#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pbw s THR 5 N 0.00 4.45 0.12 5.15 2.01 -1.26 -4.44 115.64 121.67 2pbw s THR 5 Ca 0.00 1.77 -0.23 0.00 0.31 0.00 0.00 61.69 63.54 2pbw s THR 5 Cb 0.00 -4.13 -0.07 0.00 0.01 0.00 0.00 72.50 68.30 2pbw s THR 5 CO 0.00 0.14 0.70 -0.76 -0.69 0.00 0.00 174.62 174.01 2pbw s LEU 6 N 0.98 4.56 -0.23 4.42 1.43 0.12 -4.88 118.68 125.08 2pbw s LEU 6 Ca 0.55 1.49 -0.21 0.00 -1.03 0.00 0.00 54.13 54.93 2pbw s LEU 6 Cb -0.25 -3.14 -0.02 0.00 0.03 0.00 0.00 46.19 42.81 2pbw s LEU 6 CO 0.29 0.22 0.64 -0.63 0.23 0.00 0.00 176.35 177.10 2pbw s ILE 7 N -1.05 4.99 -0.32 -0.59 -1.09 -1.26 -1.19 121.20 120.68 2pbw s ILE 7 Ca 0.33 1.18 -0.08 0.00 -2.23 0.00 0.00 60.65 59.85 2pbw s ILE 7 Cb -0.22 -3.95 0.01 0.00 -1.58 0.00 0.00 42.46 36.73 2pbw s ILE 7 CO 0.23 0.05 0.13 -0.69 -1.23 0.00 0.00 174.94 173.43 2pbw s VAL 8 N 2.29 4.22 0.04 2.92 1.01 -0.38 -0.55 120.40 129.95 2pbw s VAL 8 Ca 0.28 -0.73 -0.22 0.00 0.00 0.00 0.00 61.98 61.30 2pbw s VAL 8 Cb -0.16 -3.24 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 2pbw s VAL 8 CO 0.09 -0.03 0.66 0.28 0.00 0.00 0.00 175.10 176.11 2pbw s THR 9 N 1.52 4.76 0.37 3.92 -1.32 -0.15 -0.17 115.64 124.57 2pbw s THR 9 Ca 0.02 1.41 -0.03 0.00 -1.21 0.00 0.00 61.69 61.88 2pbw s THR 9 Cb -0.18 -4.01 0.01 0.00 -1.51 0.00 0.00 72.50 66.82 2pbw s THR 9 CO 0.04 0.43 0.53 1.07 -2.21 0.00 0.00 174.62 174.49 2pbw n THR 10 N 2.46 0.00 -3.92 5.08 5.66 -0.86 -2.69 114.28 120.01 2pbw n THR 10 Ca -0.06 -1.77 -0.10 0.00 -3.05 0.00 0.00 64.05 59.07 2pbw n THR 10 Cb 0.50 1.12 -0.10 0.00 -1.55 0.00 0.00 70.33 70.31 2pbw n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 2pbw s ILE 11 N -2.77 0.12 -0.06 1.09 2.07 -1.26 -0.69 121.20 119.70 2pbw s ILE 11 Ca 0.29 -0.96 -0.30 0.00 -1.41 0.00 0.00 60.65 58.27 2pbw s ILE 11 Cb -0.01 -0.67 -0.03 0.00 0.13 0.00 0.00 42.46 41.88 2pbw s ILE 11 CO 0.21 -0.53 1.11 -0.76 -1.91 0.00 0.00 174.94 173.06 2pbw s LEU 12 N -1.82 4.28 -0.30 8.50 1.43 -1.26 -4.53 118.68 124.98 2pbw s LEU 12 Ca -0.09 1.72 -0.13 0.00 -1.03 0.00 0.00 54.13 54.59 2pbw s LEU 12 Cb -0.04 -3.56 0.15 0.00 0.03 0.00 0.00 46.19 42.77 2pbw s LEU 12 CO -0.02 -0.50 0.84 -0.70 0.23 0.00 0.00 176.35 176.19 2pbw s GLU 13 N 1.97 0.42 0.23 1.70 2.56 -0.30 -4.96 118.70 120.32 2pbw s GLU 13 Ca 0.53 1.05 -0.30 0.00 0.00 0.00 0.00 54.97 56.25 2pbw s GLU 13 Cb -0.22 0.61 -0.09 0.00 2.00 0.00 0.00 34.13 36.43 2pbw s GLU 13 CO 0.21 -0.14 1.34 -1.21 -0.56 0.00 0.00 175.26 174.91 2pbw s GLU 14 N 2.60 4.35 -0.31 4.30 2.02 -1.26 0.05 118.70 130.46 2pbw s GLU 14 Ca -0.04 2.14 0.09 0.00 0.02 0.00 0.00 54.97 57.18 2pbw s GLU 14 Cb -0.08 -3.16 0.55 0.00 0.10 0.00 0.00 34.13 31.54 2pbw s GLU 14 CO -0.18 -0.29 1.56 -0.35 0.02 0.00 0.00 175.26 176.02 2pbw n PRO 15 N 2.34 2.15 0.03 0.39 -0.04 -1.26 -4.93 135.00 133.68 2pbw n PRO 15 Ca 0.06 -3.11 -0.11 0.00 -0.04 0.00 0.00 63.50 60.30 2pbw n PRO 15 Cb 0.42 -1.91 -0.08 0.00 -0.04 0.00 0.00 33.50 31.89 2pbw n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2pbw h TYR 16 N 1.19 -0.16 -3.25 0.54 0.05 -0.72 -1.51 116.97 113.12 2pbw h TYR 16 Ca 0.27 -0.00 -0.43 0.00 0.05 0.00 0.00 58.73 58.62 2pbw h TYR 16 Cb 1.88 0.05 -0.39 0.00 1.01 0.00 0.00 36.73 39.28 2pbw h TYR 16 CO 1.08 0.31 -0.75 0.08 -1.05 0.00 0.00 178.16 177.83 2pbw s VAL 17 N -3.26 0.16 0.04 -2.88 1.01 -0.46 -1.30 120.40 113.71 2pbw s VAL 17 Ca -0.13 0.11 -0.00 0.00 0.00 0.00 0.00 61.98 61.96 2pbw s VAL 17 Cb 0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 2pbw s VAL 17 CO 0.49 0.10 -0.03 -0.04 0.00 0.00 0.00 175.10 175.61 2pbw s MET 18 N 2.05 0.51 0.07 2.72 -1.94 0.20 -1.15 119.30 121.77 2pbw s MET 18 Ca 0.04 -0.99 -0.31 0.00 -1.71 0.00 0.00 55.69 52.72 2pbw s MET 18 Cb -0.13 0.13 -0.06 0.00 2.01 0.00 0.00 34.83 36.78 2pbw s MET 18 CO -0.05 -0.08 1.21 0.71 -0.01 0.00 0.00 175.02 176.80 2pbw s TYR 19 N -2.91 3.43 0.93 -0.03 4.12 -1.26 -0.59 117.35 121.04 2pbw s TYR 19 Ca -0.02 1.29 -0.11 0.00 0.02 0.00 0.00 57.07 58.25 2pbw s TYR 19 Cb 0.01 -3.43 0.15 0.00 -1.52 0.00 0.00 41.96 37.16 2pbw s TYR 19 CO -0.06 -1.32 1.09 1.03 0.02 0.00 0.00 175.55 176.31 2pbw s ARG 20 N 1.00 0.97 -0.26 -0.62 0.52 0.10 -4.85 118.95 115.82 2pbw s ARG 20 Ca 0.59 1.04 -0.11 0.00 -0.52 0.00 0.00 55.73 56.73 2pbw s ARG 20 Cb -0.30 -1.76 -0.05 0.00 0.52 0.00 0.00 34.95 33.36 2pbw s ARG 20 CO 0.30 -2.50 0.17 0.15 0.02 0.00 0.00 175.30 173.43 2pbw s LYS 21 N -4.79 3.97 -0.05 3.54 -0.14 -1.26 -5.01 119.74 116.00 2pbw s LYS 21 Ca 0.65 -0.32 -0.21 0.00 -1.36 0.00 0.00 55.97 54.74 2pbw s LYS 21 Cb -0.20 -3.59 0.04 0.00 -1.68 0.00 0.00 37.83 32.40 2pbw s LYS 21 CO 0.58 -0.10 0.46 0.45 -0.76 0.00 0.00 175.35 175.99 2pbw s SER 22 N 1.50 -0.39 0.42 2.83 0.15 -1.26 -5.04 113.70 111.91 2pbw s SER 22 Ca 0.07 0.42 0.23 0.00 0.70 0.00 0.00 55.95 57.37 2pbw s SER 22 Cb -0.15 0.48 0.83 0.00 -1.71 0.00 0.00 66.02 65.48 2pbw s SER 22 CO 0.08 -0.47 1.79 -2.24 1.20 0.00 0.00 173.24 173.61 2pbw h ASP 23 N 3.77 0.00 -1.89 5.45 2.03 -2.07 -3.45 116.42 120.26 2pbw h ASP 23 Ca -0.28 0.00 -0.59 0.00 -0.73 0.00 0.00 57.03 55.42 2pbw h ASP 23 Cb 1.16 0.00 -0.11 0.00 -0.83 0.00 0.00 39.33 39.55 2pbw h ASP 23 CO 0.37 0.26 -0.62 -1.59 -1.03 0.00 0.00 179.24 176.63 2pbw s LYS 24 N -3.61 2.03 0.35 4.15 0.00 -1.26 -5.10 119.74 116.30 2pbw s LYS 24 Ca 0.01 -1.81 -0.28 0.00 0.00 0.00 0.00 55.97 53.88 2pbw s LYS 24 Cb 0.10 -1.87 -0.12 0.00 0.00 0.00 0.00 37.83 35.94 2pbw s LYS 24 CO 0.65 0.11 1.46 -2.30 0.00 0.00 0.00 175.35 175.27 2pbw n PRO 25 N -0.94 2.53 -4.03 1.78 -0.02 -1.26 -5.01 135.00 128.06 2pbw n PRO 25 Ca -0.04 0.89 -0.28 0.00 -2.02 0.00 0.00 63.50 62.04 2pbw n PRO 25 Cb 0.63 -2.60 -0.05 0.00 -0.02 0.00 0.00 33.50 31.46 2pbw n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2pbw s LEU 26 N -1.46 3.94 0.13 2.45 1.43 -1.26 -5.13 118.68 118.79 2pbw s LEU 26 Ca 0.56 0.01 0.05 0.00 -1.03 0.00 0.00 54.13 53.72 2pbw s LEU 26 Cb -0.51 -2.58 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 2pbw s LEU 26 CO 0.60 0.12 -0.11 -0.31 0.23 0.00 0.00 176.35 176.88 2pbw s TYR 27 N -1.58 1.25 0.00 0.29 1.51 -1.26 -4.83 117.35 112.73 2pbw s TYR 27 Ca 0.31 -0.69 0.00 0.00 -1.01 0.00 0.00 57.07 55.68 2pbw s TYR 27 Cb -0.11 -0.65 0.00 0.00 -0.11 0.00 0.00 41.96 41.09 2pbw s TYR 27 CO 0.24 0.08 0.00 0.41 -1.11 0.00 0.00 175.55 175.17 2pbw n GLY 28 N 0.13 1.35 0.26 0.71 0.00 -1.26 -2.45 105.19 103.92 2pbw n GLY 28 Ca -0.13 -0.54 0.17 0.00 0.00 0.00 0.00 46.02 45.53 2pbw n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2pbw h ASN 29 N 7.02 0.00 0.42 1.61 2.35 -1.93 -1.83 115.58 123.22 2pbw h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2pbw h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2pbw h ASN 29 CO 0.00 0.00 0.00 -0.67 -1.65 0.00 0.00 177.43 175.11 2pbw n ASP 30 N -2.81 0.28 0.18 5.81 2.03 -1.03 -2.19 116.55 118.83 2pbw n ASP 30 Ca -0.01 0.58 0.06 0.00 0.52 0.00 0.00 54.79 55.95 2pbw n ASP 30 Cb 0.17 -0.64 0.28 0.00 -0.72 0.00 0.00 41.12 40.22 2pbw n ASP 30 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 2pbw h ARG 31 N 0.00 0.00 -6.15 -0.67 3.08 -1.36 -3.44 114.38 105.84 2pbw h ARG 31 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 2pbw h ARG 31 Cb 0.21 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.15 2pbw h ARG 31 CO 0.00 0.37 -0.66 -0.06 -1.07 0.00 0.00 179.97 178.55 2pbw s PHE 32 N -3.43 2.56 0.16 3.04 0.40 -0.93 -0.72 117.98 119.06 2pbw s PHE 32 Ca 0.01 -0.31 -0.18 0.00 -0.60 0.00 0.00 56.93 55.86 2pbw s PHE 32 Cb 0.10 -1.24 0.04 0.00 0.51 0.00 0.00 43.02 42.43 2pbw s PHE 32 CO 0.69 0.60 0.48 -1.83 0.70 0.00 0.00 175.22 175.85 2pbw s GLU 33 N -3.65 1.22 0.00 0.44 -1.05 0.25 -4.74 118.70 111.17 2pbw s GLU 33 Ca 0.32 -0.74 0.00 0.00 -0.15 0.00 0.00 54.97 54.40 2pbw s GLU 33 Cb -0.04 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.15 2pbw s GLU 33 CO 0.19 -0.51 0.00 0.41 0.95 0.00 0.00 175.26 176.30 2pbw n GLY 34 N -0.29 1.65 0.23 -3.83 0.00 -1.26 -0.62 105.19 101.07 2pbw n GLY 34 Ca -0.14 -1.91 -0.02 0.00 0.00 0.00 0.00 46.02 43.95 2pbw n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2pbw h TYR 35 N 0.00 0.54 -0.09 1.61 5.03 -1.02 -1.48 116.97 121.56 2pbw h TYR 35 Ca 0.00 0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.25 2pbw h TYR 35 Cb 0.00 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 38.11 2pbw h TYR 35 CO 0.00 0.24 -0.35 0.00 -1.32 0.00 0.00 178.16 176.73 2pbw h LEU 37 N 0.16 0.64 -0.35 0.00 -0.00 -1.57 0.11 115.31 114.29 2pbw h LEU 37 Ca 0.02 -0.32 -0.07 0.00 -0.00 0.00 0.00 57.88 57.51 2pbw h LEU 37 Cb 0.69 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 41.16 2pbw h LEU 37 CO 0.05 1.03 -0.04 0.44 -0.00 0.00 0.00 178.44 179.92 2pbw h ASP 38 N 0.46 0.65 -0.10 -0.43 3.45 -0.73 -1.34 116.42 118.38 2pbw h ASP 38 Ca 0.02 -0.34 -0.00 0.00 0.43 0.00 0.00 57.03 57.14 2pbw h ASP 38 Cb 1.04 -0.18 -0.00 0.00 -0.56 0.00 0.00 39.33 39.63 2pbw h ASP 38 CO 0.10 0.83 0.06 0.25 -1.57 0.00 0.00 179.24 178.91 2pbw h LEU 39 N 0.45 0.12 -0.73 1.55 5.85 -0.54 -2.07 115.31 119.94 2pbw h LEU 39 Ca 0.09 -0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.84 2pbw h LEU 39 Cb 0.53 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.46 2pbw h LEU 39 CO 0.03 0.15 0.39 0.25 -0.34 0.00 0.00 178.44 178.92 2pbw h LEU 40 N 0.09 0.54 -0.85 2.25 5.85 -0.65 0.57 115.31 123.11 2pbw h LEU 40 Ca 0.04 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.73 2pbw h LEU 40 Cb 0.05 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2pbw h LEU 40 CO -0.01 0.32 -0.35 0.07 -0.34 0.00 0.00 178.44 178.13 2pbw h LYS 41 N 0.67 0.00 -0.16 1.25 5.09 -1.07 -0.40 116.57 121.95 2pbw h LYS 41 Ca 0.35 0.00 -0.10 0.00 0.09 0.00 0.00 60.65 60.99 2pbw h LYS 41 Cb 0.32 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.65 2pbw h LYS 41 CO -0.24 0.35 -0.29 0.93 -2.09 0.00 0.00 179.45 178.11 2pbw h GLU 42 N 0.00 0.48 -0.77 0.07 4.39 -0.44 -2.07 114.58 116.24 2pbw h GLU 42 Ca -0.00 -0.30 -0.05 0.00 0.34 0.00 0.00 59.36 59.35 2pbw h GLU 42 Cb 0.92 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.57 2pbw h GLU 42 CO 0.05 0.90 0.29 -0.07 -1.16 0.00 0.00 179.01 179.02 2pbw h LEU 43 N 0.11 1.07 -1.39 1.33 3.38 -0.77 -2.09 115.31 116.95 2pbw h LEU 43 Ca 0.01 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 2pbw h LEU 43 Cb 0.87 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2pbw h LEU 43 CO 0.06 0.96 -0.27 0.77 0.09 0.00 0.00 178.44 180.05 2pbw h SER 44 N 1.12 0.05 -0.11 -0.43 4.64 -1.01 0.31 113.55 118.12 2pbw h SER 44 Ca 0.25 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.48 2pbw h SER 44 Cb 0.23 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2pbw h SER 44 CO -0.02 0.33 -0.24 0.78 -0.87 0.00 0.00 176.83 176.80 2pbw h ASN 45 N 0.05 0.40 -0.01 4.97 2.35 -0.90 0.31 115.58 122.74 2pbw h ASN 45 Ca 0.01 -0.57 -0.00 0.00 -0.55 0.00 0.00 56.30 55.18 2pbw h ASN 45 Cb 0.51 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 2pbw h ASN 45 CO 0.04 0.90 0.00 0.40 -1.65 0.00 0.00 177.43 177.12 2pbw h ILE 46 N -0.08 1.18 0.00 2.81 2.04 -1.14 -3.21 117.51 119.10 2pbw h ILE 46 Ca 0.00 -0.52 -0.03 0.00 1.00 0.00 0.00 64.86 65.30 2pbw h ILE 46 Cb 0.84 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 2pbw h ILE 46 CO 0.05 0.14 -0.50 -0.07 0.00 0.00 0.00 178.15 177.77 2pbw h LEU 47 N -0.20 0.00 -2.70 1.44 4.07 -1.04 -3.49 115.31 113.39 2pbw h LEU 47 Ca 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.89 2pbw h LEU 47 Cb 0.22 0.00 0.05 0.00 1.08 0.00 0.00 40.66 42.02 2pbw h LEU 47 CO -0.00 0.14 -0.24 0.61 -1.08 0.00 0.00 178.44 177.88 2pbw n GLY 48 N 1.17 0.32 3.17 0.83 0.00 0.10 -5.05 105.19 105.74 2pbw n GLY 48 Ca 0.01 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 2pbw n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2pbw s PHE 49 N -3.11 0.90 0.24 1.61 -0.12 -1.00 -5.05 117.98 111.45 2pbw s PHE 49 Ca 0.11 -0.92 0.05 0.00 -0.05 0.00 0.00 56.93 56.12 2pbw s PHE 49 Cb -0.01 -0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 41.82 2pbw s PHE 49 CO 0.21 -0.15 0.33 -0.51 -0.05 0.00 0.00 175.22 175.04 2pbw s LEU 50 N -3.05 4.23 -0.00 -1.99 1.43 -1.26 -4.77 118.68 113.27 2pbw s LEU 50 Ca 0.12 0.02 -0.23 0.00 -1.03 0.00 0.00 54.13 53.02 2pbw s LEU 50 Cb 0.05 -2.78 0.05 0.00 0.03 0.00 0.00 46.19 43.55 2pbw s LEU 50 CO -0.04 -0.06 0.50 -0.72 0.23 0.00 0.00 176.35 176.26 2pbw s TYR 51 N -1.99 -0.42 -0.24 0.29 1.13 -1.26 -0.70 117.35 114.17 2pbw s TYR 51 Ca 0.34 0.60 0.00 0.00 -1.41 0.00 0.00 57.07 56.60 2pbw s TYR 51 Cb -0.09 0.28 0.03 0.00 -1.10 0.00 0.00 41.96 41.09 2pbw s TYR 51 CO 0.28 -0.55 -0.10 -0.51 -2.51 0.00 0.00 175.55 172.15 2pbw s ASP 52 N -1.54 4.08 0.13 -0.18 1.01 -0.34 -4.90 116.67 114.93 2pbw s ASP 52 Ca -0.09 -0.96 -0.30 0.00 0.71 0.00 0.00 52.55 51.91 2pbw s ASP 52 Cb -0.02 -1.59 -0.07 0.00 1.01 0.00 0.00 42.92 42.25 2pbw s ASP 52 CO 0.04 -0.11 1.10 -0.69 0.21 0.00 0.00 175.17 175.71 2pbw s VAL 53 N 1.26 4.05 -0.05 -1.27 1.01 -1.26 -1.25 120.40 122.89 2pbw s VAL 53 Ca -0.01 1.66 -0.02 0.00 0.00 0.00 0.00 61.98 63.61 2pbw s VAL 53 Cb -0.17 -4.06 0.03 0.00 0.00 0.00 0.00 36.38 32.18 2pbw s VAL 53 CO -0.07 0.23 0.04 -0.75 0.00 0.00 0.00 175.10 174.56 2pbw s LYS 54 N 0.12 0.09 0.25 2.72 2.20 0.76 -4.80 119.74 121.08 2pbw s LYS 54 Ca 0.52 0.31 -0.30 0.00 -0.36 0.00 0.00 55.97 56.13 2pbw s LYS 54 Cb -0.28 -0.61 -0.10 0.00 -1.51 0.00 0.00 37.83 35.33 2pbw s LYS 54 CO 0.32 -0.32 1.45 -0.51 -0.36 0.00 0.00 175.35 175.94 2pbw s LEU 55 N 2.07 4.38 0.09 5.43 1.43 -1.26 -2.03 118.68 128.79 2pbw s LEU 55 Ca 0.04 2.69 -0.31 0.00 -1.03 0.00 0.00 54.13 55.52 2pbw s LEU 55 Cb -0.12 -3.62 -0.10 0.00 0.03 0.00 0.00 46.19 42.37 2pbw s LEU 55 CO -0.03 -0.71 1.90 0.55 0.23 0.00 0.00 176.35 178.28 2pbw n VAL 56 N 2.30 0.53 -0.27 -1.59 3.14 0.14 -4.84 118.33 117.73 2pbw n VAL 56 Ca 0.07 -0.10 0.01 0.00 -2.96 0.00 0.00 64.34 61.37 2pbw n VAL 56 Cb 0.40 -2.21 0.09 0.00 -1.06 0.00 0.00 33.84 31.06 2pbw n VAL 56 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 2pbw h PRO 57 N 9.39 -0.01 -0.01 1.45 0.11 -1.91 -0.98 132.00 140.04 2pbw h PRO 57 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2pbw h PRO 57 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2pbw h PRO 57 CO 0.95 -0.01 -0.03 -0.40 -0.21 0.00 0.00 178.00 178.30 2pbw n ASP 58 N -5.50 0.73 -1.95 -2.05 5.75 -1.26 -4.94 116.55 107.33 2pbw n ASP 58 Ca 0.10 -1.12 -0.18 0.00 -0.01 0.00 0.00 54.79 53.58 2pbw n ASP 58 Cb 0.39 -0.01 -0.02 0.00 -1.03 0.00 0.00 41.12 40.45 2pbw n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pbw n GLY 59 N 1.13 -0.00 3.43 6.12 0.00 -0.37 -4.99 105.19 110.50 2pbw n GLY 59 Ca 0.20 -0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 2pbw n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pbw s LYS 60 N -4.67 1.55 -0.05 1.61 1.02 -1.26 -5.04 119.74 112.90 2pbw s LYS 60 Ca 0.00 -1.35 -0.26 0.00 0.02 0.00 0.00 55.97 54.38 2pbw s LYS 60 Cb 0.00 -1.95 -0.21 0.00 -0.52 0.00 0.00 37.83 35.15 2pbw s LYS 60 CO 0.00 0.44 1.14 1.88 -0.92 0.00 0.00 175.35 177.89 2pbw h TYR 61 N 3.63 0.07 0.00 3.18 -1.99 -1.93 -2.06 116.97 117.87 2pbw h TYR 61 Ca -0.49 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.21 2pbw h TYR 61 Cb 1.18 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.90 2pbw h TYR 61 CO 0.62 0.67 0.00 0.41 -0.00 0.00 0.00 178.16 179.87 2pbw n GLY 62 N 0.62 3.10 3.20 3.88 0.00 -1.26 -1.60 105.19 113.13 2pbw n GLY 62 Ca -0.09 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 2pbw n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pbw s ALA 63 N 0.00 0.84 -0.05 4.61 0.00 -1.26 -4.91 121.76 121.00 2pbw s ALA 63 Ca 0.00 -1.47 0.04 0.00 0.00 0.00 0.00 51.96 50.53 2pbw s ALA 63 Cb 0.00 1.04 -0.03 0.00 0.00 0.00 0.00 23.12 24.13 2pbw s ALA 63 CO 0.00 -0.55 -0.14 1.14 0.00 0.00 0.00 175.76 176.21 2pbw s GLN 64 N -4.08 2.50 1.00 0.00 -2.07 -1.26 -2.23 119.66 113.52 2pbw s GLN 64 Ca 0.28 -0.70 -0.17 0.00 -1.82 0.00 0.00 55.36 52.95 2pbw s GLN 64 Cb 0.07 -2.38 0.23 0.00 -1.09 0.00 0.00 33.01 29.83 2pbw s GLN 64 CO 0.05 0.62 1.35 0.54 -1.32 0.00 0.00 175.29 176.53 2pbw s ASN 65 N -0.78 2.80 0.54 12.60 2.20 -0.29 -4.85 114.94 127.17 2pbw s ASN 65 Ca 0.12 0.17 0.24 0.00 -0.94 0.00 0.00 52.86 52.45 2pbw s ASN 65 Cb -0.11 -0.12 1.43 0.00 -2.00 0.00 0.00 41.25 40.46 2pbw s ASN 65 CO 0.01 -2.92 2.05 0.44 -2.94 0.00 0.00 177.10 173.73 2pbw h ASP 66 N -1.78 0.00 0.17 3.54 3.32 -2.00 0.17 116.42 119.84 2pbw h ASP 66 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2pbw h ASP 66 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2pbw h ASP 66 CO 0.32 0.00 -0.07 0.29 -1.72 0.00 0.00 179.24 178.06 2pbw n LYS 67 N -4.25 1.04 -0.64 3.56 5.02 -1.26 -4.92 118.16 116.70 2pbw n LYS 67 Ca 0.05 -0.42 0.00 0.00 -2.02 0.00 0.00 58.31 55.92 2pbw n LYS 67 Cb 0.43 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 2pbw n LYS 67 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pbw