#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bdm s THR 2 N 0.00 0.37 0.01 12.58 2.01 -1.26 -0.14 115.64 129.21 3bdm s THR 2 Ca 0.00 0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.09 3bdm s THR 2 Cb 0.00 -0.57 -0.01 0.00 0.01 0.00 0.00 72.50 71.93 3bdm s THR 2 CO 0.00 0.21 -0.10 0.27 -0.69 0.00 0.00 174.62 174.31 3bdm s ILE 3 N 1.97 0.75 0.07 1.82 -4.36 -0.85 -1.77 121.20 118.82 3bdm s ILE 3 Ca 0.04 -0.62 -0.01 0.00 -0.26 0.00 0.00 60.65 59.81 3bdm s ILE 3 Cb -0.13 -0.67 -0.04 0.00 1.25 0.00 0.00 42.46 42.87 3bdm s ILE 3 CO -0.06 0.06 -0.02 0.68 0.24 0.00 0.00 174.94 175.85 3bdm s VAL 4 N -0.53 0.22 -0.03 8.37 -7.23 -0.41 -1.80 120.40 119.00 3bdm s VAL 4 Ca 0.01 -1.83 0.01 0.00 -1.81 0.00 0.00 61.98 58.35 3bdm s VAL 4 Cb -0.05 -1.63 0.03 0.00 0.56 0.00 0.00 36.38 35.29 3bdm s VAL 4 CO 0.00 -0.89 -0.01 -0.83 -0.31 0.00 0.00 175.10 173.06 3bdm s GLY 5 N -2.95 0.27 -0.05 2.32 0.00 0.70 -1.90 107.32 105.71 3bdm s GLY 5 Ca 0.10 0.12 -0.01 0.00 0.00 0.00 0.00 44.72 44.93 3bdm s GLY 5 CO -0.08 0.54 0.02 0.14 0.00 0.00 0.00 173.10 173.73 3bdm s VAL 6 N 0.95 0.16 0.11 1.40 1.01 0.16 -1.14 120.40 123.05 3bdm s VAL 6 Ca -0.10 0.23 -0.19 0.00 0.00 0.00 0.00 61.98 61.92 3bdm s VAL 6 Cb -0.13 -0.35 -0.07 0.00 0.00 0.00 0.00 36.38 35.83 3bdm s VAL 6 CO -0.01 0.21 0.59 -0.54 0.00 0.00 0.00 175.10 175.35 3bdm s LYS 7 N 1.89 4.19 0.38 2.72 1.02 0.76 -1.10 119.74 129.60 3bdm s LYS 7 Ca 0.03 0.73 0.04 0.00 0.02 0.00 0.00 55.97 56.78 3bdm s LYS 7 Cb -0.12 -3.15 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 3bdm s LYS 7 CO -0.04 0.58 0.08 -0.59 -0.92 0.00 0.00 175.35 174.46 3bdm s PHE 8 N -1.22 1.91 0.50 3.18 -0.12 -0.49 -4.66 117.98 117.08 3bdm s PHE 8 Ca 0.32 -1.07 0.41 0.00 -0.05 0.00 0.00 56.93 56.54 3bdm s PHE 8 Cb -0.19 -1.29 1.60 0.00 -0.63 0.00 0.00 43.02 42.51 3bdm s PHE 8 CO 0.20 -0.07 1.59 -2.95 -0.05 0.00 0.00 175.22 173.94 3bdm h ASN 9 N 1.89 0.11 -0.05 1.98 7.08 -1.05 -2.71 115.58 122.83 3bdm h ASN 9 Ca -0.39 0.07 -0.16 0.00 -3.08 0.00 0.00 56.30 52.75 3bdm h ASN 9 Cb 1.26 0.07 -0.31 0.00 -2.08 0.00 0.00 38.32 37.27 3bdm h ASN 9 CO 0.66 -0.12 -0.93 -3.20 -2.08 0.00 0.00 177.43 171.76 3bdm n ASN 10 N -4.34 1.29 0.00 6.14 5.15 -1.26 -5.06 115.26 117.17 3bdm n ASN 10 Ca 0.41 -2.44 0.00 0.00 -0.60 0.00 0.00 54.58 51.95 3bdm n ASN 10 Cb 1.74 -0.36 0.00 0.00 -0.53 0.00 0.00 39.78 40.63 3bdm n ASN 10 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3bdm n GLY 11 N 0.05 -0.52 3.13 8.20 0.00 -1.02 -0.22 105.19 114.81 3bdm n GLY 11 Ca 0.10 -0.92 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 3bdm n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bdm s VAL 12 N -3.31 0.10 -0.01 1.61 0.11 -0.28 -1.40 120.40 117.22 3bdm s VAL 12 Ca 0.00 -0.79 0.02 0.00 -2.93 0.00 0.00 61.98 58.28 3bdm s VAL 12 Cb 0.00 -0.61 -0.00 0.00 -1.53 0.00 0.00 36.38 34.24 3bdm s VAL 12 CO 0.00 -0.43 -0.06 0.54 -3.33 0.00 0.00 175.10 171.82 3bdm s VAL 13 N -1.80 0.46 0.03 2.04 0.11 -0.26 -1.29 120.40 119.68 3bdm s VAL 13 Ca -0.11 -0.25 0.06 0.00 -2.93 0.00 0.00 61.98 58.75 3bdm s VAL 13 Cb -0.05 -0.39 -0.02 0.00 -1.53 0.00 0.00 36.38 34.38 3bdm s VAL 13 CO -0.00 0.13 -0.18 0.27 -3.33 0.00 0.00 175.10 171.99 3bdm s ILE 14 N -0.12 1.46 0.16 7.04 -4.36 -0.91 -0.67 121.20 123.80 3bdm s ILE 14 Ca 0.02 -1.04 0.01 0.00 -0.26 0.00 0.00 60.65 59.38 3bdm s ILE 14 Cb -0.02 -1.27 -0.04 0.00 1.25 0.00 0.00 42.46 42.37 3bdm s ILE 14 CO -0.00 0.20 0.02 0.00 0.24 0.00 0.00 174.94 175.40 3bdm s ALA 15 N -0.71 1.17 0.18 2.27 0.00 -0.80 -1.22 121.76 122.64 3bdm s ALA 15 Ca 0.06 -1.54 -0.23 0.00 0.00 0.00 0.00 51.96 50.24 3bdm s ALA 15 Cb -0.08 0.65 0.06 0.00 0.00 0.00 0.00 23.12 23.75 3bdm s ALA 15 CO 0.01 -0.38 0.70 0.00 0.00 0.00 0.00 175.76 176.10 3bdm s ALA 16 N -3.80 -1.52 0.80 0.00 0.00 -0.33 -1.29 121.76 115.63 3bdm s ALA 16 Ca 0.24 0.28 -0.05 0.00 0.00 0.00 0.00 51.96 52.42 3bdm s ALA 16 Cb 0.07 0.80 0.15 0.00 0.00 0.00 0.00 23.12 24.14 3bdm s ALA 16 CO 0.03 -0.87 1.00 -0.40 0.00 0.00 0.00 175.76 175.52 3bdm n ASP 17 N -0.40 0.84 -0.28 0.00 5.75 -0.73 -0.83 116.55 120.91 3bdm n ASP 17 Ca -0.11 -1.83 0.07 0.00 -0.01 0.00 0.00 54.79 52.91 3bdm n ASP 17 Cb 0.62 -0.70 0.12 0.00 -1.03 0.00 0.00 41.12 40.14 3bdm n ASP 17 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3bdm n THR 18 N -3.03 1.51 -3.77 2.12 -2.24 -1.07 -4.52 114.28 103.27 3bdm n THR 18 Ca 0.15 -1.93 -0.35 0.00 -2.27 0.00 0.00 64.05 59.64 3bdm n THR 18 Cb 0.53 -0.05 -0.08 0.00 -2.10 0.00 0.00 70.33 68.63 3bdm n THR 18 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3bdm s ARG 19 N -2.28 4.02 0.03 -0.78 3.52 -1.21 -0.50 118.95 121.75 3bdm s ARG 19 Ca 0.27 -0.20 0.08 0.00 -0.13 0.00 0.00 55.73 55.75 3bdm s ARG 19 Cb 0.24 -3.36 -0.03 0.00 -1.56 0.00 0.00 34.95 30.24 3bdm s ARG 19 CO 0.00 0.41 -0.24 0.45 -0.81 0.00 0.00 175.30 175.11 3bdm s SER 20 N 0.05 3.33 0.12 -2.12 0.15 -0.60 -4.61 113.70 110.02 3bdm s SER 20 Ca 0.09 -0.51 -0.06 0.00 0.70 0.00 0.00 55.95 56.17 3bdm s SER 20 Cb -0.11 -0.40 -0.02 0.00 -1.71 0.00 0.00 66.02 63.78 3bdm s SER 20 CO -0.01 0.27 0.16 0.42 1.20 0.00 0.00 173.24 175.29 3bdm s THR 21 N -0.79 0.12 -0.25 6.45 -4.23 -1.26 0.36 115.64 116.04 3bdm s THR 21 Ca 0.12 -1.52 -0.03 0.00 -1.18 0.00 0.00 61.69 59.09 3bdm s THR 21 Cb -0.10 -1.70 0.08 0.00 1.34 0.00 0.00 72.50 72.12 3bdm s THR 21 CO 0.02 -0.54 0.08 -1.10 -0.54 0.00 0.00 174.62 172.54 3bdm s GLN 22 N -3.95 0.51 7.24 3.99 -0.21 -0.53 -4.81 119.66 121.90 3bdm s GLN 22 Ca 0.14 -0.61 0.00 0.00 0.02 0.00 0.00 55.36 54.91 3bdm s GLN 22 Cb 0.05 -1.83 0.00 0.00 1.00 0.00 0.00 33.01 32.24 3bdm s GLN 22 CO -0.04 -0.84 0.00 0.41 -2.12 0.00 0.00 175.29 172.70 3bdm n GLY 23 N 5.06 2.31 1.09 3.09 0.00 -1.26 -2.23 105.19 113.25 3bdm n GLY 23 Ca -0.06 -0.33 0.10 0.00 0.00 0.00 0.00 46.02 45.73 3bdm n GLY 23 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3bdm n PRO 24 N 13.06 2.56 -3.50 1.61 -0.04 -1.26 -4.93 135.00 142.50 3bdm n PRO 24 Ca 0.00 -2.33 -0.37 0.00 -0.04 0.00 0.00 63.50 60.76 3bdm n PRO 24 Cb 0.00 -1.47 -0.07 0.00 -0.04 0.00 0.00 33.50 31.93 3bdm n PRO 24 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3bdm s ILE 25 N -1.15 5.26 -0.27 0.52 1.09 -0.94 -5.04 121.20 120.67 3bdm s ILE 25 Ca 0.38 0.65 -0.29 0.00 -1.10 0.00 0.00 60.65 60.29 3bdm s ILE 25 Cb 0.21 -3.67 -0.00 0.00 -1.06 0.00 0.00 42.46 37.93 3bdm s ILE 25 CO 0.28 0.41 1.34 -0.69 -0.10 0.00 0.00 174.94 176.17 3bdm s VAL 26 N 0.27 4.10 -0.11 2.92 1.01 -1.26 -1.45 120.40 125.88 3bdm s VAL 26 Ca 0.19 1.25 -0.24 0.00 0.00 0.00 0.00 61.98 63.19 3bdm s VAL 26 Cb -0.14 -4.07 -0.20 0.00 0.00 0.00 0.00 36.38 31.97 3bdm s VAL 26 CO 0.06 -0.40 0.76 0.00 0.00 0.00 0.00 175.10 175.52 3bdm h ALA 27 N 9.33 -0.03 -3.19 5.51 0.00 -0.41 -3.45 119.26 127.03 3bdm h ALA 27 Ca -0.27 -0.36 -0.52 0.00 0.00 0.00 0.00 54.91 53.75 3bdm h ALA 27 Cb 1.11 0.01 -0.37 0.00 0.00 0.00 0.00 17.79 18.54 3bdm h ALA 27 CO 1.02 -0.08 -0.80 0.34 0.00 0.00 0.00 179.25 179.73 3bdm s ASP 28 N -5.96 2.17 0.24 0.00 3.68 -1.11 -4.99 116.67 110.71 3bdm s ASP 28 Ca -0.15 -0.30 0.24 0.00 2.13 0.00 0.00 52.55 54.46 3bdm s ASP 28 Cb -0.02 -0.83 0.94 0.00 -1.45 0.00 0.00 42.92 41.57 3bdm s ASP 28 CO 0.57 -0.12 1.73 0.29 0.13 0.00 0.00 175.17 177.76 3bdm n LYS 29 N 4.95 0.21 -2.91 4.34 5.02 -1.26 -1.55 118.16 126.95 3bdm n LYS 29 Ca -0.12 0.37 -0.14 0.00 -2.02 0.00 0.00 58.31 56.40 3bdm n LYS 29 Cb 0.50 -1.85 0.01 0.00 -0.02 0.00 0.00 