.59 1.25 0.99 -0.62 -0.59 116.97 118.14 2bk5 h TYR 368 Ca -0.01 -0.05 0.03 0.00 2.00 0.00 0.00 58.73 60.70 2bk5 h TYR 368 Cb 0.09 -0.26 -0.04 0.00 1.00 0.00 0.00 36.73 37.52 2bk5 h TYR 368 CO -0.07 0.67 0.35 0.00 -0.00 0.00 0.00 178.16 179.10 2bk5 h ALA 369 N 1.41 0.77 0.34 3.88 0.00 -0.88 0.74 119.26 125.51 2bk5 h ALA 369 Ca 0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2bk5 h ALA 369 Cb 0.18 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2bk5 h ALA 369 CO -0.02 0.06 -0.17 0.87 0.00 0.00 0.00 179.25 180.00 2bk5 h LYS 370 N 0.68 -0.44 -0.28 0.00 1.57 -0.96 0.59 116.57 117.72 2bk5 h LYS 370 Ca 0.24 0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.87 2bk5 h LYS 370 Cb 0.06 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2bk5 h LYS 370 CO -0.12 -0.25 -0.55 0.28 -0.57 0.00 0.00 179.45 178.24 2bk5 h VAL 371 N -0.53 1.28 -0.00 0.50 2.07 -0.90 -2.66 116.25 116.01 2bk5 h VAL 371 Ca -0.05 -1.74 0.00 0.00 0.82 0.00 0.00 66.70 65.73 2bk5 h VAL 371 Cb 0.40 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 2bk5 h VAL 371 CO 0.08 0.57 -0.16 0.18 0.02 0.00 0.00 177.57 178.25 2bk5 n LEU 372 N -4.00 0.22 -3.67 2.57 4.77 0.23 -4.79 117.00 112.33 2bk5 n LEU 372 Ca -0.04 0.27 -0.23 0.00 -0.03 0.00 0.00 56.01 55.98 2bk5 n LEU 372 Cb 0.63 -0.37 0.05 0.00 -2.33 0.00 0.00 43.42 41.40 2bk5 n LEU 372 CO 0.50 0.05 0.05 0.61 -1.33 0.00 0.00 177.39 177.28 2bk5 n GLY 373 N 1.46 -0.38 2.83 -0.72 0.00 0.06 -4.99 105.19 103.45 2bk5 n GLY 373 Ca 0.08 0.15 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 2bk5 n GLY 373 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bk5 s SER 374 N -3.99 0.63 0.57 1.61 0.01 -0.40 -5.01 113.70 107.12 2bk5 s SER 374 Ca 0.22 0.30 0.37 0.00 1.31 0.00 0.00 55.95 58.15 2bk5 s SER 374 Cb -0.11 0.21 1.74 0.00 0.21 0.00 0.00 66.02 68.08 2bk5 s SER 374 CO 0.79 -0.23 2.10 -0.07 0.41 0.00 0.00 173.24 176.24 2bk5 h LEU 375 N 8.17 0.00 -2.26 2.44 3.38 -1.94 -2.72 115.31 122.38 2bk5 h LEU 375 Ca -0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2bk5 h LEU 375 Cb 1.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 2bk5 h LEU 375 CO 0.20 0.00 -0.05 -0.33 0.09 0.00 0.00 178.44 178.34 2bk5 h GLU 376 N 0.00 0.00 0.00 1.13 5.08 -1.96 -1.67 114.58 117.16 2bk5 h GLU 376 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2bk5 h GLU 376 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2bk5 h GLU 376 CO 0.00 0.05 0.00 0.00 -1.00 0.00 0.00 179.01 178.06 2bk5 h ALA 377 N 1.95 1.00 -0.05 3.43 0.00 -1.81 -2.46 119.26 121.31 2bk5 h ALA 377 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bk5 h ALA 377 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2bk5 h ALA 377 CO 0.01 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.54 2bk5 n LEU 378 N -2.95 0.90 -3.00 0.00 4.77 -0.63 -4.35 117.00 111.74 2bk5 n LEU 378 Ca -0.01 -0.34 -0.27 0.00 -0.03 0.00 0.00 56.01 55.36 2bk5 n LEU 378 Cb 0.18 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2bk5 n LEU 378 CO 0.22 0.17 0.13 -0.62 -1.33 0.00 0.00 177.39 175.96 2bk5 n GLU 379 N -0.24 3.09 -2.14 3.23 -0.58 -0.93 -5.06 120.64 118.00 2bk5 n GLU 379 Ca 0.18 -4.79 -0.35 0.00 -0.42 0.00 0.00 57.16 51.77 2bk5 n GLU 379 Cb 0.23 -2.22 0.01 0.00 -0.57 0.00 0.00 31.44 28.89 2bk5 n GLU 379 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2bk5 s PRO 380 N -3.32 3.20 -0.02 3.49 0.04 -1.26 -4.68 135.00 132.44 2bk5 s PRO 380 Ca 0.48 1.63 0.19 0.00 0.04 0.00 0.00 61.00 63.33 2bk5 s PRO 380 Cb 0.27 -1.98 -0.27 0.00 0.04 0.00 0.00 34.50 32.56 2bk5 s PRO 380 CO -0.12 -0.98 0.49 1.33 0.04 0.00 0.00 177.00 177.76 2bk5 n VAL 381 N -1.50 0.00 -3.54 -0.36 0.24 0.40 -4.99 118.33 108.59 2bk5 n VAL 381 Ca 0.12 -0.35 -0.09 0.00 -2.04 0.00 0.00 64.34 61.98 2bk5 n VAL 381 Cb 0.51 0.28 -0.02 0.00 -1.47 0.00 0.00 33.84 33.14 2bk5 n VAL 381 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2bk5 s HIS 382 N -3.16 -0.36 -0.12 6.34 5.65 -1.23 -5.01 115.29 117.39 2bk5 s HIS 382 Ca -0.04 0.16 -0.09 0.00 0.25 0.00 0.00 55.06 55.34 2bk5 s HIS 382 Cb 0.12 0.57 0.04 0.00 -1.18 0.00 0.00 32.58 32.14 2bk5 s HIS 382 CO 0.77 -0.72 0.31 -0.47 -0.65 0.00 0.00 174.74 173.97 2bk5 s TYR 383 N -3.39 -0.39 0.03 3.88 5.04 -1.26 -1.10 117.35 120.17 2bk5 s TYR 383 Ca 0.05 0.90 0.04 0.00 -2.44 0.00 0.00 57.07 55.62 2bk5 s TYR 383 Cb -0.01 0.12 -0.02 0.00 0.35 0.00 0.00 41.96 42.40 2bk5 s TYR 383 CO -0.07 -0.22 -0.11 -1.21 -1.34 0.00 0.00 175.55 172.59 2bk5 s GLU 384 N 0.79 0.75 0.10 4.97 0.41 -0.51 -5.02 118.70 120.20 2bk5 s GLU 384 Ca -0.05 -0.66 -0.14 0.00 -0.41 0.00 0.00 54.97 53.71 2bk5 s GLU 384 Cb -0.06 -0.70 0.02 0.00 -1.78 0.00 0.00 34.13 31.61 2bk5 s GLU 384 CO -0.05 0.17 0.33 -1.83 -0.49 0.00 0.00 175.26 173.39 2bk5 s GLU 385 N -1.06 0.97 -0.12 1.61 -1.05 -1.26 -0.17 118.70 117.63 2bk5 s GLU 385 Ca -0.01 -0.75 -0.05 0.00 -0.15 0.00 0.00 54.97 54.01 2bk5 s GLU 385 Cb -0.07 0.42 0.06 0.00 -0.44 0.00 0.00 34.13 34.09 2bk5 s GLU 385 CO 0.01 -0.36 0.25 0.21 0.95 0.00 0.00 175.26 176.32 2bk5 s LYS 386 N -3.67 0.16 -0.51 -4.83 2.20 -0.07 -4.99 119.74 108.03 2bk5 s LYS 386 Ca 0.03 0.65 -0.20 0.00 -0.36 0.00 0.00 55.97 56.09 2bk5 s LYS 386 Cb 0.02 -0.08 0.06 0.00 -1.51 0.00 0.00 37.83 36.32 2bk5 s LYS 386 CO -0.11 -0.24 0.66 1.21 -0.36 0.00 0.00 175.35 176.52 2bk5 s ASN 387 N 1.97 6.24 0.11 1.43 3.84 -1.26 -1.30 114.94 125.96 2bk5 s ASN 387 Ca -0.03 -0.85 0.22 0.00 0.21 0.00 0.00 52.86 52.42 2bk5 s ASN 387 Cb -0.11 -2.31 0.89 0.00 -0.55 0.00 0.00 41.25 39.17 2bk5 s ASN 387 CO -0.08 -0.93 1.69 0.79 -2.79 0.00 0.00 177.10 175.77 2bk5 n TRP 388 N 6.32 0.38 0.28 0.43 7.02 -0.87 -2.93 117.44 128.07 2bk5 n TRP 388 Ca -0.06 0.13 0.16 0.00 -1.02 0.00 0.00 57.50 56.71 2bk5 n TRP 388 Cb 0.46 -0.71 0.82 0.00 -2.42 0.00 0.00 31.31 29.45 2bk5 n TRP 388 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2bk5 n GLU 390 N -3.40 0.73 -2.73 0.00 0.28 -1.15 -4.74 120.64 109.63 2bk5 n GLU 390 Ca -0.01 -0.33 -0.43 0.00 -0.16 0.00 0.00 57.16 56.23 2bk5 n GLU 390 Cb 0.22 -1.49 -0.03 0.00 1.43 0.00 0.00 31.44 31.57 2bk5 n GLU 390 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2bk5 s GLU 391 N -2.49 3.70 0.29 3.44 0.41 -1.09 -4.92 118.70 118.04 2bk5 s GLU 391 Ca 0.27 0.45 0.00 0.00 -0.41 0.00 0.00 54.97 55.29 2bk5 s GLU 391 Cb 0.20 -3.88 0.52 0.00 -1.78 0.00 0.00 34.13 29.18 2bk5 s GLU 391 CO 0.49 -1.20 1.90 0.37 -0.49 0.00 0.00 175.26 176.33 2bk5 h GLN 392 N 8.93 1.01 -0.72 1.61 4.15 -1.91 0.52 115.11 128.71 2bk5 h GLN 392 Ca -0.23 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.13 2bk5 h GLN 392 Cb 1.07 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.53 2bk5 h GLN 392 CO 1.05 0.67 0.00 0.66 -1.93 0.00 0.00 178.83 179.28 2bk5 n TYR 393 N -4.51 1.19 -0.02 3.99 4.02 -1.26 -4.25 117.16 116.32 2bk5 n TYR 393 Ca 0.15 -0.54 -0.04 0.00 -0.01 0.00 0.00 57.90 57.46 2bk5 n TYR 393 Cb 0.22 -0.09 -0.01 0.00 -0.02 0.00 0.00 39.34 39.44 2bk5 n TYR 393 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2bk5 n SER 394 N 1.51 0.27 0.00 7.72 7.64 -1.07 -4.91 113.62 124.77 2bk5 n SER 394 Ca 0.25 0.05 0.00 0.00 1.01 0.00 0.00 58.87 60.18 2bk5 n SER 394 Cb 0.73 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 2bk5 n SER 394 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bk5 n GLY 395 N 2.77 1.76 0.00 0.23 0.00 0.15 -4.87 105.19 105.23 2bk5 n GLY 395 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2bk5 n GLY 395 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bk5 n GLY 396 N -2.00 -0.20 3.36 -0.02 0.00 -1.20 -4.49 105.19 100.63 2bk5 n GLY 396 Ca 0.00 -1.53 -0.12 0.00 0.00 0.00 0.00 46.02 44.38 2bk5 n GLY 396 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bk5 h TYR 398 N 2.47 0.00 -3.25 0.00 0.05 -1.86 -3.03 116.97 111.35 2bk5 h TYR 398 Ca -0.33 -0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.37 2bk5 h TYR 398 Cb 1.25 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.98 2bk5 h TYR 398 CO 0.32 0.93 0.18 -0.08 -1.05 0.00 0.00 178.16 178.46 2bk5 s THR 399 N -2.87 0.00 0.10 -2.88 -1.32 -1.26 -4.95 115.64 102.46 2bk5 s THR 399 Ca 0.01 -1.13 -0.30 0.00 -1.21 0.00 0.00 61.69 59.05 2bk5 s THR 399 Cb 0.10 -2.88 -0.06 0.00 -1.51 0.00 0.00 72.50 68.15 2bk5 s THR 399 CO 0.81 0.00 1.11 -0.89 -2.21 0.00 0.00 174.62 173.44 2bk5 s THR 400 N -2.36 4.12 0.21 5.08 2.01 -1.26 -1.83 115.64 121.62 2bk5 s THR 400 Ca 0.19 1.65 0.08 0.00 0.31 0.00 0.00 61.69 63.91 2bk5 s THR 400 Cb -0.04 -4.05 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 2bk5 s THR 400 CO 0.14 0.20 0.03 -0.72 -0.69 0.00 0.00 174.62 173.58 2bk5 s TYR 401 N 0.47 2.84 -0.27 4.92 -0.85 -0.05 -4.95 117.35 119.47 2bk5 s TYR 401 Ca 0.53 -0.16 -0.05 0.00 -0.52 0.00 0.00 57.07 56.88 2bk5 s TYR 401 Cb -0.28 -1.33 0.01 0.00 0.38 0.00 0.00 41.96 40.75 2bk5 s TYR 401 CO 0.31 