#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 4.05 -0.22 -0.52 0.52 -1.26 -5.08 118.95 116.44 2bwg s ARG 3 Ca 0.00 0.58 -0.08 0.00 -0.52 0.00 0.00 55.73 55.72 2bwg s ARG 3 Cb 0.00 -2.93 -0.04 0.00 0.52 0.00 0.00 34.95 32.50 2bwg s ARG 3 CO 0.00 0.47 0.07 0.42 0.02 0.00 0.00 175.30 176.28 2bwg s ILE 4 N -1.47 4.63 0.03 1.52 1.01 -1.26 -5.08 121.20 120.59 2bwg s ILE 4 Ca 0.39 -0.08 -0.30 0.00 0.00 0.00 0.00 60.65 60.66 2bwg s ILE 4 Cb -0.15 -3.13 -0.07 0.00 0.01 0.00 0.00 42.46 39.12 2bwg s ILE 4 CO 0.19 0.40 1.59 -0.62 0.00 0.00 0.00 174.94 176.50 2bwg s ASP 5 N 0.96 6.68 0.19 3.58 -1.08 -1.26 -4.92 116.67 120.83 2bwg s ASP 5 Ca 0.04 2.34 -0.10 0.00 -0.52 0.00 0.00 52.55 54.31 2bwg s ASP 5 Cb -0.14 -2.56 0.12 0.00 -1.46 0.00 0.00 42.92 38.88 2bwg s ASP 5 CO 0.03 -0.85 1.76 0.00 0.52 0.00 0.00 175.17 176.63 2bwg h ALA 6 N 8.44 0.91 -2.44 3.66 0.00 -2.07 -3.42 119.26 124.33 2bwg h ALA 6 Ca -0.41 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 53.81 2bwg h ALA 6 Cb 1.19 -0.27 0.03 0.00 0.00 0.00 0.00 17.79 18.73 2bwg h ALA 6 CO 0.93 0.50 1.14 0.34 0.00 0.00 0.00 179.25 182.16 2bwg s ASP 7 N -6.18 6.47 0.13 0.00 2.15 -1.26 -4.98 116.67 112.99 2bwg s ASP 7 Ca -0.13 2.67 -0.30 0.00 0.43 0.00 0.00 52.55 55.22 2bwg s ASP 7 Cb 0.14 -2.55 -0.07 0.00 -0.30 0.00 0.00 42.92 40.14 2bwg s ASP 7 CO 0.81 -1.00 1.15 -0.22 -0.17 0.00 0.00 175.17 175.74 2bwg s LEU 8 N 3.37 4.43 -0.21 -1.34 2.96 -1.26 -5.03 118.68 121.60 2bwg s LEU 8 Ca 0.82 2.08 -0.09 0.00 -0.22 0.00 0.00 54.13 56.72 2bwg s LEU 8 Cb -0.43 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 42.62 2bwg s LEU 8 CO 0.37 -0.35 0.11 -0.54 -1.32 0.00 0.00 176.35 174.63 2bwg s LYS 9 N 0.24 4.05 0.02 1.98 -0.14 -1.26 -5.09 119.74 119.54 2bwg s LYS 9 Ca 0.54 -0.29 -0.02 0.00 -1.36 0.00 0.00 55.97 54.83 2bwg s LYS 9 Cb -0.30 -3.38 -0.04 0.00 -1.68 0.00 0.00 37.83 32.43 2bwg s LYS 9 CO 0.33 0.19 0.20 -0.51 -0.76 0.00 0.00 175.35 174.80 2bwg s LEU 10 N 0.65 4.36 0.00 3.17 1.43 -1.26 -4.83 118.68 122.21 2bwg s LEU 10 Ca 0.06 0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.51 2bwg s LEU 10 Cb -0.12 -2.77 0.01 0.00 0.03 0.00 0.00 46.19 43.33 2bwg s LEU 10 CO 0.01 0.22 0.07 -0.67 0.23 0.00 0.00 176.35 176.21 2bwg n ASP 11 N 0.67 0.65 0.03 2.29 -0.08 -1.26 -1.89 116.55 116.96 2bwg n ASP 11 Ca -0.08 -1.19 -0.03 0.00 -1.51 0.00 0.00 54.79 51.98 2bwg n ASP 11 Cb 0.52 -0.03 0.22 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 0.22 0.49 0.00 -0.67 0.04 -1.94 -2.48 116.94 112.60 2bwg h PHE 12 Ca -0.03 -0.10 -0.01 0.00 2.80 0.00 0.00 57.97 60.62 2bwg h PHE 12 Cb 0.14 -0.12 -0.00 0.00 2.20 0.00 0.00 35.95 38.17 2bwg h PHE 12 CO 0.00 0.65 -0.06 1.57 -0.60 0.00 0.00 178.31 179.86 2bwg h LYS 13 N 0.39 0.00 0.00 1.51 2.10 -1.99 -2.67 116.57 115.92 2bwg h LYS 13 Ca 0.06 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.71 2bwg h LYS 13 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 2bwg h LYS 13 CO 0.05 0.06 -0.05 -0.25 -2.00 0.00 0.00 179.45 177.26 2bwg n ASP 14 N -3.31 0.63 -4.38 7.07 8.00 -0.93 -4.77 116.55 118.85 2bwg n ASP 14 Ca -0.01 0.51 -0.19 0.00 0.71 0.00 0.00 54.79 55.81 2bwg n ASP 14 Cb 0.24 -0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 40.59 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 -3.08 1.39 0.08 2.53 -7.23 -1.01 -0.70 120.40 112.38 2bwg s VAL 15 Ca 0.11 -2.09 0.04 0.00 -1.81 0.00 0.00 61.98 58.23 2bwg s VAL 15 Cb 0.14 -2.37 -0.03 0.00 0.56 0.00 0.00 36.38 34.68 2bwg s VAL 15 CO 0.59 -0.34 -0.11 -0.76 -0.31 0.00 0.00 175.10 174.18 2bwg s LEU 16 N -3.37 2.35 0.07 1.32 1.43 -0.58 -4.88 118.68 115.02 2bwg s LEU 16 Ca 0.28 -0.73 -0.25 0.00 -1.03 0.00 0.00 54.13 52.40 2bwg s LEU 16 Cb 0.04 -0.33 -0.06 0.00 0.03 0.00 0.00 46.19 45.88 2bwg s LEU 16 CO 0.10 -0.21 0.79 -0.76 0.23 0.00 0.00 176.35 176.49 2bwg s LEU 17 N -2.15 4.48 0.09 1.79 1.43 -1.26 -0.42 118.68 122.63 2bwg s LEU 17 Ca 0.01 1.52 -0.29 0.00 -1.03 0.00 0.00 54.13 54.34 2bwg s LEU 17 Cb -0.06 -3.28 -0.05 0.00 0.03 0.00 0.00 46.19 42.83 2bwg s LEU 17 CO 0.01 0.04 0.92 -0.60 0.23 0.00 0.00 176.35 176.95 2bwg s ARG 18 N -0.25 4.64 0.57 1.70 3.52 -0.37 -4.94 118.95 123.83 2bwg s ARG 18 Ca 0.39 1.36 -0.17 0.00 -0.13 0.00 0.00 55.73 57.18 2bwg s ARG 18 Cb -0.21 -3.38 -0.05 0.00 -1.56 0.00 0.00 34.95 29.75 2bwg s ARG 18 CO 0.24 0.20 1.06 -1.25 -0.81 0.00 0.00 175.30 174.74 2bwg s PRO 19 N 0.08 3.40 0.05 5.12 0.04 -1.26 -4.66 135.00 137.77 2bwg s PRO 19 Ca 0.45 1.25 -0.00 0.00 0.04 0.00 0.00 61.00 62.74 2bwg s PRO 19 Cb -0.22 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 2bwg s PRO 19 CO 0.28 -0.75 -0.04 0.15 0.04 0.00 0.00 177.00 176.68 2bwg s LYS 20 N -3.90 0.58 0.27 4.56 1.02 0.41 -4.95 119.74 117.73 2bwg s LYS 20 Ca 0.65 -1.11 -0.30 0.00 0.02 0.00 0.00 55.97 55.23 2bwg s LYS 20 Cb -0.16 0.12 -0.10 0.00 -0.52 0.00 0.00 37.83 37.16 2bwg s LYS 20 CO 0.34 -0.08 1.48 1.03 -0.92 0.00 0.00 175.35 177.19 2bwg s ARG 21 N -3.38 4.23 0.35 1.68 0.52 -1.26 -4.31 118.95 116.78 2bwg s ARG 21 Ca 0.03 2.38 -0.12 0.00 -0.52 0.00 0.00 55.73 57.50 2bwg s ARG 21 Cb 0.04 -3.08 0.05 0.00 0.52 0.00 0.00 34.95 32.48 2bwg s ARG 21 CO -0.07 -0.47 0.68 -1.13 0.02 0.00 0.00 175.30 174.33 2bwg n SER 22 N 2.15 -1.97 -1.09 0.23 3.41 -1.26 -4.73 113.62 110.36 2bwg n SER 22 Ca 0.07 -2.46 0.11 0.00 -0.26 0.00 0.00 58.87 56.32 2bwg n SER 22 Cb 0.40 3.31 0.22 0.00 -0.26 0.00 0.00 64.21 67.88 2bwg n SER 22 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2bwg n SER 23 N -1.50 3.41 -4.57 4.04 7.64 -1.26 -4.93 113.62 116.45 2bwg n SER 23 Ca -0.07 -1.96 -0.41 0.00 1.01 0.00 0.00 58.87 57.44 2bwg n SER 23 Cb 0.53 -0.28 -0.07 0.00 -1.01 0.00 0.00 64.21 63.38 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 -1.28 4.27 -0.12 -3.43 1.43 -1.26 -4.93 118.68 113.35 2bwg s LEU 24 Ca 0.37 0.11 -0.08 0.00 -1.03 0.00 0.00 54.13 53.50 2bwg s LEU 24 Cb 0.21 -2.67 -0.06 0.00 0.03 0.00 0.00 46.19 43.70 2bwg s LEU 24 CO 0.29 -0.50 0.09 0.07 0.23 0.00 0.00 176.35 176.53 2bwg h LYS 25 N 8.40 0.00 -6.34 1.70 5.09 -1.93 -3.47 116.57 120.02 2bwg h LYS 25 Ca -0.27 0.00 -0.66 0.00 0.09 0.00 0.00 60.65 59.81 2bwg h LYS 25 Cb 1.12 0.00 -0.14 0.00 0.10 0.00 0.00 32.23 33.31 2bwg h LYS 25 CO 0.79 0.23 -0.68 0.45 -2.09 0.00 0.00 179.45 178.15 2bwg s SER 26 N -5.80 4.86 0.49 7.07 0.15 -1.26 -5.02 113.70 114.19 2bwg s SER 26 Ca -0.09 -0.18 0.28 0.00 0.70 0.00 0.00 55.95 56.67 2bwg s SER 26 Cb 0.01 -1.14 1.14 0.00 -1.71 0.00 0.00 66.02 64.32 2bwg s SER 26 CO 0.21 0.21 1.91 0.08 1.20 0.00 0.00 173.24 176.85 2bwg h ARG 27 N 3.83 0.00 0.00 5.44 0.11 -1.94 -2.81 114.38 119.01 2bwg h ARG 27 Ca -0.48 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.55 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 0.57 0.12 -0.25 0.00 0.10 0.00 0.00 179.97 180.51 2bwg h ALA 28 N 1.88 1.28 -0.00 0.08 0.00 -1.95 -2.21 119.26 118.34 2bwg h ALA 28 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2bwg h ALA 28 Cb 0.62 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2bwg h ALA 28 CO 0.02 0.31 0.00 0.93 0.00 0.00 0.00 179.25 180.51 2bwg h GLU 29 N 0.00 0.00 -6.50 0.00 5.08 -1.91 -3.44 114.58 107.81 2bwg h GLU 29 Ca -0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 2bwg h GLU 29 Cb 0.55 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2bwg h GLU 29 CO 0.03 0.00 0.39 0.08 -1.00 0.00 0.00 179.01 178.51 2bwg s VAL 30 N -4.45 4.60 -0.39 3.13 1.01 -0.83 -4.96 120.40 118.50 2bwg s VAL 30 Ca -0.05 2.00 -0.17 0.00 0.00 0.00 0.00 61.98 63.75 2bwg s VAL 30 Cb 0.14 -4.28 0.01 0.00 0.00 0.00 0.00 36.38 32.25 2bwg s VAL 30 CO 0.50 0.23 0.46 -0.62 0.00 0.00 0.00 175.10 175.66 2bwg s ASP 31 N 0.53 6.23 0.28 3.32 2.15 -0.54 -4.95 116.67 123.68 2bwg s ASP 31 Ca 0.50 -0.42 0.22 0.00 0.43 0.00 0.00 52.55 53.28 2bwg s ASP 31 Cb -0.23 -2.24 0.12 0.00 -0.30 0.00 0.00 42.92 40.27 2bwg s ASP 31 CO 0.29 -0.53 1.26 -0.07 -0.17 0.00 0.00 175.17 175.95 2bwg h LEU 32 N 9.07 0.00 -9.86 -1.34 3.38 -1.96 -1.06 115.31 113.55 2bwg h LEU 32 Ca -0.27 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.15 2bwg h LEU 32 Cb 1.12 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.97 2bwg h LEU 32 CO 0.78 0.07 0.73 -0.62 0.09 0.00 0.00 178.44 179.49 2bwg n GLU 33 N -2.88 2.53 -4.50 1.13 1.02 -1.26 -4.45 120.64 112.23 2bwg n GLU 33 Ca 0.01 0.89 -0.21 0.00 -0.02 0.00 0.00 57.16 57.83 2bwg n GLU 33 Cb 0.58 -2.59 -0.14 0.00 -0.02 0.00 0.00 31.44 29.26 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 -1.71 1.01 -0.21 3.49 0.52 0.12 -4.68 118.95 117.49 2bwg s ARG 34 Ca 0.56 -0.59 -0.05 0.00 -0.52 0.00 0.00 55.73 55.13 2bwg s ARG 34 Cb -0.51 -1.00 -0.02 0.00 0.52 0.00 0.00 34.95 33.95 2bwg s ARG 34 CO 0.60 0.26 -0.02 0.99 0.02 0.00 0.00 175.30 177.16 2bwg s THR 35 N -0.54 3.74 -0.04 0.02 2.01 -1.26 -1.96 115.64 117.62 2bwg s THR 35 Ca 0.04 -0.38 0.07 0.00 0.31 0.00 0.00 61.69 61.73 2bwg s THR 35 Cb -0.06 -2.70 -0.02 0.00 0.01 0.00 0.00 72.50 69.74 2bwg s THR 35 CO 0.00 0.43 -0.25 -0.36 -0.69 0.00 0.00 174.62 173.75 2bwg s PHE 36 N 1.16 2.39 -0.28 4.92 0.08 -0.14 -4.97 117.98 121.15 2bwg s PHE 36 Ca 0.02 -0.53 -0.02 0.00 0.12 0.00 0.00 56.93 56.53 2bwg s PHE 36 Cb -0.14 -1.55 0.04 0.00 -0.57 0.00 0.00 43.02 40.80 2bwg s PHE 36 CO 0.01 -0.09 -0.02 0.99 -0.10 0.00 0.00 175.22 176.01 2bwg s THR 37 N -0.45 2.98 0.51 0.64 2.01 -1.26 0.59 115.64 120.65 2bwg s THR 37 Ca 0.05 -1.23 -0.20 0.00 0.31 0.00 0.00 61.69 60.62 2bwg s THR 37 Cb -0.11 -2.64 -0.08 0.00 0.01 0.00 0.00 72.50 69.68 2bwg s THR 37 CO 0.01 0.01 1.05 -0.36 -0.69 0.00 0.00 174.62 174.64 2bwg s PHE 38 N 1.29 2.96 0.09 4.92 0.08 0.11 -4.95 117.98 122.47 2bwg s PHE 38 Ca -0.03 1.56 -0.15 0.00 0.12 0.00 0.00 56.93 58.44 2bwg s PHE 38 Cb -0.19 -3.08 -0.13 0.00 -0.57 0.00 0.00 43.02 39.05 2bwg s PHE 38 CO -0.02 -0.94 1.33 -0.09 -0.10 0.00 0.00 175.22 175.39 2bwg h ARG 39 N 1.38 0.70 0.00 0.44 2.43 -1.86 -2.29 114.38 115.18 2bwg h ARG 39 Ca -0.49 -0.49 -0.39 0.00 -0.81 0.00 0.00 59.98 57.80 2bwg h ARG 39 Cb 1.22 0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 30.78 2bwg h ARG 39 CO 0.59 1.11 -2.45 0.09 -1.51 0.00 0.00 179.97 177.79 2bwg n ASN 40 N -4.13 2.01 0.18 -3.80 3.02 -1.26 -4.36 115.26 106.91 2bwg n ASN 40 Ca -0.06 -0.05 0.05 0.00 -0.03 0.00 0.00 54.58 54.48 2bwg n ASN 40 Cb 0.61 -0.47 0.27 0.00 -0.61 0.00 0.00 39.78 39.58 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 -0.18 0.00 -0.04 6.41 4.64 -1.79 -3.47 113.55 119.12 2bwg h SER 41 Ca -0.59 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.72 2bwg h SER 41 Cb 1.83 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.91 2bwg h SER 41 CO -0.15 0.42 -0.01 0.29 -0.87 0.00 0.00 176.83 176.51 2bwg n LYS 42 N -3.49 -1.75 -1.52 4.77 4.76 -0.86 -4.66 118.16 115.41 2bwg n LYS 42 Ca 0.00 0.47 -0.30 0.00 -2.87 0.00 0.00 58.31 55.61 2bwg n LYS 42 Cb 0.56 -4.80 0.08 0.00 -1.84 0.00 0.00 35.03 29.03 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 