#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1id1 s LYS 5 N 0.00 1.02 -1.15 5.56 -0.14 -1.26 -4.75 119.74 119.02 1id1 s LYS 5 Ca 0.00 -1.47 -0.02 0.00 -1.36 0.00 0.00 55.97 53.12 1id1 s LYS 5 Cb 0.00 -0.19 0.02 0.00 -1.68 0.00 0.00 37.83 35.98 1id1 s LYS 5 CO 0.00 -0.12 0.05 -0.40 -0.76 0.00 0.00 175.35 174.13 1id1 n ASP 6 N -0.17 0.44 -3.65 2.83 5.68 0.13 -4.89 116.55 116.91 1id1 n ASP 6 Ca -0.08 -0.92 -0.22 0.00 -0.50 0.00 0.00 54.79 53.07 1id1 n ASP 6 Cb 0.63 -1.14 -0.06 0.00 -1.14 0.00 0.00 41.12 39.41 1id1 n ASP 6 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1id1 n HIS 7 N -3.52 0.39 -4.76 2.11 -0.00 -1.25 -4.73 115.22 103.46 1id1 n HIS 7 Ca -0.20 -2.07 -0.31 0.00 -0.00 0.00 0.00 57.72 55.14 1id1 n HIS 7 Cb 0.48 -0.09 -0.13 0.00 -0.00 0.00 0.00 29.99 30.25 1id1 n HIS 7 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1id1 s PHE 8 N -2.67 2.60 -0.20 -1.40 0.40 -0.57 0.17 117.98 116.31 1id1 s PHE 8 Ca 0.11 -0.23 -0.01 0.00 -0.60 0.00 0.00 56.93 56.20 1id1 s PHE 8 Cb 0.01 -1.52 0.01 0.00 0.51 0.00 0.00 43.02 42.02 1id1 s PHE 8 CO 0.08 0.22 -0.13 0.42 0.70 0.00 0.00 175.22 176.50 1id1 s ILE 9 N -0.85 2.58 -0.22 0.64 1.01 -1.10 0.14 121.20 123.40 1id1 s ILE 9 Ca 0.14 -0.79 -0.06 0.00 0.00 0.00 0.00 60.65 59.94 1id1 s ILE 9 Cb -0.11 -2.14 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 1id1 s ILE 9 CO 0.04 0.47 0.02 -0.69 0.00 0.00 0.00 174.94 174.78 1id1 s VAL 10 N 1.36 4.01 -0.35 2.92 1.01 -0.23 -0.01 120.40 129.11 1id1 s VAL 10 Ca 0.05 -0.28 -0.11 0.00 0.00 0.00 0.00 61.98 61.63 1id1 s VAL 10 Cb -0.14 -2.84 0.01 0.00 0.00 0.00 0.00 36.38 33.42 1id1 s VAL 10 CO -0.09 0.40 0.21 0.00 0.00 0.00 0.00 175.10 175.62 1id1 n GLY 12 N 5.03 3.36 0.88 0.00 0.00 -0.80 -1.28 105.19 112.38 1id1 n GLY 12 Ca -0.12 -1.79 0.01 0.00 0.00 0.00 0.00 46.02 44.11 1id1 n GLY 12 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1id1 n HIS 13 N -1.67 0.00 -1.08 1.61 1.44 -1.26 -4.75 115.22 109.50 1id1 n HIS 13 Ca 0.00 -0.20 -0.29 0.00 -2.01 0.00 0.00 57.72 55.22 1id1 n HIS 13 Cb 0.00 -0.05 0.22 0.00 0.12 0.00 0.00 29.99 30.28 1id1 n HIS 13 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 1id1 s SER 14 N -1.31 1.47 0.19 4.39 1.04 -1.26 -4.71 113.70 113.51 1id1 s SER 14 Ca 0.12 0.86 -0.11 0.00 0.48 0.00 0.00 55.95 57.30 1id1 s SER 14 Cb 0.14 -1.28 0.12 0.00 0.10 0.00 0.00 66.02 65.11 1id1 s SER 14 CO -0.06 -3.81 1.83 0.40 0.98 0.00 0.00 173.24 172.58 1id1 h ILE 15 N -2.36 1.20 -0.64 -1.02 2.04 -1.99 -1.07 117.51 113.66 1id1 h ILE 15 Ca -0.49 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 64.88 1id1 h ILE 15 Cb 1.31 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1id1 h ILE 15 CO 0.43 0.21 0.30 0.25 0.00 0.00 0.00 178.15 179.35 1id1 h LEU 16 N 0.93 0.85 0.07 1.44 5.85 -1.92 -2.30 115.31 120.23 1id1 h LEU 16 Ca 0.24 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1id1 h LEU 16 Cb -0.01 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.80 1id1 h LEU 16 CO -0.04 0.75 -0.03 0.00 -0.34 0.00 0.00 178.44 178.77 1id1 h ALA 17 N 1.13 -0.10 -0.66 1.25 0.00 -1.58 -1.35 119.26 117.96 1id1 h ALA 17 Ca 0.22 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1id1 h ALA 17 Cb 0.13 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1id1 h ALA 17 CO -0.03 -0.55 0.40 0.82 0.00 0.00 0.00 179.25 179.90 1id1 h ILE 18 N -0.12 1.19 0.00 0.00 2.04 -1.15 -1.11 117.51 118.37 1id1 h ILE 18 Ca -0.01 -0.41 -0.10 0.00 1.00 0.00 0.00 64.86 65.34 1id1 h ILE 18 Cb 0.09 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1id1 h ILE 18 CO 0.02 0.19 -0.48 0.78 0.00 0.00 0.00 178.15 178.66 1id1 h ASN 19 N 0.90 0.00 0.09 1.72 2.35 -1.35 -1.10 115.58 118.18 1id1 h ASN 19 Ca 0.24 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.82 1id1 h ASN 19 Cb -0.04 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1id1 h ASN 19 CO -0.05 0.48 -0.59 0.74 -1.65 0.00 0.00 177.43 176.37 1id1 h THR 20 N 0.00 1.33 0.01 2.81 2.02 -0.82 -0.01 112.91 118.25 1id1 h THR 20 Ca -0.00 -1.87 -0.00 0.00 0.77 0.00 0.00 66.41 65.31 1id1 h THR 20 Cb 1.02 1.85 0.00 0.00 -1.74 0.00 0.00 68.15 69.28 1id1 h THR 20 CO 0.06 0.58 -0.00 0.40 0.37 0.00 0.00 175.52 176.92 1id1 h ILE 21 N 0.38 1.25 -0.37 3.11 2.04 -0.99 -0.28 117.51 122.65 1id1 h ILE 21 Ca -0.00 -0.76 0.05 0.00 1.00 0.00 0.00 64.86 65.15 1id1 h ILE 21 Cb 1.13 1.77 -0.05 0.00 -0.74 0.00 0.00 36.82 38.93 1id1 h ILE 21 CO 0.11 0.20 0.09 -0.07 0.00 0.00 0.00 178.15 178.47 1id1 h LEU 22 N -0.34 0.04 -0.99 1.44 3.38 -1.15 0.65 115.31 118.34 1id1 h LEU 22 Ca -0.00 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1id1 h LEU 22 Cb 0.33 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 1id1 h LEU 22 CO 0.00 0.06 0.41 1.56 0.09 0.00 0.00 178.44 180.56 1id1 h GLN 23 N 0.22 1.13 -0.53 1.13 1.08 -0.91 -0.18 115.11 117.04 1id1 h GLN 23 Ca 0.18 -0.14 -0.11 0.00 -1.45 0.00 0.00 58.65 57.12 1id1 h GLN 23 Cb 0.19 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 1id1 h GLN 23 CO -0.22 0.84 -0.09 -0.07 -0.95 0.00 0.00 178.83 178.35 1id1 h LEU 24 N 1.13 1.00 -0.12 1.46 3.38 -0.45 -2.44 115.31 119.26 1id1 h LEU 24 Ca 0.28 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1id1 