0.55 0.02 -0.06 -1.52 0.00 0.00 175.55 174.85 2bk5 s PHE 402 N -1.98 3.10 1.00 -3.49 0.40 -1.26 -3.79 117.98 111.96 2bk5 s PHE 402 Ca 0.30 -1.14 -0.12 0.00 -0.60 0.00 0.00 56.93 55.36 2bk5 s PHE 402 Cb -0.08 -2.17 0.19 0.00 0.51 0.00 0.00 43.02 41.47 2bk5 s PHE 402 CO 0.20 -0.61 1.08 -2.14 0.70 0.00 0.00 175.22 174.45 2bk5 s PRO 403 N 1.44 0.42 0.28 0.24 0.02 -1.26 -0.85 135.00 135.29 2bk5 s PRO 403 Ca 0.02 0.84 -0.30 0.00 0.02 0.00 0.00 61.00 61.58 2bk5 s PRO 403 Cb -0.17 -1.71 -0.13 0.00 0.02 0.00 0.00 34.50 32.52 2bk5 s PRO 403 CO -0.00 -2.82 1.37 -0.35 -0.33 0.00 0.00 177.00 174.86 2bk5 n PRO 404 N -4.29 2.10 0.00 5.54 -0.04 -1.26 -2.54 135.00 134.51 2bk5 n PRO 404 Ca 0.06 0.74 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 2bk5 n PRO 404 Cb 0.55 -2.38 0.00 0.00 -0.04 0.00 0.00 33.50 31.63 2bk5 n PRO 404 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bk5 n GLY 405 N 1.66 2.01 0.11 0.55 0.00 0.41 -4.92 105.19 105.00 2bk5 n GLY 405 Ca 0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 2bk5 n GLY 405 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2bk5 h ILE 406 N 0.00 1.48 -0.79 -0.61 1.08 -1.77 -3.23 117.51 113.67 2bk5 h ILE 406 Ca 0.00 -2.48 0.01 0.00 -0.39 0.00 0.00 64.86 62.00 2bk5 h ILE 406 Cb 0.00 3.14 -0.04 0.00 -3.07 0.00 0.00 36.82 36.85 2bk5 h ILE 406 CO 0.00 0.69 0.52 0.25 -0.69 0.00 0.00 178.15 178.92 2bk5 h LEU 407 N -0.48 0.89 -0.53 1.44 5.85 -1.92 0.24 115.31 120.80 2bk5 h LEU 407 Ca -0.15 -0.02 -0.16 0.00 0.84 0.00 0.00 57.88 58.40 2bk5 h LEU 407 Cb 1.55 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.35 2bk5 h LEU 407 CO 0.10 0.64 -0.52 0.71 -0.34 0.00 0.00 178.44 179.03 2bk5 h THR 408 N 1.05 1.32 0.14 1.05 1.35 -1.93 0.10 112.91 115.99 2bk5 h THR 408 Ca 0.29 -1.76 -0.28 0.00 -0.55 0.00 0.00 66.41 64.12 2bk5 h THR 408 Cb -0.10 1.73 0.01 0.00 -1.73 0.00 0.00 68.15 68.06 2bk5 h THR 408 CO -0.07 0.55 -1.25 1.56 -0.25 0.00 0.00 175.52 176.06 2bk5 h GLN 409 N 0.44 0.31 0.00 4.72 1.08 -1.45 -3.41 115.11 116.81 2bk5 h GLN 409 Ca 0.01 -0.52 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 2bk5 h GLN 409 Cb 1.06 0.19 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 2bk5 h GLN 409 CO 0.10 1.24 -0.16 0.66 -0.95 0.00 0.00 178.83 179.73 2bk5 n TYR 410 N -3.57 0.00 -0.29 2.96 4.02 0.79 -4.81 117.16 116.26 2bk5 n TYR 410 Ca -0.09 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 57.89 2bk5 n TYR 410 Cb 1.02 0.00 0.32 0.00 -0.02 0.00 0.00 39.34 40.66 2bk5 n TYR 410 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2bk5 h GLY 411 N 0.00 1.32 0.92 2.72 0.00 -0.80 -2.14 103.07 105.09 2bk5 h GLY 411 Ca 0.00 -0.35 0.15 0.00 0.00 0.00 0.00 47.33 47.13 2bk5 h GLY 411 CO 0.00 0.16 0.39 3.21 0.00 0.00 0.00 176.54 180.30 2bk5 h ARG 412 N 0.84 0.02 -0.02 4.80 3.08 -1.87 -2.44 114.38 118.79 2bk5 h ARG 412 Ca 0.44 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.49 2bk5 h ARG 412 Cb 0.53 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2bk5 h ARG 412 CO -0.20 0.02 -0.12 1.33 -1.07 0.00 0.00 179.97 179.92 2bk5 n VAL 413 N -4.38 0.00 -0.22 2.04 0.24 -0.80 -4.37 118.33 110.84 2bk5 n VAL 413 Ca 0.10 -0.26 0.02 0.00 -2.04 0.00 0.00 64.34 62.17 2bk5 n VAL 413 Cb 0.60 0.71 0.13 0.00 -1.47 0.00 0.00 33.84 33.81 2bk5 n VAL 413 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 2bk5 h LEU 414 N 2.42 -0.06 -3.05 1.34 5.85 -1.56 -2.60 115.31 117.65 2bk5 h LEU 414 Ca 0.00 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2bk5 h LEU 414 Cb 0.61 0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.83 2bk5 h LEU 414 CO 0.00 -0.03 0.00 -2.11 -0.34 0.00 0.00 178.44 175.96 2bk5 n ARG 415 N -5.17 2.11 -2.28 1.25 1.85 -1.26 -4.90 116.66 108.26 2bk5 n ARG 415 Ca 0.11 -2.41 -0.42 0.00 -1.00 0.00 0.00 57.85 54.12 2bk5 n ARG 415 Cb 0.37 -1.48 -0.03 0.00 -1.05 0.00 0.00 32.46 30.28 2bk5 n ARG 415 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 2bk5 s GLN 416 N -2.39 4.26 0.48 2.89 0.74 -0.98 -4.61 119.66 120.05 2bk5 s GLN 416 Ca 0.28 1.87 -0.24 0.00 0.05 0.00 0.00 55.36 57.33 2bk5 s GLN 416 Cb 0.23 -3.69 -0.07 0.00 1.10 0.00 0.00 33.01 30.58 2bk5 s GLN 416 CO 0.05 -0.63 1.34 -2.30 -0.55 0.00 0.00 175.29 173.20 2bk5 n PRO 417 N 5.96 1.92 -3.68 1.67 -0.02 -1.26 -4.86 135.00 134.73 2bk5 n PRO 417 Ca 0.14 0.69 -0.38 0.00 -2.02 0.00 0.00 63.50 61.93 2bk5 n PRO 417 Cb 0.44 -2.52 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 