n GLY 68 N 1.20 0.64 3.85 0.72 0.00 0.60 -5.06 105.19 107.15 2pbw n GLY 68 Ca 0.17 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 2pbw n GLY 68 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2pbw s GLU 69 N -0.80 3.77 0.27 1.61 2.12 -1.26 -4.80 118.70 119.62 2pbw s GLU 69 Ca 0.00 0.23 -0.03 0.00 0.36 0.00 0.00 54.97 55.53 2pbw s GLU 69 Cb 0.00 -3.18 -0.05 0.00 0.26 0.00 0.00 34.13 31.17 2pbw s GLU 69 CO 0.00 0.69 0.50 -1.58 -0.54 0.00 0.00 175.26 174.34 2pbw s TRP 70 N -1.12 3.48 0.00 5.30 0.52 -1.26 -1.13 118.94 124.73 2pbw s TRP 70 Ca 0.23 0.51 0.00 0.00 0.02 0.00 0.00 56.10 56.87 2pbw s TRP 70 Cb -0.15 -2.00 0.00 0.00 -1.15 0.00 0.00 33.47 30.17 2pbw s TRP 70 CO 0.12 0.23 0.00 0.27 0.02 0.00 0.00 176.95 177.59 2pbw n ASN 71 N -0.97 1.33 0.00 2.95 0.23 -0.94 -4.69 115.26 113.17 2pbw n ASN 71 Ca -0.03 -0.96 0.00 0.00 -0.53 0.00 0.00 54.58 53.06 2pbw n ASN 71 Cb 0.54 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.24 2pbw n ASN 71 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2pbw n GLY 72 N 3.32 0.87 0.37 4.83 0.00 -1.26 -1.55 105.19 111.77 2pbw n GLY 72 Ca 0.00 -0.71 0.05 0.00 0.00 0.00 0.00 46.02 45.36 2pbw n GLY 72 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2pbw h MET 73 N 0.00 1.05 -0.71 1.61 2.86 -0.54 -0.38 114.93 118.82 2pbw h MET 73 Ca 0.00 -0.06 0.03 0.00 -2.06 0.00 0.00 59.70 57.61 2pbw h MET 73 Cb 0.00 -0.24 -0.04 0.00 0.06 0.00 0.00 31.60 31.38 2pbw h MET 73 CO 0.00 0.69 0.45 0.28 1.06 0.00 0.00 176.91 179.39 2pbw h VAL 74 N 1.08 1.10 -0.47 -2.22 2.07 -1.47 -1.48 116.25 114.86 2pbw h VAL 74 Ca 0.47 -0.30 -0.11 0.00 0.82 0.00 0.00 66.70 67.58 2pbw h VAL 74 Cb 0.34 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2pbw h VAL 74 CO -0.22 0.16 -0.13 0.50 0.02 0.00 0.00 177.57 177.90 2pbw h LYS 75 N 0.87 0.87 -0.74 1.57 1.63 -0.11 -1.21 116.57 119.45 2pbw h LYS 75 Ca 0.28 -0.31 0.03 0.00 -0.85 0.00 0.00 60.65 59.80 2pbw h LYS 75 Cb 0.01 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 31.54 2pbw h LYS 75 CO -0.11 0.95 0.47 0.93 -3.45 0.00 0.00 179.45 178.24 2pbw h GLU 76 N 0.78 0.90 -0.28 1.90 4.39 -0.37 -1.39 114.58 120.50 2pbw h GLU 76 Ca 0.12 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.70 2pbw h GLU 76 Cb 0.65 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 2pbw h GLU 76 CO 0.05 0.59 -0.08 -0.07 -1.16 0.00 0.00 179.01 178.34 2pbw h LEU 77 N 0.92 0.55 -1.01 1.33 3.38 -1.00 0.30 115.31 119.79 2pbw h LEU 77 Ca 0.29 -0.37 0.08 0.00 0.09 0.00 0.00 57.88 57.97 2pbw h LEU 77 Cb -0.00 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.53 2pbw h LEU 77 CO -0.10 0.79 0.65 0.40 0.09 0.00 0.00 178.44 180.27 2pbw h ILE 78 N 0.30 1.06 -0.32 1.22 2.04 -0.76 -1.09 117.51 119.96 2pbw h ILE 78 Ca 0.07 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.54 2pbw h ILE 78 Cb 0.56 -0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 2pbw h ILE 78 CO 0.03 0.21 0.00 0.47 0.00 0.00 0.00 178.15 178.86 2pbw n ASP 79 N -4.52 1.80 -3.12 1.72 8.00 -0.57 -4.92 116.55 114.95 2pbw n ASP 79 Ca 0.16 -1.95 -0.23 0.00 0.71 0.00 0.00 54.79 53.48 2pbw n ASP 79 Cb 0.21 -0.21 0.04 0.00 -0.02 0.00 0.00 41.12 41.14 2pbw n ASP 79 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2pbw n HIS 80 N 0.47 -2.08 1.11 1.24 8.25 -0.41 -4.87 115.22 118.93 2pbw n HIS 80 Ca 0.12 0.59 0.12 0.00 -0.26 0.00 0.00 57.72 58.29 2pbw n HIS 80 Cb 0.30 -4.49 0.26 0.00 1.12 0.00 0.00 29.99 27.17 2pbw n HIS 80 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2pbw n ARG 81 N -4.16 0.49 -3.81 -0.41 1.74 0.07 -4.88 116.66 105.70 2pbw n ARG 81 Ca -0.09 -0.31 -0.12 0.00 -0.77 0.00 0.00 57.85 56.56 2pbw n ARG 81 Cb 0.61 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 30.47 2pbw n ARG 81 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2pbw s ALA 82 N -2.73 -0.56 -0.12 7.54 0.00 -1.20 -4.92 121.76 119.78 2pbw s ALA 82 Ca 0.18 0.04 0.05 0.00 0.00 0.00 0.00 51.96 52.23 2pbw s ALA 82 Cb 0.18 0.15 -0.24 0.00 0.00 0.00 0.00 23.12 23.22 2pbw s ALA 82 CO 0.62 -0.28 0.36 -0.25 0.00 0.00 0.00 175.76 176.21 2pbw n ASP 83 N 1.14 1.34 -4.12 0.00 8.00 0.29 -4.58 116.55 118.63 2pbw n ASP 83 Ca -0.21 0.21 -0.11 0.00 0.71 0.00 0.00 54.79 55.40 2pbw n ASP 83 Cb 0.57 -0.25 -0.10 0.00 -0.02 0.00 0.00 41.12 41.32 2pbw n ASP 83 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2pbw s LEU 84 N -6.40 2.43 -0.20 0.64 1.43 -1.10 -4.19 118.68 111.28 2pbw s LEU 84 Ca -0.16 -0.86 -0.00 0.00 -1.03 0.00 0.00 54.13 52.09 2pbw s LEU 84 Cb 0.07 -0.06 0.05 0.00 0.03 0.00 0.00 46.19 46.29 2pbw s LEU 84 CO 0.78 -0.40 -0.05 0.00 0.23 0.00 0.00 176.35 176.91 2pbw s ALA 85 N -2.94 1.67 -0.29 4.21 0.00 0.82 -0.97 121.76 124.25 2pbw s ALA 85 Ca 0.04 -1.07 0.02 0.00 0.00 0.00 0.00 51.96 50.95 2pbw s ALA 85 Cb 0.01 -1.27 0.07 0.00 0.00 0.00 0.00 23.12 21.92 2pbw s ALA 85 CO -0.04 -1.00 -0.04 0.08 0.00 0.00 0.00 175.76 174.76 2pbw s VAL 86 N 1.54 2.37 -0.01 0.00 1.01 -1.10 -0.43 120.40 123.78 2pbw s VAL 86 Ca -0.02 -1.78 -0.29 0.00 0.00 0.00 0.00 61.98 59.88 2pbw s VAL 86 Cb -0.17 -2.48 0.11 0.00 0.00 0.00 0.00 36.38 33.84 2pbw s VAL 86 CO -0.07 -0.20 1.28 0.00 0.00 0.00 0.00 175.10 176.11 2pbw s ALA 87 N 1.08 -2.31 -0.89 5.51 0.00 -1.26 -4.60 121.76 119.28 2pbw s ALA 87 Ca -0.03 0.42 -0.09 0.00 0.00 0.00 0.00 51.96 52.26 2pbw s ALA 87 Cb -0.20 0.57 -0.07 0.00 0.00 0.00 0.00 23.12 23.42 2pbw s ALA 87 CO -0.05 -1.09 2.07 -0.35 0.00 0.00 0.00 175.76 176.34 2pbw n PRO 88 N -0.65 1.98 -2.97 0.00 -0.04 -1.26 -4.67 135.00 127.40 2pbw n PRO 88 Ca -0.04 -1.54 -0.43 0.00 -0.04 0.00 0.00 63.50 61.44 2pbw n PRO 88 Cb 0.61 -2.55 -0.05 0.00 -0.04 0.00 0.00 33.50 31.48 2pbw n PRO 88 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2pbw s LEU 89 N 0.32 4.64 0.23 1.53 2.96 -1.26 -5.01 118.68 122.08 2pbw s LEU 89 Ca 0.43 -0.91 -0.32 0.00 -0.22 0.00 0.00 54.13 53.11 2pbw s LEU 89 Cb 0.11 -2.49 -0.12 0.00 0.50 0.00 0.00 46.19 44.18 2pbw s LEU 89 CO -0.01 -1.21 1.65 0.41 -1.32 0.00 0.00 176.35 175.87 2pbw n THR 90 N 5.85 0.37 -2.47 3.68 -1.04 -1.26 -3.05 114.28 116.35 2pbw n THR 90 Ca -0.04 -0.09 -0.42 0.00 -2.04 0.00 0.00 64.05 61.45 2pbw n THR 90 Cb 0.45 -1.88 -0.02 0.00 -1.82 0.00 0.00 70.33 67.06 2pbw n THR 90 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2pbw s ILE 91 N 0.70 3.96 0.25 12.58 1.01 -0.20 -4.94 121.20 134.56 2pbw s ILE 91 Ca 0.72 0.90 0.10 0.00 0.00 0.00 0.00 60.65 62.37 2pbw s ILE 91 Cb -0.54 -4.50 -0.05 0.00 0.01 0.00 0.00 42.46 37.38 2pbw s ILE 91 CO 0.39 -1.10 -0.17 0.42 0.00 0.00 0.00 174.94 174.49 2pbw s THR 92 N 5.31 2.13 0.13 2.92 -4.23 -1.26 -4.67 115.64 115.97 2pbw s THR 92 Ca 0.51 -2.31 -0.24 0.00 -1.18 0.00 0.00 61.69 58.47 2pbw s THR 92 Cb -0.10 -2.21 -0.04 0.00 1.34 0.00 0.00 72.50 71.50 2pbw s THR 92 CO 0.28 -0.47 1.65 0.22 -0.54 0.00 0.00 174.62 175.76 2pbw h TYR 93 N 2.38 -0.56 -0.38 3.99 3.20 -1.98 0.12 116.97 123.74 2pbw h TYR 93 Ca -0.39 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.47 2pbw h TYR 93 Cb 1.24 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.75 2pbw h TYR 93 CO 0.77 -0.29 0.10 -0.24 -1.64 0.00 0.00 178.16 176.85 2pbw h VAL 94 N -0.31 1.17 0.24 1.81 3.04 -2.00 -3.02 116.25 117.20 2pbw h VAL 94 Ca 0.08 -0.60 -0.33 0.00 -1.01 0.00 0.00 66.70 64.83 2pbw h VAL 94 Cb 0.41 0.77 0.04 0.00 -2.01 0.00 0.00 31.29 30.51 2pbw h VAL 94 CO -0.23 0.22 -1.44 0.03 -1.01 0.00 0.00 177.57 175.13 2pbw h ARG 95 N 0.55 0.55 0.00 4.17 3.08 -1.84 -3.29 114.38 117.61 2pbw h ARG 95 Ca 0.13 -0.92 0.00 0.00 0.07 0.00 0.00 59.98 59.26 2pbw h ARG 95 Cb 0.20 0.34 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2pbw h ARG 95 CO -0.00 1.44 0.00 1.49 -1.07 0.00 0.00 179.97 181.82 2pbw h GLU 96 N 0.14 0.00 0.00 0.04 4.57 -0.66 -1.15 114.58 117.52 2pbw h GLU 96 Ca -0.25 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 57.82 2pbw h GLU 96 Cb 2.14 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.71 2pbw h GLU 96 CO 0.27 0.00 -0.54 0.87 -1.18 0.00 0.00 179.01 178.44 2pbw h LYS 97 N 0.00 0.00 -0.00 1.92 1.57 -1.60 -3.35 116.57 115.11 2pbw h LYS 97 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2pbw h LYS 97 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2pbw h LYS 97 CO 0.00 0.54 -0.65 1.33 -0.57 0.00 0.00 179.45 180.09 2pbw n VAL 98 N -3.30 0.00 -3.91 0.50 0.24 -0.48 -5.01 118.33 106.36 2pbw n VAL 98 Ca 0.01 -0.17 -0.08 0.00 -2.04 0.00 0.00 64.34 62.05 2pbw n VAL 98 Cb 0.71 1.00 -0.08 0.00 -1.47 0.00 0.00 33.84 34.00 