2.37 -0.07 1.97 -1.52 -1.26 -4.68 119.66 114.62 2bwg s GLN 43 Ca 0.00 0.81 0.05 0.00 -1.95 0.00 0.00 55.36 54.27 2bwg s GLN 43 Cb 0.00 -1.94 -0.01 0.00 -0.22 0.00 0.00 33.01 30.84 2bwg s GLN 43 CO 0.00 -1.46 -0.24 0.99 -0.25 0.00 0.00 175.29 174.33 2bwg s THR 44 N -3.08 2.15 0.02 -0.19 2.01 -1.26 -0.71 115.64 114.57 2bwg s THR 44 Ca 0.60 -1.02 0.07 0.00 0.31 0.00 0.00 61.69 61.65 2bwg s THR 44 Cb -0.15 -1.79 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 2bwg s THR 44 CO 0.55 0.57 -0.21 -0.47 -0.69 0.00 0.00 174.62 174.36 2bwg s TYR 45 N -0.07 2.47 -0.03 4.92 5.04 0.20 -4.97 117.35 124.91 2bwg s TYR 45 Ca -0.06 -0.32 0.01 0.00 -2.44 0.00 0.00 57.07 54.26 2bwg s TYR 45 Cb -0.15 -1.47 0.02 0.00 0.35 0.00 0.00 41.96 40.72 2bwg s TYR 45 CO 0.05 0.16 -0.04 0.45 -1.34 0.00 0.00 175.55 174.84 2bwg s SER 46 N -1.17 0.76 0.00 4.32 0.15 -1.26 -0.96 113.70 115.54 2bwg s SER 46 Ca 0.13 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.68 2bwg s SER 46 Cb -0.10 -0.34 0.00 0.00 -1.71 0.00 0.00 66.02 63.87 2bwg s SER 46 CO 0.03 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.03 2bwg n GLY 47 N 3.89 -1.67 3.57 9.45 0.00 -0.83 -4.96 105.19 114.64 2bwg n GLY 47 Ca -0.24 -1.10 -0.43 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.57 4.45 -0.41 -0.61 1.01 0.97 0.14 121.20 124.18 2bwg s ILE 48 Ca 0.00 0.85 -0.07 0.00 0.00 0.00 0.00 60.65 61.43 2bwg s ILE 48 Cb 0.00 -4.45 -0.20 0.00 0.01 0.00 0.00 42.46 37.82 2bwg s ILE 48 CO 0.00 -0.83 3.23 -0.81 0.00 0.00 0.00 174.94 176.53 2bwg n PRO 49 N 7.22 2.27 -4.65 2.79 -0.04 -1.26 -4.15 135.00 137.18 2bwg n PRO 49 Ca 0.07 -1.23 -0.33 0.00 -0.04 0.00 0.00 63.50 61.97 2bwg n PRO 49 Cb 0.49 -2.17 -0.14 0.00 -0.04 0.00 0.00 33.50 31.63 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 1.49 3.03 -0.10 0.52 1.01 -1.26 -1.74 121.20 124.15 2bwg s ILE 50 Ca 0.63 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 60.63 2bwg s ILE 50 Cb 0.26 -2.28 -0.02 0.00 0.01 0.00 0.00 42.46 40.43 2bwg s ILE 50 CO -0.01 0.51 -0.13 -0.63 0.00 0.00 0.00 174.94 174.68 2bwg s ILE 51 N 0.53 3.11 0.05 2.92 1.01 0.44 -1.94 121.20 127.31 2bwg s ILE 51 Ca -0.08 -0.67 -0.30 0.00 0.00 0.00 0.00 60.65 59.60 2bwg s ILE 51 Cb -0.16 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 2bwg s ILE 51 CO 0.04 0.55 0.97 -0.69 0.00 0.00 0.00 174.94 175.81 2bwg s VAL 52 N -0.14 4.72 0.64 2.92 1.01 -0.22 -0.60 120.40 128.73 2bwg s VAL 52 Ca -0.01 2.06 -0.17 0.00 0.00 0.00 0.00 61.98 63.87 2bwg s VAL 52 Cb -0.14 -4.32 -0.01 0.00 0.00 0.00 0.00 36.38 31.91 2bwg s VAL 52 CO 0.03 0.22 1.14 0.00 0.00 0.00 0.00 175.10 176.50 2bwg s ALA 53 N 0.59 2.47 -0.68 5.51 0.00 -0.42 -1.19 121.76 128.05 2bwg s ALA 53 Ca 0.50 0.73 -0.06 0.00 0.00 0.00 0.00 51.96 53.12 2bwg s ALA 53 Cb -0.22 -3.37 -0.11 0.00 0.00 0.00 0.00 23.12 19.42 2bwg s ALA 53 CO 0.29 -1.24 3.12 0.27 0.00 0.00 0.00 175.76 178.20 2bwg n ASN 54 N -2.10 6.76 -4.97 0.00 6.94 -1.19 -3.13 115.26 117.57 2bwg n ASN 54 Ca 0.12 -2.74 -0.21 0.00 -0.02 0.00 0.00 54.58 51.73 2bwg n ASN 54 Cb 0.51 -1.41 -0.00 0.00 -2.36 0.00 0.00 39.78 36.52 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 0.45 3.18 0.31 -3.83 -1.94 -1.26 -4.30 119.30 111.92 2bwg s MET 55 Ca 0.64 -0.72 -0.01 0.00 -1.71 0.00 0.00 55.69 53.89 2bwg s MET 55 Cb 0.28 -2.72 0.50 0.00 2.01 0.00 0.00 34.83 34.90 2bwg s MET 55 CO -0.07 0.01 1.97 -0.44 -0.01 0.00 0.00 175.02 176.48 2bwg h ASP 56 N 0.75 0.89 0.23 3.03 3.32 -1.90 -0.86 116.42 121.87 2bwg h ASP 56 Ca -0.47 -0.02 -0.34 0.00 0.02 0.00 0.00 57.03 56.22 2bwg h ASP 56 Cb 1.25 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 40.53 2bwg h ASP 56 CO 0.56 0.64 -2.05 0.35 -1.72 0.00 0.00 179.24 177.02 2bwg n THR 57 N -4.42 1.55 -0.10 0.35 -2.24 -1.26 -4.55 114.28 103.60 2bwg n THR 57 Ca 0.09 -0.77 -0.12 0.00 -2.27 0.00 0.00 64.05 60.98 2bwg n THR 57 Cb 0.05 -0.99 -0.15 0.00 -2.10 0.00 0.00 70.33 67.14 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 -3.04 1.44 -1.74 2.28 0.24 -1.21 -1.25 118.33 115.05 2bwg n VAL 58 Ca -0.27 -0.78 -0.40 0.00 -2.04 0.00 0.00 64.34 60.85 2bwg n VAL 58 Cb 1.08 -0.75 -0.01 0.00 -1.47 0.00 0.00 33.84 32.68 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 1.86 4.78 3.83 7.63 0.00 -0.33 -4.73 105.19 118.22 2bwg n GLY 59 Ca -0.35 -1.82 -0.22 0.00 0.00 0.00 0.00 46.02 43.63 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 0.44 2.92 0.26 2.61 -4.23 -1.26 -1.49 115.64 114.88 2bwg s THR 60 Ca 0.59 -1.46 0.03 0.00 -1.18 0.00 0.00 61.69 59.68 2bwg s THR 60 Cb 0.18 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.97 2bwg s THR 60 CO -0.07 -0.08 1.63 -0.26 -0.54 0.00 0.00 174.62 175.29 2bwg h PHE 61 N 1.23 0.41 -0.35 3.99 0.04 -1.94 -1.53 116.94 118.79 2bwg h PHE 61 Ca -0.43 -0.13 -0.14 0.00 2.80 0.00 0.00 57.97 60.07 2bwg h PHE 61 Cb 1.26 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 39.31 2bwg h PHE 61 CO 0.55 0.74 -0.35 0.93 -0.60 0.00 0.00 178.31 179.58 2bwg h GLU 62 N 0.28 0.82 -0.50 1.51 3.07 -1.96 -2.00 114.58 115.79 2bwg h GLU 62 Ca 0.02 -0.41 -0.08 0.00 -0.50 0.00 0.00 59.36 58.39 2bwg h GLU 62 Cb 0.92 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.81 2bwg h GLU 62 CO 0.08 1.04 -0.00 1.98 -1.40 0.00 0.00 179.01 180.70 2bwg h MET 63 N 0.68 0.89 -0.54 2.33 4.05 -1.71 -3.07 114.93 117.55 2bwg h MET 63 Ca 0.06 -0.29 0.00 0.00 -0.28 0.00 0.00 59.70 59.20 2bwg h MET 63 Cb 0.91 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.61 2bwg h MET 63 CO 0.08 0.93 0.35 0.00 0.23 0.00 0.00 176.91 178.50 2bwg h ALA 64 N 0.93 1.60 0.00 0.39 0.00 -1.00 -0.67 119.26 120.51 2bwg h ALA 64 Ca 0.14 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2bwg h ALA 64 Cb 0.53 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2bwg h ALA 64 CO 0.03 0.37 -0.39 0.00 0.00 0.00 0.00 179.25 179.26 2bwg h ALA 65 N 1.65 1.27 0.03 0.00 0.00 -1.27 -0.96 119.26 119.98 2bwg h ALA 65 Ca 0.20 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2bwg h ALA 65 Cb -0.07 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.66 2bwg h ALA 65 CO -0.04 0.49 -0.24 0.28 0.00 0.00 0.00 179.25 179.74 2bwg h VAL 66 N 0.00 1.66 -0.82 0.00 2.07 -1.45 -3.34 116.25 114.37 2bwg h VAL 66 Ca -0.00 -2.25 0.05 0.00 0.82 0.00 0.00 66.70 65.31 2bwg h VAL 66 Cb 0.73 3.16 -0.05 0.00 -1.52 0.00 0.00 31.29 33.60 2bwg h VAL 66 CO 0.05 0.60 0.52 0.24 0.02 0.00 0.00 177.57 179.00 2bwg h MET 67 N -0.72 0.95 -0.95 1.57 2.86 -0.88 -2.28 114.93 115.47 2bwg h MET 67 Ca -0.04 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 2bwg h MET 67 Cb 1.13 -0.21 -0.05 0.00 0.06 0.00 0.00 31.60 32.53 2bwg h MET 67 CO 0.05 0.63 0.62 0.77 1.06 0.00 0.00 176.91 180.04 2bwg h SER 68 N 0.97 1.09 -0.77 1.22 0.02 -1.17 0.71 113.55 115.62 2bwg h SER 68 Ca 0.35 -0.03 0.19 0.00 -0.84 0.00 0.00 61.79 61.45 2bwg h SER 68 Cb 0.09 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.32 2bwg h SER 68 CO -0.14 0.79 0.53 1.56 -1.14 0.00 0.00 176.83 178.43 2bwg h GLN 69 N 1.29 0.21 -0.63 3.45 4.20 -1.52 -0.29 115.11 121.81 2bwg h GLN 69 Ca 0.35 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.04 2bwg h GLN 69 Cb -0.14 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.59 2bwg h GLN 69 CO -0.07 0.14 0.00 0.72 -0.67 0.00 0.00 178.83 178.94 2bwg n HIS 70 N -4.41 1.73 -2.41 2.96 8.25 -0.40 -4.91 115.22 116.02 2bwg n HIS 70 Ca 0.15 -0.64 -0.18 0.00 -0.26 0.00 0.00 57.72 56.80 2bwg n HIS 70 Cb 0.69 -0.37 -0.01 0.00 1.12 0.00 0.00 29.99 31.42 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 0.84 -5.20 -4.86 0.41 7.64 -0.12 -4.64 113.62 107.69 2bwg n SER 71 Ca 0.26 0.06 -0.23 0.00 1.01 0.00 0.00 58.87 59.97 2bwg n SER 71 Cb 1.02 -4.35 -0.04 0.00 -1.01 0.00 0.00 64.21 59.83 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 -5.03 3.08 0.02 1.43 -1.94 0.11 -0.02 119.30 116.94 2bwg s MET 72 Ca 0.00 -0.92 0.01 0.00 -1.71 0.00 0.00 55.69 53.07 2bwg s MET 72 Cb 0.00 -2.68 -0.04 0.00 2.01 0.00 0.00 34.83 34.12 2bwg s MET 72 CO 0.00 0.43 0.06 0.12 -0.01 0.00 0.00 175.02 175.63 2bwg s PHE 73 N -2.00 3.22 -0.11 -0.03 5.36 -0.82 -3.31 117.98 120.29 2bwg s PHE 73 Ca 0.33 0.15 0.01 0.00 -0.96 0.00 0.00 56.93 56.45 2bwg s PHE 73 Cb -0.09 -1.69 0.02 0.00 -0.34 0.00 0.00 43.02 40.92 2bwg s PHE 73 CO 0.26 0.53 -0.12 0.99 -1.46 0.00 0.00 175.22 175.41 2bwg s THR 74 N -1.23 1.30 -0.37 0.12 2.01 0.01 -1.05 115.64 116.43 2bwg s THR 74 Ca 0.24 -0.50 -0.23 0.00 0.31 0.00 0.00 61.69 61.51 2bwg s THR 74 Cb -0.12 -1.23 0.01 0.00 0.01 0.00 0.00 72.50 71.17 2bwg s THR 74 CO 0.15 0.41 0.75 0.00 -0.69 0.00 0.00 174.62 175.24 2bwg s ALA 75 N 1.25 3.42 0.06 7.40 0.00 -0.33 -1.77 121.76 131.78 2bwg s ALA 75 Ca -0.02 -0.75 -0.29 0.00 0.00 0.00 0.00 51.96 50.90 2bwg s ALA 75 Cb -0.14 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 2bwg s ALA 75 CO -0.04 -1.51 0.94 0.42 0.00 0.00 0.00 175.76 175.56 2bwg s ILE 76 N 3.03 4.67 0.68 0.00 -1.09 -0.43 -3.17 121.20 124.90 2bwg s ILE 76 Ca 0.29 2.00 -0.16 0.00 -2.23 0.00 0.00 60.65 60.56 2bwg s ILE 76 Cb -0.13 -4.29 0.01 0.00 -1.58 0.00 0.00 42.46 36.47 2bwg s ILE 76 CO 0.17 0.27 1.19 -1.38 -1.23 0.00 0.00 174.94 173.96 2bwg s HIS 77 N 0.37 2.23 -2.00 3.97 -3.43 -0.56 -3.54 115.29 112.33 2bwg s HIS 77 Ca 0.47 1.57 0.03 0.00 -0.80 0.00 0.00 55.06 56.33 2bwg s HIS 77 Cb -0.22 -3.43 0.20 0.00 -1.43 0.00 0.00 32.58 27.69 2bwg s HIS 77 CO 0.28 -2.37 1.11 0.36 -2.00 0.00 0.00 174.74 172.12 2bwg n LYS 78 N -2.36 0.98 -0.08 -0.38 2.85 -1.26 -3.76 118.16 114.14 2bwg n LYS 78 Ca 0.13 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.47 2bwg n LYS 78 Cb 0.50 -1.05 0.12 0.00 -0.65 0.00 0.00 35.03 33.95 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 -0.55 0.22 -2.37 5.58 8.25 -1.26 -4.91 115.22 120.17 2bwg n HIS 79 Ca 0.02 -0.17 -0.40 0.00 -0.26 0.00 0.00 57.72 56.92 2bwg n HIS 79 Cb 0.01 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 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 -1.23 3.37 0.76 4.41 2.02 -1.25 -5.04 117.35 120.39 2bwg s TYR 80 Ca 0.24 1.61 -0.12 0.00 -0.37 0.00 0.00 57.07 58.43 2bwg s TYR 80 Cb 0.15 -3.38 0.05 0.00 -0.40 0.00 0.00 41.96 38.38 2bwg s TYR 80 CO 0.21 -0.95 1.12 -1.54 -1.57 0.00 0.00 175.55 172.82 2bwg s SER 81 N -0.87 4.89 0.18 2.29 1.04 -1.26 -4.91 113.70 115.06 2bwg s SER 81 Ca 0.48 1.07 -0.14 0.00 0.48 0.00 0.00 55.95 57.84 2bwg s SER 81 Cb -0.33 -1.76 0.16 0.00 0.10 0.00 0.00 66.02 64.19 2bwg s SER 81 CO 0.42 -1.69 1.72 0.25 0.98 0.00 0.00 173.24 174.93 2bwg h LEU 82 N -0.90 0.02 -0.96 2.42 5.85 -1.96 -1.87 115.31 117.92 2bwg h LEU 82 Ca -0.46 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.37 2bwg h LEU 82 Cb 1.28 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.36 2bwg h LEU 82 CO 0.63 0.04 0.63 0.44 -0.34 0.00 0.00 178.44 179.85 2bwg h ASP 83 N 0.24 1.06 -0.66 1.25 3.32 -1.99 -0.56 116.42 119.08 2bwg h ASP 83 Ca 0.23 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.28 2bwg h ASP 83 Cb 