#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bwg s ARG 3 N 0.00 4.11 -0.21 -0.52 1.70 -1.26 -5.08 118.95 117.69 2bwg s ARG 3 Ca 0.00 0.66 -0.09 0.00 -0.47 0.00 0.00 55.73 55.82 2bwg s ARG 3 Cb 0.00 -3.01 -0.05 0.00 -0.57 0.00 0.00 34.95 31.33 2bwg s ARG 3 CO 0.00 0.50 0.12 0.42 -1.08 0.00 0.00 175.30 175.26 2bwg s ILE 4 N -1.38 5.12 0.02 4.99 1.01 -1.26 -5.07 121.20 124.64 2bwg s ILE 4 Ca 0.37 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.80 2bwg s ILE 4 Cb -0.17 -3.35 -0.06 0.00 0.01 0.00 0.00 42.46 38.89 2bwg s ILE 4 CO 0.20 0.41 1.45 -0.62 0.00 0.00 0.00 174.94 176.37 2bwg s ASP 5 N 0.70 6.80 0.22 3.58 -1.08 -1.26 -4.92 116.67 120.71 2bwg s ASP 5 Ca 0.06 2.20 -0.06 0.00 -0.52 0.00 0.00 52.55 54.23 2bwg s ASP 5 Cb -0.13 -2.56 0.21 0.00 -1.46 0.00 0.00 42.92 38.98 2bwg s ASP 5 CO 0.01 -0.74 1.73 0.00 0.52 0.00 0.00 175.17 176.69 2bwg h ALA 6 N 7.84 1.01 -2.36 3.66 0.00 -2.07 -3.42 119.26 123.92 2bwg h ALA 6 Ca -0.39 -0.26 -0.53 0.00 0.00 0.00 0.00 54.91 53.73 2bwg h ALA 6 Cb 1.18 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 18.75 2bwg h ALA 6 CO 0.90 0.63 1.19 0.34 0.00 0.00 0.00 179.25 182.32 2bwg s ASP 7 N -6.54 6.48 0.17 0.00 2.15 -1.26 -4.99 116.67 112.68 2bwg s ASP 7 Ca -0.11 2.62 -0.30 0.00 0.43 0.00 0.00 52.55 55.19 2bwg s ASP 7 Cb 0.15 -2.54 -0.08 0.00 -0.30 0.00 0.00 42.92 40.15 2bwg s ASP 7 CO 0.83 -1.03 1.24 -0.22 -0.17 0.00 0.00 175.17 175.83 2bwg s LEU 8 N 4.15 4.42 -0.20 -1.34 2.96 -1.26 -5.03 118.68 122.38 2bwg s LEU 8 Ca 0.85 2.26 -0.09 0.00 -0.22 0.00 0.00 54.13 56.93 2bwg s LEU 8 Cb -0.42 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 42.63 2bwg s LEU 8 CO 0.39 -0.45 0.10 -0.54 -1.32 0.00 0.00 176.35 174.53 2bwg s LYS 9 N 0.08 4.07 0.00 1.98 -0.14 -1.26 -5.09 119.74 119.39 2bwg s LYS 9 Ca 0.56 -0.29 -0.02 0.00 -1.36 0.00 0.00 55.97 54.86 2bwg s LYS 9 Cb -0.34 -3.34 -0.04 0.00 -1.68 0.00 0.00 37.83 32.43 2bwg s LYS 9 CO 0.36 0.25 0.16 -0.51 -0.76 0.00 0.00 175.35 174.84 2bwg s LEU 10 N 0.48 4.24 0.00 3.17 1.43 -1.26 -4.84 118.68 121.90 2bwg s LEU 10 Ca 0.06 0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.43 2bwg s LEU 10 Cb -0.12 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.53 2bwg s LEU 10 CO -0.00 0.25 0.00 -0.67 0.23 0.00 0.00 176.35 176.16 2bwg n ASP 11 N 0.91 0.40 0.07 2.29 -0.08 -1.26 -2.08 116.55 116.80 2bwg n ASP 11 Ca -0.11 -0.90 -0.03 0.00 -1.51 0.00 0.00 54.79 52.24 2bwg n ASP 11 Cb 0.52 0.00 0.19 0.00 2.34 0.00 0.00 41.12 44.17 2bwg n ASP 11 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 2bwg h PHE 12 N 0.18 0.36 0.00 -0.67 0.04 -1.94 -2.83 116.94 112.07 2bwg h PHE 12 Ca 0.00 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.67 2bwg h PHE 12 Cb 0.00 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.07 2bwg h PHE 12 CO 0.00 0.69 0.00 1.57 -0.60 0.00 0.00 178.31 179.97 2bwg h LYS 13 N 0.25 0.00 0.00 1.51 -0.00 -1.98 -2.71 116.57 113.64 2bwg h LYS 13 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.67 2bwg h LYS 13 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.10 2bwg h LYS 13 CO 0.07 0.00 -0.07 -0.25 -0.00 0.00 0.00 179.45 179.20 2bwg n ASP 14 N -2.70 0.39 -4.32 7.07 8.00 -1.07 -4.87 116.55 119.05 2bwg n ASP 14 Ca 0.02 0.46 -0.17 0.00 0.71 0.00 0.00 54.79 55.81 2bwg n ASP 14 Cb 0.33 -0.52 -0.10 0.00 -0.02 0.00 0.00 41.12 40.80 2bwg n ASP 14 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2bwg s VAL 15 N -3.05 1.04 0.07 2.53 -7.23 -1.02 -1.31 120.40 111.43 2bwg s VAL 15 Ca 0.12 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.27 2bwg s VAL 15 Cb 0.16 -2.27 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 2bwg s VAL 15 CO 0.58 -0.38 -0.06 -0.76 -0.31 0.00 0.00 175.10 174.16 2bwg s LEU 16 N -3.28 2.40 0.03 1.32 1.43 -0.70 -4.89 118.68 114.99 2bwg s LEU 16 Ca 0.27 -0.81 -0.22 0.00 -1.03 0.00 0.00 54.13 52.34 2bwg s LEU 16 Cb 0.05 -0.07 -0.06 0.00 0.03 0.00 0.00 46.19 46.15 2bwg s LEU 16 CO 0.07 -0.38 0.65 -0.76 0.23 0.00 0.00 176.35 176.17 2bwg s LEU 17 N -2.40 4.46 0.08 1.79 1.43 -1.26 -0.75 118.68 122.02 2bwg s LEU 17 Ca 0.02 1.28 -0.28 0.00 -1.03 0.00 0.00 54.13 54.12 2bwg s LEU 17 Cb -0.01 -3.02 -0.05 0.00 0.03 0.00 0.00 46.19 43.14 2bwg s LEU 17 CO -0.03 0.12 0.90 -0.60 0.23 0.00 0.00 176.35 176.97 2bwg s ARG 18 N -0.38 4.62 0.43 1.70 3.52 -0.21 -4.94 118.95 123.70 2bwg s ARG 18 Ca 0.33 1.33 -0.22 0.00 -0.13 0.00 0.00 55.73 57.04 2bwg s ARG 18 Cb -0.19 -3.38 -0.09 0.00 -1.56 0.00 0.00 34.95 29.72 2bwg s ARG 18 CO 0.20 0.20 1.01 -1.25 -0.81 0.00 0.00 175.30 174.65 2bwg s PRO 19 N 0.10 4.08 0.06 5.12 0.04 -1.26 -4.67 135.00 138.47 2bwg s PRO 19 Ca 0.45 1.34 0.01 0.00 0.04 0.00 0.00 61.00 62.84 2bwg s PRO 19 Cb -0.22 -2.30 -0.03 0.00 0.04 0.00 0.00 34.50 31.98 2bwg s PRO 19 CO 0.27 -0.19 -0.06 0.15 0.04 0.00 0.00 177.00 177.22 2bwg s LYS 20 N -2.91 0.65 0.27 4.56 1.02 0.24 -4.95 119.74 118.62 2bwg s LYS 20 Ca 0.62 -1.08 -0.30 0.00 0.02 0.00 0.00 55.97 55.23 2bwg s LYS 20 Cb -0.16 -0.11 -0.10 0.00 -0.52 0.00 0.00 37.83 36.93 2bwg s LYS 20 CO 0.21 -0.02 1.49 1.03 -0.92 0.00 0.00 175.35 177.13 2bwg s ARG 21 N -2.99 4.22 0.37 1.68 0.52 -1.26 -4.31 118.95 117.17 2bwg s ARG 21 Ca 0.02 2.40 -0.11 0.00 -0.52 0.00 0.00 55.73 57.52 2bwg s ARG 21 Cb 0.00 -3.08 0.03 0.00 0.52 0.00 0.00 34.95 32.43 2bwg s ARG 21 CO -0.04 -0.49 0.67 -1.54 0.02 0.00 0.00 175.30 173.92 2bwg s SER 22 N 0.37 0.33 0.00 0.23 1.04 -1.26 -4.75 113.70 109.65 2bwg s SER 22 Ca 0.60 -1.25 0.18 0.00 0.48 0.00 0.00 55.95 55.96 2bwg s SER 22 Cb -0.44 0.78 0.50 0.00 0.10 0.00 0.00 66.02 66.96 2bwg s SER 22 CO 0.46 -1.53 1.42 -1.54 0.98 0.00 0.00 173.24 173.02 2bwg n SER 23 N -1.37 3.52 -4.58 7.02 3.41 -1.26 -4.93 113.62 115.42 2bwg n SER 23 Ca -0.05 -1.99 -0.42 0.00 -0.26 0.00 0.00 58.87 56.15 2bwg n SER 23 Cb 0.60 -0.38 -0.06 0.00 -0.26 0.00 0.00 64.21 64.11 2bwg n SER 23 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2bwg s LEU 24 N -1.02 4.20 -0.11 1.04 1.43 -1.26 -4.95 118.68 118.01 2bwg s LEU 24 Ca 0.38 0.28 -0.03 0.00 -1.03 0.00 0.00 54.13 53.74 2bwg s LEU 24 Cb 0.20 -2.82 -0.01 0.00 0.03 0.00 0.00 46.19 43.59 2bwg s LEU 24 CO 0.26 -0.56 -0.06 0.07 0.23 0.00 0.00 176.35 176.30 2bwg h LYS 25 N 8.35 0.00 -6.38 1.70 5.09 -1.93 -3.47 116.57 119.93 2bwg h LYS 25 Ca -0.26 0.00 -0.65 0.00 0.09 0.00 0.00 60.65 59.83 2bwg h LYS 25 Cb 1.11 0.00 -0.12 0.00 0.10 0.00 0.00 32.23 33.32 2bwg h LYS 25 CO 0.83 0.00 -0.67 0.45 -2.09 0.00 0.00 179.45 177.97 2bwg s SER 26 N -5.59 4.91 0.45 7.07 0.15 -1.26 -5.03 113.70 114.41 2bwg s SER 26 Ca -0.05 -0.22 0.23 0.00 0.70 0.00 0.00 55.95 56.61 2bwg s SER 26 Cb 0.01 -1.13 1.05 0.00 -1.71 0.00 0.00 66.02 64.23 2bwg s SER 26 CO 0.07 0.17 1.90 0.08 1.20 0.00 0.00 173.24 176.66 2bwg h ARG 27 N 3.41 0.00 0.00 5.44 0.11 -1.94 -2.88 114.38 118.53 2bwg h ARG 27 Ca -0.48 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.56 2bwg h ARG 27 Cb 1.17 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.24 2bwg h ARG 27 CO 0.58 0.24 -0.19 0.00 0.10 0.00 0.00 179.97 180.70 2bwg h ALA 28 N 1.76 1.49 -0.06 0.08 0.00 -1.96 -1.81 119.26 118.77 2bwg h ALA 28 Ca -0.00 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.76 2bwg h ALA 28 Cb 0.61 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2bwg h ALA 28 CO 0.03 0.23 0.09 0.93 0.00 0.00 0.00 179.25 180.53 2bwg h GLU 29 N 0.00 0.00 -6.34 0.00 5.08 -1.91 -3.44 114.58 107.96 2bwg h GLU 29 Ca -0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 2bwg h GLU 29 Cb 0.38 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 2bwg h GLU 29 CO 0.02 0.00 0.53 0.08 -1.00 0.00 0.00 179.01 178.65 2bwg s VAL 30 N -4.52 4.62 -0.35 3.13 1.01 -0.68 -4.95 120.40 118.66 2bwg s VAL 30 Ca -0.05 1.89 -0.19 0.00 0.00 0.00 0.00 61.98 63.64 2bwg s VAL 30 Cb 0.14 -4.21 -0.00 0.00 0.00 0.00 0.00 36.38 32.31 2bwg s VAL 30 CO 0.51 0.06 0.55 -0.62 0.00 0.00 0.00 175.10 175.60 2bwg s ASP 31 N 1.14 6.35 0.17 3.32 2.15 -0.64 -4.95 116.67 124.22 2bwg s ASP 31 Ca 0.52 0.02 0.23 0.00 0.43 0.00 0.00 52.55 53.75 2bwg s ASP 31 Cb -0.22 -2.29 0.05 0.00 -0.30 0.00 0.00 42.92 40.17 2bwg s ASP 31 CO 0.23 -0.52 1.07 0.18 -0.17 0.00 0.00 175.17 175.97 2bwg n LEU 32 N 5.84 0.79 -4.65 -1.34 4.77 -1.26 -1.25 117.00 119.90 2bwg n LEU 32 Ca -0.04 0.28 -0.44 0.00 -0.03 0.00 0.00 56.01 55.78 2bwg n LEU 32 Cb 0.49 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.48 2bwg n LEU 32 CO 0.46 -0.15 0.85 -0.62 -1.33 0.00 0.00 177.39 176.60 2bwg n GLU 33 N -2.52 1.82 -4.54 3.23 1.02 -1.26 -4.51 120.64 113.88 2bwg n GLU 33 Ca 0.01 0.64 -0.23 0.00 -0.02 0.00 0.00 57.16 57.56 2bwg n GLU 33 Cb 0.52 -2.19 -0.14 0.00 -0.02 0.00 0.00 31.44 29.61 2bwg n GLU 33 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2bwg s ARG 34 N -1.15 1.19 -0.19 3.49 1.81 0.20 -4.68 118.95 119.62 2bwg s ARG 34 Ca 0.62 -0.82 -0.01 0.00 -1.72 0.00 0.00 55.73 53.80 2bwg s ARG 34 Cb -0.65 -1.24 0.00 0.00 -0.45 0.00 0.00 34.95 32.61 2bwg s ARG 34 CO 0.56 0.32 -0.12 0.99 -0.68 0.00 0.00 175.30 176.37 2bwg s THR 35 N -0.76 2.80 -0.03 0.02 2.01 -1.26 -1.31 115.64 117.10 2bwg s THR 35 Ca 0.05 -0.70 0.08 0.00 0.31 0.00 0.00 61.69 61.43 2bwg s THR 35 Cb -0.08 -2.23 -0.02 0.00 0.01 0.00 0.00 72.50 70.18 2bwg s THR 35 CO 0.01 0.48 -0.26 -0.36 -0.69 0.00 0.00 174.62 173.81 2bwg s PHE 36 N 1.26 2.36 -0.28 4.92 0.08 -0.15 -4.97 117.98 121.21 2bwg s PHE 36 Ca 0.03 -0.50 -0.04 0.00 0.12 0.00 0.00 56.93 56.54 2bwg s PHE 36 Cb -0.14 -1.52 0.02 0.00 -0.57 0.00 0.00 43.02 40.81 2bwg s PHE 36 CO -0.06 -0.07 0.01 0.99 -0.10 0.00 0.00 175.22 175.99 2bwg s THR 37 N -0.52 3.39 0.50 0.64 2.01 -1.26 0.19 115.64 120.59 2bwg s THR 37 Ca 0.07 -0.93 -0.19 0.00 0.31 0.00 0.00 61.69 60.94 2bwg s THR 37 Cb -0.11 -2.77 -0.08 0.00 0.01 0.00 0.00 72.50 69.56 2bwg s THR 37 CO 0.00 0.09 1.03 -0.36 -0.69 0.00 0.00 174.62 174.70 2bwg s PHE 38 N 1.39 3.04 0.02 4.92 0.08 0.08 -4.95 117.98 122.57 2bwg s PHE 38 Ca 0.00 1.56 -0.21 0.00 0.12 0.00 0.00 56.93 58.41 2bwg s PHE 38 Cb -0.17 -3.03 -0.17 0.00 -0.57 0.00 0.00 43.02 39.08 2bwg s PHE 38 CO -0.01 -0.80 1.27 -0.09 -0.10 0.00 0.00 175.22 175.49 2bwg h ARG 39 N 1.35 0.33 0.01 0.44 2.43 -1.85 -2.49 114.38 114.61 2bwg h ARG 39 Ca -0.49 -0.21 -0.40 0.00 -0.81 0.00 0.00 59.98 58.07 2bwg h ARG 39 Cb 1.22 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.73 2bwg h ARG 39 CO 0.59 0.80 -2.39 0.09 -1.51 0.00 0.00 179.97 177.55 2bwg n ASN 40 N -4.52 1.99 0.16 -3.80 3.02 -1.26 -4.34 115.26 106.51 2bwg n ASN 40 Ca -0.07 0.05 0.03 0.00 -0.03 0.00 0.00 54.58 54.56 2bwg n ASN 40 Cb 0.41 -0.59 0.23 0.00 -0.61 0.00 0.00 39.78 39.22 2bwg n ASN 40 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2bwg h SER 41 N -0.30 0.00 0.00 6.41 4.64 -1.79 -3.47 113.55 119.04 2bwg h SER 41 Ca -0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.73 2bwg h SER 41 Cb 1.