#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1loa s GLU 2 N 0.00 1.44 0.25 -2.82 2.02 -1.26 -5.16 118.70 113.16 1loa s GLU 2 Ca 0.00 -0.29 0.06 0.00 0.02 0.00 0.00 54.97 54.76 1loa s GLU 2 Cb 0.00 -1.30 -0.05 0.00 0.10 0.00 0.00 34.13 32.87 1loa s GLU 2 CO 0.00 -0.07 -0.06 0.95 0.02 0.00 0.00 175.26 176.09 1loa s THR 3 N 0.98 1.50 -0.08 3.63 -4.23 -1.26 -5.05 115.64 111.13 1loa s THR 3 Ca -0.09 -2.12 -0.06 0.00 -1.18 0.00 0.00 61.69 58.24 1loa s THR 3 Cb -0.15 -2.32 0.03 0.00 1.34 0.00 0.00 72.50 71.40 1loa s THR 3 CO 0.00 -0.38 0.21 -0.89 -0.54 0.00 0.00 174.62 173.02 1loa s THR 4 N -3.11 -0.01 0.01 3.99 2.01 -1.26 -5.07 115.64 112.19 1loa s THR 4 Ca 0.27 0.05 -0.17 0.00 0.31 0.00 0.00 61.69 62.15 1loa s THR 4 Cb 0.03 -0.31 0.03 0.00 0.01 0.00 0.00 72.50 72.26 1loa s THR 4 CO 0.10 0.02 0.37 -0.44 -0.69 0.00 0.00 174.62 173.98 1loa s SER 5 N 0.47 -0.25 0.02 3.53 0.01 -1.26 -5.09 113.70 111.14 1loa s SER 5 Ca -0.03 0.07 -0.27 0.00 1.31 0.00 0.00 55.95 57.03 1loa s SER 5 Cb -0.04 0.37 0.09 0.00 0.21 0.00 0.00 66.02 66.65 1loa s SER 5 CO -0.02 -0.56 0.79 0.72 0.41 0.00 0.00 173.24 174.58 1loa s PHE 6 N -1.86 -0.44 0.07 2.43 -0.12 -1.26 -5.19 117.98 111.60 1loa s PHE 6 Ca -0.09 0.40 -0.02 0.00 -0.05 0.00 0.00 56.93 57.17 1loa s PHE 6 Cb -0.03 0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 42.85 1loa s PHE 6 CO 0.02 -0.62 0.01 -1.54 -0.05 0.00 0.00 175.22 173.04 1loa s SER 7 N -2.26 0.41 -0.35 1.98 1.04 -1.26 -5.12 113.70 108.15 1loa s SER 7 Ca 0.01 -0.98 0.06 0.00 0.48 0.00 0.00 55.95 55.52 1loa s SER 7 Cb -0.01 0.23 0.18 0.00 0.10 0.00 0.00 66.02 66.53 1loa s SER 7 CO -0.07 -0.64 0.55 -0.63 0.98 0.00 0.00 173.24 173.43 1loa s ILE 8 N -3.93 -0.85 -0.89 -1.02 1.01 -1.26 -5.01 121.20 109.26 1loa s ILE 8 Ca 0.09 -0.18 0.27 0.00 0.00 0.00 0.00 60.65 60.83 1loa s ILE 8 Cb 0.07 -0.57 0.25 0.00 0.01 0.00 0.00 42.46 42.22 1loa s ILE 8 CO -0.09 -0.13 1.84 0.41 0.00 0.00 0.00 174.94 176.98 1loa n THR 9 N 4.87 0.30 -3.65 2.92 -1.04 -1.26 -4.77 114.28 111.65 1loa n THR 9 Ca 0.07 -0.08 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 1loa n THR 9 Cb 0.53 -0.59 -0.06 0.00 -1.82 0.00 0.00 70.33 68.39 1loa n THR 9 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1loa s LYS 10 N -3.05 0.61 0.25 -2.82 2.20 -1.26 -5.09 119.74 110.58 1loa s LYS 10 Ca 0.12 1.29 -0.06 0.00 -0.36 0.00 0.00 55.97 56.96 1loa s LYS 10 Cb 0.16 0.45 -0.06 0.00 -1.51 0.00 0.00 37.83 36.87 1loa s LYS 10 CO 0.53 -0.18 0.53 -0.06 -0.36 0.00 0.00 175.35 175.81 1loa s PHE 11 N 2.21 3.46 0.48 4.03 0.40 -0.91 -5.04 117.98 122.62 1loa s PHE 11 Ca -0.08 0.68 0.03 0.00 -0.60 0.00 0.00 56.93 56.96 1loa s PHE 11 Cb -0.09 -2.12 -0.02 0.00 0.51 0.00 0.00 43.02 41.30 1loa s PHE 11 CO -0.19 0.23 0.06 0.20 0.70 0.00 0.00 175.22 176.23 1loa s GLY 12 N -2.88 2.79 0.56 4.36 0.00 -1.26 -4.35 107.32 106.54 1loa s GLY 12 Ca 0.44 -1.03 0.28 0.00 0.00 0.00 0.00 44.72 44.42 1loa s GLY 12 CO 0.27 -2.13 1.96 -2.55 0.00 0.00 0.00 173.10 170.65 1loa h PRO 13 N 1.38 0.00 -1.72 2.90 0.11 -1.98 -3.18 132.00 129.51 1loa h PRO 13 Ca -0.43 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.17 1loa h PRO 13 Cb 1.29 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 32.05 1loa h PRO 13 CO 0.74 0.00 -1.03 -3.47 -0.21 0.00 0.00 178.00 174.03 1loa n ASP 14 N -4.10 -0.20 -4.56 -2.05 2.03 -1.26 -4.82 116.55 101.58 1loa n ASP 14 Ca 0.10 -2.81 -0.34 0.00 0.52 0.00 0.00 54.79 52.26 1loa n ASP 14 Cb 0.67 -0.28 -0.04 0.00 -0.72 0.00 0.00 41.12 40.74 1loa n ASP 14 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1loa s GLN 15 N -1.02 3.09 0.00 -0.67 2.00 -1.20 -4.79 119.66 117.06 1loa s GLN 15 Ca 0.35 -0.87 0.27 0.00 -2.00 0.00 0.00 55.36 53.11 1loa s GLN 15 Cb 0.19 -5.24 1.16 0.00 0.80 0.00 0.00 33.01 29.92 1loa s GLN 15 CO -0.12 -2.87 1.86 1.04 -0.50 0.00 0.00 175.29 174.69 1loa n GLN 16 N 8.77 0.05 0.00 1.67 6.02 -1.26 -2.98 117.38 129.65 1loa n GLN 16 Ca 0.39 0.04 0.14 0.00 -0.01 0.00 0.00 57.00 57.56 1loa n GLN 16 Cb 0.48 -1.50 0.50 0.00 1.02 0.00 0.00 30.24 30.74 1loa n GLN 16 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1loa n ASN 17 N -1.47 1.09 -4.90 1.08 6.94 -1.26 -4.85 115.26 111.89 1loa n ASN 17 Ca 0.07 -1.10 -0.32 0.00 -0.02 0.00 0.00 54.58 53.21 1loa n ASN 17 Cb 0.30 0.04 -0.05 0.00 -2.36 0.00 0.00 39.78 37.72 1loa n ASN 17 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1loa s LEU 18 N -2.27 4.31 -0.13 -4.53 1.43 -1.16 -0.48 118.68 115.86 1loa s LEU 18 Ca 0.32 0.28 -0.09 0.00 -1.03 0.00 0.00 54.13 53.60 1loa s LEU 18 Cb 0.20 -2.75 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 1loa s LEU 18 CO 0.43 0.22 0.19 -0.63 0.23 0.00 0.00 176.35 176.79 1loa s ILE 19 N -1.41 5.40 -0.03 -0.59 1.01 -0.39 -4.83 121.20 120.37 1loa s ILE 19 Ca 0.31 0.33 0.05 0.00 0.00 0.00 0.00 60.65 61.34 1loa s ILE 19 Cb -0.13 -3.48 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 1loa s ILE 19 CO 0.23 0.55 -0.19 -0.36 0.00 0.00 0.00 174.94 175.17 1loa s PHE 20 N -0.56 2.56 0.06 3.97 0.40 -1.26 -2.01 117.98 121.14 1loa s PHE 20 Ca 0.15 -0.26 0.04 0.00 -0.60 0.00 0.00 56.93 56.25 1loa s PHE 20 Cb -0.13 -1.57 -0.03 0.00 0.51 0.00 0.00 43.02 41.81 1loa s PHE 20 CO 0.04 0.11 -0.11 -0.65 0.70 0.00 0.00 175.22 175.32 1loa