#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b3g h VAL 2 N 0.00 1.19 0.00 1.12 2.07 -1.95 0.57 116.25 119.25 2b3g h VAL 2 Ca 0.00 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.65 2b3g h VAL 2 Cb 0.00 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2b3g h VAL 2 CO 0.00 0.26 0.00 0.61 0.02 0.00 0.00 177.57 178.46 2b3g n GLY 3 N -0.80 -0.38 0.04 2.17 0.00 -1.26 -0.76 105.19 104.20 2b3g n GLY 3 Ca -0.01 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.11 2b3g n GLY 3 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2b3g n GLN 4 N -1.31 0.21 -4.13 1.61 6.02 0.19 -4.94 117.38 115.03 2b3g n GLN 4 Ca 0.01 0.05 -0.27 0.00 -0.01 0.00 0.00 57.00 56.78 2b3g n GLN 4 Cb 0.02 -1.62 -0.07 0.00 1.02 0.00 0.00 30.24 29.59 2b3g n GLN 4 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2b3g s LEU 5 N -3.83 3.58 -1.46 1.08 1.43 0.06 -4.86 118.68 114.69 2b3g s LEU 5 Ca 0.07 -0.23 -0.13 0.00 -1.03 0.00 0.00 54.13 52.82 2b3g s LEU 5 Cb 0.15 -2.23 0.04 0.00 0.03 0.00 0.00 46.19 44.18 2b3g s LEU 5 CO 0.72 0.10 2.28 -1.20 0.23 0.00 0.00 176.35 178.47 2b3g n SER 6 N -0.10 4.54 -4.68 2.29 7.64 0.72 -4.89 113.62 119.14 2b3g n SER 6 Ca -0.09 -2.84 -0.56 0.00 1.01 0.00 0.00 58.87 56.39 2b3g n SER 6 Cb 0.54 -1.63 -0.07 0.00 -1.01 0.00 0.00 64.21 62.05 2b3g n SER 6 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2b3g n GLU 7 N 5.57 1.18 -0.02 1.43 1.02 -0.90 -1.07 120.64 127.86 2b3g n GLU 7 Ca 0.54 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 2b3g n GLU 7 Cb 0.37 -2.11 0.00 0.00 -0.02 0.00 0.00 31.44 29.68 2b3g n GLU 7 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2b3g n GLY 8 N 3.82 0.39 0.29 0.62 0.00 -1.26 -4.94 105.19 104.10 2b3g n GLY 8 Ca 0.25 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.21 2b3g n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b3g h ALA 9 N 0.00 0.90 0.13 4.61 0.00 -1.44 -0.23 119.26 123.24 2b3g h ALA 9 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2b3g h ALA 9 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2b3g h ALA 9 CO 0.00 0.39 -0.06 0.82 0.00 0.00 0.00 179.25 180.40 2b3g h ILE 10 N 0.97 0.95 -0.99 0.00 2.04 -1.93 0.06 117.51 118.61 2b3g h ILE 10 Ca 0.25 -0.33 0.11 0.00 1.00 0.00 0.00 64.86 65.90 2b3g h ILE 10 Cb -0.01 1.16 -0.08 0.00 -0.74 0.00 0.00 36.82 37.15 2b3g h ILE 10 CO -0.04 0.08 0.62 0.00 0.00 0.00 0.00 178.15 178.80 2b3g h ALA 11 N 0.51 1.47 -0.25 1.87 0.00 -1.95 -0.28 119.26 120.63 2b3g h ALA 11 Ca -0.02 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2b3g h ALA 11 Cb 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2b3g h ALA 11 CO 0.03 0.23 0.10 0.00 0.00 0.00 0.00 179.25 179.61 2b3g h ALA 12 N 1.52 0.32 -0.72 0.00 0.00 -0.64 0.11 119.26 119.86 2b3g h ALA 12 Ca 0.48 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 2b3g h ALA 12 Cb 0.45 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2b3g h ALA 12 CO -0.26 -0.08 0.24 0.82 0.00 0.00 0.00 179.25 179.97 2b3g h ILE 13 N 0.25 1.26 -0.22 0.00 2.04 -0.51 0.19 117.51 120.51 2b3g h ILE 13 Ca 0.08 -0.86 -0.15 0.00 1.00 0.00 0.00 64.86 64.93 2b3g h ILE 13 Cb 0.17 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 2b3g h ILE 13 CO -0.01 0.34 -0.47 0.24 0.00 0.00 0.00 178.15 178.26 2b3g h MET 14 N 1.05 0.57 0.00 2.37 2.86 -0.77 0.22 114.93 121.23 2b3g h MET 14 Ca 0.23 -0.32 -0.03 0.00 -2.06 0.00 0.00 59.70 57.52 2b3g h MET 14 Cb 0.28 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.95 2b3g h MET 14 CO -0.01 0.92 -0.18 1.96 1.06 0.00 0.00 176.91 180.65 2b3g h GLN 15 N 0.46 0.00 0.00 1.72 4.20 -0.85 -3.41 115.11 117.23 2b3g h GLN 15 Ca 0.03 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.46 2b3g h GLN 15 Cb 0.99 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.72 2b3g h GLN 15 CO 0.09 0.79 -1.63 0.87 -0.67 0.00 0.00 178.83 178.28 2b3g h LYS 16 N -1.00 0.00 -0.01 1.46 1.79 -0.71 -3.48 