#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 2.50 0.55 1.61 0.52 -1.26 -4.99 118.94 117.88 3m7o s TRP 27 Ca 0.00 1.54 -0.21 0.00 0.02 0.00 0.00 56.10 57.45 3m7o s TRP 27 Cb 0.00 -3.34 -0.05 0.00 -1.15 0.00 0.00 33.47 28.94 3m7o s TRP 27 CO 0.00 -1.91 1.31 -1.25 0.02 0.00 0.00 176.95 175.13 3m7o s PRO 28 N -3.56 3.12 0.47 4.98 0.04 -1.26 -4.82 135.00 133.97 3m7o s PRO 28 Ca 0.73 2.12 -0.22 0.00 0.04 0.00 0.00 61.00 63.68 3m7o s PRO 28 Cb -0.26 -2.19 -0.08 0.00 0.04 0.00 0.00 34.50 32.01 3m7o s PRO 28 CO 0.34 -1.17 1.09 0.15 0.04 0.00 0.00 177.00 177.45 3m7o s LYS 29 N -2.98 3.78 0.03 4.56 1.02 -1.26 -4.63 119.74 120.26 3m7o s LYS 29 Ca 0.73 1.55 0.05 0.00 0.02 0.00 0.00 55.97 58.31 3m7o s LYS 29 Cb -0.38 -2.26 -0.02 0.00 -0.52 0.00 0.00 37.83 34.65 3m7o s LYS 29 CO 0.44 -0.48 -0.14 -1.01 -0.92 0.00 0.00 175.35 173.24 3m7o s HIS 30 N -1.75 1.20 -0.33 3.18 3.76 0.11 -4.99 115.29 116.46 3m7o s HIS 30 Ca 0.65 -0.34 -0.19 0.00 -0.15 0.00 0.00 55.06 55.03 3m7o s HIS 30 Cb -0.22 -0.72 -0.01 0.00 1.11 0.00 0.00 32.58 32.74 3m7o s HIS 30 CO 0.27 0.02 0.57 0.99 -0.85 0.00 0.00 174.74 175.74 3m7o s THR 31 N -0.79 4.97 0.13 1.30 2.01 -1.26 -0.52 115.64 121.48 3m7o s THR 31 Ca 0.02 0.56 -0.07 0.00 0.31 0.00 0.00 61.69 62.51 3m7o s THR 31 Cb -0.07 -3.99 -0.16 0.00 0.01 0.00 0.00 72.50 68.29 3m7o s THR 31 CO 0.01 -0.20 1.33 0.00 -0.69 0.00 0.00 174.62 175.07 3m7o h ALA 32 N 8.37 0.39 -2.43 7.40 0.00 -0.99 -3.46 119.26 128.53 3m7o h ALA 32 Ca -0.27 -0.65 0.08 0.00 0.00 0.00 0.00 54.91 54.06 3m7o h ALA 32 Cb 1.12 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 18.75 3m7o h ALA 32 CO 0.79 0.75 0.43 0.00 0.00 0.00 0.00 179.25 181.22 3m7o s ASN 34 N -2.51 -0.17 -0.13 0.00 3.84 -1.25 -0.72 114.94 114.00 3m7o s ASN 34 Ca 0.04 -0.19 -0.30 0.00 0.21 0.00 0.00 52.86 52.62 3m7o s ASN 34 Cb -0.01 1.36 0.12 0.00 -0.55 0.00 0.00 41.25 42.17 3m7o s ASN 34 CO -0.10 -0.34 0.96 -0.55 -2.79 0.00 0.00 177.10 174.29 3m7o s SER 35 N 2.62 -0.38 -1.55 -4.21 0.15 -0.61 -4.98 113.70 104.74 3m7o s SER 35 Ca 0.10 0.34 0.00 0.00 0.70 0.00 0.00 55.95 57.09 3m7o s SER 35 Cb -0.12 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.52 3m7o s SER 35 CO -0.28 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 174.36 3m7o n GLY 36 N 0.54 -0.02 1.42 9.45 0.00 -1.25 -1.52 105.19 113.82 3m7o n GLY 36 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.79 0.63 3.08 -0.02 0.00 -1.26 -1.51 105.19 105.32 3m7o n GLY 37 Ca -0.20 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 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 1.86 -0.12 0.99 2.96 -0.57 -0.89 118.68 122.91 3m7o s LEU 38 Ca 0.00 -0.52 -0.01 0.00 -0.22 0.00 0.00 54.13 53.38 3m7o s LEU 38 Cb 0.00 -1.26 -0.02 0.00 0.50 0.00 0.00 46.19 45.41 3m7o s LEU 38 CO 0.00 0.01 -0.10 -0.70 -1.32 0.00 0.00 176.35 174.24 3m7o s GLU 39 N 1.15 3.34 -0.15 1.98 2.12 -0.06 -1.58 118.70 125.49 3m7o s GLU 39 Ca -0.01 -0.63 0.00 0.00 0.36 0.00 0.00 54.97 54.69 3m7o s GLU 39 Cb -0.14 -2.68 0.03 0.00 0.26 0.00 0.00 34.13 31.59 3m7o s GLU 39 CO -0.06 0.30 -0.11 0.08 -0.54 0.00 0.00 175.26 174.92 3m7o s VAL 40 N 0.16 1.44 -0.05 3.70 1.01 0.10 -0.28 120.40 126.48 3m7o s VAL 40 Ca -0.05 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.34 3m7o s VAL 40 Cb -0.15 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 3m7o s VAL 40 CO 0.04 0.35 -0.22 -0.69 0.00 0.00 0.00 175.10 174.58 3m7o s VAL 41 N 1.52 1.84 0.16 2.92 1.01 -0.59 -0.54 120.40 126.73 3m7o s VAL 41 Ca 0.03 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.11 3m7o s VAL 41 Cb -0.14 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 3m7o s VAL 41 CO -0.10 0.52 -0.10 -0.72 0.00 0.00 0.00 175.10 174.70 3m7o s TYR 42 N -0.13 1.34 -0.03 5.22 -0.85 0.32 -0.50 117.35 122.72 3m7o s TYR 42 Ca -0.03 -0.74 0.00 0.00 -0.52 0.00 0.00 57.07 55.79 3m7o s TYR 42 Cb -0.13 -0.67 0.03 0.00 0.38 0.00 0.00 41.96 41.57 3m7o s TYR 42 CO 0.03 0.12 0.00 -1.14 -1.52 0.00 0.00 175.55 173.04 3m7o s GLN 43 N -3.74 0.28 0.23 -3.49 0.74 -0.20 -0.71 119.66 112.78 3m7o s GLN 43 Ca 0.18 0.08 -0.31 0.00 0.05 0.00 0.00 55.36 55.36 3m7o s GLN 43 