#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 4.64 0.35 3.17 1.02 -1.26 -4.42 119.74 123.24 3bf7 s LYS 2 Ca 0.00 1.51 0.03 0.00 0.02 0.00 0.00 55.97 57.53 3bf7 s LYS 2 Cb 0.00 -3.37 -0.02 0.00 -0.52 0.00 0.00 37.83 33.92 3bf7 s LYS 2 CO 0.00 0.12 0.53 -0.51 -0.92 0.00 0.00 175.35 174.57 3bf7 s LEU 3 N 0.17 3.96 0.16 3.17 1.43 -1.26 -4.73 118.68 121.57 3bf7 s LEU 3 Ca 0.49 0.18 -0.30 0.00 -1.03 0.00 0.00 54.13 53.47 3bf7 s LEU 3 Cb -0.24 -3.05 -0.07 0.00 0.03 0.00 0.00 46.19 42.86 3bf7 s LEU 3 CO 0.30 -0.39 1.11 0.21 0.23 0.00 0.00 176.35 177.81 3bf7 s ASN 4 N -4.11 7.24 0.13 2.29 2.47 -1.26 -4.94 114.94 116.76 3bf7 s ASN 4 Ca 0.42 2.07 -0.01 0.00 0.42 0.00 0.00 52.86 55.77 3bf7 s ASN 4 Cb -0.10 -2.60 -0.04 0.00 -1.45 0.00 0.00 41.25 37.06 3bf7 s ASN 4 CO 0.34 -0.25 0.05 0.27 -3.72 0.00 0.00 177.10 173.78 3bf7 s ILE 5 N -0.06 0.17 -0.14 -5.21 -4.36 -1.26 -1.44 121.20 108.90 3bf7 s ILE 5 Ca 0.51 -1.91 -0.02 0.00 -0.26 0.00 0.00 60.65 58.96 3bf7 s ILE 5 Cb -0.29 -2.03 0.04 0.00 1.25 0.00 0.00 42.46 41.43 3bf7 s ILE 5 CO 0.34 -0.49 0.00 -0.60 0.24 0.00 0.00 174.94 174.43 3bf7 s ARG 6 N -4.03 0.81 -0.01 0.37 3.52 -0.31 -4.98 118.95 114.32 3bf7 s ARG 6 Ca 0.23 -0.24 0.03 0.00 -0.13 0.00 0.00 55.73 55.62 3bf7 s ARG 6 Cb 0.07 -1.67 -0.03 0.00 -1.56 0.00 0.00 34.95 31.76 3bf7 s ARG 6 CO 0.01 -0.47 -0.10 0.00 -0.81 0.00 0.00 175.30 173.94 3bf7 s ALA 7 N 1.85 2.88 -0.03 6.12 0.00 -1.26 -1.04 121.76 130.29 3bf7 s ALA 7 Ca 0.02 -1.02 0.02 0.00 0.00 0.00 0.00 51.96 50.98 3bf7 s ALA 7 Cb -0.15 -1.06 0.01 0.00 0.00 0.00 0.00 23.12 21.92 3bf7 s ALA 7 CO -0.07 0.59 -0.08 -0.65 0.00 0.00 0.00 175.76 175.55 3bf7 s GLN 8 N -1.19 0.90 0.26 0.00 -0.21 -0.23 -4.99 119.66 114.20 3bf7 s GLN 8 Ca 0.15 -0.24 -0.26 0.00 0.02 0.00 0.00 55.36 55.02 3bf7 s GLN 8 Cb -0.11 -0.85 -0.09 0.00 1.00 0.00 0.00 33.01 32.96 3bf7 s GLN 8 CO 0.05 0.06 0.89 0.99 -2.12 0.00 0.00 175.29 175.16 3bf7 s THR 9 N 0.36 4.24 0.33 -0.19 2.01 -1.26 -0.34 115.64 120.79 3bf7 s THR 9 Ca -0.05 1.81 -0.28 0.00 0.31 0.00 0.00 61.69 63.47 3bf7 s THR 9 Cb -0.10 -4.10 -0.13 0.00 0.01 0.00 0.00 72.50 68.19 3bf7 s THR 9 CO 0.00 0.31 1.21 0.00 -0.69 0.00 0.00 174.62 175.46 3bf7 n ALA 10 N 1.00 0.88 0.20 7.40 0.00 -1.22 -4.87 120.51 123.90 3bf7 n ALA 10 Ca -0.01 0.37 0.07 0.00 0.00 0.00 0.00 53.44 53.87 3bf7 n ALA 10 Cb 0.49 -2.19 0.35 0.00 0.00 0.00 0.00 19.45 18.10 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 2.42 0.00 -3.64 0.00 4.20 -1.13 -3.45 115.11 113.51 3bf7 h GLN 11 Ca -0.44 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.10 3bf7 h GLN 11 Cb 1.30 0.00 -0.22 0.00 0.30 0.00 0.00 27.48 28.86 3bf7 h GLN 11 CO 0.62 0.31 -0.58 -0.80 -0.67 0.00 0.00 178.83 177.72 3bf7 s ASN 12 N -6.32 0.05 -0.22 1.46 -0.87 -0.84 -5.03 114.94 103.17 3bf7 s ASN 12 Ca 0.01 -0.18 -0.17 0.00 -1.57 0.00 0.00 52.86 50.95 3bf7 s ASN 12 Cb 0.10 0.18 -0.03 0.00 -0.02 0.00 0.00 41.25 41.47 3bf7 s ASN 12 CO 0.67 -0.26 0.45 -1.10 -2.57 0.00 0.00 177.10 174.29 3bf7 s GLN 13 N -1.03 4.14 -0.03 -0.60 -0.21 -1.26 -4.45 119.66 116.21 3bf7 s GLN 13 Ca -0.11 0.27 0.05 0.00 0.02 0.00 0.00 55.36 55.58 3bf7 s GLN 13 Cb -0.07 -3.58 0.07 0.00 1.00 0.00 0.00 33.01 30.44 3bf7 s GLN 13 CO 0.00 -0.16 1.00 0.72 -2.12 0.00 0.00 175.29 174.73 3bf7 n HIS 14 N 4.89 0.00 -3.77 0.91 8.25 -1.26 -5.02 115.22 119.22 3bf7 n HIS 14 Ca -0.06 -0.27 -0.26 0.00 -0.26 0.00 0.00 57.72 56.87 3bf7 n HIS 14 Cb 0.51 -0.07 0.04 0.00 1.12 0.00 0.00 29.99 31.58 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 -0.38 -3.96 -4.79 0.41 5.15 -1.26 -4.99 115.26 105.44 3bf7 n ASN 15 Ca 0.04 -0.74 -0.29 0.00 -0.60 0.00 0.00 54.58 52.99 3bf7 n ASN 15 Cb 0.66 -4.21 -0.06 0.00 -0.53 0.00 0.00 39.78 35.63 3bf7 n ASN 15 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3bf7 s ASN 16 N -3.66 5.57 0.56 1.20 0.01 -1.26 -5.09 114.94 112.27 3bf7 s ASN 16 Ca 0.44 -0.03 -0.19 0.00 -0.71 0.00 0.00 52.86 52.37 3bf7 s ASN 16 Cb -0.21 -1.50 -0.05 0.00 0.41 0.00 0.00 41.25 39.90 3bf7 s ASN 16 CO 0.80 0.14 1.14 -0.44 -1.51 0.00 0.00 177.10 177.23 3bf7 s SER 17 N -2.59 5.58 0.78 -1.22 0.01 -1.26 -4.79 113.70 110.21 3bf7 s SER 17 Ca 0.30 2.18 -0.12 0.00 1.31 0.00 0.00 55.95 59.62 3bf7 s SER 17 Cb -0.12 -2.58 0.07 0.00 0.21 0.00 0.00 66.02 63.60 3bf7 s SER 17 CO 0.23 -1.32 1.12 -2.16 0.41 0.00 0.00 173.24 171.52 3bf7 s PRO 18 N -3.39 2.01 -0.15 12.44 0.04 -1.26 -4.67 135.00 140.03 3bf7 s PRO 18 Ca 0.73 1.38 0.00 0.00 0.04 0.00 0.00 61.00 63.15 3bf7 s PRO 18 Cb -0.24 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 3bf7 s PRO 18 CO 0.29 -1.86 -0.15 0.42 0.04 0.00 0.00 177.00 175.75 3bf7 s ILE 19 N -2.63 2.77 -0.21 0.56 1.01 -0.19 -0.74 121.20 121.78 3bf7 s ILE 19 Ca 0.65 -0.74 -0.07 0.00 0.00 0.00 0.00 60.65 60.49 3bf7 s ILE 19 Cb -0.21 -2.16 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 3bf7 s ILE 19 CO 0.53 0.52 0.06 -0.69 0.00 0.00 0.00 174.94 175.35 3bf7 s VAL 20 N 0.65 4.49 -0.17 2.92 1.01 0.27 -0.94 120.40 128.63 3bf7 s VAL 20 Ca -0.08 -0.13 -0.06 0.00 0.00 0.00 0.00 61.98 61.71 3bf7 s VAL 20 Cb -0.16 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 3bf7 s VAL 20 CO 0.02 0.41 0.03 -0.76 0.00 0.00 0.00 175.10 174.80 3bf7 s LEU 21 N 0.94 3.63 -0.19 3.92 1.43 -0.01 -1.05 118.68 127.35 3bf7 s LEU 21 Ca 0.03 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.15 3bf7 s LEU 21 Cb -0.14 -1.91 0.04 0.00 0.03 0.00 0.00 46.19 44.22 3bf7 s LEU 21 CO 0.03 0.17 -0.09 -0.69 0.23 0.00 0.00 176.35 176.00 3bf7 s VAL 22 N 0.38 1.49 1.05 -1.59 1.01 0.26 -2.48 120.40 120.51 3bf7 s VAL 22 Ca 0.01 -0.89 -0.16 0.00 0.00 0.00 0.00 61.98 60.94 3bf7 s VAL 22 Cb -0.13 -1.59 0.22 0.00 0.00 0.00 0.00 36.38 34.88 3bf7 s VAL 22 CO 0.01 0.16 1.17 -1.38 0.00 0.00 0.00 175.10 175.06 3bf7 s HIS 23 N 1.47 1.43 0.18 5.22 -3.43 -1.26 -1.00 115.29 117.89 3bf7 s HIS 23 Ca -0.01 0.59 0.03 0.00 -0.80 0.00 0.00 55.06 54.87 3bf7 s HIS 23 Cb -0.16 -3.58 0.03 0.00 -1.43 0.00 0.00 32.58 27.44 3bf7 s HIS 23 CO -0.08 -3.11 0.23 0.41 -2.00 0.00 0.00 174.74 170.19 3bf7 n GLY 24 N -1.96 2.09 3.67 -1.38 0.00 -1.16 -2.33 105.19 104.12 3bf7 n GLY 24 Ca 0.11 -2.17 -0.45 0.00 0.00 0.00 0.00 46.02 43.52 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 3.14 0.00 0.99 7.94 -1.26 -1.10 117.00 126.71 3bf7 n LEU 25 Ca 0.04 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.08 3bf7 n LEU 25 Cb 0.18 -1.43 0.00 0.00 0.53 0.00 0.00 43.42 42.70 3bf7 n LEU 25 CO 0.12 -0.45 0.00 0.49 -1.11 0.00 0.00 177.39 176.44 3bf7 n PHE 26 N 2.08 0.00 -2.40 1.96 3.72 -1.26 -4.99 117.46 116.57 3bf7 n PHE 26 Ca 0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.52 3bf7 n PHE 26 Cb 0.31 -1.03 0.00 0.00 -0.94 0.00 0.00 39.48 37.82 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 -1.09 1.03 3.67 1.37 0.00 -0.26 -4.79 105.19 105.11 3bf7 n GLY 27 Ca 0.00 -1.99 -0.09 0.00 0.00 0.00 0.00 46.02 43.94 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 -0.04 0.61 1.61 1.04 -1.26 -4.20 113.70 110.47 3bf7 s SER 28 Ca 0.00 -0.92 0.38 0.00 0.48 0.00 0.00 55.95 55.89 3bf7 s SER 28 Cb 0.00 0.65 2.08 0.00 0.10 0.00 0.00 66.02 68.85 3bf7 s SER 28 CO 0.00 -1.25 2.17 0.17 0.98 0.00 0.00 173.24 175.30 3bf7 h LEU 29 N 2.16 0.00 -0.49 2.42 8.10 -1.93 -0.86 115.31 124.70 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 -0.37 0.17 3.45 -1.96 -3.35 116.42 114.35 3bf7 h ASP 30 Ca 0.00 0.00 0.02 0.00 0.43 0.00 0.00 57.03 57.48 3bf7 h ASP 30 Cb 0.13 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.88 3bf7 h ASP 30 CO 0.00 0.00 0.25 -1.13 -1.57 0.00 0.00 179.24 176.79 3bf7 h ASN 31 N 0.00 0.36 -0.59 6.45 -1.24 -1.56 -0.98 115.58 118.02 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 0.81 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.78 3bf7 h ASN 31 CO 0.00 0.25 0.00 0.18 -1.29 0.00 0.00 177.43 176.57 3bf7 n LEU 32 N -4.48 4.84 -0.10 0.34 4.77 -1.26 -4.52 117.00 116.59 3bf7 n LEU 32 Ca 0.03 -2.58 0.10 0.00 -0.03 0.00 0.00 56.01 53.54 3bf7 n LEU 32 Cb 0.13 -0.59 0.46 0.00 -2.33 0.00 0.00 43.42 41.10 3bf7 n LEU 32 CO 0.35 0.76 1.19 1.23 -1.33 0.00 0.00 177.39 179.59 3bf7 h GLY 33 N 3.82 0.67 1.65 -0.72 0.00 -1.35 -0.74 103.07 106.40 3bf7 h GLY 33 Ca 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 3bf7 h GLY 33 CO 0.28 0.13 0.20 -0.24 0.00 0.00 0.00 176.54 176.91 3bf7 h VAL 34 N 0.49 1.10 0.09 4.60 3.04 -1.79 0.70 116.25 124.48 3bf7 h VAL 34 Ca 0.28 -0.24 -0.26 0.00 -1.01 0.00 0.00 66.70 65.47 3bf7 h VAL 34 Cb 0.46 0.63 0.03 0.00 -2.01 0.00 0.00 31.29 30.39 3bf7 h VAL 34 CO -0.08 0.11 -1.08 -0.07 -1.01 0.00 0.00 177.57 175.44 3bf7 h