h LEU 24 Cb 0.07 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1id1 h LEU 24 CO -0.04 1.11 0.03 0.78 0.09 0.00 0.00 178.44 180.41 1id1 h ASN 25 N 0.88 0.19 -0.61 -0.43 2.35 -0.37 -0.70 115.58 116.87 1id1 h ASN 25 Ca 0.14 -0.22 0.17 0.00 -0.55 0.00 0.00 56.30 55.84 1id1 h ASN 25 Cb 0.65 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.95 1id1 h ASN 25 CO 0.05 0.36 0.44 1.56 -1.65 0.00 0.00 177.43 178.18 1id1 h GLN 26 N 0.00 0.03 -0.03 0.81 4.20 -0.97 1.13 115.11 120.28 1id1 h GLN 26 Ca 0.04 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1id1 h GLN 26 Cb 0.24 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.02 1id1 h GLN 26 CO -0.00 0.02 0.00 0.54 -0.67 0.00 0.00 178.83 178.72 1id1 n ARG 27 N -4.37 1.17 -0.72 1.46 5.12 -0.93 -4.89 116.66 113.51 1id1 n ARG 27 Ca 0.12 -0.26 0.00 0.00 -1.93 0.00 0.00 57.85 55.78 1id1 n ARG 27 Cb 0.67 -1.38 0.00 0.00 -1.16 0.00 0.00 32.46 30.59 1id1 n ARG 27 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1id1 n GLY 28 N 0.93 0.69 3.83 -0.13 0.00 0.39 -5.06 105.19 105.84 1id1 n GLY 28 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1id1 n GLY 28 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1id1 s GLN 29 N -0.28 4.09 0.22 1.61 -1.52 -0.31 -4.98 119.66 118.48 1id1 s GLN 29 Ca 0.00 0.63 -0.29 0.00 -1.95 0.00 0.00 55.36 53.75 1id1 s GLN 29 Cb 0.00 -2.95 -0.09 0.00 -0.22 0.00 0.00 33.01 29.75 1id1 s GLN 29 CO 0.00 0.47 0.91 -0.80 -0.25 0.00 0.00 175.29 175.63 1id1 s ASN 30 N -1.62 7.59 -0.02 5.90 0.01 -1.26 -3.95 114.94 121.58 1id1 s ASN 30 Ca 0.38 1.88 0.01 0.00 -0.71 0.00 0.00 52.86 54.43 1id1 s ASN 30 Cb -0.16 -2.59 0.01 0.00 0.41 0.00 0.00 41.25 38.92 1id1 s ASN 30 CO 0.20 0.15 -0.04 -0.69 -1.51 0.00 0.00 177.10 175.20 1id1 s VAL 31 N -1.07 0.43 -0.23 1.60 1.01 -1.26 -1.51 120.40 119.37 1id1 s VAL 31 Ca 0.41 -0.15 -0.05 0.00 0.00 0.00 0.00 61.98 62.19 1id1 s VAL 31 Cb -0.25 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 1id1 s VAL 31 CO 0.31 0.16 -0.01 -0.89 0.00 0.00 0.00 175.10 174.67 1id1 s THR 32 N 0.38 3.64 -0.17 3.92 2.01 0.12 -4.34 115.64 121.19 1id1 s THR 32 Ca -0.04 -0.43 -0.08 0.00 0.31 0.00 0.00 61.69 61.45 1id1 s THR 32 Cb -0.08 -2.69 -0.04 0.00 0.01 0.00 0.00 72.50 69.70 1id1 s THR 32 CO -0.00 0.38 0.08 -0.69 -0.69 0.00 0.00 174.62 173.70 1id1 s VAL 33 N 1.51 5.01 -0.14 3.82 1.01 -0.61 -1.06 120.40 129.93 1id1 s VAL 33 Ca 0.06 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1id1 s VAL 33 Cb -0.15 -3.24 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 1id1 s VAL 33 CO -0.01 0.49 -0.18 -0.63 0.00 0.00 0.00 175.10 174.77 1id1 s ILE 34 N 0.07 2.46 0.06 2.22 1.01 -0.44 -0.14 121.20 126.44 1id1 s ILE 34 Ca 0.07 -0.85 -0.06 0.00 0.00 0.00 0.00 60.65 59.81 1id1 s ILE 34 Cb -0.12 -2.01 -0.01 0.00 0.01 0.00 0.00 42.46 40.33 1id1 s ILE 34 CO 0.00 0.53 0.11 -0.94 0.00 0.00 0.00 174.94 174.64 1id1 s SER 35 N 0.68 0.21 -0.18 3.58 1.04 -1.21 -1.91 113.70 115.92 1id1 s SER 35 Ca -0.09 -0.66 0.15 0.00 0.48 0.00 0.00 55.95 55.83 1id1 s SER 35 Cb -0.16 0.26 0.74 0.00 0.10 0.00 0.00 66.02 66.96 1id1 s SER 35 CO 0.02 -0.61 1.63 -0.46 0.98 0.00 0.00 173.24 174.80 1id1 n ASN 36 N 0.34 5.08 -4.77 7.02 0.23 -1.23 -1.29 115.26 120.64 1id1 n ASN 36 Ca -0.17 -2.69 -0.35 0.00 -0.53 0.00 0.00 54.58 50.84 1id1 n ASN 36 Cb 0.60 -0.63 0.01 0.00 -2.08 0.00 0.00 39.78 37.68 1id1 n ASN 36 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1id1 s LEU 37 N -2.24 3.72 0.50 -4.53 1.43 -1.26 -4.98 118.68 111.30 1id1 s LEU 37 Ca 0.50 2.22 -0.22 0.00 -1.03 0.00 0.00 54.13 55.61 1id1 s LEU 37 Cb 0.36 -4.58 -0.06 0.00 0.03 0.00 0.00 46.19 41.93 1id1 s LEU 37 CO 0.18 -1.32 1.19 -2.84 0.23 0.00 0.00 176.35 173.79 1id1 s PRO 38 N -3.32 3.54 0.13 1.29 0.02 -1.26 -4.61 135.00 130.78 1id1 s PRO 38 Ca 0.74 1.82 -0.04 0.00 0.02 0.00 0.00 61.00 63.53 1id1 s PRO 38 Cb -0.25 -2.28 0.20 0.00 0.02 0.00 0.00 34.50 32.19 1id1 s PRO 38 CO 0.29 -0.75 0.72 -0.85 -0.33 0.00 0.00 177.00 176.08 1id1 n GLU 39 N -0.79 -0.05 -0.03 5.54 0.00 -1.26 0.12 120.64 124.17 1id1 n GLU 39 Ca 0.09 0.72 -0.11 0.00 0.00 0.00 0.00 57.16 57.85 1id1 n GLU 39 Cb 0.48 -1.07 -0.06 0.00 0.00 0.00 0.00 31.44 30.80 1id1 n GLU 39 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.13 177.51 1id1 h ASP 40 N 0.00 0.19 0.04 -1.84 3.04 -2.01 -2.84 116.42 113.00 1id1 h ASP 40 Ca 0.21 -0.18 -0.05 0.00 -3.24 0.00 0.00 57.03 53.78 1id1 h ASP 40 Cb 0.33 -0.05 -0.01 0.00 -1.04 0.00 0.00 39.33 38.56 1id1 h ASP 40 CO -0.47 0.32 -0.14 0.44 -2.04 0.00 0.00 179.24 177.34 1id1 h ASP 41 N 0.06 0.21 -0.43 4.15 5.19 -0.66 -2.48 116.42 122.46 1id1 h ASP 41 Ca 0.04 -0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1id1 h ASP 41 Cb 0.19 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.62 1id1 h ASP 41 CO -0.00 0.38 0.27 0.40 -3.12 0.00 0.00 179.24 177.17 1id1 h ILE 42 N 0.21 1.12 -0.40 0.35 1.08 -1.06 -1.34 117.51 117.47 1id1 h ILE 42 Ca 0.04 -0.25 0.03 0.00 -0.39 0.00 0.00 64.86 64.29 1id1 h ILE 42 Cb 0.38 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 34.62 1id1 h ILE 42 CO 0.02 0.12 0.21 0.11 -0.69 0.00 0.00 178.15 177.93 1id1 h LYS 43 N 0.58 0.42 -0.25 2.37 6.56 -1.22 -0.77 116.57 