#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bdm n GLY 7 N 0.00 -0.76 0.52 0.00 0.00 -1.26 -3.06 105.19 100.62 3bdm n GLY 7 Ca 0.00 -0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.07 3bdm n GLY 7 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3bdm n TYR 8 N -0.60 0.27 1.52 1.61 4.01 -1.26 -3.62 117.16 119.10 3bdm n TYR 8 Ca 0.04 -0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 3bdm n TYR 8 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 3bdm n TYR 8 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3bdm n ASP 9 N 0.27 0.07 0.00 7.72 5.75 -1.17 -1.45 116.55 127.73 3bdm n ASP 9 Ca 0.14 -1.59 0.00 0.00 -0.01 0.00 0.00 54.79 53.33 3bdm n ASP 9 Cb 0.28 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 3bdm n ASP 9 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3bdm n ARG 10 N -0.45 2.19 -0.01 0.11 1.74 -1.24 -4.46 116.66 114.54 3bdm n ARG 10 Ca 0.00 -1.27 -0.01 0.00 -0.77 0.00 0.00 57.85 55.79 3bdm n ARG 10 Cb 0.02 -0.96 -0.02 0.00 -1.02 0.00 0.00 32.46 30.47 3bdm n ARG 10 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3bdm n HIS 11 N -0.39 0.00 -4.56 -1.55 8.25 -0.53 -4.66 115.22 111.78 3bdm n HIS 11 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.20 3bdm n HIS 11 Cb 0.23 -0.14 -0.10 0.00 1.12 0.00 0.00 29.99 31.10 3bdm n HIS 11 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 3bdm s ILE 12 N -2.07 1.44 -1.36 1.59 -4.36 -1.19 -4.98 121.20 110.27 3bdm s ILE 12 Ca -0.01 -2.00 -0.09 0.00 -0.26 0.00 0.00 60.65 58.28 3bdm s ILE 12 Cb 0.01 -2.75 0.10 0.00 1.25 0.00 0.00 42.46 41.07 3bdm s ILE 12 CO 0.12 0.00 2.19 0.35 0.24 0.00 0.00 174.94 177.84 3bdm n THR 13 N -0.89 4.39 -4.53 8.37 -2.24 -1.26 -4.66 114.28 113.45 3bdm n THR 13 Ca -0.06 -3.92 -0.25 0.00 -2.27 0.00 0.00 64.05 57.56 3bdm n THR 13 Cb 0.67 -2.37 -0.11 0.00 -2.10 0.00 0.00 70.33 66.42 3bdm n THR 13 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 3bdm s ILE 14 N 0.74 1.78 0.43 2.28 -4.36 -1.26 -4.65 121.20 116.15 3bdm s ILE 14 Ca 0.48 -2.06 -0.24 0.00 -0.26 0.00 0.00 60.65 58.57 3bdm s ILE 14 Cb 0.13 -2.79 -0.08 0.00 1.25 0.00 0.00 42.46 40.97 3bdm s ILE 14 CO -0.04 -0.09 1.16 -0.36 0.24 0.00 0.00 174.94 175.85 3bdm s PHE 15 N -2.89 3.00 0.32 1.37 0.08 -1.26 -4.65 117.98 113.94 3bdm s PHE 15 Ca 0.34 1.55 0.06 0.00 0.12 0.00 0.00 56.93 59.00 3bdm s PHE 15 Cb 0.07 -3.37 -0.01 0.00 -0.57 0.00 0.00 43.02 39.14 3bdm s PHE 15 CO 0.16 -1.35 0.45 -1.54 -0.10 0.00 0.00 175.22 172.84 3bdm s SER 16 N -1.27 6.05 0.51 1.36 1.04 -0.56 -4.88 113.70 115.95 3bdm s SER 16 Ca 0.60 -0.13 0.28 0.00 0.48 0.00 0.00 55.95 57.18 3bdm s SER 16 Cb -0.29 -1.37 1.40 0.00 0.10 0.00 0.00 66.02 65.86 3bdm s SER 16 CO 0.36 -0.36 1.89 -0.65 0.98 0.00 0.00 173.24 175.46 3bdm h PRO 17 N 0.95 0.08 0.00 4.02 0.11 -1.97 0.35 132.00 135.53 3bdm h PRO 17 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3bdm h PRO 17 Cb 1.25 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3bdm h PRO 17 CO 0.54 0.05 0.00 0.39 -0.21 0.00 0.00 178.00 178.78 3bdm n GLU 18 N -4.33 0.23 -1.38 1.05 4.71 -1.26 -4.87 120.64 114.79 3bdm n GLU 18 Ca 0.18 0.04 0.00 0.00 -0.01 0.00 0.00 57.16 57.37 3bdm n GLU 18 Cb 0.88 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.81 3bdm n GLU 18 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3bdm n GLY 19 N 1.11 0.86 3.62 0.62 0.00 0.12 -5.07 105.19 106.45 3bdm n GLY 19 Ca 0.10 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.26 3bdm n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bdm s ARG 20 N -3.06 2.20 -0.53 1.61 0.52 -1.25 -4.83 118.95 113.60 3bdm s ARG 20 Ca 0.00 -1.42 0.03 0.00 -0.52 0.00 0.00 55.73 53.83 3bdm s ARG 20 Cb 0.00 -2.13 0.13 0.00 0.52 0.00 0.00 34.95 33.47 3bdm s ARG 20 CO 0.00 0.38 0.28 -0.51 0.02 0.00 0.00 175.30 175.47 3bdm s LEU 21 N -3.49 4.42 0.24 2.53 1.43 -1.26 -1.49 118.68 121.06 3bdm s LEU 21 Ca 0.30 -3.00 -0.04 0.00 -1.03 0.00 0.00 54.13 50.36 3bdm s LEU 21 Cb -0.07 -1.66 0.46 0.00 0.03 0.00 0.00 46.19 44.95 3bdm s LEU 21 CO 0.19 -0.25 1.72 1.88 0.23 0.00 0.00 176.35 180.13 3bdm h TYR 22 N 6.55 0.49 -0.48 0.29 0.05 -1.84 -1.06 116.97 120.97 3bdm h TYR 22 Ca -0.07 0.04 0.08 0.00 0.05 0.00 0.00 58.73 58.83 3bdm h TYR 22 Cb 0.90 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 38.51 3bdm h TYR 22 CO 0.54 0.05 0.33 1.96 -1.05 0.00 0.00 178.16 179.99 3bdm h GLN 23 N 0.43 0.30 -0.33 4.88 1.08 -1.83 0.31 115.11 119.95 3bdm h GLN 23 Ca 0.42 -0.02 -0.10 0.00 -1.45 0.00 0.00 58.65 57.50 3bdm h GLN 23 Cb 0.64 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.99 3bdm h GLN 23 CO -0.41 0.20 -0.17 0.28 -0.95 0.00 0.00 178.83 177.78 3bdm h VAL 24 N 0.31 1.29 -0.34 -0.54 2.07 -1.57 -2.06 116.25 115.41 3bdm h VAL 24 Ca 0.22 -1.28 -0.02 0.00 0.82 0.00 0.00 66.70 66.43 3bdm h VAL 24 Cb 0.46 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 3bdm h VAL 24 CO -0.05 0.42 0.11 -0.33 0.02 0.00 0.00 177.57 177.74 3bdm h GLU 25 N 0.46 0.52 0.00 1.57 5.08 -0.64 -2.04 114.58 119.53 3bdm h GLU 25 Ca 0.07 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 3bdm h GLU 25 Cb 0.70 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 3bdm h GLU 25 CO 0.05 0.54 -0.14 1.88 -1.00 0.00 0.00 179.01 180.34 3bdm h TYR 26 N 0.39 0.00 -0.21 4.33 0.05 -0.47 -1.81 116.97 119.25 3bdm h TYR 26 Ca 0.11 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.83 3bdm h TYR 26 Cb 0.23 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 3bdm h TYR 26 CO 0.00 0.14 -0.09 0.00 -1.05 0.00 0.00 178.16 177.17 3bdm h ALA 27 N 1.86 0.30 -0.90 3.88 0.00 -0.80 -2.48 119.26 121.13 3bdm h ALA 27 Ca -0.00 -0.28 0.14 0.00 0.00 0.00 0.00 54.91 54.77 3bdm h ALA 27 Cb 0.32 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 3bdm h ALA 27 CO 0.02 0.12 0.50 0.74 0.00 0.00 0.00 179.25 180.63 3bdm h PHE 28 N 0.15 0.89 -0.97 0.00 0.04 -0.67 0.37 116.94 116.74 3bdm h PHE 28 Ca 0.05 0.03 0.07 0.00 2.80 0.00 0.00 57.97 60.92 3bdm h PHE 28 Cb 0.57 -0.26 -0.07 0.00 2.20 0.00 0.00 35.95 38.39 3bdm h PHE 28 CO 0.06 0.25 0.63 -0.22 -0.60 0.00 0.00 178.31 178.43 3bdm h LYS 29 N 0.73 1.08 0.00 1.51 1.63 -0.96 -1.72 116.57 118.84 3bdm h LYS 29 Ca 0.48 -0.06 -0.01 0.00 -0.85 0.00 0.00 60.65 60.21 3bdm h LYS 29 Cb 0.63 -0.24 -0.00 0.00 -0.60 0.00 0.00 32.23 32.02 3bdm h LYS 29 CO -0.34 0.71 -0.04 0.00 -3.45 0.00 0.00 179.45 176.34 3bdm h ALA 30 N 1.48 1.02 -0.45 5.00 0.00 -0.60 -3.05 119.26 122.65 3bdm h ALA 30 Ca 0.42 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.27 3bdm h ALA 30 Cb 0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3bdm h ALA 30 CO -0.17 0.05 0.15 1.79 0.00 0.00 0.00 179.25 181.07 3bdm h THR 31 N 0.00 1.18 0.00 0.00 1.35 -1.11 -1.70 112.91 112.64 3bdm h THR 31 Ca -0.00 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 3bdm h THR 31 Cb 0.48 0.68 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 3bdm h THR 31 CO 0.00 0.23 0.00 0.59 -0.25 0.00 0.00 175.52 176.10 3bdm n ASN 32 N -4.34 0.00 -0.12 5.36 3.02 -1.15 -3.21 115.26 114.82 3bdm n ASN 32 Ca 0.03 -1.08 0.20 0.00 -0.03 0.00 0.00 54.58 53.70 3bdm n ASN 32 Cb 0.17 0.00 0.61 0.00 -0.61 0.00 0.00 39.78 39.96 3bdm n ASN 32 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 3bdm h GLN 33 N 0.00 0.18 0.00 3.52 4.15 -1.46 -1.03 115.11 120.48 3bdm h GLN 33 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 3bdm h GLN 33 Cb 0.00 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.65 3bdm h GLN 33 CO 0.00 0.12 0.00 1.79 -1.93 0.00 0.00 178.83 178.81 3bdm h THR 34 N 0.19 0.00 -5.82 2.39 1.35 -1.81 -3.48 112.91 105.73 3bdm h THR 34 Ca 0.36 -0.59 -0.37 0.00 -0.55 0.00 0.00 66.41 65.26 3bdm h THR 34 Cb 1.13 1.58 0.13 0.00 -1.73 0.00 0.00 68.15 69.25 3bdm h THR 34 CO -0.06 0.00 -0.77 -3.20 -0.25 0.00 0.00 175.52 171.23 3bdm n ASN 34 N -2.48 -2.57 -4.05 5.36 4.05 -0.39 -5.00 115.26 110.18 3bdm n ASN 34 Ca 0.05 -0.67 -0.21 0.00 0.45 0.00 0.00 54.58 54.20 3bdm n ASN 34 Cb 0.44 -4.79 -0.15 0.00 1.23 0.00 0.00 39.78 36.51 3bdm n ASN 34 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3bdm s ILE 35 N -3.43 0.90 0.21 -1.44 -1.09 -1.26 -5.00 121.20 110.09 3bdm s ILE 35 Ca 0.12 -0.46 0.07 0.00 -2.23 0.00 0.00 60.65 58.14 3bdm s ILE 35 Cb -0.05 -0.77 -0.04 0.00 -1.58 0.00 0.00 42.46 40.02 3bdm s