116.57 114.61 2b3g h LYS 16 Ca -0.05 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2b3g h LYS 16 Cb 0.84 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.49 2b3g h LYS 16 CO -0.03 0.54 -0.01 0.41 -1.08 0.00 0.00 179.45 179.29 2b3g n GLY 17 N 1.53 0.22 3.82 3.86 0.00 0.78 -5.00 105.19 110.41 2b3g n GLY 17 Ca -0.15 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 2b3g n GLY 17 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b3g s ASP 18 N -2.02 6.58 -0.04 1.61 1.01 -1.26 -4.78 116.67 117.77 2b3g s ASP 18 Ca 0.00 1.71 0.06 0.00 0.71 0.00 0.00 52.55 55.03 2b3g s ASP 18 Cb 0.00 -2.53 0.11 0.00 1.01 0.00 0.00 42.92 41.51 2b3g s ASP 18 CO 0.00 -0.61 1.07 0.35 0.21 0.00 0.00 175.17 176.19 2b3g n THR 19 N -1.19 1.28 -0.48 -1.27 -2.24 -1.26 -4.68 114.28 104.44 2b3g n THR 19 Ca 0.07 -1.37 -0.16 0.00 -2.27 0.00 0.00 64.05 60.33 2b3g n THR 19 Cb 0.54 0.28 0.12 0.00 -2.10 0.00 0.00 70.33 69.16 2b3g n THR 19 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2b3g n ASN 20 N -0.68 3.60 -4.37 3.42 6.94 -1.26 -4.75 115.26 118.16 2b3g n ASN 20 Ca 0.06 -3.06 -0.19 0.00 -0.02 0.00 0.00 54.58 51.36 2b3g n ASN 20 Cb 0.38 -0.73 -0.10 0.00 -2.36 0.00 0.00 39.78 36.97 2b3g n ASN 20 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 2b3g s ILE 21 N -2.19 1.79 -0.47 1.53 -4.36 -1.26 -5.09 121.20 111.16 2b3g s ILE 21 Ca 0.37 -2.22 0.08 0.00 -0.26 0.00 0.00 60.65 58.63 2b3g s ILE 21 Cb 0.31 -2.14 0.29 0.00 1.25 0.00 0.00 42.46 42.18 2b3g s ILE 21 CO 0.07 -0.53 0.69 0.29 0.24 0.00 0.00 174.94 175.70 2b3g n LYS 22 N -0.44 1.59 -2.19 0.37 5.02 -1.26 -4.87 118.16 116.38 2b3g n LYS 22 Ca -0.07 -3.85 -0.36 0.00 -2.02 0.00 0.00 58.31 52.00 2b3g n LYS 22 Cb 0.61 -1.74 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 2b3g n LYS 22 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2b3g s PRO 23 N -2.15 3.45 -0.22 1.97 0.04 -1.24 -4.36 135.00 132.47 2b3g s PRO 23 Ca 0.40 1.75 -0.11 0.00 0.04 0.00 0.00 61.00 63.07 2b3g s PRO 23 Cb 0.23 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 32.55 2b3g s PRO 23 CO -0.08 -0.80 0.18 0.42 0.04 0.00 0.00 177.00 176.75 2b3g s ILE 24 N -1.63 5.36 0.11 0.56 1.01 -1.26 -0.55 121.20 124.79 2b3g s ILE 24 Ca 0.70 0.24 0.01 0.00 0.00 0.00 0.00 60.65 61.60 2b3g s ILE 24 Cb -0.28 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 2b3g s ILE 24 CO 0.32 0.36 -0.05 -0.76 0.00 0.00 0.00 174.94 174.81 2b3g s LEU 25 N 0.90 2.42 -0.13 2.97 1.43 -0.07 -0.20 118.68 126.00 2b3g s LEU 25 Ca 0.09 -1.04 -0.03 0.00 -1.03 0.00 0.00 54.13 52.12 2b3g s LEU 25 Cb -0.13 -0.03 -0.03 0.00 0.03 0.00 0.00 46.19 46.03 2b3g s LEU 25 CO 0.03 -0.51 -0.02 -1.58 0.23 0.00 0.00 176.35 174.51 2b3g s GLN 26 N -3.86 3.38 -0.03 1.70 0.74 -0.05 -0.95 119.66 120.59 2b3g s GLN 26 Ca 0.14 -0.47 -0.30 0.00 0.05 0.00 0.00 55.36 54.78 2b3g s GLN 26 Cb 0.06 -2.87 -0.04 0.00 1.10 0.00 0.00 33.01 31.26 2b3g s GLN 26 CO -0.04 0.44 1.27 0.08 -0.55 0.00 0.00 175.29 176.49 2b3g s VAL 27 N -0.18 4.07 -0.22 1.34 1.01 -0.15 -0.16 120.40 126.11 2b3g s VAL 27 Ca 0.04 1.42 -0.06 0.00 0.00 0.00 0.00 61.98 63.38 2b3g s VAL 27 Cb -0.13 -3.91 -0.19 0.00 0.00 0.00 0.00 36.38 32.15 2b3g s VAL 27 CO 0.02 0.00 -0.03 -0.38 0.00 0.00 0.00 175.10 174.71 2b3g n ILE 28 N 4.61 1.59 -3.63 2.22 2.08 0.44 0.81 119.36 127.47 2b3g n ILE 28 Ca 0.12 -0.51 -0.16 0.00 0.56 0.00 0.00 62.75 62.76 2b3g n ILE 28 Cb 0.45 -1.66 -0.07 0.00 -0.75 0.00 0.00 39.64 37.61 2b3g n ILE 28 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 2b3g s ASN 29 N -6.88 -0.47 -0.03 4.38 2.47 -0.97 -4.48 114.94 108.96 2b3g s ASN 29 Ca -0.31 0.50 0.01 0.00 0.42 0.00 0.00 52.86 53.48 2b3g s ASN 29 Cb 0.09 0.49 0.01 0.00 -1.45 0.00 0.00 41.25 40.39 2b3g s ASN 29 CO 0.63 -0.51 -0.05 -0.63 -3.72 0.00 0.00 177.10 172.82 2b3g s ILE 30 N -1.13 0.51 -0.02 -5.21 1.01 -1.26 -0.96 121.20 114.13 2b3g s ILE 30 Ca -0.11 