#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b37 s GLY 3 N 0.00 1.65 0.51 3.38 0.00 -1.23 -4.96 107.32 106.67 2b37 s GLY 3 Ca 0.00 -0.87 0.41 0.00 0.00 0.00 0.00 44.72 44.26 2b37 s GLY 3 CO 0.00 -0.57 1.61 1.41 0.00 0.00 0.00 173.10 175.55 2b37 h LEU 4 N -0.20 0.09 -4.83 0.66 3.38 -1.96 -2.59 115.31 109.86 2b37 h LEU 4 Ca -0.45 0.06 -0.63 0.00 0.09 0.00 0.00 57.88 56.95 2b37 h LEU 4 Cb 1.28 0.06 -0.39 0.00 0.09 0.00 0.00 40.66 41.69 2b37 h LEU 4 CO 0.59 -0.08 -0.35 0.18 0.09 0.00 0.00 178.44 178.87 2b37 n LEU 5 N -4.27 5.23 -4.72 1.67 4.32 -1.05 -4.70 117.00 113.48 2b37 n LEU 5 Ca 0.40 -5.26 -0.42 0.00 -0.02 0.00 0.00 56.01 50.71 2b37 n LEU 5 Cb 1.73 -0.61 -0.04 0.00 -1.62 0.00 0.00 43.42 42.89 2b37 n LEU 5 CO 0.34 2.18 0.77 -1.81 -1.22 0.00 0.00 177.39 177.65 2b37 s ASP 6 N -3.04 7.28 -0.67 -1.43 1.01 -0.98 -0.65 116.67 118.19 2b37 s ASP 6 Ca 0.48 1.90 0.00 0.00 0.71 0.00 0.00 52.55 55.65 2b37 s ASP 6 Cb 0.37 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.72 2b37 s ASP 6 CO -0.21 -0.27 0.00 0.61 0.21 0.00 0.00 175.17 175.51 2b37 n GLY 7 N 2.64 0.86 3.58 0.21 0.00 -1.26 -4.97 105.19 106.23 2b37 n GLY 7 Ca 0.05 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 2b37 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b37 s LYS 8 N -2.29 3.86 -0.37 1.61 1.02 -1.24 -4.98 119.74 117.36 2b37 s LYS 8 Ca 0.00 -0.40 -0.16 0.00 0.02 0.00 0.00 55.97 55.43 2b37 s LYS 8 Cb 0.00 -3.17 -0.00 0.00 -0.52 0.00 0.00 37.83 34.14 2b37 s LYS 8 CO 0.00 0.20 0.40 1.03 -0.92 0.00 0.00 175.35 176.05 2b37 s ARG 9 N 0.56 3.42 -0.15 1.68 0.52 -1.26 0.07 118.95 123.80 2b37 s ARG 9 Ca 0.02 -0.50 0.01 0.00 -0.52 0.00 0.00 55.73 54.73 2b37 s ARG 9 Cb -0.13 -3.85 0.02 0.00 0.52 0.00 0.00 34.95 31.50 2b37 s ARG 9 CO 0.01 -0.63 -0.16 0.42 0.02 0.00 0.00 175.30 174.97 2b37 s ILE 10 N 2.08 1.65 0.17 1.52 1.01 -0.44 -1.19 121.20 126.01 2b37 s ILE 10 Ca 0.12 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.78 2b37 s ILE 10 Cb -0.17 -1.53 -0.07 0.00 0.01 0.00 0.00 42.46 40.70 2b37 s ILE 10 CO 0.12 0.47 1.07 -0.22 0.00 0.00 0.00 174.94 176.38 2b37 s LEU 11 N 1.33 4.50 -0.17 2.97 2.96 -0.54 -1.74 118.68 128.00 2b37 s LEU 11 Ca 0.02 2.03 -0.04 0.00 -0.22 0.00 0.00 54.13 55.93 2b37 s LEU 11 Cb -0.13 -3.60 0.06 0.00 0.50 0.00 0.00 46.19 43.01 2b37 s LEU 11 CO -0.09 -0.18 0.07 -0.69 -1.32 0.00 0.00 176.35 174.14 2b37 s VAL 12 N -0.25 0.10 0.36 1.68 1.01 0.78 -0.93 120.40 123.15 2b37 s VAL 12 Ca 0.49 -0.22 0.06 0.00 0.00 0.00 0.00 61.98 62.30 2b37 s VAL 12 Cb -0.28 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.42 2b37 s VAL 12 CO 0.34 -0.21 0.51 -0.94 0.00 0.00 0.00 175.10 174.80 2b37 s SER 13 N 2.06 5.91 0.00 3.32 1.04 -1.04 -1.76 113.70 123.23 2b37 s SER 13 Ca 0.01 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.32 2b37 s SER 13 Cb -0.16 -1.23 0.00 0.00 0.10 0.00 0.00 66.02 64.73 2b37 s SER 13 CO -0.08 -0.51 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2b37 n GLY 14 N -1.74 2.72 3.59 7.32 0.00 -1.26 -3.99 105.19 111.84 2b37 n GLY 14 Ca 0.01 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.57 2b37 n GLY 14 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2b37 n ILE 15 N -1.64 0.43 0.00 -0.61 5.41 -1.26 -4.52 119.36 117.17 2b37 n ILE 15 Ca 0.00 -0.28 0.00 0.00 1.00 0.00 0.00 62.75 63.47 2b37 n ILE 15 Cb 0.00 -2.13 0.00 0.00 -0.71 0.00 0.00 39.64 36.80 2b37 n ILE 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2b37 n ILE 16 N 6.63 0.00 -4.55 1.39 0.13 -1.26 -4.84 119.36 116.86 2b37 n ILE 16 Ca 0.29 0.00 -0.25 0.00 -1.10 0.00 0.00 62.75 61.69 2b37 n ILE 16 Cb 0.35 -0.58 -0.11 0.00 -0.84 0.00 0.00 39.64 38.47 2b37 n ILE 16 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2b37 s THR 17 N -1.72 1.81 -1.50 9.51 -4.23 -1.26 -4.64 115.64 113.61 2b37 s THR 17 Ca 0.00 -2.05 0.24 0.00 -1.18 0.00 0.00 61.69 58.70 2b37 s THR 17 Cb 0.00 -2.83 0.45 0.00 1.34 0.00 0.00 72.50 71.46 2b37 s THR 17 CO 0.00 -0.07 1.80 -0.90 -0.54 0.00 0.00 174.62 174.91 2b37 n ASP 18 N -0.83 0.00 -0.71 3.99 5.75 -1.26 -2.33 116.55 121.16 2b37 n ASP 18 Ca -0.04 -0.14 0.07 0.00 -0.01 0.00 0.00 54.79 54.67 2b37 n ASP 18 Cb 0.66 -0.25 0.13 0.00 -1.03 0.00 0.00 41.12 40.62 2b37 n ASP 18 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2b37 n SER 19 N -1.25 2.69 -4.78 -1.12 2.88 -1.26 -4.83 113.62 105.94 2b37 n SER 19 Ca 0.12 -1.79 -0.33 0.00 -1.33 0.00 0.00 58.87 55.54 2b37 n SER 19 Cb 0.18 -0.14 0.02 0.00 -0.75 0.00 0.00 64.21 63.52 2b37 n SER 19 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2b37 s SER 20 N -1.13 5.54 0.25 -3.46 0.01 -0.98 -4.76 113.70 109.16 2b37 s SER 20 Ca 0.23 1.95 0.12 0.00 1.31 0.00 0.00 55.95 59.57 2b37 s SER 20 Cb 0.14 -2.55 0.17 0.00 0.21 0.00 0.00 66.02 63.99 2b37 s SER 20 CO 0.20 -1.33 1.49 0.40 0.41 0.00 0.00 173.24 174.40 2b37 h ILE 21 N 0.47 1.27 0.00 1.44 2.04 -1.90 -2.51 117.51 118.32 2b37 h ILE 21 Ca -0.47 -2.45 -0.02 0.00 1.00 0.00 0.00 64.86 62.92 2b37 h ILE 21 Cb 1.24 2.40 -0.00 0.00 -0.74 0.00 0.00 36.82 39.71 2b37 h ILE 21 CO 0.56 0.65 -0.11 0.00 0.00 0.00 0.00 178.15 179.25 2b37 h ALA 22 N 1.34 1.47 0.24 1.87 0.00 -1.84 -1.20 119.26 121.13 2b37 h ALA 22 Ca -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2b37 h ALA 22 Cb 1.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2b37 h ALA 22 CO 0.09 0.14 -0.11 0.35 0.00 0.00 0.00 179.25 179.71 2b37 h PHE 23 N 0.00 -0.29 -0.44 0.00 3.57 -1.72 -2.67 116.94 115.38 2b37 h PHE 23 Ca -0.00 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.52 2b37 h PHE 23 Cb 0.26 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 2b37 h PHE 23 CO 0.00 -0.05 0.29 0.45 -2.23 0.00 0.00 178.31 176.77 2b37 h HIS 24 N -1.04 0.49 -0.04 0.41 3.86 -1.47 0.29 115.15 117.65 2b37 h HIS 24 Ca -0.03 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2b37 h HIS 24 Cb 0.37 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 28.68 2b37 h HIS 24 CO 0.03 0.29 0.01 0.82 0.86 0.00 0.00 177.93 179.94 2b37 h ILE 25 N 0.51 1.20 -0.80 2.45 2.04 -1.34 -1.34 117.51 120.24 2b37 h ILE 25 Ca 0.17 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 2b37 h ILE 25 Cb 0.07 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 2b37 h ILE 25 CO -0.04 0.16 0.38 0.00 0.00 0.00 0.00 178.15 178.65 2b37 h ALA 26 N 0.77 1.03 -0.55 1.87 0.00 -0.88 0.71 119.26 122.20 2b37 h ALA 26 Ca 0.01 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 2b37 h ALA 26 Cb 0.26 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2b37 h ALA 26 CO 0.00 0.60 0.00 -0.09 0.00 0.00 0.00 179.25 179.76 2b37 h ARG 27 N 1.13 0.98 -0.26 0.00 2.43 -0.49 -2.66 114.38 115.50 2b37 h ARG 27 Ca 0.27 -0.31 -0.19 0.00 -0.81 0.00 0.00 59.98 58.94 2b37 h ARG 27 Cb 0.13 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 2b37 h ARG 27 CO -0.03 0.98 -0.58 0.28 -1.51 0.00 0.00 179.97 179.10 2b37 h VAL 28 N 0.86 1.28 0.29 0.20 2.07 -0.83 -1.73 116.25 118.39 2b37 h VAL 28 Ca 0.16 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.92 2b37 h VAL 28 Cb 0.53 1.70 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 2b37 h VAL 28 CO 0.03 0.57 -0.49 0.00 0.02 0.00 0.00 177.57 177.70 2b37 h ALA 29 N 0.65 -0.99 -0.69 1.67 0.00 -0.82 -2.13 119.26 116.95 2b37 h ALA 29 Ca 0.00 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 54.84 2b37 h ALA 29 Cb 1.19 0.77 -0.04 0.00 0.00 0.00 0.00 17.79 19.71 2b37 h ALA 29 CO 0.13 -1.11 0.45 1.96 0.00 0.00 0.00 179.25 180.68 2b37 h GLN 30 N -0.84 0.67 0.00 0.00 4.20 -1.48 0.19 115.11 117.85 2b37 h GLN 30 Ca -0.02 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2b37 h GLN 30 Cb 0.79 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.42 2b37 h GLN 30 CO -0.17 0.44 0.00 -1.91 -0.67 0.00 0.00 178.83 176.52 2b37 n GLU 31 N -4.48 0.07 -0.01 1.46 2.13 -0.65 -2.18 120.64 116.98 2b37 n GLU 31 Ca 0.10 0.50 0.01 0.00 0.66 0.00 0.00 57.16 58.43 2b37 n GLU 31 Cb 0.24 -1.70 0.01 0.00 0.27 0.00 0.00 31.44 30.26 2b37 n GLU 31 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2b37 n GLN 32 N -1.84 1.26 0.00 5.31 1.13 0.65 -4.90 117.38 118.99 2b37 n GLN 32 Ca 0.00 -1.11 0.00 0.00 -1.94 0.00 0.00 57.00 53.96 2b37 n GLN 32 Cb 0.06 -1.02 0.00 0.00 0.11 0.00 0.00 30.24 29.39 2b37 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2b37 n GLY 33 N -0.20 2.35 3.66 1.08 0.00 -0.93 -2.53 105.19 108.62 2b37 n GLY 33 Ca 0.01 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.57 2b37 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b37 n ALA 34 N -0.51 0.86 -2.65 4.61 0.00 0.18 -4.36 120.51 118.64 2b37 n ALA 34 Ca 0.00 0.43 -0.39 0.00 0.00 0.00 0.00 53.44 53.48 2b37 n ALA 34 Cb 0.00 -2.26 -0.07 0.00 0.00 0.00 0.00 19.45 17.12 2b37 n ALA 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2b37 s GLN 35 N -0.07 4.14 0.13 0.00 -0.44 0.11 -4.08 119.66 119.46 2b37 s GLN 35 Ca 0.72 0.30 0.02 0.00 -2.50 0.00 0.00 55.36 53.90 2b37 s GLN 35 Cb -0.69 -3.58 -0.04 0.00 -1.64 0.00 0.00 33.01 27.06 2b37 s GLN 35 CO 0.47 -0.17 0.25 -0.51 0.50 0.00 0.00 175.29 175.84 2b37 s LEU 36 N 1.71 4.29 -0.11 3.68 1.43 -1.26 -1.32 118.68 127.09 2b37 s LEU 36 Ca 0.21 0.16 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 2b37 s LEU 36 Cb -0.15 -2.87 0.01 0.00 0.03 0.00 0.00 46.19 43.21 2b37 s LEU 36 CO 0.09 0.08 -0.16 -0.69 0.23 0.00 0.00 176.35 175.90 2b37 s VAL 37 N -1.69 1.56 0.06 -1.59 1.01 -0.71 -4.33 120.40 114.70 2b37 s VAL 37 Ca 0.34 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.67 2b37 s VAL 37 Cb -0.11 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2b37 s VAL 37 CO 0.28 0.45 0.06 -0.76 0.00 0.00 0.00 175.10 175.13 2b37 s LEU 38 N 0.95 3.75 0.12 3.92 1.43 -1.26 -0.16 118.68 127.43 2b37 s LEU 38 Ca -0.07 -0.00 0.07 0.00 -1.03 0.00 0.00 54.13 53.10 2b37 s LEU 38 Cb -0.15 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 2b37 s LEU 38 CO -0.01 0.20 -0.18 0.42 0.23 0.00 0.00 176.35 177.01 2b37 s THR 39 N -1.31 1.59 0.05 5.49 -4.23 -0.72 0.12 115.64 116.62 2b37 s THR 39 Ca 0.27 -1.62 0.02 0.00 -1.18 0.00 0.00 61.69 59.17 2b37 s THR 39 Cb -0.12 -1.55 -0.03 0.00 1.34 0.00 0.00 72.50 72.15 2b37 s THR 39 CO 0.19 -0.20 -0.07 -0.83 -0.54 0.00 0.00 174.62 173.16 2b37 s GLY 40 N -2.15 0.53 0.00 3.99 0.00 0.53 -4.02 107.32 106.20 2b37 s GLY 40 Ca 0.08 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 43.95 2b37 s GLY 40 CO 0.04 -0.91 0.00 0.33 0.00 0.00 0.00 173.10 172.56 2b37 n PHE 41 N 1.23 0.00 -0.04 1.90 7.35 -1.26 0.14 117.46 126.79 2b37 n PHE 41 Ca -0.21 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.43 2b37 n PHE 41 Cb 0.56 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.37 2b37 n PHE 41 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2b37 n ASP 42 N -0.23 1.32 -3.62 -2.13 2.03 -1.26 -4.51 116.55 108.14 2b37 n ASP 42 Ca 0.00 0.21 -0.43 0.00 0.52 0.00 0.00 54.79 55.10 2b37 n ASP 42 Cb 0.00 -0.57 -0.05 0.00 -0.72 0.00 0.00 41.12 39.79 2b37 n ASP 42 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2b37 n ARG 43 N -3.80 1.71 -0.35 -0.67 1.74 -1.26 -4.74 116.66 109.29 2b37 n ARG 43 Ca -0.08 -1.94 0.05 0.00 -0.77 0.00 0.00 57.85 55.12 2b37 n ARG 43 Cb 0.29 -2.95 0.21 0.00 -1.02 0.00 0.00 32.46 28.99 2b37 n ARG 43 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2b37 h LEU 44 N 13.07 0.91 0.00 0.55 -0.00 -1.94 -2.48 115.31 125.42 2b37 h LEU 44 Ca 0.45 0.04 -0.08 0.00 -0.00 0.00 0.00 57.88 58.29 2b37 h LEU 44 Cb 0.65 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 41.15 2b37 h LEU 44 CO 1.94 0.51 -0.73 -0.09 -0.00 0.00 0.00 178.44 180.07 2b37 h ARG 45 N 1.00 0.00 0.18 1.13 2.43 -2.00 -2.97 114.38 114.15 2b37 h ARG 45 Ca 0.47 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.63 2b37 h ARG 45 Cb 0.40 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2b37 h ARG 45 CO -0.24 0.25 -0.09 1.25 -1.51 0.00 0.00 179.97 179.63 2b37 h LEU 46 N 0.00 -0.21 -2.13 3.80 5.85 -1.89 -3.14 115.31 117.60 2b37 h LEU 46 Ca -0.04 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 2b37 h LEU 46 Cb 1.28 0.05 -0.00 0.00 0.37 0.00 0.00 40.66 42.37 2b37 h LEU 46 CO 0.03 0.34 -0.04 0.16 -0.34 0.00 0.00 178.44 178.59 2b37 h ILE 47 N -0.89 0.20 -0.46 4.05 3.07 -1.60 -0.72 117.51 121.17 2b37 h ILE 47 Ca -0.02 -0.35 0.00 0.00 1.55 0.00 0.00 64.86 66.04 2b37 h ILE 47 Cb 0.51 1.28 -0.02 0.00 -0.27 0.00 0.00 36.82 38.32 2b37 h ILE 47 CO 0.04 0.04 0.30 -0.61 -1.05 0.00 0.00 178.15 176.87 2b37 h GLN 48 N 0.00 0.61 0.00 0.16 -0.00 -1.57 0.47 115.11 114.78 2b37 h GLN 48 Ca -0.00 -0.04 -0.04 0.00 -0.00 0.00 0.00 58.65 58.57 2b37 h GLN 48 Cb 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 27.62 2b37 h GLN 48 CO 0.01 0.41 -0.19 -0.09 0.00 0.00 0.00 178.83 178.97 2b37 h ARG 49 N 0.62 0.00 0.16 1.69 2.43 -1.09 -2.45 114.38 115.73 2b37 h ARG 49 Ca 0.17 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 59.02 2b37 h ARG 49 Cb -0.05 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.50 2b37 h ARG 49 CO -0.03 0.19 -1.55 0.82 -1.51 0.00 0.00 179.97 177.89 2b37 h ILE 50 N 0.00 1.15 -0.15 1.20 2.04 -1.10 -3.32 117.51 117.33 2b37 h ILE 50 Ca -0.00 -2.74 -0.04 0.00 1.00 0.00 0.00 64.86 63.08 2b37 h ILE 50 Cb 0.70 2.82 -0.01 0.00 -0.74 0.00 0.00 36.82 39.59 2b37 h ILE 50 CO 0.03 0.83 -0.10 0.71 0.00 0.00 0.00 178.15 179.62 2b37 h THR 51 N 0.09 1.16 0.00 -0.27 1.35 -0.80 -1.78 112.91 112.66 2b37 h THR 51 Ca -0.26 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 2b37 h THR 51 Cb 2.06 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 69.63 2b37 h THR 51 CO 0.19 0.21 0.00 0.44 -0.25 0.00 0.00 175.52 176.11 2b37 h ASP 52 N 0.22 0.00 -0.05 5.36 3.45 -1.54 -1.01 116.42 122.85 2b37 h ASP 52 Ca 0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.51 2b37 h ASP 52 Cb 0.31 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.08 2b37 h ASP 52 CO 0.02 0.00 0.00 0.54 -1.57 0.00 0.00 179.24 178.23 2b37 n ARG 53 N -2.81 1.44 -1.40 3.56 1.74 -0.67 -4.88 116.66 113.65 2b37 n ARG 53 Ca -0.02 -0.65 -0.31 0.00 -0.77 0.00 0.00 57.85 56.10 2b37 n ARG 53 Cb 0.09 -1.43 0.07 0.00 -1.02 0.00 0.00 32.46 30.18 2b37 n ARG 53 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2b37 s LEU 54 N -1.81 3.10 0.40 0.55 1.43 -0.39 -4.94 118.68 117.02 2b37 s LEU 54 Ca 0.37 1.77 0.16 0.00 -1.03 0.00 0.00 54.13 55.40 2b37 s LEU 54 Cb 0.19 -4.52 1.04 0.00 0.03 0.00 0.00 46.19 42.93 2b37 s LEU 54 CO 0.30 -1.81 1.83 -0.65 0.23 0.00 0.00 176.35 176.24 2b37 h PRO 55 N -0.90 0.44 -4.04 1.29 0.11 -1.88 -3.42 132.00 123.61 2b37 h PRO 55 Ca -0.44 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 2b37 h PRO 55 Cb 1.23 -0.10 -0.17 0.00 0.11 0.00 0.00 31.00 32.07 2b37 h PRO 55 CO 0.53 0.29 -0.61 0.00 -0.21 0.00 0.00 178.00 178.01 2b37 s ALA 56 N -5.50 0.22 0.62 -0.75 0.00 -1.26 -5.14 121.76 109.95 2b37 s ALA 56 Ca -0.09 -0.88 -0.10 0.00 0.00 0.00 0.00 51.96 50.90 2b37 s ALA 56 Cb 0.24 0.27 -0.02 0.00 0.00 0.00 0.00 23.12 23.60 2b37 s ALA 56 CO 0.79 -0.34 1.00 -1.59 0.00 0.00 0.00 175.76 175.62 2b37 s LYS 57 N -3.18 3.37 -0.14 0.00 -2.85 -1.26 -4.96 119.74 110.72 2b37 s LYS 57 Ca 0.00 0.55 -0.19 0.00 -1.00 0.00 0.00 55.97 55.33 2b37 s LYS 57 Cb 0.02 -2.12 0.05 0.00 -2.06 0.00 0.00 37.83 33.72 2b37 s LYS 57 CO -0.07 -0.64 0.51 0.00 0.10 0.00 0.00 175.35 175.25 2b37 s ALA 58 N -3.15 -1.27 0.00 0.59 0.00 -1.26 -4.87 121.76 111.81 2b37 s ALA 58 Ca 0.55 1.23 -0.16 0.00 0.00 0.00 0.00 51.96 53.57 2b37 s ALA 58 Cb -0.11 -0.54 -0.19 0.00 0.00 0.00 0.00 23.12 22.28 2b37 s ALA 58 CO 0.52 -0.27 1.07 -2.30 0.00 0.00 0.00 175.76 174.78 2b37 n PRO 59 N 2.21 0.00 -1.59 0.00 -0.02 -1.26 -4.69 135.00 129.65 2b37 n PRO 59 Ca -0.16 -0.55 -0.45 0.00 -2.02 0.00 0.00 63.50 60.32 2b37 n PRO 59 Cb 0.56 -1.85 -0.02 0.00 -0.02 0.00 0.00 33.50 32.18 2b37 n PRO 59 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2b37 n LEU 60 N 6.37 1.77 -4.12 2.45 0.00 -1.25 -4.02 117.00 118.19 2b37 n LEU 60 Ca 0.24 1.18 -0.16 0.00 0.00 0.00 0.00 56.01 57.27 2b37 n LEU 60 Cb 0.30 -1.28 -0.12 0.00 0.00 0.00 0.00 43.42 42.32 2b37 n LEU 60 CO 0.74 -1.39 -0.43 -0.76 0.00 0.00 0.00 177.39 175.55 2b37 s LEU 61 N 0.49 2.27 0.13 -1.96 1.43 0.32 -4.92 118.68 116.43 2b37 s LEU 61 Ca 0.60 -0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 52.80 2b37 s LEU 61 Cb -0.71 -0.35 -0.07 0.00 0.03 0.00 0.00 46.19 45.08 2b37 s LEU 61 CO 0.59 -0.14 1.15 -0.70 0.23 0.00 0.00 176.35 177.48 2b37 s GLU 62 N -1.72 4.51 -0.38 1.70 2.12 -1.26 0.20 118.70 123.87 2b37 s GLU 62 Ca -0.05 1.75 0.06 0.00 0.36 0.00 0.00 54.97 57.09 2b37 s GLU 62 Cb -0.10 -3.31 0.17 0.00 0.26 0.00 0.00 34.13 31.16 2b37 s GLU 62 CO 0.01 -0.08 0.53 -1.17 -0.54 0.00 0.00 175.26 174.01 2b37 s LEU 63 N 0.25 -1.01 -0.40 2.70 2.96 0.38 -4.75 118.68 118.81 2b37 s LEU 63 Ca 0.54 -0.95 -0.18 0.00 -0.22 0.00 0.00 54.13 53.32 2b37 s LEU 63 Cb -0.30 1.45 0.01 0.00 0.50 0.00 0.00 46.19 47.86 2b37 s LEU 63 CO 0.33 -0.22 0.49 -0.62 -1.32 0.00 0.00 176.35 175.00 2b37 s ASP 64 N 1.83 6.25 0.30 3.68 2.15 -1.26 -3.99 116.67 125.63 2b37 s ASP 64 Ca 0.15 -0.39 0.25 0.00 0.43 0.00 0.00 52.55 52.99 2b37 s ASP 64 Cb -0.09 -2.25 1.06 0.00 -0.30 0.00 0.00 42.92 41.35 2b37 s ASP 64 CO -0.09 -0.57 1.74 -0.37 -0.17 0.00 0.00 175.17 175.72 2b37 h VAL 65 N 5.71 0.00 0.00 1.11 -1.51 -1.97 -1.93 116.25 117.66 2b37 h VAL 65 Ca -0.27 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2b37 h VAL 65 Cb 1.11 0.97 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 2b37 h VAL 65 CO 0.80 0.00 -0.37 0.00 -1.23 0.00 0.00 177.57 176.77 2b37 n GLN 66 N -2.34 0.24 -3.23 5.19 6.02 -1.26 -4.82 117.38 117.18 2b37 n GLN 66 Ca 0.01 0.12 -0.40 0.00 -0.01 0.00 0.00 57.00 56.73 2b37 n GLN 66 Cb 0.21 -1.70 -0.07 0.00 1.02 0.00 0.00 30.24 29.70 2b37 n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2b37 s ASN 67 N -4.16 6.49 0.06 1.08 2.47 -0.73 -4.98 114.94 115.17 2b37 s ASN 67 Ca 0.09 0.59 -0.20 0.00 0.42 0.00 0.00 52.86 53.75 2b37 s ASN 67 Cb 0.14 -2.29 -0.12 0.00 -1.45 0.00 0.00 41.25 37.53 2b37 s ASN 67 CO 0.67 -0.26 1.48 -0.08 -3.72 0.00 0.00 177.10 175.18 2b37 h GLU 68 N 7.81 0.31 -0.73 0.43 4.57 -1.87 -2.73 114.58 122.36 2b37 h GLU 68 Ca -0.30 -0.11 0.12 0.00 -1.18 0.00 0.00 59.36 57.89 2b37 h GLU 68 Cb 1.14 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.66 2b37 h GLU 68 CO 0.73 0.54 0.48 0.93 -1.18 0.00 0.00 179.01 180.52 2b37 h GLU 69 N 0.04 0.52 -0.75 1.92 5.08 -1.95 -1.08 114.58 118.36 2b37 h GLU 69 Ca 0.05 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2b37 h GLU 69 Cb 0.41 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 2b37 h GLU 69 CO 0.01 0.35 0.27 0.45 -1.00 0.00 0.00 179.01 179.09 2b37 h HIS 70 N 0.54 1.16 0.23 4.33 3.86 -1.80 -1.84 115.15 121.63 2b37 h HIS 70 Ca 0.35 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.45 2b37 h HIS 70 Cb 0.61 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.74 2b37 h HIS 70 CO -0.00 0.89 -0.11 -0.07 0.86 0.00 0.00 177.93 179.50 2b37 h LEU 71 N 1.10 -0.26 -0.65 2.43 -0.00 -1.10 -0.01 115.31 116.81 2b37 h LEU 71 Ca 0.25 -0.26 0.09 0.00 -0.00 0.00 0.00 57.88 57.96 2b37 h LEU 71 Cb 0.24 0.07 -0.11 0.00 -0.00 0.00 0.00 40.66 40.86 2b37 h LEU 71 CO -0.02 0.23 -0.44 0.00 -0.00 0.00 0.00 178.44 178.21 2b37 h ALA 72 N -0.38 -0.29 0.14 1.53 0.00 -1.29 -1.71 119.26 117.26 2b37 h ALA 72 Ca -0.03 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2b37 h ALA 72 Cb 0.51 0.99 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2b37 h ALA 72 CO 0.05 -0.81 -0.07 0.66 0.00 0.00 0.00 179.25 179.08 2b37 h SER 73 N -0.19 -0.15 0.00 0.00 4.64 -1.43 -3.38 113.55 113.04 2b37 h SER 73 Ca 0.20 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2b37 h SER 73 Cb 0.56 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2b37 h SER 73 CO -0.74 0.00 0.00 -0.11 -0.87 0.00 0.00 176.83 175.11 2b37 n LEU 74 N -5.11 0.00 0.04 5.97 -0.00 -0.02 -0.90 117.00 116.99 2b37 n LEU 74 Ca -0.09 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.79 2b37 n LEU 74 Cb 0.14 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.49 2b37 n LEU 74 CO 0.34 0.00 0.58 0.00 -0.00 0.00 0.00 177.39 178.30 2b37 h ALA 75 N 0.00 -0.68 -0.00 1.96 0.00 -1.71 -2.24 119.26 116.58 2b37 h ALA 75 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2b37 h ALA 75 Cb 0.00 0.78 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2b37 h ALA 75 CO 0.00 -0.97 -0.12 0.78 0.00 0.00 0.00 179.25 178.94 2b37 h GLY 76 N -0.56 0.01 1.54 0.00 0.00 -1.28 -1.46 103.07 101.31 2b37 h GLY 76 Ca 0.05 -0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.26 2b37 h GLY 76 CO -0.35 0.00 -0.36 3.21 0.00 0.00 0.00 176.54 179.05 2b37 h ARG 77 N 0.01 0.52 -0.32 4.80 3.08 -1.36 -2.79 114.38 118.32 2b37 h ARG 77 Ca 0.00 -0.24 -0.11 0.00 0.07 0.00 0.00 59.98 59.70 2b37 h ARG 77 Cb 0.22 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 2b37 h ARG 77 CO 0.02 0.80 -0.27 0.28 -1.07 0.00 0.00 179.97 179.73 2b37 h VAL 78 N 0.44 1.28 -0.92 2.04 2.07 -0.70 -2.80 116.25 117.66 2b37 h VAL 78 Ca 0.05 -1.37 0.01 0.00 0.82 0.00 0.00 66.70 66.21 2b37 h VAL 78 Cb 0.83 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 2b37 h VAL 78 CO 0.07 0.44 0.61 0.74 0.02 0.00 0.00 177.57 179.45 2b37 h THR 79 N 0.55 1.23 0.00 2.57 2.02 -1.35 -2.67 112.91 115.27 2b37 h THR 79 Ca 0.07 -0.43 -0.03 0.00 0.77 0.00 0.00 66.41 66.80 2b37 h THR 79 Cb 0.75 -0.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.04 2b37 h THR 79 CO 0.06 0.23 -0.13 -0.33 0.37 0.00 0.00 175.52 175.72 2b37 h GLU 80 N 1.24 0.00 0.00 6.66 4.39 -1.22 -1.50 114.58 124.15 2b37 h GLU 80 Ca 0.34 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.80 2b37 h GLU 80 Cb -0.14 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.47 2b37 h GLU 80 CO -0.07 0.13 -1.45 0.00 -1.16 0.00 0.00 179.01 176.45 2b37 h ALA 81 N 1.87 0.68 -0.01 3.43 0.00 -1.41 -3.34 119.26 120.47 2b37 h ALA 81 Ca -0.00 -1.15 0.00 0.00 0.00 0.00 0.00 54.91 53.76 2b37 h ALA 81 Cb 0.33 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2b37 h ALA 81 CO 0.02 1.29 -0.05 0.44 0.00 0.00 0.00 179.25 180.94 2b37 n ILE 82 N -3.05 0.00 0.00 0.00 -5.35 -1.18 -4.94 119.36 104.84 2b37 n ILE 82 Ca -0.11 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 61.89 2b37 n ILE 82 Cb 0.95 1.23 0.00 0.00 -1.74 0.00 0.00 39.64 40.08 2b37 n ILE 82 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2b37 n GLY 83 N 0.75 -0.40 3.65 3.28 0.00 -0.58 -4.80 105.19 107.08 2b37 n GLY 83 Ca 0.07 -1.33 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 2b37 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b37 n ALA 84 N 0.80 -0.70 -1.06 4.61 0.00 -1.13 -2.63 120.51 120.41 2b37 n ALA 84 Ca 0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 53.44 52.96 2b37 n ALA 84 Cb 0.00 -2.17 -0.01 0.00 0.00 0.00 0.00 19.45 17.27 2b37 n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b37 n GLY 85 N 0.55 0.39 3.30 0.00 0.00 -1.26 -4.99 105.19 103.18 2b37 n GLY 85 Ca 0.12 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2b37 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b37 s ASN 86 N -2.14 3.27 0.47 1.61 0.01 -1.08 -5.15 114.94 111.92 2b37 s ASN 86 Ca 0.00 -0.46 0.05 0.00 -0.71 0.00 0.00 52.86 51.74 2b37 s ASN 86 Cb 0.00 -0.89 -0.03 0.00 0.41 0.00 0.00 41.25 40.75 2b37 s ASN 86 CO 0.00 0.25 0.14 -0.54 -1.51 0.00 0.00 177.10 175.44 2b37 s LYS 87 N -0.21 2.18 -0.09 -0.60 1.02 -1.26 -4.89 119.74 115.89 2b37 s LYS 87 Ca -0.02 -2.10 -0.19 0.00 0.02 0.00 0.00 55.97 53.68 2b37 s LYS 87 Cb -0.13 -1.81 -0.04 0.00 -0.52 0.00 0.00 37.83 35.33 2b37 s LYS 87 CO 0.03 -0.29 0.53 -0.51 -0.92 0.00 0.00 175.35 174.20 2b37 s LEU 88 N -3.94 4.31 0.00 3.17 1.43 0.58 -4.70 118.68 119.53 2b37 s LEU 88 Ca 0.27 0.93 0.08 0.00 -1.03 0.00 0.00 54.13 54.39 2b37 s LEU 88 Cb 0.03 -2.79 -0.23 0.00 0.03 0.00 0.00 46.19 43.23 2b37 s LEU 88 CO 0.15 0.01 0.84 0.44 0.23 0.00 0.00 176.35 178.03 2b37 h ASP 89 N 6.49 0.06 -5.21 2.29 3.32 -1.47 -1.06 116.42 120.84 2b37 h ASP 89 Ca -0.42 -0.10 -0.11 0.00 0.02 0.00 0.00 57.03 56.41 2b37 h ASP 89 Cb 1.19 -0.02 -0.15 0.00 0.22 0.00 0.00 39.33 40.57 2b37 h ASP 89 CO 0.74 1.09 -0.60 -0.83 -1.72 0.00 0.00 179.24 177.92 2b37 s GLY 90 N -5.00 0.36 -0.06 2.75 0.00 -1.12 -1.15 107.32 103.11 2b37 s GLY 90 Ca -0.04 -1.02 -0.07 0.00 0.00 0.00 0.00 44.72 43.58 2b37 s GLY 90 CO 0.82 -1.15 0.20 0.14 0.00 0.00 0.00 173.10 173.11 2b37 s VAL 91 N -3.77 0.01 -0.16 1.40 1.01 -0.35 -1.46 120.40 117.08 2b37 s VAL 91 Ca 0.05 -0.12 -0.00 0.00 0.00 0.00 0.00 61.98 61.91 2b37 s VAL 91 Cb 0.06 -0.33 0.04 0.00 0.00 0.00 0.00 36.38 36.16 2b37 s VAL 91 CO -0.10 -0.07 -0.07 -0.69 0.00 0.00 0.00 175.10 174.18 2b37 s VAL 92 N -0.17 1.23 -0.55 2.92 1.01 -0.10 -1.88 120.40 122.86 2b37 s VAL 92 Ca -0.03 -0.66 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 2b37 s VAL 92 Cb -0.02 -1.35 0.08 0.00 0.00 0.00 0.00 36.38 35.09 2b37 s VAL 92 CO 0.01 0.18 0.65 -2.28 0.00 0.00 0.00 175.10 173.66 2b37 s HIS 93 N 1.59 3.04 -0.57 5.22 2.46 -0.73 -2.51 115.29 123.79 2b37 s HIS 93 Ca 0.01 -0.79 0.07 0.00 0.47 0.00 0.00 55.06 54.82 2b37 s HIS 93 Cb -0.15 -3.75 0.27 0.00 -0.13 0.00 0.00 32.58 28.82 2b37 s HIS 93 CO -0.08 -1.15 0.74 0.45 -2.47 0.00 0.00 174.74 172.23 2b37 n SER 94 N 6.17 3.07 -3.94 9.88 2.88 -1.26 -1.98 113.62 128.44 2b37 n SER 94 Ca -0.09 -3.33 -0.14 0.00 -1.33 0.00 0.00 58.87 53.98 2b37 n SER 94 Cb 0.44 -0.64 -0.14 0.00 -0.75 0.00 0.00 64.21 63.11 2b37 n SER 94 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2b37 s ILE 95 N -2.58 0.31 0.03 2.46 1.01 -1.26 -3.98 121.20 117.19 2b37 s ILE 95 Ca 0.41 -0.25 -0.25 0.00 0.00 0.00 0.00 60.65 60.55 2b37 s ILE 95 Cb 0.19 -0.28 