ILE 35 CO 0.76 0.26 0.08 0.20 -1.23 0.00 0.00 174.94 175.01 3bdm s ASN 36 N -0.10 5.10 0.07 3.58 0.01 -1.26 -4.37 114.94 117.97 3bdm s ASN 36 Ca 0.01 -0.34 -0.11 0.00 -0.71 0.00 0.00 52.86 51.72 3bdm s ASN 36 Cb -0.06 -1.18 0.01 0.00 0.41 0.00 0.00 41.25 40.42 3bdm s ASN 36 CO 0.00 0.04 0.24 -0.94 -1.51 0.00 0.00 177.10 174.93 3bdm s SER 37 N -3.33 0.01 0.03 -1.22 1.04 0.27 -1.37 113.70 109.14 3bdm s SER 37 Ca 0.30 -0.46 -0.21 0.00 0.48 0.00 0.00 55.95 56.07 3bdm s SER 37 Cb -0.09 0.35 0.04 0.00 0.10 0.00 0.00 66.02 66.43 3bdm s SER 37 CO 0.21 -0.68 0.47 -1.48 0.98 0.00 0.00 173.24 172.74 3bdm s LEU 38 N -2.52 0.15 0.01 2.42 0.05 0.73 -0.58 118.68 118.93 3bdm s LEU 38 Ca 0.00 0.14 0.02 0.00 0.05 0.00 0.00 54.13 54.34 3bdm s LEU 38 Cb 0.02 1.94 -0.01 0.00 -2.05 0.00 0.00 46.19 46.08 3bdm s LEU 38 CO -0.08 -0.67 -0.06 0.00 -0.55 0.00 0.00 176.35 174.99 3bdm s ALA 39 N -2.28 0.45 0.08 1.48 0.00 0.50 0.33 121.76 122.32 3bdm s ALA 39 Ca -0.06 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 51.50 3bdm s ALA 39 Cb -0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 3bdm s ALA 39 CO -0.01 0.05 -0.07 0.14 0.00 0.00 0.00 175.76 175.88 3bdm s VAL 40 N -0.59 0.60 -0.18 0.00 -7.23 -0.48 -1.28 120.40 111.24 3bdm s VAL 40 Ca -0.03 -1.67 -0.07 0.00 -1.81 0.00 0.00 61.98 58.40 3bdm s VAL 40 Cb -0.05 -1.35 -0.04 0.00 0.56 0.00 0.00 36.38 35.50 3bdm s VAL 40 CO -0.00 -0.74 0.07 -0.13 -0.31 0.00 0.00 175.10 173.98 3bdm s ARG 41 N -3.18 3.93 0.00 4.82 0.52 -1.23 -1.73 118.95 122.08 3bdm s ARG 41 Ca 0.05 -0.33 0.00 0.00 -0.52 0.00 0.00 55.73 54.93 3bdm s ARG 41 Cb 0.01 -3.21 0.00 0.00 0.52 0.00 0.00 34.95 32.27 3bdm s ARG 41 CO -0.04 0.32 0.00 0.41 0.02 0.00 0.00 175.30 176.01 3bdm n GLY 42 N 3.39 0.03 0.09 -3.53 0.00 0.21 0.12 105.19 105.50 3bdm n GLY 42 Ca -0.17 -1.73 -0.13 0.00 0.00 0.00 0.00 46.02 44.00 3bdm n GLY 42 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3bdm h LYS 43 N 0.00 0.16 -0.09 1.61 3.64 -1.88 -3.39 116.57 116.62 3bdm h LYS 43 Ca 0.00 -0.28 -0.21 0.00 -1.27 0.00 0.00 60.65 58.89 3bdm h LYS 43 Cb 0.00 0.10 -0.18 0.00 -0.41 0.00 0.00 32.23 31.74 3bdm h LYS 43 CO 0.00 1.08 -0.42 -0.40 -2.27 0.00 0.00 179.45 177.44 3bdm n ASP 44 N -3.42 -1.25 -3.50 4.20 3.85 -1.26 -4.86 116.55 110.31 3bdm n ASP 44 Ca -0.08 -2.33 -0.11 0.00 -0.71 0.00 0.00 54.79 51.56 3bdm n ASP 44 Cb 1.00 0.66 -0.03 0.00 -1.35 0.00 0.00 41.12 41.41 3bdm n ASP 44 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3bdm s THR 46 N -2.63 1.19 0.01 0.00 2.01 0.29 0.64 115.64 117.15 3bdm s THR 46 Ca 0.00 -0.59 0.08 0.00 0.31 0.00 0.00 61.69 61.49 3bdm s THR 46 Cb -0.01 -1.03 -0.02 0.00 0.01 0.00 0.00 72.50 71.45 3bdm s THR 46 CO -0.05 0.35 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.29 3bdm s VAL 47 N 0.07 1.94 -0.08 3.82 1.01 -0.70 -0.28 120.40 126.17 3bdm s VAL 47 Ca -0.03 -1.14 0.02 0.00 0.00 0.00 0.00 61.98 60.82 3bdm s VAL 47 Cb -0.10 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.66 3bdm s VAL 47 CO 0.01 0.46 -0.12 0.68 0.00 0.00 0.00 175.10 176.13 3bdm s VAL 48 N -0.65 1.23 -0.03 2.92 -7.23 -0.37 -1.39 120.40 114.88 3bdm s VAL 48 Ca 0.10 -0.50 0.04 0.00 -1.81 0.00 0.00 61.98 59.80 3bdm s VAL 48 Cb -0.09 -1.14 -0.03 0.00 0.56 0.00 0.00 36.38 35.68 3bdm s VAL 48 CO 0.00 0.38 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.42 3bdm s ILE 49 N 0.91 3.23 -0.11 -0.62 -1.09 0.15 -1.39 121.20 122.28 3bdm s ILE 49 Ca -0.09 -0.77 -0.14 0.00 -2.23 0.00 0.00 60.65 57.42 3bdm s ILE 49 Cb -0.15 -2.32 0.03 0.00 -1.58 0.00 0.00 42.46 38.44 3bdm s ILE 49 CO 0.01 0.51 0.37 -0.55 -1.23 0.00 0.00 174.94 174.05 3bdm s SER 50 N -1.00 -0.36 0.65 3.58 0.15 -0.68 -0.19 113.70 115.85 3bdm s SER 50 Ca 0.13 0.63 -0.15 0.00 0.70 0.00 0.00 55.95 57.26 3bdm s SER 50 Cb -0.11 0.68 -0.01 0.00 -1.71 0.00 0.00 66.02 64.87 3bdm s SER 50 CO 0.03 -0.20 1.09 -1.10 1.20 0.00 0.00 173.24 174.26 3bdm s GLN 51 N -0.14 2.93 -0.10 5.44 -0.21 -0.47 -1.26 119.66 125.85 3bdm s GLN 51 Ca -0.03 1.31 -0.02 0.00 0.02 0.00 0.00 55.36 56.64 3bdm s GLN 51 Cb -0.03 -1.97 0.04 0.00 1.00 0.00 0.00 33.01 32.05 3bdm s GLN 51 CO 0.01 -1.14 0.04 0.21 -2.12 0.00 0.00 175.29 172.30 3bdm s LYS 52 N -4.16 0.34 -0.46 2.91 2.20 -0.66 -4.76 119.74 115.15 3bdm s LYS 52 Ca 0.65 0.06 0.04 0.00 -0.36 0.00 0.00 55.97 56.36 3bdm s LYS 52 Cb -0.19 -1.19 0.12 0.00 -1.51 0.00 0.00 37.83 35.06 3bdm s LYS 52 CO 0.41 -0.43 0.20 0.15 -0.36 0.00 0.00 175.35 175.32 3bdm s LYS 53 N 2.03 1.80 -0.80 4.03 1.02 -1.26 -4.36 119.74 122.20 3bdm s LYS 53 Ca 0.03 -2.38 -0.14 0.00 0.02 0.00 0.00 55.97 53.50 3bdm s LYS 53 Cb -0.14 -3.24 0.21 0.00 -0.52 0.00 0.00 37.83 34.14 3bdm s LYS 53 CO -0.06 -1.06 0.75 0.08 -0.92 0.00 0.00 175.35 174.14 3bdm s VAL 54 N 0.09 5.54 -0.05 3.17 1.01 -1.26 -4.91 120.40 123.99 3bdm s VAL 54 Ca 0.15 -2.33 -0.23 0.00 0.00 0.00 0.00 61.98 59.57 3bdm s VAL 54 Cb -0.24 -4.46 -0.18 0.00 0.00 0.00 0.00 36.38 31.50 3bdm s VAL 54 CO -0.03 -1.03 1.00 1.55 0.00 0.00 0.00 175.10 176.60 3bdm h PRO 55 N 7.94 -0.14 -6.99 2.72 0.13 -2.01 -3.46 132.00 130.20 3bdm h PRO 55 Ca 0.06 0.01 -0.56 0.00 -0.87 0.00 0.00 66.00 64.64 3bdm h PRO 55 Cb 1.05 0.03 0.14 0.00 0.13 0.00 0.00 31.00 32.35 3bdm h PRO 55 CO 0.80 0.35 0.51 -3.47 -0.23 0.00 0.00 178.00 175.97 3bdm n ASP 56 N -4.89 2.36 0.05 1.44 -0.08 -1.26 -4.91 116.55 109.26 3bdm n ASP 56 Ca -0.08 0.96 0.12 0.00 -1.51 0.00 0.00 54.79 54.27 3bdm n ASP 56 Cb 0.28 -1.54 0.08 0.00 2.34 0.00 0.00 41.12 42.28 3bdm n ASP 56 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3bdm n LYS 57 N -0.94 0.33 0.00 -0.67 5.02 -1.26 -3.83 118.16 116.81 3bdm n LYS 57 Ca 0.11 0.04 0.13 0.00 -2.02 0.00 0.00 58.31 56.57 3bdm n LYS 57 Cb 0.45 -1.65 0.47 0.00 -0.02 0.00 0.00 35.03 34.27 3bdm n LYS 57 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3bdm n LEU 58 N -2.10 0.35 -4.81 -0.35 4.77 -1.26 -4.88 117.00 108.71 3bdm n LEU 58 Ca 0.02 0.16 -0.33 0.00 -0.03 0.00 0.00 56.01 55.83 3bdm n LEU 58 Cb 0.45 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 3bdm n LEU 58 CO 0.39 0.08 0.70 -0.76 -1.33 0.00 0.00 177.39 176.46 3bdm s LEU 59 N -2.85 3.69 -0.71 2.23 1.43 -1.25 -5.00 118.68 116.23 3bdm s LEU 59 Ca 0.17 1.77 -0.13 0.00 -1.03 0.00 0.00 54.13 54.91 3bdm s LEU 59 Cb 0.19 -4.54 0.18 0.00 0.03 0.00 0.00 46.19 42.06 3bdm s LEU 59 CO 0.58 -0.79 0.64 -0.62 0.23 0.00 0.00 176.35 176.38 3bdm s ASP 60 N -2.54 6.38 0.47 2.29 3.68 -1.26 -4.94 116.67 120.75 3bdm s ASP 60 Ca 0.63 -2.45 0.38 0.00 2.13 0.00 0.00 52.55 53.24 3bdm s ASP 60 Cb -0.14 -2.15 1.54 0.00 -1.45 0.00 0.00 42.92 40.72 3bdm s ASP 60 CO 0.27 -0.62 1.52 -2.65 0.13 0.00 0.00 175.17 173.82 3bdm n PRO 61 N 4.28 -0.02 0.28 4.34 -0.02 -1.26 -0.47 135.00 142.13 3bdm n PRO 61 Ca 0.05 1.17 0.16 0.00 -2.02 0.00 0.00 63.50 62.86 3bdm n PRO 61 Cb 0.44 -2.42 0.84 0.00 -0.02 0.00 0.00 33.50 32.34 3bdm n PRO 61 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3bdm h THR 62 N 0.00 0.33 -0.01 3.45 1.35 -2.05 -2.61 112.91 113.38 3bdm h THR 62 Ca 0.88 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 66.36 3bdm h THR 62 Cb 3.09 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 70.80 3bdm h THR 62 CO -0.30 0.06 -0.29 0.35 -0.25 0.00 0.00 175.52 175.09 3bdm n THR 63 N -3.42 0.00 -3.27 6.82 -2.24 0.39 -4.86 114.28 107.70 3bdm n THR 63 Ca -0.02 -0.11 -0.39 0.00 -2.27 0.00 0.00 64.05 61.27 3bdm n THR 63 Cb 0.21 0.38 -0.07 0.00 -2.10 0.00 0.00 70.33 68.75 3bdm n THR 63 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3bdm s VAL 64 N -2.57 5.13 -0.18 2.28 1.01 -0.99 -5.04 120.40 120.04 3bdm s VAL 64 Ca 0.22 0.93 -0.29 0.00 0.00 0.00 0.00 61.98 62.84 3bdm s VAL 64 Cb 0.19 -3.83 0.12 0.00 0.00 0.00 0.00 36.38 32.86 3bdm s VAL 64 CO 0.55 0.21 0.97 -0.55 0.00 0.00 0.00 175.10 176.28 3bdm s SER 65 N 1.04 -0.42 -0.05 3.32 0.15 -1.26 -5.00 113.70 111.48 3bdm s SER 65 Ca 0.24 0.54 0.07 0.00 0.70 0.00 0.00 55.95 57.51 3bdm s SER 65 Cb -0.15 0.46 0.11 0.00 -1.71 0.00 0.00 66.02 64.73 3bdm s SER 65 CO 0.10 -0.33 1.01 -1.22 1.20 0.00 0.00 173.24 174.00 3bdm n TYR 66 N 1.08 0.00 -4.61 3.44 4.02 -1.26 -4.97 117.16 114.86 3bdm n TYR 66 Ca -0.12 -0.61 -0.33 0.00 -0.01 0.00 0.00 57.90 56.83 3bdm n TYR 66 Cb 0.57 -0.08 -0.13 0.00 -0.02 0.00 0.00 39.34 39.68 3bdm n TYR 66 