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.37 2b3g s ILE 30 Cb -0.02 -0.49 0.01 0.00 0.01 0.00 0.00 42.46 41.96 2b3g s ILE 30 CO 0.07 0.19 -0.04 -0.60 0.00 0.00 0.00 174.94 174.56 2b3g s ARG 31 N 0.47 0.53 0.33 2.79 3.52 -0.18 -4.98 118.95 121.43 2b3g s ARG 31 Ca -0.06 -0.11 -0.26 0.00 -0.13 0.00 0.00 55.73 55.17 2b3g s ARG 31 Cb -0.10 -0.56 -0.10 0.00 -1.56 0.00 0.00 34.95 32.63 2b3g s ARG 31 CO -0.00 0.00 0.98 -1.25 -0.81 0.00 0.00 175.30 174.22 2b3g s PRO 32 N 0.44 4.51 -0.20 5.12 0.04 -1.26 -0.49 135.00 143.16 2b3g s PRO 32 Ca -0.05 1.42 -0.02 0.00 0.04 0.00 0.00 61.00 62.38 2b3g s PRO 32 Cb -0.09 -2.80 -0.00 0.00 0.04 0.00 0.00 34.50 31.66 2b3g s PRO 32 CO -0.00 0.19 -0.09 0.42 0.04 0.00 0.00 177.00 177.55 2b3g s ILE 33 N -1.57 2.97 0.48 0.56 1.01 0.47 -4.89 121.20 120.23 2b3g s ILE 33 Ca 0.51 -0.63 -0.19 0.00 0.00 0.00 0.00 60.65 60.33 2b3g s ILE 33 Cb -0.21 -2.32 -0.09 0.00 0.01 0.00 0.00 42.46 39.85 2b3g s ILE 33 CO 0.26 0.46 1.00 0.42 0.00 0.00 0.00 174.94 177.09 2b3g s THR 34 N 1.36 4.15 0.19 2.92 -4.23 -1.26 -0.40 115.64 118.36 2b3g s THR 34 Ca 0.05 1.24 0.00 0.00 -1.18 0.00 0.00 61.69 61.80 2b3g s THR 34 Cb -0.14 -3.55 0.00 0.00 1.34 0.00 0.00 72.50 70.16 2b3g s THR 34 CO -0.06 -0.38 0.00 -1.54 -0.54 0.00 0.00 174.62 172.10 2b3g n SER 38 N -1.08 -3.15 -4.58 3.99 3.41 -1.26 -4.89 113.62 106.06 2b3g n SER 38 Ca 0.08 0.40 -0.38 0.00 -0.26 0.00 0.00 58.87 58.71 2b3g n SER 38 Cb 0.53 -2.69 0.05 0.00 -0.26 0.00 0.00 64.21 61.84 2b3g n SER 38 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2b3g n PRO 39 N -2.93 0.80 -1.62 4.33 -0.02 -1.26 -4.92 135.00 129.39 2b3g n PRO 39 Ca -0.02 0.31 -0.36 0.00 -2.02 0.00 0.00 63.50 61.42 2b3g n PRO 39 Cb 0.53 -2.06 0.08 0.00 -0.02 0.00 0.00 33.50 32.02 2b3g n PRO 39 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2b3g s PRO 40 N -2.61 2.38 -0.20 0.52 0.04 -1.26 -5.01 135.00 128.86 2b3g s PRO 40 Ca 0.74 1.90 -0.06 0.00 0.04 0.00 0.00 61.00 63.63 2b3g s PRO 40 Cb -0.42 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 2b3g s PRO 40 CO 0.48 -1.69 0.03 1.03 0.04 0.00 0.00 177.00 176.90 2b3g s ARG 41 N -3.62 3.74 -0.15 4.56 1.81 0.46 -4.92 118.95 120.84 2b3g s ARG 41 Ca 0.78 -0.46 -0.14 0.00 -1.72 0.00 0.00 55.73 54.20 2b3g s ARG 41 Cb -0.33 -3.15 -0.05 0.00 -0.45 0.00 0.00 34.95 30.98 2b3g s ARG 41 CO 0.42 0.09 0.30 0.71 -0.68 0.00 0.00 175.30 176.13 2b3g s TYR 42 N 0.84 3.49 -0.03 -0.53 2.02 -1.26 0.18 117.35 122.05 2b3g s TYR 42 Ca 0.02 0.63 -0.03 0.00 -0.37 0.00 0.00 57.07 57.32 2b3g s TYR 42 Cb -0.14 -2.32 -0.04 0.00 -0.40 0.00 0.00 41.96 39.06 2b3g s TYR 42 CO 0.02 0.29 0.14 0.50 -1.57 0.00 0.00 175.55 174.93 2b3g s ARG 43 N 0.28 3.32 -0.00 -0.62 3.52 0.36 -1.05 118.95 124.76 2b3g s ARG 43 Ca 0.17 -0.33 0.04 0.00 -0.13 0.00 0.00 55.73 55.48 2b3g s ARG 43 Cb -0.13 -3.04 -0.01 0.00 -1.56 0.00 0.00 34.95 30.21 2b3g s ARG 43 CO 0.05 0.69 -0.13 -0.51 -0.81 0.00 0.00 175.30 174.59 2b3g s LEU 44 N -1.65 2.05 -0.36 -0.88 1.02 0.27 -1.01 118.68 118.12 2b3g s LEU 44 Ca 0.23 -0.27 -0.12 0.00 0.02 0.00 0.00 54.13 53.99 2b3g s LEU 44 Cb -0.12 -0.64 0.01 0.00 0.02 0.00 0.00 46.19 45.45 2b3g s LEU 44 CO 0.14 0.13 0.22 -0.22 0.02 0.00 0.00 176.35 176.64 2b3g s LEU 45 N -0.44 4.59 0.24 1.79 2.96 -0.14 -3.23 118.68 124.45 2b3g s LEU 45 Ca 0.04 -0.71 0.09 0.00 -0.22 0.00 0.00 54.13 53.33 2b3g s LEU 45 Cb -0.05 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 2b3g s LEU 45 CO -0.00 -0.31 -0.03 -0.04 -1.32 0.00 0.00 176.35 174.65 2b3g s MET 46 N 1.64 2.24 -0.00 1.98 -1.94 -0.64 -0.42 119.30 122.15 2b3g s MET 46 Ca 0.04 -1.37 0.06 0.00 -1.71 0.00 0.00 55.69 52.72 2b3g s MET 46 Cb -0.18 -2.17 -0.02 0.00 2.01 0.00 0.00 34.83 34.47 2b3g s MET 46 CO 0.08 0.39 -0.20 0.45 -0.01 0.00 0.00 175.02 175.72 2b3g s SER 47 N -3.43 2.39 -0.15 3.03 0.15 0.77 -1.49 113.70 114.97 2b3g s SER 47 Ca 0.30 -0.39 0.16 0.00 0.70 