LEU 35 N 0.47 0.79 -0.92 3.16 3.38 -1.51 -3.30 115.31 117.38 3bf7 h LEU 35 Ca 0.12 -0.82 0.02 0.00 0.09 0.00 0.00 57.88 57.29 3bf7 h LEU 35 Cb -0.01 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 3bf7 h LEU 35 CO -0.02 1.52 0.61 0.00 0.09 0.00 0.00 178.44 180.64 3bf7 h ALA 36 N 0.28 1.18 -0.02 1.53 0.00 -0.65 -0.55 119.26 121.03 3bf7 h ALA 36 Ca -0.16 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.70 3bf7 h ALA 36 Cb 1.77 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 19.20 3bf7 h ALA 36 CO 0.21 0.54 0.02 0.00 0.00 0.00 0.00 179.25 180.02 3bf7 h ARG 37 N 1.23 0.00 0.06 0.00 3.08 -0.97 -0.65 114.38 117.13 3bf7 h ARG 37 Ca 0.35 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 60.11 3bf7 h ARG 37 Cb -0.11 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 3bf7 h ARG 37 CO -0.09 0.00 -1.58 0.22 -1.07 0.00 0.00 179.97 177.46 3bf7 h ASP 38 N 0.00 0.19 0.74 7.04 1.82 -1.50 -3.39 116.42 121.32 3bf7 h ASP 38 Ca 0.01 -0.70 -0.01 0.00 -0.39 0.00 0.00 57.03 55.94 3bf7 h ASP 38 Cb 0.04 -0.06 -0.00 0.00 0.68 0.00 0.00 39.33 39.99 3bf7 h ASP 38 CO -0.00 1.65 -0.04 -0.07 -1.61 0.00 0.00 179.24 179.17 3bf7 h LEU 39 N -0.54 0.00 -0.25 2.28 3.38 -0.92 -2.80 115.31 116.47 3bf7 h LEU 39 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3bf7 h LEU 39 Cb 1.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.37 3bf7 h LEU 39 CO -0.08 0.04 0.00 0.55 0.09 0.00 0.00 178.44 179.04 3bf7 n VAL 40 N -3.19 0.88 -0.14 1.22 3.14 -0.27 -1.66 118.33 118.32 3bf7 n VAL 40 Ca -0.00 0.22 0.01 0.00 -2.96 0.00 0.00 64.34 61.60 3bf7 n VAL 40 Cb 0.27 -1.02 0.28 0.00 -1.06 0.00 0.00 33.84 32.30 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 0.73 0.00 6.55 -0.26 -1.73 -0.70 115.58 120.17 3bf7 h ASN 41 Ca 0.00 -0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.70 3bf7 h ASN 41 Cb 0.31 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.39 3bf7 h ASN 41 CO 0.00 0.58 -0.26 -0.90 -1.06 0.00 0.00 177.43 175.79 3bf7 n ASP 42 N -4.40 0.64 -3.84 5.81 5.75 -1.09 -1.98 116.55 117.45 3bf7 n ASP 42 Ca 0.06 -2.02 -0.12 0.00 -0.01 0.00 0.00 54.79 52.70 3bf7 n ASP 42 Cb 0.08 -0.19 -0.10 0.00 -1.03 0.00 0.00 41.12 39.89 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 -0.67 -0.03 0.26 2.11 3.76 -0.66 -4.53 115.29 115.53 3bf7 s HIS 43 Ca 0.07 0.01 -0.30 0.00 -0.15 0.00 0.00 55.06 54.69 3bf7 s HIS 43 Cb 0.06 -0.00 -0.09 0.00 1.11 0.00 0.00 32.58 33.65 3bf7 s HIS 43 CO 0.01 -0.30 1.05 -0.80 -0.85 0.00 0.00 174.74 173.85 3bf7 s ASN 44 N -1.28 7.38 0.02 1.40 0.02 -1.26 -3.41 114.94 117.81 3bf7 s ASN 44 Ca -0.13 2.17 0.08 0.00 -1.02 0.00 0.00 52.86 53.95 3bf7 s ASN 44 Cb -0.07 -2.62 -0.03 0.00 0.02 0.00 0.00 41.25 38.56 3bf7 s ASN 44 CO 0.02 -0.06 -0.24 -0.63 0.02 0.00 0.00 177.10 176.21 3bf7 s ILE 45 N -1.11 2.29 -0.18 0.60 -1.09 0.54 -1.02 121.20 121.24 3bf7 s ILE 45 Ca 0.44 -1.22 -0.02 0.00 -2.23 0.00 0.00 60.65 57.62 3bf7 s ILE 45 Cb -0.30 -1.88 0.05 0.00 -1.58 0.00 0.00 42.46 38.76 3bf7 s ILE 45 CO 0.38 0.45 0.02 -0.63 -1.23 0.00 0.00 174.94 173.93 3bf7 s ILE 46 N -0.76 0.59 -0.24 2.92 1.09 -0.11 -1.06 121.20 123.63 3bf7 s ILE 46 Ca 0.12 -0.50 -0.10 0.00 -1.10 0.00 0.00 60.65 59.07 3bf7 s ILE 46 Cb -0.10 -1.02 -0.04 0.00 -1.06 0.00 0.00 42.46 40.24 3bf7 s ILE 46 CO 0.01 -0.11 0.13 -1.10 -0.10 0.00 0.00 174.94 173.77 3bf7 s GLN 47 N 1.84 3.96 0.16 2.79 -0.21 -0.21 -0.83 119.66 127.17 3bf7 s GLN 47 Ca -0.00 -0.33 0.07 0.00 0.02 0.00 0.00 55.36 55.12 3bf7 s GLN 47 Cb -0.16 -3.47 -0.04 0.00 1.00 0.00 0.00 33.01 30.33 3bf7 s GLN 47 CO -0.07 0.00 -0.03 0.14 -2.12 0.00 0.00 175.29 173.21 3bf7 s VAL 48 N 1.18 3.58 -0.24 1.09 -7.23 -1.04 -1.16 120.40 116.59 3bf7 s VAL 48 Ca 0.06 -1.43 -0.12 0.00 -1.81 0.00 0.00 61.98 58.68 3bf7 s VAL 48 Cb -0.14 -2.78 -0.05 0.00 0.56 0.00 0.00 36.38 33.97 3bf7 s VAL 48 CO 0.05 -0.07 0.23 -1.81 -0.31 0.00 0.00 175.10 173.19 3bf7 s ASP 49 N -2.80 6.17 0.67 4.85 1.01 -0.52 -3.84 116.67 122.22 3bf7 s ASP 49 Ca 0.26 0.18 -0.15 0.00 0.71 0.00 0.00 52.55 53.55 3bf7 s ASP 49 Cb -0.09 -2.14 0.01 0.00 1.01 0.00 0.00 42.92 41.70 3bf7 s ASP 49 CO 0.17 -0.00 1.14 -0.69 0.21 0.00 0.00 175.17 176.00 3bf7 s VAL 50 N 1.30 2.99 0.45 -1.27 1.01 -1.26 -4.29 120.40 119.33 3bf7 s VAL 50 Ca 0.10 0.47 -0.23 0.00 0.00 0.00 0.00 61.98 62.33 3bf7 s VAL 50 Cb -0.14 -3.00 -0.10 0.00 0.00 0.00 0.00 36.38 33.13 3bf7 s VAL 50 CO 0.07 -0.27 0.83 -2.11 0.00 0.00 0.00 175.10 173.62 3bf7 n ARG 51 N -2.45 1.00 -1.15 2.72 1.85 -1.26 -1.31 116.66 116.06 3bf7 n ARG 51 Ca 0.11 0.36 -0.05 0.00 -1.00 0.00 0.00 57.85 57.27 3bf7 n ARG 51 Cb 0.51 -1.87 -0.02 0.00 -1.05 0.00 0.00 32.46 30.03 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 0.58 -4.81 -4.23 2.89 3.02 -0.53 -4.98 115.26 107.20 3bf7 n ASN 52 Ca 0.11 0.12 -0.14 0.00 -0.03 0.00 0.00 54.58 54.64 3bf7 n ASN 52 Cb 0.41 -2.76 -0.10 0.00 -0.61 0.00 0.00 39.78 36.72 3bf7 n ASN 52 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3bf7 s HIS 53 N -1.78 1.21 0.00 3.10 3.76 -0.43 -0.97 115.29 120.17 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 -0.63 0.00 0.00 1.11 0.00 0.00 32.58 33.06 3bf7 s HIS 53 CO 0.00 0.05 0.00 0.41 -0.85 0.00 0.00 174.74 174.35 3bf7 n GLY 54 N -0.02 3.09 1.11 -2.22 0.00 -1.26 -1.70 105.19 104.19 3bf7 n GLY 54 Ca -0.12 -0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.93 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 4.25 -4.89 0.99 4.77 -1.26 -4.62 117.00 116.23 3bf7 n LEU 55 Ca 0.00 -3.24 -0.29 0.00 -0.03 0.00 0.00 56.01 52.45 3bf7 n LEU 55 Cb 0.00 -0.60 0.02 0.00 -2.33 0.00 0.00 43.42 40.52 3bf7 n LEU 55 CO 0.00 0.84 0.62 -0.44 -1.33 0.00 0.00 177.39 177.08 3bf7 s SER 56 N -1.98 5.86 0.85 -1.43 0.01 -0.69 -4.69 113.70 111.64 3bf7 s SER 56 Ca 0.45 1.06 -0.11 0.00 1.31 0.00 0.00 55.95 58.66 3bf7 s SER 56 Cb 0.37 -2.08 0.11 0.00 0.21 0.00 0.00 66.02 64.63 3bf7 s SER 56 CO 0.07 -0.98 1.15 -2.84 0.41 0.00 0.00 173.24 171.04 3bf7 s PRO 57 N -5.09 1.47 0.12 12.44 0.02 -1.26 -4.44 135.00 138.26 3bf7 s PRO 57 Ca 0.54 1.51 -0.02 0.00 0.02 0.00 0.00 61.00 63.04 3bf7 s PRO 57 Cb -0.11 -1.78 -0.05 0.00 0.02 0.00 0.00 34.50 32.58 3bf7 s PRO 57 CO 0.49 -2.29 0.31 1.03 -0.33 0.00 0.00 177.00 176.22 3bf7 s ARG 58 N -4.57 3.53 -0.28 5.54 3.00 -1.26 -1.45 118.95 123.46 3bf7 s ARG 58 Ca 0.67 -0.27 -0.21 0.00 0.00 0.00 0.00 55.73 55.91 3bf7 s ARG 58 Cb -0.23 -2.93 0.09 0.00 0.00 0.00 0.00 34.95 31.89 3bf7 s ARG 58 CO 0.55 0.52 0.78 -2.00 0.00 0.00 0.00 175.30 175.15 3bf7 s GLU 59 N -2.69 0.71 0.55 3.54 -6.30 -1.26 -4.93 118.70 108.31 3bf7 s GLU 59 Ca 0.38 0.98 0.22 0.00 -2.50 0.00 0.00 54.97 54.05 3bf7 s GLU 59 Cb -0.12 0.27 1.48 0.00 0.00 0.00 0.00 34.13 35.76 3bf7 s GLU 59 CO 0.27 -0.11 2.16 -1.35 0.02 0.00 0.00 175.26 176.25 3bf7 h PRO 60 N 5.58 0.00 -6.03 4.30 0.11 -1.99 -3.43 132.00 130.54 3bf7 h PRO 60 Ca -0.29 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.25 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 0.11 0.00 -0.02 0.08 -0.21 0.00 0.00 178.00 177.96 3bf7 s VAL 61 N -4.90 4.96 -0.47 3.15 1.01 -1.26 -4.86 120.40 118.04 3bf7 s VAL 61 Ca -0.05 1.24 0.06 0.00 0.00 0.00 0.00 61.98 63.23 3bf7 s VAL 61 Cb 0.17 -3.93 0.22 0.00 0.00 0.00 0.00 36.38 32.84 3bf7 s VAL 61 CO 0.63 0.39 0.51 0.23 0.00 0.00 0.00 175.10 176.86 3bf7 n MET 62 N 2.97 1.00 -4.51 2.72 2.81 -1.26 -4.98 117.12 115.88 3bf7 n MET 62 Ca -0.06 -3.58 -0.24 0.00 -1.81 0.00 0.00 57.70 52.01 3bf7 n MET 62 Cb 0.51 -1.61 -0.11 0.00 -0.71 0.00 0.00 33.22 31.30 3bf7 n MET 62 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3bf7 s ASN 63 N -1.12 2.99 0.23 7.83 2.20 -1.26 -4.26 114.94 121.54 3bf7 s ASN 63 Ca 0.34 -1.35 0.04 0.00 -0.94 0.00 0.00 52.86 50.96 3bf7 s ASN 63 Cb 0.11 -0.21 0.22 0.00 -2.00 0.00 0.00 41.25 39.37 3bf7 s ASN 63 CO -0.12 -0.51 1.54 1.88 -2.94 0.00 0.00 177.10 176.95 3bf7 h TYR 64 N 2.01 0.32 -0.45 1.54 0.05 -1.94 -2.17 116.97 116.33 3bf7 h TYR 64 Ca -0.42 -0.13 -0.05 0.00 0.05 0.00 0.00 58.73 58.18 3bf7 h TYR 64 Cb 1.24 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 38.90 3bf7 h TYR 64 CO 0.65 0.81 0.06 -1.35 -1.05 0.00 0.00 178.16 177.27 3bf7 h PRO 65 N 0.18 0.70 -0.19 4.88 0.11 -1.95 0.98 132.00 136.72 3bf7 h PRO 65 Ca -0.01 -0.15 -0.03 0.00 0.11 0.00 0.00 66.00 65.92 3bf7 h PRO 65 Cb 1.15 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 3bf7 h PRO 65 CO 0.10 0.68 0.02 0.00 -0.21 0.00 0.00 178.00 178.59 3bf7 h ALA 66 N 1.39 0.26 -0.30 -0.75 0.00 -1.94 0.13 119.26 118.05 3bf7 h ALA 66 Ca 0.14 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3bf7 h ALA 66 Cb 0.34 