#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m7o s TRP 27 N 0.00 2.89 0.60 1.61 0.52 -1.26 -5.01 118.94 118.30 3m7o s TRP 27 Ca 0.00 1.55 -0.18 0.00 0.02 0.00 0.00 56.10 57.49 3m7o s TRP 27 Cb 0.00 -3.11 -0.03 0.00 -1.15 0.00 0.00 33.47 29.18 3m7o s TRP 27 CO 0.00 -1.12 1.16 -1.25 0.02 0.00 0.00 176.95 175.76 3m7o s PRO 28 N -3.47 2.99 0.45 4.98 0.04 -1.26 -4.78 135.00 133.95 3m7o s PRO 28 Ca 0.68 1.65 -0.24 0.00 0.04 0.00 0.00 61.00 63.13 3m7o s PRO 28 Cb -0.18 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.33 3m7o s PRO 28 CO 0.26 -1.15 1.26 0.15 0.04 0.00 0.00 177.00 177.57 3m7o s LYS 29 N -3.53 3.75 0.02 4.56 1.02 -1.26 -4.63 119.74 119.67 3m7o s LYS 29 Ca 0.73 2.03 0.04 0.00 0.02 0.00 0.00 55.97 58.80 3m7o s LYS 29 Cb -0.26 -2.55 -0.02 0.00 -0.52 0.00 0.00 37.83 34.49 3m7o s LYS 29 CO 0.34 -0.63 -0.13 -1.01 -0.92 0.00 0.00 175.35 172.99 3m7o s HIS 30 N -1.37 1.14 -0.37 3.18 3.76 0.06 -4.99 115.29 116.70 3m7o s HIS 30 Ca 0.62 -0.30 -0.25 0.00 -0.15 0.00 0.00 55.06 54.98 3m7o s HIS 30 Cb -0.35 -0.70 0.01 0.00 1.11 0.00 0.00 32.58 32.66 3m7o s HIS 30 CO 0.44 0.01 0.89 0.99 -0.85 0.00 0.00 174.74 176.21 3m7o s THR 31 N -0.65 4.62 0.11 1.30 2.01 -1.26 -0.84 115.64 120.93 3m7o s THR 31 Ca 0.02 1.10 -0.11 0.00 0.31 0.00 0.00 61.69 63.01 3m7o s THR 31 Cb -0.07 -4.30 -0.16 0.00 0.01 0.00 0.00 72.50 67.98 3m7o s THR 31 CO 0.01 -0.52 1.31 0.00 -0.69 0.00 0.00 174.62 174.73 3m7o h ALA 32 N 8.49 0.33 -2.63 7.40 0.00 -0.73 -3.47 119.26 128.65 3m7o h ALA 32 Ca -0.24 -0.62 0.07 0.00 0.00 0.00 0.00 54.91 54.12 3m7o h ALA 32 Cb 1.08 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.74 3m7o h ALA 32 CO 0.96 0.70 0.36 0.00 0.00 0.00 0.00 179.25 181.28 3m7o s ASN 34 N -2.69 -1.30 -0.11 0.00 2.47 -1.25 -0.76 114.94 111.31 3m7o s ASN 34 Ca 0.05 -0.31 -0.31 0.00 0.42 0.00 0.00 52.86 52.71 3m7o s ASN 34 Cb -0.02 1.72 0.12 0.00 -1.45 0.00 0.00 41.25 41.62 3m7o s ASN 34 CO -0.07 -0.18 1.01 -0.94 -3.72 0.00 0.00 177.10 173.19 3m7o s SER 35 N 2.28 -0.31 -1.71 -4.21 1.04 -0.48 -5.00 113.70 105.32 3m7o s SER 35 Ca 0.15 0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.72 3m7o s SER 35 Cb -0.05 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.37 3m7o s SER 35 CO -0.16 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.25 3m7o n GLY 36 N 0.16 0.27 1.47 7.32 0.00 -1.26 -1.53 105.19 111.62 3m7o n GLY 36 Ca -0.07 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3m7o n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m7o n GLY 37 N -0.92 0.63 3.03 -0.02 0.00 -1.26 -0.69 105.19 105.95 3m7o n GLY 37 Ca -0.21 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 3m7o n GLY 37 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m7o s LEU 38 N 0.00 1.67 -0.09 0.99 2.96 -0.58 -0.92 118.68 122.71 3m7o s LEU 38 Ca 0.00 -0.30 0.04 0.00 -0.22 0.00 0.00 54.13 53.65 3m7o s LEU 38 Cb 0.00 -0.83 0.00 0.00 0.50 0.00 0.00 46.19 45.86 3m7o s LEU 38 CO 0.00 0.04 -0.23 -0.70 -1.32 0.00 0.00 176.35 174.15 3m7o s GLU 39 N 0.62 2.80 -0.18 1.98 2.12 -0.20 -1.38 118.70 124.45 3m7o s GLU 39 Ca -0.14 -0.82 0.01 0.00 0.36 0.00 0.00 54.97 54.38 3m7o s GLU 39 Cb -0.15 -2.16 0.04 0.00 0.26 0.00 0.00 34.13 32.12 3m7o s GLU 39 CO 0.04 0.19 -0.10 0.08 -0.54 0.00 0.00 175.26 174.92 3m7o s VAL 40 N 0.31 1.53 -0.05 3.70 1.01 0.06 -0.59 120.40 126.38 3m7o s VAL 40 Ca -0.16 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.02 3m7o s VAL 40 Cb -0.17 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 3m7o s VAL 40 CO 0.08 0.23 -0.22 -0.69 0.00 0.00 0.00 175.10 174.50 3m7o s VAL 41 N 1.46 2.38 0.17 2.92 1.01 -0.60 -0.14 120.40 127.60 3m7o s VAL 41 Ca 0.01 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 61.06 3m7o s VAL 41 Cb -0.15 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 3m7o s VAL 41 CO -0.09 0.58 -0.07 -0.72 0.00 0.00 0.00 175.10 174.80 3m7o s TYR 42 N -0.42 1.35 -0.02 5.22 -0.85 -0.02 -0.55 117.35 122.06 3m7o s TYR 42 Ca 0.04 -0.82 0.02 0.00 -0.52 0.00 0.00 57.07 55.79 3m7o s TYR 42 Cb -0.12 -0.73 0.00 0.00 0.38 0.00 0.00 41.96 41.50 3m7o s TYR 42 CO 0.01 0.03 -0.05 -1.14 -1.52 0.00 0.00 175.55 172.88 3m7o s GLN 43 N -3.79 0.57 0.14 -3.49 0.74 -0.00 -0.76 119.66 