0.00 0.00 55.95 56.71 2b3g s SER 47 Cb -0.07 -0.25 0.57 0.00 -1.71 0.00 0.00 66.02 64.56 2b3g s SER 47 CO 0.19 0.23 1.48 -0.90 1.20 0.00 0.00 173.24 175.44 2b3g n ASP 48 N 2.45 4.19 0.00 5.45 5.68 -0.53 -0.87 116.55 132.92 2b3g n ASP 48 Ca -0.15 -2.78 0.00 0.00 -0.50 0.00 0.00 54.79 51.36 2b3g n ASP 48 Cb 0.53 -0.53 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2b3g n ASP 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2b3g n GLY 49 N 0.05 2.68 0.10 6.12 0.00 -1.26 -2.11 105.19 110.77 2b3g n GLY 49 Ca 0.22 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2b3g n GLY 49 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2b3g n LEU 50 N 0.00 1.88 -4.50 0.99 7.94 -1.26 -3.85 117.00 118.20 2b3g n LEU 50 Ca 0.00 0.46 -0.26 0.00 -1.11 0.00 0.00 56.01 55.10 2b3g n LEU 50 Cb 0.00 -0.86 -0.10 0.00 0.53 0.00 0.00 43.42 42.99 2b3g n LEU 50 CO 0.00 -0.05 -0.47 0.20 -1.11 0.00 0.00 177.39 175.96 2b3g s ASN 51 N -6.37 3.82 0.23 1.96 0.02 -1.26 -1.04 114.94 112.30 2b3g s ASN 51 Ca -0.26 -0.78 0.07 0.00 -1.02 0.00 0.00 52.86 50.87 2b3g s ASN 51 Cb 0.06 -0.46 -0.04 0.00 0.02 0.00 0.00 41.25 40.83 2b3g s ASN 51 CO 0.41 0.09 0.15 0.42 0.02 0.00 0.00 177.10 178.19 2b3g s THR 52 N -1.87 4.28 -0.17 1.60 -4.23 -0.40 -1.45 115.64 113.40 2b3g s THR 52 Ca 0.24 -1.42 -0.13 0.00 -1.18 0.00 0.00 61.69 59.20 2b3g s THR 52 Cb -0.08 -3.28 0.05 0.00 1.34 0.00 0.00 72.50 70.53 2b3g s THR 52 CO 0.13 -0.30 0.43 -0.22 -0.54 0.00 0.00 174.62 174.13 2b3g s LEU 53 N -3.64 0.19 0.00 4.79 2.96 -0.55 -1.06 118.68 121.36 2b3g s LEU 53 Ca 0.32 0.89 0.18 0.00 -0.22 0.00 0.00 54.13 55.31 2b3g s LEU 53 Cb -0.08 1.47 0.42 0.00 0.50 0.00 0.00 46.19 48.50 2b3g s LEU 53 CO 0.24 -0.17 1.34 -1.54 -1.32 0.00 0.00 176.35 174.91 2b3g n SER 54 N 3.29 3.31 -1.97 3.68 3.41 -1.26 -1.63 113.62 122.45 2b3g n SER 54 Ca -0.16 -1.94 -0.05 0.00 -0.26 0.00 0.00 58.87 56.45 2b3g n SER 54 Cb 0.57 -0.29 0.30 0.00 -0.26 0.00 0.00 64.21 64.52 2b3g n SER 54 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2b3g n SER 55 N 1.17 4.80 -4.78 4.04 3.41 -1.26 -4.54 113.62 116.46 2b3g n SER 55 Ca 0.17 -3.15 -0.39 0.00 -0.26 0.00 0.00 58.87 55.25 2b3g n SER 55 Cb 0.53 -0.74 -0.06 0.00 -0.26 0.00 0.00 64.21 63.68 2b3g n SER 55 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2b3g s PHE 56 N -2.86 3.88 0.08 7.33 0.08 -1.20 -1.17 117.98 124.12 2b3g s PHE 56 Ca 0.53 1.61 0.05 0.00 0.12 0.00 0.00 56.93 59.24 2b3g s PHE 56 Cb 0.42 -2.75 -0.03 0.00 -0.57 0.00 0.00 43.02 40.08 2b3g s PHE 56 CO 0.13 0.49 -0.14 -1.64 -0.10 0.00 0.00 175.22 173.97 2b3g s MET 57 N -1.24 0.85 -0.16 0.44 -1.94 0.65 -0.57 119.30 117.33 2b3g s MET 57 Ca 0.37 -1.01 -0.11 0.00 -1.71 0.00 0.00 55.69 53.23 2b3g s MET 57 Cb -0.22 -0.82 -0.05 0.00 2.01 0.00 0.00 34.83 35.75 2b3g s MET 57 CO 0.26 0.18 0.19 -1.17 -0.01 0.00 0.00 175.02 174.46 2b3g s LEU 58 N -1.89 4.27 0.59 -0.03 2.96 -0.22 -0.13 118.68 124.24 2b3g s LEU 58 Ca 0.00 0.39 -0.20 0.00 -0.22 0.00 0.00 54.13 54.10 2b3g s LEU 58 Cb -0.09 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.38 2b3g s LEU 58 CO 0.02 0.22 1.28 0.00 -1.32 0.00 0.00 176.35 176.55 2b3g s ALA 59 N 0.01 2.60 0.08 5.97 0.00 0.19 -4.50 121.76 126.11 2b3g s ALA 59 Ca 0.12 1.17 0.31 0.00 0.00 0.00 0.00 51.96 53.56 2b3g s ALA 59 Cb -0.12 -3.51 1.19 0.00 0.00 0.00 0.00 23.12 20.68 2b3g s ALA 59 CO 0.02 -1.33 1.92 1.79 0.00 0.00 0.00 175.76 178.16 2b3g h THR 60 N 1.00 0.15 0.00 0.00 1.35 -1.91 -2.01 112.91 111.48 2b3g h THR 60 Ca -0.51 -0.70 -0.00 0.00 -0.55 0.00 0.00 66.41 64.66 2b3g h THR 60 Cb 1.31 1.60 -0.00 0.00 -1.73 0.00 0.00 68.15 69.33 2b3g h THR 60 CO 0.55 0.06 -0.00 0.06 -0.25 0.00 0.00 175.52 175.94 2b3g h GLN 61 N 0.00 0.00 -0.00 4.72 -0.00 -1.93 -1.24 115.11 116.65 2b3g h GLN 61 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2b3g h GLN 61 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.08 