#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bf7 s LYS 2 N 0.00 4.48 0.27 3.17 1.02 -1.26 -4.41 119.74 123.01 3bf7 s LYS 2 Ca 0.00 2.01 0.06 0.00 0.02 0.00 0.00 55.97 58.06 3bf7 s LYS 2 Cb 0.00 -3.15 -0.03 0.00 -0.52 0.00 0.00 37.83 34.13 3bf7 s LYS 2 CO 0.00 -0.03 0.29 -0.51 -0.92 0.00 0.00 175.35 174.18 3bf7 s LEU 3 N -1.31 3.94 0.16 3.17 1.43 -1.26 -4.73 118.68 120.08 3bf7 s LEU 3 Ca 0.49 -0.19 -0.30 0.00 -1.03 0.00 0.00 54.13 53.09 3bf7 s LEU 3 Cb -0.36 -2.52 -0.07 0.00 0.03 0.00 0.00 46.19 43.27 3bf7 s LEU 3 CO 0.45 -0.14 1.13 0.21 0.23 0.00 0.00 176.35 178.23 3bf7 s ASN 4 N -3.94 7.20 0.09 2.29 3.04 -1.26 -4.93 114.94 117.42 3bf7 s ASN 4 Ca 0.36 2.11 -0.02 0.00 0.04 0.00 0.00 52.86 55.35 3bf7 s ASN 4 Cb -0.08 -2.60 -0.04 0.00 -1.54 0.00 0.00 41.25 36.99 3bf7 s ASN 4 CO 0.27 -0.29 0.03 0.27 -3.04 0.00 0.00 177.10 174.34 3bf7 s ILE 5 N -0.03 0.16 -0.19 -5.21 -0.00 -1.26 -1.25 121.20 113.42 3bf7 s ILE 5 Ca 0.51 -1.80 0.00 0.00 -0.00 0.00 0.00 60.65 59.36 3bf7 s ILE 5 Cb -0.30 -1.74 0.04 0.00 -0.00 0.00 0.00 42.46 40.46 3bf7 s ILE 5 CO 0.35 -0.73 -0.07 -0.60 -0.00 0.00 0.00 174.94 173.88 3bf7 s ARG 6 N -3.97 1.69 0.00 0.37 6.06 -0.09 -4.97 118.95 118.04 3bf7 s ARG 6 Ca 0.14 -0.69 0.03 0.00 -2.50 0.00 0.00 55.73 52.71 3bf7 s ARG 6 Cb 0.07 -2.23 -0.03 0.00 0.06 0.00 0.00 34.95 32.82 3bf7 s ARG 6 CO -0.05 -0.45 -0.06 0.00 -2.50 0.00 0.00 175.30 172.24 3bf7 s ALA 7 N 1.52 3.04 -0.04 6.12 0.00 -1.26 -1.01 121.76 130.12 3bf7 s ALA 7 Ca -0.01 -1.02 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 3bf7 s ALA 7 Cb -0.16 -1.15 0.03 0.00 0.00 0.00 0.00 23.12 21.84 3bf7 s ALA 7 CO -0.08 0.62 0.08 -1.14 0.00 0.00 0.00 175.76 175.24 3bf7 s GLN 8 N -1.43 0.03 0.32 0.00 0.74 -0.40 -5.00 119.66 113.92 3bf7 s GLN 8 Ca 0.17 0.24 -0.27 0.00 0.05 0.00 0.00 55.36 55.55 3bf7 s GLN 8 Cb -0.11 -0.18 -0.09 0.00 1.10 0.00 0.00 33.01 33.73 3bf7 s GLN 8 CO 0.08 -0.14 1.04 0.99 -0.55 0.00 0.00 175.29 176.71 3bf7 s THR 9 N 0.95 3.74 0.32 -0.34 2.01 -1.26 -0.76 115.64 120.30 3bf7 s THR 9 Ca -0.08 1.55 -0.29 0.00 0.31 0.00 0.00 61.69 63.19 3bf7 s THR 9 Cb -0.10 -3.91 -0.12 0.00 0.01 0.00 0.00 72.50 68.37 3bf7 s THR 9 CO -0.04 0.22 1.31 0.00 -0.69 0.00 0.00 174.62 175.42 3bf7 n ALA 10 N 0.69 1.25 0.44 7.40 0.00 -1.21 -4.86 120.51 124.22 3bf7 n ALA 10 Ca 0.01 0.37 0.13 0.00 0.00 0.00 0.00 53.44 53.95 3bf7 n ALA 10 Cb 0.47 -2.25 0.46 0.00 0.00 0.00 0.00 19.45 18.13 3bf7 n ALA 10 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3bf7 h GLN 11 N 2.85 0.00 -3.15 0.00 4.20 -1.09 -3.43 115.11 114.50 3bf7 h GLN 11 Ca -0.46 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.06 3bf7 h GLN 11 Cb 1.28 0.00 -0.28 0.00 0.30 0.00 0.00 27.48 28.78 3bf7 h GLN 11 CO 0.65 0.00 -0.49 -0.80 -0.67 0.00 0.00 178.83 177.52 3bf7 s ASN 12 N -4.71 -0.23 -0.17 1.46 0.01 -0.97 -5.02 114.94 105.31 3bf7 s ASN 12 Ca 0.06 0.45 -0.29 0.00 -0.71 0.00 0.00 52.86 52.38 3bf7 s ASN 12 Cb 0.10 0.40 -0.00 0.00 0.41 0.00 0.00 41.25 42.16 3bf7 s ASN 12 CO 0.50 -0.12 1.01 -1.10 -1.51 0.00 0.00 177.10 175.88 3bf7 s GLN 13 N 0.64 4.33 -0.01 -0.60 -1.52 -1.26 -4.45 119.66 116.79 3bf7 s GLN 13 Ca -0.04 1.34 0.01 0.00 -1.95 0.00 0.00 55.36 54.72 3bf7 s GLN 13 Cb -0.06 -3.59 0.02 0.00 -0.22 0.00 0.00 33.01 29.16 3bf7 s GLN 13 CO -0.04 -0.47 0.74 0.72 -0.25 0.00 0.00 175.29 176.00 3bf7 n HIS 14 N 5.68 0.00 -3.47 0.91 8.25 -1.26 -5.02 115.22 120.32 3bf7 n HIS 14 Ca 0.10 -0.18 -0.25 0.00 -0.26 0.00 0.00 57.72 57.13 3bf7 n HIS 14 Cb 0.47 -0.03 0.05 0.00 1.12 0.00 0.00 29.99 31.60 3bf7 n HIS 14 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3bf7 n ASN 15 N -0.22 -5.86 -4.89 0.41 2.85 -1.26 -4.99 115.26 101.30 3bf7 n ASN 15 Ca 0.01 -0.50 -0.28 0.00 -0.11 0.00 0.00 54.58 53.70 3bf7 n ASN 15 Cb 0.49 -4.67 -0.04 0.00 1.24 0.00 0.00 39.78 36.80 3bf7 n ASN 15 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 3bf7 s ASN 16 N -3.09 6.10 0.54 1.20 0.01 -1.26 -5.08 114.94 113.36 3bf7 s ASN 16 Ca 0.51 0.13 -0.20 0.00 -0.71 0.00 0.00 52.86 52.58 3bf7 s ASN 16 Cb -0.23 -1.79 -0.05 0.00 0.41 0.00 0.00 41.25 39.58 3bf7 s ASN 16 CO 0.62 0.11 1.18 -0.44 -1.51 0.00 0.00 177.10 177.06 3bf7 s SER 17 N -2.88 5.61 0.79 -1.22 0.01 -1.26 -4.80 113.70 109.94 3bf7 s SER 17 Ca 0.33 2.31 -0.11 0.00 1.31 0.00 0.00 55.95 59.79 3bf7 s SER 17 Cb -0.12 -2.59 0.07 0.00 0.21 0.00 0.00 66.02 63.59 3bf7 s SER 17 CO 0.27 -1.30 1.11 -2.16 0.41 0.00 0.00 173.24 171.57 3bf7 s PRO 18 N -3.16 2.08 -0.14 12.44 0.04 -1.26 -4.68 135.00 140.32 3bf7 s PRO 18 Ca 0.72 1.29 0.01 0.00 0.04 0.00 0.00 61.00 63.06 3bf7 s PRO 18 Cb -0.28 -1.87 -0.00 0.00 0.04 0.00 0.00 34.50 32.39 3bf7 s PRO 18 CO 0.32 -1.80 -0.17 0.42 0.04 0.00 0.00 177.00 175.81 3bf7 s ILE 19 N -2.76 2.56 -0.20 0.56 1.01 -0.27 -0.65 121.20 121.45 3bf7 s ILE 19 Ca 0.63 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 60.40 3bf7 s ILE 19 Cb -0.19 -2.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 3bf7 s ILE 19 CO 0.54 0.53 0.05 -0.69 0.00 0.00 0.00 174.94 175.37 3bf7 s VAL 20 N 0.65 4.44 -0.17 2.92 1.01 0.13 -0.89 120.40 128.50 3bf7 s VAL 20 Ca -0.09 -0.15 -0.06 0.00 0.00 0.00 0.00 61.98 61.69 3bf7 s VAL 20 Cb -0.16 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 3bf7 s VAL 20 CO 0.02 0.42 0.01 -0.76 0.00 0.00 0.00 175.10 174.79 3bf7 s LEU 21 N 0.87 3.55 -0.18 3.92 1.43 0.07 -1.07 118.68 127.27 3bf7 s LEU 21 Ca 0.03 -0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 3bf7 s LEU 21 Cb -0.14 -1.88 0.04 0.00 0.03 0.00 0.00 46.19 44.24 3bf7 s LEU 21 CO 0.02 0.18 -0.10 -0.69 0.23 0.00 0.00 176.35 175.99 3bf7 s VAL 22 N 0.34 1.49 1.06 -1.59 1.01 0.32 -2.47 120.40 120.56 3bf7 s VAL 22 Ca -0.00 -0.85 -0.16 0.00 0.00 0.00 0.00 61.98 60.97 3bf7 s VAL 22 Cb -0.13 -1.56 0.22 0.00 0.00 0.00 0.00 36.38 34.91 3bf7 s VAL 22 CO 0.01 0.20 1.16 -1.38 0.00 0.00 0.00 175.10 175.10 3bf7 s HIS 23 N 1.47 1.38 0.26 5.22 -3.43 -1.26 -1.00 115.29 117.93 3bf7 s HIS 23 Ca 0.00 0.59 0.04 0.00 -0.80 0.00 0.00 55.06 54.89 3bf7 s HIS 23 Cb -0.15 -3.56 0.04 0.00 -1.43 0.00 0.00 32.58 27.47 3bf7 s HIS 23 CO -0.08 -3.16 0.33 0.41 -2.00 0.00 0.00 174.74 170.24 3bf7 n GLY 24 N -1.87 2.13 3.65 -1.38 0.00 -1.15 -2.10 105.19 104.47 3bf7 n GLY 24 Ca 0.11 -2.18 -0.46 0.00 0.00 0.00 0.00 46.02 43.49 3bf7 n GLY 24 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3bf7 n LEU 25 N 0.00 2.82 0.00 0.99 7.94 -1.26 -1.05 117.00 126.44 3bf7 n LEU 25 Ca 0.06 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 56.09 3bf7 n LEU 25 Cb 0.27 -1.39 0.00 0.00 0.53 0.00 0.00 43.42 42.83 3bf7 n LEU 25 CO 0.17 -0.59 0.00 0.49 -1.11 0.00 0.00 177.39 176.35 3bf7 n PHE 26 N 2.11 0.00 -2.26 1.96 3.72 -1.26 -4.99 117.46 116.74 3bf7 n PHE 26 Ca 0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 3bf7 n PHE 26 Cb 0.30 -0.95 0.00 0.00 -0.94 0.00 0.00 39.48 37.88 3bf7 n PHE 26 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3bf7 n GLY 27 N -1.23 0.98 3.69 1.37 0.00 -0.21 -4.78 105.19 105.00 3bf7 n GLY 27 Ca 0.00 -1.98 -0.09 0.00 0.00 0.00 0.00 46.02 43.95 3bf7 n GLY 27 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bf7 s SER 28 N -1.00 -0.00 0.57 1.61 1.04 -1.26 -4.21 113.70 110.45 3bf7 s SER 28 Ca 0.00 -0.94 0.36 0.00 0.48 0.00 0.00 55.95 55.85 3bf7 s SER 28 Cb 0.00 0.68 1.96 0.00 0.10 0.00 0.00 66.02 68.76 3bf7 s SER 28 CO 0.00 -1.31 2.10 0.17 0.98 0.00 0.00 173.24 175.18 3bf7 h LEU 29 N 2.13 0.00 -0.39 2.42 8.10 -1.92 -0.63 115.31 125.02 3bf7 h LEU 29 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.74 3bf7 h LEU 29 Cb 1.25 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.47 3bf7 h LEU 29 CO 0.33 0.00 0.00 0.44 -4.11 0.00 0.00 178.44 175.10 3bf7 h ASP 30 N 0.00 0.00 -0.34 0.17 5.19 -1.96 -3.36 116.42 116.13 3bf7 h ASP 30 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3bf7 h ASP 30 Cb 0.12 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.62 3bf7 h ASP 30 CO 0.00 0.00 0.22 -1.13 -3.12 0.00 0.00 179.24 175.21 3bf7 h ASN 31 N 0.00 0.39 -0.55 6.45 -1.24 -1.52 -1.19 115.58 117.93 3bf7 h ASN 31 Ca 0.00 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.00 3bf7 h ASN 31 Cb 0.82 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.77 3bf7 h ASN 31 CO 0.00 0.29 0.00 0.18 -1.29 0.00 0.00 177.43 176.61 3bf7 n LEU 32 N -4.48 5.22 -0.03 0.34 4.32 -1.26 -4.51 117.00 116.61 3bf7 n LEU 32 Ca 0.02 -2.80 0.08 0.00 -0.02 0.00 0.00 56.01 53.29 3bf7 n LEU 32 Cb 0.07 -0.63 0.48 0.00 -1.62 0.00 0.00 43.42 41.71 3bf7 n LEU 32 CO 0.35 0.69 1.17 1.23 -1.22 0.00 0.00 177.39 179.61 3bf7 h GLY 33 N 3.72 0.54 1.64 -0.72 0.00 -1.39 -0.78 103.07 106.07 3bf7 h GLY 33 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.15 3bf7 h GLY 33 CO 0.38 0.14 0.23 -0.24 0.00 0.00 0.00 176.54 177.06 3bf7 h VAL 34 N 0.45 1.10 0.13 4.60 3.04 -1.79 0.58 116.25 124.35 3bf7 h VAL 34 Ca 0.20 -0.21 -0.28 0.00 -1.01 0.00 0.00 66.70 