s GLN 21 N -0.75 0.69 6.65 0.44 -0.21 -0.20 -4.95 119.66 121.34 1loa s GLN 21 Ca 0.11 -0.90 0.00 0.00 0.02 0.00 0.00 55.36 54.59 1loa s GLN 21 Cb -0.10 -0.54 0.00 0.00 1.00 0.00 0.00 33.01 33.37 1loa s GLN 21 CO 0.00 0.11 0.00 0.41 -2.12 0.00 0.00 175.29 173.69 1loa n GLY 22 N 1.25 2.62 0.00 3.09 0.00 -1.26 -2.09 105.19 108.79 1loa n GLY 22 Ca -0.21 -0.36 0.10 0.00 0.00 0.00 0.00 46.02 45.56 1loa n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1loa n ASP 23 N 3.86 0.00 -4.74 1.61 9.92 -0.39 -4.91 116.55 121.89 1loa n ASP 23 Ca 0.00 -1.28 -0.41 0.00 -0.53 0.00 0.00 54.79 52.57 1loa n ASP 23 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 1loa n ASP 23 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1loa s GLY 24 N -1.69 2.67 0.13 0.44 0.00 -0.89 -4.79 107.32 103.20 1loa s GLY 24 Ca 0.31 0.97 -0.25 0.00 0.00 0.00 0.00 44.72 45.75 1loa s GLY 24 CO 0.24 1.87 0.78 -2.52 0.00 0.00 0.00 173.10 173.46 1loa s TYR 25 N -0.09 -0.34 -0.12 1.90 1.13 -1.18 -4.60 117.35 114.06 1loa s TYR 25 Ca 0.53 0.09 -0.11 0.00 -1.41 0.00 0.00 57.07 56.17 1loa s TYR 25 Cb -0.33 0.59 -0.05 0.00 -1.10 0.00 0.00 41.96 41.08 1loa s TYR 25 CO 0.37 -0.82 0.25 0.99 -2.51 0.00 0.00 175.55 173.84 1loa s THR 26 N -3.49 5.32 0.08 -3.49 2.01 -1.26 -1.73 115.64 113.08 1loa s THR 26 Ca 0.06 0.46 -0.03 0.00 0.31 0.00 0.00 61.69 62.49 1loa s THR 26 Cb -0.02 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 68.90 1loa s THR 26 CO -0.05 0.51 0.05 0.28 -0.69 0.00 0.00 174.62 174.71 1loa s THR 27 N -0.34 0.17 -0.27 -0.82 -1.32 -0.98 -4.83 115.64 107.24 1loa s THR 27 Ca 0.16 -1.70 -0.03 0.00 -1.21 0.00 0.00 61.69 58.91 1loa s THR 27 Cb -0.13 -1.64 0.03 0.00 -1.51 0.00 0.00 72.50 69.25 1loa s THR 27 CO 0.05 -0.77 0.07 0.29 -2.21 0.00 0.00 174.62 172.05 1loa n LYS 28 N 0.01 -0.96 -3.08 7.08 4.01 -1.26 -0.79 118.16 123.17 1loa n LYS 28 Ca -0.12 0.02 -0.23 0.00 -0.51 0.00 0.00 58.31 57.48 1loa n LYS 28 Cb 0.62 -0.67 0.04 0.00 -0.51 0.00 0.00 35.03 34.51 1loa n LYS 28 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 1loa n GLU 29 N -1.13 -5.08 -4.35 1.97 -0.58 -1.26 -5.04 120.64 105.17 1loa n GLU 29 Ca 0.00 0.89 -0.18 0.00 -0.42 0.00 0.00 57.16 57.45 1loa n GLU 29 Cb 0.07 -5.77 -0.10 0.00 -0.57 0.00 0.00 31.44 25.07 1loa n GLU 29 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1loa s ARG 30 N -5.77 1.35 -0.23 3.49 0.52 0.03 -2.14 118.95 116.20 1loa s ARG 30 Ca 0.33 -1.63 -0.21 0.00 -0.52 0.00 0.00 55.73 53.70 1loa s ARG 30 Cb -0.15 -1.00 -0.02 0.00 0.52 0.00 0.00 34.95 34.30 1loa s ARG 30 CO 0.41 0.10 0.64 -1.17 0.02 0.00 0.00 175.30 175.29 1loa s LEU 31 N -3.33 4.10 -0.31 2.53 2.96 -1.26 -2.33 118.68 121.04 1loa s LEU 31 Ca 0.24 0.77 -0.09 0.00 -0.22 0.00 0.00 54.13 54.83 1loa s LEU 31 Cb 0.02 -2.88 -0.00 0.00 0.50 0.00 0.00 46.19 43.82 1loa s LEU 31 CO 0.08 -0.33 0.14 -0.89 -1.32 0.00 0.00 176.35 174.02 1loa s THR 32 N 2.27 4.50 0.05 3.68 2.01 -0.71 -4.96 115.64 122.48 1loa s THR 32 Ca 0.27 -0.49 0.06 0.00 0.31 0.00 0.00 61.69 61.85 1loa s THR 32 Cb -0.16 -3.31 -0.23 0.00 0.01 0.00 0.00 72.50 68.81 1loa s THR 32 CO 0.09 0.05 1.03 -0.07 -0.69 0.00 0.00 174.62 175.04 1loa h LEU 33 N 8.34 0.10 -7.31 4.42 -0.00 -1.88 -3.11 115.31 115.86 1loa h LEU 33 Ca -0.32 -0.13 -0.10 0.00 -0.00 0.00 0.00 57.88 57.33 1loa h LEU 33 Cb 1.14 -0.03 -0.21 0.00 -0.00 0.00 0.00 40.66 41.56 1loa h LEU 33 CO 0.62 1.11 -0.13 0.42 -0.00 0.00 0.00 178.44 180.46 1loa s THR 34 N -2.66 0.03 0.73 0.22 -4.23 -1.26 -3.37 115.64 105.10 1loa s THR 34 Ca -0.03 -0.22 -0.03 0.00 -1.18 0.00 0.00 61.69 60.23 1loa s THR 34 Cb 0.09 -0.72 0.12 0.00 1.34 0.00 0.00 72.50 73.32 1loa s THR 34 CO 0.83 -0.12 1.02 -0.54 -0.54 0.00 0.00 174.62 175.27 1loa s LYS 35 N -0.81 1.69 -1.31 3.99 -0.14 -1.26 -4.99 119.74 116.90 1loa s LYS 35 Ca -0.09 -0.87 -0.17 0.00 -1.36 0.00 0.00 55.97 53.48 1loa s LYS 35 Cb -0.03 -2.26 0.07 0.00 -1.68 0.00 0.00 37.83 33.93 1loa s LYS 35 CO 0.05 -1.47 1.79 0.00 -0.76 0.00 0.00 175.35 174.95 1loa n ALA 36 N -2.92 3.83 -2.87 5.17 0.00 -1.26 -4.91 120.51 117.55 1loa n ALA 36 Ca 0.13 -3.88 -0.11 0.00 0.00 0.00 0.00 53.44 49.59 1loa n ALA 36 Cb 0.60 -3.57 -0.08 0.00 0.00 0.00 0.00 19.45 16.40 1loa n ALA 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1loa s VAL 37 N 3.94 0.11 0.76 0.00 0.11 -1.26 -5.13 120.40 118.92 1loa s VAL 37 Ca 0.52 -0.87 -0.12 0.00 -2.93 0.00 0.00 61.98 58.59 1loa s VAL 37 Cb 0.05 -0.94 0.05 0.00 -1.53 0.00 0.00 36.38 34.01 1loa s VAL 37 CO 0.05 -0.48 1.12 -0.13 -3.33 0.00 0.00 175.10 172.34 1loa s ARG 38 N -2.63 2.42 0.00 1.54 0.52 -1.26 -4.46 118.95 115.08 1loa s ARG 38 Ca -0.05 0.40 0.00 0.00 -0.52 0.00 0.00 55.73 55.57 1loa s ARG 38 Cb -0.01 -1.98 0.00 0.00 0.52 0.00 0.00 34.95 33.49 1loa s ARG 38 CO -0.04 -1.33 0.00 0.09 0.02 0.00 0.00 175.30 174.04 1loa n ASN 39 N -3.20 0.00 -4.09 0.23 3.02 -1.26 -5.02 115.26 104.94 1loa n ASN 39 Ca 0.07 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.49 1loa n ASN 39 Cb 0.58 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.64 1loa n ASN 39 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1loa s THR 40 N 0.00 0.64 0.06 3.41 -4.23 -1.26 -5.09 115.64 109.16 1loa s THR 40 Ca 0.00 -1.23 0.06 0.00 -1.18 0.00 0.00 61.69 59.34 1loa s THR 