#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pr5 s THR 2 N 0.00 1.14 0.43 0.00 -4.23 -0.30 -4.95 115.64 107.73 1pr5 s THR 2 Ca 0.00 -1.89 0.34 0.00 -1.18 0.00 0.00 61.69 58.96 1pr5 s THR 2 Cb 0.00 -1.67 0.52 0.00 1.34 0.00 0.00 72.50 72.69 1pr5 s THR 2 CO 0.00 -0.64 1.44 -2.65 -0.54 0.00 0.00 174.62 172.23 1pr5 n PRO 3 N 0.12 -0.03 0.00 3.99 -0.02 -1.26 -1.48 135.00 136.33 1pr5 n PRO 3 Ca -0.13 1.12 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1pr5 n PRO 3 Cb 0.59 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 1pr5 n PRO 3 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1pr5 n HIS 4 N -4.36 0.00 -3.65 6.00 8.25 -1.26 -4.95 115.22 115.25 1pr5 n HIS 4 Ca 0.38 -0.26 -0.27 0.00 -0.26 0.00 0.00 57.72 57.30 1pr5 n HIS 4 Cb 1.55 -0.03 -0.16 0.00 1.12 0.00 0.00 29.99 32.47 1pr5 n HIS 4 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1pr5 s ILE 5 N -0.53 0.18 -1.35 1.59 1.01 -0.55 -4.71 121.20 116.84 1pr5 s ILE 5 Ca 0.00 -0.48 -0.14 0.00 0.00 0.00 0.00 60.65 60.03 1pr5 s ILE 5 Cb 0.00 -0.87 0.09 0.00 0.01 0.00 0.00 42.46 41.69 1pr5 s ILE 5 CO 0.00 -0.37 1.92 -3.20 0.00 0.00 0.00 174.94 173.29 1pr5 n ASN 6 N 5.17 4.60 -3.92 3.58 2.85 -1.26 -1.15 115.26 125.12 1pr5 n ASN 6 Ca -0.07 -2.94 -0.09 0.00 -0.11 0.00 0.00 54.58 51.37 1pr5 n ASN 6 Cb 0.47 -1.63 -0.04 0.00 1.24 0.00 0.00 39.78 39.81 1pr5 n ASN 6 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pr5 s ALA 7 N 2.64 -0.45 0.28 5.20 0.00 -1.26 -4.68 121.76 123.48 1pr5 s ALA 7 Ca 0.47 -0.76 0.12 0.00 0.00 0.00 0.00 51.96 51.78 1pr5 s ALA 7 Cb 0.08 1.01 -0.05 0.00 0.00 0.00 0.00 23.12 24.17 1pr5 s ALA 7 CO -0.01 -0.90 -0.16 -1.21 0.00 0.00 0.00 175.76 173.47 1pr5 s GLU 8 N -3.93 1.79 0.17 0.00 0.41 -1.26 -0.35 118.70 115.52 1pr5 s GLU 8 Ca 0.20 -1.71 -0.33 0.00 -0.41 0.00 0.00 54.97 52.72 1pr5 s GLU 8 Cb -0.02 -1.84 -0.16 0.00 -1.78 0.00 0.00 34.13 30.33 1pr5 s GLU 8 CO 0.09 0.33 1.08 -0.12 -0.49 0.00 0.00 175.26 176.15 1pr5 n MET 9 N -0.67 0.96 0.00 1.61 0.00 -1.26 -1.30 117.12 116.46 1pr5 n MET 9 Ca -0.05 0.34 0.00 0.00 -0.00 0.00 0.00 57.70 57.99 1pr5 n MET 9 Cb 0.60 -1.78 0.00 0.00 0.00 0.00 0.00 33.22 32.04 1pr5 n MET 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1pr5 n GLY 10 N 1.91 3.11 0.16 -5.12 0.00 -1.26 -4.92 105.19 99.06 1pr5 n GLY 10 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 1pr5 n GLY 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pr5 h ASP 11 N 0.09 0.03 -3.05 1.61 3.32 -1.56 -3.44 116.42 113.41 1pr5 h ASP 11 Ca 0.00 -0.01 -0.62 0.00 0.02 0.00 0.00 57.03 56.41 1pr5 h ASP 11 Cb 0.00 -0.01 -0.08 0.00 0.22 0.00 0.00 39.33 39.47 1pr5 h ASP 11 CO 0.00 0.55 -0.58 -0.36 -1.72 0.00 0.00 179.24 177.14 1pr5 s PHE 12 N -3.83 3.25 0.77 4.55 0.40 -1.26 -4.76 117.98 117.09 1pr5 s PHE 12 Ca -0.02 0.09 -0.12 0.00 -0.60 0.00 0.00 56.93 56.29 1pr5 s PHE 12 Cb 0.13 -1.63 0.05 0.00 0.51 0.00 0.00 43.02 42.08 1pr5 s PHE 12 CO 0.75 0.53 1.11 0.00 0.70 0.00 0.00 175.22 178.31 1pr5 s ALA 13 N -1.47 2.55 -1.71 5.36 0.00 -1.26 -4.90 121.76 120.33 1pr5 s ALA 13 Ca 0.31 -0.34 0.17 0.00 0.00 0.00 0.00 51.96 52.10 1pr5 s ALA 13 Cb -0.12 -3.05 0.95 0.00 0.00 0.00 0.00 23.12 20.90 1pr5 s ALA 13 CO 0.23 -1.50 1.48 -0.40 0.00 0.00 0.00 175.76 175.58 1pr5 n ASP 14 N -3.25 0.00 -4.01 0.00 5.75 -1.26 -4.56 116.55 109.22 1pr5 n ASP 14 Ca 0.07 -0.24 -0.23 0.00 -0.01 0.00 0.00 54.79 54.38 1pr5 n ASP 14 Cb 0.57 -0.15 -0.16 0.00 -1.03 0.00 0.00 41.12 40.36 1pr5 n ASP 14 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1pr5 s VAL 15 N -2.29 0.96 -0.07 2.12 1.01 -1.26 -0.56 120.40 120.31 1pr5 s VAL 15 Ca 0.21 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.77 1pr5 s VAL 15 Cb 0.12 -0.87 0.02 0.00 0.00 0.00 0.00 36.38 35.65 1pr5 s VAL 15 CO 0.23 0.30 -0.04 -0.69 0.00 0.00 0.00 175.10 174.91 1pr5 s VAL 16 N 0.43 0.59 0.15 2.92 1.01 -0.56 -2.65 120.40 122.28 1pr5 s VAL 16 Ca -0.08 -0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.61 1pr5 s VAL 16 Cb -0.12 -0.65 -0.08 0.00 0.00 0.00 0.00 36.38 35.53 1pr5 s VAL 16 CO 0.02 0.27 0.68 -0.76 0.00 0.00 0.00 175.10 175.30 1pr5 s LEU 17 N 1.39 4.48 -0.21 3.92 1.43 -0.45 -1.83 118.68 127.41 1pr5 s LEU 17 Ca -0.03 1.42 -0.03 0.00 -1.03 0.00 0.00 54.13 54.45 1pr5 s LEU 17 Cb -0.13 -3.25 0.07 0.00 0.03 0.00 0.00 46.19 42.91 1pr5 s LEU 17 CO -0.03 0.17 0.07 -0.04 0.23 0.00 0.00 176.35 176.76 1pr5 s MET 18 N -1.43 0.44 0.57 1.70 -1.94 -0.17 -2.04 119.30 116.44 1pr5 s MET 18 Ca 0.36 -0.42 -0.06 0.00 -1.71 0.00 0.00 55.69 53.86 1pr5 s MET 18 Cb -0.20 -1.89 -0.00 0.00 2.01 0.00 0.00 34.83 34.75 1pr5 s MET 18 CO 0.22 -0.74 0.89 -1.25 -0.01 0.00 0.00 175.02 174.12 1pr5 s PRO 19 N 1.94 3.05 0.02 2.03 0.04 -1.24 -2.48 135.00 138.36 1pr5 s PRO 19 Ca 0.02 0.06 -0.20 0.00 0.04 0.00 0.00 61.00 60.92 1pr5 s PRO 19 Cb -0.17 -2.28 -0.19 0.00 0.04 0.00 0.00 34.50 31.90 1pr5 s PRO 19 CO -0.14 -0.61 1.19 0.78 0.04 0.00 0.00 177.00 178.26 1pr5 h GLY 20 N -0.11 0.45 -5.10 0.56 0.00 -1.87 -0.56 103.07 96.44 1pr5 h GLY 20 Ca -0.46 -0.65 -0.56 0.00 0.00 0.00 0.00 47.33 45.66 1pr5 h GLY 20 CO 0.61 0.58 0.90 -0.35 0.00 0.00 0.00 176.54 178.28 1pr5 s ASP 21 N -6.53 6.91 0.42 0.19 -1.08 -1.26 -2.06 116.67 113.25 1pr5 s ASP 21 Ca -0.14 1.82 0.13 0.00 -0.52 0.00 0.00 52.55 53.84 1pr5 s ASP 21 Cb 0.04 -2.54 0.89 0.00 -1.46 0.00 0.00 42.92 39.85 1pr5 s ASP 21 CO 0.80 -0.76 1.94 -0.65 0.52 0.00 0.00 175.17 177.02 1pr5 h PRO 22 N 8.28 0.08 0.00 4.34 0.11 -1.88 -1.83 132.00 141.10 1pr5 h PRO 22 Ca -0.30 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 1pr5 h PRO 22 Cb 1.13 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1pr5 h PRO 22 CO 0.95 0.27 -0.05 -0.07 -0.21 0.00 0.00 178.00 178.89 1pr5 h LEU 23 N 0.08 0.00 0.00 2.35 3.38 -1.91 -2.54 115.31 116.66 1pr5 h LEU 23 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1pr5 h LEU 23 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1pr5 h LEU 23 CO 0.03 0.05 -0.46 0.03 0.09 0.00 0.00 178.44 178.18 1pr5 h ARG 24 N 0.00 0.00 -0.44 1.13 3.08 -1.73 -3.22 114.38 113.19 1pr5 h ARG 24 Ca -0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 1pr5 h ARG 24 Cb 0.29 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1pr5 h ARG 24 CO 0.01 0.00 -0.18 0.00 -1.07 0.00 0.00 179.97 178.73 1pr5 h ALA 25 N 2.35 0.85 -0.38 0.04 0.00 -1.51 -1.96 119.26 118.65 1pr5 h ALA 25 Ca 0.00 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 54.45 1pr5 h ALA 25 Cb 0.83 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1pr5 h ALA 25 CO 0.00 0.64 -0.14 -0.22 0.00 0.00 0.00 179.25 179.53 1pr5 h LYS 26 N 0.76 0.76 -0.61 0.00 1.63 -1.66 -2.21 116.57 115.24 1pr5 h LYS 26 Ca 0.11 -0.32 0.02 0.00 -0.85 0.00 0.00 60.65 59.62 1pr5 h LYS 26 Cb 0.71 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 32.27 1pr5 h LYS 26 CO 0.05 0.93 0.38 -0.92 -3.45 0.00 0.00 179.45 176.45 1pr5 h TYR 27 N 0.56 0.72 -0.70 1.91 5.03 -1.53 -2.06 116.97 120.90 1pr5 h TYR 27 Ca 0.09 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.34 1pr5 h TYR 27 Cb 0.68 -0.24 -0.03 0.00 1.55 0.00 0.00 36.73 38.70 1pr5 h TYR 27 CO 0.05 0.42 0.14 0.82 -1.32 0.00 0.00 178.16 178.27 1pr5 h ILE 28 N 0.76 1.26 -0.80 1.81 2.04 -1.27 0.92 117.51 122.23 1pr5 h ILE 28 Ca 0.24 -1.