#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bs2 n GLY 2 N 0.00 0.00 1.80 -5.12 0.00 -1.26 -4.99 105.19 95.61 2bs2 n GLY 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2bs2 n GLY 2 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2bs2 n ARG 3 N 0.00 -5.00 -2.85 1.61 1.85 -1.26 -2.97 116.66 108.04 2bs2 n ARG 3 Ca 0.00 3.69 -0.41 0.00 -1.00 0.00 0.00 57.85 60.12 2bs2 n ARG 3 Cb 0.00 -4.13 -0.04 0.00 -1.05 0.00 0.00 32.46 27.24 2bs2 n ARG 3 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 2bs2 s MET 4 N -3.03 4.40 -0.02 2.89 -1.94 -1.26 -2.02 119.30 118.32 2bs2 s MET 4 Ca 0.00 1.13 -0.08 0.00 -1.71 0.00 0.00 55.69 55.03 2bs2 s MET 4 Cb 0.00 -3.52 -0.05 0.00 2.01 0.00 0.00 34.83 33.27 2bs2 s MET 4 CO 0.00 -0.19 0.27 -0.51 -0.01 0.00 0.00 175.02 174.57 2bs2 s LEU 5 N 1.63 4.39 -0.33 -0.03 1.43 0.22 -4.89 118.68 121.12 2bs2 s LEU 5 Ca 0.42 0.62 -0.08 0.00 -1.03 0.00 0.00 54.13 54.07 2bs2 s LEU 5 Cb -0.18 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.56 2bs2 s LEU 5 CO 0.17 0.31 0.12 -0.89 0.23 0.00 0.00 176.35 176.29 2bs2 s THR 6 N -1.19 4.07 -0.30 5.49 2.01 0.99 -1.44 115.64 125.28 2bs2 s THR 6 Ca 0.24 -0.85 -0.11 0.00 0.31 0.00 0.00 61.69 61.28 2bs2 s THR 6 Cb -0.14 -3.20 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 2bs2 s THR 6 CO 0.12 -0.07 0.18 -0.63 -0.69 0.00 0.00 174.62 173.54 2bs2 s ILE 7 N 1.49 5.09 -0.23 1.82 -1.09 0.24 -1.04 121.20 127.47 2bs2 s ILE 7 Ca 0.01 -0.05 -0.06 0.00 -2.23 0.00 0.00 60.65 58.32 2bs2 s ILE 7 Cb -0.18 -3.49 -0.03 0.00 -1.58 0.00 0.00 42.46 37.18 2bs2 s ILE 7 CO 0.04 0.17 0.04 -0.13 -1.23 0.00 0.00 174.94 173.82 2bs2 s ARG 8 N 1.71 3.64 -0.05 2.79 0.52 0.47 -0.18 118.95 127.85 2bs2 s ARG 8 Ca 0.06 -0.50 0.06 0.00 -0.52 0.00 0.00 55.73 54.84 2bs2 s ARG 8 Cb -0.16 -3.22 -0.01 0.00 0.52 0.00 0.00 34.95 32.07 2bs2 s ARG 8 CO 0.09 -0.11 -0.23 0.08 0.02 0.00 0.00 175.30 175.15 2bs2 s VAL 9 N 1.36 1.91 0.08 3.52 1.01 0.81 -0.01 120.40 129.08 2bs2 s VAL 9 Ca 0.05 -1.00 -0.31 0.00 0.00 0.00 0.00 61.98 60.72 2bs2 s VAL 9 Cb -0.15 -1.61 -0.06 0.00 0.00 0.00 0.00 36.38 34.56 2bs2 s VAL 9 CO 0.02 0.54 1.28 0.12 0.00 0.00 0.00 175.10 177.06 2bs2 s PHE 10 N -0.23 3.34 -0.04 5.22 5.36 -0.60 -0.78 117.98 130.25 2bs2 s PHE 10 Ca -0.00 1.15 0.02 0.00 -0.96 0.00 0.00 56.93 57.13 2bs2 s PHE 10 Cb -0.12 -3.53 0.01 0.00 -0.34 0.00 0.00 43.02 39.04 2bs2 s PHE 10 CO 0.02 -1.75 -0.08 0.15 -1.46 0.00 0.00 175.22 172.10 2bs2 s LYS 11 N 1.15 1.07 -0.29 10.12 1.02 0.75 -4.33 119.74 129.22 2bs2 s LYS 11 Ca 0.61 -0.26 -0.17 0.00 0.02 0.00 0.00 55.97 56.18 2bs2 s LYS 11 Cb -0.32 -0.98 0.15 0.00 -0.52 0.00 0.00 37.83 36.15 2bs2 s LYS 11 CO 0.29 0.03 1.00 -0.47 -0.92 0.00 0.00 175.35 175.28 2bs2 s TYR 12 N 0.54 -0.53 -0.50 3.18 5.04 -1.26 -1.73 117.35 122.09 2bs2 s TYR 12 Ca -0.09 1.08 0.02 0.00 -2.44 0.00 0.00 57.07 55.65 2bs2 s TYR 12 Cb -0.12 0.33 0.13 0.00 0.35 0.00 0.00 41.96 42.65 2bs2 s TYR 12 CO 0.01 -0.26 0.25 0.34 -1.34 0.00 0.00 175.55 174.55 2bs2 s ASP 13 N 1.23 4.63 0.64 4.32 2.15 -0.49 -1.38 116.67 127.77 2bs2 s ASP 13 Ca -0.08 -2.76 0.35 0.00 0.43 0.00 0.00 52.55 50.49 2bs2 s ASP 13 Cb -0.04 -1.69 1.95 0.00 -0.30 0.00 0.00 42.92 42.85 2bs2 s ASP 13 CO -0.14 -0.30 2.17 1.55 -0.17 0.00 0.00 175.17 178.27 2bs2 h PRO 14 N 6.91 0.00 -0.00 4.34 0.13 -1.77 -1.06 132.00 140.55 2bs2 h PRO 14 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2bs2 h PRO 14 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2bs2 h PRO 14 CO 0.66 0.00 -0.16 1.04 -0.23 0.00 0.00 178.00 179.31 2bs2 n GLN 15 N -3.31 0.07 -3.84 0.86 6.02 -1.26 -4.74 117.38 111.18 2bs2 n GLN 15 Ca -0.01 -0.02 -0.36 0.00 -0.01 0.00 0.00 57.00 56.60 2bs2 n GLN 15 Cb 0.23 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 29.89 2bs2 n GLN 15 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2bs2 s SER 16 N -2.95 5.67 0.49 1.08 0.15 -0.40 -4.99 113.70 112.74 2bs2 s SER 16 Ca 0.15 0.02 0.26 0.00 0.70 0.00 0.00 55.95 57.07 2bs2 s SER 16 Cb 0.19 -2.00 1.23 0.00 -1.71 0.00 0.00 66.02 63.72 2bs2 s SER 16 CO 0.57 0.08 1.97 0.00 1.20 0.00 0.00 173.24 177.07 2bs2 h ALA 17 N 7.36 1.18 -0.02 5.45 0.00 -1.85 -2.96 119.26 128.43 2bs2 h ALA 17 Ca -0.37 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2bs2 h ALA 17 Cb 1.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2bs2 h ALA 17 CO 0.65 0.22 -0.10 1.33 0.00 0.00 0.00 179.25 181.35 2bs2 n VAL 18 N -3.56 0.00 -2.88 0.00 0.24 -1.26 -4.94 118.33 105.92 2bs2 n VAL 18 Ca -0.01 -0.31 -0.38 0.00 -2.04 0.00 0.00 64.34 61.60 2bs2 n VAL 18 Cb 0.32 0.89 -0.06 0.00 -1.47 0.00 0.00 33.84 33.51 2bs2 n VAL 18 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2bs2 s SER 19 N -2.14 7.36 0.02 -1.34 0.15 -1.12 -5.07 113.70 111.56 2bs2 s SER 19 Ca 0.30 1.73 0.05 0.00 0.70 0.00 0.00 55.95 58.73 2bs2 s SER 19 Cb 0.20 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.96 2bs2 s SER 19 CO 0.38 0.07 -0.14 -0.54 1.20 0.00 0.00 173.24 174.21 2bs2 s LYS 20 N -1.63 1.04 0.18 5.44 1.02 -1.25 -4.86 119.74 119.68 2bs2 s LYS 20 Ca 0.43 -0.64 -0.31 0.00 0.02 0.00 0.00 55.97 55.48 2bs2 s LYS 20 Cb -0.21 -1.03 -0.10 0.00 -0.52 0.00 0.00 37.83 35.97 2bs2 s LYS 20 CO 0.26 0.27 1.48 -1.25 -0.92 0.00 0.00 175.35 175.19 2bs2 s PRO 21 N -0.75 4.26 0.26 -1.68 0.04 -1.26 -4.68 135.00 131.19 2bs2 s PRO 21 Ca 0.04 2.27 -0.22 0.00 0.04 0.00 0.00 61.00 63.13 2bs2 s PRO 21 Cb -0.07 -3.16 0.03 0.00 0.04 0.00 0.00 34.50 31.34 2bs2 s PRO 21 CO 0.00 -0.50 0.75 -3.38 0.04 0.00 0.00 177.00 173.92 2bs2 s HIS 22 N 0.75 -0.19 -0.05 0.56 -3.43 -0.71 -5.02 115.29 107.21 2bs2 s HIS 22 Ca 0.65 -0.25 -0.01 0.00 -0.80 0.00 0.00 55.06 54.66 2bs2 s HIS 22 Cb -0.41 0.70 -0.03 0.00 -1.43 0.00 0.00 32.58 31.40 2bs2 s HIS 22 CO 0.35 -1.17 0.02 -0.06 -2.00 0.00 0.00 174.74 171.87 2bs2 s PHE 23 N -3.82 3.17 -0.02 0.38 0.08 -1.26 -0.18 117.98 116.33 2bs2 s PHE 23 Ca 0.11 0.18 0.07 0.00 0.12 0.00 0.00 56.93 57.40 2bs2 s PHE 23 Cb -0.05 -1.76 -0.02 0.00 -0.57 0.00 0.00 43.02 40.63 2bs2 s PHE 23 CO 0.06 0.49 -0.22 -1.14 -0.10 0.00 0.00 175.22 174.31 2bs2 s GLN 24 N -1.18 1.76 0.01 0.44 0.74 0.04 -4.92 119.66 116.55 2bs2 s GLN 24 Ca 0.16 -0.77 0.03 0.00 0.05 0.00 0.00 55.36 54.83 2bs2 s GLN 24 Cb -0.11 -1.70 -0.03 0.00 1.10 0.00 0.00 33.01 32.27 2bs2 s GLN 24 CO 0.06 0.46 -0.05 -1.21 -0.55 0.00 0.00 175.29 174.01 2bs2 s GLU 25 N -0.50 2.61 0.05 1.67 2.02 -1.26 -0.13 118.70 123.15 2bs2 s GLU 25 Ca 0.08 -0.70 0.04 0.00 0.02 0.00 0.00 54.97 54.41 2bs2 s GLU 25 Cb -0.08 -2.55 -0.02 0.00 0.10 0.00 0.00 34.13 31.58 2bs2 s GLU 25 CO -0.01 0.60 -0.12 0.71 0.02 0.00 0.00 175.26 176.46 2bs2 s TYR 26 N -1.04 1.06 -0.30 1.61 1.51 0.74 -4.96 117.35 115.97 2bs2 s TYR 26 Ca 0.18 -0.41 -0.07 0.00 -1.01 0.00 0.00 57.07 55.76 2bs2 s TYR 26 Cb -0.11 -0.61 0.01 0.00 -0.11 0.00 0.00 41.96 41.13 2bs2 s TYR 26 CO 0.09 0.02 0.08 0.15 -1.11 0.00 0.00 175.55 174.78 2bs2 s LYS 27 N -1.40 3.10 -0.05 -0.62 -0.14 -1.26 -0.59 119.74 118.78 2bs2 s LYS 27 Ca -0.02 -0.85 0.05 0.00 -1.36 0.00 0.00 55.97 53.78 2bs2 s LYS 27 Cb -0.09 -3.38 -0.01 0.00 -1.68 0.00 0.00 37.83 32.67 2bs2 s LYS 27 CO 0.01 -0.45 -0.21 0.42 -0.76 0.00 0.00 175.35 174.37 2bs2 s ILE 28 N 1.50 1.73 -0.25 2.17 -1.09 -0.52 -4.94 121.20 119.80 2bs2 s ILE 28 Ca 0.03 -0.88 -0.22 0.00 -2.23 0.00 0.00 60.65 57.34 2bs2 s ILE 28 Cb -0.17 -1.48 -0.01 0.00 -1.58 0.00 0.00 42.46 39.22 2bs2 s ILE 28 CO 0.03 0.49 0.73 -0.70 -1.23 0.00 0.00 174.94 174.25 2bs2 s GLU 29 N -0.00 4.15 0.55 2.79 2.12 -1.26 0.72 118.70 127.76 2bs2 s GLU 29 Ca -0.05 0.74 -0.21 0.00 0.36 0.00 0.00 54.97 55.81 2bs2 s GLU 29 Cb -0.13 -3.65 -0.05 0.00 0.26 0.00 0.00 34.13 30.57 2bs2 s GLU 29 CO 0.03 -0.46 1.31 -2.00 -0.54 0.00 0.00 175.26 173.60 2bs2 s GLU 30 N 2.67 3.12 0.24 4.30 2.12 -0.85 -4.96 118.70 125.33 2bs2 s GLU 30 Ca 0.30 2.12 0.05 0.00 0.36 0.00 0.00 54.97 57.81 2bs2 s GLU 30 