0.29 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.56 2bwg h ASP 83 CO -0.29 0.73 0.42 0.44 -1.72 0.00 0.00 179.24 178.82 2bwg h ASP 84 N 1.23 0.71 -0.27 6.45 3.32 -1.79 -0.30 116.42 125.76 2bwg h ASP 84 Ca 0.38 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.39 2bwg h ASP 84 Cb -0.03 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2bwg h ASP 84 CO -0.11 0.50 0.07 -0.50 -1.72 0.00 0.00 179.24 177.48 2bwg h TRP 85 N 0.84 0.45 -0.82 4.55 4.06 -0.82 -1.80 115.95 122.40 2bwg h TRP 85 Ca 0.25 -0.05 0.09 0.00 2.06 0.00 0.00 58.89 61.24 2bwg h TRP 85 Cb -0.04 -0.13 -0.07 0.00 -1.00 0.00 0.00 29.16 27.93 2bwg h TRP 85 CO -0.04 0.50 0.47 0.87 -3.56 0.00 0.00 178.44 176.69 2bwg h LYS 86 N 0.26 0.78 -0.42 0.49 1.57 -0.68 0.94 116.57 119.51 2bwg h LYS 86 Ca 0.08 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.71 2bwg h LYS 86 Cb 0.28 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2bwg h LYS 86 CO 0.00 0.52 -0.16 1.25 -0.57 0.00 0.00 179.45 180.49 2bwg h LEU 87 N 0.81 0.80 -0.72 2.94 5.85 -0.93 -0.84 115.31 123.22 2bwg h LEU 87 Ca 0.39 -0.26 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 2bwg h LEU 87 Cb 0.33 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2bwg h LEU 87 CO -0.23 0.96 -0.18 0.15 -0.34 0.00 0.00 178.44 178.80 2bwg h PHE 88 N 0.71 0.89 -0.48 1.25 3.57 -0.40 -1.26 116.94 121.22 2bwg h PHE 88 Ca 0.11 -0.19 -0.12 0.00 3.53 0.00 0.00 57.97 61.30 2bwg h PHE 88 Cb 0.66 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 2bwg h PHE 88 CO 0.04 0.91 -0.19 0.00 -2.23 0.00 0.00 178.31 176.84 2bwg h ALA 89 N 1.10 0.67 -0.20 2.41 0.00 -0.61 0.42 119.26 123.04 2bwg h ALA 89 Ca 0.11 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2bwg h ALA 89 Cb 0.68 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2bwg h ALA 89 CO 0.05 0.63 0.13 1.15 0.00 0.00 0.00 179.25 181.21 2bwg h THR 90 N 0.82 1.05 0.00 0.00 2.02 -0.98 -3.08 112.91 112.74 2bwg h THR 90 Ca 0.11 -0.10 -0.27 0.00 0.77 0.00 0.00 66.41 66.92 2bwg h THR 90 Cb 0.76 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 67.89 2bwg h THR 90 CO 0.06 0.05 -1.67 0.59 0.37 0.00 0.00 175.52 174.92 2bwg n ASN 91 N -4.95 0.85 -2.86 4.18 3.02 -0.49 -4.52 115.26 110.50 2bwg n ASN 91 Ca -0.03 0.40 -0.20 0.00 -0.03 0.00 0.00 54.58 54.72 2bwg n ASN 91 Cb 0.03 -0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.19 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 -3.01 2.04 0.09 3.10 8.25 0.15 -4.92 115.22 120.92 2bwg n HIS 92 Ca -0.16 -3.47 0.09 0.00 -0.26 0.00 0.00 57.72 53.92 2bwg n HIS 92 Cb 1.02 -0.36 0.57 0.00 1.12 0.00 0.00 29.99 32.33 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 2.91 0.21 0.00 -0.41 0.13 -1.68 -1.72 132.00 131.45 2bwg h PRO 93 Ca 0.10 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2bwg h PRO 93 Cb 0.89 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.98 2bwg h PRO 93 CO 0.65 0.14 -0.00 1.05 -0.23 0.00 0.00 178.00 179.60 2bwg h GLU 94 N 0.22 0.00 0.00 0.86 9.09 -1.91 -2.98 114.58 119.86 2bwg h GLU 94 Ca 0.13 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.54 2bwg h GLU 94 Cb 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.33 2bwg h GLU 94 CO -0.02 0.00 -0.81 0.00 0.05 0.00 0.00 179.01 178.23 2bwg h LEU 96 N 0.00 0.00 -0.58 0.00 3.38 -1.62 0.39 115.31 116.89 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 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2bwg h LEU 96 CO 0.00 0.10 0.00 0.06 0.09 0.00 0.00 178.44 178.69 2bwg h GLN 97 N 0.00 0.00 -0.41 1.13 3.07 -1.79 -3.26 115.11 113.86 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 0.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.81 2bwg h GLN 97 CO 0.01 0.00 0.00 0.09 0.09 0.00 0.00 178.83 179.02 2bwg n ASN 98 N -2.61 3.98 -4.28 0.06 3.02 0.14 -4.93 115.26 110.64 2bwg n ASN 98 Ca 0.03 -2.59 -0.17 0.00 -0.03 0.00 0.00 54.58 51.82 2bwg n ASN 98 Cb 0.36 -0.48 -0.11 0.00 -0.61 0.00 0.00 39.78 38.94 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 -2.07 1.44 0.02 2.41 -7.23 -1.16 -0.81 120.40 112.99 2bwg s VAL 99 Ca 0.40 -1.95 0.06 0.00 -1.81 0.00 0.00 61.98 58.68 2bwg s VAL 99 Cb 0.28 -1.77 -0.02 0.00 0.56 0.00 0.00 36.38 35.43 2bwg s VAL 99 CO 0.15 -0.54 -0.19 0.00 -0.31 0.00 0.00 175.10 174.22 2bwg s ALA 100 N -2.65 1.56 0.08 1.32 0.00 -0.73 -4.27 121.76 117.07 2bwg s ALA 100 Ca 0.15 -0.90 -0.15 0.00 0.00 0.00 0.00 51.96 51.05 2bwg s ALA 100 Cb -0.02 -0.34 -0.06 0.00 0.00 0.00 0.00 23.12 22.70 2bwg s ALA 100 CO 0.04 0.36 0.50 0.54 0.00 0.00 0.00 175.76 177.20 2bwg s VAL 101 N -0.64 4.89 0.05 0.00 0.11 -0.71 -1.31 120.40 122.79 2bwg s VAL 101 Ca 0.06 0.90 0.05 0.00 -2.93 0.00 0.00 61.98 60.07 2bwg s VAL 101 Cb -0.08 -3.77 -0.04 0.00 -1.53 0.00 0.00 36.38 30.97 2bwg s VAL 101 CO 0.01 0.43 -0.09 -0.44 -3.33 0.00 0.00 175.10 171.68 2bwg s SER 102 N -1.37 4.48 -0.12 3.54 0.01 -1.23 0.24 113.70 119.25 2bwg s SER 102 Ca 0.31 -0.26 -0.16 0.00 1.31 0.00 0.00 55.95 57.15 2bwg s SER 102 Cb -0.17 -0.95 0.04 0.00 0.21 0.00 0.00 66.02 65.15 2bwg s SER 102 CO 0.17 0.23 0.41 -0.55 0.41 0.00 0.00 173.24 173.92 2bwg s SER 103 N -1.76 -0.39 1.02 2.44 0.15 0.17 -4.48 113.70 110.84 2bwg s SER 103 Ca 0.19 0.65 -0.07 0.00 0.70 0.00 0.00 55.95 57.42 2bwg s SER 103 Cb -0.11 0.71 0.10 0.00 -1.71 0.00 0.00 66.02 65.01 2bwg s SER 103 CO 0.10 -0.25 0.55 0.61 1.20 0.00 0.00 173.24 175.45 2bwg n GLY 104 N 2.33 -1.49 1.07 9.45 0.00 -1.26 -2.14 105.19 113.15 2bwg n GLY 104 Ca -0.16 -1.65 0.09 0.00 0.00 0.00 0.00 46.02 44.30 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 -3.43 3.11 -4.85 1.61 3.41 -1.26 -4.54 113.62 107.67 2bwg n SER 105 Ca 0.07 -2.04 -0.31 0.00 -0.26 0.00 0.00 58.87 56.33 2bwg n SER 105 Cb 0.25 -0.39 0.03 0.00 -0.26 0.00 0.00 64.21 63.83 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 -0.98 1.66 0.17 5.00 0.00 -1.26 -4.96 107.32 106.96 2bwg s GLY 106 Ca 0.38 -0.04 -0.11 0.00 0.00 0.00 0.00 44.72 44.94 2bwg s GLY 106 CO 0.25 0.24 1.69 -1.61 0.00 0.00 0.00 173.10 173.67 2bwg h GLN 107 N -0.47 0.92 -0.72 2.90 4.15 -2.00 -2.25 115.11 117.64 2bwg h GLN 107 Ca -0.44 -0.21 -0.06 0.00 0.77 0.00 0.00 58.65 58.71 2bwg h GLN 107 Cb 1.20 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 28.73 2bwg h GLN 107 CO 0.60 0.85 0.23 -0.91 -1.93 0.00 0.00 178.83 177.67 2bwg h ASN 108 N 0.84 1.04 -0.45 -0.69 2.35 -1.97 -1.53 115.58 115.16 2bwg h ASN 108 Ca 0.18 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.70 2bwg h ASN 108 Cb 0.33 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2bwg h ASN 108 CO -0.00 0.97 0.15 0.44 -1.65 0.00 0.00 177.43 177.34 2bwg h ASP 109 N 1.06 0.65 -0.43 5.81 5.19 -1.85 -1.05 116.42 125.81 2bwg h ASP 109 Ca 0.23 -0.20 -0.02 0.00 -0.62 0.00 0.00 57.03 56.42 2bwg h ASP 109 Cb 0.29 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 2bwg h ASP 109 CO -0.01 0.67 0.18 0.25 -3.12 0.00 0.00 179.24 177.21 2bwg h LEU 110 N 0.59 0.59 -0.67 1.55 5.85 -1.14 -0.61 115.31 121.47 2bwg h LEU 110 Ca 0.15 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 2bwg h LEU 110 Cb 0.25 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2bwg h LEU 110 CO -0.01 0.59 0.20 -0.33 -0.34 0.00 0.00 178.44 178.55 2bwg h GLU 111 N 0.55 1.06 -0.39 1.25 5.08 -1.19 0.19 114.58 121.13 2bwg h GLU 111 Ca 0.14 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 2bwg h GLU 111 Cb 0.18 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2bwg h GLU 111 CO -0.01 0.92 -0.02 -0.22 -1.00 0.00 0.00 179.01 178.68 2bwg h LYS 112 N 0.99 0.70 -0.49 2.33 3.64 -0.96 -1.66 116.57 121.11 2bwg h LYS 112 Ca 0.22 -0.24 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 2bwg h LYS 112 Cb 0.32 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 2bwg h LYS 112 CO -0.00 0.81 0.22 1.98 -2.27 0.00 0.00 179.45 180.19 2bwg h MET 113 N 0.52 0.72 -0.63 1.90 4.05 -0.98 -1.68 114.93 118.84 2bwg h MET 113 Ca 0.11 -0.12 0.09 0.00 -0.28 0.00 0.00 59.70 59.50 2bwg h MET 113 Cb 0.51 -0.12 -0.07 0.00 -0.80 0.00 0.00 31.60 31.11 2bwg h MET 113 CO 0.02 0.62 0.27 1.15 0.23 0.00 0.00 176.91 179.20 2bwg h THR 114 N 0.65 0.81 -0.71 -0.77 2.02 -0.86 0.28 112.91 114.33 2bwg h THR 114 Ca 0.17 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 2bwg h THR 114 Cb 0.15 0.30 -0.03 0.00 -1.74 0.00 0.00 68.15 66.82 2bwg h THR 114 CO -0.02 0.09 0.31 0.77 0.37 0.00 0.00 175.52 177.04 2bwg h SER 115 N 0.47 0.95 -0.32 4.18 4.64 -0.86 -1.47 113.55 121.15 2bwg h SER 115 Ca 0.31 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.46 2bwg h SER 115 Cb 0.35 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 2bwg h SER 115 CO -0.28 0.84 0.10 0.40 -0.87 0.00 0.00 176.83 177.02 2bwg h ILE 116 N 1.00 1.20 -0.65 0.95 2.04 -0.76 -0.83 117.51 120.46 2bwg h ILE 116 Ca 0.24 -0.65 -0.09 0.00 1.00 0.00 0.00 64.86 65.36 2bwg h ILE 116 Cb 0.16 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2bwg h ILE 116 CO -0.03 0.22 0.07 -0.07 0.00 0.00 0.00 178.15 178.35 2bwg h LEU 117 N 0.35 1.06 -0.55 1.44 3.38 -0.82 0.31 115.31 120.48 2bwg h LEU 117 Ca 0.10 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 2bwg h LEU 117 Cb 0.24 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2bwg h LEU 117 CO -0.00 1.07 -0.00 -0.33 0.09 0.00 0.00 178.44 179.27 2bwg h GLU 118 N 1.02 0.97 0.00 1.13 5.08 -1.22 -2.97 114.58 118.59 2bwg h GLU 118 Ca 0.19 -0.31 -0.13 0.00 -1.00 0.00 0.00 59.36 58.11 2bwg h GLU 118 Cb 0.49 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 2bwg h GLU 118 CO 0.02 0.98 -0.62 0.00 -1.00 0.00 0.00 179.01 178.39 2bwg h ALA 119 N 0.96 0.83 -2.68 3.43 0.00 -0.89 -3.37 119.26 117.53 2bwg h ALA 119 Ca 0.16 -0.56 -0.60 0.00 0.00 0.00 0.00 54.91 53.90 2bwg h ALA 119 Cb 0.54 -0.10 -0.41 0.00 0.00 0.00 0.00 17.79 17.82 2bwg h ALA 119 CO 0.03 0.77 -0.72 0.28 0.00 0.00 0.00 179.25 179.61 2bwg n VAL 120 N -3.59 0.84 0.19 0.00 0.31 0.11 -4.95 118.33 111.24 2bwg n VAL 120 Ca -0.00 -4.49 0.13 0.00 -0.01 0.00 0.00 64.34 59.96 2bwg n VAL 120 Cb 0.66 -2.02 0.68 0.00 -0.91 0.00 0.00 33.84 32.26 2bwg n VAL 120 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2bwg h PRO 121 N 5.16 0.00 0.00 5.55 0.11 -1.70 -2.09 132.00 139.03 2bwg h PRO 121 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2bwg h PRO 121 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 2bwg h PRO 121 CO 0.63 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 180.38 2bwg h GLN 122 N 0.00 0.00 -6.30 1.05 7.50 -1.93 -3.42 115.11 112.02 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 0.00 0.00 -0.07 0.00 0.05 0.00 0.00 27.48 27.46 2bwg h GLN 122 CO 0.00 0.00 0.78 0.08 -1.50 0.00 0.00 178.83 178.19 2bwg s VAL 123 N -3.21 4.49 -0.07 -0.54 1.01 -0.79 -4.17 120.40 117.13 2bwg s VAL 123 Ca 0.08 1.49 0.10 0.00 0.00 0.00 0.00 61.98 63.65 2bwg s VAL 123 Cb 0.09 -4.42 0.15 0.00 0.00 0.00 0.00 36.38 32.20 2bwg s VAL 123 CO 0.59 -0.57 1.07 0.29 0.00 0.00 0.00 175.10 176.48 2bwg n LYS 124 N 6.98 2.10 -4.69 2.72 