Cb 0.02 -0.47 -0.11 0.00 1.10 0.00 0.00 33.01 33.54 3m7o s GLN 43 CO 0.02 -0.14 1.66 0.45 -0.55 0.00 0.00 175.29 176.73 3m7o s SER 44 N 1.03 6.40 -0.13 6.67 0.15 -1.26 -1.53 113.70 125.03 3m7o s SER 44 Ca -0.10 2.86 0.17 0.00 0.70 0.00 0.00 55.95 59.58 3m7o s SER 44 Cb -0.13 -2.61 0.68 0.00 -1.71 0.00 0.00 66.02 62.24 3m7o s SER 44 CO -0.02 -0.93 1.59 0.00 1.20 0.00 0.00 173.24 175.08 3m7o s ASP 46 N -1.04 6.42 0.60 0.00 3.68 -1.25 -4.91 116.67 120.17 3m7o s ASP 46 Ca 0.48 0.23 0.37 0.00 2.13 0.00 0.00 52.55 55.77 3m7o s ASP 46 Cb 0.33 -2.31 1.93 0.00 -1.45 0.00 0.00 42.92 41.42 3m7o s ASP 46 CO 0.20 -0.50 2.22 1.55 0.13 0.00 0.00 175.17 178.77 3m7o h PRO 47 N 8.33 0.00 0.02 4.34 0.13 -1.98 -3.05 132.00 139.79 3m7o h PRO 47 Ca -0.27 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.65 3m7o h PRO 47 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 3m7o h PRO 47 CO 0.80 0.03 -0.95 -0.07 -0.23 0.00 0.00 178.00 177.57 3m7o h LEU 48 N 0.00 0.12 -7.19 1.56 3.38 -2.00 -3.48 115.31 107.70 3m7o h LEU 48 Ca -0.00 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3m7o h LEU 48 Cb 0.18 -0.04 -0.11 0.00 0.09 0.00 0.00 40.66 40.78 3m7o h LEU 48 CO 0.00 1.00 0.21 0.00 0.09 0.00 0.00 178.44 179.75 3m7o s GLN 49 N -2.94 1.38 0.55 1.13 -2.07 -1.15 -5.17 119.66 111.38 3m7o s GLN 49 Ca -0.01 -0.57 0.09 0.00 -1.82 0.00 0.00 55.36 53.05 3m7o s GLN 49 Cb 0.10 0.59 0.07 0.00 -1.09 0.00 0.00 33.01 32.68 3m7o s GLN 49 CO 0.82 -0.61 0.69 0.34 -1.32 0.00 0.00 175.29 175.22 3m7o s ASP 50 N -2.78 5.09 0.15 12.60 3.68 -1.26 -4.40 116.67 129.76 3m7o s ASP 50 Ca 0.03 -0.86 -0.19 0.00 2.13 0.00 0.00 52.55 53.66 3m7o s ASP 50 Cb -0.02 0.18 0.05 0.00 -1.45 0.00 0.00 42.92 41.68 3m7o s ASP 50 CO -0.09 -1.22 0.51 0.72 0.13 0.00 0.00 175.17 175.22 3m7o s PHE 51 N -2.64 -0.32 -0.13 -5.34 -0.12 -1.26 -4.79 117.98 103.37 3m7o s PHE 51 Ca 0.56 0.04 -0.04 0.00 -0.05 0.00 0.00 56.93 57.45 3m7o s PHE 51 Cb -0.06 0.41 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 3m7o s PHE 51 CO 0.35 -0.81 -0.01 0.20 -0.05 0.00 0.00 175.22 174.91 3m7o s GLY 52 N -2.80 1.80 -0.09 1.99 0.00 -0.19 -4.97 107.32 103.06 3m7o s GLY 52 Ca 0.03 -0.80 -0.04 0.00 0.00 0.00 0.00 44.72 43.91 3m7o s GLY 52 CO -0.10 -0.24 0.19 -2.27 0.00 0.00 0.00 173.10 170.68 3m7o s LEU 53 N -0.11 0.25 0.05 0.66 2.96 -1.25 -0.59 118.68 120.66 3m7o s LEU 53 Ca 0.04 0.41 0.05 0.00 -0.22 0.00 0.00 54.13 54.40 3m7o s LEU 53 Cb -0.13 0.48 -0.03 0.00 0.50 0.00 0.00 46.19 47.02 3m7o s LEU 53 CO 0.02 -0.20 -0.14 -0.94 -1.32 0.00 0.00 176.35 173.78 3m7o s SER 54 N 1.73 1.61 -0.08 3.68 1.04 0.15 -4.25 113.70 117.57 3m7o s SER 54 Ca -0.04 -0.53 0.04 0.00 0.48 0.00 0.00 55.95 55.90 3m7o s SER 54 Cb -0.12 -0.07 -0.00 0.00 0.10 0.00 0.00 66.02 65.93 3m7o s SER 54 CO -0.07 -0.03 -0.22 -0.63 0.98 0.00 0.00 173.24 173.27 3m7o s ILE 55 N -1.07 1.85 0.15 -1.02 1.01 0.06 -1.07 121.20 121.12 3m7o s ILE 55 Ca -0.01 -0.92 -0.10 0.00 0.00 0.00 0.00 60.65 59.62 3m7o s ILE 55 Cb -0.09 -1.60 -0.06 0.00 0.01 0.00 0.00 42.46 40.72 3m7o s ILE 55 CO 0.02 0.52 0.48 -0.62 0.00 0.00 0.00 174.94 175.33 3m7o s ASP 56 N 0.20 6.66 -1.50 3.58 2.15 -0.29 -4.42 116.67 123.05 3m7o s ASP 56 Ca -0.12 0.87 -0.06 0.00 0.43 0.00 0.00 52.55 53.66 3m7o s ASP 56 Cb -0.16 -2.20 0.01 0.00 -0.30 0.00 0.00 42.92 40.27 3m7o s ASP 56 CO 0.06 0.07 0.75 0.00 -0.17 0.00 0.00 175.17 175.88 3m7o n GLN 57 N 0.45 -5.58 -1.78 4.34 6.02 -1.26 -4.47 117.38 115.09 3m7o n GLN 57 Ca -0.04 0.86 -0.39 0.00 -0.01 0.00 0.00 57.00 57.42 3m7o n GLN 57 Cb 0.52 -5.76 0.03 0.00 1.02 0.00 0.00 30.24 26.05 3m7o n GLN 57 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3m7o s SER 59 N -0.74 -0.28 0.27 0.00 1.04 -1.22 -3.81 113.70 108.97 3m7o s SER 59 Ca 0.67 -0.14 -0.02 0.00 0.48 0.00 0.00 55.95 56.94 3m7o s SER 59 Cb -0.42 0.40 0.44 0.00 0.10 0.00 0.00 66.02 66.53 3m7o s SER 59 CO 0.52 -0.68 1.87 0.11 0.98 0.00 0.00 173.24 176.04 3m7o h LYS 60 N 2.00 1.07 -5.11 4.02 1.57 -1.50 -3.20 116.57 115.43 3m7o h LYS 60 Ca -0.23 -0.06 -0.67 0.00 -1.87 0.00 0.00 60.65 57.82 3m7o h LYS 60 Cb 1.23 -0.24 -0.17 0.00 0.08 0.00 0.00 32.23 33.13 3m7o