Cb -0.15 -2.19 -0.05 0.00 0.26 0.00 0.00 34.13 31.99 2bs2 s GLU 30 CO 0.08 -1.17 -0.05 0.00 -0.54 0.00 0.00 175.26 173.58 2bs2 s ALA 31 N -1.37 2.00 0.24 6.30 0.00 -1.26 -4.48 121.76 123.19 2bs2 s ALA 31 Ca 0.73 -1.77 -0.31 0.00 0.00 0.00 0.00 51.96 50.60 2bs2 s ALA 31 Cb -0.38 0.24 -0.12 0.00 0.00 0.00 0.00 23.12 22.87 2bs2 s ALA 31 CO 0.44 -0.12 1.64 -2.30 0.00 0.00 0.00 175.76 175.41 2bs2 n PRO 32 N -0.45 2.64 -3.51 0.00 -0.02 -1.26 -2.48 135.00 129.92 2bs2 n PRO 32 Ca -0.06 0.95 -0.25 0.00 -2.02 0.00 0.00 63.50 62.11 2bs2 n PRO 32 Cb 0.63 -2.75 0.04 0.00 -0.02 0.00 0.00 33.50 31.40 2bs2 n PRO 32 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2bs2 n SER 33 N 3.03 -5.47 -4.71 2.55 7.64 -1.26 -4.94 113.62 110.46 2bs2 n SER 33 Ca 0.13 -0.53 -0.42 0.00 1.01 0.00 0.00 58.87 59.06 2bs2 n SER 33 Cb 0.35 -4.38 -0.03 0.00 -1.01 0.00 0.00 64.21 59.14 2bs2 n SER 33 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 2bs2 s MET 34 N -6.21 4.55 0.37 1.43 0.00 -1.03 -5.01 119.30 113.39 2bs2 s MET 34 Ca 0.51 1.39 0.08 0.00 0.00 0.00 0.00 55.69 57.68 2bs2 s MET 34 Cb -0.24 -3.46 -0.04 0.00 0.00 0.00 0.00 34.83 31.09 2bs2 s MET 34 CO 0.63 -0.06 0.23 0.95 0.00 0.00 0.00 175.02 176.77 2bs2 s THR 35 N 1.05 2.92 0.43 10.11 -4.23 -1.26 -1.36 115.64 123.30 2bs2 s THR 35 Ca 0.51 -1.56 0.25 0.00 -1.18 0.00 0.00 61.69 59.71 2bs2 s THR 35 Cb -0.21 -3.02 0.28 0.00 1.34 0.00 0.00 72.50 70.88 2bs2 s THR 35 CO 0.27 -0.11 2.07 0.40 -0.54 0.00 0.00 174.62 176.71 2bs2 h ILE 36 N 1.36 0.67 -0.13 2.99 1.08 -1.21 -1.41 117.51 120.86 2bs2 h ILE 36 Ca -0.43 -0.52 -0.00 0.00 -0.39 0.00 0.00 64.86 63.51 2bs2 h ILE 36 Cb 1.26 1.33 -0.01 0.00 -3.07 0.00 0.00 36.82 36.32 2bs2 h ILE 36 CO 0.62 0.12 0.08 0.15 -0.69 0.00 0.00 178.15 178.44 2bs2 h PHE 37 N 0.00 0.17 -0.40 1.37 3.57 -1.84 0.68 116.94 120.49 2bs2 h PHE 37 Ca -0.00 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 2bs2 h PHE 37 Cb 0.32 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 2bs2 h PHE 37 CO 0.00 0.15 0.15 0.82 -2.23 0.00 0.00 178.31 177.20 2bs2 h ILE 38 N 0.14 1.20 -0.15 1.41 2.04 -1.69 -2.34 117.51 118.13 2bs2 h ILE 38 Ca 0.05 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.28 2bs2 h ILE 38 Cb 0.03 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2bs2 h ILE 38 CO -0.01 0.23 0.01 0.58 0.00 0.00 0.00 178.15 178.96 2bs2 h VAL 39 N 0.50 0.91 -0.36 1.67 2.07 -1.03 -0.88 116.25 119.13 2bs2 h VAL 39 Ca 0.13 -0.02 -0.09 0.00 0.82 0.00 0.00 66.70 67.54 2bs2 h VAL 39 Cb 0.22 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 2bs2 h VAL 39 CO -0.01 0.01 -0.14 -0.07 0.02 0.00 0.00 177.57 177.38 2bs2 h LEU 40 N 0.06 0.64 -0.66 2.57 3.38 -0.82 -1.72 115.31 118.75 2bs2 h LEU 40 Ca 0.07 -0.19 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 2bs2 h LEU 40 Cb 0.07 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2bs2 h LEU 40 CO -0.11 0.80 -0.59 0.78 0.09 0.00 0.00 178.44 179.41 2bs2 h ASN 41 N 0.59 0.00 -0.16 -0.43 2.35 -1.26 -0.93 115.58 115.74 2bs2 h ASN 41 Ca 0.10 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.83 2bs2 h ASN 41 Cb 0.58 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.94 2bs2 h ASN 41 CO 0.04 0.59 0.01 0.24 -1.65 0.00 0.00 177.43 176.65 2bs2 h MET 42 N 0.00 0.28 -0.68 0.81 2.86 -0.80 -1.45 114.93 115.96 2bs2 h MET 42 Ca -0.01 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.56 2bs2 h MET 42 Cb 1.15 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.74 2bs2 h MET 42 CO 0.08 0.49 0.45 0.82 1.06 0.00 0.00 176.91 179.80 2bs2 h ILE 43 N 0.04 1.16 0.04 -1.22 2.04 -1.19 -0.53 117.51 117.85 2bs2 h ILE 43 Ca 0.05 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 2bs2 h ILE 43 Cb 0.36 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2bs2 h ILE 43 CO 0.01 0.17 -0.02 -0.09 0.00 0.00 0.00 178.15 178.21 2bs2 h ARG 44 N 0.91 -0.05 0.00 2.37 2.43 -1.03 0.77 114.38 119.77 2bs2 h ARG 44 Ca 0.25 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.36 2bs2 h ARG 44 Cb -0.09 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2bs2 h ARG 44 CO -0.06 0.04 -0.33 0.93 -1.51 0.00 0.00 179.97 179.04 2bs2 h GLU 45 N -0.14 0.00 0.00 0.20 5.08 -1.14 -3.05 114.58 115.53 2bs2 h GLU 45 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2bs2 h GLU 45 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2bs2 h GLU 45 CO 0.01 0.33 -0.69 0.25 -1.00 0.00 0.00 179.01 177.91 2bs2 n THR 46 N -3.25 0.00 0.00 1.13 -2.24 -0.22 -4.94 114.28 104.77 2bs2 n THR 46 Ca 0.02 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2bs2 n THR 46 Cb 0.61 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 2bs2 n THR 46 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2bs2 n TYR 47 N -1.22 0.00 -3.29 4.78 4.02 -0.05 -5.03 117.16 116.37 2bs2 n TYR 47 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.81 2bs2 n TYR 47 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.28 2bs2 n TYR 47 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2bs2 s ASP 48 N -4.18 -0.08 0.00 7.72 2.15 0.25 -5.00 116.67 117.53 2bs2 s ASP 48 Ca 0.00 -1.11 0.15 0.00 0.43 0.00 0.00 52.55 52.02 2bs2 s ASP 48 Cb 0.00 1.22 0.89 0.00 -0.30 0.00 0.00 42.92 44.73 2bs2 s ASP 48 CO 0.00 -0.23 1.30 -0.81 -0.17 0.00 0.00 175.17 175.26 2bs2 n PRO 49 N 4.44 0.51 0.09 4.34 -0.04 -1.15 -3.19 135.00 140.00 2bs2 n PRO 49 Ca 0.10 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.37 2bs2 n PRO 49 Cb 0.51 -1.46 -0.11 0.00 -0.04 0.00 0.00 33.50 32.40 2bs2 n PRO 49 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2bs2 h ASP 50 N 0.00 0.73 -1.76 3.54 3.58 -1.93 -3.47 116.42 117.11 2bs2 h ASP 50 Ca 0.00 -0.67 -0.68 0.00 0.42 0.00 0.00 57.03 56.10 2bs2 h ASP 50 Cb 0.00 -0.23 0.02 0.00 1.72 0.00 0.00 39.33 40.84 2bs2 h ASP 50 CO 0.00 1.49 0.92 -0.11 -2.88 0.00 0.00 179.24 178.66 2bs2 n LEU 51 N -3.73 2.71 -4.81 2.28 7.94 -1.19 -4.98 117.00 115.21 2bs2 n LEU 51 Ca -0.11 1.05 -0.37 0.00 -1.11 0.00 0.00 56.01 55.46 2bs2 n LEU 51 Cb 0.96 -1.24 -0.06 0.00 0.53 0.00 0.00 43.42 43.61 2bs2 n LEU 51 CO 0.56 -0.35 0.02 0.20 -1.11 0.00 0.00 177.39 176.71 2bs2 s ASN 52 N 3.30 6.62 0.10 1.96 -0.87 -1.26 -4.99 114.94 119.80 2bs2 s ASN 52 Ca 0.94 0.73 -0.25 0.00 -1.57 0.00 0.00 52.86 52.71 2bs2 s ASN 52 Cb -0.91 -2.20 0.08 0.00 -0.02 0.00 0.00 41.25 38.20 2bs2 s ASN 52 CO 0.58 0.27 0.77 0.72 -2.57 0.00 0.00 177.10 176.86 2bs2 s PHE 53 N -0.57 -0.39 -0.18 2.20 -0.12 -1.26 -2.02 117.98 115.64 2bs2 s PHE 53 Ca 0.20 0.18 0.01 0.00 -0.05 0.00 0.00 56.93 57.27 2bs2 s PHE 53 Cb -0.15 0.57 0.03 0.00 -0.63 0.00 0.00 43.02 42.85 2bs2 s PHE 53 CO 0.09 -0.75 -0.14 -0.51 -0.05 0.00 0.00 175.22 173.85 2bs2 s ASP 54 N -2.67 3.21 0.06 1.98 1.01 -1.26 -4.92 116.67 114.08 2bs2 s ASP 54 Ca 0.05 -0.76 0.06 0.00 0.71 0.00 0.00 52.55 52.61 2bs2 s ASP 54 Cb -0.01 -1.31 -0.03 0.00 1.01 0.00 0.00 42.92 42.58 2bs2 s ASP 54 CO -0.08 -0.09 -0.17 -0.36 0.21 0.00 0.00 175.17 174.68 2bs2 s PHE 55 N 1.37 1.45 0.00 4.23 0.08 -1.26 -3.33 117.98 120.52 2bs2 s PHE 55 Ca 0.01 -0.40 0.00 0.00 0.12 0.00 0.00 56.93 56.67 2bs2 s PHE 55 Cb -0.15 -0.84 0.00 0.00 -0.57 0.00 0.00 43.02 41.47 2bs2 s PHE 55 CO -0.10 0.09 0.00 0.28 -0.10 0.00 0.00 175.22 175.39 2bs2 n VAL 56 N 1.55 0.00 0.18 -0.44 0.31 -1.26 -4.95 118.33 113.72 2bs2 n VAL 56 Ca -0.19 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.20 2bs2 n VAL 56 Cb 0.54 -0.21 0.17 0.00 -0.91 0.00 0.00 33.84 33.43 2bs2 n VAL 56 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2bs2 n ARG 58 N -3.25 -1.36 0.00 0.00 -4.01 -1.26 -4.73 116.66 102.05 2bs2 n ARG 58 Ca 0.02 0.56 0.00 0.00 -1.04 0.00 0.00 57.85 57.39 2bs2 n ARG 58 Cb 0.62 -4.79 0.00 0.00 -3.04 0.00 0.00 32.46 25.25 2bs2 n ARG 58 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2bs2 n ALA 59 N -0.19 1.79 -1.13 2.89 0.00 -1.26 -4.88 120.51 117.73 2bs2 n ALA 59 Ca -0.10 -0.70 -0.04 0.00 0.00 