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3bf7 h ALA 66 CO 0.01 -0.06 -0.11 0.52 0.00 0.00 0.00 179.25 179.61 3bf7 h MET 67 N 0.11 0.51 -0.37 0.00 2.86 -1.10 -1.35 114.93 115.58 3bf7 h MET 67 Ca 0.06 -0.14 -0.12 0.00 -2.06 0.00 0.00 59.70 57.43 3bf7 h MET 67 Cb 0.33 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 3bf7 h MET 67 CO 0.01 0.61 -0.25 0.00 1.06 0.00 0.00 176.91 178.34 3bf7 h ALA 68 N 1.42 0.53 -0.35 6.32 0.00 -0.63 -2.66 119.26 123.89 3bf7 h ALA 68 Ca 0.09 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 3bf7 h ALA 68 Cb 0.47 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3bf7 h ALA 68 CO 0.03 0.52 0.07 0.37 0.00 0.00 0.00 179.25 180.24 3bf7 h GLN 69 N 0.62 0.52 -0.87 0.00 5.75 -0.61 -0.99 115.11 119.52 3bf7 h GLN 69 Ca 0.07 -0.09 -0.00 0.00 -0.15 0.00 0.00 58.65 58.49 3bf7 h GLN 69 Cb 0.82 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.24 3bf7 h GLN 69 CO 0.07 0.49 0.54 -0.44 -2.65 0.00 0.00 178.83 176.84 3bf7 h ASP 70 N 0.51 1.04 -0.59 -0.69 3.45 -0.97 0.17 116.42 119.33 3bf7 h ASP 70 Ca 0.12 -0.05 -0.07 0.00 0.43 0.00 0.00 57.03 57.45 3bf7 h ASP 70 Cb 0.22 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.70 3bf7 h ASP 70 CO -0.00 0.78 0.08 -0.07 -1.57 0.00 0.00 179.24 178.46 3bf7 h LEU 71 N 1.20 0.95 -0.29 1.55 3.38 -0.87 -0.41 115.31 120.81 3bf7 h LEU 71 Ca 0.32 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3bf7 h LEU 71 Cb -0.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 3bf7 h LEU 71 CO -0.06 0.98 0.09 0.58 0.09 0.00 0.00 178.44 180.12 3bf7 h VAL 72 N 0.89 1.20 -0.87 1.22 2.07 -0.59 -0.40 116.25 119.77 3bf7 h VAL 72 Ca 0.18 -0.65 0.03 0.00 0.82 0.00 0.00 66.70 67.08 3bf7 h VAL 72 Cb 0.45 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 3bf7 h VAL 72 CO 0.02 0.22 0.57 0.44 0.02 0.00 0.00 177.57 178.83 3bf7 h ASP 73 N 0.31 0.93 -0.28 0.57 3.32 -0.49 0.61 116.42 121.40 3bf7 h ASP 73 Ca 0.09 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.01 3bf7 h ASP 73 Cb 0.25 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3bf7 h ASP 73 CO -0.00 0.65 -0.32 0.74 -1.72 0.00 0.00 179.24 178.58 3bf7 h THR 74 N 1.09 1.30 -0.68 0.35 2.02 -0.77 -2.12 112.91 114.10 3bf7 h THR 74 Ca 0.34 -1.50 -0.06 0.00 0.77 0.00 0.00 66.41 65.97 3bf7 h THR 74 Cb 0.01 1.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 3bf7 h THR 74 CO -0.10 0.48 0.21 -0.07 0.37 0.00 0.00 175.52 176.41 3bf7 h LEU 75 N 0.45 0.99 -0.79 2.58 3.38 -0.55 -2.17 115.31 119.19 3bf7 h LEU 75 Ca 0.04 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.81 3bf7 h LEU 75 Cb 0.90 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 3bf7 h LEU 75 CO 0.08 0.94 0.52 0.44 0.09 0.00 0.00 178.44 180.51 3bf7 h ASP 76 N 0.99 0.89 0.09 -0.43 3.32 -0.80 -0.15 116.42 120.34 3bf7 h ASP 76 Ca 0.22 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.18 3bf7 h ASP 76 Cb 0.31 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3bf7 h ASP 76 CO -0.01 0.63 -0.25 0.00 -1.72 0.00 0.00 179.24 177.90 3bf7 h ALA 77 N 1.30 1.31 -0.01 3.45 0.00 -1.10 -2.32 119.26 121.89 3bf7 h ALA 77 Ca 0.30 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3bf7 h ALA 77 Cb -0.08 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3bf7 h ALA 77 CO -0.08 0.47 -0.04 1.28 0.00 0.00 0.00 179.25 180.88 3bf7 n LEU 78 N -4.16 1.29 -3.60 0.00 4.77 -0.84 -4.94 117.00 109.53 3bf7 n LEU 78 Ca -0.01 -0.41 -0.25 0.00 -0.03 0.00 0.00 56.01 55.30 3bf7 n LEU 78 Cb 0.36 -0.02 0.06 0.00 -2.33 0.00 0.00 43.42 41.49 3bf7 n LEU 78 CO 0.40 0.22 0.17 0.00 -1.33 0.00 0.00 177.39 176.85 3bf7 n GLN 79 N -0.06 -6.84 -3.61 3.23 6.02 -0.18 -4.97 117.38 110.97 3bf7 n GLN 79 Ca 0.18 0.77 -0.39 0.00 -0.01 0.00 0.00 57.00 57.56 3bf7 n GLN 79 Cb 0.33 -5.76 -0.11 0.00 1.02 0.00 0.00 30.24 25.73 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 -3.28 4.98 0.09 5.09 1.01 -0.53 -4.99 121.20 123.56 3bf7 s ILE 80 Ca 0.57 -0.13 -0.17 0.00 0.00 0.00 0.00 60.65 60.92 3bf7 s ILE 80 Cb -0.26 -3.46 -0.08 0.00 0.01 0.00 0.00 42.46 38.67 3bf7 s ILE 80 CO 0.70 0.15 1.47 0.44 0.00 0.00 0.00 174.94 177.70 3bf7 h ASP 81 N 8.38 0.59 -4.63 3.58 3.32 -1.93 -3.42 116.42 122.31 3bf7 h ASP 81 Ca -0.34 -0.39 -0.11 0.00 0.02 0.00 0.00 57.03 56.21 3bf7 h ASP 81 Cb 1.17 -0.16 -0.21 0.00 0.22 0.00 0.00 39.33 40.34 3bf7 h ASP 81 CO 0.59 0.85 -0.22 -0.75 -1.72 0.00 0.00 179.24 177.99 3bf7 s LYS 82 N -4.67 0.64 0.10 3.56 2.20 -1.26 -4.39 119.74 115.93 3bf7 s LYS 82 Ca -0.13 0.09 -0.05 0.00 -0.36 0.00 0.00 55.97 55.52 3bf7 s LYS 82 Cb 0.08 0.29 -0.02 0.00 -1.51 0.00 0.00 37.83 36.67 3bf7 s LYS 82 CO 0.78 -0.16 0.12 0.00 -0.36 0.00 0.00 175.35 175.74 3bf7 s ALA 83 N -0.81 0.22 0.01 3.13 0.00 -0.55 -4.43 121.76 119.33 3bf7 s ALA 83 Ca -0.09 -0.99 -0.17 0.00 0.00 0.00 0.00 51.96 50.71 3bf7 s ALA 83 Cb -0.04 0.57 -0.06 0.00 0.00 0.00 0.00 23.12 23.60 3bf7 s ALA 83 CO 0.04 -0.49 0.48 0.99 0.00 0.00 0.00 175.76 176.77 3bf7 s THR 84 N -3.93 4.95 -0.07 0.00 2.01 0.09 -0.49 115.64 118.19 3bf7 s THR 84 Ca 0.11 1.00 0.05 0.00 0.31 0.00 0.00 61.69 63.17 3bf7 s THR 84 Cb 0.06 -3.80 -0.01 0.00 0.01 0.00 0.00 72.50 68.76 3bf7 s THR 84 CO -0.06 0.53 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.81 3bf7 s PHE 85 N -0.80 2.52 -0.16 4.92 0.08 -0.40 -0.57 117.98 123.57 3bf7 s PHE 85 Ca 0.26 -0.75 0.00 0.00 0.12 0.00 0.00 56.93 56.56 3bf7 s PHE 85 Cb -0.17 -1.65 0.03 0.00 -0.57 0.00 0.00 43.02 40.66 3bf7 s PHE 85 CO 0.15 -0.24 -0.10 0.42 -0.10 0.00 0.00 175.22 175.35 3bf7 s ILE 86 N -0.04 1.40 0.02 0.64 1.01 -0.22 -0.88 121.20 123.13 3bf7 s ILE 86 Ca -0.07 -0.66 0.04 0.00 0.00 0.00 0.00 60.65 59.96 3bf7 s ILE 86 Cb -0.15 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.89 3bf7 s ILE 86 CO 0.05 0.31 -0.12 -0.83 0.00 0.00 0.00 174.94 174.35 3bf7 s GLY 87 N 1.53 0.64 -0.20 6.18 0.00 -0.19 -0.58 107.32 114.71 3bf7 s GLY 87 Ca 0.03 -0.64 -0.08 0.00 0.00 0.00 0.00 44.72 44.02 3bf7 s GLY 87 CO -0.09 -0.60 0.08 -1.58 0.00 0.00 0.00 173.10 170.91 3bf7 s HIS 88 N -0.59 3.24 0.00 1.90 2.46 -0.17 -0.57 115.29 121.56 3bf7 s HIS 88 Ca 0.02 0.04 0.00 0.00 0.47 0.00 0.00 55.06 55.59 3bf7 s HIS 88 Cb -0.06 -2.14 0.00 0.00 -0.13 0.00 0.00 32.58 30.25 3bf7 s HIS 88 CO 0.00 0.07 0.00 0.45 -2.47 0.00 0.00 174.74 172.80 3bf7 n SER 89 N 3.86 0.00 -0.34 9.88 2.88 -0.60 -0.54 113.62 128.77 3bf7 n SER 89 Ca -0.16 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.51 3bf7 n SER 89 Cb 0.52 0.00 0.31 0.00 -0.75 0.00 0.00 64.21 64.29 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 0.64 -0.19 -1.46 1.85 -1.91 0.42 114.93 114.29 3bf7 h MET 90 Ca 0.00 -0.04 -0.07 0.00 -0.61 0.00 0.00 59.70 58.98 3bf7 h MET 90 Cb 0.00 -0.14 -0.01 0.00 0.43 0.00 0.00 31.60 31.87 3bf7 h MET 90 CO 0.00 0.42 -0.19 0.78 -0.40 0.00 0.00 176.91 177.53 3bf7 h GLY 91 N 0.66 0.34 1.21 1.39 0.00 -0.41 -1.13 103.07 105.14 3bf7 h GLY 91 Ca 0.57 -0.24 -0.12 0.00 0.00 0.00 0.00 47.33 47.54 3bf7 h GLY 91 CO -0.42 0.22 -0.21 -1.33 0.00 0.00 0.00 176.54 174.80 3bf7 h GLY 92 N 0.90 0.98 1.34 4.60 0.00 -0.17 -1.74 103.07 108.97 3bf7 h GLY 92 Ca 0.05 -0.85 -0.09 0.00 0.00 0.00 0.00 47.33 46.44 3bf7 h GLY 92 CO 0.03 0.77 -0.10 0.50 0.00 0.00 0.00 176.54 177.75 3bf7 h LYS 93 N 0.79 0.79 -0.45 4.80 1.57 -0.48 -0.11 116.57 123.47 3bf7 h LYS 93 Ca 0.11 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 3bf7 h LYS 93 Cb 0.76 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 3bf7 h LYS 93 CO 0.06 0.86 0.17 0.00 -0.57 0.00 0.00 179.45 179.97 3bf7 h ALA 94 N 1.18 0.58 -0.52 3.86 0.00 -0.98 -0.09 119.26 123.28 3bf7 h ALA 94 Ca 0.12 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3bf7 h ALA 94 Cb 0.58 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3bf7 h ALA 94 CO 0.04 0.19 -0.08 0.28 0.00 0.00 0.00 179.25 179.68 3bf7 h VAL 95 N 0.58 1.26 -0.69 0.00 2.07 -1.12 -1.54 116.25 116.81 3bf7 h VAL 95 Ca 0.15 -1.20 -0.07 0.00 0.82 0.00 0.00 66.70 66.40 3bf7 h VAL 95 Cb 0.20 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 3bf7 h VAL 95 CO -0.01 0.42 0.15 0.24 0.02 0.00 0.00 177.57 178.39 3bf7 h MET 96 N 0.86 1.13 -0.05 1.57 2.07 -0.77 -2.38 114.93 117.35 3bf7 h MET 96 Ca 0.14 -0.28 -0.05 0.00 -2.07 0.00 0.00 59.70 57.44 3bf7 h MET 96 Cb 0.61 -0.14 -0.01 0.00 -1.87 0.00 0.00 31.60 30.19 3bf7 h MET 96 CO 0.04 1.01 -0.19 0.00 1.07 0.00 0.00 176.91 178.84 3bf7 h ALA 97 N 1.07 1.59 -0.13 6.32 0.00 -0.69 -2.32 119.26 125.10 3bf7 h ALA 97 Ca 0.22 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3bf7 h ALA 97 Cb 0.40 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3bf7 h ALA 97 CO 0.01 0.30 -0.02 1.25 0.00 0.00 0.00 179.25 