#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 2.15 0.07 3.38 0.00 -1.26 -5.03 107.32 106.63 2b37 s GLY 3 Ca 0.00 -2.10 -0.16 0.00 0.00 0.00 0.00 44.72 42.45 2b37 s GLY 3 CO 0.00 -1.87 1.31 -2.00 0.00 0.00 0.00 173.10 170.54 2b37 h LEU 4 N 2.05 0.71 -4.53 0.66 6.46 -1.93 -3.32 115.31 115.40 2b37 h LEU 4 Ca -0.41 -0.58 -0.64 0.00 -0.12 0.00 0.00 57.88 56.13 2b37 h LEU 4 Cb 1.24 -0.21 -0.37 0.00 -0.73 0.00 0.00 40.66 40.59 2b37 h LEU 4 CO 0.72 1.16 -0.16 0.18 -0.62 0.00 0.00 178.44 179.72 2b37 n LEU 5 N -4.21 5.68 -4.70 2.25 4.32 -1.17 -4.76 117.00 114.41 2b37 n LEU 5 Ca -0.06 -5.01 -0.42 0.00 -0.02 0.00 0.00 56.01 50.49 2b37 n LEU 5 Cb 0.57 -0.64 -0.03 0.00 -1.62 0.00 0.00 43.42 41.70 2b37 n LEU 5 CO 0.47 2.05 1.10 -0.62 -1.22 0.00 0.00 177.39 179.17 2b37 s ASP 6 N -2.78 6.85 -1.36 -1.43 3.68 -1.06 -2.47 116.67 118.10 2b37 s ASP 6 Ca 0.50 2.17 -0.02 0.00 2.13 0.00 0.00 52.55 57.33 2b37 s ASP 6 Cb 0.42 -2.57 0.00 0.00 -1.45 0.00 0.00 42.92 39.32 2b37 s ASP 6 CO -0.22 -0.69 0.30 0.61 0.13 0.00 0.00 175.17 175.30 2b37 n GLY 7 N 3.60 -0.32 3.61 2.66 0.00 0.28 -4.90 105.19 110.11 2b37 n GLY 7 Ca 0.13 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 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 -5.23 3.93 -0.20 1.61 1.02 -1.17 -4.90 119.74 114.80 2b37 s LYS 8 Ca 0.15 -0.36 -0.24 0.00 0.02 0.00 0.00 55.97 55.53 2b37 s LYS 8 Cb -0.06 -3.23 -0.01 0.00 -0.52 0.00 0.00 37.83 34.01 2b37 s LYS 8 CO 0.18 0.21 0.78 0.50 -0.92 0.00 0.00 175.35 176.11 2b37 s ARG 9 N 0.54 4.23 -0.00 1.68 3.52 -1.26 -1.70 118.95 125.96 2b37 s ARG 9 Ca 0.03 0.90 0.01 0.00 -0.13 0.00 0.00 55.73 56.53 2b37 s ARG 9 Cb -0.13 -3.60 -0.00 0.00 -1.56 0.00 0.00 34.95 29.66 2b37 s ARG 9 CO 0.01 -0.38 -0.02 0.42 -0.81 0.00 0.00 175.30 174.52 2b37 s ILE 10 N 2.36 0.14 0.06 4.11 1.01 -0.49 0.27 121.20 128.66 2b37 s ILE 10 Ca 0.35 -0.07 0.01 0.00 0.00 0.00 0.00 60.65 60.94 2b37 s ILE 10 Cb -0.16 -0.13 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 2b37 s ILE 10 CO 0.10 0.04 0.16 -0.22 0.00 0.00 0.00 174.94 175.03 2b37 s LEU 11 N -0.00 4.16 -0.06 2.97 0.20 -0.48 -1.37 118.68 124.10 2b37 s LEU 11 Ca 0.00 0.18 -0.02 0.00 0.69 0.00 0.00 54.13 54.98 2b37 s LEU 11 Cb -0.01 -2.77 0.04 0.00 -0.43 0.00 0.00 46.19 43.01 2b37 s LEU 11 CO -0.00 0.18 0.12 -0.69 -0.29 0.00 0.00 176.35 175.66 2b37 s VAL 12 N -1.45 -0.11 0.40 1.68 1.01 -0.32 -0.61 120.40 120.99 2b37 s VAL 12 Ca 0.33 0.26 0.08 0.00 0.00 0.00 0.00 61.98 62.64 2b37 s VAL 12 Cb -0.13 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 2b37 s VAL 12 CO 0.25 0.11 0.23 -0.94 0.00 0.00 0.00 175.10 174.76 2b37 s SER 13 N 1.53 4.67 0.00 3.32 1.04 -0.47 -2.17 113.70 121.63 2b37 s SER 13 Ca -0.05 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.47 2b37 s SER 13 Cb -0.12 -0.56 0.00 0.00 0.10 0.00 0.00 66.02 65.44 2b37 s SER 13 CO -0.05 -0.53 0.00 0.61 0.98 0.00 0.00 173.24 174.25 2b37 n GLY 14 N -1.32 0.31 3.64 7.32 0.00 -1.26 -3.93 105.19 109.96 2b37 n GLY 14 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2b37 n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b37 s ILE 15 N -2.00 4.22 0.00 -0.61 1.01 -1.26 -4.72 121.20 117.84 2b37 s ILE 15 Ca 0.00 1.42 0.00 0.00 0.00 0.00 0.00 60.65 62.07 2b37 s ILE 15 Cb 0.00 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.38 2b37 s ILE 15 CO 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 174.94 174.63 2b37 n ILE 16 N 5.81 0.00 -4.33 2.92 0.13 -1.26 -4.83 119.36 117.80 2b37 n ILE 16 Ca 0.14 0.00 -0.20 0.00 -1.10 0.00 0.00 62.75 61.59 2b37 n ILE 16 Cb 0.46 -0.67 -0.07 0.00 -0.84 0.00 0.00 39.64 38.52 2b37 n ILE 16 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 2b37 n THR 17 N -2.27 0.00 1.41 9.51 -2.24 -1.26 -4.66 114.28 114.76 2b37 n THR 17 Ca 0.00 -2.26 0.14 0.00 -2.27 0.00 0.00 64.05 59.66 2b37 n THR 17 Cb 0.48 1.03 0.64 0.00 -2.10 0.00 0.00 70.33 70.39 2b37 n THR 17 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2b37 n ASP 18 N -1.71 0.35 0.20 3.42 5.75 -1.26 -2.62 116.55 120.68 2b37 n ASP 18 Ca 0.03 -0.47 0.13 0.00 -0.01 0.00 0.00 54.79 54.48 2b37 n ASP 18 Cb 0.57 -0.12 0.30 0.00 -1.03 0.00 0.00 41.12 40.84 2b37 n ASP 18 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2b37 h SER 19 N 0.41 0.00 -3.87 -1.12 0.02 -1.96 -3.46 113.55 103.57 2b37 h SER 19 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 2b37 h SER 19 Cb 0.34 0.00 0.09 0.00 0.14 0.00 0.00 62.40 62.96 2b37 h SER 19 CO 0.00 0.00 0.72 -0.44 -1.14 0.00 0.00 176.83 175.97 2b37 s SER 20 N -5.70 6.55 0.48 3.07 0.01 -1.08 -4.70 113.70 112.34 2b37 s SER 20 Ca 0.07 2.87 0.13 0.00 1.31 0.00 0.00 55.95 60.33 2b37 s SER 20 Cb 0.07 -2.66 1.14 0.00 0.21 0.00 0.00 66.02 64.79 2b37 s SER 20 CO 0.63 -0.72 2.12 0.40 0.41 0.00 0.00 173.24 176.08 2b37 h ILE 21 N 3.04 1.02 -0.25 1.44 2.04 -1.90 -0.41 117.51 122.50 2b37 h ILE 21 Ca -0.50 -0.06 -0.11 0.00 1.00 0.00 0.00 64.86 65.19 2b37 h ILE 21 Cb 1.23 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2b37 h ILE 21 CO 0.66 0.03 -0.30 0.00 0.00 0.00 0.00 178.15 178.54 2b37 h ALA 22 N 1.91 1.02 -0.73 1.87 0.00 -1.85 -1.62 119.26 119.86 2b37 h ALA 22 Ca 0.06 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2b37 h ALA 22 Cb 0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2b37 h ALA 22 CO -0.01 0.59 0.42 0.35 0.00 0.00 0.00 179.25 180.59 2b37 h PHE 23 N 0.43 0.99 0.00 0.00 3.57 -1.35 0.47 116.94 121.05 2b37 h PHE 23 Ca 0.06 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 2b37 h PHE 23 Cb 0.74 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 2b37 h PHE 23 CO 0.03 0.69 -0.36 0.45 -2.23 0.00 0.00 178.31 176.89 2b37 h HIS 24 N 1.01 0.00 -0.03 0.41 3.86 -1.43 0.66 115.15 119.62 2b37 h HIS 24 Ca 0.26 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.24 2b37 h HIS 24 Cb 0.01 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.48 2b37 h HIS 24 CO -0.01 0.36 -0.91 0.82 0.86 0.00 0.00 177.93 179.05 2b37 h ILE 25 N 0.00 1.35 0.31 2.45 2.04 -0.84 -2.04 117.51 120.79 2b37 h ILE 25 Ca -0.00 -2.29 -0.01 0.00 1.00 0.00 0.00 64.86 63.55 2b37 h ILE 25 Cb 1.26 2.30 0.00 0.00 -0.74 0.00 0.00 36.82 39.65 2b37 h ILE 25 CO 0.05 0.69 -0.15 0.00 0.00 0.00 0.00 178.15 178.74 2b37 h ALA 26 N 0.67 -0.41 -0.46 1.87 0.00 0.12 -1.13 119.26 119.91 2b37 h ALA 26 Ca -0.08 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.72 2b37 h ALA 26 Cb 1.54 0.16 -0.10 0.00 0.00 0.00 0.00 17.79 19.39 2b37 h ALA 26 CO 0.17 -0.56 -0.41 -0.09 0.00 0.00 0.00 179.25 178.35 2b37 h ARG 27 N -0.75 -0.27 -0.48 0.00 2.43 0.29 0.92 114.38 116.51 2b37 h ARG 27 Ca -0.04 0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 2b37 h ARG 27 Cb 0.50 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 2b37 h ARG 27 CO 0.07 -0.18 0.03 0.28 -1.51 0.00 0.00 179.97 178.66 2b37 h VAL 28 N -0.28 1.26 -0.71 0.20 2.07 -1.44 0.11 116.25 117.46 2b37 h VAL 28 Ca 0.16 -1.01 0.16 0.00 0.82 0.00 0.00 66.70 66.83 2b37 h VAL 28 Cb 0.57 0.96 -0.12 0.00 -1.52 0.00 0.00 31.29 31.19 2b37 h VAL 28 CO -0.60 0.35 0.07 0.00 0.02 0.00 0.00 177.57 177.40 2b37 h ALA 29 N 0.94 0.79 -0.38 1.67 0.00 -0.44 -1.02 119.26 120.82 2b37 h ALA 29 Ca 0.14 0.20 -0.15 0.00 0.00 0.00 0.00 54.91 55.10 2b37 h ALA 29 Cb 0.46 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2b37 h ALA 29 CO 0.02 -0.39 -0.35 1.96 0.00 0.00 0.00 179.25 180.49 2b37 h GLN 30 N 0.16 0.89 0.00 0.00 4.20 -0.31 -2.65 115.11 117.41 2b37 h GLN 30 Ca 0.39 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2b37 h GLN 30 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 2b37 h GLN 30 CO -0.57 1.09 0.00 0.93 -0.67 0.00 0.00 178.83 179.61 2b37 h GLU 31 N 0.74 0.00 -0.44 1.46 5.08 0.34 -2.10 114.58 119.65 2b37 h GLU 31 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2b37 h GLU 31 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2b37 h GLU 31 CO 0.09 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.14 2b37 n GLN 32 N -2.61 2.69 -1.56 2.33 1.13 -0.50 -4.89 117.38 113.98 2b37 n GLN 32 Ca -0.02 -2.20 0.00 0.00 -1.94 0.00 0.00 57.00 52.85 2b37 n GLN 32 Cb 0.06 -1.37 0.00 0.00 0.11 0.00 0.00 30.24 29.05 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 0.90 0.54 3.90 1.08 0.00 -0.79 -2.56 105.19 108.25 2b37 n GLY 33 Ca 0.15 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 