2b3g h GLN 61 CO 0.01 0.00 -0.35 1.28 -0.00 0.00 0.00 178.83 179.77 2b3g n LEU 62 N -3.29 0.53 -0.34 0.06 4.77 -0.76 -4.23 117.00 113.75 2b3g n LEU 62 Ca -0.03 0.02 0.17 0.00 -0.03 0.00 0.00 56.01 56.14 2b3g n LEU 62 Cb 0.08 -0.25 0.38 0.00 -2.33 0.00 0.00 43.42 41.29 2b3g n LEU 62 CO 0.22 0.12 1.15 0.78 -1.33 0.00 0.00 177.39 178.32 2b3g h ASN 63 N 0.29 0.63 -0.15 -1.43 4.21 -1.33 -0.02 115.58 117.77 2b3g h ASN 63 Ca 0.00 0.14 0.04 0.00 1.21 0.00 0.00 56.30 57.69 2b3g h ASN 63 Cb 0.49 0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 37.73 2b3g h ASN 63 CO 0.00 0.09 0.11 -0.65 -1.29 0.00 0.00 177.43 175.69 2b3g h PRO 64 N 0.56 0.00 -0.32 0.81 0.11 -1.79 0.12 132.00 131.49 2b3g h PRO 64 Ca 0.63 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.71 2b3g h PRO 64 Cb 1.21 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2b3g h PRO 64 CO -0.48 0.00 0.03 -0.07 -0.21 0.00 0.00 178.00 177.26 2b3g h LEU 65 N 0.00 0.44 0.11 2.35 3.38 -1.29 0.13 115.31 120.43 2b3g h LEU 65 Ca 0.07 -0.07 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 2b3g h LEU 65 Cb 0.30 -0.11 0.02 0.00 0.09 0.00 0.00 40.66 40.95 2b3g h LEU 65 CO -0.00 0.48 -0.78 0.58 0.09 0.00 0.00 178.44 178.82 2b3g h VAL 66 N 0.46 1.49 -0.23 1.22 2.07 -1.15 0.67 116.25 120.78 2b3g h VAL 66 Ca 0.10 -2.43 -0.10 0.00 0.82 0.00 0.00 66.70 65.09 2b3g h VAL 66 Cb 0.26 3.06 -0.01 0.00 -1.52 0.00 0.00 31.29 33.08 2b3g h VAL 66 CO 0.00 0.69 -0.28 -0.33 0.02 0.00 0.00 177.57 177.68 2b3g h GLU 67 N -0.30 0.46 -0.17 1.57 5.08 -0.91 -1.85 114.58 118.46 2b3g h GLU 67 Ca -0.13 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2b3g h GLU 67 Cb 1.58 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.80 2b3g h GLU 67 CO 0.15 0.70 0.00 0.39 -1.00 0.00 0.00 179.01 179.24 2b3g n GLU 68 N -4.11 1.53 -1.35 2.33 1.02 0.02 -4.93 120.64 115.15 2b3g n GLU 68 Ca -0.01 -0.80 -0.12 0.00 -0.02 0.00 0.00 57.16 56.21 2b3g n GLU 68 Cb 0.42 -1.29 -0.05 0.00 -0.02 0.00 0.00 31.44 30.49 2b3g n GLU 68 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2b3g n GLU 69 N 0.07 -0.95 -0.01 3.49 -0.58 -0.69 -4.90 120.64 117.06 2b3g n GLU 69 Ca 0.13 0.91 -0.16 0.00 -0.42 0.00 0.00 57.16 57.61 2b3g n GLU 69 Cb 0.23 -4.96 -0.10 0.00 -0.57 0.00 0.00 31.44 26.03 2b3g n GLU 69 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 2b3g h GLN 70 N 0.03 0.40 -4.80 3.49 4.20 -1.20 -3.41 115.11 113.83 2b3g h GLN 70 Ca -0.25 -0.38 -0.70 0.00 0.06 0.00 0.00 58.65 57.38 2b3g h GLN 70 Cb 0.85 0.10 -0.19 0.00 0.30 0.00 0.00 27.48 28.53 2b3g h GLN 70 CO 0.36 1.04 -0.25 -1.17 -0.67 0.00 0.00 178.83 178.14 2b3g s LEU 71 N -8.49 4.89 0.21 1.46 2.96 -0.10 -4.77 118.68 114.85 2b3g s LEU 71 Ca -0.13 -0.70 -0.14 0.00 -0.22 0.00 0.00 54.13 52.94 2b3g s LEU 71 Cb 0.04 -2.34 0.01 0.00 0.50 0.00 0.00 46.19 44.39 2b3g s LEU 71 CO 0.81 -0.54 0.45 -0.94 -1.32 0.00 0.00 176.35 174.80 2b3g s SER 72 N 1.78 -0.12 0.17 3.68 1.04 -1.26 -4.38 113.70 114.61 2b3g s SER 72 Ca 0.11 -0.74 -0.33 0.00 0.48 0.00 0.00 55.95 55.46 2b3g s SER 72 Cb -0.17 0.55 -0.14 0.00 0.10 0.00 0.00 66.02 66.35 2b3g s SER 72 CO 0.13 -1.05 1.42 -1.20 0.98 0.00 0.00 173.24 173.52 2b3g n SER 73 N -0.32 2.47 0.00 7.02 7.64 -1.26 -1.36 113.62 127.80 2b3g n SER 73 Ca -0.06 1.12 0.00 0.00 1.01 0.00 0.00 58.87 60.94 2b3g n SER 73 Cb 0.62 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 2b3g n SER 73 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2b3g n ASN 74 N 2.64 0.00 -4.78 6.43 3.02 0.24 -4.64 115.26 118.17 2b3g n ASN 74 Ca 0.15 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.39 2b3g n ASN 74 Cb 0.27 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.51 2b3g n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2b3g s VAL 76 N -2.75 3.02 0.06 0.00 1.01 -0.68 -0.98 120.40 120.07 2b3g s VAL 76 Ca 0.62 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.92 2b3g s VAL 