2pbw n VAL 98 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2pbw s ILE 99 N -2.30 0.16 -0.17 1.34 -4.36 -0.92 -4.48 121.20 110.46 2pbw s ILE 99 Ca 0.05 -1.29 -0.14 0.00 -0.26 0.00 0.00 60.65 59.01 2pbw s ILE 99 Cb 0.10 -1.34 -0.05 0.00 1.25 0.00 0.00 42.46 42.43 2pbw s ILE 99 CO 0.57 -0.71 0.29 -1.81 0.24 0.00 0.00 174.94 173.52 2pbw s ASP 100 N -2.81 6.41 0.05 4.36 1.01 -0.05 -4.43 116.67 121.22 2pbw s ASP 100 Ca 0.04 0.47 0.01 0.00 0.71 0.00 0.00 52.55 53.79 2pbw s ASP 100 Cb 0.05 -2.18 -0.04 0.00 1.01 0.00 0.00 42.92 41.76 2pbw s ASP 100 CO -0.10 0.07 0.11 -0.36 0.21 0.00 0.00 175.17 175.10 2pbw s PHE 101 N 0.63 3.29 0.82 4.23 0.08 -1.26 -0.71 117.98 125.05 2pbw s PHE 101 Ca 0.16 0.15 -0.10 0.00 0.12 0.00 0.00 56.93 57.26 2pbw s PHE 101 Cb -0.13 -1.68 0.13 0.00 -0.57 0.00 0.00 43.02 40.76 2pbw s PHE 101 CO 0.04 0.55 1.16 -1.54 -0.10 0.00 0.00 175.22 175.33 2pbw s SER 102 N -2.25 4.04 0.65 1.36 1.04 -0.60 -4.97 113.70 112.97 2pbw s SER 102 Ca 0.29 0.31 -0.17 0.00 0.48 0.00 0.00 55.95 56.87 2pbw s SER 102 Cb -0.12 -0.66 -0.00 0.00 0.10 0.00 0.00 66.02 65.33 2pbw s SER 102 CO 0.21 -2.13 1.17 -0.54 0.98 0.00 0.00 173.24 172.94 2pbw s LYS 103 N -5.54 2.68 0.41 4.02 -0.14 -1.26 -4.58 119.74 115.34 2pbw s LYS 103 Ca 0.67 1.67 -0.26 0.00 -1.36 0.00 0.00 55.97 56.68 2pbw s LYS 103 Cb -0.07 -1.91 -0.10 0.00 -1.68 0.00 0.00 37.83 34.07 2pbw s LYS 103 CO 0.49 -1.40 1.36 -0.35 -0.76 0.00 0.00 175.35 174.69 2pbw n PRO 104 N -2.16 2.19 0.00 -1.68 -0.04 -1.26 -4.61 135.00 127.43 2pbw n PRO 104 Ca 0.12 0.78 0.09 0.00 -0.04 0.00 0.00 63.50 64.45 2pbw n PRO 104 Cb 0.51 -2.50 0.04 0.00 -0.04 0.00 0.00 33.50 31.51 2pbw n PRO 104 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2pbw n PHE 105 N -0.01 0.00 -3.64 0.54 1.16 0.30 -4.91 117.46 110.90 2pbw n PHE 105 Ca 0.05 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.55 2pbw n PHE 105 Cb 0.39 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.19 2pbw n PHE 105 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 2pbw s MET 106 N -1.69 0.72 0.07 3.97 0.00 -1.24 -5.00 119.30 116.14 2pbw s MET 106 Ca 0.18 1.17 0.04 0.00 0.00 0.00 0.00 55.69 57.08 2pbw s MET 106 Cb 0.14 0.18 -0.04 0.00 0.00 0.00 0.00 34.83 35.12 2pbw s MET 106 CO 0.31 -0.14 -0.02 0.95 0.00 0.00 0.00 175.02 176.12 2pbw s THR 107 N 1.41 3.94 0.00 10.11 -4.23 -1.26 -0.77 115.64 124.84 2pbw s THR 107 Ca -0.08 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.50 2pbw s THR 107 Cb -0.05 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 70.95 2pbw s THR 107 CO -0.16 0.19 0.00 0.00 -0.54 0.00 0.00 174.62 174.11 2pbw n LEU 108 N 0.81 0.00 -3.82 4.79 -0.00 0.15 -4.91 117.00 114.02 2pbw n LEU 108 Ca -0.12 0.00 -0.08 0.00 -0.00 0.00 0.00 56.01 55.81 2pbw n LEU 108 Cb 0.52 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.92 2pbw n LEU 108 CO 0.37 0.00 0.44 -0.83 -0.00 0.00 0.00 177.39 177.37 2pbw s GLY 109 N -0.79 -0.11 -0.01 1.47 0.00 -1.26 0.26 107.32 106.88 2pbw s GLY 109 Ca 0.00 -0.26 -0.28 0.00 0.00 0.00 0.00 44.72 44.19 2pbw s GLY 109 CO 0.00 -0.10 0.89 -0.42 0.00 0.00 0.00 173.10 173.47 2pbw s ILE 110 N -3.91 4.89 0.01 0.90 1.01 -1.25 0.66 121.20 123.51 2pbw s ILE 110 Ca 0.11 1.87 0.00 0.00 0.00 0.00 0.00 60.65 62.63 2pbw s ILE 110 Cb -0.05 -4.23 -0.00 0.00 0.01 0.00 0.00 42.46 38.19 2pbw s ILE 110 CO 0.05 0.20 0.01 -0.24 0.00 0.00 0.00 174.94 174.96 2pbw n SER 111 N 3.75 -0.02 -4.22 3.58 2.88 0.16 -1.10 113.62 118.66 2pbw n SER 111 Ca 0.03 -1.05 -0.33 0.00 -1.33 0.00 0.00 58.87 56.19 2pbw n SER 111 Cb 0.51 0.05 -0.16 0.00 -0.75 0.00 0.00 64.21 63.85 2pbw n SER 111 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2pbw s ILE 112 N -2.10 2.27 -0.24 2.46 1.01 -1.24 -0.96 121.20 122.39 2pbw s ILE 112 Ca 0.01 -0.92 -0.09 0.00 0.00 0.00 0.00 60.65 59.65 2pbw s ILE 112 Cb 0.00 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 2pbw s ILE 112 CO 0.01 0.54 0.13 -0.22 0.00 0.00 0.00 174.94 175.40 2pbw s LEU 113 N 0.66 3.88 0.35 2.97 2.96 0.08 0.31 118.68 129.89 2pbw s LEU 113 Ca -0.10 0.00 -0.03 0.00 -0.22 0.00 0.00 54.13 53.78 2pbw s LEU 113 Cb -0.16 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 44.50 2pbw s LEU 113 CO 0.02 0.03 0.50 -0.47 -1.32 0.00 0.00 176.35 175.11 2pbw s TYR 114 N 1.23 1.02 0.45 5.38 5.04 -0.94 -0.93 117.35 128.60 2pbw s TYR 114 Ca 0.06 -1.28 -0.04 0.00 -2.44 0.00 0.00 57.07 53.38 2pbw s TYR 114 Cb -0.14 -0.03 -0.03 0.00 0.35 0.00 0.00 41.96 42.11 2pbw s TYR 114 CO 0.05 -1.18 0.73 -0.98 -1.34 0.00 0.00 175.55 172.84 2pbw s ARG 115 N -2.96 3.49 0.84 4.97 1.70 -1.26 -1.40 118.95 124.32 2pbw s ARG 115 Ca 0.30 0.04 -0.11 0.00 -0.47 0.00 0.00 55.73 55.49 2pbw s ARG 115 Cb -0.01 -2.44 0.09 0.00 -0.57 0.00 0.00 34.95 32.02 2pbw s ARG 115 CO 0.20 -0.14 1.09 0.15 -1.08 0.00 0.00 175.30 175.52 2pbw s LYS 116 N -4.65 1.76 -1.04 3.89 1.02 0.08 -4.38 119.74 116.42 2pbw s LYS 116 Ca 0.46 0.79 -0.03 0.00 0.02 0.00 0.00 55.97 57.21 2pbw s LYS 116 Cb -0.10 -1.87 0.00 0.00 -0.52 0.00 0.00 37.83 35.34 2pbw s LYS 116 CO 0.43 -1.89 0.39 0.41 -0.92 0.00 0.00 175.35 173.77 2pbw n GLY 117 N -1.55 -0.12 3.42 -3.33 0.00 -1.26 -5.04 105.19 97.30 2pbw n GLY 117 Ca 0.07 -0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 2pbw n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pbw s THR 118 N -2.95 2.24 -0.16 2.61 -4.23 -1.26 -5.03 115.64 106.86 2pbw s THR 118 Ca 0.19 -2.24 0.29 0.00 -1.18 0.00 0.00 61.69 58.76 2pbw s THR 118 Cb -0.09 -2.17 0.34 0.00 1.34 0.00 0.00 72.50 71.93 2pbw s THR 118 CO 0.24 -0.37 1.87 1.55 -0.54 0.00 0.00 174.62 177.37 2pbw h PRO 119 N 2.62 0.00 -6.81 3.99 0.13 -1.96 -3.45 132.00 126.52 2pbw h PRO 119 Ca -0.41 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.19 2pbw h PRO 119 Cb 1.24 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.44 2pbw h PRO 119 CO 0.57 0.00 0.83 0.42 -0.23 0.00 0.00 178.00 179.59 2pbw s ILE 120 N -3.51 2.24 0.00 -3.56 -1.09 -1.26 -4.90 121.20 109.12 2pbw s ILE 120 Ca 0.03 0.20 0.00 0.00 -2.23 0.00 0.00 60.65 58.65 2pbw s ILE 120 Cb 0.09 -3.13 0.00 0.00 -1.58 0.00 0.00 42.46 37.84 2pbw s ILE 120 CO 0.50 0.04 0.04 -0.67 -1.23 0.00 0.00 174.94 173.61 2pbw n ASP 121 N 1.97 0.00 -3.60 3.58 2.03 -1.26 -4.92 116.55 114.35 2pbw n ASP 121 Ca 0.07 -1.00 -0.10 0.00 0.52 0.00 0.00 54.79 54.28 2pbw n ASP 121 Cb 0.38 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.76 2pbw n ASP 121 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2pbw s SER 122 N 0.00 -0.44 0.54 1.67 1.04 -1.26 -3.30 113.70 111.95 2pbw s SER 122 Ca 0.00 -0.25 0.28 0.00 0.48 0.00 0.00 55.95 56.45 2pbw s SER 122 Cb 0.00 0.65 1.54 0.00 0.10 0.00 0.00 66.02 68.31 2pbw s SER 122 CO 0.00 -1.13 2.12 0.00 0.98 0.00 0.00 173.24 175.21 2pbw h ALA 123 N 2.00 1.35 -0.23 5.32 0.00 -1.97 -1.73 119.26 124.00 2pbw h ALA 123 Ca -0.28 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.39 2pbw h ALA 123 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2pbw h ALA 123 CO 0.32 0.11 -0.48 0.22 0.00 0.00 0.00 179.25 179.43 2pbw h ASP 124 N 0.00 0.82 -0.99 0.00 3.58 -1.95 -1.67 116.42 116.20 2pbw h ASP 124 Ca -0.00 -0.55 0.08 0.00 0.42 0.00 0.00 57.03 56.98 2pbw h ASP 124 Cb 0.25 -0.24 -0.07 0.00 1.72 0.00 0.00 39.33 41.00 2pbw h ASP 124 CO 0.01 1.22 0.64 0.44 -2.88 0.00 0.00 179.24 178.66 2pbw h ASP 125 N 0.46 0.99 -0.24 2.28 3.32 -1.71 -1.98 116.42 119.54 2pbw h ASP 125 Ca 0.01 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.98 2pbw h ASP 125 Cb 1.08 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.44 2pbw h ASP 125 CO 0.11 0.61 -0.20 -0.07 -1.72 0.00 0.00 179.24 177.97 2pbw h LEU 126 N 1.11 0.60 -1.63 1.55 3.38 -1.39 -3.21 115.31 115.71 2pbw h LEU 126 Ca 0.44 -0.45 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2pbw h LEU 126 Cb 0.25 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2pbw h LEU 126 CO -0.19 0.92 0.29 0.00 0.09 0.00 0.00 178.44 179.55 2pbw h ALA 127 N 0.69 1.81 0.00 1.53 0.00 -0.66 -2.59 119.26 120.04 2pbw h ALA 127 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2pbw h ALA 127 Cb 0.74 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2pbw h ALA 127 CO 0.05 0.14 0.00 1.63 0.00 0.00 0.00 179.25 181.07 2pbw n LYS 128 N -4.48 0.23 -4.24 0.00 5.02 -0.81 -4.89 118.16 109.00 2pbw n LYS 128 Ca 0.05 0.08 -0.22 0.00 -2.02 0.00 0.00 58.31 56.20 2pbw n LYS 128 Cb 0.14 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.58 2pbw n LYS 128 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2pbw