180.78 3bf7 h LEU 98 N 0.08 0.17 -1.92 0.00 5.85 -0.75 -2.21 115.31 116.53 3bf7 h LEU 98 Ca 0.02 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 3bf7 h LEU 98 Cb 0.38 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 3bf7 h LEU 98 CO 0.03 0.23 0.03 0.71 -0.34 0.00 0.00 178.44 179.09 3bf7 h THR 99 N 0.18 1.02 0.15 1.05 1.35 -1.34 0.22 112.91 115.55 3bf7 h THR 99 Ca 0.04 -0.07 -0.33 0.00 -0.55 0.00 0.00 66.41 65.50 3bf7 h THR 99 Cb 0.17 0.95 -0.00 0.00 -1.73 0.00 0.00 68.15 67.54 3bf7 h THR 99 CO 0.01 0.03 -1.69 0.00 -0.25 0.00 0.00 175.52 173.61 3bf7 h ALA 100 N 1.95 0.25 -0.03 6.62 0.00 -1.55 -3.14 119.26 123.36 3bf7 h ALA 100 Ca 0.02 -1.17 -0.01 0.00 0.00 0.00 0.00 54.91 53.75 3bf7 h ALA 100 Cb 0.01 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3bf7 h ALA 100 CO -0.00 1.12 -0.03 1.25 0.00 0.00 0.00 179.25 181.59 3bf7 h LEU 101 N 0.08 0.09 -5.76 0.00 5.85 -1.02 -3.41 115.31 111.15 3bf7 h LEU 101 Ca -0.31 -0.48 -0.47 0.00 0.84 0.00 0.00 57.88 57.46 3bf7 h LEU 101 Cb 2.06 -0.03 -0.32 0.00 0.37 0.00 0.00 40.66 42.74 3bf7 h LEU 101 CO 0.16 0.56 -0.93 0.00 -0.34 0.00 0.00 178.44 177.88 3bf7 n ALA 102 N -2.36 1.41 -0.08 1.25 0.00 0.03 -4.99 120.51 115.77 3bf7 n ALA 102 Ca -0.08 -2.83 0.20 0.00 0.00 0.00 0.00 53.44 50.73 3bf7 n ALA 102 Cb 0.27 -0.95 0.63 0.00 0.00 0.00 0.00 19.45 19.41 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 4.15 0.13 0.00 0.00 0.13 -1.63 -1.30 132.00 133.49 3bf7 h PRO 103 Ca 0.03 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3bf7 h PRO 103 Cb 0.92 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.03 3bf7 h PRO 103 CO 0.41 0.09 0.00 -0.25 -0.23 0.00 0.00 178.00 178.02 3bf7 n ASP 104 N -4.40 0.00 -0.86 1.44 8.00 -1.26 -2.70 116.55 116.77 3bf7 n ASP 104 Ca 0.12 0.23 0.12 0.00 0.71 0.00 0.00 54.79 55.98 3bf7 n ASP 104 Cb 0.63 -0.38 0.17 0.00 -0.02 0.00 0.00 41.12 41.51 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 -1.38 2.16 -5.03 -1.24 5.12 -0.49 -4.67 116.66 111.13 3bf7 n ARG 105 Ca 0.07 -1.72 -0.29 0.00 -1.93 0.00 0.00 57.85 53.98 3bf7 n ARG 105 Cb 0.19 -1.46 -0.16 0.00 -1.16 0.00 0.00 32.46 29.86 3bf7 n ARG 105 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 3bf7 s ILE 106 N -2.02 1.74 0.00 0.55 2.07 -1.10 -1.48 121.20 120.95 3bf7 s ILE 106 Ca 0.29 -0.87 0.00 0.00 -1.41 0.00 0.00 60.65 58.67 3bf7 s ILE 106 Cb 0.20 -1.50 0.00 0.00 0.13 0.00 0.00 42.46 41.30 3bf7 s ILE 106 CO 0.32 0.49 0.00 -0.67 -1.91 0.00 0.00 174.94 173.17 3bf7 n ASP 107 N 3.27 0.00 -4.75 4.50 -0.08 0.36 -4.86 116.55 114.99 3bf7 n ASP 107 Ca -0.19 0.00 -0.22 0.00 -1.51 0.00 0.00 54.79 52.87 3bf7 n ASP 107 Cb 0.52 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.93 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 2.56 -0.02 -0.67 1.02 -1.26 -4.98 119.74 116.38 3bf7 s LYS 108 Ca 0.00 -1.34 0.00 0.00 0.02 0.00 0.00 55.97 54.65 3bf7 s LYS 108 Cb 0.00 -2.33 0.02 0.00 -0.52 0.00 0.00 37.83 35.01 3bf7 s LYS 108 CO 0.00 0.25 0.01 -1.17 -0.92 0.00 0.00 175.35 173.52 3bf7 s LEU 109 N -3.83 1.36 -0.09 3.17 0.20 -1.26 -1.27 118.68 116.96 3bf7 s LEU 109 Ca 0.35 -0.00 0.01 0.00 0.69 0.00 0.00 54.13 55.19 3bf7 s LEU 109 Cb -0.05 -0.12 0.02 0.00 -0.43 0.00 0.00 46.19 45.60 3bf7 s LEU 109 CO 0.23 -0.08 -0.12 -0.69 -0.29 0.00 0.00 176.35 175.41 3bf7 s VAL 110 N 0.75 1.19 -0.22 1.68 1.01 -0.06 -1.12 120.40 123.64 3bf7 s VAL 110 Ca -0.07 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.45 3bf7 s VAL 110 Cb -0.10 -1.12 0.03 0.00 0.00 0.00 0.00 36.38 35.19 3bf7 s VAL 110 CO -0.02 0.38 -0.13 0.00 0.00 0.00 0.00 175.10 175.33 3bf7 s ALA 111 N 1.05 2.51 -0.23 5.51 0.00 0.34 -1.02 121.76 129.93 3bf7 s ALA 111 Ca -0.07 -1.41 -0.16 0.00 0.00 0.00 0.00 51.96 50.33 3bf7 s ALA 111 Cb -0.15 -1.44 -0.04 0.00 0.00 0.00 0.00 23.12 21.50 3bf7 s ALA 111 CO -0.01 -0.68 0.39 0.42 0.00 0.00 0.00 175.76 175.88 3bf7 s ILE 112 N 1.26 5.19 -0.96 0.00 1.01 0.26 -1.24 121.20 126.72 3bf7 s ILE 112 Ca 0.00 0.66 -0.21 0.00 0.00 0.00 0.00 60.65 61.10 3bf7 s ILE 112 Cb -0.16 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.62 3bf7 s ILE 112 CO -0.08 0.21 0.57 -0.67 0.00 0.00 0.00 174.94 174.97 3bf7 n ASP 113 N 4.81 -3.78 -3.53 3.58 4.64 0.41 -1.55 116.55 121.13 3bf7 n ASP 113 Ca -0.08 -1.06 -0.17 0.00 -1.38 0.00 0.00 54.79 52.10 3bf7 n ASP 113 Cb 0.51 -1.39 -0.06 0.00 -1.04 0.00 0.00 41.12 39.14 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 -3.44 0.00 0.08 5.18 1.10 -1.26 -4.39 121.20 118.47 3bf7 s ILE 114 Ca 0.30 0.00 0.06 0.00 -0.51 0.00 0.00 60.65 60.49 3bf7 s ILE 114 Cb -0.17 -1.00 -0.03 0.00 0.15 0.00 0.00 42.46 41.41 3bf7 s ILE 114 CO 0.84 0.00 -0.16 0.00 -2.11 0.00 0.00 174.94 173.51 3bf7 s ALA 115 N -1.15 1.32 -1.37 1.50 0.00 -1.25 -4.85 121.76 115.96 3bf7 s ALA 115 Ca -0.09 -1.06 -0.16 0.00 0.00 0.00 0.00 51.96 50.65 3bf7 s ALA 115 Cb -0.00 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.02 3bf7 s ALA 115 CO 0.09 0.21 2.12 -0.35 0.00 0.00 0.00 175.76 177.82 3bf7 n PRO 116 N 1.22 2.76 -3.86 0.00 -0.04 -1.26 -4.85 135.00 128.96 3bf7 n PRO 116 Ca -0.21 -2.64 -0.09 0.00 -0.04 0.00 0.00 63.50 60.52 3bf7 n PRO 116 Cb 0.54 -3.30 -0.08 0.00 -0.04 0.00 0.00 33.50 30.62 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 3.68 0.14 -0.35 0.52 -7.23 -1.26 -4.72 120.40 111.17 3bf7 s VAL 117 Ca 0.49 -1.11 -0.21 0.00 -1.81 0.00 0.00 61.98 59.34 3bf7 s VAL 117 Cb 0.12 -1.20 0.00 0.00 0.56 0.00 0.00 36.38 35.86 3bf7 s VAL 117 CO -0.04 -0.62 0.67 -0.62 -0.31 0.00 0.00 175.10 174.19 3bf7 s ASP 118 N -2.60 6.47 0.32 4.85 -1.08 -1.26 -4.42 116.67 118.94 3bf7 s ASP 118 Ca 0.02 0.23 0.26 0.00 -0.52 0.00 0.00 52.55 52.54 3bf7 s ASP 118 Cb 0.03 -2.35 0.97 0.00 -1.46 0.00 0.00 42.92 40.12 3bf7 s ASP 118 CO -0.09 -0.62 1.77 1.88 0.52 0.00 0.00 175.17 178.64 3bf7 h TYR 119 N 8.43 0.00 -6.38 -5.34 0.05 -1.71 -3.48 116.97 108.55 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 1.11 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 38.78 3bf7 h TYR 119 CO 0.76 0.00 -0.77 0.72 -1.05 0.00 0.00 178.16 177.82 3bf7 n HIS 120 N -2.47 -2.21 -3.81 4.88 8.25 -1.26 -4.97 115.22 113.63 3bf7 n HIS 120 Ca 0.03 0.89 -0.09 0.00 -0.26 0.00 0.00 57.72 58.28 3bf7 n HIS 120 Cb 0.31 -3.78 -0.06 0.00 1.12 0.00 0.00 29.99 27.58 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 -3.29 0.11 -0.26 1.59 -7.23 -1.26 -5.13 120.40 104.94 3bf7 s VAL 121 Ca 0.69 -1.05 -0.09 0.00 -1.81 0.00 0.00 61.98 59.71 3bf7 s VAL 121 Cb -0.35 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 3bf7 s VAL 121 CO 0.85 -0.51 0.13 -0.13 -0.31 0.00 0.00 175.10 175.13 3bf7 s ARG 122 N -3.86 3.85 0.00 4.82 0.52 -1.26 -4.95 118.95 118.07 3bf7 s ARG 122 Ca 0.06 -0.38 0.03 0.00 -0.52 0.00 0.00 55.73 54.93 3bf7 s ARG 122 Cb 0.04 -3.49 0.02 0.00 0.52 0.00 0.00 34.95 32.04 3bf7 s ARG 122 CO -0.10 -0.13 0.56 0.54 0.02 0.00 0.00 175.30 176.19 3bf7 n ARG 123 N 4.83 0.15 -0.20 3.54 1.74 -1.26 -4.77 116.66 120.69 3bf7 n ARG 123 Ca -0.15 -0.63 0.04 0.00 -0.77 0.00 0.00 57.85 56.34 3bf7 n ARG 123 Cb 0.52 -1.02 0.06 0.00 -1.02 0.00 0.00 32.46 31.00 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 -0.36 -1.55 8.25 -1.26 -4.85 115.22 115.51 3bf7 n HIS 124 Ca 0.02 -0.49 -0.01 0.00 -0.26 0.00 0.00 57.72 56.98 3bf7 n HIS 124 Cb 0.08 -0.09 0.12 0.00 1.12 0.00 0.00 29.99 31.23 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 1.08 0.32 0.41 3.32 -2.00 -0.10 116.42 119.46 3bf7 h ASP 125 Ca 0.00 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 56.90 3bf7 h ASP 125 Cb 1.08 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 3bf7 h ASP 125 CO 0.00 0.76 -0.52 -0.33 -1.72 0.00 0.00 179.24 177.42 3bf7 h GLU 126 N 1.27 0.22 -0.31 3.56 5.08 -1.94 -0.72 114.58 121.74 3bf7 h GLU 126 Ca 0.38 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.54 3bf7 h GLU 126 Cb -0.05 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 3bf7 h GLU 126 CO -0.11 0.70 -0.05 0.82 -1.00 0.00 0.00 179.01 179.37 3bf7 h ILE 127 N 0.18 1.27 -0.81 3.13 2.04 -1.72 -0.12 117.51 121.48 3bf7 h ILE 127 Ca 0.00 -1.06 -0.03 0.00 1.00 0.00 0.00 64.86 64.77 3bf7 h ILE 127 Cb 0.98 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 38.36 3bf7 h ILE 127 CO 0.08 0.34 0.39 -0.26 0.00 0.00 0.00 178.15 178.71 3bf7 h PHE 128 N 0.36 1.16 -0.78 1.37 0.04 -0.82 -0.39 116.94 117.87 3bf7 h PHE 128 Ca 0.08 -0.05 -0.04 0.00 2.80 0.00 0.00 57.97 60.76 3bf7 h PHE 128 Cb 0.52 -0.36 -0.04 0.00 2.20 0.00 0.00 35.95 38.28 3bf7 h PHE 128 CO 0.05 0.83 0.34 0.00 -0.60 0.00 0.00 178.31 178.92 3bf7 h ALA 129 N 1.28 1.02 -0.38 2.45 0.00 -0.84 -0.28 119.26 122.51 3bf7 h