40 Cb 0.00 -0.81 -0.03 0.00 1.34 0.00 0.00 72.50 73.00 1loa s THR 40 CO 0.00 -0.43 -0.17 0.54 -0.54 0.00 0.00 174.62 174.03 1loa s VAL 41 N -1.67 1.33 -0.05 2.29 0.11 -1.26 -4.70 120.40 116.46 1loa s VAL 41 Ca -0.06 -1.22 -0.02 0.00 -2.93 0.00 0.00 61.98 57.75 1loa s VAL 41 Cb -0.08 -1.21 0.03 0.00 -1.53 0.00 0.00 36.38 33.59 1loa s VAL 41 CO 0.00 -0.03 0.11 -0.83 -3.33 0.00 0.00 175.10 171.03 1loa s GLY 42 N -1.44 -0.02 0.03 6.54 0.00 -1.22 -1.27 107.32 109.95 1loa s GLY 42 Ca 0.03 0.53 0.01 0.00 0.00 0.00 0.00 44.72 45.28 1loa s GLY 42 CO 0.02 0.78 -0.05 0.50 0.00 0.00 0.00 173.10 174.35 1loa s ARG 43 N 0.91 0.42 -0.07 2.90 0.52 -0.91 -4.86 118.95 117.85 1loa s ARG 43 Ca -0.07 -0.71 -0.03 0.00 -0.52 0.00 0.00 55.73 54.40 1loa s ARG 43 Cb -0.09 -0.04 0.04 0.00 0.52 0.00 0.00 34.95 35.38 1loa s ARG 43 CO -0.04 -0.02 0.14 0.00 0.02 0.00 0.00 175.30 175.40 1loa s ALA 44 N -1.61 -0.12 0.25 2.13 0.00 -1.26 -1.03 121.76 120.12 1loa s ALA 44 Ca -0.12 0.52 0.09 0.00 0.00 0.00 0.00 51.96 52.45 1loa s ALA 44 Cb -0.09 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1loa s ALA 44 CO -0.01 -0.43 0.05 -0.51 0.00 0.00 0.00 175.76 174.86 1loa s LEU 45 N 1.93 3.38 0.34 0.00 1.43 -0.85 -4.94 118.68 119.98 1loa s LEU 45 Ca -0.00 -0.50 -0.17 0.00 -1.03 0.00 0.00 54.13 52.43 1loa s LEU 45 Cb -0.12 -1.93 -0.09 0.00 0.03 0.00 0.00 46.19 44.08 1loa s LEU 45 CO -0.05 0.00 0.79 -0.47 0.23 0.00 0.00 176.35 176.85 1loa s TYR 46 N -2.18 3.38 -0.20 0.29 5.04 -1.26 -1.26 117.35 121.16 1loa s TYR 46 Ca 0.31 1.33 0.22 0.00 -2.44 0.00 0.00 57.07 56.50 1loa s TYR 46 Cb -0.07 -2.62 0.49 0.00 0.35 0.00 0.00 41.96 40.11 1loa s TYR 46 CO 0.21 0.06 1.65 0.66 -1.34 0.00 0.00 175.55 176.79 1loa h SER 47 N 2.27 0.00 -3.26 4.32 4.64 -1.10 -3.44 113.55 116.98 1loa h SER 47 Ca -0.48 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.27 1loa h SER 47 Cb 1.18 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.22 1loa h SER 47 CO 0.64 0.18 -0.04 -0.55 -0.87 0.00 0.00 176.83 176.19 1loa s SER 48 N -6.21 6.98 0.45 4.97 0.15 -1.26 -5.04 113.70 113.74 1loa s SER 48 Ca 0.04 1.17 -0.24 0.00 0.70 0.00 0.00 55.95 57.62 1loa s SER 48 Cb 0.07 -2.35 -0.09 0.00 -1.71 0.00 0.00 66.02 61.94 1loa s SER 48 CO 0.67 0.18 1.17 -2.65 1.20 0.00 0.00 173.24 173.80 1loa n PRO 49 N 2.34 1.63 -4.32 5.44 -0.02 -1.26 -5.03 135.00 133.78 1loa n PRO 49 Ca -0.09 0.59 -0.34 0.00 -2.02 0.00 0.00 63.50 61.64 1loa n PRO 49 Cb 0.51 -2.27 -0.12 0.00 -0.02 0.00 0.00 33.50 31.60 1loa n PRO 49 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1loa s ILE 50 N -1.26 3.96 -0.52 4.25 -1.09 -1.26 -5.09 121.20 120.19 1loa s ILE 50 Ca 0.64 -0.33 -0.24 0.00 -2.23 0.00 0.00 60.65 58.49 1loa s ILE 50 Cb -0.51 -2.75 0.04 0.00 -1.58 0.00 0.00 42.46 37.66 1loa s ILE 50 CO 0.56 0.48 0.90 -2.28 -1.23 0.00 0.00 174.94 173.37 1loa s HIS 51 N 0.46 2.86 -0.11 3.97 2.46 -1.26 -4.91 115.29 118.76 1loa s HIS 51 Ca -0.03 0.07 0.19 0.00 0.47 0.00 0.00 55.06 55.76 1loa s HIS 51 Cb -0.14 -3.97 -0.28 0.00 -0.13 0.00 0.00 32.58 28.06 1loa s HIS 51 CO 0.03 -1.23 0.25 1.51 -2.47 0.00 0.00 174.74 172.82 1loa n ILE 52 N 6.21 0.70 -3.78 0.89 0.13 -1.26 -4.82 119.36 117.43 1loa n ILE 52 Ca 0.02 -0.66 -0.09 0.00 -1.10 0.00 0.00 62.75 60.93 1loa n ILE 52 Cb 0.48 -0.25 -0.03 0.00 -0.84 0.00 0.00 39.64 39.00 1loa n ILE 52 CO 0.00 0.00 0.00 -1.66 2.80 0.00 0.00 176.55 177.69 1loa s TRP 53 N -2.93 -0.16 -0.05 9.51 1.48 -1.26 -0.38 118.94 125.15 1loa s TRP 53 Ca -0.09 -0.22 -0.02 0.00 -1.06 0.00 0.00 56.10 54.71 1loa s TRP 53 Cb 0.09 0.54 0.03 0.00 -1.16 0.00 0.00 33.47 32.98 1loa s TRP 53 CO 0.83 -1.07 0.05 0.34 -4.06 0.00 0.00 176.95 173.04 1loa s ASP 54 N -2.89 1.26 0.07 -2.66 2.15 -0.71 -4.99 116.67 108.90 1loa s ASP 54 Ca 0.10 0.02 0.21 0.00 0.43 0.00 0.00 52.55 53.32 1loa s ASP 54 Cb -0.03 -0.19 0.87 0.00 -0.30 0.00 0.00 42.92 43.27 1loa s ASP 54 CO 0.02 -0.25 1.67 -1.54 -0.17 0.00 0.00 175.17 174.89 1loa n SER 55 N 5.28 0.22 -0.26 -0.34 3.41 -1.26 -0.25 113.62 120.42 1loa n SER 55 Ca -0.04 0.54 -0.07 0.00 -0.26 0.00 0.00 58.87 59.04 1loa n SER 55 Cb 0.50 -0.59 0.05 0.00 -0.26 0.00 0.00 64.21 63.91 1loa n SER 55 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1loa h LYS 56 N 0.00 1.11 0.00 4.33 3.64 -1.97 -3.35 116.57 120.33 1loa h LYS 56 Ca 0.00 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1loa h LYS 56 Cb 0.39 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1loa h LYS 56 CO 0.00 0.96 0.00 0.25 -2.27 0.00 0.00 179.45 178.39 1loa n THR 57 N -4.28 0.00 -0.76 1.00 -2.24 -1.05 -5.01 114.28 101.94 1loa n THR 57 Ca 0.05 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1loa n THR 57 Cb 0.23 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 1loa n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1loa n GLY 58 N 0.75 1.22 3.79 3.38 0.00 0.66 -5.00 105.19 109.99 1loa n GLY 58 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1loa n GLY 58 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1loa s ASN 59 N -3.12 5.93 0.16 1.61 0.01 -1.24 -4.80 114.94 113.49 1loa s ASN 59 Ca 0.00 2.02 0.07 0.00 -0.71 0.00 0.00 52.86 54.23 1loa s ASN 59 Cb 0.00 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.05 1loa s ASN 59 CO 0.00 -1.07 -0.14 -0.69 -1.51 