124.26 1id1 h LYS 43 Ca 0.16 -0.03 -0.03 0.00 -1.06 0.00 0.00 60.65 59.69 1id1 h LYS 43 Cb -0.04 -0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 31.51 1id1 h LYS 43 CO -0.03 0.28 0.02 -0.56 -2.06 0.00 0.00 179.45 177.10 1id1 h GLN 44 N 0.43 0.36 -0.26 3.15 -0.00 -1.26 -2.50 115.11 115.03 1id1 h GLN 44 Ca 0.17 -0.05 -0.17 0.00 -0.00 0.00 0.00 58.65 58.59 1id1 h GLN 44 Cb 0.05 -0.06 0.00 0.00 -0.00 0.00 0.00 27.48 27.47 1id1 h GLN 44 CO -0.10 0.37 -0.50 1.25 -0.00 0.00 0.00 178.83 179.85 1id1 h LEU 45 N 0.35 0.89 -1.08 0.06 6.46 -0.38 -2.68 115.31 118.92 1id1 h LEU 45 Ca 0.08 -0.54 -0.04 0.00 -0.12 0.00 0.00 57.88 57.27 1id1 h LEU 45 Cb 0.20 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.85 1id1 h LEU 45 CO 0.00 1.26 0.21 -0.33 -0.62 0.00 0.00 178.44 178.96 1id1 h GLU 46 N 0.55 0.86 0.00 1.25 5.08 -0.84 -2.19 114.58 119.29 1id1 h GLU 46 Ca 0.01 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 1id1 h GLU 46 Cb 1.10 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 1id1 h GLU 46 CO 0.11 0.72 -0.27 1.96 -1.00 0.00 0.00 179.01 180.54 1id1 h GLN 47 N 0.84 0.00 0.00 2.33 4.20 -1.38 -2.68 115.11 118.42 1id1 h GLN 47 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 1id1 h GLN 47 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1id1 h GLN 47 CO -0.01 0.27 -0.29 0.07 -0.67 0.00 0.00 178.83 178.19 1id1 h ARG 48 N 0.00 0.00 -0.47 1.46 -0.00 -1.06 -3.27 114.38 111.03 1id1 h ARG 48 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 1id1 h ARG 48 Cb 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.79 1id1 h ARG 48 CO 0.03 0.00 0.00 1.28 -0.00 0.00 0.00 179.97 181.28 1id1 n LEU 49 N -2.57 3.42 0.00 0.08 4.77 -0.90 -5.07 117.00 116.73 1id1 n LEU 49 Ca 0.04 -1.55 0.00 0.00 -0.03 0.00 0.00 56.01 54.47 1id1 n LEU 49 Cb 0.48 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1id1 n LEU 49 CO 0.34 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 1id1 n GLY 50 N 1.51 -2.45 0.28 -0.72 0.00 -1.16 -4.23 105.19 98.43 1id1 n GLY 50 Ca 0.20 -1.61 0.17 0.00 0.00 0.00 0.00 46.02 44.79 1id1 n GLY 50 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1id1 h ASP 51 N 0.00 0.00 0.09 1.61 -0.00 -1.92 -2.91 116.42 113.29 1id1 h ASP 51 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1id1 h ASP 51 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 1id1 h ASP 51 CO 0.00 0.00 -0.05 -0.46 -0.00 0.00 0.00 179.24 178.73 1id1 n ASN 52 N -3.08 0.85 -4.51 4.15 2.04 -1.26 -4.92 115.26 108.53 1id1 n ASN 52 Ca 0.01 -1.11 -0.29 0.00 -0.44 0.00 0.00 54.58 52.74 1id1 n ASN 52 Cb 0.30 -0.00 -0.16 0.00 -2.53 0.00 0.00 39.78 37.39 1id1 n ASN 52 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1id1 n ALA 53 N -0.45 0.70 -3.23 -2.53 0.00 -1.10 -4.88 120.51 109.02 1id1 n ALA 53 Ca 0.19 -0.71 -0.45 0.00 0.00 0.00 0.00 53.44 52.46 1id1 n ALA 53 Cb 0.27 -2.55 -0.01 0.00 0.00 0.00 0.00 19.45 17.17 1id1 n ALA 53 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1id1 s ASP 54 N 5.89 7.02 -0.33 0.00 2.15 -1.26 -5.01 116.67 125.12 1id1 s ASP 54 Ca 1.25 -3.02 -0.10 0.00 0.43 0.00 0.00 52.55 51.11 1id1 s ASP 54 Cb -0.84 -2.26 0.00 0.00 -0.30 0.00 0.00 42.92 39.53 1id1 s ASP 54 CO 0.45 -0.54 0.17 -0.69 -0.17 0.00 0.00 175.17 174.39 1id1 s VAL 55 N 0.10 4.59 -0.61 1.11 1.01 -1.26 -1.58 120.40 123.76 1id1 s VAL 55 Ca 0.28 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 61.52 1id1 s VAL 55 Cb -0.08 -3.42 0.12 0.00 0.00 0.00 0.00 36.38 33.00 1id1 s VAL 55 CO -0.07 -0.03 0.68 -0.63 0.00 0.00 0.00 175.10 175.04 1id1 s ILE 56 N 1.59 4.97 -0.08 2.22 1.01 0.80 -5.00 121.20 126.71 1id1 s ILE 56 Ca 0.04 -1.25 -0.29 0.00 0.00 0.00 0.00 60.65 59.14 1id1 s ILE 56 Cb -0.18 -4.47 -0.06 0.00 0.01 0.00 0.00 42.46 37.77 1id1 s ILE 56 CO 0.06 -1.08 1.74 -2.16 0.00 0.00 0.00 174.94 173.51 1id1 s PRO 57 N 2.25 4.03 0.00 2.79 0.04 -1.26 -3.31 135.00 139.53 1id1 s PRO 57 Ca 0.11 2.16 0.00 0.00 0.04 0.00 0.00 61.00 63.31 1id1 s PRO 57 Cb -0.24 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.25 1id1 s PRO 57 CO 0.04 -1.04 0.00 0.41 0.04 0.00 0.00 177.00 176.45 1id1 n GLY 58 N 4.42 1.30 3.07 0.56 0.00 -0.41 -4.95 105.19 109.18 1id1 n GLY 58 Ca 0.19 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 1id1 n GLY 58 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1id1 s ASP 59 N 2.00 3.73 0.59 1.61 2.15 -1.26 -3.57 116.67 121.91 1id1 s ASP 59 Ca 0.00 -1.01 0.29 0.00 0.43 0.00 0.00 52.55 52.26 1id1 s ASP 59 Cb 0.00 -1.45 1.72 0.00 -0.30 0.00 0.00 42.92 42.89 1id1 s ASP 59 CO 0.00 -0.11 2.17 0.28 -0.17 0.00 0.00 175.17 177.33 1id1 h SER 60 N 7.88 0.00 1.31 -0.34 0.02 -1.93 -1.59 113.55 118.90 1id1 h SER 60 Ca -0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1id1 h SER 60 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.63 1id1 h SER 60 CO 0.53 0.00 0.00 0.78 -1.14 0.00 0.00 176.83 177.00 1id1 h ASN 61 N 0.00 0.00 -3.62 3.07 -0.26 -1.94 -3.42 115.58 109.41 1id1 h ASN 61 Ca 0.05 0.00 -0.62 0.00 -0.56 0.00 0.00 56.30 55.17 1id1 h ASN 61 Cb 0.28 0.00 -0.12 0.00 -1.06 0.00 0.00 38.32 37.41 1id1 h ASN 61 CO -0.00 0.00 0.40 -0.62 -1.06 0.00 0.00 177.43 176.15 1id1 s ASP 62 N -4.78 6.45 0.38 5.81 3.68 -0.60 -4.92 