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3bdm s ILE 67 N -1.57 3.47 0.08 -0.72 1.01 -1.26 0.21 121.20 122.41 3bdm s ILE 67 Ca 0.12 -0.52 0.07 0.00 0.00 0.00 0.00 60.65 60.33 3bdm s ILE 67 Cb 0.11 -2.48 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 3bdm s ILE 67 CO 0.01 0.52 -0.19 -0.36 0.00 0.00 0.00 174.94 174.93 3bdm s PHE 68 N 0.20 1.61 -0.51 3.97 0.08 0.28 -4.98 117.98 118.63 3bdm s PHE 68 Ca -0.05 -0.41 -0.13 0.00 0.12 0.00 0.00 56.93 56.45 3bdm s PHE 68 Cb -0.15 -0.91 0.12 0.00 -0.57 0.00 0.00 43.02 41.52 3bdm s PHE 68 CO 0.04 0.14 0.43 0.00 -0.10 0.00 0.00 175.22 175.72 3bdm h ILE 70 N 5.98 1.33 -3.75 0.00 1.08 -1.39 -3.48 117.51 117.28 3bdm h ILE 70 Ca -0.26 -1.82 -0.20 0.00 -0.39 0.00 0.00 64.86 62.18 3bdm h ILE 70 Cb 1.09 2.04 -0.05 0.00 -3.07 0.00 0.00 36.82 36.84 3bdm h ILE 70 CO 0.96 0.56 -0.02 -0.94 -0.69 0.00 0.00 178.15 178.01 3bdm s SER 71 N -6.79 0.69 0.41 1.72 1.04 -0.93 -4.61 113.70 105.22 3bdm s SER 71 Ca -0.12 -1.42 0.18 0.00 0.48 0.00 0.00 55.95 55.07 3bdm s SER 71 Cb 0.07 0.74 1.08 0.00 0.10 0.00 0.00 66.02 68.02 3bdm s SER 71 CO 0.85 -1.46 1.83 -0.09 0.98 0.00 0.00 173.24 175.35 3bdm h ARG 72 N 2.05 0.40 0.00 4.02 9.65 -1.94 -3.03 114.38 125.53 3bdm h ARG 72 Ca -0.30 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.56 3bdm h ARG 72 Cb 1.24 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.73 3bdm h ARG 72 CO 0.40 0.27 -0.58 0.25 2.80 0.00 0.00 179.97 183.10 3bdm n THR 73 N -4.53 0.00 -4.44 0.20 -2.24 -1.26 -1.76 114.28 100.24 3bdm n THR 73 Ca 0.21 -0.29 -0.34 0.00 -2.27 0.00 0.00 64.05 61.36 3bdm n THR 73 Cb 0.74 0.84 -0.13 0.00 -2.10 0.00 0.00 70.33 69.68 3bdm n THR 73 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3bdm s ILE 74 N -1.87 3.65 0.12 2.28 1.01 -1.15 -4.42 121.20 120.82 3bdm s ILE 74 Ca 0.01 -0.44 0.10 0.00 0.00 0.00 0.00 60.65 60.33 3bdm s ILE 74 Cb 0.05 -2.59 -0.04 0.00 0.01 0.00 0.00 42.46 39.89 3bdm s ILE 74 CO 0.29 0.49 -0.23 -0.83 0.00 0.00 0.00 174.94 174.66 3bdm s GLY 75 N 0.47 1.62 -0.02 6.18 0.00 -0.71 -0.95 107.32 113.91 3bdm s GLY 75 Ca -0.05 -1.41 0.02 0.00 0.00 0.00 0.00 44.72 43.27 3bdm s GLY 75 CO 0.03 -1.39 -0.05 -0.29 0.00 0.00 0.00 173.10 171.40 3bdm s MET 76 N -2.06 0.66 -0.09 2.90 0.00 0.42 -1.16 119.30 119.98 3bdm s MET 76 Ca 0.15 -0.16 0.02 0.00 0.00 0.00 0.00 55.69 55.71 3bdm s MET 76 Cb -0.10 -0.67 -0.02 0.00 0.00 0.00 0.00 34.83 34.04 3bdm s MET 76 CO 0.07 0.02 -0.14 0.54 0.00 0.00 0.00 175.02 175.51 3bdm s VAL 77 N 0.41 2.99 -0.15 10.11 0.11 -0.24 0.98 120.40 134.61 3bdm s VAL 77 Ca -0.05 -0.71 -0.03 0.00 -2.93 0.00 0.00 61.98 58.26 3bdm s VAL 77 Cb -0.09 -2.21 -0.02 0.00 -1.53 0.00 0.00 36.38 32.53 3bdm s VAL 77 CO -0.00 0.56 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.57 3bdm s VAL 78 N -0.13 3.65 -0.48 2.04 1.01 0.13 -1.60 120.40 125.02 3bdm s VAL 78 Ca -0.01 -0.44 -0.09 0.00 0.00 0.00 0.00 61.98 61.43 3bdm s VAL 78 Cb -0.14 -2.58 0.12 0.00 0.00 0.00 0.00 36.38 33.78 3bdm s VAL 78 CO 0.04 0.50 0.36 0.20 0.00 0.00 0.00 175.10 176.19 3bdm s ASN 79 N 0.40 5.72 0.00 3.32 -0.87 -0.73 -4.85 114.94 117.93 3bdm s ASN 79 Ca -0.06 -1.96 0.00 0.00 -1.57 0.00 0.00 52.86 49.27 3bdm s ASN 79 Cb -0.15 -2.01 0.00 0.00 -0.02 0.00 0.00 41.25 39.07 3bdm s ASN 79 CO 0.04 -0.68 0.00 0.61 -2.57 0.00 0.00 177.10 174.49 3bdm n GLY 80 N 4.84 -0.14 3.43 0.66 0.00 -1.20 -1.94 105.19 110.86 3bdm n GLY 80 Ca -0.07 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.31 3bdm n GLY 80 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3bdm n PRO 81 N -1.03 0.09 0.09 1.61 -0.02 -1.24 -4.78 135.00 129.72 3bdm n PRO 81 Ca 0.00 0.07 -0.19 0.00 -2.02 0.00 0.00 63.50 61.37 3bdm n PRO 81 Cb 0.00 -1.80 -0.11 0.00 -0.02 0.00 0.00 33.50 31.56 3bdm n PRO 81 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 3bdm h ILE 82 N -0.79 1.36 -0.68 4.25 6.09 -1.98 -2.30 117.51 123.47 3bdm h ILE 82 Ca -0.45 -2.60 -0.01 0.00 -1.37 0.00 0.00 64.86 60.43 3bdm h ILE 82 Cb 1.33 2.69 -0.03 0.00 0.47 0.00 0.00 36.82 41.28 3bdm h ILE 82 CO 0.39 0.78 0.37 1.55 -3.07 0.00 0.00 178.15 178.17 3bdm h PRO 83 N 0.22 0.94 0.00 2.19 0.13 -2.00 0.10 132.00 133.58 3bdm h PRO 83 Ca -0.15 -0.10 -0.12 0.00 -0.87 0.00 0.00 66.00 64.75 3bdm h PRO 83 Cb 1.86 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 32.78 3bdm h PRO 83 CO 0.22 0.69 -0.58 -0.44 -0.23 0.00 0.00 178.00 177.66 3bdm h ASP 84 N 0.95 0.00 -0.33 1.44 3.45 -1.94 -2.46 116.42 117.53 3bdm h ASP 84 Ca 0.24 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.68 3bdm h ASP 84 Cb 0.03 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.79 3bdm h ASP 84 CO -0.04 0.58 0.13 0.00 -1.57 0.00 0.00 179.24 178.34 3bdm h ALA 85 N 1.42 0.43 -0.17 3.45 0.00 -0.54 -1.69 119.26 122.17 3bdm h ALA 85 Ca -0.01 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 3bdm h ALA 85 Cb 1.12 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3bdm h ALA 85 CO 0.08 0.04 -0.51 0.00 0.00 0.00 0.00 179.25 178.86 3bdm h ARG 86 N 0.39 0.45 0.50 0.00 3.08 -0.82 -1.19 114.38 116.80 3bdm h ARG 86 Ca 0.11 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 3bdm h ARG 86 Cb 0.19 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3bdm h ARG 86 CO -0.01 0.85 -0.24 -0.97 -1.07 0.00 0.00 179.97 178.53 3bdm h ASN 87 N 0.36 -0.57 -0.65 7.04 -0.00 -1.30 -1.22 115.58 119.24 3bdm h ASN 87 Ca 0.01 0.00 0.09 0.00 -0.00 0.00 0.00 56.30 56.41 3bdm h ASN 87 Cb 1.01 0.15 -0.07 0.00 -0.00 0.00 0.00 38.32 39.41 3bdm h ASN 87 CO 0.09 -0.38 0.28 0.00 -0.00 0.00 0.00 177.43 177.41 3bdm h ALA 88 N -0.22 0.86 0.36 1.57 0.00 -1.22 -1.96 119.26 118.65 3bdm h ALA 88 Ca -0.07 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3bdm h ALA 88 Cb 0.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3bdm h ALA 88 CO 0.11 -0.14 -0.18 0.00 0.00 0.00 0.00 179.25 179.04 3bdm h ALA 89 N 1.42 -0.50 -0.20 0.00 0.00 -1.04 -1.72 119.26 117.23 3bdm h ALA 89 Ca 0.32 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.18 3bdm h ALA 89 Cb 0.38 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 3bdm h ALA 89 CO -0.29 -0.78 -0.23 1.25 0.00 0.00 0.00 179.25 179.20 3bdm h LEU 90 N -0.50 -0.71 -1.04 0.00 5.85 -0.91 -0.07 115.31 117.92 3bdm h LEU 90 Ca -0.05 0.13 0.15 0.00 0.84 0.00 0.00 57.88 58.95 3bdm h LEU 90 Cb 0.39 0.33 -0.09 0.00 0.37 0.00 0.00 40.66 41.66 3bdm h LEU 90 CO 0.07 -0.27 0.62 -0.09 -0.34 0.00 0.00 178.44 178.43 3bdm h ARG 91 N -0.25 0.84 -0.48 1.25 9.65 -1.25 -1.12 114.38 123.02 3bdm h ARG 91 Ca 0.12 -0.05 -0.13 0.00 -1.10 0.00 0.00 59.98 58.82 3bdm h ARG 91 Cb 0.44 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 28.82 3bdm h ARG 91 CO -0.34 0.55 -0.21 0.00 2.80 0.00 0.00 179.97 182.77 3bdm h ALA 92 N 1.59 0.72 -0.44 2.80 0.00 -0.27 -0.79 119.26 122.87 3bdm h ALA 92 Ca 0.53 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3bdm h ALA 92 Cb 0.70 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 3bdm h ALA 92 CO -0.31 0.67 0.17 0.87 0.00 0.00 0.00 179.25 180.65 3bdm h LYS 93 N 0.84 0.66 0.22 0.00 1.57 0.10 -0.75 116.57 119.21 3bdm h LYS 93 Ca 0.11 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3bdm h LYS 93 Cb 0.78 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.99 3bdm h LYS 93 CO 0.07 0.62 -0.10 0.00 -0.57 0.00 0.00 179.45 179.46 3bdm h ALA 94 N 1.01 -0.29 -0.76 3.86 0.00 -1.21 -1.11 119.26 120.76 3bdm h ALA 94 Ca 0.14 -0.11 0.19 0.00 0.00 0.00 0.00 54.91 55.13 3bdm h ALA 94 Cb 0.21 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 3bdm h ALA 94 CO -0.01 -0.60 0.52 0.93 0.00 0.00 0.00 179.25 180.10 3bdm h GLU 95 N -0.43 0.18 0.18 0.00 4.39 -0.98 -0.62 114.58 117.31 3bdm h GLU 95 Ca -0.03 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 3bdm h GLU 95 Cb 0.33 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 3bdm h GLU 95 CO 0.05 0.12 -0.09 0.00 -1.16 0.00 0.00 179.01 177.93 3bdm h ALA 96 N 1.64 -0.24 0.12 3.43 0.00 -0.41 -2.03 119.26 121.77 3bdm h ALA 96 Ca 0.37 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3bdm h ALA 96 Cb 1.19 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 3bdm h ALA 96 CO -0.07 -0.42 -0.12 0.00 0.00 0.00 0.00 179.25 178.64 3bdm h ALA 97 N 0.01 -0.23 -0.75 0.00 0.00 -0.51 -2.53 119.26 115.25 3bdm h ALA 97 Ca -0.02 