0.00 0.00 177.10 173.69 1loa s VAL 60 N -1.98 1.53 0.16 1.60 1.01 -1.26 -1.75 120.40 119.71 1loa s VAL 60 Ca 0.69 -1.99 0.05 0.00 0.00 0.00 0.00 61.98 60.73 1loa s VAL 60 Cb -0.20 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 1loa s VAL 60 CO 0.26 -0.52 0.14 0.00 0.00 0.00 0.00 175.10 174.98 1loa s ALA 61 N -2.64 3.59 0.17 5.51 0.00 0.49 -4.77 121.76 124.11 1loa s ALA 61 Ca 0.16 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 50.90 1loa s ALA 61 Cb -0.02 -1.39 -0.05 0.00 0.00 0.00 0.00 23.12 21.66 1loa s ALA 61 CO 0.04 0.51 0.37 -0.80 0.00 0.00 0.00 175.76 175.89 1loa s ASN 62 N -3.10 6.43 0.14 0.00 0.01 -1.26 -4.18 114.94 112.98 1loa s ASN 62 Ca 0.31 0.48 -0.21 0.00 -0.71 0.00 0.00 52.86 52.73 1loa s ASN 62 Cb -0.10 -2.04 0.06 0.00 0.41 0.00 0.00 41.25 39.57 1loa s ASN 62 CO 0.24 0.01 0.54 0.72 -1.51 0.00 0.00 177.10 177.10 1loa s PHE 63 N -1.75 -0.44 0.02 2.20 -0.12 -1.00 -4.99 117.98 111.90 1loa s PHE 63 Ca 0.39 0.23 0.02 0.00 -0.05 0.00 0.00 56.93 57.52 1loa s PHE 63 Cb -0.12 0.46 -0.02 0.00 -0.63 0.00 0.00 43.02 42.72 1loa s PHE 63 CO 0.27 -0.80 -0.06 0.08 -0.05 0.00 0.00 175.22 174.66 1loa s VAL 64 N -3.67 0.42 0.01 -2.49 1.01 -1.26 -1.73 120.40 112.69 1loa s VAL 64 Ca 0.01 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 61.09 1loa s VAL 64 Cb -0.00 -0.46 0.02 0.00 0.00 0.00 0.00 36.38 35.94 1loa s VAL 64 CO -0.12 -0.23 0.32 0.28 0.00 0.00 0.00 175.10 175.34 1loa s THR 65 N -0.95 0.07 0.01 3.92 -1.32 -0.61 -4.99 115.64 111.77 1loa s THR 65 Ca -0.07 -0.56 -0.01 0.00 -1.21 0.00 0.00 61.69 59.84 1loa s THR 65 Cb -0.07 -0.78 -0.01 0.00 -1.51 0.00 0.00 72.50 70.12 1loa s THR 65 CO 0.00 -0.31 -0.01 -0.44 -2.21 0.00 0.00 174.62 171.65 1loa s SER 66 N -1.69 0.14 0.02 8.08 0.01 -1.26 -1.06 113.70 117.95 1loa s SER 66 Ca -0.09 -0.31 -0.26 0.00 1.31 0.00 0.00 55.95 56.60 1loa s SER 66 Cb -0.03 0.08 0.06 0.00 0.21 0.00 0.00 66.02 66.34 1loa s SER 66 CO 0.01 -0.20 0.60 0.72 0.41 0.00 0.00 173.24 174.78 1loa s PHE 67 N -0.96 -0.55 -0.14 2.43 -0.12 -0.59 -4.98 117.98 113.08 1loa s PHE 67 Ca -0.10 0.74 -0.03 0.00 -0.05 0.00 0.00 56.93 57.49 1loa s PHE 67 Cb -0.07 0.41 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 1loa s PHE 67 CO -0.01 -0.66 -0.04 0.99 -0.05 0.00 0.00 175.22 175.45 1loa s THR 68 N -2.07 3.86 0.16 -4.49 2.01 -1.26 -1.09 115.64 112.75 1loa s THR 68 Ca -0.07 -0.38 0.01 0.00 0.31 0.00 0.00 61.69 61.56 1loa s THR 68 Cb -0.01 -2.67 -0.04 0.00 0.01 0.00 0.00 72.50 69.79 1loa s THR 68 CO 0.02 0.52 -0.00 0.72 -0.69 0.00 0.00 174.62 175.18 1loa s PHE 69 N 0.13 1.12 0.03 4.92 -0.71 -0.94 -4.92 117.98 117.61 1loa s PHE 69 Ca -0.01 -1.03 0.03 0.00 -1.04 0.00 0.00 56.93 54.88 1loa s PHE 69 Cb -0.14 -0.64 -0.02 0.00 -1.21 0.00 0.00 43.02 41.02 1loa s PHE 69 CO 0.03 -0.24 -0.10 0.08 -1.34 0.00 0.00 175.22 173.65 1loa s VAL 70 N -3.70 0.74 -0.14 -2.49 1.01 -1.26 -0.90 120.40 113.65 1loa s VAL 70 Ca 0.22 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1loa s VAL 70 Cb 0.06 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.74 1loa s VAL 70 CO 0.02 -0.12 -0.17 -0.63 0.00 0.00 0.00 175.10 174.20 1loa s ILE 71 N -0.90 1.75 -0.17 2.22 1.01 -1.26 -5.03 121.20 118.81 1loa s ILE 71 Ca -0.03 -0.76 -0.02 0.00 0.00 0.00 0.00 60.65 59.84 1loa s ILE 71 Cb -0.07 -1.59 -0.01 0.00 0.01 0.00 0.00 42.46 40.79 1loa s ILE 71 CO 0.01 0.49 -0.08 -0.62 0.00 0.00 0.00 174.94 174.73 1loa s ASP 72 N 1.18 4.20 0.01 3.58 -1.08 -1.26 -0.88 116.67 122.42 1loa s ASP 72 Ca -0.00 -0.34 0.01 0.00 -0.52 0.00 0.00 52.55 51.70 1loa s ASP 72 Cb -0.14 -1.68 -0.01 0.00 -1.46 0.00 0.00 42.92 39.63 1loa s ASP 72 CO -0.07 0.08 -0.04 0.00 0.52 0.00 0.00 175.17 175.66 1loa s ALA 73 N 0.87 0.33 0.05 3.66 0.00 -1.26 -4.89 121.76 120.52 1loa s ALA 73 Ca -0.02 -0.36 -0.17 0.00 0.00 0.00 0.00 51.96 51.41 1loa s ALA 73 Cb -0.15 -0.02 -0.07 0.00 0.00 0.00 0.00 23.12 22.88 1loa s ALA 73 CO 0.01 0.02 1.27 -1.35 0.00 0.00 0.00 175.76 175.71 1loa h PRO 74 N 5.50 -0.38 -6.71 0.00 0.11 -2.00 -3.42 132.00 125.09 1loa h PRO 74 Ca -0.29 0.03 -0.68 0.00 0.11 0.00 0.00 66.00 65.16 1loa h PRO 74 Cb 1.20 0.09 -0.25 0.00 0.11 0.00 0.00 31.00 32.15 1loa h PRO 74 CO 0.47 -0.25 -0.87 0.54 -0.21 0.00 0.00 178.00 177.67 1loa s ASN 75 N -3.49 3.13 0.00 -2.05 6.03 -1.26 -5.01 114.94 112.29 1loa s ASN 75 Ca -0.08 -0.63 0.05 0.00 -1.03 0.00 0.00 52.86 51.16 1loa s ASN 75 Cb 0.03 -0.26 0.27 0.00 -3.03 0.00 0.00 41.25 38.26 1loa s ASN 75 CO 0.30 0.22 0.82 -1.20 -2.03 0.00 0.00 177.10 175.21 1loa n SER 76 N 1.52 0.00 -0.02 3.54 7.64 -1.26 -2.99 113.62 122.05 1loa n SER 76 Ca -0.17 -0.05 0.05 0.00 1.01 0.00 0.00 58.87 59.71 1loa n SER 76 Cb 0.52 -0.08 -0.11 0.00 -1.01 0.00 0.00 64.21 63.53 1loa n SER 76 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1loa n TYR 77 N -1.08 0.00 -4.04 1.43 4.02 -1.26 -4.80 117.16 111.43 1loa n TYR 77 Ca 0.03 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.61 1loa n TYR 77 Cb 0.02 -0.39 -0.15 0.00 -0.02 0.00 0.00 39.34 38.80 1loa n TYR 77 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 1loa s ASN 78 N -3.86 4.52 -0.19 7.72 0.01 -1.16 -5.04 114.94 116.93 1loa s ASN 78 Ca -0.06 -1.65 -0.21 0.00 -0.71 0.00 0.00 52.86 50.23 1loa s ASN 78 Cb 0.09 -1.54 0.06 0.00 0.41 0.00 