76 Cb -0.17 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 2b3g s VAL 76 CO 0.51 0.54 -0.04 0.00 0.00 0.00 0.00 175.10 176.10 2b3g s GLN 78 N -3.15 3.52 -0.21 0.00 0.74 0.25 -0.89 119.66 119.92 2b3g s GLN 78 Ca 0.02 -0.50 -0.22 0.00 0.05 0.00 0.00 55.36 54.71 2b3g s GLN 78 Cb 0.02 -2.89 -0.02 0.00 1.10 0.00 0.00 33.01 31.22 2b3g s GLN 78 CO -0.06 0.34 0.70 0.42 -0.55 0.00 0.00 175.29 176.14 2b3g s ILE 79 N 0.09 4.96 -0.12 -2.34 -1.09 0.29 -1.23 121.20 121.75 2b3g s ILE 79 Ca 0.00 1.31 0.19 0.00 -2.23 0.00 0.00 60.65 59.93 2b3g s ILE 79 Cb -0.13 -4.00 -0.26 0.00 -1.58 0.00 0.00 42.46 36.49 2b3g s ILE 79 CO 0.03 0.05 0.37 1.41 -1.23 0.00 0.00 174.94 175.57 2b3g n HIS 80 N 5.34 0.20 -3.68 3.97 8.25 0.14 -3.73 115.22 125.71 2b3g n HIS 80 Ca 0.01 0.07 -0.11 0.00 -0.26 0.00 0.00 57.72 57.43 2b3g n HIS 80 Cb 0.49 -0.84 -0.09 0.00 1.12 0.00 0.00 29.99 30.67 2b3g n HIS 80 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2b3g s ARG 81 N -2.95 0.54 0.13 -0.41 3.52 -1.00 -4.91 118.95 113.88 2b3g s ARG 81 Ca -0.08 0.86 -0.09 0.00 -0.13 0.00 0.00 55.73 56.29 2b3g s ARG 81 Cb 0.09 0.13 -0.00 0.00 -1.56 0.00 0.00 34.95 33.61 2b3g s ARG 81 CO 0.85 -0.12 0.25 -0.59 -0.81 0.00 0.00 175.30 174.88 2b3g s PHE 82 N 1.04 0.24 0.19 5.12 -0.12 -1.26 -0.28 117.98 122.90 2b3g s PHE 82 Ca -0.06 -0.63 0.08 0.00 -0.05 0.00 0.00 56.93 56.27 2b3g s PHE 82 Cb -0.06 -0.04 -0.04 0.00 -0.63 0.00 0.00 43.02 42.25 2b3g s PHE 82 CO -0.09 -0.63 -0.16 0.96 -0.05 0.00 0.00 175.22 175.24 2b3g s ILE 83 N -3.91 1.79 -0.07 -4.49 -4.36 -0.53 -4.89 121.20 104.75 2b3g s ILE 83 Ca 0.10 -2.08 0.02 0.00 -0.26 0.00 0.00 60.65 58.43 2b3g s ILE 83 Cb 0.04 -1.95 -0.03 0.00 1.25 0.00 0.00 42.46 41.77 2b3g s ILE 83 CO -0.06 -0.47 -0.12 -0.69 0.24 0.00 0.00 174.94 173.84 2b3g s VAL 84 N -2.54 3.26 -0.07 8.37 1.01 -1.26 -0.96 120.40 128.21 2b3g s VAL 84 Ca 0.20 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.55 2b3g s VAL 84 Cb -0.03 -2.31 0.02 0.00 0.00 0.00 0.00 36.38 34.06 2b3g s VAL 84 CO 0.07 0.58 -0.10 0.21 0.00 0.00 0.00 175.10 175.86 2b3g s ASN 85 N -0.61 1.74 -0.23 3.32 3.84 0.01 -4.98 114.94 118.02 2b3g s ASN 85 Ca 0.09 -0.28 -0.09 0.00 0.21 0.00 0.00 52.86 52.79 2b3g s ASN 85 Cb -0.11 -0.78 -0.04 0.00 -0.55 0.00 0.00 41.25 39.76 2b3g s ASN 85 CO 0.01 -0.00 0.12 -0.89 -2.79 0.00 0.00 177.10 173.55 2b3g s THR 86 N 0.88 4.97 0.89 -5.21 2.01 -1.26 -0.52 115.64 117.40 2b3g s THR 86 Ca -0.11 0.04 -0.12 0.00 0.31 0.00 0.00 61.69 61.82 2b3g s THR 86 Cb -0.15 -3.30 0.13 0.00 0.01 0.00 0.00 72.50 69.18 2b3g s THR 86 CO 0.01 0.36 1.12 -0.76 -0.69 0.00 0.00 174.62 174.67 2b3g s LEU 87 N 1.06 2.12 0.46 4.42 1.43 0.84 -4.91 118.68 124.10 2b3g s LEU 87 Ca 0.06 1.09 0.19 0.00 -1.03 0.00 0.00 54.13 54.45 2b3g s LEU 87 Cb -0.14 -3.48 1.18 0.00 0.03 0.00 0.00 46.19 43.78 2b3g s LEU 87 CO 0.04 -2.48 1.93 0.11 0.23 0.00 0.00 176.35 176.19 2b3g h LYS 88 N -1.44 0.27 -0.01 1.70 1.57 -1.98 -1.89 116.57 114.78 2b3g h LYS 88 Ca -0.50 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 2b3g h LYS 88 Cb 1.31 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.56 2b3g h LYS 88 CO 0.61 0.18 -0.07 -0.40 -0.57 0.00 0.00 179.45 179.19 2b3g n ASP 89 N -4.44 1.33 0.00 0.86 5.68 -1.26 -4.93 116.55 113.79 2b3g n ASP 89 Ca 0.14 -1.30 0.00 0.00 -0.50 0.00 0.00 54.79 53.12 2b3g n ASP 89 Cb 0.59 0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.60 2b3g n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2b3g n GLY 90 N 1.22 3.00 3.76 6.12 0.00 -0.71 -5.07 105.19 113.52 2b3g n GLY 90 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2b3g n GLY 90 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2b3g s ARG 91 N -0.59 4.31 -0.23 1.61 3.52 -1.26 -4.72 118.95 121.58 2b3g s ARG 91 Ca 0.00 2.26 -0.10 0.00 -0.13 0.00 0.00 55.73 57.76 2b3g s ARG 91 Cb 0.00 -3.07 -0.05 0.00 -1.56 0.00 0.00 34.95 30.27 2b3g s ARG 