4.76 -1.26 -4.97 118.16 123.80 2bwg n LYS 124 Ca 0.10 -2.04 -0.25 0.00 -2.87 0.00 0.00 58.31 53.26 2bwg n LYS 124 Cb 0.48 -1.25 -0.16 0.00 -1.84 0.00 0.00 35.03 32.26 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 -1.94 1.52 -0.08 2.13 0.08 -1.26 -0.68 117.98 117.74 2bwg s PHE 125 Ca 0.16 -0.47 0.03 0.00 0.12 0.00 0.00 56.93 56.77 2bwg s PHE 125 Cb 0.14 -1.05 -0.02 0.00 -0.57 0.00 0.00 43.02 41.52 2bwg s PHE 125 CO 0.02 -0.19 -0.16 0.42 -0.10 0.00 0.00 175.22 175.20 2bwg s ILE 126 N 0.27 2.82 -0.28 0.64 1.01 0.70 -1.74 121.20 124.62 2bwg s ILE 126 Ca -0.07 -0.78 -0.04 0.00 0.00 0.00 0.00 60.65 59.76 2bwg s ILE 126 Cb -0.12 -2.12 0.03 0.00 0.01 0.00 0.00 42.46 40.25 2bwg s ILE 126 CO 0.03 0.56 0.01 0.00 0.00 0.00 0.00 174.94 175.54 2bwg s LEU 128 N 1.36 3.38 -0.03 0.00 1.43 0.10 -0.66 118.68 124.27 2bwg s LEU 128 Ca -0.01 -0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.02 2bwg s LEU 128 Cb -0.18 -1.81 0.03 0.00 0.03 0.00 0.00 46.19 44.26 2bwg s LEU 128 CO -0.01 0.20 0.04 -1.81 0.23 0.00 0.00 176.35 175.00 2bwg s ASP 129 N 0.20 0.26 0.27 2.29 1.01 -0.91 -1.45 116.67 118.34 2bwg s ASP 129 Ca -0.01 0.06 0.04 0.00 0.71 0.00 0.00 52.55 53.36 2bwg s ASP 129 Cb -0.13 -0.06 -0.06 0.00 1.01 0.00 0.00 42.92 43.67 2bwg s ASP 129 CO 0.02 -0.15 0.01 0.68 0.21 0.00 0.00 175.17 175.94 2bwg s VAL 130 N 1.29 1.21 0.09 -1.27 -7.23 -1.07 -4.16 120.40 109.25 2bwg s VAL 130 Ca -0.06 -2.04 -0.15 0.00 -1.81 0.00 0.00 61.98 57.92 2bwg s VAL 130 Cb -0.13 -2.53 -0.11 0.00 0.56 0.00 0.00 36.38 34.17 2bwg s VAL 130 CO -0.03 -0.20 1.37 0.00 -0.31 0.00 0.00 175.10 175.93 2bwg h ALA 131 N 2.30 0.37 -3.40 1.32 0.00 -1.00 -3.37 119.26 115.49 2bwg h ALA 131 Ca -0.39 -0.46 -0.64 0.00 0.00 0.00 0.00 54.91 53.42 2bwg h ALA 131 Cb 1.23 -0.07 -0.41 0.00 0.00 0.00 0.00 17.79 18.55 2bwg h ALA 131 CO 0.67 0.48 -0.63 1.21 0.00 0.00 0.00 179.25 180.98 2bwg s ASN 132 N -6.68 4.40 0.00 0.00 2.47 -1.26 -3.54 114.94 110.33 2bwg s ASN 132 Ca -0.12 -2.93 0.12 0.00 0.42 0.00 0.00 52.86 50.35 2bwg s ASN 132 Cb 0.08 -1.65 0.60 0.00 -1.45 0.00 0.00 41.25 38.83 2bwg s ASN 132 CO 0.84 -0.25 1.33 0.61 -3.72 0.00 0.00 177.10 175.91 2bwg n GLY 133 N 3.23 -0.75 0.83 1.21 0.00 -1.25 -2.03 105.19 106.43 2bwg n GLY 133 Ca 0.05 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.34 0.36 -2.93 1.61 4.01 -1.26 -4.87 117.16 112.74 2bwg n TYR 134 Ca 0.05 -0.18 -0.36 0.00 -0.16 0.00 0.00 57.90 57.25 2bwg n TYR 134 Cb 0.11 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.08 2bwg n TYR 134 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2bwg s SER 135 N -1.49 7.12 0.47 7.72 0.15 -0.86 -4.95 113.70 121.87 2bwg s SER 135 Ca 0.35 1.61 0.26 0.00 0.70 0.00 0.00 55.95 58.87 2bwg s SER 135 Cb 0.19 -2.50 1.12 0.00 -1.71 0.00 0.00 66.02 63.12 2bwg s SER 135 CO 0.28 -0.09 1.91 -0.33 1.20 0.00 0.00 173.24 176.21 2bwg h GLU 136 N 2.97 0.00 -0.09 5.44 4.39 -1.93 -1.92 114.58 123.43 2bwg h GLU 136 Ca -0.48 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.14 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 0.64 0.18 -0.31 1.25 -1.16 0.00 0.00 179.01 179.61 2bwg h HIS 137 N 0.00 0.19 0.17 4.33 2.76 -1.94 -2.36 115.15 118.30 2bwg h HIS 137 Ca -0.00 -0.04 -0.30 0.00 -2.20 0.00 0.00 60.37 57.83 2bwg h HIS 137 Cb 0.61 -0.05 0.01 0.00 1.55 0.00 0.00 27.41 29.54 2bwg h HIS 137 CO 0.00 0.47 -1.39 0.35 -1.30 0.00 0.00 177.93 176.06 2bwg h PHE 138 N 0.15 0.64 -0.68 5.26 3.57 -1.66 -2.25 116.94 121.97 2bwg h PHE 138 Ca 0.02 -0.47 0.12 0.00 3.53 0.00 0.00 57.97 61.17 2bwg h PHE 138 Cb 0.63 -0.03 -0.08 0.00 2.79 0.00 0.00 35.95 39.26 2bwg h PHE 138 CO 0.01 1.40 0.26 0.28 -2.23 0.00 0.00 178.31 178.03 2bwg h VAL 139 N 0.10 0.72 -0.19 1.41 2.07 -1.36 -1.06 116.25 117.94 2bwg h VAL 139 Ca -0.20 -0.15 -0.16 0.00 0.82 0.00 0.00 66.70 67.01 2bwg h VAL 139 Cb 2.04 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 2bwg h VAL 139 CO 0.22 0.08 -0.54 -0.33 0.02 0.00 0.00 177.57 177.02 2bwg h GLU 140 N 0.43 0.55 -0.50 1.57 4.39 -1.41 -2.12 114.58 117.49 2bwg h GLU 140 Ca 0.36 -0.34 -0.10 0.00 0.34 0.00 0.00 59.36 59.62 2bwg h GLU 140 Cb 0.49 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.16 2bwg h GLU 140 CO -0.35 0.94 -0.09 0.35 -1.16 0.00 0.00 179.01 178.70 2bwg h PHE 141 N 0.42 1.05 -0.30 4.33 3.57 -1.00 -1.95 116.94 123.07 2bwg h PHE 141 Ca 0.01 -0.22 0.01 0.00 3.53 0.00 0.00 57.97 61.30 2bwg h PHE 141 Cb 1.07 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 2bwg h PHE 141 CO 0.04 1.00 0.19 0.28 -2.23 0.00 0.00 178.31 177.59 2bwg h VAL 142 N 0.80 1.06 -0.93 1.41 2.07 -1.13 -0.59 116.25 118.95 2bwg h VAL 142 Ca 0.13 -0.13 0.09 0.00 0.82 0.00 0.00 66.70 67.61 2bwg h VAL 142 Cb 0.64 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 2bwg h VAL 142 CO 0.04 0.07 0.60 0.11 0.02 0.00 0.00 177.57 178.41 2bwg h LYS 143 N 0.38 0.94 -0.23 1.57 1.57 -1.16 -0.23 116.57 119.41 2bwg h LYS 143 Ca 0.11 -0.06 -0.17 0.00 -1.87 0.00 0.00 60.65 58.67 2bwg h LYS 143 Cb -0.03 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.07 2bwg h LYS 143 CO -0.04 0.62 -0.51 1.25 -0.57 0.00 0.00 179.45 180.21 2bwg h LEU 144 N 0.97 0.85 -0.43 2.94 5.85 -1.03 -1.93 115.31 122.53 2bwg h LEU 144 Ca 0.43 -0.55 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 2bwg h LEU 144 Cb 0.35 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2bwg h LEU 144 CO -0.18 1.25 -0.08 0.58 -0.34 0.00 0.00 178.44 179.67 2bwg h VAL 145 N 0.49 1.27 -0.17 1.05 2.07 -0.67 0.17 116.25 120.47 2bwg h VAL 145 Ca 0.00 -1.17 0.05 0.00 0.82 0.00 0.00 66.70 66.40 2bwg h VAL 145 Cb 1.12 1.15 -0.05 0.00 -1.52 0.00 0.00 31.29 31.98 2bwg h VAL 145 CO 0.11 0.40 -0.18 -0.09 0.02 0.00 0.00 177.57 177.83 2bwg h ARG 146 N 0.64 -0.20 -0.67 1.57 9.65 -1.07 0.16 114.38 124.47 2bwg h ARG 146 Ca 0.11 0.01 -0.04 0.00 -1.10 0.00 0.00 59.98 58.97 2bwg h ARG 146 Cb 0.60 0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 29.20 2bwg h ARG 146 CO 0.04 -0.13 0.26 0.00 2.80 0.00 0.00 179.97 182.93 2bwg h ALA 147 N 0.85 0.87 -0.39 2.80 0.00 -1.16 -1.87 119.26 120.36 2bwg h ALA 147 Ca 0.11 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2bwg h ALA 147 Cb 0.37 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2bwg h ALA 147 CO -0.29 0.50 -0.08 0.87 0.00 0.00 0.00 179.25 180.24 2bwg h LYS 148 N 0.95 0.67 -2.22 0.00 1.57 -0.62 -3.37 116.57 113.56 2bwg h LYS 148 Ca 0.22 -0.20 -0.58 0.00 -1.87 0.00 0.00 60.65 58.22 2bwg h LYS 148 Cb 0.22 -0.07 -0.40 0.00 0.08 0.00 0.00 32.23 32.06 2bwg h LYS 148 CO -0.02 0.74 -0.88 1.19 -0.57 0.00 0.00 179.45 179.92 2bwg n PHE 149 N -4.19 1.14 0.27 -1.35 3.72 0.53 -4.99 117.46 112.58 2bwg n PHE 149 Ca 0.01 -3.78 0.16 0.00 -0.05 0.00 0.00 57.45 53.79 2bwg n PHE 149 Cb 0.33 -0.35 0.78 0.00 -0.94 0.00 0.00 39.48 39.30 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 4.43 0.00 -0.01 -1.08 0.13 -1.52 -2.72 132.00 131.23 2bwg h PRO 150 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2bwg h PRO 150 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2bwg h PRO 150 CO 0.59 0.00 -0.11 0.39 -0.23 0.00 0.00 178.00 178.64 2bwg n GLU 151 N -2.60 1.35 -3.04 0.86 -0.58 -1.26 -4.54 120.64 110.82 2bwg n GLU 151 Ca -0.01 -0.80 -0.35 0.00 -0.42 0.00 0.00 57.16 55.58 2bwg n GLU 151 Cb 0.11 -1.12 -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 -1.09 3.55 -0.13 -0.32 3.76 -1.03 -4.76 115.29 115.27 2bwg s HIS 152 Ca 0.09 1.41 -0.25 0.00 -0.15 0.00 0.00 55.06 56.17 2bwg s HIS 152 Cb 0.08 -2.66 -0.02 0.00 1.11 0.00 0.00 32.58 31.09 2bwg s HIS 152 CO 0.19 0.21 0.80 0.99 -0.85 0.00 0.00 174.74 176.08 2bwg s THR 153 N -1.72 4.92 -0.27 1.30 2.01 0.14 -4.50 115.64 117.52 2bwg s THR 153 Ca 0.49 1.60 -0.07 0.00 0.31 0.00 0.00 61.69 64.02 2bwg s THR 153 Cb -0.14 -4.12 -0.01 0.00 0.01 0.00 0.00 72.50 68.24 2bwg s THR 153 CO 0.20 0.09 0.07 -0.63 -0.69 0.00 0.00 174.62 173.66 2bwg s ILE 154 N 1.75 4.07 -0.08 1.82 1.01 -1.26 -0.21 121.20 128.30 2bwg s ILE 154 Ca 0.39 -0.46 -0.22 0.00 0.00 0.00 0.00 60.65 60.36 2bwg s ILE 154 Cb -0.17 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.26 2bwg s ILE 154 CO 0.15 0.21 0.63 -0.04 0.00 0.00 0.00 174.94 175.88 2bwg s MET 155 N 1.55 4.40 -0.04 2.79 -1.94 0.11 -0.25 119.30 125.91 2bwg s MET 155 Ca 0.04 0.74 -0.02 0.00 -1.71 0.00 0.00 55.69 54.75 2bwg s MET 155 Cb -0.16 -3.44 0.03 0.00 2.01 0.00 0.00 34.83 33.27 2bwg s MET 155 CO 0.03 0.11 0.09 0.00 -0.01 0.00 0.00 175.02 175.24 2bwg s ALA 156 N 0.67 -0.13 0.10 3.03 0.00 -0.18 0.02 121.76 125.27 2bwg s ALA 156 Ca 0.34 0.44 -0.05 0.00 0.00 0.00 0.00 51.96 52.69 2bwg s ALA 156 Cb -0.17 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.66 2bwg s ALA 156 CO 0.16 -0.11 0.25 0.41 0.00 0.00 0.00 175.76 176.46 2bwg n GLY 157 N 3.93 1.54 3.49 0.00 0.00 -0.53 -0.43 105.19 113.18 2bwg n GLY 157 Ca -0.24 -1.06 -0.30 0.00 0.00 0.00 0.00 46.02 44.43 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 -1.62 3.95 0.40 1.61 -0.87 -1.26 -2.66 114.94 114.48 2bwg s ASN 158 Ca 0.05 -0.46 0.04 0.00 -1.57 0.00 0.00 52.86 50.92 2bwg s ASN 158 Cb -0.01 -0.64 -0.03 0.00 -0.02 0.00 0.00 41.25 40.55 2bwg s ASN 158 CO 0.03 0.22 0.12 0.68 -2.57 0.00 0.00 177.10 175.58 2bwg s VAL 159 N -1.06 0.64 0.00 1.60 -7.23 -0.65 -3.89 120.40 109.82 2bwg s VAL 159 Ca 0.17 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.34 2bwg s VAL 159 Cb -0.11 -2.39 0.00 0.00 0.56 0.00 0.00 36.38 34.44 2bwg s VAL 159 CO 0.08 0.00 0.06 1.33 -0.31 0.00 0.00 175.10 176.26 2bwg n VAL 160 N -0.88 0.00 -4.25 1.32 0.24 -1.26 -0.70 118.33 112.80 2bwg n VAL 160 Ca -0.05 -0.05 -0.17 0.00 -2.04 0.00 0.00 64.34 62.03 2bwg n VAL 160 Cb 0.65 1.88 -0.13 0.00 -1.47 0.00 0.00 33.84 34.77 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 0.73 0.06 3.34 -4.23 -1.26 -4.61 115.64 109.66 2bwg s THR 161 Ca 0.00 -0.69 0.29 0.00 -1.18 0.00 0.00 61.69 60.11 2bwg s THR 161 Cb 0.00 -0.67 0.32 0.00 1.34 0.00 0.00 72.50 73.49 2bwg s THR 161 CO 0.00 -0.01 1.88 1.23 -0.54 0.00 0.00 174.62 177.18 2bwg h GLY 162 N 5.32 0.00 1.65 3.99 0.00 -1.91 -2.61 103.07 109.51 2bwg h GLY 162 Ca -0.33 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.89 2bwg h GLY 162 CO 0.46 0.00 -0.32 1.05 0.00 0.00 0.00 176.54 177.73 2bwg h GLU 163 N 0.00 0.40 0.00 4.80 9.09 -1.97 -1.21 114.58 125.68 2bwg h GLU 163 Ca -0.00 -0.16 -0.16 0.00 0.05 0.00 0.00 59.36 59.09 2bwg h GLU 163 Cb 0.66 -0.02 -0.02 0.00 -1.65 0.00 0.00 28.75 27.73 2bwg h GLU 163 CO 0.01 0.67 -0.74 1.98 0.05 0.00 0.00 179.01 180.98 2bwg h MET 164 N 0.34 0.00 0.55 1.06 4.05 -1.89 -2.30 114.93 116.74 2bwg h MET 164 Ca 0.04 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.44 2bwg h MET 164 Cb 0.73 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.53 2bwg h MET 164 CO 0.06 0.74 -0.33 0.28 0.23 0.00 0.00 176.91 177.89 2bwg h VAL 165 N 0.00 0.33 -0.74 -5.77 2.07 -1.21 -1.63 116.25 109.30 2bwg h VAL 165 Ca -0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.62 