0.00 0.00 53.44 52.60 2bs2 n ALA 59 Cb 0.35 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.78 2bs2 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bs2 n GLY 60 N -0.24 0.72 0.00 0.00 0.00 -1.26 -4.92 105.19 99.49 2bs2 n GLY 60 Ca 0.00 -0.66 0.06 0.00 0.00 0.00 0.00 46.02 45.42 2bs2 n GLY 60 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2bs2 n ILE 61 N -2.82 0.00 0.08 -0.61 5.41 -1.26 -4.73 119.36 115.43 2bs2 n ILE 61 Ca -0.04 -0.26 0.10 0.00 1.00 0.00 0.00 62.75 63.55 2bs2 n ILE 61 Cb 0.17 0.41 -0.15 0.00 -0.71 0.00 0.00 39.64 39.36 2bs2 n ILE 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2bs2 n GLY 63 N 1.38 0.62 0.13 0.00 0.00 -1.26 -4.80 105.19 101.27 2bs2 n GLY 63 Ca -0.03 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.24 2bs2 n GLY 63 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2bs2 h SER 64 N 0.00 0.40 -0.61 1.61 0.87 -1.88 -3.38 113.55 110.57 2bs2 h SER 64 Ca -0.06 -0.34 -0.23 0.00 -1.23 0.00 0.00 61.79 59.92 2bs2 h SER 64 Cb 0.26 -0.12 -0.14 0.00 -0.44 0.00 0.00 62.40 61.95 2bs2 h SER 64 CO 0.09 1.16 0.30 0.00 -0.53 0.00 0.00 176.83 177.85 2bs2 s GLY 66 N -0.62 2.76 0.16 0.00 0.00 -1.26 -2.17 107.32 106.18 2bs2 s GLY 66 Ca 0.41 1.29 -0.24 0.00 0.00 0.00 0.00 44.72 46.17 2bs2 s GLY 66 CO 0.09 2.06 0.84 -3.16 0.00 0.00 0.00 173.10 172.93 2bs2 s MET 67 N -1.27 1.29 -0.19 2.90 0.23 -0.67 -4.47 119.30 117.13 2bs2 s MET 67 Ca 0.53 -0.66 -0.26 0.00 -1.03 0.00 0.00 55.69 54.27 2bs2 s MET 67 Cb -0.41 0.48 -0.01 0.00 -1.53 0.00 0.00 34.83 33.36 2bs2 s MET 67 CO 0.50 -0.59 0.85 -1.64 -2.03 0.00 0.00 175.02 172.11 2bs2 s MET 68 N -3.48 4.27 -0.27 3.16 -1.94 0.57 -0.76 119.30 120.85 2bs2 s MET 68 Ca 0.09 1.04 0.03 0.00 -1.71 0.00 0.00 55.69 55.14 2bs2 s MET 68 Cb -0.02 -3.59 0.07 0.00 2.01 0.00 0.00 34.83 33.29 2bs2 s MET 68 CO -0.00 -0.39 -0.07 0.42 -0.01 0.00 0.00 175.02 174.96 2bs2 s ILE 69 N 2.37 2.07 -1.43 2.53 1.01 -0.10 -1.40 121.20 126.25 2bs2 s ILE 69 Ca 0.38 -1.69 -0.07 0.00 0.00 0.00 0.00 60.65 59.28 2bs2 s ILE 69 Cb -0.16 -2.26 0.04 0.00 0.01 0.00 0.00 42.46 40.09 2bs2 s ILE 69 CO 0.11 -0.15 0.80 0.59 0.00 0.00 0.00 174.94 176.30 2bs2 n ASN 70 N 4.44 -2.76 0.00 3.58 4.13 -0.19 -2.28 115.26 122.18 2bs2 n ASN 70 Ca -0.11 -0.82 0.00 0.00 1.68 0.00 0.00 54.58 55.33 2bs2 n ASN 70 Cb 0.42 -3.86 0.00 0.00 -1.54 0.00 0.00 39.78 34.80 2bs2 n ASN 70 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2bs2 n GLY 71 N -1.66 1.56 3.21 7.41 0.00 -1.26 -5.04 105.19 109.41 2bs2 n GLY 71 Ca -0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 2bs2 n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bs2 s ARG 72 N -0.32 2.91 0.07 1.61 1.81 -0.97 -5.04 118.95 119.03 2bs2 s ARG 72 Ca 0.00 -0.84 -0.31 0.00 -1.72 0.00 0.00 55.73 52.86 2bs2 s ARG 72 Cb 0.00 -2.22 -0.08 0.00 -0.45 0.00 0.00 34.95 32.21 2bs2 s ARG 72 CO 0.00 0.18 1.52 -1.25 -0.68 0.00 0.00 175.30 175.07 2bs2 s PRO 73 N 0.34 4.25 0.18 3.54 0.04 -1.26 -0.93 135.00 141.17 2bs2 s PRO 73 Ca -0.18 2.18 -0.10 0.00 0.04 0.00 0.00 61.00 62.94 2bs2 s PRO 73 Cb -0.18 -3.46 -0.00 0.00 0.04 0.00 0.00 34.50 30.90 2bs2 s PRO 73 CO 0.08 -0.62 0.34 -1.12 0.04 0.00 0.00 177.00 175.73 2bs2 s SER 74 N 1.84 -0.02 -0.43 6.66 0.01 0.06 -4.93 113.70 116.88 2bs2 s SER 74 Ca 0.69 -0.85 -0.25 0.00 1.31 0.00 0.00 55.95 56.85 2bs2 s SER 74 Cb -0.37 0.48 0.02 0.00 0.21 0.00 0.00 66.02 66.36 2bs2 s SER 74 CO 0.30 -0.96 0.87 -0.76 0.41 0.00 0.00 173.24 173.10 2bs2 s LEU 75 N -2.97 4.09 0.42 2.44 1.43 -1.26 -1.67 118.68 121.16 2bs2 s LEU 75 Ca 0.18 0.14 0.12 0.00 -1.03 0.00 0.00 54.13 53.54 2bs2 s LEU 75 Cb 0.02 -3.12 0.98 0.00 0.03 0.00 0.00 46.19 44.10 2bs2 s LEU 75 CO 0.02 -0.95 1.97 0.00 0.23 0.00 0.00 176.35 177.62 2bs2 h ALA 76 N 8.90 1.96 0.00 4.21 0.00 -1.78 -1.09 119.26 131.47 2bs2 h ALA 76 Ca -0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2bs2 h ALA 76 Cb 1.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2bs2 h ALA 76 CO 0.99 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 180.14 2bs2 n ARG 78 N -2.48 2.58 -3.81 0.00 0.63 -0.44 -4.78 116.66 108.36 2bs2 n ARG 78 Ca 0.02 -1.95 -0.36 0.00 -0.92 0.00 0.00 57.85 54.64 2bs2 n ARG 78 Cb 0.28 -1.27 -0.10 0.00 0.45 0.00 0.00 32.46 31.82 2bs2 n ARG 78 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2bs2 s THR 79 N -0.99 4.88 -0.10 5.15 2.01 -1.03 -5.00 115.64 120.56 2bs2 s THR 79 Ca 0.22 0.01 -0.13 0.00 0.31 0.00 0.00 61.69 62.10 2bs2 s THR 79 Cb 0.12 -3.25 -0.05 0.00 0.01 0.00 0.00 72.50 69.33 2bs2 s THR 79 CO 0.16 0.38 0.30 -0.76 -0.69 0.00 0.00 174.62 174.01 2bs2 s LEU 80 N 1.00 4.34 0.48 4.42 1.43 -1.26 -1.86 118.68 127.23 2bs2 s LEU 80 Ca 0.05 0.65 0.21 0.00 -1.03 0.00 0.00 54.13 54.01 2bs2 s LEU 80 Cb -0.14 -2.39 1.23 0.00 0.03 0.00 0.00 46.19 44.92 2bs2 s LEU 80 CO 0.03 0.23 2.03 0.71 0.23 0.00 0.00 176.35 179.58 2bs2 h THR 81 N 4.25 0.85 -0.44 5.49 1.35 -1.55 -2.65 112.91 120.21 2bs2 h THR 81 Ca -0.47 -0.60 0.05 0.00 -0.55 0.00 0.00 66.41 64.84 2bs2 h THR 81 Cb 1.19 1.35 -0.02 0.00 -1.73 0.00 0.00 68.15 68.94 2bs2 h THR 81 CO 0.68 0.15 0.29 0.50 -0.25 0.00 0.00 175.52 176.90 2bs2 h LYS 82 N 0.00 0.40 0.00 4.72 3.64 -1.94 -2.17 116.57 121.22 2bs2 h LYS 82 Ca -0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2bs2 h LYS 82 Cb 0.33 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2bs2 h LYS 82 CO 0.02 0.26 0.00 -0.25 -2.27 0.00 0.00 179.45 177.21 2bs2 n ASP 83 N -4.48 0.00 -4.17 4.20 8.00 -1.00 -4.32 116.55 114.78 2bs2 n ASP 83 Ca 0.05 -0.73 -0.39 0.00 0.71 0.00 0.00 54.79 54.44 2bs2 n ASP 83 Cb 0.21 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.25 2bs2 n ASP 83 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2bs2 s PHE 84 N -2.00 3.80 -0.81 1.24 0.40 -0.82 -5.00 117.98 114.79 2bs2 s PHE 84 Ca 0.29 -2.76 -0.25 0.00 -0.60 0.00 0.00 56.93 53.61 2bs2 s PHE 84 Cb 0.13 -3.39 -0.03 0.00 0.51 0.00 0.00 43.02 40.24 2bs2 s PHE 84 CO 0.22 -0.83 1.88 -2.00 0.70 0.00 0.00 175.22 175.19 2bs2 s GLU 85 N -0.79 2.65 0.00 0.44 2.56 -1.26 -1.79 118.70 120.51 2bs2 s GLU 85 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.97 55.18 2bs2 s GLU 85 Cb -0.11 -4.83 0.00 0.00 2.00 0.00 0.00 34.13 31.19 2bs2 s GLU 85 CO -0.09 -3.07 0.00 -3.47 -0.56 0.00 0.00 175.26 168.07 2bs2 n ASP 86 N 13.20 0.00 0.00 -1.70 -0.08 -1.26 -4.97 116.55 121.74 2bs2 n ASP 86 Ca 0.32 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.60 2bs2 n ASP 86 Cb 0.49 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.95 2bs2 n ASP 86 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2bs2 n GLY 87 N 0.00 1.65 3.41 0.27 0.00 -0.74 -4.96 105.19 104.82 2bs2 n GLY 87 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2bs2 n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bs2 s VAL 88 N -3.14 4.40 -0.15 1.61 1.01 -1.26 -0.01 120.40 122.86 2bs2 s VAL 88 Ca 0.00 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.51 2bs2 s VAL 88 Cb 0.00 -3.24 -0.00 0.00 0.00 0.00 0.00 36.38 33.14 2bs2 s VAL 88 CO 0.00 0.09 -0.17 -0.63 0.00 0.00 0.00 175.10 174.39 2bs2 s ILE 89 N 1.58 2.53 -0.18 2.22 1.01 -0.21 -4.98 121.20 123.17 2bs2 s ILE 89 Ca 0.04 -0.82 -0.03 0.00 0.00 0.00 0.00 60.65 59.83 2bs2 s ILE 89 Cb -0.17 -2.05 -0.02 0.00 0.01 0.00 0.00 42.46 40.23 2bs2 s ILE 89 CO 0.05 0.53 -0.05 -0.89 0.00 0.00 0.00 174.94 174.58 2bs2 s THR 90 N 0.74 3.64 -0.14 2.92 2.01 -1.26 -0.40 115.64 123.15 2bs2 s THR 90 Ca -0.07 -0.43 -0.01 0.00 0.31 0.00 0.00 61.69 61.48 2bs2 s THR 90 Cb -0.16 -2.61 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 2bs2 s THR 90 CO 0.01 0.47 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.54 2bs2 s LEU 91 N 0.78 2.82 0.10 4.42 1.43 0.99 -1.02 118.68 128.20 2bs2 s LEU 91 Ca -0.02 -0.30 0.06 0.00 -1.03 0.00 0.00 54.13 52.84 2bs2 s LEU 91 Cb -0.15 -1.65 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 2bs2 s LEU 91 CO 0.02 0.15 -0.14 -0.76 0.23 0.00 0.00 176.35 175.84 2bs2 s LEU 92 N 0.47 2.35 0.77 1.79 1.43 -0.49 -1.55 118.68 123.45 2bs2 s LEU 92 Ca -0.08 -0.74 -0.11 0.00 -1.03 0.00 0.00 54.13 52.17 2bs2 s LEU 92 Cb -0.15 -0.56 0.05 0.00 0.03 0.00 0.00 46.19 45.56 2bs2 s LEU 92 CO 0.04 -0.11 1.08 -2.16 0.23 0.00 0.00 176.35 175.43 2bs2 s PRO 93 N -2.30 2.30 0.17 1.29 0.04 -1.26 -0.31 135.00 134.92 2bs2 s PRO 93 Ca 0.05 0.89 -0.31 0.00 0.04 0.00 0.00 61.00 61.67 2bs2 s PRO 93 Cb -0.07 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.45 2bs2 s PRO 93 CO 0.03 -1.53 1.49 -0.51 0.04 0.00 0.00 177.00 176.51 2bs2 s LEU 94 N -5.79 4.37 0.99 -3.56 1.43 -1.26 -4.34 118.68 110.52 2bs2 s LEU 94 Ca 0.60 2.54 -0.16 0.00 -1.03 0.00 0.00 54.13 56.09 2bs2 s LEU 94 Cb -0.15 -3.60 0.20 0.00 0.03 0.00 0.00 46.19 42.67 2bs2 s LEU 94 CO 0.55 -0.74 1.25 -2.16 0.23 0.00 0.00 176.35 175.48 2bs2 s PRO 95 N 0.77 0.48 -0.18 1.29 0.04 -1.26 -4.09 135.00 132.04 2bs2 s PRO 95 Ca 0.66 -0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.48 2bs2 s PRO 95 Cb -0.41 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2bs2 s PRO 95 CO 0.34 -2.55 0.00 0.00 0.04 0.00 0.00 177.00 174.83 2bs2 n ALA 96 N -3.91 -0.03 -2.53 8.56 0.00 -1.26 -4.35 120.51 117.00 2bs2 n ALA 96 Ca 0.13 0.03 -0.13 0.00 0.00 0.00 0.00 53.44 53.47 2bs2 n ALA 96 Cb 0.60 -0.87 -0.11 0.00 0.00 0.00 0.00 19.45 19.07 2bs2 n ALA 96 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2bs2 s PHE 97 N -1.62 0.87 0.06 0.00 0.08 -1.26 -4.93 117.98 111.17 2bs2 s PHE 97 Ca 0.00 -0.67 -0.31 0.00 0.12 0.00 0.00 56.93 56.07 2bs2 s PHE 97 Cb 0.00 -0.50 -0.07 0.00 -0.57 0.00 0.00 43.02 41.88 2bs2 s PHE 97 CO 0.00 -0.08 1.45 0.21 -0.10 0.00 0.00 175.22 176.71 2bs2 s LYS 98 N -2.63 4.28 0.14 0.44 2.20 -1.26 -4.83 119.74 118.08 2bs2 s LYS 98 Ca 0.01 2.08 -0.30 0.00 -0.36 0.00 0.00 55.97 57.41 2bs2 s LYS 98 Cb -0.03 -3.46 -0.07 0.00 -1.51 0.00 0.00 37.83 32.76 2bs2 s LYS 98 CO -0.01 -0.56 1.08 -1.17 -0.36 0.00 0.00 175.35 174.32 2bs2 s LEU 99 N 1.98 4.47 -0.20 5.43 2.96 -1.26 -0.67 118.68 131.39 2bs2 s LEU 99 Ca 0.66 2.00 -0.16 0.00 -0.22 0.00 0.00 54.13 56.41 2bs2 s LEU 99 Cb -0.35 -3.60 -0.07 0.00 0.50 0.00 0.00 46.19 42.67 2bs2 s LEU 99 CO 0.29 -0.21 -0.31 -0.38 -1.32 0.00 0.00 176.35 174.42 2bs2 n ILE 100 N 2.69 1.50 -3.64 6.68 5.41 0.45 -4.90 119.36 127.55 2bs2 n ILE 100 Ca 0.03 0.03 -0.04 0.00 1.00 0.00 0.00 62.75 63.77 2bs2 n ILE 100 Cb 0.47 -2.24 -0.07 0.00 -0.71 0.00 0.00 39.64 37.09 2bs2 n ILE 100 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2bs2 s LYS 101 N -2.72 0.29 3.09 0.38 2.20 -0.81 -4.43 119.74 117.74 2bs2 s LYS 101 Ca -0.29 0.39 0.00 0.00 -0.36 0.00 0.00 55.97 55.71 2bs2 s LYS 101 Cb 0.06 0.11 0.00 0.00 -1.51 0.00 0.00 37.83 36.49 2bs2 s LYS 101 CO 0.42 -0.04 0.00 -0.25 -0.36 0.00 0.00 175.35 175.12 2bs2 n ASP 102 N 2.52 0.00 -0.87 1.43 8.00 -0.48 -0.42 116.55 126.73 2bs2 n ASP 102 Ca -0.14 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.48 2bs2 n ASP 102 Cb 0.57 0.00 0.25 0.00 -0.02 0.00 0.00 41.12 41.91 2bs2 n ASP 102 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2bs2 n LEU 103 N 0.00 2.66 -4.65 0.64 4.77 -0.86 -4.25 117.00 115.30 2bs2 n LEU 103 Ca 0.00 -0.99 -0.37 0.00 -0.03 0.00 0.00 56.01 54.61 2bs2 n LEU 103 Cb 0.00 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 40.92 2bs2 n LEU 103 CO 0.00 0.50 -0.06 -0.55 -1.33 0.00 0.00 177.39 175.95 2bs2 s SER 104 N -1.81 6.24 0.27 -1.43 0.15 0.44 -4.67 113.70 112.89 2bs2 s SER 104 Ca 0.33 0.26 0.04 0.00 0.70 0.00 0.00 55.95 57.29 2bs2 s SER 104 Cb 0.21 -2.16 -0.06 0.00 -1.71 0.00 0.00 66.02 62.30 2bs2 s SER 104 CO 0.31 -0.01 -0.00 0.68 1.20 0.00 0.00 173.24 175.41 2bs2 s VAL 105 N 1.28 1.24 -0.83 4.45 -7.23 -1.26 -0.41 120.40 117.64 2bs2 s VAL 105 Ca 0.12 -2.05 -0.15 0.00 -1.81 0.00 0.00 61.98 58.09 2bs2 s VAL 105 Cb -0.14 -2.48 0.19 0.00 0.56 0.00 0.00 36.38 34.51 2bs2 s VAL 105 CO 0.07 -0.24 0.83 -0.62 -0.31 0.00 0.00 175.10 174.83 2bs2 s ASP 106 N -3.39 6.69 -0.09 4.85 -1.08 0.15 -4.78 116.67 119.02 2bs2 s ASP 106 Ca 0.31 -2.47 -0.04 0.00 -0.52 0.00 0.00 52.55 49.83 2bs2 s ASP 106 Cb 0.06 -2.25 -0.26 0.00 -1.46 0.00 0.00 42.92 39.00 2bs2 s ASP 106 CO 0.11 -0.71 0.47 0.71 0.52 0.00 0.00 175.17 176.28 2bs2 h THR 107 N 5.09 0.72 -0.55 1.71 1.35 -1.97 -3.38 112.91 115.88 2bs2 h THR 107 Ca 0.09 -2.44 0.08 0.00 -0.55 0.00 0.00 66.41 63.59 2bs2 h THR 107 Cb 1.04 2.53 -0.06 0.00 -1.73 0.00 0.00 68.15 69.93 2bs2 h THR 107 CO 0.85 0.83 0.20 1.23 -0.25 0.00 0.00 175.52 178.38 2bs2 h GLY 108 N 1.48 0.74 2.00 5.82 0.00 -1.90 -0.89 103.07 110.32 2bs2 h GLY 108 Ca -0.38 -0.10 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 2bs2 h GLY 108 CO 0.10 -0.00 -0.36 3.43 0.00 0.00 0.00 176.54 179.70 2bs2 h ASN 109 N 0.38 0.00 -0.26 0.19 2.35 -1.98 -1.28 115.58 114.97 2bs2 h ASN 109 Ca 0.27 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.83 2bs2 h ASN 109 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 2bs2 h ASN 109 CO -0.27 0.36 -0.59 -0.25 -1.65 0.00 0.00 177.43 175.03 2bs2 h TRP 110 N 0.00 1.10 -0.56 1.19 7.01 -1.62 -2.11 115.95 120.96 2bs2 h TRP 110 Ca -0.00 -0.41 -0.11 0.00 2.11 0.00 0.00 58.89 60.48 2bs2 h TRP 110 Cb 1.09 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 27.93 2bs2 h TRP 110 CO 0.00 1.24 -0.08 0.74 -2.79 0.00 0.00 178.44 177.55 2bs2 h PHE 111 N 0.65 1.15 -0.77 2.65 0.04 -0.94 -0.30 116.94 119.43 2bs2 h PHE 111 Ca 0.00 -0.23 -0.02 0.00 2.80 0.00 0.00 57.97 60.52 2bs2 h PHE 111 Cb 1.20 -0.29 -0.04 0.00 2.20 0.00 0.00 35.95 39.02 2bs2 h PHE 111 CO 0.07 1.05 0.39 -0.91 -0.60 0.00 0.00 178.31 178.32 2bs2 h ASN 112 N 0.92 0.97 -0.55 2.17 2.35 -1.19 0.18 115.58 120.43 2bs2 h ASN 112 Ca 0.15 -0.10 -0.08 0.00 -0.55 0.00 0.00 56.30 55.72 2bs2 h ASN 112 Cb 0.65 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.75 2bs2 h ASN 112 CO 0.04 0.81 0.06 1.23 -1.65 0.00 0.00 177.43 177.93 2bs2 h GLY 113 N 1.12 1.05 0.81 2.83 0.00 -1.00 -1.44 103.07 106.43 2bs2 h GLY 113 Ca 0.27 -0.70 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 2bs2 h GLY 113 CO -0.04 0.65 -0.01 1.98 0.00 0.00 0.00 176.54 179.12 2bs2 h MET 114 N 0.91 0.34 -0.78 4.80 1.85 -0.32 -0.47 114.93 121.27 2bs2 h MET 114 Ca 0.18 -0.11 0.06 0.00 -0.61 0.00 0.00 59.70 59.22 2bs2 h MET 114 Cb 0.44 -0.03 -0.05 0.00 0.43 0.00 0.00 31.60 32.40 2bs2 h MET 114 CO 0.02 0.56 0.51 0.77 -0.40 0.00 0.00 176.91 178.36 2bs2 h SER 115 N 0.09 0.73 -0.13 1.39 0.02 -0.47 -0.98 113.55 114.20 2bs2 h SER 115 Ca 0.05 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.79 2bs2 h SER 115 Cb 0.41 -0.15 0.01 0.00 0.14 0.00 0.00 62.40 62.81 2bs2 h SER 115 CO 0.01 0.47 -0.76 1.56 -1.14 0.00 0.00 176.83 176.97 2bs2 h GLN 116 N 0.83 0.75 -0.88 3.45 4.20 -1.05 0.12 115.11 122.53 2bs2 h GLN 116 Ca 0.33 -0.63 0.05 0.00 0.06 0.00 0.00 58.65 58.46 2bs2 h GLN 116 Cb 0.24 0.14 -0.05 0.00 0.30 0.00 0.00 27.48 28.11 2bs2 h GLN 116 CO -0.12 1.24 0.58 -0.09 -0.67 0.00 0.00 178.83 179.77 2bs2 h ARG 117 N 0.46 1.03 -0.72 1.46 2.43 -0.14 -1.62 114.38 117.28 2bs2 h ARG 117 Ca -0.06 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2bs2 h ARG 117 Cb 1.40 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 2bs2 h ARG 117 CO 0.16 0.68 0.00 1.33 -1.51 0.00 0.00 179.97 180.63 2bs2 n VAL 118 N -4.46 1.25 -3.72 0.20 0.24 -0.46 -4.94 118.33 106.44 2bs2 n VAL 118 Ca 0.12 -1.06 -0.32 0.00 -2.04 0.00 0.00 64.34 61.05 2bs2 n VAL 118 Cb 0.14 0.39 0.03 0.00 -1.47 0.00 0.00 33.84 32.94 2bs2 n VAL 118 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2bs2 n GLU 119 N 1.53 -1.08 -1.19 7.34 1.02 -0.61 -4.78 120.64 122.86 2bs2 n GLU 119 Ca 0.25 0.48 -0.40 0.00 -0.02 0.00 0.00 57.16 57.47 2bs2 n GLU 119 Cb 0.71 -3.79 -0.04 0.00 -0.02 0.00 0.00 31.44 28.30 2bs2 n GLU 119 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2bs2 n SER 120 N -2.53 3.27 -3.47 