0.06 0.00 0.01 0.00 0.00 42.46 42.43 2b37 s ILE 95 CO -0.05 0.03 0.57 -0.83 0.00 0.00 0.00 174.94 174.66 2b37 s GLY 96 N -0.24 -0.49 -0.28 6.18 0.00 -1.26 -4.63 107.32 106.59 2b37 s GLY 96 Ca 0.00 0.80 -0.18 0.00 0.00 0.00 0.00 44.72 45.34 2b37 s GLY 96 CO -0.00 0.48 0.85 -0.12 0.00 0.00 0.00 173.10 174.31 2b37 s PHE 97 N -2.18 -0.77 -0.15 1.90 5.36 -1.26 -4.94 117.98 115.94 2b37 s PHE 97 Ca -0.07 1.61 -0.06 0.00 -0.96 0.00 0.00 56.93 57.45 2b37 s PHE 97 Cb -0.01 0.45 0.07 0.00 -0.34 0.00 0.00 43.02 43.20 2b37 s PHE 97 CO 0.01 -0.38 0.32 1.41 -1.46 0.00 0.00 175.22 175.11 2b37 s MET 98 N 1.23 0.23 0.66 10.12 -2.45 -1.26 -4.09 119.30 123.73 2b37 s MET 98 Ca -0.07 0.81 -0.17 0.00 -1.25 0.00 0.00 55.69 55.00 2b37 s MET 98 Cb -0.04 0.06 -0.02 0.00 1.25 0.00 0.00 34.83 36.08 2b37 s MET 98 CO -0.14 -0.25 1.08 -2.30 1.05 0.00 0.00 175.02 174.46 2b37 n PRO 99 N 5.11 0.84 -0.09 4.11 -0.02 -1.26 -4.85 135.00 138.84 2b37 n PRO 99 Ca -0.11 0.34 0.26 0.00 -2.02 0.00 0.00 63.50 61.97 2b37 n PRO 99 Cb 0.51 -2.31 0.72 0.00 -0.02 0.00 0.00 33.50 32.39 2b37 n PRO 99 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2b37 h GLN 100 N 0.25 0.00 -0.98 -0.52 1.08 -1.98 -1.66 115.11 111.30 2b37 h GLN 100 Ca -0.49 0.00 0.14 0.00 -1.45 0.00 0.00 58.65 56.85 2b37 h GLN 100 Cb 1.35 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 28.69 2b37 h GLN 100 CO 0.50 0.00 0.62 1.15 -0.95 0.00 0.00 178.83 180.15 2b37 h THR 101 N 0.00 0.87 -0.08 -0.54 2.02 -1.95 -2.79 112.91 110.44 2b37 h THR 101 Ca 0.35 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 67.22 2b37 h THR 101 Cb 1.56 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 2b37 h THR 101 CO -0.00 0.16 0.00 0.61 0.37 0.00 0.00 175.52 176.66 2b37 n GLY 102 N -1.37 4.32 3.36 2.16 0.00 -0.63 -4.18 105.19 108.85 2b37 n GLY 102 Ca 0.19 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 2b37 n GLY 102 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2b37 s MET 103 N -2.52 0.45 0.00 1.61 -2.45 -1.05 -1.53 119.30 113.80 2b37 s MET 103 Ca 0.30 0.94 0.00 0.00 -1.25 0.00 0.00 55.69 55.68 2b37 s MET 103 Cb 0.25 0.11 0.00 0.00 1.25 0.00 0.00 34.83 36.44 2b37 s MET 103 CO 0.05 -0.17 0.00 0.41 1.05 0.00 0.00 175.02 176.35 2b37 n GLY 104 N 4.52 0.51 0.10 2.11 0.00 0.14 -4.51 105.19 108.06 2b37 n GLY 104 Ca -0.20 -1.28 0.12 0.00 0.00 0.00 0.00 46.02 44.66 2b37 n GLY 104 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2b37 h ILE 105 N 0.00 0.00 -2.81 -0.61 6.09 -1.85 -3.32 117.51 115.00 2b37 h ILE 105 Ca 0.00 -0.86 -0.53 0.00 -1.37 0.00 0.00 64.86 62.10 2b37 h ILE 105 Cb 0.00 1.36 0.03 0.00 0.47 0.00 0.00 36.82 38.68 2b37 h ILE 105 CO 0.00 0.00 0.89 0.21 -3.07 0.00 0.00 178.15 176.18 2b37 s ASN 106 N -5.03 6.65 0.19 2.19 2.47 -1.26 -4.92 114.94 115.22 2b37 s ASN 106 Ca 0.01 2.50 -0.31 0.00 0.42 0.00 0.00 52.86 55.48 2b37 s ASN 106 Cb 0.11 -2.58 -0.16 0.00 -1.45 0.00 0.00 41.25 37.17 2b37 s ASN 106 CO 0.78 -0.81 0.92 -2.65 -3.72 0.00 0.00 177.10 171.62 2b37 n PRO 107 N 4.58 0.75 -0.27 0.43 -0.02 -1.26 -4.68 135.00 134.54 2b37 n PRO 107 Ca 0.14 0.27 0.08 0.00 -2.02 0.00 0.00 63.50 61.96 2b37 n PRO 107 Cb 0.40 -1.58 0.21 0.00 -0.02 0.00 0.00 33.50 32.51 2b37 n PRO 107 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2b37 h PHE 108 N 2.26 0.32 0.00 6.00 3.57 -1.92 -1.64 116.94 125.53 2b37 h PHE 108 Ca -0.38 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.14 2b37 h PHE 108 Cb 1.38 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 40.10 2b37 h PHE 108 CO 0.49 -0.10 -0.10 0.74 -2.23 0.00 0.00 178.31 177.11 2b37 h PHE 109 N 0.27 0.00 -0.22 0.41 0.04 -1.96 -3.25 116.94 112.24 2b37 h PHE 109 Ca 0.46 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.23 2b37 h PHE 109 Cb 0.82 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.97 2b37 h PHE 109 CO -0.25 0.10 0.00 -0.25 -0.60 0.00 0.00 178.31 177.31 2b37 n ASP 110 N -3.29 2.57 -4.37 2.17 8.00 -0.62 -4.80 116.55 116.22 2b37 n ASP 110 Ca -0.00 -2.30 -0.40 0.00 0.71 0.00 0.00 54.79 52.80 2b37 n ASP 110 Cb 0.32 -0.52 -0.11 0.00 -0.02 0.00 0.00 41.12 40.79 2b37 n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b37 s ALA 111 N -1.64 3.26 0.60 2.24 0.00 -1.23 -4.89 121.76 120.10 2b37 s ALA 111 Ca 0.20 -1.73 -0.19 0.00 0.00 0.00 0.00 51.96 50.24 2b37 s ALA 111 Cb 0.14 -2.57 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 2b37 s ALA 111 CO 0.07 -1.39 1.26 -1.25 0.00 0.00 0.00 175.76 174.44 2b37 s PRO 112 N 1.54 2.85 0.36 0.00 0.04 -1.26 -4.88 135.00 133.65 2b37 s PRO 112 Ca 0.02 1.98 0.04 0.00 0.04 0.00 0.00 61.00 63.08 2b37 s PRO 112 Cb -0.19 -1.95 0.67 0.00 0.04 0.00 0.00 34.50 33.06 2b37 s PRO 112 CO 0.06 -1.34 1.95 -0.92 0.04 0.00 0.00 177.00 176.79 2b37 h TYR 113 N 0.87 0.61 -0.16 0.56 3.20 -1.98 -1.55 116.97 118.51 2b37 h TYR 113 Ca -0.51 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.38 2b37 h TYR 113 Cb 1.31 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 2b37 h TYR 113 CO 0.45 0.48 0.11 0.00 -1.64 0.00 0.00 178.16 177.56 2b37 h ALA 114 N 1.58 2.15 0.07 1.82 0.00 -1.99 0.63 119.26 123.52 2b37 h ALA 114 Ca 0.15 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.81 2b37 h ALA 114 Cb 0.13 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2b37 h ALA 114 CO -0.01 -0.19 -1.11 -0.44 0.00 0.00 0.00 179.25 177.49 2b37 h ASP 115 N 0.00 0.28 0.11 0.00 3.45 -1.67 -3.26 116.42 115.33 2b37 h ASP 115 Ca 0.07 -0.29 -0.17 0.00 0.43 0.00 0.00 57.03 57.07 2b37 h ASP 115 Cb 0.30 -0.09 0.02 0.00 -0.56 0.00 0.00 39.33 38.99 2b37 h ASP 115 CO -0.00 1.20 -0.75 0.58 -1.57 0.00 0.00 179.24 178.70 2b37 h VAL 116 N 0.06 1.50 -0.89 -1.35 2.07 -0.49 -3.00 116.25 114.15 2b37 h VAL 116 Ca -0.08 -2.42 0.07 0.00 0.82 0.00 0.00 66.70 65.08 2b37 h VAL 116 Cb 1.84 3.06 -0.06 0.00 -1.52 0.00 0.00 31.29 34.62 2b37 h VAL 116 CO 0.17 0.69 0.58 -1.28 0.02 0.00 0.00 177.57 177.75 2b37 h SER 117 N -0.32 0.88 0.40 0.57 0.87 0.01 0.19 113.55 116.15 2b37 h SER 117 Ca -0.12 0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.32 2b37 h SER 117 Cb 1.55 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 63.32 2b37 h SER 117 CO 0.14 0.56 -0.52 0.50 -0.53 0.00 0.00 176.83 176.98 2b37 h LYS 118 N 0.99 0.14 -0.44 2.24 3.64 -1.64 0.35 116.57 121.86 2b37 h LYS 118 Ca 0.39 -0.08 -0.11 0.00 -1.27 0.00 0.00 60.65 59.57 2b37 h LYS 118 Cb 0.23 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 2b37 h LYS 118 CO -0.15 0.63 -0.17 0.78 -2.27 0.00 0.00 179.45 178.27 2b37 h GLY 119 N 1.46 0.91 1.71 5.01 0.00 -0.82 -2.82 103.07 108.52 2b37 h GLY 119 Ca 0.00 -0.75 -0.25 0.00 0.00 0.00 0.00 47.33 46.34 2b37 h GLY 119 CO 0.08 0.68 -1.20 -2.22 0.00 0.00 0.00 176.54 173.88 2b37 h ILE 120 N 0.74 1.51 0.16 2.60 2.04 -0.41 -2.28 117.51 121.87 2b37 h ILE 120 Ca 0.11 -3.19 0.01 0.00 1.00 0.00 0.00 64.86 62.80 2b37 h ILE 120 Cb 0.69 2.83 -0.03 0.00 -0.74 0.00 0.00 36.82 39.57 2b37 h ILE 120 CO 0.05 0.89 -0.24 -0.74 0.00 0.00 0.00 178.15 178.12 2b37 h HIS 121 N 0.03 -0.63 0.07 1.37 2.76 -0.32 0.14 115.15 118.58 2b37 h HIS 121 Ca -0.10 0.01 -0.24 0.00 -2.20 0.00 0.00 60.37 57.84 2b37 h HIS 121 Cb 1.88 0.25 -0.01 0.00 1.55 0.00 0.00 27.41 31.09 2b37 h HIS 121 CO 0.03 -0.34 -1.12 0.82 -1.30 0.00 0.00 177.93 176.02 2b37 h ILE 122 N -0.46 1.56 0.05 6.26 2.04 -1.59 -1.53 117.51 123.83 2b37 h ILE 122 Ca 0.02 -3.08 -0.31 0.00 1.00 0.00 0.00 64.86 62.48 2b37 h ILE 122 Cb 0.46 2.84 -0.04 0.00 -0.74 0.00 0.00 36.82 39.34 2b37 h ILE 122 CO -0.10 0.89 -1.77 0.28 0.00 0.00 0.00 178.15 177.46 2b37 h SER 123 N 0.06 0.15 0.00 1.72 0.02 -1.42 -3.41 113.55 110.68 2b37 h SER 123 Ca -0.09 -0.33 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 2b37 h SER 123 Cb 1.84 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 64.33 2b37 h SER 123 CO 0.17 1.29 -0.30 0.00 -1.14 0.00 0.00 176.83 176.85 2b37 n ALA 124 N -2.69 2.22 -0.22 3.77 0.00 -0.08 -4.74 120.51 118.77 2b37 n ALA 124 Ca -0.21 -0.26 0.01 0.00 0.00 0.00 0.00 53.44 52.99 2b37 n ALA 124 Cb 1.05 0.15 0.25 0.00 0.00 0.00 0.00 19.45 20.90 2b37 n ALA 124 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2b37 h TYR 125 N -0.30 0.93 0.00 0.00 5.03 -1.26 -1.42 116.97 119.95 2b37 h TYR 125 Ca 0.00 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.33 2b37 h TYR 125 Cb 0.30 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.26 2b37 h TYR 125 CO -0.13 0.58 0.00 -1.13 -1.32 0.00 0.00 178.16 176.16 2b37 n SER 126 N -4.43 0.00 -0.06 -2.11 3.41 -0.58 -1.72 113.62 108.14 2b37 n SER 126 Ca 0.09 -0.50 -0.13 0.00 -0.26 