#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pr2 s THR 2 N 0.00 1.33 0.35 0.00 -4.23 -0.40 -4.99 115.64 107.70 1pr2 s THR 2 Ca 0.00 -1.77 0.35 0.00 -1.18 0.00 0.00 61.69 59.09 1pr2 s THR 2 Cb 0.00 -2.10 0.38 0.00 1.34 0.00 0.00 72.50 72.11 1pr2 s THR 2 CO 0.00 0.00 2.11 -0.65 -0.54 0.00 0.00 174.62 175.54 1pr2 h PRO 3 N 1.05 0.00 0.00 3.99 0.11 -2.03 -3.13 132.00 132.00 1pr2 h PRO 3 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1pr2 h PRO 3 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1pr2 h PRO 3 CO 0.66 0.04 -0.49 0.72 -0.21 0.00 0.00 178.00 178.72 1pr2 n HIS 4 N -3.24 0.00 -3.74 0.65 8.25 -1.26 -4.93 115.22 110.94 1pr2 n HIS 4 Ca -0.01 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.17 1pr2 n HIS 4 Cb 0.23 -0.02 -0.16 0.00 1.12 0.00 0.00 29.99 31.15 1pr2 n HIS 4 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1pr2 s ILE 5 N -1.86 0.55 -1.24 1.59 1.01 -1.18 -4.64 121.20 115.43 1pr2 s ILE 5 Ca 0.02 -0.55 -0.09 0.00 0.00 0.00 0.00 60.65 60.03 1pr2 s ILE 5 Cb 0.06 -1.04 0.19 0.00 0.01 0.00 0.00 42.46 41.69 1pr2 s ILE 5 CO 0.34 -0.19 1.76 -3.20 0.00 0.00 0.00 174.94 173.65 1pr2 n ASN 6 N 5.04 5.31 -3.29 3.58 5.15 -1.26 -1.27 115.26 128.52 1pr2 n ASN 6 Ca -0.09 -3.14 -0.16 0.00 -0.60 0.00 0.00 54.58 50.59 1pr2 n ASN 6 Cb 0.47 -1.45 -0.05 0.00 -0.53 0.00 0.00 39.78 38.21 1pr2 n ASN 6 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1pr2 s ALA 7 N -0.02 1.12 0.14 5.20 0.00 -1.26 -4.69 121.76 122.25 1pr2 s ALA 7 Ca 0.38 -1.70 0.06 0.00 0.00 0.00 0.00 51.96 50.71 1pr2 s ALA 7 Cb 0.07 1.26 -0.04 0.00 0.00 0.00 0.00 23.12 24.41 1pr2 s ALA 7 CO 0.02 -0.75 -0.14 -1.21 0.00 0.00 0.00 175.76 173.68 1pr2 s GLU 8 N -3.19 1.09 -0.17 0.00 0.41 -1.26 -2.70 118.70 112.87 1pr2 s GLU 8 Ca 0.34 -1.33 -0.40 0.00 -0.41 0.00 0.00 54.97 53.16 1pr2 s GLU 8 Cb 0.01 -0.91 -0.17 0.00 -1.78 0.00 0.00 34.13 31.28 1pr2 s GLU 8 CO 0.22 0.16 1.55 -0.12 -0.49 0.00 0.00 175.26 176.59 1pr2 n MET 9 N 0.26 0.91 0.00 1.61 0.00 -1.26 -0.58 117.12 118.06 1pr2 n MET 9 Ca -0.13 0.33 0.00 0.00 0.00 0.00 0.00 57.70 57.90 1pr2 n MET 9 Cb 0.58 -1.97 0.00 0.00 0.00 0.00 0.00 33.22 31.83 1pr2 n MET 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1pr2 n GLY 10 N 3.44 1.77 0.25 -5.12 0.00 -1.26 -4.95 105.19 99.32 1pr2 n GLY 10 Ca 0.24 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.35 1pr2 n GLY 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pr2 h ASP 11 N 0.86 0.00 -3.18 1.61 3.32 -1.21 -3.43 116.42 114.39 1pr2 h ASP 11 Ca 0.00 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.42 1pr2 h ASP 11 Cb 0.00 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.44 1pr2 h ASP 11 CO 0.00 0.13 -0.64 -0.36 -1.72 0.00 0.00 179.24 176.65 1pr2 s PHE 12 N -4.56 3.02 0.87 4.55 0.40 -1.26 -4.71 117.98 116.30 1pr2 s PHE 12 Ca -0.04 -0.02 -0.12 0.00 -0.60 0.00 0.00 56.93 56.15 1pr2 s PHE 12 Cb 0.15 -1.53 0.12 0.00 0.51 0.00 0.00 43.02 42.27 1pr2 s PHE 12 CO 0.65 0.50 1.14 0.00 0.70 0.00 0.00 175.22 178.20 1pr2 s ALA 13 N -1.43 1.99 -2.00 5.36 0.00 -1.26 -4.90 121.76 119.52 1pr2 s ALA 13 Ca 0.27 -0.48 0.11 0.00 0.00 0.00 0.00 51.96 51.86 1pr2 s ALA 13 Cb -0.11 -3.04 0.67 0.00 0.00 0.00 0.00 23.12 20.64 1pr2 s ALA 13 CO 0.20 -2.09 1.40 -0.40 0.00 0.00 0.00 175.76 174.87 1pr2 n ASP 14 N -3.63 0.00 -3.85 0.00 3.85 -1.26 -4.58 116.55 107.07 1pr2 n ASP 14 Ca 0.07 -1.57 -0.20 0.00 -0.71 0.00 0.00 54.79 52.38 1pr2 n ASP 14 Cb 0.59 0.00 -0.17 0.00 -1.35 0.00 0.00 41.12 40.19 1pr2 n ASP 14 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1pr2 s VAL 15 N -2.00 0.44 -0.08 2.12 1.01 -1.26 -0.97 120.40 119.65 1pr2 s VAL 15 Ca 0.17 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.14 1pr2 s VAL 15 Cb 0.08 -0.51 0.01 0.00 0.00 0.00 0.00 36.38 35.96 1pr2 s VAL 15 CO 0.13 0.22 -0.14 -0.69 0.00 0.00 0.00 175.10 174.62 1pr2 s VAL 16 N 1.17 1.31 -0.04 2.92 1.01 -0.62 -2.40 120.40 123.75 1pr2 s VAL 16 Ca -0.07 -0.56 -0.18 0.00 0.00 0.00 0.00 61.98 61.17 1pr2 s VAL 16 Cb -0.14 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 1pr2 s VAL 16 CO -0.01 0.40 0.48 -0.76 0.00 0.00 0.00 175.10 175.21 1pr2 s LEU 17 N 0.79 4.39 -0.20 3.92 1.02 -0.02 -1.13 118.68 127.44 1pr2 s LEU 17 Ca -0.12 0.96 -0.02 0.00 0.02 0.00 0.00 54.13 54.98 1pr2 s LEU 17 Cb -0.16 -2.72 0.06 0.00 0.02 0.00 0.00 46.19 43.40 1pr2 s LEU 17 CO 0.02 0.15 0.02 -0.04 0.02 0.00 0.00 176.35 176.52 1pr2 s MET 18 N -0.22 0.83 0.52 1.70 -1.94 0.51 -1.29 119.30 119.41 1pr2 s MET 18 Ca 0.26 -0.54 -0.01 0.00 -1.71 0.00 0.00 55.69 53.69 1pr2 s MET 18 Cb -0.17 -2.20 0.01 0.00 2.01 0.00 0.00 34.83 34.49 1pr2 s MET 18 CO 0.13 -0.64 0.76 -1.25 -0.01 0.00 0.00 175.02 174.02 1pr2 s PRO 19 N 1.77 2.83 0.06 2.03 0.04 -1.25 -1.81 135.00 138.67 1pr2 s PRO 19 Ca -0.02 -0.47 -0.15 0.00 0.04 0.00 0.00 61.00 60.40 1pr2 s PRO 19 Cb -0.17 -2.46 -0.23 0.00 0.04 0.00 0.00 34.50 31.68 1pr2 s PRO 19 CO -0.08 -0.54 1.18 0.78 0.04 0.00 0.00 177.00 178.38 1pr2 h GLY 20 N 0.13 0.73 -5.39 0.56 0.00 -1.85 -2.12 103.07 95.13 1pr2 h GLY 20 Ca -0.45 -1.25 -0.58 0.00 0.00 0.00 0.00 47.33 45.05 1pr2 h GLY 20 CO 0.57 1.10 0.59 -0.35 0.00 0.00 0.00 176.54 178.45 1pr2 s ASP 21 N -7.16 6.98 0.48 0.19 2.15 -1.26 -1.57 116.67 116.47 1pr2 s ASP 21 Ca -0.11 1.22 0.13 0.00 0.43 0.00 0.00 52.55 54.22 1pr2 s ASP 21 Cb 0.06 -2.48 1.12 0.00 -0.30 0.00 0.00 42.92 41.32 1pr2 s ASP 21 CO 0.90 -0.55 2.11 1.55 -0.17 0.00 0.00 175.17 179.01 1pr2 h PRO 22 N 7.50 0.17 0.00 4.34 0.13 -1.88 -0.37 132.00 141.89 1pr2 h PRO 22 Ca -0.23 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 64.85 1pr2 h PRO 22 Cb 1.09 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 1pr2 h PRO 22 CO 0.91 0.12 -0.19 -0.07 -0.23 0.00 0.00 178.00 178.54 1pr2 h LEU 23 N 0.17 0.00 -0.38 1.56 3.38 -1.92 -1.86 115.31 116.25 1pr2 h LEU 23 Ca 0.05 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1pr2 h LEU 23 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1pr2 h LEU 23 CO -0.01 0.19 -0.20 -0.09 0.09 0.00 0.00 178.44 178.42 1pr2 h ARG 24 N 0.00 0.00 -0.17 1.13 9.65 -1.47 -2.68 114.38 120.85 1pr2 h ARG 24 Ca -0.00 0.00 -0.22 0.00 -1.10 0.00 0.00 59.98 58.66 1pr2 h ARG 24 Cb 0.61 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 29.20 1pr2 h ARG 24 CO 0.02 0.20 -0.75 0.00 2.80 0.00 0.00 179.97 182.24 1pr2 h ALA 25 N 1.80 0.34 -0.60 2.80 0.00 -1.20 -1.26 119.26 121.15 1pr2 h ALA 25 Ca -0.00 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.23 1pr2 h ALA 25 Cb 1.01 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1pr2 h ALA 25 CO 0.03 0.69 0.06 -0.22 0.00 0.00 0.00 179.25 179.80 1pr2 h LYS 26 N 0.55 1.03 -0.51 0.00 1.63 -1.49 -0.48 116.57 117.29 1pr2 h LYS 26 Ca -0.04 -0.30 0.02 0.00 -0.85 0.00 0.00 60.65 59.48 1pr2 h LYS 26 Cb 1.38 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 32.87 1pr2 h LYS 26 CO 0.16 0.98 0.31 -0.92 -3.45 0.00 0.00 179.45 176.53 1pr2 h TYR 27 N 0.93 0.58 -0.10 1.91 5.03 -1.36 0.11 116.97 124.07 1pr2 h TYR 27 Ca 0.18 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.49 1pr2 h TYR 27 Cb 0.48 -0.19 -0.00 0.00 1.55 0.00 0.00 36.73 38.57 1pr2 h TYR 27 CO 0.04 0.34 0.01 0.82 -1.32 0.00 0.00 178.16 178.04 1pr2 h ILE 28 N 0.62 1.24 -0.32 1.81 2.04 -0.98 -1.24 117.51 120.68 1pr2 h ILE 28 Ca 0.20 -0.75 0.06 0.00 1.00 0.00 0.00 64.86 65.37 1pr2 h ILE 28 Cb 0.01 1.