h LYS 60 CO 0.29 0.71 0.56 -0.65 -0.57 0.00 0.00 179.45 179.78 3m7o s GLN 61 N -6.02 3.29 -0.11 3.15 1.11 -1.26 -0.67 119.66 119.15 3m7o s GLN 61 Ca -0.12 -1.30 -0.30 0.00 0.01 0.00 0.00 55.36 53.65 3m7o s GLN 61 Cb 0.21 -4.49 -0.02 0.00 -1.01 0.00 0.00 33.01 27.69 3m7o s GLN 61 CO 0.81 -1.74 1.23 0.42 0.01 0.00 0.00 175.29 176.02 3m7o s ILE 62 N 3.21 4.26 0.52 1.08 1.01 0.21 -4.94 121.20 126.55 3m7o s ILE 62 Ca 0.24 1.56 -0.20 0.00 0.00 0.00 0.00 60.65 62.25 3m7o s ILE 62 Cb -0.14 -4.01 -0.07 0.00 0.01 0.00 0.00 42.46 38.26 3m7o s ILE 62 CO 0.02 -0.07 1.10 0.00 0.00 0.00 0.00 174.94 175.99 3m7o s GLN 63 N 2.85 3.52 0.69 2.79 -2.07 -1.26 -1.60 119.66 124.57 3m7o s GLN 63 Ca 0.55 1.53 -0.16 0.00 -1.82 0.00 0.00 55.36 55.47 3m7o s GLN 63 Cb -0.23 -2.05 0.02 0.00 -1.09 0.00 0.00 33.01 29.66 3m7o s GLN 63 CO 0.18 -0.70 1.19 -1.54 -1.32 0.00 0.00 175.29 173.10 3m7o s SER 64 N -1.83 4.54 -1.18 12.60 1.04 -1.26 -4.01 113.70 123.60 3m7o s SER 64 Ca 0.71 2.28 -0.09 0.00 0.48 0.00 0.00 55.95 59.33 3m7o s SER 64 Cb -0.21 -2.58 -0.02 0.00 0.10 0.00 0.00 66.02 63.30 3m7o s SER 64 CO 0.25 -2.03 0.80 0.59 0.98 0.00 0.00 173.24 173.83 3m7o n ASN 65 N -2.49 -4.12 -4.66 7.02 5.03 -0.48 -4.90 115.26 110.66 3m7o n ASN 65 Ca 0.13 -0.86 -0.39 0.00 0.87 0.00 0.00 54.58 54.33 3m7o n ASN 65 Cb 0.50 -4.14 0.04 0.00 -1.02 0.00 0.00 39.78 35.16 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 -3.96 4.10 -4.77 3.41 4.77 -1.25 -4.62 117.00 114.68 3m7o n LEU 66 Ca -0.16 0.91 -0.38 0.00 -0.03 0.00 0.00 56.01 56.35 3m7o n LEU 66 Cb 0.63 -1.45 -0.06 0.00 -2.33 0.00 0.00 43.42 40.22 3m7o n LEU 66 CO 0.65 -1.34 0.18 0.21 -1.33 0.00 0.00 177.39 175.76 3m7o s ASN 67 N -1.02 6.79 0.24 -1.43 2.47 -1.26 -0.73 114.94 119.99 3m7o s ASN 67 Ca 0.72 0.93 0.08 0.00 0.42 0.00 0.00 52.86 55.01 3m7o s ASN 67 Cb -0.45 -2.29 -0.05 0.00 -1.45 0.00 0.00 41.25 37.01 3m7o s ASN 67 CO 0.50 0.13 -0.11 0.27 -3.72 0.00 0.00 177.10 174.16 3m7o s ILE 68 N -0.09 1.74 -0.12 -5.21 -4.36 -0.19 -1.13 121.20 111.84 3m7o s ILE 68 Ca 0.26 -2.19 0.03 0.00 -0.26 0.00 0.00 60.65 58.49 3m7o s ILE 68 Cb -0.16 -2.23 0.01 0.00 1.25 0.00 0.00 42.46 41.33 3m7o s ILE 68 CO 0.13 -0.46 -0.21 -0.13 0.24 0.00 0.00 174.94 174.51 3m7o s ARG 69 N -3.67 2.83 -0.06 0.37 0.52 -0.23 -1.33 118.95 117.37 3m7o s ARG 69 Ca 0.26 -0.79 0.01 0.00 -0.52 0.00 0.00 55.73 54.69 3m7o s ARG 69 Cb 0.01 -2.27 0.02 0.00 0.52 0.00 0.00 34.95 33.23 3m7o s ARG 69 CO 0.09 0.01 -0.06 0.12 0.02 0.00 0.00 175.30 175.49 3m7o s PHE 70 N 0.76 0.96 -0.09 -0.53 5.36 0.67 -0.68 117.98 124.43 3m7o s PHE 70 Ca -0.09 -0.33 0.01 0.00 -0.96 0.00 0.00 56.93 55.55 3m7o s PHE 70 Cb -0.16 -0.84 0.02 0.00 -0.34 0.00 0.00 43.02 41.70 3m7o s PHE 70 CO 0.00 -0.27 -0.10 0.20 -1.46 0.00 0.00 175.22 173.59 3m7o s GLY 71 N 1.15 0.81 0.00 13.12 0.00 0.25 -0.29 107.32 122.36 3m7o s GLY 71 Ca -0.07 -0.48 -0.20 0.00 0.00 0.00 0.00 44.72 43.96 3m7o s GLY 71 CO -0.01 0.48 0.45 -1.50 0.00 0.00 0.00 173.10 172.52 3m7o s ILE 72 N 1.21 0.04 -0.31 0.90 2.07 -0.65 -1.02 121.20 123.43 3m7o s ILE 72 Ca -0.04 -0.33 -0.18 0.00 -1.41 0.00 0.00 60.65 58.68 3m7o s ILE 72 Cb -0.14 -0.85 -0.01 0.00 0.13 0.00 0.00 42.46 41.59 3m7o s ILE 72 CO -0.03 -0.18 0.53 -0.63 -1.91 0.00 0.00 174.94 172.72 3m7o s ILE 73 N -1.77 5.02 0.01 2.00 1.01 -1.26 0.15 121.20 126.37 3m7o s ILE 73 Ca -0.10 0.62 -0.30 0.00 0.00 0.00 0.00 60.65 60.87 3m7o s ILE 73 Cb -0.02 -3.92 -0.07 0.00 0.01 0.00 0.00 42.46 38.46 3m7o s ILE 73 CO 0.03 -0.10 1.71 -0.76 0.00 0.00 0.00 174.94 175.82 3m7o s LEU 74 N 2.41 4.36 -0.10 2.97 1.43 -0.04 -4.86 118.68 124.84 3m7o s LEU 74 Ca 0.21 2.42 0.17 0.00 -1.03 0.00 0.00 54.13 55.89 3m7o s LEU 74 Cb -0.15 -3.55 0.63 0.00 0.03 0.00 0.00 46.19 43.15 3m7o s LEU 74 CO 0.12 -0.93 1.54 0.54 0.23 0.00 0.00 176.35 177.85 3m7o n ARG 75 N 6.57 3.49 -3.73 1.70 5.12 -1.26 -0.40 116.66 128.14 3m7o n ARG 75 Ca 0.17 -2.75 -0.14 0.00 -1.93 0.00 0.00 57.85 53.20 3m7o n ARG 75 Cb 0.42 -1.79 -0.08 0.00 -1.16 0.00 0.00 32.46 29.85 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 -1.86 0.71 0.21 5.56 -1.52 -1.26 -4.95 119.66 116.54 3m7o s GLN 76 Ca 