0.00 0.00 58.87 58.06 2b37 n SER 126 Cb 0.05 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.88 2b37 n SER 126 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2b37 h TYR 127 N 0.00 -0.01 0.22 7.33 3.20 -1.55 -2.82 116.97 123.35 2b37 h TYR 127 Ca 0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2b37 h TYR 127 Cb 0.00 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 2b37 h TYR 127 CO 0.00 0.86 -0.14 0.00 -1.64 0.00 0.00 178.16 177.24 2b37 h ALA 128 N 0.03 -0.34 -0.89 1.82 0.00 -1.49 -1.88 119.26 116.52 2b37 h ALA 128 Ca -0.00 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.92 2b37 h ALA 128 Cb 0.87 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.76 2b37 h ALA 128 CO 0.00 -0.70 0.55 0.66 0.00 0.00 0.00 179.25 179.77 2b37 h SER 129 N -0.35 0.85 -0.35 0.00 4.64 -1.59 0.34 113.55 117.09 2b37 h SER 129 Ca -0.02 0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.27 2b37 h SER 129 Cb 0.29 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2b37 h SER 129 CO 0.02 0.52 0.00 -0.03 -0.87 0.00 0.00 176.83 176.47 2b37 h MET 130 N 0.97 0.62 0.10 4.77 -1.53 -1.48 -1.32 114.93 117.06 2b37 h MET 130 Ca 0.41 -0.20 0.02 0.00 -3.44 0.00 0.00 59.70 56.49 2b37 h MET 130 Cb 0.25 -0.06 -0.03 0.00 -0.55 0.00 0.00 31.60 31.21 2b37 h MET 130 CO -0.20 0.73 -0.25 0.00 0.14 0.00 0.00 176.91 177.33 2b37 h ALA 131 N 0.86 -0.41 -0.56 0.39 0.00 -0.40 -2.48 119.26 116.66 2b37 h ALA 131 Ca 0.10 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.09 2b37 h ALA 131 Cb 0.45 0.41 -0.11 0.00 0.00 0.00 0.00 17.79 18.54 2b37 h ALA 131 CO 0.02 -0.78 -0.23 -0.22 0.00 0.00 0.00 179.25 178.04 2b37 h LYS 132 N -0.44 -0.09 0.00 0.00 3.64 -0.22 0.30 116.57 119.76 2b37 h LYS 132 Ca 0.03 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2b37 h LYS 132 Cb 0.48 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2b37 h LYS 132 CO -0.15 -0.06 -0.06 0.00 -2.27 0.00 0.00 179.45 176.90 2b37 h ALA 133 N 1.29 1.15 0.00 5.00 0.00 -1.09 -3.35 119.26 122.26 2b37 h ALA 133 Ca 0.26 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 2b37 h ALA 133 Cb 0.50 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2b37 h ALA 133 CO -0.63 0.08 -1.39 1.28 0.00 0.00 0.00 179.25 178.60 2b37 n LEU 134 N -3.38 0.00 -0.13 0.00 4.77 0.14 -4.11 117.00 114.29 2b37 n LEU 134 Ca -0.02 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.89 2b37 n LEU 134 Cb 0.21 0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 2b37 n LEU 134 CO 0.27 0.12 0.64 -0.07 -1.33 0.00 0.00 177.39 177.01 2b37 h LEU 135 N 0.00 -1.11 -1.74 2.23 -0.00 -0.66 -1.44 115.31 112.59 2b37 h LEU 135 Ca -0.13 0.20 0.39 0.00 -0.00 0.00 0.00 57.88 58.34 2b37 h LEU 135 Cb 1.17 0.52 -0.08 0.00 -0.00 0.00 0.00 40.66 42.27 2b37 h LEU 135 CO 0.01 -0.32 0.92 -0.65 -0.00 0.00 0.00 178.44 178.40 2b37 h PRO 136 N -0.24 0.09 -0.79 1.13 0.11 -1.84 0.25 132.00 130.72 2b37 h PRO 136 Ca 0.18 -0.01 -0.42 0.00 0.11 0.00 0.00 66.00 65.86 2b37 h PRO 136 Cb 0.54 -0.02 -0.25 0.00 0.11 0.00 0.00 31.00 31.38 2b37 h PRO 136 CO -0.56 0.06 0.41 0.44 -0.21 0.00 0.00 178.00 178.14 2b37 n ILE 137 N -4.34 3.02 -4.27 4.15 -5.35 -0.55 -4.97 119.36 107.06 2b37 n ILE 137 Ca 0.32 -2.30 -0.27 0.00 -0.27 0.00 0.00 62.75 60.22 2b37 n ILE 137 Cb 1.36 -0.48 -0.09 0.00 -1.74 0.00 0.00 39.64 38.69 2b37 n ILE 137 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2b37 s MET 138 N -3.33 2.11 0.19 6.28 -1.94 0.89 -0.31 119.30 123.19 2b37 s MET 138 Ca 0.53 -1.20 -0.11 0.00 -1.71 0.00 0.00 55.69 53.20 2b37 s MET 138 Cb 0.46 -2.21 -0.07 0.00 2.01 0.00 0.00 34.83 35.02 2b37 s MET 138 CO 0.06 0.45 0.54 -0.80 -0.01 0.00 0.00 175.02 175.27 2b37 s ASN 139 N -2.71 6.70 0.70 3.03 0.02 -0.40 -4.82 114.94 117.46 2b37 s ASN 139 Ca 0.24 0.97 -0.16 0.00 -1.02 0.00 0.00 52.86 52.90 2b37 s ASN 139 Cb -0.09 -2.25 0.02 0.00 0.02 0.00 0.00 41.25 38.95 2b37 s ASN 139 CO 0.15 0.01 1.24 -2.84 0.02 0.00 0.00 177.10 175.68 2b37 s PRO 140 N -2.44 2.30 0.00 -0.60 0.02 -1.23 -2.38 135.00 130.67 2b37 s PRO 140 Ca 0.43 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.33 2b37 s PRO 140 Cb -0.13 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.55 2b37 s PRO 140 CO 0.20 -1.74 0.00 0.41 -0.33 0.00 0.00 177.00 175.54 2b37 n GLY 141 N 0.61 0.56 3.96 0.52 0.00 0.20 -5.00 105.19 106.05 2b37 n GLY 141 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 2b37 n GLY 141 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b37 s GLY 142 N -2.00 1.76 -0.01 -0.02 0.00 -1.00 -4.93 107.32 101.12 2b37 s GLY 142 Ca 0.00 -1.37 -0.00 0.00 0.00 0.00 0.00 44.72 43.35 2b37 s GLY 142 CO 0.00 -0.87 0.01 -0.45 0.00 0.00 0.00 173.10 171.80 2b37 s SER 143 N -4.64 0.03 -0.14 1.64 0.15 -0.30 -1.63 113.70 108.81 2b37 s SER 143 Ca 0.64 0.02 0.01 0.00 0.70 0.00 0.00 55.95 57.32 2b37 s SER 143 Cb -0.07 -0.03 -0.00 0.00 -1.71 0.00 0.00 66.02 64.20 2b37 s SER 143 CO 0.45 -0.05 -0.16 -0.63 1.20 0.00 0.00 173.24 174.04 2b37 s ILE 144 N 0.44 2.64 -0.05 6.45 1.01 0.11 -1.21 121.20 130.60 2b37 s ILE 144 Ca -0.04 -0.79 -0.02 0.00 0.00 0.00 0.00 60.65 59.80 2b37 s ILE 144 Cb -0.05 -2.10 0.04 0.00 0.01 0.00 0.00 42.46 40.36 2b37 s ILE 144 CO -0.01 0.53 0.09 0.54 0.00 0.00 0.00 174.94 176.09 2b37 s VAL 145 N 0.61 -0.13 0.24 2.92 0.11 -0.79 -1.18 120.40 122.17 2b37 s VAL 145 Ca -0.09 0.32 0.11 0.00 -2.93 0.00 0.00 61.98 59.39 2b37 s VAL 145 Cb -0.16 -0.19 -0.05 0.00 -1.53 0.00 0.00 36.38 34.46 2b37 s VAL 145 CO 0.03 0.13 -0.21 -0.83 -3.33 0.00 0.00 175.10 170.89 2b37 s GLY 146 N 1.80 1.76 0.19 6.54 0.00 -0.75 -1.78 107.32 115.08 2b37 s GLY 146 Ca -0.01 -1.75 -0.23 0.00 0.00 0.00 0.00 44.72 42.73 2b37 s GLY 146 CO -0.04 -1.82 0.75 1.06 0.00 0.00 0.00 173.10 173.05 2b37 s MET 147 N -3.16 4.42 0.22 2.90 -1.94 -0.84 -1.57 119.30 119.34 2b37 s MET 147 Ca 0.25 1.02 0.01 0.00 -1.71 0.00 0.00 55.69 55.27 2b37 s MET 147 Cb -0.06 -3.08 -0.05 0.00 2.01 0.00 0.00 34.83 33.65 2b37 s MET 147 CO 0.12 0.49 0.08 0.34 -0.01 0.00 0.00 175.02 176.04 2b37 s ASP 148 N -1.37 1.03 -0.15 3.03 2.15 -0.39 -4.87 116.67 116.10 2b37 s ASP 148 Ca 0.39 -1.32 -0.06 0.00 0.43 0.00 0.00 52.55 51.98 2b37 s ASP 148 Cb -0.20 0.18 0.07 0.00 -0.30 0.00 0.00 42.92 42.68 2b37 s ASP 148 CO 0.23 -0.70 0.33 0.12 -0.17 0.00 0.00 175.17 174.98 2b37 s PHE 149 N -3.79 -0.56 -0.44 -5.34 2.19 -1.26 -2.31 117.98 106.47 2b37 s PHE 149 Ca 0.34 1.17 -0.42 0.00 0.33 0.00 0.00 56.93 58.35 2b37 s PHE 149 Cb 0.07 0.11 -0.17 0.00 -1.31 0.00 0.00 43.02 41.73 2b37 s PHE 149 CO 0.11 -0.39 2.04 -3.47 1.83 0.00 0.00 175.22 175.34 2b37 n ASP 150 N 5.18 1.33 -0.72 6.13 -0.08 -1.26 -4.81 116.55 122.31 2b37 n ASP 150 Ca -0.10 0.72 0.08 0.00 -1.51 0.00 0.00 54.79 53.98 2b37 n ASP 150 Cb 0.50 -1.01 0.13 0.00 2.34 0.00 0.00 41.12 43.08 2b37 n ASP 150 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2b37 n PRO 151 N 6.99 1.87 0.29 -0.67 -0.04 -1.26 -4.67 135.00 137.51 2b37 n PRO 151 Ca 0.45 -1.78 0.19 0.00 -0.04 0.00 0.00 63.50 62.33 2b37 n PRO 151 Cb 0.04 -1.32 0.94 0.00 -0.04 0.00 0.00 33.50 33.11 2b37 n PRO 151 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2b37 h SER 152 N 2.88 0.00 -3.90 3.54 4.64 -1.93 -3.43 113.55 115.35 2b37 h SER 152 Ca 0.00 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.90 2b37 h SER 152 Cb 0.71 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.63 2b37 h SER 152 CO 0.00 0.00 -0.75 -0.13 -0.87 0.00 0.00 176.83 175.08 2b37 s ARG 153 N -3.88 1.08 0.82 4.77 0.52 -1.26 -5.17 118.95 115.84 2b37 s ARG 153 Ca -0.02 -1.32 -0.11 0.00 -0.52 0.00 0.00 55.73 53.76 2b37 s ARG 153 Cb 0.11 -0.93 0.11 0.00 0.52 0.00 0.00 34.95 34.75 2b37 s ARG 153 CO 0.45 0.17 1.17 0.00 0.02 0.00 0.00 175.30 177.11 2b37 s ALA 154 N -2.37 2.71 0.08 2.13 0.00 -1.26 -5.10 121.76 117.96 2b37 s ALA 154 Ca 0.12 -0.90 -0.27 0.00 0.00 0.00 0.00 51.96 50.91 2b37 s ALA 154 Cb -0.04 -2.79 0.08 0.00 0.00 0.00 0.00 23.12 20.38 2b37 s ALA 154 CO 0.03 -1.77 0.98 0.00 0.00 0.00 0.00 175.76 175.00 2b37 s MET 155 N -5.56 0.99 0.71 0.00 0.23 -1.26 -5.15 119.30 109.26 2b37 s MET 155 Ca 0.65 -0.50 -0.12 0.00 -1.03 0.00 0.00 55.69 54.69 2b37 s MET 155 Cb -0.09 0.37 0.02 0.00 -1.53 0.00 0.00 34.83 33.60 2b37 s MET 155 CO 0.49 -0.45 1.08 -1.25 -2.03 0.00 0.00 175.02 172.86 2b37 s PRO 156 N -3.14 2.70 0.00 3.16 0.04 -1.26 -4.37 135.00 132.13 2b37 s PRO 156 Ca 0.10 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.29 2b37 s PRO 156 Cb -0.01 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.58 2b37 s PRO 156 CO -0.02 -1.30 0.00 0.00 0.04 0.00 