2bk5 n PRO 417 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bk5 s VAL 418 N -1.24 3.72 0.00 -1.45 1.01 -0.20 -4.96 120.40 117.28 2bk5 s VAL 418 Ca 0.65 -2.16 0.00 0.00 0.00 0.00 0.00 61.98 60.47 2bk5 s VAL 418 Cb -0.45 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.44 2bk5 s VAL 418 CO 0.54 -0.76 0.00 -0.67 0.00 0.00 0.00 175.10 174.21 2bk5 n ASP 419 N 4.46 0.00 -0.93 3.32 2.03 -1.26 -0.88 116.55 123.30 2bk5 n ASP 419 Ca -0.02 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.37 2bk5 n ASP 419 Cb 0.41 0.00 0.23 0.00 -0.72 0.00 0.00 41.12 41.03 2bk5 n ASP 419 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2bk5 n ARG 420 N 0.00 3.03 -3.57 -0.67 1.74 -1.26 -4.91 116.66 111.01 2bk5 n ARG 420 Ca 0.00 -2.43 -0.37 0.00 -0.77 0.00 0.00 57.85 54.28 2bk5 n ARG 420 Cb 0.00 -1.53 -0.09 0.00 -1.02 0.00 0.00 32.46 29.82 2bk5 n ARG 420 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2bk5 s ILE 421 N -1.53 5.31 0.18 0.55 1.01 -0.06 -1.20 121.20 125.46 2bk5 s ILE 421 Ca 0.35 0.32 0.07 0.00 0.00 0.00 0.00 60.65 61.39 2bk5 s ILE 421 Cb 0.22 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 2bk5 s ILE 421 CO 0.18 0.30 0.01 -0.31 0.00 0.00 0.00 174.94 175.11 2bk5 s TYR 422 N 1.27 2.86 -0.21 3.97 1.51 0.46 -1.03 117.35 126.18 2bk5 s TYR 422 Ca 0.10 -0.13 -0.00 0.00 -1.01 0.00 0.00 57.07 56.03 2bk5 s TYR 422 Cb -0.14 -1.38 0.02 0.00 -0.11 0.00 0.00 41.96 40.35 2bk5 s TYR 422 CO 0.06 0.52 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.83 2bk5 s PHE 423 N -1.76 2.92 0.00 2.71 0.40 -1.26 -0.42 117.98 120.57 2bk5 s PHE 423 Ca 0.28 -1.58 0.00 0.00 -0.60 0.00 0.00 56.93 55.03 2bk5 s PHE 423 Cb -0.09 -1.98 0.00 0.00 0.51 0.00 0.00 43.02 41.46 2bk5 s PHE 423 CO 0.19 -0.76 0.00 0.00 0.70 0.00 0.00 175.22 175.35 2bk5 n ALA 424 N 4.64 0.00 0.00 5.36 0.00 -0.12 -4.72 120.51 125.67 2bk5 n ALA 424 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2bk5 n ALA 424 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2bk5 n ALA 424 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bk5 n GLY 425 N 5.00 -0.45 0.29 0.00 0.00 -1.26 -4.52 105.19 104.25 2bk5 n GLY 425 Ca 0.00 -1.44 0.13 0.00 0.00 0.00 0.00 46.02 44.71 2bk5 n GLY 425 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bk5 h THR 426 N 0.00 0.67 0.00 2.61 1.03 -1.84 -1.40 112.91 113.98 2bk5 h THR 426 Ca 0.00 -0.02 -0.00 0.00 -0.01 0.00 0.00 66.41 66.37 2bk5 h THR 426 Cb 0.00 1.01 -0.00 0.00 -1.07 0.00 0.00 68.15 68.09 2bk5 h THR 426 CO 0.00 0.01 -0.01 -0.33 -0.01 0.00 0.00 175.52 175.17 2bk5 h GLU 427 N 0.00 0.00 -0.02 0.00 3.07 -1.90 -2.07 114.58 113.67 2bk5 h GLU 427 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2bk5 h GLU 427 Cb 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 2bk5 h GLU 427 CO 0.00 0.01 -0.03 0.25 -1.40 0.00 0.00 179.01 177.85 2bk5 n THR 428 N -3.19 0.00 -1.42 1.13 -2.24 -0.53 -4.94 114.28 103.08 2bk5 n THR 428 Ca -0.02 -0.35 -0.30 0.00 -2.27 0.00 0.00 64.05 61.11 2bk5 n THR 428 Cb 0.15 0.94 0.10 0.00 -2.10 0.00 0.00 70.33 69.42 2bk5 n THR 428 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bk5 s ALA 429 N -2.04 2.09 -0.41 6.98 0.00 -0.78 -4.89 121.76 122.71 2bk5 s ALA 429 Ca 0.33 -0.09 0.05 0.00 0.00 0.00 0.00 51.96 52.25 2bk5 s ALA 429 Cb 0.20 -3.15 -0.02 0.00 0.00 0.00 0.00 23.12 20.15 2bk5 s ALA 429 CO 0.34 -1.86 0.39 0.25 0.00 0.00 0.00 175.76 174.87 2bk5 n THR 430 N -3.54 0.00 -3.71 0.00 -2.24 -1.26 -4.58 114.28 98.95 2bk5 n THR 430 Ca 0.07 -0.43 -0.19 0.00 -2.27 0.00 0.00 64.05 61.24 2bk5 n THR 430 Cb 0.55 1.04 -0.17 0.00 -2.10 0.00 0.00 70.33 69.65 2bk5 n THR 430 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2bk5 s HIS 431 N -1.09 0.09 -1.47 4.78 5.65 -1.26 -4.73 115.29 117.26 2bk5 s HIS 431 Ca 0.04 0.20 -0.11 0.00 0.25 0.00 0.00 55.06 55.44 2bk5 s HIS 431 Cb 0.04 -0.44 0.07 0.00 -1.18 0.00 0.00 32.58 31.07 2bk5 s HIS 431 CO 0.15 -0.17 0.79 0.91 -0.65 0.00 0.00 174.74 175.77 2bk5 n TRP 432 N 5.01 -2.12 -1.70 3.88 7.02 -0.37 -3.94 117.44 125.21 2bk5 n TRP 432 Ca -0.09 0.72 -0.43 0.00 -1.02 0.00 0.00 57.50 56.68 2bk5 n TRP 432 Cb 0.50 -3.80 -0.02 0.00 -2.42 0.00 0.00 31.31 25.57 2bk5 n TRP 432 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2bk5 n SER 433 N -2.63 3.12 0.00 -0.99 2.88 -1.26 -1.92 113.62 112.82 2bk5 n SER 433 Ca 0.00 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 