0.00 41.25 40.26 1loa s ASN 78 CO 0.61 -0.26 0.57 0.54 -1.51 0.00 0.00 177.10 177.05 1loa s VAL 79 N 1.06 0.00 0.19 1.60 0.11 -1.26 -4.50 120.40 117.60 1loa s VAL 79 Ca -0.02 -0.03 -0.22 0.00 -2.93 0.00 0.00 61.98 58.78 1loa s VAL 79 Cb -0.20 -0.81 0.07 0.00 -1.53 0.00 0.00 36.38 33.92 1loa s VAL 79 CO -0.06 -0.02 1.01 0.00 -3.33 0.00 0.00 175.10 172.70 1loa s ALA 80 N 0.05 -1.55 -0.29 1.54 0.00 -1.26 -4.32 121.76 115.94 1loa s ALA 80 Ca -0.02 -0.28 0.21 0.00 0.00 0.00 0.00 51.96 51.88 1loa s ALA 80 Cb -0.04 0.73 0.11 0.00 0.00 0.00 0.00 23.12 23.92 1loa s ALA 80 CO 0.02 -1.06 1.26 -0.44 0.00 0.00 0.00 175.76 175.54 1loa h ASP 81 N 2.00 0.00 -4.94 0.00 3.32 -1.93 -3.49 116.42 111.38 1loa h ASP 81 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 1loa h ASP 81 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1loa h ASP 81 CO 0.34 0.10 0.00 0.61 -1.72 0.00 0.00 179.24 178.58 1loa n GLY 82 N 1.18 0.62 3.37 2.75 0.00 -1.26 -1.65 105.19 110.19 1loa n GLY 82 Ca 0.01 -2.30 -0.27 0.00 0.00 0.00 0.00 46.02 43.46 1loa n GLY 82 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1loa s PHE 83 N -0.62 2.14 -0.00 1.61 5.36 -0.38 -4.98 117.98 121.10 1loa s PHE 83 Ca 0.00 -0.39 0.00 0.00 -0.96 0.00 0.00 56.93 55.58 1loa s PHE 83 Cb 0.00 -1.12 -0.00 0.00 -0.34 0.00 0.00 43.02 41.55 1loa s PHE 83 CO 0.00 0.35 -0.01 0.99 -1.46 0.00 0.00 175.22 175.08 1loa s THR 84 N -1.34 0.12 -0.17 0.12 2.01 -1.26 -0.73 115.64 114.38 1loa s THR 84 Ca 0.14 -0.06 -0.07 0.00 0.31 0.00 0.00 61.69 62.01 1loa s THR 84 Cb -0.09 -0.11 -0.04 0.00 0.01 0.00 0.00 72.50 72.27 1loa s THR 84 CO 0.07 0.03 0.05 0.12 -0.69 0.00 0.00 174.62 174.20 1loa s PHE 85 N -0.03 3.22 0.13 4.92 5.36 -0.63 -4.95 117.98 126.00 1loa s PHE 85 Ca 0.01 0.03 -0.02 0.00 -0.96 0.00 0.00 56.93 55.98 1loa s PHE 85 Cb -0.01 -2.05 -0.03 0.00 -0.34 0.00 0.00 43.02 40.59 1loa s PHE 85 CO -0.00 0.15 0.08 -0.59 -1.46 0.00 0.00 175.22 173.40 1loa s PHE 86 N 0.30 0.74 -0.01 10.12 -0.71 -1.26 -0.73 117.98 126.43 1loa s PHE 86 Ca 0.02 -1.13 0.04 0.00 -1.04 0.00 0.00 56.93 54.82 1loa s PHE 86 Cb -0.13 -0.40 -0.01 0.00 -1.21 0.00 0.00 43.02 41.28 1loa s PHE 86 CO 0.01 -0.54 -0.12 0.42 -1.34 0.00 0.00 175.22 173.65 1loa s ILE 87 N -4.02 0.98 0.13 -4.49 1.01 -1.03 -5.02 121.20 108.75 1loa s ILE 87 Ca 0.21 -0.53 -0.25 0.00 0.00 0.00 0.00 60.65 60.08 1loa s ILE 87 Cb 0.07 -0.82 0.08 0.00 0.01 0.00 0.00 42.46 41.80 1loa s ILE 87 CO -0.00 0.27 1.06 0.00 0.00 0.00 0.00 174.94 176.28 1loa s ALA 88 N -0.29 -1.77 0.98 9.38 0.00 -1.26 -2.67 121.76 126.13 1loa s ALA 88 Ca 0.05 0.01 -0.11 0.00 0.00 0.00 0.00 51.96 51.91 1loa s ALA 88 Cb -0.05 0.66 0.16 0.00 0.00 0.00 0.00 23.12 23.90 1loa s ALA 88 CO -0.00 -1.06 0.99 -2.30 0.00 0.00 0.00 175.76 173.38 1loa n PRO 89 N -0.60 -0.87 0.16 0.00 -0.02 -1.22 -4.86 135.00 127.60 1loa n PRO 89 Ca -0.05 -0.20 0.05 0.00 -2.02 0.00 0.00 63.50 61.29 1loa n PRO 89 Cb 0.60 -2.25 0.49 0.00 -0.02 0.00 0.00 33.50 32.33 1loa n PRO 89 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1loa h VAL 90 N -2.02 1.10 -1.92 -1.45 2.07 -2.00 -2.67 116.25 109.36 1loa h VAL 90 Ca -0.47 -0.42 -0.71 0.00 0.82 0.00 0.00 66.70 65.92 1loa h VAL 90 Cb 1.29 1.06 -0.32 0.00 -1.52 0.00 0.00 31.29 31.80 1loa h VAL 90 CO 0.42 0.13 0.44 -0.90 0.02 0.00 0.00 177.57 177.68 1loa n ASP 91 N -4.40 6.52 -4.75 0.57 5.68 -1.26 -5.01 116.55 113.90 1loa n ASP 91 Ca -0.01 -3.78 -0.40 0.00 -0.50 0.00 0.00 54.79 50.10 1loa n ASP 91 Cb 0.18 -0.88 -0.05 0.00 -1.14 0.00 0.00 41.12 39.23 1loa n ASP 91 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1loa s THR 92 N -5.07 4.68 0.04 2.12 -1.32 -1.01 -5.06 115.64 110.02 1loa s THR 92 Ca 0.49 1.68 0.09 0.00 -1.21 0.00 0.00 61.69 62.73 1loa s THR 92 Cb 0.39 -4.14 -0.03 0.00 -1.51 0.00 0.00 72.50 67.21 1loa s THR 92 CO -0.30 0.37 -0.25 -1.59 -2.21 0.00 0.00 174.62 170.65 1loa s LYS 93 N -0.14 1.70 0.66 7.08 -2.85 -1.26 -5.09 119.74 119.84 1loa s LYS 93 Ca 0.39 -1.04 -0.17 0.00 -1.00 0.00 0.00 55.97 54.15 1loa s LYS 93 Cb -0.21 -1.84 -0.02 0.00 -2.06 0.00 0.00 37.83 33.70 1loa s LYS 93 CO 0.24 0.48 0.93 -0.35 0.10 0.00 0.00 175.35 176.75 1loa n PRO 94 N 1.88 0.69 0.00 1.78 -0.04 -1.26 -5.03 135.00 133.01 1loa n PRO 94 Ca -0.17 0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1loa n PRO 94 Cb 0.52 -2.17 0.00 0.00 -0.04 0.00 0.00 33.50 31.81 1loa n PRO 94 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1loa n GLN 95 N -1.36 1.31 -2.49 0.54 1.13 -0.18 -5.01 117.38 111.33 1loa n GLN 95 Ca 0.13 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.79 1loa n GLN 95 Cb 0.48 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.79 1loa n GLN 95 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1loa s THR 96 N 4.23 3.55 0.00 5.09 2.01 -1.21 -4.66 115.64 124.64 1loa s THR 96 Ca 0.00 1.52 0.00 0.00 0.31 0.00 0.00 61.69 63.52 1loa s THR 96 Cb 0.00 -3.97 0.00 0.00 0.01 0.00 0.00 72.50 68.54 1loa s THR 96 CO 0.00 0.35 0.00 0.61 -0.69 0.00 0.00 174.62 174.89 1loa n GLY 97 N 1.33 0.52 7.00 4.40 0.00 -1.26 -0.82 105.19 116.36 1loa n GLY 97 Ca -0.01 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.14 1loa n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1loa n GLY 98 N 5.00 2.03 0.33 -0.02 0.00 -1.26 -3.06 