#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 4.02 -0.22 -0.52 1.04 -1.26 -5.08 118.95 116.93 2bwg s ARG 3 Ca 0.00 0.53 -0.08 0.00 -1.04 0.00 0.00 55.73 55.14 2bwg s ARG 3 Cb 0.00 -2.99 -0.04 0.00 -2.04 0.00 0.00 34.95 29.88 2bwg s ARG 3 CO 0.00 0.51 0.09 0.42 -0.04 0.00 0.00 175.30 176.28 2bwg s ILE 4 N -1.40 4.81 -0.07 4.99 1.01 -1.26 -5.07 121.20 124.21 2bwg s ILE 4 Ca 0.36 -0.02 -0.30 0.00 0.00 0.00 0.00 60.65 60.70 2bwg s ILE 4 Cb -0.16 -3.21 -0.05 0.00 0.01 0.00 0.00 42.46 39.05 2bwg s ILE 4 CO 0.19 0.40 1.60 -0.62 0.00 0.00 0.00 174.94 176.51 2bwg s ASP 5 N 0.89 6.70 0.25 3.58 -1.08 -1.26 -4.92 116.67 120.84 2bwg s ASP 5 Ca 0.05 2.16 -0.04 0.00 -0.52 0.00 0.00 52.55 54.20 2bwg s ASP 5 Cb -0.14 -2.53 0.29 0.00 -1.46 0.00 0.00 42.92 39.08 2bwg s ASP 5 CO 0.03 -0.90 1.83 0.00 0.52 0.00 0.00 175.17 176.64 2bwg h ALA 6 N 9.37 1.17 -2.34 3.66 0.00 -2.07 -3.42 119.26 125.63 2bwg h ALA 6 Ca -0.38 -0.17 -0.54 0.00 0.00 0.00 0.00 54.91 53.82 2bwg h ALA 6 Cb 1.17 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.68 2bwg h ALA 6 CO 0.96 0.61 1.16 0.34 0.00 0.00 0.00 179.25 182.32 2bwg s ASP 7 N -6.42 6.53 0.15 0.00 2.15 -1.26 -4.99 116.67 112.83 2bwg s ASP 7 Ca -0.11 2.52 -0.30 0.00 0.43 0.00 0.00 52.55 55.09 2bwg s ASP 7 Cb 0.16 -2.54 -0.07 0.00 -0.30 0.00 0.00 42.92 40.17 2bwg s ASP 7 CO 0.82 -1.00 1.19 -0.22 -0.17 0.00 0.00 175.17 175.79 2bwg s LEU 8 N 4.11 4.43 -0.19 -1.34 2.96 -1.26 -5.03 118.68 122.36 2bwg s LEU 8 Ca 0.82 2.16 -0.08 0.00 -0.22 0.00 0.00 54.13 56.81 2bwg s LEU 8 Cb -0.40 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.65 2bwg s LEU 8 CO 0.37 -0.39 0.09 -0.54 -1.32 0.00 0.00 176.35 174.56 2bwg s LYS 9 N 0.12 4.04 0.06 1.98 -0.14 -1.26 -5.09 119.74 119.45 2bwg s LYS 9 Ca 0.54 -0.28 -0.00 0.00 -1.36 0.00 0.00 55.97 54.87 2bwg s LYS 9 Cb -0.32 -3.30 -0.04 0.00 -1.68 0.00 0.00 37.83 32.50 2bwg s LYS 9 CO 0.34 0.31 0.21 -0.51 -0.76 0.00 0.00 175.35 174.94 2bwg s LEU 10 N 0.30 4.35 0.00 3.17 1.43 -1.26 -4.84 118.68 121.83 2bwg s LEU 10 Ca 0.06 0.27 0.01 0.00 -1.03 0.00 0.00 54.13 53.44 2bwg s LEU 10 Cb -0.12 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.18 2bwg s LEU 10 CO -0.01 0.18 0.08 -0.67 0.23 0.00 0.00 176.35 176.15 2bwg n ASP 11 N 0.33 0.94 0.10 2.29 -0.08 -1.26 -2.15 116.55 116.73 2bwg n ASP 11 Ca -0.05 -1.25 -0.02 0.00 -1.51 0.00 0.00 54.79 51.95 2bwg n ASP 11 Cb 0.51 -0.02 0.22 0.00 2.34 0.00 0.00 41.12 44.16 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 0.36 0.25 0.00 -0.67 0.04 -1.94 -2.60 116.94 112.37 2bwg h PHE 12 Ca -0.05 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.64 2bwg h PHE 12 Cb 0.18 -0.05 -0.00 0.00 2.20 0.00 0.00 35.95 38.27 2bwg h PHE 12 CO 0.00 0.62 -0.04 1.57 -0.60 0.00 0.00 178.31 179.86 2bwg h LYS 13 N 0.17 0.00 0.00 1.51 2.10 -1.98 -2.79 116.57 115.58 2bwg h LYS 13 Ca 0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 2bwg h LYS 13 Cb 0.86 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.19 2bwg h LYS 13 CO 0.07 0.04 -0.07 -0.25 -2.00 0.00 0.00 179.45 177.24 2bwg n ASP 14 N -3.17 0.29 -4.30 7.07 8.00 -0.98 -4.88 116.55 118.60 2bwg n ASP 14 Ca 0.00 0.44 -0.16 0.00 0.71 0.00 0.00 54.79 55.78 2bwg n ASP 14 Cb 0.30 -0.49 -0.10 0.00 -0.02 0.00 0.00 41.12 40.82 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 -3.03 1.07 0.11 2.53 -7.23 -1.05 -1.04 120.40 111.76 2bwg s VAL 15 Ca 0.13 -2.04 0.05 0.00 -1.81 0.00 0.00 61.98 58.30 2bwg s VAL 15 Cb 0.17 -2.15 -0.04 0.00 0.56 0.00 0.00 36.38 34.92 2bwg s VAL 15 CO 0.57 -0.49 -0.13 -0.76 -0.31 0.00 0.00 175.10 173.99 2bwg s LEU 16 N -3.25 2.39 0.01 1.32 1.43 -0.39 -4.89 118.68 115.31 2bwg s LEU 16 Ca 0.24 -0.79 -0.23 0.00 -1.03 0.00 0.00 54.13 52.31 2bwg s LEU 16 Cb 0.04 -0.46 -0.05 0.00 0.03 0.00 0.00 46.19 45.75 2bwg s LEU 16 CO 0.06 -0.18 0.71 -0.76 0.23 0.00 0.00 176.35 176.40 2bwg s LEU 17 N -2.39 4.41 0.10 1.79 1.43 -1.26 -0.45 118.68 122.32 2bwg s LEU 17 Ca 0.07 1.32 -0.29 0.00 -1.03 0.00 0.00 54.13 54.19 2bwg s LEU 17 Cb -0.05 -3.12 -0.06 0.00 0.03 0.00 0.00 46.19 43.00 2bwg s LEU 17 CO 0.02 0.01 0.93 -0.60 0.23 0.00 0.00 176.35 176.94 2bwg s ARG 18 N 0.10 4.67 0.50 1.70 3.52 -0.41 -4.94 118.95 124.09 2bwg s ARG 18 Ca 0.36 1.39 -0.20 0.00 -0.13 0.00 0.00 55.73 57.16 2bwg s ARG 18 Cb -0.19 -3.37 -0.08 0.00 -1.56 0.00 0.00 34.95 29.74 2bwg s ARG 18 CO 0.20 0.23 1.04 -1.25 -0.81 0.00 0.00 175.30 174.71 2bwg s PRO 19 N -0.03 3.76 0.08 5.12 0.04 -1.26 -4.66 135.00 138.04 2bwg s PRO 19 Ca 0.46 1.33 0.01 0.00 0.04 0.00 0.00 61.00 62.83 2bwg s PRO 19 Cb -0.23 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 2bwg s PRO 19 CO 0.29 -0.46 -0.06 0.15 0.04 0.00 0.00 177.00 176.96 2bwg s LYS 20 N -3.35 0.72 0.30 4.56 1.02 0.56 -4.95 119.74 118.61 2bwg s LYS 20 Ca 0.67 -1.21 -0.29 0.00 0.02 0.00 0.00 55.97 55.15 2bwg s LYS 20 Cb -0.16 -0.09 -0.10 0.00 -0.52 0.00 0.00 37.83 36.96 2bwg s LYS 20 CO 0.22 -0.04 1.42 1.03 -0.92 0.00 0.00 175.35 177.07 2bwg s ARG 21 N -3.51 4.25 0.37 1.68 0.52 -1.26 -4.34 118.95 116.65 2bwg s ARG 21 Ca 0.07 2.36 -0.14 0.00 -0.52 0.00 0.00 55.73 57.50 2bwg s ARG 21 Cb 0.04 -3.06 0.04 0.00 0.52 0.00 0.00 34.95 32.49 2bwg s ARG 21 CO -0.05 -0.39 0.72 -1.54 0.02 0.00 0.00 175.30 174.05 2bwg s SER 22 N 0.02 0.15 -0.05 0.23 1.04 -1.26 -4.71 113.70 109.13 2bwg s SER 22 Ca 0.55 -1.16 0.17 0.00 0.48 0.00 0.00 55.95 56.00 2bwg s SER 22 Cb -0.43 0.80 0.57 0.00 0.10 0.00 0.00 66.02 67.06 2bwg s SER 22 CO 0.51 -1.58 1.48 -1.20 0.98 0.00 0.00 173.24 173.42 2bwg n SER 23 N -1.31 3.92 -4.56 7.02 7.64 -1.26 -4.93 113.62 120.13 2bwg n SER 23 Ca -0.06 -2.22 -0.42 0.00 1.01 0.00 0.00 58.87 57.18 2bwg n SER 23 Cb 0.60 -0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 63.29 2bwg n SER 23 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2bwg s LEU 24 N -1.40 4.26 -0.10 -3.43 1.02 -1.26 -4.94 118.68 112.82 2bwg s LEU 24 Ca 0.42 0.04 -0.01 0.00 0.02 0.00 0.00 54.13 54.60 2bwg s LEU 24 Cb 0.25 -2.90 -0.00 0.00 0.02 0.00 0.00 46.19 43.56 2bwg s LEU 24 CO 0.24 -0.76 -0.02 0.07 0.02 0.00 0.00 176.35 175.90 2bwg h LYS 25 N 8.70 0.00 -6.40 1.70 2.10 -1.93 -3.47 116.57 117.27 2bwg h LYS 25 Ca -0.25 0.00 -0.65 0.00 -2.00 0.00 0.00 60.65 57.75 2bwg h LYS 25 Cb 1.10 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 32.30 2bwg h LYS 25 CO 0.90 0.00 -0.68 -1.54 -2.00 0.00 0.00 179.45 176.13 2bwg s SER 26 N -5.55 4.85 0.40 7.07 1.04 -1.26 -5.03 113.70 115.22 2bwg s SER 26 Ca -0.02 -0.25 0.20 0.00 0.48 0.00 0.00 55.95 56.36 2bwg s SER 26 Cb 0.00 -1.09 0.80 0.00 0.10 0.00 0.00 66.02 65.84 2bwg s SER 26 CO 0.02 0.16 1.79 0.08 0.98 0.00 0.00 173.24 176.28 2bwg h ARG 27 N 3.39 0.00 0.00 4.02 0.11 -1.94 -2.94 114.38 117.02 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 0.32 -0.19 0.00 0.10 0.00 0.00 179.97 180.78 2bwg h ALA 28 N 1.68 1.54 -0.15 0.08 0.00 -1.96 -1.95 119.26 118.50 2bwg h ALA 28 Ca -0.00 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.78 2bwg h ALA 28 Cb 0.80 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2bwg h ALA 28 CO 0.04 0.24 0.19 1.05 0.00 0.00 0.00 179.25 180.77 2bwg h GLU 29 N 0.00 0.00 -6.39 0.00 4.11 -1.93 -3.44 114.58 106.93 2bwg h GLU 29 Ca -0.00 0.00 -0.54 0.00 0.07 0.00 0.00 59.36 58.89 2bwg h GLU 29 Cb 0.37 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 0.41 0.08 0.07 0.00 0.00 179.01 179.60 2bwg s VAL 30 N -4.56 4.80 -0.37 -1.06 1.01 -0.74 -4.95 120.40 114.54 2bwg s VAL 30 Ca -0.05 2.02 -0.18 0.00 0.00 0.00 0.00 61.98 63.77 2bwg s VAL 30 Cb 0.15 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 32.23 2bwg s VAL 30 CO 0.52 0.13 0.52 -0.62 0.00 0.00 0.00 175.10 175.65 2bwg s ASP 31 N 1.03 6.31 0.24 3.32 2.15 -0.54 -4.95 116.67 124.23 2bwg s ASP 31 Ca 0.52 -0.11 0.22 0.00 0.43 0.00 0.00 52.55 53.61 2bwg s ASP 31 Cb -0.21 -2.27 0.05 0.00 -0.30 0.00 0.00 42.92 40.18 2bwg s ASP 31 CO 0.27 -0.52 1.12 -0.07 -0.17 0.00 0.00 175.17 175.79 2bwg h LEU 32 N 9.16 0.00 -9.52 -1.34 3.38 -1.96 -0.61 115.31 114.43 2bwg h LEU 32 Ca -0.27 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.09 2bwg h LEU 32 Cb 1.12 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.96 2bwg h LEU 32 CO 0.79 0.01 0.44 -0.62 0.09 0.00 0.00 178.44 179.16 2bwg n GLU 33 N -2.75 1.72 -4.34 1.13 1.02 -1.26 -4.50 120.64 111.66 2bwg n GLU 33 Ca 0.00 0.61 -0.21 0.00 -0.02 0.00 0.00 57.16 57.54 2bwg n GLU 33 Cb 0.55 -2.17 -0.13 0.00 -0.02 0.00 0.00 31.44 29.67 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 -0.71 1.01 -0.20 3.49 0.52 0.83 -4.67 118.95 119.22 2bwg s ARG 34 Ca 0.67 -0.92 -0.00 0.00 -0.52 0.00 0.00 55.73 54.96 2bwg s ARG 34 Cb -0.70 -1.09 0.02 0.00 0.52 0.00 0.00 34.95 33.70 2bwg s ARG 34 CO 0.53 0.26 -0.15 0.99 0.02 0.00 0.00 175.30 176.95 2bwg s THR 35 N -1.02 2.39 -0.05 0.02 2.01 -1.26 -1.64 115.64 116.08 2bwg s THR 35 Ca 0.02 -0.90 0.05 0.00 0.31 0.00 0.00 61.69 61.17 2bwg s THR 35 Cb -0.09 -2.06 -0.02 0.00 0.01 0.00 0.00 72.50 70.34 2bwg s THR 35 CO 0.02 0.45 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.85 2bwg s PHE 36 N 1.32 2.56 -0.29 4.92 0.08 0.34 -4.96 117.98 121.95 2bwg s PHE 36 Ca 0.04 -0.42 -0.04 0.00 0.12 0.00 0.00 56.93 56.63 2bwg s PHE 36 Cb -0.14 -1.62 0.03 0.00 -0.57 0.00 0.00 43.02 40.73 2bwg s PHE 36 CO -0.10 -0.01 0.02 0.99 -0.10 0.00 0.00 175.22 176.02 2bwg s THR 37 N -0.43 3.30 0.52 0.64 2.01 -1.26 0.45 115.64 120.87 2bwg s THR 37 Ca 0.05 -1.12 -0.19 0.00 0.31 0.00 0.00 61.69 60.74 2bwg s THR 37 Cb -0.12 -2.80 -0.07 0.00 0.01 0.00 0.00 72.50 69.52 2bwg s THR 37 CO 0.02 -0.01 1.05 -0.36 -0.69 0.00 0.00 174.62 174.62 2bwg s PHE 38 N 1.35 2.99 0.04 4.92 0.08 0.10 -4.95 117.98 122.50 2bwg s PHE 38 Ca -0.02 1.55 -0.19 0.00 0.12 0.00 0.00 56.93 58.40 2bwg s PHE 38 Cb -0.18 -3.05 -0.17 0.00 -0.57 0.00 0.00 43.02 39.05 2bwg s PHE 38 CO -0.00 -0.93 1.26 -0.09 -0.10 0.00 0.00 175.22 175.35 2bwg h ARG 39 N 1.21 0.46 0.00 0.44 2.43 -1.85 -2.45 114.38 114.63 2bwg h ARG 39 Ca -0.49 -0.33 -0.42 0.00 -0.81 0.00 0.00 59.98 57.94 2bwg h ARG 39 Cb 1.22 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 30.76 2bwg h ARG 39 CO 0.59 0.95 -2.47 0.09 -1.51 0.00 0.00 179.97 177.61 2bwg n ASN 40 N -4.35 1.97 0.18 -3.80 3.02 -1.26 -4.35 115.26 106.67 2bwg n ASN 40 Ca -0.07 0.07 0.04 0.00 -0.03 0.00 0.00 54.58 54.59 2bwg n ASN 40 Cb 0.51 -0.60 0.29 0.00 -0.61 0.00 0.00 39.78 39.38 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 -0.41 0.00 -0.15 6.41 4.64 -1.78 -3.47 113.55 118.78 2bwg h SER 41 Ca -0.62 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.63 2bwg h SER 41 Cb 1.78 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.85 2bwg h SER 41 CO -0.22 0.42 -0.06 0.29 -0.87 0.00 0.00 176.83 176.39 2bwg n LYS 42 N -3.57 -1.39 -1.79 4.77 4.76 -0.92 -4.64 118.16 115.37 2bwg n LYS 