1.62 2.88 0.38 -4.79 113.62 110.98 2bs2 n SER 120 Ca -0.11 -2.65 -0.10 0.00 -1.33 0.00 0.00 58.87 54.68 2bs2 n SER 120 Cb 0.59 -1.21 -0.02 0.00 -0.75 0.00 0.00 64.21 62.82 2bs2 n SER 120 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2bs2 s TRP 121 N 4.38 -0.44 0.09 0.66 -2.14 -1.26 -5.02 118.94 115.21 2bs2 s TRP 121 Ca 0.53 0.26 -0.31 0.00 2.66 0.00 0.00 56.10 59.24 2bs2 s TRP 121 Cb 0.14 0.55 -0.08 0.00 -3.10 0.00 0.00 33.47 30.98 2bs2 s TRP 121 CO 0.06 -0.70 1.53 0.42 -2.66 0.00 0.00 176.95 175.60 2bs2 s ILE 122 N -3.43 3.13 -0.32 0.66 -1.09 -1.26 -4.99 121.20 113.90 2bs2 s ILE 122 Ca 0.03 0.68 -0.09 0.00 -2.23 0.00 0.00 60.65 59.04 2bs2 s ILE 122 Cb -0.01 -3.44 0.00 0.00 -1.58 0.00 0.00 42.46 37.43 2bs2 s ILE 122 CO -0.11 0.02 0.15 -1.00 -1.23 0.00 0.00 174.94 172.77 2bs2 s HIS 123 N 1.96 3.18 -0.08 3.97 3.76 -1.26 -5.03 115.29 121.79 2bs2 s HIS 123 Ca 0.69 -0.69 -0.10 0.00 -0.15 0.00 0.00 55.06 54.81 2bs2 s HIS 123 Cb -0.38 -2.35 0.02 0.00 1.11 0.00 0.00 32.58 30.98 2bs2 s HIS 123 CO 0.30 -0.50 0.26 0.00 -0.85 0.00 0.00 174.74 173.95 2bs2 s ALA 124 N 1.59 -0.65 0.22 -1.40 0.00 -1.26 -0.71 121.76 119.54 2bs2 s ALA 124 Ca 0.04 0.62 -0.01 0.00 0.00 0.00 0.00 51.96 52.61 2bs2 s ALA 124 Cb -0.17 -0.33 0.19 0.00 0.00 0.00 0.00 23.12 22.81 2bs2 s ALA 124 CO 0.06 -0.15 1.55 1.96 0.00 0.00 0.00 175.76 179.18 2bs2 h GLN 125 N 5.36 0.48 -6.43 0.00 1.08 -1.97 -3.45 115.11 110.18 2bs2 h GLN 125 Ca -0.27 -0.28 -0.63 0.00 -1.45 0.00 0.00 58.65 56.02 2bs2 h GLN 125 Cb 1.19 0.02 -0.25 0.00 -0.05 0.00 0.00 27.48 28.40 2bs2 h GLN 125 CO 0.35 0.88 -0.85 -1.59 -0.95 0.00 0.00 178.83 176.66 2bs2 s LYS 126 N -4.04 1.45 -0.19 1.46 -2.85 -1.26 -5.12 119.74 109.20 2bs2 s LYS 126 Ca -0.07 -1.10 -0.21 0.00 -1.00 0.00 0.00 55.97 53.60 2bs2 s LYS 126 Cb 0.12 -1.68 -0.03 0.00 -2.06 0.00 0.00 37.83 34.18 2bs2 s LYS 126 CO 0.82 0.42 0.62 -1.21 0.10 0.00 0.00 175.35 176.10 2bs2 s GLU 127 N -1.49 4.23 0.28 1.78 2.02 -1.26 -5.04 118.70 119.22 2bs2 s GLU 127 Ca 0.10 0.60 -0.29 0.00 0.02 0.00 0.00 54.97 55.40 2bs2 s GLU 127 Cb -0.10 -3.56 -0.10 0.00 0.10 0.00 0.00 34.13 30.48 2bs2 s GLU 127 CO 0.03 -0.19 1.20 -1.58 0.02 0.00 0.00 175.26 174.74 2bs2 s HIS 128 N 1.76 3.35 -0.01 1.61 5.65 -1.26 -4.93 115.29 121.46 2bs2 s HIS 128 Ca 0.29 1.53 -0.30 0.00 0.25 0.00 0.00 55.06 56.82 2bs2 s HIS 128 Cb -0.16 -3.47 -0.07 0.00 -1.18 0.00 0.00 32.58 27.71 2bs2 s HIS 128 CO 0.11 -1.20 1.75 0.34 -0.65 0.00 0.00 174.74 175.09 2bs2 s ASP 129 N -0.52 6.59 0.00 9.88 -1.08 -1.26 -4.88 116.67 125.41 2bs2 s ASP 129 Ca 0.48 2.40 0.23 0.00 -0.52 0.00 0.00 52.55 55.15 2bs2 s ASP 129 Cb -0.35 -2.54 1.26 0.00 -1.46 0.00 0.00 42.92 39.83 2bs2 s ASP 129 CO 0.44 -0.96 1.76 2.30 0.52 0.00 0.00 175.17 179.24 2bs2 n ILE 130 N 5.40 0.17 1.04 4.11 -5.35 -1.26 -2.44 119.36 121.03 2bs2 n ILE 130 Ca 0.18 0.04 0.12 0.00 -0.27 0.00 0.00 62.75 62.82 2bs2 n ILE 130 Cb 0.42 -0.67 0.09 0.00 -1.74 0.00 0.00 39.64 37.74 2bs2 n ILE 130 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2bs2 n SER 131 N -1.17 2.39 -4.81 7.28 3.41 -1.26 -4.96 113.62 114.50 2bs2 n SER 131 Ca 0.14 -1.71 -0.24 0.00 -0.26 0.00 0.00 58.87 56.80 2bs2 n SER 131 Cb 0.14 0.22 -0.05 0.00 -0.26 0.00 0.00 64.21 64.26 2bs2 n SER 131 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2bs2 s LYS 132 N -2.24 2.34 0.42 4.33 1.02 -1.02 -5.09 119.74 119.51 2bs2 s LYS 132 Ca 0.24 -1.77 -0.25 0.00 0.02 0.00 0.00 55.97 54.21 2bs2 s LYS 132 Cb 0.19 -2.13 -0.10 0.00 -0.52 0.00 0.00 37.83 35.27 2bs2 s LYS 132 CO 0.43 -0.21 1.30 1.28 -0.92 0.00 0.00 175.35 177.23 2bs2 n LEU 133 N -1.42 4.19 -4.75 3.17 7.99 -1.26 -4.96 117.00 119.96 2bs2 n LEU 133 Ca 0.00 1.11 -0.31 0.00 -0.01 0.00 0.00 56.01 56.80 2bs2 n LEU 133 Cb 0.64 -1.52 0.10 0.00 -0.11 0.00 0.00 43.42 42.52 2bs2 n LEU 133 CO 0.44 -0.56 0.71 -1.83 -1.51 0.00 0.00 177.39 174.63 2bs2 s GLU 134 N -2.24 2.16 0.22 3.23 1.03 -1.26 -4.96 118.70 116.88 2bs2 s GLU 134 Ca 0.61 1.28 -0.30 0.00 0.03 0.00 0.00 54.97 56.59 2bs2 s GLU 134 Cb -0.50 -1.88 -0.09 0.00 -0.80 0.00 0.00 34.13 30.87 2bs2 s GLU 134 CO 0.58 -1.73 1.17 -1.21 -1.33 0.00 0.00 175.26 172.74 2bs2 s GLU 135 N -4.72 4.53 0.40 -4.83 2.02 -1.26 -4.98 118.70 109.87 2bs2 s GLU 135 Ca 0.63 1.87 -0.25 0.00 0.02 0.00 0.00 54.97 57.24 2bs2 s GLU 135 Cb -0.19 -3.22 -0.08 0.00 0.10 0.00 0.00 34.13 30.74 2bs2 s GLU 135 CO 0.54 -0.01 1.18 1.03 0.02 0.00 0.00 175.26 178.02 2bs2 s ARG 136 N -0.68 4.05 -0.01 1.61 0.52 -1.26 -5.05 118.95 118.13 2bs2 s ARG 136 Ca 0.50 1.86 0.01 0.00 -0.52 0.00 0.00 55.73 57.58 2bs2 s ARG 136 Cb -0.33 -2.68 0.01 0.00 0.52 0.00 0.00 34.95 32.47 2bs2 s ARG 136 CO 0.39 -0.33 -0.02 0.42 0.02 0.00 0.00 175.30 175.77 2bs2 s ILE 137 N -1.41 0.26 0.27 1.52 -1.09 -1.26 -5.12 121.20 114.36 2bs2 s ILE 137 Ca 0.57 -0.06 -0.30 0.00 -2.23 0.00 0.00 60.65 58.63 2bs2 s ILE 137 Cb -0.31 -0.27 -0.11 0.00 -1.58 0.00 0.00 42.46 40.19 2bs2 s ILE 137 CO 0.39 0.11 1.51 -1.61 -1.23 0.00 0.00 174.94 174.11 2bs2 s GLU 138 N 0.38 4.20 0.31 2.79 0.41 -1.26 -4.87 118.70 120.66 2bs2 s GLU 138 Ca -0.04 2.42 0.05 0.00 -0.41 0.00 0.00 54.97 57.00 2bs2 s GLU 138 Cb -0.07 -3.07 0.69 0.00 -1.78 0.00 0.00 34.13 29.90 2bs2 s GLU 138 CO -0.01 -0.52 1.83 -1.00 -0.49 0.00 0.00 175.26 175.08 2bs2 h PRO 139 N 4.99 0.82 -0.73 0.39 0.13 -2.00 -1.11 132.00 134.49 2bs2 h PRO 139 Ca -0.46 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.58 2bs2 h PRO 139 Cb 1.22 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 32.13 2bs2 h PRO 139 CO 0.79 0.54 0.31 0.93 -0.23 0.00 0.00 178.00 180.34 2bs2 h GLU 140 N 0.84 1.06 -0.22 0.86 3.07 -1.99 -0.82 114.58 117.38 2bs2 h GLU 140 Ca 0.50 -0.17 -0.04 0.00 -0.50 0.00 0.00 59.36 59.15 2bs2 h GLU 140 Cb 0.67 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 2bs2 h GLU 140 CO -0.27 0.85 -0.01 0.28 -1.40 0.00 0.00 179.01 178.46 2bs2 h VAL 141 N 1.04 1.26 -0.93 3.13 2.07 -1.61 -1.20 116.25 120.03 2bs2 h VAL 141 Ca 0.25 -0.91 0.06 0.00 0.82 0.00 0.00 66.70 66.92 2bs2 h VAL 141 Cb 0.17 1.42 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 2bs2 h VAL 141 CO -0.02 0.28 0.59 0.00 0.02 0.00 0.00 177.57 178.44 2bs2 h ALA 142 N 0.79 1.28 -0.72 1.67 0.00 -1.00 -0.83 119.26 120.46 2bs2 h ALA 142 Ca 0.06 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2bs2 h ALA 142 Cb 0.42 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2bs2 h ALA 142 CO 0.01 0.36 0.23 0.37 0.00 0.00 0.00 179.25 180.22 2bs2 h GLN 143 N 1.07 1.11 -0.37 0.00 5.75 -0.86 -1.23 115.11 120.59 2bs2 h GLN 143 Ca 0.40 -0.24 -0.03 0.00 -0.15 0.00 0.00 58.65 58.64 2bs2 h GLN 143 Cb 0.16 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.53 2bs2 h GLN 143 CO -0.17 0.95 0.12 0.93 -2.65 0.00 0.00 178.83 178.01 2bs2 h GLU 144 N 1.05 0.57 -0.47 1.69 5.08 -0.13 -1.38 114.58 121.00 2bs2 h GLU 144 Ca 0.23 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2bs2 h GLU 144 Cb 0.30 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2bs2 h GLU 144 CO -0.01 0.59 0.27 0.28 -1.00 0.00 0.00 179.01 179.14 2bs2 h VAL 145 N 0.45 1.15 -0.62 3.13 2.07 -1.03 -2.74 116.25 118.66 2bs2 h VAL 145 Ca 0.12 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.32 2bs2 h VAL 145 Cb 0.25 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 30.52 2bs2 h VAL 145 CO -0.00 0.16 0.34 0.15 0.02 0.00 0.00 177.57 178.24 2bs2 h PHE 146 N 0.62 0.63 -0.82 1.57 3.57 -1.01 0.76 116.94 122.26 2bs2 h PHE 146 Ca 0.17 0.02 0.16 0.00 3.53 0.00 0.00 57.97 61.85 2bs2 h PHE 146 Cb 0.02 -0.19 -0.10 0.00 2.79 0.00 0.00 35.95 38.46 2bs2 h PHE 146 CO -0.03 0.31 0.36 1.49 -2.23 0.00 0.00 178.31 178.22 2bs2 h GLU 147 N 0.65 0.47 0.00 1.11 4.81 -0.95 -0.38 114.58 120.29 2bs2 h GLU 147 Ca 0.27 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.38 2bs2 h GLU 147 Cb 0.15 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2bs2 h GLU 147 CO -0.16 