113.06 3m7o s GLN 43 Ca 0.21 -0.18 -0.31 0.00 0.05 0.00 0.00 55.36 55.13 3m7o s GLN 43 Cb 0.04 -0.57 -0.09 0.00 1.10 0.00 0.00 33.01 33.49 3m7o s GLN 43 CO 0.03 0.07 1.43 0.45 -0.55 0.00 0.00 175.29 176.72 3m7o s SER 44 N 0.18 6.77 -0.21 6.67 0.15 -1.26 -1.07 113.70 124.93 3m7o s SER 44 Ca -0.02 2.41 0.15 0.00 0.70 0.00 0.00 55.95 59.20 3m7o s SER 44 Cb -0.06 -2.59 0.70 0.00 -1.71 0.00 0.00 66.02 62.36 3m7o s SER 44 CO -0.00 -0.69 1.61 0.00 1.20 0.00 0.00 173.24 175.37 3m7o s ASP 46 N -1.27 6.45 0.57 0.00 3.68 -1.25 -4.84 116.67 120.01 3m7o s ASP 46 Ca 0.49 0.41 0.26 0.00 2.13 0.00 0.00 52.55 55.84 3m7o s ASP 46 Cb 0.38 -2.31 1.64 0.00 -1.45 0.00 0.00 42.92 41.19 3m7o s ASP 46 CO 0.13 -0.41 2.21 1.55 0.13 0.00 0.00 175.17 178.78 3m7o h PRO 47 N 8.16 0.00 -0.37 4.34 0.13 -1.98 -2.62 132.00 139.66 3m7o h PRO 47 Ca -0.28 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.79 3m7o h PRO 47 Cb 1.13 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 3m7o h PRO 47 CO 0.77 0.01 -0.04 -0.07 -0.23 0.00 0.00 178.00 178.44 3m7o h LEU 48 N 0.00 0.57 -7.00 1.56 3.38 -2.00 -3.48 115.31 108.34 3m7o h LEU 48 Ca -0.00 -0.13 0.15 0.00 0.09 0.00 0.00 57.88 57.99 3m7o h LEU 48 Cb 0.03 -0.15 -0.17 0.00 0.09 0.00 0.00 40.66 40.45 3m7o h LEU 48 CO 0.00 0.67 0.60 0.00 0.09 0.00 0.00 178.44 179.79 3m7o s GLN 49 N -4.90 0.64 0.64 1.13 -2.07 -0.99 -5.16 119.66 108.95 3m7o s GLN 49 Ca -0.08 -0.20 0.00 0.00 -1.82 0.00 0.00 55.36 53.26 3m7o s GLN 49 Cb 0.15 0.30 0.09 0.00 -1.09 0.00 0.00 33.01 32.45 3m7o s GLN 49 CO 0.78 -0.27 0.90 0.34 -1.32 0.00 0.00 175.29 175.71 3m7o s ASP 50 N -2.26 4.77 0.23 12.60 3.68 -1.26 -4.40 116.67 130.03 3m7o s ASP 50 Ca 0.06 -0.22 -0.16 0.00 2.13 0.00 0.00 52.55 54.36 3m7o s ASP 50 Cb -0.01 -0.38 0.01 0.00 -1.45 0.00 0.00 42.92 41.09 3m7o s ASP 50 CO -0.07 -1.54 0.54 0.72 0.13 0.00 0.00 175.17 174.95 3m7o s PHE 51 N -2.97 0.09 -0.14 -5.34 -0.12 -1.26 -4.83 117.98 103.41 3m7o s PHE 51 Ca 0.62 -0.47 -0.05 0.00 -0.05 0.00 0.00 56.93 56.98 3m7o s PHE 51 Cb -0.08 0.36 -0.04 0.00 -0.63 0.00 0.00 43.02 42.63 3m7o s PHE 51 CO 0.42 -1.01 0.04 0.20 -0.05 0.00 0.00 175.22 174.81 3m7o s GLY 52 N -2.95 1.89 -0.09 1.99 0.00 -0.21 -4.97 107.32 102.99 3m7o s GLY 52 Ca 0.16 -0.76 -0.04 0.00 0.00 0.00 0.00 44.72 44.08 3m7o s GLY 52 CO 0.04 -0.18 0.19 -2.27 0.00 0.00 0.00 173.10 170.89 3m7o s LEU 53 N -0.13 0.38 0.02 0.66 2.96 -1.26 -0.75 118.68 120.56 3m7o s LEU 53 Ca 0.06 0.41 0.02 0.00 -0.22 0.00 0.00 54.13 54.40 3m7o s LEU 53 Cb -0.12 0.50 -0.01 0.00 0.50 0.00 0.00 46.19 47.06 3m7o s LEU 53 CO 0.02 -0.18 -0.08 -0.55 -1.32 0.00 0.00 176.35 174.24 3m7o s SER 54 N 1.52 0.90 -0.11 3.68 0.15 0.49 -4.30 113.70 116.04 3m7o s SER 54 Ca -0.06 -0.29 0.03 0.00 0.70 0.00 0.00 55.95 56.33 3m7o s SER 54 Cb -0.11 -0.05 -0.00 0.00 -1.71 0.00 0.00 66.02 64.14 3m7o s SER 54 CO -0.07 -0.01 -0.21 -0.63 1.20 0.00 0.00 173.24 173.52 3m7o s ILE 55 N -0.61 2.32 0.12 6.45 1.01 -0.37 -0.20 121.20 129.91 3m7o s ILE 55 Ca -0.01 -0.93 -0.20 0.00 0.00 0.00 0.00 60.65 59.51 3m7o s ILE 55 Cb -0.05 -1.91 -0.07 0.00 0.01 0.00 0.00 42.46 40.43 3m7o s ILE 55 CO 0.00 0.55 0.62 -1.81 0.00 0.00 0.00 174.94 174.30 3m7o s ASP 56 N 0.35 7.09 -1.35 3.58 1.01 -0.30 -4.41 116.67 122.64 3m7o s ASP 56 Ca -0.17 1.33 -0.08 0.00 0.71 0.00 0.00 52.55 54.34 3m7o s ASP 56 Cb -0.17 -2.38 0.01 0.00 1.01 0.00 0.00 42.92 41.38 3m7o s ASP 56 CO 0.08 0.21 0.99 0.00 0.21 0.00 0.00 175.17 176.66 3m7o n GLN 57 N 1.45 -6.88 -1.71 8.23 1.13 -1.26 -4.56 117.38 113.78 3m7o n GLN 57 Ca -0.08 0.81 -0.39 0.00 -1.94 0.00 0.00 57.00 55.41 3m7o n GLN 57 Cb 0.51 -5.71 0.04 0.00 0.11 0.00 0.00 30.24 25.18 3m7o n GLN 57 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3m7o s SER 59 N -0.91 -0.40 0.29 0.00 1.04 -1.23 -4.08 113.70 108.41 3m7o s SER 59 Ca 0.71 -0.02 0.04 0.00 0.48 0.00 0.00 55.95 57.16 3m7o s SER 59 Cb -0.44 0.43 0.69 0.00 0.10 0.00 0.00 66.02 66.80 3m7o s SER 59 CO 0.50 -0.70 1.77 0.11 0.98 0.00 0.00 173.24 175.90 3m7o h LYS 60 N 2.00 0.70 -5.31 4.02 1.57 -1.11 -3.18 116.57 115.27 3m7o h LYS 60 Ca -0.24 -0.04 -0.64 0.00 -1.87 0.00 0.00 60.65 57.85 3m7o h LYS 60 Cb 1.25 -0.16 -0.15 0.00 0.08 0.00 0.00 32.23 33.25 3m7o h LYS 60 