45.05 2b37 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b37 s ALA 34 N -2.00 3.73 -0.13 4.61 0.00 -1.03 0.98 121.76 127.92 2b37 s ALA 34 Ca 0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 51.96 51.27 2b37 s ALA 34 Cb 0.00 -2.18 -0.05 0.00 0.00 0.00 0.00 23.12 20.89 2b37 s ALA 34 CO 0.00 0.52 0.27 -1.14 0.00 0.00 0.00 175.76 175.41 2b37 s GLN 35 N -2.98 4.04 0.01 0.00 0.74 -0.69 -4.54 119.66 116.24 2b37 s GLN 35 Ca 0.42 0.09 0.07 0.00 0.05 0.00 0.00 55.36 55.98 2b37 s GLN 35 Cb -0.11 -3.35 -0.03 0.00 1.10 0.00 0.00 33.01 30.62 2b37 s GLN 35 CO 0.26 0.42 -0.19 -0.51 -0.55 0.00 0.00 175.29 174.72 2b37 s LEU 36 N -0.09 2.52 -0.00 3.68 1.43 -1.26 -1.40 118.68 123.56 2b37 s LEU 36 Ca 0.17 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2b37 s LEU 36 Cb -0.13 -1.48 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 2b37 s LEU 36 CO 0.05 0.29 -0.08 -0.69 0.23 0.00 0.00 176.35 176.15 2b37 s VAL 37 N -0.82 3.54 -0.05 -1.59 1.01 -0.47 -4.00 120.40 118.02 2b37 s VAL 37 Ca 0.13 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.36 2b37 s VAL 37 Cb -0.10 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.76 2b37 s VAL 37 CO 0.03 0.42 -0.13 -0.76 0.00 0.00 0.00 175.10 174.65 2b37 s LEU 38 N -1.32 1.79 0.21 3.92 1.43 0.10 -1.17 118.68 123.63 2b37 s LEU 38 Ca 0.16 -0.30 0.07 0.00 -1.03 0.00 0.00 54.13 53.04 2b37 s LEU 38 Cb -0.11 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 45.25 2b37 s LEU 38 CO 0.06 0.09 0.08 0.42 0.23 0.00 0.00 176.35 177.23 2b37 s THR 39 N 0.31 4.01 -0.03 5.49 -4.23 -0.92 -0.43 115.64 119.84 2b37 s THR 39 Ca -0.08 -1.44 -0.07 0.00 -1.18 0.00 0.00 61.69 58.92 2b37 s THR 39 Cb -0.13 -3.09 0.01 0.00 1.34 0.00 0.00 72.50 70.64 2b37 s THR 39 CO 0.02 -0.22 0.17 -0.83 -0.54 0.00 0.00 174.62 173.22 2b37 s GLY 40 N -3.34 -0.05 0.00 3.99 0.00 -0.94 -4.19 107.32 102.79 2b37 s GLY 40 Ca 0.30 0.19 0.00 0.00 0.00 0.00 0.00 44.72 45.22 2b37 s GLY 40 CO 0.21 0.09 0.00 0.33 0.00 0.00 0.00 173.10 173.73 2b37 n PHE 41 N 2.17 0.00 0.04 1.90 7.35 -1.26 -0.35 117.46 127.31 2b37 n PHE 41 Ca -0.18 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.51 2b37 n PHE 41 Cb 0.57 -0.28 0.00 0.00 0.35 0.00 0.00 39.48 40.12 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 -1.50 0.61 -3.68 -2.13 2.03 -1.26 -4.44 116.55 106.18 2b37 n ASP 42 Ca 0.00 0.11 -0.42 0.00 0.52 0.00 0.00 54.79 55.00 2b37 n ASP 42 Cb 0.00 -0.16 -0.07 0.00 -0.72 0.00 0.00 41.12 40.17 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 -3.12 1.30 0.16 -0.67 1.74 -1.26 -4.66 116.66 110.15 2b37 n ARG 43 Ca 0.00 -1.78 0.01 0.00 -0.77 0.00 0.00 57.85 55.31 2b37 n ARG 43 Cb 0.00 -2.93 0.30 0.00 -1.02 0.00 0.00 32.46 28.81 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 14.69 0.05 -0.20 0.55 -0.00 -1.94 -1.95 115.31 126.51 2b37 h LEU 44 Ca 0.38 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.24 2b37 h LEU 44 Cb 0.69 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.34 2b37 h LEU 44 CO 1.91 0.46 -0.14 0.54 -0.00 0.00 0.00 178.44 181.21 2b37 n ARG 45 N -4.04 0.56 -0.12 1.13 1.74 -1.26 -2.23 116.66 112.44 2b37 n ARG 45 Ca -0.02 -0.20 -0.16 0.00 -0.77 0.00 0.00 57.85 56.71 2b37 n ARG 45 Cb 0.45 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 30.27 2b37 n ARG 45 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2b37 n LEU 46 N -1.04 2.41 0.24 0.55 0.00 -0.99 -3.59 117.00 114.57 2b37 n LEU 46 Ca 0.13 -0.11 0.11 0.00 0.00 0.00 0.00 56.01 56.14 2b37 n LEU 46 Cb 0.29 -0.61 0.58 0.00 0.00 0.00 0.00 43.42 43.69 2b37 n LEU 46 CO 0.25 0.83 0.88 0.16 0.00 0.00 0.00 177.39 179.51 2b37 h ILE 47 N 0.00 0.54 0.44 1.96 3.07 -1.44 0.65 117.51 122.72 2b37 h ILE 47 Ca -0.55 -0.86 -0.01 0.00 1.55 0.00 0.00 64.86 64.99 2b37 h ILE 47 Cb 1.92 1.58 -0.01 0.00 -0.27 0.00 0.00 36.82 40.04 2b37 h ILE 47 CO -0.06 0.17 -0.34 1.56 -1.05 0.00 0.00 178.15 178.43 2b37 h GLN 48 N 0.00 -0.74 0.00 0.16 1.08 -1.61 -1.57 115.11 112.43 2b37 h GLN 48 Ca -0.00 0.05 -0.08 0.00 -1.45 0.00 0.00 58.65 57.17 2b37 h GLN 48 Cb 0.57 0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 28.15 2b37 h GLN 48 CO 0.02 -0.49 -0.39 -0.09 -0.95 0.00 0.00 178.83 176.93 2b37 h ARG 49 N -0.77 0.00 -0.19 1.46 1.12 -1.44 -2.32 114.38 112.25 2b37 h ARG 49 Ca -0.04 0.00 -0.13 0.00 -1.11 0.00 0.00 59.98 58.70 2b37 h ARG 49 Cb 0.66 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.62 2b37 h ARG 49 CO -0.00 0.39 -0.40 0.82 -3.11 0.00 0.00 179.97 177.67 2b37 h ILE 50 N 0.00 1.33 0.00 1.20 1.08 -0.92 -3.33 117.51 116.87 2b37 h ILE 50 Ca -0.00 -1.64 -0.07 0.00 -0.39 0.00 0.00 64.86 62.76 2b37 h ILE 50 Cb 0.83 1.90 -0.01 0.00 -3.07 0.00 0.00 36.82 36.47 2b37 h ILE 50 CO 0.05 0.50 -0.35 0.71 -0.69 0.00 0.00 178.15 178.38 2b37 h THR 51 N 0.27 0.66 -0.60 -0.27 1.35 -1.05 -3.11 112.91 110.16 2b37 h THR 51 Ca 0.00 -1.69 0.11 0.00 -0.55 0.00 0.00 66.41 64.28 2b37 h THR 51 Cb 1.00 2.14 -0.12 0.00 -1.73 0.00 0.00 68.15 69.45 2b37 h THR 51 CO 0.09 0.34 -0.27 0.44 -0.25 0.00 0.00 175.52 175.87 2b37 h ASP 52 N 0.00 -0.93 0.00 5.36 3.45 -1.52 -0.95 116.42 121.82 2b37 h ASP 52 Ca -0.00 0.21 0.00 0.00 0.43 0.00 0.00 57.03 57.67 2b37 h ASP 52 Cb 1.12 0.50 0.00 0.00 -0.56 0.00 0.00 39.33 40.39 2b37 h ASP 52 CO 0.05 -0.27 0.00 0.54 -1.57 0.00 0.00 179.24 177.98 2b37 n ARG 53 N -5.44 0.35 -4.33 3.56 1.74 -1.18 -4.78 116.66 106.59 2b37 n ARG 53 Ca 0.05 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.80 2b37 n ARG 53 Cb 0.35 -1.31 -0.09 0.00 -1.02 0.00 0.00 32.46 30.39 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 0.00 3.54 0.11 0.55 1.43 -0.36 -5.03 118.68 118.92 2b37 s LEU 54 Ca 0.00 0.05 -0.07 0.00 -1.03 0.00 0.00 54.13 53.08 2b37 s LEU 54 Cb 0.00 -1.94 0.13 0.00 0.03 0.00 0.00 46.19 44.41 2b37 s LEU 54 CO 0.00 0.32 0.72 -2.65 0.23 0.00 0.00 176.35 174.97 2b37 n PRO 55 N 1.70 -0.10 -4.42 1.29 -0.02 -1.26 -4.16 135.00 128.03 2b37 n PRO 55 Ca -0.16 0.71 -0.26 0.00 -2.02 0.00 0.00 63.50 61.77 2b37 n PRO 55 Cb 0.53 -1.06 -0.11 0.00 -0.02 0.00 0.00 33.50 32.84 2b37 n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b37 s ALA 56 N -5.47 2.61 0.57 3.55 0.00 -1.26 -5.12 121.76 116.64 2b37 s ALA 56 Ca -0.06 -1.68 -0.17 0.00 0.00 0.00 0.00 51.96 50.05 2b37 s ALA 56 Cb 0.10 -0.35 -0.05 0.00 0.00 0.00 0.00 23.12 22.83 2b37 s ALA 56 CO 0.34 0.40 1.07 -1.59 0.00 0.00 0.00 175.76 175.98 2b37 s LYS 57 N -2.85 3.37 -0.11 0.00 -2.85 -1.26 -4.99 119.74 111.05 2b37 s LYS 57 Ca 0.23 1.33 -0.25 0.00 -1.00 0.00 0.00 55.97 56.28 2b37 s LYS 57 Cb -0.07 -2.03 0.06 0.00 -2.06 0.00 0.00 37.83 33.72 2b37 s LYS 57 CO 0.11 -0.79 0.60 0.00 0.10 0.00 0.00 175.35 175.38 2b37 s ALA 58 N -2.21 -1.54 0.27 0.59 0.00 -1.26 -4.96 121.76 112.65 2b37 s ALA 58 Ca 0.66 1.32 -0.31 0.00 0.00 0.00 0.00 51.96 53.63 2b37 s ALA 58 Cb -0.18 -0.34 -0.12 0.00 0.00 0.00 0.00 23.12 22.47 2b37 s ALA 58 CO 0.32 -0.33 1.54 -0.35 0.00 0.00 0.00 175.76 176.94 2b37 n PRO 59 N 1.60 2.45 -3.80 0.00 -0.04 -1.26 -4.87 135.00 129.08 2b37 n PRO 59 Ca -0.18 0.87 -0.29 0.00 -0.04 0.00 0.00 63.50 63.87 2b37 n PRO 59 Cb 0.56 -2.61 -0.13 0.00 -0.04 0.00 0.00 33.50 31.28 2b37 n PRO 59 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2b37 s LEU 60 N -0.14 3.58 0.44 1.53 1.98 -1.26 -0.72 118.68 124.10 2b37 s LEU 60 Ca 0.66 -3.06 -0.10 0.00 -2.89 0.00 0.00 54.13 48.75 2b37 s LEU 60 Cb -0.56 -1.31 -0.06 0.00 0.66 0.00 0.00 46.19 44.92 2b37 s LEU 60 CO 0.48 -0.21 0.81 -0.76 -1.89 0.00 0.00 176.35 174.78 2b37 s LEU 61 N -0.28 3.73 0.31 -0.68 1.43 0.43 -4.92 118.68 118.70 2b37 s LEU 61 Ca 0.20 1.13 -0.14 0.00 -1.03 0.00 0.00 54.13 54.30 2b37 s LEU 61 Cb -0.18 -4.05 -0.09 0.00 0.03 0.00 0.00 46.19 41.90 2b37 s LEU 61 CO -0.05 -0.49 0.71 -0.70 0.23 0.00 0.00 176.35 176.05 2b37 s GLU 62 N -4.16 3.96 -0.32 1.70 2.12 -1.26 -2.21 118.70 118.54 2b37 s GLU 62 Ca 0.51 0.60 -0.02 0.00 0.36 0.00 0.00 54.97 56.43 2b37 s GLU 62 Cb -0.10 -2.46 0.19 0.00 0.26 0.00 0.00 34.13 32.02 2b37 s GLU 62 CO 0.36 0.17 0.82 -1.17 -0.54 0.00 0.00 175.26 174.90 2b37 s LEU 63 N -3.00 -1.02 -0.60 2.70 2.96 0.52 -4.73 118.68 115.51 2b37 s LEU 63 Ca 0.53 -0.08 -0.22 0.00 -0.22 0.00 0.00 54.13 54.14 2b37 s LEU 63 Cb -0.10 1.52 0.07 0.00 0.50 0.00 0.00 46.19 48.18 2b37 s LEU 63 CO 0.18 -0.16 0.86 -0.62 -1.32 0.00 0.00 176.35 175.29 2b37 