91 CO 0.00 -0.28 0.14 1.03 -0.81 0.00 0.00 175.30 175.39 2b3g s ARG 92 N -1.44 4.03 -0.14 5.12 0.52 -1.26 -0.11 118.95 125.66 2b3g s ARG 92 Ca 0.52 -0.30 -0.10 0.00 -0.52 0.00 0.00 55.73 55.33 2b3g s ARG 92 Cb -0.41 -3.49 -0.05 0.00 0.52 0.00 0.00 34.95 31.53 2b3g s ARG 92 CO 0.51 0.06 0.19 0.08 0.02 0.00 0.00 175.30 176.17 2b3g s VAL 93 N 1.04 5.39 -0.25 3.52 1.01 0.32 -4.80 120.40 126.63 2b3g s VAL 93 Ca 0.07 0.33 -0.03 0.00 0.00 0.00 0.00 61.98 62.35 2b3g s VAL 93 Cb -0.14 -3.50 0.01 0.00 0.00 0.00 0.00 36.38 32.76 2b3g s VAL 93 CO 0.04 0.51 -0.03 -0.69 0.00 0.00 0.00 175.10 174.93 2b3g s VAL 94 N -0.26 3.20 -0.26 2.92 1.01 -0.31 -0.81 120.40 125.89 2b3g s VAL 94 Ca 0.14 -0.82 -0.09 0.00 0.00 0.00 0.00 61.98 61.21 2b3g s VAL 94 Cb -0.12 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 2b3g s VAL 94 CO 0.03 0.24 0.11 -0.63 0.00 0.00 0.00 175.10 174.85 2b3g s ILE 95 N 1.40 4.72 -0.24 2.22 1.01 -0.13 -0.25 121.20 129.93 2b3g s ILE 95 Ca 0.02 -0.03 -0.20 0.00 0.00 0.00 0.00 60.65 60.44 2b3g s ILE 95 Cb -0.16 -3.22 -0.02 0.00 0.01 0.00 0.00 42.46 39.07 2b3g s ILE 95 CO -0.03 0.32 0.60 -0.76 0.00 0.00 0.00 174.94 175.07 2b3g s LEU 96 N 1.57 4.09 -0.24 2.97 1.43 0.81 -1.45 118.68 127.86 2b3g s LEU 96 Ca 0.06 0.71 0.06 0.00 -1.03 0.00 0.00 54.13 53.93 2b3g s LEU 96 Cb -0.15 -2.82 -0.19 0.00 0.03 0.00 0.00 46.19 43.06 2b3g s LEU 96 CO 0.06 -0.32 -0.15 0.23 0.23 0.00 0.00 176.35 176.41 2b3g n MET 97 N 5.43 0.66 -3.92 1.70 2.81 0.61 -0.63 117.12 123.78 2b3g n MET 97 Ca -0.02 0.11 -0.14 0.00 -1.81 0.00 0.00 57.70 55.84 2b3g n MET 97 Cb 0.49 -1.52 -0.15 0.00 -0.71 0.00 0.00 33.22 31.34 2b3g n MET 97 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2b3g s GLU 98 N -2.51 0.13 0.11 0.03 2.02 -0.72 -4.82 118.70 112.94 2b3g s GLU 98 Ca -0.28 0.01 -0.21 0.00 0.02 0.00 0.00 54.97 54.51 2b3g s GLU 98 Cb 0.08 -0.22 0.06 0.00 0.10 0.00 0.00 34.13 34.15 2b3g s GLU 98 CO 0.66 -0.04 0.53 -0.48 0.02 0.00 0.00 175.26 175.95 2b3g s LEU 99 N 0.37 -0.18 -0.11 1.80 0.05 -1.26 -0.68 118.68 118.67 2b3g s LEU 99 Ca -0.03 -0.01 0.03 0.00 0.05 0.00 0.00 54.13 54.16 2b3g s LEU 99 Cb -0.05 2.27 0.01 0.00 -2.05 0.00 0.00 46.19 46.36 2b3g s LEU 99 CO -0.01 -0.86 -0.20 -0.70 -0.55 0.00 0.00 176.35 174.03 2b3g s GLU 100 N -3.32 2.71 -0.14 1.48 2.12 -0.37 -4.93 118.70 116.25 2b3g s GLU 100 Ca -0.01 -0.75 -0.29 0.00 0.36 0.00 0.00 54.97 54.28 2b3g s GLU 100 Cb -0.00 -2.14 -0.01 0.00 0.26 0.00 0.00 34.13 32.23 2b3g s GLU 100 CO -0.09 0.06 1.12 0.08 -0.54 0.00 0.00 175.26 175.89 2b3g s VAL 101 N 0.63 4.52 -0.08 3.70 1.01 -1.26 -0.58 120.40 128.34 2b3g s VAL 101 Ca -0.13 1.82 -0.10 0.00 0.00 0.00 0.00 61.98 63.57 2b3g s VAL 101 Cb -0.16 -4.17 -0.29 0.00 0.00 0.00 0.00 36.38 31.75 2b3g s VAL 101 CO 0.03 -0.07 0.55 -0.07 0.00 0.00 0.00 175.10 175.54 2b3g h LEU 102 N 8.79 0.53 -7.41 3.92 3.38 -1.09 -3.48 115.31 119.95 2b3g h LEU 102 Ca -0.28 -0.93 -0.22 0.00 0.09 0.00 0.00 57.88 56.54 2b3g h LEU 102 Cb 1.12 -0.17 -0.30 0.00 0.09 0.00 0.00 40.66 41.39 2b3g h LEU 102 CO 0.92 1.80 -0.54 -0.75 0.09 0.00 0.00 178.44 179.96 2b3g s LYS 103 N -2.56 0.15 0.80 1.13 2.20 -0.98 -5.02 119.74 115.47 2b3g s LYS 103 Ca -0.19 0.43 -0.11 0.00 -0.36 0.00 0.00 55.97 55.74 2b3g s LYS 103 Cb 0.06 -0.13 0.07 0.00 -1.51 0.00 0.00 37.83 36.32 2b3g s LYS 103 CO 0.81 -0.15 1.09 -1.54 -0.36 0.00 0.00 175.35 175.21 2b3g s SER 104 N 1.10 4.46 0.20 1.43 1.04 -1.26 -1.69 113.70 118.98 2b3g s SER 104 Ca -0.08 1.34 -0.10 0.00 0.48 0.00 0.00 55.95 57.58 2b3g s SER 104 Cb -0.10 -2.08 0.20 0.00 0.10 0.00 0.00 66.02 64.14 2b3g s SER 104 CO -0.06 -1.99 1.81 0.00 0.98 0.00 0.00 173.24 173.97 2b3g h ALA 105 N -1.10 0.82 -0.19 5.32 0.00 -1.82 -1.58 119.26 120.71 2b3g h ALA 105 Ca -0.47 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 2b3g h ALA 105 Cb 1.27 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2b3g h ALA 