116.67 122.68 1id1 s ASP 62 Ca 0.08 0.01 0.23 0.00 2.13 0.00 0.00 52.55 54.99 1id1 s ASP 62 Cb 0.10 -2.40 1.25 0.00 -1.45 0.00 0.00 42.92 40.43 1id1 s ASP 62 CO 0.55 -0.91 1.69 0.28 0.13 0.00 0.00 175.17 176.91 1id1 h SER 63 N 8.91 0.00 0.97 -0.34 0.02 -1.85 -1.43 113.55 119.83 1id1 h SER 63 Ca -0.25 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.50 1id1 h SER 63 Cb 1.09 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.60 1id1 h SER 63 CO 0.96 0.00 -0.99 0.77 -1.14 0.00 0.00 176.83 176.43 1id1 h SER 64 N 0.00 0.02 0.79 3.07 4.64 -1.92 -2.38 113.55 117.77 1id1 h SER 64 Ca 0.00 -0.02 -0.18 0.00 -0.47 0.00 0.00 61.79 61.12 1id1 h SER 64 Cb 0.14 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 1id1 h SER 64 CO 0.00 1.00 -0.84 -0.37 -0.87 0.00 0.00 176.83 175.75 1id1 h VAL 65 N 0.00 1.58 -0.70 0.95 -1.51 -1.53 -2.09 116.25 112.95 1id1 h VAL 65 Ca -0.01 -2.82 -0.06 0.00 -1.23 0.00 0.00 66.70 62.57 1id1 h VAL 65 Cb 1.75 2.53 -0.03 0.00 -2.13 0.00 0.00 31.29 33.41 1id1 h VAL 65 CO 0.13 0.81 0.18 -0.07 -1.23 0.00 0.00 177.57 177.39 1id1 h LEU 66 N 0.02 1.04 -0.63 4.19 4.07 -1.46 0.38 115.31 122.92 1id1 h LEU 66 Ca -0.01 -0.23 -0.11 0.00 0.08 0.00 0.00 57.88 57.61 1id1 h LEU 66 Cb 1.48 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 42.93 1id1 h LEU 66 CO 0.11 1.00 -0.12 0.50 -1.08 0.00 0.00 178.44 178.85 1id1 h LYS 67 N 1.04 0.95 -0.41 1.13 3.64 -1.27 -2.02 116.57 119.62 1id1 h LYS 67 Ca 0.22 -0.35 -0.02 0.00 -1.27 0.00 0.00 60.65 59.23 1id1 h LYS 67 Cb 0.35 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 1id1 h LYS 67 CO -0.00 1.01 0.16 -0.22 -2.27 0.00 0.00 179.45 178.13 1id1 h LYS 68 N 0.84 0.58 0.00 1.90 3.64 -1.00 -1.54 116.57 121.00 1id1 h LYS 68 Ca 0.13 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1id1 h LYS 68 Cb 0.66 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1id1 h LYS 68 CO 0.05 0.49 0.00 0.00 -2.27 0.00 0.00 179.45 177.72 1id1 n ALA 69 N -2.47 2.23 -1.44 5.00 0.00 0.09 -4.95 120.51 118.97 1id1 n ALA 69 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1id1 n ALA 69 Cb 0.15 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1id1 n ALA 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1id1 n GLY 70 N 1.21 0.93 0.28 0.00 0.00 -0.58 -4.96 105.19 102.07 1id1 n GLY 70 Ca 0.05 -0.39 0.18 0.00 0.00 0.00 0.00 46.02 45.87 1id1 n GLY 70 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1id1 h ILE 71 N 0.00 0.00 0.00 -0.61 -2.65 -1.69 -2.16 117.51 110.40 1id1 h ILE 71 Ca 0.00 -0.40 -0.01 0.00 1.03 0.00 0.00 64.86 65.48 1id1 h ILE 71 Cb 0.59 1.39 -0.00 0.00 -2.05 0.00 0.00 36.82 36.74 1id1 h ILE 71 CO 0.00 0.00 -0.06 0.44 0.03 0.00 0.00 178.15 178.56 1id1 h ASP 72 N 0.00 0.00 0.00 2.16 3.45 -1.88 -3.21 116.42 116.94 1id1 h ASP 72 Ca 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.45 1id1 h ASP 72 Cb 0.41 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.15 1id1 h ASP 72 CO 0.00 0.06 -0.27 0.54 -1.57 0.00 0.00 179.24 178.00 1id1 n ARG 73 N -3.19 0.91 -2.76 3.56 1.74 -0.85 -5.08 116.66 110.98 1id1 n ARG 73 Ca 0.00 -2.23 -0.22 0.00 -0.77 0.00 0.00 57.85 54.62 1id1 n ARG 73 Cb 0.33 -1.16 0.03 0.00 -1.02 0.00 0.00 32.46 30.63 1id1 n ARG 73 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1id1 h ARG 75 N 0.18 0.39 -1.59 0.00 2.47 0.14 -3.44 114.38 112.52 1id1 h ARG 75 Ca -0.44 -0.67 0.22 0.00 -1.26 0.00 0.00 59.98 57.83 1id1 h ARG 75 Cb 1.27 0.25 -0.19 0.00 -1.65 0.00 0.00 29.97 29.65 1id1 h ARG 75 CO 0.55 1.30 0.75 0.00 0.56 0.00 0.00 179.97 183.14 1id1 s ALA 76 N -2.62 -2.03 -0.08 0.04 0.00 -1.25 -4.35 121.76 111.48 1id1 s ALA 76 Ca -0.08 1.52 0.03 0.00 0.00 0.00 0.00 51.96 53.43 1id1 s ALA 76 Cb 0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 1id1 s ALA 76 CO 0.90 -0.58 -0.18 -1.50 0.00 0.00 0.00 175.76 174.40 1id1 s ILE 77 N -2.41 2.71 -0.18 0.00 2.07 -0.12 -2.70 121.20 120.57 1id1 s ILE 77 Ca 0.08 -0.82 -0.01 0.00 -1.41 0.00 0.00 60.65 58.49 1id1 s ILE 77 Cb -0.01 -2.06 -0.00 0.00 0.13 0.00 0.00 42.46 40.52 1id1 s ILE 77 CO -0.05 0.56 -0.12 -0.76 -1.91 0.00 0.00 174.94 172.66 1id1 s LEU 78 N -0.19 2.57 -0.70 8.50 1.02 0.99 -1.24 118.68 129.63 1id1 s LEU 78 Ca -0.01 -0.47 -0.16 0.00 0.02 0.00 0.00 54.13 53.52 1id1 s LEU 78 Cb -0.13 -1.61 0.17 0.00 0.02 0.00 0.00 46.19 44.63 1id1 s LEU 78 CO 0.03 0.04 0.69 0.00 0.02 0.00 0.00 176.35 177.13 1id1 s ALA 79 N 1.11 3.79 -0.18 4.21 0.00 0.14 -0.31 121.76 130.52 1id1 s ALA 79 Ca 0.00 -2.86 0.13 0.00 0.00 0.00 0.00 51.96 49.24 1id1 s ALA 79 Cb -0.14 -3.46 0.39 0.00 0.00 0.00 0.00 23.12 19.91 1id1 s ALA 79 CO -0.04 -2.24 1.20 1.28 0.00 0.00 0.00 175.76 175.97 1id1 n LEU 80 N 4.91 2.47 -4.93 0.00 4.77 -0.41 -1.95 117.00 121.86 1id1 n LEU 80 Ca 0.01 -3.58 -0.28 0.00 -0.03 0.00 0.00 56.01 52.13 1id1 n LEU 80 Cb 0.44 -0.46 0.12 0.00 -2.33 0.00 0.00 43.42 41.18 1id1 n LEU 80 CO 0.45 1.21 0.75 -0.94 -1.33 0.00 0.00 177.39 177.53 1id1 s SER 81 N -3.05 4.12 -0.02 -1.43 1.04 -1.15 -4.09 113.70 109.12 1id1 s SER 81 Ca 0.36 0.41 0.06 0.00 0.48 0.00 0.00 55.95 57.25 1id1 s SER 81 Cb 0.35 -0.78 0.19 0.00 0.10 0.00 0.00 66.02 65.88 1id1 s SER 81 CO -0.06 -2.09 1.08 0.47 0.98 0.00 0.00 173.24 173.62 1id1 n ASP 82 N -3.31 1.39 -4.08 7.02 10.43 -1.26 -4.67 116.55 122.07 1id1 n ASP 82 Ca 0.11 -2.06 -0.32 0.00 2.57 0.00 0.00 54.79 55.09 1id1 n ASP 82 Cb 0.60 -0.23 -0.15 0.00 1.84 0.00 0.00 41.12 43.18 1id1 n ASP 82 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 1id1 s ASN 83 N -0.82 4.52 0.54 -2.24 3.84 -1.26 -4.87 114.94 114.65 1id1 s ASN 83 Ca 0.14 -1.44 0.28 0.00 0.21 0.00 0.00 52.86 52.06 1id1 s ASN 83 Cb 0.08 -1.57 1.55 0.00 -0.55 0.00 0.00 41.25 40.76 1id1 s ASN 83 CO 0.08 -0.21 2.12 0.44 -2.79 0.00 0.00 177.10 176.74 1id1 h ASP 84 N 7.79 0.00 0.06 -4.21 3.32 -1.93 -2.23 116.42 119.22 1id1 h ASP 84 Ca -0.18 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.86 1id1 h ASP 84 Cb 1.