35.03 33.68 3bdm n LYS 29 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3bdm n ASN 30 N -2.22 -1.66 -4.95 4.39 4.05 -1.00 -4.45 115.26 109.41 3bdm n ASN 30 Ca 0.03 -3.16 -0.23 0.00 0.45 0.00 0.00 54.58 51.67 3bdm n ASN 30 Cb 0.28 0.95 -0.00 0.00 1.23 0.00 0.00 39.78 42.24 3bdm n ASN 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3bdm s ALA 32 N -2.40 3.51 -2.40 0.00 0.00 -1.26 -4.47 121.76 114.74 3bdm s ALA 32 Ca 0.44 -1.34 0.23 0.00 0.00 0.00 0.00 51.96 51.29 3bdm s ALA 32 Cb -0.10 -2.68 0.48 0.00 0.00 0.00 0.00 23.12 20.82 3bdm s ALA 32 CO 0.36 -0.96 1.43 1.63 0.00 0.00 0.00 175.76 178.22 3bdm n LYS 33 N 5.15 2.48 -3.57 0.00 5.02 -1.26 -4.84 118.16 121.13 3bdm n LYS 33 Ca -0.12 -2.25 -0.39 0.00 -2.02 0.00 0.00 58.31 53.53 3bdm n LYS 33 Cb 0.50 -1.51 -0.11 0.00 -0.02 0.00 0.00 35.03 33.89 3bdm n LYS 33 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3bdm s LEU 34 N -1.42 4.21 -0.06 -0.35 1.02 -1.26 -1.51 118.68 119.31 3bdm s LEU 34 Ca 0.40 -0.18 0.03 0.00 0.02 0.00 0.00 54.13 54.39 3bdm s LEU 34 Cb 0.23 -2.12 -0.03 0.00 0.02 0.00 0.00 46.19 44.29 3bdm s LEU 34 CO 0.31 -0.12 -0.13 -1.00 0.02 0.00 0.00 176.35 175.43 3bdm s HIS 35 N 1.74 2.75 -0.36 0.29 3.76 0.17 -4.96 115.29 118.68 3bdm s HIS 35 Ca 0.07 -0.17 -0.18 0.00 -0.15 0.00 0.00 55.06 54.64 3bdm s HIS 35 Cb -0.17 -1.66 -0.00 0.00 1.11 0.00 0.00 32.58 31.86 3bdm s HIS 35 CO 0.11 0.18 0.48 0.50 -0.85 0.00 0.00 174.74 175.16 3bdm s ARG 36 N -0.66 3.57 -0.06 1.40 3.52 -1.26 0.76 118.95 126.22 3bdm s ARG 36 Ca 0.10 -0.26 -0.12 0.00 -0.13 0.00 0.00 55.73 55.32 3bdm s ARG 36 Cb -0.11 -3.82 -0.30 0.00 -1.56 0.00 0.00 34.95 29.16 3bdm s ARG 36 CO 0.01 -0.64 0.65 0.82 -0.81 0.00 0.00 175.30 175.33 3bdm h ILE 37 N 5.61 0.96 -3.67 4.11 2.04 -1.41 -3.48 117.51 121.67 3bdm h ILE 37 Ca -0.28 -2.49 -0.07 0.00 1.00 0.00 0.00 64.86 63.02 3bdm h ILE 37 Cb 1.13 2.76 -0.11 0.00 -0.74 0.00 0.00 36.82 39.86 3bdm h ILE 37 CO 0.76 0.83 -0.17 -0.94 0.00 0.00 0.00 178.15 178.64 3bdm s SER 38 N -7.25 -0.08 0.43 1.72 1.04 -1.06 -4.52 113.70 103.98 3bdm s SER 38 Ca -0.17 -0.81 0.27 0.00 0.48 0.00 0.00 55.95 55.73 3bdm s SER 38 Cb 0.05 0.53 1.34 0.00 0.10 0.00 0.00 66.02 68.04 3bdm s SER 38 CO 0.84 -1.02 1.66 -0.65 0.98 0.00 0.00 173.24 175.05 3bdm h PRO 39 N 2.35 0.16 0.00 4.02 0.11 -2.01 -2.34 132.00 134.29 3bdm h PRO 39 Ca -0.29 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.77 3bdm h PRO 39 Cb 1.24 -0.04 -0.09 0.00 0.11 0.00 0.00 31.00 32.23 3bdm h PRO 39 CO 0.41 0.10 -0.55 1.63 -0.21 0.00 0.00 178.00 179.38 3bdm n LYS 40 N -4.67 1.09 -3.58 1.05 5.02 -1.26 -4.53 118.16 111.27 3bdm n LYS 40 Ca 0.34 -2.77 -0.29 0.00 -2.02 0.00 0.00 58.31 53.57 3bdm n LYS 40 Cb 1.29 -1.16 -0.14 0.00 -0.02 0.00 0.00 35.03 34.99 3bdm n LYS 40 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3bdm s ILE 41 N -2.25 0.31 0.06 -0.18 1.01 -0.88 -1.79 121.20 117.47 3bdm s ILE 41 Ca 0.34 -1.23 0.03 0.00 0.00 0.00 0.00 60.65 59.79 3bdm s ILE 41 Cb 0.34 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.53 3bdm s ILE 41 CO -0.07 -0.78 0.07 0.26 0.00 0.00 0.00 174.94 174.42 3bdm s TRP 42 N 1.66 3.19 -0.08 3.97 0.52 -0.37 -1.04 118.94 126.78 3bdm s TRP 42 Ca 0.12 0.09 0.03 0.00 0.02 0.00 0.00 56.10 56.36 3bdm s TRP 42 Cb -0.18 -1.64 0.01 0.00 -1.15 0.00 0.00 33.47 30.51 3bdm s TRP 42 CO -0.24 0.52 -0.17 0.00 0.02 0.00 0.00 176.95 177.08 3bdm s ALA 44 N 0.54 3.75 -0.03 0.00 0.00 0.58 0.43 121.76 127.04 3bdm s ALA 44 Ca -0.16 -0.60 0.02 0.00 0.00 0.00 0.00 51.96 51.22 3bdm s ALA 44 Cb -0.17 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 20.82 3bdm s ALA 44 CO 0.06 0.36 -0.08 0.20 0.00 0.00 0.00 175.76 176.30 3bdm s GLY 45 N -0.30 0.49 0.44 0.00 0.00 -0.57 -0.40 107.32 106.99 3bdm s GLY 45 Ca 0.13 -0.29 0.06 0.00 0.00 0.00 0.00 44.72 44.62 3bdm s GLY 45 CO 0.02 -0.03 0.07 0.00 0.00 0.00 0.00 173.10 173.16 3bdm s ALA 46 N 0.25 3.56 0.00 3.20 0.00 0.23 -4.89 121.76 124.11 3bdm s ALA 46 Ca -0.04 -1.75 0.00 0.00 0.00 0.00 0.00 51.96 50.17 3bdm s ALA 46 Cb -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.00 3bdm s ALA 46 CO 0.00 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.05 3bdm n GLY 47 N -1.14 0.86 3.49 0.00 0.00 -1.26 -1.43 105.19 105.71 3bdm n GLY 47 Ca -0.07 -1.49 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 3bdm n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3bdm s THR 48 N 0.00 4.52 0.20 2.61 2.01 0.61 -4.95 115.64 120.64 3bdm s THR 48 Ca 0.00 0.01 -0.22 0.00 0.31 0.00 0.00 61.69 61.79 3bdm s THR 48 Cb 0.00 -4.48 0.14 0.00 0.01 0.00 0.00 72.50 68.16 3bdm s THR 48 CO 0.00 -1.05 1.52 0.00 -0.69 0.00 0.00 174.62 174.40 3bdm n ALA 49 N 7.11 -0.29 0.09 7.40 0.00 -1.26 0.31 120.51 133.87 3bdm n ALA 49 Ca -0.01 0.93 0.18 0.00 0.00 0.00 0.00 53.44 54.54 3bdm n ALA 49 Cb 0.47 -0.34 0.71 0.00 0.00 0.00 0.00 19.45 20.29 3bdm n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3bdm h ALA 50 N 1.07 2.25 0.09 0.00 0.00 -1.96 -1.47 119.26 119.24 3bdm h ALA 50 Ca 0.28 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.97 3bdm h ALA 50 Cb 0.53 0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.36 3bdm h ALA 50 CO -0.96 -0.48 -0.86 -0.44 0.00 0.00 0.00 179.25 176.51 3bdm h ASP 51 N 0.00 0.61 -0.74 0.00 3.45 -0.46 -2.02 116.42 117.27 3bdm h ASP 51 Ca 0.17 -0.85 -0.05 0.00 0.43 0.00 0.00 57.03 56.73 3bdm h ASP 51 Cb 0.75 -0.19 -0.03 0.00 -0.56 0.00 0.00 39.33 39.29 3bdm h ASP 51 CO -0.00 1.40 0.26 0.71 -1.57 0.00 0.00 179.24 180.04 3bdm h THR 52 N -0.09 1.26 0.15 0.35 1.35 -0.91 0.20 112.91 115.22 3bdm h THR 52 Ca -0.13 -0.85 -0.01 0.00 -0.55 0.00 0.00 66.41 64.87 3bdm h THR 52 Cb 1.61 0.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 3bdm h THR 52 CO 0.17 0.34 -0.07 -0.08 -0.25 0.00 0.00 175.52 175.62 3bdm h GLU 53 N 1.08 -0.19 0.33 4.72 4.57 -1.34 -0.75 114.58 123.00 3bdm h GLU 53 Ca 0.24 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.42 3bdm h GLU 53 Cb 0.26 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 3bdm h GLU 53 CO -0.01 -0.05 -0.16 0.00 -1.18 0.00 0.00 179.01 177.61 3bdm h ALA 54 N 0.55 -0.44 -0.32 2.92 0.00 -1.22 -1.66 119.26 119.09 3bdm h ALA 54 Ca -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3bdm h ALA 54 Cb 0.23 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3bdm h ALA 54 CO 0.03 -0.69 0.16 -0.24 0.00 0.00 0.00 179.25 178.51 3bdm h VAL 55 N -0.55 1.11 -0.36 0.00 3.04 -1.00 -1.32 116.25 117.16 3bdm h VAL 55 Ca -0.05 -0.31 -0.04 0.00 -1.01 0.00 0.00 66.70 65.30 3bdm h VAL 55 Cb 0.41 0.70 -0.01 0.00 -2.01 0.00 0.00 31.29 30.37 3bdm h VAL 55 CO 0.07 0.13 0.07 0.74 -1.01 0.00 0.00 177.57 177.57 3bdm h THR 56 N 0.44 1.23 -0.04 3.17 2.02 -0.93 -2.72 112.91 116.09 3bdm h THR 56 Ca 0.11 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.48 3bdm h THR 56 Cb 0.04 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.52 3bdm h THR 56 CO -0.02 0.27 -0.00 1.56 0.37 0.00 0.00 175.52 177.70 3bdm h GLN 57 N 0.44 0.07 -0.17 6.66 4.20 -0.64 -0.64 115.11 125.02 3bdm h GLN 57 Ca 0.11 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.84 3bdm h GLN 57 Cb 0.33 -0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.04 3bdm h GLN 57 CO 0.00 0.38 -0.44 1.25 -0.67 0.00 0.00 178.83 179.36 3bdm h LEU 58 N -0.25 -1.39 -1.12 1.46 5.85 -1.28 0.65 115.31 119.23 3bdm h LEU 58 Ca 0.01 0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 3bdm h LEU 58 Cb 0.35 0.57 