42 Ca -0.00 0.51 -0.30 0.00 -2.87 0.00 0.00 58.31 55.64 2bwg n LYS 42 Cb 0.54 -4.62 0.05 0.00 -1.84 0.00 0.00 35.03 29.16 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 -1.85 2.73 -0.03 1.97 -1.52 -1.26 -4.72 119.66 114.98 2bwg s GLN 43 Ca 0.00 0.54 0.06 0.00 -1.95 0.00 0.00 55.36 54.00 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 -1.15 -0.19 0.99 -0.25 0.00 0.00 175.29 174.69 2bwg s THR 44 N -3.29 2.62 0.00 -0.19 2.01 -1.26 -0.72 115.64 114.81 2bwg s THR 44 Ca 0.59 -0.92 0.08 0.00 0.31 0.00 0.00 61.69 61.74 2bwg s THR 44 Cb -0.12 -1.99 -0.02 0.00 0.01 0.00 0.00 72.50 70.38 2bwg s THR 44 CO 0.53 0.56 -0.24 -0.47 -0.69 0.00 0.00 174.62 174.31 2bwg s TYR 45 N -0.70 2.39 -0.04 4.92 5.04 0.17 -4.97 117.35 124.16 2bwg s TYR 45 Ca 0.11 -0.38 0.01 0.00 -2.44 0.00 0.00 57.07 54.37 2bwg s TYR 45 Cb -0.10 -1.48 0.02 0.00 0.35 0.00 0.00 41.96 40.75 2bwg s TYR 45 CO 0.00 0.06 -0.05 -1.12 -1.34 0.00 0.00 175.55 173.10 2bwg s SER 46 N -0.88 0.97 0.00 4.32 0.01 -1.26 -0.50 113.70 116.36 2bwg s SER 46 Ca 0.11 -0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.23 2bwg s SER 46 Cb -0.10 -0.46 0.00 0.00 0.21 0.00 0.00 66.02 65.67 2bwg s SER 46 CO 0.01 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2bwg n GLY 47 N 3.95 -1.87 3.59 3.44 0.00 -0.65 -4.96 105.19 108.68 2bwg n GLY 47 Ca -0.25 -1.14 -0.43 0.00 0.00 0.00 0.00 46.02 44.20 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 -2.32 4.46 0.00 -0.61 1.01 0.49 -0.12 121.20 124.11 2bwg s ILE 48 Ca 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 60.65 61.64 2bwg s ILE 48 Cb 0.00 -4.43 -0.23 0.00 0.01 0.00 0.00 42.46 37.81 2bwg s ILE 48 CO 0.00 -0.74 3.23 -0.81 0.00 0.00 0.00 174.94 176.62 2bwg n PRO 49 N 7.14 1.75 -4.63 2.79 -0.04 -1.26 -4.12 135.00 136.62 2bwg n PRO 49 Ca 0.08 -0.87 -0.33 0.00 -0.04 0.00 0.00 63.50 62.34 2bwg n PRO 49 Cb 0.48 -1.93 -0.15 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 1.24 2.96 -0.10 0.52 1.01 -1.26 -1.54 121.20 124.04 2bwg s ILE 50 Ca 0.58 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 60.58 2bwg s ILE 50 Cb 0.28 -2.26 -0.01 0.00 0.01 0.00 0.00 42.46 40.48 2bwg s ILE 50 CO 0.00 0.51 -0.18 -0.63 0.00 0.00 0.00 174.94 174.64 2bwg s ILE 51 N 0.58 2.63 0.06 2.92 1.01 0.69 -1.81 121.20 127.27 2bwg s ILE 51 Ca -0.08 -0.83 -0.30 0.00 0.00 0.00 0.00 60.65 59.44 2bwg s ILE 51 Cb -0.16 -2.05 -0.05 0.00 0.01 0.00 0.00 42.46 40.22 2bwg s ILE 51 CO 0.03 0.55 1.09 -0.69 0.00 0.00 0.00 174.94 175.92 2bwg s VAL 52 N 0.08 4.36 0.61 2.92 1.01 -0.43 -0.65 120.40 128.30 2bwg s VAL 52 Ca -0.08 1.75 -0.18 0.00 0.00 0.00 0.00 61.98 63.47 2bwg s VAL 52 Cb -0.15 -4.12 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 2bwg s VAL 52 CO 0.05 0.17 1.21 0.00 0.00 0.00 0.00 175.10 176.53 2bwg s ALA 53 N 0.79 2.51 0.00 5.51 0.00 -0.35 -1.45 121.76 128.77 2bwg s ALA 53 Ca 0.54 1.00 -0.04 0.00 0.00 0.00 0.00 51.96 53.46 2bwg s ALA 53 Cb -0.26 -3.45 -0.20 0.00 0.00 0.00 0.00 23.12 19.21 2bwg s ALA 53 CO 0.30 -1.23 2.91 0.27 0.00 0.00 0.00 175.76 178.00 2bwg n ASN 54 N -1.70 4.18 -4.96 0.00 6.94 -1.14 -3.06 115.26 115.52 2bwg n ASN 54 Ca 0.14 -2.27 -0.23 0.00 -0.02 0.00 0.00 54.58 52.20 2bwg n ASN 54 Cb 0.50 -1.12 -0.01 0.00 -2.36 0.00 0.00 39.78 36.79 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 1.35 3.36 0.33 -3.83 -1.94 -1.26 -4.36 119.30 112.94 2bwg s MET 55 Ca 0.50 -0.53 0.01 0.00 -1.71 0.00 0.00 55.69 53.96 2bwg s MET 55 Cb 0.24 -2.71 0.56 0.00 2.01 0.00 0.00 34.83 34.93 2bwg s MET 55 CO 0.00 0.12 1.99 -0.44 -0.01 0.00 0.00 175.02 176.69 2bwg h ASP 56 N 0.79 0.82 0.34 3.03 3.32 -1.89 0.11 116.42 122.94 2bwg h ASP 56 Ca -0.49 -0.02 -0.32 0.00 0.02 0.00 0.00 57.03 56.22 2bwg h ASP 56 Cb 1.23 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.52 2bwg h ASP 56 CO 0.60 0.59 -1.91 0.35 -1.72 0.00 0.00 179.24 177.15 2bwg n THR 57 N -4.43 1.56 -0.09 0.35 -2.24 -1.26 -4.55 114.28 103.63 2bwg n THR 57 Ca 0.08 -0.80 -0.09 0.00 -2.27 0.00 0.00 64.05 60.96 2bwg n THR 57 Cb 0.04 -0.93 -0.13 0.00 -2.10 0.00 0.00 70.33 67.21 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 -3.00 1.16 -1.69 2.28 0.24 -1.19 -0.85 118.33 115.28 2bwg n VAL 58 Ca -0.22 -0.67 -0.36 0.00 -2.04 0.00 0.00 64.34 61.04 2bwg n VAL 58 Cb 1.08 -0.67 -0.03 0.00 -1.47 0.00 0.00 33.84 32.75 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 2.05 4.73 3.79 7.63 0.00 0.02 -4.76 105.19 118.65 2bwg n GLY 59 Ca -0.29 -1.84 -0.22 0.00 0.00 0.00 0.00 46.02 43.67 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 -0.30 3.28 0.27 2.61 -4.23 -1.26 -1.14 115.64 114.87 2bwg s THR 60 Ca 0.60 -1.55 0.02 0.00 -1.18 0.00 0.00 61.69 59.58 2bwg s THR 60 Cb 0.22 -3.08 0.06 0.00 1.34 0.00 0.00 72.50 71.04 2bwg s THR 60 CO -0.10 -0.18 1.71 -0.26 -0.54 0.00 0.00 174.62 175.25 2bwg h PHE 61 N 1.41 0.56 -0.56 3.99 0.04 -1.93 -1.59 116.94 118.86 2bwg h PHE 61 Ca -0.44 -0.12 -0.10 0.00 2.80 0.00 0.00 57.97 60.11 2bwg h PHE 61 Cb 1.25 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 39.24 2bwg h PHE 61 CO 0.58 0.71 -0.05 0.93 -0.60 0.00 0.00 178.31 179.89 2bwg h GLU 62 N 0.44 1.01 -0.45 1.51 3.07 -1.96 -1.40 114.58 116.80 2bwg h GLU 62 Ca 0.07 -0.33 -0.05 0.00 -0.50 0.00 0.00 59.36 58.54 2bwg h GLU 62 Cb 0.67 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.48 2bwg h GLU 62 CO 0.05 1.02 0.07 1.98 -1.40 0.00 0.00 179.01 180.73 2bwg h MET 63 N 0.91 0.75 -0.54 2.33 4.05 -1.68 -3.08 114.93 117.66 2bwg h MET 63 Ca 0.15 -0.20 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 2bwg h MET 63 Cb 0.60 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.28 2bwg h MET 63 CO 0.04 0.77 0.36 0.00 0.23 0.00 0.00 176.91 178.30 2bwg h ALA 64 N 0.95 1.60 -0.19 0.39 0.00 -0.79 -0.72 119.26 120.51 2bwg h ALA 64 Ca 0.14 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2bwg h ALA 64 Cb 0.38 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2bwg h ALA 64 CO 0.01 0.37 -0.20 0.00 0.00 0.00 0.00 179.25 179.42 2bwg h ALA 65 N 1.65 1.32 0.16 0.00 0.00 -1.18 -0.07 119.26 121.14 2bwg h ALA 65 Ca 0.20 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.61 2bwg h ALA 65 Cb -0.08 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 17.64 2bwg h ALA 65 CO -0.04 0.46 -0.95 0.28 0.00 0.00 0.00 179.25 179.00 2bwg h VAL 66 N 0.29 1.46 -0.77 0.00 2.07 -1.43 -3.31 116.25 114.57 2bwg h VAL 66 Ca 0.05 -2.56 -0.02 0.00 0.82 0.00 0.00 66.70 65.00 2bwg h VAL 66 Cb 0.53 3.15 -0.04 0.00 -1.52 0.00 0.00 31.29 33.41 2bwg h VAL 66 CO 0.04 0.73 0.41 0.24 0.02 0.00 0.00 177.57 179.01 2bwg h MET 67 N -0.25 1.07 -0.43 1.57 2.86 -0.88 -2.59 114.93 116.28 2bwg h MET 67 Ca -0.16 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.30 2bwg h MET 67 Cb 1.75 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 33.18 2bwg h MET 67 CO 0.18 0.79 0.07 1.03 1.06 0.00 0.00 176.91 180.03 2bwg h SER 68 N 1.08 0.61 -0.42 1.22 0.87 -1.05 0.12 113.55 115.97 2bwg h SER 68 Ca 0.27 -0.11 0.10 0.00 -1.23 0.00 0.00 61.79 60.82 2bwg h SER 68 Cb 0.04 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 2bwg h SER 68 CO -0.04 0.64 0.30 1.56 -0.53 0.00 0.00 176.83 178.75 2bwg h GLN 69 N 0.63 0.14 -0.64 2.24 4.20 -1.55 -1.28 115.11 118.85 2bwg h GLN 69 Ca 0.14 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.84 2bwg h GLN 69 Cb 0.30 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.05 2bwg h GLN 69 CO 0.00 0.09 0.00 0.72 -0.67 0.00 0.00 178.83 178.98 2bwg n HIS 70 N -4.45 1.52 -2.40 2.96 8.25 -0.68 -4.92 115.22 115.50 2bwg n HIS 70 Ca 0.07 -0.58 -0.20 0.00 -0.26 0.00 0.00 57.72 56.75 2bwg n HIS 70 Cb 0.40 -0.29 -0.01 0.00 1.12 0.00 0.00 29.99 31.20 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 0.94 -5.65 -4.89 0.41 7.64 -0.48 -4.66 113.62 106.94 2bwg n SER 71 Ca 0.24 0.02 -0.21 0.00 1.01 0.00 0.00 58.87 59.93 2bwg n SER 71 Cb 0.91 -4.71 -0.03 0.00 -1.01 0.00 0.00 64.21 59.37 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 -5.04 2.87 0.08 1.43 -1.94 0.34 -0.38 119.30 116.65 2bwg s MET 72 Ca 0.00 -1.18 0.02 0.00 -1.71 0.00 0.00 55.69 52.82 2bwg s MET 72 Cb 0.00 -2.58 -0.04 0.00 2.01 0.00 0.00 34.83 34.22 2bwg s MET 72 CO 0.00 0.13 0.11 0.12 -0.01 0.00 0.00 175.02 175.38 2bwg s PHE 73 N -2.24 3.27 -0.08 -0.03 5.36 -0.75 -3.52 117.98 119.99 2bwg s PHE 73 Ca 0.41 0.12 -0.00 0.00 -0.96 0.00 0.00 56.93 56.49 2bwg s PHE 73 Cb -0.07 -1.65 0.02 0.00 -0.34 0.00 0.00 43.02 40.98 2bwg s PHE 73 CO 0.28 0.54 -0.05 0.99 -1.46 0.00 0.00 175.22 175.51 2bwg s THR 74 N -1.43 0.75 -0.41 0.12 2.01 0.51 -1.31 115.64 115.89 2bwg s THR 74 Ca 0.31 -0.15 -0.20 0.00 0.31 0.00 0.00 61.69 61.95 2bwg s THR 74 Cb -0.12 -0.80 0.02 0.00 0.01 0.00 0.00 72.50 71.60 2bwg s THR 74 CO 0.24 0.31 0.63 0.00 -0.69 0.00 0.00 174.62 175.10 2bwg s ALA 75 N 1.56 3.39 0.06 7.40 0.00 -0.53 -1.42 121.76 132.22 2bwg s ALA 75 Ca 0.00 -1.09 -0.30 0.00 0.00 0.00 0.00 51.96 50.57 2bwg s ALA 75 Cb -0.13 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 2bwg s ALA 75 CO -0.05 -1.61 0.99 0.42 0.00 0.00 0.00 175.76 175.52 2bwg s ILE 76 N 2.74 4.60 0.75 0.00 -1.09 -0.35 -2.90 121.20 124.95 2bwg s ILE 76 Ca 0.23 2.00 -0.15 0.00 -2.23 0.00 0.00 60.65 60.50 2bwg s ILE 76 Cb -0.14 -4.28 0.05 0.00 -1.58 0.00 0.00 42.46 36.50 2bwg s ILE 76 CO 0.17 0.23 1.24 -1.38 -1.23 0.00 0.00 174.94 173.97 2bwg s HIS 77 N 0.49 1.90 -2.01 3.97 -3.43 -0.29 -3.55 115.29 112.38 2bwg s HIS 77 Ca 0.50 1.60 0.06 0.00 -0.80 0.00 0.00 55.06 56.42 2bwg s HIS 77 Cb -0.23 -3.56 0.23 0.00 -1.43 0.00 0.00 32.58 27.58 2bwg s HIS 77 CO 0.29 -2.88 1.17 0.36 -2.00 0.00 0.00 174.74 171.68 2bwg n LYS 78 N -2.79 1.28 -0.10 -0.38 2.85 -1.26 -3.83 118.16 113.92 2bwg n LYS 78 Ca 0.14 -0.43 0.09 0.00 -1.05 0.00 0.00 58.31 57.06 2bwg n LYS 78 Cb 0.50 -1.13 0.14 0.00 -0.65 0.00 0.00 35.03 33.89 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 -0.18 0.27 -2.42 5.58 8.25 -1.26 -4.91 115.22 120.55 2bwg n HIS 79 Ca 0.06 -0.18 -0.39 0.00 -0.26 0.00 0.00 57.72 56.95 2bwg n HIS 79 Cb 0.11 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.18 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 -1.34 3.31 0.68 4.41 2.02 -1.25 -5.04 117.35 120.14 2bwg s TYR 80 Ca 0.27 1.63 -0.11 0.00 -0.37 0.00 0.00 57.07 58.49 2bwg s TYR 80 Cb 0.17 -3.29 -0.00 0.00 -0.40 0.00 0.00 41.96 38.44 2bwg s TYR 80 CO 0.24 -0.86 1.06 -1.54 -1.57 0.00 0.00 175.55 172.88 2bwg s SER 81 N -1.14 5.61 0.25 2.29 1.04 -1.26 -4.92 113.70 115.56 2bwg s SER 81 Ca 0.52 1.43 -0.03 0.00 0.48 0.00 0.00 55.95 58.35 2bwg s SER 81 Cb -0.29 -2.35 0.44 0.00 0.10 0.00 0.00 66.02 63.93 2bwg s SER 81 CO 0.37 -1.27 1.79 0.25 0.98 0.00 0.00 173.24 175.35 2bwg h LEU 82 N -0.60 0.58 -1.03 2.42 5.85 -1.96 -1.50 115.31 119.08 2bwg h LEU 82 Ca -0.44 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.34 2bwg h