ALA 129 Ca 0.28 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3bf7 h ALA 129 Cb 0.11 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3bf7 h ALA 129 CO -0.04 0.62 0.04 0.00 0.00 0.00 0.00 179.25 179.87 3bf7 h ALA 130 N 1.17 0.51 -0.36 0.00 0.00 -0.47 -0.37 119.26 119.74 3bf7 h ALA 130 Ca 0.26 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3bf7 h ALA 130 Cb 0.18 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3bf7 h ALA 130 CO -0.03 0.24 0.23 0.82 0.00 0.00 0.00 179.25 180.51 3bf7 h ILE 131 N 0.48 1.11 -0.47 0.00 2.04 -0.80 -1.60 117.51 118.27 3bf7 h ILE 131 Ca 0.11 -0.23 -0.09 0.00 1.00 0.00 0.00 64.86 65.66 3bf7 h ILE 131 Cb 0.41 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 3bf7 h ILE 131 CO 0.01 0.11 -0.06 -1.13 0.00 0.00 0.00 178.15 177.08 3bf7 h ASN 132 N 0.48 0.79 -0.72 1.72 -0.73 -0.95 -2.26 115.58 113.92 3bf7 h ASN 132 Ca 0.13 -0.22 -0.01 0.00 1.87 0.00 0.00 56.30 58.07 3bf7 h ASN 132 Cb -0.02 -0.21 -0.03 0.00 0.27 0.00 0.00 38.32 38.32 3bf7 h ASN 132 CO -0.03 0.90 0.39 0.00 -0.37 0.00 0.00 177.43 178.33 3bf7 h ALA 133 N 1.18 0.92 -0.34 1.57 0.00 -0.70 -0.17 119.26 121.72 3bf7 h ALA 133 Ca 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3bf7 h ALA 133 Cb 0.54 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3bf7 h ALA 133 CO 0.03 0.44 0.16 0.28 0.00 0.00 0.00 179.25 180.16 3bf7 h VAL 134 N 0.99 1.16 -0.66 0.00 2.07 -1.04 -1.74 116.25 117.04 3bf7 h VAL 134 Ca 0.25 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 3bf7 h VAL 134 Cb 0.04 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 3bf7 h VAL 134 CO -0.04 0.17 0.40 0.28 0.02 0.00 0.00 177.57 178.39 3bf7 h SER 135 N 0.41 0.79 0.60 0.57 0.02 -0.98 -2.66 113.55 112.30 3bf7 h SER 135 Ca 0.12 -0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 60.93 3bf7 h SER 135 Cb 0.12 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 3bf7 h SER 135 CO -0.01 0.62 -0.35 -0.33 -1.14 0.00 0.00 176.83 175.62 3bf7 h GLU 136 N 0.90 0.00 0.00 3.45 4.39 -0.89 -3.45 114.58 118.98 3bf7 h GLU 136 Ca 0.24 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.81 3bf7 h GLU 136 Cb -0.03 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 28.68 3bf7 h GLU 136 CO -0.04 0.35 0.09 -1.13 -1.16 0.00 0.00 179.01 177.12 3bf7 n SER 137 N -3.74 -0.45 -1.28 1.42 3.41 -0.67 -4.97 113.62 107.34 3bf7 n SER 137 Ca -0.01 -0.98 0.08 0.00 -0.26 0.00 0.00 58.87 57.70 3bf7 n SER 137 Cb 0.44 -0.30 0.30 0.00 -0.26 0.00 0.00 64.21 64.40 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 -3.36 4.37 -4.72 4.04 8.00 -1.26 -5.00 116.55 118.62 3bf7 n ASP 138 Ca 0.05 -2.62 -0.42 0.00 0.71 0.00 0.00 54.79 52.51 3bf7 n ASP 138 Cb 0.17 -0.53 -0.02 0.00 -0.02 0.00 0.00 41.12 40.72 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 0.48 2.38 0.00 2.24 0.00 -1.26 -4.90 120.51 119.45 3bf7 n ALA 139 Ca 0.23 0.39 0.00 0.00 0.00 0.00 0.00 53.44 54.05 3bf7 n ALA 139 Cb 0.87 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.87 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 2.69 0.00 -3.18 0.00 1.13 -1.26 -4.85 117.38 111.91 3bf7 n GLN 140 Ca 0.11 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.95 3bf7 n GLN 140 Cb 0.35 -0.99 0.00 0.00 0.11 0.00 0.00 30.24 29.71 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 -1.99 4.23 0.30 5.09 -4.23 -1.26 -2.75 115.64 115.02 3bf7 s THR 141 Ca 0.00 -0.61 0.03 0.00 -1.18 0.00 0.00 61.69 59.93 3bf7 s THR 141 Cb 0.00 -3.54 0.09 0.00 1.34 0.00 0.00 72.50 70.39 3bf7 s THR 141 CO 0.00 -0.33 1.76 0.03 -0.54 0.00 0.00 174.62 175.54 3bf7 h ARG 142 N 0.58 0.46 -0.32 3.99 3.08 -1.96 -0.84 114.38 119.38 3bf7 h ARG 142 Ca -0.47 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 59.43 3bf7 h ARG 142 Cb 1.25 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 3bf7 h ARG 142 CO 0.57 0.65 0.19 0.37 -1.07 0.00 0.00 179.97 180.68 3bf7 h GLN 143 N 0.42 0.43 -0.59 0.04 5.75 -1.99 0.39 115.11 119.56 3bf7 h GLN 143 Ca 0.07 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 3bf7 h GLN 143 Cb 0.59 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.03 3bf7 h GLN 143 CO 0.04 0.32 0.05 1.96 -2.65 0.00 0.00 178.83 178.55 3bf7 h GLN 144 N 0.41 1.00 -0.58 1.69 4.20 -1.90 -2.58 115.11 117.35 3bf7 h GLN 144 Ca 0.11 -0.29 -0.07 0.00 0.06 0.00 0.00 58.65 58.46 3bf7 h GLN 144 Cb 0.00 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 3bf7 h GLN 144 CO -0.02 0.97 0.08 0.00 -0.67 0.00 0.00 178.83 179.19 3bf7 h ALA 145 N 0.99 0.77 -0.89 3.87 0.00 -0.74 -2.90 119.26 120.36 3bf7 h ALA 145 Ca 0.17 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 54.86 3bf7 h ALA 145 Cb 0.49 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 3bf7 h ALA 145 CO 0.02 0.53 0.57 0.00 0.00 0.00 0.00 179.25 180.37 3bf7 h ALA 146 N 1.00 1.18 -0.80 0.00 0.00 -0.06 -0.95 119.26 119.63 3bf7 h ALA 146 Ca 0.17 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.09 3bf7 h ALA 146 Cb 0.43 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 3bf7 h ALA 146 CO 0.01 0.41 0.50 0.00 0.00 0.00 0.00 179.25 180.18 3bf7 h ALA 147 N 1.37 1.07 -0.28 0.00 0.00 -1.26 -0.96 119.26 119.19 3bf7 h ALA 147 Ca 0.36 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.14 3bf7 h ALA 147 Cb 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3bf7 h ALA 147 CO -0.12 0.28 -0.23 0.82 0.00 0.00 0.00 179.25 180.00 3bf7 h ILE 148 N 0.95 1.30 -0.20 0.00 2.04 -1.29 -3.17 117.51 117.15 3bf7 h ILE 148 Ca 0.33 -1.38 -0.04 0.00 1.00 0.00 0.00 64.86 64.77 3bf7 h ILE 148 Cb 0.07 1.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 3bf7 h ILE 148 CO -0.14 0.44 -0.07 0.24 0.00 0.00 0.00 178.15 178.63 3bf7 h MET 149 N 0.39 0.30 0.00 2.37 2.86 -0.76 -1.83 114.93 118.27 3bf7 h MET 149 Ca 0.05 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3bf7 h MET 149 Cb 0.79 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.40 3bf7 h MET 149 CO 0.06 0.39 0.00 0.54 1.06 0.00 0.00 176.91 178.96 3bf7 n ARG 150 N -4.31 0.10 0.02 1.72 1.74 -0.40 -0.44 116.66 115.09 3bf7 n ARG 150 Ca -0.00 0.42 0.13 0.00 -0.77 0.00 0.00 57.85 57.63 3bf7 n ARG 150 Cb 0.24 -1.73 0.42 0.00 -1.02 0.00 0.00 32.46 30.37 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 -1.93 0.06 -0.01 5.56 6.02 -0.69 -4.07 117.38 122.32 3bf7 n GLN 151 Ca 0.02 0.03 -0.01 0.00 -0.01 0.00 0.00 57.00 57.03 3bf7 n GLN 151 Cb 0.15 -1.56 -0.02 0.00 1.02 0.00 0.00 30.24 29.83 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 -1.66 0.00 -4.45 1.08 8.25 -0.24 -5.06 115.22 113.14 3bf7 n HIS 152 Ca 0.06 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.26 3bf7 n HIS 152 Cb 0.36 -0.12 -0.13 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 -4.31 2.26 -0.08 2.41 1.43 0.41 -4.92 118.68 115.87 3bf7 s LEU 153 Ca -0.02 -0.64 0.12 0.00 -1.03 0.00 0.00 54.13 52.56 3bf7 s LEU 153 Cb 0.01 -1.00 0.19 0.00 0.03 0.00 0.00 46.19 45.42 3bf7 s LEU 153 CO 0.10 0.12 1.09 0.59 0.23 0.00 0.00 176.35 178.49 3bf7 n ASN 154 N 1.32 2.18 -4.15 2.29 4.13 -1.26 -4.30 115.26 115.47 3bf7 n ASN 154 Ca -0.18 -2.70 -0.38 0.00 1.68 0.00 0.00 54.58 53.00 3bf7 n ASN 154 Cb 0.53 -0.28 -0.10 0.00 -1.54 0.00 0.00 39.78 38.39 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 -2.20 2.23 0.32 3.52 2.02 -1.26 -4.97 118.70 118.37 3bf7 s GLU 155 Ca 0.21 -1.88 0.05 0.00 0.02 0.00 0.00 54.97 53.37 3bf7 s GLU 155 Cb 0.18 -3.72 0.70 0.00 0.10 0.00 0.00 34.13 31.38 3bf7 s GLU 155 CO 0.02 -1.13 1.86 1.49 0.02 0.00 0.00 175.26 177.52 3bf7 h GLU 156 N 8.09 0.81 -0.80 1.61 4.57 -1.99 -1.70 114.58 125.16 3bf7 h GLU 156 Ca -0.14 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 57.99 3bf7 h GLU 156 Cb 1.05 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 29.42 3bf7 h GLU 156 CO 0.76 0.54 0.49 0.78 -1.18 0.00 0.00 179.01 180.39 3bf7 h GLY 157 N 0.83 1.15 1.05 1.92 0.00 -1.99 -0.46 103.07 105.57 3bf7 h GLY 157 Ca 0.46 -0.47 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 3bf7 h GLY 157 CO -0.22 0.46 -0.14 -2.08 0.00 0.00 0.00 176.54 174.55 3bf7 h VAL 158 N 1.09 1.27 -0.25 4.60 2.07 -1.77 -1.48 116.25 121.78 3bf7 h VAL 158 Ca 0.29 -1.28 0.01 0.00 0.82 0.00 0.00 66.70 66.54 3bf7 h VAL 158 Cb -0.06 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3bf7 h VAL 158 CO -0.06 0.44 0.15 0.40 0.02 0.00 0.00 177.57 178.53 3bf7 h ILE 159 N 0.74 1.04 -0.50 4.57 2.04 -0.95 -0.69 117.51 123.77 3bf7 h ILE 159 Ca 0.11 -0.11 -0.07 0.00 1.00 0.00 0.00 64.86 65.79 3bf7 h ILE 159 Cb 0.70 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 3bf7 h ILE 159 CO 0.05 0.06 0.02 1.56 0.00 0.00 0.00 178.15 179.84 3bf7 h GLN 160 N 0.32 0.81 -0.08 2.37 1.08 -1.01 -0.72 115.11 117.88 3bf7 h GLN 160 Ca 0.10 -0.21 -0.00 0.00 -1.45 0.00 0.00 58.65 57.08 3bf7 h GLN 160 Cb -0.02 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.31 3bf7 h GLN 160 CO -0.04 0.80 0.05 0.35 -0.95 0.00 0.00 178.83 179.04 3bf7 h PHE 161 N 0.76 0.11 -0.84 2.96 3.57 -0.90 -2.70 116.94 119.90 3bf7 h PHE 161 Ca 0.15 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 3bf7 h PHE 161 Cb 0.43 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.10 3bf7 h PHE 161 CO 0.02 0.12 0.46 -0.07 -2.23 0.00 0.00 178.31 176.61 3bf7 h LEU 162 N 0.06 1.05 -1.59 0.59 3.38 -0.85 -2.41 115.31 115.53 3bf7 h LEU 162 Ca 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3bf7 h LEU 162 Cb 0.04 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.53 3bf7 h LEU 162 CO -0.01 0.84 0.00 -0.07 0.09 0.00 0.00 178.44 179.30 3bf7 h LEU 163 N 1.17 0.00 -2.42 1.67 3.38 -0.86 -1.10 115.31 117.14 3bf7 h LEU 163 Ca 0.29 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 40.78 3bf7 h LEU 163 CO -0.05 0.00 -0.03 0.11 0.09 0.00 0.00 178.44 178.56 3bf7 h LYS 164 N 0.00 0.00 -0.50 1.13 1.79 -1.12 -0.73 116.57 117.13 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 0.