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 3bdm h LEU 58 CO 0.00 -0.43 0.15 0.40 -0.34 0.00 0.00 178.44 178.23 3bdm h ILE 59 N -0.48 1.21 -0.51 4.05 5.03 -1.53 -1.69 117.51 123.59 3bdm h ILE 59 Ca 0.08 -0.72 0.02 0.00 -0.12 0.00 0.00 64.86 64.11 3bdm h ILE 59 Cb 0.63 0.65 -0.03 0.00 -3.03 0.00 0.00 36.82 35.04 3bdm h ILE 59 CO -0.43 0.27 0.32 1.23 -0.68 0.00 0.00 178.15 178.86 3bdm h GLY 60 N 0.92 0.72 0.97 5.37 0.00 0.60 0.15 103.07 111.82 3bdm h GLY 60 Ca 0.17 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 3bdm h GLY 60 CO -0.01 0.21 0.15 0.23 0.00 0.00 0.00 176.54 177.13 3bdm h SER 61 N 0.63 0.30 0.03 0.19 0.87 0.70 -1.94 113.55 114.34 3bdm h SER 61 Ca 0.20 -0.05 -0.10 0.00 -1.23 0.00 0.00 61.79 60.61 3bdm h SER 61 Cb -0.01 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 3bdm h SER 61 CO -0.08 0.27 -0.29 0.78 -0.53 0.00 0.00 176.83 176.98 3bdm h ASN 62 N 0.31 0.41 0.20 6.23 2.35 -0.92 -2.07 115.58 122.09 3bdm h ASN 62 Ca 0.09 -0.14 -0.11 0.00 -0.55 0.00 0.00 56.30 55.59 3bdm h ASN 62 Cb 0.02 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 3bdm h ASN 62 CO -0.02 0.69 -0.41 0.40 -1.65 0.00 0.00 177.43 176.44 3bdm h ILE 63 N 0.35 1.31 0.03 2.81 2.04 -0.48 0.41 117.51 123.97 3bdm h ILE 63 Ca 0.05 -1.52 -0.00 0.00 1.00 0.00 0.00 64.86 64.38 3bdm h ILE 63 Cb 0.69 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 3bdm h ILE 63 CO 0.05 0.46 -0.01 -0.08 0.00 0.00 0.00 178.15 178.57 3bdm h GLU 64 N 0.23 -0.03 -0.81 2.37 4.81 -1.05 0.24 114.58 120.33 3bdm h GLU 64 Ca 0.02 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.27 3bdm h GLU 64 Cb 0.82 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.17 3bdm h GLU 64 CO 0.06 0.29 0.53 -0.07 -0.73 0.00 0.00 179.01 179.10 3bdm h LEU 65 N -0.37 0.91 -0.33 1.64 3.38 -1.25 -0.35 115.31 118.95 3bdm h LEU 65 Ca -0.00 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 3bdm h LEU 65 Cb 0.34 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3bdm h LEU 65 CO 0.01 0.65 -0.10 -0.74 0.09 0.00 0.00 178.44 178.34 3bdm h HIS 66 N 1.07 0.75 -0.09 1.13 2.76 -0.71 -1.29 115.15 118.77 3bdm h HIS 66 Ca 0.30 -0.17 0.03 0.00 -2.20 0.00 0.00 60.37 58.33 3bdm h HIS 66 Cb -0.08 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 28.67 3bdm h HIS 66 CO -0.00 0.84 -0.10 1.03 -1.30 0.00 0.00 177.93 178.40 3bdm h SER 67 N 0.44 -0.30 -0.74 3.26 0.87 0.06 -0.69 113.55 116.46 3bdm h SER 67 Ca 0.08 0.06 0.03 0.00 -1.23 0.00 0.00 61.79 60.73 3bdm h SER 67 Cb 0.61 0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.67 3bdm h SER 67 CO 0.04 -0.13 0.47 -0.07 -0.53 0.00 0.00 176.83 176.60 3bdm h LEU 68 N -0.12 0.77 -0.37 2.23 4.07 -0.97 0.28 115.31 121.20 3bdm h LEU 68 Ca 0.07 -0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.00 3bdm h LEU 68 Cb 0.22 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.77 3bdm h LEU 68 CO -0.16 0.54 0.13 0.22 -1.08 0.00 0.00 178.44 178.08 3bdm h TYR 69 N 0.92 0.58 0.00 1.13 5.03 -0.73 -3.15 116.97 120.75 3bdm h TYR 69 Ca 0.29 -0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.55 3bdm h TYR 69 Cb 0.01 -0.17 0.00 0.00 1.55 0.00 0.00 36.73 38.12 3bdm h TYR 69 CO -0.04 0.54 -0.42 0.25 -1.32 0.00 0.00 178.16 177.18 3bdm n THR 70 N -4.65 0.17 -3.33 1.81 -2.24 -0.31 -4.95 114.28 100.79 3bdm n THR 70 Ca -0.01 -0.12 -0.23 0.00 -2.27 0.00 0.00 64.05 61.42 3bdm n THR 70 Cb 0.16 -0.08 0.06 0.00 -2.10 0.00 0.00 70.33 68.37 3bdm n THR 70 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3bdm n SER 71 N -1.78 -6.23 -4.12 3.42 7.64 0.97 -5.00 113.62 108.53 3bdm n SER 71 Ca 0.05 -0.42 -0.16 0.00 1.01 0.00 0.00 58.87 59.35 3bdm n SER 71 Cb 0.38 -4.94 -0.12 0.00 -1.01 0.00 0.00 64.21 58.53 3bdm n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3bdm s ARG 72 N -6.02 0.68 0.59 1.43 0.52 -1.15 -5.06 118.95 109.93 3bdm s ARG 72 Ca 0.45 -0.85 -0.20 0.00 -0.52 0.00 0.00 55.73 54.61 3bdm s ARG 72 Cb -0.20 -0.57 -0.03 0.00 0.52 0.00 0.00 34.95 34.67 3bdm s ARG 72 CO 0.56 0.12 1.29 -1.21 0.02 0.00 0.00 175.30 176.08 3bdm s GLU 73 N -1.65 2.91 0.51 3.54 0.41 -1.26 -4.62 118.70 118.54 3bdm s GLU 73 Ca -0.06 2.04 -0.21 0.00 -0.41 0.00 0.00 54.97 56.34 3bdm s GLU 73 Cb -0.10 -2.03 -0.07 0.00 -1.78 0.00 0.00 34.13 30.16 3bdm s GLU 73 CO 0.01 -1.31 1.13 -2.14 -0.49 0.00 0.00 175.26 172.46 3bdm s PRO 74 N -3.18 3.55 0.06 0.39 0.02 -1.26 -4.89 135.00 129.69 3bdm s PRO 74 Ca 0.77 1.65 0.02 0.00 0.02 0.00 0.00 61.00 63.46 3bdm s PRO 74 Cb -0.36 -2.16 -0.04 0.00 0.02 0.00 0.00 34.50 31.95 3bdm s PRO 74 CO 0.40 -0.70 0.08 1.03 -0.33 0.00 0.00 177.00 177.48 3bdm s ARG 75 N -3.05 2.92 0.29 5.54 0.52 -1.26 -4.72 118.95 119.19 3bdm s ARG 75 Ca 0.69 -0.64 0.09 0.00 -0.52 0.00 0.00 55.73 55.35 3bdm s ARG 75 Cb -0.25 -2.76 0.42 0.00 0.52 0.00 0.00 34.95 32.88 3bdm s ARG 75 CO 0.29 0.59 1.65 0.28 0.02 0.00 0.00 175.30 178.13 3bdm h VAL 76 N 2.73 1.39 0.00 3.52 2.07 -1.91 -2.18 116.25 121.88 3bdm h VAL 76 Ca -0.47 -1.87 -0.01 0.00 0.82 0.00 0.00 66.70 65.17 3bdm h VAL 76 Cb 1.17 1.98 -0.00 0.00 -1.52 0.00 0.00 31.29 32.92 3bdm h VAL 76 CO 0.65 0.54 -0.03 -0.37 0.02 0.00 0.00 177.57 178.38 3bdm h VAL 77 N 0.05 0.09 -0.08 2.57 -1.51 -1.98 -0.91 116.25 114.48 3bdm h VAL 77 Ca -0.00 -0.47 -0.18 0.00 -1.23 0.00 0.00 66.70 64.82 3bdm h VAL 77 Cb 0.98 1.43 0.01 0.00 -2.13 0.00 0.00 31.29 31.58 3bdm h VAL 77 CO 0.07 0.03 -0.65 0.28 -1.23 0.00 0.00 177.57 176.07 3bdm h SER 78 N 0.00 0.71 -0.39 4.19 0.02 -1.80 -1.63 113.55 114.64 3bdm h SER 78 Ca -0.00 -0.68 -0.10 0.00 -0.84 0.00 0.00 61.79 60.17 3bdm h SER 78 Cb 0.42 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 3bdm h SER 78 CO 0.00 1.28 -0.12 0.00 -1.14 0.00 0.00 176.83 176.85 3bdm h ALA 79 N 0.45 0.92 -0.32 3.77 0.00 -1.30 -2.25 119.26 120.52 3bdm h ALA 79 Ca -0.06 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 3bdm h ALA 79 Cb 1.31 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 3bdm h ALA 79 CO 0.13 0.63 -0.11 1.25 0.00 0.00 0.00 179.25 181.15 3bdm h LEU 80 N 0.76 0.53 0.11 0.00 5.85 -1.12 -0.39 115.31 121.04 3bdm h LEU 80 Ca 0.12 -0.14 -0.28 0.00 0.84 0.00 0.00 57.88 58.42 3bdm h LEU 80 Cb 0.63 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 3bdm h LEU 80 CO 0.04 0.67 -1.36 -0.61 -0.34 0.00 0.00 178.44 176.84 3bdm h GLN 81 N 0.50 0.23 -0.28 1.25 5.75 -1.13 -2.43 115.11 119.01 3bdm h GLN 81 Ca 0.09 -0.40 -0.19 0.00 -0.15 0.00 0.00 58.65 58.01 3bdm h GLN 81 Cb 0.49 0.15 0.00 0.00 1.07 0.00 0.00 27.48 29.19 3bdm h GLN 81 CO 0.03 1.13 -0.56 0.52 -2.65 0.00 0.00 178.83 177.30 3bdm h MET 82 N 0.06 0.86 0.76 1.69 2.86 -1.36 -2.13 114.93 117.67 3bdm h MET 82 Ca -0.18 -0.55 -0.04 0.00 -2.06 0.00 0.00 59.70 56.88 3bdm h MET 82 Cb 1.98 0.07 0.01 0.00 0.06 0.00 0.00 31.60 33.71 3bdm h MET 82 CO 0.18 1.18 -0.37 -0.07 1.06 0.00 0.00 176.91 178.89 3bdm h LEU 83 N 0.65 -0.86 -0.91 1.22 3.38 -1.14 -2.68 115.31 114.96 3bdm h LEU 83 Ca 0.01 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.07 3bdm h LEU 83 Cb 1.17 0.22 -0.06 0.00 0.09 0.00 0.00 40.66 42.08 3bdm h LEU 83 CO 0.12 -0.49 0.57 0.07 0.09 0.00 0.00 178.44 178.80 3bdm h LYS 84 N -1.27 1.00 0.00 1.13 2.10 -1.52 -1.05 116.57 116.96 3bdm h LYS 84 Ca -0.10 -0.06 -0.05 0.00 -2.00 0.00 0.00 60.65 58.44 3bdm h LYS 84 Cb 0.78 -0.23 -0.01 0.00 -0.90 0.00 0.00 32.23 31.88 3bdm h LYS 84 CO 0.17 0.66 -0.22 1.96 -2.00 0.00 0.00 179.45 180.02 3bdm h GLN 85 N 1.03 0.00 -0.01 0.07 4.20 -1.43 0.00 115.11 118.97 3bdm h GLN 85 Ca 0.40 