#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1plk s THR 2 N 0.00 3.79 -0.30 3.17 2.01 -1.26 -5.00 115.64 118.05 1plk s THR 2 Ca 0.00 1.07 -0.02 0.00 0.31 0.00 0.00 61.69 63.05 1plk s THR 2 Cb 0.00 -3.69 0.05 0.00 0.01 0.00 0.00 72.50 68.87 1plk s THR 2 CO 0.00 -0.05 0.01 -1.61 -0.69 0.00 0.00 174.62 172.27 1plk s GLU 3 N 3.17 2.49 -0.13 4.92 2.02 -1.26 -3.21 118.70 126.70 1plk s GLU 3 Ca 0.65 -1.23 -0.22 0.00 0.02 0.00 0.00 54.97 54.19 1plk s GLU 3 Cb -0.30 -3.20 -0.03 0.00 0.10 0.00 0.00 34.13 30.70 1plk s GLU 3 CO 0.25 -0.61 0.65 0.71 0.02 0.00 0.00 175.26 176.28 1plk s TYR 4 N 1.28 3.49 -0.31 1.61 2.02 0.27 -4.96 117.35 120.74 1plk s TYR 4 Ca -0.04 1.08 -0.19 0.00 -0.37 0.00 0.00 57.07 57.55 1plk s TYR 4 Cb -0.19 -2.77 -0.01 0.00 -0.40 0.00 0.00 41.96 38.58 1plk s TYR 4 CO -0.01 -0.01 0.56 0.21 -1.57 0.00 0.00 175.55 174.74 1plk s LYS 5 N 1.23 3.84 -0.19 -0.62 2.36 -1.26 -0.85 119.74 124.26 1plk s LYS 5 Ca 0.33 0.14 0.01 0.00 -2.55 0.00 0.00 55.97 53.89 1plk s LYS 5 Cb -0.17 -3.74 0.02 0.00 -1.05 0.00 0.00 37.83 32.90 1plk s LYS 5 CO 0.14 -0.55 -0.18 -0.51 1.55 0.00 0.00 175.35 175.80 1plk s LEU 6 N 2.47 2.26 -0.28 5.43 1.43 0.36 -3.05 118.68 127.30 1plk s LEU 6 Ca 0.22 -0.65 -0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1plk s LEU 6 Cb -0.15 -1.51 0.09 0.00 0.03 0.00 0.00 46.19 44.65 1plk s LEU 6 CO 0.12 -0.01 0.11 -0.69 0.23 0.00 0.00 176.35 176.11 1plk s VAL 7 N 1.30 0.36 0.78 -1.59 1.01 -1.15 -4.68 120.40 116.43 1plk s VAL 7 Ca 0.05 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 1plk s VAL 7 Cb -0.13 -1.24 0.06 0.00 0.00 0.00 0.00 36.38 35.06 1plk s VAL 7 CO -0.12 -0.64 1.08 -0.69 0.00 0.00 0.00 175.10 174.73 1plk s VAL 8 N 1.89 3.33 0.00 2.92 1.01 -1.26 -4.51 120.40 123.77 1plk s VAL 8 Ca 0.08 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.49 1plk s VAL 8 Cb -0.17 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.14 1plk s VAL 8 CO -0.29 -0.56 0.00 0.61 0.00 0.00 0.00 175.10 174.86 1plk n GLY 10 N -1.72 1.60 3.71 4.51 0.00 -1.26 -3.64 105.19 108.38 1plk n GLY 10 Ca 0.08 -0.78 -0.04 0.00 0.00 0.00 0.00 46.02 45.27 1plk n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1plk n GLY 13 N 0.00 -0.07 2.79 -0.02 0.00 -1.26 -4.44 105.19 102.19 1plk n GLY 13 Ca 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 1plk n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1plk n GLY 15 N -1.01 1.75 0.00 -0.02 0.00 -1.26 -5.02 105.19 99.63 1plk n GLY 15 Ca -0.01 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1plk n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1plk n LYS 16 N -0.59 0.00 -0.15 1.61 5.02 -1.26 -3.78 118.16 119.01 1plk n LYS 16 Ca 0.05 0.46 0.04 0.00 -2.02 0.00 0.00 58.31 56.84 1plk n LYS 16 Cb 0.81 -1.20 0.09 0.00 -0.02 0.00 0.00 35.03 34.72 1plk n LYS 16 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1plk n SER 17 N -1.87 -0.10 -0.29 4.39 7.64 -1.26 0.35 113.62 122.48 1plk n SER 17 Ca 0.00 0.74 -0.04 0.00 1.01 0.00 0.00 58.87 60.58 1plk n SER 17 Cb 0.00 -0.25 -0.02 0.00 -1.01 0.00 0.00 64.21 62.94 1plk n SER 17 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1plk n ALA 18 N -3.64 -0.26 -0.01 -0.43 0.00 -1.25 -1.33 120.51 113.58 1plk n ALA 18 Ca 0.09 0.66 -0.01 0.00 0.00 0.00 0.00 53.44 54.18 1plk n ALA 18 Cb 0.27 -0.21 -0.00 0.00 0.00 0.00 0.00 19.45 19.51 1plk n ALA 18 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1plk h LEU 19 N 0.00 -0.08 -2.36 0.00 3.38 -0.20 -2.30 115.31 113.76 1plk h LEU 19 Ca 0.18 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1plk h LEU 19 Cb 0.36 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1plk h LEU 19 CO -0.69 -0.01 0.00 0.41 0.09 0.00 0.00 178.44 178.24 1plk n THR 20 N -2.91 0.00 0.00 0.22 -1.04 -0.44 -4.62 114.28 105.49 1plk n THR 20 Ca -0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1plk n THR 20 Cb 0.01 -0.09 0.00 0.00 -1.82 0.00 0.00 70.33 68.44 1plk n THR 20 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1plk n GLN 22 N 0.50 0.00 0.00 -2.82 1.13 -0.87 -3.53 117.38 111.79 1plk n GLN 22 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1plk n GLN 22 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 1plk n GLN 22 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1plk n ILE 24 N 0.00 0.00 -0.41 5.09 2.08 -1.26 -1.07 119.36 123.78 1plk n ILE 24 Ca 0.00 0.00 0.09 0.00 0.56 0.00 0.00 62.75 63.40 1plk n ILE 24 Cb 0.00 0.00 0.28 0.00 -0.75 0.00 0.00 39.64 39.17 1plk n ILE 24 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1plk n GLN 25 N -0.29 3.03 -1.17 0.38 6.02 -1.23 -4.97 117.38 119.14 1plk n GLN 25 Ca 0.00 -2.56 -0.09 0.00 -0.01 0.00 0.00 57.00 54.34 1plk n GLN 25 Cb 0.00 -1.58 -0.04 0.00 1.02 0.00 0.00 