CO 0.32 0.46 0.48 -1.14 -0.57 0.00 0.00 179.45 179.00 3m7o s GLN 61 N -5.89 3.11 -0.04 3.15 0.74 -1.26 -0.82 119.66 118.65 3m7o s GLN 61 Ca -0.11 -0.94 -0.30 0.00 0.05 0.00 0.00 55.36 54.06 3m7o s GLN 61 Cb 0.24 -4.25 -0.04 0.00 1.10 0.00 0.00 33.01 30.06 3m7o s GLN 61 CO 0.80 -1.77 1.22 0.42 -0.55 0.00 0.00 175.29 175.41 3m7o s ILE 62 N 3.80 4.18 0.45 -2.34 1.01 0.10 -4.92 121.20 123.48 3m7o s ILE 62 Ca 0.21 1.52 -0.16 0.00 0.00 0.00 0.00 60.65 62.21 3m7o s ILE 62 Cb -0.18 -3.97 -0.08 0.00 0.01 0.00 0.00 42.46 38.23 3m7o s ILE 62 CO 0.09 0.00 0.90 -1.10 0.00 0.00 0.00 174.94 174.84 3m7o s GLN 63 N 2.18 3.99 0.47 2.79 -1.52 -1.26 -0.73 119.66 125.58 3m7o s GLN 63 Ca 0.57 0.86 -0.22 0.00 -1.95 0.00 0.00 55.36 54.61 3m7o s GLN 63 Cb -0.26 -2.23 -0.09 0.00 -0.22 0.00 0.00 33.01 30.21 3m7o s GLN 63 CO 0.23 -0.11 0.98 0.43 -0.25 0.00 0.00 175.29 176.56 3m7o n SER 64 N -1.15 1.05 -3.46 5.90 7.64 -1.26 -3.89 113.62 118.44 3m7o n SER 64 Ca 0.05 0.96 -0.20 0.00 1.01 0.00 0.00 58.87 60.69 3m7o n SER 64 Cb 0.54 -1.36 0.06 0.00 -1.01 0.00 0.00 64.21 62.44 3m7o n SER 64 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3m7o n ASN 65 N 0.20 -4.73 -4.71 6.43 5.03 -0.63 -4.89 115.26 111.95 3m7o n ASN 65 Ca 0.10 -0.79 -0.41 0.00 0.87 0.00 0.00 54.58 54.35 3m7o n ASN 65 Cb 0.42 -4.56 0.01 0.00 -1.02 0.00 0.00 39.78 34.62 3m7o n ASN 65 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3m7o n LEU 66 N -3.76 4.15 -4.75 3.41 4.77 -1.25 -4.59 117.00 114.98 3m7o n LEU 66 Ca -0.15 1.13 -0.39 0.00 -0.03 0.00 0.00 56.01 56.57 3m7o n LEU 66 Cb 0.63 -1.52 -0.05 0.00 -2.33 0.00 0.00 43.42 40.15 3m7o n LEU 66 CO 0.63 -0.51 0.34 0.20 -1.33 0.00 0.00 177.39 176.72 3m7o s ASN 67 N -0.47 7.01 0.29 -1.43 0.02 -1.26 -1.02 114.94 118.07 3m7o s ASN 67 Ca 0.60 1.20 0.05 0.00 -1.02 0.00 0.00 52.86 53.69 3m7o s ASN 67 Cb -0.51 -2.39 -0.06 0.00 0.02 0.00 0.00 41.25 38.31 3m7o s ASN 67 CO 0.59 0.03 -0.01 0.27 0.02 0.00 0.00 177.10 177.99 3m7o s ILE 68 N 0.11 1.41 -0.07 0.60 -4.36 -0.02 -1.15 121.20 117.72 3m7o s ILE 68 Ca 0.34 -2.07 0.02 0.00 -0.26 0.00 0.00 60.65 58.68 3m7o s ILE 68 Cb -0.18 -2.54 0.01 0.00 1.25 0.00 0.00 42.46 41.01 3m7o s ILE 68 CO 0.18 -0.22 -0.12 -0.13 0.24 0.00 0.00 174.94 174.89 3m7o s ARG 69 N -3.80 1.73 -0.05 0.37 0.52 0.71 -1.53 118.95 116.91 3m7o s ARG 69 Ca 0.31 -0.41 -0.00 0.00 -0.52 0.00 0.00 55.73 55.11 3m7o s ARG 69 Cb 0.06 -1.46 0.03 0.00 0.52 0.00 0.00 34.95 34.10 3m7o s ARG 69 CO 0.12 -0.00 -0.01 0.12 0.02 0.00 0.00 175.30 175.55 3m7o s PHE 70 N 0.76 0.61 -0.04 -0.53 5.36 0.11 -0.38 117.98 123.87 3m7o s PHE 70 Ca -0.13 -0.14 0.03 0.00 -0.96 0.00 0.00 56.93 55.73 3m7o s PHE 70 Cb -0.16 -0.68 0.01 0.00 -0.34 0.00 0.00 43.02 41.86 3m7o s PHE 70 CO 0.03 -0.25 -0.11 0.20 -1.46 0.00 0.00 175.22 173.63 3m7o s GLY 71 N 1.48 0.66 0.03 13.12 0.00 0.07 -0.36 107.32 122.32 3m7o s GLY 71 Ca -0.03 -0.37 -0.28 0.00 0.00 0.00 0.00 44.72 44.04 3m7o s GLY 71 CO -0.03 0.00 0.65 -1.50 0.00 0.00 0.00 173.10 172.23 3m7o s ILE 72 N 0.40 0.00 -0.24 0.90 2.07 -0.67 -1.04 121.20 122.63 3m7o s ILE 72 Ca -0.08 0.00 -0.13 0.00 -1.41 0.00 0.00 60.65 59.03 3m7o s ILE 72 Cb -0.12 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.43 3m7o s ILE 72 CO 0.02 0.00 0.27 -0.63 -1.91 0.00 0.00 174.94 172.69 3m7o s ILE 73 N -2.16 5.27 0.12 2.00 1.01 -1.26 -0.42 121.20 125.76 3m7o s ILE 73 Ca -0.06 0.40 -0.31 0.00 0.00 0.00 0.00 60.65 60.68 3m7o s ILE 73 Cb -0.00 -3.61 -0.07 0.00 0.01 0.00 0.00 42.46 38.78 3m7o s ILE 73 CO 0.01 0.27 1.31 -0.76 0.00 0.00 0.00 174.94 175.77 3m7o s LEU 74 N 1.45 4.38 0.00 2.97 1.43 0.30 -4.91 118.68 124.30 3m7o s LEU 74 Ca 0.12 2.25 0.12 0.00 -1.03 0.00 0.00 54.13 55.59 3m7o s LEU 74 Cb -0.15 -3.59 0.07 0.00 0.03 0.00 0.00 46.19 42.55 3m7o s LEU 74 CO 0.08 -0.56 0.83 0.54 0.23 0.00 0.00 176.35 177.47 3m7o n ARG 75 N 3.62 1.14 -4.10 1.70 5.12 -1.26 -0.13 116.66 122.75 3m7o n ARG 75 Ca 0.09 -1.06 -0.14 0.00 -1.93 0.00 0.00 57.85 54.81 3m7o n ARG 75 Cb 0.44 -1.21 -0.12 0.00 -1.16 0.00 0.00 32.46 30.41 3m7o n ARG 75 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3m7o s GLN 76 N -1.20 0.54 0.47 5.56 -1.52 -1.26 -4.91 119.66 117.34 3m7o s GLN 76 Ca 0.13 -0.66 -0.22 0.00 -1.95 0.00 0.00 55.36 52.66 3m7o s GLN 76 Cb 0.10 -0.38 -0.08 0.00 -0.22 0.00 0.00 33.01 32.44 3m7o s GLN 76 CO 0.20 0.08 1.11 -0.51 -0.25 0.00 0.00 175.29 175.92 3m7o s ASP 77 N -1.29 6.23 -0.16 5.90 -0.00 -1.26 -3.84 116.67 122.24 3m7o s ASP 77 Ca -0.07 2.16 0.01 0.00 -0.00 0.00 0.00 52.55 54.64 3m7o s ASP 77 Cb -0.08 -2.59 0.03 0.00 -0.00 0.00 0.00 42.92 40.28 3m7o s ASP 77 CO 0.00 -0.87 -0.14 -0.63 -0.00 0.00 0.00 175.17 173.54 3m7o s ILE 78 N -1.69 1.64 -0.26 0.77 1.01 0.31 -4.89 121.20 118.08 3m7o s ILE 78 Ca 0.65 -0.76 -0.03 0.00 0.00 0.00 0.00 60.65 60.51 3m7o s ILE 78 Cb -0.24 -1.58 -0.15 0.00 0.01 0.00 0.00 42.46 40.50 3m7o s ILE 78 CO 0.29 0.39 -0.27 0.54 0.00 0.00 0.00 174.94 175.90 3m7o n ARG 79 N 4.73 0.63 -4.26 2.79 1.74 -1.26 0.09 116.66 121.12 3m7o n ARG 79 Ca -0.17 0.18 -0.20 0.00 -0.77 0.00 0.00 57.85 56.90 3m7o n ARG 79 Cb 0.49 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.31 3m7o n ARG 79 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3m7o s LYS 80 N -2.51 1.06 -0.01 5.56 1.02 -1.26 -4.18 119.74 119.42 3m7o s LYS 80 Ca -0.36 -1.23 0.01 0.00 0.02 0.00 0.00 55.97 54.42 3m7o s LYS 80 Cb 0.11 -1.04 0.00 0.00 -0.52 0.00 0.00 37.83 36.38 3m7o s LYS 80 CO 0.56 0.21 -0.04 -1.17 -0.92 0.00 0.00 175.35 173.99 3m7o s LEU 81 N -2.34 1.82 0.02 3.17 2.96 -1.11 -2.67 118.68 120.54 3m7o s LEU 81 Ca 0.09 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 53.95 3m7o s LEU 81 Cb -0.06 -0.28 -0.02 0.00 0.50 0.00 0.00 46.19 46.33 3m7o s LEU 81 CO 0.04 0.03 -0.12 -0.36 -1.32 0.00 0.00 176.35 174.62 3m7o s PHE 82 N 0.15 1.03 -0.16 5.38 0.08 -0.12 0.02 117.98 124.37 3m7o s PHE 82 Ca -0.01 -0.30 0.01 0.00 0.12 0.00 0.00 56.93 56.74 3m7o s PHE 82 Cb -0.05 -0.63 0.02 0.00 -0.57 0.00 0.00 43.02 41.79 3m7o s PHE 82 CO -0.00 0.00 -0.16 -1.17 -0.10 0.00 0.00 175.22 173.79 3m7o s LEU 83 N -0.88 1.86 -0.06 -0.37 2.96 -0.12 -1.42 118.68 120.64 3m7o s LEU 83 Ca 0.01 -0.55 0.02 0.00 -0.22 0.00 0.00 54.13 53.39 3m7o s LEU 83 Cb -0.07 -1.30 -0.03 0.00 0.50 0.00 0.00 46.19 45.30 3m7o s LEU 83 CO 0.01 -0.03 -0.11 -1.81 -1.32 0.00 0.00 176.35 173.08 3m7o s ASP 84 N 1.40 4.29 -0.04 3.68 1.11 0.14 -0.87 116.67 126.38 3m7o s ASP 84 Ca 0.05 -0.13 0.03 0.00 0.18 0.00 0.00 52.55 52.67 3m7o s ASP 84 Cb -0.13 -1.05 0.00 0.00 1.07 0.00 0.00 42.92 42.82 3m7o s ASP 84 CO -0.11 0.34 -0.12 -0.63 1.18 0.00 0.00 175.17 175.82 3m7o s ILE 85 N -0.66 1.03 -0.12 0.77 1.01 0.07 -0.73 121.20 122.57 3m7o s ILE 85 Ca 0.10 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.29 3m7o s ILE 85 Cb -0.11 -0.92 -0.00 0.00 0.01 0.00 0.00 42.46 41.44 3m7o s ILE 85 CO 0.01 0.32 -0.20 -0.89 0.00 0.00 0.00 174.94 174.18 3m7o s THR 86 N 0.28 2.40 -0.11 2.92 2.01 0.04 -0.64 115.64 122.55 3m7o s THR 86 Ca -0.06 -0.89 0.03 0.00 0.31 0.00 0.00 61.69 61.08 3m7o s THR 86 Cb -0.11 -1.96 0.01 0.00 0.01 0.00 0.00 72.50 70.44 3m7o s THR 86 CO 0.02 0.54 -0.19 -0.22 -0.69 0.00 0.00 174.62 174.08 3m7o s LEU 87 N 0.50 1.90 0.16 4.42 2.96 -0.55 -0.82 118.68 127.25 3m7o s LEU 87 Ca -0.13 -0.49 0.05 0.00 -0.22 0.00 0.00 54.13 53.34 3m7o s LEU 87 Cb -0.17 -1.22 -0.04 0.00 0.50 0.00 0.00 46.19 45.26 3m7o s LEU 87 CO 0.05 0.07 -0.11 -0.04 -1.32 0.00 0.00 176.35 175.00 3m7o s MET 88 N 0.73 1.10 -0.17 1.98 -1.94 0.02 -0.88 119.30 120.14 3m7o s MET 88 Ca -0.11 -1.47 -0.11 0.00 -1.71 0.00 0.00 55.69 52.30 3m7o s MET 88 Cb -0.16 -0.71 0.06 0.00 2.01 0.00 0.00 34.83 36.03 3m7o s MET 88 CO 0.02 0.10 0.43 0.00 -0.01 0.00 0.00 175.02 175.55 3m7o s ALA 89 N -3.23 -1.09 -1.45 3.03 0.00 -0.48 -0.99 121.76 117.55 3m7o s ALA 89 Ca 0.17 1.50 -0.10 0.00 0.00 0.00 0.00 51.96 53.53 3m7o s ALA 89 Cb 0.02 -0.90 0.04 0.00 0.00 0.00 0.00 23.12 22.28 3m7o s ALA 89 CO 0.02 -0.26 0.97 1.63 0.00 0.00 0.00 175.76 178.12 3m7o n LYS 90 N 3.93 -6.35 -0.78 0.00 5.02 -1.26 -1.22 118.16 117.50 3m7o n LYS 90 Ca -0.21 0.75 0.00 0.00 -2.02 0.00 0.00 58.31 56.83 3m7o n LYS 90 Cb 0.56 -5.70 0.00 0.00 -0.02 0.00 0.00 35.03 29.87 3m7o n LYS 90 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3m7o n GLY 91 N -1.77 1.36 3.63 0.72 0.00 -1.26 -5.02 105.19 102.86 3m7o n GLY 91 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3m7o