105.19 108.20 1loa n GLY 98 Ca 0.00 -0.49 0.20 0.00 0.00 0.00 0.00 46.02 45.73 1loa n GLY 98 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1loa h GLY 99 N 0.00 0.00 0.61 -0.02 0.00 -1.94 -1.25 103.07 100.46 1loa h GLY 99 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1loa h GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 1loa n TYR 100 N -3.33 0.01 -1.19 5.60 4.02 -1.17 -4.96 117.16 116.14 1loa n TYR 100 Ca -0.03 -0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.76 1loa n TYR 100 Cb 0.08 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.36 1loa n TYR 100 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1loa n LEU 101 N -0.71 -0.39 0.00 7.72 4.32 -0.47 -2.56 117.00 124.91 1loa n LEU 101 Ca 0.21 0.24 0.00 0.00 -0.02 0.00 0.00 56.01 56.44 1loa n LEU 101 Cb 0.16 -2.23 0.00 0.00 -1.62 0.00 0.00 43.42 39.72 1loa n LEU 101 CO 0.16 -0.82 0.00 0.61 -1.22 0.00 0.00 177.39 176.12 1loa n GLY 102 N 0.14 0.85 0.00 -0.72 0.00 -0.00 -4.79 105.19 100.67 1loa n GLY 102 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1loa n GLY 102 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1loa n VAL 103 N -2.16 0.00 -4.51 1.61 3.14 -1.06 -1.01 118.33 114.34 1loa n VAL 103 Ca 0.00 0.00 -0.24 0.00 -2.96 0.00 0.00 64.34 61.14 1loa n VAL 103 Cb 0.00 -0.69 -0.11 0.00 -1.06 0.00 0.00 33.84 31.99 1loa n VAL 103 CO 0.00 0.00 0.00 -0.36 -6.46 0.00 0.00 176.83 170.01 1loa s PHE 104 N -1.95 2.21 -0.01 1.45 0.08 -1.10 -4.70 117.98 113.96 1loa s PHE 104 Ca 0.00 -0.68 0.05 0.00 0.12 0.00 0.00 56.93 56.42 1loa s PHE 104 Cb 0.00 -1.37 -0.08 0.00 -0.57 0.00 0.00 43.02 41.00 1loa s PHE 104 CO 0.00 0.36 0.11 0.09 -0.10 0.00 0.00 175.22 175.68 1loa n ASN 105 N -0.75 3.87 -4.26 1.36 3.02 -1.26 -3.35 115.26 113.88 1loa n ASN 105 Ca -0.05 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.32 1loa n ASN 105 Cb 0.65 1.21 -0.11 0.00 -0.61 0.00 0.00 39.78 40.92 1loa n ASN 105 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1loa s SER 106 N -2.59 2.14 0.12 6.41 1.04 -1.26 -4.98 113.70 114.58 1loa s SER 106 Ca -0.02 -0.85 0.16 0.00 0.48 0.00 0.00 55.95 55.73 1loa s SER 106 Cb 0.03 -0.08 -0.08 0.00 0.10 0.00 0.00 66.02 65.98 1loa s SER 106 CO 0.21 -0.14 0.99 0.07 0.98 0.00 0.00 173.24 175.34 1loa h LYS 107 N 3.35 0.00 -7.15 4.02 2.10 -1.94 -1.58 116.57 115.36 1loa h LYS 107 Ca -0.40 0.00 -0.50 0.00 -2.00 0.00 0.00 60.65 57.75 1loa h LYS 107 Cb 1.20 0.00 0.08 0.00 -0.90 0.00 0.00 32.23 32.61 1loa h LYS 107 CO 0.52 0.34 0.39 -0.51 -2.00 0.00 0.00 179.45 178.20 1loa s ASP 108 N -5.94 5.52 -0.00 7.07 1.01 -1.26 -4.34 116.67 118.73 1loa s ASP 108 Ca -0.01 2.01 -0.30 0.00 0.71 0.00 0.00 52.55 54.96 1loa s ASP 108 Cb 0.08 -2.56 -0.06 0.00 1.01 0.00 0.00 42.92 41.39 1loa s ASP 108 CO 0.80 -1.35 1.56 -0.47 0.21 0.00 0.00 175.17 175.91 1loa s TYR 109 N -2.16 2.43 -0.26 4.23 6.14 -1.26 -4.60 117.35 121.87 1loa s TYR 109 Ca 0.68 0.46 -0.03 0.00 0.64 0.00 0.00 57.07 58.82 1loa s TYR 109 Cb -0.20 -3.83 0.02 0.00 0.42 0.00 0.00 41.96 38.36 1loa s TYR 109 CO 0.34 -3.32 -0.01 0.34 0.64 0.00 0.00 175.55 173.54 1loa s ASP 110 N 2.53 4.59 0.25 4.32 -1.08 0.33 -5.01 116.67 122.60 1loa s ASP 110 Ca 0.70 -0.80 0.26 0.00 -0.52 0.00 0.00 52.55 52.19 1loa s ASP 110 Cb -0.34 -1.74 0.74 0.00 -1.46 0.00 0.00 42.92 40.11 1loa s ASP 110 CO 0.29 -0.14 1.75 0.07 0.52 0.00 0.00 175.17 177.65 1loa h LYS 111 N 8.09 0.00 0.00 4.34 2.10 -1.95 -2.98 116.57 126.17 1loa h LYS 111 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1loa h LYS 111 Cb 1.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 1loa h LYS 111 CO 0.58 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.28 1loa n THR 112 N -2.40 0.27 -0.13 0.07 -2.24 -1.26 -3.95 114.28 104.64 1loa n THR 112 Ca 0.05 -0.13 -0.08 0.00 -2.27 0.00 0.00 64.05 61.63 1loa n THR 112 Cb 0.45 -0.54 -0.00 0.00 -2.10 0.00 0.00 70.33 68.13 1loa n THR 112 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1loa h SER 113 N 0.00 0.48 -4.25 3.42 0.87 -1.87 -3.46 113.55 108.74 1loa h SER 113 Ca 0.00 -0.05 -0.30 0.00 -1.23 0.00 0.00 61.79 60.22 1loa h SER 113 Cb 0.60 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 1loa h SER 113 CO 0.00 0.38 -0.40 0.00 -0.53 0.00 0.00 176.83 176.28 1loa n GLN 114 N -4.77 -2.72 -4.35 2.24 6.02 -1.25 -4.71 117.38 107.83 1loa n GLN 114 Ca 0.00 0.60 -0.20 0.00 -0.01 0.00 0.00 57.00 57.39 1loa n GLN 114 Cb 0.05 -5.25 -0.13 0.00 1.02 0.00 0.00 30.24 25.92 1loa n GLN 114 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1loa s THR 115 N -2.75 1.19 -0.03 5.09 -1.32 -1.26 -3.45 115.64 113.11 1loa s THR 115 Ca 0.12 -1.09 0.03 0.00 -1.21 0.00 0.00 61.69 59.54 1loa s THR 115 Cb -0.06 -1.08 0.00 0.00 -1.51 0.00 0.00 72.50 69.85 1loa s THR 115 CO 0.15 -0.01 -0.10 0.68 -2.21 0.00 0.00 174.62 173.12 1loa s VAL 116 N -0.92 0.87 0.17 5.08 -7.23 -1.09 -1.58 120.40 115.70 1loa s VAL 116 Ca 0.02 -0.41 0.01 0.00 -1.81 0.00 0.00 61.98 59.78 1loa s VAL 116 Cb -0.08 -0.77 -0.04 0.00 0.56 0.00 0.00 36.38 36.04 1loa s VAL 116 CO 0.02 0.27 0.03 0.00 -0.31 0.00 0.00 175.10 175.11 1loa s ALA 117 N 0.15 1.25 -0.22 1.32 0.00 0.40 -2.48 121.76 122.18 1loa s ALA 117 Ca -0.03 -1.60 0.01 0.00 0.00 0.00 0.00 51.96 50.35 1loa s ALA 117 Cb -0.09 0.74 0.05 0.00 0.00 0.00 0.00 23.12 23.82 1loa s ALA 117 CO 0.01 -0.40 -0.10 0.08 0.00 0.00 0.00 175.76 175.35 1loa s VAL 118 N -3.80 1.78 -0.00 0.00 1.01 0.10 -1.14 120.40 118.33 1loa s VAL 118 Ca 0.26 -1.