2bwg h VAL 165 Cb 1.48 0.33 -0.08 0.00 -1.52 0.00 0.00 31.29 31.51 2bwg h VAL 165 CO 0.10 0.00 0.36 -0.33 0.02 0.00 0.00 177.57 177.72 2bwg h GLU 166 N -0.83 0.58 -0.27 1.57 5.08 -1.20 -0.25 114.58 119.25 2bwg h GLU 166 Ca -0.07 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 2bwg h GLU 166 Cb 0.67 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2bwg h GLU 166 CO 0.08 0.38 -0.02 1.49 -1.00 0.00 0.00 179.01 179.93 2bwg h GLU 167 N 0.59 0.49 -0.30 2.33 4.57 -1.34 -0.31 114.58 120.62 2bwg h GLU 167 Ca 0.38 -0.17 -0.11 0.00 -1.18 0.00 0.00 59.36 58.28 2bwg h GLU 167 Cb 0.45 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 2bwg h GLU 167 CO -0.30 0.67 -0.28 -0.07 -1.18 0.00 0.00 179.01 177.86 2bwg h LEU 168 N 0.26 0.62 -0.15 1.64 3.38 -0.89 0.53 115.31 120.70 2bwg h LEU 168 Ca 0.07 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 2bwg h LEU 168 Cb 0.47 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2bwg h LEU 168 CO 0.02 0.87 -0.18 0.40 0.09 0.00 0.00 178.44 179.64 2bwg h ILE 169 N 0.52 1.35 0.00 1.22 2.04 -0.92 -1.42 117.51 120.30 2bwg h ILE 169 Ca 0.07 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.55 2bwg h ILE 169 Cb 0.75 1.90 -0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2bwg h ILE 169 CO 0.06 0.40 -0.06 -0.07 0.00 0.00 0.00 178.15 178.48 2bwg h LEU 170 N 0.01 0.00 -0.00 1.44 3.38 -0.88 -1.25 115.31 118.00 2bwg h LEU 170 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2bwg h LEU 170 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2bwg h LEU 170 CO 0.04 0.06 -0.06 -1.20 0.09 0.00 0.00 178.44 177.37 2bwg n SER 171 N -4.28 0.06 0.00 -0.43 7.64 0.16 -4.93 113.62 111.85 2bwg n SER 171 Ca -0.03 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.23 2bwg n SER 171 Cb 0.14 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.95 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 1.49 0.61 3.77 0.23 0.00 -0.47 -3.47 105.19 107.34 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 -1.24 3.27 -0.14 4.61 0.00 -0.57 -4.74 121.76 122.95 2bwg s ALA 173 Ca 0.00 0.84 -0.07 0.00 0.00 0.00 0.00 51.96 52.73 2bwg s ALA 173 Cb 0.00 -3.32 -0.25 0.00 0.00 0.00 0.00 23.12 19.56 2bwg s ALA 173 CO 0.00 -0.22 0.29 -0.25 0.00 0.00 0.00 175.76 175.58 2bwg n ASP 174 N 0.65 2.10 -3.99 0.00 8.00 0.65 -4.30 116.55 119.66 2bwg n ASP 174 Ca 0.01 0.19 -0.23 0.00 0.71 0.00 0.00 54.79 55.47 2bwg n ASP 174 Cb 0.46 -0.83 -0.16 0.00 -0.02 0.00 0.00 41.12 40.57 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 -2.54 0.97 -0.20 0.53 1.01 -0.23 -2.45 121.20 118.29 2bwg s ILE 175 Ca -0.24 -0.39 -0.06 0.00 0.00 0.00 0.00 60.65 59.95 2bwg s ILE 175 Cb 0.07 -0.91 -0.03 0.00 0.01 0.00 0.00 42.46 41.60 2bwg s ILE 175 CO 0.74 0.32 0.04 -0.63 0.00 0.00 0.00 174.94 175.41 2bwg s ILE 176 N 0.69 4.39 -0.22 2.92 -1.09 -0.08 -1.01 121.20 126.80 2bwg s ILE 176 Ca -0.13 -0.16 -0.24 0.00 -2.23 0.00 0.00 60.65 57.88 2bwg s ILE 176 Cb -0.15 -3.00 -0.01 0.00 -1.58 0.00 0.00 42.46 37.72 2bwg s ILE 176 CO 0.03 0.42 0.82 -0.54 -1.23 0.00 0.00 174.94 174.44 2bwg s LYS 177 N 0.83 4.21 -0.19 2.79 1.02 0.42 -0.92 119.74 127.91 2bwg s LYS 177 Ca 0.02 0.94 -0.03 0.00 0.02 0.00 0.00 55.97 56.92 2bwg s LYS 177 Cb -0.14 -3.62 -0.02 0.00 -0.52 0.00 0.00 37.83 33.53 2bwg s LYS 177 CO 0.02 -0.46 -0.05 0.08 -0.92 0.00 0.00 175.35 174.02 2bwg s VAL 178 N 2.62 3.48 0.00 3.17 1.01 0.13 -1.64 120.40 129.17 2bwg s VAL 178 Ca 0.35 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2bwg s VAL 178 Cb -0.16 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.67 2bwg s VAL 178 CO 0.09 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2bwg n GLY 179 N 4.25 3.43 2.64 4.51 0.00 0.12 0.88 105.19 121.02 2bwg n GLY 179 Ca -0.18 -0.24 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.14 0.00 1.61 1.01 -1.26 -4.60 120.40 117.02 2bwg s VAL 180 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.81 2bwg s VAL 180 Cb 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 36.38 35.78 2bwg s VAL 180 CO 0.00 -0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.43 2bwg n GLY 181 N 5.29 2.70 0.34 4.51 0.00 -1.26 -1.20 105.19 115.56 2bwg n GLY 181 Ca -0.07 -0.82 0.19 0.00 0.00 0.00 0.00 46.02 45.32 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 -6.46 1.61 0.11 -1.92 -3.44 132.00 121.91 2bwg h PRO 182 Ca 0.00 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.50 2bwg h PRO 182 Cb 0.00 0.00 0.10 0.00 0.11 0.00 0.00 31.00 31.21 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 -1.24 -0.04 0.28 -0.55 0.00 -1.26 -3.63 105.19 98.75 2bwg n GLY 183 Ca -0.01 0.40 0.07 0.00 0.00 0.00 0.00 46.02 46.48 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 2.59 0.12 -0.30 1.61 4.64 -1.94 -1.93 113.55 118.35 2bwg h SER 184 Ca -0.41 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2bwg h SER 184 Cb 1.33 0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 2bwg h SER 184 CO 0.65 -0.01 0.00 1.33 -0.87 0.00 0.00 176.83 177.93 2bwg n VAL 185 N -5.11 0.62 -1.96 0.95 0.24 -1.26 -4.96 118.33 106.85 2bwg n VAL 185 Ca 0.16 -0.81 -0.38 0.00 -2.04 0.00 0.00 64.34 61.26 2bwg n VAL 185 Cb 0.49 0.81 0.02 0.00 -1.47 0.00 0.00 33.84 33.68 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 -0.53 0.56 -0.33 0.00 -2.24 -1.26 -4.80 114.28 105.69 2bwg n THR 187 Ca 0.07 -1.31 -0.03 0.00 -2.27 0.00 0.00 64.05 60.51 2bwg n THR 187 Cb 0.45 0.56 0.09 0.00 -2.10 0.00 0.00 70.33 69.33 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 5.32 1.22 -0.45 4.28 1.35 -1.85 -0.30 112.91 122.48 2bwg h THR 188 Ca -0.12 -0.41 -0.05 0.00 -0.55 0.00 0.00 66.41 65.28 2bwg h THR 188 Cb 1.55 -0.08 -0.02 0.00 -1.73 0.00 0.00 68.15 67.88 2bwg h THR 188 CO 0.05 0.22 0.09 0.03 -0.25 0.00 0.00 175.52 175.66 2bwg h ARG 189 N 1.19 0.74 -0.06 4.72 3.08 -1.87 0.70 114.38 122.89 2bwg h ARG 189 Ca 0.33 -0.19 -0.19 0.00 0.07 0.00 0.00 59.98 60.00 2bwg h ARG 189 Cb -0.13 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 29.83 2bwg h ARG 189 CO -0.07 0.75 -0.78 1.15 -1.07 0.00 0.00 179.97 179.95 2bwg h THR 190 N 0.61 1.39 0.00 2.04 2.02 -1.87 -0.92 112.91 116.18 2bwg h THR 190 Ca 0.14 -2.24 -0.26 0.00 0.77 0.00 0.00 66.41 64.82 2bwg h THR 190 Cb 0.36 2.20 -0.05 0.00 -1.74 0.00 0.00 68.15 68.92 2bwg h THR 190 CO 0.01 0.67 -1.98 0.29 0.37 0.00 0.00 175.52 174.88 2bwg n LYS 191 N -3.81 0.66 0.00 6.66 5.02 -0.14 -4.69 118.16 121.87 2bwg n LYS 191 Ca -0.05 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2bwg n LYS 191 Cb 0.74 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 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 -2.78 0.00 -0.96 -0.18 -2.24 0.23 -5.02 114.28 103.33 2bwg n THR 192 Ca -0.21 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2bwg n THR 192 Cb 0.99 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 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 1.29 0.36 3.84 3.38 0.00 -0.35 -4.97 105.19 108.74 2bwg n GLY 193 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.84 5.13 -3.82 1.61 1.01 -1.25 -4.91 120.40 116.33 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 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 33.05 2bwg s VAL 194 CO 0.00 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.12 2bwg n GLY 195 N 1.32 -2.07 3.63 4.51 0.00 -1.26 -3.46 105.19 107.87 2bwg n GLY 195 Ca -0.14 -1.21 -0.12 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.39 -0.77 0.26 1.61 5.04 -0.34 -5.00 117.35 115.77 2bwg s TYR 196 Ca 0.00 1.80 -0.30 0.00 -2.44 0.00 0.00 57.07 56.13 2bwg s TYR 196 Cb 0.00 0.35 -0.14 0.00 0.35 0.00 0.00 41.96 42.52 2bwg s TYR 196 CO 0.00 -0.37 1.24 -2.30 -1.34 0.00 0.00 175.55 172.78 2bwg n PRO 197 N 2.89 1.73 -0.02 4.97 -0.02 -1.26 -4.50 135.00 138.79 2bwg n PRO 197 Ca -0.15 0.61 -0.11 0.00 -2.02 0.00 0.00 63.50 61.83 2bwg n PRO 197 Cb 0.56 -2.15 0.03 0.00 -0.02 0.00 0.00 33.50 31.91 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 3.14 0.66 0.02 -0.52 5.75 -1.94 -1.33 115.11 120.89 2bwg h GLN 198 Ca -0.44 -0.42 -0.00 0.00 -0.15 0.00 0.00 58.65 57.65 2bwg h GLN 198 Cb 1.31 0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.90 2bwg h GLN 198 CO 0.68 1.03 -0.01 1.25 -2.65 0.00 0.00 178.83 179.13 2bwg h LEU 199 N 0.51 -0.03 -1.48 -2.39 5.85 -1.84 -1.97 115.31 113.97 2bwg h LEU 199 Ca 0.01 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.52 2bwg h LEU 199 Cb 1.11 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2bwg h LEU 199 CO 0.11 0.14 -0.19 0.28 -0.34 0.00 0.00 178.44 178.44 2bwg h SER 200 N -0.20 0.09 0.77 1.25 0.02 -1.34 -0.23 113.55 113.91 2bwg h SER 200 Ca -0.00 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 2bwg h SER 200 Cb 0.18 -0.02 0.01 0.00 0.14 0.00 0.00 62.40 62.71 2bwg h SER 200 CO 0.01 0.30 -0.37 0.00 -1.14 0.00 0.00 176.83 175.62 2bwg h ALA 201 N 1.71 -1.03 -0.66 3.77 0.00 -1.13 -2.45 119.26 119.48 2bwg h ALA 201 Ca 0.02 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.73 2bwg h ALA 201 Cb 0.40 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 2bwg h ALA 201 CO 0.03 -1.07 0.40 0.28 0.00 0.00 0.00 179.25 178.89 2bwg h VAL 202 N -1.05 1.07 -0.30 0.00 2.07 -0.88 -0.75 116.25 116.40 2bwg h VAL 202 Ca -0.11 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.18 2bwg h VAL 202 Cb 0.80 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 2bwg h VAL 202 CO 0.17 0.14 0.09 0.40 0.02 0.00 0.00 177.57 178.40 2bwg h ILE 203 N 0.78 0.90 -0.06 4.57 2.04 -1.03 0.17 117.51 124.88 2bwg h ILE 203 Ca 0.27 -0.08 -0.07 0.00 1.00 0.00 0.00 64.86 65.99 2bwg h ILE 203 Cb 0.04 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 2bwg h ILE 203 CO -0.11 0.04 -0.22 -0.33 0.00 0.00 0.00 178.15 177.53 2bwg h GLU 204 N 0.22 0.26 -0.02 2.37 5.08 -1.21 -3.10 114.58 118.18 2bwg h GLU 204 Ca 0.14 -0.19 -0.16 0.00 -1.00 0.00 0.00 59.36 58.14 2bwg h GLU 204 Cb 0.12 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2bwg h GLU 204 CO -0.15 0.82 -0.73 0.00 -1.00 0.00 0.00 179.01 177.95 2bwg h ALA 206 N 1.18 0.22 -0.57 0.00 0.00 -0.75 -1.58 119.26 117.75 2bwg h ALA 206 Ca -0.02 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 54.86 2bwg h ALA 206 Cb 1.29 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 2bwg h ALA 206 CO 0.10 -0.13 -0.01 0.22 0.00 0.00 0.00 179.25 179.43 2bwg h ASP 207 N 0.06 -0.27 -0.38 0.00 3.58 -1.51 -0.35 116.42 117.55 2bwg h ASP 207 Ca 0.05 0.14 -0.05 0.00 0.42 0.00 0.00 57.03 57.59 2bwg h ASP 207 Cb 0.28 0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 2bwg h ASP 207 CO 0.00 -0.10 0.05 -1.28 -2.88 0.00 0.00 179.24 175.03 2bwg h SER 208 N 0.11 0.62 -0.37 2.28 0.87 -1.38 -1.50 113.55 114.19 2bwg h SER 208 Ca 0.29 -0.27 -0.05 0.00 -1.23 0.00 0.00 61.79 60.53 2bwg h SER 208 Cb 0.46 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 2bwg h SER 208 CO -0.49 0.74 0.02 0.00 -0.53 0.00 0.00 176.83 176.57 2bwg h ALA 209 N 0.91 0.49 0.00 6.23 0.00 -0.93 -3.21 119.26 