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 2bwg h SER 41 CO -0.16 0.49 0.00 0.29 -0.87 0.00 0.00 176.83 176.57 2bwg n LYS 42 N -3.55 -1.25 -1.72 4.77 4.76 -0.94 -4.65 118.16 115.57 2bwg n LYS 42 Ca -0.00 0.31 -0.31 0.00 -2.87 0.00 0.00 58.31 55.45 2bwg n LYS 42 Cb 0.59 -4.34 0.05 0.00 -1.84 0.00 0.00 35.03 29.49 2bwg n LYS 42 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2bwg s GLN 43 N -1.32 2.90 -0.08 1.97 -1.52 -1.26 -4.70 119.66 115.65 2bwg s GLN 43 Ca 0.00 0.71 0.03 0.00 -1.95 0.00 0.00 55.36 54.15 2bwg s GLN 43 Cb 0.00 -2.00 -0.02 0.00 -0.22 0.00 0.00 33.01 30.77 2bwg s GLN 43 CO 0.00 -1.06 -0.16 0.99 -0.25 0.00 0.00 175.29 174.80 2bwg s THR 44 N -3.18 2.84 0.01 -0.19 2.01 -1.26 -0.74 115.64 115.12 2bwg s THR 44 Ca 0.58 -0.78 0.07 0.00 0.31 0.00 0.00 61.69 61.87 2bwg s THR 44 Cb -0.13 -2.12 -0.03 0.00 0.01 0.00 0.00 72.50 70.24 2bwg s THR 44 CO 0.54 0.56 -0.23 -0.47 -0.69 0.00 0.00 174.62 174.34 2bwg s TYR 45 N -0.25 2.43 -0.02 4.92 5.04 0.13 -4.98 117.35 124.62 2bwg s TYR 45 Ca 0.01 -0.35 0.01 0.00 -2.44 0.00 0.00 57.07 54.29 2bwg s TYR 45 Cb -0.13 -1.48 0.02 0.00 0.35 0.00 0.00 41.96 40.72 2bwg s TYR 45 CO 0.03 0.11 -0.01 0.45 -1.34 0.00 0.00 175.55 174.78 2bwg s SER 46 N -0.99 0.41 0.00 4.32 0.15 -1.26 -0.97 113.70 115.36 2bwg s SER 46 Ca 0.12 -0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2bwg s SER 46 Cb -0.10 -0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 2bwg s SER 46 CO 0.01 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.01 2bwg n GLY 47 N 3.80 -1.63 3.56 9.45 0.00 -0.43 -4.95 105.19 114.99 2bwg n GLY 47 Ca -0.23 -1.09 -0.43 0.00 0.00 0.00 0.00 46.02 44.27 2bwg n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bwg s ILE 48 N -2.59 4.53 -0.19 -0.61 1.01 0.01 0.61 121.20 123.97 2bwg s ILE 48 Ca 0.00 0.68 -0.04 0.00 0.00 0.00 0.00 60.65 61.29 2bwg s ILE 48 Cb 0.00 -4.39 -0.14 0.00 0.01 0.00 0.00 42.46 37.93 2bwg s ILE 48 CO 0.00 -0.78 2.35 -0.81 0.00 0.00 0.00 174.94 175.69 2bwg n PRO 49 N 7.01 1.40 -4.67 2.79 -0.04 -1.26 -4.19 135.00 136.05 2bwg n PRO 49 Ca 0.05 -0.78 -0.33 0.00 -0.04 0.00 0.00 63.50 62.40 2bwg n PRO 49 Cb 0.48 -1.93 -0.14 0.00 -0.04 0.00 0.00 33.50 31.87 2bwg n PRO 49 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2bwg s ILE 50 N 2.09 3.02 -0.09 0.52 1.01 -1.26 -1.43 121.20 125.04 2bwg s ILE 50 Ca 0.41 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 60.42 2bwg s ILE 50 Cb 0.18 -2.28 -0.01 0.00 0.01 0.00 0.00 42.46 40.36 2bwg s ILE 50 CO -0.01 0.52 -0.19 -0.63 0.00 0.00 0.00 174.94 174.63 2bwg s ILE 51 N 0.51 2.54 0.01 2.92 1.01 0.53 -1.65 121.20 127.08 2bwg s ILE 51 Ca -0.09 -0.87 -0.30 0.00 0.00 0.00 0.00 60.65 59.40 2bwg s ILE 51 Cb -0.16 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.27 2bwg s ILE 51 CO 0.04 0.55 1.05 -0.69 0.00 0.00 0.00 174.94 175.90 2bwg s VAL 52 N 0.06 4.61 0.63 2.92 1.01 -0.21 -0.60 120.40 128.81 2bwg s VAL 52 Ca -0.08 1.87 -0.17 0.00 0.00 0.00 0.00 61.98 63.60 2bwg s VAL 52 Cb -0.15 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.01 2bwg s VAL 52 CO 0.05 0.13 1.17 0.00 0.00 0.00 0.00 175.10 176.46 2bwg s ALA 53 N 1.13 2.47 -0.38 5.51 0.00 0.15 -1.57 121.76 129.08 2bwg s ALA 53 Ca 0.54 0.85 -0.07 0.00 0.00 0.00 0.00 51.96 53.28 2bwg s ALA 53 Cb -0.23 -3.41 -0.20 0.00 0.00 0.00 0.00 23.12 19.28 2bwg s ALA 53 CO 0.27 -1.26 3.41 0.27 0.00 0.00 0.00 175.76 178.46 2bwg n ASN 54 N -1.95 6.08 -4.96 0.00 6.94 -1.20 -2.92 115.26 117.25 2bwg n ASN 54 Ca 0.12 -2.56 -0.22 0.00 -0.02 0.00 0.00 54.58 51.90 2bwg n ASN 54 Cb 0.50 -1.43 -0.01 0.00 -2.36 0.00 0.00 39.78 36.48 2bwg n ASN 54 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 2bwg s MET 55 N 0.99 3.33 0.37 -3.83 -1.94 -1.26 -4.34 119.30 112.61 2bwg s MET 55 Ca 0.67 -0.60 0.04 0.00 -1.71 0.00 0.00 55.69 54.08 2bwg s MET 55 Cb 0.29 -2.73 0.70 0.00 2.01 0.00 0.00 34.83 35.10 2bwg s MET 55 CO -0.03 0.13 2.02 -0.44 -0.01 0.00 0.00 175.02 176.69 2bwg h ASP 56 N 0.82 0.65 0.27 3.03 3.32 -1.89 0.04 116.42 122.67 2bwg h ASP 56 Ca -0.49 -0.02 -0.33 0.00 0.02 0.00 0.00 57.03 56.21 2bwg h ASP 56 Cb 1.24 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.58 2bwg h ASP 56 CO 0.59 0.48 -1.95 0.35 -1.72 0.00 0.00 179.24 176.98 2bwg n THR 57 N -4.45 1.63 -0.10 0.35 -2.24 -1.26 -4.54 114.28 103.67 2bwg n THR 57 Ca 0.05 -0.74 -0.12 0.00 -2.27 0.00 0.00 64.05 60.97 2bwg n THR 57 Cb 0.05 -1.21 -0.13 0.00 -2.10 0.00 0.00 70.33 66.94 2bwg n THR 57 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2bwg n VAL 58 N -3.16 1.27 -1.21 2.28 0.24 -1.20 -0.81 118.33 115.74 2bwg n VAL 58 Ca -0.26 -0.67 -0.29 0.00 -2.04 0.00 0.00 64.34 61.08 2bwg n VAL 58 Cb 1.06 -0.82 -0.08 0.00 -1.47 0.00 0.00 33.84 32.52 2bwg n VAL 58 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bwg n GLY 59 N 2.08 3.81 3.78 7.63 0.00 -0.00 -4.73 105.19 117.76 2bwg n GLY 59 Ca -0.34 -1.41 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 2bwg n GLY 59 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bwg s THR 60 N 1.66 3.84 0.31 2.61 -4.23 -1.26 -1.33 115.64 117.24 2bwg s THR 60 Ca 0.69 -1.54 0.04 0.00 -1.18 0.00 0.00 61.69 59.70 2bwg s THR 60 Cb 0.23 -3.18 0.10 0.00 1.34 0.00 0.00 72.50 71.00 2bwg s THR 60 CO -0.04 -0.29 1.79 -0.26 -0.54 0.00 0.00 174.62 175.28 2bwg h PHE 61 N 1.52 0.49 -0.51 3.99 0.04 -1.93 -1.31 116.94 119.24 2bwg h PHE 61 Ca -0.46 -0.08 -0.13 0.00 2.80 0.00 0.00 57.97 60.10 2bwg h PHE 61 Cb 1.25 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 39.25 2bwg h PHE 61 CO 0.59 0.60 -0.17 0.93 -0.60 0.00 0.00 178.31 179.65 2bwg h GLU 62 N 0.41 1.01 -0.54 1.51 3.07 -1.96 -2.09 114.58 115.98 2bwg h GLU 62 Ca 0.07 -0.41 -0.04 0.00 -0.50 0.00 0.00 59.36 58.49 2bwg h GLU 62 Cb 0.53 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.38 2bwg h GLU 62 CO 0.03 1.09 0.20 1.98 -1.40 0.00 0.00 179.01 180.92 2bwg h MET 63 N 0.87 0.82 -0.67 2.33 4.05 -1.64 -2.95 114.93 117.75 2bwg h MET 63 Ca 0.12 -0.16 0.04 0.00 -0.28 0.00 0.00 59.70 59.43 2bwg h MET 63 Cb 0.75 -0.13 -0.04 0.00 -0.80 0.00 0.00 31.60 31.38 2bwg h MET 63 CO 0.06 0.73 0.44 0.00 0.23 0.00 0.00 176.91 178.37 2bwg h ALA 64 N 1.05 1.68 -0.27 0.39 0.00 -0.97 -0.95 119.26 120.19 2bwg h ALA 64 Ca 0.18 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2bwg h ALA 64 Cb 0.22 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2bwg h ALA 64 CO -0.01 0.24 -0.15 0.00 0.00 0.00 0.00 179.25 179.33 2bwg h ALA 65 N 1.62 1.25 0.17 0.00 0.00 -1.20 -0.27 119.26 120.83 2bwg h ALA 65 Ca 0.27 -0.28 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 2bwg h ALA 65 Cb 0.15 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 17.84 2bwg h ALA 65 CO -0.08 0.49 -1.00 0.28 0.00 0.00 0.00 179.25 178.94 2bwg h VAL 66 N 0.42 1.44 -0.65 0.00 2.07 -1.37 -3.29 116.25 114.87 2bwg h VAL 66 Ca 0.08 -2.58 0.00 0.00 0.82 0.00 0.00 66.70 65.02 2bwg h VAL 66 Cb 0.51 3.16 -0.03 0.00 -1.52 0.00 0.00 31.29 33.41 2bwg h VAL 66 CO 0.03 0.74 0.42 0.24 0.02 0.00 0.00 177.57 179.02 2bwg h MET 67 N -0.24 0.87 -0.42 1.57 2.86 -1.00 -2.63 114.93 115.93 2bwg h MET 67 Ca -0.18 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.38 2bwg h MET 67 Cb 1.78 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 33.23 2bwg h MET 67 CO 0.18 0.59 0.16 1.03 1.06 0.00 0.00 176.91 179.93 2bwg h SER 68 N 0.88 0.55 -0.47 1.22 0.87 -1.05 0.18 113.55 115.73 2bwg h SER 68 Ca 0.24 -0.06 0.09 0.00 -1.23 0.00 0.00 61.79 60.83 2bwg h SER 68 Cb -0.07 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 2bwg h SER 68 CO -0.05 0.51 0.32 1.56 -0.53 0.00 0.00 176.83 178.64 2bwg h GLN 69 N 0.60 0.22 -0.64 2.24 4.20 -1.53 -1.20 115.11 118.99 2bwg h GLN 69 Ca 0.15 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.84 2bwg h GLN 69 Cb 0.14 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.87 2bwg h GLN 69 CO -0.01 0.14 0.00 0.72 -0.67 0.00 0.00 178.83 179.01 2bwg n HIS 70 N -4.45 1.53 -1.90 2.96 8.25 -0.38 -4.91 115.22 116.31 2bwg n HIS 70 Ca 0.07 -0.57 -0.21 0.00 -0.26 0.00 0.00 57.72 56.76 2bwg n HIS 70 Cb 0.38 -0.32 -0.06 0.00 1.12 0.00 0.00 29.99 31.11 2bwg n HIS 70 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2bwg n SER 71 N 0.79 -5.67 -4.94 0.41 7.64 -0.45 -4.66 113.62 106.74 2bwg n SER 71 Ca 0.23 0.31 -0.20 0.00 1.01 0.00 0.00 58.87 60.22 2bwg n SER 71 Cb 0.91 -4.88 -0.02 0.00 -1.01 0.00 0.00 64.21 59.22 2bwg n SER 71 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2bwg s MET 72 N -4.25 3.15 -0.02 1.43 -1.94 0.49 -0.81 119.30 117.35 2bwg s MET 72 Ca 0.00 -0.97 0.00 0.00 -1.71 0.00 0.00 55.69 53.01 2bwg s MET 72 Cb 0.00 -2.76 -0.04 0.00 2.01 0.00 0.00 34.83 34.04 2bwg s MET 72 CO 0.00 0.25 0.04 0.12 -0.01 0.00 0.00 175.02 175.42 2bwg s PHE 73 N -2.12 3.19 -0.08 -0.03 5.36 -0.66 -3.36 117.98 120.29 2bwg s PHE 73 Ca 0.39 0.16 0.01 0.00 -0.96 0.00 0.00 56.93 56.53 2bwg s PHE 73 Cb -0.09 -1.72 0.02 0.00 -0.34 0.00 0.00 43.02 40.89 2bwg s PHE 73 CO 0.29 0.51 -0.11 0.99 -1.46 0.00 0.00 175.22 175.44 2bwg s THR 74 N -1.10 1.11 -0.35 0.12 2.01 0.16 -1.05 115.64 116.54 2bwg s THR 74 Ca 0.20 -0.42 -0.20 0.00 0.31 0.00 0.00 61.69 61.58 2bwg s THR 74 Cb -0.12 -1.05 -0.00 0.00 0.01 0.00 0.00 72.50 71.34 2bwg s THR 74 CO 0.11 0.36 0.60 0.00 -0.69 0.00 0.00 174.62 175.00 2bwg s ALA 75 N 0.99 3.47 0.03 7.40 0.00 -0.61 -1.36 121.76 131.68 2bwg s ALA 75 Ca -0.08 -0.87 -0.26 0.00 0.00 0.00 0.00 51.96 50.75 2bwg s ALA 75 Cb -0.15 -3.13 -0.05 0.00 0.00 0.00 0.00 23.12 19.80 2bwg s ALA 75 CO -0.00 -1.28 0.79 0.42 0.00 0.00 0.00 175.76 175.69 2bwg s ILE 76 N 2.62 4.78 0.73 0.00 -1.09 -0.39 -3.22 121.20 124.63 2bwg s ILE 76 Ca 0.23 1.67 -0.15 0.00 -2.23 0.00 0.00 60.65 60.17 2bwg s ILE 76 Cb -0.15 -4.14 0.04 0.00 -1.58 0.00 0.00 42.46 36.63 2bwg s ILE 76 CO 0.14 0.32 1.23 -1.38 -1.23 0.00 0.00 174.94 174.02 2bwg s HIS 77 N 0.20 1.99 -2.00 3.97 -3.43 -0.44 -3.41 115.29 112.17 2bwg s HIS 77 Ca 0.40 1.59 0.14 0.00 -0.80 0.00 0.00 55.06 56.39 2bwg s HIS 77 Cb -0.20 -3.54 0.81 0.00 -1.43 0.00 0.00 32.58 28.22 2bwg s HIS 77 CO 0.23 -2.77 1.52 0.36 -2.00 0.00 0.00 174.74 172.08 2bwg n LYS 78 N -2.64 1.01 -0.08 -0.38 2.85 -1.26 -3.84 118.16 113.83 2bwg n LYS 78 Ca 0.14 -0.02 0.09 0.00 -1.05 0.00 0.00 58.31 57.48 2bwg n LYS 78 Cb 0.50 -1.22 0.12 0.00 -0.65 0.00 0.00 35.03 33.79 2bwg n LYS 78 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2bwg n HIS 79 N -0.69 0.20 -2.43 5.58 8.25 -1.26 -4.90 115.22 119.96 2bwg n HIS 79 Ca 0.10 -0.13 -0.39 0.00 -0.26 0.00 0.00 57.72 57.04 2bwg n HIS 79 Cb 0.05 -0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.12 2bwg n HIS 79 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2bwg s TYR 80 N -1.43 3.39 0.76 4.41 2.02 -1.25 -5.04 117.35 120.22 2bwg s TYR 80 Ca 0.26 1.64 -0.11 0.00 -0.37 0.00 0.00 57.07 58.50 2bwg s TYR 80 Cb 0.17 -3.30 0.05 0.00 -0.40 0.00 0.00 41.96 38.47 2bwg s TYR 80 CO 0.24 -0.79 1.09 -1.54 -1.57 0.00 0.00 175.55 172.98 2bwg s SER 81 N -1.02 4.82 0.22 2.29 1.04 -1.26 -4.90 113.70 114.89 2bwg s SER 81 Ca 0.49 1.39 -0.08 0.00 0.48 0.00 0.00 55.95 58.24 2bwg s SER 81 Cb -0.30 -2.17 0.31 0.00 0.10 0.00 0.00 66.02 63.96 2bwg s SER 81 CO 0.39 -1.77 1.77 0.25 0.98 0.00 0.00 173.24 174.86 2bwg h LEU 82 N -0.95 0.42 -0.96 2.42 5.85 -1.96 -1.83 115.31 118.30 2bwg h LEU 82 Ca -0.46 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.35 2bwg h LEU 82 Cb 