s ASP 64 N 2.57 6.21 0.09 3.68 2.15 -1.26 -3.99 116.67 126.12 2b37 s ASP 64 Ca 0.18 -0.96 0.05 0.00 0.43 0.00 0.00 52.55 52.24 2b37 s ASP 64 Cb -0.04 -2.38 0.26 0.00 -0.30 0.00 0.00 42.92 40.46 2b37 s ASP 64 CO -0.20 -1.26 1.04 1.33 -0.17 0.00 0.00 175.17 175.91 2b37 n VAL 65 N 5.85 1.30 1.11 1.11 0.24 -1.26 0.84 118.33 127.53 2b37 n VAL 65 Ca -0.04 0.57 0.08 0.00 -2.04 0.00 0.00 64.34 62.90 2b37 n VAL 65 Cb 0.45 -1.57 0.26 0.00 -1.47 0.00 0.00 33.84 31.51 2b37 n VAL 65 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b37 n GLN 66 N -1.60 1.72 -3.75 7.34 6.02 -1.26 -4.80 117.38 121.05 2b37 n GLN 66 Ca -0.00 -1.10 -0.37 0.00 -0.01 0.00 0.00 57.00 55.51 2b37 n GLN 66 Cb 0.15 -1.32 -0.12 0.00 1.02 0.00 0.00 30.24 29.96 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 -1.27 5.18 0.37 1.08 2.47 0.25 -4.97 114.94 118.05 2b37 s ASN 67 Ca 0.27 -0.69 0.10 0.00 0.42 0.00 0.00 52.86 52.96 2b37 s ASN 67 Cb 0.14 -1.90 0.86 0.00 -1.45 0.00 0.00 41.25 38.90 2b37 s ASN 67 CO 0.20 -0.19 1.90 -0.08 -3.72 0.00 0.00 177.10 175.21 2b37 h GLU 68 N 8.25 0.62 0.02 0.43 4.57 -1.87 -2.58 114.58 124.03 2b37 h GLU 68 Ca -0.31 -0.04 -0.14 0.00 -1.18 0.00 0.00 59.36 57.68 2b37 h GLU 68 Cb 1.13 -0.14 0.01 0.00 -0.16 0.00 0.00 28.75 29.59 2b37 h GLU 68 CO 0.61 0.41 -0.58 0.93 -1.18 0.00 0.00 179.01 179.19 2b37 h GLU 69 N 0.64 0.35 -0.88 1.92 5.08 -1.94 0.16 114.58 119.91 2b37 h GLU 69 Ca 0.40 -0.41 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 2b37 h GLU 69 Cb 0.65 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.95 2b37 h GLU 69 CO -0.16 1.10 0.54 0.45 -1.00 0.00 0.00 179.01 179.94 2b37 h HIS 70 N -0.22 0.98 -0.21 4.33 3.86 -1.85 0.22 115.15 122.26 2b37 h HIS 70 Ca -0.08 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.10 2b37 h HIS 70 Cb 1.32 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 29.48 2b37 h HIS 70 CO 0.16 0.45 -0.12 -0.07 0.86 0.00 0.00 177.93 179.21 2b37 h LEU 71 N 0.93 0.47 -1.46 2.43 4.07 -1.46 -1.05 115.31 119.24 2b37 h LEU 71 Ca 0.41 -0.42 0.00 0.00 0.08 0.00 0.00 57.88 57.95 2b37 h LEU 71 Cb 0.29 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 41.87 2b37 h LEU 71 CO -0.21 0.79 0.34 0.00 -1.08 0.00 0.00 178.44 178.27 2b37 h ALA 72 N 0.69 1.60 -0.37 1.53 0.00 -0.22 -2.22 119.26 120.27 2b37 h ALA 72 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2b37 h ALA 72 Cb 0.62 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2b37 h ALA 72 CO 0.03 0.36 0.00 -1.13 0.00 0.00 0.00 179.25 178.52 2b37 n SER 73 N -4.44 2.93 0.24 0.00 3.41 0.74 -4.60 113.62 111.89 2b37 n SER 73 Ca 0.05 -1.92 -0.14 0.00 -0.26 0.00 0.00 58.87 56.59 2b37 n SER 73 Cb 0.06 -0.24 -0.08 0.00 -0.26 0.00 0.00 64.21 63.69 2b37 n SER 73 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2b37 h LEU 74 N 3.68 -0.53 -0.75 1.04 6.46 -0.53 -2.76 115.31 121.92 2b37 h LEU 74 Ca 0.00 -0.08 0.14 0.00 -0.12 0.00 0.00 57.88 57.82 2b37 h LEU 74 Cb 0.82 0.14 -0.09 0.00 -0.73 0.00 0.00 40.66 40.79 2b37 h LEU 74 CO 0.00 -0.19 0.29 0.00 -0.62 0.00 0.00 178.44 177.92 2b37 h ALA 75 N -0.53 1.04 0.00 1.25 0.00 -1.77 -2.08 119.26 117.17 2b37 h ALA 75 Ca -0.06 0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2b37 h ALA 75 Cb 0.58 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2b37 h ALA 75 CO 0.11 -0.21 -0.63 0.78 0.00 0.00 0.00 179.25 179.30 2b37 h GLY 76 N 0.44 0.00 1.81 0.00 0.00 -1.88 -0.66 103.07 102.78 2b37 h GLY 76 Ca 0.41 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.56 2b37 h GLY 76 CO -0.40 0.00 -0.76 3.21 0.00 0.00 0.00 176.54 178.59 2b37 h ARG 77 N 0.00 0.18 -0.02 4.80 3.08 -1.10 -3.03 114.38 118.30 2b37 h ARG 77 Ca -0.01 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 59.83 2b37 h ARG 77 Cb 1.16 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2b37 h ARG 77 CO 0.08 0.86 -0.16 0.28 -1.07 0.00 0.00 179.97 179.96 2b37 h VAL 78 N 0.12 1.52 0.00 2.04 2.07 -1.28 -2.96 116.25 117.76 2b37 h VAL 78 Ca -0.03 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.74 2b37 h VAL 78 Cb 1.33 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 33.71 2b37 h VAL 78 CO 0.11 0.47 0.03 0.74 0.02 0.00 0.00 177.57 178.95 2b37 h THR 79 N -0.50 0.00 0.00 2.57 2.02 -1.16 0.16 112.91 116.00 2b37 h THR 79 Ca -0.01 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 2b37 h THR 79 Cb 0.86 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 2b37 h THR 79 CO 0.03 0.00 -0.54 -0.08 0.37 0.00 0.00 175.52 175.30 2b37 h GLU 80 N 0.00 0.00 -0.70 6.66 4.81 -1.56 -2.82 114.58 120.96 2b37 h GLU 80 Ca 0.00 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.37 2b37 h GLU 80 Cb 0.05 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 29.30 2b37 h GLU 80 CO 0.00 0.35 -0.18 0.00 -0.73 0.00 0.00 179.01 178.44 2b37 h ALA 81 N -0.78 0.44 -0.00 2.92 0.00 -1.20 -0.07 119.26 120.58 2b37 h ALA 81 Ca -0.09 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2b37 h ALA 81 Cb 0.65 0.55 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2b37 h ALA 81 CO -0.05 -0.43 -0.03 0.44 0.00 0.00 0.00 179.25 179.18 2b37 n ILE 82 N -5.47 0.00 0.00 0.00 -5.35 0.49 -5.03 119.36 104.00 2b37 n ILE 82 Ca 0.09 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 2b37 n ILE 82 Cb 0.36 -0.36 0.00 0.00 -1.74 0.00 0.00 39.64 37.90 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 1.20 -1.94 3.62 3.28 0.00 -0.04 -4.76 105.19 106.54 2b37 n GLY 83 Ca 0.17 -1.44 -0.29 0.00 0.00 0.00 0.00 46.02 44.46 2b37 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b37 s ALA 84 N -3.38 0.71 0.00 4.61 0.00 -1.18 -3.55 121.76 118.97 2b37 s ALA 84 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.03 2b37 s ALA 84 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.84 2b37 s ALA 84 CO 0.00 -3.07 0.00 0.41 0.00 0.00 0.00 175.76 173.10 2b37 n GLY 85 N -0.03 1.51 3.99 0.00 0.00 -1.26 -4.94 105.19 104.46 2b37 n GLY 85 Ca 0.07 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.80 5.94 0.09 1.61 0.02 -1.23 -5.14 114.94 115.43 2b37 s ASN 86 Ca 0.00 -0.14 -0.04 0.00 -1.02 0.00 0.00 52.86 51.66 2b37 s ASN 86 Cb 0.00 -1.25 -0.03 0.00 0.02 0.00 0.00 41.25 39.99 2b37 s ASN 86 CO 0.00 -0.47 0.08 -0.54 0.02 0.00 0.00 177.10 176.18 2b37 s LYS 87 N -4.23 0.79 0.56 -0.60 1.02 -1.26 -4.95 119.74 111.07 2b37 s LYS 87 Ca 0.46 -1.18 -0.19 0.00 0.02 0.00 0.00 55.97 55.08 2b37 s LYS 87 Cb -0.10 0.27 -0.05 0.00 -0.52 0.00 0.00 37.83 37.43 2b37 s LYS 87 CO 0.32 -0.21 1.14 -0.51 -0.92 0.00 0.00 175.35 175.17 2b37 s LEU 88 N -2.93 3.71 -0.02 3.17 1.43 -0.56 -4.64 118.68 118.84 2b37 s LEU 88 Ca 0.10 2.19 0.12 0.00 -1.03 0.00 0.00 54.13 55.52 2b37 s LEU 88 Cb 0.07 -4.58 -0.19 0.00 0.03 0.00 0.00 46.19 41.51 2b37 s LEU 88 CO -0.07 -1.30 0.27 0.47 0.23 0.00 0.00 176.35 175.95 2b37 n ASP 89 N -1.42 2.16 -3.81 2.29 8.00 0.75 -1.81 116.55 122.71 2b37 n ASP 89 Ca 0.12 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.51 2b37 n ASP 89 Cb 0.51 1.56 -0.08 0.00 -0.02 0.00 0.00 41.12 43.09 2b37 n ASP 89 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2b37 s GLY 90 N -3.44 -0.04 -0.03 0.44 0.00 -0.94 -1.33 107.32 101.98 2b37 s GLY 90 Ca -0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 44.72 44.57 2b37 s GLY 90 CO 0.52 -0.29 0.06 0.14 0.00 0.00 0.00 173.10 173.52 2b37 s VAL 91 N -2.32 -0.06 -0.32 1.40 1.01 -0.58 -1.39 120.40 118.14 2b37 s VAL 91 Ca -0.07 0.22 -0.02 0.00 0.00 0.00 0.00 61.98 62.12 2b37 s VAL 91 Cb -0.02 -0.12 0.06 0.00 0.00 0.00 0.00 36.38 36.30 2b37 s VAL 91 CO -0.02 0.09 0.04 -0.69 0.00 0.00 0.00 175.10 174.52 2b37 s VAL 92 N 1.17 3.02 -0.32 2.92 1.01 0.22 -1.25 120.40 127.17 2b37 s VAL 92 Ca -0.08 -1.54 -0.21 0.00 0.00 0.00 0.00 61.98 60.15 2b37 s VAL 92 Cb -0.13 -2.82 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 2b37 s VAL 92 CO -0.04 -0.23 0.67 -2.28 0.00 0.00 0.00 175.10 173.23 2b37 s HIS 93 N 1.22 3.19 -0.34 5.22 2.46 -0.26 -1.37 115.29 125.42 2b37 s HIS 93 Ca -0.02 0.59 0.16 0.00 0.47 0.00 0.00 55.06 56.26 2b37 s HIS 93 Cb -0.20 -3.09 0.42 0.00 -0.13 0.00 0.00 32.58 29.58 2b37 s HIS 93 CO -0.02 -0.54 0.89 0.45 -2.47 0.00 0.00 174.74 173.05 2b37 n SER 94 N 6.01 1.21 -4.42 9.88 2.88 -1.25 -2.92 113.62 125.01 2b37 n SER 94 Ca 0.00 -2.81 -0.31 0.00 -1.33 0.00 0.00 58.87 54.43 2b37 n SER 94 Cb 0.49 -0.54 -0.13 0.00 -0.75 0.00 