0.31 -0.76 -0.07 -0.73 0.00 0.00 179.01 177.60 2bs2 h LEU 148 N 0.49 0.00 0.00 1.64 3.38 -1.30 -3.24 115.31 116.28 2bs2 h LEU 148 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 2bs2 h LEU 148 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2bs2 h LEU 148 CO -0.42 0.39 0.00 -0.67 0.09 0.00 0.00 178.44 177.83 2bs2 n ASP 149 N -3.04 0.00 0.01 -0.43 2.03 0.20 -3.43 116.55 111.89 2bs2 n ASP 149 Ca -0.01 0.20 0.08 0.00 0.52 0.00 0.00 54.79 55.57 2bs2 n ASP 149 Cb 0.71 -0.38 0.35 0.00 -0.72 0.00 0.00 41.12 41.08 2bs2 n ASP 149 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2bs2 n ARG 150 N -1.38 0.02 -1.63 -0.67 1.74 -0.58 -4.83 116.66 109.32 2bs2 n ARG 150 Ca 0.09 0.24 -0.49 0.00 -0.77 0.00 0.00 57.85 56.92 2bs2 n ARG 150 Cb 0.23 -1.53 -0.05 0.00 -1.02 0.00 0.00 32.46 30.09 2bs2 n ARG 150 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bs2 n ILE 152 N 3.04 1.88 -4.04 0.00 -5.35 -1.26 -4.98 119.36 108.65 2bs2 n ILE 152 Ca 0.18 -1.34 -0.27 0.00 -0.27 0.00 0.00 62.75 61.04 2bs2 n ILE 152 Cb 0.24 0.07 -0.04 0.00 -1.74 0.00 0.00 39.64 38.18 2bs2 n ILE 152 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2bs2 n GLU 153 N 0.60 -2.89 0.21 6.28 1.02 -1.26 -4.18 120.64 120.42 2bs2 n GLU 153 Ca 0.23 0.35 0.11 0.00 -0.02 0.00 0.00 57.16 57.82 2bs2 n GLU 153 Cb 0.84 -4.43 0.14 0.00 -0.02 0.00 0.00 31.44 27.97 2bs2 n GLU 153 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bs2 n GLY 155 N 1.12 1.54 0.34 0.00 0.00 -1.26 -4.53 105.19 102.40 2bs2 n GLY 155 Ca 0.04 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.08 2bs2 n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bs2 h ILE 158 N 0.00 1.58 0.00 0.00 1.08 -1.67 -3.13 117.51 115.38 2bs2 h ILE 158 Ca 0.00 -2.45 -0.07 0.00 -0.39 0.00 0.00 64.86 61.95 2bs2 h ILE 158 Cb 0.79 3.23 -0.01 0.00 -3.07 0.00 0.00 36.82 37.76 2bs2 h ILE 158 CO 0.00 0.66 -0.33 0.00 -0.69 0.00 0.00 178.15 177.80 2bs2 h ALA 159 N 0.03 1.03 0.00 1.87 0.00 -1.27 -2.83 119.26 118.09 2bs2 h ALA 159 Ca -0.10 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2bs2 h ALA 159 Cb 1.39 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2bs2 h ALA 159 CO 0.08 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.73 2bs2 h ALA 160 N 1.67 1.00 -1.75 0.00 0.00 -1.33 -3.44 119.26 115.41 2bs2 h ALA 160 Ca -0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 2bs2 h ALA 160 Cb 0.83 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.54 2bs2 h ALA 160 CO 0.04 0.00 0.83 0.00 0.00 0.00 0.00 179.25 180.12 2bs2 h GLY 162 N 11.16 0.65 0.98 0.00 0.00 -1.87 -1.83 103.07 112.16 2bs2 h GLY 162 Ca -0.24 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2bs2 h GLY 162 CO 1.11 0.21 0.20 -0.84 0.00 0.00 0.00 176.54 177.22 2bs2 h THR 163 N 0.59 1.11 -0.66 4.70 2.02 -1.95 -1.99 112.91 116.74 2bs2 h THR 163 Ca 0.19 -0.26 -0.08 0.00 0.77 0.00 0.00 66.41 67.04 2bs2 h THR 163 Cb 0.04 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 2bs2 h THR 163 CO -0.05 0.11 0.11 0.11 0.37 0.00 0.00 175.52 176.18 2bs2 h LYS 164 N 0.42 1.07 -0.87 6.66 1.79 -1.60 0.21 116.57 124.25 2bs2 h LYS 164 Ca 0.12 -0.28 0.03 0.00 -2.18 0.00 0.00 60.65 58.35 2bs2 h LYS 164 Cb 0.01 -0.13 -0.05 0.00 -1.58 0.00 0.00 32.23 30.47 2bs2 h LYS 164 CO -0.02 0.98 0.56 0.82 -1.08 0.00 0.00 179.45 180.70 2bs2 h ILE 165 N 1.01 1.14 0.22 1.86 2.04 -1.03 -3.04 117.51 119.70 2bs2 h ILE 165 Ca 0.20 -0.37 -0.29 0.00 1.00 0.00 0.00 64.86 65.40 2bs2 h ILE 165 Cb 0.42 -0.04 0.03 0.00 -0.74 0.00 0.00 36.82 36.49 2bs2 h ILE 165 CO 0.01 0.20 -1.26 0.24 0.00 0.00 0.00 178.15 177.33 2bs2 h MET 166 N 1.08 0.47 -4.34 2.37 2.86 -1.08 -3.43 114.93 112.86 2bs2 h MET 166 Ca 0.35 -0.80 -0.66 0.00 -2.06 0.00 0.00 59.70 56.53 2bs2 h MET 166 Cb 0.01 0.30 -0.40 0.00 0.06 0.00 0.00 31.60 31.58 2bs2 h MET 166 CO -0.12 1.38 -0.67 1.03 1.06 0.00 0.00 176.91 179.59 2bs2 s ARG 167 N -2.55 1.67 0.62 1.72 0.52 0.70 -5.00 118.95 116.64 2bs2 s ARG 167 Ca -0.11 -2.07 0.38 0.00 -0.52 0.00 0.00 55.73 53.42 2bs2 s ARG 167 Cb 0.03 -3.28 2.08 0.00 0.52 0.00 0.00 34.95 34.30 2bs2 s ARG 167 CO 0.91 -1.00 2.28 1.05 0.02 0.00 0.00 175.30 178.56 2bs2 h GLU 168 N 7.37 0.00 -0.00 3.54 4.11 -1.81 -2.37 114.58 125.42 2bs2 h GLU 168 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.37 2bs2 h GLU 168 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2bs2 h GLU 168 CO 0.58 0.01 -0.08 -0.25 0.07 0.00 0.00 179.01 179.34 2bs2 n ASP 169 N -3.33 0.28 -4.72 3.06 8.00 -1.26 -4.85 116.55 113.73 2bs2 n ASP 169 Ca -0.03 -0.35 -0.42 0.00 0.71 0.00 0.00 54.79 54.70 2bs2 n ASP 169 Cb 0.11 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.03 2bs2 n ASP 169 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2bs2 s PHE 170 N -2.56 2.93 0.51 1.24 5.36 -0.89 -4.81 117.98 119.76 2bs2 s PHE 170 Ca 0.27 0.39 0.36 0.00 -0.96 0.00 0.00 56.93 56.99 2bs2 s PHE 170 Cb 0.20 -4.11 1.94 0.00 -0.34 0.00 0.00 43.02 40.72 2bs2 s PHE 170 CO 0.48 -4.17 2.23 -0.24 -1.46 0.00 0.00 175.22 172.06 2bs2 h VAL 171 N 3.84 0.23 0.00 3.12 3.04 -1.32 -3.48 116.25 121.68 2bs2 h VAL 171 Ca -0.43 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 65.07 2bs2 h VAL 171 Cb 1.20 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 31.63 2bs2 h VAL 171 CO 0.95 0.03 0.00 0.61 -1.01 0.00 0.00 177.57 178.15 2bs2 n GLY 172 N -0.88 -2.01 0.33 3.17 0.00 -1.26 -3.64 105.19 100.90 2bs2 n GLY 172 Ca -0.02 -1.51 -0.05 0.00 0.00 0.00 0.00 46.02 44.44 2bs2 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bs2 h ALA 173 N 0.00 1.05 -0.30 4.61 0.00 -1.94 -2.08 119.26 120.60 2bs2 h ALA 173 Ca 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2bs2 h ALA 173 Cb 0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2bs2 h ALA 173 CO 0.00 0.56 0.06 0.00 0.00 0.00 0.00 179.25 179.87 2bs2 h ALA 174 N 1.24 1.55 -0.29 0.00 0.00 -1.91 0.07 119.26 119.92 2bs2 h ALA 174 Ca 0.29 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 2bs2 h ALA 174 Cb 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2bs2 h ALA 174 CO -0.05 0.34 -0.43 0.78 0.00 0.00 0.00 179.25 179.89 2bs2 h GLY 175 N 0.68 0.88 1.22 0.00 0.00 -1.46 -1.72 103.07 102.66 2bs2 h GLY 175 Ca 0.10 -0.98 -0.13 0.00 0.00 0.00 0.00 47.33 46.32 2bs2 h GLY 175 CO -0.00 0.88 -0.26 1.41 0.00 0.00 0.00 176.54 178.57 2bs2 h LEU 176 N 0.56 0.91 -0.63 3.11 3.38 -0.92 -2.40 115.31 119.33 2bs2 h LEU 176 Ca 0.03 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.60 2bs2 h LEU 176 Cb 1.03 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 2bs2 h LEU 176 CO 0.10 1.12 0.23 -1.13 0.09 0.00 0.00 178.44 178.84 2bs2 h ASN 177 N 0.76 0.89 -0.94 -0.43 -0.73 -0.98 -2.40 115.58 111.75 2bs2 h ASN 177 Ca 0.09 -0.19 0.01 0.00 1.87 0.00 0.00 56.30 58.09 2bs2 h ASN 177 Cb 0.81 -0.23 -0.05 0.00 0.27 0.00 0.00 38.32 39.12 2bs2 h ASN 177 CO 0.07 0.84 0.62 -0.09 -0.37 0.00 0.00 177.43 178.50 2bs2 h ARG 178 N 0.89 1.22 -0.12 6.67 9.65 -1.11 0.81 114.38 132.40 2bs2 h ARG 178 Ca 0.21 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 59.01 2bs2 h ARG 178 Cb 0.25 -0.28 -0.01 0.00 -1.39 0.00 0.00 29.97 28.55 2bs2 h ARG 178 CO -0.01 0.81 0.06 0.28 2.80 0.00 0.00 179.97 183.91 2bs2 h VAL 179 N 1.26 1.11 -0.72 0.20 2.07 -1.14 -2.62 116.25 116.41 2bs2 h VAL 179 Ca 0.35 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 2bs2 h VAL 179 Cb -0.12 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 2bs2 h VAL 179 CO -0.08 0.10 0.38 0.58 0.02 0.00 0.00 177.57 178.57 2bs2 h VAL 180 N 0.07 1.22 -0.61 2.57 2.07 -0.91 -0.51 116.25 120.15 2bs2 h VAL 180 Ca 0.04 -0.57 0.11 0.00 0.82 0.00 0.00 66.70 67.10 2bs2 h VAL 180 Cb 0.11 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.10 2bs2 h VAL 180 CO -0.01 0.25 0.41 -0.09 0.02 0.00 0.00 177.57 178.15 2bs2 h ARG 181 N 1.01 0.37 0.01 1.57 1.12 -0.49 -1.38 114.38 116.60 2bs2 h ARG 181 Ca 0.26 -0.02 -0.30 0.00 -1.11 0.00 0.00 