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.08 3bdm h GLN 85 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3bdm h GLN 85 CO -0.18 0.22 -0.09 1.25 -0.67 0.00 0.00 178.83 179.36 3bdm h HIS 86 N 0.00 0.12 -0.74 2.96 2.76 -0.88 -2.46 115.15 116.91 3bdm h HIS 86 Ca -0.00 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.10 3bdm h HIS 86 Cb 0.48 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.39 3bdm h HIS 86 CO 0.00 0.77 0.42 -0.07 -1.30 0.00 0.00 177.93 177.75 3bdm h LEU 87 N -0.55 0.92 -1.04 0.26 3.38 -0.97 -2.24 115.31 115.06 3bdm h LEU 87 Ca -0.01 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 3bdm h LEU 87 Cb 0.78 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 3bdm h LEU 87 CO 0.02 0.74 0.03 0.15 0.09 0.00 0.00 178.44 179.47 3bdm h PHE 88 N 1.02 0.75 -0.37 1.13 3.57 -1.06 -2.07 116.94 119.92 3bdm h PHE 88 Ca 0.26 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 3bdm h PHE 88 Cb 0.02 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 3bdm h PHE 88 CO -0.00 0.69 0.22 -0.22 -2.23 0.00 0.00 178.31 176.76 3bdm h LYS 89 N 0.68 0.49 -0.85 1.11 3.64 -0.91 -2.46 116.57 118.27 3bdm h LYS 89 Ca 0.14 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.34 3bdm h LYS 89 Cb 0.38 -0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.00 3bdm h LYS 89 CO 0.01 0.35 0.19 0.66 -2.27 0.00 0.00 179.45 178.39 3bdm n TYR 90 N -4.46 1.64 -1.82 1.91 4.01 -0.78 -4.92 117.16 112.74 3bdm n TYR 90 Ca 0.02 -0.87 -0.02 0.00 -0.16 0.00 0.00 57.90 56.88 3bdm n TYR 90 Cb 0.08 -0.52 -0.00 0.00 -0.31 0.00 0.00 39.34 38.59 3bdm n TYR 90 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3bdm n GLN 91 N -0.02 -2.01 -0.27 -0.72 1.13 -0.93 0.28 117.38 114.84 3bdm n GLN 91 Ca 0.27 0.11 0.00 0.00 -1.94 0.00 0.00 57.00 55.45 3bdm n GLN 91 Cb 1.04 -4.41 0.00 0.00 0.11 0.00 0.00 30.24 26.98 3bdm n GLN 91 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3bdm n GLY 93 N -0.31 1.07 0.29 1.08 0.00 -1.22 -4.91 105.19 101.19 3bdm n GLY 93 Ca -0.02 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.18 3bdm n GLY 93 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3bdm h HIS 94 N 0.00 0.00 -3.06 1.61 3.86 -0.46 -3.36 115.15 113.74 3bdm h HIS 94 Ca 0.00 0.00 -0.68 0.00 -1.16 0.00 0.00 60.37 58.53 3bdm h HIS 94 Cb 0.00 0.00 -0.18 0.00 1.06 0.00 0.00 27.41 28.29 3bdm h HIS 94 CO 0.00 0.00 0.16 0.42 0.86 0.00 0.00 177.93 179.37 3bdm s ILE 95 N -3.81 4.76 -0.87 2.45 1.01 -1.26 -4.95 121.20 118.54 3bdm s ILE 95 Ca -0.01 -0.61 -0.22 0.00 0.00 0.00 0.00 60.65 59.81 3bdm s ILE 95 Cb 0.10 -4.42 -0.14 0.00 0.01 0.00 0.00 42.46 38.01 3bdm s ILE 95 CO 0.47 -1.01 1.92 0.61 0.00 0.00 0.00 174.94 176.94 3bdm n GLY 96 N 5.22 2.22 3.23 6.18 0.00 -1.26 -4.73 105.19 116.05 3bdm n GLY 96 Ca -0.07 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.49 3bdm n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bdm s ALA 97 N 6.36 2.25 -0.19 4.61 0.00 -1.26 -0.29 121.76 133.25 3bdm s ALA 97 Ca 0.60 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 51.57 3bdm s ALA 97 Cb 0.11 -0.92 0.04 0.00 0.00 0.00 0.00 23.12 22.35 3bdm s ALA 97 CO 0.12 0.19 -0.09 0.71 0.00 0.00 0.00 175.76 176.69 3bdm s TYR 98 N 0.49 2.20 0.04 0.00 2.02 -0.52 -1.05 117.35 120.54 3bdm s TYR 98 Ca -0.14 -1.43 0.05 0.00 -0.37 0.00 0.00 57.07 55.18 3bdm s TYR 98 Cb -0.17 -1.55 -0.02 0.00 -0.40 0.00 0.00 41.96 39.82 3bdm s TYR 98 CO 0.05 -0.70 -0.16 -0.51 -1.57 0.00 0.00 175.55 172.66 3bdm s LEU 99 N 1.47 2.18 -0.30 -1.29 1.43 -0.09 0.78 118.68 122.85 3bdm s LEU 99 Ca -0.00 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 3bdm s LEU 99 Cb -0.16 -0.69 0.07 0.00 0.03 0.00 0.00 46.19 45.44 3bdm s LEU 99 CO -0.08 0.06 -0.01 -0.63 0.23 0.00 0.00 176.35 175.91 3bdm s ILE 100 N -0.87 2.62 -0.13 -0.59 1.01 0.46 0.75 121.20 124.46 3bdm s ILE 100 Ca 0.03 -1.69 -0.04 0.00 0.00 0.00 0.00 60.65 58.95 3bdm s ILE 100 Cb -0.08 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 3bdm s ILE 100 CO 0.01 -0.21 0.02 0.54 0.00 0.00 0.00 174.94 175.30 3bdm s VAL 101 N 1.13 4.46 0.33 2.92 0.11 -0.41 -0.31 120.40 128.63 3bdm s VAL 101 Ca -0.03 -0.17 0.02 0.00 -2.93 0.00 0.00 61.98 58.87 3bdm s VAL 101 Cb -0.20 -2.93 -0.01 0.00 -1.53 0.00 0.00 36.38 31.71 3bdm s VAL 101 CO -0.04 0.55 0.38 0.00 -3.33 0.00 0.00 175.10 172.66 3bdm n ALA 102 N 2.78 0.14 0.00 1.54 0.00 0.02 -1.17 120.51 123.81 3bdm n ALA 102 Ca -0.18 -1.70 0.00 0.00 0.00 0.00 0.00 53.44 51.56 3bdm n ALA 102 Cb 0.53 1.37 0.00 0.00 0.00 0.00 0.00 19.45 21.35 3bdm n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bdm n GLY 103 N -0.58 2.07 3.50 0.00 0.00 -1.11 -1.23 105.19 107.84 3bdm n GLY 103 Ca 0.04 -1.79 -0.29 0.00 0.00 0.00 0.00 46.02 43.98 3bdm n GLY 103 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3bdm s VAL 104 N -1.56 2.88 0.30 1.61 -7.23 -0.74 -1.17 120.40 114.48 3bdm s VAL 104 Ca 0.00 -1.56 -0.18 0.00 -1.81 0.00 0.00 61.98 58.43 3bdm s VAL 104 Cb 0.00 -2.34 0.02 0.00 0.56 0.00 0.00 36.38 34.62 3bdm s VAL 104 CO 0.00 0.05 0.68 1.51 -0.31 0.00 0.00 175.10 177.03 3bdm s ASP 105 N -2.29 -0.14 0.08 4.85 3.84 -0.53 -4.74 116.67 117.75 3bdm s ASP 105 Ca 0.19 -0.80 0.00 0.00 -0.00 0.00 0.00 52.55 51.95 3bdm s ASP 105 Cb -0.10 0.72 0.00 0.00 -1.38 0.00 0.00 42.92 42.16 3bdm s ASP 105 CO 0.11 -1.37 0.55 -2.65 -0.00 0.00 0.00 175.17 171.81 3bdm n PRO 10 N -0.46 0.00 -0.07 2.11 -0.02 -1.26 -0.05 135.00 135.25 3bdm n PRO 10 Ca -0.04 0.11 0.03 0.00 -2.02 0.00 0.00 63.50 61.58 3bdm n PRO 10 Cb 0.60 -2.03 0.07 0.00 -0.02 0.00 0.00 33.50 32.12 3bdm n PRO 10 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3bdm n THR 106 N -1.16 0.86 0.00 3.45 -2.24 -1.26 -5.11 114.28 108.82 3bdm n THR 106 Ca 0.00 -0.93 0.00 0.00 -2.27 0.00 0.00 64.05 60.85 3bdm n THR 106 Cb 0.55 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 3bdm n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bdm n GLY 107 N 0.04 0.50 3.74 3.38 0.00 0.93 -5.05 105.19 108.74 3bdm n GLY 107 Ca 0.05 -2.27 -0.34 0.00 0.00 0.00 0.00 46.02 43.46 3bdm n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bdm s SER 108 N -4.00 5.48 0.06 1.61 1.04 -1.26 -1.45 113.70 115.18 3bdm s SER 108 Ca 0.00 0.16 0.03 0.00 0.48 0.00 0.00 55.95 56.62 3bdm s SER 108 Cb 0.00 -1.57 -0.03 0.00 0.10 0.00 0.00 66.02 64.53 3bdm s SER 108 CO 0.00 0.33 -0.10 -1.00 0.98 0.00 0.00 173.24 173.45 3bdm s HIS 109 N -1.03 0.92 -0.11 5.02 3.76 -0.32 -5.01 115.29 118.52 3bdm s HIS 109 Ca 0.17 -0.53 -0.04 0.00 -0.15 0.00 0.00 55.06 54.52 3bdm s HIS 109 Cb -0.12 -0.53 0.05 0.00 1.11 0.00 0.00 32.58 33.10 3bdm s HIS 109 CO 0.07 -0.03 0.13 -1.17 -0.85 0.00 0.00 174.74 172.90 3bdm s LEU 110 N -1.84 0.06 0.29 0.89 2.96 -1.26 -2.76 118.68 117.02 3bdm s LEU 110 Ca -0.04 -0.