0.00 64.21 63.28 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 -2.86 2.57 -0.30 2.46 1.01 -1.26 -4.06 121.20 118.77 2b37 s ILE 95 Ca 0.31 -1.23 -0.23 0.00 0.00 0.00 0.00 60.65 59.50 2b37 s ILE 95 Cb 0.42 -2.05 0.19 0.00 0.01 0.00 0.00 42.46 41.03 2b37 s ILE 95 CO 0.00 0.36 1.37 -0.83 0.00 0.00 0.00 174.94 175.84 2b37 s GLY 96 N -1.32 0.36 -0.05 6.18 0.00 -1.26 -4.59 107.32 106.62 2b37 s GLY 96 Ca 0.13 3.51 -0.30 0.00 0.00 0.00 0.00 44.72 48.06 2b37 s GLY 96 CO 0.04 2.09 0.72 -0.12 0.00 0.00 0.00 173.10 175.83 2b37 s PHE 97 N 0.25 -0.61 -0.26 1.90 5.36 -1.26 -4.93 117.98 118.42 2b37 s PHE 97 Ca 0.04 1.00 -0.06 0.00 -0.96 0.00 0.00 56.93 56.95 2b37 s PHE 97 Cb -0.04 0.43 0.13 0.00 -0.34 0.00 0.00 43.02 43.19 2b37 s PHE 97 CO -0.14 -0.59 0.54 1.41 -1.46 0.00 0.00 175.22 174.99 2b37 s MET 98 N -1.35 0.47 0.45 10.12 -2.45 -1.26 -4.16 119.30 121.13 2b37 s MET 98 Ca -0.09 1.14 -0.21 0.00 -1.25 0.00 0.00 55.69 55.28 2b37 s MET 98 Cb -0.00 0.49 -0.13 0.00 1.25 0.00 0.00 34.83 36.44 2b37 s MET 98 CO 0.07 -0.35 0.29 -2.30 1.05 0.00 0.00 175.02 173.78 2b37 n PRO 99 N 5.42 0.28 -0.33 4.11 -0.02 -1.26 -4.76 135.00 138.44 2b37 n PRO 99 Ca -0.08 0.10 0.26 0.00 -2.02 0.00 0.00 63.50 61.76 2b37 n PRO 99 Cb 0.50 -1.29 0.50 0.00 -0.02 0.00 0.00 33.50 33.18 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 0.43 0.14 -0.73 -0.52 1.08 -2.00 0.15 115.11 113.66 2b37 h GLN 100 Ca -0.40 -0.01 0.15 0.00 -1.45 0.00 0.00 58.65 56.94 2b37 h GLN 100 Cb 1.42 -0.03 -0.10 0.00 -0.05 0.00 0.00 27.48 28.72 2b37 h GLN 100 CO 0.48 0.10 0.22 1.15 -0.95 0.00 0.00 178.83 179.83 2b37 h THR 101 N 0.15 0.59 -0.30 -0.54 2.02 -1.96 -2.76 112.91 110.09 2b37 h THR 101 Ca 0.76 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.77 2b37 h THR 101 Cb 1.84 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 68.44 2b37 h THR 101 CO -0.71 0.06 0.06 0.61 0.37 0.00 0.00 175.52 175.92 2b37 n GLY 102 N -1.34 2.38 3.53 2.16 0.00 0.53 -4.49 105.19 107.97 2b37 n GLY 102 Ca 0.14 -0.44 -0.11 0.00 0.00 0.00 0.00 46.02 45.60 2b37 n GLY 102 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2b37 s MET 103 N -1.75 1.70 3.03 1.61 1.00 -1.04 -1.56 119.30 122.30 2b37 s MET 103 Ca 0.25 -1.49 0.00 0.00 0.00 0.00 0.00 55.69 54.45 2b37 s MET 103 Cb 0.20 0.45 0.00 0.00 0.00 0.00 0.00 34.83 35.48 2b37 s MET 103 CO 0.07 -0.71 0.00 0.41 0.00 0.00 0.00 175.02 174.79 2b37 n GLY 104 N -0.45 1.26 0.24 -0.03 0.00 0.55 -3.35 105.19 103.40 2b37 n GLY 104 Ca -0.01 -0.55 0.16 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.38 -0.61 2.10 -1.90 -3.42 117.51 110.30 2b37 h ILE 105 Ca 0.00 -0.05 -0.52 0.00 1.08 0.00 0.00 64.86 65.37 2b37 h ILE 105 Cb 0.00 0.78 0.01 0.00 -1.09 0.00 0.00 36.82 36.52 2b37 h ILE 105 CO 0.00 0.00 0.55 0.20 -1.08 0.00 0.00 178.15 177.82 2b37 s ASN 106 N -4.58 7.11 -0.37 2.19 -0.87 -1.21 -4.93 114.94 112.27 2b37 s ASN 106 Ca -0.03 2.13 -0.29 0.00 -1.57 0.00 0.00 52.86 53.11 2b37 s ASN 106 Cb 0.09 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.73 2b37 s ASN 106 CO 0.32 -0.39 1.48 -2.84 -2.57 0.00 0.00 177.10 173.09 2b37 s PRO 107 N 0.24 3.60 0.00 -0.60 0.02 -1.26 -4.68 135.00 132.32 2b37 s PRO 107 Ca 0.55 1.12 0.00 0.00 0.02 0.00 0.00 61.00 62.69 2b37 s PRO 107 Cb -0.31 -4.03 0.00 0.00 0.02 0.00 0.00 34.50 30.18 2b37 s PRO 107 CO 0.33 -1.53 0.00 0.34 -0.33 0.00 0.00 177.00 175.82 2b37 n PHE 108 N 8.85 0.00 0.52 6.54 7.35 -1.26 0.24 117.46 139.70 2b37 n PHE 108 Ca 0.17 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.98 2b37 n PHE 108 Cb 0.47 -0.48 0.45 0.00 0.35 0.00 0.00 39.48 40.27 2b37 n PHE 108 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 2b37 n PHE 109 N -2.90 0.58 1.05 -5.13 3.72 -1.26 -3.78 117.46 109.74 2b37 n PHE 109 Ca 0.00 0.21 0.12 0.00 -0.05 0.00 0.00 57.45 57.72 2b37 n PHE 109 Cb 0.00 -0.84 0.08 0.00 -0.94 0.00 0.00 39.48 37.78 2b37 n PHE 109 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2b37 n ASP 110 N -2.01 2.10 -4.63 4.37 8.00 0.67 -4.91 116.55 120.14 2b37 n ASP 110 Ca 0.04 -1.55 -0.43 0.00 0.71 0.00 0.00 54.79 53.56 2b37 n ASP 110 Cb 0.27 0.32 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 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 -2.36 3.30 0.37 2.24 0.00 -1.25 -4.99 121.76 119.07 2b37 s ALA 111 Ca 0.22 0.54 -0.26 0.00 0.00 0.00 0.00 51.96 52.46 2b37 s ALA 111 Cb 0.19 -3.84 -0.09 0.00 0.00 0.00 0.00 23.12 19.37 2b37 s ALA 111 CO 0.50 -1.90 1.13 -1.25 0.00 0.00 0.00 175.76 174.24 2b37 s PRO 112 N 4.64 4.22 0.26 0.00 0.04 -1.26 -4.83 135.00 138.07 2b37 s PRO 112 Ca 0.72 1.77 -0.01 0.00 0.04 0.00 0.00 61.00 63.52 2b37 s PRO 112 Cb -0.26 -2.77 0.52 0.00 0.04 0.00 0.00 34.50 32.02 2b37 s PRO 112 CO 0.29 -0.15 1.77 -0.92 0.04 0.00 0.00 177.00 178.03 2b37 h TYR 113 N 2.90 0.78 -1.05 0.56 3.20 -1.98 0.20 116.97 121.58 2b37 h TYR 113 Ca -0.48 0.03 0.28 0.00 3.14 0.00 0.00 58.73 61.70 2b37 h TYR 113 Cb 1.22 -0.22 -0.09 0.00 1.54 0.00 0.00 36.73 39.18 2b37 h TYR 113 CO 0.57 0.21 0.69 0.00 -1.64 0.00 0.00 178.16 177.98 2b37 h ALA 114 N 1.54 2.32 0.20 1.82 0.00 -1.98 1.93 119.26 125.10 2b37 h ALA 114 Ca 0.46 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.41 2b37 h ALA 114 Cb 0.61 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2b37 h ALA 114 CO -0.35 -0.72 -0.10 -0.44 0.00 0.00 0.00 179.25 177.64 2b37 h ASP 115 N 0.35 -0.23 -0.71 0.00 3.45 -0.98 -3.04 116.42 115.25 2b37 h ASP 115 Ca 0.59 -0.25 0.16 0.00 0.43 0.00 0.00 57.03 57.96 2b37 h ASP 115 Cb 1.59 0.06 -0.12 0.00 -0.56 0.00 0.00 39.33 40.30 2b37 h ASP 115 CO -0.27 0.30 0.08 0.58 -1.57 0.00 0.00 179.24 178.36 2b37 h VAL 116 N -0.95 0.44 -0.77 -1.35 2.07 -0.45 -1.00 116.25 114.25 2b37 h VAL 116 Ca -0.03 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.51 2b37 h VAL 116 Cb 0.47 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.43 2b37 h VAL 116 CO 0.05 0.03 0.44 -1.28 0.02 0.00 0.00 177.57 176.83 2b37 h SER 117 N 0.17 0.64 -0.36 0.57 0.87 0.29 -1.59 113.55 114.14 2b37 h SER 117 Ca 0.39 0.04 -0.08 0.00 -1.23 0.00 0.00 61.79 60.91 2b37 h SER 117 Cb 0.68 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 2b37 h SER 117 CO -0.57 0.39 -0.09 0.50 -0.53 0.00 0.00 176.83 176.53 2b37 h LYS 118 N 0.77 0.69 0.00 2.24 3.64 -1.07 -0.63 116.57 122.21 2b37 h LYS 118 Ca 0.36 -0.27 -0.08 0.00 -1.27 0.00 0.00 60.65 59.40 2b37 h LYS 118 Cb 0.27 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2b37 h LYS 118 CO -0.22 0.85 -0.36 0.78 -2.27 0.00 0.00 179.45 178.24 2b37 h GLY 119 N 0.48 0.00 1.50 5.01 0.00 -1.23 0.58 103.07 109.41 2b37 h GLY 119 Ca 0.09 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.21 2b37 h GLY 119 CO 0.04 0.00 -0.85 -2.22 0.00 0.00 0.00 176.54 173.51 2b37 h ILE 120 N 0.00 1.37 0.34 2.60 2.04 -1.15 -1.76 117.51 120.94 2b37 h ILE 120 Ca -0.00 -2.27 -0.00 0.00 1.00 0.00 0.00 64.86 63.59 2b37 h ILE 120 Cb 0.64 2.25 -0.02 0.00 -0.74 0.00 0.00 36.82 38.95 2b37 h ILE 120 CO 0.05 0.68 -0.28 -0.74 0.00 0.00 0.00 178.15 177.86 2b37 h HIS 121 N 0.29 -0.75 0.15 1.37 2.76 -0.49 0.14 115.15 118.62 2b37 h HIS 121 Ca -0.06 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.10 2b37 h HIS 121 Cb 1.46 0.29 0.00 0.00 1.55 0.00 0.00 27.41 30.71 2b37 h HIS 121 CO 0.06 -0.42 -0.07 0.82 -1.30 0.00 0.00 177.93 177.02 2b37 h ILE 122 N -0.63 0.98 0.05 6.26 2.04 -0.99 -1.40 117.51 123.82 2b37 h ILE 122 Ca -0.02 -1.06 -0.00 0.00 1.00 0.00 0.00 64.86 64.78 2b37 h ILE 122 Cb 0.56 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 2b37 h ILE 122 CO -0.03 0.23 -0.03 0.28 0.00 0.00 0.00 178.15 178.61 2b37 h SER 123 N -0.75 -0.06 0.00 1.72 0.02 -1.40 -3.36 113.55 109.72 2b37 h SER 123 Ca -0.02 -0.52 -0.01 0.00 -0.84 0.00 0.00 61.79 60.40 2b37 h SER 123 Cb 0.53 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 2b37 h SER 123 CO 0.03 0.52 -0.56 0.00 -1.14 0.00 0.00 176.83 175.69 2b37 n ALA 124 N -2.45 0.48 -0.15 3.77 0.00 -0.15 -4.59 120.51 117.42 2b37 n ALA 124 Ca -0.09 -0.44 -0.07 0.00 0.00 0.00 0.00 53.44 52.85 2b37 n ALA 124 Cb 0.29 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.76 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 -1.00 0.54 0.00 0.00 5.03 -0.79 -2.92 116.97 117.83 2b37 h TYR 125 Ca -0.01 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.31 2b37 h TYR 125 Cb 0.56 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 38.66 2b37 h TYR 125 CO -0.22 0.32 0.19 0.66 -1.32 0.00 0.00 178.16 177.78 2b37 h SER 126 N 0.58 0.00 -0.18 -2.11 4.64 -1.40 0.08 113.55 115.16 2b37 h SER 126 Ca 0.18 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.34 2b37 h SER 126 Cb -0.