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 3bf7 h LYS 164 CO 0.00 0.03 0.00 0.43 -1.08 0.00 0.00 179.45 178.83 3bf7 n SER 165 N -3.51 3.51 -4.28 0.86 7.64 -0.42 -4.75 113.62 112.69 3bf7 n SER 165 Ca -0.02 -1.99 -0.44 0.00 1.01 0.00 0.00 58.87 57.43 3bf7 n SER 165 Cb 0.13 -0.33 -0.06 0.00 -1.01 0.00 0.00 64.21 62.94 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 -1.34 3.32 -0.05 1.43 5.36 -0.28 -0.23 117.98 126.18 3bf7 s PHE 166 Ca 0.42 -1.50 0.03 0.00 -0.96 0.00 0.00 56.93 54.92 3bf7 s PHE 166 Cb 0.23 -3.70 0.00 0.00 -0.34 0.00 0.00 43.02 39.22 3bf7 s PHE 166 CO 0.32 -1.01 -0.15 0.08 -1.46 0.00 0.00 175.22 172.99 3bf7 s VAL 167 N 1.51 1.31 -1.46 3.12 1.01 -0.51 -4.75 120.40 120.62 3bf7 s VAL 167 Ca 0.04 -0.62 -0.07 0.00 0.00 0.00 0.00 61.98 61.33 3bf7 s VAL 167 Cb -0.29 -1.15 0.03 0.00 0.00 0.00 0.00 36.38 34.98 3bf7 s VAL 167 CO 0.02 0.39 0.66 0.47 0.00 0.00 0.00 175.10 176.63 3bf7 n ASP 168 N 3.39 -5.39 -0.73 3.32 8.00 -1.26 -1.85 116.55 122.03 3bf7 n ASP 168 Ca -0.20 -0.38 -0.09 0.00 0.71 0.00 0.00 54.79 54.83 3bf7 n ASP 168 Cb 0.53 -4.36 -0.04 0.00 -0.02 0.00 0.00 41.12 37.22 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 -1.49 1.10 2.99 0.44 0.00 -1.11 -5.01 105.19 102.11 3bf7 n GLY 169 Ca -0.06 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.75 0.33 0.00 1.61 0.41 -0.77 -4.93 118.70 112.60 3bf7 s GLU 170 Ca 0.00 -0.63 -0.27 0.00 -0.41 0.00 0.00 54.97 53.66 3bf7 s GLU 170 Cb 0.00 0.08 -0.04 0.00 -1.78 0.00 0.00 34.13 32.39 3bf7 s GLU 170 CO 0.00 -0.04 0.86 -1.58 -0.49 0.00 0.00 175.26 174.01 3bf7 s TRP 171 N -1.49 3.67 0.27 1.61 0.52 -1.26 -1.42 118.94 120.84 3bf7 s TRP 171 Ca -0.15 1.55 0.04 0.00 0.02 0.00 0.00 56.10 57.56 3bf7 s TRP 171 Cb -0.10 -2.97 0.39 0.00 -1.15 0.00 0.00 33.47 29.64 3bf7 s TRP 171 CO -0.01 0.09 1.67 0.00 0.02 0.00 0.00 176.95 178.72 3bf7 h ARG 172 N 6.44 0.32 -7.06 4.98 2.47 -0.92 -3.44 114.38 117.16 3bf7 h ARG 172 Ca -0.42 -0.16 -0.49 0.00 -1.26 0.00 0.00 59.98 57.66 3bf7 h ARG 172 Cb 1.21 -0.00 0.02 0.00 -1.65 0.00 0.00 29.97 29.55 3bf7 h ARG 172 CO 0.74 0.69 0.25 -0.59 0.56 0.00 0.00 179.97 181.62 3bf7 s PHE 173 N -4.16 3.50 -1.08 3.04 -0.12 -1.26 -4.02 117.98 113.89 3bf7 s PHE 173 Ca -0.05 1.20 -0.18 0.00 -0.05 0.00 0.00 56.93 57.84 3bf7 s PHE 173 Cb 0.13 -2.59 0.11 0.00 -0.63 0.00 0.00 43.02 40.05 3bf7 s PHE 173 CO 0.79 -0.31 1.38 1.21 -0.05 0.00 0.00 175.22 178.23 3bf7 s ASN 174 N -3.43 6.75 0.16 1.98 3.84 -0.14 -4.92 114.94 119.17 3bf7 s ASN 174 Ca 0.54 -2.21 -0.18 0.00 0.21 0.00 0.00 52.86 51.22 3bf7 s ASN 174 Cb -0.10 -2.47 0.07 0.00 -0.55 0.00 0.00 41.25 38.20 3bf7 s ASN 174 CO 0.37 -1.10 1.67 0.58 -2.79 0.00 0.00 177.10 175.83 3bf7 h VAL 175 N 5.72 0.62 -0.97 -5.21 2.07 -1.92 -1.69 116.25 114.87 3bf7 h VAL 175 Ca 0.26 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.86 3bf7 h VAL 175 Cb 0.96 0.62 -0.07 0.00 -1.52 0.00 0.00 31.29 31.28 3bf7 h VAL 175 CO 1.27 0.00 0.62 -0.65 0.02 0.00 0.00 177.57 178.84 3bf7 h PRO 176 N -0.02 1.03 -0.16 1.57 0.11 -1.99 -0.73 132.00 131.80 3bf7 h PRO 176 Ca 0.17 -0.06 -0.18 0.00 0.11 0.00 0.00 66.00 66.04 3bf7 h PRO 176 Cb 0.28 -0.23 0.01 0.00 0.11 0.00 0.00 31.00 31.16 3bf7 h PRO 176 CO -0.37 0.68 -0.59 0.28 -0.21 0.00 0.00 178.00 177.79 3bf7 h VAL 177 N 1.06 1.31 -0.34 3.15 2.07 -1.85 -0.70 116.25 120.95 3bf7 h VAL 177 Ca 0.44 -1.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.08 3bf7 h VAL 177 Cb 0.29 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 3bf7 h VAL 177 CO -0.19 0.57 0.04 -0.07 0.02 0.00 0.00 177.57 177.95 3bf7 h LEU 178 N 0.37 0.48 0.15 2.57 3.38 -0.92 0.50 115.31 121.84 3bf7 h LEU 178 Ca -0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3bf7 h LEU 178 Cb 1.22 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3bf7 h LEU 178 CO 0.12 0.51 -0.07 -0.25 0.09 0.00 0.00 178.44 178.85 3bf7 h TRP 179 N 0.50 -0.19 -0.89 1.13 2.91 -1.08 -1.73 115.95 116.61 3bf7 h TRP 179 Ca 0.11 -0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.21 3bf7 h TRP 179 Cb 0.26 0.06 -0.07 0.00 -0.51 0.00 0.00 29.16 28.90 3bf7 h TRP 179 CO 0.01 0.25 0.54 0.22 -1.03 0.00 0.00 178.44 178.43 3bf7 h ASP 180 N -0.73 0.83 -0.26 2.65 3.58 -0.88 -2.45 116.42 119.15 3bf7 h ASP 180 Ca -0.02 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.46 3bf7 h ASP 180 Cb 0.52 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.43 3bf7 h ASP 180 CO 0.03 0.50 0.00 0.00 -2.88 0.00 0.00 179.24 176.90 3bf7 n GLN 181 N -4.64 2.09 -0.26 0.28 1.13 0.14 -4.63 117.38 111.49 3bf7 n GLN 181 Ca 0.14 -1.63 0.05 0.00 -1.94 0.00 0.00 57.00 53.61 3bf7 n GLN 181 Cb 0.23 -1.45 0.14 0.00 0.11 0.00 0.00 30.24 29.28 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 3.26 -0.16 -0.43 1.08 3.20 -0.80 -0.00 116.97 123.12 3bf7 h TYR 182 Ca 0.00 0.06 0.12 0.00 3.14 0.00 0.00 58.73 62.05 3bf7 h TYR 182 Cb 0.72 0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 3bf7 h TYR 182 CO 0.17 -0.28 0.30 -1.35 -1.64 0.00 0.00 178.16 175.36 3bf7 h PRO 183 N 0.07 0.03 0.00 1.82 0.11 -1.83 -0.25 132.00 131.95 3bf7 h PRO 183 Ca 0.41 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.40 3bf7 h PRO 183 Cb 0.70 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.79 3bf7 h PRO 183 CO -0.71 0.02 -0.52 0.45 -0.21 0.00 0.00 178.00 177.03 3bf7 h HIS 184 N 0.03 0.00 0.02 0.65 3.86 -1.29 -0.14 115.15 118.28 3bf7 h HIS 184 Ca 0.20 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.21 3bf7 h HIS 184 Cb 0.77 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.25 3bf7 h HIS 184 CO -0.00 0.52 -0.79 0.82 0.86 0.00 0.00 177.93 179.34 3bf7 h ILE 185 N 0.00 1.38 0.00 2.45 2.04 -0.79 -3.09 117.51 119.50 3bf7 h ILE 185 Ca -0.01 -2.18 0.00 0.00 1.00 0.00 0.00 64.86 63.67 3bf7 h ILE 185 Cb 1.39 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 40.05 3bf7 h ILE 185 CO 0.07 0.65 -0.13 1.33 0.00 0.00 0.00 178.15 180.06 3bf7 n VAL 186 N -4.08 0.53 -1.10 1.67 0.24 -0.67 -4.86 118.33 110.07 3bf7 n VAL 186 Ca -0.11 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 3bf7 n VAL 186 Cb 0.77 -0.48 0.00 0.00 -1.47 0.00 0.00 33.84 32.65 3bf7 n VAL 186 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3bf7 n GLY 187 N 1.32 -0.74 3.59 7.63 0.00 -0.06 -1.96 105.19 114.97 3bf7 n GLY 187 Ca 0.05 -1.72 -0.09 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.65 -0.29 -0.21 1.61 -0.11 -1.26 -4.57 118.94 113.45 3bf7 s TRP 188 Ca 0.00 0.51 -0.00 0.00 1.22 0.00 0.00 56.10 57.83 3bf7 s TRP 188 Cb 0.00 0.46 0.02 0.00 -1.50 0.00 0.00 33.47 32.45 3bf7 s TRP 188 CO 0.00 -0.27 -0.13 -2.00 -4.62 0.00 0.00 176.95 169.93 3bf7 s GLU 189 N -1.06 2.91 0.30 5.86 2.56 -1.26 -4.71 118.70 123.31 3bf7 s GLU 189 Ca 0.01 -0.90 -0.29 0.00 0.00 0.00 0.00 54.97 53.79 3bf7 s GLU 189 Cb -0.01 -2.77 -0.13 0.00 2.00 0.00 0.00 34.13 33.22 3bf7 s GLU 189 CO -0.01 -0.30 1.25 1.63 -0.56 0.00 0.00 175.26 177.27 3bf7 n LYS 190 N 4.63 1.90 -4.50 4.30 5.02 -1.26 -5.01 118.16 123.25 3bf7 n LYS 190 Ca -0.19 0.67 -0.25 0.00 -2.02 0.00 0.00 58.31 56.52 3bf7 n LYS 190 Cb 0.48 -2.22 -0.10 0.00 -0.02 0.00 0.00 35.03 33.18 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 -0.81 2.38 0.80 -0.18 -4.36 -1.26 -5.13 121.20 112.64 3bf7 s ILE 191 Ca 0.60 -2.23 -0.11 0.00 -0.26 0.00 0.00 60.65 58.65 3bf7 s ILE 191 Cb -0.63 -2.57 0.07 0.00 1.25 0.00 0.00 42.46 40.59 3bf7 s ILE 191 CO 0.58 -0.26 1.11 -2.84 