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 1pr5 h ILE 28 Cb -0.00 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 1pr5 h ILE 28 CO -0.09 0.39 0.38 0.00 0.00 0.00 0.00 178.15 178.83 1pr5 h ALA 29 N 1.07 1.16 0.02 1.87 0.00 -1.05 0.56 119.26 122.88 1pr5 h ALA 29 Ca 0.22 -0.16 -0.22 0.00 0.00 0.00 0.00 54.91 54.75 1pr5 h ALA 29 Cb 0.41 -0.32 0.02 0.00 0.00 0.00 0.00 17.79 17.90 1pr5 h ALA 29 CO 0.01 0.64 -0.86 0.93 0.00 0.00 0.00 179.25 179.97 1pr5 h GLU 30 N 1.15 0.54 0.24 0.00 5.08 -1.16 -3.15 114.58 117.28 1pr5 h GLU 30 Ca 0.28 -0.61 -0.33 0.00 -1.00 0.00 0.00 59.36 57.69 1pr5 h GLU 30 Cb 0.12 0.18 0.03 0.00 0.50 0.00 0.00 28.75 29.59 1pr5 h GLU 30 CO -0.03 1.23 -1.45 1.15 -1.00 0.00 0.00 179.01 178.90 1pr5 h THR 31 N 0.11 1.31 0.00 1.13 2.02 -0.72 -3.42 112.91 113.34 1pr5 h THR 31 Ca -0.11 -2.76 -0.09 0.00 0.77 0.00 0.00 66.41 64.22 1pr5 h THR 31 Cb 1.55 3.03 -0.02 0.00 -1.74 0.00 0.00 68.15 70.98 1pr5 h THR 31 CO 0.17 0.82 -1.36 0.49 0.37 0.00 0.00 175.52 176.01 1pr5 n PHE 32 N -3.69 0.00 -2.17 3.16 3.01 0.17 -5.06 117.46 112.88 1pr5 n PHE 32 Ca -0.16 0.00 -0.27 0.00 1.01 0.00 0.00 57.45 58.03 1pr5 n PHE 32 Cb 1.10 -0.25 0.06 0.00 -0.01 0.00 0.00 39.48 40.37 1pr5 n PHE 32 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1pr5 s LEU 33 N -4.28 2.88 0.07 4.37 1.43 -1.10 -4.79 118.68 117.26 1pr5 s LEU 33 Ca -0.03 0.63 0.07 0.00 -1.03 0.00 0.00 54.13 53.77 1pr5 s LEU 33 Cb 0.02 -3.31 -0.03 0.00 0.03 0.00 0.00 46.19 42.90 1pr5 s LEU 33 CO 0.23 -1.49 -0.18 -0.70 0.23 0.00 0.00 176.35 174.44 1pr5 s GLU 34 N -5.24 1.06 -1.48 1.70 2.56 -0.29 -4.77 118.70 112.24 1pr5 s GLU 34 Ca 0.59 -0.98 -0.15 0.00 0.00 0.00 0.00 54.97 54.43 1pr5 s GLU 34 Cb -0.11 -1.18 0.12 0.00 2.00 0.00 0.00 34.13 34.96 1pr5 s GLU 34 CO 0.46 0.28 0.66 -0.25 -0.56 0.00 0.00 175.26 175.85 1pr5 n ASP 35 N 1.46 -3.43 -4.72 -1.70 8.00 -1.26 -1.37 116.55 113.52 1pr5 n ASP 35 Ca -0.19 -0.72 -0.33 0.00 0.71 0.00 0.00 54.79 54.26 1pr5 n ASP 35 Cb 0.54 -2.83 0.10 0.00 -0.02 0.00 0.00 41.12 38.92 1pr5 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pr5 s ALA 36 N -3.10 2.04 -0.20 2.24 0.00 -1.26 -4.60 121.76 116.88 1pr5 s ALA 36 Ca 0.59 0.73 -0.13 0.00 0.00 0.00 0.00 51.96 53.15 1pr5 s ALA 36 Cb -0.32 -3.43 0.06 0.00 0.00 0.00 0.00 23.12 19.43 1pr5 s ALA 36 CO 0.73 -1.98 0.50 -0.98 0.00 0.00 0.00 175.76 174.03 1pr5 s ARG 37 N -4.18 0.52 0.32 0.00 1.70 -0.40 -4.95 118.95 111.96 1pr5 s ARG 37 Ca 0.71 0.87 -0.29 0.00 -0.47 0.00 0.00 55.73 56.55 1pr5 s ARG 37 Cb -0.26 0.10 -0.11 0.00 -0.57 0.00 0.00 34.95 34.12 1pr5 s ARG 37 CO 0.48 -0.13 1.47 -2.00 -1.08 0.00 0.00 175.30 174.04 1pr5 s GLU 38 N 1.15 4.19 0.00 3.89 2.12 -1.26 -2.20 118.70 126.58 1pr5 s GLU 38 Ca -0.07 2.45 0.00 0.00 0.36 0.00 0.00 54.97 57.71 1pr5 s GLU 38 Cb -0.06 -3.03 0.00 0.00 0.26 0.00 0.00 34.13 31.30 1pr5 s GLU 38 CO -0.11 -0.47 0.33 1.33 -0.54 0.00 0.00 175.26 175.80 1pr5 n VAL 39 N 1.28 0.05 -3.54 3.70 0.24 0.04 -4.93 118.33 115.16 1pr5 n VAL 39 Ca 0.04 -0.31 -0.12 0.00 -2.04 0.00 0.00 64.34 61.91 1pr5 n VAL 39 Cb 0.39 1.37 -0.04 0.00 -1.47 0.00 0.00 33.84 34.09 1pr5 n VAL 39 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1pr5 s ASN 40 N -0.05 -0.44 0.00 -1.34 3.84 -1.21 -4.43 114.94 111.31 1pr5 s ASN 40 Ca 0.00 0.36 0.00 0.00 0.21 0.00 0.00 52.86 53.43 1pr5 s ASN 40 Cb 0.00 0.39 0.00 0.00 -0.55 0.00 0.00 41.25 41.09 1pr5 s ASN 40 CO 0.00 -0.49 0.00 -0.46 -2.79 0.00 0.00 177.10 173.36 1pr5 n ASN 41 N 0.49 0.00 -0.20 -4.21 0.23 -1.26 -2.94 115.26 107.38 1pr5 n ASN 41 Ca -0.12 -0.97 0.08 0.00 -0.53 0.00 0.00 54.58 53.04 1pr5 n ASN 41 Cb 0.59 0.00 0.16 0.00 -2.08 0.00 0.00 39.78 38.45 1pr5 n ASN 41 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 1pr5 n VAL 42 N 0.00 -0.24 -2.32 3.53 0.31 -1.26 -1.35 118.33 116.99 1pr5 n VAL 42 Ca 0.00 1.28 0.02 0.00 -0.01 0.00 0.00 64.34 65.63 1pr5 n VAL 42 Cb 0.32 -1.85 0.07 0.00 -0.91 0.00 0.00 33.84 31.47 1pr5 n VAL 42 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1pr5 n ARG 43 N -4.75 0.77 -0.79 5.55 1.74 -1.26 -4.89 116.66 113.02 1pr5 n ARG 43 Ca 0.13 -2.60 0.00 0.00 -0.77 0.00 0.00 57.85 54.61 1pr5 n ARG 43 Cb 0.42 -0.69 0.00 0.00 -1.02 0.00 0.00 32.46 31.17 1pr5 n ARG 43 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pr5 n GLY 44 N -0.07 0.72 3.46 -0.13 0.00 -0.46 -4.95 105.19 103.76 1pr5 n GLY 44 Ca 0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.69 1pr5 n GLY 44 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1pr5 s MET 45 N -0.21 3.97 0.05 1.61 0.00 -1.26 -4.83 119.30 118.63 1pr5 s MET 45 Ca 0.00 -2.39 -0.31 0.00 0.00 0.00 0.00 55.69 52.99 1pr5 s MET 45 Cb 0.00 -5.02 -0.07 0.00 0.00 0.00 0.00 34.83 29.74 1pr5 s MET 45 CO 0.00 -1.76 1.45 -0.51 0.00 0.00 0.00 175.02 174.19 1pr5 s LEU 46 N 1.82 4.34 -0.02 4.11 1.43 -1.26 -4.03 118.68 125.06 1pr5 s LEU 46 Ca 0.40 2.25 0.07 0.00 -1.03 0.00 0.00 54.13 55.82 1pr5 s LEU 46 Cb -0.03 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.60 1pr5 s LEU 46 CO -0.02 -0.73 -0.23 -0.83 0.23 0.00 0.00 176.35 174.76 1pr5 s GLY 47 N 1.76 1.16 0.09 -3.19 0.00 -1.15 -3.69 107.32 102.29 1pr5 s GLY 47 Ca 0.66 -1.01 0.03 0.00 0.00 0.00 0.00 44.72 44.41 1pr5 s GLY 47 CO 0.29 -0.80 -0.10 -1.36 0.00 0.00 0.00 173.10 171.13 1pr5 s PHE 48 N -0.49 1.01 -0.02 1.90 0.08 0.35 -0.78 117.98 120.03 1pr5 s PHE 48 Ca 0.07 -0.66 0.02 0.00 0.12 0.00 0.00 56.93 56.48 1pr5 s PHE 48 Cb -0.10 -0.56 0.01 0.00 -0.57 0.00 0.00 43.02 41.80 1pr5 s PHE 48 CO -0.00 -0.02 -0.07 0.99 -0.10 0.00 0.00 175.22 176.02 1pr5 s THR 49 N -2.40 0.60 0.00 0.64 2.01 -0.94 0.74 115.64 116.29 1pr5 s THR 49 Ca 0.04 -0.25 0.00 0.00 0.31 0.00 0.00 61.69 61.79 1pr5 s THR 49 Cb -0.03 -0.55 0.00 0.00 0.01 0.00 0.00 72.50 71.93 1pr5 s THR 49 CO -0.00 0.20 0.00 0.61 -0.69 0.00 0.00 174.62 174.74 1pr5 n GLY 50 N 3.39 3.35 3.07 4.40 0.00 0.12 -1.28 105.19 118.25 1pr5 n GLY 50 Ca -0.19 -0.58 -0.12 0.00 0.00 0.00 0.00 46.02 45.13 1pr5 n GLY 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pr5 s THR 51 N -1.55 0.51 -0.17 2.61 -4.23 -0.47 0.21 115.64 112.54 1pr5 s THR 51 Ca 0.00 -1.26 -0.00 0.00 -1.18 0.00 0.00 61.69 59.25 1pr5 s THR 51 Cb 0.00 -0.82 0.04 0.00 1.34 0.00 0.00 72.50 73.07 1pr5 s THR 51 CO 0.00 -0.52 -0.06 -0.47 -0.54 0.00 0.00 174.62 173.03 1pr5 s TYR 52 N -1.93 1.83 -1.45 3.99 6.14 0.34 -1.13 117.35 125.13 1pr5 s TYR 52 Ca -0.06 -1.17 -0.05 0.00 0.64 0.00 0.00 57.07 56.43 1pr5 s TYR 52 Cb -0.06 -1.37 0.04 0.00 0.42 0.00 0.00 41.96 40.98 1pr5 s TYR 52 CO -0.01 -0.64 0.60 1.63 0.64 0.00 0.00 175.55 177.77 1pr5 n LYS 53 N 4.84 -3.85 0.00 4.97 5.02 -1.26 -0.21 118.16 127.67 1pr5 n LYS 53 Ca -0.12 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 1pr5 n LYS 53 Cb 0.48 -4.86 0.00 0.00 -0.02 0.00 0.00 35.03 30.63 1pr5 n LYS 53 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pr5 n GLY 54 N -1.78 2.95 3.71 0.72 0.00 -1.26 -5.00 105.19 104.51 1pr5 n GLY 54 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1pr5 n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1pr5 s ARG 55 N -0.11 4.52 0.05 1.61 3.00 0.71 -4.95 118.95 123.78 1pr5 s ARG 55 Ca 0.00 1.35 -0.31 0.00 -1.00 0.00 0.00 55.73 55.78 1pr5 s ARG 55 Cb 0.00 -3.48 -0.06 0.00 0.00 0.00 0.00 34.95 31.42 1pr5 s ARG 55 CO 0.00 -0.09 1.28 0.21 0.00 0.00 0.00 175.30 176.70 1pr5 s LYS 56 N 1.18 4.37 -0.01 5.12 2.20 -1.26 0.12 119.74 131.47 1pr5 s LYS 56 Ca 0.50 1.86 -0.07 0.00 -0.36 0.00 0.00 55.97 57.89 1pr5 s LYS 56 Cb -0.20 -3.39 0.01 0.00 -1.51 0.00 0.00 37.83 32.74 1pr5 s LYS 56 CO 0.25 -0.37 0.15 0.42 -0.36 0.00 0.00 175.35 175.44 1pr5 s ILE 57 N 1.42 0.06 0.20 5.43 1.01 0.13 -4.71 121.20 124.74 1pr5 s ILE 57 Ca 0.61 -0.52 0.11 0.00 0.00 0.00 0.00 60.65 60.84 1pr5 s ILE 57 Cb -0.31 -0.40 -0.04 0.00 0.01 0.00 0.00 42.46 41.72 1pr5 s ILE 57 CO 0.28 -0.29 -0.21 -0.44 0.00 0.00 0.00 174.94 174.29 1pr5 s SER 58 N -1.04 3.62 -0.03 3.58 0.01 -1.09 0.15 113.70 118.91 1pr5 s SER 58 Ca -0.11 -0.83 0.02 0.00 1.31 0.00 0.00 55.95 56.34 1pr5 s SER 58 Cb -0.06 -0.35 0.01 0.00 0.21 0.00 0.00 66.02 65.82 1pr5 s SER 58 CO 0.01 0.11 -0.07 -0.69 0.41 0.00 0.00 173.24 173.01 1pr5 s VAL 59 N -1.78 0.61 -0.28 3.43 1.01 0.23 -1.34 120.40 122.28 1pr5 s VAL 59 Ca 0.23 -0.25 -0.22 0.00 0.00 0.00 0.00 61.98 61.73 1pr5 s VAL 59 Cb -0.08 -0.57 0.12 0.00 0.00 0.00 0.00 