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 2b37 h SER 126 CO -0.07 0.00 -0.45 0.22 -0.87 0.00 0.00 176.83 175.67 2b37 h TYR 127 N 0.00 0.89 -0.38 4.77 3.20 -1.76 -1.59 116.97 122.10 2b37 h TYR 127 Ca 0.00 -0.28 -0.16 0.00 3.14 0.00 0.00 58.73 61.43 2b37 h TYR 127 Cb 0.37 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 2b37 h TYR 127 CO 0.00 1.04 -0.39 0.00 -1.64 0.00 0.00 178.16 177.17 2b37 h ALA 128 N 0.91 0.56 0.56 1.82 0.00 -1.16 -2.52 119.26 119.44 2b37 h ALA 128 Ca 0.04 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 2b37 h ALA 128 Cb 1.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2b37 h ALA 128 CO 0.10 0.67 -0.45 0.77 0.00 0.00 0.00 179.25 180.34 2b37 h SER 129 N 0.76 -1.18 -0.76 0.00 0.02 -1.49 0.56 113.55 111.45 2b37 h SER 129 Ca 0.06 0.08 0.13 0.00 -0.84 0.00 0.00 61.79 61.22 2b37 h SER 129 Cb 0.99 0.37 -0.09 0.00 0.14 0.00 0.00 62.40 63.81 2b37 h SER 129 CO 0.10 -0.63 0.34 0.24 -1.14 0.00 0.00 176.83 175.73 2b37 h MET 130 N -0.98 0.50 0.19 3.45 2.07 -1.37 1.35 114.93 120.14 2b37 h MET 130 Ca -0.07 -0.03 -0.01 0.00 -2.07 0.00 0.00 59.70 57.52 2b37 h MET 130 Cb 0.82 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 30.44 2b37 h MET 130 CO 0.01 0.33 -0.09 0.00 1.07 0.00 0.00 176.91 178.23 2b37 h ALA 131 N 1.52 -0.26 -0.33 6.32 0.00 -1.27 0.32 119.26 125.56 2b37 h ALA 131 Ca 0.41 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.31 2b37 h ALA 131 Cb 0.57 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 2b37 h ALA 131 CO -0.36 -0.64 0.08 -0.22 0.00 0.00 0.00 179.25 178.10 2b37 h LYS 132 N -0.26 0.19 -0.37 0.00 3.64 0.25 -1.88 116.57 118.15 2b37 h LYS 132 Ca -0.03 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 2b37 h LYS 132 Cb 0.20 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 2b37 h LYS 132 CO 0.04 0.13 0.08 0.00 -2.27 0.00 0.00 179.45 177.43 2b37 h ALA 133 N 1.24 0.49 -0.16 5.00 0.00 0.19 -3.34 119.26 122.68 2b37 h ALA 133 Ca 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2b37 h ALA 133 Cb 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2b37 h ALA 133 CO -0.20 0.17 0.00 1.28 0.00 0.00 0.00 179.25 180.50 2b37 n LEU 134 N -4.58 2.94 0.11 0.00 4.77 0.11 -4.44 117.00 115.91 2b37 n LEU 134 Ca -0.01 -1.11 -0.23 0.00 -0.03 0.00 0.00 56.01 54.63 2b37 n LEU 134 Cb 0.21 -0.10 -0.15 0.00 -2.33 0.00 0.00 43.42 41.05 2b37 n LEU 134 CO 0.38 0.55 -0.35 0.25 -1.33 0.00 0.00 177.39 176.89 2b37 h LEU 135 N 4.25 0.71 -2.90 2.23 5.85 -1.46 -3.03 115.31 120.96 2b37 h LEU 135 Ca 0.00 -0.88 0.00 0.00 0.84 0.00 0.00 57.88 57.84 2b37 h LEU 135 Cb 0.92 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.71 2b37 h LEU 135 CO 0.00 1.71 0.00 -0.65 -0.34 0.00 0.00 178.44 179.16 2b37 h PRO 136 N 0.12 0.00 -0.69 5.25 0.11 -1.79 -1.72 132.00 133.28 2b37 h PRO 136 Ca -0.29 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.48 2b37 h PRO 136 Cb 2.13 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 33.03 2b37 h PRO 136 CO 0.23 0.00 0.30 0.44 -0.21 0.00 0.00 178.00 178.76 2b37 n ILE 137 N -3.08 2.89 -4.47 4.15 -5.35 -1.15 -4.97 119.36 107.38 2b37 n ILE 137 Ca -0.03 -2.28 -0.33 0.00 -0.27 0.00 0.00 62.75 59.84 2b37 n ILE 137 Cb 0.08 -0.39 -0.16 0.00 -1.74 0.00 0.00 39.64 37.43 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 -3.26 3.08 0.62 6.28 -1.94 -0.65 -1.49 119.30 121.95 2b37 s MET 138 Ca 0.51 -0.81 -0.18 0.00 -1.71 0.00 0.00 55.69 53.50 2b37 s MET 138 Cb 0.44 -2.54 -0.02 0.00 2.01 0.00 0.00 34.83 34.72 2b37 s MET 138 CO 0.06 -0.06 1.20 -0.80 -0.01 0.00 0.00 175.02 175.41 2b37 s ASN 139 N 0.96 5.00 0.71 3.03 0.02 -0.75 -4.97 114.94 118.94 2b37 s ASN 139 Ca -0.03 2.34 -0.16 0.00 -1.02 0.00 0.00 52.86 53.99 2b37 s ASN 139 Cb -0.15 -2.59 0.02 0.00 0.02 0.00 0.00 41.25 38.55 2b37 s ASN 139 CO -0.04 -1.72 1.17 -2.65 0.02 0.00 0.00 177.10 173.88 2b37 n PRO 140 N -1.88 0.69 -0.99 -0.60 -0.02 -1.25 -2.48 135.00 128.48 2b37 n PRO 140 Ca 0.13 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2b37 n PRO 140 Cb 0.50 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2b37 n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b37 n GLY 141 N 0.89 0.40 0.51 -1.23 0.00 0.21 -5.01 105.19 100.96 2b37 n GLY 141 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.12 2b37 n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b37 n GLY 142 N -2.01 -1.89 3.61 -0.02 0.00 -1.03 -4.93 105.19 98.91 2b37 n GLY 142 Ca 0.00 -1.56 -0.03 0.00 0.00 0.00 0.00 46.02 44.43 2b37 n GLY 142 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b37 s SER 143 N -1.80 -0.80 -0.11 1.61 0.15 -0.44 -2.93 113.70 109.37 2b37 s SER 143 Ca 0.10 1.22 -0.03 0.00 0.70 0.00 0.00 55.95 57.94 2b37 s SER 143 Cb -0.01 1.55 -0.03 0.00 -1.71 0.00 0.00 66.02 65.82 2b37 s SER 143 CO 0.07 -0.18 0.01 -0.63 1.20 0.00 0.00 173.24 173.71 2b37 s ILE 144 N 1.91 4.37 0.04 6.45 1.01 0.30 -1.53 121.20 133.75 2b37 s ILE 144 Ca -0.08 -0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.37 2b37 s ILE 144 Cb -0.06 -2.86 -0.03 0.00 0.01 0.00 0.00 42.46 39.52 2b37 s ILE 144 CO -0.18 0.58 -0.07 0.68 0.00 0.00 0.00 174.94 175.95 2b37 s VAL 145 N -0.62 0.46 0.08 2.92 -7.23 -0.38 -0.98 120.40 114.66 2b37 s VAL 145 Ca 0.10 -1.17 0.04 0.00 -1.81 0.00 0.00 61.98 59.14 2b37 s VAL 145 Cb -0.12 -0.69 -0.03 0.00 0.56 0.00 0.00 36.38 36.10 2b37 s VAL 145 CO 0.02 -0.48 -0.11 -0.83 -0.31 0.00 0.00 175.10 173.39 2b37 s GLY 146 N -1.77 0.80 -0.06 2.32 0.00 0.13 -1.10 107.32 107.64 2b37 s GLY 146 Ca -0.08 -1.07 -0.17 0.00 0.00 0.00 0.00 44.72 43.40 2b37 s GLY 146 CO -0.01 -1.13 0.45 1.06 0.00 0.00 0.00 173.10 173.47 2b37 s MET 147 N -2.30 4.16 0.06 2.90 -1.94 -1.15 0.80 119.30 121.84 2b37 s MET 147 Ca 0.01 0.44 0.02 0.00 -1.71 0.00 0.00 55.69 54.45 2b37 s MET 147 Cb -0.06 -3.34 -0.03 0.00 2.01 0.00 0.00 34.83 33.41 2b37 s MET 147 CO 0.01 0.41 -0.08 0.34 -0.01 0.00 0.00 175.02 175.69 2b37 s ASP 148 N -0.18 1.00 -0.19 3.03 2.15 -0.59 -4.89 116.67 117.00 2b37 s ASP 148 Ca 0.25 -0.71 0.01 0.00 0.43 0.00 0.00 52.55 52.53 2b37 s ASP 148 Cb -0.16 0.05 0.04 0.00 -0.30 0.00 0.00 42.92 42.55 2b37 s ASP 148 CO 0.12 -0.28 -0.12 0.12 -0.17 0.00 0.00 175.17 174.84 2b37 s PHE 149 N -2.12 2.42 -0.56 -5.34 2.19 -1.26 -0.80 117.98 112.51 2b37 s PHE 149 Ca -0.02 -1.54 -0.25 0.00 0.33 0.00 0.00 56.93 55.45 2b37 s PHE 149 Cb -0.05 -1.66 -0.14 0.00 -1.31 0.00 0.00 43.02 39.86 2b37 s PHE 149 CO -0.01 -0.74 1.72 -3.47 1.83 0.00 0.00 175.22 174.55 2b37 n ASP 150 N 4.69 0.32 -1.40 6.13 -0.08 -1.26 -4.81 116.55 120.15 2b37 n ASP 150 Ca -0.16 0.26 0.12 0.00 -1.51 0.00 0.00 54.79 53.50 2b37 n ASP 150 Cb 0.47 -0.63 0.33 0.00 2.34 0.00 0.00 41.12 43.63 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 5.62 2.82 0.27 -0.67 -0.04 -1.26 -4.53 135.00 137.21 2b37 n PRO 151 Ca 0.43 -2.70 0.18 0.00 -0.04 0.00 0.00 63.50 61.37 2b37 n PRO 151 Cb 0.00 -1.61 0.93 0.00 -0.04 0.00 0.00 33.50 32.78 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 4.35 0.00 -4.15 3.54 4.64 -1.94 -3.41 113.55 116.57 2b37 h SER 152 Ca 0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 2b37 h SER 152 Cb 1.04 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 62.87 2b37 h SER 152 CO 0.02 0.00 -0.74 -0.13 -0.87 0.00 0.00 176.83 175.11 2b37 s ARG 153 N -3.86 0.36 0.58 4.77 0.52 -1.26 -5.15 118.95 114.91 2b37 s ARG 153 Ca -0.03 -0.31 -0.18 0.00 -0.52 0.00 0.00 55.73 54.69 2b37 s ARG 153 Cb 0.10 -0.27 -0.04 0.00 0.52 0.00 0.00 34.95 35.27 2b37 s ARG 153 CO 0.38 0.07 1.15 0.00 0.02 0.00 0.00 175.30 176.92 2b37 s ALA 154 N -0.49 2.59 0.15 2.13 0.00 -1.26 -5.07 121.76 119.81 2b37 s ALA 154 Ca -0.02 0.84 -0.06 0.00 0.00 0.00 0.00 51.96 52.71 2b37 s ALA 154 Cb -0.04 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 2b37 s ALA 154 CO -0.00 -1.02 0.20 0.00 0.00 0.00 0.00 175.76 174.95 2b37 s MET 155 N -3.45 1.05 0.61 0.00 0.23 -1.26 -5.16 119.30 111.32 2b37 s MET 155 Ca 0.73 -1.23 -0.12 0.00 -1.03 0.00 0.00 55.69 54.04 2b37 s MET 155 Cb -0.26 0.33 -0.05 0.00 -1.53 0.00 