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.59 1pr2 h ILE 28 CO -0.09 0.21 0.01 0.00 0.00 0.00 0.00 178.15 178.29 1pr2 h ALA 29 N 0.75 0.30 -0.62 1.87 0.00 -0.83 -0.22 119.26 120.51 1pr2 h ALA 29 Ca 0.03 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1pr2 h ALA 29 Cb 0.33 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1pr2 h ALA 29 CO 0.00 -0.39 0.17 1.49 0.00 0.00 0.00 179.25 180.52 1pr2 h GLU 30 N 0.11 0.96 0.11 0.00 4.57 -0.72 -2.13 114.58 117.47 1pr2 h GLU 30 Ca 0.16 -0.20 -0.29 0.00 -1.18 0.00 0.00 59.36 57.84 1pr2 h GLU 30 Cb 0.20 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 1pr2 h GLU 30 CO -0.25 0.84 -1.46 1.15 -1.18 0.00 0.00 179.01 178.11 1pr2 h THR 31 N 0.92 1.22 0.00 0.32 2.02 -0.83 -3.42 112.91 113.14 1pr2 h THR 31 Ca 0.20 -2.87 0.00 0.00 0.77 0.00 0.00 66.41 64.51 1pr2 h THR 31 Cb 0.30 2.78 0.00 0.00 -1.74 0.00 0.00 68.15 69.49 1pr2 h THR 31 CO -0.00 0.82 -0.52 0.49 0.37 0.00 0.00 175.52 176.68 1pr2 n PHE 32 N -3.44 0.00 -4.17 3.16 3.01 -0.13 -5.04 117.46 110.85 1pr2 n PHE 32 Ca -0.14 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 57.97 1pr2 n PHE 32 Cb 1.03 -0.03 -0.08 0.00 -0.01 0.00 0.00 39.48 40.40 1pr2 n PHE 32 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1pr2 s LEU 33 N -2.55 3.87 0.08 4.37 1.02 -0.80 -4.69 118.68 119.99 1pr2 s LEU 33 Ca 0.00 0.23 -0.00 0.00 0.02 0.00 0.00 54.13 54.38 1pr2 s LEU 33 Cb 0.02 -2.00 -0.04 0.00 0.02 0.00 0.00 46.19 44.19 1pr2 s LEU 33 CO 0.12 0.36 0.24 -1.61 0.02 0.00 0.00 176.35 175.48 1pr2 s GLU 34 N -1.14 3.46 -1.52 1.70 2.02 -0.43 -4.45 118.70 118.34 1pr2 s GLU 34 Ca 0.16 -0.42 -0.04 0.00 0.02 0.00 0.00 54.97 54.69 1pr2 s GLU 34 Cb -0.12 -3.01 0.04 0.00 0.10 0.00 0.00 34.13 31.15 1pr2 s GLU 34 CO 0.06 0.58 0.37 -0.25 0.02 0.00 0.00 175.26 176.04 1pr2 n ASP 35 N 0.17 -0.53 -4.76 -0.19 8.00 -1.26 -2.04 116.55 115.93 1pr2 n ASP 35 Ca -0.05 -1.10 -0.40 0.00 0.71 0.00 0.00 54.79 53.96 1pr2 n ASP 35 Cb 0.51 -2.51 -0.05 0.00 -0.02 0.00 0.00 41.12 39.05 1pr2 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pr2 s ALA 36 N -3.93 3.41 0.05 2.24 0.00 -1.26 -4.57 121.76 117.70 1pr2 s ALA 36 Ca 0.17 0.30 0.06 0.00 0.00 0.00 0.00 51.96 52.49 1pr2 s ALA 36 Cb -0.10 -2.96 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 1pr2 s ALA 36 CO 0.93 0.18 -0.18 -0.98 0.00 0.00 0.00 175.76 175.71 1pr2 s ARG 37 N -0.55 1.20 0.13 0.00 1.70 -0.16 -4.94 118.95 116.32 1pr2 s ARG 37 Ca 0.37 -0.88 -0.30 0.00 -0.47 0.00 0.00 55.73 54.44 1pr2 s ARG 37 Cb -0.21 -1.28 -0.07 0.00 -0.57 0.00 0.00 34.95 32.82 1pr2 s ARG 37 CO 0.24 0.32 1.10 -2.00 -1.08 0.00 0.00 175.30 173.88 1pr2 s GLU 38 N -1.20 4.56 0.00 3.89 2.12 -1.26 -1.58 118.70 125.22 1pr2 s GLU 38 Ca 0.05 1.68 0.00 0.00 0.36 0.00 0.00 54.97 57.06 1pr2 s GLU 38 Cb -0.08 -3.32 -0.00 0.00 0.26 0.00 0.00 34.13 30.98 1pr2 s GLU 38 CO 0.02 -0.01 0.18 1.33 -0.54 0.00 0.00 175.26 176.24 1pr2 n VAL 39 N 2.93 0.00 -3.57 3.70 0.24 0.27 -4.95 118.33 116.96 1pr2 n VAL 39 Ca 0.05 -0.49 -0.17 0.00 -2.04 0.00 0.00 64.34 61.68 1pr2 n VAL 39 Cb 0.47 1.00 -0.07 0.00 -1.47 0.00 0.00 33.84 33.78 1pr2 n VAL 39 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1pr2 s ASN 40 N -0.69 -0.64 0.00 -1.34 2.47 -1.19 -4.30 114.94 109.24 1pr2 s ASN 40 Ca 0.00 0.82 0.00 0.00 0.42 0.00 0.00 52.86 54.11 1pr2 s ASN 40 Cb 0.00 0.72 0.00 0.00 -1.45 0.00 0.00 41.25 40.52 1pr2 s ASN 40 CO 0.01 -0.51 0.32 -0.46 -3.72 0.00 0.00 177.10 172.74 1pr2 n ASN 41 N 1.35 0.00 -4.74 -4.21 6.94 -1.26 -1.74 115.26 111.61 1pr2 n ASN 41 Ca -0.18 -1.10 -0.42 0.00 -0.02 0.00 0.00 54.58 52.87 1pr2 n ASN 41 Cb 0.57 -0.02 -0.02 0.00 -2.36 0.00 0.00 39.78 37.94 1pr2 n ASN 41 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1pr2 s VAL 42 N 0.00 2.23 -1.71 3.53 1.01 -1.26 -1.20 120.40 123.00 1pr2 s VAL 42 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.16 1pr2 s VAL 42 Cb 0.00 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.26 1pr2 s VAL 42 CO 0.00 0.02 0.00 0.54 0.00 0.00 0.00 175.10 175.66 1pr2 n ARG 43 N 2.88 -1.45 -0.95 2.72 1.74 -1.26 -1.48 116.66 118.85 1pr2 n ARG 43 Ca 0.11 0.99 0.00 0.00 -0.77 0.00 0.00 57.85 58.18 1pr2 n ARG 43 Cb 0.37 -5.31 0.00 0.00 -1.02 0.00 0.00 32.46 26.51 1pr2 n ARG 43 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pr2 n GLY 44 N -0.22 0.56 3.02 -0.13 0.00 -0.34 -4.94 105.19 103.14 1pr2 n GLY 44 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1pr2 n GLY 44 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1pr2 n MET 45 N -2.08 3.15 -1.61 1.61 0.00 -0.55 -4.84 117.12 112.80 1pr2 n MET 45 Ca 0.00 -3.07 -0.50 0.00 0.00 0.00 0.00 57.70 54.13 1pr2 n MET 45 Cb 0.06 -3.23 -0.05 0.00 0.00 0.00 0.00 33.22 30.00 1pr2 n MET 45 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1pr2 n LEU 46 N 6.06 2.01 -4.13 -0.89 4.77 -1.26 -4.40 117.00 119.16 1pr2 n LEU 46 Ca 0.47 1.12 -0.21 0.00 -0.03 0.00 0.00 56.01 57.36 1pr2 n LEU 46 Cb 0.40 -1.26 -0.14 0.00 -2.33 0.00 0.00 43.42 40.09 1pr2 n LEU 46 CO 0.83 -0.91 -0.47 -0.83 -1.33 0.00 0.00 177.39 174.67 1pr2 s GLY 47 N 0.45 0.76 0.08 -0.72 0.00 -0.71 -3.04 107.32 104.13 1pr2 s GLY 47 Ca 0.80 -0.74 0.02 0.00 0.00 0.00 0.00 44.72 44.79 1pr2 s GLY 47 CO 0.46 -0.68 -0.07 -1.36 0.00 0.00 0.00 173.10 171.45 1pr2 s PHE 48 N -0.63 0.82 -0.03 1.90 0.08 0.10 -0.56 117.98 119.67 1pr2 s PHE 48 Ca 0.03 -0.77 0.01 0.00 0.12 0.00 0.00 56.93 56.32 1pr2 s PHE 48 Cb -0.07 -0.48 0.03 0.00 -0.57 0.00 0.00 43.02 41.93 1pr2 s PHE 48 CO 0.01 -0.13 -0.01 0.99 -0.10 0.00 0.00 175.22 175.98 1pr2 s THR 49 N -2.86 0.23 0.00 0.64 2.01 -0.62 -0.96 115.64 114.08 1pr2 s THR 49 Ca 0.05 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.09 1pr2 s THR 49 Cb 0.00 -0.32 0.00 0.00 0.01 0.00 0.00 72.50 72.19 1pr2 s THR 49 CO -0.03 0.16 0.00 0.61 -0.69 0.00 0.00 174.62 174.67 1pr2 n GLY 50 N 4.10 3.78 3.09 4.40 0.00 -0.13 -0.99 105.19 119.44 1pr2 n GLY 50 Ca -0.27 -0.77 -0.16 0.00 0.00 0.00 0.00 46.02 44.82 1pr2 n GLY 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pr2 s THR 51 N -1.34 0.77 -0.24 2.61 -4.23 -0.87 -0.72 115.64 111.63 1pr2 s THR 51 Ca 0.00 -0.96 0.02 0.00 -1.18 0.00 0.00 61.69 59.57 1pr2 s THR 51 Cb 0.00 -0.76 0.06 0.00 1.34 0.00 0.00 72.50 73.14 1pr2 s THR 51 CO 0.00 -0.17 -0.09 -0.47 -0.54 0.00 0.00 174.62 173.35 1pr2 s TYR 52 N -1.01 2.81 -1.39 3.99 6.14 0.20 -1.31 117.35 126.78 1pr2 s TYR 52 Ca -0.04 -1.98 -0.02 0.00 0.64 0.00 0.00 57.07 55.67 1pr2 s TYR 52 Cb -0.08 -1.77 0.02 0.00 0.42 0.00 0.00 41.96 40.55 1pr2 s TYR 52 CO 0.01 -0.82 0.61 1.63 0.64 0.00 0.00 175.55 177.62 1pr2 n LYS 53 N 4.56 -4.18 -0.13 4.97 5.02 -1.26 -0.61 118.16 126.53 1pr2 n LYS 53 Ca -0.14 0.51 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 1pr2 n LYS 53 Cb 0.44 -4.92 0.00 0.00 -0.02 0.00 0.00 35.03 30.52 1pr2 n LYS 53 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pr2 n GLY 54 N -1.75 2.55 3.72 0.72 0.00 -1.26 -5.00 105.19 104.17 1pr2 n GLY 54 Ca -0.25 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 1pr2 n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1pr2 s ARG 55 N -0.01 4.35 0.02 1.61 3.00 0.22 -5.02 118.95 123.11 1pr2 s ARG 55 Ca 0.00 0.53 -0.30 0.00 -1.00 0.00 0.00 55.73 54.95 1pr2 s ARG 55 Cb 0.00 -3.45 -0.05 0.00 0.00 0.00 0.00 34.95 31.45 1pr2 s ARG 55 CO 0.00 0.12 1.33 0.21 0.00 0.00 0.00 175.30 176.96 1pr2 s LYS 56 N 0.72 4.32 0.01 5.12 2.20 -1.26 0.63 119.74 131.48 1pr2 s LYS 56 Ca 0.28 1.90 -0.01 0.00 -0.36 0.00 0.00 55.97 57.78 1pr2 s LYS 56 Cb -0.16 -3.49 -0.01 0.00 -1.51 0.00 0.00 37.83 32.66 1pr2 s LYS 56 CO 0.12 -0.48 0.00 0.42 -0.36 0.00 0.00 175.35 175.05 1pr2 s ILE 57 N 1.96 0.09 0.24 5.43 -1.09 0.10 -4.73 121.20 123.21 1pr2 s ILE 57 Ca 0.62 -0.75 0.11 0.00 -2.23 0.00 0.00 60.65 58.39 1pr2 s ILE 57 Cb -0.31 -0.26 -0.05 0.00 -1.58 0.00 0.00 42.46 40.27 1pr2 s ILE 57 CO 0.27 -0.41 -0.19 -0.44 -1.23 0.00 0.00 174.94 172.93 1pr2 s SER 58 N -1.25 3.23 -0.13 3.58 0.01 -1.01 -0.96 113.70 117.17 1pr2 s SER 58 Ca -0.14 -0.99 -0.07 0.00 1.31 0.00 0.00 55.95 56.06 1pr2 s SER 58 Cb -0.08 -0.24 0.05 0.00 0.21 0.00 0.00 66.02 65.96 1pr2 s SER 58 CO -0.00 -0.01 0.32 0.54 0.41 0.00 0.00 173.24 174.50 1pr2 s VAL 59 N -2.48 -0.03 -0.13 3.43 0.11 -0.14 -0.84 120.40 120.33 1pr2 s VAL 59 Ca 0.26 0.11 -0.23 0.00 -2.93 0.00 0.00 61.98 59.19 1pr2 s VAL 59 Cb -0.04 -0.49 0.06 0.00 -1.53 0.00 0.00 36.38 34.38 1pr2 s VAL 59 CO 0.12 0.05 0.57 -0.32 -3.33 0.00 0.00 175.10 172.18 1pr2 s MET 60 N 1.22 0.81 0.66 1.54 0.00 -0.41 0.01 119.30 123.13 1pr2 s MET 60 Ca -0.09 0.46 -0.13 0.00 0.00 0.00 0.00 55.69 55.93 1pr2 s MET 60 Cb -0.09 0.38 -0.00 0.00 0.00 0.00 0.00 34.83 35.12 1pr2 s MET 60 CO -0.10 -0.18 1.07 0.20 0.00 