#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x00 n LYS -6 N 0.00 0.60 0.00 -0.72 4.01 -1.26 -3.75 118.16 117.04 2x00 n LYS -6 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2x00 n LYS -6 Cb 0.00 -1.28 0.00 0.00 -0.51 0.00 0.00 35.03 33.24 2x00 n LYS -6 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 2x00 n ASP -5 N 0.29 0.00 -0.26 4.39 3.85 -1.26 -3.73 116.55 119.83 2x00 n ASP -5 Ca 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.08 2x00 n ASP -5 Cb 0.18 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.95 2x00 n ASP -5 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 2x00 n ASP -4 N 0.00 0.26 0.01 -1.12 4.64 -1.26 -1.98 116.55 117.09 2x00 n ASP -4 Ca 0.00 -0.98 -0.19 0.00 -1.38 0.00 0.00 54.79 52.24 2x00 n ASP -4 Cb 0.00 -0.13 -0.14 0.00 -1.04 0.00 0.00 41.12 39.81 2x00 n ASP -4 CO 0.00 0.00 0.00 -0.78 -0.82 0.00 0.00 177.20 175.60 2x00 h ASP -3 N 0.27 0.35 -0.33 1.67 3.58 -1.74 -2.49 116.42 117.73 2x00 h ASP -3 Ca 0.00 -0.77 -0.15 0.00 0.42 0.00 0.00 57.03 56.52 2x00 h ASP -3 Cb 0.13 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 2x00 h ASP -3 CO 0.00 1.69 -0.40 0.44 -2.88 0.00 0.00 179.24 178.09 2x00 h ASP -2 N 0.06 0.92 -0.46 2.28 3.45 -1.48 -2.73 116.42 118.47 2x00 h ASP -2 Ca -0.39 -0.49 -0.03 0.00 0.43 0.00 0.00 57.03 56.55 2x00 h ASP -2 Cb 2.04 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 40.52 2x00 h ASP -2 CO 0.09 1.23 0.18 0.11 -1.57 0.00 0.00 179.24 179.28 2x00 h LYS -1 N 0.64 0.69 -0.82 3.56 1.57 -1.68 -0.81 116.57 119.72 2x00 h LYS -1 Ca 0.04 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2x00 h LYS -1 Cb 0.99 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.15 2x00 h LYS -1 CO 0.10 0.63 0.54 -0.07 -0.57 0.00 0.00 179.45 180.08 2x00 h LEU 0 N 0.60 0.94 -0.99 2.94 4.07 -1.51 -1.42 115.31 119.93 2x00 h LEU 0 Ca 0.15 -0.02 -0.09 0.00 0.08 0.00 0.00 57.88 58.00 2x00 h LEU 0 Cb 0.20 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.70 2x00 h LEU 0 CO -0.01 0.68 -0.27 -0.74 -1.08 0.00 0.00 178.44 177.02 2x00 h HIS 1 N 1.11 0.45 0.01 1.13 2.76 -1.20 -1.14 115.15 118.27 2x00 h HIS 1 Ca 0.30 -0.10 -0.24 0.00 -2.20 0.00 0.00 60.37 58.14 2x00 h HIS 1 Cb -0.12 -0.11 0.01 0.00 1.55 0.00 0.00 27.41 28.74 2x00 h HIS 1 CO -0.02 0.64 -0.98 0.66 -1.30 0.00 0.00 177.93 176.93 2x00 h SER 2 N 0.36 0.61 -0.35 3.26 4.64 -0.83 -1.45 113.55 119.79 2x00 h SER 2 Ca 0.05 -0.50 -0.09 0.00 -0.47 0.00 0.00 61.79 60.78 2x00 h SER 2 Cb 0.66 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 2x00 h SER 2 CO 0.05 1.30 -0.14 1.56 -0.87 0.00 0.00 176.83 178.73 2x00 h GLN 3 N 0.26 0.71 -0.67 4.77 4.20 -1.19 -2.19 115.11 120.99 2x00 h GLN 3 Ca -0.09 -0.30 -0.04 0.00 0.06 0.00 0.00 58.65 58.28 2x00 h GLN 3 Cb 1.63 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 29.35 2x00 h GLN 3 CO 0.18 0.89 0.26 0.00 -0.67 0.00 0.00 178.83 179.49 2x00 h ALA 4 N 0.79 1.19 -0.31 3.87 0.00 -1.21 -2.02 119.26 121.57 2x00 h ALA 4 Ca 0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2x00 h ALA 4 Cb 0.67 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2x00 h ALA 4 CO 0.05 0.58 0.03 -0.91 0.00 0.00 0.00 179.25 179.00 2x00 h ASN 5 N 0.97 0.50 -0.14 0.00 2.35 -1.21 -0.39 115.58 117.66 2x00 h ASN 5 Ca 0.22 -0.28 0.02 0.00 -0.55 0.00 0.00 56.30 55.72 2x00 h ASN 5 Cb 0.20 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 2x00 h ASN 5 CO -0.02 0.65 -0.01 0.25 -1.65 0.00 0.00 177.43 176.66 2x00 h LEU 6 N 0.34 -0.07 -1.34 1.61 5.85 -1.19 0.12 115.31 120.63 2x00 h LEU 6 Ca 0.09 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 2x00 h LEU 6 Cb 0.37 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2x00 h LEU 6 CO 0.01 -0.01 -0.18 0.24 -0.34 0.00 0.00 178.44 178.16 2x00 h MET 7 N 0.04 0.22 -0.52 1.25 2.86 -1.37 -1.48 114.93 115.93 2x00 h MET 7 Ca 0.06 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 2x00 h MET 7 Cb 0.08 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 2x00 h MET 7 CO -0.11 0.40 -0.04 -0.09 1.06 0.00 0.00 176.91 178.13 2x00 h ARG 8 N 0.21 0.95 0.09 1.72 2.43 -0.40 -2.44 114.38 116.94 2x00 h ARG 8 Ca 0.04 -0.32 -0.00 0.00 -0.81 0.00 0.00 59.98 58.88 2x00 h ARG 8 Cb 0.44 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2x00 h ARG 8 CO 0.03 0.98 -0.05 1.25 -1.51 0.00 0.00 179.97 180.67 2x00 h LEU 9 N 0.82 -0.11 -1.16 3.80 5.85 -0.28 -1.19 115.31 123.04 2x00 h LEU 9 Ca 0.14 -0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.65 2x00 h LEU 9 Cb 0.58 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 2x00 h LEU 9 CO 0.03 0.20 0.58 0.11 -0.34 0.00 0.00 178.44 179.02 2x00 h LYS 10 N -0.42 1.05 -0.52 1.25 1.57 -1.35 -1.06 116.57 117.08 2x00 h LYS 10 Ca -0.01 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.63 2x00 h LYS 10 Cb 0.35 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2x00 h LYS 10 CO 0.02 0.70 0.04 1.03 -0.57 0.00 0.00 179.45 180.67 2x00 h SER 11 N 1.08 0.86 0.51 0.86 0.87 -1.36 -0.05 113.55 116.33 2x00 h SER 11 Ca 0.35 -0.29 -0.05 0.00 -1.23 0.00 0.00 61.79 60.58 2x00 h SER 11 Cb 0.04 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 2x00 h SER 11 CO -0.11 0.93 -0.23 0.44 -0.53 0.00 0.00 176.83 177.34 2x00 h ASP 12 N 0.76 0.00 0.19 6.23 3.32 -0.57 -1.15 116.42 125.21 2x00 h ASP 12 Ca 0.15 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.85 2x00 h ASP 12 Cb 0.47 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 2x00 h ASP 12 CO 0.02 0.23 -1.86 -0.07 -1.72 0.00 0.00 179.24 175.84 2x00 h LEU 13 N 0.00 0.47 -1.99 1.55 3.38 -0.98 -3.34 115.31 114.40 2x00 h LEU 13 Ca -0.00 -0.87 0.00 0.00 0.09 0.00 0.00 57.88 57.10 2x00 h LEU 13 Cb 0.55 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2x00 h LEU 13 CO 0.03 1.76 0.00 0.49 0.09 0.00 0.00 178.44 180.81 2x00 n PHE 14 N -3.50 0.20 0.00 1.13 3.01 -0.05 -4.31 117.46 113.94 2x00 n PHE 14 Ca -0.27 -0.16 0.00 0.00 1.01 0.00 0.00 57.45 58.03 2x00 n PHE 14 Cb 1.06 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.52 2x00 n PHE 14 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2x00 n ASN 15 N 0.88 0.84 0.00 4.37 5.03 -0.46 -4.83 115.26 121.09 2x00 n ASN 15 Ca 0.11 0.00 0.15 0.00 0.87 0.00 0.00 54.58 55.71 2x00 n ASN 15 Cb 0.42 0.00 0.74 0.00 -1.02 0.00 0.00 39.78 39.92 2x00 n ASN 15 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2x00 n ARG 16 N -1.94 0.39 -4.42 3.52 5.12 -1.04 -4.76 116.66 113.53 2x00 n ARG 16 Ca 0.00 0.01 -0.22 0.00 -1.93 0.00 0.00 57.85 55.71 2x00 n ARG 16 Cb 0.13 -1.50 -0.16 0.00 -1.16 0.00 0.00 32.46 29.77 2x00 n ARG 16 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2x00 s SER 17 N -2.60 1.34 0.54 0.55 0.01 -1.25 -5.02 113.70 107.27 2x00 s SER 17 Ca 0.27 -0.21 -0.22 0.00 1.31 0.00 0.00 55.95 57.11 2x00 s SER 17 Cb 0.20 -0.47 -0.05 0.00 0.21 0.00 0.00 66.02 65.90 2x00 s SER 17 CO 0.46 0.04 1.28 -0.81 0.41 0.00 0.00 173.24 174.62 2x00 n PRO 18 N 3.53 1.56 -1.69 12.44 -0.04 -1.26 -4.71 135.00 144.84 2x00 n PRO 18 Ca -0.21 0.58 -0.44 0.00 -0.04 0.00 0.00 63.50 63.39 2x00 n PRO 18 Cb 0.53 -2.48 -0.04 0.00 -0.04 0.00 0.00 33.50 31.47 2x00 n PRO 18 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 2x00 n MET 19 N -0.93 2.46 -1.75 0.54 1.56 -1.26 -4.89 117.12 112.85 2x00 n MET 19 Ca 0.11 0.89 -0.42 0.00 -0.27 0.00 0.00 57.70 58.00 2x00 n MET 19 Cb 0.44 -2.70 -0.03 0.00 2.15 0.00 0.00 33.22 33.08 2x00 n MET 19 CO 0.00 0.00 0.00 -0.47 -0.73 0.00 0.00 175.97 174.77 2x00 s TYR 20 N 1.29 1.62 -2.09 1.12 5.04 -1.26 -4.88 117.35 118.19 2x00 s TYR 20 Ca 0.78 -0.23 0.14 0.00 -2.44 0.00 0.00 57.07 55.32 2x00 s TYR 20 Cb -0.59 -4.16 0.53 0.00 0.35 0.00 0.00 41.96 38.09 2x00 s TYR 20 CO 0.36 -5.06 1.38 -0.35 -1.34 0.00 0.00 175.55 170.54 2x00 n PRO 21 N 7.02 1.53 0.00 4.97 -0.04 -1.26 -4.94 135.00 142.28 2x00 n PRO 21 Ca 0.19 -0.81 0.00 0.00 -0.04 0.00 0.00 63.50 62.84 2x00 n PRO 21 Cb 0.41 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 2x00 n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2x00 n GLY 22 N 0.95 -0.30 3.77 0.55 0.00 -1.26 -4.99 105.19 103.91 2x00 n GLY 22 Ca 0.12 -1.74 -0.34 0.00 0.00 0.00 0.00 46.02 44.06 2x00 n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2x00 s PRO 23 N -2.16 3.05 0.38 1.61 0.04 -1.26 -5.05 135.00 131.61 2x00 s PRO 23 Ca 0.00 1.48 0.04 0.00 0.04 0.00 0.00 61.00 62.56 2x00 s PRO 23 Cb 0.00 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2x00 s PRO 23 CO 0.00 -1.07 0.10 0.95 0.04 0.00 0.00 177.00 177.03 2x00 s THR 24 N -2.10 0.78 0.44 1.26 -4.23 -0.96 -4.96 115.64 105.87 2x00 s THR 24 Ca 0.69 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.43 2x00 s THR 24 Cb -0.22 -2.50 0.26 0.00 1.34 0.00 0.00 72.50 71.38 2x00 s THR 24 CO 0.35 0.00 2.05 0.11 -0.54 0.00 0.00 174.62 176.59 2x00 h LYS 25 N 1.92 0.00 0.00 3.99 1.57 -1.92 -1.62 116.57 120.51 2x00 h LYS 25 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 2x00 h LYS 25 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 2x00 h LYS 25 CO 0.61 0.14 -1.18 -0.25 -0.57 0.00 0.00 179.45 178.20 2x00 n ASP 26 N -3.89 0.58 -3.24 0.86 8.00 -1.26 -4.48 116.55 113.13 2x00 n ASP 26 Ca -0.02 0.01 -0.25 0.00 0.71 0.00 0.00 54.79 55.25 2x00 n ASP 26 Cb 0.23 0.88 -0.06 0.00 -0.02 0.00 0.00 41.12 42.15 2x00 n ASP 26 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2x00 n ASP 27 N -2.25 2.17 -4.89 -2.24 2.03 -0.90 -5.12 116.55 105.34 2x00 n ASP 27 Ca 0.00 -3.15 -0.30 0.00 0.52 0.00 0.00 54.79 51.87 2x00 n ASP 27 Cb 0.50 -0.64 0.07 0.00 -0.72 0.00 0.00 41.12 40.33 2x00 n ASP 27 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2x00 s PRO 28 N -2.15 2.42 0.03 -0.67 0.04 -0.66 -2.26 135.00 131.75 2x00 s PRO 28 Ca 0.39 0.29 0.05 0.00 0.04 0.00 0.00 61.00 61.78 2x00 s PRO 28 Cb 0.20 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.74 2x00 s PRO 28 CO -0.07 -1.31 -0.16 -1.17 0.04 0.00 0.00 177.00 174.32 2x00 s LEU 29 N -5.47 2.13 -0.30 -3.56 2.96 0.08 -4.93 118.68 109.59 2x00 s LEU 29 Ca 0.60 -0.42 -0.06 0.00 -0.22 0.00 0.00 54.13 54.03 2x00 s LEU 29 Cb -0.11 -0.74 0.02 0.00 0.50 0.00 0.00 46.19 45.86 2x00 s LEU 29 CO 0.50 0.11 0.07 -0.89 -1.32 0.00 0.00 176.35 174.82 2x00 s THR 30 N -0.70 3.77 -0.23 3.68 2.01 -1.26 0.68 115.64 123.59 2x00 s THR 30 Ca 0.04 -0.85 -0.13 0.00 0.31 0.00 0.00 61.69 61.06 2x00 s THR 30 Cb -0.08 -2.99 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 2x00 s THR 30 CO 0.01 0.03 0.29 -0.69 -0.69 0.00 0.00 174.62 173.58 2x00 s VAL 31 N 1.45 5.26 -0.20 3.82 1.01 0.69 -4.45 120.40 127.99 2x00 s VAL 31 Ca 0.01 0.46 -0.14 0.00 0.00 0.00 0.00 61.98 62.31 2x00 s VAL 31 Cb -0.18 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 2x00 s VAL 31 CO 0.02 0.27 0.33 -0.89 0.00 0.00 0.00 175.10 174.83 2x00 s THR 32 N 1.34 5.26 -0.10 3.92 2.01 -0.14 -1.35 115.64 126.58 2x00 s THR 32 Ca 0.13 0.56 0.04 0.00 0.31 0.00 0.00 61.69 62.73 2x00 s THR 32 Cb -0.14 -3.66 0.00 0.00 0.01 0.00 0.00 72.50 68.71 2x00 s THR 32 CO 0.07 0.30 -0.22 -0.22 -0.69 0.00 0.00 174.62 173.86 2x00 s LEU 33 N 1.06 2.01 -0.03 4.42 2.96 0.69 -1.76 118.68 128.04 2x00 s LEU 33 Ca 0.16 -0.52 -0.06 0.00 -0.22 0.00 0.00 54.13 53.49 2x00 s LEU 33 Cb -0.14 -1.31 0.01 0.00 0.50 0.00 0.00 46.19 45.25 2x00 s LEU 33 CO 0.06 0.13 0.14 -0.83 -1.32 0.00 0.00 176.35 174.54 2x00 s GLY 34 N 0.42 -0.03 -0.05 7.98 0.00 -0.74 -4.36 107.32 110.54 2x00 s GLY 34 Ca -0.18 0.13 0.01 0.00 0.00 0.00 0.00 44.72 44.68 2x00 s GLY 34 CO 0.08 0.03 -0.05 -1.36 0.00 0.00 0.00 173.10 171.80 2x00 s PHE 35 N -0.67 2.98 -0.32 1.90 0.08 -1.26 -0.42 117.98 120.27 2x00 s PHE 35 Ca -0.08 0.05 0.00 0.00 0.12 0.00 0.00 56.93 57.02 2x00 s PHE 35 Cb -0.05 -1.70 0.08 0.00 -0.57 0.00 0.00 43.02 40.78 2x00 s PHE 35 CO 0.01 0.38 0.03 0.99 -0.10 0.00 0.00 175.22 176.53 2x00 s THR 36 N -0.89 2.73 -0.25 0.64 2.01 -0.35 -1.61 115.64 117.92 2x00 s THR 36 Ca 0.14 -1.78 -0.26 0.00 0.31 0.00 0.00 61.69 60.10 2x00 s THR 36 Cb -0.11 -2.73 0.00 0.00 0.01 0.00 0.00 72.50 69.67 2x00 s THR 36 CO 0.04 -0.32 0.89 -0.22 -0.69 0.00 0.00 174.62 174.32 2x00 s LEU 37 N 1.12 4.08 -0.26 4.42 2.96 -0.57 -0.99 118.68 129.44 2x00 s LEU 37 Ca 0.00 1.08 -0.01 0.00 -0.22 0.00 0.00 54.13 54.98 2x00 s LEU 37 Cb -0.20 -3.28 -0.16 0.00 0.50 0.00 0.00 46.19 43.04 2x00 s LEU 37 CO -0.04 -0.59 -0.24 1.67 -1.32 0.00 0.00 176.35 175.83 2x00 n GLN 38 N 6.16 0.64 -3.62 1.98 7.27 -0.17 -3.41 117.38 126.24 2x00 n GLN 38 Ca 0.07 0.17 -0.13 0.00 0.07 0.00 0.00 57.00 57.18 2x00 n GLN 38 Cb 0.47 -1.52 -0.07 0.00 2.41 0.00 0.00 30.24 31.53 2x00 n GLN 38 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2x00 s ASP 39 N -6.67 -0.69 -0.46 1.69 2.15 -0.51 0.07 116.67 112.25 2x00 s ASP 39 Ca -0.35 1.29 -0.15 0.00 0.43 0.00 0.00 52.55 53.77 2x00 s ASP 39 Cb 0.10 1.29 0.06 0.00 -0.30 0.00 0.00 42.92 44.07 2x00 s ASP 39 CO 0.59 -0.26 0.37 -0.63 -0.17 0.00 0.00 175.17 175.06 2x00 s ILE 40 N 0.22 5.20 -0.01 4.11 1.01 -1.26 0.36 121.20 130.83 2x00 s ILE 40 Ca -0.00 -0.98 -0.21 0.00 0.00 0.00 0.00 60.65 59.45 2x00 s ILE 40 Cb -0.05 -4.06 -0.22 0.00 0.01 0.00 0.00 42.46 38.14 2x00 s ILE 40 CO 0.01 -0.51 1.10 0.58 0.00 0.00 0.00 174.94 176.11 2x00 h VAL 41 N 5.74 1.46 -2.82 2.92 2.07 -1.54 -3.41 116.25 120.67 2x00 h VAL 41 Ca -0.28 -1.95 -0.12 0.00 0.82 0.00 0.00 66.70 65.16 2x00 h VAL 41 Cb 1.11 2.58 -0.23 0.00 -1.52 0.00 0.00 31.29 33.24 2x00 h VAL 41 CO 0.84 0.56 -0.24 -0.75 0.02 0.00 0.00 177.57 177.99 2x00 s LYS 42 N -3.29 0.54 -0.30 1.57 2.20 -1.23 -4.87 119.74 114.36 2x00 s LYS 42 Ca -0.14 0.34 0.00 0.00 -0.36 0.00 0.00 55.97 55.81 2x00 s LYS 42 Cb 0.03 0.25 0.09 0.00 -1.51 0.00 0.00 37.83 36.69 2x00 s LYS 42 CO 0.79 -0.10 0.07 0.00 -0.36 0.00 0.00 175.35 175.75 2x00 s ALA 43 N -0.24 1.81 -0.48 3.13 0.00 -1.26 -0.75 121.76 123.96 2x00 s ALA 43 Ca -0.04 -1.76 -0.19 0.00 0.00 0.00 0.00 51.96 49.97 2x00 s ALA 43 Cb -0.03 -1.65 0.05 0.00 0.00 0.00 0.00 23.12 21.49 2x00 s ALA 43 CO 0.02 -1.60 0.60 0.34 0.00 0.00 0.00 175.76 175.11 2x00 s ASP 44 N 1.47 6.23 0.00 0.00 -1.08 0.19 -4.91 116.67 118.58 2x00 s ASP 44 Ca 0.08 -0.80 0.28 0.00 -0.52 0.00 0.00 52.55 51.59 2x00 s ASP 44 Cb -0.18 -2.28 1.12 0.00 -1.46 0.00 0.00 42.92 40.12 2x00 s ASP 44 CO -0.19 -0.83 1.81 -1.54 0.52 0.00 0.00 175.17 174.94 2x00 n SER 45 N 6.08 0.37 0.09 -0.34 3.41 -1.26 -1.06 113.62 120.91 2x00 n SER 45 Ca -0.06 -0.30 0.12 0.00 -0.26 0.00 0.00 58.87 58.37 2x00 n SER 45 Cb 0.46 -0.11 0.17 0.00 -0.26 0.00 0.00 64.21 64.47 2x00 n SER 45 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2x00 h SER 46 N 0.35 0.00 0.00 4.04 4.64 -1.96 -3.36 113.55 117.26 2x00 h SER 46 Ca 0.00 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 