30.24 29.64 1plk n GLN 25 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1plk n ASN 26 N 1.09 -3.65 -2.35 1.08 5.15 -0.24 -4.91 115.26 111.44 1plk n ASN 26 Ca 0.21 0.24 -0.11 0.00 -0.60 0.00 0.00 54.58 54.31 1plk n ASN 26 Cb 0.65 -3.05 -0.04 0.00 -0.53 0.00 0.00 39.78 36.80 1plk n ASN 26 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1plk n HIS 27 N -1.71 -0.67 -3.58 1.20 1.44 -1.25 -4.78 115.22 105.87 1plk n HIS 27 Ca -0.09 -1.66 -0.28 0.00 -2.01 0.00 0.00 57.72 53.67 1plk n HIS 27 Cb 0.41 0.23 -0.16 0.00 0.12 0.00 0.00 29.99 30.59 1plk n HIS 27 CO 0.00 0.00 0.00 0.12 -2.81 0.00 0.00 176.34 173.65 1plk s PHE 28 N -3.10 0.31 0.00 -1.40 5.36 -1.26 -2.12 117.98 115.77 1plk s PHE 28 Ca 0.23 -0.67 0.00 0.00 -0.96 0.00 0.00 56.93 55.53 1plk s PHE 28 Cb 0.01 -0.83 0.00 0.00 -0.34 0.00 0.00 43.02 41.85 1plk s PHE 28 CO 0.16 -0.70 0.00 1.33 -1.46 0.00 0.00 175.22 174.55 1plk n VAL 29 N 5.25 0.00 -1.99 3.12 0.24 -1.26 -5.15 118.33 118.54 1plk n VAL 29 Ca -0.06 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 61.98 1plk n VAL 29 Cb 0.45 -0.15 -0.07 0.00 -1.47 0.00 0.00 33.84 32.60 1plk n VAL 29 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1plk s TYR 32 N -1.00 1.81 0.45 6.34 5.04 -1.26 -5.02 117.35 123.71 1plk s TYR 32 Ca 0.00 0.76 0.04 0.00 -2.44 0.00 0.00 57.07 55.44 1plk s TYR 32 Cb 0.00 -3.91 -0.05 0.00 0.35 0.00 0.00 41.96 38.35 1plk s TYR 32 CO 0.00 -1.26 0.01 0.34 -1.34 0.00 0.00 175.55 173.30 1plk s ASP 33 N 7.18 3.89 -0.09 4.32 2.15 -1.26 -5.31 116.67 127.55 1plk s ASP 33 Ca 0.71 -1.50 -0.06 0.00 0.43 0.00 0.00 52.55 52.13 1plk s ASP 33 Cb -0.03 0.03 -0.04 0.00 -0.30 0.00 0.00 42.92 42.58 1plk s ASP 33 CO 0.11 -0.64 -0.14 -0.38 -0.17 0.00 0.00 175.17 173.94 1plk n ILE 36 N -1.08 0.81 -3.64 4.11 -0.00 -1.26 -5.10 119.36 113.20 1plk n ILE 36 Ca -0.11 -0.03 -0.07 0.00 -0.00 0.00 0.00 62.75 62.54 1plk n ILE 36 Cb 0.67 -1.72 -0.07 0.00 -0.00 0.00 0.00 39.64 38.52 1plk n ILE 36 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 1plk s GLU 37 N -2.25 0.37 -0.08 0.38 2.12 -1.26 -4.40 118.70 113.57 1plk s GLU 37 Ca -0.15 0.45 -0.02 0.00 0.36 0.00 0.00 54.97 55.62 1plk s GLU 37 Cb 0.05 0.18 0.03 0.00 0.26 0.00 0.00 34.13 34.65 1plk s GLU 37 CO 0.19 -0.05 0.01 -0.51 -0.54 0.00 0.00 175.26 174.37 1plk s ASP 38 N 0.23 1.71 0.20 -1.70 1.01 -1.18 -5.03 116.67 111.91 1plk s ASP 38 Ca 0.04 -0.16 -0.10 0.00 0.71 0.00 0.00 52.55 53.03 1plk s ASP 38 Cb -0.05 -0.43 -0.07 0.00 1.01 0.00 0.00 42.92 43.38 1plk s ASP 38 CO -0.09 -0.22 0.53 -0.94 0.21 0.00 0.00 175.17 174.67 1plk s SER 39 N 1.98 6.65 0.01 0.27 1.04 -1.26 0.25 113.70 122.65 1plk s SER 39 Ca 0.04 0.92 -0.00 0.00 0.48 0.00 0.00 55.95 57.39 1plk s SER 39 Cb -0.13 -2.23 -0.01 0.00 0.10 0.00 0.00 66.02 63.76 1plk s SER 39 CO -0.05 -0.03 -0.01 -0.31 0.98 0.00 0.00 173.24 173.82 1plk s TYR 40 N -1.73 0.13 -0.14 5.02 2.02 -1.26 -4.96 117.35 116.43 1plk s TYR 40 Ca 0.45 -0.26 -0.04 0.00 -0.37 0.00 0.00 57.07 56.85 1plk s TYR 40 Cb -0.12 -0.09 0.05 0.00 -0.40 0.00 0.00 41.96 41.40 1plk s TYR 40 CO 0.21 -0.11 0.07 1.03 -1.57 0.00 0.00 175.55 175.18 1plk s ARG 41 N -0.77 0.13 0.18 -0.62 0.52 -1.26 -3.91 118.95 113.22 1plk s ARG 41 Ca -0.08 -0.01 0.08 0.00 -0.52 0.00 0.00 55.73 55.19 1plk s ARG 41 Cb -0.05 -1.52 -0.04 0.00 0.52 0.00 0.00 34.95 33.85 1plk s ARG 41 CO -0.00 -0.57 -0.15 0.21 0.02 0.00 0.00 175.30 174.80 1plk s LYS 42 N 2.10 1.28 -0.89 3.54 2.47 -1.12 -4.95 119.74 122.17 1plk s LYS 42 Ca 0.02 -1.50 -0.01 0.00 -1.56 0.00 0.00 55.97 52.92 1plk s LYS 42 Cb -0.15 -1.13 0.23 0.00 -1.46 0.00 0.00 37.83 35.32 1plk s LYS 42 CO -0.07 0.20 0.85 1.04 0.16 0.00 0.00 175.35 177.53 1plk n GLN 43 N -0.12 2.81 -2.43 4.03 6.02 -1.26 0.62 117.38 127.04 1plk n GLN 43 Ca -0.10 -4.51 -0.24 0.00 -0.01 0.00 0.00 57.00 52.14 1plk n GLN 43 Cb 0.59 -2.41 0.14 0.00 1.02 0.00 0.00 30.24 29.58 1plk n GLN 43 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1plk n VAL 44 N 2.06 0.00 -4.40 5.09 0.24 0.33 -4.71 118.33 116.93 1plk n VAL 44 Ca 0.23 -1.46 -0.34 0.00 -2.04 0.00 0.00 64.34 60.74 1plk n VAL 44 Cb 0.37 -1.01 -0.13 0.00 -1.47 0.00 0.00 33.84 31.59 1plk n VAL 44 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1plk s VAL 45 N -3.25 3.60 -0.12 3.34 1.01 -1.26 0.32 120.40 124.04 1plk s VAL 45 Ca 0.68 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 62.22 1plk s VAL 45 Cb -0.03 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.79 1plk s VAL 45 CO 0.46 0.49 -0.15 -0.63 0.00 0.00 0.00 175.10 175.26 1plk s ILE 46 N 0.57 1.51 -0.85 2.22 1.01 -1.26 -4.76 121.20 119.64 1plk s ILE 46 Ca -0.04 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 59.98 1plk s ILE 46 Cb -0.15 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 