122.75 2bwg h ALA 209 Ca 0.12 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 2bwg h ALA 209 Cb 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2bwg h ALA 209 CO 0.01 0.24 -0.42 0.45 0.00 0.00 0.00 179.25 179.53 2bwg h HIS 210 N 0.46 0.00 -0.12 0.00 -0.00 -0.92 0.33 115.15 114.89 2bwg h HIS 210 Ca 0.11 0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.51 2bwg h HIS 210 Cb 0.43 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.83 2bwg h HIS 210 CO 0.03 0.42 0.11 0.78 -0.00 0.00 0.00 177.93 179.28 2bwg h GLY 211 N 1.98 0.00 -2.16 2.45 0.00 -1.27 -1.50 103.07 102.57 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 0.05 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.63 2bwg n LEU 212 N -4.09 3.28 -1.95 3.11 4.77 -0.75 -4.92 117.00 116.46 2bwg n LEU 212 Ca 0.00 -1.40 -0.19 0.00 -0.03 0.00 0.00 56.01 54.39 2bwg n LEU 212 Cb 0.23 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2bwg n LEU 212 CO 0.30 0.70 -0.22 0.29 -1.33 0.00 0.00 177.39 177.13 2bwg n LYS 213 N 1.38 -1.45 -0.78 3.23 5.02 -0.56 -4.99 118.16 120.02 2bwg n LYS 213 Ca 0.19 0.98 -0.00 0.00 -2.02 0.00 0.00 58.31 57.45 2bwg n LYS 213 Cb 0.58 -5.46 0.00 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 -0.92 1.12 3.14 0.72 0.00 0.11 -4.22 105.19 105.14 2bwg n GLY 214 Ca -0.21 -2.01 -0.09 0.00 0.00 0.00 0.00 46.02 43.70 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 0.41 0.19 0.12 1.61 3.76 -1.03 -4.03 115.29 116.32 2bwg s HIS 215 Ca 0.01 -0.52 0.04 0.00 -0.15 0.00 0.00 55.06 54.45 2bwg s HIS 215 Cb -0.00 -0.13 -0.04 0.00 1.11 0.00 0.00 32.58 33.52 2bwg s HIS 215 CO 0.01 -0.40 -0.11 0.96 -0.85 0.00 0.00 174.74 174.35 2bwg s ILE 216 N -2.88 1.09 -0.19 0.60 -4.36 -1.26 -0.90 121.20 113.30 2bwg s ILE 216 Ca -0.03 -1.78 -0.05 0.00 -0.26 0.00 0.00 60.65 58.53 2bwg s ILE 216 Cb 0.00 -1.54 -0.03 0.00 1.25 0.00 0.00 42.46 42.14 2bwg s ILE 216 CO -0.06 -0.58 0.00 -0.63 0.24 0.00 0.00 174.94 173.91 2bwg s ILE 217 N -2.64 4.08 -0.50 8.37 1.01 -0.09 -1.40 121.20 130.02 2bwg s ILE 217 Ca 0.10 -0.28 -0.28 0.00 0.00 0.00 0.00 60.65 60.19 2bwg s ILE 217 Cb -0.02 -2.83 0.00 0.00 0.01 0.00 0.00 42.46 39.62 2bwg s ILE 217 CO 0.01 0.44 1.57 -0.55 0.00 0.00 0.00 174.94 176.41 2bwg s SER 218 N 0.78 5.95 -0.46 3.58 0.15 -0.54 0.17 113.70 123.34 2bwg s SER 218 Ca 0.01 0.57 -0.12 0.00 0.70 0.00 0.00 55.95 57.10 2bwg s SER 218 Cb -0.14 -2.54 0.08 0.00 -1.71 0.00 0.00 66.02 61.72 2bwg s SER 218 CO 0.02 -1.80 0.34 -0.62 1.20 0.00 0.00 173.24 172.39 2bwg s ASP 219 N 5.37 5.90 0.00 5.45 2.15 0.25 -0.53 116.67 135.27 2bwg s ASP 219 Ca 0.62 -1.49 0.00 0.00 0.43 0.00 0.00 52.55 52.10 2bwg s ASP 219 Cb -0.14 -2.09 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 2bwg s ASP 219 CO 0.27 -0.63 0.00 0.61 -0.17 0.00 0.00 175.17 175.25 2bwg n GLY 220 N 5.06 -0.13 0.00 2.66 0.00 -1.11 -4.19 105.19 107.49 2bwg n GLY 220 Ca -0.11 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.22 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 0.04 3.09 3.68 -0.02 0.00 -1.24 -4.71 105.19 106.04 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 4.88 0.00 -3.66 0.00 -2.24 -1.26 -4.54 114.28 107.47 2bwg n THR 223 Ca 0.12 -0.39 -0.08 0.00 -2.27 0.00 0.00 64.05 61.44 2bwg n THR 223 Cb 0.45 1.10 -0.02 0.00 -2.10 0.00 0.00 70.33 69.77 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 -0.38 0.00 0.11 -1.92 -1.42 132.00 130.39 2bwg h PRO 225 Ca -0.25 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.86 2bwg h PRO 225 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 2bwg h PRO 225 CO 0.29 0.00 0.24 0.78 -0.21 0.00 0.00 178.00 179.10 2bwg h GLY 226 N 0.00 0.55 0.93 -0.55 0.00 -1.95 -1.40 103.07 100.64 2bwg h GLY 226 Ca 0.09 -0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.22 2bwg h GLY 226 CO -0.00 0.22 0.49 -0.55 0.00 0.00 0.00 176.54 176.69 2bwg h ASP 227 N 0.50 0.82 -0.88 0.19 3.32 -1.67 0.12 116.42 118.84 2bwg h ASP 227 Ca 0.14 -0.01 0.05 0.00 0.02 0.00 0.00 57.03 57.23 2bwg h ASP 227 Cb -0.01 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.29 2bwg h ASP 227 CO -0.03 0.58 0.55 0.58 -1.72 0.00 0.00 179.24 179.21 2bwg h VAL 228 N 0.97 1.08 -0.54 -1.35 2.07 -1.20 0.23 116.25 117.51 2bwg h VAL 228 Ca 0.29 -0.36 -0.11 0.00 0.82 0.00 0.00 66.70 67.35 2bwg h VAL 228 Cb -0.04 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.67 2bwg h VAL 228 CO -0.09 0.19 -0.08 0.00 0.02 0.00 0.00 177.57 177.61 2bwg h ALA 229 N 1.39 0.83 -0.43 1.67 0.00 -0.12 -2.42 119.26 120.19 2bwg h ALA 229 Ca 0.37 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2bwg h ALA 229 Cb 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2bwg h ALA 229 CO -0.15 0.66 0.07 0.87 0.00 0.00 0.00 179.25 180.70 2bwg h LYS 230 N 0.89 0.72 -0.10 0.00 1.57 -0.03 -0.11 116.57 119.52 2bwg h LYS 230 Ca 0.15 -0.19 0.04 0.00 -1.87 0.00 0.00 60.65 58.78 2bwg h LYS 230 Cb 0.63 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.80 2bwg h LYS 230 CO 0.04 0.75 -0.31 0.00 -0.57 0.00 0.00 179.45 179.36 2bwg h ALA 231 N 0.94 -0.38 -0.98 3.86 0.00 -0.43 0.07 119.26 122.34 2bwg h ALA 231 Ca 0.13 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.09 2bwg h ALA 231 Cb 0.38 0.58 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 2bwg h ALA 231 CO 0.01 -0.80 0.64 0.74 0.00 0.00 0.00 179.25 179.84 2bwg h PHE 232 N -0.41 1.20 -0.35 0.00 0.04 -1.29 -2.20 116.94 113.93 2bwg h PHE 232 Ca 0.09 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.86 2bwg h PHE 232 Cb 0.54 -0.40 -0.02 0.00 2.20 0.00 0.00 35.95 38.27 2bwg h PHE 232 CO -0.38 0.69 0.11 0.78 -0.60 0.00 0.00 178.31 178.91 2bwg h GLY 233 N 1.23 0.54 2.00 -1.45 0.00 -0.40 -2.37 103.07 102.62 2bwg h GLY 233 Ca 0.39 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2bwg h GLY 233 CO -0.13 0.25 0.00 0.00 0.00 0.00 0.00 176.54 176.66 2bwg n ALA 234 N -2.48 2.19 0.00 3.60 0.00 -0.04 -4.34 120.51 119.44 2bwg n ALA 234 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2bwg n ALA 234 Cb 0.16 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.16 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 1.14 0.71 3.70 0.00 0.00 -0.89 -4.04 105.19 105.80 2bwg n GLY 235 Ca 0.05 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.64 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 2.18 0.09 4.61 0.00 -0.94 -4.85 120.51 121.60 2bwg n ALA 236 Ca 0.00 0.42 -0.22 0.00 0.00 0.00 0.00 53.44 53.64 2bwg n ALA 236 Cb 0.00 -2.45 -0.15 0.00 0.00 0.00 0.00 19.45 16.86 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 6.37 0.66 -2.89 0.00 3.32 -1.68 -3.41 116.42 118.80 2bwg h ASP 237 Ca -0.44 -0.92 -0.50 0.00 0.02 0.00 0.00 57.03 55.20 2bwg h ASP 237 Cb 1.22 -0.21 -0.14 0.00 0.22 0.00 0.00 39.33 40.42 2bwg h ASP 237 CO 0.93 1.52 -0.69 -0.36 -1.72 0.00 0.00 179.24 178.92 2bwg s PHE 238 N -2.60 1.96 -0.08 4.55 0.08 -0.49 -4.79 117.98 116.60 2bwg s PHE 238 Ca -0.11 -0.66 0.00 0.00 0.12 0.00 0.00 56.93 56.28 2bwg s PHE 238 Cb 0.03 -1.08 0.02 0.00 -0.57 0.00 0.00 43.02 41.42 2bwg s PHE 238 CO 0.88 0.32 -0.07 0.08 -0.10 0.00 0.00 175.22 176.34 2bwg s VAL 239 N -2.97 0.83 -0.17 -0.44 1.01 -0.71 -1.47 120.40 116.49 2bwg s VAL 239 Ca 0.29 -0.22 -0.08 0.00 0.00 0.00 0.00 61.98 61.97 2bwg s VAL 239 Cb 0.03 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2bwg s VAL 239 CO 0.12 0.32 0.09 -0.32 0.00 0.00 0.00 175.10 175.31 2bwg s MET 240 N 1.36 3.86 -0.04 2.72 1.75 0.31 -0.42 119.30 128.84 2bwg s MET 240 Ca -0.03 -0.27 0.02 0.00 -1.25 0.00 0.00 55.69 54.17 2bwg s MET 240 Cb -0.14 -3.24 0.01 0.00 2.84 0.00 0.00 34.83 34.30 2bwg s MET 240 CO -0.03 0.42 -0.09 -0.51 -0.65 0.00 0.00 175.02 174.15 2bwg s LEU 241 N -0.01 1.62 0.05 4.11 1.43 0.23 -2.75 118.68 123.37 2bwg s LEU 241 Ca 0.08 -0.21 -0.03 0.00 -1.03 0.00 0.00 54.13 52.94 2bwg s LEU 241 Cb -0.12 -0.62 -0.01 0.00 0.03 0.00 0.00 46.19 45.47 2bwg s LEU 241 CO 0.00 0.02 -0.05 0.61 0.23 0.00 0.00 176.35 177.17 2bwg n GLY 242 N 3.66 -0.11 0.36 -3.19 0.00 -1.26 -1.30 105.19 103.35 2bwg n GLY 242 Ca -0.22 -0.05 -0.03 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.15 1.36 2.00 -0.02 0.00 -1.95 0.29 103.07 104.60 2bwg h GLY 243 Ca 0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 2bwg h GLY 243 CO 0.00 0.57 -0.12 -0.33 0.00 0.00 0.00 176.54 176.66 2bwg h MET 244 N 1.29 0.00 0.00 4.80 2.07 -1.88 -2.40 114.93 118.81 2bwg h MET 244 Ca 0.33 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.96 2bwg h MET 244 Cb -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.72 2bwg h MET 244 CO -0.06 0.12 -0.99 1.19 1.07 0.00 0.00 176.91 178.25 2bwg n PHE 245 N -3.94 0.23 -1.72 -0.22 3.72 -0.68 -4.95 117.46 109.91 2bwg n PHE 245 Ca -0.02 0.07 -0.37 0.00 -0.05 0.00 0.00 57.45 57.07 2bwg n PHE 245 Cb 0.21 -0.40 0.06 0.00 -0.94 0.00 0.00 39.48 38.41 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 -1.91 2.06 0.00 4.37 3.41 0.00 -3.90 113.62 117.65 2bwg n SER 246 Ca 0.02 0.86 0.00 0.00 -0.26 0.00 0.00 58.87 59.49 2bwg n SER 246 Cb 0.42 -1.54 0.00 0.00 -0.26 0.00 0.00 64.21 62.83 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 0.73 3.97 5.00 0.00 -1.26 -4.83 105.19 109.73 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 -2.71 2.68 0.46 1.61 4.02 -1.25 -0.59 115.29 119.50 2bwg s HIS 248 Ca 0.00 -0.03 0.14 0.00 1.02 0.00 0.00 55.06 56.19 2bwg s HIS 248 Cb 0.00 -2.80 1.03 0.00 -1.02 0.00 0.00 32.58 29.79 2bwg s HIS 248 CO 0.00 -1.01 2.01 1.15 1.02 0.00 0.00 174.74 177.91 2bwg h THR 249 N -0.04 1.11 0.00 1.30 2.02 -1.49 -2.46 112.91 113.36 2bwg h THR 249 Ca -0.41 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.24 2bwg h THR 249 Cb 1.29 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.97 2bwg h THR 249 CO 0.51 0.15 0.00 -0.33 0.37 0.00 0.00 175.52 176.22 2bwg h GLU 250 N 0.01 0.00 -6.92 6.66 3.07 -1.95 -3.46 114.58 112.00 2bwg h GLU 250 Ca 0.00 0.00 -0.49 0.00 -0.50 0.00 0.00 59.36 58.37 2bwg h GLU 250 Cb 0.27 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.20 2bwg h GLU 250 CO 0.02 0.00 0.43 0.00 -1.40 0.00 0.00 179.01 178.06 2bwg s ALA 252 N -1.53 3.61 0.00 0.00 0.00 -0.38 -4.84 121.76 118.61 2bwg s ALA 252 Ca 0.55 1.59 0.00 0.00 0.00 0.00 0.00 51.96 54.09 2bwg s ALA 252 Cb -0.25 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2bwg s ALA 252 CO 0.31 -1.06 0.00 0.41 0.00 0.00 0.00 175.76 175.42 2bwg n GLY 253 N 0.76 2.98 3.94 0.00 0.00 -1.26 -4.80 105.19 106.81 2bwg n GLY 253 Ca 0.02 -1.84 -0.24 0.00 0.00 0.00 0.00 46.02 43.96 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 -3.57 3.50 0.21 1.61 0.41 -1.26 -5.03 118.70 114.58 2bwg s GLU 254 Ca 0.00 -0.26 -0.30 0.00 -0.41 0.00 0.00 54.97 54.00 2bwg s GLU 254 Cb 0.00 -2.63 -0.08 0.00 -1.78 0.00 0.00 34.13 29.64 2bwg s GLU 254 CO 0.00 0.11 1.18 0.08 -0.49 0.00 0.00 175.26 176.14 2bwg s VAL 255 N -2.36 3.52 0.04 2.63 1.01 -1.26 -4.63 120.40 119.35 2bwg s VAL 255 Ca 0.41 1.34 -0.04 0.00 0.00 0.00 0.00 61.98 63.69 2bwg s VAL 255 