2bk5 n SER 433 Cb 0.55 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.51 2bk5 n SER 433 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2bk5 n GLY 434 N 1.85 1.19 3.62 0.46 0.00 -1.22 -4.95 105.19 106.14 2bk5 n GLY 434 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 2bk5 n GLY 434 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bk5 s TYR 435 N -2.24 2.51 0.28 1.61 1.51 -0.81 -4.68 117.35 115.54 2bk5 s TYR 435 Ca 0.00 -0.58 -0.01 0.00 -1.01 0.00 0.00 57.07 55.47 2bk5 s TYR 435 Cb 0.00 -1.66 0.46 0.00 -0.11 0.00 0.00 41.96 40.65 2bk5 s TYR 435 CO 0.00 0.45 1.91 0.52 -1.11 0.00 0.00 175.55 177.32 2bk5 h MET 436 N 1.79 1.08 -0.32 -0.62 2.86 -1.90 -1.05 114.93 116.77 2bk5 h MET 436 Ca -0.43 -0.07 0.07 0.00 -2.06 0.00 0.00 59.70 57.21 2bk5 h MET 436 Cb 1.25 -0.24 -0.07 0.00 0.06 0.00 0.00 31.60 32.59 2bk5 h MET 436 CO 0.74 0.72 -0.14 1.49 1.06 0.00 0.00 176.91 180.78 2bk5 h GLU 437 N 1.12 -0.09 -0.65 1.72 4.57 -1.93 -1.60 114.58 117.73 2bk5 h GLU 437 Ca 0.40 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.57 2bk5 h GLU 437 Cb 0.14 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.72 2bk5 h GLU 437 CO -0.15 -0.06 0.35 0.78 -1.18 0.00 0.00 179.01 178.76 2bk5 h GLY 438 N -0.09 0.96 0.77 1.92 0.00 -0.73 -1.38 103.07 104.52 2bk5 h GLY 438 Ca 0.16 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 47.11 2bk5 h GLY 438 CO -0.38 0.40 0.15 0.00 0.00 0.00 0.00 176.54 176.72 2bk5 h ALA 439 N 1.49 0.43 -0.18 3.60 0.00 -0.46 -0.68 119.26 123.46 2bk5 h ALA 439 Ca 0.23 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2bk5 h ALA 439 Cb 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2bk5 h ALA 439 CO -0.04 -0.23 0.09 0.28 0.00 0.00 0.00 179.25 179.36 2bk5 h VAL 440 N 0.32 1.11 -0.30 0.00 2.07 -0.78 -1.13 116.25 117.55 2bk5 h VAL 440 Ca 0.15 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.42 2bk5 h VAL 440 Cb 0.09 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 2bk5 h VAL 440 CO -0.13 0.10 0.01 -0.08 0.02 0.00 0.00 177.57 177.50 2bk5 h GLU 441 N 0.17 0.10 -0.36 1.57 4.81 -0.99 -1.71 114.58 118.17 2bk5 h GLU 441 Ca 0.06 -0.01 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 2bk5 h GLU 441 Cb 0.08 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2bk5 h GLU 441 CO -0.01 0.07 -0.40 0.00 -0.73 0.00 0.00 179.01 177.94 2bk5 h ALA 442 N 1.25 0.60 -0.09 2.92 0.00 -1.03 -0.85 119.26 122.06 2bk5 h ALA 442 Ca 0.14 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2bk5 h ALA 442 Cb 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2bk5 h ALA 442 CO -0.23 0.68 0.05 0.78 0.00 0.00 0.00 179.25 180.53 2bk5 h GLY 443 N 0.81 0.14 1.23 0.00 0.00 -1.04 -0.46 103.07 103.75 2bk5 h GLY 443 Ca 0.05 -0.07 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 2bk5 h GLY 443 CO 0.10 0.07 -0.19 0.83 0.00 0.00 0.00 176.54 177.34 2bk5 h GLU 444 N 0.03 0.89 -0.09 4.80 5.08 -1.28 -1.18 114.58 122.82 2bk5 h GLU 444 Ca 0.03 -0.36 -0.00 0.00 -1.00 0.00 0.00 59.36 58.03 2bk5 h GLU 444 Cb 0.11 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2bk5 h GLU 444 CO -0.00 1.00 0.05 -0.09 -1.00 0.00 0.00 179.01 178.96 2bk5 h ARG 445 N 0.78 0.13 -0.61 2.33 1.12 -1.09 -1.19 114.38 115.85 2bk5 h ARG 445 Ca 0.11 -0.02 0.03 0.00 -1.11 0.00 0.00 59.98 58.99 2bk5 h ARG 445 Cb 0.73 -0.02 -0.04 0.00 -0.01 0.00 0.00 29.97 30.63 2bk5 h ARG 445 CO 0.06 0.21 0.38 0.00 -3.11 0.00 0.00 179.97 177.50 2bk5 h ALA 446 N 0.92 0.79 -0.47 2.80 0.00 -1.01 0.58 119.26 122.86 2bk5 h ALA 446 Ca 0.03 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.99 2bk5 h ALA 446 Cb 0.12 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2bk5 h ALA 446 CO -0.00 0.12 0.17 0.00 0.00 0.00 0.00 179.25 179.54 2bk5 h ALA 447 N 1.26 0.57 0.00 0.00 0.00 -1.08 -2.56 119.26 117.45 2bk5 h ALA 447 Ca 0.24 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 2bk5 h ALA 447 Cb 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2bk5 h ALA 447 CO -0.10 -0.22 -0.36 0.00 0.00 0.00 0.00 179.25 178.58 2bk5 h ARG 448 N 0.35 0.00 -0.68 0.00 3.08 -0.45 -1.09 114.38 115.58 2bk5 h ARG 448 Ca 0.22 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.28 2bk5 h ARG 448 Cb 0.22 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 2bk5 h ARG 448 CO -0.23 0.36 0.45 0.93 -1.07 0.00 0.00 179.97 180.41 2bk5 h GLU 449 N 0.00 0.89 -0.39 0.04 5.08 -0.52 -0.25 114.58 119.43 2bk5 h GLU 449 