40.93 1plk s ILE 46 CO 0.03 0.44 0.00 0.47 0.00 0.00 0.00 174.94 175.88 1plk n ASP 47 N 4.37 -2.78 0.00 3.58 8.00 -1.26 -4.96 116.55 123.50 1plk n ASP 47 Ca -0.18 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1plk n ASP 47 Cb 0.51 -2.55 0.00 0.00 -0.02 0.00 0.00 41.12 39.06 1plk n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1plk n GLY 48 N -0.48 0.69 3.28 0.44 0.00 -1.26 -5.26 105.19 102.60 1plk n GLY 48 Ca -0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 1plk n GLY 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1plk s THR 50 N -0.86 4.07 -0.27 2.61 2.01 -1.26 -5.06 115.64 116.88 1plk s THR 50 Ca 0.00 -1.27 0.01 0.00 0.31 0.00 0.00 61.69 60.74 1plk s THR 50 Cb 0.00 -3.41 0.08 0.00 0.01 0.00 0.00 72.50 69.17 1plk s THR 50 CO 0.00 -0.37 -0.00 0.00 -0.69 0.00 0.00 174.62 173.56 1plk s LEU 52 N 1.34 4.42 0.03 0.00 0.20 -1.20 0.12 118.68 123.60 1plk s LEU 52 Ca 0.00 1.34 -0.18 0.00 0.69 0.00 0.00 54.13 55.99 1plk s LEU 52 Cb -0.19 -3.14 -0.06 0.00 -0.43 0.00 0.00 46.19 42.37 1plk s LEU 52 CO -0.10 0.01 0.50 -0.76 -0.29 0.00 0.00 176.35 175.71 1plk s LEU 53 N 0.07 4.49 -0.10 -0.68 1.02 0.20 -0.57 118.68 123.11 1plk s LEU 53 Ca 0.37 1.11 0.01 0.00 0.02 0.00 0.00 54.13 55.64 1plk s LEU 53 Cb -0.20 -2.77 0.02 0.00 0.02 0.00 0.00 46.19 43.27 1plk s LEU 53 CO 0.21 0.27 -0.11 -0.62 0.02 0.00 0.00 176.35 176.11 1plk s ASP 54 N -0.94 2.09 -0.30 2.29 -1.08 -0.03 -2.78 116.67 115.93 1plk s ASP 54 Ca 0.27 -0.34 -0.11 0.00 -0.52 0.00 0.00 52.55 51.85 1plk s ASP 54 Cb -0.18 -0.90 0.12 0.00 -1.46 0.00 0.00 42.92 40.50 1plk s ASP 54 CO 0.16 -0.03 0.66 -0.62 0.52 0.00 0.00 175.17 175.86 1plk s ASP 57 N 1.14 -1.12 0.30 -0.34 2.15 0.14 0.14 116.67 119.08 1plk s ASP 57 Ca -0.05 1.57 0.07 0.00 0.43 0.00 0.00 52.55 54.57 1plk s ASP 57 Cb -0.14 2.16 -0.03 0.00 -0.30 0.00 0.00 42.92 44.60 1plk s ASP 57 CO -0.02 -0.22 0.25 0.42 -0.17 0.00 0.00 175.17 175.42 1plk s THR 58 N 2.69 3.85 -0.24 1.71 -4.23 -1.24 -3.13 115.64 115.06 1plk s THR 58 Ca -0.07 -1.40 -0.03 0.00 -1.18 0.00 0.00 61.69 59.01 1plk s THR 58 Cb -0.11 -3.25 0.01 0.00 1.34 0.00 0.00 72.50 70.48 1plk s THR 58 CO -0.19 -0.24 -0.04 0.00 -0.54 0.00 0.00 174.62 173.61 1plk s ALA 59 N -2.25 2.78 -0.17 3.99 0.00 -1.26 -4.29 121.76 120.56 1plk s ALA 59 Ca 0.38 -1.29 0.01 0.00 0.00 0.00 0.00 51.96 51.06 1plk s ALA 59 Cb -0.06 -1.72 0.25 0.00 0.00 0.00 0.00 23.12 21.58 1plk s ALA 59 CO 0.26 -0.60 1.38 0.41 0.00 0.00 0.00 175.76 177.21 1plk n GLY 60 N 4.76 2.99 3.57 0.00 0.00 -1.26 -4.89 105.19 110.35 1plk n GLY 60 Ca -0.17 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 1plk n GLY 60 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1plk s GLN 61 N -1.25 3.66 0.00 1.61 2.00 -1.26 -4.95 119.66 119.47 1plk s GLN 61 Ca 0.22 0.05 0.00 0.00 -2.00 0.00 0.00 55.36 53.62 1plk s GLN 61 Cb 0.18 -3.82 0.00 0.00 0.80 0.00 0.00 33.01 30.17 1plk s GLN 61 CO 0.04 -0.77 0.00 -1.91 -0.50 0.00 0.00 175.29 172.15 1plk n GLU 62 N 6.09 0.00 -0.22 1.67 4.07 -1.26 -3.78 120.64 127.22 1plk n GLU 62 Ca -0.01 0.00 0.17 0.00 -0.06 0.00 0.00 57.16 57.26 1plk n GLU 62 Cb 0.48 0.00 0.28 0.00 -0.06 0.00 0.00 31.44 32.15 1plk n GLU 62 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1plk n GLU 63 N 0.00 -0.01 0.03 5.31 2.13 -1.26 -3.57 120.64 123.27 1plk n GLU 63 Ca 0.00 0.45 -0.03 0.00 0.66 0.00 0.00 57.16 58.25 1plk n GLU 63 Cb 0.00 -0.95 -0.09 0.00 0.27 0.00 0.00 31.44 30.67 1plk n GLU 63 CO 0.00 0.00 0.00 1.88 -0.41 0.00 0.00 177.13 178.60 1plk h TYR 64 N 0.00 0.00 0.00 4.31 0.05 -1.94 -3.44 116.97 115.95 1plk h TYR 64 Ca 0.35 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.13 1plk h TYR 64 Cb 1.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.96 1plk h TYR 64 CO -0.00 0.71 0.00 0.43 -1.05 0.00 0.00 178.16 178.25 1plk n SER 65 N -2.99 0.00 -0.27 3.88 7.64 -1.23 0.13 113.62 120.77 1plk n SER 65 Ca -0.10 0.00 0.13 0.00 1.01 0.00 0.00 58.87 59.91 1plk n SER 65 Cb 0.89 0.00 0.40 0.00 -1.01 0.00 0.00 64.21 64.49 1plk n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1plk n ALA 66 N 0.00 3.01 0.08 -0.43 0.00 -1.26 -3.12 120.51 118.79 1plk n ALA 66 Ca 0.00 -0.41 -0.13 0.00 0.00 0.00 0.00 53.44 52.90 1plk n ALA 66 Cb 0.00 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.24 1plk n ALA 66 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1plk h MET 67 N 1.33 0.30 -0.13 0.00 -1.53 0.67 -3.30 114.93 112.27 1plk h MET 67 Ca 0.00 -0.39 0.04 0.00 -3.44 0.00 0.00 59.70 55.91 1plk h MET 67 Cb 0.50 0.13 -0.07 0.00 -0.55 0.00 0.00 31.60 31.61 1plk h MET 67 CO 0.00 1.11 -0.42 0.00 0.14 0.00 0.00 176.91 177.74 1plk h ARG 68 N 0.14 -0.47 0.00 0.39 3.08 -1.48 -2.00 114.38 114.04 1plk h ARG 68 Ca -0.09 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1plk h ARG 68 Cb 1.71 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.86 1plk h ARG 68 CO 0.17 -0.32 0.00 -0.25 -1.07 0.00 0.00 179.97 178.51 1plk n ASP 69 N -5.44 0.00 0.00 7.04 9.92 -1.24 0.38 116.55 127.21 1plk n ASP 69 Ca -0.04 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.22 1plk n ASP 69 Cb 0.36 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.84 1plk n ASP 69 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1plk n TYR 71 N 0.01 0.00 0.87 1.24 0.18 -0.75 -0.92 117.16 117.79 1plk n TYR 71 Ca 0.00 0.00 0.14 0.00 1.88 0.00 0.00 57.90 59.92 1plk n TYR 71 Cb 0.00 0.00 0.54 0.00 -0.38 0.00 0.00 39.34 39.50 1plk n TYR 71 CO 0.00 0.00 0.00 -1.33 -2.08 0.00 0.00 176.86 173.45 1plk n MET 72 N -0.01 0.09 -0.02 -3.48 0.00 0.16 -4.31 117.12 109.55 1plk n MET 72 Ca 0.00 0.07 -0.09 0.00 0.00 0.00 0.00 57.70 57.69 1plk n MET 72 Cb 0.00 -1.61 -0.14 0.00 0.00 0.00 0.00 33.22 31.47 1plk n MET 72 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 1plk h ARG 73 N 0.00 0.00 -0.88 0.03 2.43 -1.26 -3.37 114.38 111.33 1plk h ARG 73 Ca 0.00 -0.00 -0.40 0.00 -0.81 0.00 0.00 59.98 58.77 1plk h ARG 73 Cb 0.58 0.00 -0.24 0.00 -0.42 0.00 0.00 29.97 29.90 1plk h ARG 73 CO 0.00 0.53 0.49 0.25 -1.51 0.00 0.00 179.97 179.73 1plk n THR 74 N -3.07 3.09 -4.39 0.20 -2.24 -1.26 -4.99 114.28 101.62 1plk n THR 74 Ca -0.16 -1.85 -0.21 0.00 -2.27 0.00 0.00 64.05 59.56 1plk n THR 74 Cb 1.04 -0.42 -0.10 0.00 -2.10 0.00 0.00 70.33 68.75 1plk n THR 74 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1plk s GLY 75 N -1.26 1.60 -0.13 3.38 0.00 -1.26 -4.93 107.32 104.73 1plk s GLY 75 Ca 0.56 -1.71 -0.13 0.00 0.00 0.00 0.00 44.72 43.43 1plk s GLY 75 CO 0.11 -1.80 -0.26 1.18 0.00 0.00 0.00 173.10 172.34 1plk n GLU 76 N -0.35 0.39 -3.61 2.90 1.02 -1.17 -5.00 120.64 114.82 1plk n GLU 76 Ca -0.08 0.15 -0.37 0.00 -0.02 0.00 0.00 57.16 56.84 1plk n GLU 76 Cb 0.60 -1.18 -0.06 0.00 -0.02 0.00 0.00 31.44 30.78 1plk n GLU 76 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1plk s GLY 77 N -4.48 2.38 0.17 0.62 0.00 -1.17 -4.25 107.32 100.59 1plk s GLY 77 Ca -0.21 -0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.17 1plk s GLY 77 CO 0.32 -0.03 0.04 0.69 0.00 0.00 0.00 173.10 174.12 1plk n PHE 78 N 1.72 0.16 -3.64 1.90 3.01 -1.09 -2.95 117.46 116.56 1plk n PHE 78 Ca -0.15 -1.04 -0.08 0.00 1.01 0.00 0.00 57.45 57.20 1plk n PHE 78 Cb 0.53 -0.04 -0.07 0.00 -0.01 0.00 0.00 39.48 39.89 1plk n PHE 78 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1plk s VAL 81 N -2.04 0.00 0.37 -4.37 1.01 -1.26 -4.34 120.40 109.77 1plk s VAL 81 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 61.98 62.08 1plk s VAL 81 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 1plk s VAL 81 CO 0.04 0.00 0.14 0.72 0.00 0.00 0.00 175.10 176.00 1plk s PHE 82 N 0.29 1.76 -0.20 5.22 -0.12 0.47 -4.62 117.98 120.79 1plk s PHE 82 Ca 0.03 -1.29 -0.06 0.00 -0.05 0.00 0.00 56.93 55.55 1plk s PHE 82 Cb -0.05 -1.08 -0.03 0.00 -0.63 0.00 0.00 43.02 41.23 1plk s PHE 82 CO -0.07 -0.35 0.04 0.00 -0.05 0.00 0.00 175.22 174.79 1plk s ALA 83 N -3.31 3.21 -0.79 1.99 0.00 -1.26 -0.88 121.76 120.72 1plk s ALA 83 Ca 0.28 -0.91 0.06 0.00 0.00 0.00 0.00 51.96 51.40 1plk s ALA 83 Cb 0.04 -1.89 0.32 0.00 0.00 0.00 0.00 23.12 21.59 1plk s ALA 83 CO 0.16 -0.06 1.18 0.44 0.00 0.00 0.00 175.76 177.48 1plk n ILE 84 N 4.06 1.72 0.70 0.00 -6.64 0.25 0.24 119.36 119.69 1plk n ILE 84 Ca -0.17 0.55 0.11 0.00 -1.77 0.00 0.00 62.75 61.48 1plk n ILE 84 Cb 0.52 -1.55 0.06 0.00 -1.44 0.00 0.00 39.64 37.23 1plk n ILE 84 CO 0.00 0.00 0.00 -0.46 -1.77 0.00 0.00 176.55 174.32 1plk n ASN 85 N -1.70 0.64 -4.16 7.28 6.94 -1.26 0.63 115.26 123.63 1plk n ASN 85 Ca -0.00 -0.30 -0.39 0.00 -0.02 0.00 0.00 54.58 53.87 1plk n ASN 85 Cb 0.01 0.69 -0.08 0.00 -2.36 0.00 0.00 39.78 38.04 1plk n ASN 85 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1plk s ASN 86 N -3.65 5.59 0.11 0.53 3.04 0.64 -3.74 114.94 117.46 1plk s ASN 86 Ca 0.06 -2.58 -0.21 0.00 0.04 0.00 0.00 52.86 50.16 1plk s ASN 86 Cb 0.15 -1.94 -0.09 0.00 -1.54 0.00 0.00 41.25 37.83 1plk s ASN 86 CO 0.79 -0.48 1.74 0.74 -3.04 0.00 0.00 177.10 176.85 1plk h THR 87 N 5.44 0.95 -0.84 -5.21 2.02 -1.84 -0.81 112.91 112.63 1plk h THR 87 Ca -0.04 -0.02 0.17 0.00 0.77 0.00 0.00 66.41 67.29 1plk h THR 87 Cb 1.00 0.88 -0.06 0.00 -1.74 0.00 0.00 68.15 68.23 1plk h THR 87 CO 0.74 0.01 0.55 0.50 0.37 0.00 0.00 175.52 177.70 1plk h LYS 88 N 0.06 0.43 -0.39 6.66 3.64 -1.97 0.39 116.57 125.40 1plk h LYS 88 Ca 0.05 -0.03 -0.14 0.00 -1.27 0.00 0.00 60.65 59.26 1plk h LYS 88 Cb 0.04 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1plk h LYS 