65.41 3bf7 h VAL 34 Cb 0.25 0.58 0.03 0.00 -2.01 0.00 0.00 31.29 30.13 3bf7 h VAL 34 CO -0.05 0.10 -1.16 -0.07 -1.01 0.00 0.00 177.57 175.39 3bf7 h LEU 35 N 0.50 0.80 -1.04 3.16 3.38 -1.52 -3.31 115.31 117.28 3bf7 h LEU 35 Ca 0.13 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 57.26 3bf7 h LEU 35 Cb -0.03 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 3bf7 h LEU 35 CO -0.03 1.56 0.60 0.00 0.09 0.00 0.00 178.44 180.67 3bf7 h ALA 36 N 0.25 1.29 0.00 1.53 0.00 -0.64 -1.02 119.26 120.68 3bf7 h ALA 36 Ca -0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3bf7 h ALA 36 Cb 1.85 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 3bf7 h ALA 36 CO 0.22 0.64 -0.05 0.00 0.00 0.00 0.00 179.25 180.06 3bf7 h ARG 37 N 1.28 0.00 0.06 0.00 3.08 -1.00 -0.67 114.38 117.14 3bf7 h ARG 37 Ca 0.34 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 60.07 3bf7 h ARG 37 Cb -0.11 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 3bf7 h ARG 37 CO -0.07 0.05 -1.77 -3.47 -1.07 0.00 0.00 179.97 173.64 3bf7 n ASP 38 N -3.94 2.00 0.28 7.04 -0.08 -0.88 -4.31 116.55 116.66 3bf7 n ASP 38 Ca -0.03 0.28 0.17 0.00 -1.51 0.00 0.00 54.79 53.71 3bf7 n ASP 38 Cb 0.13 -0.88 0.76 0.00 2.34 0.00 0.00 41.12 43.48 3bf7 n ASP 38 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 3bf7 h LEU 39 N -0.45 0.00 -0.09 -2.67 3.38 -1.02 -2.68 115.31 111.78 3bf7 h LEU 39 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 3bf7 h LEU 39 Cb 1.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.45 3bf7 h LEU 39 CO -0.08 0.03 0.00 0.55 0.09 0.00 0.00 178.44 179.03 3bf7 n VAL 40 N -3.17 0.87 0.11 1.22 3.14 -0.27 -1.57 118.33 118.65 3bf7 n VAL 40 Ca -0.00 0.21 0.03 0.00 -2.96 0.00 0.00 64.34 61.62 3bf7 n VAL 40 Cb 0.27 -0.96 0.41 0.00 -1.06 0.00 0.00 33.84 32.50 3bf7 n VAL 40 CO 0.00 0.00 0.00 0.78 -6.46 0.00 0.00 176.83 171.15 3bf7 h ASN 41 N 0.00 0.25 0.00 6.55 2.35 -1.71 -0.17 115.58 122.85 3bf7 h ASN 41 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 3bf7 h ASN 41 Cb 0.30 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.60 3bf7 h ASN 41 CO 0.00 0.36 -0.41 -0.90 -1.65 0.00 0.00 177.43 174.82 3bf7 n ASP 42 N -4.32 0.14 -3.80 5.81 5.75 -1.07 -2.30 116.55 116.76 3bf7 n ASP 42 Ca -0.00 -1.95 -0.12 0.00 -0.01 0.00 0.00 54.79 52.70 3bf7 n ASP 42 Cb 0.23 -0.19 -0.09 0.00 -1.03 0.00 0.00 41.12 40.04 3bf7 n ASP 42 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 3bf7 s HIS 43 N -0.17 -0.09 0.27 2.11 3.76 -0.61 -4.54 115.29 116.03 3bf7 s HIS 43 Ca 0.02 0.09 -0.29 0.00 -0.15 0.00 0.00 55.06 54.72 3bf7 s HIS 43 Cb 0.02 0.04 -0.09 0.00 1.11 0.00 0.00 32.58 33.65 3bf7 s HIS 43 CO 0.00 -0.36 1.00 -0.80 -0.85 0.00 0.00 174.74 173.73 3bf7 s ASN 44 N -1.40 7.46 0.02 1.40 0.01 -1.26 -3.35 114.94 117.81 3bf7 s ASN 44 Ca -0.14 2.05 0.09 0.00 -0.71 0.00 0.00 52.86 54.16 3bf7 s ASN 44 Cb -0.06 -2.61 -0.03 0.00 0.41 0.00 0.00 41.25 38.96 3bf7 s ASN 44 CO 0.03 0.01 -0.25 -0.63 -1.51 0.00 0.00 177.10 174.74 3bf7 s ILE 45 N -1.23 2.18 -0.17 0.60 -1.09 0.06 -1.11 121.20 120.44 3bf7 s ILE 45 Ca 0.44 -1.27 -0.01 0.00 -2.23 0.00 0.00 60.65 57.57 3bf7 s ILE 45 Cb -0.27 -1.82 0.05 0.00 -1.58 0.00 0.00 42.46 38.84 3bf7 s ILE 45 CO 0.34 0.44 -0.01 -0.63 -1.23 0.00 0.00 174.94 173.85 3bf7 s ILE 46 N -0.75 0.79 -0.25 2.92 1.09 -0.07 -1.28 121.20 123.66 3bf7 s ILE 46 Ca 0.11 -0.54 -0.09 0.00 -1.10 0.00 0.00 60.65 59.03 3bf7 s ILE 46 Cb -0.10 -1.11 -0.04 0.00 -1.06 0.00 0.00 42.46 40.14 3bf7 s ILE 46 CO 0.01 -0.02 0.12 -1.10 -0.10 0.00 0.00 174.94 173.86 3bf7 s GLN 47 N 1.76 3.87 0.18 2.79 -0.21 -0.18 -0.75 119.66 127.12 3bf7 s GLN 47 Ca -0.00 -0.37 0.07 0.00 0.02 0.00 0.00 55.36 55.08 3bf7 s GLN 47 Cb -0.16 -3.45 -0.04 0.00 1.00 0.00 0.00 33.01 30.36 3bf7 s GLN 47 CO -0.07 -0.07 0.03 0.14 -2.12 0.00 0.00 175.29 173.20 3bf7 s VAL 48 N 1.37 3.87 -0.25 1.09 -7.23 -1.03 -0.91 120.40 117.30 3bf7 s VAL 48 Ca 0.06 -1.38 -0.11 0.00 -1.81 0.00 0.00 61.98 58.75 3bf7 s VAL 48 Cb -0.15 -2.96 -0.05 0.00 0.56 0.00 0.00 36.38 33.79 3bf7 s VAL 48 CO 0.06 -0.12 0.16 -1.81 -0.31 0.00 0.00 175.10 173.08 3bf7 s ASP 49 N -3.02 6.06 0.69 4.85 1.01 -0.38 -3.76 116.67 122.12 3bf7 s ASP 49 Ca 0.28 0.07 -0.15 0.00 0.71 0.00 0.00 52.55 53.47 3bf7 s ASP 49 Cb -0.09 -2.10 0.02 0.00 1.01 0.00 0.00 42.92 41.75 3bf7 s ASP 49 CO 0.20 0.04 1.14 -0.69 0.21 0.00 0.00 175.17 176.06 3bf7 s VAL 50 N 1.24 2.93 0.49 -1.27 1.01 -1.26 -4.27 120.40 119.26 3bf7 s VAL 50 Ca 0.07 0.43 -0.22 0.00 0.00 0.00 0.00 61.98 62.26 3bf7 s VAL 50 Cb -0.14 -2.95 -0.09 0.00 0.00 0.00 0.00 36.38 33.20 3bf7 s VAL 50 CO 0.06 -0.27 0.95 -2.11 0.00 0.00 0.00 175.10 173.73 3bf7 n ARG 51 N -2.59 1.15 -1.12 2.72 1.85 -1.26 -1.43 116.66 115.98 3bf7 n ARG 51 Ca 0.11 0.42 -0.04 0.00 -1.00 0.00 0.00 57.85 57.34 3bf7 n ARG 51 Cb 0.51 -2.04 -0.02 0.00 -1.05 0.00 0.00 32.46 29.86 3bf7 n ARG 51 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3bf7 n ASN 52 N 0.16 -4.63 -4.23 2.89 5.03 -0.63 -4.99 115.26 108.87 3bf7 n ASN 52 Ca 0.11 0.11 -0.14 0.00 0.87 0.00 0.00 54.58 55.52 3bf7 n ASN 52 Cb 0.42 -2.50 -0.10 0.00 -1.02 0.00 0.00 39.78 36.58 3bf7 n ASN 52 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.26 174.43 3bf7 s HIS 53 N -1.78 1.19 0.00 3.10 3.76 -0.51 -0.98 115.29 120.06 3bf7 s HIS 53 Ca 0.00 -0.75 0.00 0.00 -0.15 0.00 0.00 55.06 54.16 3bf7 s HIS 53 Cb 0.00 -0.62 0.00 0.00 1.11 0.00 0.00 32.58 33.07 3bf7 s HIS 53 CO 0.00 0.04 0.00 0.41 -0.85 0.00 0.00 174.74 174.34 3bf7 n GLY 54 N -0.02 3.03 1.20 -2.22 0.00 -1.25 -1.63 105.19 104.30 3bf7 n GLY 54 Ca -0.12 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 45.91 3bf7 n GLY 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3bf7 n LEU 55 N 0.00 4.43 -4.89 0.99 4.77 -1.26 -4.62 117.00 116.43 3bf7 n LEU 55 Ca 0.00 -3.26 -0.29 0.00 -0.03 0.00 0.00 56.01 52.43 3bf7 n LEU 55 Cb 0.00 -0.61 0.03 0.00 -2.33 0.00 0.00 43.42 40.51 3bf7 n LEU 55 CO 0.00 0.85 0.68 -0.44 -1.33 0.00 0.00 177.39 177.15 3bf7 s SER 56 N -1.90 5.75 0.85 -1.43 0.01 -0.65 -4.68 113.70 111.65 3bf7 s SER 56 Ca 0.46 1.12 -0.12 0.00 1.31 0.00 0.00 55.95 58.72 3bf7 s SER 56 Cb 0.38 -2.06 0.11 0.00 0.21 0.00 0.00 66.02 64.66 3bf7 s SER 56 CO 0.08 -1.10 1.16 -2.84 0.41 0.00 0.00 173.24 170.95 3bf7 s PRO 57 N -5.20 1.46 -0.02 12.44 0.02 -1.26 -4.47 135.00 137.98 3bf7 s PRO 57 Ca 0.56 1.59 -0.03 0.00 0.02 0.00 0.00 61.00 63.13 3bf7 s PRO 57 Cb -0.11 -1.77 -0.04 0.00 0.02 0.00 0.00 34.50 32.60 3bf7 s PRO 57 CO 0.51 -2.31 0.19 1.03 -0.33 0.00 0.00 177.00 176.08 3bf7 s ARG 58 N -4.45 3.45 -0.21 5.54 3.00 -1.26 -1.60 118.95 123.42 3bf7 s ARG 58 Ca 0.69 -0.28 -0.16 0.00 0.00 0.00 0.00 55.73 55.97 3bf7 s ARG 58 Cb -0.24 -3.10 0.06 0.00 0.00 0.00 0.00 34.95 31.66 3bf7 s ARG 58 CO 0.54 0.68 0.55 -1.21 0.00 0.00 0.00 175.30 175.86 3bf7 s GLU 59 N -1.86 0.60 0.58 3.54 0.41 -1.26 -4.96 118.70 115.76 3bf7 s GLU 59 Ca 0.26 0.88 0.37 0.00 -0.41 0.00 0.00 54.97 56.08 3bf7 s GLU 59 Cb -0.13 0.19 1.74 0.00 -1.78 0.00 0.00 34.13 34.16 3bf7 s GLU 59 CO 0.17 -0.11 2.11 -1.35 -0.49 0.00 0.00 175.26 175.59 3bf7 h PRO 60 N 6.11 0.00 -5.95 0.39 0.11 -1.99 -3.43 132.00 127.25 3bf7 h PRO 60 Ca -0.31 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.24 3bf7 h PRO 60 Cb 1.19 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 3bf7 h PRO 60 CO 0.19 0.00 0.06 0.08 -0.21 0.00 0.00 178.00 178.12 3bf7 s VAL 61 N -3.83 5.06 -0.36 3.15 1.01 -1.26 -4.89 120.40 119.29 3bf7 s VAL 61 Ca -0.01 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.32 3bf7 s VAL 61 Cb 0.10 -4.00 0.14 0.00 0.00 0.00 0.00 36.38 32.63 3bf7 s VAL 61 CO 0.49 0.25 0.23 -0.32 0.00 0.00 0.00 175.10 175.74 3bf7 s MET 62 N 0.90 0.57 0.14 2.72 1.75 -1.26 -5.02 119.30 119.10 3bf7 s MET 62 Ca 0.35 -1.37 -0.01 0.00 -1.25 0.00 0.00 55.69 53.42 3bf7 s MET 62 Cb -0.17 -1.28 -0.04 0.00 2.84 0.00 0.00 34.83 36.18 3bf7 s MET 62 CO 0.16 -1.22 0.06 0.54 -0.65 0.00 0.00 175.02 173.90 3bf7 s ASN 63 N 1.01 0.36 0.24 1.11 2.20 -1.26 -4.56 114.94 114.04 3bf7 s ASN 63 Ca 0.19 -1.22 -0.00 0.00 -0.94 0.00 0.00 52.86 50.89 3bf7 s ASN 63 Cb -0.21 0.29 0.26 0.00 -2.00 0.00 0.00 41.25 39.59 3bf7 s ASN 63 CO -0.01 -0.72 1.62 1.88 -2.94 0.00 0.00 177.10 176.93 3bf7 h TYR 64 N 2.84 0.63 -0.56 1.54 0.05 -1.95 -1.93 116.97 117.58 3bf7 h TYR 64 Ca -0.35 -0.17 -0.03 0.00 0.05 0.00 0.00 58.73 58.22 3bf7 h TYR 64 Cb 1.20 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 38.78 3bf7 h TYR 64 CO 0.44 0.83 0.21 -1.35 -1.05 0.00 0.00 178.16 177.24 3bf7 h PRO 65 N 0.45 0.82 -0.37 4.88 0.11 -1.95 0.11 132.00 136.04 3bf7 h PRO 65 Ca 0.04 -0.13 -0.04 0.00 0.11 0.00 0.00 66.00 65.99 3bf7 h PRO 65 Cb 0.86 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.81 3bf7 h PRO 65 CO 0.07 0.68 0.08 0.00 -0.21 0.00 0.00 178.00 178.63 3bf7 h ALA 66 N 1.43 0.49 -0.24 -0.75 0.00 -1.93 -0.23 119.26 118.03 3bf7 h ALA 66 Ca 0.19 