0.45 -0.14 -0.30 0.00 -1.95 0.00 0.00 55.36 53.43 3m7o s GLN 76 Cb 0.30 0.32 -0.08 0.00 -0.22 0.00 0.00 33.01 33.32 3m7o s GLN 76 CO 0.21 -0.20 1.17 -0.51 -0.25 0.00 0.00 175.29 175.71 3m7o s ASP 77 N -1.30 7.13 -0.34 5.90 1.11 -1.26 -3.75 116.67 124.16 3m7o s ASP 77 Ca -0.13 2.24 -0.13 0.00 0.18 0.00 0.00 52.55 54.71 3m7o s ASP 77 Cb -0.05 -2.61 -0.02 0.00 1.07 0.00 0.00 42.92 41.32 3m7o s ASP 77 CO 0.05 -0.32 0.23 -0.63 1.18 0.00 0.00 175.17 175.68 3m7o s ILE 78 N -0.31 5.24 -0.09 0.77 1.01 -0.61 -4.89 121.20 122.31 3m7o s ILE 78 Ca 0.51 -0.23 -0.11 0.00 0.00 0.00 0.00 60.65 60.82 3m7o s ILE 78 Cb -0.32 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 3m7o s ILE 78 CO 0.38 -0.00 -0.21 -1.14 0.00 0.00 0.00 174.94 173.96 3m7o n ARG 79 N 5.10 0.32 -4.23 2.79 3.00 -1.26 -1.93 116.66 120.46 3m7o n ARG 79 Ca -0.13 0.13 -0.32 0.00 -0.00 0.00 0.00 57.85 57.53 3m7o n ARG 79 Cb 0.50 -1.05 -0.08 0.00 0.00 0.00 0.00 32.46 31.83 3m7o n ARG 79 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 3m7o s LYS 80 N -2.38 2.71 0.01 -0.14 -0.14 -1.26 -4.58 119.74 113.95 3m7o s LYS 80 Ca -0.18 -0.69 0.01 0.00 -1.36 0.00 0.00 55.97 53.76 3m7o s LYS 80 Cb 0.02 -2.63 -0.01 0.00 -1.68 0.00 0.00 37.83 33.54 3m7o s LYS 80 CO 0.26 0.60 -0.04 -1.17 -0.76 0.00 0.00 175.35 174.24 3m7o s LEU 81 N -1.83 2.07 0.02 3.17 2.96 -1.26 -3.79 118.68 120.03 3m7o s LEU 81 Ca 0.22 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 53.95 3m7o s LEU 81 Cb -0.12 -0.15 -0.02 0.00 0.50 0.00 0.00 46.19 46.41 3m7o s LEU 81 CO 0.13 -0.04 -0.06 -0.36 -1.32 0.00 0.00 176.35 174.71 3m7o s PHE 82 N -0.45 0.50 -0.16 5.38 0.08 0.07 -0.72 117.98 122.67 3m7o s PHE 82 Ca -0.02 -0.36 -0.00 0.00 0.12 0.00 0.00 56.93 56.67 3m7o s PHE 82 Cb -0.04 -0.31 -0.00 0.00 -0.57 0.00 0.00 43.02 42.10 3m7o s PHE 82 CO -0.00 -0.07 -0.15 -1.17 -0.10 0.00 0.00 175.22 173.73 3m7o s LEU 83 N -1.05 2.49 -0.11 -0.37 2.96 -0.04 -1.60 118.68 120.96 3m7o s LEU 83 Ca -0.07 -0.48 -0.04 0.00 -0.22 0.00 0.00 54.13 53.32 3m7o s LEU 83 Cb -0.07 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 3m7o s LEU 83 CO -0.00 0.07 0.05 -1.81 -1.32 0.00 0.00 176.35 173.34 3m7o s ASP 84 N 0.92 5.62 -0.10 3.68 1.11 0.31 -0.54 116.67 127.66 3m7o s ASP 84 Ca -0.03 0.22 0.01 0.00 0.18 0.00 0.00 52.55 52.93 3m7o s ASP 84 Cb -0.15 -1.73 0.02 0.00 1.07 0.00 0.00 42.92 42.13 3m7o s ASP 84 CO -0.02 0.35 -0.11 -0.63 1.18 0.00 0.00 175.17 175.94 3m7o s ILE 85 N -0.70 1.21 -0.17 0.77 1.01 0.09 -1.03 121.20 122.39 3m7o s ILE 85 Ca 0.12 -0.45 -0.01 0.00 0.00 0.00 0.00 60.65 60.30 3m7o s ILE 85 Cb -0.12 -1.16 -0.00 0.00 0.01 0.00 0.00 42.46 41.19 3m7o s ILE 85 CO 0.02 0.39 -0.12 -0.89 0.00 0.00 0.00 174.94 174.34 3m7o s THR 86 N 1.24 2.88 -0.13 2.92 2.01 -0.02 -0.29 115.64 124.25 3m7o s THR 86 Ca -0.03 -0.69 -0.23 0.00 0.31 0.00 0.00 61.69 61.06 3m7o s THR 86 Cb -0.14 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.10 3m7o s THR 86 CO -0.04 0.49 0.69 -0.22 -0.69 0.00 0.00 174.62 174.85 3m7o s LEU 87 N 0.96 4.24 0.15 4.42 2.96 0.28 -1.05 118.68 130.64 3m7o s LEU 87 Ca -0.02 1.06 0.04 0.00 -0.22 0.00 0.00 54.13 54.98 3m7o s LEU 87 Cb -0.15 -3.03 -0.04 0.00 0.50 0.00 0.00 46.19 43.48 3m7o s LEU 87 CO -0.01 -0.20 0.19 -0.04 -1.32 0.00 0.00 176.35 174.96 3m7o s MET 88 N 1.35 3.11 -0.26 1.98 -1.94 -0.33 -1.42 119.30 121.80 3m7o s MET 88 Ca 0.34 -0.75 -0.02 0.00 -1.71 0.00 0.00 55.69 53.55 3m7o s MET 88 Cb -0.17 -2.78 0.15 0.00 2.01 0.00 0.00 34.83 34.04 3m7o s MET 88 CO 0.14 0.50 0.43 0.00 -0.01 0.00 0.00 175.02 176.09 3m7o s ALA 89 N -1.73 -1.37 -1.26 3.03 0.00 0.13 -4.36 121.76 116.20 3m7o s ALA 89 Ca 0.32 1.15 -0.04 0.00 0.00 0.00 0.00 51.96 53.40 3m7o s ALA 89 Cb -0.11 -1.78 0.00 0.00 0.00 0.00 0.00 23.12 21.24 3m7o s ALA 89 CO 0.25 -1.26 1.08 1.63 0.00 0.00 0.00 175.76 177.46 3m7o n LYS 90 N 5.38 -7.19 -0.52 0.00 5.02 -1.26 -2.44 118.16 117.16 3m7o n LYS 90 Ca -0.03 0.83 0.00 0.00 -2.02 0.00 0.00 58.31 57.09 3m7o n LYS 90 Cb 0.50 -5.83 0.00 0.00 -0.02 0.00 0.00 35.03 29.68 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 -1.55 1.19 3.88 0.72 0.00 -1.26 -5.00 105.19 103.18 3m7o n GLY 