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.59 1id1 h ASP 84 CO 0.47 0.09 -0.03 0.00 -1.72 0.00 0.00 179.24 178.05 1id1 h ALA 85 N 1.91 -0.08 -0.83 3.45 0.00 -1.98 -1.74 119.26 119.99 1id1 h ALA 85 Ca -0.00 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.76 1id1 h ALA 85 Cb 0.26 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 1id1 h ALA 85 CO 0.01 -0.33 0.54 -0.44 0.00 0.00 0.00 179.25 179.03 1id1 h ASP 86 N -0.51 0.80 -0.18 0.00 3.45 -1.93 -1.09 116.42 116.96 1id1 h ASP 86 Ca -0.01 0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.31 1id1 h ASP 86 Cb 0.45 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.04 1id1 h ASP 86 CO 0.01 0.52 -0.42 0.78 -1.57 0.00 0.00 179.24 178.57 1id1 h ASN 87 N 0.91 0.77 -0.02 6.45 -0.26 -1.29 -1.39 115.58 120.75 1id1 h ASN 87 Ca 0.35 -0.36 -0.12 0.00 -0.56 0.00 0.00 56.30 55.62 1id1 h ASN 87 Cb 0.22 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.25 1id1 h ASN 87 CO -0.13 1.09 -0.35 0.00 -1.06 0.00 0.00 177.43 176.98 1id1 h ALA 88 N 0.94 0.95 -0.21 -0.83 0.00 -0.87 -2.58 119.26 116.66 1id1 h ALA 88 Ca 0.04 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 1id1 h ALA 88 Cb 0.96 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1id1 h ALA 88 CO 0.09 0.61 -0.37 0.35 0.00 0.00 0.00 179.25 179.93 1id1 h PHE 89 N 0.43 0.79 -0.55 0.00 3.57 -1.04 -1.80 116.94 118.34 1id1 h PHE 89 Ca 0.05 -0.28 0.10 0.00 3.53 0.00 0.00 57.97 61.37 1id1 h PHE 89 Cb 0.82 -0.15 -0.08 0.00 2.79 0.00 0.00 35.95 39.33 1id1 h PHE 89 CO 0.03 1.03 0.14 0.28 -2.23 0.00 0.00 178.31 177.56 1id1 h VAL 90 N 0.32 0.71 -0.05 1.41 2.07 -1.18 0.46 116.25 119.99 1id1 h VAL 90 Ca 0.01 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.45 1id1 h VAL 90 Cb 0.97 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1id1 h VAL 90 CO 0.08 0.05 -0.01 0.58 0.02 0.00 0.00 177.57 178.30 1id1 h VAL 91 N 0.28 0.96 -0.39 2.57 2.07 -1.24 -0.33 116.25 120.17 1id1 h VAL 91 Ca 0.28 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.84 1id1 h VAL 91 Cb 0.39 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 1id1 h VAL 91 CO -0.35 0.00 0.16 -0.07 0.02 0.00 0.00 177.57 177.34 1id1 h LEU 92 N 0.01 0.21 -0.31 2.57 3.38 -0.44 -1.19 115.31 119.54 1id1 h LEU 92 Ca 0.02 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.09 1id1 h LEU 92 Cb 0.03 -0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 1id1 h LEU 92 CO -0.04 0.16 -0.11 0.28 0.09 0.00 0.00 178.44 178.81 1id1 h SER 93 N 0.34 -0.40 -1.00 -0.43 0.02 0.38 -2.01 113.55 110.46 1id1 h SER 93 Ca 0.17 0.11 0.03 0.00 -0.84 0.00 0.00 61.79 61.26 1id1 h SER 93 Cb 0.12 0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.84 1id1 h SER 93 CO -0.15 -0.15 0.66 0.00 -1.14 0.00 0.00 176.83 176.05 1id1 h ALA 94 N 1.23 1.32 0.00 3.77 0.00 -0.37 -1.13 119.26 124.09 1id1 h ALA 94 Ca 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1id1 h ALA 94 Cb 0.29 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1id1 h ALA 94 CO -0.35 0.58 0.00 1.63 0.00 0.00 0.00 179.25 181.11 1id1 n LYS 95 N -4.43 0.09 0.08 0.00 5.02 -0.52 -2.27 118.16 116.14 1id1 n LYS 95 Ca 0.13 0.26 0.12 0.00 -2.02 0.00 0.00 58.31 56.80 1id1 n LYS 95 Cb 0.07 -1.65 0.08 0.00 -0.02 0.00 0.00 35.03 33.52 1id1 n LYS 95 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 1id1 h ASP 96 N 0.00 0.00 0.00 4.39 3.58 -0.52 -3.35 116.42 120.53 1id1 h ASP 96 Ca 0.00 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.32 1id1 h ASP 96 Cb 0.38 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.43 1id1 h ASP 96 CO 0.00 0.06 -0.42 0.23 -2.88 0.00 0.00 179.24 176.24 1id1 n MET 97 N -2.38 0.23 -0.07 0.28 2.81 -0.96 -4.88 117.12 112.14 1id1 n MET 97 Ca 0.02 0.10 -0.13 0.00 -1.81 0.00 0.00 57.70 55.88 1id1 n MET 97 Cb 0.49 -0.91 -0.14 0.00 -0.71 0.00 0.00 33.22 31.95 1id1 n MET 97 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1id1 n SER 98 N -3.34 0.95 0.00 7.83 2.88 -1.07 -4.94 113.62 115.93 1id1 n SER 98 Ca -0.06 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1id1 n SER 98 Cb 0.22 0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.85 1id1 n SER 98 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1id1 n SER 99 N -3.04 -3.13 0.00 -3.46 3.41 -1.23 -4.44 113.62 101.72 1id1 n SER 99 Ca -0.32 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 1id1 n SER 99 Cb 1.08 -2.60 0.00 0.00 -0.26 0.00 0.00 64.21 62.43 1id1 n SER 99 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1id1 