n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3m7o s SER 92 N -3.16 4.83 -0.00 1.61 0.01 -0.36 -5.10 113.70 111.53 3m7o s SER 92 Ca 0.00 -0.10 -0.30 0.00 1.31 0.00 0.00 55.95 56.86 3m7o s SER 92 Cb 0.00 -1.18 -0.05 0.00 0.21 0.00 0.00 66.02 65.01 3m7o s SER 92 CO 0.00 0.27 1.29 -0.55 0.41 0.00 0.00 173.24 174.66 3m7o s SER 93 N -1.54 6.97 -0.21 2.44 0.15 -1.26 -1.38 113.70 118.86 3m7o s SER 93 Ca 0.19 2.00 -0.17 0.00 0.70 0.00 0.00 55.95 58.66 3m7o s SER 93 Cb -0.11 -2.56 -0.14 0.00 -1.71 0.00 0.00 66.02 61.50 3m7o s SER 93 CO 0.09 -0.62 -0.04 -0.38 1.20 0.00 0.00 173.24 173.49 3m7o n ILE 94 N 4.46 1.51 -3.58 6.45 5.41 -0.05 -4.94 119.36 128.61 3m7o n ILE 94 Ca 0.11 -0.06 -0.16 0.00 1.00 0.00 0.00 62.75 63.64 3m7o n ILE 94 Cb 0.45 -2.09 -0.06 0.00 -0.71 0.00 0.00 39.64 37.23 3m7o n ILE 94 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 3m7o s LEU 95 N -7.84 -0.20 -0.01 1.39 0.05 -1.04 -5.02 118.68 106.01 3m7o s LEU 95 Ca -0.29 0.44 0.06 0.00 0.05 0.00 0.00 54.13 54.40 3m7o s LEU 95 Cb 0.07 2.18 -0.03 0.00 -2.05 0.00 0.00 46.19 46.37 3m7o s LEU 95 CO 0.49 -0.61 -0.20 0.20 -0.55 0.00 0.00 176.35 175.68 3m7o s ASN 96 N -1.43 3.62 -0.00 1.48 0.01 -1.26 -1.48 114.94 115.87 3m7o s ASN 96 Ca -0.10 -0.37 0.01 0.00 -0.71 0.00 0.00 52.86 51.69 3m7o s ASN 96 Cb -0.01 -0.60 -0.00 0.00 0.41 0.00 0.00 41.25 41.05 3m7o s ASN 96 CO 0.06 0.31 -0.03 -0.47 -1.51 0.00 0.00 177.10 175.45 3m7o s TYR 97 N -0.76 0.25 -0.10 2.20 6.14 0.19 -4.99 117.35 120.29 3m7o s TYR 97 Ca 0.12 -0.05 -0.04 0.00 0.64 0.00 0.00 57.07 57.73 3m7o s TYR 97 Cb -0.10 -0.16 0.05 0.00 0.42 0.00 0.00 41.96 42.16 3m7o s TYR 97 CO 0.02 -0.01 0.22 0.45 0.64 0.00 0.00 175.55 176.86 3m7o s SER 98 N -0.08 0.10 -0.06 4.32 0.15 -1.26 -0.75 113.70 116.11 3m7o s SER 98 Ca 0.01 0.47 -0.03 0.00 0.70 0.00 0.00 55.95 57.09 3m7o s SER 98 Cb -0.01 0.42 0.03 0.00 -1.71 0.00 0.00 66.02 64.75 3m7o s SER 98 CO -0.00 -0.20 0.14 -0.47 1.20 0.00 0.00 173.24 173.91 3m7o s TYR 99 N 1.72 -0.16 -0.10 3.44 5.04 -0.04 -4.99 117.35 122.26 3m7o s TYR 99 Ca -0.04 0.45 -0.29 0.00 -2.44 0.00 0.00 57.07 54.75 3m7o s TYR 99 Cb -0.11 -0.06 -0.01 0.00 0.35 0.00 0.00 41.96 42.12 3m7o s TYR 99 CO -0.08 -0.15 0.97 -1.25 -1.34 0.00 0.00 175.55 173.71 3m7o s PRO 100 N 0.94 4.42 0.07 4.97 0.04 -1.26 -0.95 135.00 143.23 3m7o s PRO 100 Ca -0.07 1.33 0.23 0.00 0.04 0.00 0.00 61.00 62.52 3m7o s PRO 100 Cb -0.09 -3.54 0.03 0.00 0.04 0.00 0.00 34.50 30.94 3m7o s PRO 100 CO -0.05 -0.28 1.00 1.28 0.04 0.00 0.00 177.00 179.00 3m7o n LEU 101 N 4.89 0.60 0.00 -3.56 4.77 0.10 -4.99 117.00 118.81 3m7o n LEU 101 Ca 0.08 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3m7o n LEU 101 Cb 0.49 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3m7o n LEU 101 CO 0.51 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.58 3m7o n PHE 109 N 2.97 1.57 -3.10 0.00 7.35 -1.26 -2.74 117.46 122.25 3m7o n PHE 109 Ca 0.00 0.20 0.00 0.00 -0.76 0.00 0.00 57.45 56.89 3m7o n PHE 109 Cb 0.00 -2.57 0.00 0.00 0.35 0.00 0.00 39.48 37.26 3m7o n PHE 109 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 3m7o n SER 110 N 10.98 0.00 -0.32 -2.13 3.41 -1.26 -5.05 113.62 119.25 3m7o n SER 110 Ca 0.41 -0.77 0.02 0.00 -0.26 0.00 0.00 58.87 58.26 3m7o n SER 110 Cb 0.29 0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.40 3m7o n SER 110 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 3m7o h PHE 111 N 0.77 1.00 -3.95 7.33 0.04 -1.99 -3.42 116.94 116.73 3m7o h PHE 111 Ca 0.00 0.03 -0.49 0.00 2.80 0.00 0.00 57.97 60.30 3m7o h PHE 111 Cb 0.00 -0.32 0.03 0.00 2.20 0.00 0.00 35.95 37.86 3m7o h PHE 111 CO 0.00 0.48 0.45 0.00 -0.60 0.00 0.00 178.31 178.64 3m7o n GLY 113 N 0.52 0.75 3.79 0.00 0.00 0.11 -4.94 105.19 105.43 3m7o n GLY 113 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 3m7o n GLY 113 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3m7o s ARG 114 N -0.49 3.72 0.15 1.61 3.00 -1.05 -4.87 118.95 121.02 3m7o s ARG 114 Ca 0.00 1.44 0.10 0.00 0.00 0.00 0.00 55.73 57.27 3m7o s ARG 114 Cb 0.00 -2.11 -0.04 0.00 0.00 0.00 0.00 34.95 32.80 3m7o s ARG 114 CO 0.00 -0.51 -0.20 1.03 0.00 0.00 0.00 175.30 175.62 3m7o s ARG 115 N -3.18 1.69 0.12 3.54 0.52 -1.26 -0.53 118.95 119.85 3m7o s ARG 