1.25 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.22 2bwg h LEU 82 CO 0.59 0.24 0.63 0.44 -0.34 0.00 0.00 178.44 180.00 2bwg h ASP 83 N 0.57 1.07 -0.64 1.25 3.32 -1.99 -0.53 116.42 119.47 2bwg h ASP 83 Ca 0.34 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.36 2bwg h ASP 83 Cb 0.35 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 2bwg h ASP 83 CO -0.27 0.75 0.37 0.44 -1.72 0.00 0.00 179.24 178.81 2bwg h ASP 84 N 1.25 0.78 -0.44 6.45 3.32 -1.74 -0.53 116.42 125.51 2bwg h ASP 84 Ca 0.37 -0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.29 2bwg h ASP 84 Cb -0.06 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 2bwg h ASP 84 CO -0.10 0.63 0.03 -0.50 -1.72 0.00 0.00 179.24 177.58 2bwg h TRP 85 N 0.87 0.80 -0.75 4.55 4.06 -0.98 -1.43 115.95 123.07 2bwg h TRP 85 Ca 0.23 -0.13 0.08 0.00 2.06 0.00 0.00 58.89 61.13 2bwg h TRP 85 Cb 0.00 -0.21 -0.06 0.00 -1.00 0.00 0.00 29.16 27.88 2bwg h TRP 85 CO -0.01 0.78 0.42 0.87 -3.56 0.00 0.00 178.44 176.93 2bwg h LYS 86 N 0.59 0.71 -0.51 0.49 1.57 -0.80 0.19 116.57 118.81 2bwg h LYS 86 Ca 0.13 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.80 2bwg h LYS 86 Cb 0.44 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 2bwg h LYS 86 CO 0.02 0.47 0.06 1.25 -0.57 0.00 0.00 179.45 180.67 2bwg h LEU 87 N 0.73 0.84 -0.61 2.94 5.85 -0.93 -1.14 115.31 122.98 2bwg h LEU 87 Ca 0.35 -0.28 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 2bwg h LEU 87 Cb 0.28 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 2bwg h LEU 87 CO -0.22 0.90 0.28 0.15 -0.34 0.00 0.00 178.44 179.22 2bwg h PHE 88 N 0.74 0.90 -0.74 1.25 3.57 -0.78 -0.50 116.94 121.38 2bwg h PHE 88 Ca 0.15 -0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 2bwg h PHE 88 Cb 0.44 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 2bwg h PHE 88 CO 0.03 0.69 0.23 0.00 -2.23 0.00 0.00 178.31 177.03 2bwg h ALA 89 N 1.12 1.00 -0.40 2.41 0.00 -0.81 0.71 119.26 123.28 2bwg h ALA 89 Ca 0.21 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2bwg h ALA 89 Cb 0.14 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2bwg h ALA 89 CO -0.02 0.67 0.04 1.15 0.00 0.00 0.00 179.25 181.08 2bwg h THR 90 N 1.10 1.25 0.00 0.00 2.02 -0.82 -3.16 112.91 113.31 2bwg h THR 90 Ca 0.24 -0.92 -0.27 0.00 0.77 0.00 0.00 66.41 66.23 2bwg h THR 90 Cb 0.31 1.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.74 2bwg h THR 90 CO -0.01 0.31 -1.66 0.59 0.37 0.00 0.00 175.52 175.13 2bwg n ASN 91 N -4.49 0.87 -2.88 4.18 4.13 -0.23 -4.58 115.26 112.25 2bwg n ASN 91 Ca -0.01 0.41 -0.20 0.00 1.68 0.00 0.00 54.58 56.46 2bwg n ASN 91 Cb 0.25 -0.02 -0.01 0.00 -1.54 0.00 0.00 39.78 38.46 2bwg n ASN 91 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2bwg n HIS 92 N -3.01 1.95 -0.28 3.10 8.25 0.25 -4.92 115.22 120.56 2bwg n HIS 92 Ca -0.16 -3.51 0.07 0.00 -0.26 0.00 0.00 57.72 53.87 2bwg n HIS 92 Cb 1.02 -0.37 0.31 0.00 1.12 0.00 0.00 29.99 32.06 2bwg n HIS 92 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2bwg h PRO 93 N 2.92 0.83 -0.10 -0.41 0.13 -1.69 -1.52 132.00 132.17 2bwg h PRO 93 Ca 0.10 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.21 2bwg h PRO 93 Cb 0.89 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 31.83 2bwg h PRO 93 CO 0.64 0.55 0.18 1.05 -0.23 0.00 0.00 178.00 180.19 2bwg h GLU 94 N 0.86 0.00 0.00 0.86 9.09 -1.91 -2.46 114.58 121.02 2bwg h GLU 94 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.82 2bwg h GLU 94 Cb 0.42 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.52 2bwg h GLU 94 CO -0.17 0.00 -0.52 0.00 0.05 0.00 0.00 179.01 178.37 2bwg h LEU 96 N 0.00 0.00 -0.33 0.00 3.38 -1.54 0.20 115.31 117.02 2bwg h LEU 96 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bwg h LEU 96 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2bwg h LEU 96 CO 0.00 0.13 0.00 0.00 0.09 0.00 0.00 178.44 178.66 2bwg n GLN 97 N -3.69 0.24 -0.38 1.13 3.00 -1.26 -3.52 117.38 112.90 2bwg n GLN 97 Ca -0.02 0.32 0.09 0.00 -0.01 0.00 0.00 57.00 57.38 2bwg n GLN 97 Cb 0.24 -1.85 0.24 0.00 0.00 0.00 0.00 30.24 28.87 2bwg n GLN 97 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2bwg n ASN 98 N -2.29 3.64 -4.35 1.08 3.02 0.69 -4.94 115.26 112.10 2bwg n ASN 98 Ca 0.04 -3.00 -0.20 0.00 -0.03 0.00 0.00 54.58 51.39 2bwg n ASN 98 Cb 0.35 -0.52 -0.10 0.00 -0.61 0.00 0.00 39.78 38.89 2bwg n ASN 98 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2bwg s VAL 99 N -2.78 1.85 0.01 2.41 -7.23 -1.16 -0.67 120.40 112.83 2bwg s VAL 99 Ca 0.40 -2.12 0.06 0.00 -1.81 0.00 0.00 61.98 58.51 2bwg s VAL 99 Cb 0.33 -1.99 -0.02 0.00 0.56 0.00 0.00 36.38 35.25 2bwg s VAL 99 CO 0.08 -0.47 -0.19 0.00 -0.31 0.00 0.00 175.10 174.21 2bwg s ALA 100 N -2.56 1.63 0.01 1.32 0.00 -0.47 -4.22 121.76 117.46 2bwg s ALA 100 Ca 0.21 -0.91 -0.20 0.00 0.00 0.00 0.00 51.96 51.07 2bwg s ALA 100 Cb -0.03 -0.37 -0.06 0.00 0.00 0.00 0.00 23.12 22.66 2bwg s ALA 100 CO 0.08 0.38 0.56 0.54 0.00 0.00 0.00 175.76 177.32 2bwg s VAL 101 N -0.59 4.90 -0.05 0.00 0.11 -0.70 -1.26 120.40 122.82 2bwg s VAL 101 Ca 0.07 1.18 0.00 0.00 -2.93 0.00 0.00 61.98 60.30 2bwg s VAL 101 Cb -0.08 -3.90 -0.03 0.00 -1.53 0.00 0.00 36.38 30.84 2bwg s VAL 101 CO 0.00 0.46 -0.03 -0.44 -3.33 0.00 0.00 175.10 171.76 2bwg s SER 102 N -0.42 4.97 -0.08 3.54 0.01 -1.22 -0.07 113.70 120.43 2bwg s SER 102 Ca 0.29 0.03 -0.07 0.00 1.31 0.00 0.00 55.95 57.51 2bwg s SER 102 Cb -0.18 -1.31 0.02 0.00 0.21 0.00 0.00 66.02 64.77 2bwg s SER 102 CO 0.17 0.34 0.22 -0.55 0.41 0.00 0.00 173.24 173.82 2bwg s SER 103 N -1.10 -0.23 1.10 2.44 0.15 -0.28 -4.39 113.70 111.39 2bwg s SER 103 Ca 0.15 0.44 -0.13 0.00 0.70 0.00 0.00 55.95 57.11 2bwg s SER 103 Cb -0.11 0.43 0.19 0.00 -1.71 0.00 0.00 66.02 64.81 2bwg s SER 103 CO 0.05 -0.09 0.83 0.61 1.20 0.00 0.00 173.24 175.84 2bwg n GLY 104 N 3.13 -2.10 0.70 9.45 0.00 -1.26 -2.30 105.19 112.80 2bwg n GLY 104 Ca -0.14 -1.58 0.09 0.00 0.00 0.00 0.00 46.02 44.39 2bwg n GLY 104 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bwg n SER 105 N -3.98 2.06 -4.83 1.61 3.41 -1.26 -4.54 113.62 106.08 2bwg n SER 105 Ca 0.11 -1.86 -0.31 0.00 -0.26 0.00 0.00 58.87 56.55 2bwg n SER 105 Cb 0.40 -0.19 0.02 0.00 -0.26 0.00 0.00 64.21 64.19 2bwg n SER 105 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2bwg s GLY 106 N -1.32 1.78 0.17 5.00 0.00 -1.26 -4.95 107.32 106.75 2bwg s GLY 106 Ca 0.31 0.10 -0.14 0.00 0.00 0.00 0.00 44.72 44.99 2bwg s GLY 106 CO 0.24 0.39 1.81 -1.61 0.00 0.00 0.00 173.10 173.93 2bwg h GLN 107 N -0.24 0.73 -0.53 2.90 4.15 -2.00 -2.17 115.11 117.96 2bwg h GLN 107 Ca -0.45 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 58.85 2bwg h GLN 107 Cb 1.20 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.72 2bwg h GLN 107 CO 0.59 0.52 0.11 -0.91 -1.93 0.00 0.00 178.83 177.21 2bwg h ASN 108 N 0.73 0.81 -0.56 -0.69 2.35 -1.97 -1.15 115.58 115.11 2bwg h ASN 108 Ca 0.20 -0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2bwg h ASN 108 Cb -0.03 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.10 2bwg h ASN 108 CO -0.04 0.85 0.37 0.44 -1.65 0.00 0.00 177.43 177.40 2bwg h ASP 109 N 0.74 0.65 -0.41 5.81 3.32 -1.85 -0.64 116.42 124.05 2bwg h ASP 109 Ca 0.16 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 2bwg h ASP 109 Cb 0.37 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2bwg h ASP 109 CO 0.01 0.48 0.16 0.25 -1.72 0.00 0.00 179.24 178.41 2bwg h LEU 110 N 0.76 0.56 -0.18 1.55 5.85 -1.04 -0.22 115.31 122.59 2bwg h LEU 110 Ca 0.20 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.77 2bwg h LEU 110 Cb -0.08 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 2bwg h LEU 110 CO -0.04 0.58 0.04 -0.33 -0.34 0.00 0.00 178.44 178.36 2bwg h GLU 111 N 0.51 0.12 -0.61 1.25 5.08 -0.98 0.25 114.58 120.21 2bwg h GLU 111 Ca 0.13 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2bwg h GLU 111 Cb 0.20 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 2bwg h GLU 111 CO -0.01 0.08 0.34 -0.22 -1.00 0.00 0.00 179.01 178.20 2bwg h LYS 112 N 0.12 0.85 -0.24 2.33 3.64 -0.84 -1.39 116.57 121.03 2bwg h LYS 112 Ca 0.08 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 2bwg h LYS 112 Cb 0.06 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2bwg h LYS 112 CO -0.10 0.64 0.06 1.98 -2.27 0.00 0.00 179.45 179.76 2bwg h MET 113 N 0.83 0.39 -0.71 1.90 4.05 -0.78 -1.95 114.93 118.66 2bwg h MET 113 Ca 0.21 -0.09 0.15 0.00 -0.28 0.00 0.00 59.70 59.70 2bwg h MET 113 Cb 0.04 -0.05 -0.11 0.00 -0.80 0.00 0.00 31.60 30.68 2bwg h MET 113 CO -0.04 0.49 0.13 1.15 0.23 0.00 0.00 176.91 178.88 2bwg h THR 114 N 0.22 0.50 -0.61 -0.77 2.02 -0.72 0.04 112.91 113.59 2bwg h THR 114 Ca 0.08 -0.08 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 2bwg h THR 114 Cb 0.28 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 2bwg h THR 114 CO 0.00 0.04 0.02 0.77 0.37 0.00 0.00 175.52 176.72 2bwg h SER 115 N 0.22 1.02 -0.08 4.18 4.64 -0.94 -1.21 113.55 121.39 2bwg h SER 115 Ca 0.40 -0.28 -0.01 0.00 -0.47 0.00 0.00 61.79 61.43 2bwg h SER 115 Cb 0.67 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2bwg h SER 115 CO -0.52 1.06 0.02 0.40 -0.87 0.00 0.00 176.83 176.92 2bwg h ILE 116 N 0.96 1.18 -0.77 0.95 2.04 -0.78 -1.37 117.51 119.72 2bwg h ILE 116 Ca 0.17 -0.54 -0.04 0.00 1.00 0.00 0.00 64.86 65.46 2bwg h ILE 116 Cb 0.53 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.97 2bwg h ILE 116 CO 0.03 0.15 0.33 -0.07 0.00 0.00 0.00 178.15 178.59 2bwg h LEU 117 N -0.07 1.05 -0.73 1.44 3.38 -0.88 0.41 115.31 119.92 2bwg h LEU 117 Ca 0.03 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 2bwg h LEU 117 Cb 0.22 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2bwg h LEU 117 CO -0.00 0.93 -0.19 -0.33 0.09 0.00 0.00 178.44 178.94 2bwg h GLU 118 N 1.11 0.77 0.00 1.13 5.08 -1.22 -2.94 114.58 118.51 2bwg h GLU 118 Ca 0.26 -0.30 -0.14 0.00 -1.00 0.00 0.00 59.36 58.18 2bwg h GLU 118 Cb 0.19 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 2bwg h GLU 118 CO -0.02 0.91 -0.68 0.00 -1.00 0.00 0.00 179.01 178.21 2bwg h ALA 119 N 1.10 0.74 -2.44 3.43 0.00 -0.73 -3.38 119.26 117.99 2bwg h ALA 119 Ca 0.10 -0.62 -0.60 0.00 0.00 0.00 0.00 54.91 53.79 2bwg h ALA 119 Cb 0.69 -0.11 -0.41 0.00 0.00 0.00 0.00 17.79 17.97 2bwg h ALA 119 CO 0.05 0.85 -0.75 0.28 0.00 0.00 0.00 179.25 179.69 2bwg n VAL 120 N -3.53 0.99 0.11 0.00 0.31 0.14 -4.96 118.33 111.39 2bwg n VAL 120 Ca -0.00 -4.60 0.07 0.00 -0.01 0.00 0.00 64.34 59.80 2bwg n VAL 120 Cb 0.72 -2.03 0.39 0.00 -0.91 0.00 0.00 33.84 32.00 2bwg n VAL 120 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2bwg n PRO 121 N 1.59 0.09 0.22 5.55 -0.04 -1.12 -1.72 135.00 139.58 2bwg n PRO 121 Ca 0.25 0.59 0.14 0.00 -0.04 0.00 0.00 63.50 64.44 2bwg n PRO 121 Cb 0.43 -1.81 0.40 0.00 -0.04 0.00 0.00 33.50 32.48 2bwg n PRO 121 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2bwg h GLN 122 N 0.00 0.00 -6.30 0.54 7.50 -1.93 -3.42 115.11 111.51 2bwg h GLN 122 Ca 0.00 0.00 -0.58 0.00 0.50 0.00 0.00 58.65 58.57 2bwg h GLN 122 Cb 0.02 0.00 -0.08 0.00 0.05 0.00 0.00 27.48 27.47 2bwg h GLN 122 