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.91 3bdm h ALA 97 Cb 0.48 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 3bdm h ALA 97 CO 0.04 -0.65 0.45 1.49 0.00 0.00 0.00 179.25 180.58 3bdm h GLU 98 N -0.26 0.80 -0.98 0.00 4.81 -1.22 -1.12 114.58 116.62 3bdm h GLU 98 Ca 0.00 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3bdm h GLU 98 Cb 0.25 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.40 3bdm h GLU 98 CO -0.03 0.53 0.65 0.35 -0.73 0.00 0.00 179.01 179.78 3bdm h PHE 99 N 0.83 1.22 0.17 0.92 3.04 -1.15 -0.34 116.94 121.63 3bdm h PHE 99 Ca 0.33 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.30 3bdm h PHE 99 Cb 0.15 -0.41 0.00 0.00 2.56 0.00 0.00 35.95 38.25 3bdm h PHE 99 CO -0.05 0.75 -0.08 -0.09 -2.02 0.00 0.00 178.31 176.82 3bdm h ARG 100 N 1.30 -0.22 -0.66 1.11 9.65 -0.94 -0.48 114.38 124.14 3bdm h ARG 100 Ca 0.37 0.01 0.11 0.00 -1.10 0.00 0.00 59.98 59.37 3bdm h ARG 100 Cb -0.11 0.05 -0.08 0.00 -1.39 0.00 0.00 29.97 28.44 3bdm h ARG 100 CO -0.09 0.01 0.25 -0.92 2.80 0.00 0.00 179.97 182.02 3bdm h TYR 101 N -0.43 0.43 0.16 2.20 3.20 -0.88 0.19 116.97 121.84 3bdm h TYR 101 Ca -0.02 0.03 -0.31 0.00 3.14 0.00 0.00 58.73 61.57 3bdm h TYR 101 Cb 0.33 -0.09 0.03 0.00 1.54 0.00 0.00 36.73 38.54 3bdm h TYR 101 CO -0.01 0.09 -1.31 0.87 -1.64 0.00 0.00 178.16 176.16 3bdm h LYS 102 N 0.42 0.60 -0.01 1.82 1.57 -1.00 -3.38 116.57 116.59 3bdm h LYS 102 Ca 0.34 -0.86 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 3bdm h LYS 102 Cb 0.46 0.29 0.00 0.00 0.08 0.00 0.00 32.23 33.06 3bdm h LYS 102 CO -0.34 1.40 -0.33 0.66 -0.57 0.00 0.00 179.45 180.27 3bdm n TYR 103 N -3.77 0.00 -1.16 -1.35 4.01 -0.20 -5.01 117.16 109.68 3bdm n TYR 103 Ca -0.15 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.54 3bdm n TYR 103 Cb 1.02 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 40.03 3bdm n TYR 103 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3bdm n GLY 104 N 1.19 0.80 3.49 2.72 0.00 0.64 -5.01 105.19 109.02 3bdm n GLY 104 Ca 0.07 -0.70 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 3bdm n GLY 104 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3bdm s TYR 105 N -2.18 -0.61 0.25 1.61 -0.85 -1.25 -5.07 117.35 109.25 3bdm s TYR 105 Ca 0.00 0.95 -0.31 0.00 -0.52 0.00 0.00 57.07 57.19 3bdm s TYR 105 Cb 0.00 0.42 -0.12 0.00 0.38 0.00 0.00 41.96 42.64 3bdm s TYR 105 CO 0.00 -0.64 1.67 -0.51 -1.52 0.00 0.00 175.55 174.55 3bdm s ASP 106 N -1.46 6.37 0.23 -0.18 -0.00 -1.26 -4.16 116.67 116.20 3bdm s ASP 106 Ca -0.09 2.92 -0.31 0.00 -0.00 0.00 0.00 52.55 55.06 3bdm s ASP 106 Cb -0.00 -2.62 -0.12 0.00 -0.00 0.00 0.00 42.92 40.18 3bdm s ASP 106 CO 0.06 -0.95 1.69 -0.32 -0.00 0.00 0.00 175.17 175.64 3bdm s MET 107 N 0.39 4.13 0.18 8.23 -2.45 -1.26 -4.95 119.30 123.56 3bdm s MET 107 Ca 0.70 2.59 -0.30 0.00 -1.25 0.00 0.00 55.69 57.43 3bdm s MET 107 Cb -0.49 -3.07 -0.07 0.00 1.25 0.00 0.00 34.83 32.45 3bdm s MET 107 CO 0.40 -0.72 1.00 -2.14 1.05 0.00 0.00 175.02 174.61 3bdm s PRO 108 N 0.79 4.71 0.27 4.11 0.02 -1.26 -4.89 135.00 138.76 3bdm s PRO 108 Ca 0.72 1.56 -0.02 0.00 0.02 0.00 0.00 61.00 63.28 3bdm s PRO 108 Cb -0.49 -3.31 0.59 0.00 0.02 0.00 0.00 34.50 31.31 3bdm s PRO 108 CO 0.36 0.26 1.44 0.00 -0.33 0.00 0.00 177.00 178.73 3bdm h ASP 110 N 0.00 0.63 -0.13 0.00 -0.00 -1.96 -2.02 116.42 112.95 3bdm h ASP 110 Ca 0.51 -0.15 0.00 0.00 -0.00 0.00 0.00 57.03 57.39 3bdm h ASP 110 Cb 0.96 -0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 40.12 3bdm h ASP 110 CO -0.90 0.61 0.08 0.58 -0.00 0.00 0.00 179.24 179.61 3bdm h VAL 111 N 0.62 1.05 -0.87 4.15 2.07 -0.98 0.86 116.25 123.15 3bdm h VAL 111 Ca 0.16 -0.12 0.10 0.00 0.82 0.00 0.00 66.70 67.65 3bdm h VAL 111 Cb 0.15 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 30.77 3bdm h VAL 111 CO -0.02 0.05 0.56 0.25 0.02 0.00 0.00 177.57 178.43 3bdm h LEU 112 N 0.15 0.77 0.70 2.57 5.85 -1.11 0.15 115.31 124.39 3bdm h LEU 112 Ca 0.05 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 3bdm h LEU 112 Cb 0.01 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 40.91 3bdm h LEU 112 CO -0.01 0.46 -0.34 0.00 -0.34 0.00 0.00 178.44 178.21 3bdm h ALA 113 N 1.56 -0.94 -1.01 1.25 0.00 -0.57 -1.03 119.26 118.52 3bdm h ALA 113 Ca 0.40 -0.22 0.24 0.00 0.00 0.00 0.00 54.91 55.34 3bdm h ALA 113 Cb 0.41 0.36 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 3bdm h ALA 113 CO -0.17 -0.94 0.64 -0.22 0.00 0.00 0.00 179.25 178.57 3bdm h LYS 114 N -1.11 0.47 -0.22 0.00 3.64 0.04 0.45 116.57 119.84 3bdm h LYS 114 Ca -0.10 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.19 3bdm h LYS 114 Cb 0.75 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 3bdm h LYS 114 CO 0.16 0.31 -0.12 -0.09 -2.27 0.00 0.00 179.45 177.44 3bdm h ARG 115 N 0.48 0.47 -0.09 1.90 9.65 -0.50 -1.27 114.38 125.03 3bdm h ARG 115 Ca 0.59 -0.21 -0.11 0.00 -1.10 0.00 0.00 59.98 59.15 3bdm h ARG 115 Cb 1.33 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.89 3bdm h ARG 115 CO -0.33 0.76 -0.42 0.52 2.80 0.00 0.00 179.97 183.30 3bdm h MET 116 N 0.18 0.20 -0.10 0.20 2.86 0.45 -1.58 114.93 117.14 3bdm h MET 116 Ca 0.05 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 3bdm h MET 116 Cb 0.62 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.28 3bdm h MET 116 CO 0.03 0.59 0.01 0.00 1.06 0.00 0.00 176.91 178.61 3bdm h ALA 117 N 1.40 0.14 -0.19 6.32 0.00 -0.11 -1.41 119.26 125.41 3bdm h ALA 117 Ca 0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3bdm h ALA 117 Cb 0.81 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3bdm h ALA 117 CO 0.06 -0.21 -0.01 -0.91 0.00 0.00 0.00 179.25 178.19 3bdm h ASN 118 N -0.07 0.25 -0.55 0.00 -0.26 -1.05 0.02 115.58 113.92 3bdm h ASN 118 Ca 0.03 -0.03 -0.10 0.00 -0.56 0.00 0.00 56.30 55.64 3bdm h ASN 118 Cb 0.30 -0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 37.47 3bdm h ASN 118 CO 0.00 0.31 -0.02 0.25 -1.06 0.00 0.00 177.43 176.91 3bdm h LEU 119 N 0.27 0.98 -0.30 1.61 5.85 -0.93 -2.53 115.31 120.26 3bdm h LEU 119 Ca 0.06 -0.28 -0.10 0.00 0.84 0.00 0.00 57.88 58.40 3bdm h LEU 119 Cb 0.20 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3bdm h LEU 119 CO 0.00 1.05 -0.21 0.28 -0.34 0.00 0.00 178.44 179.22 3bdm h SER 120 N 0.92 0.70 -0.99 1.25 0.02 -0.09 -2.84 113.55 112.51 3bdm h SER 120 Ca 0.16 -0.44 0.22 0.00 -0.84 0.00 0.00 61.79 60.89 3bdm h SER 120 Cb 0.56 -0.20 -0.10 0.00 0.14 0.00 0.00 62.40 62.81 3bdm h SER 120 CO 0.03 0.99 0.62 -0.61 -1.14 0.00 0.00 176.83 176.73 3bdm h GLN 121 N 0.42 0.56 -0.31 3.45 -0.00 -0.84 0.18 115.11 118.55 3bdm h GLN 121 Ca 0.06 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.65 58.67 3bdm h GLN 121 Cb 0.76 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 28.10 3bdm h GLN 121 CO 0.06 0.37 0.17 0.82 0.00 0.00 0.00 178.83 180.25 3bdm h ILE 122 N 0.57 1.13 0.00 2.39 2.04 -1.21 -1.65 117.51 120.79 3bdm h ILE 122 Ca 0.57 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 66.09 3bdm h ILE 122 Cb 1.15 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 3bdm h ILE 122 CO -0.32 0.13 0.00 1.88 0.00 0.00 0.00 178.15 179.84 3bdm h TYR 123 N 0.39 0.00 0.00 1.37 0.05 -0.97 0.24 116.97 118.05 3bdm h TYR 123 Ca 0.11 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.72 3bdm h TYR 123 Cb 0.06 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.77 3bdm h TYR 123 CO -0.03 0.00 -0.82 1.15 -1.05 0.00 0.00 178.16 177.41 3bdm h THR 124 N 0.00 1.52 0.00 -2.88 2.02 -0.84 -3.37 112.91 109.36 3bdm h THR 124 Ca 0.00 -2.89 -0.28 0.00 0.77 0.00 0.00 66.41 64.02 3bdm h THR 124 Cb 0.10 2.58 -0.05 0.00 -1.74 0.00 0.00 68.15 69.04 3bdm h THR 124 CO 0.00 0.81 -2.06 1.67 0.37 0.00 0.00 175.52 176.30 3bdm n GLN 125 N -3.46 1.43 -3.23 6.66 7.27 0.15 -4.75 117.38 121.44 3bdm n GLN 125 Ca -0.00 -0.01 -0.39 0.00 0.07 0.00 0.00 57.00 56.67 3bdm n GLN 125 Cb 0.82 -1.40 -0.06 0.00 2.41 0.00 0.00 30.24 32.01 3bdm n GLN 125 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 3bdm s ARG 126 N -2.40 4.30 0.31 3.69 0.52 0.61 -4.98 118.95 121.00 3bdm s ARG 126 Ca -0.08 0.53 0.01 0.00 -0.52 0.00 0.00 55.73 55.67 3bdm s ARG 126 Cb 0.05 -3.49 0.49 0.00 0.52 0.00 0.00 34.95 32.52 3bdm s ARG 126 CO 0.64 0.02 1.87 0.00 0.02 0.00 0.00 175.30 177.85 3bdm h ALA 127 N 7.01 1.31 