n ASP 100 N -0.15 1.30 -4.69 4.04 8.00 -1.26 -5.04 116.55 118.75 1id1 n ASP 100 Ca 0.00 -0.22 -0.42 0.00 0.71 0.00 0.00 54.79 54.85 1id1 n ASP 100 Cb 0.26 0.71 -0.03 0.00 -0.02 0.00 0.00 41.12 42.04 1id1 n ASP 100 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1id1 s VAL 101 N -0.97 4.29 0.08 2.53 0.11 -1.26 -4.99 120.40 120.19 1id1 s VAL 101 Ca 0.00 1.61 -0.31 0.00 -2.93 0.00 0.00 61.98 60.36 1id1 s VAL 101 Cb 0.00 -4.04 -0.08 0.00 -1.53 0.00 0.00 36.38 30.73 1id1 s VAL 101 CO 0.00 0.02 1.56 -0.75 -3.33 0.00 0.00 175.10 172.60 1id1 s LYS 102 N 2.00 4.23 -0.10 1.54 2.20 -1.26 -4.91 119.74 123.44 1id1 s LYS 102 Ca 0.56 2.25 -0.01 0.00 -0.36 0.00 0.00 55.97 58.41 1id1 s LYS 102 Cb -0.25 -3.46 -0.03 0.00 -1.51 0.00 0.00 37.83 32.59 1id1 s LYS 102 CO 0.23 -0.65 -0.07 0.95 -0.36 0.00 0.00 175.35 175.46 1id1 s THR 103 N 2.11 3.69 -0.08 3.43 -4.23 -1.26 -0.95 115.64 118.35 1id1 s THR 103 Ca 0.70 -0.46 0.02 0.00 -1.18 0.00 0.00 61.69 60.77 1id1 s THR 103 Cb -0.39 -2.55 0.01 0.00 1.34 0.00 0.00 72.50 70.92 1id1 s THR 103 CO 0.31 0.56 -0.14 -0.69 -0.54 0.00 0.00 174.62 174.11 1id1 s VAL 104 N -0.31 1.33 -0.04 2.29 1.01 -0.37 -0.99 120.40 123.32 1id1 s VAL 104 Ca 0.04 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.45 1id1 s VAL 104 Cb -0.13 -1.20 0.02 0.00 0.00 0.00 0.00 36.38 35.07 1id1 s VAL 104 CO 0.02 0.40 -0.07 -0.22 0.00 0.00 0.00 175.10 175.23 1id1 s LEU 105 N 0.67 1.52 -0.19 3.92 0.20 0.10 0.26 118.68 125.16 1id1 s LEU 105 Ca -0.14 -0.18 -0.05 0.00 0.69 0.00 0.00 54.13 54.45 1id1 s LEU 105 Cb -0.16 -0.54 -0.03 0.00 -0.43 0.00 0.00 46.19 45.03 1id1 s LEU 105 CO 0.04 -0.01 -0.00 0.00 -0.29 0.00 0.00 176.35 176.09 1id1 s ALA 106 N 0.67 3.07 -0.10 5.97 0.00 -0.83 -0.56 121.76 129.99 1id1 s ALA 106 Ca -0.10 -0.91 -0.29 0.00 0.00 0.00 0.00 51.96 50.65 1id1 s ALA 106 Cb -0.13 -1.74 -0.01 0.00 0.00 0.00 0.00 23.12 21.23 1id1 s ALA 106 CO 0.01 -0.01 0.97 0.14 0.00 0.00 0.00 175.76 176.87 1id1 s VAL 107 N 0.75 4.81 -0.00 0.00 -7.23 -0.44 -4.80 120.40 113.49 1id1 s VAL 107 Ca 0.00 1.98 -0.18 0.00 -1.81 0.00 0.00 61.98 61.97 1id1 s VAL 107 Cb -0.14 -4.29 -0.34 0.00 0.56 0.00 0.00 36.38 32.17 1id1 s VAL 107 CO 0.02 0.03 0.94 0.28 -0.31 0.00 0.00 175.10 176.07 1id1 h SER 108 N 7.08 0.72 -3.48 4.85 0.02 -1.89 -3.41 113.55 117.44 1id1 h SER 108 Ca -0.32 -0.93 -0.67 0.00 -0.84 0.00 0.00 61.79 59.03 1id1 h SER 108 Cb 1.15 -0.23 -0.35 0.00 0.14 0.00 0.00 62.40 63.11 1id1 h SER 108 CO 0.84 1.62 -0.80 -0.62 -1.14 0.00 0.00 176.83 176.73 1id1 s ASP 109 N -7.38 3.98 0.52 3.07 3.68 -1.26 -5.00 116.67 114.27 1id1 s ASP 109 Ca -0.11 -0.97 0.30 0.00 2.13 0.00 0.00 52.55 53.90 1id1 s ASP 109 Cb 0.03 -1.57 1.43 0.00 -1.45 0.00 0.00 42.92 41.36 1id1 s ASP 109 CO 0.91 -0.11 1.88 0.77 0.13 0.00 0.00 175.17 178.75 1id1 h SER 110 N 7.91 0.06 0.42 -0.34 4.64 -2.02 0.17 113.55 124.39 1id1 h SER 110 Ca -0.33 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1id1 h SER 110 Cb 1.10 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1id1 h SER 110 CO 0.56 0.02 -0.02 0.11 -0.87 0.00 0.00 176.83 176.63 1id1 h LYS 111 N 0.06 0.00 -0.14 4.77 1.57 -1.99 -2.45 116.57 118.39 1id1 h LYS 111 Ca 0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 1id1 h LYS 111 Cb 1.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.94 1id1 h LYS 111 CO -0.03 0.02 0.00 0.09 -0.57 0.00 0.00 179.45 178.96 1id1 n ASN 112 N -3.20 1.37 0.09 0.86 3.02 0.59 -4.45 115.26 113.54 1id1 n ASN 112 Ca -0.02 -1.67 -0.13 0.00 -0.03 0.00 0.00 54.58 52.74 1id1 n ASN 112 Cb 0.18 -0.09 -0.06 0.00 -0.61 0.00 0.00 39.78 39.21 1id1 n ASN 112 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1id1 h LEU 113 N 1.81 -0.92 -0.82 3.41 6.46 -1.57 -1.64 115.31 122.04 1id1 h LEU 113 Ca 0.00 0.11 0.05 0.00 -0.12 0.00 0.00 57.88 57.92 1id1 h LEU 113 Cb 0.40 0.36 -0.05 0.00 -0.73 0.00 0.00 40.66 40.63 1id1 h LEU 113 CO 0.00 -0.39 0.51 0.78 -0.62 0.00 0.00 178.44 178.72 1id1 h ASN 114 N -0.51 0.82 0.88 1.25 2.35 -1.84 -2.19 115.58 116.33 1id1 h ASN 114 Ca 0.04 0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 1id1 h ASN 114 Cb 0.56 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 1id1 h ASN 114 CO -0.22 0.54 -0.32 0.07 -1.65 0.00 0.00 177.43 175.86 1id1 h LYS 115 N 0.96 0.00 0.00 0.81 2.10 -1.78 -3.08 116.57 115.58 1id1 h LYS 115 Ca 0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.99 1id1 h LYS 115 Cb 0.