CO 0.00 0.00 0.75 0.08 -1.50 0.00 0.00 178.83 178.16 2bwg s VAL 123 N -3.37 4.47 -0.20 -0.54 1.01 -0.70 -4.26 120.40 116.81 2bwg s VAL 123 Ca 0.05 1.34 0.11 0.00 0.00 0.00 0.00 61.98 63.48 2bwg s VAL 123 Cb 0.07 -4.43 0.23 0.00 0.00 0.00 0.00 36.38 32.26 2bwg s VAL 123 CO 0.60 -0.65 1.16 0.29 0.00 0.00 0.00 175.10 176.50 2bwg n LYS 124 N 7.07 2.33 -4.68 2.72 4.76 -1.26 -4.97 118.16 124.13 2bwg n LYS 124 Ca 0.10 -2.19 -0.25 0.00 -2.87 0.00 0.00 58.31 53.10 2bwg n LYS 124 Cb 0.48 -1.36 -0.16 0.00 -1.84 0.00 0.00 35.03 32.15 2bwg n LYS 124 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2bwg s PHE 125 N -1.99 1.57 -0.08 2.13 0.08 -1.26 -0.55 117.98 117.88 2bwg s PHE 125 Ca 0.22 -0.54 0.03 0.00 0.12 0.00 0.00 56.93 56.76 2bwg s PHE 125 Cb 0.17 -1.11 -0.01 0.00 -0.57 0.00 0.00 43.02 41.50 2bwg s PHE 125 CO 0.05 -0.25 -0.19 0.42 -0.10 0.00 0.00 175.22 175.15 2bwg s ILE 126 N 0.44 2.54 -0.27 0.64 1.01 0.78 -1.72 121.20 124.62 2bwg s ILE 126 Ca -0.11 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 59.64 2bwg s ILE 126 Cb -0.14 -1.99 0.03 0.00 0.01 0.00 0.00 42.46 40.37 2bwg s ILE 126 CO 0.04 0.56 -0.02 0.00 0.00 0.00 0.00 174.94 175.51 2bwg s LEU 128 N 1.32 3.58 -0.01 0.00 1.43 0.12 -1.13 118.68 123.99 2bwg s LEU 128 Ca -0.01 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 2bwg s LEU 128 Cb -0.18 -1.86 0.02 0.00 0.03 0.00 0.00 46.19 44.20 2bwg s LEU 128 CO -0.03 0.25 0.01 -1.81 0.23 0.00 0.00 176.35 175.00 2bwg s ASP 129 N -0.08 0.13 0.28 2.29 1.01 -0.97 -1.20 116.67 118.13 2bwg s ASP 129 Ca 0.04 0.01 0.02 0.00 0.71 0.00 0.00 52.55 53.34 2bwg s ASP 129 Cb -0.13 -0.07 -0.06 0.00 1.01 0.00 0.00 42.92 43.68 2bwg s ASP 129 CO 0.02 -0.07 0.08 0.68 0.21 0.00 0.00 175.17 176.09 2bwg s VAL 130 N 0.66 0.79 0.06 -1.27 -7.23 -0.98 -4.04 120.40 108.39 2bwg s VAL 130 Ca -0.06 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 57.92 2bwg s VAL 130 Cb -0.08 -2.70 -0.12 0.00 0.56 0.00 0.00 36.38 34.04 2bwg s VAL 130 CO -0.02 -0.00 1.42 0.00 -0.31 0.00 0.00 175.10 176.20 2bwg h ALA 131 N 2.28 0.27 -3.37 1.32 0.00 -0.80 -3.37 119.26 115.59 2bwg h ALA 131 Ca -0.39 -0.28 -0.64 0.00 0.00 0.00 0.00 54.91 53.60 2bwg h ALA 131 Cb 1.25 -0.07 -0.41 0.00 0.00 0.00 0.00 17.79 18.56 2bwg h ALA 131 CO 0.64 0.08 -0.63 1.21 0.00 0.00 0.00 179.25 180.55 2bwg s ASN 132 N -6.04 4.33 0.00 0.00 3.84 -1.26 -3.57 114.94 112.24 2bwg s ASN 132 Ca -0.14 -3.05 0.13 0.00 0.21 0.00 0.00 52.86 50.01 2bwg s ASN 132 Cb 0.06 -1.64 0.62 0.00 -0.55 0.00 0.00 41.25 39.74 2bwg s ASN 132 CO 0.75 -0.22 1.35 0.61 -2.79 0.00 0.00 177.10 176.80 2bwg n GLY 133 N 3.06 -0.78 0.68 1.21 0.00 -1.25 -1.85 105.19 106.25 2bwg n GLY 133 Ca 0.06 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2bwg n GLY 133 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bwg n TYR 134 N -1.35 0.24 -2.78 1.61 4.01 -1.26 -4.85 117.16 112.77 2bwg n TYR 134 Ca 0.05 -0.12 -0.34 0.00 -0.16 0.00 0.00 57.90 57.33 2bwg n TYR 134 Cb 0.12 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.08 2bwg n TYR 134 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2bwg s SER 135 N -1.60 7.02 0.45 7.72 1.04 -0.77 -4.94 113.70 122.62 2bwg s SER 135 Ca 0.34 1.76 0.23 0.00 0.48 0.00 0.00 55.95 58.76 2bwg s SER 135 Cb 0.19 -2.55 1.02 0.00 0.10 0.00 0.00 66.02 64.78 2bwg s SER 135 CO 0.28 -0.30 1.88 -0.08 0.98 0.00 0.00 173.24 176.00 2bwg h GLU 136 N 2.28 0.00 -0.33 4.02 4.57 -1.93 -2.47 114.58 120.72 2bwg h GLU 136 Ca -0.48 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 57.63 2bwg h GLU 136 Cb 1.19 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.76 2bwg h GLU 136 CO 0.62 0.23 -0.10 1.25 -1.18 0.00 0.00 179.01 179.83 2bwg h HIS 137 N 0.00 0.59 0.04 0.92 2.76 -1.94 -2.24 115.15 115.28 2bwg h HIS 137 Ca -0.00 -0.09 -0.26 0.00 -2.20 0.00 0.00 60.37 57.82 2bwg h HIS 137 Cb 0.65 -0.16 0.02 0.00 1.55 0.00 0.00 27.41 29.47 2bwg h HIS 137 CO 0.00 0.64 -1.04 0.35 -1.30 0.00 0.00 177.93 176.58 2bwg h PHE 138 N 0.51 0.98 -0.69 5.26 3.57 -1.75 -2.10 116.94 122.73 2bwg h PHE 138 Ca 0.10 -0.56 0.12 0.00 3.53 0.00 0.00 57.97 61.16 2bwg h PHE 138 Cb 0.48 -0.10 -0.09 0.00 2.79 0.00 0.00 35.95 39.03 2bwg h PHE 138 CO 0.02 1.40 0.25 0.28 -2.23 0.00 0.00 178.31 178.03 2bwg h VAL 139 N 0.28 0.69 0.00 1.41 2.07 -1.35 -0.50 116.25 118.85 2bwg h VAL 139 Ca -0.14 -0.14 -0.13 0.00 0.82 0.00 0.00 66.70 67.11 2bwg h VAL 139 Cb 1.71 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2bwg h VAL 139 CO 0.20 0.07 -0.60 -0.33 0.02 0.00 0.00 177.57 176.93 2bwg h GLU 140 N 0.41 0.00 -0.36 1.57 4.39 -1.41 -2.16 114.58 117.03 2bwg h GLU 140 Ca 0.36 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.95 2bwg h GLU 140 Cb 0.52 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 2bwg h GLU 140 CO -0.37 0.60 -0.21 0.35 -1.16 0.00 0.00 179.01 178.23 2bwg h PHE 141 N 0.00 0.89 -0.42 4.33 3.57 -0.68 -2.33 116.94 122.31 2bwg h PHE 141 Ca -0.01 -0.23 0.02 0.00 3.53 0.00 0.00 57.97 61.28 2bwg h PHE 141 Cb 1.20 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.71 2bwg h PHE 141 CO 0.00 0.98 0.25 0.28 -2.23 0.00 0.00 178.31 177.58 2bwg h VAL 142 N 0.55 1.04 -0.90 1.41 2.07 -1.02 -1.01 116.25 118.39 2bwg h VAL 142 Ca 0.07 -0.17 0.12 0.00 0.82 0.00 0.00 66.70 67.54 2bwg h VAL 142 Cb 0.76 0.50 -0.07 0.00 -1.52 0.00 0.00 31.29 30.96 2bwg h VAL 142 CO 0.06 0.09 0.58 0.11 0.02 0.00 0.00 177.57 178.43 2bwg h LYS 143 N 0.50 0.80 -0.10 1.57 1.57 -1.31 0.17 116.57 119.77 2bwg h LYS 143 Ca 0.17 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.83 2bwg h LYS 143 Cb 0.01 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.14 2bwg h LYS 143 CO -0.08 0.53 -0.21 1.25 -0.57 0.00 0.00 179.45 180.37 2bwg h LEU 144 N 0.82 0.37 -0.56 2.94 5.85 -0.87 -2.10 115.31 121.75 2bwg h LEU 144 Ca 0.44 -0.56 -0.06 0.00 0.84 0.00 0.00 57.88 58.54 2bwg h LEU 144 Cb 0.53 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 2bwg h LEU 144 CO -0.20 0.86 0.13 0.58 -0.34 0.00 0.00 178.44 179.47 2bwg h VAL 145 N -0.11 1.25 -0.31 1.05 2.07 -0.92 0.10 116.25 119.37 2bwg h VAL 145 Ca 0.00 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 66.67 2bwg h VAL 145 Cb 0.80 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2bwg h VAL 145 CO 0.05 0.33 0.01 -0.09 0.02 0.00 0.00 177.57 177.89 2bwg h ARG 146 N 0.80 0.10 -0.52 1.57 9.65 -1.01 0.19 114.38 125.17 2bwg h ARG 146 Ca 0.17 -0.01 -0.10 0.00 -1.10 0.00 0.00 59.98 58.95 2bwg h ARG 146 Cb 0.36 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.90 2bwg h ARG 146 CO 0.00 0.07 -0.08 0.00 2.80 0.00 0.00 179.97 182.76 2bwg h ALA 147 N 1.26 0.88 -0.19 2.80 0.00 -1.03 -2.00 119.26 120.98 2bwg h ALA 147 Ca 0.15 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 2bwg h ALA 147 Cb 0.19 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2bwg h ALA 147 CO -0.24 0.64 -0.43 0.87 0.00 0.00 0.00 179.25 180.09 2bwg h LYS 148 N 0.85 0.45 -2.29 0.00 1.57 -0.46 -3.38 116.57 113.32 2bwg h LYS 148 Ca 0.14 -0.23 -0.59 0.00 -1.87 0.00 0.00 60.65 58.10 2bwg h LYS 148 Cb 0.61 0.01 -0.40 0.00 0.08 0.00 0.00 32.23 32.53 2bwg h LYS 148 CO 0.04 0.80 -0.88 1.19 -0.57 0.00 0.00 179.45 180.03 2bwg n PHE 149 N -4.01 0.99 0.28 -1.35 3.72 0.64 -4.98 117.46 112.75 2bwg n PHE 149 Ca -0.02 -3.75 0.15 0.00 -0.05 0.00 0.00 57.45 53.78 2bwg n PHE 149 Cb 0.52 -0.30 0.75 0.00 -0.94 0.00 0.00 39.48 39.52 2bwg n PHE 149 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2bwg h PRO 150 N 4.62 0.00 -0.01 -1.08 0.13 -1.55 -2.78 132.00 131.33 2bwg h PRO 150 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2bwg h PRO 150 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2bwg h PRO 150 CO 0.57 0.00 -0.10 0.39 -0.23 0.00 0.00 178.00 178.63 2bwg n GLU 151 N -2.60 1.24 -3.12 0.86 -0.58 -1.26 -4.51 120.64 110.67 2bwg n GLU 151 Ca -0.01 -0.85 -0.35 0.00 -0.42 0.00 0.00 57.16 55.53 2bwg n GLU 151 Cb 0.13 -1.13 -0.06 0.00 -0.57 0.00 0.00 31.44 29.80 2bwg n GLU 151 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2bwg s HIS 152 N -1.07 3.57 -0.08 -0.32 3.76 -1.05 -4.79 115.29 115.31 2bwg s HIS 152 Ca 0.10 1.32 -0.22 0.00 -0.15 0.00 0.00 55.06 56.11 2bwg s HIS 152 Cb 0.08 -2.58 -0.04 0.00 1.11 0.00 0.00 32.58 31.15 2bwg s HIS 152 CO 0.18 0.28 0.65 0.99 -0.85 0.00 0.00 174.74 175.99 2bwg s THR 153 N -1.64 5.08 -0.26 1.30 2.01 0.29 -4.52 115.64 117.91 2bwg s THR 153 Ca 0.46 1.33 -0.03 0.00 0.31 0.00 0.00 61.69 63.75 2bwg s THR 153 Cb -0.15 -3.99 0.02 0.00 0.01 0.00 0.00 72.50 68.39 2bwg s THR 153 CO 0.20 0.27 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.75 2bwg s ILE 154 N 0.77 3.22 -0.05 1.82 1.01 -1.26 -0.16 121.20 126.55 2bwg s ILE 154 Ca 0.35 -0.88 -0.19 0.00 0.00 0.00 0.00 60.65 59.93 2bwg s ILE 154 Cb -0.17 -2.62 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 2bwg s ILE 154 CO 0.16 0.19 0.53 -0.04 0.00 0.00 0.00 174.94 175.78 2bwg s MET 155 N 1.39 4.29 -0.08 2.79 -1.94 0.10 -0.46 119.30 125.39 2bwg s MET 155 Ca 0.01 0.59 -0.03 0.00 -1.71 0.00 0.00 55.69 54.55 2bwg s MET 155 Cb -0.17 -3.37 0.04 0.00 2.01 0.00 0.00 34.83 33.35 2bwg s MET 155 CO -0.02 0.31 0.17 0.00 -0.01 0.00 0.00 175.02 175.46 2bwg s ALA 156 N 0.09 -0.31 0.24 3.03 0.00 -0.27 0.11 121.76 124.64 2bwg s ALA 156 Ca 0.29 0.73 -0.09 0.00 0.00 0.00 0.00 51.96 52.89 2bwg s ALA 156 Cb -0.17 -0.57 0.03 0.00 0.00 0.00 0.00 23.12 22.42 2bwg s ALA 156 CO 0.14 -0.25 0.47 0.41 0.00 0.00 0.00 175.76 176.53 2bwg n GLY 157 N 4.44 1.43 3.47 0.00 0.00 -0.34 -1.00 105.19 113.19 2bwg n GLY 157 Ca -0.22 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.34 2bwg n GLY 157 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bwg s ASN 158 N -2.26 3.77 0.41 1.61 -0.87 -1.26 -2.32 114.94 114.03 2bwg s ASN 158 Ca 0.10 -0.64 0.04 0.00 -1.57 0.00 0.00 52.86 50.79 2bwg s ASN 158 Cb -0.03 -0.47 -0.02 0.00 -0.02 0.00 0.00 41.25 40.71 2bwg s ASN 158 CO 0.07 0.16 0.15 0.68 -2.57 0.00 0.00 177.10 175.59 2bwg s VAL 159 N -1.28 0.51 0.00 1.60 -7.23 -0.74 -3.83 120.40 109.44 2bwg s VAL 159 Ca 0.19 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.36 2bwg s VAL 159 Cb -0.10 -2.32 0.00 0.00 0.56 0.00 0.00 36.38 34.52 2bwg s VAL 159 CO 0.10 0.00 0.14 1.33 -0.31 0.00 0.00 175.10 176.36 2bwg n VAL 160 N -0.91 0.00 -4.11 1.32 0.24 -1.26 -0.62 118.33 112.98 2bwg n VAL 160 Ca -0.05 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.10 2bwg n VAL 160 Cb 0.65 1.53 -0.13 0.00 -1.47 0.00 0.00 33.84 34.42 2bwg n VAL 160 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2bwg s THR 161 N 0.00 0.50 0.38 3.34 -4.23 -1.26 -4.61 115.64 109.76 2bwg s THR 161 Ca 0.00 -0.73 0.20 0.00 -1.18 0.00 0.00 61.69 59.98 2bwg s THR 161 Cb 0.00 -0.51 0.20 0.00 1.34 0.00 0.00 72.50 73.53 2bwg s THR 161 CO 0.00 -0.17 1.96 1.23 -0.54 0.00 0.00 174.62 177.10 2bwg h GLY 162 N 5.13 0.00 1.23 3.99 0.00 -1.91 -2.64 103.07 108.87 2bwg h GLY 162 Ca -0.33 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.94 2bwg h GLY 162 CO 0.45 0.00 0.11 1.05 0.00 0.00 0.00 176.54 178.14 2bwg h GLU 163 N 0.00 0.96 0.00 4.80 9.09 -1.97 -0.98 114.58 126.47 2bwg h GLU 163 Ca -0.00 -0.23 -0.14 0.00 0.05 