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3bf7 h ALA 66 Cb 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3bf7 h ALA 66 CO -0.02 0.17 -0.22 0.52 0.00 0.00 0.00 179.25 179.70 3bf7 h MET 67 N 0.45 0.44 -0.34 0.00 2.86 -0.93 -1.25 114.93 116.15 3bf7 h MET 67 Ca 0.12 -0.15 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 3bf7 h MET 67 Cb 0.32 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 3bf7 h MET 67 CO 0.00 0.63 -0.09 0.00 1.06 0.00 0.00 176.91 178.51 3bf7 h ALA 68 N 1.38 0.47 -0.70 6.32 0.00 -0.50 -2.68 119.26 123.56 3bf7 h ALA 68 Ca 0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3bf7 h ALA 68 Cb 0.60 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3bf7 h ALA 68 CO 0.04 0.32 0.37 0.37 0.00 0.00 0.00 179.25 180.36 3bf7 h GLN 69 N 0.45 0.96 -0.92 0.00 5.75 -0.73 -1.32 115.11 119.31 3bf7 h GLN 69 Ca 0.09 -0.11 0.04 0.00 -0.15 0.00 0.00 58.65 58.52 3bf7 h GLN 69 Cb 0.60 -0.19 -0.05 0.00 1.07 0.00 0.00 27.48 28.90 3bf7 h GLN 69 CO 0.04 0.71 0.60 -0.44 -2.65 0.00 0.00 178.83 177.09 3bf7 h ASP 70 N 0.97 0.98 -0.60 -0.69 3.45 -0.98 0.14 116.42 119.69 3bf7 h ASP 70 Ca 0.25 -0.01 -0.08 0.00 0.43 0.00 0.00 57.03 57.62 3bf7 h ASP 70 Cb 0.03 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.56 3bf7 h ASP 70 CO -0.04 0.66 0.07 -0.07 -1.57 0.00 0.00 179.24 178.29 3bf7 h LEU 71 N 1.13 0.98 -0.31 1.55 3.38 -0.94 -0.33 115.31 120.76 3bf7 h LEU 71 Ca 0.37 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 3bf7 h LEU 71 Cb 0.06 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3bf7 h LEU 71 CO -0.12 1.00 0.09 0.58 0.09 0.00 0.00 178.44 180.09 3bf7 h VAL 72 N 0.91 1.21 -0.47 1.22 2.07 -0.65 -0.76 116.25 119.78 3bf7 h VAL 72 Ca 0.18 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 3bf7 h VAL 72 Cb 0.46 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 3bf7 h VAL 72 CO 0.02 0.22 0.23 0.44 0.02 0.00 0.00 177.57 178.50 3bf7 h ASP 73 N 0.35 0.58 -0.28 0.57 3.32 -0.56 -0.23 116.42 120.16 3bf7 h ASP 73 Ca 0.10 -0.05 -0.16 0.00 0.02 0.00 0.00 57.03 56.95 3bf7 h ASP 73 Cb 0.25 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 3bf7 h ASP 73 CO -0.00 0.49 -0.44 0.74 -1.72 0.00 0.00 179.24 178.31 3bf7 h THR 74 N 0.65 1.29 -0.63 0.35 2.02 -0.75 -1.29 112.91 114.55 3bf7 h THR 74 Ca 0.16 -1.63 -0.04 0.00 0.77 0.00 0.00 66.41 65.67 3bf7 h THR 74 Cb 0.06 1.64 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 3bf7 h THR 74 CO -0.02 0.53 0.22 -0.07 0.37 0.00 0.00 175.52 176.54 3bf7 h LEU 75 N 0.55 0.90 -0.85 2.58 3.38 -0.61 -2.19 115.31 119.07 3bf7 h LEU 75 Ca 0.03 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 3bf7 h LEU 75 Cb 1.04 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 3bf7 h LEU 75 CO 0.10 0.85 0.43 0.44 0.09 0.00 0.00 178.44 180.35 3bf7 h ASP 76 N 0.89 1.09 -0.14 -0.43 3.32 -0.95 0.42 116.42 120.62 3bf7 h ASP 76 Ca 0.21 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 3bf7 h ASP 76 Cb 0.26 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3bf7 h ASP 76 CO -0.01 0.90 0.02 0.00 -1.72 0.00 0.00 179.24 178.43 3bf7 h ALA 77 N 1.23 1.60 -0.10 3.45 0.00 -0.84 -1.90 119.26 122.70 3bf7 h ALA 77 Ca 0.29 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3bf7 h ALA 77 Cb 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3bf7 h ALA 77 CO -0.04 0.30 0.00 1.28 0.00 0.00 0.00 179.25 180.79 3bf7 n LEU 78 N -4.36 2.59 -3.56 0.00 4.77 -0.86 -4.97 117.00 110.61 3bf7 n LEU 78 Ca 0.00 -0.93 -0.21 0.00 -0.03 0.00 0.00 56.01 54.84 3bf7 n LEU 78 Cb 0.18 -0.05 0.07 0.00 -2.33 0.00 0.00 43.42 41.30 3bf7 n LEU 78 CO 0.37 0.47 0.13 0.00 -1.33 0.00 0.00 177.39 177.03 3bf7 n GLN 79 N 0.99 -6.78 -3.85 3.23 6.02 -0.02 -4.99 117.38 111.98 3bf7 n GLN 79 Ca 0.16 0.79 -0.36 0.00 -0.01 0.00 0.00 57.00 57.59 3bf7 n GLN 79 Cb 0.52 -5.76 -0.13 0.00 1.02 0.00 0.00 30.24 25.89 3bf7 n GLN 79 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3bf7 s ILE 80 N -3.38 4.07 0.08 5.09 1.01 -0.29 -5.01 121.20 122.76 3bf7 s ILE 80 Ca 0.25 -0.26 -0.15 0.00 0.00 0.00 0.00 60.65 60.50 3bf7 s ILE 80 Cb -0.11 -2.88 -0.17 0.00 0.01 0.00 0.00 42.46 39.30 3bf7 s ILE 80 CO 0.75 0.37 1.26 0.44 0.00 0.00 0.00 174.94 177.77 3bf7 h ASP 81 N 8.05 0.84 -4.34 3.58 3.32 -1.94 -3.41 116.42 122.52 3bf7 h ASP 81 Ca -0.39 -0.65 -0.13 0.00 0.02 0.00 0.00 57.03 55.89 3bf7 h ASP 81 Cb 1.17 -0.25 -0.23 0.00 0.22 0.00 0.00 39.33 40.25 3bf7 h ASP 81 CO 0.59 1.36 -0.29 -0.75 -1.72 0.00 0.00 179.24 178.43 3bf7 s LYS 82 N -3.66 0.52 0.08 3.56 2.20 -1.26 -4.42 119.74 116.75 3bf7 s LYS 82 Ca -0.11 0.21 -0.07 0.00 -0.36 0.00 0.00 55.97 55.64 3bf7 s LYS 82 Cb 0.07 0.24 -0.01 0.00 -1.51 0.00 0.00 37.83 36.63 3bf7 s LYS 82 CO 0.88 -0.11 0.13 0.00 -0.36 0.00 0.00 175.35 175.90 3bf7 s ALA 83 N -0.45 -0.05 0.04 3.13 0.00 -0.50 -4.39 121.76 119.55 3bf7 s ALA 83 Ca -0.06 -0.75 -0.19 0.00 0.00 0.00 0.00 51.96 50.97 3bf7 s ALA 83 Cb -0.04 0.42 -0.06 0.00 0.00 0.00 0.00 23.12 23.44 3bf7 s ALA 83 CO 0.02 -0.47 0.55 0.99 0.00 0.00 0.00 175.76 176.85 3bf7 s THR 84 N -3.80 4.84 -0.07 0.00 2.01 0.17 -0.66 115.64 118.13 3bf7 s THR 84 Ca 0.05 1.15 0.05 0.00 0.31 0.00 0.00 61.69 63.25 3bf7 s THR 84 Cb 0.05 -3.87 -0.01 0.00 0.01 0.00 0.00 72.50 68.68 3bf7 s THR 84 CO -0.10 0.52 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.77 3bf7 s PHE 85 N -0.84 2.55 -0.15 4.92 0.08 -0.51 -0.69 117.98 123.33 3bf7 s PHE 85 Ca 0.28 -0.64 0.00 0.00 0.12 0.00 0.00 56.93 56.69 3bf7 s PHE 85 Cb -0.19 -1.65 0.03 0.00 -0.57 0.00 0.00 43.02 40.64 3bf7 s PHE 85 CO 0.17 -0.16 -0.10 0.42 -0.10 0.00 0.00 175.22 175.45 3bf7 s ILE 86 N -0.14 1.33 0.01 0.64 1.01 -0.23 -0.89 121.20 122.93 3bf7 s ILE 86 Ca -0.03 -0.58 0.03 0.00 0.00 0.00 0.00 60.65 60.07 3bf7 s ILE 86 Cb -0.14 -1.34 -0.01 0.00 0.01 0.00 0.00 42.46 40.97 3bf7 s ILE 86 CO 0.04 0.33 -0.11 -0.83 0.00 0.00 0.00 174.94 174.37 3bf7 s GLY 87 N 1.57 0.55 -0.20 6.18 0.00 -0.23 -0.52 107.32 114.66 3bf7 s GLY 87 Ca 0.03 -0.54 -0.08 0.00 0.00 0.00 0.00 44.72 44.13 3bf7 s GLY 87 CO -0.09 -0.48 0.09 -1.58 0.00 0.00 0.00 173.10 171.04 3bf7 s HIS 88 N -0.45 3.26 0.00 1.90 2.46 -0.17 -0.54 115.29 121.75 3bf7 s HIS 88 Ca 0.02 0.08 0.00 0.00 0.47 0.00 0.00 55.06 55.63 3bf7 s HIS 88 Cb -0.05 -2.15 0.00 0.00 -0.13 0.00 0.00 32.58 30.25 3bf7 s HIS 88 CO 0.00 0.09 0.00 0.45 -2.47 0.00 0.00 174.74 172.81 3bf7 n SER 89 N 3.86 0.00 -0.33 9.88 2.88 -0.61 -0.57 113.62 128.72 3bf7 n SER 89 Ca -0.16 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.52 3bf7 n SER 89 Cb 0.52 0.00 0.33 0.00 -0.75 0.00 0.00 64.21 64.31 3bf7 n SER 89 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 3bf7 h MET 90 N 0.00 0.59 -0.30 -1.46 1.85 -1.90 0.47 114.93 114.18 3bf7 h MET 90 Ca 0.00 -0.04 -0.06 0.00 -0.61 0.00 0.00 59.70 58.99 3bf7 h MET 90 Cb 0.00 -0.13 -0.02 0.00 0.43 0.00 0.00 31.60 31.88 3bf7 h MET 90 CO 0.00 0.39 -0.08 0.78 -0.40 0.00 0.00 176.91 177.61 3bf7 h GLY 91 N 0.61 0.52 1.29 1.39 0.00 -0.27 -0.79 103.07 105.82 3bf7 h GLY 91 Ca 0.59 -0.33 -0.12 0.00 0.00 0.00 0.00 47.33 47.46 3bf7 h GLY 91 CO -0.44 0.31 -0.25 -1.33 0.00 0.00 0.00 176.54 174.83 3bf7 h GLY 92 N 0.87 0.88 1.34 4.60 0.00 -0.07 -1.67 103.07 109.03 3bf7 h GLY 92 Ca 0.09 -0.77 -0.09 0.00 0.00 0.00 0.00 47.33 46.56 3bf7 h GLY 92 CO 0.02 0.71 -0.09 0.50 0.00 0.00 0.00 176.54 177.67 3bf7 h LYS 93 N 0.70 0.79 -0.57 4.80 1.57 -0.29 0.03 116.57 123.60 3bf7 h LYS 93 Ca 0.09 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.57 3bf7 h LYS 93 Cb 0.78 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 3bf7 h LYS 93 CO 0.06 0.86 0.19 0.00 -0.57 0.00 0.00 179.45 179.99 3bf7 h ALA 94 N 1.18 0.74 -0.56 3.86 0.00 -0.90 -0.03 119.26 123.54 3bf7 h ALA 94 Ca 0.12 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 3bf7 h ALA 94 Cb 0.57 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3bf7 h ALA 94 CO 0.04 0.40 -0.09 0.28 0.00 0.00 0.00 179.25 179.88 3bf7 h VAL 95 N 0.79 1.27 -0.61 0.00 2.07 -1.08 -1.47 116.25 117.23 3bf7 h VAL 95 Ca 0.18 -1.25 -0.08 0.00 0.82 0.00 0.00 66.70 66.37 3bf7 h VAL 95 Cb 0.27 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 3bf7 h VAL 95 CO -0.01 0.44 0.05 0.24 0.02 0.00 0.00 177.57 178.32 3bf7 h MET 96 N 0.93 1.02 0.00 1.57 2.07 -0.75 -2.32 114.93 117.45 3bf7 h MET 96 Ca 0.15 -0.29 -0.05 0.00 -2.07 0.00 0.00 59.70 57.44 3bf7 h MET 96 Cb 0.66 -0.11 -0.01 0.00 -1.87 0.00 0.00 31.60 30.27 3bf7 h MET 96 CO 0.05 0.97 -0.22 0.00 1.07 0.00 0.00 176.91 178.77 3bf7 h ALA 97 N 1.10 1.62 -0.01 6.32 0.00 -0.72 -2.16 119.26 125.41 3bf7 h ALA 97 Ca 0.18 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3bf7 h ALA 97 Cb 0.48 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3bf7 h ALA 97 CO 0.02 0.28 -0.14 1.25 0.00 0.00 0.00 179.25 180.66 3bf7 h LEU 98 N 0.00 0.01 -1.87 0.00 5.85 -0.69 -1.78 115.31 116.84 3bf7 h LEU 98 Ca -0.00 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 3bf7 h LEU 98 