0.00 0.00 175.02 176.02 1pr2 s GLY 61 N -0.47 1.91 0.00 2.11 0.00 -1.17 -3.74 107.32 105.96 1pr2 s GLY 61 Ca -0.06 0.29 0.00 0.00 0.00 0.00 0.00 44.72 44.95 1pr2 s GLY 61 CO 0.04 0.62 0.53 -2.39 0.00 0.00 0.00 173.10 171.90 1pr2 n HIS 62 N -2.68 0.00 -0.63 1.90 1.44 -0.80 -4.92 115.22 109.53 1pr2 n HIS 62 Ca 0.09 -0.10 0.08 0.00 -2.01 0.00 0.00 57.72 55.78 1pr2 n HIS 62 Cb 0.53 -0.01 -0.02 0.00 0.12 0.00 0.00 29.99 30.61 1pr2 n HIS 62 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1pr2 n GLY 63 N -0.10 -1.76 3.76 -1.39 0.00 -0.61 -2.87 105.19 102.23 1pr2 n GLY 63 Ca 0.00 -1.36 -0.37 0.00 0.00 0.00 0.00 46.02 44.29 1pr2 n GLY 63 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1pr2 s MET 64 N -1.84 4.14 0.00 1.61 1.00 -1.26 -4.63 119.30 118.32 1pr2 s MET 64 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 55.69 55.93 1pr2 s MET 64 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 34.83 31.47 1pr2 s MET 64 CO 0.00 0.37 0.00 0.41 0.00 0.00 0.00 175.02 175.80 1pr2 n GLY 65 N 2.88 2.44 0.19 -0.03 0.00 -1.24 -4.53 105.19 104.91 1pr2 n GLY 65 Ca -0.12 -1.81 -0.09 0.00 0.00 0.00 0.00 46.02 44.01 1pr2 n GLY 65 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1pr2 h ILE 66 N 0.00 1.17 -0.91 -0.61 2.04 -1.78 -1.93 117.51 115.49 1pr2 h ILE 66 Ca 0.00 -0.50 0.06 0.00 1.00 0.00 0.00 64.86 65.42 1pr2 h ILE 66 Cb 0.00 0.77 -0.06 0.00 -0.74 0.00 0.00 36.82 36.79 1pr2 h ILE 66 CO 0.00 0.19 0.59 -0.65 0.00 0.00 0.00 178.15 178.28 1pr2 h PRO 67 N 0.50 1.02 0.30 2.37 0.11 -1.91 0.81 132.00 135.21 1pr2 h PRO 67 Ca 0.14 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 1pr2 h PRO 67 Cb 0.12 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.01 1pr2 h PRO 67 CO -0.02 0.68 -0.14 1.03 -0.21 0.00 0.00 178.00 179.34 1pr2 h SER 68 N 1.05 -0.34 0.57 -2.05 0.87 -1.74 -3.10 113.55 108.81 1pr2 h SER 68 Ca 0.39 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.74 1pr2 h SER 68 Cb 0.17 0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1pr2 h SER 68 CO -0.14 0.11 -0.05 0.00 -0.53 0.00 0.00 176.83 176.22 1pr2 h SER 70 N 0.00 0.85 0.16 0.00 0.02 -0.84 -2.16 113.55 111.59 1pr2 h SER 70 Ca -0.00 -0.29 -0.01 0.00 -0.84 0.00 0.00 61.79 60.65 1pr2 h SER 70 Cb 0.35 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.66 1pr2 h SER 70 CO 0.01 1.01 -0.08 0.40 -1.14 0.00 0.00 176.83 177.03 1pr2 h ILE 71 N 0.75 0.91 0.02 3.27 2.04 -1.38 -2.62 117.51 120.49 1pr2 h ILE 71 Ca 0.11 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 1pr2 h ILE 71 Cb 0.68 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1pr2 h ILE 71 CO 0.05 0.07 -0.01 1.88 0.00 0.00 0.00 178.15 180.14 1pr2 h TYR 72 N -0.36 -0.02 -0.62 1.37 0.05 -1.53 -2.38 116.97 113.49 1pr2 h TYR 72 Ca -0.02 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 1pr2 h TYR 72 Cb 0.28 0.01 -0.03 0.00 1.01 0.00 0.00 36.73 38.00 1pr2 h TYR 72 CO -0.02 0.20 0.34 1.79 -1.05 0.00 0.00 178.16 179.42 1pr2 h THR 73 N -0.24 1.19 0.00 -2.88 1.35 -1.49 -0.97 112.91 109.87 1pr2 h THR 73 Ca -0.00 -0.47 -0.00 0.00 -0.55 0.00 0.00 66.41 65.39 1pr2 h THR 73 Cb 0.23 0.35 0.00 0.00 -1.73 0.00 0.00 68.15 67.00 1pr2 h THR 73 CO 0.00 0.21 -0.00 0.50 -0.25 0.00 0.00 175.52 175.98 1pr2 h LYS 74 N 0.86 -0.01 -0.75 4.72 3.11 -1.41 -1.69 116.57 121.40 1pr2 h LYS 74 Ca 0.22 0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 58.03 1pr2 h LYS 74 Cb 0.02 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 31.22 1pr2 h LYS 74 CO -0.04 0.19 0.36 0.93 -2.81 0.00 0.00 179.45 178.08 1pr2 h GLU 75 N -0.20 1.07 -0.43 1.90 5.08 -1.14 -0.68 114.58 120.18 1pr2 h GLU 75 Ca -0.00 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 1pr2 h GLU 75 Cb 0.20 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1pr2 h GLU 75 CO 0.00 0.83 0.14 -0.07 -1.00 0.00 0.00 179.01 178.91 1pr2 h LEU 76 N 1.07 0.62 -0.00 1.33 3.38 -1.08 0.18 115.31 120.80 1pr2 h LEU 76 Ca 0.26 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1pr2 h LEU 76 Cb 0.11 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1pr2 h LEU 76 CO -0.03 0.65 -0.00 0.40 0.09 0.00 0.00 178.44 179.55 1pr2 h ILE 77 N 0.55 1.27 0.00 1.22 2.04 -0.95 -1.80 117.51 119.83 1pr2 h ILE 77 Ca 0.14 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.20 1pr2 h ILE 77 Cb 0.25 1.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.14 1pr2 h ILE 77 CO -0.01 0.21 -0.67 0.71 0.00 0.00 0.00 178.15 178.39 1pr2 h THR 78 N -0.33 0.00 0.00 -0.27 1.35 -1.15 -3.31 112.91 109.20 1pr2 h THR 78 Ca 0.00 -0.73 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1pr2 h THR 78 Cb 0.34 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 1pr2 h THR 78 CO 0.00 0.00 -0.50 0.47 -0.25 0.00 0.00 175.52 175.25 1pr2 n ASP 79 N -2.43 1.69 -0.03 5.36 8.00 0.62 -4.75 116.55 125.01 1pr2 n ASP 79 Ca 0.02 -0.36 0.01 0.00 0.71 0.00 0.00 54.79 55.18 1pr2 n ASP 79 Cb 0.49 1.05 0.02 0.00 -0.02 0.00 0.00 41.12 42.65 1pr2 n ASP 79 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1pr2 n PHE 80 N -1.26 0.00 -1.33 1.24 3.01 -0.72 -4.60 117.46 113.81 1pr2 n PHE 80 Ca 0.00 -0.42 -0.11 0.00 1.01 0.00 0.00 57.45 57.93 1pr2 n PHE 80 Cb 0.05 -0.05 -0.05 0.00 -0.01 0.00 0.00 39.48 39.42 1pr2 n PHE 80 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pr2 n GLY 81 N -0.47 1.19 3.71 1.37 0.00 -1.11 -4.63 105.19 105.26 1pr2 n GLY 81 Ca 0.02 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1pr2 n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pr2 s VAL 82 N -2.25 3.06 -0.20 1.61 1.01 -0.95 -4.75 120.40 117.92 1pr2 s VAL 82 Ca 0.00 0.73 0.14 0.00 0.00 0.00 0.00 61.98 62.85 1pr2 s VAL 82 Cb 0.00 -3.47 -0.23 0.00 0.00 0.00 0.00 36.38 32.68 1pr2 s VAL 82 CO 0.00 0.05 0.04 0.29 0.00 0.00 0.00 175.10 175.48 1pr2 n LYS 83 N 4.21 0.68 -4.54 2.72 4.76 -0.14 -4.44 118.16 121.41 1pr2 n LYS 83 Ca 0.13 0.04 -0.21 0.00 -2.87 0.00 0.00 58.31 55.40 1pr2 n LYS 83 Cb 0.41 -1.54 -0.15 0.00 -1.84 0.00 0.00 35.03 31.91 1pr2 n LYS 83 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1pr2 s LYS 84 N -2.50 1.10 -0.08 1.97 1.02 -0.73 -1.76 119.74 118.75 1pr2 s LYS 84 Ca -0.15 -0.42 0.04 0.00 0.02 0.00 0.00 55.97 55.46 1pr2 s LYS 84 Cb 0.07 -1.03 0.00 0.00 -0.52 0.00 0.00 37.83 36.35 1pr2 s LYS 84 CO 0.78 0.21 -0.21 0.42 -0.92 0.00 0.00 175.35 175.63 1pr2 s ILE 85 N -0.07 1.78 -0.23 2.17 -1.09 -0.13 -1.58 121.20 122.05 1pr2 s ILE 85 Ca 0.01 -0.87 0.01 0.00 -2.23 0.00 0.00 60.65 57.57 1pr2 s ILE 85 Cb -0.07 -1.55 0.06 0.00 -1.58 0.00 0.00 42.46 39.32 1pr2 s ILE 85 CO 0.00 0.50 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.53 1pr2 s ILE 86 N 0.36 1.48 0.06 2.92 1.01 -0.29 -1.24 121.20 125.50 1pr2 s ILE 86 Ca -0.16 -1.19 -0.28 0.00 0.00 0.00 0.00 60.65 59.02 1pr2 s ILE 86 Cb -0.17 -1.76 -0.05 0.00 0.01 0.00 0.00 42.46 40.50 1pr2 s ILE 86 CO 0.07 -0.11 0.90 -0.60 0.00 0.00 0.00 174.94 175.20 1pr2 s ARG 87 N 1.42 4.60 -0.36 2.79 3.52 0.10 -0.37 118.95 130.66 1pr2 s ARG 87 Ca -0.06 1.31 0.01 0.00 -0.13 0.00 0.00 55.73 56.87 1pr2 s ARG 87 Cb -0.19 -3.39 0.11 0.00 -1.56 0.00 0.00 34.95 29.92 1pr2 s ARG 87 CO -0.06 0.17 0.13 0.14 -0.81 0.00 0.00 175.30 174.87 1pr2 s VAL 88 N 0.24 1.45 0.00 7.11 -7.23 -0.75 -0.80 120.40 120.42 1pr2 s VAL 88 Ca 0.45 -2.03 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 1pr2 s VAL 88 Cb -0.22 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 34.66 1pr2 s VAL 88 CO 0.27 -0.72 0.00 0.61 -0.31 0.00 0.00 175.10 174.95 1pr2 n GLY 89 N 4.28 5.67 3.65 2.32 0.00 -0.46 -4.19 105.19 116.46 1pr2 n GLY 89 Ca 0.02 -1.48 -0.27 0.00 0.00 0.00 0.00 46.02 44.30 1pr2 n GLY 89 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pr2 s SER 90 N 1.00 4.04 0.20 1.61 1.04 -1.26 -1.73 113.70 118.61 1pr2 s SER 90 Ca 0.00 -1.26 -0.23 0.00 0.48 0.00 0.00 55.95 54.95 1pr2 s SER 90 Cb 0.00 -0.43 0.05 0.00 0.10 0.00 0.00 66.02 65.74 1pr2 s SER 90 CO 0.00 -0.45 0.69 0.00 0.98 0.00 0.00 173.24 174.46 1pr2 s GLY 92 N -2.82 2.04 0.04 0.00 0.00 -0.49 -0.92 107.32 105.18 1pr2 s GLY 92 Ca 0.06 -0.91 0.02 