91 Ca -0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.93 6.43 -0.56 1.61 0.01 -1.02 -5.06 113.70 112.18 3m7o s SER 92 Ca 0.00 0.49 -0.26 0.00 1.31 0.00 0.00 55.95 57.49 3m7o s SER 92 Cb 0.00 -2.07 0.04 0.00 0.21 0.00 0.00 66.02 64.20 3m7o s SER 92 CO 0.00 0.36 1.05 -0.94 0.41 0.00 0.00 173.24 174.11 3m7o s SER 93 N -1.30 6.40 0.15 2.44 1.04 -1.26 -0.69 113.70 120.48 3m7o s SER 93 Ca 0.20 -0.12 0.24 0.00 0.48 0.00 0.00 55.95 56.75 3m7o s SER 93 Cb -0.13 -2.49 0.26 0.00 0.10 0.00 0.00 66.02 63.76 3m7o s SER 93 CO 0.09 -1.32 1.26 0.16 0.98 0.00 0.00 173.24 174.41 3m7o h ILE 94 N 6.09 0.00 -2.65 -1.02 3.07 -1.57 -3.46 117.51 117.97 3m7o h ILE 94 Ca -0.25 -0.63 -0.13 0.00 1.55 0.00 0.00 64.86 65.39 3m7o h ILE 94 Cb 1.07 1.20 -0.29 0.00 -0.27 0.00 0.00 36.82 38.53 3m7o h ILE 94 CO 1.13 0.00 -0.40 -0.22 -1.05 0.00 0.00 178.15 177.60 3m7o s LEU 95 N -4.56 -0.41 -0.21 0.16 0.20 -1.14 -5.01 118.68 107.71 3m7o s LEU 95 Ca 0.05 0.85 -0.03 0.00 0.69 0.00 0.00 54.13 55.68 3m7o s LEU 95 Cb 0.12 1.16 -0.01 0.00 -0.43 0.00 0.00 46.19 47.03 3m7o s LEU 95 CO 0.74 -0.22 -0.06 0.20 -0.29 0.00 0.00 176.35 176.72 3m7o s ASN 96 N 2.29 4.22 0.08 3.68 0.01 -1.26 -0.55 114.94 123.40 3m7o s ASN 96 Ca -0.03 -0.40 0.10 0.00 -0.71 0.00 0.00 52.86 51.82 3m7o s ASN 96 Cb -0.11 -1.72 -0.03 0.00 0.41 0.00 0.00 41.25 39.80 3m7o s ASN 96 CO -0.11 -0.01 -0.25 -0.47 -1.51 0.00 0.00 177.10 174.75 3m7o s TYR 97 N 1.40 2.36 -0.03 2.20 6.14 0.60 -5.00 117.35 125.02 3m7o s TYR 97 Ca 0.05 -0.37 -0.06 0.00 0.64 0.00 0.00 57.07 57.32 3m7o s TYR 97 Cb -0.14 -1.35 0.01 0.00 0.42 0.00 0.00 41.96 40.89 3m7o s TYR 97 CO -0.03 0.23 0.14 0.45 0.64 0.00 0.00 175.55 176.98 3m7o s SER 98 N -1.59 -0.06 -0.03 4.32 0.15 -1.26 -0.73 113.70 114.50 3m7o s SER 98 Ca 0.13 0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.80 3m7o s SER 98 Cb -0.10 0.26 0.03 0.00 -1.71 0.00 0.00 66.02 64.50 3m7o s SER 98 CO 0.04 -0.23 0.03 -0.47 1.20 0.00 0.00 173.24 173.82 3m7o s TYR 99 N -0.72 0.14 0.09 3.44 5.04 0.30 -4.99 117.35 120.66 3m7o s TYR 99 Ca -0.08 0.12 -0.28 0.00 -2.44 0.00 0.00 57.07 54.39 3m7o s TYR 99 Cb -0.05 -0.39 -0.06 0.00 0.35 0.00 0.00 41.96 41.81 3m7o s TYR 99 CO 0.01 -0.15 0.88 -1.25 -1.34 0.00 0.00 175.55 173.71 3m7o s PRO 100 N 1.49 4.63 -0.00 4.97 0.04 -1.26 -0.86 135.00 144.00 3m7o s PRO 100 Ca -0.04 1.30 0.22 0.00 0.04 0.00 0.00 61.00 62.53 3m7o s PRO 100 Cb -0.13 -3.36 -0.29 0.00 0.04 0.00 0.00 34.50 30.75 3m7o s PRO 100 CO -0.03 0.26 0.56 1.28 0.04 0.00 0.00 177.00 179.12 3m7o n LEU 101 N 2.71 0.13 -4.11 -3.56 4.77 0.10 -4.96 117.00 112.07 3m7o n LEU 101 Ca 0.00 0.02 -0.33 0.00 -0.03 0.00 0.00 56.01 55.67 3m7o n LEU 101 Cb 0.49 -0.01 -0.14 0.00 -2.33 0.00 0.00 43.42 41.43 3m7o n LEU 101 CO 0.49 -0.01 -0.42 0.00 -1.33 0.00 0.00 177.39 176.13 3m7o n PHE 109 N 4.51 0.00 0.27 0.00 7.35 -1.26 -4.80 117.46 123.53 3m7o n PHE 109 Ca -0.14 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.68 3m7o n PHE 109 Cb 0.43 -1.07 0.74 0.00 0.35 0.00 0.00 39.48 39.93 3m7o n PHE 109 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 3m7o h SER 110 N 0.00 0.00 -0.88 -2.13 4.64 -2.02 -2.31 113.55 110.85 3m7o h SER 110 Ca 0.00 0.00 0.18 0.00 -0.47 0.00 0.00 61.79 61.50 3m7o h SER 110 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 3m7o h SER 110 CO 0.00 0.10 0.57 -0.26 -0.87 0.00 0.00 176.83 176.38 3m7o h PHE 111 N 0.00 0.62 -2.80 4.77 -1.00 -2.00 -3.43 116.94 113.10 3m7o h PHE 111 Ca -0.00 0.02 -0.52 0.00 2.81 0.00 0.00 57.97 60.27 3m7o h PHE 111 Cb 0.26 -0.19 0.05 0.00 3.61 0.00 0.00 35.95 39.68 3m7o h PHE 111 CO 0.00 0.19 0.90 0.00 -1.61 0.00 0.00 178.31 177.79 3m7o n GLY 113 N 3.78 0.98 3.80 0.00 0.00 -0.81 -5.04 105.19 107.90 3m7o n GLY 113 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.53 2.47 0.18 1.61 1.81 -0.98 -4.83 118.95 118.69 3m7o s ARG 114 Ca 0.00 0.86 0.09 0.00 -1.72 0.00 0.00 55.73 54.96 3m7o s ARG 114 Cb 0.00 -1.94 -0.04 0.00 -0.45 0.00 0.00 34.95 32.51 3m7o s ARG 114 CO 0.00 -1.40 -0.07 1.03 -0.68 0.00 0.00 175.30 174.17 3m7o s ARG 115 N -5.06 2.14 0.11 3.54 1.81 -1.26 -1.57 118.95 118.66 3m7o s ARG 115 Ca 0.60 -1.24 -0.35 0.00 -1.72 0.00 0.00 55.73 53.01 3m7o s ARG 115 Cb -0.15 -2.20 -0.17 0.00 -0.45 0.00 0.00 34.95 31.98 3m7o s ARG 115 CO 0.55 0.43 1.11 1.63 -0.68 0.00 0.00 175.30 178.34 3m7o n LYS 116 N -0.04 0.74 0.00 3.54 5.02 -1.25 -2.25 118.16 123.93 3m7o n LYS 116 Ca -0.10 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 3m7o n LYS 116 Cb 0.56 -1.74 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 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 1.99 2.80 3.75 0.72 0.00 0.46 -5.01 105.19 109.90 3m7o n GLY 117 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.53 4.29 -0.51 1.61 2.02 -0.95 -4.69 118.70 119.95 3m7o s GLU 118 Ca 0.00 2.26 -0.26 0.00 0.02 0.00 0.00 54.97 56.99 3m7o s GLU 118 Cb 0.00 -3.12 0.03 0.00 0.10 0.00 0.00 34.13 31.14 3m7o s GLU 118 CO 0.00 -0.38 1.00 -1.14 0.02 0.00 0.00 175.26 174.77 3m7o s GLN 119 N -0.44 3.50 -0.16 1.61 2.00 -1.26 -0.86 119.66 124.05 3m7o s GLN 119 Ca 0.58 0.12 -0.12 0.00 -2.00 0.00 0.00 55.36 53.94 3m7o s GLN 119 Cb -0.41 -3.97 -0.05 0.00 0.80 0.00 0.00 33.01 29.38 3m7o s GLN 119 CO 0.43 -1.39 0.25 0.42 -0.50 0.00 0.00 175.29 174.50 3m7o s ILE 120 N 4.10 5.33 -0.25 -2.34 -1.09 0.12 -4.97 121.20 122.10 3m7o s ILE 120 Ca 0.38 0.45 0.01 0.00 -2.23 0.00 0.00 60.65 59.26 3m7o s ILE 120 Cb -0.10 -3.58 0.05 0.00 -1.58 0.00 0.00 42.46 37.25 3m7o s ILE 120 CO 0.25 0.43 -0.09 -0.31 -1.23 0.00 0.00 174.94 173.99 3m7o s TYR 121 N 0.22 3.16 -0.19 3.97 2.02 -1.26 -1.64 117.35 123.63 3m7o s TYR 121 Ca 0.15 -1.98 -0.02 0.00 -0.37 0.00 0.00 57.07 54.84 3m7o s TYR 121 Cb -0.13 -1.99 -0.01 0.00 -0.40 0.00 0.00 41.96 39.43 3m7o s TYR 121 CO 0.03 -0.82 -0.08 -0.47 -1.57 0.00 0.00 175.55 172.64 3m7o s TYR 122 N 1.20 2.91 -0.17 2.71 5.04 0.60 -4.98 117.35 124.67 3m7o s TYR 122 Ca -0.04 -0.84 -0.00 0.00 -2.44 0.00 0.00 57.07 53.74 3m7o s TYR 122 Cb -0.18 -2.01 0.04 0.00 0.35 0.00 0.00 41.96 40.16 3m7o s TYR 122 CO -0.05 -0.43 -0.08 0.00 -1.34 0.00 0.00 175.55 173.66 3m7o s ALA 123 N 1.05 1.66 0.00 3.97 0.00 -1.26 -0.24 121.76 126.94 3m7o s ALA 123 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.03 3m7o s ALA 123 Cb -0.15 -1.15 0.00 0.00 0.00 0.00 0.00 23.12 21.82 3m7o s ALA 123 CO -0.01 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 175.43 3m7o n GLY 124 N 4.81 -1.56 3.82 0.00 0.00 -0.44 -4.98 105.19 106.84 3m7o n GLY 124 Ca -0.13 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.48 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 -1.37 3.47 0.27 1.61 0.04 -1.26 -1.02 135.00 136.73 3m7o s PRO 125 Ca 0.00 1.08 0.10 0.00 0.04 0.00 0.00 61.00 62.22 3m7o s PRO 125 Cb 0.00 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 3m7o s PRO 125 CO 0.00 -0.68 -0.02 0.14 0.04 0.00 0.00 177.00 176.48 3m7o s VAL 126 N -2.61 3.36 -0.34 -0.36 -7.23 0.09 -4.87 120.40 108.44 3m7o s VAL 126 Ca 0.61 -1.95 0.03 0.00 -1.81 0.00 0.00 61.98 58.86 3m7o s VAL 126 Cb -0.14 -2.79 0.31 0.00 0.56 0.00 0.00 36.38 34.32 3m7o s VAL 126 CO 0.38 -0.37 1.28 -3.20 -0.31 0.00 0.00 175.10 172.89 3m7o n ASN 127 N -0.85 3.24 -4.76 4.85 5.15 -1.26 -3.96 115.26 117.66 3m7o n ASN 127 Ca -0.06 -2.60 -0.38 0.00 -0.60 0.00 0.00 54.58 50.94 3m7o n ASN 127 Cb 0.59 -0.63 0.00 0.00 -0.53 0.00 0.00 39.78 39.22 3m7o n ASN 127 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3m7o s ASN 128 N -0.10 5.93 0.63 1.20 4.22 -1.26 -4.79 114.94 120.78 3m7o s ASN 128 Ca 0.24 2.45 -0.11 0.00 -2.14 0.00 0.00 52.86 53.30 3m7o s ASN 128 Cb 0.20 -2.61 -0.04 0.00 1.28 0.00 0.00 41.25 40.08 3m7o s ASN 128 CO 0.05 -1.09 1.04 -2.16 -2.04 0.00 0.00 177.10 172.90 3m7o s PRO 129 N -2.73 3.53 0.30 3.55 0.04 -1.26 -1.39 135.00 137.05 3m7o s PRO 129 Ca 0.65 0.74 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 3m7o s PRO 129 Cb -0.32 -2.07 -0.12 0.00 0.04 0.00 0.00 34.50 32.02 3m7o s PRO 129 CO 0.39 -0.61 1.51 0.41 0.04 0.00 0.00 177.00 178.73 3m7o n GLY 130 N -2.75 1.12 3.03 0.56 0.00 -1.26 -4.45 105.19 101.45 3m7o n GLY 130 Ca 0.06 0.43 -0.13 0.00 0.00 0.00 0.00 46.02 46.38 3m7o n GLY 130 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m7o s LEU 131 N -0.68 1.06 -0.40 0.99 2.96 -0.63 -4.92 