Ca -0.00 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 2bk5 h GLU 449 Cb 0.84 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 2bk5 h GLU 449 CO 0.05 0.59 -0.02 0.82 -1.00 0.00 0.00 179.01 179.45 2bk5 h ILE 450 N 0.92 1.26 -0.92 3.13 2.04 -1.09 0.14 117.51 123.00 2bk5 h ILE 450 Ca 0.25 -1.05 0.06 0.00 1.00 0.00 0.00 64.86 65.12 2bk5 h ILE 450 Cb -0.11 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.07 2bk5 h ILE 450 CO -0.05 0.35 0.58 -0.07 0.00 0.00 0.00 178.15 178.96 2bk5 h LEU 451 N 0.53 0.92 -0.37 1.44 3.38 -1.01 0.12 115.31 120.33 2bk5 h LEU 451 Ca 0.11 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 2bk5 h LEU 451 Cb 0.51 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2bk5 h LEU 451 CO 0.02 0.59 0.00 -0.74 0.09 0.00 0.00 178.44 178.41 2bk5 h HIS 452 N 1.06 0.72 -0.37 1.13 2.76 -0.83 0.04 115.15 119.65 2bk5 h HIS 452 Ca 0.40 -0.12 0.06 0.00 -2.20 0.00 0.00 60.37 58.50 2bk5 h HIS 452 Cb 0.17 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 28.92 2bk5 h HIS 452 CO -0.02 0.75 0.25 0.00 -1.30 0.00 0.00 177.93 177.61 2bk5 h ALA 453 N 0.87 2.02 -0.01 5.26 0.00 -0.30 0.35 119.26 127.45 2bk5 h ALA 453 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2bk5 h ALA 453 Cb 0.46 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2bk5 h ALA 453 CO 0.02 -0.09 -0.01 -1.33 0.00 0.00 0.00 179.25 177.84 2bk5 n MET 454 N -4.48 1.24 -1.15 0.00 2.00 -0.03 -4.91 117.12 109.79 2bk5 n MET 454 Ca 0.05 -0.39 -0.05 0.00 0.00 0.00 0.00 57.70 57.31 2bk5 n MET 454 Cb 0.26 -1.49 -0.02 0.00 0.00 0.00 0.00 33.22 31.96 2bk5 n MET 454 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2bk5 n GLY 455 N 1.08 0.78 0.12 3.03 0.00 0.11 -4.93 105.19 105.39 2bk5 n GLY 455 Ca 0.22 -0.61 0.03 0.00 0.00 0.00 0.00 46.02 45.65 2bk5 n GLY 455 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bk5 h LYS 456 N 0.13 0.00 -4.43 1.61 1.57 -1.19 -3.47 116.57 110.80 2bk5 h LYS 456 Ca -0.11 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.45 2bk5 h LYS 456 Cb 0.40 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.53 2bk5 h LYS 456 CO 0.16 0.30 -0.71 0.96 -0.57 0.00 0.00 179.45 179.59 2bk5 s ILE 457 N -3.01 0.45 0.73 1.86 -4.36 -1.21 -4.98 121.20 110.68 2bk5 s ILE 457 Ca 0.00 -1.36 -0.11 0.00 -0.26 0.00 0.00 60.65 58.92 2bk5 s ILE 457 Cb 0.08 -0.93 0.03 0.00 1.25 0.00 0.00 42.46 42.89 2bk5 s ILE 457 CO 0.78 -0.61 1.07 -2.16 0.24 0.00 0.00 174.94 174.26 2bk5 s PRO 458 N -2.44 2.62 0.29 0.37 0.04 -1.26 -4.35 135.00 130.26 2bk5 s PRO 458 Ca -0.03 0.89 0.03 0.00 0.04 0.00 0.00 61.00 61.92 2bk5 s PRO 458 Cb -0.04 -1.96 0.62 0.00 0.04 0.00 0.00 34.50 33.16 2bk5 s PRO 458 CO -0.03 -1.31 1.80 1.49 0.04 0.00 0.00 177.00 179.00 2bk5 h GLU 459 N -0.87 0.82 0.00 4.56 4.81 -1.98 -1.41 114.58 120.50 2bk5 h GLU 459 Ca -0.45 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2bk5 h GLU 459 Cb 1.23 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2bk5 h GLU 459 CO 0.57 0.54 0.00 -0.40 -0.73 0.00 0.00 179.01 178.99 2bk5 n ASP 460 N -4.72 0.00 -0.76 1.04 3.85 -1.26 -2.22 116.55 112.48 2bk5 n ASP 460 Ca 0.20 -0.71 0.10 0.00 -0.71 0.00 0.00 54.79 53.67 2bk5 n ASP 460 Cb 0.45 0.00 0.08 0.00 -1.35 0.00 0.00 41.12 40.30 2bk5 n ASP 460 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2bk5 n GLU 461 N -0.94 1.67 -0.03 0.11 1.02 -0.53 -4.52 120.64 117.42 2bk5 n GLU 461 Ca 0.13 -1.63 -0.12 0.00 -0.02 0.00 0.00 57.16 55.53 2bk5 n GLU 461 Cb 0.06 -1.37 -0.07 0.00 -0.02 0.00 0.00 31.44 30.05 2bk5 n GLU 461 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2bk5 h ILE 462 N 3.73 1.22 -3.80 -3.67 2.04 -1.57 -3.40 117.51 112.06 2bk5 h ILE 462 Ca 0.00 -0.68 -0.65 0.00 1.00 0.00 0.00 64.86 64.53 2bk5 h ILE 462 Cb 0.80 1.46 -0.19 0.00 -0.74 0.00 0.00 36.82 38.15 2bk5 h ILE 462 CO 0.00 0.20 -0.54 0.26 0.00 0.00 0.00 178.15 178.07 2bk5 s TRP 463 N -5.17 3.19 -0.08 1.37 0.52 -1.26 -4.60 118.94 112.91 2bk5 s TRP 463 Ca -0.14 -0.10 0.04 0.00 0.02 0.00 0.00 56.10 55.92 2bk5 s TRP 463 Cb 0.05 -2.36 -0.00 0.00 -1.15 0.00 0.00 33.47 30.01 2bk5 s TRP 463 CO 0.70 -0.26 -0.23 -1.14 0.02 0.00 0.00 176.95 176.04 2bk5 s GLN 464 N 1.71 2.76 0.82 4.98 0.74 -1.26 -5.03 119.66 124.39 2bk5 s GLN 464 Ca 0.07 -0.84 -0.11 0.00 0.05 0.00 0.00 55.36 54.53 2bk5 s GLN 464 Cb -0.16 -2.16 0.09 0.00 1.10 0.00 0.00 33.01 31.87 2bk5 s GLN 464 CO 0.09 0.23 1.09 -1.54 -0.55 0.00 0.00 