0.00 2.13 0.00 -1.87 -3.08 119.26 124.76 3bdm h ALA 127 Ca -0.38 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3bdm h ALA 127 Cb 1.17 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3bdm h ALA 127 CO 0.75 0.50 0.00 2.48 0.00 0.00 0.00 179.25 182.98 3bdm n TYR 128 N -4.31 0.29 -3.64 0.00 0.18 -1.26 -4.61 117.16 103.82 3bdm n TYR 128 Ca 0.04 0.09 -0.36 0.00 1.88 0.00 0.00 57.90 59.54 3bdm n TYR 128 Cb 0.19 -0.64 -0.09 0.00 -0.38 0.00 0.00 39.34 38.42 3bdm n TYR 128 CO 0.00 0.00 0.00 -1.64 -2.08 0.00 0.00 176.86 173.14 3bdm s MET 129 N -3.03 4.10 0.22 -3.48 -1.94 -1.16 -5.09 119.30 108.91 3bdm s MET 129 Ca 0.13 -0.21 -0.09 0.00 -1.71 0.00 0.00 55.69 53.81 3bdm s MET 129 Cb 0.17 -3.52 -0.07 0.00 2.01 0.00 0.00 34.83 33.42 3bdm s MET 129 CO 0.55 0.09 0.52 -0.98 -0.01 0.00 0.00 175.02 175.18 3bdm s ARG 130 N 0.98 3.76 1.10 2.03 1.70 -1.26 -4.70 118.95 122.56 3bdm s ARG 130 Ca 0.09 0.20 -0.16 0.00 -0.47 0.00 0.00 55.73 55.39 3bdm s ARG 130 Cb -0.13 -2.68 0.24 0.00 -0.57 0.00 0.00 34.95 31.80 3bdm s ARG 130 CO 0.04 0.34 1.11 -2.14 -1.08 0.00 0.00 175.30 173.57 3bdm s PRO 131 N -2.81 -0.38 -0.20 3.89 0.02 -1.26 -4.91 135.00 129.34 3bdm s PRO 131 Ca 0.46 0.19 -0.08 0.00 0.02 0.00 0.00 61.00 61.60 3bdm s PRO 131 Cb -0.11 -1.67 -0.04 0.00 0.02 0.00 0.00 34.50 32.70 3bdm s PRO 131 CO 0.22 -3.21 0.08 -0.51 -0.33 0.00 0.00 177.00 173.25 3bdm s LEU 132 N -6.68 3.80 -0.92 -5.54 1.43 -1.26 -5.00 118.68 104.52 3bdm s LEU 132 Ca 0.68 0.04 -0.10 0.00 -1.03 0.00 0.00 54.13 53.72 3bdm s LEU 132 Cb -0.14 -1.98 -0.08 0.00 0.03 0.00 0.00 46.19 44.03 3bdm s LEU 132 CO 0.57 0.13 2.09 0.61 0.23 0.00 0.00 176.35 179.98 3bdm n GLY 133 N 3.85 3.06 3.40 -3.19 0.00 -1.26 -4.53 105.19 106.52 3bdm n GLY 133 Ca -0.16 -1.00 -0.16 0.00 0.00 0.00 0.00 46.02 44.70 3bdm n GLY 133 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3bdm s VAL 134 N 3.77 0.02 -0.09 1.61 -7.23 -1.26 -3.71 120.40 113.51 3bdm s VAL 134 Ca 0.45 -0.21 0.02 0.00 -1.81 0.00 0.00 61.98 60.43 3bdm s VAL 134 Cb 0.12 -0.87 -0.02 0.00 0.56 0.00 0.00 36.38 36.17 3bdm s VAL 134 CO 0.00 -0.11 -0.15 -0.63 -0.31 0.00 0.00 175.10 173.90 3bdm s ILE 135 N -1.48 2.94 -0.17 -0.62 1.01 -0.82 -3.87 121.20 118.20 3bdm s ILE 135 Ca -0.11 -0.73 -0.02 0.00 0.00 0.00 0.00 60.65 59.79 3bdm s ILE 135 Cb -0.02 -2.19 -0.02 0.00 0.01 0.00 0.00 42.46 40.25 3bdm s ILE 135 CO 0.06 0.55 -0.08 -0.76 0.00 0.00 0.00 174.94 174.71 3bdm s LEU 136 N -0.09 2.90 -0.29 2.97 1.43 0.11 -1.77 118.68 123.93 3bdm s LEU 136 Ca -0.02 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 52.73 3bdm s LEU 136 Cb -0.14 -1.69 0.03 0.00 0.03 0.00 0.00 46.19 44.41 3bdm s LEU 136 CO 0.04 0.11 0.03 -0.89 0.23 0.00 0.00 176.35 175.86 3bdm s THR 137 N 0.72 3.45 -0.05 5.49 2.01 -0.62 -0.01 115.64 126.62 3bdm s THR 137 Ca -0.04 -0.98 -0.03 0.00 0.31 0.00 0.00 61.69 60.95 3bdm s THR 137 Cb -0.15 -2.83 -0.04 0.00 0.01 0.00 0.00 72.50 69.49 3bdm s THR 137 CO 0.02 0.04 0.11 -0.36 -0.69 0.00 0.00 174.62 173.74 3bdm s PHE 138 N 1.39 3.41 0.03 4.92 0.40 0.22 -1.08 117.98 127.27 3bdm s PHE 138 Ca -0.00 0.33 -0.06 0.00 -0.60 0.00 0.00 56.93 56.60 3bdm s PHE 138 Cb -0.18 -1.83 -0.01 0.00 0.51 0.00 0.00 43.02 41.52 3bdm s PHE 138 CO -0.00 0.61 0.12 0.14 0.70 0.00 0.00 175.22 176.79 3bdm s VAL 139 N -1.12 0.12 -0.03 -0.44 -7.23 -0.31 -1.18 120.40 110.21 3bdm s VAL 139 Ca 0.20 -0.95 0.00 0.00 -1.81 0.00 0.00 61.98 59.42 3bdm s VAL 139 Cb -0.12 -0.75 0.00 0.00 0.56 0.00 0.00 36.38 36.07 3bdm s VAL 139 CO 0.10 -0.52 0.00 -1.54 -0.31 0.00 0.00 175.10 172.82 3bdm n SER 140 N 0.97 0.00 -3.81 4.85 3.41 -1.05 -1.74 113.62 116.26 3bdm n SER 140 Ca -0.20 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.13 3bdm n SER 140 Cb 0.58 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.41 3bdm n SER 140 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3bdm s VAL 141 N -2.35 2.41 0.26 -3.33 1.01 -1.26 -0.15 120.40 117.00 3bdm s VAL 141 Ca 0.00 -3.96 -0.29 0.00 0.00 0.00 0.00 61.98 57.72 3bdm s VAL 141 Cb 0.00 -2.59 -0.14 0.00 0.00 0.00 0.00 36.38 33.64 3bdm s VAL 141 CO 0.00 -1.05 1.06 -0.67 0.00 0.00 0.00 175.10 174.44 3bdm n ASP 142 N 2.15 1.34 0.14 3.32 2.03 -0.69 -4.68 116.55 120.16 3bdm n ASP 142 Ca 0.21 1.17 0.11 0.00 0.52 0.00 0.00 54.79 56.80 3bdm n ASP 142 Cb 0.37 -1.27 0.52 0.00 -0.72 0.00 0.00 41.12 40.02 3bdm n ASP 142 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 3bdm n GLU 143 N 1.03 0.17 -0.03 -0.67 0.28 -1.26 -1.06 120.64 119.09 3bdm n GLU 143 Ca 0.11 0.52 -0.04 0.00 -0.16 0.00 0.00 57.16 57.59 3bdm n GLU 143 Cb 0.30 -1.90 -0.04 0.00 1.43 0.00 0.00 31.44 31.23 3bdm n GLU 143 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3bdm n GLU 14 N -2.23 1.31 -0.00 3.44 1.02 -1.26 -4.82 120.64 118.09 3bdm n GLU 14 Ca 0.01 0.02 0.05 0.00 -0.02 0.00 0.00 57.16 57.22 3bdm n GLU 14 Cb 0.14 -1.14 -0.13 0.00 -0.02 0.00 0.00 31.44 30.29 3bdm n GLU 14 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3bdm n LEU 144 N -2.52 0.27 0.00 -4.62 4.77 -1.20 -5.11 117.00 108.60 3bdm n LEU 144 Ca -0.11 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3bdm n LEU 144 Cb 0.65 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 3bdm n LEU 144 CO 0.09 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 3bdm n GLY 145 N 1.37 -1.78 3.63 -0.72 0.00 -0.23 -4.86 105.19 102.59 3bdm n GLY 145 Ca -0.10 -1.65 -0.52 0.00 0.00 0.00 0.00 46.02 43.75 3bdm n GLY 145 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3bdm n PRO 146 N 0.00 1.30 -4.24 1.61 -0.02 -1.26 -1.70 135.00 130.69 3bdm n PRO 146 Ca 0.00 0.47 -0.17 0.00 -2.02 0.00 0.00 63.50 61.78 3bdm n PRO 146 Cb 0.00 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.19 3bdm n PRO 146 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3bdm s SER 147 N 1.27 0.87 -0.10 2.55 0.01 0.79 -4.90 113.70 114.18 3bdm s SER 147 Ca 0.87 -0.20 -0.01 0.00 1.31 0.00 0.00 55.95 57.92 3bdm s SER 147 Cb -0.94 -0.08 0.03 0.00 0.21 0.00 0.00 66.02 65.25 3bdm s SER 147 CO 0.50 0.05 -0.03 -0.63 0.41 0.00 0.00 173.24 173.53 3bdm s ILE 148 N -0.35 0.70 -0.05 1.44 1.01 -1.26 -2.52 121.20 120.18 3bdm s ILE 148 Ca 0.01 -0.14 0.02 0.00 0.00 0.00 0.00 60.65 60.54 3bdm s ILE 148 Cb -0.04 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.62 3bdm s ILE 148 CO -0.00 0.26 -0.09 -0.31 0.00 0.00 0.00 174.94 174.81 3bdm s TYR 149 N 1.83 1.09 0.01 3.97 2.02 -0.32 -0.75 117.35 125.20 3bdm s TYR 149 Ca 0.04 -0.35 0.06 0.00 -0.37 0.00 0.00 57.07 56.45 3bdm s TYR 149 Cb -0.13 -0.84 -0.02 0.00 -0.40 0.00 0.00 41.96 40.57 3bdm s TYR 149 CO -0.07 -0.21 -0.18 0.21 -1.57 0.00 0.00 175.55 173.73 3bdm s LYS 150 N 0.66 1.33 0.07 -0.62 2.20 -0.89 0.72 119.74 123.21 3bdm s LYS 150 Ca -0.11 -0.75 0.06 0.00 -0.36 0.00 0.00 55.97 54.81 3bdm s LYS 150 Cb -0.14 -1.35 -0.03 0.00 -1.51 0.00 0.00 37.83 34.80 3bdm s LYS 150 CO 0.02 0.36 -0.17 0.95 -0.36 0.00 0.00 175.35 176.15 3bdm s THR 151 N -0.60 1.32 0.46 3.43 -4.23 0.98 -2.71 115.64 114.29 3bdm s THR 151 Ca 0.06 -1.29 0.03 0.00 -1.18 0.00 0.00 61.69 59.31 3bdm s THR 151 Cb -0.08 -1.22 -0.03 0.00 1.34 0.00 0.00 72.50 72.51 3bdm s THR 151 CO 0.00 -0.09 0.03 1.51 -0.54 0.00 0.00 174.62 175.53 3bdm s ASP 152 N -1.60 3.75 0.00 3.99 1.47 -0.89 0.05 116.67 123.44 3bdm s ASP 152 Ca 0.02 -1.58 0.05 0.00 1.18 0.00 0.00 52.55 52.22 3bdm s ASP 152 Cb -0.09 0.27 0.21 0.00 -0.34 0.00 0.00 42.92 42.97 3bdm s ASP 152 CO 0.03 -0.76 1.15 -2.65 0.68 0.00 0.00 175.17 173.62 3bdm n PRO 153 N -1.10 0.00 0.07 2.11 -0.02 -1.25 -1.76 135.00 133.04 3bdm n PRO 153 Ca -0.13 0.41 0.13 0.00 -2.02 0.00 0.00 63.50 61.89 3bdm n PRO 153 Cb 0.67 -1.50 0.31 0.00 -0.02 0.00 0.00 33.50 32.96 3bdm n PRO 153 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bdm n ALA 154 N -1.50 2.64 -0.35 3.55 0.00 -1.26 -4.79 120.51 118.81 3bdm n ALA 154 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.31 3bdm n ALA 154 Cb 0.06 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3bdm n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bdm n GLY 155 N 1.35 0.81 3.88 0.00 0.00 -0.72 -4.54 105.19 105.97 3bdm n GLY 155 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 3bdm n GLY 155 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3bdm s TYR 156 N -2.10 3.45 -0.00 1.61 6.14 -1.26 -4.58 117.35 120.60 3bdm s TYR 156 Ca 0.00 0.82 -0.28 0.00 0.64 0.00 0.00 57.07 58.25 3bdm s TYR 156 Cb 0.00 -2.23 0.09 0.00 0.42 0.00 0.00 41.96 40.24 3bdm s TYR 156 CO 0.00 0.20 0.79 1.52 0.64 0.00 0.00 175.55 178.69 3bdm s TYR 157 N -1.96 -0.47 0.11 4.97 1.13 -1.26 -2.10 117.35 117.76 3bdm s TYR 157 Ca 0.47 0.53 -0.26 0.00 -1.41 0.00 0.00 57.07 56.40 3bdm s TYR 157 Cb -0.11 0.50 0.07 0.00 -1.10 0.00 0.00 41.96 41.32 3bdm s TYR 157 CO 0.25 -0.60 0.88 0.54 -2.51 0.00 0.00 175.55 174.11 3bdm s VAL 158 N -2.46 0.00 0.30 -3.49 0.11 -1.10 -4.99 120.40 108.77 3bdm s VAL 158 Ca -0.01 -0.38 -0.04 0.00 -2.93 0.00 0.00 61.98 58.62 3bdm s VAL 158 Cb -0.01 -1.54 -0.05 0.00 -1.53 0.00 0.00 36.38 33.26 3bdm s VAL 158 CO -0.04 0.00 0.55 -0.83 -3.33 0.00 0.00 175.10 171.45 3bdm s GLY 159 N -2.75 1.77 0.11 6.54 0.00 -1.26 -2.10 107.32 109.63 3bdm s GLY 159 Ca 0.08 -0.62 0.02 0.00 0.00 0.00 0.00 44.72 44.21 3bdm s GLY 159 CO -0.03 -0.52 -0.07 -0.19 0.00 0.00 0.00 173.10 172.28 3bdm s TYR 160 N -2.12 1.01 0.11 1.90 1.51 0.07 -4.98 117.35 114.85 3bdm s TYR 160 Ca 0.43 -0.88 0.01 0.00 -1.01 0.00 0.00 57.07 55.63 3bdm s TYR 160 Cb -0.11 -0.56 -0.20 0.00 -0.11 0.00 0.00 41.96 40.98 3bdm s TYR 160 CO 0.31 -0.09 1.24 0.87 -1.11 0.00 0.00 175.55 176.77 3bdm h LYS 161 N 2.90 0.16 -1.83 -0.62 1.57 -1.89 -3.38 116.57 113.48 3bdm h LYS 161 Ca -0.36 -0.25 0.23 0.00 -1.87 0.00 0.00 60.65 58.40 3bdm h LYS 161 Cb 1.17 0.09 -0.14 0.00 0.08 0.00 0.00 32.23 33.43 3bdm h LYS 161 CO 0.64 1.09 0.68 0.00 -0.57 0.00 0.00 179.45 181.29 3bdm s ALA 162 N -2.78 -1.97 0.14 3.86 0.00 -1.26 -3.48 121.76 116.26 3bdm s ALA 162 Ca -0.02 0.90 -0.24 0.00 0.00 0.00 0.00 51.96 52.60 3bdm s ALA 162 Cb 0.09 0.30 0.07 0.00 0.00 0.00 0.00 23.12 23.57 3bdm s ALA 162 CO 0.85 -0.84 0.73 -0.08 0.00 0.00 0.00 175.76 176.42 3bdm s THR 163 N -2.76 0.00 0.04 0.00 -1.32 -0.40 -4.98 115.64 106.22 3bdm s THR 163 Ca 0.10 -0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.34 3bdm s THR 163 Cb 0.01 -1.29 -0.03 0.00 -1.51 0.00 0.00 72.50 69.68 3bdm s THR 163 CO -0.04 0.00 -0.04 0.00 -2.21 0.00 0.00 174.62 172.33 3bdm s ALA 164 N -3.57 0.40 -0.09 11.08 0.00 -1.26 -0.37 121.76 127.95 3bdm s ALA 164 Ca 0.05 -0.86 -0.11 0.00 0.00 0.00 0.00 51.96 51.04 3bdm s ALA 164 Cb -0.02 0.16 0.03 0.00 0.00 0.00 0.00 23.12 23.29 3bdm s ALA 164 CO -0.07 -0.19 0.30 0.99 0.00 0.00 0.00 175.76 176.79 3bdm s THR 165 N -2.29 0.02 -3.60 0.00 2.01 0.25 -4.93 115.64 107.10 3bdm s THR 165 Ca -0.06 -0.13 0.00 0.00 0.31 0.00 0.00 61.69 61.81 3bdm s THR 165 Cb -0.04 -0.46 0.00 0.00 0.01 0.00 0.00 72.50 72.01 3bdm s THR 165 CO -0.03 -0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.44 3bdm n GLY 166 N 2.53 0.85 0.23 4.40 0.00 -1.26 -0.56 105.19 111.38 3bdm n GLY 166 Ca -0.15 -2.03 -0.04 0.00 0.00 0.00 0.00 46.02 43.80 3bdm n GLY 166 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3bdm h PRO 167 N 7.77 0.57 -0.97 1.61 0.11 -1.89 -2.38 132.00 136.82 3bdm h PRO 167 Ca 0.00 -0.03 -0.53 0.00 0.11 0.00 0.00 66.00 65.55 3bdm h PRO 167 Cb 0.00 -0.13 -0.30 0.00 0.11 0.00 0.00 31.00 30.68 3bdm h PRO 167 CO 0.00 0.38 0.65 1.63 -0.21 0.00 0.00 178.00 180.45 3bdm n LYS 168 N -4.83 2.30 -0.19 1.05 5.02 -1.26 -4.65 118.16 115.60 3bdm n LYS 168 Ca 0.06 -3.07 -0.01 0.00 -2.02 0.00 0.00 58.31 53.27 3bdm n LYS 168 Cb 0.14 -2.18 0.08 0.00 -0.02 0.00 0.00 35.03 33.05 3bdm n LYS 168 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 3bdm h GLN 169 N 1.16 0.10 -0.63 1.97 -0.00 -1.72 -2.44 115.11 113.56 3bdm h GLN 169 Ca 0.61 -0.01 0.03 0.00 -0.00 0.00 0.00 58.65 59.29 3bdm h GLN 169 Cb 2.50 -0.02 -0.03 0.00 0.00 0.00 0.00 27.48 29.92 3bdm h GLN 169 CO 1.15 0.07 0.41 0.37 0.00 0.00 0.00 178.83 180.83 3bdm h GLN 170 N 0.11 0.71 -0.10 1.69 5.75 -1.85 -0.18 115.11 121.25 3bdm h GLN 170 Ca 0.29 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.72 3bdm h GLN 170 Cb 0.46 -0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.84 3bdm h GLN 170 CO -0.49 0.47 -0.04 0.93 -2.65 0.00 0.00 178.83 177.05 3bdm h GLU 171 N 0.74 0.20 -0.78 1.69 3.07 -1.81 -2.25 114.58 115.44 3bdm h GLU 171 Ca 0.25 -0.09 0.01 0.00 -0.50 0.00 0.00 59.36 59.03 3bdm h GLU 171 Cb 0.09 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 27.95 3bdm h GLU 171 CO -0.07 0.55 0.52 0.82 -1.40 0.00 0.00 179.01 179.43 3bdm h ILE 172 N -0.15 1.20 0.78 3.13 1.08 -1.29 -2.21 117.51 120.06 3bdm h ILE 172 Ca 0.02 -0.36 -0.04 0.00 -0.39 0.00 0.00 64.86 64.09 3bdm h ILE 172 Cb 0.49 0.05 0.01 0.00 -3.07 0.00 0.00 36.82 34.29 3bdm h ILE 172 CO 0.01 0.19 -0.38 0.74 -0.69 0.00 0.00 178.15 178.03 3bdm h THR 173 N 1.06 0.20 -0.69 -0.27 2.02 -0.98 -2.40 112.91 111.84 3bdm h THR 173 Ca 0.29 -0.06 0.12 0.00 0.77 0.00 0.00 66.41 67.53 3bdm h THR 173 Cb -0.12 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 66.46 3bdm h THR 173 CO -0.06 0.01 0.46 0.71 0.37 0.00 0.00 175.52 177.01 3bdm h THR 174 N -1.10 0.85 0.78 3.16 1.35 -1.37 0.22 112.91 116.79 3bdm h THR 174 Ca -0.11 -0.15 -0.04 0.00 -0.55 0.00 0.00 66.41 65.57 3bdm h THR 174 Cb 0.82 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 3bdm h THR 174 CO 0.18 0.08 -0.40 -1.13 -0.25 0.00 0.00 175.52 174.00 3bdm h ASN 175 N 0.43 -0.95 -0.65 5.36 -0.73 -1.17 -1.39 115.58 116.49 3bdm h ASN 175 Ca 0.33 0.04 -0.00 0.00 1.87 0.00 0.00 56.30 58.54 3bdm h ASN 175 Cb 0.69 0.26 -0.03 0.00 0.27 0.00 0.00 38.32 39.51 3bdm h ASN 175 CO -0.10 -0.66 0.40 -0.07 -0.37 0.00 0.00 177.43 176.63 3bdm h LEU 176 N -1.07 0.77 -0.70 0.34 3.38 -0.90 -1.80 115.31 115.31 3bdm h LEU 176 Ca -0.10 -0.05 0.16 0.00 0.09 0.00 0.00 57.88 57.97 3bdm h LEU 176 Cb 0.83 -0.19 -0.12 0.00 0.09 0.00 0.00 40.66 41.27 3bdm h LEU 176 CO 0.16 0.59 0.02 -0.33 0.09 0.00 0.00 178.44 178.98 3bdm h GLU 177 N 0.88 0.12 -0.35 1.13 5.08 -0.44 0.51 114.58 121.51 3bdm h GLU 177 Ca 0.23 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.53 3bdm h GLU 177 Cb -0.04 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3bdm h GLU 177 CO -0.04 0.08 -0.01 -0.91 -1.00 0.00 0.00 179.01 177.13 3bdm h ASN 178 N 0.13 0.61 -0.77 1.42 -0.26 -0.67 -3.03 115.58 113.01 3bdm h ASN 178 Ca 0.38 -0.31 0.08 0.00 -0.56 0.00 0.00 56.30 55.88 3bdm h ASN 178 Cb 0.65 -0.16 -0.06 0.00 -1.06 0.00 0.00 38.32 37.68 3bdm h ASN 178 CO -0.60 0.78 0.44 -0.74 -1.06 0.00 0.00 177.43 176.25 3bdm h HIS 179 N 0.43 0.80 0.00 1.19 2.76 -0.16 -1.20 115.15 118.97 3bdm h HIS 179 Ca 0.10 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.29 3bdm h HIS 179 Cb 0.47 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 29.18 3bdm h HIS 179 CO 0.04 0.36 -0.01 1.19 -1.30 0.00 0.00 177.93 178.21 3bdm n PHE 17 N -4.74 0.00 0.00 5.26 3.72 -0.09 -0.72 117.46 120.89 3bdm n PHE 17 Ca 0.11 -0.78 0.00 0.00 -0.05 0.00 0.00 57.45 56.73 3bdm n PHE 17 Cb 0.22 -0.49 0.00 0.00 -0.94 0.00 0.00 39.48 38.27 3bdm n PHE 17 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 3bdm n LYS 17 N 1.67 0.00 -0.07 -1.08 4.81 -0.45 -0.27 118.16 122.76 3bdm n LYS 17 Ca 0.02 0.00 0.26 0.00 -0.87 0.00 0.00 58.31 57.71 3bdm n LYS 17 Cb 0.40 0.00 0.71 0.00 0.02 0.00 0.00 35.03 36.16 3bdm n LYS 17 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3bdm h SER 17 N 0.00 0.00 0.00 3.14 4.64 -1.19 -3.45 113.55 116.69 3bdm h SER 17 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3bdm h SER 17 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3bdm h SER 17 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 3bdm n LYS 17 N -3.92 -0.09 -4.41 4.77 5.02 0.63 -4.98 118.16 115.18 3bdm n LYS 17 Ca 0.15 0.02 -0.26 0.00 -2.02 0.00 0.00 58.31 56.20 3bdm n LYS 17 Cb 0.89 -3.46 -0.10 0.00 -0.02 0.00 0.00 35.03 32.33 3bdm n LYS 17 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3bdm s ILE 18 N -2.52 2.63 -1.41 -0.18 -5.25 -1.26 -5.05 121.20 108.16 3bdm s ILE 18 Ca 0.00 -2.09 0.04 0.00 -0.99 0.00 0.00 60.65 57.62 3bdm s ILE 18 Cb 0.00 -2.32 0.18 0.00 2.95 0.00 0.00 42.46 43.27 3bdm s ILE 18 CO 0.00 -0.23 0.97 -0.90 -1.79 0.00 0.00 174.94 172.99 3bdm n ASP 18 N -0.17 1.56 -2.45 4.36 5.75 -1.26 -4.83 116.55 119.51 3bdm n ASP 18 Ca -0.09 -2.11 -0.09 0.00 -0.01 0.00 0.00 54.79 52.49 3bdm n ASP 18 Cb 0.57 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 3bdm n ASP 18 