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 1id1 h LYS 115 CO -0.15 0.32 -0.22 -0.84 -2.00 0.00 0.00 179.45 176.57 1id1 h ILE 116 N 0.00 0.00 0.00 0.07 -0.00 -0.68 -3.06 117.51 113.84 1id1 h ILE 116 Ca -0.00 -0.77 -0.02 0.00 -0.00 0.00 0.00 64.86 64.06 1id1 h ILE 116 Cb 0.84 1.65 -0.00 0.00 -0.00 0.00 0.00 36.82 39.31 1id1 h ILE 116 CO 0.04 0.00 -0.12 0.11 -0.00 0.00 0.00 178.15 178.18 1id1 h LYS 117 N 0.00 0.00 0.00 0.16 1.57 -1.38 -2.64 116.57 114.28 1id1 h LYS 117 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1id1 h LYS 117 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1id1 h LYS 117 CO 0.00 0.12 0.00 0.52 -0.57 0.00 0.00 179.45 179.52 1id1 h MET 118 N 0.00 0.00 -0.29 3.15 2.86 -1.63 -1.25 114.93 117.77 1id1 h MET 118 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1id1 h MET 118 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 1id1 h MET 118 CO 0.02 0.00 0.00 1.33 1.06 0.00 0.00 176.91 179.32 1id1 n VAL 119 N -2.97 0.37 -3.91 -2.22 0.24 -0.99 -5.00 118.33 103.85 1id1 n VAL 119 Ca -0.00 -0.54 -0.37 0.00 -2.04 0.00 0.00 64.34 61.39 1id1 n VAL 119 Cb 0.22 0.60 0.02 0.00 -1.47 0.00 0.00 33.84 33.21 1id1 n VAL 119 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1id1 n HIS 120 N 0.84 -1.63 -1.94 6.34 -0.00 -0.47 -4.79 115.22 113.57 1id1 n HIS 120 Ca 0.17 0.33 -0.33 0.00 -0.00 0.00 0.00 57.72 57.89 1id1 n HIS 120 Cb 0.44 -3.16 0.02 0.00 -0.00 0.00 0.00 29.99 27.30 1id1 n HIS 120 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 1id1 s PRO 121 N -6.73 3.14 0.23 -0.41 0.04 -1.26 -4.94 135.00 125.06 1id1 s PRO 121 Ca 0.41 1.26 -0.03 0.00 0.04 0.00 0.00 61.00 62.69 1id1 s PRO 121 Cb -0.19 -2.00 0.25 0.00 0.04 0.00 0.00 34.50 32.60 1id1 s PRO 121 CO 0.92 -0.96 1.67 -0.44 0.04 0.00 0.00 177.00 178.23 1id1 h ASP 122 N 0.29 0.73 -3.77 6.66 5.19 -1.74 -3.43 116.42 120.35 1id1 h ASP 122 Ca -0.47 -0.25 -0.43 0.00 -0.62 0.00 0.00 57.03 55.27 1id1 h ASP 122 Cb 1.23 -0.20 -0.31 0.00 0.18 0.00 0.00 39.33 40.23 1id1 h ASP 122 CO 0.56 0.92 -0.79 -0.63 -3.12 0.00 0.00 179.24 176.18 1id1 s ILE 123 N -4.66 0.76 -0.15 0.35 1.01 -0.16 -2.03 121.20 116.32 1id1 s ILE 123 Ca -0.09 -0.34 0.01 0.00 0.00 0.00 0.00 60.65 60.23 1id1 s ILE 123 Cb 0.13 -0.69 0.02 0.00 0.01 0.00 0.00 42.46 41.94 1id1 s ILE 123 CO 0.82 0.24 -0.17 -0.63 0.00 0.00 0.00 174.94 175.21 1id1 s ILE 124 N 0.26 1.77 -0.30 2.92 1.01 -1.03 -0.72 121.20 125.10 1id1 s ILE 124 Ca -0.04 -0.76 -0.04 0.00 0.00 0.00 0.00 60.65 59.80 1id1 s ILE 124 Cb -0.09 -1.62 0.03 0.00 0.01 0.00 0.00 42.46 40.79 1id1 s ILE 124 CO 0.01 0.49 0.04 -0.22 0.00 0.00 0.00 174.94 175.25 1id1 s LEU 125 N 1.33 3.84 -0.59 2.97 2.96 0.27 -4.73 118.68 124.72 1id1 s LEU 125 Ca 0.03 -0.98 -0.08 0.00 -0.22 0.00 0.00 54.13 52.88 1id1 s LEU 125 Cb -0.13 -1.79 0.15 0.00 0.50 0.00 0.00 46.19 44.92 1id1 s LEU 125 CO -0.10 -0.23 0.46 -0.55 -1.32 0.00 0.00 176.35 174.62 1id1 s SER 126 N 1.38 5.79 0.30 3.68 0.15 -1.26 -1.33 113.70 122.41 1id1 s SER 126 Ca -0.01 -2.37 0.06 0.00 0.70 0.00 0.00 55.95 54.34 1id1 s SER 126 Cb -0.18 -2.00 0.79 0.00 -1.71 0.00 0.00 66.02 62.91 1id1 s SER 126 CO 0.00 -0.57 1.73 -0.65 1.20 0.00 0.00 173.24 174.95 1id1 h PRO 127 N 7.87 0.54 -0.18 5.44 0.11 -1.96 0.14 132.00 143.96 1id1 h PRO 127 Ca -0.08 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.84 1id1 h PRO 127 Cb 1.03 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1id1 h PRO 127 CO 0.79 0.36 -0.49 1.96 -0.21 0.00 0.00 178.00 180.41 1id1 h GLN 128 N 0.56 0.65 -0.18 1.05 1.08 -1.94 -2.13 115.11 114.19 1id1 h GLN 128 Ca 0.60 -0.46 -0.13 0.00 -1.45 0.00 0.00 58.65 57.21 1id1 h GLN 128 Cb 1.09 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.59 1id1 h GLN 128 CO -0.47 1.08 -0.40 -0.07 -0.95 0.00 0.00 178.83 178.02 1id1 h LEU 129 N 0.33 0.67 0.25 1.46 4.07 -1.85 -1.73 115.31 118.52 1id1 h LEU 129 Ca -0.01 -0.56 -0.01 0.00 0.08 0.00 0.00 57.88 57.38 1id1 h LEU 129 Cb 1.11 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 42.66 1id1 h LEU 129 CO 0.11 1.11 -0.12 0.15 -1.08 0.00 0.00 178.44 178.60 1id1 h PHE 130 N 0.26 -0.31 -0.61 1.13 3.57 -0.82 -0.36 116.94 119.79 1id1 h PHE 130 Ca 0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1id1 h PHE 130 Cb 1.00 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.82 1id1 h PHE 130 CO 0.09 -0.19 0.36 0.78 -2.23 0.00 0.00 178.31 177.13 1id1 h GLY 131 N -0.35 0.90 1.12 2.40 0.00 -1.45 -1.26 103.07 104.43 1id1 h GLY 131 Ca -0.03 -0.38 -0.10 0.00 0.00 0.00 0.00 47.33 46.81 1id1 h GLY 131 CO 0.06 0.37 -0.02 1.48 0.00 0.00 0.00 176.54 178.43 1id1 h SER 132 N 0.83 1.03 -0.54 0.19 4.64 -1.20 -1.50 113.55 117.01 1id1 h SER 132 Ca 0.22 -0.30 -0.09 0.00 -0.47 0.00 0.00 61.79 61.15 1id1 h SER 132 Cb -0.00 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.79 1id1 h SER 132 CO -0.04 1.09 0.00 -0.08 -0.87 0.00 0.00 176.83 176.93 1id1 h GLU 133 N 0.95 0.98 -0.17 4.77 4.81 -0.77 -1.28 114.58 123.87 1id1 h GLU 133 Ca 0.17 -0.29 -0.11 0.00 -0.13 0.00 0.00 59.36 58.99 1id1 h GLU 133 Cb 0.57 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 1id1 h GLU 133 CO 0.03 0.96 -0.38 0.82 -0.73 0.00 0.00 179.01 179.72 1id1 h ILE 134 N 0.90 1.30 0.12 2.32 2.04 -1.02 -1.61 117.51 121.56 1id1 h ILE 134 Ca 0.16 -1.48 -0.01 0.00 1.00 0.00 0.00 64.86 64.54 1id1 h ILE 134 Cb 0.52 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 1id1 h ILE 134 CO 0.03 0.45 -0.06 -0.07 0.00 0.00 0.00 178.15 178.50 1id1 h LEU 135 N 0.32 -0.14 -0.20 1.44 3.38 -0.98 -1.54 115.31 117.59 1id1 h LEU 135 Ca 0.03 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 57.90 1id1 h LEU 135 Cb 0.81 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.53 1id1 h LEU 135 CO 0.06 0.08 -0.31 0.00 0.09 0.00 0.00 178.44 178.37 1id1 h ALA 136 N 0.50 -0.29 -0.12 1.53 0.00 -1.07 0.90 119.26 120.70 1id1 h ALA 136 Ca -0.02 0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1id1 h ALA 136 Cb 0.29 0.60 