Cb 0.40 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 3bf7 h LEU 98 CO 0.03 0.15 -0.12 0.71 -0.34 0.00 0.00 178.44 178.87 3bf7 h THR 99 N 0.01 0.88 0.05 1.05 1.35 -1.34 0.39 112.91 115.30 3bf7 h THR 99 Ca 0.00 -0.44 -0.28 0.00 -0.55 0.00 0.00 66.41 65.14 3bf7 h THR 99 Cb 0.25 1.25 -0.03 0.00 -1.73 0.00 0.00 68.15 67.90 3bf7 h THR 99 CO 0.02 0.12 -1.45 0.00 -0.25 0.00 0.00 175.52 173.95 3bf7 h ALA 100 N 1.88 0.45 0.07 6.62 0.00 -1.45 -3.24 119.26 123.59 3bf7 h ALA 100 Ca -0.00 -1.17 -0.13 0.00 0.00 0.00 0.00 54.91 53.61 3bf7 h ALA 100 Cb 0.24 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3bf7 h ALA 100 CO 0.02 1.31 -0.62 1.25 0.00 0.00 0.00 179.25 181.21 3bf7 h LEU 101 N 0.03 0.23 -5.62 0.00 5.85 -1.07 -3.43 115.31 111.28 3bf7 h LEU 101 Ca -0.20 -0.92 -0.43 0.00 0.84 0.00 0.00 57.88 57.18 3bf7 h LEU 101 Cb 1.95 -0.07 -0.30 0.00 0.37 0.00 0.00 40.66 42.61 3bf7 h LEU 101 CO 0.13 1.28 -0.88 0.00 -0.34 0.00 0.00 178.44 178.63 3bf7 n ALA 102 N -2.76 0.98 -0.10 1.25 0.00 0.08 -5.00 120.51 114.97 3bf7 n ALA 102 Ca -0.16 -2.65 0.18 0.00 0.00 0.00 0.00 53.44 50.81 3bf7 n ALA 102 Cb 0.68 -1.01 0.59 0.00 0.00 0.00 0.00 19.45 19.71 3bf7 n ALA 102 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3bf7 h PRO 103 N 3.97 0.23 0.00 0.00 0.13 -1.61 -1.40 132.00 133.32 3bf7 h PRO 103 Ca -0.01 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 3bf7 h PRO 103 Cb 0.94 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.02 3bf7 h PRO 103 CO 0.41 0.15 0.00 -0.25 -0.23 0.00 0.00 178.00 178.08 3bf7 n ASP 104 N -4.43 0.13 -0.61 1.44 8.00 -1.26 -2.02 116.55 117.80 3bf7 n ASP 104 Ca 0.13 0.54 0.13 0.00 0.71 0.00 0.00 54.79 56.29 3bf7 n ASP 104 Cb 0.57 -0.56 0.32 0.00 -0.02 0.00 0.00 41.12 41.43 3bf7 n ASP 104 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3bf7 n ARG 105 N -1.65 1.75 -4.87 -1.24 5.12 -0.53 -4.71 116.66 110.53 3bf7 n ARG 105 Ca 0.03 -1.23 -0.33 0.00 -1.93 0.00 0.00 57.85 54.39 3bf7 n ARG 105 Cb 0.16 -1.47 -0.14 0.00 -1.16 0.00 0.00 32.46 29.85 3bf7 n ARG 105 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3bf7 s ILE 106 N -2.10 3.03 0.00 0.55 1.01 -0.86 -1.41 121.20 121.43 3bf7 s ILE 106 Ca 0.31 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 60.25 3bf7 s ILE 106 Cb 0.20 -2.21 0.00 0.00 0.01 0.00 0.00 42.46 40.46 3bf7 s ILE 106 CO 0.37 0.57 0.00 -0.67 0.00 0.00 0.00 174.94 175.21 3bf7 n ASP 107 N 2.69 0.00 -4.90 3.58 -0.08 0.17 -4.83 116.55 113.18 3bf7 n ASP 107 Ca -0.17 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 52.90 3bf7 n ASP 107 Cb 0.52 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.96 3bf7 n ASP 107 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 3bf7 s LYS 108 N 0.00 2.89 -0.02 -0.67 1.02 -1.26 -4.97 119.74 116.72 3bf7 s LYS 108 Ca 0.00 -1.17 -0.00 0.00 0.02 0.00 0.00 55.97 54.82 3bf7 s LYS 108 Cb 0.00 -2.60 0.02 0.00 -0.52 0.00 0.00 37.83 34.73 3bf7 s LYS 108 CO 0.00 0.12 0.04 -1.17 -0.92 0.00 0.00 175.35 173.42 3bf7 s LEU 109 N -4.04 1.23 -0.09 3.17 0.20 -1.26 -1.43 118.68 116.46 3bf7 s LEU 109 Ca 0.41 0.07 0.01 0.00 0.69 0.00 0.00 54.13 55.31 3bf7 s LEU 109 Cb -0.07 0.01 0.02 0.00 -0.43 0.00 0.00 46.19 45.72 3bf7 s LEU 109 CO 0.28 -0.10 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.43 3bf7 s VAL 110 N 0.85 1.15 -0.22 1.68 1.01 -0.06 -1.20 120.40 123.60 3bf7 s VAL 110 Ca -0.07 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.47 3bf7 s VAL 110 Cb -0.10 -1.09 0.03 0.00 0.00 0.00 0.00 36.38 35.23 3bf7 s VAL 110 CO -0.03 0.37 -0.12 0.00 0.00 0.00 0.00 175.10 175.32 3bf7 s ALA 111 N 1.04 2.53 -0.23 5.51 0.00 0.25 -1.07 121.76 129.80 3bf7 s ALA 111 Ca -0.07 -1.44 -0.15 0.00 0.00 0.00 0.00 51.96 50.29 3bf7 s ALA 111 Cb -0.15 -1.47 -0.04 0.00 0.00 0.00 0.00 23.12 21.46 3bf7 s ALA 111 CO -0.01 -0.72 0.39 0.42 0.00 0.00 0.00 175.76 175.83 3bf7 s ILE 112 N 1.26 5.19 -0.94 0.00 1.01 0.30 -1.27 121.20 126.75 3bf7 s ILE 112 Ca -0.00 0.65 -0.20 0.00 0.00 0.00 0.00 60.65 61.10 3bf7 s ILE 112 Cb -0.16 -3.71 0.03 0.00 0.01 0.00 0.00 42.46 38.62 3bf7 s ILE 112 CO -0.08 0.22 0.56 -0.67 0.00 0.00 0.00 174.94 174.97 3bf7 n ASP 113 N 4.78 -3.75 -3.54 3.58 4.64 0.37 -1.58 116.55 121.05 3bf7 n ASP 113 Ca -0.08 -1.04 -0.16 0.00 -1.38 0.00 0.00 54.79 52.12 3bf7 n ASP 113 Cb 0.51 -1.37 -0.06 0.00 -1.04 0.00 0.00 41.12 39.16 3bf7 n ASP 113 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 3bf7 s ILE 114 N -3.42 0.00 0.10 5.18 1.10 -1.26 -4.36 121.20 118.54 3bf7 s ILE 114 Ca 0.28 0.00 0.07 0.00 -0.51 0.00 0.00 60.65 60.49 3bf7 s ILE 114 Cb -0.16 -1.00 -0.03 0.00 0.15 0.00 0.00 42.46 41.42 3bf7 s ILE 114 CO 0.82 0.00 -0.17 0.00 -2.11 0.00 0.00 174.94 173.48 3bf7 s ALA 115 N -0.98 1.55 -1.40 1.50 0.00 -1.25 -4.84 121.76 116.34 3bf7 s ALA 115 Ca -0.08 -1.18 -0.15 0.00 0.00 0.00 0.00 51.96 50.55 3bf7 s ALA 115 Cb -0.01 -0.17 0.05 0.00 0.00 0.00 0.00 23.12 22.99 3bf7 s ALA 115 CO 0.07 0.25 2.08 -0.35 0.00 0.00 0.00 175.76 177.81 3bf7 n PRO 116 N 1.04 2.93 -3.85 0.00 -0.04 -1.26 -4.85 135.00 128.97 3bf7 n PRO 116 Ca -0.19 -2.79 -0.09 0.00 -0.04 0.00 0.00 63.50 60.38 3bf7 n PRO 116 Cb 0.54 -3.35 -0.08 0.00 -0.04 0.00 0.00 33.50 30.58 3bf7 n PRO 116 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3bf7 s VAL 117 N 3.56 0.13 -0.36 0.52 -7.23 -1.26 -4.72 120.40 111.04 3bf7 s VAL 117 Ca 0.49 -1.05 -0.21 0.00 -1.81 0.00 0.00 61.98 59.39 3bf7 s VAL 117 Cb 0.11 -1.17 0.01 0.00 0.56 0.00 0.00 36.38 35.88 3bf7 s VAL 117 CO -0.04 -0.58 0.69 -0.62 -0.31 0.00 0.00 175.10 174.24 3bf7 s ASP 118 N -2.56 6.47 0.33 4.85 -1.08 -1.26 -4.44 116.67 118.97 3bf7 s ASP 118 Ca 0.01 0.21 0.26 0.00 -0.52 0.00 0.00 52.55 52.51 3bf7 s ASP 118 Cb 0.03 -2.35 0.99 0.00 -1.46 0.00 0.00 42.92 40.13 3bf7 s ASP 118 CO -0.08 -0.64 1.78 1.88 0.52 0.00 0.00 175.17 178.62 3bf7 h TYR 119 N 8.48 0.00 -6.43 -5.34 0.05 -1.69 -3.47 116.97 108.57 3bf7 h TYR 119 Ca -0.26 0.00 -0.49 0.00 0.05 0.00 0.00 58.73 58.03 3bf7 h TYR 119 Cb 1.10 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 38.77 3bf7 h TYR 119 CO 0.76 0.00 -0.80 0.72 -1.05 0.00 0.00 178.16 177.80 3bf7 n HIS 120 N -2.49 -2.06 -3.83 4.88 8.25 -1.26 -4.97 115.22 113.74 3bf7 n HIS 120 Ca 0.03 0.86 -0.09 0.00 -0.26 0.00 0.00 57.72 58.25 3bf7 n HIS 120 Cb 0.30 -3.71 -0.06 0.00 1.12 0.00 0.00 29.99 27.64 3bf7 n HIS 120 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3bf7 s VAL 121 N -3.39 0.10 -0.26 1.59 -7.23 -1.26 -5.13 120.40 104.83 3bf7 s VAL 121 Ca 0.57 -1.09 -0.08 0.00 -1.81 0.00 0.00 61.98 59.58 3bf7 s VAL 121 Cb -0.30 -1.44 -0.03 0.00 0.56 0.00 0.00 36.38 35.18 3bf7 s VAL 121 CO 0.86 -0.47 0.09 -0.13 -0.31 0.00 0.00 175.10 175.15 3bf7 s ARG 122 N -3.88 3.64 0.00 4.82 0.52 -1.26 -4.96 118.95 117.83 3bf7 s ARG 122 Ca 0.08 -0.50 0.02 0.00 -0.52 0.00 0.00 55.73 54.81 3bf7 s ARG 122 Cb 0.04 -3.39 0.04 0.00 0.52 0.00 0.00 34.95 32.15 3bf7 s ARG 122 CO -0.08 -0.22 0.78 0.54 0.02 0.00 0.00 175.30 176.34 3bf7 n ARG 123 N 4.94 0.94 -0.18 3.54 1.74 -1.26 -4.75 116.66 121.64 3bf7 n ARG 123 Ca -0.16 -1.07 0.03 0.00 -0.77 0.00 0.00 57.85 55.89 3bf7 n ARG 123 Cb 0.51 -1.05 0.05 0.00 -1.02 0.00 0.00 32.46 30.95 3bf7 n ARG 123 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3bf7 n HIS 124 N -0.06 0.00 -0.34 -1.55 8.25 -1.26 -4.85 115.22 115.41 3bf7 n HIS 124 Ca 0.02 -0.43 -0.02 0.00 -0.26 0.00 0.00 57.72 57.02 3bf7 n HIS 124 Cb 0.16 -0.08 0.11 0.00 1.12 0.00 0.00 29.99 31.30 3bf7 n HIS 124 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3bf7 h ASP 125 N 0.00 1.01 0.17 0.41 3.32 -2.00 0.17 116.42 119.51 3bf7 h ASP 125 Ca 0.00 -0.02 -0.12 0.00 0.02 0.00 0.00 57.03 56.91 3bf7 h ASP 125 Cb 1.03 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 3bf7 h ASP 125 CO 0.00 0.72 -0.46 -0.33 -1.72 0.00 0.00 179.24 177.45 3bf7 h GLU 126 N 1.19 0.35 -0.33 3.56 5.08 -1.94 -0.65 114.58 121.83 3bf7 h GLU 126 Ca 0.35 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 3bf7 h GLU 126 Cb -0.07 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3bf7 h GLU 126 CO -0.09 0.74 -0.00 0.82 -1.00 0.00 0.00 179.01 179.47 3bf7 h ILE 127 N 0.28 1.26 -0.85 3.13 2.04 -1.73 -0.32 117.51 121.32 3bf7 h ILE 127 Ca 0.02 -0.97 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 3bf7 h ILE 127 Cb 0.91 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 38.18 3bf7 h ILE 127 CO 0.08 0.32 0.45 -0.26 0.00 0.00 0.00 178.15 178.73 3bf7 h PHE 128 N 0.40 1.17 -0.70 1.37 0.04 -0.77 -0.29 116.94 118.16 3bf7 h PHE 128 Ca 0.09 -0.04 -0.04 0.00 2.80 0.00 0.00 57.97 60.79 3bf7 h PHE 128 Cb 0.45 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.20 3bf7 h PHE 128 CO 0.04 0.82 0.28 0.00 -0.60 0.00 0.00 178.31 178.85 3bf7 h ALA 129 N 1.30 0.91 -0.40 2.45 0.00 -0.81 -0.48 119.26 122.23 3bf7 h ALA 129 Ca 0.30 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3bf7 h ALA 129 Cb 0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3bf7 