n GLN 129 N -1.34 0.52 0.00 1.97 -0.00 -0.98 -5.07 117.38 112.48 2pbw n GLN 129 Ca 0.09 -3.27 0.00 0.00 -0.00 0.00 0.00 57.00 53.83 2pbw n GLN 129 Cb 0.20 2.09 0.00 0.00 -0.00 0.00 0.00 30.24 32.54 2pbw n GLN 129 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2pbw n THR 130 N -0.78 0.00 0.12 -0.39 -2.24 -1.26 -4.85 114.28 104.87 2pbw n THR 130 Ca -0.01 -0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.59 2pbw n THR 130 Cb 0.58 1.73 -0.08 0.00 -2.10 0.00 0.00 70.33 70.47 2pbw n THR 130 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2pbw h LYS 131 N 0.00 -0.29 -5.98 -0.78 1.79 -1.97 -3.40 116.57 105.93 2pbw h LYS 131 Ca 0.00 0.02 -0.58 0.00 -2.18 0.00 0.00 60.65 57.91 2pbw h LYS 131 Cb 0.37 0.07 -0.07 0.00 -1.58 0.00 0.00 32.23 31.01 2pbw h LYS 131 CO 0.00 0.03 0.67 0.42 -1.08 0.00 0.00 179.45 179.49 2pbw s ILE 132 N -4.77 4.74 0.38 1.86 1.01 -1.26 -5.02 121.20 118.14 2pbw s ILE 132 Ca -0.14 1.86 -0.18 0.00 0.00 0.00 0.00 60.65 62.19 2pbw s ILE 132 Cb 0.02 -4.24 -0.10 0.00 0.01 0.00 0.00 42.46 38.16 2pbw s ILE 132 CO 0.58 -0.13 0.85 -0.70 0.00 0.00 0.00 174.94 175.55 2pbw s GLU 133 N 3.00 4.12 -0.01 2.79 2.12 -1.04 -4.92 118.70 124.76 2pbw s GLU 133 Ca 0.41 0.91 -0.19 0.00 0.36 0.00 0.00 54.97 56.46 2pbw s GLU 133 Cb -0.15 -2.29 0.04 0.00 0.26 0.00 0.00 34.13 31.98 2pbw s GLU 133 CO 0.07 0.05 0.41 1.52 -0.54 0.00 0.00 175.26 176.77 2pbw s TYR 134 N -2.10 -0.29 0.00 5.30 -0.85 -1.26 -0.59 117.35 117.55 2pbw s TYR 134 Ca 0.58 0.42 0.00 0.00 -0.52 0.00 0.00 57.07 57.55 2pbw s TYR 134 Cb -0.10 0.19 0.00 0.00 0.38 0.00 0.00 41.96 42.43 2pbw s TYR 134 CO 0.15 -0.48 0.00 0.41 -1.52 0.00 0.00 175.55 174.11 2pbw n GLY 135 N 0.99 2.05 3.60 5.49 0.00 -0.91 -4.64 105.19 111.78 2pbw n GLY 135 Ca -0.20 -0.70 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 2pbw n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pbw s ALA 136 N -1.00 0.17 0.06 4.61 0.00 -1.26 -0.57 121.76 123.77 2pbw s ALA 136 Ca 0.00 -1.20 -0.31 0.00 0.00 0.00 0.00 51.96 50.46 2pbw s ALA 136 Cb 0.00 1.00 -0.07 0.00 0.00 0.00 0.00 23.12 24.05 2pbw s ALA 136 CO 0.00 -0.86 1.45 0.08 0.00 0.00 0.00 175.76 176.43 2pbw s VAL 137 N -2.95 3.42 0.15 0.00 1.01 -1.26 -1.70 120.40 119.08 2pbw s VAL 137 Ca 0.25 0.91 -0.31 0.00 0.00 0.00 0.00 61.98 62.82 2pbw s VAL 137 Cb -0.02 -3.58 -0.10 0.00 0.00 0.00 0.00 36.38 32.67 2pbw s VAL 137 CO 0.16 0.02 1.69 -0.60 0.00 0.00 0.00 175.10 176.38 2pbw s ARG 138 N 1.96 4.16 0.00 2.72 3.52 0.26 -2.26 118.95 129.31 2pbw s ARG 138 Ca 0.66 2.49 0.00 0.00 -0.13 0.00 0.00 55.73 58.75 2pbw s ARG 138 Cb -0.35 -3.30 0.00 0.00 -1.56 0.00 0.00 34.95 29.74 2pbw s ARG 138 CO 0.29 -0.73 0.00 -0.25 -0.81 0.00 0.00 175.30 173.80 2pbw n ASP 139 N 4.63 -2.70 -4.70 -2.12 8.00 -1.26 -4.97 116.55 113.43 2pbw n ASP 139 Ca 0.16 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.37 2pbw n ASP 139 Cb 0.38 -1.23 0.11 0.00 -0.02 0.00 0.00 41.12 40.35 2pbw n ASP 139 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2pbw s GLY 140 N -2.00 1.67 0.45 0.44 0.00 -0.96 -4.87 107.32 102.04 2pbw s GLY 140 Ca 0.00 -0.89 0.13 0.00 0.00 0.00 0.00 44.72 43.96 2pbw s GLY 140 CO 0.00 -0.34 2.02 1.76 0.00 0.00 0.00 173.10 176.54 2pbw h SER 141 N -1.09 0.09 -0.24 1.64 0.02 -1.95 -2.21 113.55 109.81 2pbw h SER 141 Ca -0.45 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.45 2pbw h SER 141 Cb 1.30 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 2pbw h SER 141 CO 0.57 0.20 -0.01 0.74 -1.14 0.00 0.00 176.83 177.18 2pbw h THR 142 N 0.10 1.26 -0.23 -2.27 2.02 -1.92 -1.49 112.91 110.37 2pbw h THR 142 Ca 0.02 -0.94 0.00 0.00 0.77 0.00 0.00 66.41 66.26 2pbw h THR 142 Cb 0.22 1.41 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 2pbw h THR 142 CO 0.01 0.29 0.15 -0.03 0.37 0.00 0.00 175.52 176.31 2pbw h MET 143 N 0.19 0.31 -0.99 6.66 -1.53 -1.68 -2.15 114.93 115.74 2pbw h MET 143 Ca 0.06 -0.02 0.12 0.00 -3.44 0.00 0.00 59.70 56.42 2pbw h MET 143 Cb 0.44 -0.07 -0.08 0.00 -0.55 0.00 0.00 31.60 31.34 2pbw h MET 143 CO 0.02 0.23 0.63 1.15 0.14 0.00 0.00 176.91 179.07 2pbw h THR 144 N 0.30 0.93 -0.14 -0.77 2.02 -1.29 0.07 112.91 114.03 2pbw h THR 144 Ca 0.08 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 66.97 2pbw h THR 144 Cb -0.01 -0.14 -0.04 0.00 -1.74 0.00 0.00 68.15 66.22 2pbw h THR 144 CO -0.02 0.18 -0.11 0.15 0.37 0.00 0.00 175.52 176.09 2pbw h PHE 145 N 0.98 -0.27 -0.09 3.16 3.57 -0.61 -0.89 116.94 122.78 2pbw h PHE 145 Ca 0.48 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.92 2pbw h PHE 145 Cb 0.48 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2pbw h PHE 145 CO -0.00 -0.17 -0.32 0.74 -2.23 0.00 0.00 178.31 176.33 2pbw h PHE 146 N -0.12 0.20 -0.52 0.41 0.04 -0.98 -1.44 116.94 114.52 2pbw h PHE 146 Ca 0.09 -0.04 -0.12 0.00 2.80 0.00 0.00 57.97 60.70 2pbw h PHE 146 Cb 0.25 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 2pbw h PHE 146 CO -0.24 0.48 -0.15 -0.22 -0.60 0.00 0.00 178.31 177.59 2pbw h LYS 147 N 0.16 1.01 0.00 1.51 3.64 -0.32 -3.24 116.57 119.32 2pbw h LYS 147 Ca 0.02 -0.39 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2pbw h LYS 147 Cb 0.65 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2pbw h LYS 147 CO 0.05 1.07 -0.84 1.63 -2.27 0.00 0.00 179.45 179.09 2pbw n LYS 148 N -4.13 0.33 -1.77 1.90 4.76 -0.41 -4.97 118.16 113.87 2pbw n LYS 148 Ca 0.01 0.05 -0.37 0.00 -2.87 0.00 0.00 58.31 55.13 2pbw n LYS 148 Cb 0.42 -1.66 0.06 0.00 -1.84 0.00 0.00 35.03 32.01 2pbw n LYS 148 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2pbw s SER 149 N -4.22 4.68 0.00 4.39 0.15 -0.55 -4.93 113.70 113.21 2pbw s SER 149 Ca 0.04 2.61 0.00 0.00 0.70 0.00 0.00 55.95 59.30 2pbw s SER 149 Cb 0.13 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.83 2pbw s SER 149 CO 0.76 -1.95 0.91 0.29 1.20 0.00 0.00 173.24 174.45 2pbw n LYS 150 N -1.84 2.37 -2.49 5.44 5.02 -1.26 -4.64 118.16 120.76 2pbw n LYS 150 Ca 0.15 -1.33 -0.42 0.00 -2.02 0.00 0.00 58.31 54.69 2pbw n LYS 150 Cb 0.48 -0.98 -0.03 0.00 -0.02 0.00 0.00 35.03 34.48 2pbw n LYS 150 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2pbw s ILE 151 N -0.83 4.25 0.14 -0.18 -1.09 -1.26 -4.89 121.20 117.34 2pbw s ILE 151 Ca 0.00 1.61 -0.32 0.00 -2.23 0.00 0.00 60.65 59.71 2pbw s ILE 151 Cb 0.00 -4.03 -0.09 0.00 -1.58 0.00 0.00 42.46 36.76 2pbw s ILE 151 CO 0.00 0.09 1.55 0.77 -1.23 0.00 0.00 174.94 176.12 2pbw h SER 152 N 6.96 -1.92 -1.00 3.58 4.64 -1.98 0.26 113.55 124.09 2pbw h SER 152 Ca -0.40 0.27 0.18 0.00 -0.47 0.00 0.00 61.79 61.37 2pbw h SER 152 Cb 1.20 0.81 -0.10 0.00 -0.31 0.00 0.00 62.40 64.00 2pbw h SER 152 CO 0.82 -0.36 0.62 0.74 -0.87 0.00 0.00 176.83 177.77 2pbw h THR 153 N -0.29 0.75 0.00 2.95 2.02 -2.00 0.13 112.91 116.46 2pbw h THR 153 Ca 0.10 -0.28 -0.15 0.00 0.77 0.00 0.00 66.41 66.85 2pbw h THR 153 Cb 0.55 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 2pbw h THR 153 CO -0.69 0.15 -0.71 1.88 0.37 0.00 0.00 175.52 176.52 2pbw h TYR 154 N 0.81 0.00 -0.44 3.16 0.05 -1.67 -2.36 116.97 116.53 2pbw h TYR 154 Ca 0.56 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 59.20 2pbw h TYR 154 Cb 0.82 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.55 2pbw h TYR 154 CO -0.00 0.71 -0.27 0.93 -1.05 0.00 0.00 178.16 178.47 2pbw h GLU 155 N 0.00 0.94 -0.30 4.88 5.08 0.14 -1.11 114.58 124.21 2pbw h GLU 155 Ca -0.01 -0.43 -0.06 0.00 -1.00 0.00 0.00 59.36 57.87 2pbw h GLU 155 Cb 1.51 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.73 2pbw h GLU 155 CO 0.09 1.09 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.94 2pbw h LYS 156 N 0.80 0.55 -0.40 2.33 3.64 -0.80 -1.34 116.57 121.35 2pbw h LYS 156 Ca 0.09 -0.19 -0.05 0.00 -1.27 0.00 0.00 60.65 59.23 2pbw h LYS 156 Cb 0.85 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 2pbw h LYS 156 CO 0.07 0.72 0.05 0.52 -2.27 0.00 0.00 179.45 178.55 2pbw h MET 157 N 0.33 0.61 -0.35 1.90 2.86 -1.31 -1.69 114.93 117.28 2pbw h MET 157 Ca 0.08 -0.12 -0.13 0.00 -2.06 0.00 0.00 59.70 57.47 2pbw h MET 157 Cb 0.49 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 2pbw h MET 157 CO 0.02 0.59 -0.32 2.35 1.06 0.00 0.00 176.91 180.61 2pbw h TRP 158 N 0.59 0.90 -0.79 -0.22 -0.00 -1.00 -0.11 115.95 115.31 2pbw h TRP 158 Ca 0.13 -0.24 0.06 0.00 -0.00 0.00 0.00 58.89 58.84 2pbw h TRP 158 Cb 0.29 -0.20 -0.06 0.00 -0.00 0.00 0.00 29.16 29.19 2pbw h TRP 158 CO 0.01 0.99 0.47 0.00 -0.00 0.00 0.00 178.44 179.92 2pbw h ALA 159 N 0.99 