59.98 58.80 2bs2 h ARG 181 Cb 0.05 -0.08 -0.05 0.00 -0.01 0.00 0.00 29.97 29.88 2bs2 h ARG 181 CO -0.04 0.25 -1.73 1.19 -3.11 0.00 0.00 179.97 176.53 2bs2 n PHE 182 N -4.47 1.05 -0.21 2.20 3.72 -0.83 -3.69 117.46 115.24 2bs2 n PHE 182 Ca 0.10 0.36 -0.02 0.00 -0.05 0.00 0.00 57.45 57.84 2bs2 n PHE 182 Cb 0.40 -1.19 0.08 0.00 -0.94 0.00 0.00 39.48 37.84 2bs2 n PHE 182 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 2bs2 h MET 183 N 0.01 0.59 -0.10 -1.08 4.05 -0.09 -1.99 114.93 116.32 2bs2 h MET 183 Ca -0.30 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.09 2bs2 h MET 183 Cb 2.01 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 32.68 2bs2 h MET 183 CO 0.08 0.39 0.00 0.44 0.23 0.00 0.00 176.91 178.05 2bs2 n ILE 184 N -4.83 0.12 -3.22 1.77 -5.35 -0.64 -4.79 119.36 102.42 2bs2 n ILE 184 Ca 0.07 -0.24 -0.41 0.00 -0.27 0.00 0.00 62.75 61.90 2bs2 n ILE 184 Cb 0.16 0.20 -0.08 0.00 -1.74 0.00 0.00 39.64 38.19 2bs2 n ILE 184 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2bs2 s ASP 185 N -1.66 6.39 0.61 7.28 -1.08 -0.75 -4.86 116.67 122.60 2bs2 s ASP 185 Ca 0.33 0.26 0.32 0.00 -0.52 0.00 0.00 52.55 52.95 2bs2 s ASP 185 Cb 0.17 -2.28 1.88 0.00 -1.46 0.00 0.00 42.92 41.23 2bs2 s ASP 185 CO 0.27 -0.40 2.21 -0.65 0.52 0.00 0.00 175.17 177.12 2bs2 h PRO 186 N 8.25 0.00 0.00 4.34 0.11 -1.86 -2.08 132.00 140.76 2bs2 h PRO 186 Ca -0.28 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.78 2bs2 h PRO 186 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2bs2 h PRO 186 CO 0.75 0.00 -0.22 0.45 -0.21 0.00 0.00 178.00 178.77 2bs2 h HIS 187 N 0.00 0.00 -3.44 0.65 3.86 -1.92 -3.42 115.15 110.87 2bs2 h HIS 187 Ca 0.03 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.64 2bs2 h HIS 187 Cb 0.19 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.56 2bs2 h HIS 187 CO 0.00 0.22 0.03 0.34 0.86 0.00 0.00 177.93 179.38 2bs2 s ASP 188 N -6.23 6.62 0.00 2.45 -1.08 -0.78 -4.59 116.67 113.06 2bs2 s ASP 188 Ca -0.01 0.75 0.27 0.00 -0.52 0.00 0.00 52.55 53.04 2bs2 s ASP 188 Cb 0.11 -2.32 1.13 0.00 -1.46 0.00 0.00 42.92 40.38 2bs2 s ASP 188 CO 0.63 -0.22 1.78 -0.62 0.52 0.00 0.00 175.17 177.26 2bs2 n GLU 189 N 4.88 1.54 -1.82 4.34 1.02 0.11 -4.90 120.64 125.81 2bs2 n GLU 189 Ca -0.03 -0.79 -0.38 0.00 -0.02 0.00 0.00 57.16 55.94 2bs2 n GLU 189 Cb 0.50 -1.46 0.04 0.00 -0.02 0.00 0.00 31.44 30.51 2bs2 n GLU 189 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2bs2 s ARG 190 N -1.96 3.11 0.52 3.49 0.52 -1.26 -5.03 118.95 118.35 2bs2 s ARG 190 Ca 0.38 2.17 0.08 0.00 -0.52 0.00 0.00 55.73 57.84 2bs2 s ARG 190 Cb 0.20 -2.21 0.05 0.00 0.52 0.00 0.00 34.95 33.51 2bs2 s ARG 190 CO 0.32 -1.19 0.61 0.95 0.02 0.00 0.00 175.30 176.00 2bs2 s THR 191 N -1.34 2.21 0.29 0.02 -4.23 -1.26 -4.98 115.64 106.35 2bs2 s THR 191 Ca 0.72 -1.17 -0.02 0.00 -1.18 0.00 0.00 61.69 60.04 2bs2 s THR 191 Cb -0.39 -2.38 0.22 0.00 1.34 0.00 0.00 72.50 71.29 2bs2 s THR 191 CO 0.46 0.00 1.92 0.44 -0.54 0.00 0.00 174.62 176.89 2bs2 h ASP 192 N 0.50 0.90 -0.23 3.99 3.32 -1.98 -2.10 116.42 120.81 2bs2 h ASP 192 Ca -0.35 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 56.57 2bs2 h ASP 192 Cb 1.29 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.59 2bs2 h ASP 192 CO 0.48 0.72 -0.04 1.05 -1.72 0.00 0.00 179.24 179.72 2bs2 h GLU 193 N 1.02 0.57 -0.29 3.56 9.09 -1.96 -0.47 114.58 126.08 2bs2 h GLU 193 Ca 0.26 -0.14 -0.03 0.00 0.05 0.00 0.00 59.36 59.50 2bs2 h GLU 193 Cb 0.02 -0.07 -0.01 0.00 -1.65 0.00 0.00 28.75 27.04 2bs2 h GLU 193 CO -0.04 0.63 0.07 -0.44 0.05 0.00 0.00 179.01 179.28 2bs2 h ASP 194 N 0.54 0.44 -0.35 3.06 3.32 -1.78 -2.63 116.42 119.01 2bs2 h ASP 194 Ca 0.11 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 2bs2 h ASP 194 Cb 0.41 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 2bs2 h ASP 194 CO 0.02 0.55 0.17 1.88 -1.72 0.00 0.00 179.24 180.14 2bs2 h TYR 195 N 0.31 0.55 -0.78 4.55 0.05 -0.93 -2.03 116.97 118.68 2bs2 h TYR 195 Ca 0.09 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 2bs2 h TYR 195 Cb 0.28 -0.18 -0.04 0.00 1.01 0.00 0.00 36.73 37.81 2bs2 h TYR 195 CO 0.01 0.42 0.40 -0.92 -1.05 0.00 0.00 178.16 177.02 2bs2 h TYR 196 N 0.56 1.08 0.00 4.88 5.03 -0.75 -0.54 116.97 127.23 2bs2 h TYR 196 Ca 0.14 -0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.41 2bs2 h TYR 196 Cb 0.09 -0.34 -0.00 0.00 1.55 0.00 0.00 36.73 38.03 2bs2 h TYR 196 CO 0.00 0.77 -0.01 0.93 -1.32 0.00 0.00 178.16 178.53 2bs2 h GLU 197 N 1.09 0.00 0.00 1.82 4.39 -1.03 0.40 114.58 121.25 2bs2 h GLU 197 Ca 0.27 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.84 2bs2 h GLU 197 Cb 0.07 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 2bs2 h GLU 197 CO -0.04 0.01 -0.87 -0.07 -1.16 0.00 0.00 179.01 176.88 2bs2 h LEU 198 N 0.00 0.00 -2.87 1.33 3.38 -1.09 -3.43 115.31 112.63 2bs2 h LEU 198 Ca -0.00 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2bs2 h LEU 198 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2bs2 h LEU 198 CO 0.00 1.16 -0.03 2.30 0.09 0.00 0.00 178.44 181.96 2bs2 n ILE 199 N -4.52 1.43 -1.72 1.22 -6.64 -0.54 -4.85 119.36 103.73 2bs2 n ILE 199 Ca -0.21 -1.65 -0.36 0.00 -1.77 0.00 0.00 62.75 58.76 2bs2 n ILE 199 Cb 0.49 0.08 -0.03 0.00 -1.44 0.00 0.00 39.64 38.75 2bs2 n ILE 199 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2bs2 n GLY 200 N -1.01 4.77 2.88 3.28 0.00 0.14 -1.45 105.19 113.80 2bs2 n GLY 200 Ca 0.09 -1.86 -0.10 0.00 0.00 0.00 0.00 46.02 44.15 2bs2 n GLY 200 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bs2 n ASP 201 N 2.05 -1.45 0.04 1.61 5.68 -1.26 -4.93 116.55 118.29 2bs2 n ASP 201 Ca 0.63 -2.43 0.09 0.00 -0.50 0.00 0.00 54.79 52.58 2bs2 n ASP 201 Cb 0.32 2.53 0.37 0.00 -1.14 0.00 0.00 41.12 43.21 2bs2 n ASP 201 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2bs2 n ASP 202 N -1.59 0.19 -0.70 -1.12 8.00 -1.26 -0.91 116.55 119.17 2bs2 n ASP 202 Ca -0.03 0.54 0.12 0.00 0.71 0.00 0.00 54.79 56.13 2bs2 n ASP 202 Cb 0.48 -0.58 0.11 0.00 -0.02 0.00 0.00 41.12 41.10 2bs2 n ASP 202 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2bs2 n ASP 203 N -1.70 2.38 0.00 -2.24 8.00 -1.26 -3.55 116.55 118.18 2bs2 n ASP 203 Ca 0.03 -1.70 0.00 0.00 0.71 0.00 0.00 54.79 53.83 2bs2 n ASP 203 Cb 0.20 0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 2bs2 n ASP 203 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bs2 n GLY 204 N 1.36 2.17 0.32 0.44 0.00 -0.08 -0.91 105.19 108.50 2bs2 n GLY 204 Ca 0.12 -0.86 0.04 0.00 0.00 0.00 0.00 46.02 45.32 2bs2 n GLY 204 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2bs2 h VAL 205 N 0.00 1.11 0.00 1.61 3.04 -1.36 -1.20 116.25 119.45 2bs2 h VAL 205 Ca 0.00 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.46 2bs2 h VAL 205 Cb 0.00 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 29.66 2bs2 h VAL 205 CO 0.00 0.12 0.00 0.49 -1.01 0.00 0.00 177.57 177.17 2bs2 n PHE 206 N -4.46 0.00 0.85 3.17 3.72 -1.21 -2.28 117.46 117.25 2bs2 n PHE 206 Ca 0.05 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.58 2bs2 n PHE 206 Cb 0.08 -0.47 0.38 0.00 -0.94 0.00 0.00 39.48 38.54 2bs2 n PHE 206 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bs2 n GLY 207 N 0.58 -1.44 3.72 1.37 0.00 -0.45 -4.85 105.19 104.11 2bs2 n GLY 207 Ca 0.06 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 2bs2 n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bs2 n MET 209 N 3.36 3.14 -3.78 0.00 0.00 -1.26 -4.98 117.12 113.59 2bs2 n MET 209 Ca 0.08 -2.55 -0.25 0.00 0.00 0.00 0.00 57.70 54.98 2bs2 n MET 209 Cb 0.44 -1.61 0.03 0.00 0.00 0.00 0.00 33.22 32.08 2bs2 n MET 209 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 2bs2 n THR 210 N 0.76 -3.57 0.20 2.03 -1.04 -1.26 -4.86 114.28 106.54 2bs2 n THR 210 Ca 0.20 -0.33 0.08 0.00 -2.04 0.00 0.00 64.05 61.96 2bs2 n THR 210 Cb 0.68 -3.41 0.36 0.00 -1.82 0.00 0.00 70.33 66.14 2bs2 n THR 210 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2bs2 h LEU 211 N -1.95 0.00 0.05 -4.42 3.38 -2.01 -3.47 115.31 106.89 2bs2 h LEU 211 Ca -0.60 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.35 2bs2 h LEU 211 Cb 1.