h ALA 129 CO -0.04 0.53 0.04 0.00 0.00 0.00 0.00 179.25 179.78 3bf7 h ALA 130 N 1.13 0.53 -0.40 0.00 0.00 -0.55 -0.45 119.26 119.52 3bf7 h ALA 130 Ca 0.23 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3bf7 h ALA 130 Cb 0.21 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3bf7 h ALA 130 CO -0.02 0.27 0.26 0.82 0.00 0.00 0.00 179.25 180.58 3bf7 h ILE 131 N 0.52 1.12 -0.34 0.00 2.04 -0.81 -1.72 117.51 118.30 3bf7 h ILE 131 Ca 0.12 -0.24 -0.10 0.00 1.00 0.00 0.00 64.86 65.64 3bf7 h ILE 131 Cb 0.41 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3bf7 h ILE 131 CO 0.01 0.11 -0.20 -1.13 0.00 0.00 0.00 178.15 176.95 3bf7 h ASN 132 N 0.54 0.65 -0.77 1.72 -0.73 -0.96 -2.23 115.58 113.80 3bf7 h ASN 132 Ca 0.15 -0.22 -0.05 0.00 1.87 0.00 0.00 56.30 58.05 3bf7 h ASN 132 Cb -0.04 -0.18 -0.03 0.00 0.27 0.00 0.00 38.32 38.34 3bf7 h ASN 132 CO -0.03 0.85 0.27 0.00 -0.37 0.00 0.00 177.43 178.15 3bf7 h ALA 133 N 1.20 1.02 -0.36 1.57 0.00 -0.76 -0.45 119.26 121.48 3bf7 h ALA 133 Ca 0.09 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3bf7 h ALA 133 Cb 0.66 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3bf7 h ALA 133 CO 0.05 0.67 0.12 0.28 0.00 0.00 0.00 179.25 180.37 3bf7 h VAL 134 N 1.14 1.20 -0.66 0.00 2.07 -1.05 -1.87 116.25 117.09 3bf7 h VAL 134 Ca 0.25 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 3bf7 h VAL 134 Cb 0.27 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 3bf7 h VAL 134 CO -0.01 0.23 0.29 0.28 0.02 0.00 0.00 177.57 178.37 3bf7 h SER 135 N 0.43 0.86 1.17 0.57 0.02 -1.02 -2.58 113.55 113.00 3bf7 h SER 135 Ca 0.12 -0.10 -0.06 0.00 -0.84 0.00 0.00 61.79 60.90 3bf7 h SER 135 Cb 0.23 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 3bf7 h SER 135 CO -0.01 0.75 -0.28 -0.33 -1.14 0.00 0.00 176.83 175.82 3bf7 h GLU 136 N 0.94 0.00 0.00 3.45 4.39 -0.90 -3.45 114.58 119.00 3bf7 h GLU 136 Ca 0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.93 3bf7 h GLU 136 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 3bf7 h GLU 136 CO -0.02 0.28 0.00 -1.13 -1.16 0.00 0.00 179.01 176.98 3bf7 n SER 137 N -3.32 -0.11 -0.93 1.42 3.41 -0.72 -4.98 113.62 108.38 3bf7 n SER 137 Ca 0.01 -0.83 0.07 0.00 -0.26 0.00 0.00 58.87 57.86 3bf7 n SER 137 Cb 0.52 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.71 3bf7 n SER 137 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3bf7 n ASP 138 N -2.67 3.67 -4.71 4.04 8.00 -1.26 -5.01 116.55 118.60 3bf7 n ASP 138 Ca 0.00 -2.46 -0.43 0.00 0.71 0.00 0.00 54.79 52.61 3bf7 n ASP 138 Cb 0.00 -0.42 -0.03 0.00 -0.02 0.00 0.00 41.12 40.66 3bf7 n ASP 138 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3bf7 n ALA 139 N 0.29 2.19 -0.01 2.24 0.00 -1.26 -4.90 120.51 119.06 3bf7 n ALA 139 Ca 0.18 0.40 -0.01 0.00 0.00 0.00 0.00 53.44 54.02 3bf7 n ALA 139 Cb 0.69 -2.43 -0.01 0.00 0.00 0.00 0.00 19.45 17.70 3bf7 n ALA 139 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3bf7 n GLN 140 N 2.98 1.81 -3.53 0.00 1.13 -1.26 -4.81 117.38 113.70 3bf7 n GLN 140 Ca 0.13 0.00 -0.19 0.00 -1.94 0.00 0.00 57.00 55.00 3bf7 n GLN 140 Cb 0.34 -1.03 -0.01 0.00 0.11 0.00 0.00 30.24 29.65 3bf7 n GLN 140 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3bf7 s THR 141 N -2.03 4.11 0.34 5.09 -4.23 -1.26 -3.14 115.64 114.52 3bf7 s THR 141 Ca -0.01 -1.03 0.08 0.00 -1.18 0.00 0.00 61.69 59.55 3bf7 s THR 141 Cb 0.00 -3.42 0.09 0.00 1.34 0.00 0.00 72.50 70.52 3bf7 s THR 141 CO 0.04 -0.17 1.80 0.03 -0.54 0.00 0.00 174.62 175.78 3bf7 h ARG 142 N 0.94 0.24 -0.41 3.99 3.08 -1.95 -1.24 114.38 119.03 3bf7 h ARG 142 Ca -0.46 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 59.47 3bf7 h ARG 142 Cb 1.25 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 3bf7 h ARG 142 CO 0.54 0.51 0.11 0.37 -1.07 0.00 0.00 179.97 180.42 3bf7 h GLN 143 N 0.22 0.66 -0.53 0.04 4.15 -1.99 0.22 115.11 117.87 3bf7 h GLN 143 Ca 0.03 -0.16 -0.09 0.00 0.77 0.00 0.00 58.65 59.20 3bf7 h GLN 143 Cb 0.61 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.19 3bf7 h GLN 143 CO 0.04 0.67 -0.04 1.96 -1.93 0.00 0.00 178.83 179.54 3bf7 h GLN 144 N 0.53 0.96 -0.56 1.69 4.20 -1.90 -2.66 115.11 117.37 3bf7 h GLN 144 Ca 0.13 -0.33 -0.05 0.00 0.06 0.00 0.00 58.65 58.46 3bf7 h GLN 144 Cb 0.31 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 3bf7 h GLN 144 CO 0.00 0.99 0.15 0.00 -0.67 0.00 0.00 178.83 179.30 3bf7 h ALA 145 N 0.94 0.74 -0.85 3.87 0.00 -0.98 -2.91 119.26 120.07 3bf7 h ALA 145 Ca 0.15 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.88 3bf7 h ALA 145 Cb 0.58 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 3bf7 h ALA 145 CO 0.03 0.44 0.54 0.00 0.00 0.00 0.00 179.25 180.26 3bf7 h ALA 146 N 1.03 1.13 -0.97 0.00 0.00 -0.42 -0.92 119.26 119.10 3bf7 h ALA 146 Ca 0.18 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.11 3bf7 h ALA 146 Cb 0.33 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 3bf7 h ALA 146 CO 0.00 0.34 0.63 0.00 0.00 0.00 0.00 179.25 180.22 3bf7 h ALA 147 N 1.37 1.32 -0.15 0.00 0.00 -1.28 -0.90 119.26 119.62 3bf7 h ALA 147 Ca 0.35 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 3bf7 h ALA 147 Cb 0.06 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3bf7 h ALA 147 CO -0.13 0.46 -0.35 0.82 0.00 0.00 0.00 179.25 180.05 3bf7 h ILE 148 N 1.18 1.35 -0.09 0.00 2.04 -1.30 -3.24 117.51 117.45 3bf7 h ILE 148 Ca 0.41 -1.62 -0.04 0.00 1.00 0.00 0.00 64.86 64.61 3bf7 h ILE 148 Cb 0.09 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 3bf7 h ILE 148 CO -0.15 0.49 -0.11 0.24 0.00 0.00 0.00 178.15 178.62 3bf7 h MET 149 N 0.14 0.14 0.00 2.37 2.86 -0.76 -1.43 114.93 118.24 3bf7 h MET 149 Ca -0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3bf7 h MET 149 Cb 0.96 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.59 3bf7 h MET 149 CO 0.08 0.26 0.00 0.54 1.06 0.00 0.00 176.91 178.84 3bf7 n ARG 150 N -4.34 0.09 0.00 1.72 1.74 -0.38 -0.56 116.66 114.93 3bf7 n ARG 150 Ca -0.01 0.39 0.13 0.00 -0.77 0.00 0.00 57.85 57.59 3bf7 n ARG 150 Cb 0.22 -1.69 0.47 0.00 -1.02 0.00 0.00 32.46 30.45 3bf7 n ARG 150 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3bf7 n GLN 151 N -1.85 0.01 -0.01 5.56 6.02 -0.54 -4.05 117.38 122.53 3bf7 n GLN 151 Ca 0.02 -0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.99 3bf7 n GLN 151 Cb 0.16 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.90 3bf7 n GLN 151 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3bf7 n HIS 152 N -1.49 0.00 -4.57 1.08 8.25 -0.26 -5.06 115.22 113.17 3bf7 n HIS 152 Ca 0.07 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.26 3bf7 n HIS 152 Cb 0.34 -0.10 -0.14 0.00 1.12 0.00 0.00 29.99 31.21 3bf7 n HIS 152 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3bf7 s LEU 153 N -4.46 2.23 0.00 2.41 1.43 0.28 -4.94 118.68 115.62 3bf7 s LEU 153 Ca -0.02 -0.62 0.05 0.00 -1.03 0.00 0.00 54.13 52.51 3bf7 s LEU 153 Cb 0.01 -1.07 0.13 0.00 0.03 0.00 0.00 46.19 45.28 3bf7 s LEU 153 CO 0.07 0.16 1.08 0.59 0.23 0.00 0.00 176.35 178.49 3bf7 n ASN 154 N 1.46 2.34 -4.26 2.29 4.13 -1.26 -4.31 115.26 115.65 3bf7 n ASN 154 Ca -0.18 -1.94 -0.44 0.00 1.68 0.00 0.00 54.58 53.70 3bf7 n ASN 154 Cb 0.53 -0.10 -0.06 0.00 -1.54 0.00 0.00 39.78 38.61 3bf7 n ASN 154 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3bf7 s GLU 155 N -0.96 2.82 0.36 3.52 8.01 -1.26 -4.94 118.70 126.24 3bf7 s GLU 155 Ca 0.10 -1.84 0.07 0.00 0.01 0.00 0.00 54.97 53.31 3bf7 s GLU 155 Cb 0.05 -4.14 0.77 0.00 -4.31 0.00 0.00 34.13 26.50 3bf7 s GLU 155 CO 0.07 -1.26 1.92 1.49 0.01 0.00 0.00 175.26 177.49 3bf7 h GLU 156 N 8.53 0.72 -0.84 1.61 4.57 -2.00 -1.73 114.58 125.44 3bf7 h GLU 156 Ca -0.21 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 57.90 3bf7 h GLU 156 Cb 1.08 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 29.47 3bf7 h GLU 156 CO 0.93 0.48 0.45 0.78 -1.18 0.00 0.00 179.01 180.46 3bf7 h GLY 157 N 0.74 1.26 0.97 1.92 0.00 -1.99 -0.82 103.07 105.15 3bf7 h GLY 157 Ca 0.37 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 3bf7 h GLY 157 CO -0.14 0.56 -0.05 -2.08 0.00 0.00 0.00 176.54 174.83 3bf7 h VAL 158 N 1.17 1.27 -0.24 4.60 2.07 -1.76 -1.52 116.25 121.84 3bf7 h VAL 158 Ca 0.29 -1.11 0.01 0.00 0.82 0.00 0.00 66.70 66.72 3bf7 h VAL 158 Cb 0.05 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 3bf7 h VAL 158 CO -0.05 0.38 0.12 0.40 0.02 0.00 0.00 177.57 178.44 3bf7 h ILE 159 N 0.59 1.00 -0.39 4.57 2.04 -1.02 -0.97 117.51 123.32 3bf7 h ILE 159 Ca 0.11 -0.09 -0.07 0.00 1.00 0.00 0.00 64.86 65.81 3bf7 h ILE 159 Cb 0.56 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 3bf7 h ILE 159 CO 0.03 0.05 -0.04 1.56 0.00 0.00 0.00 178.15 179.75 3bf7 h GLN 160 N 0.26 0.64 -0.06 2.37 1.08 -1.07 -1.02 115.11 117.31 3bf7 h GLN 160 Ca 0.10 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.13 3bf7 h GLN 160 Cb 0.02 