LEU 82 Cb 1.22 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 2bwg h LEU 82 CO 0.60 0.30 0.55 0.44 -0.34 0.00 0.00 178.44 180.00 2bwg h ASP 83 N 0.70 1.08 -0.87 1.25 3.32 -1.99 -0.78 116.42 119.12 2bwg h ASP 83 Ca 0.42 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.40 2bwg h ASP 83 Cb 0.48 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 2bwg h ASP 83 CO -0.30 0.82 0.49 0.44 -1.72 0.00 0.00 179.24 178.97 2bwg h ASP 84 N 1.24 1.08 -0.25 6.45 3.32 -1.66 -0.73 116.42 125.87 2bwg h ASP 84 Ca 0.33 -0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.21 2bwg h ASP 84 Cb -0.07 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.20 2bwg h ASP 84 CO -0.06 0.86 -0.12 -0.50 -1.72 0.00 0.00 179.24 177.70 2bwg h TRP 85 N 1.21 0.61 -0.51 4.55 4.06 -1.07 -1.63 115.95 123.17 2bwg h TRP 85 Ca 0.31 -0.15 0.08 0.00 2.06 0.00 0.00 58.89 61.19 2bwg h TRP 85 Cb 0.01 -0.14 -0.07 0.00 -1.00 0.00 0.00 29.16 27.96 2bwg h TRP 85 CO 0.01 0.78 0.13 0.87 -3.56 0.00 0.00 178.44 176.66 2bwg h LYS 86 N 0.25 0.26 -0.68 0.49 1.57 -0.86 0.11 116.57 117.71 2bwg h LYS 86 Ca 0.06 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 2bwg h LYS 86 Cb 0.62 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 2bwg h LYS 86 CO 0.04 0.17 0.18 1.25 -0.57 0.00 0.00 179.45 180.53 2bwg h LEU 87 N 0.27 1.01 -0.76 2.94 5.85 -1.05 0.14 115.31 123.71 2bwg h LEU 87 Ca 0.26 -0.20 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 2bwg h LEU 87 Cb 0.33 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2bwg h LEU 87 CO -0.31 0.96 -0.29 0.15 -0.34 0.00 0.00 178.44 178.61 2bwg h PHE 88 N 1.03 0.71 -0.61 1.25 3.57 -0.51 -0.63 116.94 121.75 2bwg h PHE 88 Ca 0.22 -0.17 -0.10 0.00 3.53 0.00 0.00 57.97 61.45 2bwg h PHE 88 Cb 0.33 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.88 2bwg h PHE 88 CO 0.02 0.84 -0.01 0.00 -2.23 0.00 0.00 178.31 176.94 2bwg h ALA 89 N 1.15 0.83 -0.21 2.41 0.00 -0.43 0.28 119.26 123.30 2bwg h ALA 89 Ca 0.07 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2bwg h ALA 89 Cb 0.77 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2bwg h ALA 89 CO 0.06 0.67 0.13 1.15 0.00 0.00 0.00 179.25 181.26 2bwg h THR 90 N 0.98 1.08 0.00 0.00 2.02 -0.71 -3.16 112.91 113.11 2bwg h THR 90 Ca 0.17 -0.18 -0.17 0.00 0.77 0.00 0.00 66.41 67.00 2bwg h THR 90 Cb 0.57 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 2bwg h THR 90 CO 0.03 0.08 -1.61 0.59 0.37 0.00 0.00 175.52 174.98 2bwg n ASN 91 N -4.92 0.64 -3.06 4.18 3.02 -0.27 -4.57 115.26 110.29 2bwg n ASN 91 Ca -0.03 0.28 -0.20 0.00 -0.03 0.00 0.00 54.58 54.60 2bwg n ASN 91 Cb 0.05 0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 39.68 2bwg n ASN 91 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2bwg n HIS 92 N -2.79 1.52 0.18 3.10 8.25 0.98 -4.92 115.22 121.53 2bwg n HIS 92 Ca -0.12 -3.78 0.04 0.00 -0.26 0.00 0.00 57.72 53.60 2bwg n HIS 92 Cb 0.85 -0.43 0.47 0.00 1.12 0.00 0.00 29.99 32.00 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 2.98 0.10 0.00 -0.41 0.14 -1.70 -1.96 132.00 131.15 2bwg h PRO 93 Ca 0.10 -0.02 0.00 0.00 0.14 0.00 0.00 66.00 66.22 2bwg h PRO 93 Cb 0.84 -0.01 0.00 0.00 0.14 0.00 0.00 31.00 31.97 2bwg h PRO 93 CO 0.61 0.25 0.00 1.05 0.14 0.00 0.00 178.00 180.04 2bwg h GLU 94 N 0.09 0.00 0.00 0.86 9.09 -1.91 -2.87 114.58 119.84 2bwg h GLU 94 Ca 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.42 2bwg h GLU 94 Cb 0.32 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.41 2bwg h GLU 94 CO 0.02 0.00 -0.81 0.00 0.05 0.00 0.00 179.01 178.27 2bwg h LEU 96 N 0.00 0.00 -0.91 0.00 3.38 -1.60 0.51 115.31 116.69 2bwg h LEU 96 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bwg h LEU 96 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2bwg h LEU 96 CO 0.00 0.02 0.00 0.06 0.09 0.00 0.00 178.44 178.62 2bwg h GLN 97 N 0.00 0.00 -0.29 1.13 3.07 -1.78 -3.27 115.11 113.97 2bwg h GLN 97 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.74 2bwg h GLN 97 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.61 2bwg h GLN 97 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 178.83 179.01 2bwg n ASN 98 N -2.90 4.05 -4.24 0.06 3.02 0.18 -4.93 115.26 110.50 2bwg n ASN 98 Ca 0.02 -3.02 -0.19 0.00 -0.03 0.00 0.00 54.58 51.36 2bwg n ASN 98 Cb 0.35 -0.56 -0.11 0.00 -0.61 0.00 0.00 39.78 38.85 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 -2.83 1.35 0.03 2.41 -7.23 -1.18 -0.36 120.40 112.58 2bwg s VAL 99 Ca 0.43 -1.63 0.07 0.00 -1.81 0.00 0.00 61.98 59.04 2bwg s VAL 99 Cb 0.35 -1.46 -0.02 0.00 0.56 0.00 0.00 36.38 35.81 2bwg s VAL 99 CO 0.09 -0.34 -0.22 0.00 -0.31 0.00 0.00 175.10 174.33 2bwg s ALA 100 N -1.88 1.82 0.13 1.32 0.00 -0.51 -4.30 121.76 118.33 2bwg s ALA 100 Ca 0.07 -1.04 -0.19 0.00 0.00 0.00 0.00 51.96 50.80 2bwg s ALA 100 Cb -0.06 -0.39 -0.07 0.00 0.00 0.00 0.00 23.12 22.60 2bwg s ALA 100 CO 0.03 0.42 0.61 0.54 0.00 0.00 0.00 175.76 177.37 2bwg s VAL 101 N -0.72 4.70 -0.02 0.00 0.11 -0.79 -1.21 120.40 122.49 2bwg s VAL 101 Ca 0.08 1.18 0.04 0.00 -2.93 0.00 0.00 61.98 60.36 2bwg s VAL 101 Cb -0.09 -3.87 -0.03 0.00 -1.53 0.00 0.00 36.38 30.86 2bwg s VAL 101 CO 0.01 0.41 -0.14 -0.44 -3.33 0.00 0.00 175.10 171.62 2bwg s SER 102 N -1.36 4.10 -0.07 3.54 0.01 -1.23 0.48 113.70 119.16 2bwg s SER 102 Ca 0.34 -0.24 -0.09 0.00 1.31 0.00 0.00 55.95 57.28 2bwg s SER 102 Cb -0.18 -0.84 0.02 0.00 0.21 0.00 0.00 66.02 65.23 2bwg s SER 102 CO 0.20 0.31 0.23 -0.55 0.41 0.00 0.00 173.24 173.85 2bwg s SER 103 N -1.04 -0.21 1.04 2.44 0.15 -0.11 -4.46 113.70 111.52 2bwg s SER 103 Ca 0.13 0.35 -0.12 0.00 0.70 0.00 0.00 55.95 57.01 2bwg s SER 103 Cb -0.11 0.43 0.17 0.00 -1.71 0.00 0.00 66.02 64.80 2bwg s SER 103 CO 0.03 -0.16 0.86 0.61 1.20 0.00 0.00 173.24 175.77 2bwg n GLY 104 N 2.56 -1.71 0.91 9.45 0.00 -1.26 -2.36 105.19 112.77 2bwg n GLY 104 Ca -0.15 -1.64 0.09 0.00 0.00 0.00 0.00 46.02 44.31 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 -3.75 2.65 -4.80 1.61 3.41 -1.26 -4.55 113.62 106.92 2bwg n SER 105 Ca 0.11 -1.97 -0.32 0.00 -0.26 0.00 0.00 58.87 56.43 2bwg n SER 105 Cb 0.39 -0.31 0.03 0.00 -0.26 0.00 0.00 64.21 64.06 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 -1.09 1.98 0.16 5.00 0.00 -1.26 -4.95 107.32 107.16 2bwg s GLY 106 Ca 0.34 0.31 -0.13 0.00 0.00 0.00 0.00 44.72 45.24 2bwg s GLY 106 CO 0.24 0.63 1.75 -1.61 0.00 0.00 0.00 173.10 174.11 2bwg h GLN 107 N 0.01 0.78 -0.48 2.90 4.15 -2.00 -1.95 115.11 118.53 2bwg h GLN 107 Ca -0.46 -0.12 -0.11 0.00 0.77 0.00 0.00 58.65 58.74 2bwg h GLN 107 Cb 1.22 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.75 2bwg h GLN 107 CO 0.57 0.65 -0.12 -0.91 -1.93 0.00 0.00 178.83 177.08 2bwg h ASN 108 N 0.73 0.89 -0.56 -0.69 2.35 -1.97 -1.88 115.58 114.44 2bwg h ASN 108 Ca 0.19 -0.29 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 2bwg h ASN 108 Cb 0.12 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 2bwg h ASN 108 CO -0.02 1.02 0.32 0.44 -1.65 0.00 0.00 177.43 177.54 2bwg h ASP 109 N 0.80 0.69 -0.47 5.81 5.19 -1.85 -1.21 116.42 125.38 2bwg h ASP 109 Ca 0.13 -0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.42 2bwg h ASP 109 Cb 0.65 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 39.97 2bwg h ASP 109 CO 0.05 0.56 0.12 0.25 -3.12 0.00 0.00 179.24 177.10 2bwg h LEU 110 N 0.75 0.70 -0.23 1.55 5.85 -1.06 -1.11 115.31 121.77 2bwg h LEU 110 Ca 0.20 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2bwg h LEU 110 Cb 0.02 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2bwg h LEU 110 CO -0.03 0.75 0.14 -0.33 -0.34 0.00 0.00 178.44 178.62 2bwg h GLU 111 N 0.63 0.31 -0.52 1.25 5.08 -1.24 -0.61 114.58 119.47 2bwg h GLU 111 Ca 0.15 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2bwg h GLU 111 Cb 0.31 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2bwg h GLU 111 CO -0.00 0.26 0.19 -0.22 -1.00 0.00 0.00 179.01 178.24 2bwg h LYS 112 N 0.28 0.80 -0.28 2.33 3.64 -1.04 -0.91 116.57 121.40 2bwg h LYS 112 Ca 0.08 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2bwg h LYS 112 Cb 0.03 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2bwg h LYS 112 CO -0.01 0.72 0.15 1.98 -2.27 0.00 0.00 179.45 180.02 2bwg h MET 113 N 0.71 0.38 -0.56 1.90 4.05 -1.15 -1.69 114.93 118.58 2bwg h MET 113 Ca 0.17 -0.04 0.11 0.00 -0.28 0.00 0.00 59.70 59.66 2bwg h MET 113 Cb 0.23 -0.08 -0.09 0.00 -0.80 0.00 0.00 31.60 30.87 2bwg h MET 113 CO -0.01 0.33 0.04 1.15 0.23 0.00 0.00 176.91 178.65 2bwg h THR 114 N 0.33 0.59 -0.54 -0.77 2.02 -0.84 0.30 112.91 114.01 2bwg h THR 114 Ca 0.10 -0.05 -0.07 0.00 0.77 0.00 0.00 66.41 67.15 2bwg h THR 114 Cb 0.06 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 2bwg h THR 114 CO -0.02 0.03 0.05 0.77 0.37 0.00 0.00 175.52 176.72 2bwg h SER 115 N 0.16 0.84 -0.12 4.18 4.64 -0.84 -1.04 113.55 121.36 2bwg h SER 115 Ca 0.29 -0.19 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 2bwg h SER 115 Cb 0.45 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 2bwg h SER 115 CO -0.44 0.88 0.04 0.40 -0.87 0.00 0.00 176.83 176.83 2bwg h ILE 116 N 0.82 1.17 -0.42 0.95 2.04 -0.68 -1.74 117.51 119.64 2bwg h ILE 116 Ca 0.16 -0.51 -0.09 0.00 1.00 0.00 0.00 64.86 65.43 2bwg h ILE 116 Cb 0.43 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 2bwg h ILE 116 CO 0.01 0.15 -0.09 -0.07 0.00 0.00 0.00 178.15 178.15 2bwg h LEU 117 N 0.02 0.73 -0.60 1.44 3.38 -0.77 0.24 115.31 119.76 2bwg h LEU 117 Ca 0.04 -0.21 -0.15 0.00 0.09 0.00 0.00 57.88 57.65 2bwg h LEU 117 Cb 0.20 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2bwg h LEU 117 CO -0.00 0.86 -0.48 -0.33 0.09 0.00 0.00 178.44 178.58 2bwg h GLU 118 N 0.68 0.55 0.00 1.13 5.08 -1.23 -3.11 114.58 117.68 2bwg h GLU 118 Ca 0.12 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 58.07 2bwg h GLU 118 Cb 0.56 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 2bwg h GLU 118 CO 0.03 0.91 -0.47 0.00 -1.00 0.00 0.00 179.01 178.48 2bwg h ALA 119 N 1.04 0.77 -2.58 3.43 0.00 -0.95 -3.39 119.26 117.59 2bwg h ALA 119 Ca 0.02 -0.43 -0.60 0.00 0.00 0.00 0.00 54.91 53.90 2bwg h ALA 119 Cb 1.00 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 18.32 2bwg h ALA 119 CO 0.09 0.59 -0.81 0.28 0.00 0.00 0.00 179.25 179.40 2bwg n VAL 120 N -3.33 0.15 0.27 0.00 0.31 0.79 -4.97 118.33 111.55 2bwg n VAL 120 Ca 0.01 -4.15 0.08 0.00 -0.01 0.00 0.00 64.34 60.28 2bwg n VAL 120 Cb 0.66 -1.91 0.38 0.00 -0.91 0.00 0.00 33.84 32.06 2bwg n VAL 120 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2bwg n PRO 121 N 2.23 0.10 0.24 5.55 -0.02 -1.18 -1.85 135.00 140.07 2bwg n PRO 121 Ca 0.25 0.47 0.14 0.00 -2.02 0.00 0.00 63.50 62.35 2bwg n PRO 121 Cb 0.43 -1.75 0.39 0.00 -0.02 0.00 0.00 33.50 32.55 2bwg n PRO 121 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2bwg