0.00 177.00 175.72 2b37 n ALA 157 N -3.01 0.00 0.15 8.56 0.00 -1.25 -4.52 120.51 120.44 2b37 n ALA 157 Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.67 2b37 n ALA 157 Cb 0.53 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.66 2b37 n ALA 157 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2b37 h TYR 158 N 0.00 0.00 0.00 0.00 3.20 -1.84 0.39 116.97 118.72 2b37 h TYR 158 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2b37 h TYR 158 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2b37 h TYR 158 CO 0.00 0.00 0.00 0.09 -1.64 0.00 0.00 178.16 176.61 2b37 n ASN 159 N -4.41 0.00 0.05 -2.11 3.02 -1.26 -1.19 115.26 109.35 2b37 n ASN 159 Ca 0.03 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.70 2b37 n ASN 159 Cb 0.32 0.00 0.49 0.00 -0.61 0.00 0.00 39.78 39.98 2b37 n ASN 159 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2b37 n TRP 160 N 11.13 0.42 -0.10 3.10 7.02 -0.58 -2.34 117.44 136.09 2b37 n TRP 160 Ca 0.00 0.13 -0.08 0.00 -1.02 0.00 0.00 57.50 56.54 2b37 n TRP 160 Cb 0.00 -0.72 0.09 0.00 -2.42 0.00 0.00 31.31 28.26 2b37 n TRP 160 CO 0.00 0.00 0.00 1.98 -2.02 0.00 0.00 177.69 177.65 2b37 h MET 161 N 0.00 0.80 -0.86 -0.99 4.05 -1.34 -1.97 114.93 114.62 2b37 h MET 161 Ca 0.00 -0.31 0.06 0.00 -0.28 0.00 0.00 59.70 59.17 2b37 h MET 161 Cb 0.53 -0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 31.22 2b37 h MET 161 CO 0.00 0.93 0.54 1.15 0.23 0.00 0.00 176.91 179.76 2b37 h THR 162 N 0.71 1.04 0.00 -0.77 2.02 -1.43 0.17 112.91 114.65 2b37 h THR 162 Ca 0.10 -0.34 -0.07 0.00 0.77 0.00 0.00 66.41 66.88 2b37 h THR 162 Cb 0.70 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2b37 h THR 162 CO 0.05 0.18 -0.32 0.58 0.37 0.00 0.00 175.52 176.38 2b37 h VAL 163 N 0.98 1.02 -0.03 3.16 2.07 -1.55 -1.37 116.25 120.52 2b37 h VAL 163 Ca 0.38 -1.20 -0.25 0.00 0.82 0.00 0.00 66.70 66.46 2b37 h VAL 163 Cb 0.17 1.69 0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2b37 h VAL 163 CO -0.17 0.32 -0.96 0.00 0.02 0.00 0.00 177.57 176.77 2b37 h ALA 164 N 1.68 0.24 -0.55 1.67 0.00 -0.05 -2.46 119.26 119.79 2b37 h ALA 164 Ca -0.00 -0.68 -0.04 0.00 0.00 0.00 0.00 54.91 54.19 2b37 h ALA 164 Cb 0.66 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2b37 h ALA 164 CO 0.04 0.72 0.17 0.87 0.00 0.00 0.00 179.25 181.05 2b37 h LYS 165 N 0.38 0.85 -0.14 0.00 1.79 -0.53 0.53 116.57 119.45 2b37 h LYS 165 Ca -0.10 -0.18 -0.02 0.00 -2.18 0.00 0.00 60.65 58.16 2b37 h LYS 165 Cb 1.60 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 32.12 2b37 h LYS 165 CO 0.18 0.77 -0.02 0.77 -1.08 0.00 0.00 179.45 180.07 2b37 h SER 166 N 0.76 0.18 -0.44 0.86 0.02 -1.29 -0.77 113.55 112.87 2b37 h SER 166 Ca 0.18 -0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 61.03 2b37 h SER 166 Cb 0.28 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 2b37 h SER 166 CO -0.01 0.24 -0.03 0.00 -1.14 0.00 0.00 176.83 175.89 2b37 h ALA 167 N 1.79 0.59 -0.35 3.77 0.00 -0.91 -3.08 119.26 121.07 2b37 h ALA 167 Ca 0.05 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.69 2b37 h ALA 167 Cb 0.18 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2b37 h ALA 167 CO 0.01 0.42 0.18 1.25 0.00 0.00 0.00 179.25 181.10 2b37 h LEU 168 N 0.63 0.27 -0.75 0.00 6.46 0.14 0.13 115.31 122.19 2b37 h LEU 168 Ca 0.12 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 2b37 h LEU 168 Cb 0.54 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.40 2b37 h LEU 168 CO 0.03 0.20 0.44 -0.33 -0.62 0.00 0.00 178.44 178.16 2b37 h GLU 169 N 0.37 1.03 -0.08 1.25 5.08 -1.24 0.89 114.58 121.89 2b37 h GLU 169 Ca 0.15 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2b37 h GLU 169 Cb 0.05 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.09 2b37 h GLU 169 CO -0.10 0.74 0.00 1.03 -1.00 0.00 0.00 179.01 179.68 2b37 h SER 170 N 1.03 0.13 -0.66 1.42 0.87 -1.38 -2.75 113.55 112.21 2b37 h SER 170 Ca 0.27 -0.31 0.11 0.00 -1.23 0.00 0.00 61.79 60.64 2b37 h SER 170 Cb -0.01 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 61.87 2b37 h SER 170 CO -0.05 0.40 0.44 0.58 -0.53 0.00 0.00 176.83 177.68 2b37 h VAL 171 N -0.15 0.87 -0.61 2.23 2.07 0.38 -1.73 116.25 119.31 2b37 h VAL 171 Ca 0.02 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 2b37 h VAL 171 Cb 0.34 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2b37 h VAL 171 CO 0.00 0.08 0.30 -1.13 0.02 0.00 0.00 177.57 176.84 2b37 h ASN 172 N 0.43 0.79 -0.21 0.57 -1.24 0.11 -1.52 115.58 114.51 2b37 h ASN 172 Ca 0.31 -0.13 -0.07 0.00 0.71 0.00 0.00 56.30 57.12 2b37 h ASN 172 Cb 0.63 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.46 2b37 h ASN 172 CO -0.09 0.70 -0.08 0.03 -1.29 0.00 0.00 177.43 176.69 2b37 h ARG 173 N 0.83 0.57 -0.01 6.67 3.08 -1.13 -1.38 114.38 123.01 2b37 h ARG 173 Ca 0.21 -0.16 -0.23 0.00 0.07 0.00 0.00 59.98 59.87 2b37 h ARG 173 Cb 0.11 -0.06 0.02 0.00 0.08 0.00 0.00 29.97 30.11 2b37 h ARG 173 CO -0.03 0.65 -0.90 0.74 -1.07 0.00 0.00 179.97 179.37 2b37 h PHE 174 N 0.53 0.92 -0.21 3.04 -1.00 -1.35 -3.14 116.94 115.73 2b37 h PHE 174 Ca 0.10 -0.50 0.00 0.00 2.81 0.00 0.00 57.97 60.39 2b37 h PHE 174 Cb 0.47 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.91 2b37 h PHE 174 CO 0.02 1.33 0.14 0.28 -1.61 0.00 0.00 178.31 178.47 2b37 h VAL 175 N 0.26 1.06 -0.18 -0.55 2.07 -1.02 -0.91 116.25 116.98 2b37 h VAL 175 Ca -0.11 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2b37 h VAL 175 Cb 1.57 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 2b37 h VAL 175 CO 0.18 0.05 0.12 0.00 0.02 0.00 0.00 177.57 177.94 2b37 h ALA 176 N 1.87 0.23 -0.08 1.67 0.00 -1.26 1.40 119.26 123.09 2b37 h ALA 176 Ca 0.08 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.01 2b37 h ALA 176 Cb -0.03 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 2b37 h ALA 176 CO -0.02 -0.29 -0.42 0.00 0.00 0.00 0.00 179.25 178.52 2b37 h ARG 177 N 0.24 -0.50 -0.38 0.00 3.08 -1.14 0.16 114.38 115.83 2b37 h ARG 177 Ca 0.07 0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 2b37 h ARG 177 Cb -0.03 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2b37 h ARG 177 CO -0.01 -0.33 0.12 0.93 -1.07 0.00 0.00 179.97 179.60 2b37 h GLU 178 N -0.52 0.59 0.00 0.04 4.39 -1.06 -2.89 114.58 115.13 2b37 h GLU 178 Ca 0.06 -0.13 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 2b37 h GLU 178 Cb 0.63 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.19 2b37 h GLU 178 CO -0.37 0.60 -0.11 0.00 -1.16 0.00 0.00 179.01 177.97 2b37 h ALA 179 N 0.96 1.80 -0.11 3.43 0.00 0.24 -2.83 119.26 122.75 2b37 h ALA 179 Ca 0.12 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2b37 h ALA 179 Cb 0.25 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2b37 h ALA 179 CO -0.00 0.14 0.13 0.78 0.00 0.00 0.00 179.25 180.30 2b37 h GLY 180 N 0.35 0.00 2.00 0.00 0.00 -0.48 -1.76 103.07 103.18 2b37 h GLY 180 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2b37 h GLY 180 CO 0.01 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.05 2b37 h LYS 181 N 0.00 0.00 -0.11 4.80 1.57 -1.65 -1.50 116.57 119.68 2b37 h LYS 181 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2b37 h LYS 181 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2b37 h LYS 181 CO -0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 2b37 n TYR 182 N -3.08 0.11 -2.90 -1.35 4.02 -0.80 -4.93 117.16 108.22 2b37 n TYR 182 Ca 0.00 -0.05 -0.12 0.00 -0.01 0.00 0.00 57.90 57.72 2b37 n TYR 182 Cb 0.28 -0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.64 2b37 n TYR 182 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2b37 n GLY 183 N 1.36 0.11 3.50 2.72 0.00 -0.57 -3.53 105.19 108.79 2b37 n GLY 183 Ca 0.15 -0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 2b37 n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b37 s VAL 184 N -3.04 3.21 -0.09 1.61 1.01 -0.73 0.63 120.40 123.00 2b37 s VAL 184 Ca 0.25 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 2b37 s VAL 184 Cb -0.11 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 2b37 s VAL 184 CO 0.31 0.59 0.08 -0.13 0.00 0.00 0.00 175.10 175.95 2b37 s ARG 185 N -0.73 3.23 -0.17 2.72 0.52 -0.65 -3.10 118.95 120.77 2b37 s ARG 185 Ca 0.11 -0.29 0.01 0.00 -0.52 0.00 0.00 55.73 55.04 2b37 s ARG 185 Cb -0.11 -3.00 0.03 0.00 0.52 0.00 0.00 34.95 32.39 2b37 s ARG 185 CO 0.01 0.73 -0.14 0.45 0.02 0.00 0.00 175.30 176.37 2b37 s SER 186 N -1.12 3.03 0.08 0.23 0.15 -1.26 0.09 113.70 114.91 2b37 s SER 186 Ca 0.16 -0.67 0.01 0.00 0.70 0.00 0.00 55.95 56.15 2b37 s SER 186 Cb -0.12 -1.25 -0.04 