0.00 0.00 0.00 0.00 44.72 43.88 1pr2 s GLY 92 CO -0.04 -0.84 0.07 0.00 0.00 0.00 0.00 173.10 172.29 1pr2 s ALA 93 N -1.30 3.53 -0.02 3.20 0.00 -0.01 -0.13 121.76 127.02 1pr2 s ALA 93 Ca 0.26 -0.95 0.03 0.00 0.00 0.00 0.00 51.96 51.31 1pr2 s ALA 93 Cb -0.12 -1.47 -0.05 0.00 0.00 0.00 0.00 23.12 21.48 1pr2 s ALA 93 CO 0.18 0.71 0.04 1.33 0.00 0.00 0.00 175.76 178.03 1pr2 n VAL 94 N 0.86 0.14 -2.76 0.00 0.24 -1.26 -1.40 118.33 114.14 1pr2 n VAL 94 Ca -0.11 -0.12 -0.41 0.00 -2.04 0.00 0.00 64.34 61.66 1pr2 n VAL 94 Cb 0.52 -0.32 -0.05 0.00 -1.47 0.00 0.00 33.84 32.53 1pr2 n VAL 94 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1pr2 s LEU 95 N -3.82 4.52 0.21 1.34 1.43 -1.26 -4.86 118.68 116.25 1pr2 s LEU 95 Ca -0.02 1.78 -0.10 0.00 -1.03 0.00 0.00 54.13 54.76 1pr2 s LEU 95 Cb 0.02 -3.55 0.17 0.00 0.03 0.00 0.00 46.19 42.86 1pr2 s LEU 95 CO 0.15 -0.02 1.89 1.55 0.23 0.00 0.00 176.35 180.15 1pr2 h PRO 96 N 5.34 1.04 0.00 1.29 0.13 -1.98 -2.43 132.00 135.39 1pr2 h PRO 96 Ca -0.43 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1pr2 h PRO 96 Cb 1.21 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1pr2 h PRO 96 CO 0.71 0.69 0.00 -2.39 -0.23 0.00 0.00 178.00 176.78 1pr2 n HIS 97 N -4.53 0.00 -3.55 1.56 1.44 -1.26 -4.61 115.22 104.27 1pr2 n HIS 97 Ca 0.08 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.41 1pr2 n HIS 97 Cb 0.02 -0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.02 1pr2 n HIS 97 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1pr2 s VAL 98 N -2.00 5.29 0.36 0.61 1.01 -0.92 -5.08 120.40 119.67 1pr2 s VAL 98 Ca 0.35 0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.65 1pr2 s VAL 98 Cb 0.16 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 1pr2 s VAL 98 CO 0.27 0.24 0.37 -0.54 0.00 0.00 0.00 175.10 175.44 1pr2 s LYS 99 N 1.78 2.75 0.58 2.72 -0.14 -1.26 -4.85 119.74 121.32 1pr2 s LYS 99 Ca 0.09 -1.30 -0.20 0.00 -1.36 0.00 0.00 55.97 53.19 1pr2 s LYS 99 Cb -0.16 -2.54 -0.04 0.00 -1.68 0.00 0.00 37.83 33.41 1pr2 s LYS 99 CO 0.10 -0.02 1.27 1.28 -0.76 0.00 0.00 175.35 177.23 1pr2 n LEU 100 N -1.51 5.27 -0.27 3.17 4.77 -1.26 -2.05 117.00 125.12 1pr2 n LEU 100 Ca 0.01 0.92 -0.04 0.00 -0.03 0.00 0.00 56.01 56.87 1pr2 n LEU 100 Cb 0.60 -1.53 -0.02 0.00 -2.33 0.00 0.00 43.42 40.14 1pr2 n LEU 100 CO 0.42 -0.91 -0.03 0.54 -1.33 0.00 0.00 177.39 176.07 1pr2 n ARG 101 N -1.19 -0.95 -2.69 3.23 1.74 -0.56 -4.94 116.66 111.30 1pr2 n ARG 101 Ca 0.12 0.46 -0.40 0.00 -0.77 0.00 0.00 57.85 57.26 1pr2 n ARG 101 Cb 0.46 -4.30 -0.05 0.00 -1.02 0.00 0.00 32.46 27.54 1pr2 n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1pr2 s ASP 102 N -2.29 7.54 -0.37 0.55 1.11 -0.87 -4.75 116.67 117.60 1pr2 s ASP 102 Ca 0.00 1.98 -0.19 0.00 0.18 0.00 0.00 52.55 54.52 1pr2 s ASP 102 Cb 0.00 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 41.38 1pr2 s ASP 102 CO 0.00 0.05 0.54 -0.69 1.18 0.00 0.00 175.17 176.25 1pr2 s VAL 103 N -0.91 4.98 -0.09 -1.27 1.01 -1.26 -1.29 120.40 121.57 1pr2 s VAL 103 Ca 0.43 0.29 -0.02 0.00 0.00 0.00 0.00 61.98 62.67 1pr2 s VAL 103 Cb -0.27 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 1pr2 s VAL 103 CO 0.33 -0.29 0.01 -0.69 0.00 0.00 0.00 175.10 174.47 1pr2 s VAL 104 N 2.46 4.42 -0.19 2.92 1.01 0.16 -1.19 120.40 129.99 1pr2 s VAL 104 Ca 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1pr2 s VAL 104 Cb -0.15 -2.87 0.02 0.00 0.00 0.00 0.00 36.38 33.38 1pr2 s VAL 104 CO 0.14 0.60 -0.17 -0.63 0.00 0.00 0.00 175.10 175.05 1pr2 s ILE 105 N -0.85 2.28 -0.81 2.22 1.01 0.84 -0.28 121.20 125.61 1pr2 s ILE 105 Ca 0.13 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 59.66 1pr2 s ILE 105 Cb -0.11 -2.00 0.10 0.00 0.01 0.00 0.00 42.46 40.46 1pr2 s ILE 105 CO 0.02 0.49 1.07 -0.83 0.00 0.00 0.00 174.94 175.69 1pr2 s GLY 106 N 1.31 1.62 0.44 6.18 0.00 -0.44 -1.50 107.32 114.93 1pr2 s GLY 106 Ca 0.04 -2.30 0.24 0.00 0.00 0.00 0.00 44.72 42.71 1pr2 s GLY 106 CO -0.11 2.08 1.81 0.00 0.00 0.00 0.00 173.10 176.88 1pr2 h MET 107 N 9.25 0.00 -4.27 2.90 -0.00 -1.37 -3.40 114.93 118.04 1pr2 h MET 107 Ca -0.05 0.00 -0.13 0.00 -0.00 0.00 0.00 59.70 59.52 1pr2 h MET 107 Cb 1.05 0.00 -0.15 0.00 -0.00 0.00 0.00 31.60 32.49 1pr2 h MET 107 CO 1.17 0.22 -0.68 0.20 -0.00 0.00 0.00 176.91 177.81 1pr2 s GLY 108 N -4.29 0.49 -0.12 -3.00 0.00 -1.11 -1.58 107.32 97.71 1pr2 s GLY 108 Ca 0.01 -1.19 -0.04 0.00 0.00 0.00 0.00 44.72 43.50 1pr2 s GLY 108 CO 0.64 -1.30 0.21 0.00 0.00 0.00 0.00 173.10 172.65 1pr2 s ALA 109 N -3.77 -0.32 0.74 3.20 0.00 -0.64 -1.19 121.76 119.78 1pr2 s ALA 109 Ca 0.06 0.66 -0.08 0.00 0.00 0.00 0.00 51.96 52.60 1pr2 s ALA 109 Cb 0.07 -0.97 0.07 0.00 0.00 0.00 0.00 23.12 22.29 1pr2 s ALA 109 CO -0.09 -0.69 1.06 0.00 0.00 0.00 0.00 175.76 176.05 1pr2 s THR 111 N -3.34 0.00 -1.34 0.00 -1.32 -1.26 -0.05 115.64 108.32 1pr2 s THR 111 Ca 0.61 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 61.23 1pr2 s THR 111 Cb -0.11 -1.00 0.35 0.00 -1.51 0.00 0.00 72.50 70.23 1pr2 s THR 111 CO 0.46 0.00 1.27 -0.90 -2.21 0.00 0.00 174.62 173.24 1pr2 n ASP 112 N -0.05 3.04 -4.84 8.08 3.85 -1.21 -4.98 116.55 120.44 1pr2 n ASP 112 Ca -0.08 -1.93 -0.30 0.00 -0.71 0.00 0.00 54.79 51.77 1pr2 n ASP 112 Cb 0.61 -0.25 0.05 0.00 -1.35 0.00 0.00 41.12 40.18 1pr2 n ASP 112 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 1pr2 s SER 113 N -1.04 5.36 0.00 -1.12 0.15 -1.26 -4.88 113.70 110.90 1pr2 s SER 113 Ca 0.28 1.37 0.13 0.00 0.70 0.00 0.00 55.95 58.43 1pr2 s SER 113 Cb 0.15 -2.23 0.06 0.00 -1.71 0.00 0.00 66.02 62.30 1pr2 s SER 113 CO 0.20 -1.43 0.84 1.17 1.20 0.00 0.00 173.24 175.23 1pr2 n LYS 114 N -3.09 1.21 -0.14 5.44 4.81 -1.26 -4.67 118.16 120.45 1pr2 n LYS 114 Ca 0.07 -1.06 0.06 0.00 -0.87 0.00 0.00 58.31 56.50 1pr2 n LYS 114 Cb 0.55 -1.21 0.37 0.00 0.02 0.00 0.00 35.03 34.76 1pr2 n LYS 114 CO 0.00 0.00 0.00 -0.39 1.17 0.00 0.00 177.40 178.18 1pr2 h VAL 115 N 2.12 1.05 0.00 3.15 -1.51 -2.00 -2.01 116.25 117.05 1pr2 h VAL 115 Ca 0.00 -0.25 -0.14 0.00 -1.23 0.00 0.00 66.70 65.09 1pr2 h VAL 115 Cb 0.50 0.27 -0.02 0.00 -2.13 0.00 0.00 31.29 29.91 1pr2 h VAL 115 CO 0.00 0.13 -0.64 0.78 -1.23 0.00 0.00 177.57 176.61 1pr2 h ASN 116 N 0.72 0.00 0.10 4.19 2.35 -1.93 -2.82 115.58 118.19 1pr2 h ASN 116 Ca 0.27 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.87 1pr2 h ASN 116 Cb 0.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1pr2 h ASN 116 CO -0.08 0.64 -0.53 0.03 -1.65 0.00 0.00 177.43 175.85 1pr2 h ARG 117 N 0.00 0.47 -0.63 0.81 3.08 -1.66 0.24 114.38 116.68 1pr2 h ARG 117 Ca -0.01 -0.28 -0.05 0.00 0.07 0.00 0.00 59.98 59.71 1pr2 h ARG 117 Cb 1.46 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 31.51 1pr2 h ARG 117 CO 0.08 0.88 0.18 0.82 -1.07 0.00 0.00 179.97 180.87 1pr2 h ILE 118 N 0.36 1.24 0.07 2.04 2.04 -1.36 0.51 117.51 122.42 1pr2 h ILE 118 Ca 0.01 -0.84 -0.26 0.00 1.00 0.00 0.00 64.86 64.77 1pr2 h ILE 118 Cb 1.04 0.56 0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1pr2 h ILE 118 CO 0.09 0.32 -1.11 0.03 0.00 0.00 0.00 178.15 177.48 1pr2 h ARG 119 N 0.93 0.44 -0.96 2.37 3.08 -1.22 -3.37 114.38 115.66 1pr2 h ARG 119 Ca 0.21 -0.57 -0.65 0.00 0.07 0.00 0.00 59.98 59.03 1pr2 h ARG 119 Cb 0.29 0.19 -0.30 0.00 0.08 0.00 0.00 29.97 30.22 1pr2 h ARG 119 CO -0.01 1.22 0.67 0.34 -1.07 0.00 0.00 179.97 181.12 1pr2 n PHE 120 N -3.71 3.15 -4.03 3.04 7.35 0.80 -4.93 117.46 119.13 1pr2 n PHE 120 Ca -0.09 -2.88 -0.28 0.00 -0.76 0.00 0.00 57.45 53.44 1pr2 n PHE 120 Cb 0.93 -1.30 -0.04 0.00 0.35 0.00 0.00 39.48 39.42 1pr2 n PHE 120 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1pr2 n LYS 121 N -0.91 -2.46 -1.22 -4.13 5.02 -1.01 -1.21 118.16 112.24 1pr2 n LYS 121 Ca 0.60 0.31 -0.08 0.00 -2.02 0.00 0.00 58.31 57.13 1pr2 n LYS 121 Cb 0.75 -4.18 -0.03 0.00 -0.02 0.00 0.00 35.03 31.54 1pr2 n LYS 121 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1pr2 n ASP 122 N -2.91 -5.61 -3.12 4.39 4.64 0.18 -4.97 116.55 109.14 1pr2 n ASP 122 Ca -0.30 0.19 -0.07 0.00 -1.38 0.00 