h GLN 122 N 0.00 0.00 -6.34 -0.52 7.50 -1.93 -3.42 115.11 110.40 2bwg h GLN 122 Ca 0.00 0.00 -0.57 0.00 0.50 0.00 0.00 58.65 58.58 2bwg h GLN 122 Cb 0.16 0.00 -0.07 0.00 0.05 0.00 0.00 27.48 27.62 2bwg h GLN 122 CO 0.00 0.00 0.81 0.08 -1.50 0.00 0.00 178.83 178.22 2bwg s VAL 123 N -3.39 4.47 -0.28 -0.54 1.01 -0.77 -4.25 120.40 116.65 2bwg s VAL 123 Ca 0.05 1.54 0.09 0.00 0.00 0.00 0.00 61.98 63.66 2bwg s VAL 123 Cb 0.07 -4.43 0.20 0.00 0.00 0.00 0.00 36.38 32.22 2bwg s VAL 123 CO 0.61 -0.58 1.15 0.29 0.00 0.00 0.00 175.10 176.57 2bwg n LYS 124 N 7.02 2.59 -4.54 2.72 4.76 -1.26 -4.97 118.16 124.49 2bwg n LYS 124 Ca 0.11 -2.04 -0.23 0.00 -2.87 0.00 0.00 58.31 53.28 2bwg n LYS 124 Cb 0.48 -1.28 -0.16 0.00 -1.84 0.00 0.00 35.03 32.23 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 -1.64 1.25 -0.06 2.13 0.08 -1.26 -0.67 117.98 117.81 2bwg s PHE 125 Ca 0.18 -0.36 0.04 0.00 0.12 0.00 0.00 56.93 56.91 2bwg s PHE 125 Cb 0.13 -0.89 -0.02 0.00 -0.57 0.00 0.00 43.02 41.68 2bwg s PHE 125 CO 0.06 -0.16 -0.19 0.42 -0.10 0.00 0.00 175.22 175.25 2bwg s ILE 126 N 0.29 2.64 -0.26 0.64 1.01 0.65 -1.88 121.20 124.30 2bwg s ILE 126 Ca -0.06 -0.86 -0.02 0.00 0.00 0.00 0.00 60.65 59.71 2bwg s ILE 126 Cb -0.11 -2.01 0.03 0.00 0.01 0.00 0.00 42.46 40.37 2bwg s ILE 126 CO 0.02 0.57 -0.05 0.00 0.00 0.00 0.00 174.94 175.48 2bwg s LEU 128 N 1.33 3.48 -0.07 0.00 1.43 0.12 -0.94 118.68 124.03 2bwg s LEU 128 Ca -0.00 0.03 -0.05 0.00 -1.03 0.00 0.00 54.13 53.07 2bwg s LEU 128 Cb -0.17 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.25 2bwg s LEU 128 CO -0.04 0.27 0.19 -1.81 0.23 0.00 0.00 176.35 175.19 2bwg s ASP 129 N -0.21 -0.19 0.22 2.29 1.01 -1.00 -1.47 116.67 117.32 2bwg s ASP 129 Ca 0.05 0.38 0.02 0.00 0.71 0.00 0.00 52.55 53.71 2bwg s ASP 129 Cb -0.13 0.34 -0.05 0.00 1.01 0.00 0.00 42.92 44.10 2bwg s ASP 129 CO 0.02 -0.10 0.05 0.68 0.21 0.00 0.00 175.17 176.03 2bwg s VAL 130 N 0.49 0.64 0.09 -1.27 -7.23 -1.01 -4.11 120.40 108.01 2bwg s VAL 130 Ca -0.03 -1.99 -0.17 0.00 -1.81 0.00 0.00 61.98 57.98 2bwg s VAL 130 Cb -0.05 -2.39 -0.08 0.00 0.56 0.00 0.00 36.38 34.43 2bwg s VAL 130 CO -0.02 -0.23 1.47 0.00 -0.31 0.00 0.00 175.10 176.00 2bwg h ALA 131 N 2.53 0.40 -3.20 1.32 0.00 -0.61 -3.37 119.26 116.32 2bwg h ALA 131 Ca -0.38 -0.31 -0.65 0.00 0.00 0.00 0.00 54.91 53.58 2bwg h ALA 131 Cb 1.23 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 18.52 2bwg h ALA 131 CO 0.62 0.26 -0.51 1.21 0.00 0.00 0.00 179.25 180.82 2bwg s ASN 132 N -6.23 4.80 0.00 0.00 2.47 -1.26 -3.49 114.94 111.22 2bwg s ASN 132 Ca -0.13 -3.33 0.09 0.00 0.42 0.00 0.00 52.86 49.91 2bwg s ASN 132 Cb 0.08 -1.70 0.39 0.00 -1.45 0.00 0.00 41.25 38.57 2bwg s ASN 132 CO 0.79 -0.20 1.25 0.61 -3.72 0.00 0.00 177.10 175.82 2bwg n GLY 133 N 2.73 -0.74 0.58 1.21 0.00 -1.25 -1.51 105.19 106.21 2bwg n GLY 133 Ca 0.12 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.45 0.20 -2.88 1.61 4.01 -1.26 -4.84 117.16 112.55 2bwg n TYR 134 Ca 0.03 -0.10 -0.37 0.00 -0.16 0.00 0.00 57.90 57.30 2bwg n TYR 134 Cb 0.09 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.06 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 7.24 0.46 7.72 1.04 -0.57 -4.95 113.70 123.04 2bwg s SER 135 Ca 0.33 1.70 0.20 0.00 0.48 0.00 0.00 55.95 58.66 2bwg s SER 135 Cb 0.18 -2.53 1.10 0.00 0.10 0.00 0.00 66.02 64.88 2bwg s SER 135 CO 0.27 -0.04 1.97 -0.33 0.98 0.00 0.00 173.24 176.09 2bwg h GLU 136 N 3.22 0.00 -0.19 4.02 4.39 -1.93 -1.63 114.58 122.45 2bwg h GLU 136 Ca -0.47 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.19 2bwg h GLU 136 Cb 1.19 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 2bwg h GLU 136 CO 0.65 0.21 -0.06 1.25 -1.16 0.00 0.00 179.01 179.90 2bwg h HIS 137 N 0.00 0.29 0.17 4.33 2.76 -1.93 -1.73 115.15 119.04 2bwg h HIS 137 Ca -0.00 -0.02 -0.27 0.00 -2.20 0.00 0.00 60.37 57.87 2bwg h HIS 137 Cb 0.45 -0.09 0.03 0.00 1.55 0.00 0.00 27.41 29.35 2bwg h HIS 137 CO 0.00 0.35 -1.17 0.35 -1.30 0.00 0.00 177.93 176.16 2bwg h PHE 138 N 0.28 0.85 -0.63 5.26 3.57 -1.61 -2.32 116.94 122.35 2bwg h PHE 138 Ca 0.06 -0.58 0.13 0.00 3.53 0.00 0.00 57.97 61.11 2bwg h PHE 138 Cb 0.29 -0.05 -0.12 0.00 2.79 0.00 0.00 35.95 38.86 2bwg h PHE 138 CO 0.01 1.44 -0.11 0.28 -2.23 0.00 0.00 178.31 177.70 2bwg h VAL 139 N 0.02 0.40 0.00 1.41 2.07 -1.25 0.06 116.25 118.97 2bwg h VAL 139 Ca -0.19 -0.01 -0.10 0.00 0.82 0.00 0.00 66.70 67.21 2bwg h VAL 139 Cb 1.89 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 2bwg h VAL 139 CO 0.22 0.01 -0.49 -0.33 0.02 0.00 0.00 177.57 176.99 2bwg h GLU 140 N 0.03 0.00 -0.28 1.57 4.39 -1.34 -1.97 114.58 116.99 2bwg h GLU 140 Ca 0.31 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.84 2bwg h GLU 140 Cb 0.49 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 2bwg h GLU 140 CO -0.62 0.49 -0.50 0.35 -1.16 0.00 0.00 179.01 177.58 2bwg h PHE 141 N 0.00 1.03 -0.08 4.33 3.57 -0.74 -2.34 116.94 122.71 2bwg h PHE 141 Ca -0.00 -0.36 0.03 0.00 3.53 0.00 0.00 57.97 61.16 2bwg h PHE 141 Cb 1.01 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.53 2bwg h PHE 141 CO 0.00 1.18 -0.07 0.28 -2.23 0.00 0.00 178.31 177.46 2bwg h VAL 142 N 0.59 0.78 -0.95 1.41 2.07 -0.85 -0.91 116.25 118.39 2bwg h VAL 142 Ca 0.02 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.73 2bwg h VAL 142 Cb 1.10 0.78 -0.11 0.00 -1.52 0.00 0.00 31.29 31.54 2bwg h VAL 142 CO 0.11 0.00 0.53 0.11 0.02 0.00 0.00 177.57 178.35 2bwg h LYS 143 N -0.09 0.63 -0.13 1.57 1.57 -1.32 0.40 116.57 119.21 2bwg h LYS 143 Ca 0.06 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2bwg h LYS 143 Cb 0.18 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 2bwg h LYS 143 CO -0.14 0.42 -0.09 1.25 -0.57 0.00 0.00 179.45 180.32 2bwg h LEU 144 N 0.65 0.31 -0.57 2.94 5.85 -0.90 -1.95 115.31 121.65 2bwg h LEU 144 Ca 0.56 -0.44 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 2bwg h LEU 144 Cb 0.91 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 2bwg h LEU 144 CO -0.41 0.69 0.23 0.58 -0.34 0.00 0.00 178.44 179.18 2bwg h VAL 145 N -0.06 1.22 -0.36 1.05 2.07 -0.71 0.61 116.25 120.08 2bwg h VAL 145 Ca 0.03 -0.70 0.06 0.00 0.82 0.00 0.00 66.70 66.91 2bwg h VAL 145 Cb 0.59 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 2bwg h VAL 145 CO 0.03 0.27 0.01 -0.09 0.02 0.00 0.00 177.57 177.81 2bwg h ARG 146 N 0.78 0.11 -0.49 1.57 9.65 -0.93 0.16 114.38 125.23 2bwg h ARG 146 Ca 0.19 -0.01 -0.13 0.00 -1.10 0.00 0.00 59.98 58.93 2bwg h ARG 146 Cb 0.20 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.74 2bwg h ARG 146 CO -0.02 0.07 -0.21 0.00 2.80 0.00 0.00 179.97 182.62 2bwg h ALA 147 N 1.31 0.69 -0.43 2.80 0.00 -0.97 -2.38 119.26 120.27 2bwg h ALA 147 Ca 0.18 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 2bwg h ALA 147 Cb 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2bwg h ALA 147 CO -0.28 0.67 -0.11 0.87 0.00 0.00 0.00 179.25 180.40 2bwg h LYS 148 N 0.87 0.78 -2.34 0.00 1.57 -0.63 -3.37 116.57 113.46 2bwg h LYS 148 Ca 0.11 -0.26 -0.59 0.00 -1.87 0.00 0.00 60.65 58.04 2bwg h LYS 148 Cb 0.79 -0.06 -0.40 0.00 0.08 0.00 0.00 32.23 32.63 2bwg h LYS 148 CO 0.07 0.86 -0.82 1.19 -0.57 0.00 0.00 179.45 180.18 2bwg n PHE 149 N -4.16 1.47 0.30 -1.35 3.72 0.55 -4.98 117.46 113.01 2bwg n PHE 149 Ca 0.01 -3.84 0.17 0.00 -0.05 0.00 0.00 57.45 53.75 2bwg n PHE 149 Cb 0.37 -0.35 0.93 0.00 -0.94 0.00 0.00 39.48 39.49 2bwg n PHE 149 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 2bwg h PRO 150 N 4.63 0.00 -0.01 -1.08 0.11 -1.60 -2.81 132.00 131.23 2bwg h PRO 150 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2bwg h PRO 150 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 2bwg h PRO 150 CO 0.61 0.04 -0.00 0.39 -0.21 0.00 0.00 178.00 178.83 2bwg n GLU 151 N -3.40 0.56 -3.14 1.05 1.02 -1.26 -4.48 120.64 110.99 2bwg n GLU 151 Ca -0.02 -1.16 -0.37 0.00 -0.02 0.00 0.00 57.16 55.58 2bwg n GLU 151 Cb 0.16 -1.21 -0.06 0.00 -0.02 0.00 0.00 31.44 30.31 2bwg n GLU 151 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2bwg s HIS 152 N -0.93 3.73 -0.04 -0.32 3.76 -1.06 -4.80 115.29 115.62 2bwg s HIS 152 Ca 0.13 1.38 -0.26 0.00 -0.15 0.00 0.00 55.06 56.17 2bwg s HIS 152 Cb 0.09 -2.60 -0.03 0.00 1.11 0.00 0.00 32.58 31.15 2bwg s HIS 152 CO 0.14 0.43 0.80 0.99 -0.85 0.00 0.00 174.74 176.25 2bwg s THR 153 N -1.36 4.98 -0.25 1.30 2.01 0.15 -4.57 115.64 117.90 2bwg s THR 153 Ca 0.38 1.66 -0.03 0.00 0.31 0.00 0.00 61.69 64.01 2bwg s THR 153 Cb -0.18 -4.14 0.01 0.00 0.01 0.00 0.00 72.50 68.20 2bwg s THR 153 CO 0.21 0.22 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.71 2bwg s ILE 154 N 0.87 3.24 -0.02 1.82 1.01 -1.26 -0.26 121.20 126.60 2bwg s ILE 154 Ca 0.43 -0.80 -0.18 0.00 0.00 0.00 0.00 60.65 60.10 2bwg s ILE 154 Cb -0.19 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 2bwg s ILE 154 CO 0.22 0.24 0.51 -0.04 0.00 0.00 0.00 174.94 175.86 2bwg s MET 155 N 1.41 4.19 -0.04 2.79 -1.94 0.79 -0.28 119.30 126.21 2bwg s MET 155 Ca 0.02 0.57 -0.02 0.00 -1.71 0.00 0.00 55.69 54.55 2bwg s MET 155 Cb -0.16 -3.31 0.03 0.00 2.01 0.00 0.00 34.83 33.39 2bwg s MET 155 CO -0.03 0.45 0.10 0.00 -0.01 0.00 0.00 175.02 175.54 2bwg s ALA 156 N -0.40 -0.17 0.21 3.03 0.00 -0.15 0.16 121.76 124.44 2bwg s ALA 156 Ca 0.27 0.47 -0.10 0.00 0.00 0.00 0.00 51.96 52.60 2bwg s ALA 156 Cb -0.17 -0.32 0.04 0.00 0.00 0.00 0.00 23.12 22.67 2bwg s ALA 156 CO 0.15 -0.11 0.52 0.41 0.00 0.00 0.00 175.76 176.72 2bwg n GLY 157 N 3.87 1.25 3.60 0.00 0.00 -0.54 -0.40 105.19 112.99 2bwg n GLY 157 Ca -0.23 -1.14 -0.28 0.00 0.00 0.00 0.00 46.02 44.37 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 -2.32 4.50 0.40 1.61 -0.87 -1.26 -2.64 114.94 114.36 2bwg s ASN 158 Ca 0.11 -0.43 0.04 0.00 -1.57 0.00 0.00 52.86 51.01 2bwg s ASN 158 Cb -0.03 -0.87 -0.02 0.00 -0.02 0.00 0.00 41.25 40.31 2bwg s ASN 158 CO 0.06 0.13 0.16 0.68 -2.57 0.00 0.00 177.10 175.57 2bwg s VAL 159 N -1.49 0.45 0.00 1.60 -7.23 -0.63 -3.84 120.40 109.27 2bwg s VAL 159 Ca 0.24 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 2bwg s VAL 159 Cb -0.10 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.49 2bwg s VAL 159 CO 0.16 0.00 0.18 1.33 -0.31 0.00 0.00 175.10 176.46 2bwg n VAL 160 N -0.87 0.00 -4.02 1.32 0.24 -1.26 -0.70 118.33 113.03 2bwg n VAL 160 Ca -0.04 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.15 2bwg n VAL 160 Cb 0.64 1.40 -0.12 0.00 -1.47 0.00 0.00 33.84 34.30 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 0.31 0.30 3.34 -4.23 -1.26 -4.62 115.64 109.48 2bwg s THR 161 Ca 0.00 -0.76 0.19 0.00 -1.18 0.00 0.00 61.69 59.93 2bwg s THR 161 Cb 0.00 -0.38 0.16 0.00 1.34 0.00 0.00 72.50 73.62 2bwg s THR 161 CO 0.00 -0.30 1.85 1.23 -0.54 0.00 0.00 174.62 176.86 2bwg h GLY 162 N 4.98 0.00 1.62 3.99 