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3bdm n HIS 18 N 0.09 -1.72 -3.20 2.11 1.44 -1.26 -4.76 115.22 107.92 3bdm n HIS 18 Ca 0.06 -1.60 -0.45 0.00 -2.01 0.00 0.00 57.72 53.72 3bdm n HIS 18 Cb 0.32 0.60 -0.05 0.00 0.12 0.00 0.00 29.99 30.98 3bdm n HIS 18 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3bdm s ILE 18 N -2.48 5.03 -0.23 0.61 -1.09 0.12 -5.01 121.20 118.15 3bdm s ILE 18 Ca 0.17 -1.31 -0.29 0.00 -2.23 0.00 0.00 60.65 56.98 3bdm s ILE 18 Cb -0.03 -4.43 -0.06 0.00 -1.58 0.00 0.00 42.46 36.36 3bdm s ILE 18 CO 0.12 -1.02 2.21 -3.20 -1.23 0.00 0.00 174.94 171.82 3bdm n ASN 184 N 5.74 3.13 0.03 3.58 4.05 -1.26 -3.46 115.26 127.07 3bdm n ASN 184 Ca -0.09 0.27 0.00 0.00 0.45 0.00 0.00 54.58 55.21 3bdm n ASN 184 Cb 0.42 -1.51 0.00 0.00 1.23 0.00 0.00 39.78 39.92 3bdm n ASN 184 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 3bdm n GLU 18 N 8.60 0.00 -2.85 1.20 4.71 -1.26 -4.99 120.64 126.04 3bdm n GLU 18 Ca 0.31 0.00 -0.33 0.00 -0.01 0.00 0.00 57.16 57.13 3bdm n GLU 18 Cb 0.41 -0.31 -0.07 0.00 -1.01 0.00 0.00 31.44 30.46 3bdm n GLU 18 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3bdm s SER 18 N -5.24 6.96 0.20 1.62 1.04 -1.26 -4.77 113.70 112.25 3bdm s SER 18 Ca 0.00 1.66 0.04 0.00 0.48 0.00 0.00 55.95 58.13 3bdm s SER 18 Cb 0.00 -2.53 0.12 0.00 0.10 0.00 0.00 66.02 63.72 3bdm s SER 18 CO 0.00 -0.32 1.47 4.11 0.98 0.00 0.00 173.24 179.48 3bdm h TRP 186 N 2.06 0.29 -1.00 5.02 5.08 -1.99 -3.20 115.95 122.20 3bdm h TRP 186 Ca -0.49 -0.13 0.13 0.00 1.08 0.00 0.00 58.89 59.48 3bdm h TRP 186 Cb 1.18 -0.04 -0.09 0.00 -3.00 0.00 0.00 29.16 27.21 3bdm h TRP 186 CO 0.62 0.87 0.63 0.93 -1.28 0.00 0.00 178.44 180.21 3bdm h GLU 187 N 0.14 0.93 -0.10 0.12 3.07 -1.99 0.31 114.58 117.07 3bdm h GLU 187 Ca -0.02 -0.06 -0.11 0.00 -0.50 0.00 0.00 59.36 58.66 3bdm h GLU 187 Cb 1.31 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 28.99 3bdm h GLU 187 CO 0.11 0.62 -0.45 0.87 -1.40 0.00 0.00 179.01 178.76 3bdm h LYS 188 N 0.96 0.23 -0.01 2.33 1.79 -1.97 -1.03 116.57 118.87 3bdm h LYS 188 Ca 0.51 -0.12 -0.18 0.00 -2.18 0.00 0.00 60.65 58.68 3bdm h LYS 188 Cb 0.55 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.19 3bdm h LYS 188 CO -0.28 0.64 -0.80 0.28 -1.08 0.00 0.00 179.45 178.21 3bdm h VAL 189 N 0.19 1.47 -0.54 0.50 2.07 -0.96 -0.89 116.25 118.09 3bdm h VAL 189 Ca 0.01 -2.46 -0.08 0.00 0.82 0.00 0.00 66.70 64.99 3bdm h VAL 189 Cb 0.88 2.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.97 3bdm h VAL 189 CO 0.07 0.72 0.04 0.58 0.02 0.00 0.00 177.57 179.00 3bdm h VAL 190 N 0.11 1.26 -0.68 2.57 2.07 -0.19 -1.24 116.25 120.15 3bdm h VAL 190 Ca -0.03 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.39 3bdm h VAL 190 Cb 1.39 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 3bdm h VAL 190 CO 0.12 0.37 0.22 -0.33 0.02 0.00 0.00 177.57 177.98 3bdm h GLU 191 N 0.81 1.05 -0.14 1.57 5.08 -0.97 -0.73 114.58 121.25 3bdm h GLU 191 Ca 0.16 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3bdm h GLU 191 Cb 0.48 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 3bdm h GLU 191 CO 0.02 0.90 0.07 0.35 -1.00 0.00 0.00 179.01 179.36 3bdm h PHE 192 N 0.99 0.20 0.03 4.33 3.04 -0.94 -0.29 116.94 124.30 3bdm h PHE 192 Ca 0.22 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 62.19 3bdm h PHE 192 Cb 0.29 -0.06 -0.05 0.00 2.56 0.00 0.00 35.95 38.69 3bdm h PHE 192 CO 0.02 0.23 -0.30 0.00 -2.02 0.00 0.00 178.31 176.24 3bdm h ALA 193 N 0.95 -0.45 -0.93 2.41 0.00 -0.95 -1.30 119.26 118.99 3bdm h ALA 193 Ca 0.05 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3bdm h ALA 193 Cb 0.10 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 3bdm h ALA 193 CO -0.01 -0.82 0.61 0.82 0.00 0.00 0.00 179.25 179.86 3bdm h ILE 194 N -0.47 1.18 0.53 0.00 2.04 -1.01 -2.12 117.51 117.66 3bdm h ILE 194 Ca 0.05 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 3bdm h ILE 194 Cb 0.54 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 3bdm h ILE 194 CO -0.23 0.22 -0.27 0.74 0.00 0.00 0.00 178.15 178.60 3bdm h THR 195 N 1.19 0.00 -0.19 -0.27 2.02 -0.43 -2.03 112.91 113.19 3bdm h THR 195 Ca 0.36 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.60 3bdm h THR 195 Cb -0.03 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.38 3bdm h THR 195 CO -0.10 0.00 0.23 0.45 0.37 0.00 0.00 175.52 176.47 3bdm h HIS 196 N -0.73 0.00 -0.03 3.16 3.86 -1.21 0.20 115.15 120.40 3bdm h HIS 196 Ca -0.07 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.14 3bdm h HIS 196 Cb 0.57 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.04 3bdm h HIS 196 CO 0.07 0.00 0.01 1.98 0.86 0.00 0.00 177.93 180.85 3bdm h MET 197 N 0.00 0.04 -0.28 2.45 -1.53 -1.12 -0.59 114.93 113.90 3bdm h MET 197 Ca 0.09 -0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.35 3bdm h MET 197 Cb 0.55 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 31.58 3bdm h MET 197 CO -0.00 0.21 0.18 0.82 0.14 0.00 0.00 176.91 178.27 3bdm h ILE 198 N -0.14 1.07 -0.54 1.77 2.04 0.07 0.23 117.51 122.01 3bdm h ILE 198 Ca 0.01 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 3bdm h ILE 198 Cb 0.19 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3bdm h ILE 198 CO -0.00 0.07 0.31 0.44 0.00 0.00 0.00 178.15 178.97 3bdm h ASP 199 N 0.38 0.66 -0.07 1.72 3.45 -1.02 0.94 116.42 122.47 3bdm h ASP 199 Ca 0.10 -0.08 -0.08 0.00 0.43 0.00 0.00 57.03 57.41 3bdm h ASP 199 Cb -0.04 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.56 3bdm h ASP 199 CO -0.02 0.54 -0.26 0.00 -1.57 0.00 0.00 179.24 177.93 3bdm h ALA 200 N 1.14 0.13 0.00 3.45 0.00 -0.97 -3.19 119.26 119.82 3bdm h ALA 200 Ca 0.19 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3bdm h ALA 200 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3bdm h ALA 200 CO -0.03 0.13 0.00 -0.07 0.00 0.00 0.00 179.25 179.28 3bdm h LEU 201 N -0.20 0.00 -2.01 0.00 3.38 -0.94 -3.45 115.31 112.10 3bdm h LEU 201 Ca -0.01 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.70 3bdm h LEU 201 Cb 0.90 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.80 3bdm h LEU 201 CO 0.05 0.00 -0.68 0.61 0.09 0.00 0.00 178.44 178.52 3bdm n GLY 202 N 1.21 -0.46 3.20 0.83 0.00 0.32 -5.03 105.19 105.26 3bdm n GLY 202 Ca 0.05 0.17 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 3bdm n GLY 202 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3bdm s THR 203 N -3.31 0.09 -0.03 2.61 2.01 -0.87 -5.04 115.64 111.10 3bdm s THR 203 Ca 0.14 -0.75 -0.03 0.00 0.31 0.00 0.00 61.69 61.36 3bdm s THR 203 Cb -0.02 -0.83 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 3bdm s THR 203 CO 0.62 -0.41 0.17 -0.70 -0.69 0.00 0.00 174.62 173.60 3bdm s GLU 204 N -2.26 3.42 0.16 4.92 2.56 -1.26 -4.46 118.70 121.77 3bdm s GLU 204 Ca -0.07 -0.29 0.11 0.00 0.00 0.00 0.00 54.97 54.71 3bdm s GLU 204 Cb -0.02 -3.10 -0.04 0.00 2.00 0.00 0.00 34.13 32.96 3bdm s GLU 204 CO -0.02 0.70 -0.25 -0.06 -0.56 0.00 0.00 175.26 175.07 3bdm s PHE 205 N -1.26 2.23 0.31 5.30 0.40 -1.26 -5.11 117.98 118.59 3bdm s PHE 205 Ca 0.24 -0.38 0.04 0.00 -0.60 0.00 0.00 56.93 56.23 3bdm s PHE 205 Cb -0.12 -1.16 0.04 0.00 0.51 0.00 0.00 43.02 42.29 3bdm s PHE 205 CO 0.15 0.40 0.31 -1.13 0.70 0.00 0.00 175.22 175.65 3bdm n SER 206 N 0.61 1.62 0.00 1.36 3.41 -1.26 -4.99 113.62 114.37 3bdm n SER 206 Ca -0.15 -1.95 0.11 0.00 -0.26 0.00 0.00 58.87 56.61 3bdm n SER 206 Cb 0.55 -0.11 0.51 0.00 -0.26 0.00 0.00 64.21 64.89 3bdm n SER 206 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3bdm n LYS 207 N -1.41 0.12 -0.23 4.33 2.85 -1.26 -2.90 118.16 119.66 3bdm n LYS 207 Ca 0.03 0.10 0.06 0.00 -1.05 0.00 0.00 58.31 57.45 3bdm n LYS 207 Cb 0.34 -1.50 0.17 0.00 -0.65 0.00 0.00 35.03 33.39 3bdm n LYS 207 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3bdm n ASN 208 N -1.42 3.12 -0.48 -5.58 3.02 -1.26 -4.39 115.26 108.27 3bdm n ASN 208 Ca 0.07 -2.20 0.08 0.00 -0.03 0.00 0.00 54.58 52.50 3bdm n ASN 208 Cb 0.23 -0.29 0.03 0.00 -0.61 0.00 0.00 39.78 39.13 3bdm n ASN 208 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3bdm n ASP 209 N 0.31 1.92 -4.42 6.41 10.43 -1.14 -4.73 116.55 125.32 3bdm n ASP 209 Ca 0.14 -1.46 -0.26 0.00 2.57 0.00 0.00 54.79 55.78 3bdm n ASP 209 Cb 0.52 0.29 -0.09 0.00 1.84 0.00 0.00 41.12 43.68 3bdm n ASP 209 