0.00 54.79 53.23 1pr2 n ASP 122 Cb 0.68 -3.78 0.02 0.00 -1.04 0.00 0.00 41.12 37.01 1pr2 n ASP 122 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 1pr2 n HIS 123 N -2.21 -2.68 -3.21 -0.67 8.25 -0.35 -5.00 115.22 109.36 1pr2 n HIS 123 Ca -0.08 -0.81 -0.42 0.00 -0.26 0.00 0.00 57.72 56.15 1pr2 n HIS 123 Cb 0.53 -0.21 -0.08 0.00 1.12 0.00 0.00 29.99 31.36 1pr2 n HIS 123 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1pr2 s ASP 124 N -2.36 6.29 -0.26 0.41 1.11 -1.26 -4.51 116.67 116.09 1pr2 s ASP 124 Ca 0.23 -0.30 -0.09 0.00 0.18 0.00 0.00 52.55 52.56 1pr2 s ASP 124 Cb -0.02 -2.28 -0.04 0.00 1.07 0.00 0.00 42.92 41.65 1pr2 s ASP 124 CO 0.14 -0.62 0.13 0.12 1.18 0.00 0.00 175.17 176.12 1pr2 s PHE 125 N 2.51 3.17 -0.53 4.23 5.36 -1.26 -5.04 117.98 126.42 1pr2 s PHE 125 Ca 0.19 -0.10 -0.28 0.00 -0.96 0.00 0.00 56.93 55.77 1pr2 s PHE 125 Cb -0.15 -2.30 0.03 0.00 -0.34 0.00 0.00 43.02 40.25 1pr2 s PHE 125 CO 0.16 -0.22 1.22 0.00 -1.46 0.00 0.00 175.22 174.92 1pr2 s ALA 126 N 1.60 3.03 -0.59 11.12 0.00 -1.26 -4.95 121.76 130.72 1pr2 s ALA 126 Ca 0.07 -0.64 -0.28 0.00 0.00 0.00 0.00 51.96 51.11 1pr2 s ALA 126 Cb -0.15 -3.99 0.01 0.00 0.00 0.00 0.00 23.12 18.99 1pr2 s ALA 126 CO 0.07 -2.54 1.48 0.00 0.00 0.00 0.00 175.76 174.77 1pr2 s ALA 127 N 4.95 2.71 0.22 0.00 0.00 -1.26 -4.98 121.76 123.39 1pr2 s ALA 127 Ca 0.47 -0.74 0.11 0.00 0.00 0.00 0.00 51.96 51.80 1pr2 s ALA 127 Cb -0.08 -4.15 -0.05 0.00 0.00 0.00 0.00 23.12 18.84 1pr2 s ALA 127 CO 0.28 -3.12 -0.21 0.96 0.00 0.00 0.00 175.76 173.68 1pr2 s ILE 128 N 6.49 2.24 0.82 0.00 -4.36 -1.26 -1.61 121.20 123.52 1pr2 s ILE 128 Ca 0.53 -2.16 -0.11 0.00 -0.26 0.00 0.00 60.65 58.65 1pr2 s ILE 128 Cb -0.11 -2.13 0.12 0.00 1.25 0.00 0.00 42.46 41.59 1pr2 s ILE 128 CO 0.23 -0.30 1.16 0.00 0.24 0.00 0.00 174.94 176.28 1pr2 s ALA 129 N -2.16 2.76 -0.07 2.27 0.00 -0.61 -4.85 121.76 119.10 1pr2 s ALA 129 Ca 0.23 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 50.90 1pr2 s ALA 129 Cb -0.06 -2.71 -0.02 0.00 0.00 0.00 0.00 23.12 20.33 1pr2 s ALA 129 CO 0.11 -1.79 0.96 0.34 0.00 0.00 0.00 175.76 175.37 1pr2 s ASP 130 N -4.68 7.25 0.16 0.00 -1.08 -0.83 -4.97 116.67 112.52 1pr2 s ASP 130 Ca 0.66 1.52 -0.20 0.00 -0.52 0.00 0.00 52.55 54.01 1pr2 s ASP 130 Cb -0.08 -2.54 0.06 0.00 -1.46 0.00 0.00 42.92 38.90 1pr2 s ASP 130 CO 0.49 -0.34 1.64 0.15 0.52 0.00 0.00 175.17 177.62 1pr2 h PHE 131 N 6.97 -0.51 -0.76 -5.34 3.57 -1.95 -2.14 116.94 116.78 1pr2 h PHE 131 Ca -0.36 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.26 1pr2 h PHE 131 Cb 1.18 0.27 -0.05 0.00 2.79 0.00 0.00 35.95 40.14 1pr2 h PHE 131 CO 0.69 -0.28 0.50 -0.44 -2.23 0.00 0.00 178.31 176.56 1pr2 h ASP 132 N -0.16 0.68 -0.30 0.41 3.45 -1.99 -0.15 116.42 118.36 1pr2 h ASP 132 Ca 0.17 0.01 -0.11 0.00 0.43 0.00 0.00 57.03 57.52 1pr2 h ASP 132 Cb 0.41 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 39.03 1pr2 h ASP 132 CO -0.42 0.43 -0.21 0.24 -1.57 0.00 0.00 179.24 177.71 1pr2 h MET 133 N 0.77 0.78 -0.43 3.56 2.86 -1.79 0.55 114.93 121.22 1pr2 h MET 133 Ca 0.34 -0.31 -0.14 0.00 -2.06 0.00 0.00 59.70 57.53 1pr2 h MET 133 Cb 0.32 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1pr2 h MET 133 CO -0.12 0.92 -0.26 0.28 1.06 0.00 0.00 176.91 178.79 1pr2 h VAL 134 N 0.68 1.27 -0.30 -2.22 2.07 -0.76 -1.87 116.25 115.12 1pr2 h VAL 134 Ca 0.10 -1.42 -0.03 0.00 0.82 0.00 0.00 66.70 66.16 1pr2 h VAL 134 Cb 0.72 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1pr2 h VAL 134 CO 0.06 0.48 0.08 -0.09 0.02 0.00 0.00 177.57 178.12 1pr2 h ARG 135 N 0.77 0.48 -0.68 1.57 2.43 -0.86 -0.72 114.38 117.37 1pr2 h ARG 135 Ca 0.09 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1pr2 h ARG 135 Cb 0.84 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 1pr2 h ARG 135 CO 0.07 0.54 0.33 -0.91 -1.51 0.00 0.00 179.97 178.50 1pr2 h ASN 136 N 0.32 0.86 -0.33 -3.80 2.35 -0.84 -1.27 115.58 112.88 1pr2 h ASN 136 Ca 0.10 -0.09 -0.13 0.00 -0.55 0.00 0.00 56.30 55.62 1pr2 h ASN 136 Cb 0.28 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1pr2 h ASN 136 CO -0.00 0.73 -0.32 0.00 -1.65 0.00 0.00 177.43 176.19 1pr2 h ALA 137 N 1.41 0.49 -0.54 -0.83 0.00 -1.07 -0.58 119.26 118.13 1pr2 h ALA 137 Ca 0.24 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1pr2 h ALA 137 Cb 0.09 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1pr2 h ALA 137 CO -0.03 0.53 0.19 0.28 0.00 0.00 0.00 179.25 180.22 1pr2 h VAL 138 N 0.58 1.23 -0.44 0.00 2.07 -0.85 -0.88 116.25 117.95 1pr2 h VAL 138 Ca 0.05 -0.74 -0.13 0.00 0.82 0.00 0.00 66.70 66.71 1pr2 h VAL 138 Cb 0.90 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1pr2 h VAL 138 CO 0.08 0.28 -0.24 0.44 0.02 0.00 0.00 177.57 178.15 1pr2 h ASP 139 N 0.74 0.94 -0.42 0.57 3.32 -1.19 -1.66 116.42 118.72 1pr2 h ASP 139 Ca 0.18 -0.36 -0.06 0.00 0.02 0.00 0.00 57.03 56.81 1pr2 h ASP 139 Cb 0.24 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1pr2 h ASP 139 CO -0.01 1.13 0.07 0.00 -1.72 0.00 0.00 179.24 178.71 1pr2 h ALA 140 N 0.93 1.19 -0.05 3.45 0.00 -0.90 -1.60 119.26 122.28 1pr2 h ALA 140 Ca 0.10 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1pr2 h ALA 140 Cb 0.80 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1pr2 h ALA 140 CO 0.07 0.54 0.01 0.00 0.00 0.00 0.00 179.25 179.87 1pr2 h ALA 141 N 1.33 0.07 -0.68 0.00 0.00 -0.88 -2.45 119.26 116.65 1pr2 h ALA 141 Ca 0.16 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.02 1pr2 h ALA 141 Cb 0.35 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 1pr2 h ALA 141 CO 0.01 -0.32 0.36 -0.22 0.00 0.00 0.00 179.25 179.08 1pr2 h LYS 142 N -0.12 0.63 -0.39 0.00 3.64 -1.03 -0.66 116.57 118.64 1pr2 h LYS 142 Ca 0.02 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1pr2 h LYS 142 Cb 0.22 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1pr2 h LYS 142 CO -0.00 0.42 0.24 0.00 -2.27 0.00 0.00 179.45 177.83 1pr2 h ALA 143 N 1.38 1.69 -0.33 5.00 0.00 -1.14 0.15 119.26 126.00 1pr2 h ALA 143 Ca 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1pr2 h ALA 143 Cb 0.25 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1pr2 h ALA 143 CO -0.21 0.28 0.00 1.28 0.00 0.00 0.00 179.25 180.59 1pr2 n LEU 144 N -4.46 1.89 -3.54 0.00 4.77 -0.55 -4.93 117.00 110.18 1pr2 n LEU 144 Ca 0.03 -0.92 -0.19 0.00 -0.03 0.00 0.00 56.01 54.90 1pr2 n LEU 144 Cb 0.08 -0.22 0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1pr2 n LEU 144 CO 0.36 0.46 0.05 0.61 -1.33 0.00 0.00 177.39 177.53 1pr2 n GLY 145 N 1.08 -0.34 3.12 -0.72 0.00 0.52 -5.01 105.19 103.84 1pr2 n GLY 145 Ca 0.13 0.11 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 1pr2 n GLY 145 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pr2 s ILE 146 N -3.48 1.40 0.00 -0.61 1.01 -0.37 -5.01 121.20 114.15 1pr2 s ILE 146 Ca 0.02 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 59.99 1pr2 s ILE 146 Cb -0.01 -1.21 0.00 0.00 0.01 0.00 0.00 42.46 41.24 1pr2 s ILE 146 CO 0.76 0.41 0.39 0.47 0.00 0.00 0.00 174.94 176.97 1pr2 n ASP 147 N 3.30 0.00 -1.47 3.58 10.43 -1.26 -4.00 116.55 127.13 1pr2 n ASP 147 Ca -0.19 0.39 0.00 0.00 2.57 0.00 0.00 54.79 57.56 1pr2 n ASP 147 Cb 0.53 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.49 1pr2 n ASP 147 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1pr2 n ALA 148 N -1.26 -2.65 -2.61 2.24 0.00 -1.25 -4.84 120.51 110.13 1pr2 n ALA 148 Ca 0.00 0.17 -0.37 0.00 0.00 0.00 0.00 53.44 53.24 1pr2 n ALA 148 Cb 0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 19.45 18.86 1pr2 n ALA 148 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1pr2 s ARG 149 N -1.53 3.76 -0.15 0.00 0.52 -0.34 -4.95 118.95 116.26 1pr2 s ARG 149 Ca 0.00 0.22 -0.00 0.00 -0.52 0.00 0.00 55.73 55.43 1pr2 s ARG 149 Cb 0.00 -3.16 -0.01 0.00 0.52 0.00 0.00 34.95 32.30 1pr2 s ARG 149 CO 0.00 0.68 -0.14 0.08 0.02 0.00 0.00 175.30 175.94 1pr2 s VAL 150 N -1.14 2.82 0.00 3.52 1.01 -1.26 -0.11 120.40 125.23 1pr2 s VAL 150 Ca 0.24 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1pr2 