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.86 3bdm s LEU 110 Cb -0.08 0.08 -0.05 0.00 0.50 0.00 0.00 46.19 46.64 3bdm s LEU 110 CO 0.01 -0.28 0.10 -0.36 -1.32 0.00 0.00 176.35 174.49 3bdm s PHE 111 N 2.23 1.67 -0.06 5.38 0.08 -0.32 -3.09 117.98 123.88 3bdm s PHE 111 Ca 0.04 -1.16 -0.05 0.00 0.12 0.00 0.00 56.93 55.88 3bdm s PHE 111 Cb -0.14 -1.01 0.02 0.00 -0.57 0.00 0.00 43.02 41.32 3bdm s PHE 111 CO -0.07 -0.27 0.14 -1.54 -0.10 0.00 0.00 175.22 173.38 3bdm s SER 112 N -3.38 -0.15 -0.06 1.36 1.04 -1.08 -1.29 113.70 110.14 3bdm s SER 112 Ca 0.36 0.29 0.04 0.00 0.48 0.00 0.00 55.95 57.12 3bdm s SER 112 Cb 0.07 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.48 3bdm s SER 112 CO 0.15 -0.06 -0.18 -0.63 0.98 0.00 0.00 173.24 173.50 3bdm s ILE 113 N 0.16 1.50 0.08 -1.02 1.01 0.23 -1.49 121.20 121.68 3bdm s ILE 113 Ca -0.01 -0.74 -0.00 0.00 0.00 0.00 0.00 60.65 59.90 3bdm s ILE 113 Cb -0.02 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 41.11 3bdm s ILE 113 CO -0.00 0.43 0.24 -1.00 0.00 0.00 0.00 174.94 174.61 3bdm s HIS 114 N 0.19 3.51 0.54 3.97 3.76 -0.51 -0.91 115.29 125.84 3bdm s HIS 114 Ca -0.08 0.28 0.39 0.00 -0.15 0.00 0.00 55.06 55.50 3bdm s HIS 114 Cb -0.13 -1.79 1.57 0.00 1.11 0.00 0.00 32.58 33.34 3bdm s HIS 114 CO 0.04 0.56 1.74 0.00 -0.85 0.00 0.00 174.74 176.23 3bdm h ALA 115 N 2.96 3.25 -0.00 -1.40 0.00 -1.38 0.61 119.26 123.30 3bdm h ALA 115 Ca -0.45 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3bdm h ALA 115 Cb 1.16 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3bdm h ALA 115 CO 0.75 -1.66 -0.06 0.72 0.00 0.00 0.00 179.25 179.00 3bdm n HIS 116 N -4.16 0.00 0.00 0.00 8.25 -1.26 -3.79 115.22 114.26 3bdm n HIS 116 Ca 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.77 3bdm n HIS 116 Cb 1.42 -0.46 0.00 0.00 1.12 0.00 0.00 29.99 32.08 3bdm n HIS 116 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3bdm n GLY 117 N 1.49 0.79 3.81 -1.41 0.00 0.21 -3.96 105.19 106.13 3bdm n GLY 117 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 3bdm n GLY 117 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bdm s SER 118 N -1.79 6.97 0.14 1.61 1.04 -1.25 -4.79 113.70 115.63 3bdm s SER 118 Ca 0.00 1.73 0.09 0.00 0.48 0.00 0.00 55.95 58.25 3bdm s SER 118 Cb 0.00 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.53 3bdm s SER 118 CO 0.00 -0.34 -0.21 0.42 0.98 0.00 0.00 173.24 174.09 3bdm s THR 119 N -2.07 1.88 0.30 2.02 -4.23 -1.26 -1.43 115.64 110.86 3bdm s THR 119 Ca 0.60 -1.79 0.04 0.00 -1.18 0.00 0.00 61.69 59.37 3bdm s THR 119 Cb -0.11 -1.79 -0.06 0.00 1.34 0.00 0.00 72.50 71.88 3bdm s THR 119 CO 0.15 -0.17 0.02 -1.81 -0.54 0.00 0.00 174.62 172.28 3bdm s ASP 120 N -2.35 2.42 -0.05 3.99 1.01 -0.55 -4.98 116.67 116.16 3bdm s ASP 120 Ca 0.13 -1.31 -0.05 0.00 0.71 0.00 0.00 52.55 52.03 3bdm s ASP 120 Cb -0.08 -0.10 0.01 0.00 1.01 0.00 0.00 42.92 43.77 3bdm s ASP 120 CO 0.06 -0.53 0.14 0.54 0.21 0.00 0.00 175.17 175.60 3bdm s VAL 121 N -3.23 0.00 -0.03 -1.27 0.11 -1.26 -2.64 120.40 112.08 3bdm s VAL 121 Ca 0.34 -0.04 -0.23 0.00 -2.93 0.00 0.00 61.98 59.12 3bdm s VAL 121 Cb 0.07 -0.22 0.07 0.00 -1.53 0.00 0.00 36.38 34.78 3bdm s VAL 121 CO 0.14 -0.02 1.02 0.61 -3.33 0.00 0.00 175.10 173.52 3bdm n GLY 122 N 2.93 0.26 0.13 6.54 0.00 -1.18 -5.02 105.19 108.86 3bdm n GLY 122 Ca -0.13 -0.99 0.12 0.00 0.00 0.00 0.00 46.02 45.01 3bdm n GLY 122 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3bdm h TYR 123 N 1.78 0.00 -2.46 1.61 -1.99 -1.92 -3.42 116.97 110.57 3bdm h TYR 123 Ca -0.16 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.48 3bdm h TYR 123 Cb 0.92 0.00 -0.23 0.00 2.00 0.00 0.00 36.73 39.42 3bdm h TYR 123 CO 0.00 0.00 -0.12 1.52 -0.00 0.00 0.00 178.16 179.56 3bdm s TYR 124 N -3.32 -0.61 0.12 4.88 1.13 -1.25 -0.17 117.35 118.13 3bdm s TYR 124 Ca 0.01 1.44 -0.11 0.00 -1.41 0.00 0.00 57.07 57.00 3bdm s TYR 124 Cb 0.09 0.23 0.01 0.00 -1.10 0.00 0.00 41.96 41.19 3bdm s TYR 124 CO 0.76 -0.30 0.29 -0.51 -2.51 0.00 0.00 175.55 173.28 3bdm s LEU 125 N 0.49 0.96 -0.03 -3.49 1.43 -0.29 -4.96 118.68 112.79 3bdm s LEU 125 Ca -0.02 -0.60 -0.18 0.00 -1.03 0.00 0.00 54.13 52.31 3bdm s LEU 125 Cb -0.04 1.36 0.03 0.00 0.03 0.00 0.00 46.19 47.57 3bdm s LEU 125 CO -0.02 -0.82 0.39 -0.94 0.23 0.00 0.00 176.35 175.19 3bdm s SER 126 N -2.87 -0.30 0.19 2.29 1.04 -1.26 -0.22 113.70 112.58 3bdm s SER 126 Ca 0.07 0.26 -0.05 0.00 0.48 0.00 0.00 55.95 56.71 3bdm s SER 126 Cb 0.03 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.52 3bdm s SER 126 CO -0.08 -0.46 0.23 -0.76 0.98 0.00 0.00 173.24 173.15 3bdm s LEU 127 N -1.19 1.01 0.00 2.42 1.43 -0.74 -4.92 118.68 116.68 3bdm s LEU 127 Ca -0.12 -1.15 0.00 0.00 -1.03 0.00 0.00 54.13 51.83 3bdm s LEU 127 Cb -0.04 0.86 0.00 0.00 0.03 0.00 0.00 46.19 47.04 3bdm s LEU 127 CO 0.05 -0.91 0.00 0.61 0.23 0.00 0.00 176.35 176.34 3bdm n GLY 128 N -0.26 -2.18 0.18 -3.19 0.00 -1.26 -2.01 105.19 96.46 3bdm n GLY 128 Ca -0.02 -2.19 0.04 0.00 0.00 0.00 0.00 46.02 43.86 3bdm n GLY 128 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3bdm h SER 129 N 0.00 0.00 0.00 1.61 4.64 -0.93 -2.09 113.55 116.78 3bdm h SER 129 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3bdm h SER 129 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3bdm h SER 129 CO 0.00 0.42 -0.00 0.61 -0.87 0.00 0.00 176.83 176.99 3bdm n GLY 130 N 0.26 -0.55 0.15 -0.77 0.00 0.36 -4.46 105.19 100.19 3bdm n GLY 130 Ca -0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 46.02 45.67 3bdm n GLY 130 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3bdm n SER 131 N -0.47 -0.39 -0.26 1.61 2.88 -0.79 -1.37 113.62 114.83 3bdm n SER 131 Ca 0.22 0.89 -0.05 0.00 -1.33 0.00 0.00 58.87 58.59 3bdm n SER 131 Cb 0.22 -0.20 0.09 0.00 -0.75 0.00 0.00 64.21 63.57 3bdm n SER 131 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 3bdm h LEU 132 N 0.00 1.04 0.03 2.46 4.07 -1.83 -1.43 115.31 119.65 3bdm h LEU 132 Ca 0.06 -0.17 0.01 0.00 0.08 0.00 0.00 57.88 57.86 3bdm h LEU 132 Cb 0.15 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 41.60 3bdm h LEU 132 CO -0.34 0.94 -0.09 0.00 -1.08 0.00 0.00 178.44 177.86 3bdm h ALA 133 N 1.20 -0.12 0.76 1.53 0.00 -1.54 -1.47 119.26 119.63 3bdm h ALA 133 Ca 0.24 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 3bdm h ALA 133 Cb 0.25 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3bdm h ALA 133 CO -0.02 -0.59 -0.48 0.00 0.00 0.00 0.00 179.25 178.16 3bdm h ALA 134 N 0.78 -1.26 -1.13 0.00 0.00 -1.23 -2.56 119.26 113.86 3bdm h ALA 134 Ca 0.02 -0.24 0.32 0.00 0.00 0.00 0.00 54.91 55.01 3bdm h ALA 134 Cb 0.19 0.60 -0.07 0.00 0.00 0.00 0.00 17.79 18.52 3bdm h ALA 134 CO -0.07 -1.22 0.77 1.98 0.00 0.00 0.00 179.25 180.72 3bdm h MET 135 N -1.16 0.16 -0.83 0.00 -1.53 -1.20 0.62 114.93 110.99 3bdm h MET 135 Ca -0.10 -0.01 -0.02 0.00 -3.44 0.00 0.00 59.70 56.13 3bdm h MET 135 Cb 0.93 -0.04 -0.04 0.00 -0.55 0.00 0.00 31.60 31.91 3bdm h MET 135 CO 0.09 0.11 0.46 0.00 0.14 0.00 0.00 176.91 177.71 3bdm h ALA 136 N 1.51 1.06 -0.22 0.39 0.00 -0.85 0.18 119.26 121.33 3bdm h ALA 136 Ca 0.59 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 55.20 3bdm h ALA 136 Cb 1.96 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.42 3bdm h ALA 136 CO -0.15 0.57 -0.56 0.28 0.00 0.00 0.00 179.25 179.39 3bdm h VAL 137 N 1.15 1.29 -0.58 0.00 2.07 0.33 -2.85 116.25 117.67 3bdm h VAL 137 Ca 0.29 -1.77 -0.08 0.00 0.82 0.00 0.00 66.70 65.96 3bdm h VAL 137 Cb 0.02 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 3bdm h VAL 137 CO -0.05 0.56 0.04 -0.07 0.02 0.00 0.00 177.57 178.07 3bdm h LEU 138 N 0.52 0.96 -0.16 2.57 3.38 -0.95 -1.09 115.31 120.54 3bdm h LEU 138 Ca -0.01 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3bdm h LEU 138 Cb 1.18 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3bdm h LEU 138 CO 0.12 1.01 0.00 -0.62 0.09 0.00 0.00 178.44 179.05 3bdm n GLU 139 N -4.27 0.05 -0.01 1.13 -0.58 0.59 -1.11 120.64 116.45 3bdm n GLU 139 Ca 0.02 0.28 0.09 0.00 -0.42 0.00 0.00 57.16 57.14 3bdm n GLU 139 Cb 0.31 -1.59 -0.13 0.00 -0.57 0.00 0.00 31.44 29.46 3bdm n GLU 139 