0.00 0.00 59.36 59.03 2bwg h GLU 163 Cb 0.47 -0.13 -0.02 0.00 -1.65 0.00 0.00 28.75 27.43 2bwg h GLU 163 CO 0.03 0.88 -0.69 1.98 0.05 0.00 0.00 179.01 181.26 2bwg h MET 164 N 0.91 0.00 0.34 1.06 4.05 -1.91 -1.68 114.93 117.70 2bwg h MET 164 Ca 0.19 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.59 2bwg h MET 164 Cb 0.38 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 2bwg h MET 164 CO 0.01 0.69 -0.16 0.28 0.23 0.00 0.00 176.91 177.96 2bwg h VAL 165 N 0.00 0.68 -0.63 -5.77 2.07 -1.14 -1.44 116.25 110.01 2bwg h VAL 165 Ca -0.01 -0.13 0.06 0.00 0.82 0.00 0.00 66.70 67.45 2bwg h VAL 165 Cb 1.39 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 31.85 2bwg h VAL 165 CO 0.09 0.03 0.33 -0.33 0.02 0.00 0.00 177.57 177.71 2bwg h GLU 166 N -0.52 0.59 -0.44 1.57 5.08 -1.13 -0.93 114.58 118.80 2bwg h GLU 166 Ca -0.05 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2bwg h GLU 166 Cb 0.39 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2bwg h GLU 166 CO 0.08 0.39 0.12 1.49 -1.00 0.00 0.00 179.01 180.09 2bwg h GLU 167 N 0.61 0.69 -0.24 2.33 4.57 -1.23 0.11 114.58 121.42 2bwg h GLU 167 Ca 0.29 -0.16 -0.09 0.00 -1.18 0.00 0.00 59.36 58.22 2bwg h GLU 167 Cb 0.21 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 2bwg h GLU 167 CO -0.20 0.68 -0.25 -0.07 -1.18 0.00 0.00 179.01 178.00 2bwg h LEU 168 N 0.57 0.46 -0.09 1.64 3.38 -0.89 -0.13 115.31 120.25 2bwg h LEU 168 Ca 0.14 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 2bwg h LEU 168 Cb 0.29 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2bwg h LEU 168 CO -0.00 0.71 -0.23 0.40 0.09 0.00 0.00 178.44 179.40 2bwg h ILE 169 N 0.41 1.40 -0.26 1.22 2.04 -0.81 -0.97 117.51 120.54 2bwg h ILE 169 Ca 0.06 -1.56 0.03 0.00 1.00 0.00 0.00 64.86 64.39 2bwg h ILE 169 Cb 0.65 2.18 -0.01 0.00 -0.74 0.00 0.00 36.82 38.91 2bwg h ILE 169 CO 0.05 0.45 0.17 -0.07 0.00 0.00 0.00 178.15 178.75 2bwg h LEU 170 N -0.14 0.20 -0.01 1.44 3.38 -0.67 -1.83 115.31 117.68 2bwg h LEU 170 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bwg h LEU 170 Cb 0.84 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2bwg h LEU 170 CO 0.05 0.14 -0.01 -1.20 0.09 0.00 0.00 178.44 177.51 2bwg n SER 171 N -4.50 0.02 0.00 -0.43 7.64 -0.07 -4.91 113.62 111.37 2bwg n SER 171 Ca 0.02 0.16 0.00 0.00 1.01 0.00 0.00 58.87 60.06 2bwg n SER 171 Cb 0.16 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 2bwg n SER 171 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bwg n GLY 172 N 1.39 1.01 3.77 0.23 0.00 -0.69 -3.19 105.19 107.71 2bwg n GLY 172 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 2bwg n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwg s ALA 173 N -1.13 3.27 -0.12 4.61 0.00 -0.41 -4.78 121.76 123.20 2bwg s ALA 173 Ca 0.00 0.76 -0.08 0.00 0.00 0.00 0.00 51.96 52.64 2bwg s ALA 173 Cb 0.00 -3.28 -0.26 0.00 0.00 0.00 0.00 23.12 19.58 2bwg s ALA 173 CO 0.00 -0.10 0.38 -0.44 0.00 0.00 0.00 175.76 175.60 2bwg h ASP 174 N 3.35 0.41 -3.36 0.00 3.32 -1.08 -3.37 116.42 115.69 2bwg h ASP 174 Ca -0.47 -0.94 -0.48 0.00 0.02 0.00 0.00 57.03 55.16 2bwg h ASP 174 Cb 1.21 -0.14 -0.35 0.00 0.22 0.00 0.00 39.33 40.28 2bwg h ASP 174 CO 0.65 1.84 -0.79 -0.63 -1.72 0.00 0.00 179.24 178.59 2bwg s ILE 175 N -2.55 0.84 -0.23 0.35 1.01 -0.29 -2.49 121.20 117.85 2bwg s ILE 175 Ca -0.22 -0.26 -0.08 0.00 0.00 0.00 0.00 60.65 60.08 2bwg s ILE 175 Cb 0.06 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.66 2bwg s ILE 175 CO 0.77 0.31 0.10 -0.63 0.00 0.00 0.00 174.94 175.49 2bwg s ILE 176 N 1.12 4.83 -0.22 2.92 -1.09 -0.36 -1.11 121.20 127.29 2bwg s ILE 176 Ca -0.07 -0.01 -0.29 0.00 -2.23 0.00 0.00 60.65 58.06 2bwg s ILE 176 Cb -0.14 -3.23 0.01 0.00 -1.58 0.00 0.00 42.46 37.51 2bwg s ILE 176 CO -0.01 0.37 1.02 -0.54 -1.23 0.00 0.00 174.94 174.55 2bwg s LYS 177 N 1.09 4.27 -0.22 2.79 1.02 -0.17 -1.19 119.74 127.34 2bwg s LYS 177 Ca 0.05 1.33 -0.03 0.00 0.02 0.00 0.00 55.97 57.34 2bwg s LYS 177 Cb -0.14 -3.63 -0.00 0.00 -0.52 0.00 0.00 37.83 33.54 2bwg s LYS 177 CO 0.04 -0.59 -0.06 0.08 -0.92 0.00 0.00 175.35 173.90 2bwg s VAL 178 N 3.05 3.17 0.00 3.17 1.01 0.18 -1.78 120.40 129.20 2bwg s VAL 178 Ca 0.44 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.82 2bwg s VAL 178 Cb -0.15 -2.45 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2bwg s VAL 178 CO 0.07 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.19 2bwg n GLY 179 N 4.77 3.23 2.62 4.51 0.00 0.21 0.35 105.19 120.87 2bwg n GLY 179 Ca -0.18 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 2bwg n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bwg s VAL 180 N 0.00 -0.12 0.00 1.61 1.01 -1.26 -4.63 120.40 117.01 2bwg s VAL 180 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.72 2bwg s VAL 180 Cb 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 36.38 35.72 2bwg s VAL 180 CO 0.00 -0.35 0.00 0.61 0.00 0.00 0.00 175.10 175.36 2bwg n GLY 181 N 5.28 3.07 0.38 4.51 0.00 -1.26 -1.40 105.19 115.77 2bwg n GLY 181 Ca -0.07 -0.86 0.20 0.00 0.00 0.00 0.00 46.02 45.30 2bwg n GLY 181 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2bwg h PRO 182 N 0.00 0.00 -6.37 1.61 0.11 -1.92 -3.44 132.00 122.00 2bwg h PRO 182 Ca 0.00 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.47 2bwg h PRO 182 Cb 0.00 0.00 0.09 0.00 0.11 0.00 0.00 31.00 31.20 2bwg h PRO 182 CO 0.00 0.00 0.23 0.41 -0.21 0.00 0.00 178.00 178.43 2bwg n GLY 183 N -1.57 -0.04 0.30 -0.55 0.00 -1.26 -3.70 105.19 98.37 2bwg n GLY 183 Ca 0.08 0.48 0.10 0.00 0.00 0.00 0.00 46.02 46.68 2bwg n GLY 183 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bwg h SER 184 N 3.01 0.04 -0.05 1.61 4.64 -1.94 -1.95 113.55 118.92 2bwg h SER 184 Ca -0.42 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2bwg h SER 184 Cb 1.34 0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.66 2bwg h SER 184 CO 0.68 -0.10 0.00 1.33 -0.87 0.00 0.00 176.83 177.87 2bwg n VAL 185 N -5.18 0.06 -1.97 0.95 0.24 -1.26 -4.96 118.33 106.20 2bwg n VAL 185 Ca 0.19 -0.53 -0.40 0.00 -2.04 0.00 0.00 64.34 61.56 2bwg n VAL 185 Cb 0.60 1.31 0.00 0.00 -1.47 0.00 0.00 33.84 34.28 2bwg n VAL 185 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bwg n THR 187 N 0.11 0.88 -0.36 0.00 -2.24 -1.26 -4.79 114.28 106.63 2bwg n THR 187 Ca 0.04 -1.47 -0.02 0.00 -2.27 0.00 0.00 64.05 60.32 2bwg n THR 187 Cb 0.43 0.32 0.11 0.00 -2.10 0.00 0.00 70.33 69.09 2bwg n THR 187 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2bwg h THR 188 N 4.19 1.22 -0.48 4.28 1.35 -1.85 -0.86 112.91 120.77 2bwg h THR 188 Ca -0.07 -0.44 -0.05 0.00 -0.55 0.00 0.00 66.41 65.31 2bwg h THR 188 Cb 1.37 -0.16 -0.02 0.00 -1.73 0.00 0.00 68.15 67.61 2bwg h THR 188 CO 0.03 0.23 0.10 0.03 -0.25 0.00 0.00 175.52 175.67 2bwg h ARG 189 N 1.27 0.77 -0.04 4.72 3.08 -1.87 0.88 114.38 123.20 2bwg h ARG 189 Ca 0.36 -0.19 -0.19 0.00 0.07 0.00 0.00 59.98 60.02 2bwg h ARG 189 Cb -0.11 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.84 2bwg h ARG 189 CO -0.09 0.76 -0.80 1.15 -1.07 0.00 0.00 179.97 179.92 2bwg h THR 190 N 0.65 1.41 0.00 2.04 2.02 -1.85 -1.22 112.91 115.97 2bwg h THR 190 Ca 0.15 -2.31 -0.07 0.00 0.77 0.00 0.00 66.41 64.94 2bwg h THR 190 Cb 0.35 2.26 -0.01 0.00 -1.74 0.00 0.00 68.15 69.00 2bwg h THR 190 CO 0.00 0.69 -2.02 0.29 0.37 0.00 0.00 175.52 174.86 2bwg n LYS 191 N -3.77 0.66 0.00 6.66 5.02 -0.35 -4.67 118.16 121.71 2bwg n LYS 191 Ca -0.04 -0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 2bwg n LYS 191 Cb 0.75 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 2bwg n LYS 191 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2bwg n THR 192 N -2.39 0.00 -1.08 -0.18 -2.24 0.29 -5.02 114.28 103.66 2bwg n THR 192 Ca -0.09 -0.06 -0.03 0.00 -2.27 0.00 0.00 64.05 61.60 2bwg n THR 192 Cb 0.69 0.42 -0.01 0.00 -2.10 0.00 0.00 70.33 69.33 2bwg n THR 192 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bwg n GLY 193 N 0.94 0.47 3.80 3.38 0.00 -0.30 -4.96 105.19 108.53 2bwg n GLY 193 Ca 0.00 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 2bwg n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bwg s VAL 194 N -1.67 4.93 -4.74 1.61 1.01 -1.24 -4.92 120.40 115.38 2bwg s VAL 194 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.81 2bwg s VAL 194 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.19 2bwg s VAL 194 CO 0.00 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.19 2bwg n GLY 195 N 1.59 -2.19 3.63 4.51 0.00 -1.26 -3.43 105.19 108.04 2bwg n GLY 195 Ca -0.16 -1.27 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 2bwg n GLY 195 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2bwg s TYR 196 N -2.45 -0.80 0.30 1.61 5.04 -0.49 -5.01 117.35 115.55 2bwg s TYR 196 Ca 0.00 1.86 -0.29 0.00 -2.44 0.00 0.00 57.07 56.20 2bwg s TYR 196 Cb 0.00 0.35 -0.13 0.00 0.35 0.00 0.00 41.96 42.53 2bwg s TYR 196 CO 0.00 -0.39 1.29 -2.30 -1.34 0.00 0.00 175.55 172.82 2bwg n PRO 197 N 2.95 1.99 -0.18 4.97 -0.02 -1.26 -4.53 135.00 138.92 2bwg n PRO 197 Ca -0.15 0.70 -0.10 0.00 -2.02 0.00 0.00 63.50 61.93 2bwg n PRO 197 Cb 0.56 -2.28 0.01 0.00 -0.02 0.00 0.00 33.50 31.77 2bwg n PRO 197 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2bwg h GLN 198 N 3.04 0.98 0.13 -0.52 5.75 -1.94 -1.28 115.11 121.26 2bwg h GLN 198 Ca -0.45 -0.35 -0.01 0.00 -0.15 0.00 0.00 58.65 57.69 2bwg h GLN 198 Cb 1.29 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.77 2bwg h GLN 198 CO 0.67 1.02 -0.06 1.25 -2.65 0.00 0.00 178.83 179.06 2bwg h LEU 199 N 0.84 -0.14 -1.28 -2.39 5.85 -1.83 -1.43 115.31 114.93 2bwg h LEU 199 Ca 0.14 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 2bwg h LEU 199 Cb 0.64 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2bwg h LEU 199 CO 0.04 -0.01 -0.27 0.28 -0.34 0.00 0.00 178.44 178.14 2bwg h SER 200 N -0.27 0.14 0.63 1.25 0.02 -1.35 0.64 113.55 114.61 2bwg h SER 200 Ca -0.02 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 2bwg h SER 200 Cb 0.22 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 62.73 2bwg h SER 200 CO 0.03 0.41 -0.31 0.00 -1.14 0.00 0.00 176.83 175.83 2bwg h ALA 201 N 1.60 -0.85 -0.57 3.77 0.00 -1.06 -2.05 119.26 120.10 2bwg h ALA 201 Ca 0.02 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.78 2bwg h ALA 201 Cb 0.55 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 2bwg h ALA 201 CO 0.04 -0.96 0.30 0.28 0.00 0.00 0.00 179.25 178.91 2bwg h VAL 202 N -0.89 0.96 -0.14 0.00 2.07 -0.87 -0.18 116.25 117.20 2bwg h VAL 202 Ca -0.09 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.28 2bwg h VAL 202 Cb 0.67 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.73 2bwg h VAL 202 CO 0.14 0.10 -0.15 0.40 0.02 0.00 0.00 177.57 178.08 2bwg h ILE 203 N 0.57 0.59 -0.06 4.57 1.08 -0.76 -0.21 117.51 123.28 2bwg h ILE 203 Ca 0.25 0.00 -0.15 0.00 -0.39 0.00 0.00 64.86 64.57 2bwg h ILE 203 Cb 0.15 0.59 0.01 0.00 -3.07 0.00 0.00 36.82 34.49 2bwg h ILE 203 CO -0.16 0.00 -0.53 -0.33 -0.69 0.00 0.00 178.15 176.43 2bwg h GLU 204 N -0.19 0.47 -0.24 2.37 5.08 -1.10 -3.10 114.58 117.88 2bwg h GLU 204 Ca 0.10 -0.42 -0.14 0.00 -1.00 0.00 0.00 59.36 