0.00 -1.91 -2.63 103.07 109.11 2bwg h GLY 162 Ca -0.32 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.92 2bwg h GLY 162 CO 0.43 0.00 -0.26 1.05 0.00 0.00 0.00 176.54 177.76 2bwg h GLU 163 N 0.00 0.44 0.01 4.80 9.09 -1.98 -1.40 114.58 125.54 2bwg h GLU 163 Ca -0.00 -0.17 -0.20 0.00 0.05 0.00 0.00 59.36 59.04 2bwg h GLU 163 Cb 0.67 -0.03 -0.02 0.00 -1.65 0.00 0.00 28.75 27.72 2bwg h GLU 163 CO 0.04 0.67 -0.94 1.98 0.05 0.00 0.00 179.01 180.81 2bwg h MET 164 N 0.39 0.04 0.18 1.06 4.05 -1.92 -2.55 114.93 116.18 2bwg h MET 164 Ca 0.06 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2bwg h MET 164 Cb 0.67 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.47 2bwg h MET 164 CO 0.05 0.94 -0.18 0.28 0.23 0.00 0.00 176.91 178.23 2bwg h VAL 165 N 0.02 0.59 -0.45 -5.77 2.07 -1.28 -0.65 116.25 110.78 2bwg h VAL 165 Ca -0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.54 2bwg h VAL 165 Cb 1.64 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.96 2bwg h VAL 165 CO 0.13 0.00 0.22 -0.33 0.02 0.00 0.00 177.57 177.60 2bwg h GLU 166 N -0.39 0.42 -0.65 1.57 5.08 -1.29 -1.31 114.58 118.01 2bwg h GLU 166 Ca 0.00 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 2bwg h GLU 166 Cb 0.38 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 2bwg h GLU 166 CO -0.05 0.28 0.21 1.49 -1.00 0.00 0.00 179.01 179.94 2bwg h GLU 167 N 0.43 1.00 -0.12 2.33 4.57 -1.28 0.23 114.58 121.74 2bwg h GLU 167 Ca 0.20 -0.21 -0.13 0.00 -1.18 0.00 0.00 59.36 58.04 2bwg h GLU 167 Cb 0.12 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 2bwg h GLU 167 CO -0.15 0.87 -0.48 -0.07 -1.18 0.00 0.00 179.01 178.00 2bwg h LEU 168 N 0.93 0.34 -0.08 1.64 3.38 -0.90 -0.43 115.31 120.20 2bwg h LEU 168 Ca 0.21 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2bwg h LEU 168 Cb 0.28 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2bwg h LEU 168 CO -0.01 0.77 -0.15 0.40 0.09 0.00 0.00 178.44 179.54 2bwg h ILE 169 N 0.26 1.41 0.00 1.22 2.04 -0.91 -1.01 117.51 120.51 2bwg h ILE 169 Ca 0.01 -1.45 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 2bwg h ILE 169 Cb 0.94 2.18 -0.00 0.00 -0.74 0.00 0.00 36.82 39.20 2bwg h ILE 169 CO 0.08 0.41 -0.05 -0.07 0.00 0.00 0.00 178.15 178.51 2bwg h LEU 170 N -0.23 0.00 0.00 1.44 3.38 -0.91 -1.29 115.31 117.70 2bwg h LEU 170 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bwg h LEU 170 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2bwg h LEU 170 CO 0.03 0.05 -0.04 -1.20 0.09 0.00 0.00 178.44 177.38 2bwg n SER 171 N -4.01 0.18 0.00 -0.43 7.64 -0.18 -4.93 113.62 111.88 2bwg n SER 171 Ca -0.03 0.46 0.00 0.00 1.01 0.00 0.00 58.87 60.31 2bwg n SER 171 Cb 0.14 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 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 1.47 0.65 3.76 0.23 0.00 -0.49 -3.34 105.19 107.48 2bwg n GLY 172 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.64 3.29 -0.14 4.61 0.00 -0.40 -4.76 121.76 122.72 2bwg s ALA 173 Ca 0.00 0.70 0.01 0.00 0.00 0.00 0.00 51.96 52.67 2bwg s ALA 173 Cb 0.00 -3.25 -0.24 0.00 0.00 0.00 0.00 23.12 19.64 2bwg s ALA 173 CO 0.00 0.03 0.28 -0.25 0.00 0.00 0.00 175.76 175.82 2bwg n ASP 174 N 0.95 1.65 -3.88 0.00 8.00 0.61 -4.23 116.55 119.66 2bwg n ASP 174 Ca 0.00 0.16 -0.22 0.00 0.71 0.00 0.00 54.79 55.44 2bwg n ASP 174 Cb 0.47 -0.45 -0.17 0.00 -0.02 0.00 0.00 41.12 40.96 2bwg n ASP 174 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2bwg s ILE 175 N -2.55 0.63 -0.21 0.53 1.01 -0.54 -2.41 121.20 117.65 2bwg s ILE 175 Ca -0.20 -0.13 -0.09 0.00 0.00 0.00 0.00 60.65 60.24 2bwg s ILE 175 Cb 0.07 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.83 2bwg s ILE 175 CO 0.75 0.27 0.10 -0.63 0.00 0.00 0.00 174.94 175.43 2bwg s ILE 176 N 1.25 4.93 -0.20 2.92 -1.09 -0.40 -0.98 121.20 127.63 2bwg s ILE 176 Ca -0.05 0.02 -0.27 0.00 -2.23 0.00 0.00 60.65 58.12 2bwg s ILE 176 Cb -0.14 -3.26 -0.00 0.00 -1.58 0.00 0.00 42.46 37.48 2bwg s ILE 176 CO -0.02 0.40 0.92 -0.54 -1.23 0.00 0.00 174.94 174.48 2bwg s LYS 177 N 0.79 4.28 -0.21 2.79 1.02 0.47 -0.37 119.74 128.50 2bwg s LYS 177 Ca 0.05 1.17 -0.03 0.00 0.02 0.00 0.00 55.97 57.17 2bwg s LYS 177 Cb -0.13 -3.61 -0.01 0.00 -0.52 0.00 0.00 37.83 33.56 2bwg s LYS 177 CO 0.02 -0.47 -0.05 0.08 -0.92 0.00 0.00 175.35 174.01 2bwg s VAL 178 N 2.62 3.33 0.00 3.17 1.01 0.12 -1.60 120.40 129.06 2bwg s VAL 178 Ca 0.41 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.88 2bwg s VAL 178 Cb -0.16 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.72 2bwg s VAL 178 CO 0.10 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.24 2bwg n GLY 179 N 4.69 3.42 2.61 4.51 0.00 0.12 -0.00 105.19 120.53 2bwg n GLY 179 Ca -0.18 -0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.11 0.00 1.61 1.01 -1.26 -4.62 120.40 117.03 2bwg s VAL 180 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.71 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 -0.36 0.00 0.61 0.00 0.00 0.00 175.10 175.35 2bwg n GLY 181 N 5.28 2.93 0.34 4.51 0.00 -1.26 -1.22 105.19 115.76 2bwg n GLY 181 Ca -0.07 -0.81 0.18 0.00 0.00 0.00 0.00 46.02 45.33 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 -6.34 1.61 0.11 -1.92 -3.44 132.00 122.02 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 0.08 0.00 0.11 0.00 0.00 31.00 31.19 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 -1.27 -0.03 0.33 -0.55 0.00 -1.26 -3.64 105.19 98.76 2bwg n GLY 183 Ca -0.00 0.50 0.15 0.00 0.00 0.00 0.00 46.02 46.67 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 3.14 0.54 -0.22 1.61 4.64 -1.94 -1.79 113.55 119.52 2bwg h SER 184 Ca -0.42 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2bwg h SER 184 Cb 1.35 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 2bwg h SER 184 CO 0.68 0.08 0.00 1.33 -0.87 0.00 0.00 176.83 178.05 2bwg n VAL 185 N -4.94 0.66 -2.03 0.95 0.24 -1.26 -4.95 118.33 107.00 2bwg n VAL 185 Ca 0.24 -0.83 -0.39 0.00 -2.04 0.00 0.00 64.34 61.32 2bwg n VAL 185 Cb 0.68 0.74 0.01 0.00 -1.47 0.00 0.00 33.84 33.80 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 -0.29 0.87 -0.09 0.00 -2.24 -1.26 -4.81 114.28 106.46 2bwg n THR 187 Ca 0.06 -1.47 -0.01 0.00 -2.27 0.00 0.00 64.05 60.36 2bwg n THR 187 Cb 0.45 0.33 0.25 0.00 -2.10 0.00 0.00 70.33 69.25 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 4.23 1.20 -0.43 4.28 1.35 -1.85 -0.46 112.91 121.23 2bwg h THR 188 Ca -0.07 -0.71 -0.05 0.00 -0.55 0.00 0.00 66.41 65.03 2bwg h THR 188 Cb 1.37 0.67 -0.02 0.00 -1.73 0.00 0.00 68.15 68.45 2bwg h THR 188 CO 0.03 0.26 0.06 0.03 -0.25 0.00 0.00 175.52 175.66 2bwg h ARG 189 N 0.72 0.72 -0.07 4.72 3.08 -1.87 0.69 114.38 122.36 2bwg h ARG 189 Ca 0.17 -0.20 -0.21 0.00 0.07 0.00 0.00 59.98 59.81 2bwg h ARG 189 Cb 0.23 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.20 2bwg h ARG 189 CO -0.01 0.76 -0.80 1.15 -1.07 0.00 0.00 179.97 180.00 2bwg h THR 190 N 0.58 1.36 0.00 2.04 2.02 -1.85 -1.67 112.91 115.39 2bwg h THR 190 Ca 0.13 -2.18 -0.11 0.00 0.77 0.00 0.00 66.41 65.02 2bwg h THR 190 Cb 0.39 2.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.95 2bwg h THR 190 CO 0.01 0.66 -1.91 0.29 0.37 0.00 0.00 175.52 174.95 2bwg n LYS 191 N -3.84 0.66 0.00 6.66 5.02 -0.21 -4.63 118.16 121.82 2bwg n LYS 191 Ca -0.06 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 2bwg n LYS 191 Cb 0.75 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 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 -2.51 0.00 -1.07 -0.18 -2.24 0.22 -5.02 114.28 103.47 2bwg n THR 192 Ca -0.11 -0.03 -0.03 0.00 -2.27 0.00 0.00 64.05 61.61 2bwg n THR 192 Cb 0.75 0.32 -0.01 0.00 -2.10 0.00 0.00 70.33 69.29 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 0.97 0.44 3.78 3.38 0.00 0.17 -4.96 105.19 108.97 2bwg n GLY 193 Ca 0.00 -0.10 -0.36 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 -1.63 4.90 -2.49 1.61 1.01 -1.23 -4.91 120.40 117.66 2bwg s VAL 194 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.96 2bwg s VAL 194 Cb 0.00 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2bwg s VAL 194 CO 0.00 0.61 0.00 0.61 0.00 0.00 0.00 175.10 176.32 2bwg n GLY 195 N 2.07 -1.79 3.64 4.51 0.00 -1.26 -3.51 105.19 108.85 2bwg n GLY 195 Ca -0.19 -1.12 -0.08 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.32 -0.97 0.26 1.61 5.04 -0.36 -5.00 117.35 115.61 2bwg s TYR 196 Ca 0.00 2.03 -0.30 0.00 -2.44 0.00 0.00 57.07 56.37 2bwg s TYR 196 Cb 0.00 0.54 -0.14 0.00 0.35 0.00 0.00 41.96 42.71 2bwg s TYR 196 CO 0.00 -0.48 1.16 -2.30 -1.34 0.00 0.00 175.55 172.59 2bwg n PRO 197 N 3.88 1.56 -0.13 4.97 -0.02 -1.26 -4.53 135.00 139.47 2bwg n PRO 197 Ca -0.18 0.55 -0.11 0.00 -2.02 0.00 0.00 63.50 61.73 2bwg n PRO 197 Cb 0.58 -2.03 0.01 0.00 -0.02 0.00 0.00 33.50 32.04 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 2.81 0.93 -0.26 -0.52 5.75 -1.94 -1.62 115.11 120.25 2bwg h GLN 198 Ca -0.42 -0.43 -0.02 0.00 -0.15 0.00 0.00 58.65 57.63 2bwg h GLN 198 Cb 1.32 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.84 2bwg h GLN 198 CO 0.66 1.09 0.08 1.25 -2.65 0.00 0.00 178.83 179.26 2bwg h LEU 199 N 0.79 0.38 -1.07 -2.39 5.85 -1.84 -1.65 115.31 115.38 2bwg h LEU 199 Ca 0.09 -0.20 -0.10 0.00 0.84 0.00 0.00 57.88 58.51 2bwg h LEU 199 Cb 0.86 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2bwg h LEU 199 CO 0.08 0.48 -0.46 0.28 -0.34 0.00 0.00 178.44 178.49 2bwg h SER 200 N 0.26 0.02 0.93 1.25 0.02 -1.38 -0.39 113.55 114.26 2bwg h SER 200 Ca 0.08 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 60.98 2bwg h SER 200 Cb 0.24 -0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.79 2bwg h SER 200 CO -0.00 0.47 -0.45 0.00 -1.14 0.00 0.00 176.83 175.71 2bwg h ALA 201 N 1.53 -1.25 -0.96 3.77 0.00 -1.11 -2.56 119.26 118.67 2bwg h ALA 201 Ca -0.00 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.70 2bwg h ALA 201 Cb 0.81 0.48 -0.07 0.00 0.00 0.00 0.00 17.79 19.02 2bwg h ALA 201 CO 0.06 -1.20 0.62 0.28 0.00 0.00 0.00 179.25 179.00 2bwg h VAL 202 N -1.25 1.08 0.10 0.00 2.07 -0.99 0.46 116.25 117.72 2bwg h VAL 202 Ca -0.13 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.01 2bwg h VAL 202 Cb 0.96 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2bwg h VAL 202 CO 0.21 0.21 -0.10 0.40 0.02 0.00 0.00 177.57 178.31 2bwg h ILE 203 N 1.12 0.78 -0.03 4.57 1.08 -1.03 -0.48 117.51 123.52 2bwg h ILE 203 Ca 0.42 0.00 -0.25 0.00 -0.39 0.00 0.00 64.86 64.64 2bwg h ILE 203 Cb 0.17 0.78 0.02 0.00 -3.07 0.00 0.00 36.82 34.71 2bwg h ILE 203 CO -0.17 0.00 -0.97 -0.33 -0.69 0.00 0.00 178.15 175.98 2bwg h GLU 204 N -0.22 0.67 -0.28 2.37 5.08 -1.00 -3.02 114.58 118.19 2bwg h GLU 204 Ca 0.00 -0.68 -0.18 0.00 -1.00 0.00 0.00 59.36 57.50 2bwg h GLU 204 Cb 0.21 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 2bwg h GLU 204 