0.00 34.83 33.33 2b37 s MET 155 CO 0.32 -0.36 1.02 -1.25 -2.03 0.00 0.00 175.02 172.72 2b37 s PRO 156 N -3.98 3.64 0.00 3.16 0.05 -1.26 -4.14 135.00 132.47 2b37 s PRO 156 Ca 0.18 0.79 0.00 0.00 0.05 0.00 0.00 61.00 62.02 2b37 s PRO 156 Cb 0.05 -2.09 0.00 0.00 0.05 0.00 0.00 34.50 32.51 2b37 s PRO 156 CO -0.01 -0.54 0.00 0.00 0.05 0.00 0.00 177.00 176.51 2b37 n ALA 157 N -2.58 0.00 0.29 8.56 0.00 -1.26 -4.43 120.51 121.10 2b37 n ALA 157 Ca 0.06 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.68 2b37 n ALA 157 Cb 0.54 0.00 0.99 0.00 0.00 0.00 0.00 19.45 20.98 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 -1.93 0.16 116.97 118.40 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 -3.55 0.00 0.11 -2.11 3.02 -1.26 -0.73 115.26 110.74 2b37 n ASN 159 Ca -0.02 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.65 2b37 n ASN 159 Cb 0.14 0.00 0.47 0.00 -0.61 0.00 0.00 39.78 39.78 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 0.36 0.74 0.02 3.10 7.02 -0.60 -1.98 117.44 126.11 2b37 n TRP 160 Ca 0.00 0.28 -0.09 0.00 -1.02 0.00 0.00 57.50 56.67 2b37 n TRP 160 Cb 0.00 -0.95 0.05 0.00 -2.42 0.00 0.00 31.31 27.99 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 0.50 -0.72 -0.99 4.05 -1.05 -2.50 114.93 114.21 2b37 h MET 161 Ca 0.00 -0.33 0.06 0.00 -0.28 0.00 0.00 59.70 59.14 2b37 h MET 161 Cb 0.41 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 31.20 2b37 h MET 161 CO 0.00 0.95 0.42 1.15 0.23 0.00 0.00 176.91 179.66 2b37 h THR 162 N 0.37 1.00 -0.55 -0.77 2.02 -1.27 0.21 112.91 113.91 2b37 h THR 162 Ca -0.00 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 2b37 h THR 162 Cb 1.14 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 2b37 h THR 162 CO 0.11 0.14 0.23 0.58 0.37 0.00 0.00 175.52 176.95 2b37 h VAL 163 N 0.78 1.20 -0.55 3.16 2.07 -1.55 0.12 116.25 121.47 2b37 h VAL 163 Ca 0.32 -0.60 -0.09 0.00 0.82 0.00 0.00 66.70 67.15 2b37 h VAL 163 Cb 0.17 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 2b37 h VAL 163 CO -0.17 0.24 -0.01 0.00 0.02 0.00 0.00 177.57 177.65 2b37 h ALA 164 N 1.47 0.95 -0.07 1.67 0.00 -0.64 -2.02 119.26 120.61 2b37 h ALA 164 Ca 0.19 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.62 2b37 h ALA 164 Cb 0.14 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2b37 h ALA 164 CO -0.02 0.63 -0.75 0.87 0.00 0.00 0.00 179.25 179.98 2b37 h LYS 165 N 0.87 0.41 -0.69 0.00 1.79 0.33 0.33 116.57 119.60 2b37 h LYS 165 Ca 0.16 -0.35 0.03 0.00 -2.18 0.00 0.00 60.65 58.32 2b37 h LYS 165 Cb 0.53 0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 31.21 2b37 h LYS 165 CO 0.03 0.99 0.43 0.77 -1.08 0.00 0.00 179.45 180.59 2b37 h SER 166 N 0.28 0.70 0.05 0.86 0.02 -0.73 -1.56 113.55 113.17 2b37 h SER 166 Ca -0.03 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2b37 h SER 166 Cb 1.33 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2b37 h SER 166 CO 0.13 0.49 -0.02 0.00 -1.14 0.00 0.00 176.83 176.28 2b37 h ALA 167 N 1.30 -0.07 -0.73 3.77 0.00 -1.12 -2.60 119.26 119.81 2b37 h ALA 167 Ca 0.28 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.22 2b37 h ALA 167 Cb 0.03 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.76 2b37 h ALA 167 CO -0.11 -0.46 0.31 1.25 0.00 0.00 0.00 179.25 180.24 2b37 h LEU 168 N -0.24 0.32 -0.79 0.00 6.46 -0.74 0.31 115.31 120.64 2b37 h LEU 168 Ca -0.01 0.09 0.03 0.00 -0.12 0.00 0.00 57.88 57.87 2b37 h LEU 168 Cb 0.21 0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 40.15 2b37 h LEU 168 CO 0.01 0.15 0.51 -0.33 -0.62 0.00 0.00 178.44 178.16 2b37 h GLU 169 N 0.48 0.97 -0.02 1.25 5.08 -1.20 0.48 114.58 121.61 2b37 h GLU 169 Ca 0.39 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2b37 h GLU 169 Cb 0.54 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 2b37 h GLU 169 CO -0.36 0.64 0.01 1.03 -1.00 0.00 0.00 179.01 179.33 2b37 h SER 170 N 1.00 0.03 -0.85 1.42 0.87 -0.65 -1.90 113.55 113.47 2b37 h SER 170 Ca 0.31 -0.21 0.17 0.00 -1.23 0.00 0.00 61.79 60.83 2b37 h SER 170 Cb -0.03 -0.01 -0.10 0.00 -0.44 0.00 0.00 62.40 61.82 2b37 h SER 170 CO -0.10 0.23 0.40 0.58 -0.53 0.00 0.00 176.83 177.41 2b37 h VAL 171 N -0.17 0.65 -0.25 2.23 2.07 -0.02 -2.87 116.25 117.88 2b37 h VAL 171 Ca 0.01 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 67.39 2b37 h VAL 171 Cb 0.21 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.00 2b37 h VAL 171 CO -0.00 0.10 -0.02 -1.13 0.02 0.00 0.00 177.57 176.54 2b37 h ASN 172 N 0.54 -0.15 -0.57 0.57 -1.24 0.76 -0.76 115.58 114.73 2b37 h ASN 172 Ca 0.48 0.06 0.05 0.00 0.71 0.00 0.00 56.30 57.61 2b37 h ASN 172 Cb 0.76 0.12 -0.03 0.00 0.73 0.00 0.00 38.32 39.90 2b37 h ASN 172 CO -0.41 -0.04 0.38 0.03 -1.29 0.00 0.00 177.43 176.09 2b37 h ARG 173 N 0.05 0.56 0.01 6.67 3.08 -1.28 -2.13 114.38 121.34 2b37 h ARG 173 Ca 0.12 -0.03 -0.24 0.00 0.07 0.00 0.00 59.98 59.89 2b37 h ARG 173 Cb 0.17 -0.13 0.02 0.00 0.08 0.00 0.00 29.97 30.11 2b37 h ARG 173 CO -0.22 0.37 -0.95 0.74 -1.07 0.00 0.00 179.97 178.84 2b37 h PHE 174 N 0.58 0.94 0.00 3.04 -1.00 -1.34 -3.14 116.94 116.02 2b37 h PHE 174 Ca 0.24 -0.52 -0.01 0.00 2.81 0.00 0.00 57.97 60.49 2b37 h PHE 174 Cb 0.22 -0.11 -0.00 0.00 3.61 0.00 0.00 35.95 39.67 2b37 h PHE 174 CO -0.00 1.35 -0.04 0.28 -1.61 0.00 0.00 178.31 178.29 2b37 h VAL 175 N 0.27 0.86 -0.12 -0.55 2.07 -0.92 -0.97 116.25 116.88 2b37 h VAL 175 Ca -0.12 -0.16 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 2b37 h VAL 175 Cb 1.62 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 2b37 h VAL 175 CO 0.19 0.04 -0.30 0.00 0.02 0.00 0.00 177.57 177.52 2b37 h ALA 176 N 1.96 1.28 0.27 1.67 0.00 -1.35 0.01 119.26 123.10 2b37 h ALA 176 Ca -0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2b37 h ALA 176 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2b37 h ALA 176 CO 0.01 0.49 -0.13 0.00 0.00 0.00 0.00 179.25 179.62 2b37 h ARG 177 N 0.20 -0.35 -0.44 0.00 3.08 -1.15 -2.00 114.38 113.73 2b37 h ARG 177 Ca 0.03 0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 2b37 h ARG 177 Cb 0.63 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.75 2b37 h ARG 177 CO 0.05 -0.22 0.06 0.93 -1.07 0.00 0.00 179.97 179.72 2b37 h GLU 178 N -0.39 0.73 -0.85 0.04 4.39 -1.49 -3.21 114.58 113.80 2b37 h GLU 178 Ca -0.04 -0.20 0.05 0.00 0.34 0.00 0.00 59.36 59.51 2b37 h GLU 178 Cb 0.29 -0.08 -0.05 0.00 -0.10 0.00 0.00 28.75 28.81 2b37 h GLU 178 CO 0.06 0.76 0.56 0.00 -1.16 0.00 0.00 179.01 179.23 2b37 h ALA 179 N 0.94 1.51 -0.94 3.43 0.00 -0.84 -2.68 119.26 120.69 2b37 h ALA 179 Ca 0.13 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.06 2b37 h ALA 179 Cb 0.39 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 2b37 h ALA 179 CO 0.01 0.38 0.61 0.78 0.00 0.00 0.00 179.25 181.04 2b37 h GLY 180 N 1.01 1.38 0.39 0.00 0.00 -1.32 -0.32 103.07 104.20 2b37 h GLY 180 Ca 0.35 -0.45 0.15 0.00 0.00 0.00 0.00 47.33 47.38 2b37 h GLY 180 CO -0.11 0.35 0.61 0.50 0.00 0.00 0.00 176.54 177.89 2b37 h LYS 181 N 1.13 0.81 -0.03 4.80 1.57 -1.58 0.59 116.57 123.85 2b37 h LYS 181 Ca 0.39 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 2b37 h LYS 181 Cb 0.11 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2b37 h LYS 181 CO -0.14 0.53 0.00 0.66 -0.57 0.00 0.00 179.45 179.94 2b37 n TYR 182 N -4.64 0.03 -2.86 -1.35 4.02 -0.29 -4.90 117.16 107.18 2b37 n TYR 182 Ca 0.20 -0.02 -0.09 0.00 -0.01 0.00 0.00 57.90 57.98 2b37 n TYR 182 Cb 0.46 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.81 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 1.02 0.29 3.26 2.72 0.00 0.21 -3.87 105.19 108.81 2b37 n GLY 183 Ca 0.19 -0.29 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.13 1.34 0.03 1.61 1.01 -0.30 0.66 120.40 121.61 2b37 s VAL 184 Ca 0.18 -1.92 0.05 0.00 0.00 0.00 0.00 61.98 60.29 2b37 s VAL 184 Cb -0.08 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 2b37 s VAL 184 CO 0.30 -0.57 -0.12 -0.13 0.00 0.00 0.00 175.10 174.58 2b37 s ARG 185 N -3.22 2.31 -0.08 2.72 0.52 -1.15 -3.18 118.95 116.87 2b37 s ARG 185 Ca 0.14 -0.86 0.01 0.00 -0.52 0.00 0.00 55.73 54.51 2b37 s ARG 185 Cb -0.02 -2.35 0.02 0.00 0.52 0.00 0.00 34.95 33.12 2b37 s ARG 185 CO 0.03 0.57 -0.11 0.45 0.02 0.00 0.00 175.30 176.26 2b37 s SER 186 N -1.47 1.90 0.02 0.23 0.15 -1.26 0.11 113.70 113.38 2b37 s SER 186 Ca 