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.37 3bf7 h GLN 160 CO -0.07 0.69 0.03 0.35 -0.95 0.00 0.00 178.83 178.89 3bf7 h PHE 161 N 0.60 0.09 -0.83 2.96 3.57 -0.87 -2.81 116.94 119.66 3bf7 h PHE 161 Ca 0.12 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 3bf7 h PHE 161 Cb 0.44 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.11 3bf7 h PHE 161 CO 0.02 0.16 0.49 -0.07 -2.23 0.00 0.00 178.31 176.68 3bf7 h LEU 162 N -0.01 1.01 -1.72 0.59 3.38 -0.91 -2.41 115.31 115.23 3bf7 h LEU 162 Ca 0.02 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3bf7 h LEU 162 Cb 0.11 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.60 3bf7 h LEU 162 CO -0.00 0.79 0.00 -0.07 0.09 0.00 0.00 178.44 179.24 3bf7 h LEU 163 N 1.14 0.00 -2.37 1.67 3.38 -0.96 -0.78 115.31 117.39 3bf7 h LEU 163 Ca 0.30 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 3bf7 h LEU 163 Cb -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3bf7 h LEU 163 CO -0.05 0.00 -0.04 0.11 0.09 0.00 0.00 178.44 178.55 3bf7 h LYS 164 N 0.00 0.00 -0.70 1.13 1.79 -1.18 -0.41 116.57 117.20 3bf7 h LYS 164 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3bf7 h LYS 164 Cb 0.15 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 3bf7 h LYS 164 CO 0.00 0.04 0.00 0.43 -1.08 0.00 0.00 179.45 178.84 3bf7 n SER 165 N -3.58 3.78 -4.37 0.86 7.64 -0.30 -4.81 113.62 112.85 3bf7 n SER 165 Ca -0.02 -2.03 -0.42 0.00 1.01 0.00 0.00 58.87 57.41 3bf7 n SER 165 Cb 0.14 -0.47 -0.10 0.00 -1.01 0.00 0.00 64.21 62.77 3bf7 n SER 165 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 3bf7 s PHE 166 N -1.11 3.26 -0.01 1.43 5.36 -0.17 -0.03 117.98 126.72 3bf7 s PHE 166 Ca 0.47 -1.00 0.02 0.00 -0.96 0.00 0.00 56.93 55.45 3bf7 s PHE 166 Cb 0.25 -2.81 -0.00 0.00 -0.34 0.00 0.00 43.02 40.12 3bf7 s PHE 166 CO 0.31 -0.73 -0.05 0.08 -1.46 0.00 0.00 175.22 173.38 3bf7 s VAL 167 N 1.58 0.40 -1.35 3.12 1.01 -0.16 -4.81 120.40 120.19 3bf7 s VAL 167 Ca 0.03 -0.21 -0.08 0.00 0.00 0.00 0.00 61.98 61.72 3bf7 s VAL 167 Cb -0.22 -0.35 0.06 0.00 0.00 0.00 0.00 36.38 35.88 3bf7 s VAL 167 CO 0.06 0.12 0.53 0.47 0.00 0.00 0.00 175.10 176.28 3bf7 n ASP 168 N 3.01 -4.26 -1.07 3.32 8.00 -1.26 -0.73 116.55 123.55 3bf7 n ASP 168 Ca -0.13 -0.38 -0.12 0.00 0.71 0.00 0.00 54.79 54.87 3bf7 n ASP 168 Cb 0.58 -3.50 -0.04 0.00 -0.02 0.00 0.00 41.12 38.14 3bf7 n ASP 168 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3bf7 n GLY 169 N -1.26 0.95 3.03 0.44 0.00 -1.19 -5.01 105.19 102.15 3bf7 n GLY 169 Ca -0.03 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.45 3bf7 n GLY 169 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3bf7 s GLU 170 N -3.46 0.44 0.03 1.61 0.41 0.09 -4.96 118.70 112.87 3bf7 s GLU 170 Ca 0.00 -0.74 -0.26 0.00 -0.41 0.00 0.00 54.97 53.57 3bf7 s GLU 170 Cb 0.00 -0.06 -0.05 0.00 -1.78 0.00 0.00 34.13 32.24 3bf7 s GLU 170 CO 0.00 -0.01 0.79 -1.58 -0.49 0.00 0.00 175.26 173.97 3bf7 s TRP 171 N -1.66 3.72 0.26 1.61 0.52 -1.26 -0.99 118.94 121.14 3bf7 s TRP 171 Ca -0.11 1.50 0.05 0.00 0.02 0.00 0.00 56.10 57.55 3bf7 s TRP 171 Cb -0.08 -2.87 0.35 0.00 -1.15 0.00 0.00 33.47 29.72 3bf7 s TRP 171 CO -0.01 0.22 1.64 0.00 0.02 0.00 0.00 176.95 178.81 3bf7 h ARG 172 N 5.89 0.29 -7.06 4.98 2.47 -0.77 -3.44 114.38 116.74 3bf7 h ARG 172 Ca -0.43 -0.16 -0.49 0.00 -1.26 0.00 0.00 59.98 57.64 3bf7 h ARG 172 Cb 1.21 0.01 0.02 0.00 -1.65 0.00 0.00 29.97 29.56 3bf7 h ARG 172 CO 0.72 0.71 0.25 -0.59 0.56 0.00 0.00 179.97 181.62 3bf7 s PHE 173 N -4.02 3.50 -1.08 3.04 -0.12 -1.26 -3.95 117.98 114.09 3bf7 s PHE 173 Ca -0.05 1.20 -0.19 0.00 -0.05 0.00 0.00 56.93 57.85 3bf7 s PHE 173 Cb 0.13 -2.59 0.11 0.00 -0.63 0.00 0.00 43.02 40.04 3bf7 s PHE 173 CO 0.79 -0.31 1.38 1.21 -0.05 0.00 0.00 175.22 178.24 3bf7 s ASN 174 N -3.41 6.73 0.15 1.98 3.84 -0.15 -4.92 114.94 119.16 3bf7 s ASN 174 Ca 0.54 -2.18 -0.19 0.00 0.21 0.00 0.00 52.86 51.23 3bf7 s ASN 174 Cb -0.10 -2.47 0.03 0.00 -0.55 0.00 0.00 41.25 38.16 3bf7 s ASN 174 CO 0.37 -1.12 1.67 0.58 -2.79 0.00 0.00 177.10 175.81 3bf7 h VAL 175 N 5.77 0.62 -0.89 -5.21 2.07 -1.93 -1.32 116.25 115.36 3bf7 h VAL 175 Ca 0.25 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.83 3bf7 h VAL 175 Cb 0.96 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 3bf7 h VAL 175 CO 1.28 0.00 0.58 -0.65 0.02 0.00 0.00 177.57 178.80 3bf7 h PRO 176 N -0.07 1.01 -0.14 1.57 0.11 -2.00 -1.14 132.00 131.34 3bf7 h PRO 176 Ca 0.14 -0.06 -0.21 0.00 0.11 0.00 0.00 66.00 65.98 3bf7 h PRO 176 Cb 0.29 -0.23 0.01 0.00 0.11 0.00 0.00 31.00 31.18 3bf7 h PRO 176 CO -0.33 0.67 -0.75 0.28 -0.21 0.00 0.00 178.00 177.66 3bf7 h VAL 177 N 1.04 1.29 -0.12 3.15 2.07 -1.87 -0.93 116.25 120.89 3bf7 h VAL 177 Ca 0.37 -1.96 -0.04 0.00 0.82 0.00 0.00 66.70 65.89 3bf7 h VAL 177 Cb 0.14 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 3bf7 h VAL 177 CO -0.13 0.62 -0.13 -0.07 0.02 0.00 0.00 177.57 177.88 3bf7 h LEU 178 N 0.47 0.17 0.07 2.57 3.38 -0.89 0.89 115.31 121.97 3bf7 h LEU 178 Ca -0.05 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 3bf7 h LEU 178 Cb 1.38 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.09 3bf7 h LEU 178 CO 0.15 0.33 -0.03 -0.25 0.09 0.00 0.00 178.44 178.73 3bf7 h TRP 179 N 0.17 -0.09 -1.01 1.13 2.91 -1.14 -1.86 115.95 116.07 3bf7 h TRP 179 Ca 0.04 -0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.10 3bf7 h TRP 179 Cb 0.35 0.03 -0.06 0.00 -0.51 0.00 0.00 29.16 28.96 3bf7 h TRP 179 CO 0.00 0.47 0.66 0.22 -1.03 0.00 0.00 178.44 178.76 3bf7 h ASP 180 N -0.75 1.08 -0.35 2.65 3.58 -0.91 -2.46 116.42 119.26 3bf7 h ASP 180 Ca -0.01 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.44 3bf7 h ASP 180 Cb 0.60 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.41 3bf7 h ASP 180 CO 0.02 0.73 0.00 0.00 -2.88 0.00 0.00 179.24 177.10 3bf7 n GLN 181 N -4.46 2.20 -0.27 0.28 1.13 0.29 -4.60 117.38 111.94 3bf7 n GLN 181 Ca 0.14 -1.82 0.08 0.00 -1.94 0.00 0.00 57.00 53.46 3bf7 n GLN 181 Cb 0.12 -1.45 0.21 0.00 0.11 0.00 0.00 30.24 29.23 3bf7 n GLN 181 CO 0.00 0.00 0.00 -0.92 -1.44 0.00 0.00 177.06 174.70 3bf7 h TYR 182 N 3.43 0.18 -0.38 1.08 3.20 -0.83 -0.08 116.97 123.57 3bf7 h TYR 182 Ca 0.00 0.05 0.09 0.00 3.14 0.00 0.00 58.73 62.01 3bf7 h TYR 182 Cb 0.76 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.06 3bf7 h TYR 182 CO 0.23 -0.18 0.27 -1.35 -1.64 0.00 0.00 178.16 175.48 3bf7 h PRO 183 N 0.19 0.13 0.00 1.82 0.11 -1.83 -0.46 132.00 131.96 3bf7 h PRO 183 Ca 0.46 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 66.45 3bf7 h PRO 183 Cb 0.85 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.91 3bf7 h PRO 183 CO -0.62 0.08 -0.52 0.45 -0.21 0.00 0.00 178.00 177.19 3bf7 h HIS 184 N 0.13 0.00 0.04 0.65 3.86 -1.31 -0.30 115.15 118.22 3bf7 h HIS 184 Ca 0.18 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.25 3bf7 h HIS 184 Cb 0.53 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.02 3bf7 h HIS 184 CO -0.00 0.52 -0.54 0.82 0.86 0.00 0.00 177.93 179.58 3bf7 h ILE 185 N 0.00 1.51 0.00 2.45 2.04 -0.83 -3.14 117.51 119.54 3bf7 h ILE 185 Ca -0.01 -2.21 0.00 0.00 1.00 0.00 0.00 64.86 63.65 3bf7 h ILE 185 Cb 1.33 2.88 0.00 0.00 -0.74 0.00 0.00 36.82 40.29 3bf7 h ILE 185 CO 0.07 0.62 0.00 -0.37 0.00 0.00 0.00 178.15 178.47 3bf7 h VAL 186 N -0.34 0.00 -1.77 1.67 -1.51 -1.39 -3.45 116.25 109.46 3bf7 h VAL 186 Ca -0.08 -0.56 0.00 0.00 -1.23 0.00 0.00 66.70 64.83 3bf7 h VAL 186 Cb 1.32 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 32.01 3bf7 h VAL 186 CO 0.10 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.05 3bf7 n GLY 187 N 1.07 -0.79 3.55 5.19 0.00 -0.12 -1.90 105.19 112.20 3bf7 n GLY 187 Ca 0.05 -1.69 -0.09 0.00 0.00 0.00 0.00 46.02 44.29 3bf7 n GLY 187 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3bf7 s TRP 188 N -0.49 -0.34 -0.25 1.61 -0.11 -1.26 -4.55 118.94 113.55 3bf7 s TRP 188 Ca 0.00 0.44 0.02 0.00 1.22 0.00 0.00 56.10 57.78 3bf7 s TRP 188 Cb 0.00 0.49 0.05 0.00 -1.50 0.00 0.00 33.47 32.50 3bf7 s TRP 188 CO 0.00 -0.40 -0.12 -2.00 -4.62 0.00 0.00 176.95 169.82 3bf7 s GLU 189 N -1.91 2.47 0.33 5.86 2.56 -1.26 -4.78 118.70 121.96 3bf7 s GLU 189 Ca 0.02 -1.20 -0.28 0.00 0.00 0.00 0.00 54.97 53.51 3bf7 s GLU 189 Cb -0.01 -2.85 -0.13 0.00 2.00 0.00 0.00 34.13 33.14 3bf7 s GLU 189 CO -0.03 -0.48 1.17 1.63 -0.56 0.00 0.00 175.26 176.99 3bf7 n LYS 190 N 4.51 1.79 -4.47 4.30 5.02 -1.26 -5.00 118.16 123.05 3bf7 n LYS 190 Ca -0.16 0.63 -0.25 0.00 -2.02 0.00 0.00 58.31 56.51 3bf7 n LYS 190 Cb 0.44 -2.13 -0.10 0.00 -0.02 0.00 0.00 35.03 33.23 3bf7 n LYS 190 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3bf7 s ILE 191 N -1.09 2.47 0.78 -0.18 -4.36 -1.26 -5.13 121.20 112.43 3bf7 s ILE 191 Ca 0.57 -2.24 -0.11 0.00 -0.26 0.00 0.00 60.65 58.62 3bf7 s ILE 191 Cb -0.62 -2.54 0.06 0.00 1.25 0.00 0.00 42.46 40.61 3bf7 s ILE 191 CO 0.61 -0.29 1.09 -2.84 0.24 0.00 0.00 174.94 173.75 3bf7 s