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.01 1loa s VAL 118 Cb 0.07 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 1loa s VAL 118 CO 0.05 0.08 0.13 -0.70 0.00 0.00 0.00 175.10 174.66 1loa s GLU 119 N 1.31 3.26 -0.39 2.72 2.12 -0.52 -1.61 118.70 125.59 1loa s GLU 119 Ca -0.04 -0.40 0.02 0.00 0.36 0.00 0.00 54.97 54.90 1loa s GLU 119 Cb -0.18 -2.98 0.12 0.00 0.26 0.00 0.00 34.13 31.35 1loa s GLU 119 CO -0.07 0.66 0.16 -0.06 -0.54 0.00 0.00 175.26 175.41 1loa s PHE 120 N -1.27 2.38 -0.17 5.30 0.40 0.09 -1.78 117.98 122.94 1loa s PHE 120 Ca 0.25 -2.40 -0.07 0.00 -0.60 0.00 0.00 56.93 54.11 1loa s PHE 120 Cb -0.12 -2.14 -0.04 0.00 0.51 0.00 0.00 43.02 41.22 1loa s PHE 120 CO 0.17 -0.84 0.05 0.34 0.70 0.00 0.00 175.22 175.63 1loa s ASP 121 N 0.80 5.55 0.00 1.36 -1.08 -0.20 -1.25 116.67 121.85 1loa s ASP 121 Ca 0.14 0.08 0.01 0.00 -0.52 0.00 0.00 52.55 52.25 1loa s ASP 121 Cb -0.21 -1.91 0.01 0.00 -1.46 0.00 0.00 42.92 39.34 1loa s ASP 121 CO -0.10 0.20 0.72 0.35 0.52 0.00 0.00 175.17 176.86 1loa n THR 122 N 3.35 0.41 -3.74 1.71 -2.24 -0.66 -1.54 114.28 111.58 1loa n THR 122 Ca -0.17 -0.70 -0.15 0.00 -2.27 0.00 0.00 64.05 60.76 1loa n THR 122 Cb 0.52 0.80 -0.15 0.00 -2.10 0.00 0.00 70.33 69.41 1loa n THR 122 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1loa s PHE 123 N -0.43 -0.12 -0.34 4.78 5.36 -1.25 -4.41 117.98 121.57 1loa s PHE 123 Ca 0.01 0.42 -0.29 0.00 -0.96 0.00 0.00 56.93 56.11 1loa s PHE 123 Cb 0.00 -0.16 0.01 0.00 -0.34 0.00 0.00 43.02 42.53 1loa s PHE 123 CO 0.01 -0.17 1.24 -0.47 -1.46 0.00 0.00 175.22 174.37 1loa s TYR 124 N 1.37 2.77 -0.41 10.12 5.04 -1.26 -5.00 117.35 129.98 1loa s TYR 124 Ca -0.07 0.90 -0.02 0.00 -2.44 0.00 0.00 57.07 55.44 1loa s TYR 124 Cb -0.12 -3.98 0.11 0.00 0.35 0.00 0.00 41.96 38.33 1loa s TYR 124 CO -0.05 -1.48 0.19 -0.80 -1.34 0.00 0.00 175.55 172.06 1loa s ASN 125 N 2.63 5.16 0.54 4.32 -0.87 -1.26 -4.99 114.94 120.46 1loa s ASN 125 Ca 0.53 -2.10 0.38 0.00 -1.57 0.00 0.00 52.86 50.11 1loa s ASN 125 Cb -0.14 -1.79 1.57 0.00 -0.02 0.00 0.00 41.25 40.86 1loa s ASN 125 CO 0.24 -0.51 1.75 0.71 -2.57 0.00 0.00 177.10 176.73 1loa h THR 126 N 6.35 0.33 0.00 1.60 1.35 -1.94 0.13 112.91 120.72 1loa h THR 126 Ca -0.11 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1loa h THR 126 Cb 1.04 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 1loa h THR 126 CO 0.67 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.94 1loa h ALA 127 N 1.34 1.00 0.00 6.62 0.00 -2.03 -3.37 119.26 122.82 1loa h ALA 127 Ca 0.64 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.55 1loa h ALA 127 Cb 2.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.32 1loa h ALA 127 CO -0.03 0.00 0.00 -2.67 0.00 0.00 0.00 179.25 176.55 1loa n TRP 128 N -2.43 0.00 -2.40 0.00 2.14 -0.43 -5.09 117.44 109.23 1loa n TRP 128 Ca 0.02 0.00 -0.28 0.00 2.07 0.00 0.00 57.50 59.31 1loa n TRP 128 Cb 0.29 0.00 0.01 0.00 -0.81 0.00 0.00 31.31 30.80 1loa n TRP 128 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1loa s ASP 129 N 0.00 6.13 -0.50 -0.67 1.11 0.32 -4.66 116.67 118.40 1loa s ASP 129 Ca 0.00 1.02 -0.27 0.00 0.18 0.00 0.00 52.55 53.48 1loa s ASP 129 Cb 0.00 -2.21 -0.14 0.00 1.07 0.00 0.00 42.92 41.64 1loa s ASP 129 CO 0.00 -0.74 1.67 -2.65 1.18 0.00 0.00 175.17 174.63 1loa n PRO 130 N -2.44 0.00 0.19 8.23 -0.01 -1.26 -4.82 135.00 134.89 1loa n PRO 130 Ca 0.03 0.00 0.17 0.00 -0.01 0.00 0.00 63.50 63.69 1loa n PRO 130 Cb 0.55 -1.05 0.69 0.00 -0.01 0.00 0.00 33.50 33.69 1loa n PRO 130 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 175.50 176.15 1loa h SER 131 N 7.21 0.00 0.32 2.55 4.64 -1.95 0.34 113.55 126.66 1loa h SER 131 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1loa h SER 131 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1loa h SER 131 CO 0.85 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.35 1loa n ASN 132 N -3.22 0.27 -0.96 4.97 6.94 -1.26 -4.84 115.26 117.15 1loa n ASN 132 Ca 0.04 0.59 -0.10 0.00 -0.02 0.00 0.00 54.58 55.09 1loa n ASN 132 Cb 0.61 -0.64 -0.03 0.00 -2.36 0.00 0.00 39.78 37.37 1loa n ASN 132 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1loa n GLY 133 N -0.67 0.65 3.92 4.83 0.00 0.12 -5.01 105.19 109.03 1loa n GLY 133 Ca 0.01 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.26 1loa n GLY 133 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1loa s ASP 134 N -2.74 6.15 0.34 1.61 1.01 -1.26 -4.81 116.67 116.98 1loa s ASP 134 Ca 0.00 0.77 -0.25 0.00 0.71 0.00 0.00 52.55 53.77 1loa s ASP 134 Cb 0.00 -2.09 -0.10 0.00 1.01 0.00 0.00 42.92 41.74 1loa s ASP 134 CO 0.00 -0.60 0.95 -0.13 0.21 0.00 0.00 175.17 175.60 1loa s ARG 135 N -4.68 4.54 0.19 8.23 0.52 -1.26 -4.82 118.95 121.66 1loa s ARG 135 Ca 0.47 1.30 -0.06 0.00 -0.52 0.00 0.00 55.73 56.92 1loa s ARG 135 Cb -0.10 -2.72 -0.02 0.00 0.52 0.00 0.00 34.95 32.62 1loa s ARG 135 CO 0.43 0.24 0.25 -3.38 0.02 0.00 0.00 175.30 172.86 1loa s HIS 136 N -1.69 0.67 0.13 -0.53 -3.43 -0.59 0.15 115.29 110.00 1loa s HIS 136 Ca 0.52 -0.99 0.05 0.00 -0.80 