CO -0.03 1.28 -0.53 0.00 -1.00 0.00 0.00 179.01 178.73 2bwg h ALA 206 N 0.76 -0.06 -0.62 0.00 0.00 -1.12 -0.75 119.26 117.46 2bwg h ALA 206 Ca 0.02 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.06 2bwg h ALA 206 Cb 1.12 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.93 2bwg h ALA 206 CO 0.12 -0.56 0.11 -0.44 0.00 0.00 0.00 179.25 178.48 2bwg h ASP 207 N -0.11 -0.04 -0.34 0.00 3.32 -1.56 -0.95 116.42 116.74 2bwg h ASP 207 Ca 0.03 0.12 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 2bwg h ASP 207 Cb 0.14 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 2bwg h ASP 207 CO -0.07 -0.02 -0.10 -1.28 -1.72 0.00 0.00 179.24 176.05 2bwg h SER 208 N 0.24 0.68 -0.04 6.45 0.87 -1.30 -1.44 113.55 119.01 2bwg h SER 208 Ca 0.33 -0.38 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2bwg h SER 208 Cb 0.51 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 2bwg h SER 208 CO -0.44 0.90 0.02 0.00 -0.53 0.00 0.00 176.83 176.78 2bwg h ALA 209 N 0.80 0.05 0.00 6.23 0.00 -0.90 -3.18 119.26 122.26 2bwg h ALA 209 Ca 0.08 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2bwg h ALA 209 Cb 0.61 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2bwg h ALA 209 CO 0.04 -0.41 -0.33 0.45 0.00 0.00 0.00 179.25 179.00 2bwg h HIS 210 N -0.03 0.00 0.00 0.00 -0.00 -1.04 0.15 115.15 114.23 2bwg h HIS 210 Ca 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2bwg h HIS 210 Cb 0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.50 2bwg h HIS 210 CO -0.05 0.33 -0.02 0.78 -0.00 0.00 0.00 177.93 178.97 2bwg h GLY 211 N 1.33 0.00 -2.37 2.45 0.00 -1.24 -0.68 103.07 102.55 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 -3.75 3.57 -1.87 3.11 4.77 -0.39 -4.93 117.00 117.51 2bwg n LEU 212 Ca -0.03 -1.63 -0.19 0.00 -0.03 0.00 0.00 56.01 54.13 2bwg n LEU 212 Cb 0.10 -0.31 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 2bwg n LEU 212 CO 0.27 0.80 -0.22 0.29 -1.33 0.00 0.00 177.39 177.21 2bwg n LYS 213 N 1.51 -1.44 -0.74 3.23 5.02 -0.26 -4.99 118.16 120.48 2bwg n LYS 213 Ca 0.20 1.03 -0.02 0.00 -2.02 0.00 0.00 58.31 57.51 2bwg n LYS 213 Cb 0.61 -5.48 0.01 0.00 -0.02 0.00 0.00 35.03 30.14 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 -0.85 0.61 3.08 0.72 0.00 0.39 -4.23 105.19 104.91 2bwg n GLY 214 Ca -0.21 -1.94 -0.09 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.14 0.29 0.08 1.61 3.76 -1.01 -4.09 115.29 115.80 2bwg s HIS 215 Ca 0.06 -0.65 0.05 0.00 -0.15 0.00 0.00 55.06 54.36 2bwg s HIS 215 Cb -0.00 -0.21 -0.03 0.00 1.11 0.00 0.00 32.58 33.44 2bwg s HIS 215 CO 0.04 -0.33 -0.13 0.96 -0.85 0.00 0.00 174.74 174.43 2bwg s ILE 216 N -2.70 1.08 -0.17 0.60 -4.36 -1.26 -1.27 121.20 113.11 2bwg s ILE 216 Ca -0.04 -1.42 -0.05 0.00 -0.26 0.00 0.00 60.65 58.88 2bwg s ILE 216 Cb -0.01 -1.17 -0.03 0.00 1.25 0.00 0.00 42.46 42.50 2bwg s ILE 216 CO -0.05 -0.33 -0.00 -0.63 0.24 0.00 0.00 174.94 174.17 2bwg s ILE 217 N -1.64 4.14 -0.61 8.37 1.01 0.50 -1.51 121.20 131.46 2bwg s ILE 217 Ca 0.01 -0.26 -0.28 0.00 0.00 0.00 0.00 60.65 60.12 2bwg s ILE 217 Cb -0.08 -2.84 0.02 0.00 0.01 0.00 0.00 42.46 39.57 2bwg s ILE 217 CO 0.02 0.47 1.39 -0.55 0.00 0.00 0.00 174.94 176.26 2bwg s SER 218 N 0.55 6.11 -0.60 3.58 0.15 -0.59 0.16 113.70 123.06 2bwg s SER 218 Ca -0.01 0.08 -0.14 0.00 0.70 0.00 0.00 55.95 56.58 2bwg s SER 218 Cb -0.14 -2.55 0.15 0.00 -1.71 0.00 0.00 66.02 61.77 2bwg s SER 218 CO 0.02 -1.76 0.54 -0.62 1.20 0.00 0.00 173.24 172.62 2bwg s ASP 219 N 4.34 6.23 0.00 5.45 2.15 1.00 -0.93 116.67 134.91 2bwg s ASP 219 Ca 0.48 -2.07 0.00 0.00 0.43 0.00 0.00 52.55 51.39 2bwg s ASP 219 Cb -0.10 -2.17 0.00 0.00 -0.30 0.00 0.00 42.92 40.35 2bwg s ASP 219 CO 0.22 -0.75 0.00 0.61 -0.17 0.00 0.00 175.17 175.09 2bwg n GLY 220 N 4.82 2.00 0.00 2.66 0.00 -1.09 -4.25 105.19 109.32 2bwg n GLY 220 Ca -0.05 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.11 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 1.81 3.13 3.69 -0.02 0.00 -1.24 -4.71 105.19 107.85 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 4.67 0.00 -3.64 0.00 -2.24 -1.26 -4.58 114.28 107.24 2bwg n THR 223 Ca 0.12 -0.27 -0.09 0.00 -2.27 0.00 0.00 64.05 61.54 2bwg n THR 223 Cb 0.45 1.01 -0.02 0.00 -2.10 0.00 0.00 70.33 69.67 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 -0.50 0.00 0.11 -1.92 -1.42 132.00 130.27 2bwg h PRO 225 Ca -0.26 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.85 2bwg h PRO 225 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 2bwg h PRO 225 CO 0.30 0.06 0.30 0.78 -0.21 0.00 0.00 178.00 179.24 2bwg h GLY 226 N 0.79 0.72 1.00 -0.55 0.00 -1.95 -1.09 103.07 101.99 2bwg h GLY 226 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2bwg h GLY 226 CO 0.01 0.29 0.44 -0.55 0.00 0.00 0.00 176.54 176.72 2bwg h ASP 227 N 0.66 0.81 -0.79 0.19 3.32 -1.67 0.32 116.42 119.27 2bwg h ASP 227 Ca 0.18 -0.04 0.06 0.00 0.02 0.00 0.00 57.03 57.25 2bwg h ASP 227 Cb -0.02 -0.20 -0.06 0.00 0.22 0.00 0.00 39.33 39.27 2bwg h ASP 227 CO -0.03 0.62 0.47 0.58 -1.72 0.00 0.00 179.24 179.15 2bwg h VAL 228 N 0.94 1.01 -0.61 -1.35 2.07 -1.16 0.25 116.25 117.40 2bwg h VAL 228 Ca 0.25 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 2bwg h VAL 228 Cb -0.06 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 29.75 2bwg h VAL 228 CO -0.05 0.16 0.20 0.00 0.02 0.00 0.00 177.57 177.90 2bwg h ALA 229 N 1.39 0.80 -0.60 1.67 0.00 -0.32 -2.44 119.26 119.75 2bwg h ALA 229 Ca 0.35 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 2bwg h ALA 229 Cb 0.19 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2bwg h ALA 229 CO -0.18 0.46 0.01 0.87 0.00 0.00 0.00 179.25 180.41 2bwg h LYS 230 N 0.87 1.06 -0.04 0.00 1.57 -0.19 0.35 116.57 120.18 2bwg h LYS 230 Ca 0.20 -0.33 0.04 0.00 -1.87 0.00 0.00 60.65 58.68 2bwg h LYS 230 Cb 0.27 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 2bwg h LYS 230 CO -0.01 1.03 -0.27 0.00 -0.57 0.00 0.00 179.45 179.63 2bwg h ALA 231 N 0.99 -0.33 -0.92 3.86 0.00 -0.36 -0.07 119.26 122.43 2bwg h ALA 231 Ca 0.17 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.11 2bwg h ALA 231 Cb 0.54 0.49 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 2bwg h ALA 231 CO 0.03 -0.76 0.61 0.74 0.00 0.00 0.00 179.25 179.87 2bwg h PHE 232 N -0.38 1.13 -0.41 0.00 0.04 -1.28 -2.33 116.94 113.71 2bwg h PHE 232 Ca 0.07 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.84 2bwg h PHE 232 Cb 0.49 -0.38 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 2bwg h PHE 232 CO -0.32 0.68 0.11 0.78 -0.60 0.00 0.00 178.31 178.95 2bwg h GLY 233 N 1.19 0.64 2.00 -1.45 0.00 -0.24 -2.42 103.07 102.80 2bwg h GLY 233 Ca 0.36 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2bwg h GLY 233 CO -0.10 0.32 0.00 0.00 0.00 0.00 0.00 176.54 176.76 2bwg n ALA 234 N -2.47 2.09 0.00 3.60 0.00 -0.10 -4.32 120.51 119.31 2bwg n ALA 234 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2bwg n ALA 234 Cb 0.19 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.22 2bwg n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bwg n GLY 235 N 0.93 0.86 3.66 0.00 0.00 -0.91 -4.10 105.19 105.63 2bwg n GLY 235 Ca 0.05 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.58 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 0.61 0.04 4.61 0.00 -0.94 -4.88 120.51 119.95 2bwg n ALA 236 Ca 0.00 0.40 -0.20 0.00 0.00 0.00 0.00 53.44 53.65 2bwg n ALA 236 Cb 0.00 -2.33 -0.13 0.00 0.00 0.00 0.00 19.45 16.99 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 6.81 0.60 -2.48 0.00 3.32 -1.69 -3.41 116.42 119.57 2bwg h ASP 237 Ca -0.47 -0.84 -0.55 0.00 0.02 0.00 0.00 57.03 55.19 2bwg h ASP 237 Cb 1.28 -0.19 -0.14 0.00 0.22 0.00 0.00 39.33 40.51 2bwg h ASP 237 CO 0.89 1.38 -0.65 -0.36 -1.72 0.00 0.00 179.24 178.78 2bwg s PHE 238 N -2.88 2.18 -0.07 4.55 0.08 -0.57 -4.80 117.98 116.47 2bwg s PHE 238 Ca -0.12 -0.68 0.00 0.00 0.12 0.00 0.00 56.93 56.25 2bwg s PHE 238 Cb 0.03 -1.33 0.02 0.00 -0.57 0.00 0.00 43.02 41.17 2bwg s PHE 238 CO 0.85 0.35 -0.05 0.08 -0.10 0.00 0.00 175.22 176.35 2bwg s VAL 239 N -2.89 0.67 -0.18 -0.44 1.01 -0.59 -1.54 120.40 116.45 2bwg s VAL 239 Ca 0.32 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 62.10 2bwg s VAL 239 Cb 0.05 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 2bwg s VAL 239 CO 0.15 0.28 0.02 -0.32 0.00 0.00 0.00 175.10 175.22 2bwg s MET 240 N 1.29 3.78 -0.08 2.72 1.75 -0.11 -0.23 119.30 128.43 2bwg s MET 240 Ca -0.05 -0.45 0.03 0.00 -1.25 0.00 0.00 55.69 53.98 2bwg s MET 240 Cb -0.14 -3.09 0.01 0.00 2.84 0.00 0.00 34.83 34.45 2bwg s MET 240 CO -0.02 0.19 -0.17 -0.51 -0.65 0.00 0.00 175.02 173.85 2bwg s LEU 241 N 0.55 1.84 0.01 4.11 1.43 0.18 -2.69 118.68 124.11 2bwg s LEU 241 Ca 0.00 -0.41 -0.05 0.00 -1.03 0.00 0.00 54.13 52.64 2bwg s LEU 241 Cb -0.14 -1.08 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 2bwg s LEU 241 CO 0.02 0.09 -0.10 0.61 0.23 0.00 0.00 176.35 177.20 2bwg n GLY 242 N 3.67 -0.19 0.25 -3.19 0.00 -1.26 -1.21 105.19 103.27 2bwg n GLY 242 Ca -0.21 -0.10 -0.02 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.29 0.94 2.00 -0.02 0.00 -1.95 0.56 103.07 104.31 2bwg h GLY 243 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.06 2bwg h GLY 243 CO 0.00 0.17 -0.07 -0.33 0.00 0.00 0.00 176.54 176.30 2bwg h MET 244 N 0.68 0.00 0.00 4.80 2.07 -1.88 -2.09 114.93 118.51 2bwg h MET 244 Ca 0.28 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.91 2bwg h MET 244 Cb 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.89 2bwg h MET 244 CO -0.17 0.07 -1.17 1.19 1.07 0.00 0.00 176.91 177.91 2bwg n PHE 245 N -3.99 0.34 -1.34 -0.22 3.72 -0.53 -4.96 117.46 110.49 2bwg n PHE 245 Ca -0.03 0.10 -0.35 0.00 -0.05 0.00 0.00 57.45 57.12 2bwg n PHE 245 Cb 0.16 -0.53 0.10 0.00 -0.94 0.00 0.00 39.48 38.27 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 -2.12 0.82 0.00 4.37 3.41 0.08 -3.89 113.62 116.29 2bwg n SER 246 Ca 0.01 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.28 2bwg n SER 246 Cb 0.47 -1.45 0.00 0.00 -0.26 0.00 0.00 64.21 62.97 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 0.93 0.75 3.94 5.00 0.00 -1.26 -4.82 105.19 109.74 2bwg n GLY 247 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.90 3.31 0.53 1.61 4.02 -1.25 -0.95 115.29 119.66 2bwg s HIS 248 Ca 0.00 0.39 0.19 0.00 1.02 0.00 0.00 55.06 56.65 2bwg s HIS 248 Cb 0.00 -2.31 1.34 0.00 -1.02 0.00 0.00 32.58 30.59 2bwg s HIS 248 CO 0.00 -0.34 2.13 1.15 1.02 0.00 0.00 174.74 178.70 2bwg h THR 249 N 0.35 0.91 0.00 1.30 2.02 -0.71 -1.19 112.91 115.58 2bwg h THR 249 Ca -0.47 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.71 2bwg h THR 249 Cb 1.24 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.60 2bwg h THR 249 CO 0.59 0.00 0.00 -0.33 0.37 0.00 0.00 175.52 176.15 