88 CO -0.07 0.29 -0.31 0.66 -2.27 0.00 0.00 179.45 177.75 1plk h SER 89 N 0.44 0.89 -1.00 4.20 4.64 -1.57 0.42 113.55 121.57 1plk h SER 89 Ca 0.42 -0.37 0.19 0.00 -0.47 0.00 0.00 61.79 61.57 1plk h SER 89 Cb 0.98 -0.25 -0.10 0.00 -0.31 0.00 0.00 62.40 62.72 1plk h SER 89 CO -0.15 1.12 0.61 0.15 -0.87 0.00 0.00 176.83 177.69 1plk h PHE 90 N 0.72 1.03 0.00 4.77 3.57 0.21 -0.87 116.94 126.37 1plk h PHE 90 Ca 0.08 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 1plk h PHE 90 Cb 0.86 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.29 1plk h PHE 90 CO 0.05 0.22 -0.17 0.93 -2.23 0.00 0.00 178.31 177.11 1plk h GLU 91 N 0.73 0.00 0.00 1.11 5.08 0.24 -2.87 114.58 118.87 1plk h GLU 91 Ca 0.58 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.89 1plk h GLU 91 Cb 0.94 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1plk h GLU 91 CO -0.37 0.14 -0.22 -0.44 -1.00 0.00 0.00 179.01 177.12 1plk h ASP 92 N 0.00 0.00 -0.64 1.42 3.32 0.12 -3.33 116.42 117.32 1plk h ASP 92 Ca -0.00 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.14 1plk h ASP 92 Cb 1.11 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.55 1plk h ASP 92 CO 0.02 0.22 -0.44 0.40 -1.72 0.00 0.00 179.24 177.72 1plk h ILE 93 N 0.00 0.08 0.00 0.35 1.08 -1.30 0.30 117.51 118.02 1plk h ILE 93 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1plk h ILE 93 Cb 0.64 0.08 0.00 0.00 -3.07 0.00 0.00 36.82 34.46 1plk h ILE 93 CO 0.03 0.00 0.05 -0.74 -0.69 0.00 0.00 178.15 176.80 1plk h HIS 94 N -0.19 0.00 0.07 1.37 2.76 -1.76 0.38 115.15 117.77 1plk h HIS 94 Ca 0.19 0.00 -0.24 0.00 -2.20 0.00 0.00 60.37 58.12 1plk h HIS 94 Cb 0.56 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.51 1plk h HIS 94 CO -0.74 0.00 -1.12 -0.56 -1.30 0.00 0.00 177.93 174.20 1plk h GLN 95 N 0.00 0.15 0.49 5.26 3.07 -0.59 -3.37 115.11 120.12 1plk h GLN 95 Ca 0.00 -0.25 -0.02 0.00 0.09 0.00 0.00 58.65 58.47 1plk h GLN 95 Cb 0.10 0.09 0.00 0.00 0.08 0.00 0.00 27.48 27.75 1plk h GLN 95 CO 0.00 1.12 -0.24 1.88 0.09 0.00 0.00 178.83 181.68 1plk h TYR 96 N 0.04 -0.61 -0.95 0.06 0.05 -0.77 -3.27 116.97 111.52 1plk h TYR 96 Ca -0.08 -0.01 0.29 0.00 0.05 0.00 0.00 58.73 58.98 1plk h TYR 96 Cb 1.87 0.20 -0.15 0.00 1.01 0.00 0.00 36.73 39.66 1plk h TYR 96 CO 0.03 -0.38 0.36 -0.09 -1.05 0.00 0.00 178.16 177.03 1plk h ARG 97 N -0.76 0.19 -0.65 4.88 2.43 -1.62 0.52 114.38 119.36 1plk h ARG 97 Ca -0.07 -0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.23 1plk h ARG 97 Cb 0.51 -0.04 -0.11 0.00 -0.42 0.00 0.00 29.97 29.91 1plk h ARG 97 CO 0.11 0.12 0.04 0.93 -1.51 0.00 0.00 179.97 179.67 1plk h GLU 98 N 0.19 0.15 0.00 0.20 4.39 -1.72 0.55 114.58 118.34 1plk h GLU 98 Ca 0.65 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.35 1plk h GLU 98 Cb 1.45 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 1plk h GLU 98 CO -0.69 0.10 -0.10 0.37 -1.16 0.00 0.00 179.01 177.53 1plk h GLN 99 N 0.15 0.00 0.00 2.33 4.15 -0.06 0.33 115.11 122.01 1plk h GLN 99 Ca 0.35 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.67 1plk h GLN 99 Cb 0.58 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.25 1plk h GLN 99 CO -0.53 0.00 -1.07 0.82 -1.93 0.00 0.00 178.83 176.12 1plk h ILE 100 N 0.00 0.36 0.03 2.39 2.04 -1.46 -3.28 117.51 117.59 1plk h ILE 100 Ca 0.00 -1.64 -0.22 0.00 1.00 0.00 0.00 64.86 64.00 1plk h ILE 100 Cb 0.89 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.87 1plk h ILE 100 CO 0.00 0.20 -0.99 0.11 0.00 0.00 0.00 178.15 177.48 1plk h LYS 101 N 0.00 0.15 -1.15 2.37 1.57 -0.32 -3.07 116.57 116.12 1plk h LYS 101 Ca -0.08 -0.20 -0.57 0.00 -1.87 0.00 0.00 60.65 57.93 1plk h LYS 101 Cb 1.33 0.07 -0.25 0.00 0.08 0.00 0.00 32.23 33.46 1plk h LYS 101 CO 0.03 1.01 0.74 -2.13 -0.57 0.00 0.00 179.45 178.53 1plk n ARG 102 N -3.54 2.41 0.00 3.15 0.63 0.11 0.20 116.66 119.61 1plk n ARG 102 Ca -0.04 -2.77 0.00 0.00 -0.92 0.00 0.00 57.85 54.12 1plk n ARG 102 Cb 0.89 -2.09 0.00 0.00 0.45 0.00 0.00 32.46 31.71 1plk n ARG 102 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1plk n LYS 104 N -0.57 0.00 -0.62 -0.14 4.81 -1.16 -4.85 118.16 115.63 1plk n LYS 104 Ca 0.53 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.97 1plk n LYS 104 Cb 0.68 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.73 1plk n LYS 104 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1plk n ASP 105 N 0.00 0.00 -3.66 3.14 9.92 -0.77 -4.69 116.55 120.49 1plk n ASP 105 Ca 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 54.79 54.18 1plk n ASP 105 Cb 0.00 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.40 1plk n ASP 105 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1plk s SER 106 N -0.72 -0.77 0.20 -2.24 0.15 0.53 -5.00 113.70 105.85 