0.16 -0.30 -0.12 0.00 0.70 0.00 0.00 55.95 56.40 2b37 s SER 186 Cb -0.11 -0.83 0.01 0.00 -1.71 0.00 0.00 66.02 63.39 2b37 s SER 186 CO 0.07 -0.02 0.24 0.20 1.20 0.00 0.00 173.24 174.93 2b37 s ASN 187 N 1.03 -0.06 0.02 5.45 0.01 -0.15 0.24 114.94 121.48 2b37 s ASN 187 Ca -0.08 -0.19 0.03 0.00 -0.71 0.00 0.00 52.86 51.91 2b37 s ASN 187 Cb -0.15 0.30 -0.04 0.00 0.41 0.00 0.00 41.25 41.78 2b37 s ASN 187 CO -0.01 -0.52 -0.01 -0.76 -1.51 0.00 0.00 177.10 174.29 2b37 s LEU 188 N -1.79 3.43 -0.42 0.60 1.02 -0.95 0.21 118.68 120.77 2b37 s LEU 188 Ca -0.09 -0.08 -0.10 0.00 0.02 0.00 0.00 54.13 53.89 2b37 s LEU 188 Cb -0.03 -2.01 0.08 0.00 0.02 0.00 0.00 46.19 44.25 2b37 s LEU 188 CO -0.01 0.26 0.27 -0.69 0.02 0.00 0.00 176.35 176.20 2b37 s VAL 189 N -1.12 4.34 -0.57 -1.59 1.01 0.24 -2.12 120.40 120.59 2b37 s VAL 189 Ca 0.20 -1.36 -0.28 0.00 0.00 0.00 0.00 61.98 60.55 2b37 s VAL 189 Cb -0.11 -3.64 0.02 0.00 0.00 0.00 0.00 36.38 32.64 2b37 s VAL 189 CO 0.11 -0.51 1.37 0.00 0.00 0.00 0.00 175.10 176.08 2b37 s ALA 190 N 1.45 2.84 0.13 5.51 0.00 -0.57 -1.54 121.76 129.58 2b37 s ALA 190 Ca 0.03 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.29 2b37 s ALA 190 Cb -0.23 -4.10 -0.04 0.00 0.00 0.00 0.00 23.12 18.76 2b37 s ALA 190 CO 0.03 -2.90 0.27 0.00 0.00 0.00 0.00 175.76 173.16 2b37 s ALA 191 N 5.86 3.98 0.80 0.00 0.00 0.02 -0.30 121.76 132.11 2b37 s ALA 191 Ca 0.50 -0.99 -0.12 0.00 0.00 0.00 0.00 51.96 51.36 2b37 s ALA 191 Cb -0.10 -1.80 0.07 0.00 0.00 0.00 0.00 23.12 21.29 2b37 s ALA 191 CO 0.25 0.60 1.10 0.20 0.00 0.00 0.00 175.76 177.91 2b37 s GLY 192 N -3.08 1.62 0.56 0.00 0.00 -0.62 -4.66 107.32 101.14 2b37 s GLY 192 Ca 0.35 -0.25 -0.21 0.00 0.00 0.00 0.00 44.72 44.60 2b37 s GLY 192 CO 0.28 0.18 1.35 -1.55 0.00 0.00 0.00 173.10 173.36 2b37 n PRO 193 N -3.42 1.61 -3.98 2.90 -0.04 -1.26 -5.01 135.00 125.81 2b37 n PRO 193 Ca 0.07 0.60 -0.11 0.00 -0.04 0.00 0.00 63.50 64.02 2b37 n PRO 193 Cb 0.57 -2.57 -0.12 0.00 -0.04 0.00 0.00 33.50 31.34 2b37 n PRO 193 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2b37 s ILE 194 N -1.30 0.17 -1.11 0.52 -1.09 -1.26 -4.26 121.20 112.88 2b37 s ILE 194 Ca 0.73 -0.63 -0.21 0.00 -2.23 0.00 0.00 60.65 58.31 2b37 s ILE 194 Cb -0.41 -0.25 0.06 0.00 -1.58 0.00 0.00 42.46 40.28 2b37 s ILE 194 CO 0.48 -0.29 1.53 -0.13 -1.23 0.00 0.00 174.94 175.30 2b37 s ARG 195 N -0.96 3.73 0.41 2.79 0.52 1.20 -4.68 118.95 121.95 2b37 s ARG 195 Ca -0.09 -1.46 -0.00 0.00 -0.52 0.00 0.00 55.73 53.66 2b37 s ARG 195 Cb -0.07 -5.39 -0.02 0.00 0.52 0.00 0.00 34.95 30.00 2b37 s ARG 195 CO -0.00 -2.19 0.63 0.99 0.02 0.00 0.00 175.30 174.74 2b37 s THR 196 N 4.55 4.58 0.18 0.02 2.01 -1.26 -4.91 115.64 120.82 2b37 s THR 196 Ca 0.48 -0.41 -0.01 0.00 0.31 0.00 0.00 61.69 62.06 2b37 s THR 196 Cb 0.01 -3.69 0.27 0.00 0.01 0.00 0.00 72.50 69.10 2b37 s THR 196 CO -0.04 -0.49 0.96 0.00 -0.69 0.00 0.00 174.62 174.36 2b37 n LEU 197 N -1.97 -0.13 -2.51 4.42 -0.00 -1.26 -2.13 117.00 113.42 2b37 n LEU 197 Ca -0.01 1.05 -0.01 0.00 -0.00 0.00 0.00 56.01 57.04 2b37 n LEU 197 Cb 0.57 -0.36 0.07 0.00 -0.00 0.00 0.00 43.42 43.70 2b37 n LEU 197 CO 0.49 -1.04 0.31 0.00 -0.00 0.00 0.00 177.39 177.14 2b37 n ALA 198 N -3.51 2.80 -0.90 1.47 0.00 -1.26 -5.24 120.51 113.87 2b37 n ALA 198 Ca 0.13 -1.80 0.00 0.00 0.00 0.00 0.00 53.44 51.77 2b37 n ALA 198 Cb 0.41 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2b37 n ALA 198 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2b37 n MET 199 N -0.88 0.00 0.00 0.00 2.81 -0.90 -5.19 117.12 112.95 2b37 n MET 199 Ca -0.07 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 2b37 n MET 199 Cb 0.85 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.36 2b37 n MET 199 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 2b37 n GLU 220 N 0.00 0.00 -0.18 0.03 2.13 -1.26 -4.86 120.64 116.50 2b37 n GLU 220 Ca 0.00 0.00 0.21 0.00 0.66 0.00 0.00 57.16 58.03 2b37 n GLU 220 Cb 0.00 -0.30 0.33 0.00 0.27 0.00 0.00 31.44 31.74 2b37 n GLU 220 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2b37 n GLY 221 N 2.27 -0.56 0.11 8.31 0.00 -1.26 0.29 105.19 114.35 2b37 n GLY 221 Ca 0.00 0.28 -0.10 0.00 0.00 0.00 0.00 46.02 46.20 2b37 n GLY 221 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2b37 h TRP 222 N 0.00 0.28 -0.23 1.61 2.91 -1.98 0.36 115.95 118.89 2b37 h TRP 222 Ca 0.38 0.00 -0.14 0.00 1.13 0.00 0.00 58.89 60.26 2b37 h TRP 222 Cb 2.16 -0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 30.71 2b37 h TRP 222 CO 0.00 0.19 -0.43 0.22 -1.03 0.00 0.00 178.44 177.39 2b37 h ASP 223 N 0.29 0.61 0.77 2.65 3.58 -0.37 -0.08 116.42 123.87 2b37 h ASP 223 Ca 0.08 -0.28 -0.04 0.00 0.42 0.00 0.00 57.03 57.21 2b37 h ASP 223 Cb -0.02 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 40.87 2b37 h ASP 223 CO -0.02 0.96 -0.37 1.56 -2.88 0.00 0.00 179.24 178.50 2b37 h GLN 224 N 0.47 -1.00 -0.29 0.28 4.20 -1.55 -3.19 115.11 114.02 2b37 h GLN 224 Ca 0.03 0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2b37 h GLN 224 Cb 0.94 0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 2b37 h GLN 224 CO 0.08 -0.66 0.19 0.00 -0.67 0.00 0.00 178.83 177.78 2b37 h ARG 225 N -1.06 0.39 -6.23 1.46 3.08 -0.21 -3.42 114.38 108.38 2b37 h ARG 225 Ca -0.11 -0.02 -0.57 0.00 0.07 0.00 0.00 59.98 59.36 2b37 h ARG 225 Cb 0.80 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 2b37 h ARG 225 CO 0.17 0.26 1.24 0.00 -1.07 0.00 0.00 179.97 180.57 2b37 s ALA 226 N -5.37 3.18 0.36 0.04 0.00 -0.05 -4.57 121.76 115.34 2b37 s ALA 226 Ca -0.07 0.67 0.12 0.00 0.00 0.00 0.00 51.96 52.67 2b37 s ALA 226 Cb 0.17 -3.91 0.91 0.00 0.00 0.00 0.00 23.12 20.29 2b37 s ALA 226 CO 0.71 -2.12 1.82 -1.35 0.00 0.00 0.00 175.76 174.82 2b37 h PRO 227 N 11.80 0.57 -0.64 0.00 0.11 -1.76 0.10 132.00 142.19 2b37 h PRO 227 Ca -0.38 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2b37 h PRO 227 Cb 1.19 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2b37 h PRO 227 CO 0.98 0.38 0.00 0.44 -0.21 0.00 0.00 178.00 179.59 2b37 n ILE 228 N -4.63 1.74 -1.37 4.15 -5.35 -1.25 -5.08 119.36 107.57 2b37 n ILE 228 Ca 0.21 -1.20 0.09 0.00 -0.27 0.00 0.00 62.75 61.59 2b37 n ILE 228 Cb 0.64 0.17 -0.02 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 1.12 -1.97 3.61 3.28 0.00 0.35 -4.99 105.19 106.57 2b37 n GLY 229 Ca 0.25 -1.30 -0.03 0.00 0.00 0.00 0.00 46.02 44.94 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 -1.44 -0.81 -0.20 1.61 -0.11 -1.26 -4.57 118.94 112.16 2b37 s TRP 230 Ca 0.00 1.57 -0.07 0.00 1.22 0.00 0.00 56.10 58.82 2b37 s TRP 230 Cb 0.00 0.49 -0.04 0.00 -1.50 0.00 0.00 33.47 32.42 2b37 s TRP 230 CO 0.00 -0.40 0.06 1.21 -4.62 0.00 0.00 176.95 173.19 2b37 s ASN 231 N 1.75 5.41 0.00 5.86 2.47 -1.26 -4.41 114.94 124.76 2b37 s ASN 231 Ca -0.08 -0.02 0.25 0.00 0.42 0.00 0.00 52.86 53.42 2b37 s ASN 231 Cb -0.05 -1.94 0.40 0.00 -1.45 0.00 0.00 41.25 38.21 2b37 s ASN 231 CO -0.17 0.11 1.34 1.15 -3.72 0.00 0.00 177.10 175.81 2b37 n MET 232 N 3.93 0.74 0.00 0.43 0.00 -1.26 -3.50 117.12 117.46 2b37 n MET 232 Ca -0.16 -0.52 0.13 0.00 0.00 0.00 0.00 57.70 57.15 2b37 n MET 232 Cb 0.52 -1.49 0.39 0.00 0.00 0.00 0.00 33.22 32.64 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 -0.68 0.39 -4.02 3.17 5.02 -1.26 0.38 118.16 121.15 2b37 n LYS 233 Ca 0.10 -0.20 -0.33 0.00 -2.02 0.00 0.00 58.31 55.86 2b37 n LYS 233 Cb 0.38 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.75 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 -2.75 4.43 0.00 4.39 -1.08 -1.23 -4.77 116.67 115.66 2b37 s ASP 234 Ca 0.19 -1.25 0.23 0.00 -0.52 0.00 0.00 52.55 51.20 2b37 s ASP 234 Cb 0.19 -1.60 0.55 0.00 -1.46 0.00 0.00 42.92 40.60 2b37 s ASP 234 CO 0.59 -0.18 1.48 0.00 0.52 0.00 0.00 175.17 177.57 2b37 n ALA 235 N 4.52 2.40 -0.16 3.66 0.00 -1.26 -4.59 120.51 125.08 2b37 n ALA 235 Ca -0.15 -1.16 -0.11 0.00 0.00 0.00 0.00 53.44 52.02 2b37 n ALA 235 Cb 0.44 -0.91 -0.00 0.00 0.00 0.00 0.00 19.45 18.97 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 4.39 1.27 -0.97 0.00 2.02 -1.95 -2.37 112.91 115.30 2b37 h THR 236 Ca 0.00 -1.33 0.17 0.00 0.77 0.00 0.00 66.41 66.02 2b37 h THR 236 Cb 0.99 1.12 -0.09 0.00 -1.74 0.00 0.00 68.15 68.42 2b37 h THR 236 CO 0.00 0.46 0.61 -0.65 0.37 0.00 0.00 175.52 176.31 2b37 h PRO 237 N 0.82 0.72 -0.17 