Cb -0.10 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 2bwg s VAL 255 CO 0.37 0.24 0.25 -0.63 0.00 0.00 0.00 175.10 175.33 2bwg s ILE 256 N -0.36 5.33 -0.36 2.22 1.01 0.65 -4.91 121.20 124.79 2bwg s ILE 256 Ca 0.51 -0.05 -0.00 0.00 0.00 0.00 0.00 60.65 61.10 2bwg s ILE 256 Cb -0.33 -3.58 0.13 0.00 0.01 0.00 0.00 42.46 38.69 2bwg s ILE 256 CO 0.38 0.26 0.18 -1.61 0.00 0.00 0.00 174.94 174.15 2bwg s GLU 257 N -2.10 0.73 -0.14 2.79 2.02 -1.26 -1.14 118.70 119.60 2bwg s GLU 257 Ca 0.31 -1.35 0.01 0.00 0.02 0.00 0.00 54.97 53.96 2bwg s GLU 257 Cb -0.13 -1.70 0.02 0.00 0.10 0.00 0.00 34.13 32.42 2bwg s GLU 257 CO 0.21 -1.13 -0.14 0.50 0.02 0.00 0.00 175.26 174.72 2bwg s ARG 258 N 1.13 2.22 -1.18 1.61 3.52 -1.08 -4.88 118.95 120.29 2bwg s ARG 258 Ca 0.15 -0.53 -0.04 0.00 -0.13 0.00 0.00 55.73 55.18 2bwg s ARG 258 Cb -0.21 -2.02 0.00 0.00 -1.56 0.00 0.00 34.95 31.17 2bwg s ARG 258 CO -0.10 -0.20 1.00 0.09 -0.81 0.00 0.00 175.30 175.28 2bwg n ASN 259 N 4.66 -3.92 -2.51 -2.12 3.02 -1.26 -3.18 115.26 109.95 2bwg n ASN 259 Ca -0.17 -0.54 -0.14 0.00 -0.03 0.00 0.00 54.58 53.70 2bwg n ASN 259 Cb 0.50 -4.73 0.05 0.00 -0.61 0.00 0.00 39.78 35.00 2bwg n ASN 259 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bwg n GLY 260 N -1.49 -0.03 3.17 7.41 0.00 -1.26 -5.02 105.19 107.98 2bwg n GLY 260 Ca -0.14 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.69 2bwg n GLY 260 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bwg s ARG 261 N -5.51 0.26 -0.10 1.61 1.81 -1.19 -5.15 118.95 110.69 2bwg s ARG 261 Ca 0.25 0.90 -0.19 0.00 -1.72 0.00 0.00 55.73 54.96 2bwg s ARG 261 Cb -0.11 0.16 -0.04 0.00 -0.45 0.00 0.00 34.95 34.51 2bwg s ARG 261 CO 0.47 -0.25 0.51 0.15 -0.68 0.00 0.00 175.30 175.50 2bwg s LYS 262 N 2.38 4.34 0.05 3.54 3.01 -1.26 -2.64 119.74 129.16 2bwg s LYS 262 Ca -0.02 0.51 -0.03 0.00 -1.01 0.00 0.00 55.97 55.43 2bwg s LYS 262 Cb -0.12 -3.43 -0.03 0.00 -1.01 0.00 0.00 37.83 33.25 2bwg s LYS 262 CO -0.11 0.17 0.02 -0.51 0.51 0.00 0.00 175.35 175.43 2bwg s LEU 263 N 0.56 2.22 0.04 3.17 1.02 -0.29 -1.08 118.68 124.33 2bwg s LEU 263 Ca 0.28 -0.87 0.07 0.00 0.02 0.00 0.00 54.13 53.63 2bwg s LEU 263 Cb -0.16 0.38 -0.03 0.00 0.02 0.00 0.00 46.19 46.41 2bwg s LEU 263 CO 0.12 -0.60 -0.21 -0.54 0.02 0.00 0.00 176.35 175.14 2bwg s LYS 264 N -3.67 1.38 0.10 1.70 -0.14 -0.24 0.24 119.74 119.11 2bwg s LYS 264 Ca 0.04 -0.94 -0.28 0.00 -1.36 0.00 0.00 55.97 53.43 2bwg s LYS 264 Cb 0.06 -1.49 -0.06 0.00 -1.68 0.00 0.00 37.83 34.65 2bwg s LYS 264 CO -0.09 0.38 0.88 -1.17 -0.76 0.00 0.00 175.35 174.59 2bwg s LEU 265 N -1.19 4.50 -0.07 3.17 2.96 -1.26 -0.91 118.68 125.89 2bwg s LEU 265 Ca 0.07 1.68 0.00 0.00 -0.22 0.00 0.00 54.13 55.66 2bwg s LEU 265 Cb -0.09 -3.45 0.02 0.00 0.50 0.00 0.00 46.19 43.18 2bwg s LEU 265 CO 0.02 0.00 -0.05 0.12 -1.32 0.00 0.00 176.35 175.12 2bwg s PHE 266 N -0.21 0.95 0.04 5.38 5.99 0.74 -4.91 117.98 125.95 2bwg s PHE 266 Ca 0.43 -0.33 0.01 0.00 0.00 0.00 0.00 56.93 57.04 2bwg s PHE 266 Cb -0.23 -0.86 -0.02 0.00 0.00 0.00 0.00 43.02 41.91 2bwg s PHE 266 CO 0.27 -0.30 -0.06 1.52 -0.00 0.00 0.00 175.22 176.65 2bwg s TYR 267 N 1.32 0.57 0.56 10.12 1.13 -1.26 0.13 117.35 129.91 2bwg s TYR 267 Ca -0.04 -0.55 -0.21 0.00 -1.41 0.00 0.00 57.07 54.86 2bwg s TYR 267 Cb -0.14 -0.35 -0.05 0.00 -1.10 0.00 0.00 41.96 40.32 2bwg s TYR 267 CO -0.02 -0.12 1.19 0.41 -2.51 0.00 0.00 175.55 174.49 2bwg n GLY 268 N 1.37 0.29 0.25 5.49 0.00 0.66 -4.68 105.19 108.57 2bwg n GLY 268 Ca -0.22 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 45.82 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 1.04 0.10 -0.23 1.61 2.86 -1.92 -2.32 114.93 116.06 2bwg h MET 269 Ca -0.49 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.06 2bwg h MET 269 Cb 1.33 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.93 2bwg h MET 269 CO 0.55 0.15 -0.07 0.43 1.06 0.00 0.00 176.91 179.03 2bwg n SER 270 N -4.43 2.89 -4.69 1.22 7.64 -1.26 -4.81 113.62 110.18 2bwg n SER 270 Ca -0.02 -3.40 -0.29 0.00 1.01 0.00 0.00 58.87 56.17 2bwg n SER 270 Cb 0.16 -0.56 0.15 0.00 -1.01 0.00 0.00 64.21 62.95 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 -2.44 3.11 0.28 6.43 1.04 -0.87 -3.53 113.70 117.71 2bwg s SER 271 Ca 0.41 1.42 -0.01 0.00 0.48 0.00 0.00 55.95 58.25 2bwg s SER 271 Cb 0.36 -2.10 0.47 0.00 0.10 0.00 0.00 66.02 64.85 2bwg s SER 271 CO 0.03 -2.86 1.89 0.44 0.98 0.00 0.00 173.24 173.72 2bwg h ASP 272 N -1.70 0.98 -0.25 7.02 5.19 -1.89 -1.04 116.42 124.73 2bwg h ASP 272 Ca -0.51 0.01 0.02 0.00 -0.62 0.00 0.00 57.03 55.93 2bwg h ASP 272 Cb 1.30 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 40.58 2bwg h ASP 272 CO 0.55 0.63 0.11 0.74 -3.12 0.00 0.00 179.24 178.15 2bwg h THR 273 N 1.11 0.97 -0.48 0.35 2.02 -1.91 -0.43 112.91 114.55 2bwg h THR 273 Ca 0.42 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 67.45 2bwg h THR 273 Cb 0.19 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 2bwg h THR 273 CO -0.16 0.04 0.06 0.00 0.37 0.00 0.00 175.52 175.83 2bwg h ALA 274 N 1.14 0.64 -0.67 6.16 0.00 -1.72 -1.17 119.26 123.64 2bwg h ALA 274 Ca 0.11 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.82 2bwg h ALA 274 Cb 0.04 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 2bwg h ALA 274 CO -0.08 0.39 0.39 1.98 0.00 0.00 0.00 179.25 181.92 2bwg h MET 275 N 0.67 0.72 -0.23 0.00 -1.53 -0.85 0.28 114.93 114.00 2bwg h MET 275 Ca 0.14 -0.04 -0.17 0.00 -3.44 0.00 0.00 59.70 56.19 2bwg h MET 275 Cb 0.42 -0.16 -0.00 0.00 -0.55 0.00 0.00 31.60 31.31 2bwg h MET 275 CO 0.01 0.48 -0.53 -0.91 0.14 0.00 0.00 176.91 176.10 2bwg h ASN 276 N 0.74 0.75 0.41 1.39 2.35 -0.97 -3.23 115.58 117.03 2bwg h ASN 276 Ca 0.28 -0.40 -0.16 0.00 -0.55 0.00 0.00 56.30 55.48 2bwg h ASN 276 Cb 0.11 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 2bwg h ASN 276 CO -0.15 1.14 -0.68 0.50 -1.65 0.00 0.00 177.43 176.59 2bwg h LYS 277 N 0.53 0.24 0.00 0.81 3.64 -0.79 -3.51 116.57 117.49 2bwg h LYS 277 Ca 0.01 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 2bwg h LYS 277 Cb 1.10 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2bwg h LYS 277 CO 0.11 0.83 0.00 0.72 -2.27 0.00 0.00 179.45 178.84 2bwg n HIS 278 N -3.81 0.00 -3.22 1.91 8.25 0.96 -5.08 115.22 114.22 2bwg n HIS 278 Ca -0.03 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.28 2bwg n HIS 278 Cb 0.67 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.85 2bwg n HIS 278 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bwg n GLY 281 N 3.53 -0.22 0.00 -1.41 0.00 -1.26 -4.97 105.19 100.85 2bwg n GLY 281 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2bwg n GLY 281 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bwg n VAL 282 N -3.83 0.15 -0.00 1.61 0.24 -1.26 -4.92 118.33 110.32 2bwg n VAL 282 Ca -0.16 -0.18 -0.12 0.00 -2.04 0.00 0.00 64.34 61.84 2bwg n VAL 282 Cb 0.61 1.19 -0.06 0.00 -1.47 0.00 0.00 33.84 34.11 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 -0.56 -1.26 2.33 0.00 -1.91 -2.49 119.26 115.37 2bwg h ALA 283 Ca 0.00 -0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.37 2bwg h ALA 283 Cb 0.72 0.76 -0.42 0.00 0.00 0.00 0.00 17.79 18.85 2bwg h ALA 283 CO 0.00 -0.90 -0.83 -0.85 0.00 0.00 0.00 179.25 176.66 2bwg n GLU 284 N -5.43 3.05 0.02 0.00 0.00 -1.26 -4.73 120.64 112.28 2bwg n GLU 284 Ca -0.04 -4.22 -0.19 0.00 0.00 0.00 0.00 57.16 52.72 2bwg n GLU 284 Cb 0.36 -2.08 -0.11 0.00 0.00 0.00 0.00 31.44 29.61 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 2.57 0.81 -2.24 -1.84 3.20 -1.76 -1.38 116.97 116.34 2bwg h TYR 285 Ca 0.23 -0.44 -0.56 0.00 3.14 0.00 0.00 58.73 61.10 2bwg h TYR 285 Cb 1.08 -0.09 -0.14 0.00 1.54 0.00 0.00 36.73 39.13 2bwg h TYR 285 CO 0.76 1.27 -0.67 1.03 -1.64 0.00 0.00 178.16 178.91 2bwg s ARG 286 N -3.26 1.71 0.57 1.82 1.81 -1.26 -2.61 118.95 117.73 2bwg s ARG 286 Ca -0.12 -1.89 0.33 0.00 -1.72 0.00 0.00 55.73 52.34 2bwg s ARG 286 Cb 0.05 -1.45 1.69 0.00 -0.45 0.00 0.00 34.95 34.79 2bwg s ARG 286 CO 0.87 0.07 2.13 0.00 -0.68 0.00 0.00 175.30 177.70 2bwg h ALA 287 N 2.11 1.16 -2.69 2.13 0.00 -1.73 -3.39 119.26 116.85 2bwg h ALA 287 Ca -0.41 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.27 2bwg h ALA 287 Cb 1.24 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.84 2bwg h ALA 287 CO 0.70 0.07 -0.70 -1.54 0.00 0.00 0.00 179.25 177.78 2bwg s SER 288 N -5.80 0.52 -0.33 0.00 1.04 -1.26 -4.89 113.70 102.98 2bwg s SER 288 Ca -0.03 -0.73 -0.29 0.00 0.48 0.00 0.00 55.95 55.39 2bwg s SER 288 Cb 0.12 0.12 0.01 0.00 0.10 0.00 0.00 66.02 66.37 2bwg s SER 288 CO 0.53 -0.40 1.24 -1.61 0.98 0.00 0.00 173.24 173.98 2bwg s GLU 289 N -2.54 3.92 0.71 4.02 2.02 -1.26 -4.54 118.70 121.02 2bwg s GLU 289 Ca -0.04 1.12 -0.09 0.00 0.02 0.00 0.00 54.97 55.98 2bwg s GLU 289 Cb -0.02 -3.86 0.04 0.00 0.10 0.00 0.00 34.13 30.39 2bwg s GLU 289 CO -0.04 -1.12 1.06 0.20 0.02 0.00 0.00 175.26 175.38 2bwg s GLY 290 N 2.55 1.63 0.73 -1.39 0.00 -1.23 -4.52 107.32 105.09 2bwg s GLY 290 Ca 0.53 -0.65 -0.12 0.00 0.00 0.00 0.00 44.72 44.49 2bwg s GLY 290 CO 0.23 -0.26 1.09 0.54 0.00 0.00 0.00 173.10 174.70 2bwg s LYS 291 N -5.31 2.48 -0.20 2.90 1.02 0.10 -4.22 119.74 116.52 2bwg s LYS 291 Ca 0.59 1.20 -0.01 0.00 0.02 0.00 0.00 55.97 57.76 2bwg s LYS 291 Cb -0.11 -1.92 0.01 0.00 -0.52 0.00 0.00 37.83 35.28 2bwg s LYS 291 CO 0.48 -1.47 -0.12 0.99 -0.92 0.00 0.00 175.35 174.30 2bwg s THR 292 N -2.77 2.72 0.16 2.17 2.01 -1.26 -0.25 115.64 118.42 2bwg s THR 292 Ca 0.62 -0.72 0.10 0.00 0.31 0.00 0.00 61.69 62.00 2bwg s THR 292 Cb -0.18 -2.20 -0.04 0.00 0.01 0.00 0.00 72.50 70.10 2bwg s THR 292 CO 0.52 0.48 -0.22 0.68 -0.69 0.00 0.00 174.62 175.39 2bwg s VAL 293 N 1.34 2.06 -0.25 3.82 -7.23 0.12 -4.99 120.40 115.27 2bwg s VAL 293 Ca 0.05 -1.88 -0.16 0.00 -1.81 0.00 0.00 61.98 58.17 2bwg s VAL 293 Cb -0.14 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.85 2bwg s VAL 293 CO -0.07 -0.15 0.44 -1.61 -0.31 0.00 0.00 175.10 173.40 2bwg s GLU 294 N -2.51 4.07 -0.09 4.82 2.02 -1.26 -0.19 118.70 125.57 2bwg s GLU 294 Ca 0.16 0.20 -0.02 0.00 0.02 0.00 0.00 54.97 55.34 2bwg s GLU 294 Cb -0.08 -3.63 -0.03 0.00 0.10 0.00 0.00 34.13 30.49 2bwg s GLU 294 CO 0.07 -0.26 -0.00 0.54 0.02 0.00 0.00 175.26 175.63 2bwg s VAL 295 N 2.01 4.28 0.12 2.63 0.11 -0.09 -4.94 120.40 124.52 2bwg s VAL 295 Ca 0.19 -0.26 -0.35 0.00 -2.93 0.00 0.00 61.98 58.63 2bwg s VAL 295 Cb -0.16 -2.80 -0.17 0.00 -1.53 0.00 0.00 36.38 31.73 2bwg s VAL 295 CO 0.09 0.60 1.21 -2.65 -3.33 0.00 0.00 175.10 171.02 2bwg n PRO 296 N 2.16 0.99 -1.81 1.54 -0.02 -1.26 -1.08 135.00 135.52 2bwg n PRO 296 Ca -0.19 0.35 -0.42 0.00 -2.02 0.00 0.00 63.50 61.22 2bwg n PRO 296 Cb 0.54 -1.90 -0.03 0.00 -0.02 0.00 0.00 33.50 32.09 2bwg n PRO 296 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2bwg s TYR 297 N 0.09 1.55 -0.69 6.00 5.04 -0.24 -4.72 117.35 124.38 2bwg s TYR 297 Ca 0.80 0.04 0.23 0.00 -2.44 0.00 0.00 