1plk s SER 106 Ca 0.00 1.26 0.25 0.00 0.70 0.00 0.00 55.95 58.17 1plk s SER 106 Cb 0.00 1.19 0.89 0.00 -1.71 0.00 0.00 66.02 66.39 1plk s SER 106 CO 0.00 -0.22 1.76 0.47 1.20 0.00 0.00 173.24 176.45 1plk n ASP 107 N 4.39 0.68 -3.85 5.45 9.92 -1.26 -3.72 116.55 128.15 1plk n ASP 107 Ca -0.21 0.59 -0.30 0.00 -0.53 0.00 0.00 54.79 54.35 1plk n ASP 107 Cb 0.57 -0.76 -0.15 0.00 -0.64 0.00 0.00 41.12 40.13 1plk n ASP 107 CO 0.00 0.00 0.00 1.51 0.13 0.00 0.00 177.20 178.84 1plk s ASP 108 N -4.26 4.06 -0.03 -2.24 1.47 -1.26 -5.07 116.67 109.33 1plk s ASP 108 Ca 0.09 -1.57 -0.04 0.00 1.18 0.00 0.00 52.55 52.21 1plk s ASP 108 Cb 0.12 -1.09 -0.04 0.00 -0.34 0.00 0.00 42.92 41.57 1plk s ASP 108 CO 0.52 -0.35 0.19 -0.69 0.68 0.00 0.00 175.17 175.51 1plk s VAL 109 N 1.42 5.43 -0.03 2.11 1.01 -1.24 -5.07 120.40 124.03 1plk s VAL 109 Ca 0.05 -0.05 -0.34 0.00 0.00 0.00 0.00 61.98 61.64 1plk s VAL 109 Cb -0.18 -3.52 -0.12 0.00 0.00 0.00 0.00 36.38 32.56 1plk s VAL 109 CO -0.15 0.38 1.79 -2.65 0.00 0.00 0.00 175.10 174.48 1plk n PRO 110 N 1.16 2.12 0.00 2.72 -0.02 -1.26 -5.02 135.00 134.69 1plk n PRO 110 Ca -0.13 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1plk n PRO 110 Cb 0.53 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1plk n PRO 110 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 1plk n MET 111 N 5.73 0.00 -4.80 -0.52 1.56 -1.26 -2.68 117.12 115.15 1plk n MET 111 Ca 0.21 0.00 -0.29 0.00 -0.27 0.00 0.00 57.70 57.35 1plk n MET 111 Cb 0.29 0.00 -0.17 0.00 2.15 0.00 0.00 33.22 35.49 1plk n MET 111 CO 0.00 0.00 0.00 -1.17 -0.73 0.00 0.00 175.97 174.07 1plk s LEU 113 N 0.00 1.89 -0.24 -0.89 2.96 -1.26 -4.84 118.68 116.30 1plk s LEU 113 Ca 0.00 -0.47 -0.06 0.00 -0.22 0.00 0.00 54.13 53.38 1plk s LEU 113 Cb 0.00 -1.19 -0.02 0.00 0.50 0.00 0.00 46.19 45.48 1plk s LEU 113 CO 0.00 0.08 0.03 -0.69 -1.32 0.00 0.00 176.35 174.45 1plk s VAL 114 N 0.64 4.00 -1.05 1.68 1.01 -1.26 -1.36 120.40 124.06 1plk s VAL 114 Ca -0.13 -0.28 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 1plk s VAL 114 Cb -0.16 -2.85 0.23 0.00 0.00 0.00 0.00 36.38 33.60 1plk s VAL 114 CO 0.04 0.37 1.08 -0.83 0.00 0.00 0.00 175.10 175.76 1plk s GLY 115 N 1.56 2.85 0.42 4.51 0.00 0.12 0.18 107.32 116.96 1plk s GLY 115 Ca 0.06 -3.55 0.03 0.00 0.00 0.00 0.00 44.72 41.26 1plk s GLY 115 CO 0.01 1.49 0.61 0.21 0.00 0.00 0.00 173.10 175.43 1plk s ASN 116 N 1.97 5.80 -0.72 1.64 2.47 -0.05 0.24 114.94 126.29 1plk s ASN 116 Ca 0.30 0.06 -0.05 0.00 0.42 0.00 0.00 52.86 53.59 1plk s ASN 116 Cb -0.08 -1.31 0.01 0.00 -1.45 0.00 0.00 41.25 38.41 1plk s ASN 116 CO -0.07 -0.67 0.62 0.29 -3.72 0.00 0.00 177.10 173.55 1plk n LYS 117 N -1.96 -4.16 0.00 0.43 5.02 -1.16 0.86 118.16 117.20 1plk n LYS 117 Ca 0.02 0.44 0.15 0.00 -2.02 0.00 0.00 58.31 56.89 1plk n LYS 117 Cb 0.58 -4.28 0.76 0.00 -0.02 0.00 0.00 35.03 32.07 1plk n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1plk n ASP 119 N -0.95 1.26 -4.46 0.00 5.75 -1.26 -4.96 116.55 111.93 1plk n ASP 119 Ca 0.18 -1.25 -0.29 0.00 -0.01 0.00 0.00 54.79 53.42 1plk n ASP 119 Cb 0.22 0.04 0.14 0.00 -1.03 0.00 0.00 41.12 40.49 1plk n ASP 119 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1plk s LEU 120 N -2.18 2.64 -0.20 -2.12 1.43 -1.21 -5.06 118.68 111.98 1plk s LEU 120 Ca 0.34 0.45 0.16 0.00 -1.03 0.00 0.00 54.13 54.04 1plk s LEU 120 Cb 0.20 -2.68 0.45 0.00 0.03 0.00 0.00 46.19 44.19 1plk s LEU 120 CO 0.40 -2.37 1.18 0.00 0.23 0.00 0.00 176.35 175.79 1plk n ALA 121 N -3.55 3.51 -2.74 4.21 0.00 -1.26 -4.87 120.51 115.81 1plk n ALA 121 Ca 0.12 -3.11 -0.02 0.00 0.00 0.00 0.00 53.44 50.44 1plk n ALA 121 Cb 0.60 -0.55 0.02 0.00 0.00 0.00 0.00 19.45 19.53 1plk n ALA 121 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1plk s GLY 122 N -3.19 -1.70 -0.15 0.00 0.00 -1.26 -5.15 107.32 95.87 1plk s GLY 122 Ca 0.38 0.54 -0.04 0.00 0.00 0.00 0.00 44.72 45.60 1plk s GLY 122 CO -0.05 4.17 -0.00 1.09 0.00 0.00 0.00 173.10 178.30 1plk s ARG 123 N 1.22 3.64 0.11 2.90 1.70 -1.26 -4.69 118.95 122.56 1plk s ARG 123 Ca 0.22 -0.45 0.23 0.00 -0.47 0.00 0.00 55.73 55.27 1plk s ARG 123 Cb 0.08 -2.98 0.14 0.00 -0.57 0.00 0.00 34.95 31.62 1plk s ARG 123 CO -0.10 0.34 1.13 0.25 -1.08 0.00 0.00 175.30 175.83 1plk n THR 124 N 3.28 0.33 -3.60 4.99 -2.24 -0.98 -4.64 114.28 111.42 1plk n THR 124 Ca -0.17 -0.33 -0.40 0.00 -2.27 0.00 0.00 64.05 60.87 1plk n THR 124 Cb 0.53 -0.05 -0.10 0.00 -2.10 0.00 0.00 70.33 68.61 1plk n THR 124 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1plk s VAL 125 N -3.23 4.34 0.30 2.28 1.01 0.21 -4.70 120.40 120.61 1plk s VAL 125 Ca 0.03 -1.25 -0.29 0.00 0.00 0.00 0.00 61.98 60.47 1plk s VAL 125 Cb 0.13 -3.60 -0.11 0.00 0.00 0.00 0.00 36.38 32.81 