2x00 h SER 46 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2x00 h SER 46 CO 0.00 0.06 0.00 0.35 -0.87 0.00 0.00 176.83 176.37 2x00 n THR 47 N -2.32 0.00 -3.70 2.95 -2.24 -1.20 -5.04 114.28 102.73 2x00 n THR 47 Ca 0.03 -0.35 -0.28 0.00 -2.27 0.00 0.00 64.05 61.19 2x00 n THR 47 Cb 0.47 1.13 0.03 0.00 -2.10 0.00 0.00 70.33 69.86 2x00 n THR 47 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2x00 n ASN 48 N -0.40 -3.84 -4.21 3.42 3.02 -0.22 -4.96 115.26 108.07 2x00 n ASN 48 Ca 0.00 -0.96 -0.28 0.00 -0.03 0.00 0.00 54.58 53.31 2x00 n ASN 48 Cb 0.03 -3.57 -0.16 0.00 -0.61 0.00 0.00 39.78 35.48 2x00 n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2x00 s GLU 49 N -5.96 1.85 0.00 3.52 2.02 -1.02 -1.80 118.70 117.30 2x00 s GLU 49 Ca 0.31 -0.73 0.08 0.00 0.02 0.00 0.00 54.97 54.65 2x00 s GLU 49 Cb -0.10 -1.69 -0.02 0.00 0.10 0.00 0.00 34.13 32.41 2x00 s GLU 49 CO 0.85 0.38 -0.25 0.08 0.02 0.00 0.00 175.26 176.35 2x00 s VAL 50 N -0.30 1.95 -0.20 2.63 1.01 -0.78 -0.63 120.40 124.07 2x00 s VAL 50 Ca 0.03 -1.13 -0.06 0.00 0.00 0.00 0.00 61.98 60.82 2x00 s VAL 50 Cb -0.10 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 2x00 s VAL 50 CO 0.01 0.48 0.04 -1.81 0.00 0.00 0.00 175.10 173.81 2x00 s ASP 51 N -0.77 5.16 0.04 3.32 1.11 0.07 -1.83 116.67 123.78 2x00 s ASP 51 Ca 0.10 -0.11 0.06 0.00 0.18 0.00 0.00 52.55 52.78 2x00 s ASP 51 Cb -0.09 -1.89 -0.03 0.00 1.07 0.00 0.00 42.92 41.97 2x00 s ASP 51 CO -0.00 0.08 -0.14 -0.76 1.18 0.00 0.00 175.17 175.53 2x00 s LEU 52 N 0.93 2.83 -0.10 1.23 1.02 0.14 -1.28 118.68 123.45 2x00 s LEU 52 Ca 0.03 -0.35 0.04 0.00 0.02 0.00 0.00 54.13 53.86 2x00 s LEU 52 Cb -0.14 -1.65 -0.00 0.00 0.02 0.00 0.00 46.19 44.42 2x00 s LEU 52 CO 0.02 0.25 -0.23 -0.69 0.02 0.00 0.00 176.35 175.72 2x00 s VAL 53 N -1.00 2.13 0.16 -1.59 1.01 0.16 -0.94 120.40 120.33 2x00 s VAL 53 Ca 0.16 -1.00 -0.17 0.00 0.00 0.00 0.00 61.98 60.98 2x00 s VAL 53 Cb -0.11 -1.81 0.04 0.00 0.00 0.00 0.00 36.38 34.49 2x00 s VAL 53 CO 0.07 0.56 0.47 -0.72 0.00 0.00 0.00 175.10 175.48 2x00 s TYR 54 N 0.32 -0.21 -0.16 5.22 -0.85 -0.96 -1.00 117.35 119.71 2x00 s TYR 54 Ca -0.18 -0.11 -0.07 0.00 -0.52 0.00 0.00 57.07 56.19 2x00 s TYR 54 Cb -0.18 0.34 -0.04 0.00 0.38 0.00 0.00 41.96 42.46 2x00 s TYR 54 CO 0.09 -0.80 0.09 0.71 -1.52 0.00 0.00 175.55 174.12 2x00 s TYR 55 N -3.83 3.38 -0.48 -3.49 2.02 -0.16 -1.10 117.35 113.68 2x00 s TYR 55 Ca 0.05 0.28 -0.08 0.00 -0.37 0.00 0.00 57.07 56.95 2x00 s TYR 55 Cb 0.00 -2.03 0.12 0.00 -0.40 0.00 0.00 41.96 39.66 2x00 s TYR 55 CO -0.09 0.38 0.35 -2.00 -1.57 0.00 0.00 175.55 172.63 2x00 s GLU 56 N -0.15 2.46 -0.08 -0.62 2.12 -0.42 -1.21 118.70 120.79 2x00 s GLU 56 Ca 0.09 -1.84 -0.30 0.00 0.36 0.00 0.00 54.97 53.28 2x00 s GLU 56 Cb -0.12 -3.89 -0.03 0.00 0.26 0.00 0.00 34.13 30.35 2x00 s GLU 56 CO 0.01 -1.18 1.23 -1.14 -0.54 0.00 0.00 175.26 173.63 2x00 s GLN 57 N 1.22 4.31 -0.06 4.30 0.74 0.44 -3.54 119.66 127.07 2x00 s GLN 57 Ca 0.07 1.69 0.04 0.00 0.05 0.00 0.00 55.36 57.20 2x00 s GLN 57 Cb -0.25 -3.62 0.00 0.00 1.10 0.00 0.00 33.01 30.25 2x00 s GLN 57 CO -0.02 -0.53 -0.17 -0.65 -0.55 0.00 0.00 175.29 173.38 2x00 s GLN 58 N 2.58 1.98 -0.08 1.67 -0.21 0.52 -1.80 119.66 124.32 2x00 s GLN 58 Ca 0.56 -0.59 -0.05 0.00 0.02 0.00 0.00 55.36 55.31 2x00 s GLN 58 Cb -0.24 -1.63 0.04 0.00 1.00 0.00 0.00 33.01 32.17 2x00 s GLN 58 CO 0.20 0.15 0.20 -0.98 -2.12 0.00 0.00 175.29 172.74 2x00 s ARG 59 N 0.32 0.17 0.29 2.91 1.70 -0.72 -1.30 118.95 122.31 2x00 s ARG 59 Ca -0.10 0.42 -0.00 0.00 -0.47 0.00 0.00 55.73 55.57 2x00 s ARG 59 Cb -0.14 -0.09 -0.02 0.00 -0.57 0.00 0.00 34.95 34.13 2x00 s ARG 59 CO 0.04 -0.13 0.32 1.67 -1.08 0.00 0.00 175.30 176.11 2x00 s TRP 60 N 0.97 1.21 -0.02 5.89 -2.14 -1.07 -0.96 118.94 122.82 2x00 s TRP 60 Ca -0.07 -1.36 0.00 0.00 2.66 0.00 0.00 56.10 57.33 2x00 s TRP 60 Cb -0.09 -0.38 0.02 0.00 -3.10 0.00 0.00 33.47 29.93 2x00 s TRP 60 CO -0.06 -0.90 0.01 0.21 -2.66 0.00 0.00 176.95 173.56 2x00 s LYS 61 N -3.61 0.14 -0.04 3.25 2.20 -1.26 -0.61 119.74 119.80 2x00 s LYS 61 Ca 0.35 0.10 0.02 0.00 -0.36 0.00 0.00 55.97 56.08 2x00 s LYS 61 Cb 0.03 -0.33 0.01 0.00 -1.51 0.00 0.00 37.83 36.03 2x00 s LYS 61 CO 0.19 -0.12 -0.09 -0.51 -0.36 0.00 0.00 175.35 174.45 2x00 s LEU 62 N 0.87 1.67 0.26 5.43 1.43 -0.52 -4.90 118.68 122.92 2x00 s LEU 62 Ca -0.08 -0.21 -0.04 0.00 -1.03 0.00 0.00 54.13 52.77 2x00 s LEU 62 Cb -0.11 -0.61 0.33 0.00 0.03 0.00 0.00 46.19 45.83 2x00 s LEU 62 CO -0.02 0.04 1.93 0.78 0.23 0.00 0.00 176.35 179.31 2x00 h ASN 63 N 6.67 1.09 0.17 2.29 2.35 -1.89 -2.21 115.58 124.05 2x00 h ASN 63 Ca -0.34 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.39 2x00 h ASN 63 Cb 1.17 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.28 2x00 h ASN 63 CO 0.48 0.77 0.00 -1.54 -1.65 0.00 0.00 177.43 175.49 2x00 n SER 64 N -4.41 0.00 -0.53 5.81 3.41 -1.26 -1.65 113.62 114.99 2x00 n SER 64 Ca 0.12 0.46 0.05 0.00 -0.26 0.00 0.00 58.87 59.24 2x00 n SER 64 Cb 0.05 -0.47 0.10 0.00 -0.26 0.00 0.00 64.21 63.64 2x00 n SER 64 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2x00 n LEU 65 N -1.47 2.44 -4.81 1.04 4.77 -0.83 -4.98 117.00 113.16 2x00 n LEU 65 Ca 0.01 -1.55 -0.33 0.00 -0.03 0.00 0.00 56.01 54.12 2x00 n LEU 65 Cb 0.06 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 40.99 2x00 n LEU 65 CO 0.05 0.56 0.69 -0.04 -1.33 0.00 0.00 177.39 177.32 2x00 s MET 66 N -0.95 3.88 0.15 3.23 -1.94 -0.66 -3.89 119.30 119.12 2x00 s MET 66 Ca 0.18 1.19 -0.16 0.00 -1.71 0.00 0.00 55.69 55.19 2x00 s MET 66 Cb 0.10 -2.12 0.03 0.00 2.01 0.00 0.00 34.83 34.86 2x00 s MET 66 CO 0.14 -0.35 0.43 1.67 -0.01 0.00 0.00 175.02 176.91 2x00 s TRP 67 N -2.23 -0.12 -0.28 -0.03 -2.14 -0.57 -4.93 118.94 108.64 2x00 s TRP 67 Ca 0.64 -0.21 -0.18 0.00 2.66 0.00 0.00 56.10 59.00 2x00 s TRP 67 Cb -0.13 0.27 -0.02 0.00 -3.10 0.00 0.00 33.47 30.49 2x00 s TRP 67 CO 0.23 -0.77 0.54 0.34 -2.66 0.00 0.00 176.95 174.62 2x00 s ASP 68 N -2.84 6.43 0.59 -2.66 2.15 -1.26 -4.71 116.67 114.37 2x00 s ASP 68 Ca 0.06 0.43 0.29 0.00 0.43 0.00 0.00 52.55 53.77 2x00 s ASP 68 Cb 0.01 -2.29 1.79 0.00 -0.30 0.00 0.00 42.92 42.13 2x00 s ASP 68 CO -0.08 -0.35 2.25 -0.65 -0.17 0.00 0.00 175.17 176.17 2x00 h PRO 69 N 8.11 0.00 -0.30 4.34 0.11 -1.94 -2.56 132.00 139.76 2x00 h PRO 69 Ca -0.28 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.75 2x00 h PRO 69 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2x00 h PRO 69 CO 0.74 0.01 -0.14 -0.91 -0.21 0.00 0.00 178.00 177.48 2x00 h ASN 70 N 0.00 0.50 0.59 -2.05 2.35 -1.93 0.16 115.58 115.21 2x00 h ASN 70 Ca -0.00 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 2x00 h ASN 70 Cb 0.01 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.25 2x00 h ASN 70 CO 0.00 0.67 0.00 -0.62 -1.65 0.00 0.00 177.43 175.83 2x00 n GLU 71 N -4.19 0.20 -2.42 0.81 -0.58 -0.96 -3.87 120.64 109.63 2x00 n GLU 71 Ca 0.00 0.08 -0.06 0.00 -0.42 0.00 0.00 57.16 56.76 2x00 n GLU 71 Cb 0.34 -1.50 0.05 0.00 -0.57 0.00 0.00 31.44 29.75 2x00 n GLU 71 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2x00 n TYR 72 N -1.37 1.53 -3.66 -0.32 4.01 -0.84 -5.01 117.16 111.50 2x00 n TYR 72 Ca 0.09 -2.01 -0.24 0.00 -0.16 0.00 0.00 57.90 55.58 2x00 n TYR 72 Cb 0.22 -0.26 0.06 0.00 -0.31 0.00 0.00 39.34 39.06 2x00 n TYR 