2bwg h GLU 250 N 0.00 0.00 -6.94 6.66 3.07 -1.94 -3.46 114.58 111.96 2bwg h GLU 250 Ca 0.04 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.41 2bwg h GLU 250 Cb 0.18 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.13 2bwg h GLU 250 CO -0.00 0.00 0.46 0.00 -1.40 0.00 0.00 179.01 178.07 2bwg s ALA 252 N -1.50 3.69 0.00 0.00 0.00 -0.03 -4.83 121.76 119.09 2bwg s ALA 252 Ca 0.57 1.59 0.00 0.00 0.00 0.00 0.00 51.96 54.12 2bwg s ALA 252 Cb -0.27 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.21 2bwg s ALA 252 CO 0.34 -1.03 0.00 0.41 0.00 0.00 0.00 175.76 175.48 2bwg n GLY 253 N 1.54 3.01 3.98 0.00 0.00 -1.26 -4.78 105.19 107.70 2bwg n GLY 253 Ca 0.06 -1.94 -0.20 0.00 0.00 0.00 0.00 46.02 43.94 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 -3.08 2.85 0.20 1.61 0.41 -1.26 -5.05 118.70 114.38 2bwg s GLU 254 Ca 0.00 -0.91 -0.30 0.00 -0.41 0.00 0.00 54.97 53.35 2bwg s GLU 254 Cb 0.00 -2.65 -0.08 0.00 -1.78 0.00 0.00 34.13 29.62 2bwg s GLU 254 CO 0.00 -0.33 1.00 0.08 -0.49 0.00 0.00 175.26 175.51 2bwg s VAL 255 N -2.47 4.06 -0.03 2.63 1.01 -1.26 -4.61 120.40 119.73 2bwg s VAL 255 Ca 0.52 1.92 -0.03 0.00 0.00 0.00 0.00 61.98 64.39 2bwg s VAL 255 Cb -0.10 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 32.05 2bwg s VAL 255 CO 0.35 0.39 -0.06 -0.38 0.00 0.00 0.00 175.10 175.41 2bwg n ILE 256 N 1.93 0.27 -0.06 2.22 5.41 0.24 -4.91 119.36 124.46 2bwg n ILE 256 Ca 0.00 0.38 0.00 0.00 1.00 0.00 0.00 62.75 64.13 2bwg n ILE 256 Cb 0.47 -1.58 0.00 0.00 -0.71 0.00 0.00 39.64 37.82 2bwg n ILE 256 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 2bwg n ARG 261 N -2.84 0.00 -3.55 0.38 1.85 -1.26 -1.87 116.66 109.37 2bwg n ARG 261 Ca -0.02 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.46 2bwg n ARG 261 Cb 0.08 -0.02 -0.08 0.00 -1.05 0.00 0.00 32.46 31.40 2bwg n ARG 261 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 2bwg s LYS 262 N -0.02 4.21 0.08 2.89 -0.14 -1.26 -5.06 119.74 120.44 2bwg s LYS 262 Ca 0.00 0.02 0.01 0.00 -1.36 0.00 0.00 55.97 54.64 2bwg s LYS 262 Cb 0.00 -3.46 -0.04 0.00 -1.68 0.00 0.00 37.83 32.65 2bwg s LYS 262 CO 0.00 0.17 -0.06 -0.51 -0.76 0.00 0.00 175.35 174.19 2bwg s LEU 263 N 0.69 2.49 0.04 3.17 1.02 -0.78 -0.47 118.68 124.84 2bwg s LEU 263 Ca 0.14 -0.97 0.06 0.00 0.02 0.00 0.00 54.13 53.39 2bwg s LEU 263 Cb -0.13 -0.02 -0.02 0.00 0.02 0.00 0.00 46.19 46.04 2bwg s LEU 263 CO 0.04 -0.48 -0.18 -0.54 0.02 0.00 0.00 176.35 175.21 2bwg s LYS 264 N -3.70 1.24 0.18 1.70 -0.14 0.02 0.80 119.74 119.84 2bwg s LYS 264 Ca 0.09 -0.86 -0.30 0.00 -1.36 0.00 0.00 55.97 53.54 2bwg s LYS 264 Cb 0.05 -1.31 -0.08 0.00 -1.68 0.00 0.00 37.83 34.81 2bwg s LYS 264 CO -0.06 0.33 0.98 -1.17 -0.76 0.00 0.00 175.35 174.68 2bwg s LEU 265 N -1.11 4.56 -0.06 3.17 2.96 -1.26 -0.58 118.68 126.36 2bwg s LEU 265 Ca 0.05 1.92 -0.01 0.00 -0.22 0.00 0.00 54.13 55.88 2bwg s LEU 265 Cb -0.08 -3.60 0.03 0.00 0.50 0.00 0.00 46.19 43.03 2bwg s LEU 265 CO 0.01 0.01 -0.00 0.12 -1.32 0.00 0.00 176.35 175.17 2bwg s PHE 266 N -0.60 0.55 0.03 5.38 2.19 0.64 -4.89 117.98 121.29 2bwg s PHE 266 Ca 0.45 -0.10 0.02 0.00 0.33 0.00 0.00 56.93 57.63 2bwg s PHE 266 Cb -0.26 -0.67 -0.02 0.00 -1.31 0.00 0.00 43.02 40.76 2bwg s PHE 266 CO 0.32 -0.25 -0.07 1.52 1.83 0.00 0.00 175.22 178.57 2bwg s TYR 267 N 1.63 0.60 0.64 10.12 1.13 -1.26 -0.14 117.35 130.08 2bwg s TYR 267 Ca -0.01 -0.38 -0.18 0.00 -1.41 0.00 0.00 57.07 55.09 2bwg s TYR 267 Cb -0.13 -0.37 -0.02 0.00 -1.10 0.00 0.00 41.96 40.34 2bwg s TYR 267 CO -0.03 -0.06 1.16 0.41 -2.51 0.00 0.00 175.55 174.51 2bwg n GLY 268 N 1.89 0.17 0.30 5.49 0.00 0.80 -4.69 105.19 109.14 2bwg n GLY 268 Ca -0.20 -0.17 0.04 0.00 0.00 0.00 0.00 46.02 45.69 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 0.41 0.50 -0.37 1.61 0.00 -1.93 -2.18 114.93 112.97 2bwg h MET 269 Ca -0.50 -0.04 -0.18 0.00 0.00 0.00 0.00 59.70 58.99 2bwg h MET 269 Cb 1.35 -0.11 -0.10 0.00 0.00 0.00 0.00 31.60 32.74 2bwg h MET 269 CO 0.52 0.36 -0.04 0.43 0.00 0.00 0.00 176.91 178.17 2bwg n SER 270 N -4.45 2.67 -4.81 1.22 7.64 -1.26 -4.77 113.62 109.86 2bwg n SER 270 Ca 0.02 -3.69 -0.30 0.00 1.01 0.00 0.00 58.87 55.92 2bwg n SER 270 Cb 0.09 -0.63 0.09 0.00 -1.01 0.00 0.00 64.21 62.74 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 -2.42 4.42 0.28 6.43 1.04 -0.82 -3.32 113.70 119.31 2bwg s SER 271 Ca 0.45 1.25 0.01 0.00 0.48 0.00 0.00 55.95 58.13 2bwg s SER 271 Cb 0.40 -1.96 0.54 0.00 0.10 0.00 0.00 66.02 65.10 2bwg s SER 271 CO 0.01 -2.01 1.84 -0.78 0.98 0.00 0.00 173.24 173.28 2bwg h ASP 272 N -1.11 0.92 -0.28 7.02 1.82 -1.89 -0.56 116.42 122.34 2bwg h ASP 272 Ca -0.47 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.22 2bwg h ASP 272 Cb 1.28 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 41.13 2bwg h ASP 272 CO 0.60 0.49 0.18 0.74 -1.61 0.00 0.00 179.24 179.64 2bwg h THR 273 N 0.99 1.06 -0.49 2.25 2.02 -1.91 -0.57 112.91 116.26 2bwg h THR 273 Ca 0.49 -0.13 -0.12 0.00 0.77 0.00 0.00 66.41 67.42 2bwg h THR 273 Cb 0.47 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2bwg h THR 273 CO -0.26 0.07 -0.18 0.00 0.37 0.00 0.00 175.52 175.52 2bwg h ALA 274 N 1.10 0.69 -0.57 6.16 0.00 -1.70 -0.84 119.26 124.11 2bwg h ALA 274 Ca 0.10 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.67 2bwg h ALA 274 Cb -0.04 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 2bwg h ALA 274 CO -0.03 0.65 0.32 1.98 0.00 0.00 0.00 179.25 182.18 2bwg h MET 275 N 0.85 0.61 -0.11 0.00 -1.53 -0.95 0.20 114.93 114.00 2bwg h MET 275 Ca 0.12 -0.04 -0.17 0.00 -3.44 0.00 0.00 59.70 56.17 2bwg h MET 275 Cb 0.75 -0.14 -0.01 0.00 -0.55 0.00 0.00 31.60 31.66 2bwg h MET 275 CO 0.06 0.41 -0.64 -0.91 0.14 0.00 0.00 176.91 175.96 2bwg h ASN 276 N 0.63 0.49 0.17 1.39 2.35 -1.02 -3.23 115.58 116.36 2bwg h ASN 276 Ca 0.24 -0.29 -0.17 0.00 -0.55 0.00 0.00 56.30 55.53 2bwg h ASN 276 Cb 0.08 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 2bwg h ASN 276 CO -0.13 1.00 -0.65 0.50 -1.65 0.00 0.00 177.43 176.51 2bwg h LYS 277 N 0.31 0.46 0.00 0.81 3.64 -0.89 -3.51 116.57 117.39 2bwg h LYS 277 Ca -0.01 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 2bwg h LYS 277 Cb 1.19 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2bwg h LYS 277 CO 0.11 0.95 0.00 0.72 -2.27 0.00 0.00 179.45 178.96 2bwg n HIS 278 N -3.89 0.00 0.00 1.91 8.25 0.68 -5.08 115.22 117.10 2bwg n HIS 278 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2bwg n HIS 278 Cb 0.66 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.77 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 -0.16 1.59 0.24 -1.26 -4.98 118.33 113.77 2bwg n VAL 282 Ca 0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.16 2bwg n VAL 282 Cb 0.00 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.27 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 -0.77 -1.33 2.33 0.00 -1.91 -1.79 119.26 115.78 2bwg h ALA 283 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 2bwg h ALA 283 Cb 0.00 1.15 -0.42 0.00 0.00 0.00 0.00 17.79 18.52 2bwg h ALA 283 CO 0.00 -1.05 -0.80 0.39 0.00 0.00 0.00 179.25 177.78 2bwg n GLU 284 N -5.37 3.16 0.00 0.00 1.02 -1.26 -4.73 120.64 113.47 2bwg n GLU 284 Ca -0.03 -4.30 -0.17 0.00 -0.02 0.00 0.00 57.16 52.63 2bwg n GLU 284 Cb 0.34 -2.13 -0.10 0.00 -0.02 0.00 0.00 31.44 29.52 2bwg n GLU 284 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2bwg h TYR 285 N 2.57 0.67 -2.25 -0.32 3.20 -1.64 -0.22 116.97 118.98 2bwg h TYR 285 Ca 0.26 -0.35 -0.58 0.00 3.14 0.00 0.00 58.73 61.20 2bwg h TYR 285 Cb 1.04 -0.08 -0.14 0.00 1.54 0.00 0.00 36.73 39.09 2bwg h TYR 285 CO 0.78 1.16 -0.72 1.03 -1.64 0.00 0.00 178.16 178.77 2bwg s ARG 286 N -3.32 1.67 0.49 1.82 1.81 -1.26 -2.32 118.95 117.85 2bwg s ARG 286 Ca -0.13 -1.80 0.33 0.00 -1.72 0.00 0.00 55.73 52.41 2bwg s ARG 286 Cb 0.04 -1.60 1.72 0.00 -0.45 0.00 0.00 34.95 34.66 2bwg s ARG 286 CO 0.83 0.22 2.01 0.00 -0.68 0.00 0.00 175.30 177.69 2bwg h ALA 287 N 2.23 1.00 -2.59 2.13 0.00 -1.73 -3.39 119.26 116.91 2bwg h ALA 287 Ca -0.40 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 2bwg h ALA 287 Cb 1.25 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.86 2bwg h ALA 287 CO 0.64 0.00 -0.40 -1.54 0.00 0.00 0.00 179.25 177.95 2bwg s SER 288 N -4.75 0.03 -0.43 0.00 1.04 -1.26 -4.87 113.70 103.46 2bwg s SER 288 Ca -0.02 -0.35 -0.29 0.00 0.48 0.00 0.00 55.95 55.77 2bwg s SER 288 Cb 0.10 0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.53 2bwg s SER 288 CO 0.35 -0.54 1.10 -1.83 0.98 0.00 0.00 173.24 173.30 2bwg s GLU 289 N -2.45 3.79 0.80 4.02 -1.05 -1.26 -4.55 118.70 118.00 2bwg s GLU 289 Ca -0.06 0.65 -0.12 0.00 -0.15 0.00 0.00 54.97 55.30 2bwg s GLU 289 Cb -0.02 -3.86 0.07 0.00 -0.44 0.00 0.00 34.13 29.88 2bwg s GLU 289 CO -0.03 -1.24 1.14 0.20 0.95 0.00 0.00 175.26 176.28 2bwg s GLY 290 N 2.23 1.60 0.67 -3.83 0.00 -1.21 -4.63 107.32 102.16 2bwg s GLY 290 Ca 0.46 -0.49 -0.14 0.00 0.00 0.00 0.00 44.72 44.56 2bwg s GLY 290 CO 0.27 -0.02 1.08 0.54 0.00 0.00 0.00 173.10 174.97 2bwg s LYS 291 N -5.41 2.84 -0.18 2.90 1.02 0.16 -4.25 119.74 116.83 2bwg s LYS 291 Ca 0.61 1.22 -0.02 0.00 0.02 0.00 0.00 55.97 57.80 2bwg s LYS 291 Cb -0.12 -1.97 -0.01 0.00 -0.52 0.00 0.00 37.83 35.21 2bwg s LYS 291 CO 0.51 -1.19 -0.09 0.99 -0.92 0.00 0.00 175.35 174.65 2bwg s THR 292 N -2.61 3.23 0.12 2.17 2.01 -1.26 -0.14 115.64 119.15 2bwg s THR 292 Ca 0.63 -0.57 0.08 0.00 0.31 0.00 0.00 61.69 62.14 2bwg s THR 292 Cb -0.17 -2.41 -0.04 0.00 0.01 0.00 0.00 72.50 69.88 2bwg s THR 292 CO 0.46 0.48 -0.18 0.68 -0.69 0.00 0.00 174.62 175.36 2bwg s VAL 293 N 0.92 1.63 -0.29 3.82 -7.23 0.80 -5.00 120.40 115.06 2bwg s VAL 293 Ca -0.02 -1.68 -0.16 0.00 -1.81 0.00 0.00 61.98 58.31 2bwg s VAL 293 Cb -0.15 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.16 2bwg s VAL 293 CO 0.00 -0.22 0.44 -1.61 -0.31 0.00 0.00 175.10 173.40 2bwg s GLU 294 N -2.32 3.91 0.02 4.82 8.01 -1.26 -0.26 118.70 131.63 2bwg s GLU 294 Ca 0.09 0.04 0.01 0.00 0.01 0.00 0.00 54.97 55.12 2bwg s GLU 294 Cb -0.08 -3.70 -0.04 0.00 -4.31 0.00 0.00 34.13 26.01 2bwg s GLU 294 CO 0.05 -0.39 0.09 0.54 0.01 0.00 0.00 175.26 175.55 2bwg s VAL 295 N 2.20 4.71 0.32 2.63 0.11 0.25 -4.93 120.40 125.70 2bwg s VAL 295 Ca 0.17 -0.51 -0.29 0.00 -2.93 0.00 0.00 61.98 58.42 2bwg s VAL 295 Cb -0.16 -3.19 -0.11 0.00 -1.53 0.00 0.00 36.38 31.39 2bwg s VAL 295 CO 0.11 0.28 1.50 -2.16 -3.33 0.00 0.00 175.10 171.50 2bwg s PRO 296 N -1.96 4.16 -0.18 1.54 0.04 -1.26 -0.80 135.00 136.54 2bwg s PRO 296 Ca 0.25 2.51 -0.29 0.00 0.04 0.00 0.00 61.00 63.51 2bwg s PRO 296 Cb -0.12 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.36 2bwg s PRO 296 CO 0.17 -0.52 1.85 -0.47 0.04 0.00 0.00 177.00 178.06 2bwg s TYR 297 N -0.54 1.69 -0.67 0.56 5.04 0.38 -4.71 117.35 119.10 2bwg s TYR 297 Ca 0.57 0.35 0.24 0.00 -2.44 0.00 0.00 57.07 55.79 2bwg s TYR 297 Cb -0.46 -4.03 0.28 0.00 0.35 0.00 0.00 41.96 38.10 2bwg s TYR 297 CO 0.54 -3.75 1.25 1.63 -1.34 0.00 0.00 175.55 173.88 2bwg n LYS 298 N 7.96 0.26 0.00 4.97 5.02 -0.13 -4.96 118.16 131.29 2bwg n LYS 298 Ca 0.22 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 2bwg n LYS 298 Cb 0.44 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 2bwg n LYS 298 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bwg n GLY 299 N 1.36 0.21 3.75 0.72 0.00 -1.25 -4.94 105.19 105.04 2bwg n GLY 299 Ca 0.03 -1.59 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 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 7.45 0.51 1.61 1.01 -1.26 0.07 116.67 122.05 2bwg s ASP 300 Ca 0.00 2.08 0.32 0.00 0.71 0.00 0.00 52.55 55.65 2bwg s ASP 300 Cb 0.00 -2.61 1.22 0.00 1.01 0.00 0.00 42.92 42.53 2bwg s ASP 300 CO 0.00 -0.02 1.92 1.62 0.21 0.00 0.00 175.17 178.90 2bwg h VAL 301 N 3.27 0.00 -0.53 -1.27 3.04 -1.94 -3.11 116.25 115.71 2bwg h VAL 301 Ca -0.45 -0.53 0.10 0.00 -1.01 0.00 0.00 66.70 64.81 2bwg h VAL 301 Cb 1.21 1.51 -0.11 0.00 -2.01 0.00 0.00 31.29 31.89 2bwg h VAL 301 CO 0.68 0.00 -0.24 -0.08 -1.01 0.00 0.00 177.57 176.93 2bwg h GLU 302 N 0.00 -0.11 -0.52 4.17 4.57 -1.98 -0.35 114.58 120.36 2bwg h GLU 302 Ca 0.00 0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.23 2bwg h GLU 302 Cb 0.55 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.12 2bwg h GLU 302 CO 0.00 -0.07 0.28 -0.91 -1.18 0.00 0.00 179.01 177.13 2bwg h ASN 303 N -0.11 0.42 -0.25 1.04 2.35 -1.96 -0.55 115.58 116.51 2bwg h ASN 303 Ca 0.24 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 56.01 2bwg h ASN 303 Cb 0.49 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 2bwg h ASN 303 CO -0.60 0.29 0.15 0.74 -1.65 0.00 0.00 177.43 176.35 2bwg h THR 304 N 0.55 1.10 -0.55 2.81 2.02 -1.54 -1.79 112.91 115.51 2bwg h THR 304 Ca 0.23 -0.25 0.09 0.00 0.77 0.00 0.00 66.41 67.25 2bwg h THR 304 Cb 0.11 0.81 -0.07 0.00 -1.74 0.00 0.00 68.15 67.25 2bwg h THR 304 CO -0.14 0.10 0.15 0.40 0.37 0.00 0.00 175.52 176.40 2bwg h ILE 305 N 0.31 0.73 -0.55 3.11 2.04 -0.43 -0.89 117.51 121.83 2bwg h ILE 305 Ca 0.09 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 2bwg h ILE 305 Cb 0.03 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.49 2bwg h ILE 305 CO -0.02 0.06 0.19 -0.07 0.00 0.00 0.00 178.15 178.30 2bwg h LEU 306 N 0.30 0.75 -0.53 1.44 3.38 -0.78 -0.34 115.31 119.54 2bwg h LEU 306 Ca 0.28 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 58.00 2bwg h LEU 306 Cb 0.36 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2bwg h LEU 306 CO -0.32 0.71 -0.25 0.44 0.09 0.00 0.00 178.44 179.10 2bwg h ASP 307 N 0.80 0.96 0.25 -0.43 3.32 -0.73 0.47 116.42 121.07 2bwg h ASP 307 Ca 0.19 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.85 2bwg h ASP 307 Cb 0.22 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2bwg h ASP 307 CO -0.01 1.15 -0.12 0.40 -1.72 0.00 0.00 179.24 178.94 2bwg h ILE 308 N 0.80 0.79 -0.38 0.35 2.04 -0.62 -1.45 117.51 119.04 2bwg h ILE 308 Ca 0.10 -0.66 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 2bwg h ILE 308 Cb 0.82 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 2bwg h ILE 308 CO 0.07 0.13 0.21 -0.07 0.00 0.00 0.00 178.15 178.50 2bwg h LEU 309 N -0.70 0.47 -0.51 1.44 3.38 -1.15 -2.00 115.31 116.24 2bwg h LEU 309 Ca -0.03 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 57.90 2bwg h LEU 309 Cb 0.48 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 2bwg h LEU 309 CO 0.06 0.41 0.26 1.23 0.09 0.00 0.00 178.44 180.49 2bwg h GLY 310 N 0.49 0.72 1.96 0.83 0.00 -0.93 0.00 103.07 106.13 2bwg h GLY 310 Ca 0.13 -0.18 -0.08 0.00 0.00 0.00 0.00 47.33 47.20 2bwg h GLY 310 CO -0.02 0.12 -0.36 -1.33 0.00 0.00 0.00 176.54 174.94 2bwg h GLY 311 N 0.51 0.04 1.84 4.60 0.00 -1.12 -1.85 103.07 107.10 2bwg h GLY 311 Ca 0.22 -0.04 -0.24 0.00 0.00 0.00 0.00 47.33 47.28 2bwg h GLY 311 CO -0.15 0.03 -1.10 -2.00 0.00 0.00 0.00 176.54 173.32 2bwg h LEU 312 N 0.04 0.16 -0.43 3.11 5.85 -0.89 -1.54 115.31 121.61 2bwg h LEU 312 Ca 0.00 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 2bwg h LEU 312 Cb 0.66 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 2bwg h LEU 312 CO 0.05 1.14 0.11 0.03 -0.34 0.00 0.00 178.44 179.43 2bwg h ARG 313 N 0.03 0.69 -0.26 1.25 3.08 -0.85 -1.98 114.38 116.33 2bwg h ARG 313 Ca -0.06 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 2bwg h ARG 313 Cb 1.85 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.80 2bwg h ARG 313 CO 0.16 0.69 0.15 0.77 -1.07 0.00 0.00 179.97 180.66 2bwg h SER 314 N 0.56 0.32 -0.45 7.04 0.02 -1.27 -0.25 113.55 119.53 2bwg h SER 314 Ca 0.14 -0.08 0.09 0.00 -0.84 0.00 0.00 61.79 61.10 2bwg h SER 314 Cb 0.31 -0.08 -0.08 0.00 0.14 0.00 0.00 62.40 62.68 2bwg h SER 314 CO 0.00 0.31 -0.08 0.74 -1.14 0.00 0.00 176.83 176.66 2bwg h THR 315 N 0.31 0.58 -0.59 -2.27 2.02 -1.24 -0.64 112.91 111.09 2bwg h THR 315 Ca 0.09 -0.01 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 2bwg h THR 315 Cb 0.05 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 2bwg h THR 315 CO -0.02 0.01 0.29 0.00 0.37 0.00 0.00 175.52 176.17 2bwg h THR 317 N 0.80 0.69 0.00 0.00 2.02 -0.60 0.63 112.91 116.45 2bwg h THR 317 Ca 0.20 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.28 2bwg h THR 317 Cb 0.11 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2bwg h THR 317 CO -0.03 0.04 -0.16 1.88 0.37 0.00 0.00 175.52 177.62 2bwg h TYR 318 N 0.19 0.00 -0.00 3.16 0.05 -0.48 -2.73 116.97 117.15 2bwg h TYR 318 Ca 0.25 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.03 2bwg h TYR 318 Cb 0.35 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.09 2bwg h TYR 318 CO -0.25 0.16 -0.90 1.33 -1.05 0.00 0.00 178.16 177.45 2bwg n VAL 319 N -3.21 0.00 -0.47 -2.88 0.24 -0.76 -0.33 118.33 110.92 2bwg n VAL 319 Ca 0.02 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 2bwg n VAL 319 Cb 0.48 0.98 0.00 0.00 -1.47 0.00 0.00 33.84 33.84 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 1.49 1.14 3.49 7.63 0.00 -0.26 -4.45 105.19 114.23 2bwg n GLY 320 Ca 0.05 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 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 3.46 -0.42 4.61 0.00 0.20 -4.93 121.76 122.68 2bwg s ALA 321 Ca 0.00 -1.51 0.23 0.00 0.00 0.00 0.00 51.96 50.68 2bwg s ALA 321 Cb 0.00 -2.70 0.38 0.00 0.00 0.00 0.00 23.12 20.80 2bwg s ALA 321 CO 0.00 -1.15 1.62 0.00 0.00 0.00 0.00 175.76 176.23 2bwg h ALA 322 N 8.52 1.00 -3.69 0.00 0.00 -1.95 -3.34 119.26 119.79 2bwg h ALA 322 Ca -0.30 -0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.18 2bwg h ALA 322 Cb 1.14 -0.00 -0.24 0.00 0.00 0.00 0.00 17.79 18.69 2bwg h ALA 322 CO 0.66 0.00 -0.79 0.15 0.00 0.00 0.00 179.25 179.28 2bwg s LYS 323 N -3.23 0.90 0.42 0.00 1.02 -1.26 -1.47 119.74 116.13 2bwg s LYS 323 Ca 0.07 -0.78 0.17 0.00 0.02 0.00 0.00 55.97 55.45 2bwg s LYS 323 Cb 0.05 -0.90 1.07 0.00 -0.52 0.00 0.00 37.83 37.53 2bwg s LYS 323 CO 0.67 0.22 1.88 1.25 -0.92 0.00 0.00 175.35 178.45 2bwg h LEU 324 N 4.85 0.40 -0.89 3.17 5.85 -1.37 -0.20 115.31 127.12 2bwg h LEU 324 Ca -0.38 0.03 0.24 0.00 0.84 0.00 0.00 57.88 58.61 2bwg h LEU 324 Cb 1.18 -0.04 -0.14 0.00 0.37 0.00 0.00 40.66 42.03 2bwg h LEU 324 CO 0.43 0.18 0.32 0.50 -0.34 0.00 0.00 178.44 179.53 2bwg h LYS 325 N 0.41 0.27 0.00 1.25 3.11 -1.85 -2.21 116.57 117.55 2bwg h LYS 325 Ca 0.43 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 58.25 2bwg h LYS 325 Cb 1.03 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 32.20 2bwg h LYS 325 CO -0.15 0.18 0.00 0.39 -2.81 0.00 0.00 179.45 177.06 2bwg n GLU 326 N -5.16 0.23 0.32 1.90 1.02 -0.09 -4.27 120.64 114.61 2bwg n GLU 326 Ca 0.23 0.02 -0.17 0.00 -0.02 0.00 0.00 57.16 57.21 2bwg n GLU 326 Cb 0.71 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.54 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 -0.67 -0.79 -4.62 5.85 -1.47 -1.56 115.31 112.04 2bwg h LEU 327 Ca 0.00 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2bwg h LEU 327 Cb 0.36 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 2bwg h LEU 327 CO 0.00 -0.48 0.49 0.77 -0.34 0.00 0.00 178.44 178.89 2bwg h SER 328 N -0.78 0.94 -0.74 1.25 4.64 -1.74 0.60 113.55 117.71 2bwg h SER 328 Ca -0.08 -0.05 0.11 0.00 -0.47 0.00 0.00 61.79 61.30 2bwg h SER 328 Cb 0.60 -0.24 -0.05 0.00 -0.31 0.00 0.00 62.40 62.41 2bwg h SER 328 CO 0.13 0.71 0.49 0.03 -0.87 0.00 0.00 176.83 177.32 2bwg h ARG 329 N 1.08 0.55 -0.08 4.77 3.08 -1.77 -2.49 114.38 119.52 2bwg h ARG 329 Ca 0.29 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.30 2bwg h ARG 329 Cb -0.06 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.86 2bwg h ARG 329 CO -0.06 0.37 0.00 0.54 -1.07 0.00 0.00 179.97 179.75 2bwg n ARG 330 N -4.49 1.64 -2.56 0.04 1.74 -0.16 -4.94 116.66 107.93 2bwg n ARG 330 Ca 0.13 -1.66 -0.43 0.00 -0.77 0.00 0.00 57.85 55.12 2bwg n ARG 330 Cb 0.39 -1.35 -0.02 0.00 -1.02 0.00 0.00 32.46 30.46 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 -1.45 3.55 -0.14 7.54 0.00 0.19 -4.93 121.76 126.53 2bwg s ALA 331 Ca 0.23 0.13 0.02 0.00 0.00 0.00 0.00 51.96 52.34 2bwg s ALA 331 Cb 0.15 -3.65 0.01 0.00 0.00 0.00 0.00 23.12 19.63 2bwg s ALA 331 CO 0.23 -1.37 -0.21 0.99 0.00 0.00 0.00 175.76 175.39 2bwg s THR 332 N 3.65 2.14 0.07 0.00 2.01 -1.26 -4.97 115.64 117.27 2bwg s THR 332 Ca 0.49 -0.96 -0.07 0.00 0.31 0.00 0.00 61.69 61.46 2bwg s THR 332 Cb -0.16 -1.85 -0.05 0.00 0.01 0.00 0.00 72.50 70.45 2bwg s THR 332 CO 0.14 0.55 0.35 -0.36 -0.69 0.00 0.00 174.62 174.61 2bwg s PHE 333 N 0.74 3.55 0.02 4.92 0.08 -1.26 -1.29 117.98 124.75 2bwg s PHE 333 Ca -0.09 0.64 0.06 0.00 0.12 0.00 0.00 56.93 57.67 2bwg s PHE 333 Cb -0.16 -2.05 -0.03 0.00 -0.57 0.00 0.00 43.02 40.21 2bwg s PHE 333 CO -0.00 0.53 -0.17 0.96 -0.10 0.00 0.00 175.22 176.43 2bwg s ILE 334 N -1.44 2.84 0.11 0.64 -4.36 0.41 -4.93 121.20 114.47 2bwg s ILE 334 Ca 0.34 -1.09 -0.28 0.00 -0.26 0.00 0.00 60.65 59.36 2bwg s ILE 334 Cb -0.13 -2.18 -0.06 0.00 1.25 0.00 0.00 42.46 41.34 2bwg s ILE 334 CO 0.20 0.39 0.87 -0.13 0.24 0.00 0.00 174.94 176.51 2bwg s ARG 335 N -1.29 4.63 0.41 0.37 0.52 -1.26 -1.26 118.95 121.07 2bwg s ARG 335 Ca 0.14 1.29 0.04 0.00 -0.52 0.00 0.00 55.73 56.67 2bwg s ARG 335 Cb -0.11 -3.35 -0.04 0.00 0.52 0.00 0.00 34.95 31.97 2bwg s ARG 335 CO 0.04 0.31 0.06 0.14 0.02 0.00 0.00 175.30 175.87 2bwg s VAL 336 N -0.26 1.14 -1.30 3.52 -7.23 -0.20 -4.93 120.40 111.14 2bwg s VAL 336 Ca 0.42 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.69 2bwg s VAL 336 Cb -0.23 -2.54 0.08 0.00 0.56 0.00 0.00 36.38 34.26 2bwg s VAL 336 CO 0.27 0.00 0.83 0.35 -0.31 0.00 0.00 175.10 176.24