1.09 -0.11 2.65 0.00 -0.37 -0.70 119.26 122.80 2pbw h ALA 159 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 2pbw h ALA 159 Cb 0.86 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2pbw h ALA 159 CO 0.07 0.18 -0.34 0.35 0.00 0.00 0.00 179.25 179.51 2pbw h PHE 160 N 0.86 0.55 -0.65 0.00 3.04 -1.04 -2.78 116.94 116.92 2pbw h PHE 160 Ca 0.35 -0.22 0.02 0.00 3.98 0.00 0.00 57.97 62.09 2pbw h PHE 160 Cb 0.20 -0.09 -0.04 0.00 2.56 0.00 0.00 35.95 38.58 2pbw h PHE 160 CO -0.05 0.96 0.42 0.52 -2.02 0.00 0.00 178.31 178.14 2pbw h MET 161 N -0.01 0.82 0.00 1.11 2.86 -0.71 -2.83 114.93 116.18 2pbw h MET 161 Ca -0.01 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2pbw h MET 161 Cb 0.97 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.44 2pbw h MET 161 CO 0.07 0.54 -0.02 -1.13 1.06 0.00 0.00 176.91 177.43 2pbw n SER 162 N -4.66 0.59 -4.67 1.22 3.41 -0.30 -4.16 113.62 105.05 2pbw n SER 162 Ca 0.06 0.53 -0.29 0.00 -0.26 0.00 0.00 58.87 58.91 2pbw n SER 162 Cb 0.05 -0.68 0.17 0.00 -0.26 0.00 0.00 64.21 63.49 2pbw n SER 162 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2pbw s SER 163 N -4.09 2.76 -1.49 4.04 1.04 -1.05 -2.77 113.70 112.14 2pbw s SER 163 Ca 0.11 1.37 -0.06 0.00 0.48 0.00 0.00 55.95 57.86 2pbw s SER 163 Cb 0.14 -2.05 0.05 0.00 0.10 0.00 0.00 66.02 64.26 2pbw s SER 163 CO 0.58 -3.07 0.57 0.54 0.98 0.00 0.00 173.24 172.84 2pbw n ARG 164 N -4.15 -3.50 -2.41 4.02 1.74 -1.26 -0.95 116.66 110.14 2pbw n ARG 164 Ca 0.06 0.42 -0.19 0.00 -0.77 0.00 0.00 57.85 57.36 2pbw n ARG 164 Cb 0.56 -4.77 -0.01 0.00 -1.02 0.00 0.00 32.46 27.22 2pbw n ARG 164 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2pbw n GLN 165 N -4.42 -1.78 -2.99 5.56 6.02 -1.25 -2.31 117.38 116.21 2pbw n GLN 165 Ca -0.18 0.93 -0.22 0.00 -0.01 0.00 0.00 57.00 57.52 2pbw n GLN 165 Cb 0.62 -5.52 0.03 0.00 1.02 0.00 0.00 30.24 26.39 2pbw n GLN 165 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2pbw n GLN 166 N -2.93 -4.75 0.30 -1.09 6.02 -0.13 -4.86 117.38 109.94 2pbw n GLN 166 Ca -0.22 0.89 0.19 0.00 -0.01 0.00 0.00 57.00 57.85 2pbw n GLN 166 Cb 0.67 -5.71 0.95 0.00 1.02 0.00 0.00 30.24 27.17 2pbw n GLN 166 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2pbw h SER 167 N -1.34 0.00 1.00 1.08 4.64 -1.51 -1.95 113.55 115.47 2pbw h SER 167 Ca -0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 2pbw h SER 167 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2pbw h SER 167 CO 0.56 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 176.54 2pbw n ALA 168 N -2.13 2.17 -2.40 5.18 0.00 -1.26 -4.83 120.51 117.24 2pbw n ALA 168 Ca -0.02 -0.07 -0.27 0.00 0.00 0.00 0.00 53.44 53.09 2pbw n ALA 168 Cb 0.18 -1.43 -0.01 0.00 0.00 0.00 0.00 19.45 18.19 2pbw n ALA 168 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2pbw s LEU 169 N -3.40 3.82 0.20 0.00 1.43 -0.73 -3.65 118.68 116.35 2pbw s LEU 169 Ca 0.12 0.80 0.10 0.00 -1.03 0.00 0.00 54.13 54.11 2pbw s LEU 169 Cb 0.16 -3.70 -0.04 0.00 0.03 0.00 0.00 46.19 42.63 2pbw s LEU 169 CO 0.49 -0.42 -0.19 0.68 0.23 0.00 0.00 176.35 177.14 2pbw s VAL 170 N -2.48 2.03 0.19 -1.59 -7.23 -0.69 -4.93 120.40 105.71 2pbw s VAL 170 Ca 0.45 -2.08 0.01 0.00 -1.81 0.00 0.00 61.98 58.56 2pbw s VAL 170 Cb -0.10 -2.01 -0.09 0.00 0.56 0.00 0.00 36.38 34.73 2pbw s VAL 170 CO 0.39 -0.34 1.46 0.11 -0.31 0.00 0.00 175.10 176.41 2pbw h LYS 171 N 2.95 0.31 -3.52 4.82 1.57 -1.93 0.75 116.57 121.51 2pbw h LYS 171 Ca -0.42 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.07 2pbw h LYS 171 Cb 1.22 0.05 -0.09 0.00 0.08 0.00 0.00 32.23 33.49 2pbw h LYS 171 CO 0.54 0.90 -0.06 0.54 -0.57 0.00 0.00 179.45 180.80 2pbw s ASN 172 N -6.94 -0.13 0.22 0.86 2.20 -1.26 -4.59 114.94 105.30 2pbw s ASN 172 Ca -0.05 -0.81 -0.07 0.00 -0.94 0.00 0.00 52.86 50.99 2pbw s ASN 172 Cb 0.11 0.60 0.34 0.00 -2.00 0.00 0.00 41.25 40.30 2pbw s ASN 172 CO 0.82 -1.14 1.76 0.28 -2.94 0.00 0.00 177.10 175.88 2pbw h SER 173 N 2.23 0.37 -0.76 3.54 0.02 -1.99 -2.07 113.55 114.88 2pbw h SER 173 Ca -0.26 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 60.73 2pbw h SER 173 Cb 1.25 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.78 2pbw h SER 173 CO 0.35 0.20 0.34 0.44 -1.14 0.00 0.00 176.83 177.01 2pbw h ASP 174 N 0.52 1.01 -0.57 3.07 3.32 -1.99 0.65 116.42 122.43 2pbw h ASP 174 Ca 0.35 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 2pbw h ASP 174 Cb 0.42 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 2pbw h ASP 174 CO -0.30 0.88 0.19 -0.08 -1.72 0.00 0.00 179.24 178.21 2pbw h GLU 175 N 1.08 0.93 -0.36 3.56 4.81 -1.87 -1.15 114.58 121.58 2pbw h GLU 175 Ca 0.26 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 2pbw h GLU 175 Cb 0.16 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2pbw h GLU 175 CO -0.03 0.80 -0.01 0.78 -0.73 0.00 0.00 179.01 179.83 2pbw h GLY 176 N 1.02 0.69 0.96 1.92 0.00 -0.68 -1.14 103.07 105.84 2pbw h GLY 176 Ca 0.20 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2pbw h GLY 176 CO -0.01 0.47 0.21 -2.22 0.00 0.00 0.00 176.54 175.00 2pbw h ILE 177 N 0.45 1.19 -0.37 2.60 2.04 -0.61 -0.50 117.51 122.32 2pbw h ILE 177 Ca 0.10 -0.54 -0.06 0.00 1.00 0.00 0.00 64.86 65.36 2pbw h ILE 177 Cb 0.47 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 2pbw h ILE 177 CO 0.02 0.21 -0.02 1.56 0.00 0.00 0.00 178.15 179.92 2pbw h GLN 178 N 0.59 0.59 -0.29 2.37 1.08 -1.15 -0.69 115.11 117.61 2pbw h GLN 178 Ca 0.16 -0.14 -0.09 0.00 -1.45 0.00 0.00 58.65 57.12 2pbw h GLN 178 Cb 0.13 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.47 2pbw h GLN 178 CO -0.02 0.63 -0.20 -0.09 -0.95 0.00 0.00 178.83 178.19 2pbw h ARG 179 N 0.56 0.53 -0.31 1.46 2.43 -0.58 -1.06 114.38 117.42 2pbw h ARG 179 Ca 0.11 -0.19 -0.17 0.00 -0.81 0.00 0.00 59.98 58.92 2pbw h ARG 179 Cb 0.39 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2pbw h ARG 179 CO 0.02 0.71 -0.49 0.28 -1.51 0.00 0.00 179.97 178.98 2pbw h VAL 180 N 0.48 1.28 0.00 0.20 2.07 -0.39 -1.58 116.25 118.30 2pbw h VAL 180 Ca 0.08 -1.67 -0.06 0.00 0.82 0.00 0.00 66.70 65.87 2pbw h VAL 180 Cb 0.62 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 2pbw h VAL 180 CO 0.04 0.55 -0.28 -0.07 0.02 0.00 0.00 177.57 177.83 2pbw h LEU 181 N 0.65 0.00 0.00 2.57 3.38 -0.83 -3.36 115.31 117.72 2pbw h LEU 181 Ca 0.03 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.62 2pbw h LEU 181 Cb 1.09 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.77 2pbw h LEU 181 CO 0.11 0.28 -2.44 0.41 0.09 0.00 0.00 178.44 176.89 2pbw n THR 182 N -3.50 1.45 -4.35 0.22 -1.04 -0.43 -5.05 114.28 101.58 2pbw n THR 182 Ca -0.00 -0.59 -0.19 0.00 -2.04 0.00 0.00 64.05 61.23 2pbw n THR 182 Cb 0.44 -1.29 -0.03 0.00 -1.82 0.00 0.00 70.33 67.62 2pbw n THR 182 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2pbw n THR 183 N -3.19 0.00 -2.89 12.58 -2.24 -0.60 -5.04 114.28 112.91 2pbw n THR 183 Ca -0.44 -1.42 -0.44 0.00 -2.27 0.00 0.00 64.05 59.49 2pbw n THR 183 Cb 1.00 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 2pbw n THR 183 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2pbw n ASP 184 N -1.29 5.20 -3.96 3.42 2.03 -1.26 -4.66 116.55 116.04 2pbw n ASP 184 Ca -0.11 -2.99 -0.15 0.00 0.52 0.00 0.00 54.79 52.06 2pbw n ASP 184 Cb 0.38 -1.57 -0.14 0.00 -0.72 0.00 0.00 41.12 39.07 2pbw n ASP 184 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2pbw s TYR 185 N 1.57 0.42 -0.04 -0.67 5.04 -1.26 -2.50 117.35 119.92 2pbw s TYR 185 Ca 0.43 -0.13 0.04 0.00 -2.44 0.00 0.00 57.07 54.98 2pbw s TYR 185 Cb -0.02 -0.27 -0.03 0.00 0.35 0.00 0.00 41.96 42.00 2pbw s TYR 185 CO 0.01 -0.02 -0.16 0.00 -1.34 0.00 0.00 175.55 174.04 2pbw s ALA 186 N -0.25 2.61 -0.20 3.97 0.00 0.24 -4.45 121.76 123.69 2pbw s ALA 186 Ca 0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 51.96 50.92 2pbw s ALA 186 Cb -0.03 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 2pbw s ALA 186 CO -0.00 0.56 -0.08 -1.17 0.00 0.00 0.00 175.76 175.07 2pbw s LEU 187 N -0.81 2.78 -0.18 0.00 2.96 -0.10 -2.14 118.68 121.18 2pbw s LEU 187 Ca 0.12 -0.41 -0.29 0.00 -0.22 0.00 0.00 54.13 53.33 2pbw s LEU 187 Cb -0.11 -1.69 -0.00 0.00 0.50 0.00 0.00 46.19 44.89 2pbw s LEU 187 CO 0.01 0.01 1.15 -0.76 -1.32 0.00 0.00 176.35 175.44 2pbw s LEU 188 N 1.26 4.15 0.06 -0.68 2.01 0.26 -0.74 118.68 125.01 2pbw s LEU 188 Ca 0.03 1.55 -0.11 0.00 0.01 0.00 0.00 54.13 55.61 2pbw s LEU 188 Cb -0.14 -3.54 0.01 0.00 0.01 0.00 0.00 46.19 42.53 2pbw s LEU 188 CO -0.03 -0.69 0.24 -0.32 1.01 0.00 0.00 176.35 176.56 2pbw s MET 189 N 3.20 0.79 0.17 1.70 -2.45 -0.13 -4.56 119.30 118.03 2pbw s MET 189 Ca 0.50 -0.68 -0.31 0.00 -1.25 0.00 0.00 55.69 53.95 2pbw s MET 189 Cb -0.19 0.33 -0.09 0.00 1.25 0.00 0.00 34.83 36.14 2pbw s MET 189 CO 0.11 -0.25 1.44 -1.21 1.05 0.00 0.00 175.02 176.16 2pbw s GLU 190 N -2.98 4.29 0.30 4.11 2.02 -1.26 -0.66 118.70 124.52 2pbw s GLU 190 Ca -0.02 2.21 0.06 0.00 0.02 0.00 0.00 54.97 57.24 2pbw s GLU 190 Cb 0.01 -3.18 0.82 0.00 0.10 0.00 0.00 34.13 31.88 2pbw s GLU 190 CO -0.06 -0.45 1.67 0.66 0.02 0.00 0.00 175.26 177.10 2pbw h SER 191 N 6.14 0.28 -0.74 -0.19 4.64 -0.10 0.11 113.55 123.69 2pbw h SER 191 Ca -0.44 0.18 0.04 0.00 -0.47 0.00 0.00 61.79 61.10 2pbw h SER 191 Cb 1.21 0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 63.44 2pbw h SER 191 CO 0.84 -0.08 0.49 0.71 -0.87 0.00 0.00 176.83 177.92 2pbw h THR 192 N 0.32 1.10 -0.03 2.95 1.35 -1.91 -0.88 112.91 115.82 2pbw h THR 192 Ca 0.61 -0.31 -0.21 0.00 -0.55 0.00 0.00 66.41 65.95 2pbw h THR 192 Cb 1.25 0.14 -0.00 0.00 -1.73 0.00 0.00 68.15 67.80 2pbw h THR 192 CO -0.59 0.16 -0.87 0.28 -0.25 0.00 0.00 175.52 174.25 2pbw h SER 193 N 0.89 0.50 -0.60 5.36 0.02 -1.18 -2.88 113.55 115.66 2pbw h SER 193 Ca 0.30 -0.37 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 2pbw h SER 193 Cb 0.07 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2pbw h SER 193 CO -0.09 1.16 0.20 0.40 -1.14 0.00 0.00 176.83 177.36 2pbw h ILE 194 N 0.24 1.24 -0.38 3.27 2.04 -0.65 -1.37 117.51 121.90 2pbw h ILE 194 Ca -0.06 -0.80 0.03 0.00 1.00 0.00 0.00 64.86 65.03 2pbw h ILE 194 Cb 1.49 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 2pbw h ILE 194 CO 0.15 0.31 0.19 -0.33 0.00 0.00 0.00 178.15 178.46 2pbw h GLU 195 N 0.84 0.37 -0.18 2.37 5.08 -1.18 0.20 114.58 122.09 2pbw h GLU 195 Ca 0.19 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 2pbw h GLU 195 Cb 0.27 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2pbw h GLU 195 CO -0.01 0.25 0.01 -0.92 -1.00 0.00 0.00 179.01 177.34 2pbw h TYR 196 N 0.38 0.01 -0.03 4.33 3.20 -1.26 -2.45 116.97 121.15 2pbw h TYR 196 Ca 0.16 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 2pbw h TYR 196 Cb 0.07 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.36 2pbw h TYR 196 CO -0.10 -0.01 -0.00 0.28 -1.64 0.00 0.00 178.16 176.68 2pbw h VAL 197 N 0.07 1.26 0.00 1.81 2.07 -0.78 -3.08 116.25 117.60 2pbw h VAL 197 Ca 0.08 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 2pbw h VAL 197 Cb 0.09 1.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 2pbw h VAL 197 CO -0.13 0.21 -0.01 0.71 0.02 0.00 0.00 177.57 178.37 2pbw h THR 198 N -0.26 0.25 0.00 2.57 1.35 -0.59 0.37 112.91 116.60 2pbw h THR 198 Ca 0.01 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 2pbw h THR 198 Cb 0.34 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.84 2pbw h THR 198 CO 0.00 0.01 0.00 0.00 -0.25 0.00 0.00 175.52 175.29 2pbw n GLN 199 N -3.41 0.17 -0.01 4.72 1.13 -0.93 -3.47 117.38 115.59 2pbw n GLN 199 Ca -0.03 0.17 0.01 0.00 -1.94 0.00 0.00 57.00 55.21 2pbw n GLN 199 Cb 0.11 -1.71 0.01 0.00 0.11 0.00 0.00 30.24 28.76 2pbw n GLN 199 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2pbw n ARG 200 N -2.02 0.21 -3.36 -1.09 1.74 0.03 -4.90 116.66 107.28 2pbw n ARG 200 Ca 0.06 -0.86 -0.13 0.00 -0.77 0.00 0.00 57.85 56.14 2pbw n ARG 200 Cb 0.38 -1.04 -0.08 0.00 -1.02 0.00 0.00 32.46 30.71 2pbw n ARG 200 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2pbw s ASN 201 N -0.37 1.08 0.24 0.55 3.84 -0.63 -5.00 114.94 114.65 2pbw s ASN 201 Ca 0.02 -0.63 0.17 0.00 0.21 0.00 0.00 52.86 52.64 2pbw s ASN 201 Cb 0.02 0.78 0.89 0.00 -0.55 0.00 0.00 41.25 42.38 2pbw s ASN 201 CO 0.02 -0.37 1.53 0.00 -2.79 0.00 0.00 177.10 175.49 2pbw h ASN 203 N 0.00 0.00 -2.25 0.00 2.35 -1.94 -3.46 115.58 110.28 2pbw h ASN 203 Ca 0.00 0.00 -0.46 0.00 -0.55 0.00 0.00 56.30 55.29 2pbw h ASN 203 Cb 0.06 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2pbw h ASN 203 CO 0.00 0.38 -0.40 -0.76 -1.65 0.00 0.00 177.43 175.01 2pbw s LEU 204 N -6.47 4.27 0.21 1.61 1.43 -0.65 -0.74 118.68 118.34 2pbw s LEU 204 Ca 0.04 0.10 -0.22 0.00 -1.03 0.00 0.00 54.13 53.03 2pbw s LEU 204 Cb 0.07 -2.91 0.05 0.00 0.03 0.00 0.00 46.19 43.43 2pbw s LEU 204 CO 0.72 -0.11 0.65 0.28 0.23 0.00 0.00 176.35 178.12 2pbw s THR 205 N -2.03 0.00 0.14 5.49 -1.32 -0.49 -4.74 115.64 112.69 2pbw s THR 205 Ca 0.35 -0.47 -0.23 0.00 -1.21 0.00 0.00 61.69 60.13 2pbw s THR 205 Cb -0.09 -1.46 -0.08 0.00 -1.51 0.00 0.00 72.50 69.36 2pbw s THR 205 CO 0.30 -0.00 0.70 -1.58 -2.21 0.00 0.00 174.62 171.82 2pbw s GLN 206 N -3.83 4.40 -0.20 7.08 0.74 -1.26 -2.22 119.66 124.37 2pbw s GLN 206 Ca 0.06 0.98 -0.05 0.00 0.05 0.00 0.00 55.36 56.39 2pbw s GLN 206 Cb -0.03 -3.21 -0.02 0.00 1.10 0.00 0.00 33.01 30.85 2pbw s GLN 206 CO -0.04 0.58 -0.00 0.42 -0.55 0.00 0.00 175.29 175.69 2pbw s ILE 207 N -1.18 3.90 0.00 -2.34 -1.09 0.15 -4.95 121.20 115.69 2pbw s ILE 207 Ca 0.34 -0.33 0.00 0.00 -2.23 0.00 0.00 60.65 58.43 2pbw s ILE 207 Cb -0.21 -2.76 0.00 0.00 -1.58 0.00 0.00 42.46 37.91 2pbw s ILE 207 CO 0.23 0.43 0.00 0.61 -1.23 0.00 0.00 174.94 174.98 2pbw n GLY 208 N 4.29 -0.77 0.00 6.18 0.00 -1.21 -3.71 105.19 109.97 2pbw n GLY 208 Ca -0.17 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2pbw n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pbw n GLY 209 N 0.00 2.98 3.81 -0.02 0.00 -1.26 -4.87 105.19 105.83 2pbw n GLY 209 Ca 0.00 -1.87 -0.38 0.00 0.00 0.00 0.00 46.02 43.77 2pbw n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pbw s LEU 210 N 0.00 4.46 -0.02 0.99 1.43 -1.26 -4.58 118.68 119.71 2pbw s LEU 210 Ca 0.00 1.30 0.18 0.00 -1.03 0.00 0.00 54.13 54.58 2pbw s LEU 210 Cb 0.00 -3.14 0.55 0.00 0.03 0.00 0.00 46.19 43.63 2pbw s LEU 210 CO 0.00 0.19 1.46 2.30 0.23 0.00 0.00 176.35 180.53 2pbw n ILE 211 N 1.34 1.16 -3.60 -0.59 -5.35 -0.25 -4.96 119.36 107.10 2pbw n ILE 211 Ca -0.07 -1.06 -0.00 0.00 -0.27 0.00 0.00 62.75 61.35 2pbw n ILE 211 Cb 0.51 0.42 -0.01 0.00 -1.74 0.00 0.00 39.64 38.82 2pbw n ILE 211 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 2pbw s ASP 212 N -1.02 -0.06 -0.21 7.28 -4.77 -1.26 -4.92 116.67 111.71 2pbw s ASP 212 Ca 0.41 -0.05 0.02 0.00 -3.30 0.00 0.00 52.55 49.62 2pbw s ASP 212 Cb 0.23 0.10 0.04 0.00 -1.09 0.00 0.00 42.92 42.20 2pbw s ASP 212 CO 0.26 -0.18 -0.15 -0.55 0.70 0.00 0.00 175.17 175.25 2pbw s SER 213 N -2.63 3.60 0.38 2.11 0.15 -1.26 -3.90 113.70 112.14 2pbw s SER 213 Ca 0.13 -0.93 0.04 0.00 0.70 0.00 0.00 55.95 55.88 2pbw s SER 213 Cb 0.03 -1.46 -0.05 0.00 -1.71 0.00 0.00 66.02 62.83 2pbw s SER 213 CO -0.04 -0.09 0.07 -0.54 1.20 0.00 0.00 173.24 173.83 2pbw s LYS 214 N 1.25 1.82 0.07 5.44 1.02 0.14 -4.98 119.74 124.50 2pbw s LYS 214 Ca -0.01 -2.06 -0.06 0.00 0.02 0.00 0.00 55.97 53.86 2pbw s LYS 214 Cb -0.16 -0.96 -0.01 0.00 -0.52 0.00 0.00 37.83 36.18 2pbw s LYS 214 CO -0.10 -0.27 0.12 0.20 -0.92 0.00 0.00 175.35 174.39 2pbw s GLY 215 N -3.59 0.19 -0.12 -3.33 0.00 -1.26 0.32 107.32 99.54 2pbw s GLY 215 Ca 0.29 -0.74 -0.04 0.00 0.00 0.00 0.00 44.72 44.24 2pbw s GLY 215 CO 0.14 -0.90 0.04 -0.19 0.00 0.00 0.00 173.10 172.19 2pbw s TYR 216 N -3.64 3.25 0.12 1.90 2.02 0.05 -1.03 117.35 120.02 2pbw s TYR 216 Ca 0.04 0.19 0.01 0.00 -0.37 0.00 0.00 57.07 56.94 2pbw s TYR 216 Cb 0.05 -1.89 -0.04 0.00 -0.40 0.00 0.00 41.96 39.67 2pbw s TYR 216 CO -0.10 0.42 -0.02 0.20 -1.57 0.00 0.00 175.55 174.49 2pbw s GLY 217 N -0.56 0.89 0.01 0.71 0.00 -1.17 -0.54 107.32 106.66 2pbw s GLY 217 Ca 0.10 -1.42 -0.29 0.00 0.00 0.00 0.00 44.72 43.11 2pbw s GLY 217 CO 0.02 -1.44 0.94 0.14 0.00 0.00 0.00 173.10 172.77 2pbw s VAL 218 N -3.77 4.83 0.06 1.40 1.01 -1.26 -4.60 120.40 118.07 2pbw s VAL 218 Ca 0.17 1.99 -0.12 0.00 0.00 0.00 0.00 61.98 64.01 2pbw s VAL 218 Cb 0.06 -4.29 -0.06 0.00 0.00 0.00 0.00 36.38 32.10 2pbw s VAL 218 CO -0.02 0.20 0.42 -0.83 0.00 0.00 0.00 175.10 174.87 2pbw s GLY 219 N 0.81 2.41 0.06 4.51 0.00 0.42 -1.56 107.32 113.96 2pbw s GLY 219 Ca 0.49 -0.29 -0.03 0.00 0.00 0.00 0.00 44.72 44.89 2pbw s GLY 219 CO 0.27 -0.01 0.03 -0.51 0.00 0.00 0.00 173.10 172.88 2pbw s THR 220 N -1.28 0.19 0.71 0.90 -4.23 0.11 -0.13 115.64 111.91 2pbw s THR 220 Ca 0.30 -1.54 -0.14 0.00 -1.18 0.00 0.00 61.69 59.13 2pbw s THR 220 Cb -0.15 -1.34 0.03 0.00 1.34 0.00 0.00 72.50 72.38 2pbw s THR 220 CO 0.16 -0.85 1.16 -2.84 -0.54 0.00 0.00 174.62 171.71 2pbw s PRO 221 N -3.61 2.36 0.34 3.99 0.02 -1.26 -0.87 135.00 135.97 2pbw s PRO 221 Ca 0.04 1.56 -0.29 0.00 0.02 0.00 0.00 61.00 62.33 2pbw s PRO 221 Cb 0.05 -1.88 -0.11 0.00 0.02 0.00 0.00 34.50 32.58 2pbw s PRO 221 CO -0.09 -1.62 1.48 0.42 -0.33 0.00 0.00 177.00 176.86 2pbw s ILE 222 N -2.22 2.22 0.00 2.83 1.01 -1.26 -1.92 121.20 121.86 2pbw s ILE 222 Ca 0.70 0.21 0.00 0.00 0.00 0.00 0.00 60.65 61.56 2pbw s ILE 222 Cb -0.24 -3.13 0.00 0.00 0.01 0.00 0.00 42.46 39.09 2pbw s ILE 222 CO 0.45 0.04 0.00 0.61 0.00 0.00 0.00 174.94 176.04 2pbw n GLY 223 N 1.11 0.65 3.74 6.18 0.00 -1.26 -4.98 105.19 110.62 2pbw n GLY 223 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 2pbw n GLY 223 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2pbw s SER 224 N -2.27 6.74 0.24 1.61 0.15 -0.81 -4.92 113.70 114.44 2pbw s SER 224 Ca 0.00 2.55 0.24 0.00 0.70 0.00 0.00 55.95 59.44 2pbw s SER 224 Cb 0.00 -2.61 0.93 0.00 -1.71 0.00 0.00 66.02 62.63 2pbw s SER 224 CO 0.00 -0.65 1.73 -0.81 1.20 0.00 0.00 173.24 174.70 2pbw n PRO 225 N 2.74 0.20 0.06 5.44 -0.04 -1.26 -3.23 135.00 138.91 2pbw n PRO 225 Ca 0.08 0.36 -0.01 0.00 -0.04 0.00 0.00 63.50 63.89 2pbw n PRO 225 Cb 0.41 -1.84 -0.06 0.00 -0.04 0.00 0.00 33.50 31.97 2pbw n PRO 225 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2pbw h TYR 226 N 0.00 0.00 -1.00 0.54 -1.99 -1.97 -3.39 116.97 109.17 2pbw h TYR 226 Ca 0.00 0.00 0.10 0.00 2.00 0.00 0.00 58.73 60.83 2pbw h TYR 226 Cb 0.46 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 39.06 2pbw h TYR 226 CO 0.00 0.65 -0.54 -2.13 -0.00 0.00 0.00 178.16 176.14 2pbw n ARG 227 N -3.05 -0.39 -0.09 4.88 0.00 -1.20 -0.33 116.66 116.48 2pbw n ARG 227 Ca -0.06 1.51 -0.08 0.00 -0.00 0.00 0.00 57.85 59.22 2pbw n ARG 227 Cb 0.85 -2.23 0.09 0.00 0.00 0.00 0.00 32.46 31.16 2pbw n ARG 227 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 2pbw h ASP 228 N 0.00 0.80 -0.63 6.15 3.32 -1.82 -1.48 116.42 122.76 2pbw h ASP 228 Ca 0.20 -0.29 -0.05 0.00 0.02 0.00 0.00 57.03 56.92 2pbw h ASP 228 Cb 0.45 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 2pbw h ASP 228 CO -0.95 0.99 0.22 0.11 -1.72 0.00 0.00 179.24 177.89 2pbw h LYS 229 N 0.69 1.00 -0.33 3.56 1.57 -1.34 -1.50 116.57 120.23 2pbw h LYS 229 Ca 0.10 -0.19 -0.14 0.00 -1.87 0.00 0.00 60.65 58.55 2pbw h LYS 229 Cb 0.73 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 2pbw h LYS 229 CO 0.06 0.85 -0.32 0.82 -0.57 0.00 0.00 179.45 180.28 2pbw h ILE 230 N 0.97 1.29 -0.19 1.86 2.04 -0.50 -1.97 117.51 121.00 2pbw h ILE 230 Ca 0.22 -1.49 0.04 0.00 1.00 0.00 0.00 64.86 64.62 2pbw h ILE 230 Cb 0.26 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 2pbw h ILE 230 CO -0.01 0.49 -0.03 0.74 0.00 0.00 0.00 178.15 179.34 2pbw h THR 231 N 0.57 0.83 -0.95 -0.27 2.02 -0.97 0.84 112.91 114.97 2pbw h THR 231 Ca 0.05 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 2pbw h THR 231 Cb 0.90 0.80 -0.05 0.00 -1.74 0.00 0.00 68.15 68.07 2pbw h THR 231 CO 0.08 0.00 0.58 0.40 0.37 0.00 0.00 175.52 176.96 2pbw h ILE 232 N 0.02 1.26 -0.45 3.11 2.04 -1.23 -1.42 117.51 120.84 2pbw h ILE 232 Ca 0.09 -0.55 -0.11 0.00 1.00 0.00 0.00 64.86 65.30 2pbw h ILE 232 Cb 0.13 -0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.10 2pbw h ILE 232 CO -0.18 0.27 -0.15 0.00 0.00 0.00 0.00 178.15 178.09 2pbw h ALA 233 N 1.33 0.90 -0.35 1.87 0.00 -0.70 -1.79 119.26 120.53 2pbw h ALA 233 Ca 0.34 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2pbw h ALA 233 Cb -0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2pbw h ALA 233 CO -0.07 0.63 0.14 0.82 0.00 0.00 0.00 179.25 180.78 2pbw h ILE 234 N 0.75 1.18 -0.98 0.00 2.04 -0.26 -0.20 117.51 120.03 2pbw h ILE 234 Ca 0.12 -0.55 0.02 0.00 1.00 0.00 0.00 64.86 65.44 2pbw h ILE 234 Cb 0.66 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.59 2pbw h ILE 234 CO 0.05 0.20 0.65 -0.07 0.00 0.00 0.00 178.15 178.97 2pbw h LEU 235 N 0.42 1.11 -0.04 1.44 3.38 -1.12 0.89 115.31 121.39 2pbw h LEU 235 Ca 0.12 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2pbw h LEU 235 Cb 0.17 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2pbw h LEU 235 CO -0.01 0.79 0.02 -0.61 0.09 0.00 0.00 178.44 178.71 2pbw h GLN 236 N 1.30 0.05 -0.31 1.13 4.15 -0.89 -0.25 115.11 120.29 2pbw h GLN 236 Ca 0.37 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.76 2pbw h GLN 236 Cb -0.09 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.57 2pbw h GLN 236 CO -0.10 0.15 0.08 -0.07 -1.93 0.00 0.00 178.83 176.96 2pbw h LEU 237 N -0.05 0.40 0.02 -2.39 3.38 -0.44 -2.39 115.31 113.83 2pbw h LEU 237 Ca 0.01 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2pbw h LEU 237 Cb 0.11 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2pbw h LEU 237 CO -0.00 0.41 -0.01 -0.61 0.09 0.00 0.00 178.44 178.32 2pbw h GLN 238 N 0.44 -0.02 -0.01 1.13 -0.00 -0.56 -1.37 115.11 114.71 2pbw h GLN 238 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.76 2pbw h GLN 238 Cb 0.17 0.01 -0.00 0.00 0.00 0.00 0.00 27.48 27.65 2pbw h GLN 238 CO -0.00 0.45 0.02 0.93 0.00 0.00 0.00 178.83 180.23 2pbw h GLU 239 N -0.51 0.00 -0.54 1.69 5.08 -0.75 -1.68 114.58 117.86 2pbw h GLU 239 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2pbw h GLU 239 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2pbw h GLU 239 CO 0.00 0.00 0.00 -0.85 -1.00 0.00 0.00 179.01 177.16 2pbw n GLU 240 N -3.55 3.36 -0.97 2.33 0.28 -0.93 -4.96 120.64 116.21 2pbw n GLU 240 Ca -0.03 -2.70 0.00 0.00 -0.16 0.00 0.00 57.16 54.28 2pbw n GLU 240 Cb 0.10 -1.73 0.00 0.00 1.43 0.00 0.00 31.44 31.24 2pbw n GLU 240 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2pbw n GLY 241 N 0.82 0.59 0.24 -1.84 0.00 -0.63 -4.93 105.19 99.44 2pbw n GLY 241 Ca 0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 2pbw n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pbw h LYS 242 N 1.51 0.78 -0.67 1.61 1.57 -1.47 -1.30 116.57 118.62 2pbw h LYS 242 Ca 0.00 -0.45 -0.05 0.00 -1.87 0.00 0.00 60.65 58.28 2pbw h LYS 242 Cb 0.09 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 2pbw h LYS 242 CO 0.00 1.08 0.23 -0.07 -0.57 0.00 0.00 179.45 180.12 2pbw h LEU 243 N 0.62 0.95 -0.56 2.94 3.38 -1.82 0.58 115.31 121.40 2pbw h LEU 243 Ca 0.03 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 2pbw h LEU 243 Cb 1.04 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 2pbw h LEU 243 CO 0.10 0.89 0.08 -0.74 0.09 0.00 0.00 178.44 178.86 2pbw h HIS 244 N 0.96 1.01 -0.40 1.13 2.76 -1.85 -1.21 115.15 117.54 2pbw h HIS 244 Ca 0.22 -0.14 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 2pbw h HIS 244 Cb 0.27 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 28.93 2pbw h HIS 244 CO 0.02 0.89 0.22 1.98 -1.30 0.00 0.00 177.93 179.74 2pbw h MET 245 N 0.84 0.55 -0.72 5.26 -1.53 -0.84 -1.75 114.93 116.74 2pbw h MET 245 Ca 0.17 -0.06 -0.04 0.00 -3.44 0.00 0.00 59.70 56.33 2pbw h MET 245 Cb 0.43 -0.11 -0.03 0.00 -0.55 0.00 0.00 31.60 31.34 2pbw h MET 245 CO 0.01 0.44 0.31 0.52 0.14 0.00 0.00 176.91 178.34 2pbw h MET 246 N 0.51 1.07 -0.40 0.39 2.07 -0.67 -1.64 114.93 116.26 2pbw h MET 246 Ca 0.14 -0.18 -0.01 0.00 -2.07 0.00 0.00 59.70 57.58 2pbw h MET 246 Cb 0.05 -0.18 -0.02 0.00 -1.87 0.00 0.00 31.60 29.58 2pbw h MET 246 CO -0.02 0.86 0.21 -0.22 1.07 0.00 0.00 176.91 178.81 2pbw h LYS 247 N 1.03 0.56 -1.00 1.72 3.64 -0.94 -2.48 116.57 119.10 2pbw h LYS 247 Ca 0.24 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 2pbw h LYS 247 Cb 0.18 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.84 2pbw h LYS 247 CO -0.02 0.47 0.66 1.49 -2.27 0.00 0.00 179.45 179.77 2pbw h GLU 248 N 0.51 1.32 -0.29 1.90 4.81 -1.03 0.61 114.58 122.40 2pbw h GLU 248 Ca 0.14 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 2pbw h GLU 248 Cb 0.08 -0.30 -0.03 0.00 0.63 0.00 0.00 28.75 29.13 2pbw h GLU 248 CO -0.02 0.88 0.12 -0.22 -0.73 0.00 0.00 179.01 179.03 2pbw h LYS 249 N 1.36 0.25 0.00 1.92 3.64 -0.88 -3.17 116.57 119.69 2pbw h LYS 249 Ca 0.37 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 2pbw h LYS 249 Cb -0.15 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 2pbw h LYS 249 CO -0.08 0.17 -0.77 -1.49 -2.27 0.00 0.00 179.45 175.01 2pbw h TRP 250 N 0.26 0.00 -0.02 1.91 4.06 -1.23 -3.52 115.95 117.41 2pbw h TRP 250 Ca 0.13 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.08 2pbw h TRP 250 Cb 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.24 2pbw h TRP 250 CO -0.12 0.00 0.00 0.91 -3.56 0.00 0.00 178.44 175.67