57.89 2bwg h GLU 204 Cb 0.33 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2bwg h GLU 204 CO -0.25 1.06 -0.43 0.00 -1.00 0.00 0.00 179.01 178.39 2bwg h ALA 206 N 1.06 0.27 -0.50 0.00 0.00 -1.09 0.02 119.26 119.01 2bwg h ALA 206 Ca 0.04 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.01 2bwg h ALA 206 Cb 0.94 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 2bwg h ALA 206 CO 0.08 -0.23 0.02 -0.44 0.00 0.00 0.00 179.25 178.68 2bwg h ASP 207 N 0.26 -0.18 -0.36 0.00 3.32 -1.50 -0.22 116.42 117.74 2bwg h ASP 207 Ca 0.08 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.17 2bwg h ASP 207 Cb 0.01 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2bwg h ASP 207 CO -0.01 -0.06 -0.06 -1.28 -1.72 0.00 0.00 179.24 176.11 2bwg h SER 208 N 0.13 0.68 0.03 6.45 0.87 -1.19 -1.77 113.55 118.75 2bwg h SER 208 Ca 0.25 -0.35 -0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2bwg h SER 208 Cb 0.38 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 2bwg h SER 208 CO -0.40 0.86 -0.02 0.00 -0.53 0.00 0.00 176.83 176.74 2bwg h ALA 209 N 0.83 -0.04 0.00 6.23 0.00 -0.79 -3.19 119.26 122.30 2bwg h ALA 209 Ca 0.09 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2bwg h ALA 209 Cb 0.55 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2bwg h ALA 209 CO 0.03 -0.48 -0.30 0.45 0.00 0.00 0.00 179.25 178.95 2bwg h HIS 210 N -0.13 0.00 0.00 0.00 -0.00 -0.93 0.53 115.15 114.62 2bwg h HIS 210 Ca -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.36 2bwg h HIS 210 Cb 0.12 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.53 2bwg h HIS 210 CO -0.05 0.30 -0.01 0.78 -0.00 0.00 0.00 177.93 178.96 2bwg h GLY 211 N 1.88 0.00 -2.56 2.45 0.00 -1.31 -0.32 103.07 103.22 2bwg h GLY 211 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bwg h GLY 211 CO 0.04 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.62 2bwg n LEU 212 N -3.72 3.77 -2.03 3.11 4.32 -0.41 -4.92 117.00 117.11 2bwg n LEU 212 Ca -0.03 -1.78 -0.20 0.00 -0.02 0.00 0.00 56.01 53.98 2bwg n LEU 212 Cb 0.09 -0.39 -0.04 0.00 -1.62 0.00 0.00 43.42 41.46 2bwg n LEU 212 CO 0.26 0.89 -0.24 0.29 -1.22 0.00 0.00 177.39 177.38 2bwg n LYS 213 N 1.61 -1.54 -1.48 3.23 5.02 -0.13 -4.98 118.16 119.88 2bwg n LYS 213 Ca 0.23 1.07 -0.08 0.00 -2.02 0.00 0.00 58.31 57.50 2bwg n LYS 213 Cb 0.62 -5.60 0.04 0.00 -0.02 0.00 0.00 35.03 30.07 2bwg n LYS 213 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bwg n GLY 214 N -0.81 1.07 3.02 0.72 0.00 0.04 -4.22 105.19 105.02 2bwg n GLY 214 Ca -0.23 -2.04 -0.09 0.00 0.00 0.00 0.00 46.02 43.67 2bwg n GLY 214 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bwg s HIS 215 N -0.85 0.32 0.12 1.61 3.76 -1.04 -4.00 115.29 115.22 2bwg s HIS 215 Ca 0.25 -0.67 0.07 0.00 -0.15 0.00 0.00 55.06 54.56 2bwg s HIS 215 Cb -0.02 -0.24 -0.04 0.00 1.11 0.00 0.00 32.58 33.40 2bwg s HIS 215 CO 0.16 -0.26 -0.17 0.96 -0.85 0.00 0.00 174.74 174.59 2bwg s ILE 216 N -2.22 1.53 -0.21 0.60 -4.36 -1.26 -1.22 121.20 114.06 2bwg s ILE 216 Ca -0.09 -1.69 -0.06 0.00 -0.26 0.00 0.00 60.65 58.55 2bwg s ILE 216 Cb -0.04 -1.58 -0.03 0.00 1.25 0.00 0.00 42.46 42.06 2bwg s ILE 216 CO -0.04 -0.29 0.03 -0.63 0.24 0.00 0.00 174.94 174.25 2bwg s ILE 217 N -1.80 4.18 -0.45 8.37 1.01 -0.33 -1.28 121.20 130.90 2bwg s ILE 217 Ca 0.09 -0.23 -0.28 0.00 0.00 0.00 0.00 60.65 60.22 2bwg s ILE 217 Cb -0.07 -2.90 0.01 0.00 0.01 0.00 0.00 42.46 39.50 2bwg s ILE 217 CO 0.04 0.41 1.47 -0.55 0.00 0.00 0.00 174.94 176.32 2bwg s SER 218 N 1.03 6.20 -0.50 3.58 0.15 -0.57 0.50 113.70 124.08 2bwg s SER 218 Ca 0.03 0.74 -0.09 0.00 0.70 0.00 0.00 55.95 57.32 2bwg s SER 218 Cb -0.14 -2.54 0.13 0.00 -1.71 0.00 0.00 66.02 61.76 2bwg s SER 218 CO 0.02 -1.56 0.38 -0.62 1.20 0.00 0.00 173.24 172.65 2bwg s ASP 219 N 4.45 5.74 0.00 5.45 2.15 0.15 -0.19 116.67 134.42 2bwg s ASP 219 Ca 0.62 -2.01 0.00 0.00 0.43 0.00 0.00 52.55 51.59 2bwg s ASP 219 Cb -0.14 -2.02 0.00 0.00 -0.30 0.00 0.00 42.92 40.47 2bwg s ASP 219 CO 0.31 -0.67 0.00 0.61 -0.17 0.00 0.00 175.17 175.24 2bwg n GLY 220 N 4.78 0.20 0.00 2.66 0.00 -1.08 -4.26 105.19 107.49 2bwg n GLY 220 Ca -0.06 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.21 2bwg n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bwg n GLY 221 N 0.33 3.14 3.68 -0.02 0.00 -1.24 -4.71 105.19 106.36 2bwg n GLY 221 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2bwg n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwg n THR 223 N 4.98 0.00 -3.60 0.00 -2.24 -1.26 -4.57 114.28 107.59 2bwg n THR 223 Ca 0.14 -0.44 -0.08 0.00 -2.27 0.00 0.00 64.05 61.39 2bwg n THR 223 Cb 0.44 1.18 -0.02 0.00 -2.10 0.00 0.00 70.33 69.83 2bwg n THR 223 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bwg h PRO 225 N 2.00 0.00 -0.68 0.00 0.11 -1.92 -2.07 132.00 129.43 2bwg h PRO 225 Ca -0.25 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.83 2bwg h PRO 225 Cb 1.26 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 2bwg h PRO 225 CO 0.30 0.00 0.32 0.78 -0.21 0.00 0.00 178.00 179.19 2bwg h GLY 226 N 0.00 1.05 1.14 -0.55 0.00 -1.95 -0.61 103.07 102.16 2bwg h GLY 226 Ca 0.06 -0.53 -0.04 0.00 0.00 0.00 0.00 47.33 46.83 2bwg h GLY 226 CO -0.00 0.50 0.32 -0.55 0.00 0.00 0.00 176.54 176.81 2bwg h ASP 227 N 0.95 1.01 -0.88 0.19 3.32 -1.79 0.64 116.42 119.86 2bwg h ASP 227 Ca 0.23 -0.14 0.03 0.00 0.02 0.00 0.00 57.03 57.17 2bwg h ASP 227 Cb 0.13 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.37 2bwg h ASP 227 CO -0.03 0.88 0.57 0.58 -1.72 0.00 0.00 179.24 179.52 2bwg h VAL 228 N 1.08 1.17 -0.55 -1.35 2.07 -1.02 0.11 116.25 117.76 2bwg h VAL 228 Ca 0.25 -0.39 -0.08 0.00 0.82 0.00 0.00 66.70 67.31 2bwg h VAL 228 Cb 0.17 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 2bwg h VAL 228 CO -0.03 0.21 0.02 0.00 0.02 0.00 0.00 177.57 177.79 2bwg h ALA 229 N 1.35 0.73 -0.54 1.67 0.00 -0.26 -2.62 119.26 119.59 2bwg h ALA 229 Ca 0.34 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2bwg h ALA 229 Cb -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2bwg h ALA 229 CO -0.10 0.54 0.17 0.87 0.00 0.00 0.00 179.25 180.74 2bwg h LYS 230 N 0.83 0.84 -0.19 0.00 1.57 -0.40 -0.57 116.57 118.65 2bwg h LYS 230 Ca 0.16 -0.18 0.05 0.00 -1.87 0.00 0.00 60.65 58.81 2bwg h LYS 230 Cb 0.52 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.65 2bwg h LYS 230 CO 0.03 0.77 -0.17 0.00 -0.57 0.00 0.00 179.45 179.50 2bwg h ALA 231 N 1.04 -0.05 -0.97 3.86 0.00 -0.69 0.91 119.26 123.36 2bwg h ALA 231 Ca 0.18 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.18 2bwg h ALA 231 Cb 0.27 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 2bwg h ALA 231 CO -0.01 -0.60 0.64 0.74 0.00 0.00 0.00 179.25 180.01 2bwg h PHE 232 N -0.19 1.20 -0.19 0.00 0.04 -1.31 -2.39 116.94 114.09 2bwg h PHE 232 Ca 0.12 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.86 2bwg h PHE 232 Cb 0.36 -0.40 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 2bwg h PHE 232 CO -0.31 0.71 -0.13 0.78 -0.60 0.00 0.00 178.31 178.76 2bwg h GLY 233 N 1.26 0.33 2.00 -1.45 0.00 -0.47 -2.49 103.07 102.24 2bwg h GLY 233 Ca 0.38 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2bwg h GLY 233 CO -0.11 0.20 0.00 0.00 0.00 0.00 0.00 176.54 176.63 2bwg h ALA 234 N 1.58 1.00 0.00 3.60 0.00 -0.36 -3.39 119.26 121.69 2bwg h ALA 234 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2bwg h ALA 234 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2bwg h ALA 234 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 2bwg n GLY 235 N 0.78 0.69 3.66 0.00 0.00 -0.94 -4.15 105.19 105.23 2bwg n GLY 235 Ca 0.04 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.59 2bwg n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwg n ALA 236 N 0.00 1.05 0.09 4.61 0.00 -0.95 -4.88 120.51 120.43 2bwg n ALA 236 Ca 0.00 0.45 -0.22 0.00 0.00 0.00 0.00 53.44 53.67 2bwg n ALA 236 Cb 0.00 -2.31 -0.14 0.00 0.00 0.00 0.00 19.45 17.00 2bwg n ALA 236 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2bwg h ASP 237 N 5.59 0.70 -2.57 0.00 3.32 -1.69 -3.42 116.42 118.37 2bwg h ASP 237 Ca -0.45 -0.90 -0.54 0.00 0.02 0.00 0.00 57.03 55.16 2bwg h ASP 237 Cb 1.27 -0.23 -0.14 0.00 0.22 0.00 0.00 39.33 40.45 2bwg h ASP 237 CO 0.86 1.54 -0.63 -0.36 -1.72 0.00 0.00 179.24 178.93 2bwg s PHE 238 N -2.68 2.17 -0.07 4.55 0.08 -0.40 -4.77 117.98 116.85 2bwg s PHE 238 Ca -0.11 -0.76 0.01 0.00 0.12 0.00 0.00 56.93 56.19 2bwg s PHE 238 Cb 0.03 -1.39 0.02 0.00 -0.57 0.00 0.00 43.02 41.11 2bwg s PHE 238 CO 0.89 0.27 -0.07 0.08 -0.10 0.00 0.00 175.22 176.29 2bwg s VAL 239 N -2.98 0.83 -0.15 -0.44 1.01 -0.52 -1.51 120.40 116.64 2bwg s VAL 239 Ca 0.34 -0.24 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 2bwg s VAL 239 Cb 0.07 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 2bwg s VAL 239 CO 0.15 0.31 0.02 -0.32 0.00 0.00 0.00 175.10 175.27 2bwg s MET 240 N 1.21 3.65 -0.03 2.72 1.75 0.73 -0.35 119.30 128.99 2bwg s MET 240 Ca -0.05 -0.40 0.03 0.00 -1.25 0.00 0.00 55.69 54.02 2bwg s MET 240 Cb -0.14 -3.04 0.00 0.00 2.84 0.00 0.00 34.83 34.50 2bwg s MET 240 CO -0.02 0.38 -0.11 -0.51 -0.65 0.00 0.00 175.02 174.12 2bwg s LEU 241 N 0.02 1.79 0.09 4.11 1.43 0.23 -2.63 118.68 123.73 2bwg s LEU 241 Ca 0.04 -0.23 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 2bwg s LEU 241 Cb -0.13 -0.65 0.00 0.00 0.03 0.00 0.00 46.19 45.44 2bwg s LEU 241 CO 0.02 0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.28 2bwg n GLY 242 N 3.31 -0.04 0.23 -3.19 0.00 -1.26 -0.67 105.19 103.57 2bwg n GLY 242 Ca -0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.80 2bwg n GLY 242 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bwg h GLY 243 N 0.00 0.84 2.00 -0.02 0.00 -1.95 -0.18 103.07 103.75 2bwg h GLY 243 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 2bwg h GLY 243 CO 0.00 0.16 -0.06 -0.33 0.00 0.00 0.00 176.54 176.31 2bwg h MET 244 N 0.62 0.00 0.00 4.80 2.07 -1.88 -2.12 114.93 118.42 2bwg h MET 244 Ca 0.25 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.88 2bwg h MET 244 Cb 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.85 2bwg h MET 244 CO -0.15 0.06 -1.19 1.19 1.07 0.00 0.00 176.91 177.89 2bwg n PHE 245 N -3.44 0.13 -1.63 -0.22 3.72 -0.76 -4.96 117.46 110.31 2bwg n PHE 245 Ca -0.02 0.04 -0.37 0.00 -0.05 0.00 0.00 57.45 57.05 2bwg n PHE 245 Cb 0.19 -0.32 0.07 0.00 -0.94 0.00 0.00 39.48 38.48 2bwg n PHE 245 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2bwg n SER 246 N -1.87 1.40 0.00 4.37 3.41 -0.15 -3.97 113.62 116.81 2bwg n SER 246 Ca 0.01 0.79 0.00 0.00 -0.26 0.00 0.00 58.87 59.41 2bwg n SER 246 Cb 0.43 -1.48 0.00 0.00 -0.26 0.00 0.00 64.21 62.90 2bwg n SER 246 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bwg n GLY 247 N 1.06 0.74 3.96 5.00 0.00 -1.26 -4.83 105.19 109.86 2bwg n GLY 247 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 2bwg n GLY 247 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bwg s HIS 248 N -2.66 3.22 0.42 1.61 4.02 -1.25 -0.79 115.29 119.86 2bwg s HIS 248 Ca 0.00 0.11 0.12 0.00 1.02 0.00 0.00 55.06 56.31 2bwg s HIS 248 Cb 0.00 -2.17 0.96 0.00 -1.02 