0.24 0.00 0.00 174.94 173.77 3bf7 s PRO 192 N -3.59 1.99 0.38 0.37 0.02 -1.26 -4.72 135.00 128.19 3bf7 s PRO 192 Ca 0.32 1.27 -0.27 0.00 0.02 0.00 0.00 61.00 62.34 3bf7 s PRO 192 Cb -0.00 -1.86 -0.10 0.00 0.02 0.00 0.00 34.50 32.56 3bf7 s PRO 192 CO 0.16 -1.86 1.36 0.00 -0.33 0.00 0.00 177.00 176.33 3bf7 s ALA 193 N -2.81 3.39 -0.38 -1.55 0.00 -1.26 -4.86 121.76 114.29 3bf7 s ALA 193 Ca 0.63 1.34 -0.11 0.00 0.00 0.00 0.00 51.96 53.82 3bf7 s ALA 193 Cb -0.19 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.44 3bf7 s ALA 193 CO 0.56 -0.87 0.21 -0.46 0.00 0.00 0.00 175.76 175.20 3bf7 s TRP 194 N -1.19 3.25 -1.04 0.00 -0.00 -0.13 -5.00 118.94 114.83 3bf7 s TRP 194 Ca 0.54 -1.00 -0.07 0.00 -0.00 0.00 0.00 56.10 55.57 3bf7 s TRP 194 Cb -0.41 -2.45 -0.05 0.00 -0.00 0.00 0.00 33.47 30.56 3bf7 s TRP 194 CO 0.54 -0.66 2.93 -0.25 -0.00 0.00 0.00 176.95 179.51 3bf7 n ASP 195 N 4.99 7.52 -3.84 5.86 8.00 -1.26 -4.32 116.55 133.49 3bf7 n ASP 195 Ca -0.12 -2.79 -0.11 0.00 0.71 0.00 0.00 54.79 52.48 3bf7 n ASP 195 Cb 0.46 -1.43 -0.09 0.00 -0.02 0.00 0.00 41.12 40.03 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 0.52 0.00 0.28 1.24 3.76 -1.26 -5.04 115.29 114.79 3bf7 s HIS 196 Ca 0.64 -0.10 -0.30 0.00 -0.15 0.00 0.00 55.06 55.15 3bf7 s HIS 196 Cb 0.24 -0.01 -0.12 0.00 1.11 0.00 0.00 32.58 33.79 3bf7 s HIS 196 CO -0.08 -0.35 1.55 -2.30 -0.85 0.00 0.00 174.74 172.71 3bf7 n PRO 197 N 1.19 2.52 -4.13 8.40 -0.02 -1.26 -4.46 135.00 137.24 3bf7 n PRO 197 Ca -0.21 0.90 -0.15 0.00 -2.02 0.00 0.00 63.50 62.01 3bf7 n PRO 197 Cb 0.57 -2.65 -0.14 0.00 -0.02 0.00 0.00 33.50 31.26 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 0.01 0.40 -0.20 3.55 0.00 -1.04 -4.50 121.76 119.98 3bf7 s ALA 198 Ca 0.65 -0.24 -0.07 0.00 0.00 0.00 0.00 51.96 52.31 3bf7 s ALA 198 Cb -0.54 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 3bf7 s ALA 198 CO 0.48 0.09 0.05 -1.17 0.00 0.00 0.00 175.76 175.21 3bf7 s LEU 199 N -0.20 3.65 -0.12 0.00 2.96 -0.28 -0.45 118.68 124.24 3bf7 s LEU 199 Ca 0.01 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.91 3bf7 s LEU 199 Cb -0.02 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.72 3bf7 s LEU 199 CO -0.00 0.12 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.64 3bf7 s PHE 200 N 0.69 2.77 -0.51 5.38 0.40 0.10 -0.50 117.98 126.30 3bf7 s PHE 200 Ca 0.03 -0.69 0.04 0.00 -0.60 0.00 0.00 56.93 55.70 3bf7 s PHE 200 Cb -0.13 -1.82 0.13 0.00 0.51 0.00 0.00 43.02 41.71 3bf7 s PHE 200 CO 0.02 -0.23 0.26 0.42 0.70 0.00 0.00 175.22 176.39 3bf7 s ILE 201 N 0.32 2.48 0.47 0.64 1.01 -0.37 -0.84 121.20 124.91 3bf7 s ILE 201 Ca -0.12 -3.27 -0.14 0.00 0.00 0.00 0.00 60.65 57.12 3bf7 s ILE 201 Cb -0.16 -2.72 -0.07 0.00 0.01 0.00 0.00 42.46 39.51 3bf7 s ILE 201 CO 0.06 -0.81 0.90 -2.84 0.00 0.00 0.00 174.94 172.25 3bf7 s PRO 202 N -0.25 3.88 -0.06 2.79 0.02 -1.24 -0.44 135.00 139.70 3bf7 s PRO 202 Ca 0.17 0.76 -0.20 0.00 0.02 0.00 0.00 61.00 61.75 3bf7 s PRO 202 Cb -0.26 -2.24 -0.04 0.00 0.02 0.00 0.00 34.50 31.98 3bf7 s PRO 202 CO -0.00 -0.17 0.57 0.20 -0.33 0.00 0.00 177.00 177.27 3bf7 s GLY 203 N -3.09 2.53 0.58 0.52 0.00 -1.26 -1.16 107.32 105.44 3bf7 s GLY 203 Ca 0.56 -0.03 0.27 0.00 0.00 0.00 0.00 44.72 45.52 3bf7 s GLY 203 CO 0.31 0.85 2.23 -1.33 0.00 0.00 0.00 173.10 175.16 3bf7 h GLY 204 N 6.29 0.00 -3.41 0.20 0.00 -0.46 -2.09 103.07 103.59 3bf7 h GLY 204 Ca -0.43 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.43 3bf7 h GLY 204 CO 0.73 0.00 0.30 0.70 0.00 0.00 0.00 176.54 178.27 3bf7 n ASN 205 N -3.97 4.71 -4.10 0.19 3.02 0.49 -4.83 115.26 110.77 3bf7 n ASN 205 Ca -0.03 -3.74 -0.18 0.00 -0.03 0.00 0.00 54.58 50.60 3bf7 n ASN 205 Cb 0.10 -0.75 -0.13 0.00 -0.61 0.00 0.00 39.78 38.39 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 -2.15 1.37 0.00 6.41 0.15 -0.79 -4.63 113.70 114.06 3bf7 s SER 206 Ca 0.55 -0.42 0.25 0.00 0.70 0.00 0.00 55.95 57.03 3bf7 s SER 206 Cb 0.46 -0.08 0.77 0.00 -1.71 0.00 0.00 66.02 65.46 3bf7 s SER 206 CO 0.03 -0.00 1.58 -0.81 1.20 0.00 0.00 173.24 175.24 3bf7 n PRO 207 N 1.99 1.87 0.18 5.44 -0.04 -1.26 -4.43 135.00 138.74 3bf7 n PRO 207 Ca -0.18 -1.28 0.05 0.00 -0.04 0.00 0.00 63.50 62.06 3bf7 n PRO 207 Cb 0.55 -1.46 0.52 0.00 -0.04 0.00 0.00 33.50 33.08 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 2.88 0.15 -0.58 0.54 0.05 -1.91 -3.16 116.97 114.93 3bf7 h TYR 208 Ca 0.00 -0.00 -0.41 0.00 0.05 0.00 0.00 58.73 58.37 3bf7 h TYR 208 Cb 0.62 -0.05 -0.40 0.00 1.01 0.00 0.00 36.73 37.91 3bf7 h TYR 208 CO 0.05 0.18 -0.92 0.28 -1.05 0.00 0.00 178.16 176.70 3bf7 n VAL 209 N -4.43 2.00 -1.18 -2.88 0.31 -1.26 -3.82 118.33 107.07 3bf7 n VAL 209 Ca -0.01 -3.63 -0.29 0.00 -0.01 0.00 0.00 64.34 60.39 3bf7 n VAL 209 Cb 0.15 -0.18 0.16 0.00 -0.91 0.00 0.00 33.84 33.06 3bf7 n VAL 209 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3bf7 s SER 210 N -3.61 3.02 0.48 4.52 0.01 -1.20 -4.89 113.70 112.03 3bf7 s SER 210 Ca 0.42 1.34 0.25 0.00 1.31 0.00 0.00 55.95 59.27 3bf7 s SER 210 Cb 0.38 -2.01 1.29 0.00 0.21 0.00 0.00 66.02 65.88 3bf7 s SER 210 CO 0.00 -2.90 1.86 -0.08 0.41 0.00 0.00 173.24 172.53 3bf7 h GLU 211 N -1.73 0.19 0.00 12.44 4.57 -1.98 -1.38 114.58 126.69 3bf7 h GLU 211 Ca -0.52 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 3bf7 h GLU 211 Cb 1.31 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 3bf7 h GLU 211 CO 0.56 0.13 0.00 -0.56 -1.18 0.00 0.00 179.01 177.96 3bf7 h GLN 212 N 0.20 0.00 -0.02 1.92 3.07 -1.97 -1.74 115.11 116.57 3bf7 h GLN 212 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.20 3bf7 h GLN 212 Cb 1.49 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.05 3bf7 h GLN 212 CO -0.10 0.00 -0.16 0.66 0.09 0.00 0.00 178.83 179.32 3bf7 n TYR 213 N -3.05 0.00 -0.11 0.06 4.01 -0.52 -4.67 117.16 112.89 3bf7 n TYR 213 Ca -0.03 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.66 3bf7 n TYR 213 Cb 0.09 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.14 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 3.00 0.22 -0.46 -0.72 2.43 -1.37 -0.49 114.38 116.99 3bf7 h ARG 214 Ca 0.00 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3bf7 h ARG 214 Cb 0.72 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 3bf7 h ARG 214 CO 0.00 0.15 0.24 -0.44 -1.51 0.00 0.00 179.97 178.40 3bf7 h ASP 215 N 0.23 0.59 -0.38 -3.80 3.32 -1.83 -0.10 116.42 114.45 3bf7 h ASP 215 Ca 0.17 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 3bf7 h ASP 215 Cb 0.18 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 3bf7 h ASP 215 CO -0.21 0.54 0.00 0.44 -1.72 0.00 0.00 179.24 178.29 3bf7 h ASP 216 N 0.61 0.74 -0.12 6.45 3.45 -1.83 -0.89 116.42 124.82 3bf7 h ASP 216 Ca 0.16 -0.17 -0.01 0.00 0.43 0.00 0.00 57.03 57.44 3bf7 h ASP 216 Cb 0.09 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 38.66 3bf7 h ASP 216 CO -0.02 0.80 0.03 0.25 -1.57 0.00 0.00 179.24 178.73 3bf7 h LEU 217 N 0.72 0.18 -1.38 1.55 6.46 -0.66 -3.01 115.31 119.17 3bf7 h LEU 217 Ca 0.14 -0.23 -0.03 0.00 -0.12 0.00 0.00 57.88 57.65 3bf7 h LEU 217 Cb 0.44 -0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 40.32 3bf7 h LEU 217 CO 0.02 0.36 -0.13 -0.07 -0.62 0.00 0.00 178.44 178.00 3bf7 h LEU 218 N -0.01 0.00 -1.24 2.25 3.38 -0.81 0.21 115.31 119.10 3bf7 h LEU 218 Ca 0.04 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 3bf7 h LEU 218 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3bf7 h LEU 218 CO 0.00 0.13 -0.31 0.00 0.09 0.00 0.00 178.44 178.35 3bf7 h ALA 219 N 1.87 1.14 0.00 1.53 0.00 -1.03 -2.12 119.26 120.66 3bf7 h ALA 219 Ca -0.00 -0.28 -0.28 0.00 0.00 0.00 0.00 54.91 54.35 3bf7 h ALA 219 Cb 0.60 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 3bf7 h ALA 219 CO 0.02 0.38 -2.08 1.04 0.00 0.00 0.00 179.25 178.61 3bf7 n GLN 220 N -3.66 1.37 -3.35 0.00 6.02 -0.95 -4.22 117.38 112.59 3bf7 n GLN 220 Ca -0.01 -0.01 -0.26 0.00 -0.01 0.00 0.00 57.00 56.71 3bf7 n GLN 220 Cb 0.42 -1.41 -0.08 0.00 1.02 0.00 0.00 30.24 30.19 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 -2.57 1.45 0.32 1.08 3.72 0.70 -0.95 117.46 121.21 3bf7 n PHE 221 Ca -0.25 -3.83 0.20 0.00 -0.05 0.00 0.00 57.45 53.52 3bf7 n PHE 221 Cb 1.00 -0.40 1.11 0.00 -0.94 0.00 0.00 39.48 40.25 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 4.31 0.00 -0.68 -1.08 0.13 -1.57 -1.51 132.00 131.60 3bf7 h PRO 222 Ca 0.14 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.95 3bf7 h PRO 222 Cb 0.79 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 31.72 3bf7 h PRO 222 CO 0.62 0.00 0.29 1.04 -0.23 0.00 0.00 178.00 179.72 3bf7 n GLN 223 N -3.37 