PRO 192 N -3.59 2.23 0.36 0.37 0.02 -1.26 -4.72 135.00 128.41 3bf7 s PRO 192 Ca 0.32 1.18 -0.28 0.00 0.02 0.00 0.00 61.00 62.23 3bf7 s PRO 192 Cb -0.02 -1.89 -0.11 0.00 0.02 0.00 0.00 34.50 32.50 3bf7 s PRO 192 CO 0.16 -1.67 1.44 0.00 -0.33 0.00 0.00 177.00 176.60 3bf7 s ALA 193 N -2.89 3.56 -0.40 -1.55 0.00 -1.26 -4.85 121.76 114.37 3bf7 s ALA 193 Ca 0.61 1.47 -0.08 0.00 0.00 0.00 0.00 51.96 53.97 3bf7 s ALA 193 Cb -0.17 -3.57 0.07 0.00 0.00 0.00 0.00 23.12 19.45 3bf7 s ALA 193 CO 0.56 -0.92 0.22 -0.46 0.00 0.00 0.00 175.76 175.16 3bf7 s TRP 194 N -1.04 3.35 -1.58 0.00 -0.00 -0.29 -5.00 118.94 114.38 3bf7 s TRP 194 Ca 0.52 -1.63 -0.09 0.00 -0.00 0.00 0.00 56.10 54.90 3bf7 s TRP 194 Cb -0.44 -2.84 -0.05 0.00 -0.00 0.00 0.00 33.47 30.13 3bf7 s TRP 194 CO 0.59 -0.84 2.85 -0.25 -0.00 0.00 0.00 176.95 179.30 3bf7 n ASP 195 N 4.85 8.51 -3.81 5.86 8.00 -1.26 -4.24 116.55 134.46 3bf7 n ASP 195 Ca -0.10 -2.67 -0.12 0.00 0.71 0.00 0.00 54.79 52.62 3bf7 n ASP 195 Cb 0.43 -1.53 -0.09 0.00 -0.02 0.00 0.00 41.12 39.91 3bf7 n ASP 195 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 3bf7 s HIS 196 N 1.68 -0.06 0.25 1.24 3.76 -1.26 -5.03 115.29 115.87 3bf7 s HIS 196 Ca 0.67 0.03 -0.31 0.00 -0.15 0.00 0.00 55.06 55.29 3bf7 s HIS 196 Cb 0.18 0.03 -0.12 0.00 1.11 0.00 0.00 32.58 33.77 3bf7 s HIS 196 CO -0.07 -0.36 1.64 -2.30 -0.85 0.00 0.00 174.74 172.80 3bf7 n PRO 197 N 1.23 2.66 -4.24 8.40 -0.02 -1.26 -4.45 135.00 137.31 3bf7 n PRO 197 Ca -0.22 0.95 -0.18 0.00 -2.02 0.00 0.00 63.50 62.03 3bf7 n PRO 197 Cb 0.56 -2.75 -0.15 0.00 -0.02 0.00 0.00 33.50 31.14 3bf7 n PRO 197 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bf7 s ALA 198 N 0.54 0.63 -0.21 3.55 0.00 -1.12 -4.51 121.76 120.64 3bf7 s ALA 198 Ca 0.70 -0.23 -0.09 0.00 0.00 0.00 0.00 51.96 52.34 3bf7 s ALA 198 Cb -0.52 -0.24 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 3bf7 s ALA 198 CO 0.41 0.10 0.12 -1.17 0.00 0.00 0.00 175.76 175.22 3bf7 s LEU 199 N 0.16 4.04 -0.12 0.00 2.96 -0.34 -0.50 118.68 124.89 3bf7 s LEU 199 Ca -0.02 0.14 0.00 0.00 -0.22 0.00 0.00 54.13 54.03 3bf7 s LEU 199 Cb -0.07 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 3bf7 s LEU 199 CO -0.00 0.14 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.67 3bf7 s PHE 200 N 0.61 2.79 -0.51 5.38 0.40 0.49 -0.58 117.98 126.57 3bf7 s PHE 200 Ca 0.06 -0.57 0.04 0.00 -0.60 0.00 0.00 56.93 55.86 3bf7 s PHE 200 Cb -0.12 -1.81 0.13 0.00 0.51 0.00 0.00 43.02 41.73 3bf7 s PHE 200 CO 0.01 -0.15 0.26 0.42 0.70 0.00 0.00 175.22 176.46 3bf7 s ILE 201 N 0.18 2.35 0.44 0.64 1.01 -0.40 -0.95 121.20 124.47 3bf7 s ILE 201 Ca -0.08 -3.18 -0.14 0.00 0.00 0.00 0.00 60.65 57.25 3bf7 s ILE 201 Cb -0.15 -2.64 -0.08 0.00 0.01 0.00 0.00 42.46 39.61 3bf7 s ILE 201 CO 0.05 -0.82 0.86 -2.84 0.00 0.00 0.00 174.94 172.19 3bf7 s PRO 202 N -0.18 3.90 -0.03 2.79 0.02 -1.23 -0.47 135.00 139.79 3bf7 s PRO 202 Ca 0.17 0.73 -0.21 0.00 0.02 0.00 0.00 61.00 61.71 3bf7 s PRO 202 Cb -0.25 -2.28 -0.05 0.00 0.02 0.00 0.00 34.50 31.94 3bf7 s PRO 202 CO -0.00 -0.11 0.60 0.20 -0.33 0.00 0.00 177.00 177.36 3bf7 s GLY 203 N -2.95 2.58 0.57 0.52 0.00 -1.26 -1.02 107.32 105.76 3bf7 s GLY 203 Ca 0.55 0.02 0.27 0.00 0.00 0.00 0.00 44.72 45.56 3bf7 s GLY 203 CO 0.28 0.83 2.22 -1.33 0.00 0.00 0.00 173.10 175.11 3bf7 h GLY 204 N 6.01 0.00 -3.35 0.20 0.00 -0.23 -2.05 103.07 103.65 3bf7 h GLY 204 Ca -0.44 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.45 3bf7 h GLY 204 CO 0.72 0.00 0.33 0.70 0.00 0.00 0.00 176.54 178.29 3bf7 n ASN 205 N -3.93 4.23 -4.08 0.19 3.02 0.63 -4.83 115.26 110.49 3bf7 n ASN 205 Ca -0.03 -3.72 -0.18 0.00 -0.03 0.00 0.00 54.58 50.62 3bf7 n ASN 205 Cb 0.10 -0.76 -0.13 0.00 -0.61 0.00 0.00 39.78 38.38 3bf7 n ASN 205 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3bf7 s SER 206 N -2.01 1.27 0.00 6.41 0.15 -0.77 -4.62 113.70 114.13 3bf7 s SER 206 Ca 0.54 -0.39 0.26 0.00 0.70 0.00 0.00 55.95 57.07 3bf7 s SER 206 Cb 0.46 -0.07 0.83 0.00 -1.71 0.00 0.00 66.02 65.53 3bf7 s SER 206 CO 0.04 0.00 1.62 -0.81 1.20 0.00 0.00 173.24 175.29 3bf7 n PRO 207 N 2.09 1.82 0.17 5.44 -0.04 -1.26 -4.45 135.00 138.78 3bf7 n PRO 207 Ca -0.18 -1.20 0.07 0.00 -0.04 0.00 0.00 63.50 62.16 3bf7 n PRO 207 Cb 0.55 -1.47 0.58 0.00 -0.04 0.00 0.00 33.50 33.13 3bf7 n PRO 207 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3bf7 h TYR 208 N 2.84 0.15 -0.54 0.54 0.05 -1.92 -3.12 116.97 114.97 3bf7 h TYR 208 Ca 0.00 0.00 -0.39 0.00 0.05 0.00 0.00 58.73 58.39 3bf7 h TYR 208 Cb 0.61 -0.05 -0.37 0.00 1.01 0.00 0.00 36.73 37.93 3bf7 h TYR 208 CO 0.02 0.09 -0.86 0.28 -1.05 0.00 0.00 178.16 176.65 3bf7 n VAL 209 N -4.51 2.08 -1.36 -2.88 0.31 -1.26 -3.77 118.33 106.93 3bf7 n VAL 209 Ca -0.01 -3.64 -0.29 0.00 -0.01 0.00 0.00 64.34 60.40 3bf7 n VAL 209 Cb 0.11 -0.36 0.17 0.00 -0.91 0.00 0.00 33.84 32.84 3bf7 n VAL 209 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3bf7 s SER 210 N -3.52 2.84 0.44 4.52 1.04 -1.18 -4.90 113.70 112.94 3bf7 s SER 210 Ca 0.43 0.98 0.21 0.00 0.48 0.00 0.00 55.95 58.05 3bf7 s SER 210 Cb 0.38 -1.55 1.17 0.00 0.10 0.00 0.00 66.02 66.13 3bf7 s SER 210 CO -0.00 -2.97 1.84 -0.08 0.98 0.00 0.00 173.24 173.01 3bf7 h GLU 211 N -1.79 0.31 0.00 4.02 4.57 -1.98 -1.96 114.58 117.75 3bf7 h GLU 211 Ca -0.52 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.64 3bf7 h GLU 211 Cb 1.33 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 3bf7 h GLU 211 CO 0.57 0.21 0.00 0.00 -1.18 0.00 0.00 179.01 178.60 3bf7 n GLN 212 N -4.48 0.06 0.00 1.92 0.00 -1.26 -1.74 117.38 111.88 3bf7 n GLN 212 Ca 0.20 0.42 0.07 0.00 0.00 0.00 0.00 57.00 57.69 3bf7 n GLN 212 Cb 0.80 -1.65 0.02 0.00 0.00 0.00 0.00 30.24 29.40 3bf7 n GLN 212 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 3bf7 n TYR 213 N -1.78 0.00 -0.23 2.61 4.01 -0.74 -4.67 117.16 116.36 3bf7 n TYR 213 Ca 0.01 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.70 3bf7 n TYR 213 Cb 0.12 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.19 3bf7 n TYR 213 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3bf7 h ARG 214 N 2.04 0.87 -0.22 -0.72 2.43 -1.40 -0.72 114.38 116.66 3bf7 h ARG 214 Ca 0.00 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3bf7 h ARG 214 Cb 0.53 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 3bf7 h ARG 214 CO 0.00 0.58 0.12 -0.44 -1.51 0.00 0.00 179.97 178.72 3bf7 h ASP 215 N 0.89 0.18 -0.36 -3.80 3.32 -1.83 -0.57 116.42 114.26 3bf7 h ASP 215 Ca 0.24 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.22 3bf7 h ASP 215 Cb -0.09 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 3bf7 h ASP 215 CO -0.05 0.14 -0.05 0.44 -1.72 0.00 0.00 179.24 178.00 3bf7 h ASP 216 N 0.25 0.74 -0.15 6.45 3.45 -1.85 -1.41 116.42 123.90 3bf7 h ASP 216 Ca 0.09 -0.20 -0.00 0.00 0.43 0.00 0.00 57.03 57.35 3bf7 h ASP 216 Cb 0.01 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.58 3bf7 h ASP 216 CO -0.05 0.84 0.08 0.25 -1.57 0.00 0.00 179.24 178.78 3bf7 h LEU 217 N 0.70 0.19 -1.21 1.55 6.46 -0.66 -2.85 115.31 119.50 3bf7 h LEU 217 Ca 0.13 -0.11 -0.08 0.00 -0.12 0.00 0.00 57.88 57.70 3bf7 h LEU 217 Cb 0.51 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 3bf7 h LEU 217 CO 0.03 0.25 -0.36 -0.07 -0.62 0.00 0.00 178.44 177.66 3bf7 h LEU 218 N 0.13 0.00 -1.42 2.25 3.38 -0.97 0.17 115.31 118.85 3bf7 h LEU 218 Ca 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 3bf7 h LEU 218 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3bf7 h LEU 218 CO -0.01 0.36 -0.29 0.00 0.09 0.00 0.00 178.44 178.60 3bf7 h ALA 219 N 1.64 1.36 0.00 1.53 0.00 -1.04 -1.91 119.26 120.83 3bf7 h ALA 219 Ca -0.00 -0.26 -0.29 0.00 0.00 0.00 0.00 54.91 54.35 3bf7 h ALA 219 Cb 0.73 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 3bf7 h ALA 219 CO 0.05 0.36 -2.29 1.04 0.00 0.00 0.00 179.25 178.41 3bf7 n GLN 220 N -3.95 0.73 -3.46 0.00 6.02 -1.01 -4.19 117.38 111.51 3bf7 n GLN 220 Ca -0.02 -0.05 -0.26 0.00 -0.01 0.00 0.00 57.00 56.66 3bf7 n GLN 220 Cb 0.36 -1.51 -0.09 0.00 1.02 0.00 0.00 30.24 30.02 3bf7 n GLN 220 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3bf7 n PHE 221 N -2.64 1.21 -0.26 1.08 3.72 0.58 -1.14 117.46 120.02 3bf7 n PHE 221 Ca -0.27 -3.80 0.17 0.00 -0.05 0.00 0.00 57.45 53.51 3bf7 n PHE 221 Cb 1.03 -0.29 0.47 0.00 -0.94 0.00 0.00 39.48 39.75 3bf7 n PHE 221 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3bf7 h PRO 222 N 4.80 0.48 -1.00 -1.08 0.13 -1.52 -1.12 132.00 132.69 3bf7 h PRO 222 Ca 0.17 -0.03 -0.52 0.00 -0.87 0.00 0.00 66.00 64.75 3bf7 h PRO 222 Cb 0.81 -0.11 -0.30 0.00 0.13 0.00 0.00 31.00 31.53 3bf7 h PRO 222 CO 0.58 0.32 0.67 1.04 -0.23 0.00 0.00 178.00 180.38 3bf7 n GLN 223 N -4.55 2.27 -2.08 0.86 6.02 -1.26 -4.99 117.38 113.65 3bf7 n GLN 223 Ca 0.19 -2.97 -0.40 0.00 -0.01 0.00 0.00 57.00 53.82 3bf7 n GLN 223 Cb 0.64 -2.16 -0.01 0.00 1.02 0.00 0.00 30.24 29.73 3bf7 