6.66 0.11 -1.99 -0.19 132.00 137.97 2b37 h PRO 237 Ca 0.11 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.13 2b37 h PRO 237 Cb 0.75 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.69 2b37 h PRO 237 CO 0.06 0.48 -0.08 0.28 -0.21 0.00 0.00 178.00 178.53 2b37 h VAL 238 N 0.75 1.31 -0.59 3.15 2.07 -1.76 -1.45 116.25 119.72 2b37 h VAL 238 Ca 0.53 -1.12 -0.05 0.00 0.82 0.00 0.00 66.70 66.87 2b37 h VAL 238 Cb 0.83 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 32.27 2b37 h VAL 238 CO -0.30 0.33 0.16 0.00 0.02 0.00 0.00 177.57 177.79 2b37 h ALA 239 N 0.68 1.17 -0.64 1.67 0.00 -1.20 0.21 119.26 121.14 2b37 h ALA 239 Ca 0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 2b37 h ALA 239 Cb 0.56 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2b37 h ALA 239 CO 0.02 0.57 0.22 0.87 0.00 0.00 0.00 179.25 180.94 2b37 h LYS 240 N 0.88 0.96 0.41 0.00 1.57 -0.97 -0.35 116.57 119.07 2b37 h LYS 240 Ca 0.19 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2b37 h LYS 240 Cb 0.29 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2b37 h LYS 240 CO -0.00 0.81 -0.20 1.15 -0.57 0.00 0.00 179.45 180.64 2b37 h THR 241 N 0.94 0.50 -0.69 -0.16 2.02 -0.29 -1.24 112.91 113.99 2b37 h THR 241 Ca 0.21 -0.51 0.15 0.00 0.77 0.00 0.00 66.41 67.04 2b37 h THR 241 Cb 0.23 0.71 -0.12 0.00 -1.74 0.00 0.00 68.15 67.24 2b37 h THR 241 CO -0.01 0.08 0.03 0.58 0.37 0.00 0.00 175.52 176.56 2b37 h VAL 242 N -0.88 0.43 -0.82 3.16 2.07 -0.58 0.12 116.25 119.75 2b37 h VAL 242 Ca -0.06 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 2b37 h VAL 242 Cb 0.56 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 2b37 h VAL 242 CO 0.09 0.02 0.48 0.00 0.02 0.00 0.00 177.57 178.19 2b37 h ALA 244 N 1.26 1.00 0.00 0.00 0.00 0.27 0.13 119.26 121.91 2b37 h ALA 244 Ca 0.29 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.11 2b37 h ALA 244 Cb -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2b37 h ALA 244 CO -0.05 0.00 -1.21 -0.07 0.00 0.00 0.00 179.25 177.91 2b37 h LEU 245 N 0.00 0.00 0.00 0.00 4.07 -0.57 -3.33 115.31 115.48 2b37 h LEU 245 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2b37 h LEU 245 Cb 0.02 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.76 2b37 h LEU 245 CO 0.00 0.32 -0.41 -0.07 -1.08 0.00 0.00 178.44 177.21 2b37 h LEU 246 N 0.00 0.00 0.00 1.67 3.38 -0.16 -3.46 115.31 116.74 2b37 h LEU 246 Ca -0.09 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 2b37 h LEU 246 Cb 1.33 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.13 2b37 h LEU 246 CO 0.03 0.03 0.05 -1.54 0.09 0.00 0.00 178.44 177.10 2b37 n SER 247 N -2.57 -0.95 -0.95 -0.43 3.41 0.23 -4.87 113.62 107.49 2b37 n SER 247 Ca 0.03 -0.80 0.12 0.00 -0.26 0.00 0.00 58.87 57.96 2b37 n SER 247 Cb 0.49 -0.28 0.24 0.00 -0.26 0.00 0.00 64.21 64.41 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 -3.44 2.88 -1.29 4.04 8.00 -1.26 -4.60 116.55 120.88 2b37 n ASP 248 Ca 0.04 -1.91 0.10 0.00 0.71 0.00 0.00 54.79 53.73 2b37 n ASP 248 Cb 0.16 -0.16 0.30 0.00 -0.02 0.00 0.00 41.12 41.40 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 1.14 1.05 -3.08 1.24 7.02 -1.26 -3.84 117.44 119.71 2b37 n TRP 249 Ca 0.18 -0.47 -0.18 0.00 -1.02 0.00 0.00 57.50 56.00 2b37 n TRP 249 Cb 0.53 -0.09 -0.02 0.00 -2.42 0.00 0.00 31.31 29.31 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 1.23 1.46 0.21 -0.99 4.77 -1.26 -4.98 117.00 117.44 2b37 n LEU 250 Ca 0.22 -4.95 0.09 0.00 -0.03 0.00 0.00 56.01 51.34 2b37 n LEU 250 Cb 0.65 0.50 0.41 0.00 -2.33 0.00 0.00 43.42 42.64 2b37 n LEU 250 CO 0.17 2.21 0.76 1.55 -1.33 0.00 0.00 177.39 180.76 2b37 h PRO 251 N 2.99 0.00 -0.01 3.23 0.13 -1.90 -3.11 132.00 133.33 2b37 h PRO 251 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2b37 h PRO 251 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2b37 h PRO 251 CO 0.55 0.27 -0.15 0.00 -0.23 0.00 0.00 178.00 178.44 2b37 n ALA 252 N -2.24 2.86 -2.49 -0.56 0.00 -1.26 -4.88 120.51 111.95 2b37 n ALA 252 Ca 0.00 -0.40 -0.43 0.00 0.00 0.00 0.00 53.44 52.61 2b37 n ALA 252 Cb 0.46 -1.17 -0.09 0.00 0.00 0.00 0.00 19.45 18.65 2b37 n ALA 252 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2b37 s THR 253 N -2.31 5.14 0.04 0.00 2.01 -1.18 -5.06 115.64 114.28 2b37 s THR 253 Ca 0.30 -0.37 -0.04 0.00 0.31 0.00 0.00 61.69 61.89 2b37 s THR 253 Cb 0.20 -3.99 -0.02 0.00 0.01 0.00 0.00 72.50 68.71 2b37 s THR 253 CO 0.45 -0.35 0.06 0.28 -0.69 0.00 0.00 174.62 174.36 2b37 s THR 254 N 2.02 0.15 -0.08 -0.82 -1.32 -1.26 -4.69 115.64 109.63 2b37 s THR 254 Ca 0.10 -1.20 0.00 0.00 -1.21 0.00 0.00 61.69 59.39 2b37 s THR 254 Cb -0.17 -0.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.89 2b37 s THR 254 CO 0.13 -0.66 0.00 0.61 -2.21 0.00 0.00 174.62 172.49 2b37 n GLY 255 N 0.74 0.20 1.43 6.08 0.00 0.14 -4.95 105.19 108.84 2b37 n GLY 255 Ca -0.19 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 2b37 n GLY 255 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b37 n ASP 256 N -0.72 1.51 -3.54 1.61 -0.08 -1.25 -4.24 116.55 109.85 2b37 n ASP 256 Ca -0.01 -1.69 -0.23 0.00 -1.51 0.00 0.00 54.79 51.35 2b37 n ASP 256 Cb 0.37 -0.04 -0.15 0.00 2.34 0.00 0.00 41.12 43.65 2b37 n ASP 256 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2b37 s ILE 257 N -0.91 -0.19 -0.14 5.18 1.01 -1.26 -2.25 121.20 122.64 2b37 s ILE 257 Ca 0.13 -0.27 -0.20 0.00 0.00 0.00 0.00 60.65 60.31 2b37 s ILE 257 Cb -0.01 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.72 2b37 s ILE 257 CO 0.09 -0.35 0.59 -0.63 0.00 0.00 0.00 174.94 174.64 2b37 s ILE 258 N 2.21 5.09 -0.37 2.92 1.09 -0.90 -4.89 121.20 126.34 2b37 s ILE 258 Ca 0.05 1.16 -0.18 0.00 -1.10 0.00 0.00 60.65 60.59 2b37 s ILE 258 Cb -0.16 -3.92 0.00 0.00 -1.06 0.00 0.00 42.46 37.32 2b37 s ILE 258 CO -0.17 0.22 0.52 -0.31 -0.10 0.00 0.00 174.94 175.10 2b37 s TYR 259 N 1.20 3.16 -1.02 3.97 1.51 -1.26 -1.52 117.35 123.39 2b37 s TYR 259 Ca 0.30 0.07 -0.05 0.00 -1.01 0.00 0.00 57.07 56.38 2b37 s TYR 259 Cb -0.16 -2.99 0.27 0.00 -0.11 0.00 0.00 41.96 38.97 2b37 s TYR 259 CO 0.12 -0.61 1.08 0.00 -1.11 0.00 0.00 175.55 175.03 2b37 n ALA 260 N 5.80 4.30 -1.22 3.71 0.00 0.59 -4.68 120.51 129.02 2b37 n ALA 260 Ca -0.05 -4.68 0.00 0.00 0.00 0.00 0.00 53.44 48.71 2b37 n ALA 260 Cb 0.49 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.81 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 2.17 0.00 -0.75 0.00 5.75 -1.26 -1.58 116.55 120.88 2b37 n ASP 261 Ca 0.24 -1.10 -0.07 0.00 -0.01 0.00 0.00 54.79 53.84 2b37 n ASP 261 Cb 0.37 -0.02 -0.01 0.00 -1.03 0.00 0.00 41.12 40.43 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 0.00 0.38 2.81 6.12 0.00 -1.26 -3.37 105.19 109.87 2b37 n GLY 262 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.39 0.74 0.42 -0.02 0.00 -1.26 -2.64 105.19 101.04 2b37 n GLY 263 Ca -0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.62 -0.35 4.61 0.00 -1.80 -0.20 119.26 120.90 2b37 h ALA 264 Ca 0.00 0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.02 2b37 h ALA 264 Cb 0.04 0.91 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2b37 h ALA 264 CO 0.00 -0.95 0.28 1.12 0.00 0.00 0.00 179.25 179.70 2b37 h HIS 265 N -0.44 0.00 0.00 0.00 2.07 -1.91 0.11 115.15 114.97 2b37 h HIS 265 Ca 0.09 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.61 2b37 h HIS 265 Cb 0.62 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.60 2b37 h HIS 265 CO -0.58 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 174.53 2b37 n THR 266 N -4.20 0.06 -4.31 6.12 -2.24 -0.09 -4.80 114.28 104.81 2b37 n THR 266 Ca 0.06 0.01 -0.19 0.00 -2.27 0.00 0.00 64.05 61.66 2b37 n THR 266 Cb 0.46 -0.68 -0.11 0.00 -2.10 0.00 0.00 70.33 67.90 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 -2.09 1.23 -0.13 -0.78 -1.52 0.37 -5.06 119.66 111.70 2b37 s GLN 267 Ca 0.30 -1.46 0.05 0.00 -1.95 0.00 0.00 55.36 52.31 2b37 s GLN 267 Cb 0.14 -1.11 -0.12 0.00 -0.22 0.00 0.00 33.01 31.71 2b37 s GLN 267 CO 0.25 0.20 -0.04 -0.11 -0.25 0.00 0.00 175.29 175.34 2b37 n LEU 268 N 0.01 1.50 0.00 2.90 7.94 -1.26 -4.99 117.00 123.10 2b37 n LEU 268 Ca -0.11 -0.04 0.00 0.00 -1.11 0.00 0.00 56.01 54.75 2b37 n LEU 268 Cb 0.59 -0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.42 2b37 n LEU 268 CO 0.31 0.51 0.00 -0.11 -1.11 0.00 0.00 177.39 176.99