0.00 0.00 32.58 30.35 2bwg s HIS 248 CO 0.00 -0.20 1.99 1.15 1.02 0.00 0.00 174.74 178.69 2bwg h THR 249 N 0.58 0.94 0.00 1.30 2.02 -1.19 -0.91 112.91 115.65 2bwg h THR 249 Ca -0.46 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 66.55 2bwg h THR 249 Cb 1.25 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 2bwg h THR 249 CO 0.56 0.09 0.00 -0.62 0.37 0.00 0.00 175.52 175.92 2bwg n GLU 250 N -4.47 0.08 -2.44 6.66 4.71 -1.26 -4.83 120.64 119.09 2bwg n GLU 250 Ca 0.09 0.09 -0.36 0.00 -0.01 0.00 0.00 57.16 56.96 2bwg n GLU 250 Cb 0.30 -1.60 -0.03 0.00 -1.01 0.00 0.00 31.44 29.11 2bwg n GLU 250 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2bwg s ALA 252 N -1.68 3.53 0.00 0.00 0.00 0.01 -4.85 121.76 118.77 2bwg s ALA 252 Ca 0.62 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.95 2bwg s ALA 252 Cb -0.23 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2bwg s ALA 252 CO 0.29 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.68 2bwg n GLY 253 N 0.77 3.05 3.98 0.00 0.00 -1.26 -4.79 105.19 106.94 2bwg n GLY 253 Ca 0.01 -1.94 -0.20 0.00 0.00 0.00 0.00 46.02 43.89 2bwg n GLY 253 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bwg s GLU 254 N -3.12 3.16 0.24 1.61 0.41 -1.26 -5.05 118.70 114.69 2bwg s GLU 254 Ca 0.00 -0.88 -0.30 0.00 -0.41 0.00 0.00 54.97 53.38 2bwg s GLU 254 Cb 0.00 -2.79 -0.09 0.00 -1.78 0.00 0.00 34.13 29.47 2bwg s GLU 254 CO 0.00 0.07 1.10 0.08 -0.49 0.00 0.00 175.26 176.02 2bwg s VAL 255 N -2.21 3.62 -0.12 2.63 1.01 -1.26 -4.64 120.40 119.42 2bwg s VAL 255 Ca 0.44 1.53 -0.14 0.00 0.00 0.00 0.00 61.98 63.81 2bwg s VAL 255 Cb -0.10 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 2bwg s VAL 255 CO 0.32 0.33 -0.27 2.30 0.00 0.00 0.00 175.10 177.77 2bwg n ILE 256 N 1.66 1.37 -0.13 2.22 -5.35 0.17 -4.91 119.36 114.39 2bwg n ILE 256 Ca 0.00 0.20 0.00 0.00 -0.27 0.00 0.00 62.75 62.68 2bwg n ILE 256 Cb 0.45 -2.17 0.00 0.00 -1.74 0.00 0.00 39.64 36.18 2bwg n ILE 256 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 2bwg n ARG 261 N -4.19 0.00 -3.37 6.28 3.00 -1.26 -1.92 116.66 115.20 2bwg n ARG 261 Ca -0.11 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.36 2bwg n ARG 261 Cb 0.41 -0.04 -0.07 0.00 0.00 0.00 0.00 32.46 32.76 2bwg n ARG 261 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2bwg s LYS 262 N 0.00 4.28 0.08 -0.14 1.02 -1.26 -5.06 119.74 118.66 2bwg s LYS 262 Ca 0.00 0.33 0.02 0.00 0.02 0.00 0.00 55.97 56.34 2bwg s LYS 262 Cb 0.00 -3.46 -0.03 0.00 -0.52 0.00 0.00 37.83 33.82 2bwg s LYS 262 CO 0.00 0.12 -0.08 -0.51 -0.92 0.00 0.00 175.35 173.96 2bwg s LEU 263 N 0.79 2.40 0.05 3.17 1.43 -0.81 -0.44 118.68 125.28 2bwg s LEU 263 Ca 0.23 -0.81 0.08 0.00 -1.03 0.00 0.00 54.13 52.60 2bwg s LEU 263 Cb -0.15 -0.14 -0.03 0.00 0.03 0.00 0.00 46.19 45.90 2bwg s LEU 263 CO 0.08 -0.34 -0.23 -0.54 0.23 0.00 0.00 176.35 175.56 2bwg s LYS 264 N -2.85 1.49 0.11 1.70 -0.14 0.11 0.45 119.74 120.61 2bwg s LYS 264 Ca 0.03 -1.03 -0.30 0.00 -1.36 0.00 0.00 55.97 53.30 2bwg s LYS 264 Cb -0.02 -1.66 -0.06 0.00 -1.68 0.00 0.00 37.83 34.42 2bwg s LYS 264 CO -0.02 0.42 0.98 -1.17 -0.76 0.00 0.00 175.35 174.80 2bwg s LEU 265 N -1.31 4.48 -0.07 3.17 2.96 -1.26 -0.34 118.68 126.31 2bwg s LEU 265 Ca 0.09 1.82 -0.00 0.00 -0.22 0.00 0.00 54.13 55.81 2bwg s LEU 265 Cb -0.09 -3.59 0.02 0.00 0.50 0.00 0.00 46.19 43.03 2bwg s LEU 265 CO 0.02 -0.11 -0.03 0.12 -1.32 0.00 0.00 176.35 175.03 2bwg s PHE 266 N 0.10 0.89 0.02 5.38 2.19 0.79 -4.90 117.98 122.46 2bwg s PHE 266 Ca 0.48 -0.31 0.02 0.00 0.33 0.00 0.00 56.93 57.44 2bwg s PHE 266 Cb -0.24 -0.87 -0.02 0.00 -1.31 0.00 0.00 43.02 40.59 2bwg s PHE 266 CO 0.30 -0.33 -0.06 1.52 1.83 0.00 0.00 175.22 178.48 2bwg s TYR 267 N 1.58 0.53 0.68 10.12 1.13 -1.26 0.02 117.35 130.15 2bwg s TYR 267 Ca -0.00 -0.32 -0.17 0.00 -1.41 0.00 0.00 57.07 55.17 2bwg s TYR 267 Cb -0.13 -0.33 -0.00 0.00 -1.10 0.00 0.00 41.96 40.40 2bwg s TYR 267 CO -0.04 -0.06 1.09 0.41 -2.51 0.00 0.00 175.55 174.44 2bwg n GLY 268 N 2.11 -0.05 0.22 5.49 0.00 0.42 -4.67 105.19 108.70 2bwg n GLY 268 Ca -0.19 -0.25 0.06 0.00 0.00 0.00 0.00 46.02 45.64 2bwg n GLY 268 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2bwg h MET 269 N 0.08 0.00 -0.27 1.61 0.00 -1.92 -2.13 114.93 112.30 2bwg h MET 269 Ca -0.49 0.00 -0.11 0.00 0.00 0.00 0.00 59.70 59.10 2bwg h MET 269 Cb 1.34 0.00 -0.07 0.00 0.00 0.00 0.00 31.60 32.87 2bwg h MET 269 CO 0.50 0.23 -0.11 0.43 0.00 0.00 0.00 176.91 177.95 2bwg n SER 270 N -4.15 2.60 -4.73 1.22 7.64 -1.26 -4.82 113.62 110.12 2bwg n SER 270 Ca -0.02 -3.61 -0.30 0.00 1.01 0.00 0.00 58.87 55.94 2bwg n SER 270 Cb 0.29 -0.59 0.13 0.00 -1.01 0.00 0.00 64.21 63.03 2bwg n SER 270 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2bwg s SER 271 N -2.55 3.64 0.36 6.43 1.04 -0.80 -3.36 113.70 118.47 2bwg s SER 271 Ca 0.42 1.51 0.04 0.00 0.48 0.00 0.00 55.95 58.40 2bwg s SER 271 Cb 0.38 -2.20 0.68 0.00 0.10 0.00 0.00 66.02 64.98 2bwg s SER 271 CO 0.01 -2.54 2.00 0.44 0.98 0.00 0.00 173.24 174.13 2bwg h ASP 272 N -1.48 0.64 -0.22 7.02 3.32 -1.89 0.16 116.42 123.97 2bwg h ASP 272 Ca -0.49 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.53 2bwg h ASP 272 Cb 1.28 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 2bwg h ASP 272 CO 0.54 0.49 0.12 0.74 -1.72 0.00 0.00 179.24 179.42 2bwg h THR 273 N 0.74 1.11 -0.41 0.35 2.02 -1.92 -0.65 112.91 114.15 2bwg h THR 273 Ca 0.20 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 2bwg h THR 273 Cb -0.03 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2bwg h THR 273 CO -0.04 0.10 0.21 0.00 0.37 0.00 0.00 175.52 176.16 2bwg h ALA 274 N 1.01 0.53 -0.44 6.16 0.00 -1.69 0.02 119.26 124.84 2bwg h ALA 274 Ca 0.08 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2bwg h ALA 274 Cb 0.06 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 2bwg h ALA 274 CO -0.01 0.08 -0.00 0.52 0.00 0.00 0.00 179.25 179.83 2bwg h MET 275 N 0.52 0.10 -0.45 0.00 2.07 -0.78 0.26 114.93 116.66 2bwg h MET 275 Ca 0.14 -0.01 -0.13 0.00 -2.07 0.00 0.00 59.70 57.64 2bwg h MET 275 Cb 0.10 -0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 29.80 2bwg h MET 275 CO -0.02 0.07 -0.21 -0.91 1.07 0.00 0.00 176.91 176.91 2bwg h ASN 276 N 0.11 0.97 0.31 1.22 2.35 -0.90 -3.23 115.58 116.39 2bwg h ASN 276 Ca 0.22 -0.40 -0.14 0.00 -0.55 0.00 0.00 56.30 55.43 2bwg h ASN 276 Cb 0.32 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 2bwg h ASN 276 CO -0.37 1.15 -0.55 0.50 -1.65 0.00 0.00 177.43 176.52 2bwg h LYS 277 N 0.78 0.26 0.00 0.81 3.64 -0.51 -3.51 116.57 118.03 2bwg h LYS 277 Ca 0.10 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2bwg h LYS 277 Cb 0.79 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 2bwg h LYS 277 CO 0.07 0.74 0.00 0.72 -2.27 0.00 0.00 179.45 178.71 2bwg n HIS 278 N -3.92 0.00 0.00 1.91 8.25 0.86 -5.08 115.22 117.24 2bwg n HIS 278 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2bwg n HIS 278 Cb 0.58 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.69 2bwg n HIS 278 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2bwg n VAL 282 N 0.00 0.00 0.38 1.59 0.24 -1.26 -4.97 118.33 114.31 2bwg n VAL 282 Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.13 2bwg n VAL 282 Cb 0.00 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.28 2bwg n VAL 282 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bwg h ALA 283 N 0.00 -1.23 -1.38 2.33 0.00 -1.92 -3.28 119.26 113.78 2bwg h ALA 283 Ca 0.00 -0.22 -0.56 0.00 0.00 0.00 0.00 54.91 54.13 2bwg h ALA 283 Cb 0.00 0.54 -0.42 0.00 0.00 0.00 0.00 17.79 17.91 2bwg h ALA 283 CO 0.00 -1.19 -0.80 -0.85 0.00 0.00 0.00 179.25 176.41 2bwg n GLU 284 N -5.14 3.17 -0.02 0.00 0.00 -1.26 -4.72 120.64 112.66 2bwg n GLU 284 Ca -0.13 -4.33 -0.16 0.00 0.00 0.00 0.00 57.16 52.54 2bwg n GLU 284 Cb 0.44 -2.13 -0.09 0.00 0.00 0.00 0.00 31.44 29.66 2bwg n GLU 284 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.13 176.21 2bwg h TYR 285 N 2.59 0.65 -1.86 -1.84 3.20 -1.87 -0.53 116.97 117.31 2bwg h TYR 285 Ca 0.26 -0.31 -0.62 0.00 3.14 0.00 0.00 58.73 61.20 2bwg h TYR 285 Cb 1.01 -0.09 -0.13 0.00 1.54 0.00 0.00 36.73 39.06 2bwg h TYR 285 CO 0.78 1.09 -0.65 1.03 -1.64 0.00 0.00 178.16 178.78 2bwg s ARG 286 N -3.54 1.90 0.60 1.82 1.81 -1.26 -2.55 118.95 117.73 2bwg s ARG 286 Ca -0.13 -1.95 0.38 0.00 -1.72 0.00 0.00 55.73 52.31 2bwg s ARG 286 Cb 0.05 -1.73 1.81 0.00 -0.45 0.00 0.00 34.95 34.62 2bwg s ARG 286 CO 0.82 0.09 2.15 0.00 -0.68 0.00 0.00 175.30 177.67 2bwg h ALA 287 N 1.91 1.01 -2.45 2.13 0.00 -1.73 -3.38 119.26 116.76 2bwg h ALA 287 Ca -0.43 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 2bwg h ALA 287 Cb 1.25 -0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.87 2bwg h ALA 287 CO 0.72 0.01 -0.63 -1.54 0.00 0.00 0.00 179.25 177.81 2bwg s SER 288 N -5.49 0.36 -0.47 0.00 1.04 -1.26 -4.89 113.70 102.99 2bwg s SER 288 Ca -0.01 -0.81 -0.29 0.00 0.48 0.00 0.00 55.95 55.32 2bwg s SER 288 Cb 0.11 0.20 0.03 0.00 0.10 0.00 0.00 66.02 66.46 2bwg s SER 288 CO 0.49 -0.55 1.13 -0.70 0.98 0.00 0.00 173.24 174.59 2bwg s GLU 289 N -3.28 3.74 0.85 4.02 2.12 -1.26 -4.54 118.70 120.34 2bwg s GLU 289 Ca 0.01 0.58 -0.12 0.00 0.36 0.00 0.00 54.97 55.80 2bwg s GLU 289 Cb 0.03 -3.90 0.10 0.00 0.26 0.00 0.00 34.13 30.63 2bwg s GLU 289 CO -0.08 -1.35 1.13 0.20 -0.54 0.00 0.00 175.26 174.62 2bwg s GLY 290 N 2.41 1.59 0.61 -1.50 0.00 -1.21 -4.61 107.32 104.61 2bwg s GLY 290 Ca 0.47 -0.46 -0.14 0.00 0.00 0.00 0.00 44.72 44.59 2bwg s GLY 290 CO 0.31 0.04 1.05 0.54 0.00 0.00 0.00 173.10 175.04 2bwg s LYS 291 N -5.31 3.29 -0.21 2.90 1.02 0.18 -4.25 119.74 117.36 2bwg s LYS 291 Ca 0.62 1.10 -0.03 0.00 0.02 0.00 0.00 55.97 57.68 2bwg s LYS 291 Cb -0.14 -2.03 -0.01 0.00 -0.52 0.00 0.00 37.83 35.13 2bwg s LYS 291 CO 0.53 -0.83 -0.07 0.99 -0.92 0.00 0.00 175.35 175.05 2bwg s THR 292 N -2.65 3.23 0.14 2.17 2.01 -1.26 -0.44 115.64 118.84 2bwg s THR 292 Ca 0.61 -0.55 0.08 0.00 0.31 0.00 0.00 61.69 62.14 2bwg s THR 292 Cb -0.15 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.88 2bwg s THR 292 CO 0.42 0.45 -0.17 0.68 -0.69 0.00 0.00 174.62 175.30 2bwg s VAL 293 N 1.32 1.65 -0.26 3.82 -7.23 0.10 -4.99 120.40 114.81 2bwg s VAL 293 Ca 0.04 -1.80 -0.15 0.00 -1.81 0.00 0.00 61.98 58.26 2bwg s VAL 293 Cb -0.14 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.06 2bwg s VAL 293 CO -0.03 -0.31 0.37 -1.61 -0.31 0.00 0.00 175.10 173.21 2bwg s GLU 294 N -2.62 4.03 0.05 4.82 8.01 -1.26 -0.15 118.70 131.58 2bwg s GLU 294 Ca 0.12 0.04 0.02 0.00 0.01 0.00 0.00 54.97 55.17 2bwg s GLU 294 Cb -0.06 -3.64 -0.04 0.00 -4.31 0.00 0.00 34.13 26.08 2bwg s GLU 294 CO 0.05 -0.24 0.07 0.14 0.01 0.00 0.00 175.26 175.29 2bwg s VAL 295 N 1.96 4.52 0.28 2.63 -7.23 0.54 -4.93 120.40 118.18 2bwg s VAL 295 Ca 0.15 -0.67 -0.30 0.00 -1.81 0.00 0.00 61.98 59.35 2bwg s VAL 295 Cb -0.16 -3.13 -0.11 0.00 0.56 0.00 0.00 36.38 33.54 2bwg s VAL 295 CO 0.10 0.21 1.59 -2.16 -0.31 0.00 0.00 175.10 174.53 2bwg s PRO 296 N -2.14 4.13 -0.19 4.82 0.04 -1.26 -0.71 135.00 139.70 2bwg s PRO 296 Ca 0.27 2.56 -0.29 0.00 0.04 0.00 0.00 61.00 63.58 2bwg s PRO 296 Cb -0.12 -3.03 -0.05 0.00 0.04 0.00 0.00 34.50 31.34 2bwg s PRO 296 CO 0.19 -0.63 1.93 -0.47 0.04 0.00 0.00 177.00 178.06 2bwg s TYR 297 N 0.08 1.56 -0.58 0.56 5.04 0.42 -4.71 117.35 119.72 2bwg s TYR 297 Ca 0.64 0.36 0.24 0.00 -2.44 0.00 0.00 57.07 55.87 2bwg s TYR 297 Cb -0.47 -4.04 0.30 0.00 0.35 0.00 0.00 41.96 38.10 2bwg s TYR 297 CO 0.46 -3.86 1.29 0.87 -1.34 0.00 0.00 175.55 172.98 2bwg h LYS 298 N 12.59 0.00 0.00 4.97 1.57 -1.28 -3.48 116.57 130.94 2bwg h LYS 298 Ca -0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2bwg h LYS 298 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2bwg h LYS 298 CO 0.98 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.27 2bwg n GLY 299 N 1.31 -0.03 3.76 3.86 0.00 -1.25 -4.94 105.19 107.89 2bwg n GLY 299 Ca 0.03 -1.