57.07 55.70 2bwg s TYR 297 Cb -0.94 -4.07 0.08 0.00 0.35 0.00 0.00 41.96 37.37 2bwg s TYR 297 CO 0.51 -4.46 1.06 1.63 -1.34 0.00 0.00 175.55 172.94 2bwg n LYS 298 N 7.71 0.23 0.00 4.97 5.02 0.24 -4.97 118.16 131.36 2bwg n LYS 298 Ca 0.21 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2bwg n LYS 298 Cb 0.43 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 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 1.40 -0.70 3.76 0.72 0.00 -1.25 -4.93 105.19 104.19 2bwg n GLY 299 Ca 0.03 -1.58 -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 7.00 0.50 1.61 1.01 -1.26 -1.17 116.67 120.36 2bwg s ASP 300 Ca 0.00 2.43 0.29 0.00 0.71 0.00 0.00 52.55 55.98 2bwg s ASP 300 Cb 0.00 -2.63 1.13 0.00 1.01 0.00 0.00 42.92 42.43 2bwg s ASP 300 CO 0.00 -0.35 1.90 1.62 0.21 0.00 0.00 175.17 178.55 2bwg h VAL 301 N 2.97 0.20 -0.83 -1.27 3.04 -1.94 -3.16 116.25 115.25 2bwg h VAL 301 Ca -0.48 -0.76 0.12 0.00 -1.01 0.00 0.00 66.70 64.57 2bwg h VAL 301 Cb 1.22 1.64 -0.14 0.00 -2.01 0.00 0.00 31.29 32.00 2bwg h VAL 301 CO 0.66 0.08 -0.41 -0.08 -1.01 0.00 0.00 177.57 176.81 2bwg h GLU 302 N 0.00 -0.08 -0.72 4.17 4.57 -1.99 -0.30 114.58 120.22 2bwg h GLU 302 Ca -0.00 0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.22 2bwg h GLU 302 Cb 0.63 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.19 2bwg h GLU 302 CO 0.01 -0.05 0.45 -0.91 -1.18 0.00 0.00 179.01 177.33 2bwg h ASN 303 N -0.08 0.72 -0.37 1.04 2.35 -1.96 -0.77 115.58 116.52 2bwg h ASN 303 Ca 0.27 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 56.01 2bwg h ASN 303 Cb 0.56 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 2bwg h ASN 303 CO -0.86 0.49 0.18 0.74 -1.65 0.00 0.00 177.43 176.33 2bwg h THR 304 N 0.86 1.17 -0.33 2.81 2.02 -1.37 -2.07 112.91 116.00 2bwg h THR 304 Ca 0.30 -0.48 0.07 0.00 0.77 0.00 0.00 66.41 67.07 2bwg h THR 304 Cb 0.06 0.80 -0.07 0.00 -1.74 0.00 0.00 68.15 67.20 2bwg h THR 304 CO -0.13 0.18 -0.12 0.40 0.37 0.00 0.00 175.52 176.22 2bwg h ILE 305 N 0.46 0.59 -0.47 3.11 2.04 -0.53 -0.83 117.51 121.87 2bwg h ILE 305 Ca 0.13 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 2bwg h ILE 305 Cb 0.12 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2bwg h ILE 305 CO -0.02 0.00 0.19 -0.07 0.00 0.00 0.00 178.15 178.26 2bwg h LEU 306 N -0.06 0.61 -0.49 1.44 3.38 -1.00 -0.21 115.31 118.99 2bwg h LEU 306 Ca 0.17 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 2bwg h LEU 306 Cb 0.31 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2bwg h LEU 306 CO -0.37 0.55 -0.02 0.44 0.09 0.00 0.00 178.44 179.13 2bwg h ASP 307 N 0.67 0.87 0.26 -0.43 3.32 -0.87 0.39 116.42 120.62 2bwg h ASP 307 Ca 0.16 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 2bwg h ASP 307 Cb 0.13 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.45 2bwg h ASP 307 CO -0.02 0.97 -0.13 0.40 -1.72 0.00 0.00 179.24 178.75 2bwg h ILE 308 N 0.74 0.78 -0.37 0.35 2.04 -0.30 -1.48 117.51 119.27 2bwg h ILE 308 Ca 0.14 -0.55 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 2bwg h ILE 308 Cb 0.54 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2bwg h ILE 308 CO 0.03 0.11 0.17 -0.07 0.00 0.00 0.00 178.15 178.40 2bwg h LEU 309 N -0.65 0.49 -0.47 1.44 3.38 -1.15 -1.80 115.31 116.56 2bwg h LEU 309 Ca -0.04 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.84 2bwg h LEU 309 Cb 0.46 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2bwg h LEU 309 CO 0.06 0.49 0.25 1.23 0.09 0.00 0.00 178.44 180.55 2bwg h GLY 310 N 0.46 0.65 2.00 0.83 0.00 -0.93 -0.76 103.07 105.32 2bwg h GLY 310 Ca 0.13 -0.17 -0.06 0.00 0.00 0.00 0.00 47.33 47.22 2bwg h GLY 310 CO -0.02 0.13 -0.30 -1.33 0.00 0.00 0.00 176.54 175.02 2bwg h GLY 311 N 0.49 0.00 1.86 4.60 0.00 -1.13 -1.40 103.07 107.48 2bwg h GLY 311 Ca 0.20 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.37 2bwg h GLY 311 CO -0.13 0.00 -0.83 -2.00 0.00 0.00 0.00 176.54 173.58 2bwg h LEU 312 N 0.00 0.00 -0.26 3.11 5.85 -0.95 -1.65 115.31 121.41 2bwg h LEU 312 Ca -0.00 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 2bwg h LEU 312 Cb 0.58 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 2bwg h LEU 312 CO 0.04 0.72 -0.13 0.03 -0.34 0.00 0.00 178.44 178.76 2bwg h ARG 313 N 0.00 0.55 0.02 1.25 3.08 -0.85 -2.27 114.38 116.16 2bwg h ARG 313 Ca -0.03 -0.24 0.01 0.00 0.07 0.00 0.00 59.98 59.78 2bwg h ARG 313 Cb 1.58 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.60 2bwg h ARG 313 CO 0.09 0.81 -0.05 0.77 -1.07 0.00 0.00 179.97 180.51 2bwg h SER 314 N 0.28 -0.15 -0.58 7.04 0.02 -1.26 0.25 113.55 119.15 2bwg h SER 314 Ca 0.06 0.02 0.12 0.00 -0.84 0.00 0.00 61.79 61.15 2bwg h SER 314 Cb 0.64 0.06 -0.10 0.00 0.14 0.00 0.00 62.40 63.14 2bwg h SER 314 CO 0.04 -0.08 -0.08 0.74 -1.14 0.00 0.00 176.83 176.31 2bwg h THR 315 N -0.10 0.47 -0.54 -2.27 2.02 -1.30 -0.04 112.91 111.14 2bwg h THR 315 Ca 0.02 -0.02 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 2bwg h THR 315 Cb 0.12 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 2bwg h THR 315 CO -0.04 0.01 0.20 0.00 0.37 0.00 0.00 175.52 176.06 2bwg h THR 317 N 0.75 0.73 0.00 0.00 2.02 -0.19 0.87 112.91 117.08 2bwg h THR 317 Ca 0.18 -0.01 -0.04 0.00 0.77 0.00 0.00 66.41 67.31 2bwg h THR 317 Cb 0.23 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 2bwg h THR 317 CO -0.01 0.01 -0.19 1.88 0.37 0.00 0.00 175.52 177.58 2bwg h TYR 318 N 0.04 0.00 -0.01 3.16 0.05 -0.40 -2.38 116.97 117.43 2bwg h TYR 318 Ca 0.15 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.93 2bwg h TYR 318 Cb 0.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.95 2bwg h TYR 318 CO -0.26 0.19 -0.65 1.33 -1.05 0.00 0.00 178.16 177.72 2bwg n VAL 319 N -3.31 0.00 -1.02 -2.88 0.24 -0.56 -0.45 118.33 110.36 2bwg n VAL 319 Ca 0.01 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 2bwg n VAL 319 Cb 0.43 1.09 0.00 0.00 -1.47 0.00 0.00 33.84 33.89 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 1.06 3.36 7.63 0.00 -0.45 -4.46 105.19 113.77 2bwg n GLY 320 Ca 0.07 -0.50 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 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 3.23 -0.54 4.61 0.00 0.29 -4.94 121.76 122.40 2bwg s ALA 321 Ca 0.00 -1.70 0.25 0.00 0.00 0.00 0.00 51.96 50.51 2bwg s ALA 321 Cb 0.00 -2.51 0.67 0.00 0.00 0.00 0.00 23.12 21.28 2bwg s ALA 321 CO 0.00 -1.34 1.72 0.00 0.00 0.00 0.00 175.76 176.14 2bwg h ALA 322 N 8.38 1.00 -4.07 0.00 0.00 -1.95 -3.36 119.26 119.26 2bwg h ALA 322 Ca -0.26 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.22 2bwg h ALA 322 Cb 1.10 0.00 -0.29 0.00 0.00 0.00 0.00 17.79 18.60 2bwg h ALA 322 CO 0.65 0.00 -0.79 0.15 0.00 0.00 0.00 179.25 179.26 2bwg s LYS 323 N -3.20 0.91 0.54 0.00 1.02 -1.26 -1.47 119.74 116.29 2bwg s LYS 323 Ca 0.08 -0.39 0.34 0.00 0.02 0.00 0.00 55.97 56.02 2bwg s LYS 323 Cb 0.09 -0.88 1.51 0.00 -0.52 0.00 0.00 37.83 38.04 2bwg s LYS 323 CO 0.61 0.22 1.85 1.25 -0.92 0.00 0.00 175.35 178.36 2bwg h LEU 324 N 5.93 0.00 -0.87 3.17 5.85 -1.46 0.20 115.31 128.13 2bwg h LEU 324 Ca -0.32 0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.56 2bwg h LEU 324 Cb 1.17 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 42.10 2bwg h LEU 324 CO 0.49 0.00 0.44 0.50 -0.34 0.00 0.00 178.44 179.53 2bwg h LYS 325 N 0.00 0.57 0.00 1.25 3.64 -1.86 -2.73 116.57 117.44 2bwg h LYS 325 Ca 0.49 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.83 2bwg h LYS 325 Cb 1.96 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.65 2bwg h LYS 325 CO -0.01 0.38 0.00 0.39 -2.27 0.00 0.00 179.45 177.94 2bwg n GLU 326 N -4.90 0.07 0.21 1.90 1.02 0.68 -4.28 120.64 115.35 2bwg n GLU 326 Ca 0.19 0.02 -0.15 0.00 -0.02 0.00 0.00 57.16 57.20 2bwg n GLU 326 Cb 0.49 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.34 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 -0.59 -0.91 -4.62 5.85 -1.55 -1.66 115.31 111.82 2bwg h LEU 327 Ca 0.00 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2bwg h LEU 327 Cb 0.44 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 2bwg h LEU 327 CO 0.00 -0.36 0.30 0.77 -0.34 0.00 0.00 178.44 178.81 2bwg h SER 328 N -0.56 1.00 -0.64 1.25 4.64 -1.74 0.62 113.55 118.13 2bwg h SER 328 Ca -0.03 -0.14 0.04 0.00 -0.47 0.00 0.00 61.79 61.18 2bwg h SER 328 Cb 0.47 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 62.27 2bwg h SER 328 CO 0.01 0.88 0.42 0.03 -0.87 0.00 0.00 176.83 177.31 2bwg h ARG 329 N 1.07 0.71 -0.13 4.77 3.08 -1.75 -2.87 114.38 119.25 2bwg h ARG 329 Ca 0.25 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2bwg h ARG 329 Cb 0.19 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2bwg h ARG 329 CO -0.02 0.47 0.00 0.54 -1.07 0.00 0.00 179.97 179.89 2bwg n ARG 330 N -4.46 1.91 -2.63 0.04 1.74 -0.10 -4.90 116.66 108.25 2bwg n ARG 330 Ca 0.08 -1.81 -0.43 0.00 -0.77 0.00 0.00 57.85 54.92 2bwg n ARG 330 Cb 0.15 -1.39 -0.02 0.00 -1.02 0.00 0.00 32.46 30.18 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 -1.51 3.52 -0.14 7.54 0.00 0.20 -4.92 121.76 126.44 2bwg s ALA 331 Ca 0.26 -0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.23 2bwg s ALA 331 Cb 0.17 -3.66 0.01 0.00 0.00 0.00 0.00 23.12 19.64 2bwg s ALA 331 CO 0.25 -1.44 -0.20 0.99 0.00 0.00 0.00 175.76 175.36 2bwg s THR 332 N 3.62 2.23 0.10 0.00 2.01 -1.26 -4.97 115.64 117.38 2bwg s THR 332 Ca 0.46 -0.92 -0.06 0.00 0.31 0.00 0.00 61.69 61.47 2bwg s THR 332 Cb -0.13 -1.90 -0.05 0.00 0.01 0.00 0.00 72.50 70.42 2bwg s THR 332 CO 0.14 0.54 0.36 -0.36 -0.69 0.00 0.00 174.62 174.61 2bwg s PHE 333 N 0.78 3.52 0.02 4.92 0.08 -1.26 -1.24 117.98 124.79 2bwg s PHE 333 Ca -0.07 0.60 0.06 0.00 0.12 0.00 0.00 56.93 57.64 2bwg s PHE 333 Cb -0.16 -2.03 -0.03 0.00 -0.57 0.00 0.00 43.02 40.23 2bwg s PHE 333 CO -0.01 0.49 -0.17 0.96 -0.10 0.00 0.00 175.22 176.39 2bwg s ILE 334 N -1.53 2.84 0.04 0.64 -4.36 0.43 -4.92 121.20 114.34 2bwg s ILE 334 Ca 0.37 -1.06 -0.29 0.00 -0.26 0.00 0.00 60.65 59.41 2bwg s ILE 334 Cb -0.13 -2.16 -0.04 0.00 1.25 0.00 0.00 42.46 41.37 2bwg s ILE 334 CO 0.22 0.41 0.92 -0.13 0.24 0.00 0.00 174.94 176.60 2bwg s ARG 335 N -1.23 4.59 0.41 0.37 0.52 -1.26 -1.52 118.95 120.82 2bwg s ARG 335 Ca 0.14 1.33 0.03 0.00 -0.52 0.00 0.00 55.73 56.72 2bwg s ARG 335 Cb -0.11 -3.41 -0.03 0.00 0.52 0.00 0.00 34.95 31.92 2bwg s ARG 335 CO 0.04 0.10 0.09 0.14 0.02 0.00 0.00 175.30 175.69 2bwg s VAL 336 N 0.47 0.88 -0.12 3.52 -7.23 0.12 -4.94 120.40 113.10 2bwg s VAL 336 Ca 0.47 -2.00 0.14 0.00 -1.81 0.00 0.00 61.98 58.77 2bwg s VAL 336 Cb -0.21 -2.44 -0.19 0.00 0.56 0.00 0.00 36.38 34.09 2bwg s VAL 336 CO 0.27 0.00 0.11 0.35 -0.31 0.00 0.00 175.10 175.52 2bwg n THR 337 N -0.92 0.82 -0.85 5.32 -2.24 -1.26 -4.78 114.28 110.36 2bwg n THR 337 Ca -0.07 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 2bwg n THR 337 Cb 0.66 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 2bwg n THR 337 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50