72 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2x00 n GLY 73 N -0.56 -0.46 2.92 2.72 0.00 -1.10 -2.97 105.19 105.73 2x00 n GLY 73 Ca 0.18 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.39 2x00 n GLY 73 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2x00 n ASN 74 N -3.00 -3.06 -4.69 1.61 3.02 0.51 -4.97 115.26 104.68 2x00 n ASN 74 Ca -0.09 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.03 2x00 n ASN 74 Cb 0.59 -1.93 -0.03 0.00 -0.61 0.00 0.00 39.78 37.80 2x00 n ASN 74 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2x00 n ILE 75 N -2.28 0.38 -0.02 2.41 5.41 -1.16 -4.86 119.36 119.24 2x00 n ILE 75 Ca 0.00 -0.07 0.05 0.00 1.00 0.00 0.00 62.75 63.73 2x00 n ILE 75 Cb 0.18 -2.11 -0.11 0.00 -0.71 0.00 0.00 39.64 36.89 2x00 n ILE 75 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2x00 n THR 76 N 4.71 0.16 -3.47 1.39 -2.24 -1.26 -4.47 114.28 109.10 2x00 n THR 76 Ca 0.18 -0.37 -0.14 0.00 -2.27 0.00 0.00 64.05 61.45 2x00 n THR 76 Cb 0.37 0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.59 2x00 n THR 76 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2x00 s ASP 77 N -3.84 -0.57 0.10 3.42 -4.77 -1.26 -0.50 116.67 109.25 2x00 s ASP 77 Ca -0.06 0.28 -0.02 0.00 -3.30 0.00 0.00 52.55 49.46 2x00 s ASP 77 Cb 0.08 0.54 -0.04 0.00 -1.09 0.00 0.00 42.92 42.42 2x00 s ASP 77 CO 0.59 -0.77 0.04 0.72 0.70 0.00 0.00 175.17 176.45 2x00 s PHE 78 N -2.61 0.65 -0.01 2.11 -0.12 -0.44 -4.99 117.98 112.58 2x00 s PHE 78 Ca -0.03 -1.10 -0.01 0.00 -0.05 0.00 0.00 56.93 55.74 2x00 s PHE 78 Cb -0.01 -0.40 -0.04 0.00 -0.63 0.00 0.00 43.02 41.95 2x00 s PHE 78 CO -0.03 -0.47 0.09 1.03 -0.05 0.00 0.00 175.22 175.79 2x00 s ARG 79 N -3.98 3.12 -0.03 1.99 1.81 -1.26 -1.36 118.95 119.24 2x00 s ARG 79 Ca 0.15 -0.46 -0.19 0.00 -1.72 0.00 0.00 55.73 53.52 2x00 s ARG 79 Cb 0.07 -2.90 0.04 0.00 -0.45 0.00 0.00 34.95 31.71 2x00 s ARG 79 CO -0.04 0.65 0.40 -0.08 -0.68 0.00 0.00 175.30 175.56 2x00 s THR 80 N -1.20 0.04 0.24 0.02 -1.32 -0.51 -5.00 115.64 107.92 2x00 s THR 80 Ca 0.23 -0.34 -0.31 0.00 -1.21 0.00 0.00 61.69 60.05 2x00 s THR 80 Cb -0.12 -0.71 -0.13 0.00 -1.51 0.00 0.00 72.50 70.03 2x00 s THR 80 CO 0.14 -0.19 1.52 -0.24 -2.21 0.00 0.00 174.62 173.64 2x00 n SER 81 N 1.23 3.25 0.27 8.08 2.88 -1.26 -0.31 113.62 127.76 2x00 n SER 81 Ca -0.21 1.13 0.17 0.00 -1.33 0.00 0.00 58.87 58.63 2x00 n SER 81 Cb 0.56 -1.49 0.91 0.00 -0.75 0.00 0.00 64.21 63.44 2x00 n SER 81 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2x00 h ALA 82 N 4.84 1.57 0.00 -1.46 0.00 -0.80 -1.73 119.26 121.68 2x00 h ALA 82 Ca -0.45 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2x00 h ALA 82 Cb 1.25 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2x00 h ALA 82 CO 0.80 -0.11 -0.03 0.00 0.00 0.00 0.00 179.25 179.91 2x00 h ALA 83 N 1.90 1.00 -0.01 0.00 0.00 -1.89 -2.96 119.26 117.30 2x00 h ALA 83 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2x00 h ALA 83 Cb 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2x00 h ALA 83 CO -0.00 0.04 -0.07 -0.25 0.00 0.00 0.00 179.25 178.96 2x00 n ASP 84 N -3.13 0.79 -4.20 0.00 8.00 -0.65 -4.87 116.55 112.49 2x00 n ASP 84 Ca 0.01 -1.00 -0.14 0.00 0.71 0.00 0.00 54.79 54.37 2x00 n ASP 84 Cb 0.35 -0.01 -0.10 0.00 -0.02 0.00 0.00 41.12 41.34 2x00 n ASP 84 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2x00 s ILE 85 N -2.23 1.01 0.24 0.53 -4.36 -1.12 -5.06 121.20 110.21 2x00 s ILE 85 Ca 0.35 -1.83 -0.30 0.00 -0.26 0.00 0.00 60.65 58.61 2x00 s ILE 85 Cb 0.21 -1.58 -0.09 0.00 1.25 0.00 0.00 42.46 42.24 2x00 s ILE 85 CO 0.42 -0.66 1.34 0.86 0.24 0.00 0.00 174.94 177.13 2x00 s TRP 86 N -2.90 3.17 0.05 1.37 -0.00 -1.26 -4.94 118.94 114.43 2x00 s TRP 86 Ca 0.10 1.22 0.04 0.00 -0.00 0.00 0.00 56.10 57.47 2x00 s TRP 86 Cb 0.00 -3.66 -0.02 0.00 -0.00 0.00 0.00 33.47 29.78 2x00 s TRP 86 CO -0.00 -2.03 -0.13 0.95 -0.00 0.00 0.00 176.95 175.73 2x00 s THR 87 N -0.21 1.01 0.61 5.86 -4.23 -1.26 -5.11 115.64 112.30 2x00 s THR 87 Ca 0.55 -1.12 -0.16 0.00 -1.18 0.00 0.00 61.69 59.78 2x00 s THR 87 Cb -0.38 -0.96 -0.02 0.00 1.34 0.00 0.00 72.50 72.48 2x00 s THR 87 CO 0.42 -0.15 1.09 -2.16 -0.54 0.00 0.00 174.62 173.28 2x00 s PRO 88 N -1.44 3.11 -0.43 3.99 0.04 -1.26 -4.92 135.00 134.08 2x00 s PRO 88 Ca -0.02 1.35 -0.03 0.00 0.04 0.00 0.00 61.00 62.34 2x00 s PRO 88 Cb -0.09 -1.99 0.15 0.00 0.04 0.00 0.00 34.50 32.61 2x00 s PRO 88 CO 0.02 -1.00 2.42 -0.40 0.04 0.00 0.00 177.00 178.08 2x00 n ASP 89 N -2.07 6.60 -4.69 6.66 5.75 -1.26 -4.96 116.55 122.57 2x00 n ASP 89 Ca 0.10 -3.22 -0.42 0.00 -0.01 0.00 0.00 54.79 51.24 2x00 n ASP 89 Cb 0.52 -1.15 -0.03 0.00 -1.03 0.00 0.00 41.12 39.44 2x00 n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2x00 s ILE 90 N -2.54 2.93 0.00 2.12 -1.09 -1.26 -2.89 121.20 118.47 2x00 s ILE 90 Ca 0.49 0.41 0.02 0.00 -2.23 0.00 0.00 60.65 59.34 2x00 s ILE 90 Cb 0.34 -3.26 -0.01 0.00 -1.58 0.00 0.00 42.46 37.95 2x00 s ILE 90 CO -0.13 0.00 -0.07 -0.89 -1.23 0.00 0.00 174.94 172.62 2x00 s THR 91 N 2.57 0.54 0.21 2.92 2.01 0.80 -4.91 115.64 119.78 2x00 s THR 91 Ca 0.75 -0.43 -0.30 0.00 0.31 0.00 0.00 61.69 62.01 2x00 s THR 91 Cb -0.41 -0.48 -0.09 0.00 0.01 0.00 0.00 72.50 71.53 2x00 s THR 91 CO 0.33 0.05 1.27 0.00 -0.69 0.00 0.00 174.62 175.58 2x00 s ALA 92 N -0.38 3.50 -0.80 7.40 0.00 -1.26 -1.25 121.76 128.97 2x00 s ALA 92 Ca 0.00 1.07 0.25 0.00 0.00 0.00 0.00 51.96 53.29 2x00 s ALA 92 Cb -0.04 -3.46 0.47 0.00 0.00 0.00 0.00 23.12 20.09 2x00 s ALA 92 CO -0.00 -0.49 1.40 0.66 0.00 0.00 0.00 175.76 177.33 2x00 n TYR 93 N 2.38 0.31 -2.45 0.00 4.01 0.18 -4.20 117.16 117.40 2x00 n TYR 93 Ca 0.05 0.09 0.03 0.00 -0.16 0.00 0.00 57.90 57.91 2x00 n TYR 93 Cb 0.43 -0.50 0.05 0.00 -0.31 0.00 0.00 39.34 39.01 2x00 n TYR 93 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2x00 n SER 94 N -1.84 1.32 -4.75 7.72 3.41 -1.26 -5.02 113.62 113.19 2x00 n SER 94 Ca 0.04 -2.28 -0.35 0.00 -0.26 0.00 0.00 58.87 56.02 2x00 n SER 94 Cb 0.39 -0.36 0.04 0.00 -0.26 0.00 0.00 64.21 64.02 2x00 n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2x00 s SER 95 N -2.54 5.06 0.00 4.04 1.04 -1.26 -1.57 113.70 118.48 2x00 s SER 95 Ca 0.34 2.27 0.07 0.00 0.48 0.00 0.00 55.95 59.11 2x00 s SER 95 Cb 0.38 -2.58 0.04 0.00 0.10 0.00 0.00 66.02 63.95 2x00 s SER 95 CO -0.13 -1.67 0.66 0.35 0.98 0.00 0.00 173.24 173.43 2x00 n THR 96 N -1.93 0.00 -3.72 2.02 -2.24 0.09 -4.85 114.28 103.66 2x00 n THR 96 Ca 0.13 -0.48 -0.13 0.00 -2.27 0.00 0.00 64.05 61.30 2x00 n THR 96 Cb 0.50 1.13 -0.08 0.00 -2.10 0.00 0.00 70.33 69.79 2x00 n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2x00 s ARG 97 N -0.77 0.78 0.36 -0.78 0.52 -1.25 -5.06 118.95 112.76 2x00 s ARG 97 Ca 0.08 -0.24 -0.28 0.00 -0.52 0.00 0.00 55.73 54.76 2x00 s ARG 97 Cb 0.06 0.35 -0.11 0.00 0.52 0.00 0.00 34.95 35.77 2x00 s ARG 97 CO 0.12 -0.24 1.49 -2.14 0.02 0.00 0.00 175.30 174.55 2x00 s PRO 98 N -1.76 4.13 0.51 3.54 0.02 -1.26 -4.65 135.00 135.53 2x00 s PRO 98 Ca -0.10 2.54 -0.23 0.00 0.02 0.00 0.00 61.00 63.23 2x00 s PRO 98 Cb -0.03 -2.99 -0.07 0.00 0.02 0.00 0.00 34.50 31.44 2x00 s PRO 98 CO 0.02 -0.52 1.29 0.28 -0.33 0.00 0.00 177.00 177.74 2x00 n VAL 99 N 0.79 3.33 -4.11 3.83 0.31 -1.26 -4.88 118.33 116.34 2x00 n VAL 99 Ca 0.02 -0.50 -0.35 0.00 -0.01 0.00 0.00 64.34 