1plk s VAL 125 CO 0.77 -0.44 1.48 -0.70 0.00 0.00 0.00 175.10 176.21 1plk s GLU 126 N 1.46 4.20 0.27 2.72 2.56 -1.26 -4.77 118.70 123.88 1plk s GLU 126 Ca 0.03 2.44 -0.02 0.00 0.00 0.00 0.00 54.97 57.41 1plk s GLU 126 Cb -0.22 -3.05 0.59 0.00 2.00 0.00 0.00 34.13 33.45 1plk s GLU 126 CO 0.03 -0.48 1.63 0.77 -0.56 0.00 0.00 175.26 176.65 1plk h SER 127 N 4.31 -0.26 -0.94 -1.70 0.02 -1.97 -1.10 113.55 111.91 1plk h SER 127 Ca -0.48 0.21 0.28 0.00 -0.84 0.00 0.00 61.79 60.96 1plk h SER 127 Cb 1.22 0.35 -0.15 0.00 0.14 0.00 0.00 62.40 63.96 1plk h SER 127 CO 0.74 -0.20 0.40 -0.09 -1.14 0.00 0.00 176.83 176.53 1plk h ARG 128 N 0.12 0.26 0.00 3.45 9.65 -2.04 0.89 114.38 126.71 1plk h ARG 128 Ca 0.50 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.36 1plk h ARG 128 Cb 0.95 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.47 1plk h ARG 128 CO -0.71 0.17 -0.20 0.00 2.80 0.00 0.00 179.97 182.03 1plk n GLN 129 N -5.14 0.09 -0.06 0.20 10.64 -0.42 -2.92 117.38 119.78 1plk n GLN 129 Ca 0.26 0.06 -0.00 0.00 -1.83 0.00 0.00 57.00 55.49 1plk n GLN 129 Cb 0.83 -1.59 0.02 0.00 -0.86 0.00 0.00 30.24 28.64 1plk n GLN 129 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1plk n ALA 130 N -1.60 2.63 -0.14 2.61 0.00 0.31 -4.73 120.51 119.58 1plk n ALA 130 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1plk n ALA 130 Cb 0.37 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.80 1plk n ALA 130 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1plk n ASP 132 N 0.20 0.00 0.00 0.00 9.92 -1.15 -4.38 116.55 121.15 1plk n ASP 132 Ca 0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.28 1plk n ASP 132 Cb 0.42 -0.11 0.00 0.00 -0.64 0.00 0.00 41.12 40.79 1plk n ASP 132 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1plk n ALA 134 N -0.14 0.00 0.27 2.24 0.00 -1.26 -0.35 120.51 121.27 1plk n ALA 134 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 1plk n ALA 134 Cb 0.00 0.00 0.74 0.00 0.00 0.00 0.00 19.45 20.19 1plk n ALA 134 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1plk h ARG 135 N 0.00 0.00 0.00 0.00 2.43 -1.99 -0.53 114.38 114.29 1plk h ARG 135 Ca 0.00 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1plk h ARG 135 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1plk h ARG 135 CO 0.00 0.00 -0.45 0.66 -1.51 0.00 0.00 179.97 178.67 1plk h SER 136 N 0.00 0.00 0.00 -3.80 4.64 -1.05 -3.32 113.55 110.02 1plk h SER 136 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1plk h SER 136 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1plk h SER 136 CO -0.00 0.45 -0.09 1.88 -0.87 0.00 0.00 176.83 178.20 1plk h TYR 137 N 0.00 0.00 0.00 4.77 0.05 -1.40 -3.55 116.97 116.84 1plk h TYR 137 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1plk h TYR 137 Cb 0.90 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.64 1plk h TYR 137 CO 0.00 1.02 0.00 0.41 -1.05 0.00 0.00 178.16 178.54 1plk n GLY 138 N 1.60 1.35 0.00 3.88 0.00 -0.67 -5.03 105.19 106.32 1plk n GLY 138 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1plk n GLY 138 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1plk n ILE 142 N -0.01 0.00 -3.88 -0.61 5.41 -0.47 -4.91 119.36 114.89 1plk n ILE 142 Ca 0.00 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.40 1plk n ILE 142 Cb 0.00 0.00 -0.13 0.00 -0.71 0.00 0.00 39.64 38.80 1plk n ILE 142 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1plk s GLU 143 N -1.92 2.28 -0.13 0.38 2.02 -1.26 -0.70 118.70 119.36 1plk s GLU 143 Ca 0.00 -1.43 -0.05 0.00 0.02 0.00 0.00 54.97 53.51 1plk s GLU 143 Cb 0.00 -3.28 -0.04 0.00 0.10 0.00 0.00 34.13 30.92 1plk s GLU 143 CO 0.00 -0.74 0.05 0.95 0.02 0.00 0.00 175.26 175.54 1plk s THR 144 N 1.21 4.72 -0.31 3.63 -4.23 0.67 -4.90 115.64 116.42 1plk s THR 144 Ca -0.01 -0.08 0.02 0.00 -1.18 0.00 0.00 61.69 60.43 1plk s THR 144 Cb -0.20 -3.05 0.07 0.00 1.34 0.00 0.00 72.50 70.66 1plk s THR 144 CO -0.02 0.55 -0.01 -0.55 -0.54 0.00 0.00 174.62 174.06 1plk s SER 145 N -0.43 4.73 0.00 3.99 0.15 0.29 -2.99 113.70 119.43 1plk s SER 145 Ca 0.09 -1.65 0.15 0.00 0.70 0.00 0.00 55.95 55.25 1plk s SER 145 Cb -0.12 -1.64 0.71 0.00 -1.71 0.00 0.00 66.02 63.26 1plk s SER 145 CO 0.02 -0.30 1.46 0.00 1.20 0.00 0.00 173.24 175.62 1plk n ALA 146 N 4.44 1.77 0.04 5.45 0.00 -1.26 -0.70 120.51 130.26 1plk n ALA 146 Ca -0.08 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.41 1plk n ALA 146 Cb 0.42 -1.25 -0.14 0.00 0.00 0.00 0.00 19.45 18.48 1plk n ALA 146 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1plk n LYS 147 N -1.39 0.63 -0.06 0.00 4.81 -1.26 -4.61 118.16 116.28 1plk n LYS 147 Ca 0.05 -0.15 -0.10 0.00 -0.87 0.00 0.00 58.31 57.25 1plk n LYS 147 Cb 0.15 -1.56 -0.05 0.00 0.02 0.00 0.00 