36.38 35.85 1pr5 s VAL 59 CO 0.11 0.21 0.95 -0.32 0.00 0.00 0.00 175.10 176.05 1pr5 s MET 60 N 0.36 0.54 0.75 2.72 0.00 -0.86 0.13 119.30 122.94 1pr5 s MET 60 Ca -0.05 0.72 -0.11 0.00 0.00 0.00 0.00 55.69 56.25 1pr5 s MET 60 Cb -0.09 0.22 0.04 0.00 0.00 0.00 0.00 34.83 35.00 1pr5 s MET 60 CO 0.00 -0.08 1.08 0.20 0.00 0.00 0.00 175.02 176.22 1pr5 s GLY 61 N 0.60 1.66 -0.00 2.11 0.00 -1.24 -3.68 107.32 106.76 1pr5 s GLY 61 Ca -0.01 0.05 0.01 0.00 0.00 0.00 0.00 44.72 44.78 1pr5 s GLY 61 CO -0.08 0.41 0.06 -2.39 0.00 0.00 0.00 173.10 171.09 1pr5 n HIS 62 N -3.34 0.00 0.00 1.90 1.44 -0.22 -4.88 115.22 110.11 1pr5 n HIS 62 Ca 0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 1pr5 n HIS 62 Cb 0.54 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.65 1pr5 n HIS 62 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1pr5 n GLY 63 N 1.13 -0.97 3.82 -1.39 0.00 -0.88 -2.94 105.19 103.97 1pr5 n GLY 63 Ca 0.00 -1.65 -0.38 0.00 0.00 0.00 0.00 46.02 43.99 1pr5 n GLY 63 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1pr5 s MET 64 N -1.90 4.12 0.00 1.61 1.00 -1.26 -4.51 119.30 118.35 1pr5 s MET 64 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 55.69 56.33 1pr5 s MET 64 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 34.83 31.63 1pr5 s MET 64 CO 0.00 0.63 0.00 0.41 0.00 0.00 0.00 175.02 176.06 1pr5 n GLY 65 N 1.63 1.95 0.15 -0.03 0.00 -1.25 -4.49 105.19 103.14 1pr5 n GLY 65 Ca -0.11 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.04 1pr5 n GLY 65 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1pr5 h ILE 66 N 0.00 1.25 -0.97 -0.61 2.04 -1.85 -2.69 117.51 114.68 1pr5 h ILE 66 Ca 0.00 -0.87 0.17 0.00 1.00 0.00 0.00 64.86 65.17 1pr5 h ILE 66 Cb 0.00 1.33 -0.10 0.00 -0.74 0.00 0.00 36.82 37.31 1pr5 h ILE 66 CO 0.00 0.27 0.57 -0.65 0.00 0.00 0.00 178.15 178.34 1pr5 h PRO 67 N 0.21 0.73 0.13 2.37 0.11 -1.91 0.16 132.00 133.79 1pr5 h PRO 67 Ca 0.07 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.13 1pr5 h PRO 67 Cb 0.39 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.34 1pr5 h PRO 67 CO 0.01 0.48 -0.06 1.03 -0.21 0.00 0.00 178.00 179.25 1pr5 h SER 68 N 0.75 -0.14 -0.65 -2.05 0.87 -1.76 -2.79 113.55 107.77 1pr5 h SER 68 Ca 0.55 0.00 0.19 0.00 -1.23 0.00 0.00 61.79 61.30 1pr5 h SER 68 Cb 0.81 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.78 1pr5 h SER 68 CO -0.37 -0.08 0.51 0.00 -0.53 0.00 0.00 176.83 176.36 1pr5 h SER 70 N 0.00 0.55 0.14 0.00 0.02 -0.65 -1.14 113.55 112.47 1pr5 h SER 70 Ca 0.31 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1pr5 h SER 70 Cb 1.32 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1pr5 h SER 70 CO -0.00 0.77 -0.07 0.40 -1.14 0.00 0.00 176.83 176.79 1pr5 h ILE 71 N 0.48 1.01 0.23 3.27 2.04 -0.82 -2.57 117.51 121.15 1pr5 h ILE 71 Ca 0.07 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 1pr5 h ILE 71 Cb 0.66 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.20 1pr5 h ILE 71 CO 0.05 0.17 -0.11 1.88 0.00 0.00 0.00 178.15 180.14 1pr5 h TYR 72 N -0.54 -0.28 -0.50 1.37 0.05 -1.53 -2.01 116.97 113.52 1pr5 h TYR 72 Ca -0.02 -0.01 0.09 0.00 0.05 0.00 0.00 58.73 58.84 1pr5 h TYR 72 Cb 0.42 0.09 -0.07 0.00 1.01 0.00 0.00 36.73 38.18 1pr5 h TYR 72 CO 0.04 -0.10 0.06 1.15 -1.05 0.00 0.00 178.16 178.26 1pr5 h THR 73 N -0.40 0.68 -0.07 -2.88 2.02 -1.31 0.36 112.91 111.30 1pr5 h THR 73 Ca -0.03 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 1pr5 h THR 73 Cb 0.31 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1pr5 h THR 73 CO 0.05 0.03 0.04 0.50 0.37 0.00 0.00 175.52 176.51 1pr5 h LYS 74 N 0.19 0.11 -0.90 6.66 3.11 -1.40 -1.90 116.57 122.43 1pr5 h LYS 74 Ca 0.25 -0.01 0.01 0.00 -2.81 0.00 0.00 60.65 58.08 1pr5 h LYS 74 Cb 0.36 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 31.53 1pr5 h LYS 74 CO -0.36 0.18 0.58 0.93 -2.81 0.00 0.00 179.45 177.97 1pr5 h GLU 75 N 0.01 1.19 -0.01 1.90 5.08 -0.90 -0.25 114.58 121.61 1pr5 h GLU 75 Ca 0.03 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1pr5 h GLU 75 Cb 0.10 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.09 1pr5 h GLU 75 CO -0.00 0.80 0.00 -0.07 -1.00 0.00 0.00 179.01 178.74 1pr5 h LEU 76 N 1.22 0.01 -0.06 1.33 3.38 -0.76 0.12 115.31 120.54 1pr5 h LEU 76 Ca 0.33 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1pr5 h LEU 76 Cb -0.12 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1pr5 h LEU 76 CO -0.07 0.20 0.01 0.40 0.09 0.00 0.00 178.44 179.08 1pr5 h ILE 77 N -0.18 1.19 0.00 1.22 2.04 -1.14 -0.19 117.51 120.45 1pr5 h ILE 77 Ca 0.00 -0.59 -0.08 0.00 1.00 0.00 0.00 64.86 65.19 1pr5 h ILE 77 Cb 0.19 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 1pr5 h ILE 77 CO -0.00 0.16 -0.56 0.71 0.00 0.00 0.00 178.15 178.46 1pr5 h THR 78 N -0.12 0.53 0.00 -0.27 1.35 -1.11 -3.35 112.91 109.94 1pr5 h THR 78 Ca 0.02 -1.79 0.00 0.00 -0.55 0.00 0.00 66.41 64.09 1pr5 h THR 78 Cb 0.25 2.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 1pr5 h THR 78 CO 0.00 0.30 -0.38 0.47 -0.25 0.00 0.00 175.52 175.66 1pr5 n ASP 79 N -3.10 1.09 -0.40 5.36 9.92 0.02 -4.72 116.55 124.72 1pr5 n ASP 79 Ca 0.01 -0.44 0.07 0.00 -0.53 0.00 0.00 54.79 53.89 1pr5 n ASP 79 Cb 0.69 1.03 0.13 0.00 -0.64 0.00 0.00 41.12 42.33 1pr5 n ASP 79 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1pr5 n PHE 80 N -1.20 0.00 -1.20 1.24 3.01 -0.11 -4.51 117.46 114.69 1pr5 n PHE 80 Ca 0.00 -0.95 -0.10 0.00 1.01 0.00 0.00 57.45 57.41 1pr5 n PHE 80 Cb 0.06 -0.16 -0.04 0.00 -0.01 0.00 0.00 39.48 39.32 1pr5 n PHE 80 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pr5 n GLY 81 N -0.98 0.95 3.73 1.37 0.00 -1.17 -4.66 105.19 104.44 1pr5 n GLY 81 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1pr5 n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pr5 s VAL 82 N -1.76 3.05 -0.03 1.61 1.01 -1.07 -4.72 120.40 118.49 1pr5 s VAL 82 Ca 0.00 0.84 0.10 0.00 0.00 0.00 0.00 61.98 62.92 1pr5 s VAL 82 Cb 0.00 -3.54 -0.15 0.00 0.00 0.00 0.00 36.38 32.70 1pr5 s VAL 82 CO 0.00 0.11 0.18 0.29 0.00 0.00 0.00 175.10 175.69 1pr5 n LYS 83 N 2.84 0.69 -4.38 2.72 5.02 0.28 -4.37 118.16 120.95 1pr5 n LYS 83 Ca 0.08 -0.07 -0.20 0.00 -2.02 0.00 0.00 58.31 56.09 1pr5 n LYS 83 Cb 0.42 -1.23 -0.15 0.00 -0.02 0.00 0.00 35.03 34.04 1pr5 n LYS 83 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1pr5 s LYS 84 N -2.60 0.89 -0.12 1.97 1.02 -0.44 -1.43 119.74 119.03 1pr5 s LYS 84 Ca -0.04 -0.31 -0.01 0.00 0.02 0.00 0.00 55.97 55.64 1pr5 s LYS 84 Cb 0.06 -0.84 0.03 0.00 -0.52 0.00 0.00 37.83 36.55 1pr5 s LYS 84 CO 0.40 0.13 -0.06 0.42 -0.92 0.00 0.00 175.35 175.32 1pr5 s ILE 85 N 0.09 0.96 -0.29 2.17 1.01 -0.20 -1.49 121.20 123.45 1pr5 s ILE 85 Ca -0.01 -0.32 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 1pr5 s ILE 85 Cb -0.07 -1.04 0.02 0.00 0.01 0.00 0.00 42.46 41.38 1pr5 s ILE 85 CO 0.00 0.29 0.03 -0.63 0.00 0.00 0.00 174.94 174.64 1pr5 s ILE 86 N 1.73 3.50 -0.10 2.92 1.01 -0.76 -0.33 121.20 129.16 1pr5 s ILE 86 Ca 0.04 -0.94 -0.22 0.00 0.00 0.00 0.00 60.65 59.54 1pr5 s ILE 86 Cb -0.13 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 1pr5 s ILE 86 CO -0.08 0.05 0.63 -0.60 0.00 0.00 0.00 174.94 174.94 1pr5 s ARG 87 N 1.40 4.38 -0.28 2.79 3.52 0.22 -1.00 118.95 129.99 1pr5 s ARG 87 Ca 0.00 0.73 0.03 0.00 -0.13 0.00 0.00 55.73 56.36 1pr5 s ARG 87 Cb -0.18 -3.46 0.07 0.00 -1.56 0.00 0.00 34.95 29.82 1pr5 s ARG 87 CO 0.00 0.05 -0.06 0.14 -0.81 0.00 0.00 175.30 174.62 1pr5 s VAL 88 N 0.89 2.06 0.00 7.11 -7.23 -1.03 -0.30 120.40 121.89 1pr5 s VAL 88 Ca 0.33 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 58.77 1pr5 s VAL 88 Cb -0.17 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.49 1pr5 s VAL 88 CO 0.15 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.36 1pr5 n GLY 89 N 4.44 4.69 