105 CO 0.59 0.03 -0.33 1.05 0.00 0.00 0.00 179.25 180.59 2b3g h GLU 106 N 0.66 0.39 -0.62 0.00 4.11 -1.92 0.72 114.58 117.91 2b3g h GLU 106 Ca 0.27 -0.16 -0.07 0.00 0.07 0.00 0.00 59.36 59.47 2b3g h GLU 106 Cb 0.14 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 2b3g h GLU 106 CO -0.16 0.67 0.11 0.00 0.07 0.00 0.00 179.01 179.70 2b3g h ALA 107 N 1.32 1.03 0.02 1.06 0.00 -1.80 -3.26 119.26 117.63 2b3g h ALA 107 Ca 0.04 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 2b3g h ALA 107 Cb 0.74 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2b3g h ALA 107 CO 0.06 0.62 -0.47 0.28 0.00 0.00 0.00 179.25 179.74 2b3g h VAL 108 N 0.94 1.51 0.00 0.00 2.07 -1.09 -3.48 116.25 116.20 2b3g h VAL 108 Ca 0.19 -2.33 0.00 0.00 0.82 0.00 0.00 66.70 65.38 2b3g h VAL 108 Cb 0.39 3.05 0.00 0.00 -1.52 0.00 0.00 31.29 33.22 2b3g h VAL 108 CO 0.01 0.56 0.00 0.61 0.02 0.00 0.00 177.57 178.76 2b3g n GLY 109 N 1.58 2.84 3.51 2.17 0.00 0.25 -4.91 105.19 110.63 2b3g n GLY 109 Ca -0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 2b3g n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b3g s VAL 110 N -2.32 0.02 0.19 1.61 0.11 -1.26 -5.04 120.40 113.71 2b3g s VAL 110 Ca 0.00 -0.59 -0.32 0.00 -2.93 0.00 0.00 61.98 58.14 2b3g s VAL 110 Cb 0.00 -1.44 -0.11 0.00 -1.53 0.00 0.00 36.38 33.30 2b3g s VAL 110 CO 0.00 -0.10 1.73 -0.75 -3.33 0.00 0.00 175.10 172.65 2b3g s LYS 111 N -3.84 4.14 -0.17 1.54 2.20 -1.26 -4.92 119.74 117.42 2b3g s LYS 111 Ca 0.07 2.58 -0.29 0.00 -0.36 0.00 0.00 55.97 57.97 2b3g s LYS 111 Cb -0.01 -3.17 -0.00 0.00 -1.51 0.00 0.00 37.83 33.13 2b3g s LYS 111 CO -0.05 -0.75 1.01 0.42 -0.36 0.00 0.00 175.35 175.61 2b3g s ILE 112 N 1.45 4.74 0.00 5.43 1.01 -1.26 -4.92 121.20 127.65 2b3g s ILE 112 Ca 0.75 2.00 0.00 0.00 0.00 0.00 0.00 60.65 63.41 2b3g s ILE 112 Cb -0.48 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 37.69 2b3g s ILE 112 CO 0.33 -0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.79 2b3g n GLY 113 N 3.24 0.19 2.37 6.18 0.00 -1.26 -4.47 105.19 111.44 2b3g n GLY 113 Ca 0.10 -0.92 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 2b3g n GLY 113 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2b3g n ASN 114 N -1.60 1.64 -4.76 1.61 3.02 -1.26 -5.11 115.26 108.81 2b3g n ASN 114 Ca 0.00 -3.14 -0.38 0.00 -0.03 0.00 0.00 54.58 51.03 2b3g n ASN 114 Cb 0.00 -0.60 0.02 0.00 -0.61 0.00 0.00 39.78 38.59 2b3g n ASN 114 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2b3g s PRO 115 N -2.69 3.40 0.12 3.52 0.04 -1.25 -4.98 135.00 133.16 2b3g s PRO 115 Ca 0.41 2.07 0.06 0.00 0.04 0.00 0.00 61.00 63.59 2b3g s PRO 115 Cb 0.34 -2.33 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 2b3g s PRO 115 CO -0.09 -0.93 -0.04 0.14 0.04 0.00 0.00 177.00 176.12 2b3g s VAL 116 N -1.39 3.67 0.35 -0.36 -7.23 -0.20 -4.69 120.40 110.56 2b3g s VAL 116 Ca 0.68 -1.23 -0.28 0.00 -1.81 0.00 0.00 61.98 59.34 2b3g s VAL 116 Cb -0.36 -2.77 -0.12 0.00 0.56 0.00 0.00 36.38 33.69 2b3g s VAL 116 CO 0.43 0.05 1.41 -2.65 -0.31 0.00 0.00 175.10 174.03 2b3g n PRO 117 N 0.42 2.44 -1.87 4.82 -0.02 -1.26 -1.27 135.00 138.24 2b3g n PRO 117 Ca -0.11 0.86 -0.41 0.00 -2.02 0.00 0.00 63.50 61.81 2b3g n PRO 117 Cb 0.53 -2.53 -0.01 0.00 -0.02 0.00 0.00 33.50 31.47 2b3g n PRO 117 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2b3g s TYR 118 N -0.99 2.79 -0.59 6.00 5.04 -0.23 -4.78 117.35 124.59 2b3g s TYR 118 Ca 0.55 1.03 -0.25 0.00 -2.44 0.00 0.00 57.07 55.96 2b3g s TYR 118 Cb -0.52 -3.96 0.04 0.00 0.35 0.00 0.00 41.96 37.87 2b3g s TYR 118 CO 0.62 -3.01 1.02 1.21 -1.34 0.00 0.00 175.55 174.04 2b3g s ASN 119 N 0.15 6.31 0.00 4.32 2.47 -1.26 -5.02 114.94 121.92 2b3g s ASN 119 Ca 0.57 -0.39 0.29 0.00 0.42 0.00 0.00 52.86 53.76 2b3g s ASN 119 Cb -0.45 -2.46 1.36 0.00 -1.45 0.00 0.00 41.25 38.24 2b3g s ASN 119 CO 0.52 -1.36 1.92 -0.62 -3.72 0.00 0.00 177.10 173.85