115 Ca 0.68 -1.32 -0.34 0.00 -0.52 0.00 0.00 55.73 54.24 3m7o s ARG 115 Cb -0.19 -2.01 -0.18 0.00 0.52 0.00 0.00 34.95 33.09 3m7o s ARG 115 CO 0.22 0.45 0.88 1.63 0.02 0.00 0.00 175.30 178.50 3m7o n LYS 116 N 0.55 0.25 0.00 3.54 5.02 -1.25 -2.07 118.16 124.20 3m7o n LYS 116 Ca -0.14 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 3m7o n LYS 116 Cb 0.54 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 3m7o n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3m7o n GLY 117 N 1.79 2.44 3.74 0.72 0.00 0.81 -5.00 105.19 109.69 3m7o n GLY 117 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3m7o n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m7o s GLU 118 N -0.63 4.26 -0.30 1.61 2.02 -0.88 -4.67 118.70 120.11 3m7o s GLU 118 Ca 0.00 2.31 -0.20 0.00 0.02 0.00 0.00 54.97 57.10 3m7o s GLU 118 Cb 0.00 -3.12 -0.01 0.00 0.10 0.00 0.00 34.13 31.10 3m7o s GLU 118 CO 0.00 -0.46 0.60 -0.65 0.02 0.00 0.00 175.26 174.77 3m7o s GLN 119 N -0.05 3.92 -0.16 1.61 -0.21 -1.26 -0.54 119.66 122.98 3m7o s GLN 119 Ca 0.61 0.28 -0.06 0.00 0.02 0.00 0.00 55.36 56.22 3m7o s GLN 119 Cb -0.42 -3.72 -0.04 0.00 1.00 0.00 0.00 33.01 29.84 3m7o s GLN 119 CO 0.41 -0.53 0.04 0.42 -2.12 0.00 0.00 175.29 173.51 3m7o s ILE 120 N 2.53 4.64 -0.09 1.08 -1.09 0.44 -4.99 121.20 123.71 3m7o s ILE 120 Ca 0.24 -0.10 -0.01 0.00 -2.23 0.00 0.00 60.65 58.55 3m7o s ILE 120 Cb -0.15 -3.06 0.03 0.00 -1.58 0.00 0.00 42.46 37.70 3m7o s ILE 120 CO 0.11 0.50 -0.03 -0.47 -1.23 0.00 0.00 174.94 173.82 3m7o s TYR 121 N 0.06 0.98 -0.15 3.97 5.04 -1.26 -1.66 117.35 124.33 3m7o s TYR 121 Ca 0.04 -0.38 0.02 0.00 -2.44 0.00 0.00 57.07 54.31 3m7o s TYR 121 Cb -0.12 -0.96 0.01 0.00 0.35 0.00 0.00 41.96 41.24 3m7o s TYR 121 CO 0.01 -0.39 -0.20 -0.47 -1.34 0.00 0.00 175.55 173.17 3m7o s TYR 122 N 1.81 2.71 -0.14 4.97 5.04 0.52 -4.99 117.35 127.27 3m7o s TYR 122 Ca 0.04 -1.25 -0.01 0.00 -2.44 0.00 0.00 57.07 53.41 3m7o s TYR 122 Cb -0.12 -1.85 0.04 0.00 0.35 0.00 0.00 41.96 40.38 3m7o s TYR 122 CO -0.06 -0.57 -0.03 0.00 -1.34 0.00 0.00 175.55 173.54 3m7o s ALA 123 N 0.84 1.23 0.00 3.97 0.00 -1.26 0.06 121.76 126.59 3m7o s ALA 123 Ca -0.06 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.27 3m7o s ALA 123 Cb -0.15 -1.03 0.00 0.00 0.00 0.00 0.00 23.12 21.94 3m7o s ALA 123 CO -0.02 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.43 3m7o n GLY 124 N 4.97 -1.73 3.86 0.00 0.00 -0.58 -4.99 105.19 106.72 3m7o n GLY 124 Ca -0.11 -1.15 -0.31 0.00 0.00 0.00 0.00 46.02 44.45 3m7o n GLY 124 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3m7o s PRO 125 N -1.62 3.71 0.34 1.61 0.04 -1.26 -0.84 135.00 136.99 3m7o s PRO 125 Ca 0.00 0.81 0.09 0.00 0.04 0.00 0.00 61.00 61.94 3m7o s PRO 125 Cb 0.00 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 3m7o s PRO 125 CO 0.00 -0.47 0.08 0.14 0.04 0.00 0.00 177.00 176.78 3m7o s VAL 126 N -3.00 2.86 -0.97 -0.36 -7.23 -0.19 -4.87 120.40 106.63 3m7o s VAL 126 Ca 0.56 -1.83 -0.01 0.00 -1.81 0.00 0.00 61.98 58.89 3m7o s VAL 126 Cb -0.11 -2.89 0.32 0.00 0.56 0.00 0.00 36.38 34.26 3m7o s VAL 126 CO 0.47 -0.20 1.58 0.59 -0.31 0.00 0.00 175.10 177.23 3m7o n ASN 127 N -1.05 6.59 -4.86 4.85 3.02 -1.26 -3.99 115.26 118.56 3m7o n ASN 127 Ca -0.04 -3.60 -0.34 0.00 -0.03 0.00 0.00 54.58 50.58 3m7o n ASN 127 Cb 0.62 -1.11 -0.05 0.00 -0.61 0.00 0.00 39.78 38.63 3m7o n ASN 127 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3m7o s ASN 128 N -1.77 6.70 0.64 6.41 4.22 -1.26 -4.93 114.94 124.95 3m7o s ASN 128 Ca 0.38 0.95 -0.13 0.00 -2.14 0.00 0.00 52.86 51.92 3m7o s ASN 128 Cb 0.16 -2.24 -0.02 0.00 1.28 0.00 0.00 41.25 40.43 3m7o s ASN 128 CO -0.05 0.05 1.05 -2.16 -2.04 0.00 0.00 177.10 173.94 3m7o s PRO 129 N -2.31 3.19 0.48 3.55 0.04 -1.26 -1.60 135.00 137.09 3m7o s PRO 129 Ca 0.41 1.02 -0.22 0.00 0.04 0.00 0.00 61.00 62.25 3m7o s PRO 129 Cb -0.13 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.32 3m7o s PRO 129 CO 0.20 -0.90 1.18 0.20 0.04 0.00 0.00 177.00 177.71 3m7o s GLY 130 N -3.43 2.76 -0.18 0.56 0.00 -1.26 -4.49 107.32 101.28 3m7o s GLY 130 Ca 0.60 0.95 -0.09 0.00 0.00 0.00 0.00 44.72 46.17 3m7o s GLY 130 CO 0.47 1.39 0.42 -2.27 0.00 0.00 0.00 173.10 173.11 3m7o s