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 2bwg n GLY 299 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bwg s ASP 300 N -4.00 7.21 0.46 1.61 1.01 -1.26 -0.59 116.67 121.11 2bwg s ASP 300 Ca 0.00 2.32 0.30 0.00 0.71 0.00 0.00 52.55 55.88 2bwg s ASP 300 Cb 0.00 -2.63 1.10 0.00 1.01 0.00 0.00 42.92 42.40 2bwg s ASP 300 CO 0.00 -0.19 1.86 1.62 0.21 0.00 0.00 175.17 178.67 2bwg h VAL 301 N 3.10 0.00 -0.74 -1.27 3.04 -1.94 -3.14 116.25 115.31 2bwg h VAL 301 Ca -0.47 -0.54 0.09 0.00 -1.01 0.00 0.00 66.70 64.77 2bwg h VAL 301 Cb 1.21 1.49 -0.12 0.00 -2.01 0.00 0.00 31.29 31.87 2bwg h VAL 301 CO 0.67 0.00 -0.49 -0.08 -1.01 0.00 0.00 177.57 176.66 2bwg h GLU 302 N 0.00 -0.15 -0.88 4.17 4.57 -1.98 -0.38 114.58 119.94 2bwg h GLU 302 Ca 0.00 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2bwg h GLU 302 Cb 0.58 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.16 2bwg h GLU 302 CO 0.00 -0.10 0.52 -0.91 -1.18 0.00 0.00 179.01 177.34 2bwg h ASN 303 N -0.15 1.06 -0.32 1.04 2.35 -1.96 -0.98 115.58 116.62 2bwg h ASN 303 Ca 0.19 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 2bwg h ASN 303 Cb 0.53 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 2bwg h ASN 303 CO -0.79 0.82 0.14 0.74 -1.65 0.00 0.00 177.43 176.68 2bwg h THR 304 N 1.21 1.17 -0.51 2.81 2.02 -1.55 -2.29 112.91 115.77 2bwg h THR 304 Ca 0.32 -0.50 0.09 0.00 0.77 0.00 0.00 66.41 67.09 2bwg h THR 304 Cb -0.04 0.91 -0.07 0.00 -1.74 0.00 0.00 68.15 67.21 2bwg h THR 304 CO -0.06 0.18 0.10 0.40 0.37 0.00 0.00 175.52 176.51 2bwg h ILE 305 N 0.37 0.70 -0.32 3.11 2.04 -0.31 -1.31 117.51 121.80 2bwg h ILE 305 Ca 0.11 -0.08 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 2bwg h ILE 305 Cb 0.15 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 2bwg h ILE 305 CO -0.01 0.04 -0.09 -0.07 0.00 0.00 0.00 178.15 178.02 2bwg h LEU 306 N 0.23 0.50 -0.43 1.44 3.38 -1.04 -0.50 115.31 118.89 2bwg h LEU 306 Ca 0.26 -0.12 -0.16 0.00 0.09 0.00 0.00 57.88 57.95 2bwg h LEU 306 Cb 0.36 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2bwg h LEU 306 CO -0.34 0.64 -0.41 0.44 0.09 0.00 0.00 178.44 178.86 2bwg h ASP 307 N 0.49 0.92 0.07 -0.43 3.32 -1.02 0.31 116.42 120.08 2bwg h ASP 307 Ca 0.09 -0.43 -0.00 0.00 0.02 0.00 0.00 57.03 56.71 2bwg h ASP 307 Cb 0.46 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2bwg h ASP 307 CO 0.02 1.21 -0.03 0.40 -1.72 0.00 0.00 179.24 179.12 2bwg h ILE 308 N 0.70 1.21 -0.28 0.35 2.04 -0.75 -1.91 117.51 118.86 2bwg h ILE 308 Ca 0.05 -1.06 -0.00 0.00 1.00 0.00 0.00 64.86 64.85 2bwg h ILE 308 Cb 0.99 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.94 2bwg h ILE 308 CO 0.10 0.26 0.17 -0.07 0.00 0.00 0.00 178.15 178.60 2bwg h LEU 309 N -0.58 0.33 -0.62 1.44 3.38 -1.18 -1.67 115.31 116.41 2bwg h LEU 309 Ca -0.01 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 57.95 2bwg h LEU 309 Cb 0.50 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 2bwg h LEU 309 CO 0.02 0.29 0.37 1.23 0.09 0.00 0.00 178.44 180.43 2bwg h GLY 310 N 0.35 0.90 1.79 0.83 0.00 -0.98 0.13 103.07 106.10 2bwg h GLY 310 Ca 0.10 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.08 2bwg h GLY 310 CO -0.02 0.21 -0.25 -1.33 0.00 0.00 0.00 176.54 175.16 2bwg h GLY 311 N 0.72 0.27 1.85 4.60 0.00 -1.20 -1.27 103.07 108.04 2bwg h GLY 311 Ca 0.26 -0.20 -0.20 0.00 0.00 0.00 0.00 47.33 47.19 2bwg h GLY 311 CO -0.13 0.19 -0.93 -2.00 0.00 0.00 0.00 176.54 173.67 2bwg h LEU 312 N 0.23 0.17 -0.59 3.11 5.85 -0.86 -1.52 115.31 121.70 2bwg h LEU 312 Ca 0.04 -0.15 -0.11 0.00 0.84 0.00 0.00 57.88 58.50 2bwg h LEU 312 Cb 0.56 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 2bwg h LEU 312 CO 0.04 1.00 -0.05 0.03 -0.34 0.00 0.00 178.44 179.13 2bwg h ARG 313 N 0.06 1.07 -0.32 1.25 3.08 -0.75 -2.06 114.38 116.71 2bwg h ARG 313 Ca -0.04 -0.37 -0.03 0.00 0.07 0.00 0.00 59.98 59.61 2bwg h ARG 313 Cb 1.59 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.54 2bwg h ARG 313 CO 0.13 1.07 0.07 0.77 -1.07 0.00 0.00 179.97 180.94 2bwg h SER 314 N 0.96 0.50 -0.18 7.04 0.02 -1.13 -0.76 113.55 120.00 2bwg h SER 314 Ca 0.16 -0.25 0.05 0.00 -0.84 0.00 0.00 61.79 60.91 2bwg h SER 314 Cb 0.62 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 62.97 2bwg h SER 314 CO 0.04 0.61 -0.16 0.74 -1.14 0.00 0.00 176.83 176.93 2bwg h THR 315 N 0.36 0.56 -0.44 -2.27 2.02 -1.25 -0.75 112.91 111.14 2bwg h THR 315 Ca 0.10 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.31 2bwg h THR 315 Cb 0.32 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 2bwg h THR 315 CO 0.00 0.00 0.24 0.00 0.37 0.00 0.00 175.52 176.13 2bwg h THR 317 N 0.48 0.79 0.00 0.00 2.02 -0.78 0.66 112.91 116.08 2bwg h THR 317 Ca 0.18 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 2bwg h THR 317 Cb 0.06 0.36 -0.00 0.00 -1.74 0.00 0.00 68.15 66.82 2bwg h THR 317 CO -0.11 0.07 -0.16 1.88 0.37 0.00 0.00 175.52 177.57 2bwg h TYR 318 N 0.40 0.00 -0.01 3.16 0.05 -0.08 -2.58 116.97 117.91 2bwg h TYR 318 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.07 2bwg h TYR 318 Cb 0.34 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.08 2bwg h TYR 318 CO -0.17 0.16 -0.69 1.33 -1.05 0.00 0.00 178.16 177.74 2bwg n VAL 319 N -3.23 0.00 -0.63 -2.88 0.24 -0.53 -0.59 118.33 110.71 2bwg n VAL 319 Ca 0.01 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 2bwg n VAL 319 Cb 0.47 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.96 2bwg n VAL 319 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bwg n GLY 320 N 1.45 1.21 3.44 7.63 0.00 -0.35 -4.48 105.19 114.10 2bwg n GLY 320 Ca 0.07 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 2bwg n GLY 320 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwg s ALA 321 N -2.00 3.39 -0.30 4.61 0.00 0.22 -4.94 121.76 122.74 2bwg s ALA 321 Ca 0.00 -1.64 0.25 0.00 0.00 0.00 0.00 51.96 50.57 2bwg s ALA 321 Cb 0.00 -2.70 0.54 0.00 0.00 0.00 0.00 23.12 20.96 2bwg s ALA 321 CO 0.00 -1.30 1.68 0.00 0.00 0.00 0.00 175.76 176.14 2bwg h ALA 322 N 8.51 0.98 -3.72 0.00 0.00 -1.95 -3.35 119.26 119.73 2bwg h ALA 322 Ca -0.28 -0.03 -0.37 0.00 0.00 0.00 0.00 54.91 54.23 2bwg h ALA 322 Cb 1.12 -0.01 -0.26 0.00 0.00 0.00 0.00 17.79 18.65 2bwg h ALA 322 CO 0.68 0.04 -0.77 0.15 0.00 0.00 0.00 179.25 179.36 2bwg s LYS 323 N -3.30 0.69 0.50 0.00 1.02 -1.26 -1.62 119.74 115.77 2bwg s LYS 323 Ca 0.06 -0.53 0.27 0.00 0.02 0.00 0.00 55.97 55.78 2bwg s LYS 323 Cb 0.06 -0.63 1.36 0.00 -0.52 0.00 0.00 37.83 38.10 2bwg s LYS 323 CO 0.65 0.16 1.90 1.25 -0.92 0.00 0.00 175.35 178.39 2bwg h LEU 324 N 5.30 0.11 -0.82 3.17 5.85 -1.45 0.00 115.31 127.48 2bwg h LEU 324 Ca -0.34 0.01 0.18 0.00 0.84 0.00 0.00 57.88 58.58 2bwg h LEU 324 Cb 1.19 -0.01 -0.15 0.00 0.37 0.00 0.00 40.66 42.06 2bwg h LEU 324 CO 0.46 0.04 -0.08 0.50 -0.34 0.00 0.00 178.44 179.02 2bwg h LYS 325 N 0.11 0.04 0.00 1.25 3.64 -1.85 -2.61 116.57 117.15 2bwg h LYS 325 Ca 0.40 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2bwg h LYS 325 Cb 1.42 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.24 2bwg h LYS 325 CO -0.05 0.03 0.00 0.39 -2.27 0.00 0.00 179.45 177.55 2bwg n GLU 326 N -5.45 0.40 0.31 1.90 1.02 -0.01 -4.18 120.64 114.62 2bwg n GLU 326 Ca 0.14 0.01 -0.17 0.00 -0.02 0.00 0.00 57.16 57.13 2bwg n GLU 326 Cb 0.49 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.33 2bwg n GLU 326 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2bwg h LEU 327 N 0.00 -0.73 -0.68 -4.62 6.46 -1.55 -1.53 115.31 112.66 2bwg h LEU 327 Ca 0.00 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 2bwg h LEU 327 Cb 0.28 0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.38 2bwg h LEU 327 CO 0.00 -0.48 0.45 0.77 -0.62 0.00 0.00 178.44 178.55 2bwg h SER 328 N -0.78 0.79 -0.67 1.25 4.64 -1.73 0.84 113.55 117.89 2bwg h SER 328 Ca -0.07 -0.03 0.12 0.00 -0.47 0.00 0.00 61.79 61.34 2bwg h SER 328 Cb 0.62 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.47 2bwg h SER 328 CO 0.09 0.58 0.45 0.03 -0.87 0.00 0.00 176.83 177.12 2bwg h ARG 329 N 0.93 0.43 -0.10 4.77 3.08 -1.76 -2.44 114.38 119.28 2bwg h ARG 329 Ca 0.25 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.27 2bwg h ARG 329 Cb -0.09 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.86 2bwg h ARG 329 CO -0.05 0.28 0.00 0.54 -1.07 0.00 0.00 179.97 179.67 2bwg n ARG 330 N -4.47 1.52 -2.50 0.04 1.74 0.17 -4.93 116.66 108.23 2bwg n ARG 330 Ca 0.12 -1.61 -0.43 0.00 -0.77 0.00 0.00 57.85 55.16 2bwg n ARG 330 Cb 0.43 -1.33 -0.02 0.00 -1.02 0.00 0.00 32.46 30.52 2bwg n ARG 330 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bwg s ALA 331 N -1.30 3.61 -0.13 7.54 0.00 0.27 -4.93 121.76 126.82 2bwg s ALA 331 Ca 0.22 0.29 0.02 0.00 0.00 0.00 0.00 51.96 52.48 2bwg s ALA 331 Cb 0.14 -3.63 0.01 0.00 0.00 0.00 0.00 23.12 19.64 2bwg s ALA 331 CO 0.21 -1.26 -0.18 0.99 0.00 0.00 0.00 175.76 175.51 2bwg s THR 332 N 3.57 1.78 0.09 0.00 2.01 -1.26 -4.96 115.64 116.87 2bwg s THR 332 Ca 0.51 -0.81 -0.03 0.00 0.31 0.00 0.00 61.69 61.68 2bwg s THR 332 Cb -0.18 -1.60 -0.05 0.00 0.01 0.00 0.00 72.50 70.68 2bwg s THR 332 CO 0.14 0.50 0.29 -0.36 -0.69 0.00 0.00 174.62 174.49 2bwg s PHE 333 N 0.94 3.51 0.03 4.92 0.08 -1.26 -1.04 117.98 125.16 2bwg s PHE 333 Ca -0.06 0.43 0.06 0.00 0.12 0.00 0.00 56.93 57.48 2bwg s PHE 333 Cb -0.15 -1.90 -0.03 0.00 -0.57 0.00 0.00 43.02 40.37 2bwg s PHE 333 CO -0.03 0.52 -0.15 0.96 -0.10 0.00 0.00 175.22 176.42 2bwg s ILE 334 N -1.55 2.99 0.03 0.64 -4.36 0.07 -4.92 121.20 114.10 2bwg s ILE 334 Ca 0.37 -1.09 -0.24 0.00 -0.26 0.00 0.00 60.65 59.42 2bwg s ILE 334 Cb -0.13 -2.27 -0.05 0.00 1.25 0.00 0.00 42.46 41.26 2bwg s ILE 334 CO 0.25 0.35 0.74 -0.13 0.24 0.00 0.00 174.94 176.39 2bwg s ARG 335 N -1.45 4.47 0.44 0.37 0.52 -1.26 -1.72 118.95 120.32 2bwg s ARG 335 Ca 0.15 1.01 0.03 0.00 -0.52 0.00 0.00 55.73 56.41 2bwg s ARG 335 Cb -0.11 -3.37 -0.03 0.00 0.52 0.00 0.00 34.95 31.96 2bwg s ARG 335 CO 0.06 0.28 0.04 0.14 0.02 0.00 0.00 175.30 175.84 2bwg s VAL 336 N -0.01 1.17 -1.39 3.52 -7.23 -0.42 -4.95 120.40 111.09 2bwg s VAL 336 Ca 0.38 -2.00 0.11 0.00 -1.81 0.00 0.00 61.98 58.66 2bwg s VAL 336 Cb -0.20 -2.45 0.09 0.00 0.56 0.00 0.00 36.38 34.38 2bwg s VAL 336 CO 0.22 0.00 0.85 0.35 -0.31 0.00 0.00 175.10 176.21