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1id1 h ALA 136 CO 0.03 -0.76 -0.35 0.00 0.00 0.00 0.00 179.25 178.16 1id1 h ARG 137 N -0.34 -0.42 -0.67 0.00 -0.00 -1.21 0.25 114.38 111.98 1id1 h ARG 137 Ca 0.12 0.03 0.00 0.00 -0.50 0.00 0.00 59.98 59.63 1id1 h ARG 137 Cb 0.53 0.10 -0.03 0.00 0.00 0.00 0.00 29.97 30.56 1id1 h ARG 137 CO -0.39 -0.28 0.42 0.28 0.00 0.00 0.00 179.97 180.01 1id1 h VAL 138 N -0.43 1.19 0.00 2.04 2.07 -0.93 -1.35 116.25 118.84 1id1 h VAL 138 Ca 0.09 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1id1 h VAL 138 Cb 0.58 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1id1 h VAL 138 CO -0.37 0.19 -0.19 -0.07 0.02 0.00 0.00 177.57 177.15 1id1 h LEU 139 N 0.92 0.00 -0.43 2.57 3.38 -0.53 -1.86 115.31 119.35 1id1 h LEU 139 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1id1 h LEU 139 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1id1 h LEU 139 CO -0.05 0.19 0.00 -3.20 0.09 0.00 0.00 178.44 175.47 1id1 n ASN 140 N -3.41 0.66 0.00 -0.43 5.15 0.05 -4.91 115.26 112.36 1id1 n ASN 140 Ca -0.00 -1.46 0.00 0.00 -0.60 0.00 0.00 54.58 52.51 1id1 n ASN 140 Cb 0.38 -0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.60 1id1 n ASN 140 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1id1 n GLY 141 N 0.96 0.73 3.83 8.20 0.00 -0.70 -5.04 105.19 113.16 1id1 n GLY 141 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1id1 n GLY 141 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1id1 s GLU 142 N -0.02 2.40 -0.04 1.61 2.02 -0.59 -5.00 118.70 119.09 1id1 s GLU 142 Ca 0.00 0.63 0.03 0.00 0.02 0.00 0.00 54.97 55.66 1id1 s GLU 142 Cb 0.00 -1.95 -0.03 0.00 0.10 0.00 0.00 34.13 32.25 1id1 s GLU 142 CO 0.00 -1.40 -0.12 -1.21 0.02 0.00 0.00 175.26 172.56 1id1 s GLU 143 N -5.19 2.53 -0.20 1.61 2.02 -1.26 -4.52 118.70 113.69 1id1 s GLU 143 Ca 0.60 -0.69 -0.01 0.00 0.02 0.00 0.00 54.97 54.88 1id1 s GLU 143 Cb -0.13 -2.43 0.01 0.00 0.10 0.00 0.00 34.13 31.67 1id1 s GLU 143 CO 0.54 0.62 -0.12 0.42 0.02 0.00 0.00 175.26 176.74 1id1 s ILE 144 N -0.81 2.74 0.35 -1.63 1.01 -1.26 -5.10 121.20 116.50 1id1 s ILE 144 Ca 0.13 -0.73 0.05 0.00 0.00 0.00 0.00 60.65 60.09 1id1 s ILE 144 Cb -0.11 -2.22 -0.01 0.00 0.01 0.00 0.00 42.46 40.13 1id1 s ILE 144 CO 0.02 0.46 0.50 0.54 0.00 0.00 0.00 174.94 176.47 1id1 s ASN 145 N 1.38 5.99 0.38 3.58 4.22 -1.26 -4.94 114.94 124.29 1id1 s ASN 145 Ca 0.05 -0.04 0.16 0.00 -2.14 0.00 0.00 52.86 50.89 1id1 s ASN 145 Cb -0.14 -1.39 1.03 0.00 1.28 0.00 0.00 41.25 42.03 1id1 s ASN 145 CO -0.08 -0.45 1.78 -1.13 -2.04 0.00 0.00 177.10 175.19 1id1 h ASN 146 N 0.81 0.51 -0.39 3.54 -0.73 -1.99 -1.43 115.58 115.90 1id1 h ASN 146 Ca -0.47 0.08 -0.05 0.00 1.87 0.00 0.00 56.30 57.73 1id1 h ASN 146 Cb 1.25 -0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.82 1id1 h ASN 146 CO 0.55 0.13 0.05 0.44 -0.37 0.00 0.00 177.43 178.23 1id1 h ASP 147 N 0.46 0.63 -0.51 1.15 3.45 -1.99 -1.21 116.42 118.40 1id1 h ASP 147 Ca 0.57 -0.27 -0.05 0.00 0.43 0.00 0.00 57.03 57.71 1id1 h ASP 147 Cb 1.34 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 39.92 1id1 h ASP 147 CO -0.30 0.74 0.11 0.24 -1.57 0.00 0.00 179.24 178.47 1id1 h MET 148 N 0.49 0.82 0.01 3.56 2.86 -1.68 -1.68 114.93 119.31 1id1 h MET 148 Ca 0.12 -0.20 -0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1id1 h MET 148 Cb 0.39 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.95 1id1 h MET 148 CO 0.01 0.80 -0.00 1.25 1.06 0.00 0.00 176.91 180.02 1id1 h LEU 149 N 0.71 -0.01 -0.84 1.22 5.85 -1.27 -2.42 115.31 118.55 1id1 h LEU 149 Ca 0.16 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1id1 h LEU 149 Cb 0.35 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 1id1 h LEU 149 CO 0.00 0.01 0.54 0.58 -0.34 0.00 0.00 178.44 179.23 1id1 h VAL 150 N -0.03 1.12 -0.88 1.05 2.07 -1.12 -1.89 116.25 116.56 1id1 h VAL 150 Ca -0.00 -0.35 0.09 0.00 0.82 0.00 0.00 66.70 67.25 1id1 h VAL 150 Cb 0.03 -0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.73 1id1 h VAL 150 CO 0.00 0.19 0.57 -1.28 0.02 0.00 0.00 177.57 177.07 1id1 h SER 151 N 1.03 0.81 0.26 0.57 0.87 -0.95 0.43 113.55 116.58 1id1 h SER 151 Ca 0.34 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.88 1id1 h SER 151 Cb 0.03 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 1id1 h SER 151 CO -0.12 0.49 -0.18 0.24 -0.53 0.00 0.00 176.83 176.73 1id1 h MET 152 N 0.91 0.00 0.11 2.24 2.07 -0.86 -3.10 114.93 116.29 1id1 h MET 152 Ca 0.40 0.00 -0.34 0.00 -2.07 0.00 0.00 59.70 57.69 1id1 h MET 152 Cb 0.35 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.06 1id1 h MET 152 CO -0.16 0.18 -1.83 -0.07 1.07 0.00 0.00 176.91 176.10 1id1 h LEU 153 N 0.00 0.36 -9.67 1.22 3.38 -0.92 -3.47 115.31 106.21 1id1 h LEU 153 Ca -0.00 -0.70 -0.53 0.00 0.09 0.00 0.00 57.88 56.75 1id1 h LEU 153 Cb 0.36 -0.12 0.05 0.00 0.09 0.00 0.00 40.66 41.04 1id1 h LEU 153 CO 0.02 1.61 0.84 -0.76 0.09 0.00 0.00 178.44 180.24 1id1 s LEU 154 N -6.88 4.37 0.00 1.67 1.43 -0.15 -2.48 118.68 116.65 1id1 s LEU 154 Ca -0.16 2.65 0.27 0.00 -1.03 0.00 0.00 54.13 55.87 1id1 s LEU 154 Cb 0.07 -3.61 0.84 0.00 0.03 0.00 0.00 46.19 43.52 1id1 s LEU 154 CO 0.81 -0.79 1.63 -3.20 0.23 0.00 0.00 176.35 175.02