s VAL 150 Cb -0.15 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 34.04 1pr2 s VAL 150 CO 0.12 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.35 1pr2 n GLY 151 N 3.95 1.14 3.83 4.51 0.00 -0.56 -4.93 105.19 113.12 1pr2 n GLY 151 Ca -0.19 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.20 1pr2 n GLY 151 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pr2 s ASN 152 N 2.00 6.95 0.33 1.61 0.01 -1.26 -0.98 114.94 123.60 1pr2 s ASN 152 Ca 0.00 1.17 0.09 0.00 -0.71 0.00 0.00 52.86 53.40 1pr2 s ASN 152 Cb 0.00 -2.32 -0.05 0.00 0.41 0.00 0.00 41.25 39.29 1pr2 s ASN 152 CO 0.00 0.21 0.05 -0.76 -1.51 0.00 0.00 177.10 175.09 1pr2 s LEU 153 N -1.45 3.11 -0.15 0.60 1.43 -0.33 -0.35 118.68 121.54 1pr2 s LEU 153 Ca 0.32 -0.85 0.01 0.00 -1.03 0.00 0.00 54.13 52.58 1pr2 s LEU 153 Cb -0.17 -1.55 0.02 0.00 0.03 0.00 0.00 46.19 44.52 1pr2 s LEU 153 CO 0.19 -0.22 -0.16 0.12 0.23 0.00 0.00 176.35 176.51 1pr2 s PHE 154 N -2.45 2.34 -0.50 0.29 5.36 0.26 -0.18 117.98 123.10 1pr2 s PHE 154 Ca 0.35 -1.32 -0.18 0.00 -0.96 0.00 0.00 56.93 54.82 1pr2 s PHE 154 Cb -0.02 -1.68 0.06 0.00 -0.34 0.00 0.00 43.02 41.04 1pr2 s PHE 154 CO 0.21 -0.69 0.58 -1.12 -1.46 0.00 0.00 175.22 172.74 1pr2 s SER 155 N 1.37 6.21 0.15 6.13 0.01 0.93 -1.12 113.70 127.37 1pr2 s SER 155 Ca 0.04 -0.99 -0.13 0.00 1.31 0.00 0.00 55.95 56.17 1pr2 s SER 155 Cb -0.13 -2.27 -0.07 0.00 0.21 0.00 0.00 66.02 63.76 1pr2 s SER 155 CO -0.10 -0.85 0.53 0.00 0.41 0.00 0.00 173.24 173.23 1pr2 s ALA 156 N 2.44 3.60 -0.03 1.44 0.00 -0.43 -3.29 121.76 125.49 1pr2 s ALA 156 Ca 0.13 -0.19 0.12 0.00 0.00 0.00 0.00 51.96 52.03 1pr2 s ALA 156 Cb -0.20 -2.47 -0.20 0.00 0.00 0.00 0.00 23.12 20.24 1pr2 s ALA 156 CO 0.11 0.48 0.83 -0.44 0.00 0.00 0.00 175.76 176.73 1pr2 h ASP 157 N 3.44 0.00 -3.67 0.00 3.45 -1.90 -3.42 116.42 114.33 1pr2 h ASP 157 Ca -0.48 0.00 -0.68 0.00 0.43 0.00 0.00 57.03 56.29 1pr2 h ASP 157 Cb 1.19 0.00 -0.34 0.00 -0.56 0.00 0.00 39.33 39.62 1pr2 h ASP 157 CO 0.66 0.92 -0.65 -0.76 -1.57 0.00 0.00 179.24 177.84 1pr2 s LEU 158 N -6.17 4.44 0.24 1.55 1.02 -1.26 -4.95 118.68 113.55 1pr2 s LEU 158 Ca -0.03 -1.62 -0.07 0.00 0.02 0.00 0.00 54.13 52.43 1pr2 s LEU 158 Cb 0.08 -1.74 0.23 0.00 0.02 0.00 0.00 46.19 44.78 1pr2 s LEU 158 CO 0.82 -0.37 1.88 0.15 0.02 0.00 0.00 176.35 178.85 1pr2 h PHE 159 N 7.97 1.25 -3.67 0.29 3.04 -1.98 -3.20 116.94 120.64 1pr2 h PHE 159 Ca -0.16 -0.01 -0.78 0.00 3.98 0.00 0.00 57.97 60.99 1pr2 h PHE 159 Cb 1.05 -0.41 -0.28 0.00 2.56 0.00 0.00 35.95 38.87 1pr2 h PHE 159 CO 0.58 0.83 0.19 0.71 -2.02 0.00 0.00 178.31 178.61 1pr2 s TYR 160 N -5.94 3.95 0.16 0.41 2.02 -1.26 -5.05 117.35 111.65 1pr2 s TYR 160 Ca -0.13 -2.40 -0.31 0.00 -0.37 0.00 0.00 57.07 53.86 1pr2 s TYR 160 Cb 0.17 -3.74 -0.09 0.00 -0.40 0.00 0.00 41.96 37.90 1pr2 s TYR 160 CO 0.83 -0.94 1.43 0.45 -1.57 0.00 0.00 175.55 175.74 1pr2 s SER 161 N 1.55 6.75 0.28 2.29 0.15 -1.21 -4.93 113.70 118.58 1pr2 s SER 161 Ca 0.24 2.46 -0.02 0.00 0.70 0.00 0.00 55.95 59.33 1pr2 s SER 161 Cb -0.10 -2.60 0.41 0.00 -1.71 0.00 0.00 66.02 62.01 1pr2 s SER 161 CO -0.08 -0.68 1.88 1.55 1.20 0.00 0.00 173.24 177.10 1pr2 h PRO 162 N 6.30 0.95 -3.84 5.44 0.13 -1.96 -3.38 132.00 135.64 1pr2 h PRO 162 Ca -0.43 -0.14 -0.58 0.00 -0.87 0.00 0.00 66.00 63.98 1pr2 h PRO 162 Cb 1.21 -0.17 -0.40 0.00 0.13 0.00 0.00 31.00 31.77 1pr2 h PRO 162 CO 0.85 0.75 -0.76 0.34 -0.23 0.00 0.00 178.00 178.94 1pr2 s ASP 163 N -6.46 3.80 0.00 1.44 3.68 -1.26 -5.01 116.67 112.86 1pr2 s ASP 163 Ca -0.11 -1.39 0.00 0.00 2.13 0.00 0.00 52.55 53.18 1pr2 s ASP 163 Cb 0.16 -0.94 0.00 0.00 -1.45 0.00 0.00 42.92 40.69 1pr2 s ASP 163 CO 0.80 -0.35 0.80 0.61 0.13 0.00 0.00 175.17 177.16 1pr2 n GLY 164 N 4.80 1.31 0.07 2.66 0.00 -1.26 -3.86 105.19 108.91 1pr2 n GLY 164 Ca -0.05 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 1pr2 n GLY 164 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1pr2 h GLU 165 N 1.70 0.03 -0.02 1.61 4.57 -1.96 -3.33 114.58 117.18 1pr2 h GLU 165 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1pr2 h GLU 165 Cb 0.53 0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.13 1pr2 h GLU 165 CO 0.00 0.87 0.03 0.52 -1.18 0.00 0.00 179.01 179.25 1pr2 h MET 166 N 0.01 0.00 -0.55 1.92 2.86 -2.00 -2.39 114.93 114.77 1pr2 h MET 166 Ca -0.11 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.48 1pr2 h MET 166 Cb 1.86 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.50 1pr2 h MET 166 CO 0.12 0.00 0.14 0.74 1.06 0.00 0.00 176.91 178.97 1pr2 h PHE 167 N 0.00 0.87 -0.43 -0.22 -1.00 -1.90 0.55 116.94 114.82 1pr2 h PHE 167 Ca 0.01 -0.08 -0.14 0.00 2.81 0.00 0.00 57.97 60.57 1pr2 h PHE 167 Cb 0.06 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.35 1pr2 h PHE 167 CO 0.00 0.73 -0.29 -0.44 -1.61 0.00 0.00 178.31 176.70 1pr2 h ASP 168 N 0.82 0.98 -0.23 2.17 3.32 -1.67 -1.34 116.42 120.47 1pr2 h ASP 168 Ca 0.18 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 1pr2 h ASP 168 Cb 0.29 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1pr2 h ASP 168 CO -0.00 1.19 0.09 0.58 -1.72 0.00 0.00 179.24 179.38 1pr2 h VAL 169 N 0.79 1.17 -0.31 -1.35 2.07 -1.33 0.40 116.25 117.69 1pr2 h VAL 169 Ca 0.09 -0.52 0.03 0.00 0.82 0.00 0.00 66.70 67.11 1pr2 h VAL 169 Cb 0.87 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1pr2 h VAL 169 CO 0.08 0.17 0.13 0.24 0.02 0.00 0.00 177.57 178.21 1pr2 h MET 170 N 0.21 0.27 -0.69 1.57 2.86 0.18 -1.90 114.93 117.44 1pr2 h MET 170 Ca 0.08 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1pr2 h MET 170 Cb 0.18 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.75 1pr2 h MET 170 CO -0.01 0.18 0.43 1.49 1.06 0.00 0.00 176.91 180.06 1pr2 h GLU 171 N 0.28 0.92 -0.89 1.72 4.81 -1.09 -2.10 114.58 118.23 1pr2 h GLU 171 Ca 0.13 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1pr2 h GLU 171 Cb 0.08 -0.20 -0.06 0.00 0.63 0.00 0.00 28.75 29.20 1pr2 h GLU 171 CO -0.11 0.64 0.57 -0.22 -0.73 0.00 0.00 179.01 179.16 1pr2 h LYS 172 N 0.93 1.06 -0.73 1.92 3.64 -0.36 -2.56 116.57 120.47 1pr2 h LYS 172 Ca 0.25 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1pr2 h LYS 172 Cb -0.06 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.52 1pr2 h LYS 172 CO -0.05 0.70 0.00 0.66 -2.27 0.00 0.00 179.45 178.49 1pr2 n TYR 173 N -4.54 1.35 -1.46 1.91 4.01 -0.76 -4.94 117.16 112.72 1pr2 n TYR 173 Ca 0.12 -0.47 -0.08 0.00 -0.16 0.00 0.00 57.90 57.31 1pr2 n TYR 173 Cb 0.12 -0.37 -0.03 0.00 -0.31 0.00 0.00 39.34 38.76 1pr2 n TYR 173 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pr2 n GLY 174 N 0.42 0.74 3.70 2.72 0.00 -0.97 -5.00 105.19 106.80 1pr2 n GLY 174 Ca 0.18 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 1pr2 n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pr2 s ILE 175 N -2.31 2.76 0.08 -0.61 -1.09 -0.82 -4.60 121.20 114.62 1pr2 s ILE 175 Ca 0.00 0.33 -0.11 0.00 -2.23 0.00 0.00 60.65 58.64 1pr2 s ILE 175 Cb 0.00 -3.21 -0.26 0.00 -1.58 0.00 0.00 42.46 37.41 1pr2 s ILE 175 CO 0.00 0.01 1.16 -0.07 -1.23 0.00 0.00 174.94 174.81 1pr2 h LEU 176 N 8.16 0.74 -7.30 2.97 3.38 -1.04 -3.40 115.31 118.81 1pr2 h LEU 176 Ca -0.44 -0.67 -0.06 0.00 0.09 0.00 0.00 57.88 56.81 1pr2 h LEU 176 Cb 1.21 -0.23 -0.15 0.00 0.09 0.00 0.00 40.66 41.57 1pr2 h LEU 176 CO 0.93 1.48 -0.03 -0.83 0.09 0.00 0.00 178.44 180.08 1pr2 s GLY 177 N -4.45 -0.34 -0.22 0.83 0.00 -1.24 -4.48 107.32 97.41 1pr2 s GLY 177 Ca -0.08 0.31 -0.03 0.00 0.00 0.00 0.00 44.72 44.92 1pr2 s GLY 177 CO 0.91 0.03 -0.07 0.14 0.00 0.00 0.00 173.10 174.11 1pr2 s VAL 178 N -2.93 3.11 0.00 1.40 1.01 0.81 -0.58 120.40 123.23 1pr2 s VAL 178 Ca -0.03 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1pr2 s VAL 178 Cb -0.00 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.96 1pr2 s VAL 178 CO -0.06 0.41 0.00 -1.84 0.00 0.00 0.00 175.10 173.62 1pr2 n GLU 179 N 4.76 1.05 -1.02 2.72 -0.00 -0.28 -1.39 120.64 126.48 1pr2 n GLU 179 Ca -0.18 0.00 0.03 0.00 -0.00 0.00 0.00 57.16 57.01 1pr2 n GLU 