2.31 -2.24 0.86 6.02 -1.26 -5.00 117.38 114.71 3bf7 n GLN 223 Ca -0.03 -3.08 -0.39 0.00 -0.01 0.00 0.00 57.00 53.48 3bf7 n GLN 223 Cb 0.08 -2.03 -0.02 0.00 1.02 0.00 0.00 30.24 29.29 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 -3.22 3.30 -0.14 -1.58 0.00 -0.57 -2.49 121.76 117.06 3bf7 s ALA 224 Ca 0.51 1.07 0.02 0.00 0.00 0.00 0.00 51.96 53.57 3bf7 s ALA 224 Cb 0.44 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 20.16 3bf7 s ALA 224 CO 0.07 -0.54 -0.21 1.03 0.00 0.00 0.00 175.76 176.11 3bf7 s ARG 225 N -2.02 2.90 -0.21 0.00 0.52 0.41 -4.91 118.95 115.63 3bf7 s ARG 225 Ca 0.53 -0.81 -0.08 0.00 -0.52 0.00 0.00 55.73 54.85 3bf7 s ARG 225 Cb -0.34 -2.38 -0.04 0.00 0.52 0.00 0.00 34.95 32.71 3bf7 s ARG 225 CO 0.44 -0.05 0.09 0.00 0.02 0.00 0.00 175.30 175.80 3bf7 s ALA 226 N 0.92 3.40 -0.46 2.13 0.00 -1.26 -0.72 121.76 125.77 3bf7 s ALA 226 Ca -0.05 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.08 3bf7 s ALA 226 Cb -0.15 -2.05 0.12 0.00 0.00 0.00 0.00 23.12 21.04 3bf7 s ALA 226 CO -0.04 -0.06 0.21 -1.58 0.00 0.00 0.00 175.76 174.29 3bf7 s HIS 227 N 0.82 2.87 0.06 0.00 5.04 -0.02 -4.99 115.29 119.07 3bf7 s HIS 227 Ca 0.05 -2.87 -0.30 0.00 -1.54 0.00 0.00 55.06 50.40 3bf7 s HIS 227 Cb -0.13 -2.53 -0.05 0.00 0.04 0.00 0.00 32.58 29.91 3bf7 s HIS 227 CO 0.02 -0.79 1.09 0.08 -2.34 0.00 0.00 174.74 172.80 3bf7 s VAL 228 N 0.18 4.34 -0.46 0.89 1.01 -1.26 -3.61 120.40 121.49 3bf7 s VAL 228 Ca 0.16 1.73 -0.17 0.00 0.00 0.00 0.00 61.98 63.70 3bf7 s VAL 228 Cb -0.24 -4.11 0.05 0.00 0.00 0.00 0.00 36.38 32.08 3bf7 s VAL 228 CO -0.03 0.16 0.45 -0.63 0.00 0.00 0.00 175.10 175.06 3bf7 s ILE 229 N 0.81 5.12 0.50 2.22 -1.09 -0.31 -4.89 121.20 123.55 3bf7 s ILE 229 Ca 0.54 -0.74 -0.23 0.00 -2.23 0.00 0.00 60.65 57.99 3bf7 s ILE 229 Cb -0.26 -4.13 -0.07 0.00 -1.58 0.00 0.00 42.46 36.42 3bf7 s ILE 229 CO 0.30 -0.58 1.37 0.00 -1.23 0.00 0.00 174.94 174.79 3bf7 n ALA 230 N 5.52 1.69 -2.12 9.38 0.00 -1.26 -0.50 120.51 133.22 3bf7 n ALA 230 Ca -0.10 0.19 -0.16 0.00 0.00 0.00 0.00 53.44 53.37 3bf7 n ALA 230 Cb 0.45 -2.35 -0.02 0.00 0.00 0.00 0.00 19.45 17.53 3bf7 n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bf7 n GLY 231 N 0.71 0.14 3.23 0.00 0.00 -1.26 -4.80 105.19 103.21 3bf7 n GLY 231 Ca 0.08 -0.21 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.77 1.71 0.59 4.61 0.00 -1.17 -4.90 121.76 119.83 3bf7 s ALA 232 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 50.99 3bf7 s ALA 232 Cb 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.75 3bf7 s ALA 232 CO 0.00 0.40 0.00 0.41 0.00 0.00 0.00 175.76 176.57 3bf7 n GLY 233 N 2.17 0.44 0.34 0.00 0.00 -1.26 -0.38 105.19 106.50 3bf7 n GLY 233 Ca -0.16 -1.79 -0.03 0.00 0.00 0.00 0.00 46.02 44.04 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 1.06 -1.62 1.61 2.76 -1.92 -3.15 115.15 113.89 3bf7 h HIS 234 Ca 0.00 -0.04 -0.76 0.00 -2.20 0.00 0.00 60.37 57.36 3bf7 h HIS 234 Cb 0.00 -0.33 -0.17 0.00 1.55 0.00 0.00 27.41 28.45 3bf7 h HIS 234 CO 0.00 0.77 1.87 0.91 -1.30 0.00 0.00 177.93 180.18 3bf7 n TRP 235 N -4.33 2.71 -0.23 5.26 8.01 -1.26 -4.74 117.44 122.86 3bf7 n TRP 235 Ca 0.07 -2.74 0.04 0.00 -1.31 0.00 0.00 57.50 53.56 3bf7 n TRP 235 Cb 0.13 -1.76 0.15 0.00 -2.01 0.00 0.00 31.31 27.83 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 3.30 0.58 0.00 -0.99 2.07 -1.92 -0.87 116.25 118.42 3bf7 h VAL 236 Ca 0.45 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.84 3bf7 h VAL 236 Cb 0.52 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 3bf7 h VAL 236 CO 1.52 0.05 -0.13 1.12 0.02 0.00 0.00 177.57 180.15 3bf7 h HIS 237 N 0.29 0.00 0.09 1.57 2.07 -1.87 0.46 115.15 117.77 3bf7 h HIS 237 Ca 0.38 0.00 -0.26 0.00 -2.85 0.00 0.00 60.37 57.64 3bf7 h HIS 237 Cb 0.60 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.58 3bf7 h HIS 237 CO -0.24 0.13 -1.15 0.00 -3.07 0.00 0.00 177.93 173.59 3bf7 h ALA 238 N 1.87 0.19 0.11 6.11 0.00 -1.52 -3.00 119.26 123.01 3bf7 h ALA 238 Ca -0.00 -0.84 -0.24 0.00 0.00 0.00 0.00 54.91 53.83 3bf7 h ALA 238 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3bf7 h ALA 238 CO 0.02 0.95 -1.19 0.93 0.00 0.00 0.00 179.25 179.95 3bf7 h GLU 239 N 0.10 0.23 -2.05 0.00 5.08 -1.15 -3.42 114.58 113.37 3bf7 h GLU 239 Ca -0.11 -0.40 -0.56 0.00 -1.00 0.00 0.00 59.36 57.29 3bf7 h GLU 239 Cb 1.85 0.15 -0.40 0.00 0.50 0.00 0.00 28.75 30.85 3bf7 h GLU 239 CO 0.19 1.19 -1.00 1.63 -1.00 0.00 0.00 179.01 180.02 3bf7 n LYS 240 N -4.03 1.24 -0.31 2.33 5.02 0.12 -4.96 118.16 117.57 3bf7 n LYS 240 Ca -0.22 -3.62 0.05 0.00 -2.02 0.00 0.00 58.31 52.50 3bf7 n LYS 240 Cb 0.85 -1.55 0.25 0.00 -0.02 0.00 0.00 35.03 34.56 3bf7 n LYS 240 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3bf7 h PRO 241 N 3.83 0.97 -0.36 1.97 0.13 -1.68 -1.91 132.00 134.96 3bf7 h PRO 241 Ca 0.10 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 65.15 3bf7 h PRO 241 Cb 0.83 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 31.73 3bf7 h PRO 241 CO 0.56 0.64 0.13 -0.44 -0.23 0.00 0.00 178.00 178.66 3bf7 h ASP 242 N 1.00 0.50 -0.78 1.44 3.32 -1.93 0.95 116.42 120.93 3bf7 h ASP 242 Ca 0.41 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 3bf7 h ASP 242 Cb 0.27 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 3bf7 h ASP 242 CO -0.16 0.55 0.40 0.00 -1.72 0.00 0.00 179.24 178.30 3bf7 h ALA 243 N 0.97 1.21 -0.36 3.45 0.00 -1.87 0.56 119.26 123.21 3bf7 h ALA 243 Ca 0.12 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3bf7 h ALA 243 Cb 0.22 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3bf7 h ALA 243 CO -0.01 0.62 0.03 0.28 0.00 0.00 0.00 179.25 180.16 3bf7 h VAL 244 N 1.12 1.25 -0.41 0.00 2.07 -1.02 -2.58 116.25 116.68 3bf7 h VAL 244 Ca 0.27 -0.93 -0.06 0.00 0.82 0.00 0.00 66.70 66.81 3bf7 h VAL 244 Cb 0.09 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3bf7 h VAL 244 CO -0.04 0.31 0.02 -0.07 0.02 0.00 0.00 177.57 177.81 3bf7 h LEU 245 N 0.45 0.61 -0.63 2.57 3.38 -0.28 -0.60 115.31 120.81 3bf7 h LEU 245 Ca 0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 3bf7 h LEU 245 Cb 0.42 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3bf7 h LEU 245 CO 0.01 0.67 0.32 0.03 0.09 0.00 0.00 178.44 179.56 3bf7 h ARG 246 N 0.62 0.90 -0.32 1.13 3.08 -0.74 -0.03 114.38 119.02 3bf7 h ARG 246 Ca 0.13 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 3bf7 h ARG 246 Cb 0.36 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 3bf7 h ARG 246 CO 0.01 0.71 0.03 0.00 -1.07 0.00 0.00 179.97 179.65 3bf7 h ALA 247 N 1.14 0.42 0.02 0.04 0.00 -1.04 -2.06 119.26 117.78 3bf7 h ALA 247 Ca 0.22 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3bf7 h ALA 247 Cb 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3bf7 h ALA 247 CO -0.03 0.14 -0.01 0.82 0.00 0.00 0.00 179.25 180.17 3bf7 h ILE 248 N 0.35 1.01 -0.38 0.00 2.04 -0.87 -2.48 117.51 117.18 3bf7 h ILE 248 Ca 0.09 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.81 3bf7 h ILE 248 Cb 0.38 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 3bf7 h ILE 248 CO 0.01 0.02 -0.02 0.03 0.00 0.00 0.00 178.15 178.20 3bf7 h ARG 249 N -0.06 0.61 -0.55 2.37 3.08 -1.00 0.73 114.38 119.55 3bf7 h ARG 249 Ca -0.00 -0.15 0.03 0.00 0.07 0.00 0.00 59.98 59.93 3bf7 h ARG 249 Cb 0.05 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 29.99 3bf7 h ARG 249 CO 0.00 0.64 0.33 -0.09 -1.07 0.00 0.00 179.97 179.78 3bf7 h ARG 250 N 0.57 0.63 -0.27 0.04 2.43 -1.22 0.11 114.38 116.67 3bf7 h ARG 250 Ca 0.12 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 3bf7 h ARG 250 Cb 0.39 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 3bf7 h ARG 250 CO 0.02 0.42 -0.07 -0.92 -1.51 0.00 0.00 179.97 177.91 3bf7 h TYR 251 N 0.65 0.58 -0.23 2.20 3.20 -0.95 -2.97 116.97 119.45 3bf7 h TYR 251 Ca 0.22 -0.13 -0.06 0.00 3.14 0.00 0.00 58.73 61.91 3bf7 h TYR 251 Cb 0.03 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 3bf7 h TYR 251 CO -0.06 0.73 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.99 3bf7 h LEU 252 N 0.27 0.36 -1.33 2.82 3.38 -0.56 -2.59 115.31 117.66 3bf7 h LEU 252 Ca 0.07 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 3bf7 h LEU 252 Cb 0.54 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3bf7 h LEU 252 CO 0.03 0.52 -0.21 0.78 0.09 0.00 0.00 178.44 179.65 3bf7 h ASN 253 N 0.36 0.00 0.00 -0.43 -0.26 -0.71 -3.51 115.58 111.03 3bf7 h ASN 253 Ca 0.07 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 3bf7 h ASN 253 Cb 0.43 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.69 3bf7 h ASN 253 CO 0.02 0.21 0.00 0.47 -1.06 0.00 0.00 177.43 177.07