118.68 117.06 3m7o s LEU 131 Ca 0.62 0.38 -0.09 0.00 -0.22 0.00 0.00 54.13 54.81 3m7o s LEU 131 Cb -0.53 0.59 0.06 0.00 0.50 0.00 0.00 46.19 46.81 3m7o s LEU 131 CO 0.53 -0.09 0.23 -0.62 -1.32 0.00 0.00 176.35 175.07 3m7o s ASP 132 N 0.48 5.62 -0.34 3.68 3.68 -1.26 0.64 116.67 129.16 3m7o s ASP 132 Ca -0.03 -1.34 -0.28 0.00 2.13 0.00 0.00 52.55 53.03 3m7o s ASP 132 Cb -0.05 -1.98 0.02 0.00 -1.45 0.00 0.00 42.92 39.46 3m7o s ASP 132 CO -0.02 -0.47 1.03 -0.69 0.13 0.00 0.00 175.17 175.14 3m7o s VAL 133 N 1.45 4.52 0.55 1.11 1.01 0.16 -5.00 120.40 124.20 3m7o s VAL 133 Ca 0.02 1.53 -0.21 0.00 0.00 0.00 0.00 61.98 63.33 3m7o s VAL 133 Cb -0.22 -4.39 -0.05 0.00 0.00 0.00 0.00 36.38 31.72 3m7o s VAL 133 CO 0.03 -0.52 1.26 -2.84 0.00 0.00 0.00 175.10 173.03 3m7o s PRO 134 N 3.63 3.17 0.14 2.72 0.02 -1.26 -4.86 135.00 138.56 3m7o s PRO 134 Ca 0.43 1.98 -0.34 0.00 0.02 0.00 0.00 61.00 63.08 3m7o s PRO 134 Cb -0.12 -2.14 -0.16 0.00 0.02 0.00 0.00 34.50 32.10 3m7o s PRO 134 CO 0.17 -1.09 1.18 0.94 -0.33 0.00 0.00 177.00 177.87 3m7o n GLN 135 N -1.18 1.03 -1.88 5.54 7.27 -1.26 -4.69 117.38 122.20 3m7o n GLN 135 Ca 0.11 0.37 0.00 0.00 0.07 0.00 0.00 57.00 57.55 3m7o n GLN 135 Cb 0.48 -1.89 0.00 0.00 2.41 0.00 0.00 30.24 31.24 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 2.11 -0.79 3.47 1.69 0.00 -0.22 -4.96 105.19 106.49 3m7o n GLY 136 Ca 0.16 -1.65 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 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 -1.52 2.81 -0.06 1.61 2.12 -1.26 -0.32 118.70 122.09 3m7o s GLU 137 Ca 0.00 -0.66 0.01 0.00 0.36 0.00 0.00 54.97 54.67 3m7o s GLU 137 Cb 0.00 -2.50 0.02 0.00 0.26 0.00 0.00 34.13 31.92 3m7o s GLU 137 CO 0.00 0.51 -0.06 0.71 -0.54 0.00 0.00 175.26 175.88 3m7o s TYR 138 N -0.42 0.97 -0.22 5.30 2.02 0.74 -4.98 117.35 120.76 3m7o s TYR 138 Ca 0.05 -0.34 -0.11 0.00 -0.37 0.00 0.00 57.07 56.30 3m7o s TYR 138 Cb -0.12 -0.85 -0.05 0.00 -0.40 0.00 0.00 41.96 40.54 3m7o s TYR 138 CO 0.02 -0.28 0.18 -0.65 -1.57 0.00 0.00 175.55 173.25 3m7o s GLN 139 N 1.18 4.13 0.12 -0.62 -1.52 -1.26 -0.29 119.66 121.39 3m7o s GLN 139 Ca -0.06 -0.19 0.09 0.00 -1.95 0.00 0.00 55.36 53.25 3m7o s GLN 139 Cb -0.14 -3.50 -0.04 0.00 -0.22 0.00 0.00 33.01 29.12 3m7o s GLN 139 CO -0.01 0.13 -0.22 -0.51 -0.25 0.00 0.00 175.29 174.43 3m7o s LEU 140 N 0.85 2.32 -0.17 2.90 1.43 0.70 -1.19 118.68 125.52 3m7o s LEU 140 Ca 0.09 -0.72 -0.01 0.00 -1.03 0.00 0.00 54.13 52.47 3m7o s LEU 140 Cb -0.13 -0.95 -0.00 0.00 0.03 0.00 0.00 46.19 45.14 3m7o s LEU 140 CO 0.03 0.07 -0.13 -0.22 0.23 0.00 0.00 176.35 176.33 3m7o s LEU 141 N -2.04 2.56 -0.06 1.79 2.96 -0.22 -0.12 118.68 123.56 3m7o s LEU 141 Ca 0.09 -0.45 0.05 0.00 -0.22 0.00 0.00 54.13 53.60 3m7o s LEU 141 Cb -0.09 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 3m7o s LEU 141 CO 0.05 0.07 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.20 3m7o s LEU 142 N 0.92 2.44 -0.03 -0.68 1.02 0.83 -0.84 118.68 122.34 3m7o s LEU 142 Ca -0.03 -0.35 -0.00 0.00 0.02 0.00 0.00 54.13 53.77 3m7o s LEU 142 Cb -0.15 -1.48 0.03 0.00 0.02 0.00 0.00 46.19 44.61 3m7o s LEU 142 CO -0.01 0.29 0.02 -1.61 0.02 0.00 0.00 176.35 175.06 3m7o s GLU 143 N -0.41 0.15 -0.15 1.70 2.02 -0.19 -0.98 118.70 120.83 3m7o s GLU 143 Ca 0.04 0.15 -0.05 0.00 0.02 0.00 0.00 54.97 55.13 3m7o s GLU 143 Cb -0.12 -0.42 -0.03 0.00 0.10 0.00 0.00 34.13 33.65 3m7o s GLU 143 CO 0.02 -0.18 0.01 -0.51 0.02 0.00 0.00 175.26 174.63 3m7o s LEU 144 N 1.20 3.56 0.12 1.80 1.43 0.26 -0.53 118.68 126.53 3m7o s LEU 144 Ca -0.07 0.01 -0.14 0.00 -1.03 0.00 0.00 54.13 52.90 3m7o s LEU 144 Cb -0.13 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.24 3m7o s LEU 144 CO -0.02 0.21 0.34 -0.72 0.23 0.00 0.00 176.35 176.39 3m7o s TYR 145 N 0.13 -0.09 0.00 0.29 -0.85 -0.63 -0.52 117.35 115.69 3m7o s TYR 145 Ca 0.02 -0.26 0.00 0.00 -0.52 0.00 0.00 57.07 56.31 3m7o s TYR 145 Cb -0.13 0.17 0.00 0.00 0.38 0.00 0.00 41.96 42.38 3m7o s TYR 145 CO 0.02 -0.66 0.00 0.27 -1.52 0.00 0.00 175.55 173.65 3m7o n ASN 146 N -0.18 0.00 0.23 -0.18 6.94 -0.84 -0.75 115.26 120.47 3m7o n ASN 146 Ca -0.15 -0.88 