3.56 2.32 0.00 -0.28 -4.23 105.19 115.69 1pr5 n GLY 89 Ca -0.09 -1.19 -0.26 0.00 0.00 0.00 0.00 46.02 44.48 1pr5 n GLY 89 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pr5 s SER 90 N 1.26 3.48 0.12 1.61 1.04 -1.26 -1.35 113.70 118.60 1pr5 s SER 90 Ca 0.00 -1.32 -0.25 0.00 0.48 0.00 0.00 55.95 54.87 1pr5 s SER 90 Cb 0.00 -0.31 0.07 0.00 0.10 0.00 0.00 66.02 65.88 1pr5 s SER 90 CO 0.00 -0.41 0.73 0.00 0.98 0.00 0.00 173.24 174.53 1pr5 s GLY 92 N -2.70 2.19 0.02 0.00 0.00 -0.20 -1.24 107.32 105.39 1pr5 s GLY 92 Ca 0.04 -0.77 0.00 0.00 0.00 0.00 0.00 44.72 44.00 1pr5 s GLY 92 CO -0.08 -0.67 0.10 0.00 0.00 0.00 0.00 173.10 172.44 1pr5 s ALA 93 N -1.39 3.66 -0.05 3.20 0.00 0.70 0.93 121.76 128.81 1pr5 s ALA 93 Ca 0.30 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.43 1pr5 s ALA 93 Cb -0.13 -1.61 -0.08 0.00 0.00 0.00 0.00 23.12 21.31 1pr5 s ALA 93 CO 0.21 0.72 0.03 1.33 0.00 0.00 0.00 175.76 178.06 1pr5 n VAL 94 N 0.93 0.36 -2.24 0.00 0.24 -1.26 -2.38 118.33 113.97 1pr5 n VAL 94 Ca -0.11 -0.24 -0.39 0.00 -2.04 0.00 0.00 64.34 61.56 1pr5 n VAL 94 Cb 0.52 -0.72 -0.02 0.00 -1.47 0.00 0.00 33.84 32.15 1pr5 n VAL 94 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1pr5 s LEU 95 N -4.33 4.29 0.21 1.34 1.43 -1.26 -4.93 118.68 115.42 1pr5 s LEU 95 Ca -0.03 2.45 -0.09 0.00 -1.03 0.00 0.00 54.13 55.43 1pr5 s LEU 95 Cb 0.02 -3.88 0.25 0.00 0.03 0.00 0.00 46.19 42.61 1pr5 s LEU 95 CO 0.24 -0.61 1.79 1.55 0.23 0.00 0.00 176.35 179.56 1pr5 h PRO 96 N 2.93 0.61 -0.63 1.29 0.13 -1.99 -3.14 132.00 131.21 1pr5 h PRO 96 Ca -0.49 -0.04 -0.15 0.00 -0.87 0.00 0.00 66.00 64.46 1pr5 h PRO 96 Cb 1.23 -0.14 -0.09 0.00 0.13 0.00 0.00 31.00 32.13 1pr5 h PRO 96 CO 0.64 0.40 0.17 0.72 -0.23 0.00 0.00 178.00 179.70 1pr5 n HIS 97 N -4.83 2.12 -3.60 1.56 8.25 -1.26 -4.80 115.22 112.67 1pr5 n HIS 97 Ca 0.09 -1.11 -0.40 0.00 -0.26 0.00 0.00 57.72 56.03 1pr5 n HIS 97 Cb 0.20 -0.60 -0.11 0.00 1.12 0.00 0.00 29.99 30.60 1pr5 n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1pr5 s VAL 98 N -2.96 4.82 0.41 1.59 1.01 -1.19 -5.07 120.40 119.01 1pr5 s VAL 98 Ca 0.53 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 62.05 1pr5 s VAL 98 Cb 0.42 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 1pr5 s VAL 98 CO 0.12 -0.05 0.61 -0.54 0.00 0.00 0.00 175.10 175.24 1pr5 s LYS 99 N 1.63 3.08 0.49 2.72 1.02 -1.26 -4.86 119.74 122.56 1pr5 s LYS 99 Ca 0.04 -0.65 -0.24 0.00 0.02 0.00 0.00 55.97 55.14 1pr5 s LYS 99 Cb -0.18 -2.64 -0.07 0.00 -0.52 0.00 0.00 37.83 34.42 1pr5 s LYS 99 CO 0.08 -0.16 1.40 1.28 -0.92 0.00 0.00 175.35 177.03 1pr5 n LEU 100 N -1.94 5.26 0.00 3.17 4.77 -1.26 -2.18 117.00 124.82 1pr5 n LEU 100 Ca 0.01 1.06 0.00 0.00 -0.03 0.00 0.00 56.01 57.05 1pr5 n LEU 100 Cb 0.58 -1.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.08 1pr5 n LEU 100 CO 0.46 -0.33 0.00 0.54 -1.33 0.00 0.00 177.39 176.73 1pr5 n ARG 101 N -0.51 0.00 -0.90 3.23 1.74 0.18 -4.94 116.66 115.46 1pr5 n ARG 101 Ca 0.07 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.83 1pr5 n ARG 101 Cb 0.43 -1.62 0.15 0.00 -1.02 0.00 0.00 32.46 30.40 1pr5 n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1pr5 s ASP 102 N -3.89 3.23 -0.14 0.55 -0.00 -0.93 -4.50 116.67 110.99 1pr5 s ASP 102 Ca 0.00 2.30 -0.04 0.00 -0.00 0.00 0.00 52.55 54.81 1pr5 s ASP 102 Cb 0.00 -2.58 -0.03 0.00 -0.00 0.00 0.00 42.92 40.31 1pr5 s ASP 102 CO 0.00 -2.91 -0.02 -0.69 -0.00 0.00 0.00 175.17 171.56 1pr5 s VAL 103 N -2.38 4.11 -0.05 -1.27 1.01 -1.26 -0.83 120.40 119.74 1pr5 s VAL 103 Ca 0.70 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.41 1pr5 s VAL 103 Cb -0.26 -2.79 0.01 0.00 0.00 0.00 0.00 36.38 33.34 1pr5 s VAL 103 CO 0.54 0.51 -0.09 0.68 0.00 0.00 0.00 175.10 176.74 1pr5 s VAL 104 N 0.07 0.87 -0.25 2.92 -7.23 0.10 -0.70 120.40 116.17 1pr5 s VAL 104 Ca 0.01 -0.35 -0.09 0.00 -1.81 0.00 0.00 61.98 59.74 1pr5 s VAL 104 Cb -0.13 -0.81 -0.04 0.00 0.56 0.00 0.00 36.38 35.96 1pr5 s VAL 104 CO 0.02 0.29 0.13 -0.63 -0.31 0.00 0.00 175.10 174.60 1pr5 s ILE 105 N 0.58 4.93 -0.71 -0.62 1.09 0.12 -1.11 121.20 125.49 1pr5 s ILE 105 Ca -0.10 0.04 -0.26 0.00 -1.10 0.00 0.00 60.65 59.22 1pr5 s ILE 105 Cb -0.13 -3.31 0.04 0.00 -1.06 0.00 0.00 42.46 37.99 1pr5 s ILE 105 CO 0.02 0.31 1.19 -0.83 -0.10 0.00 0.00 174.94 175.54 1pr5 s GLY 106 N 1.47 1.02 0.27 6.18 0.00 0.03 -2.24 107.32 114.05 1pr5 s GLY 106 Ca 0.06 -1.44 0.08 0.00 0.00 0.00 0.00 44.72 43.42 1pr5 s GLY 106 CO 0.07 2.49 1.62 1.98 0.00 0.00 0.00 173.10 179.25 1pr5 h MET 107 N 9.88 0.09 -4.17 2.90 4.05 -1.24 -3.39 114.93 123.05 1pr5 h MET 107 Ca -0.28 -0.06 -0.14 0.00 -0.28 0.00 0.00 59.70 58.94 1pr5 h MET 107 Cb 1.06 0.01 -0.14 0.00 -0.80 0.00 0.00 31.60 31.72 1pr5 h MET 107 CO 1.25 0.65 -0.53 0.20 0.23 0.00 0.00 176.91 178.70 1pr5 s GLY 108 N -4.39 0.65 -0.09 1.39 0.00 -1.19 -0.73 107.32 102.96 1pr5 s GLY 108 Ca -0.02 -1.17 -0.03 0.00 0.00 0.00 0.00 44.72 43.50 1pr5 s GLY 108 CO 0.77 -1.15 0.05 0.00 0.00 0.00 0.00 173.10 172.77 1pr5 s ALA 109 N -3.98 0.45 0.63 3.20 0.00 -0.65 -1.07 121.76 120.34 1pr5 s ALA 109 Ca 0.17 -0.07 -0.10 0.00 0.00 0.00 0.00 51.96 51.97 1pr5 s ALA 109 Cb 0.06 -0.79 -0.01 0.00 0.00 0.00 0.00 23.12 22.38 1pr5 s ALA 109 CO -0.02 -0.69 1.00 0.00 0.00 0.00 0.00 175.76 176.05 1pr5 s THR 111 N -3.16 0.00 -0.69 0.00 -1.32 -1.26 0.12 115.64 109.34 1pr5 s THR 111 Ca 0.55 -0.01 0.11 0.00 -1.21 0.00 0.00 61.69 61.13 1pr5 s THR 111 Cb -0.11 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.20 1pr5 s THR 111 CO 0.51 -0.01 1.26 -0.90 -2.21 0.00 0.00 174.62 173.27 1pr5 n ASP 112 N -0.26 3.00 -4.84 8.08 5.68 -1.19 -4.98 116.55 122.04 1pr5 n ASP 112 Ca -0.17 -2.21 -0.32 0.00 -0.50 0.00 0.00 54.79 51.59 1pr5 n ASP 112 Cb 0.64 -0.27 -0.05 0.00 -1.14 0.00 0.00 41.12 40.30 1pr5 n ASP 112 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1pr5 s SER 113 N -1.20 6.71 0.00 -1.12 0.15 -1.26 -4.85 113.70 112.12 1pr5 s SER 113 Ca 0.25 1.48 0.23 0.00 0.70 0.00 0.00 55.95 58.60 1pr5 s SER 113 Cb 0.15 -2.46 0.60 0.00 -1.71 0.00 0.00 66.02 62.60 1pr5 s SER 113 CO 0.13 -0.43 1.51 1.17 1.20 0.00 0.00 173.24 176.81 1pr5 n LYS 114 N -1.09 2.69 -0.14 5.44 4.81 -1.26 -4.57 118.16 124.03 1pr5 n LYS 114 Ca 0.05 -2.59 -0.07 0.00 -0.87 0.00 0.00 58.31 54.84 1pr5 n LYS 114 Cb 0.54 -1.56 0.02 0.00 0.02 0.00 0.00 35.03 34.05 1pr5 n LYS 114 CO 0.00 0.00 0.00 -0.24 1.17 0.00 0.00 177.40 178.33 1pr5 h VAL 115 N 4.33 1.07 0.00 3.15 3.04 -2.00 -2.26 116.25 123.58 1pr5 h VAL 115 Ca 0.00 -0.19 -0.15 0.00 -1.01 0.00 0.00 66.70 65.35 1pr5 h VAL 115 Cb 0.99 0.48 -0.02 0.00 -2.01 0.00 0.00 31.29 30.72 1pr5 h VAL 115 CO 0.00 0.10 -0.71 0.78 -1.01 0.00 0.00 177.57 176.73 1pr5 h ASN 116 N 0.54 0.00 -0.07 3.17 2.35 -1.93 -3.01 115.58 116.63 1pr5 h ASN 116 Ca 0.17 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1pr5 h ASN 116 Cb -0.01 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1pr5 h ASN 116 CO -0.07 0.71 -0.15 0.03 -1.65 0.00 0.00 177.43 176.30 1pr5 h ARG 117 N 0.00 0.42 -0.19 0.81 3.08 -1.77 1.35 114.38 118.07 1pr5 h ARG 117 Ca -0.01 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.83 1pr5 h ARG 117 Cb 1.54 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.54 1pr5 h ARG 117 CO 0.09 0.56 -0.29 0.82 -1.07 0.00 0.00 179.97 180.09 1pr5 h ILE 118 N 0.38 1.27 0.16 2.04 2.04 -1.37 0.89 117.51 122.93 1pr5 h ILE 118 Ca 0.07 -1.29 -0.30 0.00 1.00 0.00 0.00 64.86 64.34 1pr5 h ILE 118 Cb 0.50 1.44 0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1pr5 h ILE 118 CO 0.03 0.40 -1.35 0.03 0.00 0.00 0.00 178.15 177.26 1pr5 h ARG 119 N 0.33 0.35 -0.91 2.37 3.08 -0.92 -3.37 114.38 115.31 1pr5 h ARG 119 Ca 0.05 -0.60 -0.58 0.00 0.07 0.00 0.00 59.98 58.92 1pr5 h ARG 119 Cb 0.68 0.22 -0.30 0.00 0.08 0.00 0.00 29.97 30.66 1pr5 