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3bdm s LEU 210 N -1.81 2.23 -0.23 0.64 1.43 -1.26 -1.65 118.68 118.03 3bdm s LEU 210 Ca 0.16 -1.52 -0.08 0.00 -1.03 0.00 0.00 54.13 51.67 3bdm s LEU 210 Cb 0.13 -0.42 0.11 0.00 0.03 0.00 0.00 46.19 46.04 3bdm s LEU 210 CO 0.33 -0.73 0.49 -0.70 0.23 0.00 0.00 176.35 175.97 3bdm s GLU 211 N -3.81 0.40 0.02 1.70 2.12 -0.39 -4.63 118.70 114.12 3bdm s GLU 211 Ca 0.27 1.15 0.08 0.00 0.36 0.00 0.00 54.97 56.84 3bdm s GLU 211 Cb 0.06 0.48 -0.02 0.00 0.26 0.00 0.00 34.13 34.91 3bdm s GLU 211 CO 0.13 -0.25 -0.25 0.08 -0.54 0.00 0.00 175.26 174.44 3bdm s VAL 212 N 2.70 1.96 0.01 3.70 1.01 -1.26 -1.68 120.40 126.84 3bdm s VAL 212 Ca -0.02 -1.21 0.04 0.00 0.00 0.00 0.00 61.98 60.78 3bdm s VAL 212 Cb -0.12 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 3bdm s VAL 212 CO -0.15 0.41 -0.12 -0.83 0.00 0.00 0.00 175.10 174.41 3bdm s GLY 213 N -0.96 0.62 -0.01 4.51 0.00 -0.49 -1.37 107.32 109.63 3bdm s GLY 213 Ca 0.10 -0.59 0.03 0.00 0.00 0.00 0.00 44.72 44.26 3bdm s GLY 213 CO 0.01 -0.53 -0.11 0.14 0.00 0.00 0.00 173.10 172.61 3bdm s VAL 214 N -0.46 0.85 -0.15 1.40 1.01 0.11 -1.24 120.40 121.92 3bdm s VAL 214 Ca 0.03 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.59 3bdm s VAL 214 Cb -0.06 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.61 3bdm s VAL 214 CO 0.00 0.25 -0.20 0.00 0.00 0.00 0.00 175.10 175.15 3bdm s ALA 215 N -0.14 2.32 0.46 5.51 0.00 0.61 -0.72 121.76 129.81 3bdm s ALA 215 Ca 0.02 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.91 3bdm s ALA 215 Cb -0.05 -1.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.97 3bdm s ALA 215 CO -0.00 -0.07 0.06 0.95 0.00 0.00 0.00 175.76 176.69 3bdm s THR 216 N 0.88 0.92 0.05 0.00 -4.23 0.14 -0.54 115.64 112.86 3bdm s THR 216 Ca -0.05 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.16 3bdm s THR 216 Cb -0.15 -2.26 -0.09 0.00 1.34 0.00 0.00 72.50 71.34 3bdm s THR 216 CO -0.03 0.00 1.95 1.17 -0.54 0.00 0.00 174.62 177.18 3bdm n LYS 217 N -1.10 2.86 -3.51 3.99 3.00 -1.26 -2.76 118.16 119.38 3bdm n LYS 217 Ca -0.13 1.05 -0.19 0.00 -0.00 0.00 0.00 58.31 59.04 3bdm n LYS 217 Cb 0.66 -2.99 0.07 0.00 0.00 0.00 0.00 35.03 32.76 3bdm n LYS 217 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3bdm n ASP 218 N 7.22 -2.47 0.00 3.14 8.00 -1.26 -4.99 116.55 126.19 3bdm n ASP 218 Ca 0.20 -0.72 0.00 0.00 0.71 0.00 0.00 54.79 54.98 3bdm n ASP 218 Cb 0.40 -4.71 0.00 0.00 -0.02 0.00 0.00 41.12 36.79 3bdm n ASP 218 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3bdm n LYS 220 N -4.06 0.00 -4.57 -1.24 4.81 -1.11 -4.94 118.16 107.05 3bdm n LYS 220 Ca -0.26 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 56.92 3bdm n LYS 220 Cb 0.66 0.00 -0.17 0.00 0.02 0.00 0.00 35.03 35.55 3bdm n LYS 220 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 3bdm s PHE 221 N -0.66 1.65 0.07 5.64 2.19 -0.73 0.26 117.98 126.41 3bdm s PHE 221 Ca 0.00 -0.66 -0.02 0.00 0.33 0.00 0.00 56.93 56.58 3bdm s PHE 221 Cb 0.00 -1.20 -0.04 0.00 -1.31 0.00 0.00 43.02 40.47 3bdm s PHE 221 CO 0.00 -0.34 0.01 -0.59 1.83 0.00 0.00 175.22 176.13 3bdm s PHE 222 N 0.77 0.58 0.08 10.12 -0.12 0.10 -4.91 117.98 124.60 3bdm s PHE 222 Ca -0.12 -1.08 0.06 0.00 -0.05 0.00 0.00 56.93 55.74 3bdm s PHE 222 Cb -0.16 -0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 41.81 3bdm s PHE 222 CO 0.02 -0.43 -0.09 0.95 -0.05 0.00 0.00 175.22 175.63 3bdm s THR 223 N -3.95 3.45 0.35 -4.49 -4.23 -1.26 0.09 115.64 105.60 3bdm s THR 223 Ca 0.11 -1.16 -0.15 0.00 -1.18 0.00 0.00 61.69 59.32 3bdm s THR 223 Cb 0.08 -2.59 -0.09 0.00 1.34 0.00 0.00 72.50 71.24 3bdm s THR 223 CO -0.07 0.17 0.77 -0.76 -0.54 0.00 0.00 174.62 174.19 3bdm s LEU 224 N -2.05 4.00 0.54 4.79 1.43 -0.47 -4.98 118.68 121.94 3bdm s LEU 224 Ca 0.21 1.30 -0.03 0.00 -1.03 0.00 0.00 54.13 54.58 3bdm s LEU 224 Cb -0.11 -4.12 0.01 0.00 0.03 0.00 0.00 46.19 42.00 3bdm s LEU 224 CO 0.13 -0.26 0.80 -0.94 0.23 0.00 0.00 176.35 176.31 3bdm s SER 225 N -2.43 5.59 0.20 2.29 1.04 -1.26 -4.63 113.70 114.50 3bdm s SER 225 Ca 0.55 0.43 -0.20 0.00 0.48 0.00 0.00 55.95 57.21 3bdm s SER 225 Cb -0.10 -1.49 0.15 0.00 0.10 0.00 0.00 66.02 64.69 3bdm s SER 225 CO 0.20 -0.97 1.57 0.00 0.98 0.00 0.00 173.24 175.02 3bdm h ALA 226 N 0.05 -0.01 -0.72 5.32 0.00 -1.97 0.77 119.26 122.70 3bdm h ALA 226 Ca -0.45 0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.70 3bdm h ALA 226 Cb 1.26 0.89 -0.05 0.00 0.00 0.00 0.00 17.79 19.90 3bdm h ALA 226 CO 0.58 -0.68 0.44 0.93 0.00 0.00 0.00 179.25 180.52 3bdm h GLU 227 N -0.11 0.81 -0.74 0.00 4.39 -1.93 0.23 114.58 117.24 3bdm h GLU 227 Ca 0.27 -0.05 0.08 0.00 0.34 0.00 0.00 59.36 60.00 3bdm h GLU 227 Cb 0.57 -0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 28.98 3bdm h GLU 227 CO -0.79 0.54 0.48 -0.91 -1.16 0.00 0.00 179.01 177.17 3bdm h ASN 228 N 0.84 0.63 0.04 1.42 -0.26 -1.25 -0.64 115.58 116.36 3bdm h ASN 228 Ca 0.30 0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 56.04 3bdm h ASN 228 Cb 0.07 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.21 3bdm h ASN 228 CO -0.13 0.39 -0.02 0.40 -1.06 0.00 0.00 177.43 177.01 3bdm h ILE 229 N 0.70 1.35 -0.94 2.81 2.04 -0.13 -2.69 117.51 120.65 3bdm h ILE 229 Ca 0.33 -1.55 0.28 0.00 1.00 0.00 0.00 64.86 64.92 3bdm h ILE 229 Cb 0.36 2.33 -0.15 0.00 -0.74 0.00 0.00 36.82 38.62 3bdm h ILE 229 CO -0.11 0.37 0.36 -0.08 0.00 0.00 0.00 178.15 178.69 3bdm h GLU 230 N -0.77 0.22 -0.27 2.37 4.57 0.12 1.14 114.58 121.96 3bdm h GLU 230 Ca -0.01 -0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.02 3bdm h GLU 230 Cb 0.66 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 3bdm h GLU 230 CO 0.01 0.15 -0.41 1.49 -1.18 0.00 0.00 179.01 179.06 3bdm h GLU 231 N 0.23 0.65 -0.19 1.92 4.81 -1.19 -1.84 114.58 118.97 3bdm h GLU 231 Ca 0.64 -0.34 -0.17 0.00 -0.13 0.00 0.00 59.36 59.36 3bdm h GLU 231 Cb 1.39 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.78 3bdm h GLU 231 CO -0.66 0.94 -0.59 -0.09 -0.73 0.00 0.00 179.01 177.88 3bdm h ARG 232 N 0.53 0.61 -0.40 1.92 9.65 0.13 -2.75 114.38 124.07 3bdm h ARG 232 Ca 0.04 -0.41 -0.06 0.00 -1.10 0.00 0.00 59.98 58.46 3bdm h ARG 232 Cb 0.94 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.56 3bdm h ARG 232 CO 0.08 1.02 0.02 -0.07 2.80 0.00 0.00 179.97 183.82 3bdm h LEU 233 N 0.46 0.67 -0.25 3.80 4.07 0.63 -2.86 115.31 121.83 3bdm h LEU 233 Ca -0.00 -0.30 0.02 0.00 0.08 0.00 0.00 57.88 57.68 3bdm h LEU 233 Cb 1.15 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.69 3bdm h LEU 233 CO 0.11 0.80 0.12 0.58 -1.08 0.00 0.00 178.44 178.98 3bdm h VAL 234 N 0.52 0.99 -0.60 1.22 2.07 -1.33 -1.61 116.25 117.51 3bdm h VAL 234 Ca 0.11 -0.09 0.12 0.00 0.82 0.00 0.00 66.70 67.67 3bdm h VAL 234 Cb 0.45 0.71 -0.10 0.00 -1.52 0.00 0.00 31.29 30.83 3bdm h VAL 234 CO 0.02 0.05 -0.00 0.00 0.02 0.00 0.00 177.57 177.65 3bdm h ALA 235 N 1.13 0.58 -0.02 1.67 0.00 -1.30 0.25 119.26 121.56 3bdm h ALA 235 Ca 0.10 0.18 -0.09 0.00 0.00 0.00 0.00 54.91 55.10 3bdm h ALA 235 Cb 0.03 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3bdm h ALA 235 CO -0.07 -0.39 -0.42 -0.84 0.00 0.00 0.00 179.25 177.53 3bdm h ILE 236 N 0.11 1.31 -0.78 0.00 3.07 -1.27 -2.69 117.51 117.27 3bdm h ILE 236 Ca 0.31 -1.46 -0.01 0.00 1.55 0.00 0.00 64.86 65.25 3bdm h ILE 236 Cb 0.50 1.76 -0.04 0.00 -0.27 0.00 0.00 36.82 38.77 3bdm h ILE 236 CO -0.51 0.42 0.46 0.00 -1.05 0.00 0.00 178.15 177.47 3bdm h ALA 237 N 1.53 1.00 -0.49 0.16 0.00 0.39 -2.85 119.26 119.01 3bdm h ALA 237 Ca 0.00 -0.09 -0.73 0.00 0.00 0.00 0.00 54.91 54.09 3bdm h ALA 237 Cb 0.76 -0.31 -0.09 0.00 0.00 0.00 0.00 17.79 18.15 3bdm h ALA 237 CO 0.06 0.47 2.74 0.39 0.00 0.00 0.00 179.25 182.90 3bdm n GLU 238 N -4.47 3.95 0.00 0.00 1.02 -0.17 -2.35 120.64 118.62 3bdm n GLU 238 Ca 0.07 -3.09 0.00 0.00 -0.02 0.00 0.00 57.16 54.12 3bdm n GLU 238 Cb 0.06 -2.82 0.00 0.00 -0.02 0.00 0.00 31.44 28.66 3bdm n GLU 238 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 3bdm n GLN 239 N 3.18 0.00 0.00 3.49 7.27 -1.08 -4.96 117.38 125.28 3bdm n GLN 239 Ca 0.59 0.00 0.06 0.00 0.07 0.00 0.00 57.00 57.73 3bdm n GLN 239 Cb 0.29 0.00 0.05 0.00 2.41 0.00 0.00 30.24 32.99 3bdm n GLN 239 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88