0.00 -1.71 0.00 0.00 66.02 62.90 2b37 s SER 186 CO 0.05 -0.08 -0.06 0.20 1.20 0.00 0.00 173.24 174.55 2b37 s ASN 187 N 1.42 0.96 -0.00 5.45 0.01 -0.33 0.22 114.94 122.68 2b37 s ASN 187 Ca 0.03 -0.98 0.05 0.00 -0.71 0.00 0.00 52.86 51.25 2b37 s ASN 187 Cb -0.14 0.12 -0.03 0.00 0.41 0.00 0.00 41.25 41.61 2b37 s ASN 187 CO -0.10 -0.48 -0.14 -0.76 -1.51 0.00 0.00 177.10 174.10 2b37 s LEU 188 N -2.93 2.76 -0.32 0.60 1.02 0.11 -1.81 118.68 118.11 2b37 s LEU 188 Ca 0.09 -0.28 -0.06 0.00 0.02 0.00 0.00 54.13 53.91 2b37 s LEU 188 Cb 0.05 -1.59 0.03 0.00 0.02 0.00 0.00 46.19 44.70 2b37 s LEU 188 CO -0.06 0.30 0.08 -0.69 0.02 0.00 0.00 176.35 176.00 2b37 s VAL 189 N -0.86 3.68 -0.46 -1.59 1.01 -0.61 -1.46 120.40 120.12 2b37 s VAL 189 Ca 0.14 -1.08 -0.26 0.00 0.00 0.00 0.00 61.98 60.78 2b37 s VAL 189 Cb -0.11 -3.05 0.03 0.00 0.00 0.00 0.00 36.38 33.25 2b37 s VAL 189 CO 0.04 -0.11 0.94 0.00 0.00 0.00 0.00 175.10 175.97 2b37 s ALA 190 N 1.40 3.24 0.41 5.51 0.00 0.34 -1.27 121.76 131.39 2b37 s ALA 190 Ca -0.01 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.20 2b37 s ALA 190 Cb -0.19 -3.66 -0.02 0.00 0.00 0.00 0.00 23.12 19.25 2b37 s ALA 190 CO 0.02 -2.05 0.63 0.00 0.00 0.00 0.00 175.76 174.36 2b37 s ALA 191 N 3.80 3.71 0.83 0.00 0.00 -0.98 -0.49 121.76 128.63 2b37 s ALA 191 Ca 0.38 -0.96 -0.12 0.00 0.00 0.00 0.00 51.96 51.26 2b37 s ALA 191 Cb -0.10 -2.16 0.10 0.00 0.00 0.00 0.00 23.12 20.96 2b37 s ALA 191 CO 0.26 -0.23 1.20 0.20 0.00 0.00 0.00 175.76 177.19 2b37 s GLY 192 N -4.13 1.63 0.10 0.00 0.00 -0.60 -4.58 107.32 99.73 2b37 s GLY 192 Ca 0.45 -0.76 -0.31 0.00 0.00 0.00 0.00 44.72 44.10 2b37 s GLY 192 CO 0.38 -0.23 1.48 2.56 0.00 0.00 0.00 173.10 177.29 2b37 s PRO 193 N -5.62 4.27 -0.08 2.90 0.04 -1.26 -5.00 135.00 130.25 2b37 s PRO 193 Ca 0.64 2.16 0.05 0.00 0.04 0.00 0.00 61.00 63.89 2b37 s PRO 193 Cb -0.10 -3.35 -0.01 0.00 0.04 0.00 0.00 34.50 31.09 2b37 s PRO 193 CO 0.49 -0.55 -0.24 0.42 0.04 0.00 0.00 177.00 177.16 2b37 s ILE 194 N 1.63 2.02 -0.26 0.56 -1.09 -1.26 -4.45 121.20 118.36 2b37 s ILE 194 Ca 0.67 -1.02 -0.29 0.00 -2.23 0.00 0.00 60.65 57.78 2b37 s ILE 194 Cb -0.38 -1.73 -0.06 0.00 -1.58 0.00 0.00 42.46 38.71 2b37 s ILE 194 CO 0.30 0.56 2.24 0.54 -1.23 0.00 0.00 174.94 177.35 2b37 n ARG 195 N 3.23 1.78 0.00 2.79 5.12 -0.10 -5.06 116.66 124.43 2b37 n ARG 195 Ca -0.18 0.46 0.00 0.00 -1.93 0.00 0.00 57.85 56.20 2b37 n ARG 195 Cb 0.52 -3.15 0.00 0.00 -1.16 0.00 0.00 32.46 28.67 2b37 n ARG 195 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 2b37 n THR 196 N 7.72 0.00 0.00 0.55 -1.04 -1.26 -4.93 114.28 115.31 2b37 n THR 196 Ca 0.32 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.33 2b37 n THR 196 Cb 0.43 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.94 2b37 n THR 196 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2b37 n LEU 217 N 0.00 0.00 0.16 -4.42 7.94 -1.26 -5.03 117.00 114.39 2b37 n LEU 217 Ca 0.00 0.00 0.07 0.00 -1.11 0.00 0.00 56.01 54.97 2b37 n LEU 217 Cb 0.21 0.00 0.56 0.00 0.53 0.00 0.00 43.42 44.73 2b37 n LEU 217 CO 0.00 0.00 1.11 -0.07 -1.11 0.00 0.00 177.39 177.32 2b37 h LEU 218 N 0.00 0.17 0.00 -1.96 3.38 -2.03 -1.83 115.31 113.05 2b37 h LEU 218 Ca 0.00 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2b37 h LEU 218 Cb 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2b37 h LEU 218 CO 0.00 0.12 -1.21 -0.33 0.09 0.00 0.00 178.44 177.12 2b37 h GLU 219 N 0.20 0.00 0.00 1.13 5.08 -2.00 -2.08 114.58 116.91 2b37 h GLU 219 Ca 0.06 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 2b37 h GLU 219 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2b37 h GLU 219 CO -0.01 0.21 -0.47 1.49 -1.00 0.00 0.00 179.01 179.23 2b37 h GLU 220 N 0.00 0.00 0.00 2.33 4.81 -1.93 -3.09 114.58 116.69 2b37 h GLU 220 Ca -0.10 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.90 2b37 h GLU 220 Cb 1.39 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.73 2b37 h GLU 220 CO 0.03 0.47 -1.30 0.78 -0.73 0.00 0.00 179.01 178.27 2b37 h GLY 221 N 3.04 0.00 0.93 1.92 0.00 -1.41 -3.14 103.07 104.41 2b37 h GLY 221 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2b37 h GLY 221 CO 0.06 0.00 -0.19 -0.25 0.00 0.00 0.00 176.54 176.16 2b37 h TRP 222 N 0.00 -0.50 0.00 5.60 2.91 -1.40 -0.08 115.95 122.48 2b37 h TRP 222 Ca -0.14 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 59.84 2b37 h TRP 222 Cb 1.80 0.16 -0.00 0.00 -0.51 0.00 0.00 29.16 30.61 2b37 h TRP 222 CO 0.00 -0.26 -0.10 0.22 -1.03 0.00 0.00 178.44 177.26 2b37 h ASP 223 N -0.61 0.00 0.34 2.65 1.82 -1.68 0.16 116.42 119.09 2b37 h ASP 223 Ca -0.05 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.57 2b37 h ASP 223 Cb 0.46 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.47 2b37 h ASP 223 CO 0.09 0.10 -0.16 1.56 -1.61 0.00 0.00 179.24 179.22 2b37 h GLN 224 N 0.00 -0.44 -0.97 0.28 4.20 -1.45 -3.33 115.11 113.39 2b37 h GLN 224 Ca -0.00 0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.86 2b37 h GLN 224 Cb 0.26 0.10 -0.08 0.00 0.30 0.00 0.00 27.48 28.06 2b37 h GLN 224 CO 0.01 -0.16 0.60 0.00 -0.67 0.00 0.00 178.83 178.61 2b37 h ARG 225 N -1.02 0.92 -6.42 1.46 3.08 -0.62 -3.41 114.38 108.37 2b37 h ARG 225 Ca -0.05 -0.06 -0.54 0.00 0.07 0.00 0.00 59.98 59.41 2b37 h ARG 225 Cb 0.49 -0.21 0.03 0.00 0.08 0.00 0.00 29.97 30.36 2b37 h ARG 225 CO 0.08 0.61 1.17 0.00 -1.07 0.00 0.00 179.97 180.75 2b37 n ALA 226 N -2.36 1.82 0.42 0.04 0.00 0.52 -4.56 120.51 116.38 2b37 n ALA 226 Ca 0.18 0.26 0.10 0.00 0.00 0.00 0.00 53.44 53.99 2b37 n ALA 226 Cb 0.35 -2.63 0.44 0.00 0.00 0.00 0.00 19.45 17.61 2b37 n ALA 226 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2b37 n PRO 227 N 6.59 0.14 -0.00 0.00 -0.02 -1.19 -2.67 135.00 137.84 2b37 n PRO 227 Ca 0.19 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2b37 n PRO 227 Cb 0.38 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2b37 n PRO 227 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 2b37 n ILE 228 N -2.02 0.84 0.00 4.25 -5.35 -1.25 -5.13 119.36 110.70 2b37 n ILE 228 Ca 0.02 -0.85 0.00 0.00 -0.27 0.00 0.00 62.75 61.65 2b37 n ILE 228 Cb 0.21 0.57 0.00 0.00 -1.74 0.00 0.00 39.64 38.68 2b37 n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2b37 n GLY 229 N -0.43 -0.94 3.11 3.28 0.00 -1.09 -5.01 105.19 104.11 2b37 n GLY 229 Ca 0.00 -1.65 -0.11 0.00 0.00 0.00 0.00 46.02 44.26 2b37 n GLY 229 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2b37 s TRP 230 N -2.00 -0.60 -0.53 1.61 -0.11 -1.26 -4.60 118.94 111.44 2b37 s TRP 230 Ca 0.00 1.19 -0.10 0.00 1.22 0.00 0.00 56.10 58.41 2b37 s TRP 230 Cb 0.00 0.11 0.14 0.00 -1.50 0.00 0.00 33.47 32.21 2b37 s TRP 230 CO 0.00 -0.43 0.42 1.21 -4.62 0.00 0.00 176.95 173.53 2b37 s ASN 231 N 2.51 5.84 0.00 5.86 2.47 -1.26 -4.58 114.94 125.78 2b37 s ASN 231 Ca 0.01 -2.07 0.09 0.00 0.42 0.00 0.00 52.86 51.31 2b37 s ASN 231 Cb -0.12 -2.05 0.46 0.00 -1.45 0.00 0.00 41.25 38.09 2b37 s ASN 231 CO -0.11 -0.68 1.11 1.15 -3.72 0.00 0.00 177.10 174.86 2b37 n MET 232 N 4.73 0.16 0.00 0.43 0.00 -1.26 -0.45 117.12 120.73 2b37 n MET 232 Ca -0.05 0.15 0.12 0.00 0.00 0.00 0.00 57.70 57.92 2b37 n MET 232 Cb 0.41 -1.50 0.12 0.00 0.00 0.00 0.00 33.22 32.25 2b37 n MET 232 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2b37 n LYS 233 N -1.22 0.71 -3.77 3.17 5.02 -1.26 -0.92 118.16 119.89 2b37 n LYS 233 Ca 0.05 -0.53 -0.37 0.00 -2.02 0.00 0.00 58.31 55.44 2b37 n LYS 233 Cb 0.06 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 33.46 2b37 n LYS 233 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b37 s ASP 234 N -2.65 5.25 0.00 4.39 2.15 0.40 -4.95 116.67 121.25 2b37 s ASP 234 Ca 0.17 -1.46 0.26 0.00 0.43 0.00 0.00 52.55 51.95 2b37 s ASP 234 Cb 0.18 -1.84 0.64 0.00 -0.30 0.00 0.00 42.92 41.60 2b37 s ASP 234 CO 0.63 -0.40 1.51 0.00 -0.17 0.00 0.00 175.17 176.74 2b37 n ALA 235 N 4.73 2.54 -0.10 3.66 0.00 -1.26 -4.38 120.51 125.70 2b37 n ALA 235 Ca -0.10 -0.56 -0.12 0.00 0.00 0.00 0.00 53.44 52.66 2b37 n ALA 235 Cb 0.43 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.85 2b37 n ALA 235 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2b37 h THR 236 N 3.42 1.30 -0.00 0.00 2.02 -1.94 -2.87 112.91 114.84 2b37 h THR 236 Ca 0.00 -1.29 0.00 0.00 0.77 0.00 0.00 66.41 65.89 2b37 h THR 236 Cb 0.73 1.49 -0.00 0.00 -1.74 0.00 0.00 68.15 68.63 2b37 h THR 236 CO 0.00 0.41 0.00 -0.65 0.37 0.00 0.00 175.52 175.66 2b37 h PRO 237 N 0.40 0.00 0.17 6.66 0.11 -1.99 -0.58 132.00 136.76 2b37 h PRO 237 Ca 0.06 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.87 2b37 h PRO 237 Cb 0.71 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.83 2b37 h PRO 237 CO 0.05 0.00 -1.43 0.28 -0.21 0.00 0.00 178.00 176.69 2b37 h VAL 238 N 0.00 1.31 -0.31 3.15 2.07 -1.81 -3.25 116.25 117.40 2b37 h VAL 238 Ca 0.00 -2.85 -0.06 0.00 0.82 0.00 0.00 66.70 64.60 2b37 h VAL 238 Cb 0.01 2.