179 Cb 0.50 0.00 0.04 0.00 -0.00 0.00 0.00 31.44 31.98 1pr2 n GLU 179 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1pr2 n MET 180 N 0.00 0.24 0.00 3.44 2.81 -1.26 -1.32 117.12 121.04 1pr2 n MET 180 Ca 0.00 -1.87 0.00 0.00 -1.81 0.00 0.00 57.70 54.02 1pr2 n MET 180 Cb 0.00 -0.41 0.00 0.00 -0.71 0.00 0.00 33.22 32.10 1pr2 n MET 180 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1pr2 n GLU 181 N 0.06 1.08 -0.30 0.03 0.00 -1.26 -2.34 120.64 117.91 1pr2 n GLU 181 Ca 0.06 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.30 1pr2 n GLU 181 Cb 0.93 -0.14 0.19 0.00 0.00 0.00 0.00 31.44 32.43 1pr2 n GLU 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1pr2 h ALA 182 N 0.00 0.85 -0.30 -1.84 0.00 -1.94 0.18 119.26 116.21 1pr2 h ALA 182 Ca 0.00 0.31 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1pr2 h ALA 182 Cb 0.00 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1pr2 h ALA 182 CO 0.00 -0.46 0.08 0.00 0.00 0.00 0.00 179.25 178.87 1pr2 h ALA 183 N 1.86 1.59 -0.16 0.00 0.00 -1.84 -0.28 119.26 120.42 1pr2 h ALA 183 Ca 0.48 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.18 1pr2 h ALA 183 Cb 0.87 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1pr2 h ALA 183 CO -0.83 0.32 -0.26 0.78 0.00 0.00 0.00 179.25 179.25 1pr2 h GLY 184 N 0.63 0.50 1.05 0.00 0.00 -1.03 -2.09 103.07 102.14 1pr2 h GLY 184 Ca 0.10 -0.57 -0.07 0.00 0.00 0.00 0.00 47.33 46.79 1pr2 h GLY 184 CO -0.00 0.51 0.14 -2.22 0.00 0.00 0.00 176.54 174.97 1pr2 h ILE 185 N 0.09 1.26 -0.08 2.60 2.04 -1.05 -1.27 117.51 121.10 1pr2 h ILE 185 Ca 0.01 -0.98 -0.08 0.00 1.00 0.00 0.00 64.86 64.81 1pr2 h ILE 185 Cb 0.84 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1pr2 h ILE 185 CO 0.06 0.37 -0.32 1.88 0.00 0.00 0.00 178.15 180.13 1pr2 h TYR 186 N 0.98 0.17 -0.22 1.37 0.99 -1.09 -0.87 116.97 118.30 1pr2 h TYR 186 Ca 0.20 -0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.83 1pr2 h TYR 186 Cb 0.39 -0.04 -0.01 0.00 1.00 0.00 0.00 36.73 38.08 1pr2 h TYR 186 CO 0.03 0.46 -0.14 0.78 -0.00 0.00 0.00 178.16 179.29 1pr2 h GLY 187 N 1.06 0.54 1.43 3.88 0.00 -0.82 -2.28 103.07 106.88 1pr2 h GLY 187 Ca 0.02 -0.50 -0.13 0.00 0.00 0.00 0.00 47.33 46.71 1pr2 h GLY 187 CO 0.05 0.46 -0.38 -0.39 0.00 0.00 0.00 176.54 176.27 1pr2 h VAL 188 N 0.19 1.29 -0.73 4.60 -1.51 -1.04 -1.22 116.25 117.84 1pr2 h VAL 188 Ca 0.05 -1.54 0.01 0.00 -1.23 0.00 0.00 66.70 63.99 1pr2 h VAL 188 Cb 0.66 1.50 -0.04 0.00 -2.13 0.00 0.00 31.29 31.28 1pr2 h VAL 188 CO 0.04 0.49 0.48 0.00 -1.23 0.00 0.00 177.57 177.35 1pr2 h ALA 189 N 1.06 0.93 -0.17 5.19 0.00 -1.14 0.08 119.26 125.21 1pr2 h ALA 189 Ca 0.05 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1pr2 h ALA 189 Cb 0.90 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1pr2 h ALA 189 CO 0.08 0.32 -0.53 0.00 0.00 0.00 0.00 179.25 179.12 1pr2 h ALA 190 N 1.28 0.76 -0.28 0.00 0.00 -1.24 -0.13 119.26 119.65 1pr2 h ALA 190 Ca 0.27 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.51 1pr2 h ALA 190 Cb -0.09 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1pr2 h ALA 190 CO -0.07 0.68 -0.49 1.49 0.00 0.00 0.00 179.25 180.87 1pr2 h GLU 191 N 0.38 0.76 -0.35 0.00 4.81 -0.59 -3.29 114.58 116.30 1pr2 h GLU 191 Ca 0.01 -0.45 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 1pr2 h GLU 191 Cb 1.06 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.47 1pr2 h GLU 191 CO 0.10 1.08 0.00 1.19 -0.73 0.00 0.00 179.01 180.64 1pr2 n PHE 192 N -4.01 1.10 -3.39 0.92 3.01 -0.04 -5.01 117.46 110.04 1pr2 n PHE 192 Ca -0.03 -0.78 -0.18 0.00 1.01 0.00 0.00 57.45 57.47 1pr2 n PHE 192 Cb 0.59 -0.30 0.07 0.00 -0.01 0.00 0.00 39.48 39.83 1pr2 n PHE 192 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pr2 n GLY 193 N -0.05 -0.82 2.05 1.37 0.00 -0.66 -4.98 105.19 102.10 1pr2 n GLY 193 Ca 0.21 0.38 -0.15 0.00 0.00 0.00 0.00 46.02 46.47 1pr2 n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pr2 n ALA 194 N -3.69 0.37 -2.42 4.61 0.00 -0.15 -5.05 120.51 114.18 1pr2 n ALA 194 Ca -0.16 -1.26 -0.30 0.00 0.00 0.00 0.00 53.44 51.71 1pr2 n ALA 194 Cb 0.64 0.87 -0.16 0.00 0.00 0.00 0.00 19.45 20.80 1pr2 n ALA 194 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1pr2 s LYS 195 N -2.94 2.10 0.05 0.00 1.02 -0.72 -4.55 119.74 114.69 1pr2 s LYS 195 Ca 0.14 -0.88 -0.01 0.00 0.02 0.00 0.00 55.97 55.24 1pr2 s LYS 195 Cb 0.01 -1.97 -0.04 0.00 -0.52 0.00 0.00 37.83 35.31 1pr2 s LYS 195 CO 0.10 0.50 -0.03 0.00 -0.92 0.00 0.00 175.35 175.00 1pr2 s ALA 196 N -0.50 0.49 -0.13 5.17 0.00 -1.26 -0.95 121.76 124.58 1pr2 s ALA 196 Ca 0.07 -1.15 -0.16 0.00 0.00 0.00 0.00 51.96 50.72 1pr2 s ALA 196 Cb -0.10 0.25 0.04 0.00 0.00 0.00 0.00 23.12 23.31 1pr2 s ALA 196 CO -0.00 -0.34 0.42 -1.17 0.00 0.00 0.00 175.76 174.67 1pr2 s LEU 197 N -2.77 0.39 -0.12 0.00 2.96 -0.37 -1.97 118.68 116.80 1pr2 s LEU 197 Ca 0.05 0.72 0.03 0.00 -0.22 0.00 0.00 54.13 54.70 1pr2 s LEU 197 Cb 0.06 1.50 0.01 0.00 0.50 0.00 0.00 46.19 48.25 1pr2 s LEU 197 CO -0.09 -0.23 -0.22 -0.89 -1.32 0.00 0.00 176.35 173.61 1pr2 s THR 198 N -0.14 1.96 -0.05 3.68 2.01 -1.26 0.02 115.64 121.86 1pr2 s THR 198 Ca -0.03 -0.94 0.05 0.00 0.31 0.00 0.00 61.69 61.08 1pr2 s THR 198 Cb -0.03 -1.72 -0.00 0.00 0.01 0.00 0.00 72.50 70.76 1pr2 s THR 198 CO 0.02 0.53 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.66 1pr2 s ILE 199 N 0.63 1.58 0.08 1.82 1.01 0.02 -1.33 121.20 125.01 1pr2 s ILE 199 Ca -0.12 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 59.75 1pr2 s ILE 199 Cb -0.16 -1.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 1pr2 s ILE 199 CO 0.03 0.45 -0.07 0.00 0.00 0.00 0.00 174.94 175.35 1pr2 s THR 201 N -2.91 3.15 -0.32 0.00 -4.23 -0.70 0.41 115.64 111.04 1pr2 s THR 201 Ca 0.04 -0.79 -0.29 0.00 -1.18 0.00 0.00 61.69 59.47 1pr2 s THR 201 Cb 0.00 -2.28 0.00 0.00 1.34 0.00 0.00 72.50 71.57 1pr2 s THR 201 CO -0.03 0.52 1.33 -0.69 -0.54 0.00 0.00 174.62 175.20 1pr2 s VAL 202 N -0.81 4.09 -2.73 2.29 1.01 -0.41 -2.08 120.40 121.76 1pr2 s VAL 202 Ca 0.13 1.21 0.24 0.00 0.00 0.00 0.00 61.98 63.56 1pr2 s VAL 202 Cb -0.11 -4.16 0.16 0.00 0.00 0.00 0.00 36.38 32.28 1pr2 s VAL 202 CO 0.02 -0.52 1.24 -1.54 0.00 0.00 0.00 175.10 174.30 1pr2 n SER 203 N 7.84 2.68 -3.61 3.32 3.41 -0.09 -1.50 113.62 125.67 1pr2 n SER 203 Ca 0.15 -1.85 0.01 0.00 -0.26 0.00 0.00 58.87 56.92 1pr2 n SER 203 Cb 0.47 0.12 -0.01 0.00 -0.26 0.00 0.00 64.21 64.53 1pr2 n SER 203 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1pr2 s ASP 204 N -2.12 -0.06 -0.38 4.04 -4.77 -1.24 -5.02 116.67 107.12 1pr2 s ASP 204 Ca 0.26 -0.11 0.03 0.00 -3.30 0.00 0.00 52.55 49.43 1pr2 s ASP 204 Cb 0.20 0.15 0.11 0.00 -1.09 0.00 0.00 42.92 42.28 1pr2 s ASP 204 CO 0.37 -0.27 0.12 -2.28 0.70 0.00 0.00 175.17 173.81 1pr2 s HIS 205 N -2.39 3.00 0.00 2.11 2.46 -1.23 -0.83 115.29 118.40 1pr2 s HIS 205 Ca 0.14 -2.68 0.00 0.00 0.47 0.00 0.00 55.06 52.98 1pr2 s HIS 205 Cb 0.04 -2.52 0.00 0.00 -0.13 0.00 0.00 32.58 29.98 1pr2 s HIS 205 CO -0.04 -0.88 0.00 -0.89 -2.47 0.00 0.00 174.74 170.46 1pr2 n ILE 206 N 4.11 0.00 -0.12 0.89 2.08 -0.49 0.19 119.36 126.02 1pr2 n ILE 206 Ca 0.03 0.00 -0.24 0.00 0.56 0.00 0.00 62.75 63.10 1pr2 n ILE 206 Cb 0.39 0.00 -0.10 0.00 -0.75 0.00 0.00 39.64 39.18 1pr2 n ILE 206 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 1pr2 n ARG 207 N -3.65 0.57 -0.02 0.38 3.00 -1.26 -4.64 116.66 111.05 1pr2 n ARG 207 Ca 0.00 0.44 -0.16 0.00 -0.00 0.00 0.00 57.85 58.13 1pr2 n ARG 207 Cb 0.00 -1.64 -0.10 0.00 0.00 0.00 0.00 32.46 30.73 1pr2 n ARG 207 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 1pr2 h THR 208 N -1.00 1.40 0.00 5.15 2.02 -1.46 -3.47 112.91 115.55 1pr2 h THR 208 Ca -0.48 -1.90 0.00 0.00 0.77 0.00 0.00 66.41 64.79 1pr2 h THR 208 Cb 1.41 2.37 0.00 0.00 -1.74 0.00 0.00 68.15 70.18 1pr2 h THR 208 CO -0.29 0.56 0.00 1.41 0.37 0.00 0.00 175.52 177.57 1pr2 n HIS 209 N -4.26 0.00 -1.65 3.16 8.25 0.50 -4.90 115.22 116.33 1pr2 n HIS 209 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 