175.29 174.61 2bk5 s SER 465 N 0.22 4.06 -0.11 6.67 1.04 -1.26 -5.06 113.70 119.25 2bk5 s SER 465 Ca -0.14 1.76 0.02 0.00 0.48 0.00 0.00 55.95 58.07 2bk5 s SER 465 Cb -0.16 -2.43 0.01 0.00 0.10 0.00 0.00 66.02 63.54 2bk5 s SER 465 CO 0.07 -2.31 -0.18 -0.70 0.98 0.00 0.00 173.24 171.10 2bk5 s GLU 466 N -4.89 2.49 0.46 4.02 2.56 -1.26 -5.12 118.70 116.97 2bk5 s GLU 466 Ca 0.62 -0.66 -0.25 0.00 0.00 0.00 0.00 54.97 54.68 2bk5 s GLU 466 Cb -0.18 -2.05 -0.08 0.00 2.00 0.00 0.00 34.13 33.83 2bk5 s GLU 466 CO 0.57 -0.02 1.38 -2.14 -0.56 0.00 0.00 175.26 174.49 2bk5 s PRO 467 N 0.85 3.64 0.30 4.30 0.02 -1.26 -4.93 135.00 137.92 2bk5 s PRO 467 Ca -0.08 2.31 -0.29 0.00 0.02 0.00 0.00 61.00 62.95 2bk5 s PRO 467 Cb -0.15 -2.59 -0.11 0.00 0.02 0.00 0.00 34.50 31.67 2bk5 s PRO 467 CO -0.00 -0.81 1.48 -2.00 -0.33 0.00 0.00 177.00 175.34 2bk5 s GLU 468 N -2.50 4.20 0.26 5.54 2.12 -1.26 -4.88 118.70 122.18 2bk5 s GLU 468 Ca 0.62 2.44 -0.30 0.00 0.36 0.00 0.00 54.97 58.08 2bk5 s GLU 468 Cb -0.41 -3.05 -0.13 0.00 0.26 0.00 0.00 34.13 30.80 2bk5 s GLU 468 CO 0.52 -0.48 1.41 0.45 -0.54 0.00 0.00 175.26 176.62 2bk5 n SER 469 N 1.74 2.88 0.15 -1.70 2.88 -1.26 -4.91 113.62 113.40 2bk5 n SER 469 Ca 0.05 1.15 0.06 0.00 -1.33 0.00 0.00 58.87 58.81 2bk5 n SER 469 Cb 0.39 -1.46 0.06 0.00 -0.75 0.00 0.00 64.21 62.45 2bk5 n SER 469 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2bk5 h VAL 470 N 2.99 0.45 0.04 2.46 -1.51 -2.01 -3.32 116.25 115.35 2bk5 h VAL 470 Ca -0.45 -1.67 -0.27 0.00 -1.23 0.00 0.00 66.70 63.08 2bk5 h VAL 470 Cb 1.27 2.15 -0.03 0.00 -2.13 0.00 0.00 31.29 32.55 2bk5 h VAL 470 CO 0.74 0.26 -1.41 0.44 -1.23 0.00 0.00 177.57 176.36 2bk5 h ASP 471 N 0.00 0.15 -2.37 4.19 5.19 -2.02 -3.40 116.42 118.16 2bk5 h ASP 471 Ca -0.02 -0.21 -0.59 0.00 -0.62 0.00 0.00 57.03 55.59 2bk5 h ASP 471 Cb 1.24 -0.05 -0.41 0.00 0.18 0.00 0.00 39.33 40.29 2bk5 h ASP 471 CO 0.03 1.18 -0.77 0.52 -3.12 0.00 0.00 179.24 177.08 2bk5 n VAL 472 N -3.30 0.89 -2.34 -1.35 0.31 -1.26 -5.11 118.33 106.17 2bk5 n VAL 472 Ca -0.11 -4.57 -0.35 0.00 -0.01 0.00 0.00 64.34 59.30 2bk5 n VAL 472 Cb 1.01 -2.02 -0.01 0.00 -0.91 0.00 0.00 33.84 31.91 2bk5 n VAL 472 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2bk5 s PRO 473 N -1.54 3.62 -0.26 5.55 0.04 -1.25 -4.52 135.00 136.63 2bk5 s PRO 473 Ca 0.34 1.59 -0.15 0.00 0.04 0.00 0.00 61.00 62.83 2bk5 s PRO 473 Cb 0.09 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 2bk5 s PRO 473 CO -0.10 -0.63 0.35 0.00 0.04 0.00 0.00 177.00 176.67 2bk5 s ALA 474 N -1.75 3.56 0.29 8.56 0.00 -1.26 -4.80 121.76 126.36 2bk5 s ALA 474 Ca 0.68 -0.80 -0.28 0.00 0.00 0.00 0.00 51.96 51.56 2bk5 s ALA 474 Cb -0.23 -2.67 -0.09 0.00 0.00 0.00 0.00 23.12 20.13 2bk5 s ALA 474 CO 0.27 -0.58 1.00 -0.65 0.00 0.00 0.00 175.76 175.80 2bk5 s GLN 475 N 1.90 4.65 0.68 0.00 -1.52 -1.26 -5.04 119.66 119.07 2bk5 s GLN 475 Ca 0.15 1.55 -0.15 0.00 -1.95 0.00 0.00 55.36 54.95 2bk5 s GLN 475 Cb -0.16 -3.06 0.01 0.00 -0.22 0.00 0.00 33.01 29.59 2bk5 s GLN 475 CO 0.09 0.30 1.13 -1.25 -0.25 0.00 0.00 175.29 175.31 2bk5 s PRO 476 N -1.61 2.61 -0.16 2.91 0.04 -1.26 -4.99 135.00 132.54 2bk5 s PRO 476 Ca 0.46 1.46 -0.24 0.00 0.04 0.00 0.00 61.00 62.72 2bk5 s PRO 476 Cb -0.26 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 2bk5 s PRO 476 CO 0.32 -1.41 0.76 0.42 0.04 0.00 0.00 177.00 177.13 2bk5 s ILE 477 N -2.30 4.94 0.24 0.56 -1.09 -1.26 -5.06 121.20 117.23 2bk5 s ILE 477 Ca 0.68 1.49 0.12 0.00 -2.23 0.00 0.00 60.65 60.71 2bk5 s ILE 477 Cb -0.22 -4.07 -0.05 0.00 -1.58 0.00 0.00 42.46 36.54 2bk5 s ILE 477 CO 0.43 0.08 -0.21 0.42 -1.23 0.00 0.00 174.94 174.43 2bk5 s THR 478 N 1.92 2.47 0.20 2.92 -4.23 -1.26 -5.15 115.64 112.50 2bk5 s THR 478 Ca 0.36 -2.20 0.07 0.00 -1.18 0.00 0.00 61.69 58.73 2bk5 s THR 478 Cb -0.16 -2.24 -0.05 0.00 1.34 0.00 0.00 72.50 71.38 2bk5 s THR 478 CO 0.13 -0.26 -0.12 0.42 -0.54 0.00 0.00 174.62 174.24 2bk5 s THR 479 N -2.09 1.58 0.35 3.99 -4.23 -1.26 -5.16 115.64 108.82 2bk5 s THR 479 Ca 0.26 -2.17 0.02 0.00 -1.18 0.00 0.00 61.69 58.62 2bk5 s THR 479 Cb -0.06 -2.04 -0.02 0.00 1.34 0.00 0.00 72.50 71.71 2bk5 s THR 479 CO 0.13 -0.60 0.53 0.42 -0.54 0.00 0.00 174.62 174.56 2bk5 s THR 480 N -3.07 4.78 0.21 3.99 -4.23 -1.26 -4.98 115.64 111.08 2bk5 s THR 480 Ca 0.22 -0.62 -0.09 0.00 -1.18 0.00 0.00 61.69 60.02 2bk5 s THR 480 Cb 0.01 -3.73 0.16 0.00 1.34 