63.51 2x00 n VAL 99 Cb 0.39 -1.59 -0.14 0.00 -0.91 0.00 0.00 33.84 31.60 2x00 n VAL 99 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2x00 s GLN 100 N -2.62 3.42 -0.08 5.55 -0.21 -0.74 -4.99 119.66 119.99 2x00 s GLN 100 Ca 0.68 -0.62 -0.27 0.00 0.02 0.00 0.00 55.36 55.17 2x00 s GLN 100 Cb -0.45 -2.94 -0.02 0.00 1.00 0.00 0.00 33.01 30.60 2x00 s GLN 100 CO 0.52 -0.07 0.90 0.08 -2.12 0.00 0.00 175.29 174.60 2x00 s VAL 101 N 1.15 4.88 -0.39 1.09 1.01 -1.26 -0.76 120.40 126.12 2x00 s VAL 101 Ca 0.02 1.83 0.20 0.00 0.00 0.00 0.00 61.98 64.04 2x00 s VAL 101 Cb -0.14 -4.22 -0.28 0.00 0.00 0.00 0.00 36.38 31.73 2x00 s VAL 101 CO -0.01 0.10 0.61 0.18 0.00 0.00 0.00 175.10 175.99 2x00 n LEU 102 N 4.49 0.37 -4.59 3.92 4.77 0.48 -4.96 117.00 121.49 2x00 n LEU 102 Ca 0.05 -0.20 -0.23 0.00 -0.03 0.00 0.00 56.01 55.60 2x00 n LEU 102 Cb 0.50 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.51 2x00 n LEU 102 CO 0.50 0.09 -0.37 -0.94 -1.33 0.00 0.00 177.39 175.34 2x00 s SER 103 N -3.79 4.25 0.28 -1.43 1.04 -1.24 -4.96 113.70 107.85 2x00 s SER 103 Ca -0.02 -0.76 -0.30 0.00 0.48 0.00 0.00 55.95 55.36 2x00 s SER 103 Cb 0.14 -0.68 -0.10 0.00 0.10 0.00 0.00 66.02 65.48 2x00 s SER 103 CO 0.85 0.02 1.47 -2.84 0.98 0.00 0.00 173.24 173.71 2x00 s PRO 104 N -3.60 4.22 -1.33 4.02 0.02 -1.26 -4.87 135.00 132.20 2x00 s PRO 104 Ca 0.31 2.39 -0.14 0.00 0.02 0.00 0.00 61.00 63.58 2x00 s PRO 104 Cb -0.06 -3.07 0.11 0.00 0.02 0.00 0.00 34.50 31.50 2x00 s PRO 104 CO 0.18 -0.46 1.87 1.04 -0.33 0.00 0.00 177.00 179.30 2x00 n GLN 105 N 1.94 3.24 -4.78 5.54 1.13 -1.26 -4.90 117.38 118.28 2x00 n GLN 105 Ca 0.06 -3.25 -0.25 0.00 -1.94 0.00 0.00 57.00 51.62 2x00 n GLN 105 Cb 0.40 -3.20 -0.16 0.00 0.11 0.00 0.00 30.24 27.39 2x00 n GLN 105 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2x00 s ILE 106 N 2.39 1.35 0.33 5.09 1.01 -1.26 -0.06 121.20 130.04 2x00 s ILE 106 Ca 0.46 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.51 2x00 s ILE 106 Cb 0.07 -1.15 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 2x00 s ILE 106 CO -0.01 0.39 0.11 0.00 0.00 0.00 0.00 174.94 175.43 2x00 s ALA 107 N -0.02 3.42 -0.15 9.38 0.00 0.57 -4.65 121.76 130.31 2x00 s ALA 107 Ca -0.02 -1.80 0.01 0.00 0.00 0.00 0.00 51.96 50.15 2x00 s ALA 107 Cb -0.10 -0.72 0.00 0.00 0.00 0.00 0.00 23.12 22.30 2x00 s ALA 107 CO 0.01 0.08 -0.18 0.08 0.00 0.00 0.00 175.76 175.76 2x00 s VAL 108 N -2.41 2.41 -0.18 0.00 1.01 0.20 -1.42 120.40 120.01 2x00 s VAL 108 Ca 0.36 -0.86 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 2x00 s VAL 108 Cb -0.03 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 2x00 s VAL 108 CO 0.22 0.53 -0.01 -0.69 0.00 0.00 0.00 175.10 175.15 2x00 s VAL 109 N 0.87 4.05 0.16 2.92 1.01 -0.47 -0.19 120.40 128.75 2x00 s VAL 109 Ca -0.05 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.68 2x00 s VAL 109 Cb -0.15 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 2x00 s VAL 109 CO -0.02 0.46 0.20 -0.89 0.00 0.00 0.00 175.10 174.85 2x00 s THR 110 N 0.61 4.82 0.62 3.92 2.01 0.62 -1.32 115.64 126.92 2x00 s THR 110 Ca -0.01 -0.92 0.32 0.00 0.31 0.00 0.00 61.69 61.39 2x00 s THR 110 Cb -0.14 -3.47 0.36 0.00 0.01 0.00 0.00 72.50 69.26 2x00 s THR 110 CO 0.02 -0.10 2.10 1.12 -0.69 0.00 0.00 174.62 177.08 2x00 h HIS 111 N 2.31 0.00 0.00 4.92 2.07 -1.09 0.17 115.15 123.53 2x00 h HIS 111 Ca -0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 2x00 h HIS 111 Cb 1.20 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 2x00 h HIS 111 CO 0.56 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.02 2x00 n ASP 112 N -3.43 0.00 0.00 3.10 5.75 -1.26 -1.52 116.55 119.19 2x00 n ASP 112 Ca 0.00 -1.00 0.00 0.00 -0.01 0.00 0.00 54.79 53.78 2x00 n ASP 112 Cb 0.30 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.39 2x00 n ASP 112 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2x00 n GLY 113 N 0.70 0.76 3.81 6.12 0.00 0.61 -4.69 105.19 112.50 2x00 n GLY 113 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2x00 n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x00 s SER 114 N -3.00 7.07 -0.06 1.61 1.04 -1.20 -1.44 113.70 117.71 2x00 s SER 114 Ca 0.00 1.69 0.04 0.00 0.48 0.00 0.00 55.95 58.16 2x00 s SER 114 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.59 2x00 s SER 114 CO 0.00 -0.23 -0.18 -0.69 0.98 0.00 0.00 173.24 173.12 2x00 s VAL 115 N -1.94 1.55 -0.17 5.02 1.01 0.22 -0.27 120.40 125.81 2x00 s VAL 115 Ca 0.56 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 2x00 s VAL 115 Cb -0.13 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.89 2x00 s VAL 115 CO 0.17 0.44 -0.06 -0.04 0.00 0.00 0.00 175.10 175.62 2x00 s MET 116 N 0.25 3.50 -0.09 2.72 -1.94 0.73 -2.61 119.30 121.86 2x00 s MET 116 Ca -0.10 -0.60 -0.03 0.00 -1.71 0.00 0.00 55.69 53.25 2x00 s MET 116 Cb -0.14 -2.89 0.05 0.00 2.01 0.00 0.00 34.83 33.86 2x00 s MET 116 CO 0.04 0.07 0.13 0.12 -0.01 0.00 0.00 175.02 175.37 2x00 s PHE 117 N 0.79 -0.08 -0.52 -0.03 5.36 -0.42 -0.63 117.98 122.46 2x00 s PHE 117 Ca -0.02 0.39 0.05 0.00 -0.96 0.00 0.00 56.93 56.39 2x00 s PHE 117 Cb -0.15 -0.38 0.20 0.00 -0.34 0.00 0.00 43.02 42.36 2x00 s PHE 117 CO 0.02 -0.30 0.48 -0.89 -1.46 0.00 0.00 175.22 173.07 2x00 n ILE 118 N 5.31 0.17 -2.40 3.12 5.41 -1.26 -0.35 119.36 129.35 2x00 n ILE 118 Ca -0.04 -4.19 -0.41 0.00 1.00 0.00 0.00 62.75 59.10 2x00 n ILE 118 Cb 0.50 -1.92 -0.03 0.00 -0.71 0.00 0.00 39.64 37.47 2x00 n ILE 118 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2x00 s PRO 119 N -0.98 4.50 0.07 0.38 0.04 -1.23 -4.73 135.00 133.05 2x00 s PRO 119 Ca 0.32 1.83 -0.27 0.00 0.04 0.00 0.00 61.00 62.93 2x00 s PRO 119 Cb 0.06 -3.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.28 2x00 s PRO 119 CO -0.15 -0.09 0.84 0.00 0.04 0.00 0.00 177.00 177.64 2x00 s ALA 120 N 0.08 3.32 0.03 8.56 0.00 -1.26 -1.30 121.76 131.19 2x00 s ALA 120 Ca 0.53 0.39 0.02 0.00 0.00 0.00 0.00 51.96 52.90 2x00 s ALA 120 Cb -0.32 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 2x00 s ALA 120 CO 0.35 0.03 -0.07 -0.65 0.00 0.00 0.00 175.76 175.43 2x00 s GLN 121 N -0.04 0.47 -0.16 0.00 -0.21 -0.26 -0.38 119.66 119.08 2x00 s GLN 121 Ca 0.41 -0.58 -0.06 0.00 0.02 0.00 0.00 55.36 55.15 2x00 s GLN 121 Cb -0.22 -0.29 -0.04 0.00 1.00 0.00 0.00 33.01 33.47 2x00 s GLN 121 CO 0.25 0.06 0.05 0.50 -2.12 0.00 0.00 175.29 174.03 2x00 s ARG 122 N -1.16 3.74 -0.07 2.91 3.52 0.06 -2.27 118.95 125.69 2x00 s ARG 122 Ca -0.07 -0.34 0.02 0.00 -0.13 0.00 0.00 55.73 55.20 2x00 s ARG 122 Cb -0.08 -3.12 0.02 0.00 -1.56 0.00 0.00 34.95 30.21 2x00 s ARG 122 CO 0.00 0.39 -0.10 -1.17 -0.81 0.00 0.00 175.30 173.62 2x00 s LEU 123 N 0.02 1.52 -0.25 -0.88 2.96 -0.11 -1.79 118.68 120.14 2x00 s LEU 123 Ca 0.05 -0.26 -0.11 0.00 -0.22 0.00 0.00 54.13 53.60 2x00 s LEU 123 Cb -0.12 -0.74 -0.05 0.00 0.50 0.00 0.00 46.19 45.78 2x00 s LEU 123 CO 0.01 -0.00 0.18 -0.44 -1.32 0.00 0.00 176.35 174.77 2x00 s SER 124 N 0.84 6.11 0.12 3.68 0.01 -1.26 -0.69 113.70 122.51 2x00 s SER 124 Ca -0.12 0.10 -0.00 0.00 1.31 0.00 0.00 55.95 57.24 2x00 s SER 124 Cb -0.15 -2.11 -0.04 0.00 0.21 0.00 0.00 66.02 63.93 2x00 s SER 124 CO 0.02 0.03 0.03 0.72 0.41 0.00 0.00 173.24 174.45 2x00 s PHE 125 N 1.22 0.86 -0.21 2.43 -0.12 -0.76 -0.73 117.98 120.66 2x00 s PHE 125 Ca 0.08 -1.16 -0.29 