h ARG 119 CO 0.05 1.28 0.53 0.34 -1.07 0.00 0.00 179.97 181.09 1pr5 n PHE 120 N -3.58 2.95 -4.08 3.04 7.35 0.44 -4.92 117.46 118.67 1pr5 n PHE 120 Ca -0.12 -2.54 -0.30 0.00 -0.76 0.00 0.00 57.45 53.73 1pr5 n PHE 120 Cb 1.05 -1.12 -0.03 0.00 0.35 0.00 0.00 39.48 39.73 1pr5 n PHE 120 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1pr5 n LYS 121 N -0.96 -3.05 -2.29 -4.13 5.02 -0.97 -0.90 118.16 110.88 1pr5 n LYS 121 Ca 0.57 0.37 -0.19 0.00 -2.02 0.00 0.00 58.31 57.04 1pr5 n LYS 121 Cb 0.96 -4.64 -0.02 0.00 -0.02 0.00 0.00 35.03 31.32 1pr5 n LYS 121 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1pr5 n ASP 122 N -2.87 -5.34 -4.95 4.39 2.03 0.30 -4.98 116.55 105.14 1pr5 n ASP 122 Ca -0.18 0.10 -0.25 0.00 0.52 0.00 0.00 54.79 54.97 1pr5 n ASP 122 Cb 0.62 -4.50 0.02 0.00 -0.72 0.00 0.00 41.12 36.54 1pr5 n ASP 122 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 1pr5 s HIS 123 N -2.88 1.39 -0.49 -0.67 3.76 -0.08 -5.01 115.29 111.31 1pr5 s HIS 123 Ca 0.00 -0.86 -0.22 0.00 -0.15 0.00 0.00 55.06 53.83 1pr5 s HIS 123 Cb 0.00 -1.96 0.04 0.00 1.11 0.00 0.00 32.58 31.77 1pr5 s HIS 123 CO 0.00 -0.72 0.75 -0.51 -0.85 0.00 0.00 174.74 173.41 1pr5 s ASP 124 N -4.41 6.33 -0.24 1.40 1.11 -1.26 -4.58 116.67 115.01 1pr5 s ASP 124 Ca 0.39 -0.41 -0.12 0.00 0.18 0.00 0.00 52.55 52.60 1pr5 s ASP 124 Cb -0.03 -2.36 -0.05 0.00 1.07 0.00 0.00 42.92 41.55 1pr5 s ASP 124 CO 0.25 -0.96 0.21 0.12 1.18 0.00 0.00 175.17 175.97 1pr5 s PHE 125 N 3.19 3.31 -0.79 4.23 5.36 -1.26 -5.03 117.98 126.99 1pr5 s PHE 125 Ca 0.25 0.28 -0.25 0.00 -0.96 0.00 0.00 56.93 56.25 1pr5 s PHE 125 Cb -0.14 -2.34 0.05 0.00 -0.34 0.00 0.00 43.02 40.24 1pr5 s PHE 125 CO 0.18 0.01 1.26 0.00 -1.46 0.00 0.00 175.22 175.21 1pr5 s ALA 126 N 1.23 2.83 -0.43 11.12 0.00 -1.26 -4.95 121.76 130.29 1pr5 s ALA 126 Ca 0.10 -1.69 -0.28 0.00 0.00 0.00 0.00 51.96 50.08 1pr5 s ALA 126 Cb -0.14 -4.24 -0.01 0.00 0.00 0.00 0.00 23.12 18.73 1pr5 s ALA 126 CO 0.06 -3.26 1.70 0.00 0.00 0.00 0.00 175.76 174.26 1pr5 s ALA 127 N 5.17 2.73 0.17 0.00 0.00 -1.26 -4.96 121.76 123.61 1pr5 s ALA 127 Ca 0.35 -0.13 0.08 0.00 0.00 0.00 0.00 51.96 52.27 1pr5 s ALA 127 Cb -0.08 -4.08 -0.04 0.00 0.00 0.00 0.00 23.12 18.92 1pr5 s ALA 127 CO 0.08 -2.92 -0.18 0.96 0.00 0.00 0.00 175.76 173.71 1pr5 s ILE 128 N 7.06 1.83 0.94 0.00 -4.36 -1.26 -1.63 121.20 123.77 1pr5 s ILE 128 Ca 0.71 -1.97 -0.16 0.00 -0.26 0.00 0.00 60.65 58.97 1pr5 s ILE 128 Cb -0.17 -1.88 0.22 0.00 1.25 0.00 0.00 42.46 41.87 1pr5 s ILE 128 CO 0.30 -0.35 1.28 0.00 0.24 0.00 0.00 174.94 176.40 1pr5 n ALA 129 N 0.18 -1.43 -2.65 2.27 0.00 0.09 -4.87 120.51 114.10 1pr5 n ALA 129 Ca -0.12 -1.68 -0.40 0.00 0.00 0.00 0.00 53.44 51.24 1pr5 n ALA 129 Cb 0.58 -0.07 -0.06 0.00 0.00 0.00 0.00 19.45 19.89 1pr5 n ALA 129 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1pr5 s ASP 130 N -5.67 6.68 0.19 0.00 2.15 -0.82 -4.93 116.67 114.27 1pr5 s ASP 130 Ca 0.72 0.83 -0.14 0.00 0.43 0.00 0.00 52.55 54.39 1pr5 s ASP 130 Cb -0.02 -2.35 0.19 0.00 -0.30 0.00 0.00 42.92 40.44 1pr5 s ASP 130 CO 0.51 -0.31 1.66 0.15 -0.17 0.00 0.00 175.17 177.00 1pr5 h PHE 131 N 7.59 -0.19 -0.64 -5.34 3.57 -1.95 -0.70 116.94 119.27 1pr5 h PHE 131 Ca -0.30 0.04 0.09 0.00 3.53 0.00 0.00 57.97 61.34 1pr5 h PHE 131 Cb 1.14 0.17 -0.07 0.00 2.79 0.00 0.00 35.95 39.97 1pr5 h PHE 131 CO 0.73 -0.20 0.28 -0.44 -2.23 0.00 0.00 178.31 176.45 1pr5 h ASP 132 N 0.04 0.34 0.03 0.41 3.32 -1.99 0.13 116.42 118.70 1pr5 h ASP 132 Ca 0.26 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.34 1pr5 h ASP 132 Cb 0.41 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1pr5 h ASP 132 CO -0.51 0.20 -0.12 0.24 -1.72 0.00 0.00 179.24 177.33 1pr5 h MET 133 N 0.50 0.20 0.18 3.56 2.86 -1.63 0.20 114.93 120.80 1pr5 h MET 133 Ca 0.32 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.91 1pr5 h MET 133 Cb 0.36 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1pr5 h MET 133 CO -0.28 0.33 -0.08 0.28 1.06 0.00 0.00 176.91 178.21 1pr5 h VAL 134 N 0.19 0.94 -0.71 -2.22 2.07 0.44 -1.72 116.25 115.24 1pr5 h VAL 134 Ca 0.04 -0.83 0.03 0.00 0.82 0.00 0.00 66.70 66.76 1pr5 h VAL 134 Cb 0.33 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 1pr5 h VAL 134 CO 0.02 0.18 0.44 -0.09 0.02 0.00 0.00 177.57 178.14 1pr5 h ARG 135 N -0.66 0.83 -0.37 1.57 2.43 -0.54 0.25 114.38 117.89 1pr5 h ARG 135 Ca -0.02 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1pr5 h ARG 135 Cb 0.48 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.82 1pr5 h ARG 135 CO 0.04 0.55 0.21 -0.91 -1.51 0.00 0.00 179.97 178.35 1pr5 h ASN 136 N 0.85 0.34 -0.53 -3.80 2.35 -0.60 0.28 115.58 114.46 1pr5 h ASN 136 Ca 0.29 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 1pr5 h ASN 136 Cb 0.04 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 1pr5 h ASN 136 CO -0.12 0.24 0.34 0.00 -1.65 0.00 0.00 177.43 176.25 1pr5 h ALA 137 N 1.17 0.68 -0.50 -0.83 0.00 -0.73 0.24 119.26 119.29 1pr5 h ALA 137 Ca 0.15 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1pr5 h ALA 137 Cb 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1pr5 h ALA 137 CO -0.08 0.13 0.29 0.28 0.00 0.00 0.00 179.25 179.88 1pr5 h VAL 138 N 0.72 1.16 -0.45 0.00 2.07 -0.25 -0.74 116.25 118.76 1pr5 h VAL 138 Ca 0.19 -0.38 -0.11 0.00 0.82 0.00 0.00 66.70 67.23 1pr5 h VAL 138 Cb -0.06 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1pr5 h VAL 138 CO -0.04 0.16 -0.16 0.44 0.02 0.00 0.00 177.57 177.99 1pr5 h ASP 139 N 0.66 0.87 -0.65 0.57 3.45 -0.19 -2.36 116.42 118.78 1pr5 h ASP 139 Ca 0.18 -0.30 -0.01 0.00 0.43 0.00 0.00 57.03 57.33 1pr5 h ASP 139 Cb 0.01 -0.24 -0.03 0.00 -0.56 0.00 0.00 39.33 38.51 1pr5 h ASP 139 CO -0.03 1.03 0.36 0.00 -1.57 0.00 0.00 179.24 179.02 1pr5 h ALA 140 N 1.04 0.83 -0.43 3.45 0.00 -0.10 -2.18 119.26 121.86 1pr5 h ALA 140 Ca 0.11 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1pr5 h ALA 140 Cb 0.69 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1pr5 h ALA 140 CO 0.05 0.34 -0.05 0.00 0.00 0.00 0.00 179.25 179.59 1pr5 h ALA 141 N 1.17 0.58 -0.86 0.00 0.00 -1.00 -2.13 119.26 117.03 1pr5 h ALA 141 Ca 0.23 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1pr5 h ALA 141 Cb 0.04 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1pr5 h ALA 141 CO -0.04 0.41 0.56 -0.22 0.00 0.00 0.00 179.25 179.96 1pr5 h LYS 142 N 0.62 1.14 -0.76 0.00 3.64 -1.22 0.68 116.57 120.67 1pr5 h LYS 142 Ca 0.12 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1pr5 h LYS 142 Cb 0.56 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 1pr5 h LYS 142 CO 0.03 0.77 0.30 0.00 -2.27 0.00 0.00 179.45 178.28 1pr5 h ALA 143 N 1.31 0.99 0.00 5.00 0.00 -1.30 0.31 119.26 125.57 1pr5 h ALA 143 Ca 0.31 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1pr5 h ALA 143 Cb -0.11 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.38 1pr5 h ALA 143 CO -0.07 0.62 0.00 1.28 0.00 0.00 0.00 179.25 181.09 1pr5 n LEU 144 N -4.30 0.00 -1.64 0.00 4.77 -0.48 -4.83 117.00 110.52 1pr5 n LEU 144 Ca 0.07 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.89 1pr5 n LEU 144 Cb 0.19 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1pr5 n LEU 144 CO 0.41 0.00 -0.19 0.61 -1.33 0.00 0.00 177.39 176.89 1pr5 n GLY 145 N 0.36 0.20 3.52 -0.72 0.00 0.10 -5.00 105.19 103.65 1pr5 n GLY 145 Ca 0.01 -0.24 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 1pr5 n GLY 145 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pr5 s ILE 146 N -2.73 3.31 -0.69 -0.61 1.01 0.23 -4.97 121.20 116.74 1pr5 s ILE 146 Ca 0.00 -0.67 -0.10 0.00 0.00 0.00 0.00 60.65 59.88 1pr5 s ILE 146 Cb 0.00 -2.33 0.18 0.00 0.01 0.00 0.00 42.46 40.32 1pr5 s ILE 146 CO 0.00 0.57 0.59 -0.62 0.00 0.00 0.00 174.94 175.47 1pr5 s ASP 147 N -0.85 6.12 0.49 3.58 -1.08 -1.26 -2.94 