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 3bdm n SER 140 N -1.68 0.78 0.00 1.62 7.64 -0.76 -4.74 113.62 116.48 3bdm n SER 140 Ca 0.03 -0.23 0.00 0.00 1.01 0.00 0.00 58.87 59.69 3bdm n SER 140 Cb 0.19 1.64 0.00 0.00 -1.01 0.00 0.00 64.21 65.03 3bdm n SER 140 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3bdm n HIS 141 N -1.97 0.00 -2.13 1.43 8.25 -0.49 -5.06 115.22 115.25 3bdm n HIS 141 Ca -0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.04 3bdm n HIS 141 Cb 0.43 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.52 3bdm n HIS 141 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 3bdm s TRP 142 N -0.51 3.08 0.04 4.41 -0.00 -0.27 -5.01 118.94 120.69 3bdm s TRP 142 Ca 0.00 1.40 -0.05 0.00 -0.00 0.00 0.00 56.10 57.45 3bdm s TRP 142 Cb 0.00 -3.67 -0.01 0.00 -0.00 0.00 0.00 33.47 29.79 3bdm s TRP 142 CO 0.00 -1.84 0.08 -1.59 -0.00 0.00 0.00 176.95 173.60 3bdm s LYS 143 N -1.63 0.60 0.38 5.86 -2.85 -1.26 -5.00 119.74 115.84 3bdm s LYS 143 Ca 0.50 -0.82 -0.26 0.00 -1.00 0.00 0.00 55.97 54.38 3bdm s LYS 143 Cb -0.39 0.23 -0.09 0.00 -2.06 0.00 0.00 37.83 35.52 3bdm s LYS 143 CO 0.51 -0.15 1.16 -1.14 0.10 0.00 0.00 175.35 175.83 3bdm s GLN 144 N -2.83 4.18 -0.67 1.78 0.74 -1.26 -4.07 119.66 117.52 3bdm s GLN 144 Ca -0.03 1.84 -0.04 0.00 0.05 0.00 0.00 55.36 57.18 3bdm s GLN 144 Cb 0.00 -2.77 -0.04 0.00 1.10 0.00 0.00 33.01 31.30 3bdm s GLN 144 CO -0.06 -0.21 0.59 -0.25 -0.55 0.00 0.00 175.29 174.81 3bdm n ASP 145 N 0.29 -4.92 -4.89 6.67 9.92 -1.26 -5.03 116.55 117.33 3bdm n ASP 145 Ca 0.03 -0.45 -0.29 0.00 -0.53 0.00 0.00 54.79 53.55 3bdm n ASP 145 Cb 0.46 -3.52 0.00 0.00 -0.64 0.00 0.00 41.12 37.43 3bdm n ASP 145 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3bdm s LEU 146 N -4.53 3.47 0.49 0.64 1.43 -1.26 -4.76 118.68 114.16 3bdm s LEU 146 Ca 0.29 1.13 0.01 0.00 -1.03 0.00 0.00 54.13 54.53 3bdm s LEU 146 Cb -0.04 -4.12 0.01 0.00 0.03 0.00 0.00 46.19 42.07 3bdm s LEU 146 CO 0.47 -0.69 0.71 0.42 0.23 0.00 0.00 176.35 177.49 3bdm s THR 147 N -2.91 3.43 0.39 5.49 -4.23 -1.26 -0.43 115.64 116.11 3bdm s THR 147 Ca 0.50 -0.59 0.11 0.00 -1.18 0.00 0.00 61.69 60.53 3bdm s THR 147 Cb -0.11 -3.27 0.32 0.00 1.34 0.00 0.00 72.50 70.79 3bdm s THR 147 CO 0.48 -0.19 1.92 0.50 -0.54 0.00 0.00 174.62 176.80 3bdm h LYS 148 N 0.28 0.57 -0.03 3.99 3.64 -1.97 -0.71 116.57 122.34 3bdm h LYS 148 Ca -0.44 -0.03 -0.25 0.00 -1.27 0.00 0.00 60.65 58.65 3bdm h LYS 148 Cb 1.27 -0.13 0.02 0.00 -0.41 0.00 0.00 32.23 32.98 3bdm h LYS 148 CO 0.55 0.38 -0.98 0.93 -2.27 0.00 0.00 179.45 178.06 3bdm h GLU 149 N 0.59 0.67 -0.44 1.90 3.07 -2.00 -2.64 114.58 115.73 3bdm h GLU 149 Ca 0.37 -0.69 -0.06 0.00 -0.50 0.00 0.00 59.36 58.48 3bdm h GLU 149 Cb 0.61 0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 28.69 3bdm h GLU 149 CO -0.13 1.28 0.06 0.93 -1.40 0.00 0.00 179.01 179.74 3bdm h GLU 150 N 0.40 0.74 -0.53 2.33 5.08 -1.80 -2.07 114.58 118.74 3bdm h GLU 150 Ca -0.11 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 3bdm h GLU 150 Cb 1.62 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.77 3bdm h GLU 150 CO 0.19 0.78 0.35 0.00 -1.00 0.00 0.00 179.01 179.32 3bdm h ALA 151 N 0.94 0.67 -0.76 3.43 0.00 -1.18 0.79 119.26 123.14 3bdm h ALA 151 Ca 0.13 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3bdm h ALA 151 Cb 0.40 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3bdm h ALA 151 CO 0.01 0.12 0.32 0.82 0.00 0.00 0.00 179.25 180.53 3bdm h ILE 152 N 0.71 1.25 0.59 0.00 2.04 -1.34 0.11 117.51 120.87 3bdm h ILE 152 Ca 0.19 -0.75 -0.03 0.00 1.00 0.00 0.00 64.86 65.27 3bdm h ILE 152 Cb -0.07 0.32 0.01 0.00 -0.74 0.00 0.00 36.82 36.33 3bdm h ILE 152 CO -0.04 0.31 -0.28 0.50 0.00 0.00 0.00 178.15 178.64 3bdm h LYS 153 N 1.09 -0.76 -0.16 2.37 3.11 -0.83 0.28 116.57 121.67 3bdm h LYS 153 Ca 0.26 0.05 0.05 0.00 -2.81 0.00 0.00 60.65 58.20 3bdm h LYS 153 Cb 0.17 0.17 -0.07 0.00 -1.00 0.00 0.00 32.23 31.50 3bdm h LYS 153 CO -0.03 -0.46 -0.36 1.25 -2.81 0.00 0.00 179.45 177.04 3bdm h LEU 154 N -0.93 -1.14 -0.20 5.20 5.85 -0.70 0.29 115.31 123.68 3bdm h LEU 154 Ca -0.08 0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3bdm h LEU 154 Cb 0.65 0.48 -0.05 0.00 0.37 0.00 0.00 40.66 42.11 3bdm h LEU 154 CO 0.13 -0.38 -0.14 0.00 -0.34 0.00 0.00 178.44 177.71 3bdm h ALA 155 N 0.34 0.01 -0.91 1.25 0.00 -0.73 0.34 119.26 119.56 3bdm h ALA 155 Ca 0.10 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.12 3bdm h ALA 155 Cb 0.58 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.63 3bdm h ALA 155 CO -0.39 -0.57 0.59 1.03 0.00 0.00 0.00 179.25 179.90 3bdm h SER 156 N -0.14 0.97 -0.22 0.00 0.87 0.29 -2.14 113.55 113.17 3bdm h SER 156 Ca 0.12 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.62 3bdm h SER 156 Cb 0.32 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 3bdm h SER 156 CO -0.29 0.66 -0.08 0.44 -0.53 0.00 0.00 176.83 177.02 3bdm h ASP 157 N 1.13 0.45 -0.95 6.23 3.45 0.20 -2.00 116.42 124.93 3bdm h ASP 157 Ca 0.37 -0.39 0.13 0.00 0.43 0.00 0.00 57.03 57.56 3bdm h ASP 157 Cb 0.03 -0.12 -0.08 0.00 -0.56 0.00 0.00 39.33 38.60 3bdm h ASP 157 CO -0.13 0.74 0.61 0.00 -1.57 0.00 0.00 179.24 178.89 3bdm h ALA 158 N 0.72 1.65 -0.48 3.45 0.00 -0.64 0.14 119.26 124.11 3bdm h ALA 158 Ca 0.05 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 3bdm h ALA 158 Cb 0.56 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3bdm h ALA 158 CO 0.03 0.11 -0.20 0.82 0.00 0.00 0.00 179.25 180.00 3bdm h ILE 159 N 0.87 1.27 -0.69 0.00 1.08 -1.25 -2.83 117.51 115.95 3bdm h ILE 159 Ca 0.47 -1.37 -0.03 0.00 -0.39 0.00 0.00 64.86 63.55 3bdm h ILE 159 Cb 0.58 1.13 -0.03 0.00 -3.07 0.00 0.00 36.82 35.43 3bdm h ILE 159 CO -0.24 0.47 0.32 1.56 -0.69 0.00 0.00 178.15 179.57 3bdm h GLN 160 N 0.84 1.00 -0.89 2.37 4.20 -0.14 -0.73 115.11 121.75 3bdm h GLN 160 Ca 0.11 -0.14 0.20 0.00 0.06 0.00 0.00 58.65 58.88 3bdm h GLN 160 Cb 0.78 -0.18 -0.07 0.00 0.30 0.00 0.00 27.48 28.31 3bdm h GLN 160 CO 0.06 0.78 0.59 0.00 -0.67 0.00 0.00 178.83 179.59 3bdm h ALA 161 N 1.36 2.18 0.00 3.87 0.00 -0.58 -2.18 119.26 123.92 3bdm h ALA 161 Ca 0.24 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3bdm h ALA 161 Cb 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3bdm h ALA 161 CO -0.03 -0.46 -0.00 0.78 0.00 0.00 0.00 179.25 179.54 3bdm h GLY 162 N 0.42 -0.00 -0.55 0.00 0.00 -1.12 -2.79 103.07 99.03 3bdm h GLY 162 Ca 0.46 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.87 3bdm h GLY 162 CO -0.18 -0.00 -0.48 -2.22 0.00 0.00 0.00 176.54 173.66 3bdm h ILE 163 N -0.97 0.05 0.49 2.60 5.03 -0.67 0.59 117.51 124.63 3bdm h ILE 163 Ca -0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.72 3bdm h ILE 163 Cb 0.90 0.05 0.00 0.00 -3.03 0.00 0.00 36.82 34.75 3bdm h ILE 163 CO 0.00 0.00 -0.24 -0.50 -0.68 0.00 0.00 178.15 176.73 3bdm h TRP 164 N -0.24 -0.61 0.00 1.37 -0.00 -1.60 -3.35 115.95 111.52 3bdm h TRP 164 Ca 0.16 -0.01 -0.04 0.00 -0.00 0.00 0.00 58.89 58.99 3bdm h TRP 164 Cb 0.56 0.20 -0.01 0.00 -0.00 0.00 0.00 29.16 29.91 3bdm h TRP 164 CO -0.76 -0.29 -0.19 -0.91 -0.00 0.00 0.00 178.44 176.30 3bdm h ASN 165 N -0.96 0.00 -3.29 -3.49 -0.26 -1.39 -3.45 115.58 102.74 3bdm h ASN 165 Ca -0.07 0.00 -0.63 0.00 -0.56 0.00 0.00 56.30 55.05 3bdm h ASN 165 Cb 0.60 0.00 -0.19 0.00 -1.06 0.00 0.00 38.32 37.67 3bdm h ASN 165 CO 0.11 0.19 -0.61 -0.62 -1.06 0.00 0.00 177.43 175.43 3bdm s ASP 166 N -6.26 5.22 0.50 5.81 2.15 0.21 -4.97 