LEU 131 N -3.22 -0.20 -0.60 0.66 2.96 0.09 -4.87 118.68 113.50 3m7o s LEU 131 Ca 0.66 0.93 -0.24 0.00 -0.22 0.00 0.00 54.13 55.25 3m7o s LEU 131 Cb -0.29 1.39 0.05 0.00 0.50 0.00 0.00 46.19 47.83 3m7o s LEU 131 CO 0.34 -0.20 1.01 -1.81 -1.32 0.00 0.00 176.35 174.37 3m7o s ASP 132 N 1.57 6.29 -0.32 3.68 1.11 -1.26 0.00 116.67 127.74 3m7o s ASP 132 Ca -0.09 -0.47 -0.29 0.00 0.18 0.00 0.00 52.55 51.89 3m7o s ASP 132 Cb -0.09 -2.46 0.01 0.00 1.07 0.00 0.00 42.92 41.45 3m7o s ASP 132 CO -0.13 -1.37 1.24 -0.69 1.18 0.00 0.00 175.17 175.40 3m7o s VAL 133 N 4.27 4.22 0.47 -1.27 1.01 0.00 -4.99 120.40 124.11 3m7o s VAL 133 Ca 0.30 1.37 -0.24 0.00 0.00 0.00 0.00 61.98 63.41 3m7o s VAL 133 Cb -0.13 -4.25 -0.07 0.00 0.00 0.00 0.00 36.38 31.93 3m7o s VAL 133 CO 0.17 -0.53 1.34 -2.84 0.00 0.00 0.00 175.10 173.24 3m7o s PRO 134 N 4.10 3.58 0.12 2.72 0.02 -1.26 -4.87 135.00 139.40 3m7o s PRO 134 Ca 0.53 2.20 -0.35 0.00 0.02 0.00 0.00 61.00 63.41 3m7o s PRO 134 Cb -0.15 -2.51 -0.17 0.00 0.02 0.00 0.00 34.50 31.70 3m7o s PRO 134 CO 0.22 -0.83 1.21 0.94 -0.33 0.00 0.00 177.00 178.21 3m7o n GLN 135 N -0.44 0.98 -0.12 5.54 7.27 -1.26 -4.68 117.38 124.66 3m7o n GLN 135 Ca 0.07 0.35 0.00 0.00 0.07 0.00 0.00 57.00 57.49 3m7o n GLN 135 Cb 0.44 -1.89 0.00 0.00 2.41 0.00 0.00 30.24 31.20 3m7o n GLN 135 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3m7o n GLY 136 N 2.17 0.92 3.41 1.69 0.00 -0.14 -4.96 105.19 108.28 3m7o n GLY 136 Ca 0.17 -1.90 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 3m7o n GLY 136 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m7o s GLU 137 N -1.76 2.46 0.08 1.61 2.12 -1.26 -0.50 118.70 121.46 3m7o s GLU 137 Ca 0.00 -0.77 0.05 0.00 0.36 0.00 0.00 54.97 54.61 3m7o s GLU 137 Cb 0.00 -2.29 -0.03 0.00 0.26 0.00 0.00 34.13 32.07 3m7o s GLU 137 CO 0.00 0.56 -0.13 0.71 -0.54 0.00 0.00 175.26 175.87 3m7o s TYR 138 N -0.59 1.16 -0.10 5.30 2.02 0.78 -4.52 117.35 121.39 3m7o s TYR 138 Ca 0.08 -0.51 0.01 0.00 -0.37 0.00 0.00 57.07 56.28 3m7o s TYR 138 Cb -0.11 -0.64 -0.02 0.00 -0.40 0.00 0.00 41.96 40.78 3m7o s TYR 138 CO 0.01 0.04 -0.11 -0.65 -1.57 0.00 0.00 175.55 173.27 3m7o s GLN 139 N -2.06 3.04 -0.06 -0.62 1.11 -0.16 -0.83 119.66 120.08 3m7o s GLN 139 Ca 0.00 -0.64 0.01 0.00 0.01 0.00 0.00 55.36 54.74 3m7o s GLN 139 Cb -0.08 -2.58 0.02 0.00 -1.01 0.00 0.00 33.01 29.36 3m7o s GLN 139 CO 0.02 0.43 -0.07 -1.17 0.01 0.00 0.00 175.29 174.50 3m7o s LEU 140 N -0.19 1.36 -0.14 2.90 2.96 -0.04 -0.80 118.68 124.72 3m7o s LEU 140 Ca 0.01 -0.20 -0.00 0.00 -0.22 0.00 0.00 54.13 53.72 3m7o s LEU 140 Cb -0.13 -0.62 -0.01 0.00 0.50 0.00 0.00 46.19 45.93 3m7o s LEU 140 CO 0.03 -0.04 -0.13 -0.22 -1.32 0.00 0.00 176.35 174.66 3m7o s LEU 141 N 1.01 2.64 -0.13 -0.68 2.96 0.00 0.08 118.68 124.56 3m7o s LEU 141 Ca -0.09 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.46 3m7o s LEU 141 Cb -0.14 -1.60 0.00 0.00 0.50 0.00 0.00 46.19 44.95 3m7o s LEU 141 CO -0.00 0.12 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.20 3m7o s LEU 142 N 0.59 2.27 -0.12 -0.68 1.43 -0.43 -0.78 118.68 120.97 3m7o s LEU 142 Ca -0.08 -0.53 -0.00 0.00 -1.03 0.00 0.00 54.13 52.49 3m7o s LEU 142 Cb -0.16 -1.49 0.02 0.00 0.03 0.00 0.00 46.19 44.60 3m7o s LEU 142 CO 0.03 0.11 -0.09 -1.61 0.23 0.00 0.00 176.35 175.02 3m7o s GLU 143 N 0.64 1.66 -0.17 1.70 2.02 0.09 -0.84 118.70 123.80 3m7o s GLU 143 Ca -0.10 -0.31 -0.05 0.00 0.02 0.00 0.00 54.97 54.53 3m7o s GLU 143 Cb -0.16 -1.66 -0.03 0.00 0.10 0.00 0.00 34.13 32.38 3m7o s GLU 143 CO 0.02 -0.24 -0.01 -0.51 0.02 0.00 0.00 175.26 174.54 3m7o s LEU 144 N 1.60 3.36 0.13 1.80 1.43 0.42 -0.68 118.68 126.74 3m7o s LEU 144 Ca 0.04 -0.10 -0.06 0.00 -1.03 0.00 0.00 54.13 52.97 3m7o s LEU 144 Cb -0.13 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 3m7o s LEU 144 CO -0.08 0.15 0.18 -0.72 0.23 0.00 0.00 176.35 176.11 3m7o s TYR 145 N 0.49 0.46 0.00 0.29 -0.85 -0.51 -0.37 117.35 116.86 3m7o s TYR 145 Ca -0.02 -0.86 0.00 0.00 -0.52 0.00 0.00 57.07 55.67 3m7o s TYR 145 Cb -0.14 -0.19 0.00 0.00 0.38 0.00 0.00 41.96 42.01 3m7o s TYR 145 CO 0.02 -0.60 0.00 0.27 -1.52 0.00 0.00 175.55 173.72 3m7o n ASN 146 N -0.12 0.12 0.15 -0.18 0.23 -0.64 -0.94 115.26 113.87 