1pr2 n HIS 209 Cb 0.61 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.72 1pr2 n HIS 209 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1pr2 n GLU 210 N 0.00 0.00 -3.57 -0.41 0.00 -1.26 -3.52 120.64 111.88 1pr2 n GLU 210 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 57.16 57.09 1pr2 n GLU 210 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 31.44 31.41 1pr2 n GLU 210 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 1pr2 s GLN 211 N 0.00 0.52 0.00 5.31 -2.07 -1.26 -4.95 119.66 117.21 1pr2 s GLN 211 Ca 0.00 -0.06 0.00 0.00 -1.82 0.00 0.00 55.36 53.48 1pr2 s GLN 211 Cb 0.00 0.24 0.00 0.00 -1.09 0.00 0.00 33.01 32.16 1pr2 s GLN 211 CO 0.00 -0.20 0.00 -2.37 -1.32 0.00 0.00 175.29 171.40 1pr2 n THR 212 N 0.21 0.00 -4.06 3.63 5.66 -1.26 -5.12 114.28 113.34 1pr2 n THR 212 Ca -0.06 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.65 1pr2 n THR 212 Cb 0.59 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.31 1pr2 n THR 212 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1pr2 s THR 213 N -0.98 4.48 0.16 1.09 -4.23 -1.26 -5.03 115.64 109.87 1pr2 s THR 213 Ca 0.00 -0.84 -0.15 0.00 -1.18 0.00 0.00 61.69 59.53 1pr2 s THR 213 Cb 0.00 -3.18 0.04 0.00 1.34 0.00 0.00 72.50 70.70 1pr2 s THR 213 CO 0.00 0.09 1.78 0.00 -0.54 0.00 0.00 174.62 175.95 1pr2 h ALA 214 N 3.16 0.62 -0.91 3.99 0.00 -2.02 -1.34 119.26 122.76 1pr2 h ALA 214 Ca -0.47 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 54.47 1pr2 h ALA 214 Cb 1.17 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.70 1pr2 h ALA 214 CO 0.65 0.12 0.59 0.00 0.00 0.00 0.00 179.25 180.61 1pr2 h ALA 215 N 1.13 1.62 -0.05 0.00 0.00 -1.98 0.25 119.26 120.22 1pr2 h ALA 215 Ca 0.17 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.86 1pr2 h ALA 215 Cb 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1pr2 h ALA 215 CO -0.03 0.19 -0.86 0.93 0.00 0.00 0.00 179.25 179.48 1pr2 h GLU 216 N 0.91 0.52 -0.42 0.00 5.08 -1.86 -1.96 114.58 116.86 1pr2 h GLU 216 Ca 0.42 -0.49 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 1pr2 h GLU 216 Cb 0.41 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1pr2 h GLU 216 CO -0.19 1.13 -0.04 0.00 -1.00 0.00 0.00 179.01 178.92 1pr2 h ARG 217 N 0.33 0.76 -0.03 2.33 3.08 -0.57 -1.55 114.38 118.73 1pr2 h ARG 217 Ca -0.07 -0.26 -0.08 0.00 0.07 0.00 0.00 59.98 59.64 1pr2 h ARG 217 Cb 1.48 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.46 1pr2 h ARG 217 CO 0.16 0.86 -0.34 1.96 -1.07 0.00 0.00 179.97 181.53 1pr2 h GLN 218 N 0.59 0.06 -0.23 0.04 4.20 -0.99 -0.56 115.11 118.21 1pr2 h GLN 218 Ca 0.11 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.71 1pr2 h GLN 218 Cb 0.54 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 1pr2 h GLN 218 CO 0.03 0.40 -0.22 1.15 -0.67 0.00 0.00 178.83 179.52 1pr2 h THR 219 N 0.05 1.32 -0.38 -0.54 2.02 -1.08 -2.67 112.91 111.63 1pr2 h THR 219 Ca 0.01 -1.38 -0.07 0.00 0.77 0.00 0.00 66.41 65.73 1pr2 h THR 219 Cb 0.64 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.71 1pr2 h THR 219 CO 0.05 0.43 -0.05 0.74 0.37 0.00 0.00 175.52 177.06 1pr2 h THR 220 N 0.27 1.23 -0.64 3.16 2.02 -0.87 -1.86 112.91 116.22 1pr2 h THR 220 Ca 0.04 -0.96 -0.09 0.00 0.77 0.00 0.00 66.41 66.17 1pr2 h THR 220 Cb 0.78 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1pr2 h THR 220 CO 0.06 0.33 0.06 0.15 0.37 0.00 0.00 175.52 176.49 1pr2 h PHE 221 N 0.58 1.15 -0.24 3.16 3.04 -1.05 -2.33 116.94 121.26 1pr2 h PHE 221 Ca 0.11 -0.17 -0.10 0.00 3.98 0.00 0.00 57.97 61.80 1pr2 h PHE 221 Cb 0.44 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.62 1pr2 h PHE 221 CO 0.02 0.99 -0.26 -0.91 -2.02 0.00 0.00 178.31 176.12 1pr2 h ASN 222 N 1.00 0.47 -0.68 0.41 2.35 -1.11 -2.33 115.58 115.69 1pr2 h ASN 222 Ca 0.19 -0.16 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 1pr2 h ASN 222 Cb 0.48 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 1pr2 h ASN 222 CO 0.02 0.72 0.33 0.44 -1.65 0.00 0.00 177.43 177.29 1pr2 h ASP 223 N 0.41 0.89 -0.11 5.81 3.32 -1.06 0.87 116.42 126.55 1pr2 h ASP 223 Ca 0.06 -0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.00 1pr2 h ASP 223 Cb 0.68 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 1pr2 h ASP 223 CO 0.05 0.77 -0.05 -0.03 -1.72 0.00 0.00 179.24 178.26 1pr2 h MET 224 N 0.94 -0.04 -0.62 3.56 1.85 -0.95 0.19 114.93 119.87 1pr2 h MET 224 Ca 0.23 0.00 -0.00 0.00 -0.61 0.00 0.00 59.70 59.32 1pr2 h MET 224 Cb 0.12 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.13 1pr2 h MET 224 CO -0.03 -0.02 0.38 0.82 -0.40 0.00 0.00 176.91 177.65 1pr2 h ILE 225 N -0.04 1.18 -0.88 1.77 1.08 -1.05 -0.15 117.51 119.42 1pr2 h ILE 225 Ca 0.06 -0.39 -0.02 0.00 -0.39 0.00 0.00 64.86 64.12 1pr2 h ILE 225 Cb 0.13 0.32 -0.04 0.00 -3.07 0.00 0.00 36.82 34.16 1pr2 h ILE 225 CO -0.14 0.18 0.48 0.50 -0.69 0.00 0.00 178.15 178.49 1pr2 h LYS 226 N 0.84 1.23 -0.65 2.37 3.64 -0.35 0.10 116.57 123.75 1pr2 h LYS 226 Ca 0.22 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1pr2 h LYS 226 Cb -0.03 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 31.52 1pr2 h LYS 226 CO -0.04 0.90 0.24 0.82 -2.27 0.00 0.00 179.45 179.10 1pr2 h ILE 227 N 1.24 1.24 0.07 2.00 2.04 0.03 0.11 117.51 124.23 1pr2 h ILE 227 Ca 0.31 -0.78 -0.00 0.00 1.00 0.00 0.00 64.86 65.39 1pr2 h ILE 227 Cb 0.03 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 1pr2 h ILE 227 CO -0.05 0.30 -0.03 0.00 0.00 0.00 0.00 178.15 178.37 1pr2 h ALA 228 N 1.10 -0.09 -0.17 1.87 0.00 -0.42 -0.90 119.26 120.65 1pr2 h ALA 228 Ca 0.21 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1pr2 h ALA 228 Cb 0.23 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1pr2 h ALA 228 CO -0.01 -0.46 0.11 -0.07 0.00 0.00 0.00 179.25 178.81 1pr2 h LEU 229 N -0.26 0.20 -1.42 0.00 3.38 -0.65 -2.68 115.31 113.88 1pr2 h LEU 229 Ca -0.01 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1pr2 h LEU 229 Cb 0.23 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1pr2 h LEU 229 CO 0.01 0.18 -0.26 -0.33 0.09 0.00 0.00 178.44 178.13 1pr2 h GLU 230 N 0.21 0.04 -0.17 1.13 4.39 -0.78 -2.61 114.58 116.79 1pr2 h GLU 230 Ca 0.06 -0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.68 1pr2 h GLU 230 Cb 0.01 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1pr2 h GLU 230 CO -0.01 0.31 -0.19 0.66 -1.16 0.00 0.00 179.01 178.62 1pr2 h SER 231 N 0.04 0.28 -0.49 1.42 4.64 -0.83 -2.24 113.55 116.37 1pr2 h SER 231 Ca 0.00 -0.07 -0.12 0.00 -0.47 0.00 0.00 61.79 61.14 1pr2 h SER 231 Cb 0.49 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 1pr2 h SER 231 CO 0.04 0.48 -0.15 0.58 -0.87 0.00 0.00 176.83 176.91 1pr2 h VAL 232 N 0.27 1.27 -0.54 0.95 2.07 -1.24 -1.68 116.25 117.34 1pr2 h VAL 232 Ca 0.05 -1.30 -0.07 0.00 0.82 0.00 0.00 66.70 66.20 1pr2 h VAL 232 Cb 0.49 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1pr2 h VAL 232 CO 0.03 0.45 0.05 -0.07 0.02 0.00 0.00 177.57 178.05 1pr2 h LEU 233 N 0.82 0.84 -0.63 2.57 3.38 -1.37 -1.76 115.31 119.16 1pr2 h LEU 233 Ca 0.12 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 1pr2 h LEU 233 Cb 0.71 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1pr2 h LEU 233 CO 0.05 0.88 -0.11 -0.07 0.09 0.00 0.00 178.44 179.28 1pr2 h LEU 234 N 0.83 0.96 -1.69 1.67 3.38 -1.27 -2.73 115.31 116.47 1pr2 h LEU 234 Ca 0.17 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1pr2 h LEU 234 Cb 0.42 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1pr2 h LEU 234 CO 0.01 1.08 -0.08 1.23 0.09 0.00 0.00 178.44 180.77 1pr2 h GLY 235 N 0.95 0.10 2.00 0.83 0.00 -0.75 -1.69 103.07 104.51 1pr2 h GLY 235 Ca 0.14 -0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.36 1pr2 h GLY 235 CO 0.05 0.05 -0.25 -0.55 0.00 0.00 0.00 176.54 175.83 1pr2 h ASP 236 N 0.09 0.00 -0.01 0.19 3.32 -1.01 -3.51 116.42 115.48 1pr2 h ASP 236 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1pr2 h ASP 236 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1pr2 h ASP 236 CO 0.01 0.25 0.00 0.29 -1.72 0.00 0.00 179.24 178.08