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 2b37 h VAL 238 CO -0.00 0.85 -0.06 0.00 0.02 0.00 0.00 177.57 178.38 2b37 h ALA 239 N 0.40 0.42 -0.95 1.67 0.00 -0.97 -2.58 119.26 117.25 2b37 h ALA 239 Ca -0.21 -0.27 0.11 0.00 0.00 0.00 0.00 54.91 54.54 2b37 h ALA 239 Cb 2.05 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 19.66 2b37 h ALA 239 CO 0.21 0.23 0.61 0.87 0.00 0.00 0.00 179.25 181.17 2b37 h LYS 240 N 0.36 0.89 -0.10 0.00 1.57 -1.30 -1.48 116.57 116.50 2b37 h LYS 240 Ca 0.08 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.68 2b37 h LYS 240 Cb 0.53 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 2b37 h LYS 240 CO 0.03 0.59 -0.50 1.15 -0.57 0.00 0.00 179.45 180.14 2b37 h THR 241 N 0.92 1.34 -0.11 -0.16 2.02 -1.55 -1.93 112.91 113.44 2b37 h THR 241 Ca 0.46 -1.75 -0.13 0.00 0.77 0.00 0.00 66.41 65.76 2b37 h THR 241 Cb 0.49 1.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.71 2b37 h THR 241 CO -0.22 0.52 -0.51 0.58 0.37 0.00 0.00 175.52 176.26 2b37 h VAL 242 N 0.22 1.34 -0.59 3.16 2.07 -0.92 -2.68 116.25 118.85 2b37 h VAL 242 Ca 0.01 -1.76 -0.06 0.00 0.82 0.00 0.00 66.70 65.71 2b37 h VAL 242 Cb 0.97 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 2b37 h VAL 242 CO 0.08 0.53 0.12 0.00 0.02 0.00 0.00 177.57 178.31 2b37 h ALA 244 N 1.02 1.17 0.00 0.00 0.00 -1.31 0.29 119.26 120.44 2b37 h ALA 244 Ca 0.18 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 2b37 h ALA 244 Cb 0.39 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2b37 h ALA 244 CO 0.01 0.40 -0.39 -0.07 0.00 0.00 0.00 179.25 179.19 2b37 h LEU 245 N 1.09 0.00 -0.64 0.00 -0.00 -1.08 -2.60 115.31 112.08 2b37 h LEU 245 Ca 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.24 2b37 h LEU 245 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.69 2b37 h LEU 245 CO -0.13 0.39 -0.13 0.18 -0.00 0.00 0.00 178.44 178.76 2b37 n LEU 246 N -3.73 1.13 0.00 1.67 4.77 0.09 -4.77 117.00 116.17 2b37 n LEU 246 Ca -0.01 -0.32 -0.07 0.00 -0.03 0.00 0.00 56.01 55.58 2b37 n LEU 246 Cb 0.48 -0.08 0.04 0.00 -2.33 0.00 0.00 43.42 41.53 2b37 n LEU 246 CO 0.37 0.20 0.17 -1.54 -1.33 0.00 0.00 177.39 175.26 2b37 n SER 247 N -0.36 0.39 -0.70 -1.43 3.41 0.91 -4.83 113.62 111.00 2b37 n SER 247 Ca 0.16 -1.33 0.13 0.00 -0.26 0.00 0.00 58.87 57.56 2b37 n SER 247 Cb 0.34 -0.19 0.24 0.00 -0.26 0.00 0.00 64.21 64.33 2b37 n SER 247 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2b37 n ASP 248 N -2.98 2.28 -0.27 4.04 8.00 -1.26 -4.46 116.55 121.90 2b37 n ASP 248 Ca 0.05 -1.71 0.06 0.00 0.71 0.00 0.00 54.79 53.91 2b37 n ASP 248 Cb 0.17 0.07 0.28 0.00 -0.02 0.00 0.00 41.12 41.62 2b37 n ASP 248 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2b37 n TRP 249 N 0.68 0.15 -2.79 1.24 7.02 -1.26 -3.46 117.44 119.01 2b37 n TRP 249 Ca 0.15 -0.08 -0.16 0.00 -1.02 0.00 0.00 57.50 56.39 2b37 n TRP 249 Cb 0.49 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.38 2b37 n TRP 249 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2b37 n LEU 250 N -0.16 2.13 0.00 -0.99 4.77 -1.26 -4.97 117.00 116.52 2b37 n LEU 250 Ca 0.10 -4.49 0.10 0.00 -0.03 0.00 0.00 56.01 51.69 2b37 n LEU 250 Cb 0.16 0.26 0.56 0.00 -2.33 0.00 0.00 43.42 42.08 2b37 n LEU 250 CO 0.08 1.94 0.80 -0.81 -1.33 0.00 0.00 177.39 178.06 2b37 n PRO 251 N -0.06 0.52 -0.02 3.23 -0.04 -1.22 -2.97 135.00 134.43 2b37 n PRO 251 Ca 0.20 0.03 0.02 0.00 -0.04 0.00 0.00 63.50 63.72 2b37 n PRO 251 Cb 0.71 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.70 2b37 n PRO 251 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b37 n ALA 252 N -1.09 2.02 -3.22 0.55 0.00 -1.26 -4.99 120.51 112.51 2b37 n ALA 252 Ca 0.13 -1.31 -0.30 0.00 0.00 0.00 0.00 53.44 51.96 2b37 n ALA 252 Cb 0.10 -0.08 -0.17 0.00 0.00 0.00 0.00 19.45 19.30 2b37 n ALA 252 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2b37 s THR 253 N -1.33 1.87 0.21 0.00 -1.32 -1.16 -5.12 115.64 108.79 2b37 s THR 253 Ca 0.06 -0.92 -0.21 0.00 -1.21 0.00 0.00 61.69 59.42 2b37 s THR 253 Cb 0.06 -1.63 0.05 0.00 -1.51 0.00 0.00 72.50 69.47 2b37 s THR 253 CO 0.01 0.52 0.62 0.28 -2.21 0.00 0.00 174.62 173.84 2b37 s THR 254 N 0.35 0.01 -1.71 5.08 -1.32 -1.26 -4.69 115.64 112.10 2b37 s THR 254 Ca -0.17 -0.48 -0.01 0.00 -1.21 0.00 0.00 61.69 59.83 2b37 s THR 254 Cb -0.17 -1.43 0.00 0.00 -1.51 0.00 0.00 72.50 69.39 2b37 s THR 254 CO 0.07 -0.03 0.10 0.61 -2.21 0.00 0.00 174.62 173.17 2b37 n GLY 255 N -0.40 -0.48 3.31 6.08 0.00 0.61 -4.91 105.19 109.40 2b37 n GLY 255 Ca -0.11 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.74 2b37 n GLY 255 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b37 s ASP 256 N -2.19 1.12 -0.17 1.61 -1.08 -1.17 -4.57 116.67 110.22 2b37 s ASP 256 Ca 0.05 -1.42 0.01 0.00 -0.52 0.00 0.00 52.55 50.67 2b37 s ASP 256 Cb -0.02 0.24 0.02 0.00 -1.46 0.00 0.00 42.92 41.70 2b37 s ASP 256 CO 0.06 -0.78 -0.17 -0.63 0.52 0.00 0.00 175.17 174.18 2b37 s ILE 257 N -3.78 1.86 0.05 4.11 1.01 -1.26 0.07 121.20 123.26 2b37 s ILE 257 Ca 0.38 -0.87 -0.08 0.00 0.00 0.00 0.00 60.65 60.07 2b37 s ILE 257 Cb 0.07 -1.73 -0.05 0.00 0.01 0.00 0.00 42.46 40.75 2b37 s ILE 257 CO 0.14 0.45 0.34 -0.63 0.00 0.00 0.00 174.94 175.24 2b37 s ILE 258 N 1.36 5.19 -0.22 2.92 1.09 -0.54 -4.96 121.20 126.04 2b37 s ILE 258 Ca 0.04 0.30 -0.03 0.00 -1.10 0.00 0.00 60.65 59.86 2b37 s ILE 258 Cb -0.14 -3.61 -0.00 0.00 -1.06 0.00 0.00 42.46 37.65 2b37 s ILE 258 CO -0.11 0.31 -0.06 -0.31 -0.10 0.00 0.00 174.94 174.67 2b37 s TYR 259 N -1.36 2.95 -0.75 3.97 1.51 -1.26 -0.50 117.35 121.90 2b37 s TYR 259 Ca 0.31 -1.03 0.03 0.00 -1.01 0.00 0.00 57.07 55.37 2b37 s TYR 259 Cb -0.14 -2.09 0.26 0.00 -0.11 0.00 0.00 41.96 39.88 2b37 s TYR 259 CO 0.18 -0.58 0.88 0.00 -1.11 0.00 0.00 175.55 174.92 2b37 n ALA 260 N 4.78 4.25 -1.28 3.71 0.00 0.36 -4.76 120.51 127.56 2b37 n ALA 260 Ca -0.18 -4.76 0.04 0.00 0.00 0.00 0.00 53.44 48.54 2b37 n ALA 260 Cb 0.51 -1.25 0.06 0.00 0.00 0.00 0.00 19.45 18.77 2b37 n ALA 260 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2b37 n ASP 261 N 1.09 1.22 0.00 0.00 5.75 -1.26 -1.55 116.55 121.80 2b37 n ASP 261 Ca 0.28 -2.36 0.00 0.00 -0.01 0.00 0.00 54.79 52.70 2b37 n ASP 261 Cb 0.39 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 2b37 n ASP 261 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2b37 n GLY 262 N -0.67 0.61 1.09 6.12 0.00 -1.26 -2.74 105.19 108.35 2b37 n GLY 262 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2b37 n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b37 n GLY 263 N -2.46 0.70 0.07 -0.02 0.00 -1.26 -3.19 105.19 99.02 2b37 n GLY 263 Ca 0.00 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.62 2b37 n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b37 h ALA 264 N 0.00 0.09 0.00 4.61 0.00 -1.76 -3.07 119.26 119.14 2b37 h ALA 264 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2b37 h ALA 264 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2b37 h ALA 264 CO 0.00 -0.40 0.00 1.12 0.00 0.00 0.00 179.25 179.97 2b37 h HIS 265 N 0.07 0.00 -0.65 0.00 2.07 -1.93 -1.04 115.15 113.66 2b37 h HIS 265 Ca 0.03 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 2b37 h HIS 265 Cb 0.03 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.01 2b37 h HIS 265 CO -0.06 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.05 2b37 n THR 266 N -2.68 1.12 -3.87 6.12 -2.24 -1.16 -4.84 114.28 106.73 2b37 n THR 266 Ca -0.02 -0.95 -0.26 0.00 -2.27 0.00 0.00 64.05 60.55 2b37 n THR 266 Cb 0.08 0.35 -0.17 0.00 -2.10 0.00 0.00 70.33 68.48 2b37 n THR 266 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2b37 s GLN 267 N -1.31 1.31 -0.01 -0.78 -1.52 -0.40 -5.05 119.66 111.91 2b37 s GLN 267 Ca 0.46 -0.18 -0.18 0.00 -1.95 0.00 0.00 55.36 53.50 2b37 s GLN 267 Cb 0.25 -1.47 -0.10 0.00 -0.22 0.00 0.00 33.01 31.47 2b37 s GLN 267 CO 0.28 -0.29 0.82 1.25 -0.25 0.00 0.00 175.29 177.10 2b37 h LEU 268 N 8.21 -0.55 -0.92 2.90 5.85 -1.88 -3.48 115.31 125.43 2b37 h LEU 268 Ca -0.27 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2b37 h LEU 268 Cb 1.13 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.30 2b37 h LEU 268 CO 0.37 -0.20 0.00 0.18 -0.34 0.00 0.00 178.44 178.46