0.00 0.00 72.50 70.27 2bk5 s THR 480 CO 0.06 -0.43 1.73 0.15 -0.54 0.00 0.00 174.62 175.60 2bk5 h PHE 481 N 0.76 0.36 -0.49 3.99 3.57 -2.02 -1.46 116.94 121.66 2bk5 h PHE 481 Ca -0.49 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 60.97 2bk5 h PHE 481 Cb 1.23 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.89 2bk5 h PHE 481 CO 0.48 0.06 0.03 -0.07 -2.23 0.00 0.00 178.31 176.59 2bk5 h LEU 482 N 0.38 0.82 -0.82 0.59 3.38 -1.96 -1.27 115.31 116.42 2bk5 h LEU 482 Ca 0.32 -0.29 0.08 0.00 0.09 0.00 0.00 57.88 58.08 2bk5 h LEU 482 Cb 0.43 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.89 2bk5 h LEU 482 CO -0.34 0.90 0.48 -0.33 0.09 0.00 0.00 178.44 179.25 2bk5 h GLU 483 N 0.71 0.81 -0.28 1.13 5.08 -1.82 0.10 114.58 120.32 2bk5 h GLU 483 Ca 0.14 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.31 2bk5 h GLU 483 Cb 0.46 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2bk5 h GLU 483 CO 0.02 0.53 -0.41 0.00 -1.00 0.00 0.00 179.01 178.15 2bk5 h ARG 484 N 0.83 0.67 0.00 2.33 3.08 -0.96 -3.39 114.38 116.95 2bk5 h ARG 484 Ca 0.38 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2bk5 h ARG 484 Cb 0.29 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2bk5 h ARG 484 CO -0.22 0.96 -0.66 0.72 -1.07 0.00 0.00 179.97 179.70 2bk5 n HIS 485 N -4.03 0.00 -1.75 3.04 8.25 -0.51 -4.99 115.22 115.23 2bk5 n HIS 485 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 2bk5 n HIS 485 Cb 0.53 -0.05 -0.01 0.00 1.12 0.00 0.00 29.99 31.58 2bk5 n HIS 485 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2bk5 n LEU 486 N -1.36 4.37 -4.81 2.41 4.77 0.33 -4.96 117.00 117.75 2bk5 n LEU 486 Ca 0.00 1.20 -0.32 0.00 -0.03 0.00 0.00 56.01 56.86 2bk5 n LEU 486 Cb 0.13 -1.58 0.04 0.00 -2.33 0.00 0.00 43.42 39.68 2bk5 n LEU 486 CO 0.13 0.02 0.71 -2.16 -1.33 0.00 0.00 177.39 174.77 2bk5 s PRO 487 N -1.50 2.98 1.12 3.23 0.04 -1.26 -4.94 135.00 134.67 2bk5 s PRO 487 Ca 0.58 1.09 -0.17 0.00 0.04 0.00 0.00 61.00 62.53 2bk5 s PRO 487 Cb -0.51 -1.99 0.25 0.00 0.04 0.00 0.00 34.50 32.29 2bk5 s PRO 487 CO 0.58 -1.07 1.12 -1.54 0.04 0.00 0.00 177.00 176.14 2bk5 s SER 488 N -3.34 1.60 0.08 6.66 1.04 -1.26 -4.77 113.70 113.71 2bk5 s SER 488 Ca 0.61 0.74 -0.26 0.00 0.48 0.00 0.00 55.95 57.52 2bk5 s SER 488 Cb -0.15 -1.08 -0.16 0.00 0.10 0.00 0.00 66.02 64.72 2bk5 s SER 488 CO 0.48 -3.71 1.68 0.58 0.98 0.00 0.00 173.24 173.24 2bk5 h VAL 489 N -2.30 0.83 -0.17 5.02 2.07 -1.90 -0.16 116.25 119.64 2bk5 h VAL 489 Ca -0.48 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 2bk5 h VAL 489 Cb 1.30 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 2bk5 h VAL 489 CO 0.41 0.01 -0.07 1.55 0.02 0.00 0.00 177.57 179.50 2bk5 h PRO 490 N -0.28 0.26 -0.57 1.57 0.13 -1.96 -1.93 132.00 129.21 2bk5 h PRO 490 Ca -0.03 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.08 2bk5 h PRO 490 Cb 0.22 -0.04 -0.04 0.00 0.13 0.00 0.00 31.00 31.27 2bk5 h PRO 490 CO 0.04 0.35 0.34 0.78 -0.23 0.00 0.00 178.00 179.28 2bk5 h GLY 491 N 0.65 0.80 1.06 1.56 0.00 -1.84 -0.09 103.07 105.21 2bk5 h GLY 491 Ca 0.05 -0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 2bk5 h GLY 491 CO 0.01 0.22 0.30 -2.00 0.00 0.00 0.00 176.54 175.07 2bk5 h LEU 492 N 0.68 1.10 -1.13 3.11 5.85 -0.62 -2.29 115.31 122.01 2bk5 h LEU 492 Ca 0.23 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 2bk5 h LEU 492 Cb 0.02 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 2bk5 h LEU 492 CO -0.10 0.99 -0.15 -0.07 -0.34 0.00 0.00 178.44 178.77 2bk5 h LEU 493 N 1.16 0.42 -0.53 2.25 3.38 -0.78 -0.94 115.31 120.27 2bk5 h LEU 493 Ca 0.26 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 58.00 2bk5 h LEU 493 Cb 0.24 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2bk5 h LEU 493 CO -0.02 0.60 -0.16 0.03 0.09 0.00 0.00 178.44 178.98 2bk5 h ARG 494 N 0.40 1.02 -0.36 1.13 3.08 -0.80 -2.89 114.38 115.95 2bk5 h ARG 494 Ca 0.07 -0.41 -0.04 0.00 0.07 0.00 0.00 59.98 59.68 2bk5 h ARG 494 Cb 0.50 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2bk5 h ARG 494 CO 0.03 1.09 0.05 -0.07 -1.07 0.00 0.00 179.97 180.01 2bk5 h LEU 495 N 0.89 0.50 0.00 3.04 4.07 -1.03 -3.52 115.31 119.28 2bk5 h LEU 495 Ca 0.13 -0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2bk5 h LEU 495 Cb 0.74 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.35 2bk5 h LEU 495 CO 0.06 0.54 0.00 -0.38 -1.08 0.00 0.00 178.44 177.58