116.67 120.73 1pr5 s ASP 147 Ca 0.12 -2.55 -0.18 0.00 -0.52 0.00 0.00 52.55 49.43 1pr5 s ASP 147 Cb -0.11 -2.08 -0.09 0.00 -1.46 0.00 0.00 42.92 39.19 1pr5 s ASP 147 CO 0.02 -0.56 0.98 0.00 0.52 0.00 0.00 175.17 176.13 1pr5 s ALA 148 N 0.40 3.04 -0.21 3.66 0.00 -1.26 -4.70 121.76 122.69 1pr5 s ALA 148 Ca 0.15 0.28 -0.09 0.00 0.00 0.00 0.00 51.96 52.29 1pr5 s ALA 148 Cb -0.17 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1pr5 s ALA 148 CO -0.05 -0.14 0.11 1.03 0.00 0.00 0.00 175.76 176.71 1pr5 s ARG 149 N -3.74 4.04 -0.19 0.00 0.52 0.12 -4.97 118.95 114.73 1pr5 s ARG 149 Ca 0.60 -0.30 -0.04 0.00 -0.52 0.00 0.00 55.73 55.47 1pr5 s ARG 149 Cb -0.10 -3.36 -0.02 0.00 0.52 0.00 0.00 34.95 31.99 1pr5 s ARG 149 CO 0.25 0.20 -0.02 0.08 0.02 0.00 0.00 175.30 175.82 1pr5 s VAL 150 N 0.61 3.75 0.00 3.52 1.01 -1.26 0.14 120.40 128.18 1pr5 s VAL 150 Ca 0.06 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1pr5 s VAL 150 Cb -0.12 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.57 1pr5 s VAL 150 CO 0.01 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.16 1pr5 n GLY 151 N 4.19 1.53 3.90 4.51 0.00 -0.95 -4.95 105.19 113.41 1pr5 n GLY 151 Ca -0.17 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 1pr5 n GLY 151 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pr5 s ASN 152 N 2.00 6.49 0.30 1.61 0.01 -1.26 -0.70 114.94 123.38 1pr5 s ASN 152 Ca 0.00 0.59 0.11 0.00 -0.71 0.00 0.00 52.86 52.85 1pr5 s ASN 152 Cb 0.00 -2.09 -0.05 0.00 0.41 0.00 0.00 41.25 39.51 1pr5 s ASN 152 CO 0.00 0.03 -0.16 -0.76 -1.51 0.00 0.00 177.10 174.70 1pr5 s LEU 153 N -2.74 2.63 -0.22 0.60 1.43 -0.23 0.03 118.68 120.17 1pr5 s LEU 153 Ca 0.41 -1.09 0.02 0.00 -1.03 0.00 0.00 54.13 52.44 1pr5 s LEU 153 Cb -0.12 -1.04 0.05 0.00 0.03 0.00 0.00 46.19 45.11 1pr5 s LEU 153 CO 0.25 -0.06 -0.12 0.12 0.23 0.00 0.00 176.35 176.78 1pr5 s PHE 154 N -2.57 2.82 -0.50 0.29 5.36 -0.92 0.16 117.98 122.63 1pr5 s PHE 154 Ca 0.30 -1.92 -0.23 0.00 -0.96 0.00 0.00 56.93 54.12 1pr5 s PHE 154 Cb -0.02 -1.80 0.04 0.00 -0.34 0.00 0.00 43.02 40.90 1pr5 s PHE 154 CO 0.15 -0.81 0.83 -1.12 -1.46 0.00 0.00 175.22 172.81 1pr5 s SER 155 N 1.26 6.36 0.11 6.13 0.01 0.33 -1.87 113.70 126.04 1pr5 s SER 155 Ca -0.04 -0.29 -0.11 0.00 1.31 0.00 0.00 55.95 56.82 1pr5 s SER 155 Cb -0.18 -2.40 -0.06 0.00 0.21 0.00 0.00 66.02 63.60 1pr5 s SER 155 CO -0.07 -1.04 0.45 0.00 0.41 0.00 0.00 173.24 172.99 1pr5 s ALA 156 N 3.48 3.67 -0.14 1.44 0.00 -0.31 -3.19 121.76 126.73 1pr5 s ALA 156 Ca 0.29 -0.31 0.18 0.00 0.00 0.00 0.00 51.96 52.12 1pr5 s ALA 156 Cb -0.13 -2.35 -0.13 0.00 0.00 0.00 0.00 23.12 20.51 1pr5 s ALA 156 CO 0.20 0.53 0.80 -0.25 0.00 0.00 0.00 175.76 177.04 1pr5 n ASP 157 N 0.76 0.77 -4.12 0.00 10.43 -1.26 -4.52 116.55 118.61 1pr5 n ASP 157 Ca -0.06 0.33 -0.33 0.00 2.57 0.00 0.00 54.79 57.30 1pr5 n ASP 157 Cb 0.52 0.34 -0.14 0.00 1.84 0.00 0.00 41.12 43.68 1pr5 n ASP 157 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1pr5 s LEU 158 N -5.63 3.56 0.27 0.64 1.43 -1.26 -4.96 118.68 112.73 1pr5 s LEU 158 Ca -0.03 -1.30 -0.04 0.00 -1.03 0.00 0.00 54.13 51.73 1pr5 s LEU 158 Cb 0.09 -1.62 0.34 0.00 0.03 0.00 0.00 46.19 45.04 1pr5 s LEU 158 CO 0.81 -0.21 1.95 0.15 0.23 0.00 0.00 176.35 179.28 1pr5 h PHE 159 N 7.87 1.17 -3.64 0.29 3.04 -1.98 -3.22 116.94 120.47 1pr5 h PHE 159 Ca -0.21 0.03 -0.73 0.00 3.98 0.00 0.00 57.97 61.03 1pr5 h PHE 159 Cb 1.05 -0.40 -0.32 0.00 2.56 0.00 0.00 35.95 38.85 1pr5 h PHE 159 CO 0.62 0.74 -0.15 0.71 -2.02 0.00 0.00 178.31 178.21 1pr5 s TYR 160 N -6.04 3.59 0.17 0.41 2.02 -1.26 -5.06 117.35 111.19 1pr5 s TYR 160 Ca -0.12 -2.48 -0.30 0.00 -0.37 0.00 0.00 57.07 53.79 1pr5 s TYR 160 Cb 0.18 -3.45 -0.08 0.00 -0.40 0.00 0.00 41.96 38.21 1pr5 s TYR 160 CO 0.81 -0.89 1.30 0.45 -1.57 0.00 0.00 175.55 175.65 1pr5 s SER 161 N 1.16 6.92 0.51 2.29 0.15 -1.22 -4.92 113.70 118.59 1pr5 s SER 161 Ca 0.19 2.34 0.19 0.00 0.70 0.00 0.00 55.95 59.36 1pr5 s SER 161 Cb -0.15 -2.60 1.30 0.00 -1.71 0.00 0.00 66.02 62.86 1pr5 s SER 161 CO -0.06 -0.53 2.12 -0.65 1.20 0.00 0.00 173.24 175.32 1pr5 h PRO 162 N 5.72 0.00 -4.66 5.44 0.11 -1.97 -3.39 132.00 133.25 1pr5 h PRO 162 Ca -0.44 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.11 1pr5 h PRO 162 Cb 1.21 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 31.98 1pr5 h PRO 162 CO 0.79 0.06 -0.83 0.16 -0.21 0.00 0.00 178.00 177.97 1pr5 s ASP 163 N -6.83 2.16 0.00 -2.05 -4.77 -1.26 -5.00 116.67 98.92 1pr5 s ASP 163 Ca -0.05 -0.37 0.24 0.00 -3.30 0.00 0.00 52.55 49.07 1pr5 s ASP 163 Cb 0.16 -0.97 0.46 0.00 -1.09 0.00 0.00 42.92 41.48 1pr5 s ASP 163 CO 0.65 0.03 1.41 0.61 0.70 0.00 0.00 175.17 178.57 1pr5 n GLY 164 N 4.01 1.13 0.25 2.12 0.00 -1.26 -4.15 105.19 107.28 1pr5 n GLY 164 Ca -0.20 -0.65 0.13 0.00 0.00 0.00 0.00 46.02 45.30 1pr5 n GLY 164 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1pr5 h GLU 165 N 4.00 0.00 0.00 1.61 4.22 -1.96 -2.47 114.58 119.98 1pr5 h GLU 165 Ca 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.41 1pr5 h GLU 165 Cb 0.87 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1pr5 h GLU 165 CO 0.00 0.13 -0.14 1.98 -2.18 0.00 0.00 179.01 178.80 1pr5 h MET 166 N 0.00 0.00 0.00 1.92 4.05 -2.01 -1.94 114.93 116.95 1pr5 h MET 166 Ca -0.00 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1pr5 h MET 166 Cb 0.50 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.30 1pr5 h MET 166 CO 0.02 0.14 -0.08 0.74 0.23 0.00 0.00 176.91 177.96 1pr5 h PHE 167 N 0.00 0.00 0.00 1.39 -1.00 -1.75 -0.66 116.94 114.93 1pr5 h PHE 167 Ca -0.00 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.69 1pr5 h PHE 167 Cb 0.36 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.93 1pr5 h PHE 167 CO 0.00 0.08 -0.33 -0.44 -1.61 0.00 0.00 178.31 176.01 1pr5 h ASP 168 N 0.00 0.29 -0.64 2.17 3.45 -1.53 -2.83 116.42 117.34 1pr5 h ASP 168 Ca -0.00 -0.78 0.11 0.00 0.43 0.00 0.00 57.03 56.79 1pr5 h ASP 168 Cb 0.30 -0.09 -0.08 0.00 -0.56 0.00 0.00 39.33 38.90 1pr5 h ASP 168 CO 0.01 1.03 0.20 0.58 -1.57 0.00 0.00 179.24 179.49 1pr5 h VAL 169 N -0.42 0.69 -0.97 -1.35 2.07 -1.36 0.44 116.25 115.35 1pr5 h VAL 169 Ca -0.04 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.40 1pr5 h VAL 169 Cb 1.08 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 1pr5 h VAL 169 CO 0.06 0.06 0.63 0.24 0.02 0.00 0.00 177.57 178.59 1pr5 h MET 170 N 0.35 1.18 -0.35 1.57 2.86 -1.17 -2.08 114.93 117.28 1pr5 h MET 170 Ca 0.33 -0.07 -0.08 0.00 -2.06 0.00 0.00 59.70 57.82 1pr5 h MET 170 Cb 0.47 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 1pr5 h MET 170 CO -0.37 0.78 -0.09 0.93 1.06 0.00 0.00 176.91 179.22 1pr5 h GLU 171 N 1.21 0.68 -0.87 1.72 5.08 -0.97 -0.55 114.58 120.88 1pr5 h GLU 171 Ca 0.39 -0.26 0.16 0.00 -1.00 0.00 0.00 59.36 58.64 1pr5 h GLU 171 Cb 0.01 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.16 1pr5 h GLU 171 CO -0.13 0.84 0.56 -0.22 -1.00 0.00 0.00 179.01 179.07 1pr5 h LYS 172 N 0.47 0.56 -0.46 2.33 3.11 -0.31 -0.23 116.57 122.04 1pr5 h LYS 172 Ca 0.09 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.89 1pr5 h LYS 172 Cb 0.59 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 31.70 1pr5 h LYS 172 CO 0.04 0.37 0.00 0.66 -2.81 0.00 0.00 179.45 177.71 1pr5 n TYR 173 N -4.54 1.53 -3.85 1.91 4.01 -0.89 -4.98 117.16 110.35 1pr5 n TYR 173 Ca 0.17 -0.76 -0.29 0.00 -0.16 0.00 0.00 57.90 56.86 1pr5 n TYR 173 Cb 0.53 -0.39 0.04 0.00 -0.31 0.00 0.00 39.34 39.21 1pr5 n TYR 173 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pr5 n GLY 174 N 0.28 -0.51 3.75 2.72 0.00 -0.10 -4.96 105.19 106.37 1pr5 n GLY 174 Ca 0.25 0.21 -0.41 0.00 0.00 0.00 0.00 46.02 46.07 1pr5 n GLY 174 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pr5 s ILE 175 N -3.30 3.19 0.10 -0.61 -5.25 -0.26 -4.58 121.20 110.49 1pr5 s ILE 175 Ca 0.66 1.12 -0.13 0.00 -0.99 0.00 0.00 60.65 61.30 1pr5 s ILE 175 Cb -0.32 -3.71 -0.18 0.00 2.95 0.00 0.00 42.46 41.20 1pr5 s ILE 175 CO 0.81 0.23 1.27 -0.07 -1.79 0.00 0.00 174.94 175.39 1pr5 h LEU 176 N 4.22 0.94 -7.14 0.37 3.38 -0.75 -3.42 115.31 112.91 1pr5 h LEU 176 Ca -0.47 -0.66 -0.07 0.00 0.09 0.00 0.00 57.88 56.78 1pr5 h LEU 176 Cb 1.22 -0.28 -0.18 0.00 0.09 0.00 0.00 40.66 41.50 1pr5 h LEU 176 CO 0.70 1.46 0.07 -0.83 0.09 0.00 0.00 178.44 179.92 1pr5 s GLY 177 N -4.17 -0.46 -0.27 0.83 0.00 -1.25 -4.56 107.32 97.44 1pr5 s GLY 177 Ca -0.10 0.93 -0.09 0.00 0.00 0.00 0.00 44.72 45.46 1pr5 s GLY 177 CO 0.91 0.62 0.12 0.14 0.00 0.00 0.00 173.10 174.89 1pr5 s VAL 178 N -1.60 4.72 0.00 1.40 1.01 0.27 -2.16 120.40 124.04 1pr5 s VAL 178 Ca -0.10 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.81 1pr5 s VAL 178 Cb -0.01 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1pr5 s VAL 178 CO 0.05 0.28 0.00 -1.84 0.00 0.00 0.00 175.10 173.59 1pr5 n GLU 179 N 4.98 1.22 -0.42 2.72 -0.00 -0.78 -1.03 120.64 127.33 1pr5 n GLU 179 Ca -0.15 0.00 0.01 0.00 -0.00 0.00 0.00 57.16 57.02 1pr5 n GLU 179 Cb 0.51 0.00 0.02 0.00 -0.00 0.00 0.00 31.44 31.97 1pr5 n GLU 179 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1pr5 n MET 180 N 0.00 0.18 0.00 3.44 2.81 -1.26 -1.16 117.12 121.13 1pr5 n MET 180 Ca 0.00 -1.18 0.00 0.00 -1.81 0.00 0.00 57.70 54.71 1pr5 n MET 180 Cb 0.00 -0.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.88 1pr5 n MET 180 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1pr5 n GLU 181 N -0.18 2.63 -0.34 0.03 0.00 -1.26 -2.77 120.64 118.74 1pr5 n GLU 181 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.30 1pr5 n GLU 181 Cb 0.68 -0.26 0.25 0.00 0.00 0.00 0.00 31.44 32.11 1pr5 n GLU 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1pr5 h ALA 182 N 0.00 1.03 0.00 -1.84 0.00 -1.95 0.46 119.26 116.95 1pr5 h ALA 182 Ca 0.00 0.35 -0.05 0.00 0.00 0.00 0.00 54.91 55.21 1pr5 h ALA 182 Cb 0.00 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1pr5 h ALA 182 CO 0.00 -0.52 -0.22 0.00 0.00 0.00 0.00 179.25 178.51 1pr5 h ALA 183 N 1.98 1.17 0.02 0.00 0.00 -1.86 -0.86 119.26 119.71 1pr5 h ALA 183 Ca 0.56 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 55.14 1pr5 h ALA 183 Cb 1.09 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.86 1pr5 h ALA 183 CO -0.94 0.28 -0.50 0.78 0.00 0.00 0.00 179.25 178.87 1pr5 h GLY 184 N 1.44 0.34 0.93 0.00 0.00 -0.50 -2.24 103.07 103.05 1pr5 h GLY 184 Ca -0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.68 1pr5 h GLY 184 CO 0.03 0.56 0.14 -2.22 0.00 0.00 0.00 176.54 175.05 1pr5 h ILE 185 N -0.30 1.16 -0.87 2.60 2.04 -1.03 -1.89 117.51 119.22 1pr5 h ILE 185 Ca -0.07 -0.45 0.04 0.00 1.00 0.00 0.00 64.86 65.38 1pr5 h ILE 185 Cb 1.25 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 38.19 1pr5 h ILE 185 CO 0.10 0.16 0.56 1.88 0.00 0.00 0.00 178.15 180.85 1pr5 h TYR 186 N 0.34 1.05 -0.46 1.37 0.99 -1.24 -0.36 116.97 118.66 1pr5 h TYR 186 Ca 0.10 0.03 0.04 0.00 2.00 0.00 0.00 58.73 60.90 1pr5 h TYR 186 Cb 0.13 -0.35 -0.04 0.00 1.00 0.00 0.00 36.73 37.47 1pr5 h TYR 186 CO -0.02 0.60 0.23 0.78 -0.00 0.00 0.00 178.16 179.75 1pr5 h GLY 187 N 1.09 0.64 1.18 3.88 0.00 -0.92 -0.78 103.07 108.16 1pr5 h GLY 187 Ca 0.35 -0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.44 1pr5 h GLY 187 CO -0.12 0.11 0.04 -2.08 0.00 0.00 0.00 176.54 174.48 1pr5 h VAL 188 N 0.46 1.26 -0.43 4.60 2.07 -0.76 -1.26 116.25 122.19 1pr5 h VAL 188 Ca 0.20 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.65 1pr5 h VAL 188 Cb 0.11 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1pr5 h VAL 188 CO -0.14 0.39 0.25 0.00 0.02 0.00 0.00 177.57 178.09 1pr5 h ALA 189 N 1.11 0.54 -0.63 1.67 0.00 -0.47 -1.01 119.26 120.46 1pr5 h ALA 189 Ca 0.18 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1pr5 h ALA 189 Cb 0.48 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1pr5 h ALA 189 CO 0.02 0.04 0.04 0.00 0.00 0.00 0.00 179.25 179.35 1pr5 h ALA 190 N 1.11 0.85 -0.48 0.00 0.00 -0.96 0.11 119.26 119.89 1pr5 h ALA 190 Ca 0.15 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1pr5 h ALA 190 Cb 0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1pr5 h ALA 190 CO -0.03 0.66 -0.07 1.49 0.00 0.00 0.00 179.25 181.31 1pr5 h GLU 191 N 1.00 0.89 -0.47 0.00 4.81 -0.94 -3.22 114.58 116.64 1pr5 h GLU 191 Ca 0.19 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1pr5 h GLU 191 Cb 0.51 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1pr5 h GLU 191 CO 0.02 0.96 0.00 1.19 -0.73 0.00 0.00 179.01 180.45 1pr5 n PHE 192 N -4.28 1.09 -2.94 0.92 3.01 -0.41 -5.02 117.46 109.83 1pr5 n PHE 192 Ca 0.00 -0.65 -0.11 0.00 1.01 0.00 0.00 57.45 57.71 1pr5 n PHE 192 Cb 0.36 -0.21 0.01 0.00 -0.01 0.00 0.00 39.48 39.64 1pr5 n PHE 192 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pr5 n GLY 193 N 0.56 -1.68 3.66 1.37 0.00 0.24 -4.97 105.19 104.37 1pr5 n GLY 193 Ca 0.21 1.01 -0.09 0.00 0.00 0.00 0.00 46.02 47.15 1pr5 n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pr5 s ALA 194 N -2.14 -1.31 -0.10 4.61 0.00 -0.28 -5.02 121.76 117.51 1pr5 s ALA 194 Ca 0.20 -0.02 -0.04 0.00 0.00 0.00 0.00 51.96 52.10 1pr5 s ALA 194 Cb -0.05 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 1pr5 s ALA 194 CO 0.75 -0.91 0.06 0.15 0.00 0.00 0.00 175.76 175.81 1pr5 s LYS 195 N -3.85 3.22 0.08 0.00 1.02 -0.52 -4.43 119.74 115.25 1pr5 s LYS 195 Ca 0.07 -0.28 0.02 0.00 0.02 0.00 0.00 55.97 55.80 1pr5 s LYS 195 Cb -0.04 -2.98 -0.04 0.00 -0.52 0.00 0.00 37.83 34.26 1pr5 s LYS 195 CO -0.01 0.72 -0.06 0.00 -0.92 0.00 0.00 175.35 175.08 1pr5 s ALA 196 N -0.91 0.80 -0.06 5.17 0.00 -1.26 -1.03 121.76 124.48 1pr5 s ALA 196 Ca 0.14 -1.16 -0.19 0.00 0.00 0.00 0.00 51.96 50.75 1pr5 s ALA 196 Cb -0.12 0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.18 1pr5 s ALA 196 CO 0.03 -0.19 0.43 -1.17 0.00 0.00 0.00 175.76 174.86 1pr5 s LEU 197 N -2.59 0.37 -0.10 0.00 2.96 0.54 -1.94 118.68 117.94 1pr5 s LEU 197 Ca 0.05 0.41 0.02 0.00 -0.22 0.00 0.00 54.13 54.39 1pr5 s LEU 197 Cb 0.01 1.63 0.01 0.00 0.50 0.00 0.00 46.19 48.34 1pr5 s LEU 197 CO -0.04 -0.42 -0.14 -0.89 -1.32 0.00 0.00 176.35 173.54 1pr5 s THR 198 N -0.95 1.36 -0.08 3.68 2.01 -1.26 0.69 115.64 121.08 1pr5 s THR 198 Ca -0.10 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 61.37 1pr5 s THR 198 Cb -0.04 -1.25 -0.00 0.00 0.01 0.00 0.00 72.50 71.22 1pr5 s THR 198 CO 0.05 0.41 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.54 1pr5 s ILE 199 N 0.96 1.87 0.05 1.82 1.01 0.58 -0.79 121.20 126.71 1pr5 s ILE 199 Ca -0.08 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 59.68 1pr5 s ILE 199 Cb -0.15 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.68 1pr5 s ILE 199 CO -0.01 0.52 -0.10 0.00 0.00 0.00 0.00 174.94 175.36 1pr5 s THR 201 N -1.34 3.37 -0.26 0.00 -4.23 -0.45 -0.72 115.64 112.00 1pr5 s THR 201 Ca -0.08 -0.51 -0.30 0.00 -1.18 0.00 0.00 61.69 59.62 1pr5 s THR 201 Cb -0.10 -2.51 -0.07 0.00 1.34 0.00 0.00 72.50 71.16 1pr5 s THR 201 CO 0.01 0.45 2.22 0.52 -0.54 0.00 0.00 174.62 177.27 1pr5 n VAL 202 N 4.44 0.29 1.06 2.29 0.31 -0.01 -3.03 118.33 123.68 1pr5 n VAL 202 Ca -0.18 -0.40 0.12 0.00 -0.01 0.00 0.00 64.34 63.87 1pr5 n VAL 202 Cb 0.51 -2.27 0.11 0.00 -0.91 0.00 0.00 33.84 31.29 1pr5 n VAL 202 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1pr5 n SER 203 N 11.15 2.31 0.00 4.52 3.41 -0.37 0.51 113.62 135.14 1pr5 n SER 203 Ca 0.34 -1.67 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 1pr5 n SER 203 Cb 0.38 0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 1pr5 n SER 203 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1pr5 n ASP 204 N 0.51 0.00 -3.88 4.04 5.75 -1.24 -4.97 