35.03 33.59 1plk n LYS 147 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1plk n THR 148 N -2.29 0.65 0.00 3.15 -2.24 -1.15 -5.01 114.28 107.39 1plk n THR 148 Ca -0.03 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1plk n THR 148 Cb 0.56 -1.14 0.00 0.00 -2.10 0.00 0.00 70.33 67.64 1plk n THR 148 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1plk n ARG 149 N -3.06 0.00 -1.21 -0.78 0.63 0.13 -5.13 116.66 107.25 1plk n ARG 149 Ca -0.21 0.00 -0.23 0.00 -0.92 0.00 0.00 57.85 56.49 1plk n ARG 149 Cb 0.70 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.61 1plk n ARG 149 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 1plk n GLN 150 N -0.42 2.15 0.00 -0.14 7.27 -0.75 -4.91 117.38 120.57 1plk n GLN 150 Ca 0.00 -2.07 0.00 0.00 0.07 0.00 0.00 57.00 55.00 1plk n GLN 150 Cb 0.00 -1.91 0.00 0.00 2.41 0.00 0.00 30.24 30.74 1plk n GLN 150 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1plk n VAL 152 N 0.47 0.00 -0.05 1.69 0.31 -1.26 0.10 118.33 119.59 1plk n VAL 152 Ca 0.41 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.73 1plk n VAL 152 Cb 0.57 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.37 1plk n VAL 152 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1plk n GLU 153 N -0.27 1.04 -0.16 5.55 1.02 -1.26 -3.93 120.64 122.63 1plk n GLU 153 Ca 0.00 -0.07 -0.01 0.00 -0.02 0.00 0.00 57.16 57.06 1plk n GLU 153 Cb 0.00 -1.41 0.22 0.00 -0.02 0.00 0.00 31.44 30.23 1plk n GLU 153 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1plk h ASP 154 N 0.00 0.80 0.41 1.62 1.82 -1.96 0.13 116.42 119.24 1plk h ASP 154 Ca -0.26 -0.09 -0.02 0.00 -0.39 0.00 0.00 57.03 56.27 1plk h ASP 154 Cb 1.50 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 41.31 1plk h ASP 154 CO 0.01 0.69 -0.20 0.00 -1.61 0.00 0.00 179.24 178.14 1plk h ALA 155 N 1.43 -0.59 0.14 -0.78 0.00 -1.96 -3.42 119.26 114.08 1plk h ALA 155 Ca 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1plk h ALA 155 Cb 0.12 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1plk h ALA 155 CO -0.03 -0.55 -0.10 0.74 0.00 0.00 0.00 179.25 179.32 1plk h PHE 156 N -1.05 -0.26 0.00 0.00 -1.00 -1.66 -3.08 116.94 109.89 1plk h PHE 156 Ca -0.06 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.72 1plk h PHE 156 Cb 0.42 0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.08 1plk h PHE 156 CO 0.01 -0.14 0.04 0.66 -1.61 0.00 0.00 178.31 177.27 1plk n TYR 157 N -2.82 0.00 0.00 -0.55 4.01 0.46 -1.51 117.16 116.75 1plk n TYR 157 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1plk n TYR 157 Cb 0.10 -0.19 0.00 0.00 -0.31 0.00 0.00 39.34 38.93 1plk n TYR 157 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1plk n LEU 159 N 1.74 0.00 -0.08 7.72 7.94 -1.17 0.11 117.00 133.27 1plk n LEU 159 Ca 0.00 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.82 1plk n LEU 159 Cb 0.00 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 43.94 1plk n LEU 159 CO 0.02 0.00 0.96 0.58 -1.11 0.00 0.00 177.39 177.84 1plk h VAL 160 N 0.00 1.00 -0.99 1.96 2.07 -1.58 -1.60 116.25 117.11 1plk h VAL 160 Ca 0.00 -0.10 0.21 0.00 0.82 0.00 0.00 66.70 67.63 1plk h VAL 160 Cb 0.00 0.67 -0.10 0.00 -1.52 0.00 0.00 31.29 30.35 1plk h VAL 160 CO 0.00 0.05 0.62 0.03 0.02 0.00 0.00 177.57 178.30 1plk h ARG 161 N 0.30 0.57 -0.24 1.57 3.08 0.54 0.15 114.38 120.35 1plk h ARG 161 Ca 0.11 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 1plk h ARG 161 Cb 0.03 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1plk h ARG 161 CO -0.07 0.38 -0.10 0.93 -1.07 0.00 0.00 179.97 180.03 1plk h GLU 162 N 0.59 0.50 -0.85 0.04 4.39 -1.59 -2.76 114.58 114.90 1plk h GLU 162 Ca 0.56 -0.21 0.21 0.00 0.34 0.00 0.00 59.36 60.26 1plk h GLU 162 Cb 1.13 -0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 29.63 1plk h GLU 162 CO -0.32 0.76 0.26 0.82 -1.16 0.00 0.00 179.01 179.36 1plk h ILE 163 N 0.23 0.40 0.00 3.13 2.04 -0.26 0.38 117.51 123.42 1plk h ILE 163 Ca 0.06 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1plk h ILE 163 Cb 0.60 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 1plk h ILE 163 CO 0.03 0.05 0.00 0.03 0.00 0.00 0.00 178.15 178.26 1plk h ARG 164 N 0.27 0.00 -2.72 2.37 3.08 -0.75 -3.21 114.38 113.42 1plk h ARG 164 Ca 0.52 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.96 1plk h ARG 164 Cb 0.99 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.64 1plk h ARG 164 CO -0.59 0.00 -0.79 -0.65 -1.07 0.00 0.00 179.97 176.87 1plk s GLN 165 N -3.50 1.58 0.00 0.04 -0.21 0.13 -5.08 119.66 112.63 1plk s GLN 165 Ca 0.02 -2.61 0.00 0.00 0.02 0.00 0.00 55.36 52.79 1plk s GLN 165 Cb 0.09 -2.33 0.00 0.00 1.00 0.00 0.00 33.01 31.77 1plk s GLN 165 CO 0.40 -1.33 0.21 0.72 -2.12 0.00 0.00 175.29 173.18