0.00 -0.05 0.00 0.00 56.93 55.50 2x00 s PHE 125 Cb -0.14 -0.50 -0.03 0.00 -0.63 0.00 0.00 43.02 41.72 2x00 s PHE 125 CO 0.06 -0.43 1.58 -1.64 -0.05 0.00 0.00 175.22 174.73 2x00 s MET 126 N -4.00 3.86 -0.25 1.99 -1.94 -0.61 -1.87 119.30 116.48 2x00 s MET 126 Ca 0.21 1.67 -0.10 0.00 -1.71 0.00 0.00 55.69 55.76 2x00 s MET 126 Cb 0.07 -4.01 0.10 0.00 2.01 0.00 0.00 34.83 33.01 2x00 s MET 126 CO -0.00 -1.21 0.55 0.00 -0.01 0.00 0.00 175.02 174.34 2x00 s ASP 128 N 2.43 6.35 -0.04 0.00 2.15 -1.26 -3.50 116.67 122.80 2x00 s ASP 128 Ca -0.06 -0.27 0.09 0.00 0.43 0.00 0.00 52.55 52.74 2x00 s ASP 128 Cb -0.10 -2.34 0.32 0.00 -0.30 0.00 0.00 42.92 40.50 2x00 s ASP 128 CO -0.16 -0.81 1.18 -0.81 -0.17 0.00 0.00 175.17 174.40 2x00 n PRO 129 N 6.38 2.12 -1.66 4.34 -0.04 -1.26 -4.69 135.00 140.19 2x00 n PRO 129 Ca -0.01 -1.28 -0.47 0.00 -0.04 0.00 0.00 63.50 61.70 2x00 n PRO 129 Cb 0.48 -1.47 -0.04 0.00 -0.04 0.00 0.00 33.50 32.43 2x00 n PRO 129 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2x00 n THR 130 N 0.41 0.02 0.00 0.52 -1.04 -1.26 -0.97 114.28 111.96 2x00 n THR 130 Ca 0.12 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 2x00 n THR 130 Cb 0.42 -1.44 0.00 0.00 -1.82 0.00 0.00 70.33 67.49 2x00 n THR 130 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2x00 n GLY 131 N 3.32 1.79 0.39 3.41 0.00 -1.26 -4.55 105.19 108.29 2x00 n GLY 131 Ca 0.17 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.41 2x00 n GLY 131 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2x00 h VAL 132 N 0.00 0.68 -0.79 1.61 3.04 -1.23 -1.37 116.25 118.19 2x00 h VAL 132 Ca 0.00 0.00 -0.46 0.00 -1.01 0.00 0.00 66.70 65.23 2x00 h VAL 132 Cb 0.00 0.71 -0.19 0.00 -2.01 0.00 0.00 31.29 29.80 2x00 h VAL 132 CO 0.00 0.00 0.55 -0.90 -1.01 0.00 0.00 177.57 176.21 2x00 n ASP 133 N -4.30 6.81 -4.15 3.17 5.75 -1.26 -0.61 116.55 121.95 2x00 n ASP 133 Ca 0.10 -3.29 -0.11 0.00 -0.01 0.00 0.00 54.79 51.48 2x00 n ASP 133 Cb 0.64 -1.08 -0.09 0.00 -1.03 0.00 0.00 41.12 39.57 2x00 n ASP 133 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2x00 s SER 134 N -0.30 0.15 0.06 -1.12 1.04 -0.52 -5.03 113.70 107.98 2x00 s SER 134 Ca 0.45 -1.26 -0.23 0.00 0.48 0.00 0.00 55.95 55.39 2x00 s SER 134 Cb 0.34 0.39 -0.16 0.00 0.10 0.00 0.00 66.02 66.69 2x00 s SER 134 CO -0.07 -0.85 1.59 -0.08 0.98 0.00 0.00 173.24 174.81 2x00 h GLU 135 N 2.63 0.04 0.00 4.02 4.81 -1.91 -2.66 114.58 121.52 2x00 h GLU 135 Ca -0.34 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 2x00 h GLU 135 Cb 1.24 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2x00 h GLU 135 CO 0.52 0.19 0.00 0.39 -0.73 0.00 0.00 179.01 179.38 2x00 n GLU 136 N -4.99 0.04 0.00 1.92 1.02 -1.26 -4.96 120.64 112.42 2x00 n GLU 136 Ca -0.07 0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2x00 n GLU 136 Cb 0.11 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 29.96 2x00 n GLU 136 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x00 n GLY 137 N 0.80 -0.24 3.65 0.62 0.00 -1.00 -4.70 105.19 104.33 2x00 n GLY 137 Ca 0.05 -1.05 -0.27 0.00 0.00 0.00 0.00 46.02 44.75 2x00 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x00 s ALA 138 N -1.48 3.17 -0.11 4.61 0.00 0.10 -4.25 121.76 123.80 2x00 s ALA 138 Ca 0.00 -1.36 0.03 0.00 0.00 0.00 0.00 51.96 50.64 2x00 s ALA 138 Cb 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 22.15 2x00 s ALA 138 CO 0.00 0.50 -0.23 0.99 0.00 0.00 0.00 175.76 177.02 2x00 s THR 139 N -1.68 2.03 0.16 0.00 2.01 -1.26 -1.06 115.64 115.85 2x00 s THR 139 Ca 0.27 -0.99 0.02 0.00 0.31 0.00 0.00 61.69 61.30 2x00 s THR 139 Cb -0.09 -1.77 -0.05 0.00 0.01 0.00 0.00 72.50 70.60 2x00 s THR 139 CO 0.18 0.55 -0.02 0.00 -0.69 0.00 0.00 174.62 174.64 2x00 s ALA 141 N -3.58 -0.86 -0.13 0.00 0.00 -1.26 0.36 121.76 116.28 2x00 s ALA 141 Ca 0.22 0.54 -0.07 0.00 0.00 0.00 0.00 51.96 52.64 2x00 s ALA 141 Cb 0.05 -0.08 0.05 0.00 0.00 0.00 0.00 23.12 23.14 2x00 s ALA 141 CO 0.03 -0.25 0.32 0.54 0.00 0.00 0.00 175.76 176.40 2x00 s VAL 142 N -0.97 -0.04 0.11 0.00 0.11 -0.21 -4.90 120.40 114.51 2x00 s VAL 142 Ca -0.10 0.12 -0.16 0.00 -2.93 0.00 0.00 61.98 58.91 2x00 s VAL 142 Cb -0.04 -0.48 -0.07 0.00 -1.53 0.00 0.00 36.38 34.26 2x00 s VAL 142 CO 0.04 0.05 0.54 -0.54 -3.33 0.00 0.00 175.10 171.86 2x00 s LYS 143 N 1.33 4.05 -0.07 1.54 1.02 -1.26 -0.80 119.74 125.55 2x00 s LYS 143 Ca -0.09 0.57 0.05 0.00 0.02 0.00 0.00 55.97 56.51 2x00 s LYS 143 Cb -0.10 -3.06 -0.00 0.00 -0.52 0.00 0.00 37.83 34.16 2x00 s LYS 143 CO -0.10 0.55 -0.22 -0.06 -0.92 0.00 0.00 175.35 174.60 2x00 s PHE 144 N -1.32 2.21 0.24 3.18 0.08 0.39 -0.65 117.98 122.12 2x00 s PHE 144 Ca 0.34 -0.76 -0.21 0.00 0.12 0.00 0.00 56.93 56.41 2x00 s PHE 144 Cb -0.17 -1.48 0.06 0.00 -0.57 0.00 0.00 43.02 40.86 2x00 s PHE 144 CO 0.19 -0.28 0.89 0.20 -0.10 0.00 0.00 175.22 176.12 2x00 s GLY 145 N 0.14 0.02 0.35 4.36 0.00 -0.38 -0.26 107.32 111.55 2x00 s GLY 145 Ca -0.10 -0.28 -0.28 0.00 0.00 0.00 0.00 44.72 44.06 2x00 s GLY 145 CO 0.05 0.49 1.34 -0.45 0.00 0.00 0.00 173.10 174.53 2x00 s SER 146 N -3.08 6.61 0.04 1.64 0.15 -1.26 -0.14 113.70 117.66 2x00 s SER 146 Ca 0.15 2.75 -0.14 0.00 0.70 0.00 0.00 55.95 59.41 2x00 s SER 146 Cb -0.03 -2.65 -0.34 0.00 -1.71 0.00 0.00 66.02 61.28 2x00 s SER 146 CO 0.06 -0.65 1.03 -0.25 1.20 0.00 0.00 173.24 174.63 2x00 h TRP 147 N 3.18 0.93 0.00 3.44 2.91 -1.88 -3.41 115.95 121.12 2x00 h TRP 147 Ca -0.49 -0.67 0.00 0.00 1.13 0.00 0.00 58.89 58.86 2x00 h TRP 147 Cb 1.23 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.84 2x00 h TRP 147 CO 0.55 1.52 -0.31 1.33 -1.03 0.00 0.00 178.44 180.50 2x00 n VAL 148 N -3.70 0.00 -4.42 2.65 0.24 -1.26 -5.03 118.33 106.80 2x00 n VAL 148 Ca -0.15 -0.37 -0.34 0.00 -2.04 0.00 0.00 64.34 61.43 2x00 n VAL 148 Cb 1.08 0.91 -0.10 0.00 -1.47 0.00 0.00 33.84 34.26 2x00 n VAL 148 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2x00 s TYR 149 N -1.45 3.09 0.74 6.34 2.02 -1.26 -5.12 117.35 121.70 2x00 s TYR 149 Ca 0.01 0.06 -0.07 0.00 -0.37 0.00 0.00 57.07 56.69 2x00 s TYR 149 Cb 0.02 -1.81 0.08 0.00 -0.40 0.00 0.00 41.96 39.85 2x00 s TYR 149 CO 0.14 0.33 1.05 -1.54 -1.57 0.00 0.00 175.55 173.96 2x00 s SER 150 N -0.58 4.57 0.61 2.29 1.04 -1.26 -4.70 113.70 115.68 2x00 s SER 150 Ca 0.09 0.38 0.40 0.00 0.48 0.00 0.00 55.95 57.30 2x00 s SER 150 Cb -0.12 -0.93 2.05 0.00 0.10 0.00 0.00 66.02 67.13 2x00 s SER 150 CO 0.02 -1.76 2.22 1.23 0.98 0.00 0.00 173.24 175.93 2x00 h GLY 151 N -0.73 0.00 2.00 7.32 0.00 -0.96 0.18 103.07 110.87 2x00 h GLY 151 Ca -0.44 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 2x00 h GLY 151 CO 0.56 0.00 -0.03 0.74 0.00 0.00 0.00 176.54 177.82 2x00 h PHE 152 N 0.00 0.00 0.00 5.60 0.04 -1.94 -3.29 116.94 117.35 2x00 h PHE 152 Ca 0.00 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.42 2x00 h PHE 152 Cb 0.15 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.25 2x00 h PHE 152 CO 0.00 0.03 -2.18 0.39 -0.60 0.00 0.00 178.31 175.94 2x00 n GLU 153 N -3.12 0.45 -4.02 1.51 4.71 -0.23 -4.37 120.64 115.56 2x00 n GLU 153 Ca 0.01 0.19 -0.33 0.00 -0.01 0.00 0.00 57.16 57.03 2x00 n GLU 153 Cb 0.36 -1.26 -0.15 0.00 -1.01 0.00 0.00 31.44 29.38 2x00 n GLU 153 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2x00 s ILE 154 N -2.39 2.38 0.20 -3.67 1.01 -0.12 -0.74 