116.55 116.76 1pr5 n ASP 204 Ca 0.12 0.00 -0.40 0.00 -0.01 0.00 0.00 54.79 54.50 1pr5 n ASP 204 Cb 0.50 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.59 1pr5 n ASP 204 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 1pr5 n HIS 205 N -0.03 2.48 -3.71 2.11 -0.00 -1.26 -0.22 115.22 114.59 1pr5 n HIS 205 Ca 0.00 -2.80 -0.24 0.00 0.46 0.00 0.00 57.72 55.14 1pr5 n HIS 205 Cb 0.00 -1.14 0.05 0.00 -0.12 0.00 0.00 29.99 28.78 1pr5 n HIS 205 CO 0.00 0.00 0.00 1.51 0.46 0.00 0.00 176.34 178.31 1pr5 n ILE 206 N 1.11 -3.63 0.00 3.57 0.13 -1.00 -4.75 119.36 114.79 1pr5 n ILE 206 Ca 0.28 -0.25 0.00 0.00 -1.10 0.00 0.00 62.75 61.69 1pr5 n ILE 206 Cb 0.34 -3.70 0.00 0.00 -0.84 0.00 0.00 39.64 35.44 1pr5 n ILE 206 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 1pr5 n THR 213 N -4.53 0.00 -0.15 9.51 -2.24 -1.26 -4.98 114.28 110.63 1pr5 n THR 213 Ca -0.13 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.56 1pr5 n THR 213 Cb 0.61 0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.87 1pr5 n THR 213 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pr5 h ALA 214 N 0.00 0.79 0.00 6.98 0.00 -1.96 -0.26 119.26 124.82 1pr5 h ALA 214 Ca 0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1pr5 h ALA 214 Cb 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1pr5 h ALA 214 CO 0.00 0.66 -0.03 0.00 0.00 0.00 0.00 179.25 179.88 1pr5 h ALA 215 N 0.97 1.19 0.00 0.00 0.00 -2.01 -3.03 119.26 116.38 1pr5 h ALA 215 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1pr5 h ALA 215 Cb 0.71 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1pr5 h ALA 215 CO 0.05 0.04 -0.29 0.39 0.00 0.00 0.00 179.25 179.44 1pr5 n GLU 216 N -3.40 0.23 0.00 0.00 1.02 -0.99 -3.53 120.64 113.98 1pr5 n GLU 216 Ca -0.02 0.35 0.00 0.00 -0.02 0.00 0.00 57.16 57.47 1pr5 n GLU 216 Cb 0.14 -1.19 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1pr5 n GLU 216 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1pr5 n ARG 217 N -3.45 0.00 -0.71 3.49 5.12 -0.14 -0.38 116.66 120.58 1pr5 n ARG 217 Ca -0.04 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.59 1pr5 n ARG 217 Cb 0.15 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.37 1pr5 n ARG 217 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 1pr5 n GLN 218 N 0.00 0.00 0.00 5.56 0.00 -1.15 -2.62 117.38 119.18 1pr5 n GLN 218 Ca 0.00 -0.70 0.00 0.00 -0.00 0.00 0.00 57.00 56.30 1pr5 n GLN 218 Cb 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 30.24 28.17 1pr5 n GLN 218 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1pr5 n THR 219 N 5.96 0.00 -0.23 1.69 -2.24 -1.25 -4.70 114.28 113.51 1pr5 n THR 219 Ca 0.31 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 62.03 1pr5 n THR 219 Cb 0.37 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.55 1pr5 n THR 219 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1pr5 n THR 220 N 0.00 -0.37 -0.10 4.28 -1.04 -1.13 0.13 114.28 116.05 1pr5 n THR 220 Ca 0.00 1.31 -0.09 0.00 -2.04 0.00 0.00 64.05 63.24 1pr5 n THR 220 Cb 0.00 -1.63 -0.01 0.00 -1.82 0.00 0.00 70.33 66.87 1pr5 n THR 220 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 1pr5 h PHE 221 N 0.00 0.43 -0.72 -1.42 3.04 -0.71 0.37 116.94 117.93 1pr5 h PHE 221 Ca 0.09 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.02 1pr5 h PHE 221 Cb 0.22 -0.14 -0.03 0.00 2.56 0.00 0.00 35.95 38.56 1pr5 h PHE 221 CO -0.56 0.27 0.33 -0.91 -2.02 0.00 0.00 178.31 175.43 1pr5 h ASN 222 N 0.46 0.94 -0.32 0.41 -0.26 0.78 -2.25 115.58 115.33 1pr5 h ASN 222 Ca 0.12 -0.11 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1pr5 h ASN 222 Cb -0.05 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 36.96 1pr5 h ASN 222 CO -0.03 0.80 0.21 0.44 -1.06 0.00 0.00 177.43 177.79 1pr5 h ASP 223 N 1.02 0.37 -0.56 5.81 3.45 0.18 -1.14 116.42 125.55 1pr5 h ASP 223 Ca 0.25 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.68 1pr5 h ASP 223 Cb 0.12 -0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 38.77 1pr5 h ASP 223 CO -0.03 0.28 0.31 -0.03 -1.57 0.00 0.00 179.24 178.20 1pr5 h MET 224 N 0.43 0.80 -0.11 3.56 4.05 -0.61 0.19 114.93 123.23 1pr5 h MET 224 Ca 0.12 -0.08 -0.16 0.00 -0.28 0.00 0.00 59.70 59.29 1pr5 h MET 224 Cb -0.04 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 30.59 1pr5 h MET 224 CO -0.02 0.59 -0.63 0.82 0.23 0.00 0.00 176.91 177.90 1pr5 h ILE 225 N 0.81 1.36 -0.25 1.77 1.08 -1.01 -1.26 117.51 120.01 1pr5 h ILE 225 Ca 0.21 -1.96 -0.08 0.00 -0.39 0.00 0.00 64.86 62.63 1pr5 h ILE 225 Cb 0.03 1.96 -0.01 0.00 -3.07 0.00 0.00 36.82 35.73 1pr5 h ILE 225 CO -0.03 0.59 -0.16 0.50 -0.69 0.00 0.00 178.15 178.36 1pr5 h LYS 226 N 0.30 0.54 -0.43 2.37 3.64 -0.60 -1.22 116.57 121.17 1pr5 h LYS 226 Ca -0.01 -0.25 0.04 0.00 -1.27 0.00 0.00 60.65 59.15 1pr5 h LYS 226 Cb 1.17 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.94 1pr5 h LYS 226 CO 0.11 0.82 0.20 0.82 -2.27 0.00 0.00 179.45 179.13 1pr5 h ILE 227 N 0.26 0.95 0.60 2.00 2.04 -0.54 -1.20 117.51 121.61 1pr5 h ILE 227 Ca 0.05 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 1pr5 h ILE 227 Cb 0.68 0.51 0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1pr5 h ILE 227 CO 0.04 0.07 -0.29 0.00 0.00 0.00 0.00 178.15 177.98 1pr5 h ALA 228 N 1.24 -0.81 -0.90 1.87 0.00 -1.10 -1.85 119.26 117.72 1pr5 h ALA 228 Ca 0.19 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1pr5 h ALA 228 Cb 0.11 0.31 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1pr5 h ALA 228 CO -0.14 -0.93 0.57 -0.07 0.00 0.00 0.00 179.25 178.68 1pr5 h LEU 229 N -0.86 0.92 -1.03 0.00 3.38 -1.13 -2.06 115.31 114.53 1pr5 h LEU 229 Ca -0.08 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1pr5 h LEU 229 Cb 0.64 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1pr5 h LEU 229 CO 0.14 0.60 -0.39 -0.33 0.09 0.00 0.00 178.44 178.54 1pr5 h GLU 230 N 1.06 0.00 -0.10 1.13 4.39 -1.19 -2.87 114.58 117.00 1pr5 h GLU 230 Ca 0.38 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.96 1pr5 h GLU 230 Cb 0.11 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1pr5 h GLU 230 CO -0.15 0.39 -0.46 0.66 -1.16 0.00 0.00 179.01 178.29 1pr5 h SER 231 N 0.00 0.26 0.08 1.42 4.64 -0.62 -2.31 113.55 117.01 1pr5 h SER 231 Ca -0.00 -0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1pr5 h SER 231 Cb 0.85 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1pr5 h SER 231 CO 0.05 0.69 -0.04 0.58 -0.87 0.00 0.00 176.83 177.24 1pr5 h VAL 232 N 0.20 0.98 -0.56 0.95 2.07 -1.25 0.15 116.25 118.79 1pr5 h VAL 232 Ca 0.01 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.38 1pr5 h VAL 232 Cb 0.89 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 1pr5 h VAL 232 CO 0.07 0.05 0.30 -0.07 0.02 0.00 0.00 177.57 177.94 1pr5 h LEU 233 N -0.19 0.44 -0.76 2.57 3.38 -1.48 0.77 115.31 120.04 1pr5 h LEU 233 Ca -0.01 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1pr5 h LEU 233 Cb 0.16 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1pr5 h LEU 233 CO 0.02 0.30 0.39 -0.07 0.09 0.00 0.00 178.44 179.17 1pr5 h LEU 234 N 0.57 0.96 -0.97 1.67 4.07 -1.24 -1.66 115.31 118.72 1pr5 h LEU 234 Ca 0.24 -0.11 0.07 0.00 0.08 0.00 0.00 57.88 58.17 1pr5 h LEU 234 Cb 0.13 -0.25 -0.07 0.00 1.08 0.00 0.00 40.66 41.56 1pr5 h LEU 234 CO -0.16 0.80 0.62 1.23 -1.08 0.00 0.00 178.44 179.85 1pr5 h GLY 235 N 1.05 1.50 1.80 0.83 0.00 0.96 0.12 103.07 109.33 1pr5 h GLY 235 Ca 0.26 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1pr5 h GLY 235 CO -0.04 0.29 0.00 1.22 0.00 0.00 0.00 176.54 178.01 1pr5 n ASP 236 N -4.55 0.00 -0.95 0.19 10.43 0.10 -5.09 116.55 116.68 1pr5 n ASP 236 Ca 0.15 0.34 0.12 0.00 2.57 0.00 0.00 54.79 57.97 1pr5 n ASP 236 Cb 0.21 -0.40 0.10 0.00 1.84 0.00 0.00 41.12 42.87 1pr5 n ASP 236 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42