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 2bs2 h LEU 211 CO 0.60 0.30 -0.02 0.18 0.09 0.00 0.00 178.44 179.59 2bs2 n LEU 212 N -3.40 0.80 0.07 1.67 4.77 -1.26 -4.84 117.00 114.81 2bs2 n LEU 212 Ca 0.00 0.02 0.02 0.00 -0.03 0.00 0.00 56.01 56.03 2bs2 n LEU 212 Cb 0.50 -2.35 0.38 0.00 -2.33 0.00 0.00 43.42 39.62 2bs2 n LEU 212 CO 0.35 -0.92 0.95 0.00 -1.33 0.00 0.00 177.39 176.44 2bs2 h ALA 213 N 0.00 1.52 -0.21 -1.18 0.00 -1.91 -2.30 119.26 115.18 2bs2 h ALA 213 Ca -0.02 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.75 2bs2 h ALA 213 Cb 0.93 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 2bs2 h ALA 213 CO 0.03 0.35 0.02 0.00 0.00 0.00 0.00 179.25 179.65 2bs2 h HIS 215 N 0.10 0.72 0.00 0.00 6.17 -1.79 -2.12 115.15 118.23 2bs2 h HIS 215 Ca 0.10 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.18 2bs2 h HIS 215 Cb 0.11 -0.24 0.00 0.00 2.52 0.00 0.00 27.41 29.80 2bs2 h HIS 215 CO -0.16 0.49 0.00 -0.25 0.71 0.00 0.00 177.93 178.72 2bs2 n ASP 216 N -4.66 0.26 -0.00 3.26 8.00 -0.93 -3.59 116.55 118.89 2bs2 n ASP 216 Ca 0.03 0.55 0.03 0.00 0.71 0.00 0.00 54.79 56.11 2bs2 n ASP 216 Cb 0.05 -0.61 -0.04 0.00 -0.02 0.00 0.00 41.12 40.50 2bs2 n ASP 216 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2bs2 n VAL 217 N -1.77 0.00 -1.53 2.53 0.24 -0.71 -5.00 118.33 112.08 2bs2 n VAL 217 Ca 0.04 -0.26 -0.49 0.00 -2.04 0.00 0.00 64.34 61.59 2bs2 n VAL 217 Cb 0.27 0.72 -0.06 0.00 -1.47 0.00 0.00 33.84 33.30 2bs2 n VAL 217 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bs2 n PRO 219 N 7.89 0.14 -0.05 0.00 -0.04 -1.26 -1.18 135.00 140.50 2bs2 n PRO 219 Ca 0.35 0.51 0.10 0.00 -0.04 0.00 0.00 63.50 64.42 2bs2 n PRO 219 Cb 0.28 -1.84 0.12 0.00 -0.04 0.00 0.00 33.50 32.01 2bs2 n PRO 219 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2bs2 n LYS 220 N -2.11 2.03 -3.80 0.54 4.76 -1.26 -5.00 118.16 113.31 2bs2 n LYS 220 Ca 0.00 -1.86 -0.25 0.00 -2.87 0.00 0.00 58.31 53.34 2bs2 n LYS 220 Cb 0.12 -1.42 0.02 0.00 -1.84 0.00 0.00 35.03 31.92 2bs2 n LYS 220 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2bs2 n ASN 221 N 1.21 -2.26 -4.78 4.39 3.02 -0.32 -4.95 115.26 111.57 2bs2 n ASN 221 Ca 0.14 -0.83 -0.34 0.00 -0.03 0.00 0.00 54.58 53.52 2bs2 n ASN 221 Cb 0.53 -3.88 0.01 0.00 -0.61 0.00 0.00 39.78 35.83 2bs2 n ASN 221 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2bs2 s LEU 222 N -6.91 3.64 -1.60 3.41 1.02 -1.26 -4.90 118.68 112.08 2bs2 s LEU 222 Ca 0.22 2.05 -0.10 0.00 0.02 0.00 0.00 54.13 56.32 2bs2 s LEU 222 Cb -0.11 -4.56 -0.07 0.00 0.02 0.00 0.00 46.19 41.46 2bs2 s LEU 222 CO 0.83 -1.26 2.86 -0.81 0.02 0.00 0.00 176.35 177.99 2bs2 n PRO 223 N -1.62 3.61 -0.16 1.29 -0.04 -1.26 -4.69 135.00 132.12 2bs2 n PRO 223 Ca 0.11 -2.28 -0.08 0.00 -0.04 0.00 0.00 63.50 61.21 2bs2 n PRO 223 Cb 0.52 -2.86 0.01 0.00 -0.04 0.00 0.00 33.50 31.12 2bs2 n PRO 223 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2bs2 h LEU 224 N 7.38 0.59 0.24 1.53 3.38 -1.93 -2.08 115.31 124.43 2bs2 h LEU 224 Ca 0.83 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.72 2bs2 h LEU 224 Cb 0.33 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 2bs2 h LEU 224 CO 1.80 0.51 -0.41 -0.61 0.09 0.00 0.00 178.44 179.82 2bs2 h GLN 225 N 0.62 -0.70 -0.14 1.13 -0.00 -1.96 -0.18 115.11 113.89 2bs2 h GLN 225 Ca 0.16 0.05 -0.13 0.00 -0.00 0.00 0.00 58.65 58.73 2bs2 h GLN 225 Cb 0.06 0.16 -0.01 0.00 0.00 0.00 0.00 27.48 27.69 2bs2 h GLN 225 CO -0.03 -0.46 -0.47 0.66 0.00 0.00 0.00 178.83 178.53 2bs2 h SER 226 N -0.72 0.37 0.09 -0.69 4.64 -1.96 -2.72 113.55 112.54 2bs2 h SER 226 Ca -0.00 -0.17 -0.17 0.00 -0.47 0.00 0.00 61.79 60.97 2bs2 h SER 226 Cb 0.70 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.68 2bs2 h SER 226 CO -0.16 0.79 -0.62 0.50 -0.87 0.00 0.00 176.83 176.46 2bs2 h LYS 227 N 0.28 0.52 -0.35 4.77 1.63 -1.22 -0.96 116.57 121.25 2bs2 h LYS 227 Ca 0.02 -0.37 -0.16 0.00 -0.85 0.00 0.00 60.65 59.29 2bs2 h LYS 227 Cb 0.94 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.62 2bs2 h LYS 227 CO 0.08 0.98 -0.43 0.82 -3.45 0.00 0.00 179.45 177.45 2bs2 h ILE 228 N 0.39 1.28 -0.79 2.00 2.04 -1.02 -1.49 117.51 119.92 2bs2 h ILE 228 Ca -0.01 -1.61 -0.05 0.00 1.00 0.00 0.00 64.86 64.20 2bs2 h ILE 228 Cb 1.18 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.68 2bs2 h ILE 228 CO 0.11 0.53 0.30 0.00 0.00 0.00 0.00 178.15 179.09 2bs2 h ALA 229 N 0.80 1.03 -0.15 1.87 0.00 -1.40 0.13 119.26 121.54 2bs2 h ALA 229 Ca 0.05 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2bs2 h ALA 229 Cb 1.02 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2bs2 h ALA 229 CO 0.10 0.67 0.05 -0.92 0.00 0.00 0.00 179.25 179.15 2bs2 h TYR 230 N 1.15 0.10 -0.76 0.00 3.20 -0.98 -0.66 116.97 119.02 2bs2 h TYR 230 Ca 0.26 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.08 2bs2 h TYR 230 Cb 0.24 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 2bs2 h TYR 230 CO 0.02 0.05 0.25 1.25 -1.64 0.00 0.00 178.16 178.09 2bs2 h LEU 231 N 0.13 1.09 -0.63 2.82 5.85 -0.82 -2.34 115.31 121.41 2bs2 h LEU 231 Ca 0.06 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 2bs2 h LEU 231 Cb 0.03 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 2bs2 h LEU 231 CO -0.06 1.00 0.34 -0.09 -0.34 0.00 0.00 178.44 179.29 2bs2 h ARG 232 N 1.12 0.88 -0.75 1.25 2.43 -0.24 -0.64 114.38 118.43 2bs2 h ARG 232 Ca 0.25 -0.10 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 2bs2 h ARG 232 Cb 0.29 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 2bs2 h ARG 232 CO -0.01 0.67 0.33 0.00 -1.51 0.00 0.00 179.97 179.45 2bs2 h ARG 233 N 0.85 1.09 -0.21 0.20 3.08 -0.92 -1.79 114.38 116.68 2bs2 h ARG 233 Ca 0.22 -0.17 -0.15 0.00 0.07 0.00 0.00 59.98 59.95 2bs2 h ARG 233 Cb 0.05 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 29.91 2bs2 h ARG 233 CO -0.04 0.86 -0.46 0.87 -1.07 0.00 0.00 179.97 180.13 2bs2 h LYS 234 N 1.07 0.67 -0.11 0.04 1.57 -1.00 -3.20 116.57 115.61 2bs2 h LYS 234 Ca 0.26 -0.45 -0.13 0.00 -1.87 0.00 0.00 60.65 58.46 2bs2 h LYS 234 Cb 0.15 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2bs2 h LYS 234 CO -0.03 1.07 -0.50 0.52 -0.57 0.00 0.00 179.45 179.94 2bs2 h MET 235 N 0.37 0.28 0.00 3.15 2.86 -1.03 -2.77 114.93 117.80 2bs2 h MET 235 Ca 0.00 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 2bs2 h MET 235 Cb 1.06 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.74 2bs2 h MET 235 CO 0.10 0.72 0.00 1.55 1.06 0.00 0.00 176.91 180.34 2bs2 n VAL 236 N -3.96 0.58 0.99 -2.22 3.14 -0.68 -2.78 118.33 113.40 2bs2 n VAL 236 Ca -0.02 0.10 0.12 0.00 -2.96 0.00 0.00 64.34 61.58 2bs2 n VAL 236 Cb 0.55 -0.80 0.06 0.00 -1.06 0.00 0.00 33.84 32.59 2bs2 n VAL 236 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2bs2 n SER 237 N -1.66 2.59 -4.74 6.55 7.64 -1.05 -4.97 113.62 117.99 2bs2 n SER 237 Ca 0.05 -1.80 -0.41 0.00 1.01 0.00 0.00 58.87 57.72 2bs2 n SER 237 Cb 0.26 0.20 -0.03 0.00 -1.01 0.00 0.00 64.21 63.64 2bs2 n SER 237 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2bs2 s VAL 238 N -2.18 2.85 0.00 0.44 1.01 -1.12 -4.79 120.40 116.60 2bs2 s VAL 238 Ca 0.24 0.70 0.00 0.00 0.00 0.00 0.00 61.98 62.91 2bs2 s VAL 238 Cb 0.19 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 33.13 2bs2 s VAL 238 CO 0.41 0.10 0.00 0.59 0.00 0.00 0.00 175.10 176.20 2bs2 n ASN 239 N 2.58 0.00 0.00 3.32 4.13 -1.26 -5.11 115.26 118.92 2bs2 n ASN 239 Ca 0.07 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.33 2bs2 n ASN 239 Cb 0.41 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.65 2bs2 n ASN 239 CO 0.00 0.00 0.00 0.80 0.28 0.00 0.00 177.26 178.34