121.20 117.87 2x00 s ILE 154 Ca -0.29 -1.64 -0.19 0.00 0.00 0.00 0.00 60.65 58.53 2x00 s ILE 154 Cb 0.11 -2.43 -0.08 0.00 0.01 0.00 0.00 42.46 40.08 2x00 s ILE 154 CO 0.38 -0.10 0.68 -0.62 0.00 0.00 0.00 174.94 175.28 2x00 s ASP 155 N 1.13 7.03 -0.01 3.58 2.15 0.21 -3.87 116.67 126.89 2x00 s ASP 155 Ca -0.06 1.35 0.07 0.00 0.43 0.00 0.00 52.55 54.33 2x00 s ASP 155 Cb -0.20 -2.39 -0.02 0.00 -0.30 0.00 0.00 42.92 40.00 2x00 s ASP 155 CO -0.04 0.07 -0.21 -0.22 -0.17 0.00 0.00 175.17 174.60 2x00 s LEU 156 N -1.88 2.37 0.03 -1.34 2.96 -1.26 -0.22 118.68 119.34 2x00 s LEU 156 Ca 0.41 -0.38 -0.08 0.00 -0.22 0.00 0.00 54.13 53.85 2x00 s LEU 156 Cb -0.17 -1.43 -0.00 0.00 0.50 0.00 0.00 46.19 45.09 2x00 s LEU 156 CO 0.21 0.31 0.16 -0.75 -1.32 0.00 0.00 176.35 174.96 2x00 s LYS 157 N -0.84 0.63 0.13 1.98 2.20 -0.46 -4.95 119.74 118.44 2x00 s LYS 157 Ca 0.11 -0.63 0.11 0.00 -0.36 0.00 0.00 55.97 55.20 2x00 s LYS 157 Cb -0.10 0.26 -0.04 0.00 -1.51 0.00 0.00 37.83 36.44 2x00 s LYS 157 CO 0.01 -0.17 -0.26 0.95 -0.36 0.00 0.00 175.35 175.52 2x00 s THR 158 N -2.40 2.20 0.14 3.43 -4.23 -1.26 -0.22 115.64 113.30 2x00 s THR 158 Ca -0.06 -1.76 0.08 0.00 -1.18 0.00 0.00 61.69 58.77 2x00 s THR 158 Cb -0.02 -1.96 -0.16 0.00 1.34 0.00 0.00 72.50 71.70 2x00 s THR 158 CO -0.03 0.05 1.36 0.44 -0.54 0.00 0.00 174.62 175.90 2x00 h ASP 159 N 3.83 0.00 -5.04 3.99 3.32 -1.97 -3.48 116.42 117.07 2x00 h ASP 159 Ca -0.50 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.49 2x00 h ASP 159 Cb 1.18 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.57 2x00 h ASP 159 CO 0.40 0.90 -0.05 0.28 -1.72 0.00 0.00 179.24 179.05 2x00 s THR 160 N -2.92 0.05 -1.78 0.35 -1.32 -1.26 -5.04 115.64 103.72 2x00 s THR 160 Ca 0.01 -0.42 0.27 0.00 -1.21 0.00 0.00 61.69 60.34 2x00 s THR 160 Cb 0.11 -1.01 0.32 0.00 -1.51 0.00 0.00 72.50 70.40 2x00 s THR 160 CO 0.80 -0.23 1.63 -0.90 -2.21 0.00 0.00 174.62 173.71 2x00 n ASP 161 N 0.26 0.95 -4.64 8.08 3.85 -1.26 -4.81 116.55 118.99 2x00 n ASP 161 Ca -0.18 -0.87 -0.41 0.00 -0.71 0.00 0.00 54.79 52.63 2x00 n ASP 161 Cb 0.61 0.09 -0.06 0.00 -1.35 0.00 0.00 41.12 40.41 2x00 n ASP 161 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 2x00 s GLN 162 N -2.47 4.16 0.30 0.11 -1.52 -1.26 -0.89 119.66 118.09 2x00 s GLN 162 Ca 0.26 0.63 -0.29 0.00 -1.95 0.00 0.00 55.36 54.01 2x00 s GLN 162 Cb 0.19 -3.62 -0.10 0.00 -0.22 0.00 0.00 33.01 29.26 2x00 s GLN 162 CO 0.50 -0.37 1.34 0.08 -0.25 0.00 0.00 175.29 176.59 2x00 s VAL 163 N 2.35 2.72 -0.41 1.09 1.01 -0.89 -4.88 120.40 121.39 2x00 s VAL 163 Ca 0.28 0.69 -0.28 0.00 0.00 0.00 0.00 61.98 62.67 2x00 s VAL 163 Cb -0.16 -3.44 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 2x00 s VAL 163 CO 0.09 0.15 1.60 -0.62 0.00 0.00 0.00 175.10 176.31 2x00 s ASP 164 N -0.23 6.05 -0.10 3.32 -1.08 -0.63 -4.85 116.67 119.16 2x00 s ASP 164 Ca 0.52 0.90 0.15 0.00 -0.52 0.00 0.00 52.55 53.60 2x00 s ASP 164 Cb -0.40 -2.53 0.52 0.00 -1.46 0.00 0.00 42.92 39.04 2x00 s ASP 164 CO 0.50 -1.65 1.43 0.18 0.52 0.00 0.00 175.17 176.15 2x00 n LEU 165 N 9.80 3.86 0.17 -1.34 4.77 -1.26 -1.51 117.00 131.48 2x00 n LEU 165 Ca 0.19 -2.50 0.13 0.00 -0.03 0.00 0.00 56.01 53.80 2x00 n LEU 165 Cb 0.48 -0.45 0.53 0.00 -2.33 0.00 0.00 43.42 41.65 2x00 n LEU 165 CO 0.70 0.73 0.89 0.77 -1.33 0.00 0.00 177.39 179.16 2x00 h SER 166 N 2.59 0.00 -0.33 -1.43 4.64 -1.88 -2.63 113.55 114.51 2x00 h SER 166 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x00 h SER 166 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2x00 h SER 166 CO 0.16 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.92 2x00 n SER 167 N -2.48 3.09 -4.74 4.97 7.64 -1.26 -5.04 113.62 115.79 2x00 n SER 167 Ca 0.02 -2.17 -0.42 0.00 1.01 0.00 0.00 58.87 57.31 2x00 n SER 167 Cb 0.27 -0.28 -0.02 0.00 -1.01 0.00 0.00 64.21 63.17 2x00 n SER 167 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2x00 s TYR 168 N -1.31 2.86 -0.14 1.43 5.04 -1.00 -4.66 117.35 119.57 2x00 s TYR 168 Ca 0.26 0.69 -0.29 0.00 -2.44 0.00 0.00 57.07 55.29 2x00 s TYR 168 Cb 0.16 -4.04 -0.05 0.00 0.35 0.00 0.00 41.96 38.38 2x00 s TYR 168 CO 0.14 -3.62 1.76 -0.47 -1.34 0.00 0.00 175.55 172.02 2x00 s TYR 169 N 0.40 1.82 -0.33 4.97 5.04 0.11 -4.87 117.35 124.48 2x00 s TYR 169 Ca 0.66 0.30 0.27 0.00 -2.44 0.00 0.00 57.07 55.87 2x00 s TYR 169 Cb -0.47 -4.00 0.96 0.00 0.35 0.00 0.00 41.96 38.80 2x00 s TYR 169 CO 0.42 -3.72 1.80 0.00 -1.34 0.00 0.00 175.55 172.70 2x00 h ALA 170 N 11.00 1.00 -0.39 3.97 0.00 -1.90 -2.41 119.26 130.53 2x00 h ALA 170 Ca -0.38 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 2x00 h ALA 170 Cb 1.18 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2x00 h ALA 170 CO 0.98 0.00 0.03 0.43 0.00 0.00 0.00 179.25 180.69 2x00 n SER 171 N -2.68 4.24 -4.65 0.00 7.64 -1.26 -5.02 113.62 111.89 2x00 n SER 171 Ca 0.03 -3.10 -0.34 0.00 1.01 0.00 0.00 58.87 56.46 2x00 n SER 171 Cb 0.35 -0.61 0.11 0.00 -1.01 0.00 0.00 64.21 63.05 2x00 n SER 171 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2x00 n SER 172 N -0.31 0.69 0.28 6.43 2.88 -0.91 -4.89 113.62 117.79 2x00 n SER 172 Ca 0.26 0.60 0.16 0.00 -1.33 0.00 0.00 58.87 58.57 2x00 n SER 172 Cb 1.03 -1.46 0.79 0.00 -0.75 0.00 0.00 64.21 63.82 2x00 n SER 172 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2x00 h LYS 173 N -0.70 0.00 -5.90 -1.46 1.79 -1.90 -3.44 116.57 104.97 2x00 h LYS 173 Ca -0.47 0.00 -0.65 0.00 -2.18 0.00 0.00 60.65 57.35 2x00 h LYS 173 Cb 1.31 0.00 -0.31 0.00 -1.58 0.00 0.00 32.23 31.65 2x00 h LYS 173 CO 0.46 0.06 -0.87 0.71 -1.08 0.00 0.00 179.45 178.73 2x00 s TYR 174 N -3.93 2.21 -0.01 -1.35 2.02 -1.26 -0.49 117.35 114.54 2x00 s TYR 174 Ca -0.01 -0.61 -0.01 0.00 -0.37 0.00 0.00 57.07 56.06 2x00 s TYR 174 Cb 0.11 -1.45 -0.04 0.00 -0.40 0.00 0.00 41.96 40.18 2x00 s TYR 174 CO 0.54 -0.17 0.10 -1.83 -1.57 0.00 0.00 175.55 172.61 2x00 s GLU 175 N -0.18 3.13 -0.11 -0.62 -1.05 0.33 -4.80 118.70 115.40 2x00 s GLU 175 Ca -0.01 -0.45 -0.23 0.00 -0.15 0.00 0.00 54.97 54.13 2x00 s GLU 175 Cb -0.12 -2.90 -0.03 0.00 -0.44 0.00 0.00 34.13 30.63 2x00 s GLU 175 CO 0.03 0.66 0.69 0.42 0.95 0.00 0.00 175.26 178.00 2x00 s ILE 176 N -1.20 5.03 -0.18 1.83 -1.09 -1.26 -1.99 121.20 122.34 2x00 s ILE 176 Ca 0.23 1.38 -0.11 0.00 -2.23 0.00 0.00 60.65 59.93 2x00 s ILE 176 Cb -0.12 -4.02 -0.22 0.00 -1.58 0.00 0.00 42.46 36.53 2x00 s ILE 176 CO 0.14 0.20 0.18 0.18 -1.23 0.00 0.00 174.94 174.42 2x00 n LEU 177 N 4.17 2.38 -3.46 2.97 4.77 0.40 -4.99 117.00 123.25 2x00 n LEU 177 Ca -0.01 0.24 -0.13 0.00 -0.03 0.00 0.00 56.01 56.09 2x00 n LEU 177 Cb 0.51 -1.02 -0.03 0.00 -2.33 0.00 0.00 43.42 40.55 2x00 n LEU 177 CO 0.46 0.67 0.38 -0.94 -1.33 0.00 0.00 177.39 176.62 2x00 s SER 178 N -6.97 -0.54 -0.20 -1.43 1.04 -1.07 -5.00 113.70 99.53 2x00 s SER 178 Ca -0.27 0.06 -0.06 0.00 0.48 0.00 0.00 55.95 56.16 2x00 s SER 178 Cb 0.07 0.57 0.09 0.00 0.10 0.00 0.00 66.02 66.86 2x00 s SER 178 CO 0.67 -0.90 0.41 0.00 0.98 0.00 0.00 173.24 174.39 2x00 s ALA 179 N -3.38 -1.12 0.18 5.32 0.00 -1.26 -0.32 121.76 121.18 2x00 s ALA 179 Ca -0.01 1.41 0.08 0.00 0.00 0.00 0.00 51.96 53.44 2x00 s ALA 179 Cb -0.01 -1.35 -0.04 0.00 0.00 0.00 0.00 23.12 21.72 2x00 s ALA 179 CO -0.10 -0.81 -0.17 0.95 0.00 0.00 0.00 175.76 175.64 2x00 s THR 180 N 2.60 1.79 -0.19 