3m7o n ASN 146 Ca -0.09 -0.73 0.13 0.00 -0.53 0.00 0.00 54.58 53.35 3m7o n ASN 146 Cb 0.63 0.00 0.51 0.00 -2.08 0.00 0.00 39.78 38.84 3m7o n ASN 146 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3m7o h GLU 147 N 0.00 0.00 -0.61 -3.83 9.09 -1.85 -1.39 114.58 115.99 3m7o h GLU 147 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3m7o h GLU 147 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3m7o h GLU 147 CO 0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 3m7o n ASN 148 N -2.33 4.23 -1.66 3.06 3.02 -1.26 -4.95 115.26 115.37 3m7o n ASN 148 Ca 0.02 -2.30 -0.18 0.00 -0.03 0.00 0.00 54.58 52.10 3m7o n ASN 148 Cb 0.24 -0.50 -0.04 0.00 -0.61 0.00 0.00 39.78 38.86 3m7o n ASN 148 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3m7o n ARG 149 N 1.08 -1.31 -3.19 3.52 1.74 -0.52 -4.98 116.66 113.00 3m7o n ARG 149 Ca 0.23 1.00 -0.39 0.00 -0.77 0.00 0.00 57.85 57.92 3m7o n ARG 149 Cb 0.75 -5.35 -0.05 0.00 -1.02 0.00 0.00 32.46 26.78 3m7o n ARG 149 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3m7o s ALA 150 N -2.76 3.44 0.05 7.54 0.00 -1.26 -4.81 121.76 123.96 3m7o s ALA 150 Ca 0.00 0.01 -0.31 0.00 0.00 0.00 0.00 51.96 51.66 3m7o s ALA 150 Cb 0.00 -2.78 -0.07 0.00 0.00 0.00 0.00 23.12 20.27 3m7o s ALA 150 CO 0.00 0.05 1.57 0.99 0.00 0.00 0.00 175.76 178.37 3m7o s THR 151 N 0.29 3.25 -0.23 0.00 2.01 -1.26 -1.62 115.64 118.08 3m7o s THR 151 Ca 0.32 0.68 -0.03 0.00 0.31 0.00 0.00 61.69 62.97 3m7o s THR 151 Cb -0.17 -3.44 -0.19 0.00 0.01 0.00 0.00 72.50 68.71 3m7o s THR 151 CO 0.16 -0.00 -0.09 0.52 -0.69 0.00 0.00 174.62 174.52 3m7o n VAL 152 N 4.70 1.56 -3.72 3.82 0.31 0.50 -4.87 118.33 120.64 3m7o n VAL 152 Ca 0.15 -0.55 -0.14 0.00 -0.01 0.00 0.00 64.34 63.79 3m7o n VAL 152 Cb 0.41 -1.57 -0.08 0.00 -0.91 0.00 0.00 33.84 31.70 3m7o n VAL 152 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3m7o s ALA 153 N -2.52 -0.95 -0.07 3.52 0.00 -0.93 -4.82 121.76 115.99 3m7o s ALA 153 Ca -0.32 0.47 -0.03 0.00 0.00 0.00 0.00 51.96 52.08 3m7o s ALA 153 Cb 0.09 0.09 0.04 0.00 0.00 0.00 0.00 23.12 23.34 3m7o s ALA 153 CO 0.63 -0.29 0.15 0.00 0.00 0.00 0.00 175.76 176.24 3m7o s ALA 155 N 1.29 0.39 -0.12 0.00 0.00 -0.02 -0.75 121.76 122.56 3m7o s ALA 155 Ca -0.08 0.08 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 3m7o s ALA 155 Cb -0.12 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.67 3m7o s ALA 155 CO -0.06 -0.03 0.03 0.54 0.00 0.00 0.00 175.76 176.24 3m7o s ASN 156 N 0.82 5.48 0.09 0.00 4.22 -0.23 -1.31 114.94 124.01 3m7o s ASN 156 Ca -0.09 0.17 0.04 0.00 -2.14 0.00 0.00 52.86 50.83 3m7o s ASN 156 Cb -0.12 -1.70 -0.03 0.00 1.28 0.00 0.00 41.25 40.68 3m7o s ASN 156 CO -0.01 0.33 -0.11 0.00 -2.04 0.00 0.00 177.10 175.27 3m7o s ALA 157 N -0.55 1.10 -0.08 3.54 0.00 0.11 -0.82 121.76 125.05 3m7o s ALA 157 Ca 0.10 -1.14 0.05 0.00 0.00 0.00 0.00 51.96 50.97 3m7o s ALA 157 Cb -0.12 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.00 3m7o s ALA 157 CO 0.02 -0.00 -0.24 0.99 0.00 0.00 0.00 175.76 176.53 3m7o s THR 158 N -2.21 2.10 -0.15 0.00 2.01 0.29 -0.86 115.64 116.82 3m7o s THR 158 Ca 0.04 -1.03 0.01 0.00 0.31 0.00 0.00 61.69 61.02 3m7o s THR 158 Cb -0.04 -1.78 0.01 0.00 0.01 0.00 0.00 72.50 70.70 3m7o s THR 158 CO 0.00 0.56 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.62 3m7o s VAL 159 N 0.07 2.26 -0.17 3.82 1.01 -0.01 -1.56 120.40 125.83 3m7o s VAL 159 Ca -0.11 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 60.98 3m7o s VAL 159 Cb -0.16 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.31 3m7o s VAL 159 CO 0.06 0.54 -0.20 -0.89 0.00 0.00 0.00 175.10 174.61 3m7o s THR 160 N 0.90 2.11 -0.20 3.92 2.01 0.24 -0.16 115.64 124.47 3m7o s THR 160 Ca -0.04 -0.94 -0.06 0.00 0.31 0.00 0.00 61.69 60.96 3m7o s THR 160 Cb -0.15 -1.87 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 3m7o s THR 160 CO -0.03 0.54 0.01 -0.55 -0.69 0.00 0.00 174.62 173.90 3m7o s SER 161 N 1.12 4.98 0.00 3.53 0.15 0.35 -1.04 113.70 122.79 3m7o s SER 161 Ca 0.01 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.50 3m7o s SER 161 Cb -0.14 -1.85 0.00 0.00 -1.71 0.00 0.00 66.02 62.32 3m7o s SER 161 CO -0.09 0.08 0.00 -1.54 1.20 0.00 0.00 173.24 172.89