0.16 0.00 -0.02 0.00 0.00 54.58 53.69 3m7o n ASN 146 Cb 0.63 0.00 0.85 0.00 -2.36 0.00 0.00 39.78 38.90 3m7o n ASN 146 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 3m7o h GLU 147 N 0.00 0.00 -0.54 -3.83 3.07 -1.91 -2.59 114.58 108.77 3m7o h GLU 147 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3m7o h GLU 147 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3m7o h GLU 147 CO 0.00 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.70 3m7o n ASN 148 N -3.82 3.67 -2.93 1.42 4.13 -1.26 -4.93 115.26 111.55 3m7o n ASN 148 Ca 0.00 -1.99 -0.22 0.00 1.68 0.00 0.00 54.58 54.05 3m7o n ASN 148 Cb 0.26 -0.36 0.02 0.00 -1.54 0.00 0.00 39.78 38.16 3m7o n ASN 148 CO 0.00 0.00 0.00 -1.14 0.28 0.00 0.00 177.26 176.40 3m7o n ARG 149 N 1.54 -4.13 -2.84 3.52 0.63 -0.98 -5.02 116.66 109.38 3m7o n ARG 149 Ca 0.21 0.88 -0.41 0.00 -0.92 0.00 0.00 57.85 57.61 3m7o n ARG 149 Cb 0.61 -5.69 -0.04 0.00 0.45 0.00 0.00 32.46 27.79 3m7o n ARG 149 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3m7o s ALA 150 N -3.12 3.24 0.07 5.13 0.00 -1.26 -4.86 121.76 120.96 3m7o s ALA 150 Ca 0.25 0.39 -0.31 0.00 0.00 0.00 0.00 51.96 52.29 3m7o s ALA 150 Cb -0.11 -3.18 -0.08 0.00 0.00 0.00 0.00 23.12 19.74 3m7o s ALA 150 CO 0.31 -0.16 1.56 0.99 0.00 0.00 0.00 175.76 178.46 3m7o s THR 151 N 0.84 3.17 -0.25 0.00 2.01 -1.26 -1.99 115.64 118.15 3m7o s THR 151 Ca 0.46 0.66 -0.02 0.00 0.31 0.00 0.00 61.69 63.10 3m7o s THR 151 Cb -0.20 -3.42 -0.15 0.00 0.01 0.00 0.00 72.50 68.74 3m7o s THR 151 CO 0.24 0.01 -0.24 0.52 -0.69 0.00 0.00 174.62 174.46 3m7o n VAL 152 N 4.56 1.40 -3.63 3.82 0.31 0.32 -4.84 118.33 120.28 3m7o n VAL 152 Ca 0.15 -0.49 -0.16 0.00 -0.01 0.00 0.00 64.34 63.83 3m7o n VAL 152 Cb 0.41 -1.48 -0.07 0.00 -0.91 0.00 0.00 33.84 31.79 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 -2.48 -1.30 -0.10 3.52 0.00 -0.95 -4.84 121.76 115.61 3m7o s ALA 153 Ca -0.34 0.84 -0.05 0.00 0.00 0.00 0.00 51.96 52.42 3m7o s ALA 153 Cb 0.10 0.04 0.04 0.00 0.00 0.00 0.00 23.12 23.30 3m7o s ALA 153 CO 0.54 -0.32 0.22 0.00 0.00 0.00 0.00 175.76 176.20 3m7o s ALA 155 N 1.11 -0.32 -0.09 0.00 0.00 -0.15 -0.82 121.76 121.48 3m7o s ALA 155 Ca -0.08 0.39 -0.23 0.00 0.00 0.00 0.00 51.96 52.03 3m7o s ALA 155 Cb -0.10 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 3m7o s ALA 155 CO -0.07 -0.07 0.71 -0.80 0.00 0.00 0.00 175.76 175.53 3m7o s ASN 156 N 0.13 6.95 0.06 0.00 -0.87 -0.58 -0.12 114.94 120.51 3m7o s ASN 156 Ca -0.01 1.15 0.08 0.00 -1.57 0.00 0.00 52.86 52.51 3m7o s ASN 156 Cb -0.02 -2.41 -0.03 0.00 -0.02 0.00 0.00 41.25 38.78 3m7o s ASN 156 CO -0.00 -0.17 -0.21 0.00 -2.57 0.00 0.00 177.10 174.14 3m7o s ALA 157 N 1.10 1.83 -0.18 0.60 0.00 0.83 -1.03 121.76 124.91 3m7o s ALA 157 Ca 0.37 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 51.20 3m7o s ALA 157 Cb -0.17 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.63 3m7o s ALA 157 CO 0.16 0.40 -0.19 0.99 0.00 0.00 0.00 175.76 177.13 3m7o s THR 158 N -0.90 2.17 -0.21 0.00 2.01 0.35 -0.22 115.64 118.84 3m7o s THR 158 Ca 0.08 -0.91 -0.05 0.00 0.31 0.00 0.00 61.69 61.13 3m7o s THR 158 Cb -0.09 -1.91 -0.02 0.00 0.01 0.00 0.00 72.50 70.49 3m7o s THR 158 CO 0.03 0.53 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.78 3m7o s VAL 159 N 1.25 3.68 -0.17 3.82 1.01 0.61 -1.54 120.40 129.06 3m7o s VAL 159 Ca 0.04 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 3m7o s VAL 159 Cb -0.13 -2.67 -0.01 0.00 0.00 0.00 0.00 36.38 33.57 3m7o s VAL 159 CO -0.11 0.42 -0.11 -0.89 0.00 0.00 0.00 175.10 174.41 3m7o s THR 160 N 1.28 3.03 -0.16 3.92 2.01 0.61 -0.19 115.64 126.15 3m7o s THR 160 Ca 0.04 -0.64 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 3m7o s THR 160 Cb -0.14 -2.32 -0.01 0.00 0.01 0.00 0.00 72.50 70.04 3m7o s THR 160 CO -0.00 0.49 -0.10 -0.55 -0.69 0.00 0.00 174.62 173.77 3m7o s SER 161 N 0.90 4.12 0.00 3.53 0.15 0.57 -0.88 113.70 122.08 3m7o s SER 161 Ca -0.03 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.28 3m7o s SER 161 Cb -0.15 -1.66 0.00 0.00 -1.71 0.00 0.00 66.02 62.50 3m7o s SER 161 CO -0.00 0.10 0.00 -1.54 1.20 0.00 0.00 173.24 173.00