n GLN 223 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3bf7 s ALA 224 N -3.28 3.39 -0.10 -1.58 0.00 -0.43 -2.81 121.76 116.95 3bf7 s ALA 224 Ca 0.56 1.26 0.02 0.00 0.00 0.00 0.00 51.96 53.80 3bf7 s ALA 224 Cb 0.47 -3.49 0.01 0.00 0.00 0.00 0.00 23.12 20.12 3bf7 s ALA 224 CO 0.09 -0.74 -0.18 1.03 0.00 0.00 0.00 175.76 175.97 3bf7 s ARG 225 N -2.02 2.42 -0.12 0.00 0.52 0.34 -4.91 118.95 115.18 3bf7 s ARG 225 Ca 0.53 -0.65 -0.03 0.00 -0.52 0.00 0.00 55.73 55.07 3bf7 s ARG 225 Cb -0.39 -1.98 -0.03 0.00 0.52 0.00 0.00 34.95 33.07 3bf7 s ARG 225 CO 0.51 0.01 -0.03 0.00 0.02 0.00 0.00 175.30 175.81 3bf7 s ALA 226 N 0.78 3.10 -0.39 2.13 0.00 -1.26 -0.38 121.76 125.74 3bf7 s ALA 226 Ca -0.10 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.05 3bf7 s ALA 226 Cb -0.16 -1.50 0.12 0.00 0.00 0.00 0.00 23.12 21.58 3bf7 s ALA 226 CO 0.01 0.38 0.16 -1.58 0.00 0.00 0.00 175.76 174.73 3bf7 s HIS 227 N -0.18 2.28 0.05 0.00 2.46 -0.13 -4.97 115.29 114.81 3bf7 s HIS 227 Ca 0.04 -2.35 -0.30 0.00 0.47 0.00 0.00 55.06 52.91 3bf7 s HIS 227 Cb -0.13 -2.08 -0.05 0.00 -0.13 0.00 0.00 32.58 30.19 3bf7 s HIS 227 CO 0.02 -0.84 1.10 0.08 -2.47 0.00 0.00 174.74 172.63 3bf7 s VAL 228 N 0.82 4.35 -0.45 0.89 1.01 -1.26 -3.55 120.40 122.21 3bf7 s VAL 228 Ca 0.14 1.73 -0.17 0.00 0.00 0.00 0.00 61.98 63.68 3bf7 s VAL 228 Cb -0.21 -4.11 0.04 0.00 0.00 0.00 0.00 36.38 32.10 3bf7 s VAL 228 CO -0.10 0.16 0.45 -0.63 0.00 0.00 0.00 175.10 174.98 3bf7 s ILE 229 N 0.86 5.10 0.46 2.22 -1.09 -0.18 -4.89 121.20 123.67 3bf7 s ILE 229 Ca 0.55 -0.57 -0.25 0.00 -2.23 0.00 0.00 60.65 58.14 3bf7 s ILE 229 Cb -0.26 -4.10 -0.08 0.00 -1.58 0.00 0.00 42.46 36.44 3bf7 s ILE 229 CO 0.29 -0.52 1.44 0.00 -1.23 0.00 0.00 174.94 174.93 3bf7 s ALA 230 N 2.07 3.24 -1.42 9.38 0.00 -1.26 -0.23 121.76 133.54 3bf7 s ALA 230 Ca 0.10 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.55 3bf7 s ALA 230 Cb -0.19 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.33 3bf7 s ALA 230 CO 0.11 -1.23 0.00 0.41 0.00 0.00 0.00 175.76 175.05 3bf7 n GLY 231 N 0.57 0.46 3.25 0.00 0.00 -1.26 -4.81 105.19 103.40 3bf7 n GLY 231 Ca 0.05 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 3bf7 n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bf7 s ALA 232 N -2.68 1.85 0.59 4.61 0.00 -1.16 -4.89 121.76 120.08 3bf7 s ALA 232 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.96 3bf7 s ALA 232 Cb 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 23.12 22.68 3bf7 s ALA 232 CO 0.00 0.44 0.00 0.41 0.00 0.00 0.00 175.76 176.61 3bf7 n GLY 233 N 2.30 0.40 0.37 0.00 0.00 -1.26 -0.27 105.19 106.73 3bf7 n GLY 233 Ca -0.16 -1.79 -0.02 0.00 0.00 0.00 0.00 46.02 44.05 3bf7 n GLY 233 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3bf7 h HIS 234 N 0.00 1.21 -1.53 1.61 2.76 -1.92 -3.10 115.15 114.17 3bf7 h HIS 234 Ca 0.00 0.01 -0.76 0.00 -2.20 0.00 0.00 60.37 57.42 3bf7 h HIS 234 Cb 0.00 -0.40 -0.16 0.00 1.55 0.00 0.00 27.41 28.39 3bf7 h HIS 234 CO 0.00 0.78 1.96 0.91 -1.30 0.00 0.00 177.93 180.28 3bf7 n TRP 235 N -4.37 2.72 -0.26 5.26 8.01 -1.26 -4.74 117.44 122.80 3bf7 n TRP 235 Ca 0.11 -2.76 0.06 0.00 -1.31 0.00 0.00 57.50 53.60 3bf7 n TRP 235 Cb 0.04 -1.79 0.20 0.00 -2.01 0.00 0.00 31.31 27.74 3bf7 n TRP 235 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.69 176.96 3bf7 h VAL 236 N 3.27 0.60 0.00 -0.99 2.07 -1.91 -0.63 116.25 118.66 3bf7 h VAL 236 Ca 0.47 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.82 3bf7 h VAL 236 Cb 0.51 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 3bf7 h VAL 236 CO 1.53 0.07 -0.17 1.12 0.02 0.00 0.00 177.57 180.14 3bf7 h HIS 237 N 0.39 0.00 0.03 1.57 2.07 -1.87 0.64 115.15 118.00 3bf7 h HIS 237 Ca 0.43 0.00 -0.22 0.00 -2.85 0.00 0.00 60.37 57.73 3bf7 h HIS 237 Cb 0.69 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.65 3bf7 h HIS 237 CO -0.19 0.17 -1.01 0.00 -3.07 0.00 0.00 177.93 173.83 3bf7 h ALA 238 N 1.83 0.36 0.09 6.11 0.00 -1.48 -3.04 119.26 123.14 3bf7 h ALA 238 Ca -0.00 -0.84 -0.33 0.00 0.00 0.00 0.00 54.91 53.74 3bf7 h ALA 238 Cb 0.39 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3bf7 h ALA 238 CO 0.02 1.08 -1.76 0.93 0.00 0.00 0.00 179.25 179.52 3bf7 h GLU 239 N 0.04 0.20 -2.10 0.00 5.08 -1.11 -3.42 114.58 113.27 3bf7 h GLU 239 Ca -0.05 -0.34 -0.54 0.00 -1.00 0.00 0.00 59.36 57.43 3bf7 h GLU 239 Cb 1.72 0.13 -0.41 0.00 0.50 0.00 0.00 28.75 30.70 3bf7 h GLU 239 CO 0.15 1.16 -0.97 1.63 -1.00 0.00 0.00 179.01 179.98 3bf7 n LYS 240 N -3.77 1.68 -0.28 2.33 4.76 0.18 -4.95 118.16 118.11 3bf7 n LYS 240 Ca -0.31 -3.88 0.06 0.00 -2.87 0.00 0.00 58.31 51.31 3bf7 n LYS 240 Cb 0.94 -1.81 0.28 0.00 -1.84 0.00 0.00 35.03 32.61 3bf7 n LYS 240 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 3bf7 h PRO 241 N 3.34 0.89 -0.28 1.97 0.13 -1.68 -1.84 132.00 134.54 3bf7 h PRO 241 Ca 0.11 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 3bf7 h PRO 241 Cb 0.80 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.71 3bf7 h PRO 241 CO 0.61 0.59 0.14 0.38 -0.23 0.00 0.00 178.00 179.50 3bf7 h ASP 242 N 0.92 0.36 -0.69 1.44 2.03 -1.92 0.76 116.42 119.32 3bf7 h ASP 242 Ca 0.40 -0.11 -0.05 0.00 -0.73 0.00 0.00 57.03 56.55 3bf7 h ASP 242 Cb 0.34 -0.09 -0.03 0.00 -0.83 0.00 0.00 39.33 38.71 3bf7 h ASP 242 CO -0.16 0.36 0.26 0.00 -1.03 0.00 0.00 179.24 178.67 3bf7 h ALA 243 N 1.01 1.12 -0.37 4.15 0.00 -1.87 -0.16 119.26 123.14 3bf7 h ALA 243 Ca 0.10 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3bf7 h ALA 243 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3bf7 h ALA 243 CO -0.01 0.62 0.05 0.28 0.00 0.00 0.00 179.25 180.18 3bf7 h VAL 244 N 1.04 1.24 -0.41 0.00 2.07 -1.02 -2.38 116.25 116.80 3bf7 h VAL 244 Ca 0.24 -0.88 -0.07 0.00 0.82 0.00 0.00 66.70 66.80 3bf7 h VAL 244 Cb 0.23 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 3bf7 h VAL 244 CO -0.02 0.30 -0.04 -0.07 0.02 0.00 0.00 177.57 177.76 3bf7 h LEU 245 N 0.46 0.65 -0.71 2.57 3.38 -0.49 -0.28 115.31 120.90 3bf7 h LEU 245 Ca 0.11 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3bf7 h LEU 245 Cb 0.38 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3bf7 h LEU 245 CO 0.01 0.75 0.31 0.03 0.09 0.00 0.00 178.44 179.63 3bf7 h ARG 246 N 0.63 1.04 -0.34 1.13 3.08 -0.87 -0.07 114.38 118.99 3bf7 h ARG 246 Ca 0.12 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 3bf7 h ARG 246 Cb 0.45 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 3bf7 h ARG 246 CO 0.02 0.84 -0.03 0.00 -1.07 0.00 0.00 179.97 179.73 3bf7 h ALA 247 N 1.15 0.47 0.01 0.04 0.00 -1.01 -1.72 119.26 118.20 3bf7 h ALA 247 Ca 0.24 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3bf7 h ALA 247 Cb 0.17 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3bf7 h ALA 247 CO -0.02 0.26 -0.01 0.82 0.00 0.00 0.00 179.25 180.30 3bf7 h ILE 248 N 0.43 1.01 -0.21 0.00 2.04 -0.78 -2.40 117.51 117.60 3bf7 h ILE 248 Ca 0.09 -0.06 -0.08 0.00 1.00 0.00 0.00 64.86 65.82 3bf7 h ILE 248 Cb 0.51 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3bf7 h ILE 248 CO 0.02 0.01 -0.20 0.03 0.00 0.00 0.00 178.15 178.02 3bf7 h ARG 249 N -0.04 0.37 -0.65 2.37 3.08 -0.99 0.62 114.38 119.13 3bf7 h ARG 249 Ca -0.00 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 3bf7 h ARG 249 Cb 0.04 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3bf7 h ARG 249 CO 0.00 0.56 0.36 -0.09 -1.07 0.00 0.00 179.97 179.73 3bf7 h ARG 250 N 0.34 0.91 -0.22 0.04 2.43 -1.15 -0.34 114.38 116.39 3bf7 h ARG 250 Ca 0.06 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 3bf7 h ARG 250 Cb 0.55 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 3bf7 h ARG 250 CO 0.04 0.69 -0.08 -0.92 -1.51 0.00 0.00 179.97 178.18 3bf7 h TYR 251 N 0.89 0.50 -0.40 2.20 3.20 -0.91 -2.41 116.97 120.04 3bf7 h TYR 251 Ca 0.23 -0.12 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 3bf7 h TYR 251 Cb 0.04 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.17 3bf7 h TYR 251 CO -0.01 0.70 0.07 -0.07 -1.64 0.00 0.00 178.16 177.21 3bf7 h LEU 252 N 0.16 0.57 -0.60 2.82 3.38 -0.68 -1.89 115.31 119.07 3bf7 h LEU 252 Ca 0.05 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3bf7 h LEU 252 Cb 0.56 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3bf7 h LEU 252 CO 0.03 0.59 -0.10 0.78 0.09 0.00 0.00 178.44 179.83 3bf7 h ASN 253 N 0.59 0.00 -6.32 -0.43 2.35 -1.03 -3.47 115.58 107.27 3bf7 h ASN 253 Ca 0.13 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.51 3bf7 h ASN 253 Cb 0.27 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 38.52 3bf7 h ASN 253 CO 0.00 0.10 -0.59 -0.90 -1.65 0.00 0.00 177.43 174.38 3bf7 n ASP 254 N -3.16 0.41 0.00 5.81 5.68 -0.71 -5.10 116.55 119.49 3bf7 n ASP 254 Ca 0.02 -0.78 0.07 0.00 -0.50 0.00 0.00 54.79 53.60 3bf7 n ASP 254 Cb 0.47 -0.97 0.41 0.00 -1.14 0.00 0.00 41.12 39.89 3bf7 n ASP 254 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28