0.00 -4.23 -0.40 -2.10 115.64 113.10 2x00 s THR 180 Ca 0.00 -2.04 -0.02 0.00 -1.18 0.00 0.00 61.69 58.46 2x00 s THR 180 Cb -0.12 -1.92 0.06 0.00 1.34 0.00 0.00 72.50 71.85 2x00 s THR 180 CO -0.13 -0.43 0.01 0.00 -0.54 0.00 0.00 174.62 173.53 2x00 s GLN 181 N -3.14 0.90 -0.10 3.99 -2.07 -0.07 -0.99 119.66 118.18 2x00 s GLN 181 Ca 0.18 -0.50 0.03 0.00 -1.82 0.00 0.00 55.36 53.25 2x00 s GLN 181 Cb -0.04 -2.12 0.01 0.00 -1.09 0.00 0.00 33.01 29.77 2x00 s GLN 181 CO 0.07 -0.59 -0.18 0.99 -1.32 0.00 0.00 175.29 174.25 2x00 s THR 182 N 1.76 1.66 0.11 3.63 2.01 -0.69 -4.32 115.64 119.81 2x00 s THR 182 Ca -0.01 -0.77 -0.30 0.00 0.31 0.00 0.00 61.69 60.91 2x00 s THR 182 Cb -0.17 -1.48 -0.07 0.00 0.01 0.00 0.00 72.50 70.80 2x00 s THR 182 CO -0.07 0.47 1.18 -0.60 -0.69 0.00 0.00 174.62 174.91 2x00 s ARG 183 N 0.63 4.48 0.06 4.92 3.52 -1.26 -0.47 118.95 130.83 2x00 s ARG 183 Ca -0.14 1.79 0.06 0.00 -0.13 0.00 0.00 55.73 57.31 2x00 s ARG 183 Cb -0.16 -3.31 -0.03 0.00 -1.56 0.00 0.00 34.95 29.89 2x00 s ARG 183 CO 0.04 -0.15 -0.17 -0.65 -0.81 0.00 0.00 175.30 173.56 2x00 s GLN 184 N 0.46 1.04 0.01 5.12 -0.21 0.45 -4.96 119.66 121.56 2x00 s GLN 184 Ca 0.55 -0.89 0.07 0.00 0.02 0.00 0.00 55.36 55.11 2x00 s GLN 184 Cb -0.30 -1.11 -0.02 0.00 1.00 0.00 0.00 33.01 32.58 2x00 s GLN 184 CO 0.32 0.27 -0.22 0.08 -2.12 0.00 0.00 175.29 173.62 2x00 s VAL 185 N -0.96 1.75 0.27 1.09 1.01 -1.26 -2.16 120.40 120.14 2x00 s VAL 185 Ca 0.03 -1.05 -0.12 0.00 0.00 0.00 0.00 61.98 60.83 2x00 s VAL 185 Cb -0.09 -1.48 0.00 0.00 0.00 0.00 0.00 36.38 34.82 2x00 s VAL 185 CO 0.02 0.40 0.51 0.00 0.00 0.00 0.00 175.10 176.03 2x00 s GLN 186 N -0.77 1.65 0.10 2.72 -2.07 -0.78 -4.99 119.66 115.52 2x00 s GLN 186 Ca 0.09 -1.30 0.10 0.00 -1.82 0.00 0.00 55.36 52.42 2x00 s GLN 186 Cb -0.09 0.49 -0.04 0.00 -1.09 0.00 0.00 33.01 32.28 2x00 s GLN 186 CO 0.00 -0.70 -0.24 -1.01 -1.32 0.00 0.00 175.29 172.02 2x00 s HIS 187 N -3.79 2.10 0.23 9.60 3.76 -1.26 -1.12 115.29 124.80 2x00 s HIS 187 Ca 0.22 -0.40 0.10 0.00 -0.15 0.00 0.00 55.06 54.84 2x00 s HIS 187 Cb -0.01 -1.17 -0.04 0.00 1.11 0.00 0.00 32.58 32.47 2x00 s HIS 187 CO 0.10 0.25 -0.10 0.71 -0.85 0.00 0.00 174.74 174.86 2x00 s TYR 188 N -1.04 2.57 0.43 1.40 2.02 -1.26 -5.04 117.35 116.44 2x00 s TYR 188 Ca 0.11 -0.25 0.14 0.00 -0.37 0.00 0.00 57.07 56.70 2x00 s TYR 188 Cb -0.10 -1.19 0.96 0.00 -0.40 0.00 0.00 41.96 41.22 2x00 s TYR 188 CO 0.05 0.58 1.97 0.66 -1.57 0.00 0.00 175.55 177.23 2x00 h SER 189 N 2.50 0.01 -0.83 2.29 4.64 -2.01 -2.70 113.55 117.45 2x00 h SER 189 Ca -0.45 -0.00 0.11 0.00 -0.47 0.00 0.00 61.79 60.98 2x00 h SER 189 Cb 1.23 -0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.26 2x00 h SER 189 CO 0.57 0.22 0.54 0.00 -0.87 0.00 0.00 176.83 177.28 2x00 h PRO 192 N 4.62 0.00 -6.85 0.00 0.13 -1.90 -3.38 132.00 124.62 2x00 h PRO 192 Ca -0.32 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.32 2x00 h PRO 192 Cb 1.21 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.34 2x00 h PRO 192 CO 0.41 0.00 0.42 -1.21 -0.23 0.00 0.00 178.00 177.40 2x00 s GLU 193 N -3.14 4.52 0.41 0.86 8.01 -1.26 -5.03 118.70 123.08 2x00 s GLU 193 Ca 0.08 1.62 -0.25 0.00 0.01 0.00 0.00 54.97 56.44 2x00 s GLU 193 Cb 0.13 -2.97 -0.08 0.00 -4.31 0.00 0.00 34.13 26.89 2x00 s GLU 193 CO 0.66 0.16 1.17 -1.25 0.01 0.00 0.00 175.26 176.01 2x00 s PRO 194 N -1.78 3.99 -0.11 0.39 0.04 -1.26 -4.62 135.00 131.64 2x00 s PRO 194 Ca 0.48 1.84 0.02 0.00 0.04 0.00 0.00 61.00 63.38 2x00 s PRO 194 Cb -0.27 -2.62 -0.01 0.00 0.04 0.00 0.00 34.50 31.64 2x00 s PRO 194 CO 0.34 -0.38 -0.17 0.71 0.04 0.00 0.00 177.00 177.55 2x00 s TYR 195 N -1.44 2.72 0.06 0.56 2.02 -0.28 -0.60 117.35 120.39 2x00 s TYR 195 Ca 0.58 -0.69 0.08 0.00 -0.37 0.00 0.00 57.07 56.68 2x00 s TYR 195 Cb -0.30 -1.77 -0.03 0.00 -0.40 0.00 0.00 41.96 39.45 2x00 s TYR 195 CO 0.38 -0.22 -0.22 0.42 -1.57 0.00 0.00 175.55 174.35 2x00 s ILE 196 N 0.20 2.54 0.18 2.71 -1.09 -1.26 -1.87 121.20 122.61 2x00 s ILE 196 Ca -0.10 -1.36 -0.15 0.00 -2.23 0.00 0.00 60.65 56.82 2x00 s ILE 196 Cb -0.16 -2.07 0.02 0.00 -1.58 0.00 0.00 42.46 38.67 2x00 s ILE 196 CO 0.06 0.28 0.43 1.51 -1.23 0.00 0.00 174.94 175.99 2x00 s ASP 197 N -1.55 -0.16 -0.20 3.58 1.47 -0.92 -4.40 116.67 114.50 2x00 s ASP 197 Ca 0.14 -0.59 -0.00 0.00 1.18 0.00 0.00 52.55 53.28 2x00 s ASP 197 Cb -0.10 0.52 0.02 0.00 -0.34 0.00 0.00 42.92 43.01 2x00 s ASP 197 CO 0.05 -0.98 -0.15 -0.69 0.68 0.00 0.00 175.17 174.08 2x00 s VAL 198 N -3.90 2.45 -0.44 2.11 1.01 0.64 -0.41 120.40 121.85 2x00 s VAL 198 Ca 0.11 -0.87 -0.22 0.00 0.00 0.00 0.00 61.98 61.01 2x00 s VAL 198 Cb 0.01 -2.09 0.02 0.00 0.00 0.00 0.00 36.38 34.32 2x00 s VAL 198 CO -0.03 0.46 0.71 0.21 0.00 0.00 0.00 175.10 176.46 2x00 s ASN 199 N 1.33 6.37 -0.50 3.32 3.04 0.38 -0.46 114.94 128.42 2x00 s ASN 199 Ca 0.04 -0.20 -0.25 0.00 0.04 0.00 0.00 52.86 52.49 2x00 s ASN 199 Cb -0.14 -2.35 0.03 0.00 -1.54 0.00 0.00 41.25 37.25 2x00 s ASN 199 CO -0.10 -0.84 0.95 -0.22 -3.04 0.00 0.00 177.10 173.86 2x00 s LEU 200 N 3.04 4.00 -0.23 3.21 2.96 0.02 -1.70 118.68 129.97 2x00 s LEU 200 Ca 0.26 -0.05 -0.07 0.00 -0.22 0.00 0.00 54.13 54.06 2x00 s LEU 200 Cb -0.13 -3.07 -0.03 0.00 0.50 0.00 0.00 46.19 43.46 2x00 s LEU 200 CO 0.20 -1.15 0.05 -0.69 -1.32 0.00 0.00 176.35 173.45 2x00 s VAL 201 N 3.92 4.25 -0.10 1.68 1.01 -0.17 -1.04 120.40 129.95 2x00 s VAL 201 Ca 0.35 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.17 2x00 s VAL 201 Cb -0.11 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.32 2x00 s VAL 201 CO 0.24 0.38 -0.23 -0.69 0.00 0.00 0.00 175.10 174.80 2x00 s VAL 202 N 1.32 1.95 -0.18 2.92 1.01 0.16 -1.28 120.40 126.30 2x00 s VAL 202 Ca 0.05 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 2x00 s VAL 202 Cb -0.15 -1.70 -0.00 0.00 0.00 0.00 0.00 36.38 34.53 2x00 s VAL 202 CO 0.03 0.54 -0.12 -0.75 0.00 0.00 0.00 175.10 174.79 2x00 s LYS 203 N 0.40 3.25 0.04 2.72 2.20 0.56 -0.68 119.74 128.24 2x00 s LYS 203 Ca -0.18 -0.71 -0.15 0.00 -0.36 0.00 0.00 55.97 54.57 2x00 s LYS 203 Cb -0.18 -2.76 0.02 0.00 -1.51 0.00 0.00 37.83 33.41 2x00 s LYS 203 CO 0.08 -0.09 0.33 -0.59 -0.36 0.00 0.00 175.35 174.72 2x00 s PHE 204 N 1.12 -0.14 0.08 4.03 -0.12 -0.22 -0.45 117.98 122.27 2x00 s PHE 204 Ca 0.01 0.03 -0.04 0.00 -0.05 0.00 0.00 56.93 56.88 2x00 s PHE 204 Cb -0.14 0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.34 2x00 s PHE 204 CO -0.04 -0.52 0.06 -0.98 -0.05 0.00 0.00 175.22 173.70 2x00 s ARG 205 N -2.53 0.74 0.13 1.99 1.70 -0.84 0.03 118.95 120.18 2x00 s ARG 205 Ca -0.05 -1.17 -0.31 0.00 -0.47 0.00 0.00 55.73 53.73 2x00 s ARG 205 Cb -0.01 0.26 -0.10 0.00 -0.57 0.00 0.00 34.95 34.53 2x00 s ARG 205 CO -0.03 -0.19 1.80 -1.21 -1.08 0.00 0.00 175.30 174.59 2x00 s GLU 206 N -3.92 4.14 0.00 3.89 2.02 0.22 -0.52 118.70 124.53 2x00 s GLU 206 Ca 0.09 2.58 -0.30 0.00 0.02 0.00 0.00 54.97 57.36 2x00 s GLU 206 Cb 0.07 -3.53 -0.03 0.00 0.10 0.00 0.00 34.13 30.74 2x00 s GLU 206 CO -0.08 -0.82 1.05 0.50 0.02 0.00 0.00 175.26 175.93 2x00 s ARG 207 N 2.53 4.50 0.00 1.61 3.52 0.35 -4.76 118.95 126.70 2x00 s ARG 207 Ca 0.80 1.52 0.00 0.00 -0.13 0.00 0.00 55.73 57.92 2x00 s ARG 207 Cb -0.46 -3.45 0.00 0.00 -1.56 0.00 0.00 34.95 29.48 2x00 s ARG 207 CO 0.36 -0.15 0.00 0.54 -0.81 0.00 0.00 175.30 175.23