116.67 119.33 3bdm s ASP 166 Ca 0.05 -0.01 0.29 0.00 0.43 0.00 0.00 52.55 53.31 3bdm s ASP 166 Cb 0.06 -1.86 1.11 0.00 -0.30 0.00 0.00 42.92 41.94 3bdm s ASP 166 CO 0.68 0.18 1.89 -0.07 -0.17 0.00 0.00 175.17 177.69 3bdm h LEU 167 N 6.63 0.00 -0.13 -1.34 3.38 -1.85 -2.79 115.31 119.22 3bdm h LEU 167 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3bdm h LEU 167 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3bdm h LEU 167 CO 0.66 0.08 -0.20 0.61 0.09 0.00 0.00 178.44 179.68 3bdm n GLY 168 N 0.18 -1.14 3.46 0.83 0.00 -1.26 -4.87 105.19 102.40 3bdm n GLY 168 Ca 0.01 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.53 3bdm n GLY 168 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3bdm s SER 169 N -2.75 3.45 0.00 1.61 0.01 -1.05 -1.92 113.70 113.05 3bdm s SER 169 Ca 0.20 -1.06 0.00 0.00 1.31 0.00 0.00 55.95 56.40 3bdm s SER 169 Cb 0.19 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 66.14 3bdm s SER 169 CO 0.55 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.78 3bdm n GLY 170 N -0.61 -1.33 7.00 3.44 0.00 -1.26 -4.61 105.19 107.82 3bdm n GLY 170 Ca -0.05 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.85 3bdm n GLY 170 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3bdm n SER 171 N 2.17 0.00 -4.56 1.61 7.64 -1.26 -2.60 113.62 116.62 3bdm n SER 171 Ca 0.00 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.62 3bdm n SER 171 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 3bdm n SER 171 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3bdm n ASN 172 N 10.60 2.89 -4.13 6.43 5.03 -1.26 -4.18 115.26 130.63 3bdm n ASN 172 Ca 0.00 -2.87 -0.31 0.00 0.87 0.00 0.00 54.58 52.27 3bdm n ASN 172 Cb 0.00 0.11 -0.17 0.00 -1.02 0.00 0.00 39.78 38.70 3bdm n ASN 172 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3bdm s VAL 173 N -2.59 1.85 -0.11 2.41 1.01 -0.49 -2.70 120.40 119.79 3bdm s VAL 173 Ca 0.17 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 3bdm s VAL 173 Cb -0.01 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 3bdm s VAL 173 CO 0.11 0.51 -0.05 -1.81 0.00 0.00 0.00 175.10 173.86 3bdm s ASP 174 N 0.85 4.76 0.11 3.32 1.01 -0.01 0.09 116.67 126.80 3bdm s ASP 174 Ca -0.08 -0.06 0.05 0.00 0.71 0.00 0.00 52.55 53.18 3bdm s ASP 174 Cb -0.15 -1.49 -0.04 0.00 1.01 0.00 0.00 42.92 42.25 3bdm s ASP 174 CO -0.01 0.27 -0.13 -0.69 0.21 0.00 0.00 175.17 174.82 3bdm s VAL 175 N -0.27 1.24 -0.10 -1.27 1.01 -0.73 -1.19 120.40 119.09 3bdm s VAL 175 Ca 0.04 -1.65 -0.04 0.00 0.00 0.00 0.00 61.98 60.33 3bdm s VAL 175 Cb -0.13 -1.45 0.05 0.00 0.00 0.00 0.00 36.38 34.86 3bdm s VAL 175 CO 0.02 -0.42 0.18 0.00 0.00 0.00 0.00 175.10 174.88 3bdm s VAL 177 N 2.31 4.77 -0.35 0.00 1.01 0.27 -2.14 120.40 126.28 3bdm s VAL 177 Ca 0.03 -0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.00 3bdm s VAL 177 Cb -0.12 -3.15 0.10 0.00 0.00 0.00 0.00 36.38 33.21 3bdm s VAL 177 CO -0.06 0.45 0.09 -0.04 0.00 0.00 0.00 175.10 175.54 3bdm s MET 178 N 0.42 1.31 -0.17 2.72 -1.94 -0.42 -0.04 119.30 121.18 3bdm s MET 178 Ca 0.03 -1.73 -0.11 0.00 -1.71 0.00 0.00 55.69 52.17 3bdm s MET 178 Cb -0.12 -2.86 -0.05 0.00 2.01 0.00 0.00 34.83 33.81 3bdm s MET 178 CO 0.00 -0.98 0.20 -2.00 -0.01 0.00 0.00 175.02 172.24 3bdm s GLU 179 N 0.97 4.15 0.21 2.03 2.12 -1.26 -1.13 118.70 125.79 3bdm s GLU 179 Ca 0.11 -0.08 0.07 0.00 0.36 0.00 0.00 54.97 55.43 3bdm s GLU 179 Cb -0.19 -3.40 0.64 0.00 0.26 0.00 0.00 34.13 31.44 3bdm s GLU 179 CO -0.12 0.33 0.95 -0.89 -0.54 0.00 0.00 175.26 174.99 3bdm n ILE 180 N 3.38 -0.25 0.27 -3.70 2.08 0.69 -1.58 119.36 120.24 3bdm n ILE 180 Ca -0.15 1.28 0.10 0.00 0.56 0.00 0.00 62.75 64.54 3bdm n ILE 180 Cb 0.52 -1.98 -0.14 0.00 -0.75 0.00 0.00 39.64 37.30 3bdm n ILE 180 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3bdm n GLY 181 N -1.23 -0.85 0.55 7.39 0.00 -1.26 -4.91 105.19 104.87 3bdm n GLY 181 Ca 0.19 -0.48 -0.03 0.00 0.00 0.00 0.00 46.02 45.69 3bdm n GLY 181 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3bdm n LYS 182 N -1.95 1.15 -2.83 1.61 5.02 -0.61 -5.09 118.16 115.45 3bdm n LYS 182 Ca -0.01 -0.46 -0.37 0.00 -2.02 0.00 0.00 58.31 55.45 3bdm n LYS 182 Cb 0.44 0.01 -0.06 0.00 -0.02 0.00 0.00 35.03 35.39 3bdm n LYS 182 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3bdm s ASP 183 N -1.48 7.28 0.31 4.39 -0.00 -1.26 -4.69 116.67 121.22 3bdm s ASP 183 Ca 0.07 1.77 -0.29 0.00 -0.00 0.00 0.00 52.55 54.09 3bdm s ASP 183 Cb -0.01 -2.55 -0.10 0.00 -0.00 0.00 0.00 42.92 40.26 3bdm s ASP 183 CO 0.04 -0.06 1.27 0.00 -0.00 0.00 0.00 175.17 176.42 3bdm s ALA 184 N -1.62 3.48 -0.23 5.23 0.00 -1.26 -4.69 121.76 122.67 3bdm s ALA 184 Ca 0.49 1.18 -0.02 0.00 0.00 0.00 0.00 51.96 53.61 3bdm s ALA 184 Cb -0.18 -3.45 0.01 0.00 0.00 0.00 0.00 23.12 19.50 3bdm s ALA 184 CO 0.23 -0.54 -0.07 -1.83 0.00 0.00 0.00 175.76 173.55 3bdm s GLU 185 N -1.56 3.05 -0.23 0.00 -1.05 0.95 -4.96 118.70 114.89 3bdm s GLU 185 Ca 0.49 -0.83 -0.20 0.00 -0.15 0.00 0.00 54.97 54.27 3bdm s GLU 185 Cb -0.38 -2.94 -0.02 0.00 -0.44 0.00 0.00 34.13 30.35 3bdm s GLU 185 CO 0.49 -0.30 0.62 -0.47 0.95 0.00 0.00 175.26 176.55 3bdm s TYR 186 N 1.38 3.32 -0.81 4.83 5.04 -1.26 -0.56 117.35 129.28 3bdm s TYR 186 Ca 0.03 0.84 -0.01 0.00 -2.44 0.00 0.00 57.07 55.50 3bdm s TYR 186 Cb -0.15 -2.81 0.20 0.00 0.35 0.00 0.00 41.96 39.55 3bdm s TYR 186 CO -0.05 -0.26 0.66 -0.51 -1.34 0.00 0.00 175.55 174.05 3bdm s LEU 187 N 2.25 5.34 0.14 6.97 1.43 0.17 -5.00 118.68 130.00 3bdm s LEU 187 Ca 0.27 -3.61 -0.31 0.00 -1.03 0.00 0.00 54.13 49.45 3bdm s LEU 187 Cb -0.16 -1.84 -0.08 0.00 0.03 0.00 0.00 46.19 44.14 3bdm s LEU 187 CO 0.09 -0.19 1.38 -0.60 0.23 0.00 0.00 176.35 177.26 3bdm s ARG 189 N -1.16 4.33 -1.29 1.70 6.06 -1.26 -1.77 118.95 125.56 3bdm s ARG 189 Ca 0.25 2.09 -0.02 0.00 -2.50 0.00 0.00 55.73 55.55 3bdm s ARG 189 Cb -0.09 -3.23 0.01 0.00 0.06 0.00 0.00 34.95 31.70 3bdm s ARG 189 CO -0.12 -0.40 0.89 0.09 -2.50 0.00 0.00 175.30 173.26 3bdm n ASN 190 N 3.60 -2.32 -0.33 -2.12 4.13 -1.23 -4.87 115.26 112.12 3bdm n ASN 190 Ca 0.10 -0.71 0.06 0.00 1.68 0.00 0.00 54.58 55.71 3bdm n ASN 190 Cb 0.42 -4.57 0.25 0.00 -1.54 0.00 0.00 39.78 34.35 3bdm n ASN 190 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 3bdm h TYR 191 N -1.98 1.07 -3.93 3.10 -0.00 -0.24 -3.40 116.97 111.58 3bdm h TYR 191 Ca -0.60 0.03 -0.50 0.00 -0.00 0.00 0.00 58.73 57.66 3bdm h TYR 191 Cb 1.35 -0.35 -0.31 0.00 -0.00 0.00 0.00 36.73 37.43 3bdm h TYR 191 CO 0.47 0.49 -0.81 -0.51 -0.00 0.00 0.00 178.16 177.79 3bdm s LEU 192 N -10.07 1.88 -0.49 2.82 1.43 -1.05 -4.99 118.68 108.22 3bdm s LEU 192 Ca -0.12 -0.27 0.07 0.00 -1.03 0.00 0.00 54.13 52.78 3bdm s LEU 192 Cb 0.21 -0.77 0.24 0.00 0.03 0.00 0.00 46.19 45.90 3bdm s LEU 192 CO 0.80 0.12 0.58 0.35 0.23 0.00 0.00 176.35 178.44 3bdm n THR 193 N 3.12 0.39 1.10 5.49 -2.24 -1.26 -1.39 114.28 119.48 3bdm n THR 193 Ca -0.17 -4.41 0.02 0.00 -2.27 0.00 0.00 64.05 57.22 3bdm n THR 193 Cb 0.54 -1.99 0.07 0.00 -2.10 0.00 0.00 70.33 66.84 3bdm n THR 193 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3bdm n PRO 194 N 1.36 1.53 -2.62 -0.78 -0.04 -1.26 -4.31 135.00 128.88 3bdm n PRO 194 Ca 0.25 -0.55 -0.13 0.00 -0.04 0.00 0.00 63.50 63.02 3bdm n PRO 194 Cb 0.48 -1.38 0.02 0.00 -0.04 0.00 0.00 33.50 32.58 3bdm n PRO 194 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3bdm n ASN 195 N 0.01 2.20 -4.71 3.54 3.02 -1.26 -5.07 115.26 113.00 3bdm n ASN 195 Ca 0.05 -2.95 -0.42 0.00 -0.03 0.00 0.00 54.58 51.23 3bdm n ASN 195 Cb 0.27 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.90 3bdm n ASN 195 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3bdm s VAL 196 N -3.68 4.36 0.35 2.41 1.01 -1.26 -4.98 120.40 118.62 3bdm s VAL 196 Ca 0.32 1.69 -0.28 0.00 0.00 0.00 0.00 61.98 63.71 3bdm s VAL 196 Cb 0.45 -4.09 -0.11 0.00 0.00 0.00 0.00 36.38 32.63 3bdm s VAL 196 CO -0.01 0.11 1.43 -0.60 0.00 0.00 0.00 175.10 176.02 3bdm s ARG 197 N 1.25 4.20 0.56 2.72 3.00 -1.26 -4.97 118.95 124.45 3bdm s ARG 197 Ca 0.56 2.45 -0.19 0.00 -1.00 0.00 0.00 55.73 57.55 3bdm s ARG 197 Cb -0.26 -3.01 -0.05 0.00 0.00 0.00 0.00 34.95 31.63 3bdm s ARG 197 CO 0.27 -0.42 1.11 -1.83 0.00 0.00 0.00 175.30 174.43 3bdm s GLU 198 N -1.84 3.34 0.29 5.12 -1.05 -1.26 -4.93 118.70 118.37 3bdm s GLU 198 Ca 0.52 1.51 -0.30 0.00 -0.15 0.00 0.00 54.97 56.55 3bdm s GLU 198 Cb -0.44 -2.01 -0.12 0.00 -0.44 0.00 0.00 34.13 31.11 3bdm s GLU 198 CO 0.58 -0.84 1.45 -1.91 0.95 0.00 0.00 175.26 175.49 3bdm n GLU 199 N -1.47 2.32 -1.68 -4.83 2.13 -1.26 -4.92 120.64 110.93 3bdm n GLU 199 Ca 0.11 0.82 -0.35 0.00 0.66 0.00 0.00 57.16 58.40 3bdm n GLU 199 Cb 0.51 -2.51 0.07 0.00 0.27 0.00 0.00 31.44 29.79 3bdm n GLU 199 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3bdm s LYS 200 N -0.89 2.49 0.46 5.31 1.02 -1.26 -4.92 119.74 121.96 3bdm s LYS 200 Ca 0.63 1.85 0.25 0.00 0.02 0.00 0.00 55.97 58.72 3bdm s LYS 200 Cb -0.57 -1.87 1.06 0.00 -0.52 0.00 0.00 37.83 35.94 3bdm s LYS 200 CO 0.53 -1.59 1.89 0.37 -0.92 0.00 0.00 175.35 175.63 3bdm h GLN 201 N 0.25 0.00 -3.32 1.68 5.75 -2.05 -3.46 115.11 113.96 3bdm h GLN 201 Ca -0.49 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 57.95 3bdm h GLN 201 Cb 1.31 0.00 -0.14 0.00 1.07 0.00 0.00 27.48 29.72 3bdm h GLN 201 CO 0.52 0.19 -0.10 0.21 -2.65 0.00 0.00 178.83 177.01 3bdm s LYS 202 N -3.76 1.02 -0.04 1.69 2.20 -1.26 -5.15 119.74 114.43 3bdm s LYS 202 Ca -0.00 -0.63 -0.11 0.00 -0.36 0.00 0.00 55.97 54.87 3bdm s LYS 202 Cb 0.11 0.45 -0.05 0.00 -1.51 0.00 0.00 37.83 36.82 3bdm s LYS 202 CO 0.62 -0.38 0.29 0.45 -0.36 0.00 0.00 175.35 175.97 3bdm s SER 203 N -2.59 6.62 -0.14 1.43 0.15 -1.26 -4.99 113.70 112.91 3bdm s SER 203 Ca 0.01 0.73 0.15 0.00 0.70 0.00 0.00 55.95 57.55 3bdm s SER 203 Cb 0.01 -2.16 0.49 0.00 -1.71 0.00 0.00 66.02 62.65 3bdm s SER 203 CO -0.09 0.35 1.40 -1.22 1.20 0.00 0.00 173.24 174.87 3bdm n TYR 204 N 1.78 0.88 -1.58 3.44 4.01 -1.26 -4.98 117.16 119.45 3bdm n TYR 204 Ca -0.16 -0.79 -0.48 0.00 -0.16 0.00 0.00 57.90 56.32 3bdm n TYR 204 Cb 0.53 -0.26 -0.05 0.00 -0.31 0.00 0.00 39.34 39.26 3bdm n TYR 204 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 3bdm n LYS 205 N -0.23 1.74 -2.53 -0.72 4.81 -1.26 -4.92 118.16 115.05 3bdm n LYS 205 Ca 0.19 0.55 -0.33 0.00 -0.87 0.00 0.00 58.31 57.85 3bdm n LYS 205 Cb 0.80 -2.75 -0.04 0.00 0.02 0.00 0.00 35.03 33.06 3bdm n LYS 205 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3bdm s PHE 206 N 6.42 3.14 0.12 5.64 0.08 -1.26 -5.00 117.98 127.12 3bdm s PHE 206 Ca 1.01 1.56 -0.30 0.00 0.12 0.00 0.00 56.93 59.32 3bdm s PHE 206 Cb -0.65 -2.97 -0.07 0.00 -0.57 0.00 0.00 43.02 38.77 3bdm s PHE 206 CO 0.46 -0.62 1.12 -1.25 -0.10 0.00 0.00 175.22 174.83 3bdm s PRO 207 N -3.44 4.54 0.43 0.24 0.04 -1.26 -4.95 135.00 130.59 3bdm s PRO 207 Ca 0.64 1.70 -0.24 0.00 0.04 0.00 0.00 61.00 63.14 3bdm s PRO 207 Cb -0.13 -3.32 -0.10 0.00 0.04 0.00 0.00 34.50 30.99 3bdm s PRO 207 CO 0.22 -0.04 1.06 0.54 0.04 0.00 0.00 177.00 178.82 3bdm n ARG 208 N 3.00 1.44 -0.04 4.56 1.74 -1.26 -2.01 116.66 124.09 3bdm n ARG 208 Ca 0.05 0.52 0.00 0.00 -0.77 0.00 0.00 57.85 57.65 3bdm n ARG 208 Cb 0.47 -2.11 0.00 0.00 -1.02 0.00 0.00 32.46 29.80 3bdm n ARG 208 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3bdm n GLY 209 N 1.12 0.94 0.36 -0.13 0.00 -1.26 -4.93 105.19 101.27 3bdm n GLY 209 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 3bdm n GLY 209 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3bdm h THR 210 N 0.00 1.25 -3.40 2.61 2.02 -1.79 -3.42 112.91 110.19 3bdm h THR 210 Ca 0.00 -0.63 -0.55 0.00 0.77 0.00 0.00 66.41 66.00 3bdm h THR 210 Cb 0.00 0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 66.47 3bdm h THR 210 CO 0.00 0.28 0.22 -0.89 0.37 0.00 0.00 175.52 175.51 3bdm s THR 211 N -5.78 4.92 -0.25 3.16 2.01 -1.26 -5.02 115.64 113.41 3bdm s THR 211 Ca -0.12 1.74 -0.25 0.00 0.31 0.00 0.00 61.69 63.37 3bdm s THR 211 Cb 0.17 -4.17 -0.00 0.00 0.01 0.00 0.00 72.50 68.50 3bdm s THR 211 CO 0.82 0.23 0.87 0.00 -0.69 0.00 0.00 174.62 175.85 3bdm s ALA 212 N 0.77 3.63 0.00 7.40 0.00 -1.26 -5.05 121.76 127.25 3bdm s ALA 212 Ca 0.44 -0.13 -0.02 0.00 0.00 0.00 0.00 51.96 52.25 3bdm s ALA 212 Cb -0.20 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 3bdm s ALA 212 CO 0.23 -1.02 0.17 0.08 0.00 0.00 0.00 175.76 175.22 3bdm s VAL 213 N 2.96 5.31 -0.24 0.00 1.01 -1.26 -5.03 120.40 123.16 3bdm s VAL 213 Ca 0.36 -0.23 0.07 0.00 0.00 0.00 0.00 61.98 62.18 3bdm s VAL 213 Cb -0.15 -3.49 -0.20 0.00 0.00 0.00 0.00 36.38 32.54 3bdm s VAL 213 CO 0.08 0.30 -0.12 0.18 0.00 0.00 0.00 175.10 175.55 3bdm n LEU 214 N 0.89 1.98 -3.69 3.92 4.77 -1.26 -5.05 117.00 118.55 3bdm n LEU 214 Ca -0.10 -0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 55.69 3bdm n LEU 214 Cb 0.52 -0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 3bdm n LEU 214 CO 0.44 0.79 0.23 -0.75 -1.33 0.00 0.00 177.39 176.77 3bdm s LYS 215 N -2.51 1.26 0.06 3.23 2.20 -1.26 -5.19 119.74 117.53 3bdm s LYS 215 Ca -0.26 -0.80 -0.12 0.00 -0.36 0.00 0.00 55.97 54.43 3bdm s LYS 215 Cb 0.08 0.50 0.01 0.00 -1.51 0.00 0.00 37.83 36.91 3bdm s LYS 215 CO 0.68 -0.52 0.26 -2.00 -0.36 0.00 0.00 175.35 173.41 3bdm s GLU 216 N -3.85 0.81 -0.17 4.03 2.12 -1.26 -5.18 118.70 115.20 3bdm s GLU 216 Ca 0.07 -0.65 -0.35 0.00 0.36 0.00 0.00 54.97 54.40 3bdm s GLU 216 Cb 0.00 0.34 0.14 0.00 0.26 0.00 0.00 34.13 34.87 3bdm s GLU 216 CO -0.06 -0.26 1.24 -1.54 -0.54 0.00 0.00 175.26 174.10 3bdm s SER 217 N -2.30 -0.11 0.23 -1.70 1.04 -1.26 -5.17 113.70 104.44 3bdm s SER 217 Ca -0.02 -0.02 -0.04 0.00 0.48 0.00 0.00 55.95 56.34 3bdm s SER 217 Cb 0.01 0.13 -0.05 0.00 0.10 0.00 0.00 66.02 66.21 3bdm s SER 217 CO -0.06 -0.22 0.48 -0.63 0.98 0.00 0.00 173.24 173.79 3bdm s ILE 218 N -2.38 5.09 0.08 -1.02 1.09 -1.26 -5.11 121.20 117.69 3bdm s ILE 218 Ca 0.10 -0.01 0.06 0.00 -1.10 0.00 0.00 60.65 59.70 3bdm s ILE 218 Cb 0.00 -3.70 -0.04 0.00 -1.06 0.00 0.00 42.46 37.66 3bdm s ILE 218 CO -0.04 -0.19 -0.08 -0.69 -0.10 0.00 0.00 174.94 173.84 3bdm s VAL 219 N -1.92 3.52 -0.36 2.92 1.01 -1.26 -5.10 120.40 119.21 3bdm s VAL 219 Ca 0.42 -1.13 -0.15 0.00 0.00 0.00 0.00 61.98 61.13 3bdm s VAL 219 Cb -0.11 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.63 3bdm s VAL 219 CO 0.28 0.17 0.32 0.21 0.00 0.00 0.00 175.10 176.07 3bdm s ASN 220 N -2.07 6.13 -0.19 3.32 2.47 -1.26 -4.93 114.94 118.41 3bdm s ASN 220 Ca 0.21 -0.46 0.09 0.00 0.42 0.00 0.00 52.86 53.13 3bdm s ASN 220 Cb -0.11 -2.17 -0.18 0.00 -1.45 0.00 0.00 41.25 37.34 3bdm s ASN 220 CO 0.13 -0.34 -0.05 -0.38 -3.72 0.00 0.00 177.10 172.73 3bdm n ILE 221 N 5.20 1.20 -2.12 -5.21 -0.00 -1.26 -4.94 119.36 112.23 3bdm n ILE 221 Ca -0.11 -0.61 -0.42 0.00 -0.00 0.00 0.00 62.75 61.61 3bdm n ILE 221 Cb 0.49 -0.87 -0.03 0.00 -0.00 0.00 0.00 39.64 39.23 3bdm n ILE 221 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55