0.00 0.00 55.06 53.84 1loa s HIS 136 Cb -0.17 -0.20 -0.04 0.00 -1.43 0.00 0.00 32.58 30.74 1loa s HIS 136 CO 0.22 -0.73 0.04 0.42 -2.00 0.00 0.00 174.74 172.70 1loa s ILE 137 N -4.04 4.13 0.04 -5.38 1.01 -0.55 -1.03 121.20 115.37 1loa s ILE 137 Ca 0.25 -1.09 -0.28 0.00 0.00 0.00 0.00 60.65 59.54 1loa s ILE 137 Cb 0.04 -3.03 0.09 0.00 0.01 0.00 0.00 42.46 39.57 1loa s ILE 137 CO 0.06 0.01 0.97 -0.83 0.00 0.00 0.00 174.94 175.14 1loa s GLY 138 N -2.67 -0.37 -0.11 6.18 0.00 -0.73 -0.98 107.32 108.64 1loa s GLY 138 Ca 0.28 0.72 0.03 0.00 0.00 0.00 0.00 44.72 45.76 1loa s GLY 138 CO 0.20 0.22 -0.22 -0.42 0.00 0.00 0.00 173.10 172.88 1loa s ILE 139 N -3.07 1.97 0.06 0.90 1.01 -0.52 -1.44 121.20 120.11 1loa s ILE 139 Ca 0.09 -0.95 0.09 0.00 0.00 0.00 0.00 60.65 59.88 1loa s ILE 139 Cb -0.01 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 1loa s ILE 139 CO -0.04 0.54 -0.26 -1.81 0.00 0.00 0.00 174.94 173.36 1loa s ASP 140 N 0.57 3.15 -0.17 3.58 1.01 -0.30 -1.06 116.67 123.46 1loa s ASP 140 Ca -0.14 -0.61 -0.08 0.00 0.71 0.00 0.00 52.55 52.43 1loa s ASP 140 Cb -0.17 -0.27 0.07 0.00 1.01 0.00 0.00 42.92 43.56 1loa s ASP 140 CO 0.04 0.24 0.39 0.54 0.21 0.00 0.00 175.17 176.59 1loa s VAL 141 N -0.84 -0.28 -0.98 -1.27 0.11 -1.26 -0.46 120.40 115.42 1loa s VAL 141 Ca 0.12 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.31 1loa s VAL 141 Cb -0.10 -0.60 0.00 0.00 -1.53 0.00 0.00 36.38 34.15 1loa s VAL 141 CO 0.03 0.06 0.00 0.59 -3.33 0.00 0.00 175.10 172.44 1loa n ASN 142 N 4.75 -2.46 -3.65 3.54 5.03 -0.61 -4.87 115.26 116.99 1loa n ASN 142 Ca -0.17 0.23 -0.02 0.00 0.87 0.00 0.00 54.58 55.49 1loa n ASN 142 Cb 0.53 -2.44 -0.01 0.00 -1.02 0.00 0.00 39.78 36.83 1loa n ASN 142 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1loa s SER 143 N -1.79 -0.15 0.00 6.41 1.04 -1.26 -0.51 113.70 117.43 1loa s SER 143 Ca 0.00 -0.20 0.15 0.00 0.48 0.00 0.00 55.95 56.38 1loa s SER 143 Cb 0.00 0.31 0.49 0.00 0.10 0.00 0.00 66.02 66.92 1loa s SER 143 CO 0.00 -0.56 1.38 0.00 0.98 0.00 0.00 173.24 175.05 1loa n ILE 144 N -0.40 0.37 -3.12 -1.02 0.13 -0.60 -4.69 119.36 110.04 1loa n ILE 144 Ca -0.06 -0.43 -0.43 0.00 -1.10 0.00 0.00 62.75 60.72 1loa n ILE 144 Cb 0.61 0.30 -0.06 0.00 -0.84 0.00 0.00 39.64 39.65 1loa n ILE 144 CO 0.00 0.00 0.00 -0.75 2.80 0.00 0.00 176.55 178.60 1loa s LYS 145 N -1.63 3.18 0.51 9.51 2.20 -1.26 -4.91 119.74 127.34 1loa s LYS 145 Ca 0.28 -0.69 -0.22 0.00 -0.36 0.00 0.00 55.97 54.97 1loa s LYS 145 Cb 0.15 -4.05 -0.06 0.00 -1.51 0.00 0.00 37.83 32.36 1loa s LYS 145 CO 0.20 -1.17 1.29 -1.12 -0.36 0.00 0.00 175.35 174.19 1loa s SER 146 N 2.48 5.59 0.25 1.43 0.01 -1.26 -4.76 113.70 117.43 1loa s SER 146 Ca 0.18 2.61 0.26 0.00 1.31 0.00 0.00 55.95 60.31 1loa s SER 146 Cb -0.17 -2.62 0.74 0.00 0.21 0.00 0.00 66.02 64.17 1loa s SER 146 CO 0.14 -1.34 1.75 0.16 0.41 0.00 0.00 173.24 174.36 1loa h ILE 147 N 1.61 0.00 -2.25 1.44 3.07 -1.48 -3.47 117.51 116.42 1loa h ILE 147 Ca -0.50 -0.56 0.03 0.00 1.55 0.00 0.00 64.86 65.38 1loa h ILE 147 Cb 1.28 1.55 -0.17 0.00 -0.27 0.00 0.00 36.82 39.22 1loa h ILE 147 CO 0.58 0.00 0.36 0.21 -1.05 0.00 0.00 178.15 178.25 1loa s ASN 148 N -4.80 -0.49 0.12 2.16 2.47 -1.25 -4.99 114.94 108.15 1loa s ASN 148 Ca 0.10 0.25 -0.06 0.00 0.42 0.00 0.00 52.86 53.57 1loa s ASN 148 Cb 0.11 0.46 -0.02 0.00 -1.45 0.00 0.00 41.25 40.35 1loa s ASN 148 CO 0.60 -0.65 0.17 -0.89 -3.72 0.00 0.00 177.10 172.61 1loa s THR 149 N -2.42 0.12 -0.08 -5.21 2.01 -1.26 -1.43 115.64 107.37 1loa s THR 149 Ca -0.01 -1.47 -0.10 0.00 0.31 0.00 0.00 61.69 60.42 1loa s THR 149 Cb -0.01 -1.67 0.02 0.00 0.01 0.00 0.00 72.50 70.85 1loa s THR 149 CO -0.03 -0.53 0.26 -0.75 -0.69 0.00 0.00 174.62 172.87 1loa s LYS 150 N -3.94 0.38 0.35 4.92 2.47 -0.15 -4.92 119.74 118.85 1loa s LYS 150 Ca 0.13 0.22 -0.26 0.00 -1.56 0.00 0.00 55.97 54.50 1loa s LYS 150 Cb 0.05 0.18 -0.09 0.00 -1.46 0.00 0.00 37.83 36.51 1loa s LYS 150 CO -0.05 -0.07 1.02 -1.12 0.16 0.00 0.00 175.35 175.30 1loa s SER 151 N -0.22 7.06 -0.01 1.43 0.01 -1.26 -1.48 113.70 119.23 1loa s SER 151 Ca -0.03 2.01 0.02 0.00 1.31 0.00 0.00 55.95 59.25 1loa s SER 151 Cb -0.03 -2.59 -0.00 0.00 0.21 0.00 0.00 66.02 63.61 1loa s SER 151 CO 0.01 -0.28 -0.06 0.86 0.41 0.00 0.00 173.24 174.19 1loa s TRP 152 N -1.55 0.53 -0.79 2.43 -0.00 0.12 -4.82 118.94 114.87 1loa s TRP 152 Ca 0.53 -0.10 -0.10 0.00 -0.00 0.00 0.00 56.10 56.42 1loa s TRP 152 Cb -0.23 -0.36 0.21 0.00 -0.00 0.00 0.00 33.47 33.09 1loa s TRP 152 CO 0.29 -0.03 0.70 0.00 -0.00 0.00 0.00 176.95 177.91 1loa s ALA 153 N -0.01 4.00 -0.24 5.86 0.00 -1.26 -4.25 121.76 125.85 1loa s ALA 153 Ca 0.01 -3.36 -0.41 0.00 0.00 0.00 0.00 51.96 48.20 1loa s ALA 153 Cb -0.04 -3.28 -0.17 0.00 0.00 0.00 0.00 23.12 19.64 1loa s ALA 153 CO -0.00 -2.23 1.63 -0.11 0.00 0.00 0.00 175.76 175.04 1loa n LEU 154 N 3.71 1.97 -4.16 0.00 7.94 -1.26 -4.91 117.00 120.29 1loa n LEU 154 Ca 0.13 1.10 -0.39 0.00 -1.11 0.00 0.00 56.01 55.75 1loa n LEU 154 Cb 0.44 -1.10 -0.09 0.00 0.53 0.00 0.00 43.42 43.20 1loa n LEU 154 CO 0.34 -0.66 0.01 -1.10 -1.11 0.00 0.00 177.39 174.86 1loa s GLN 155 N 2.79 2.49 0.27 1.96 -0.21 -1.26 -5.04 119.66 120.67 1loa s GLN 155 Ca 0.97 -2.12 -0.30 0.00 0.02 0.00 0.00 55.36 53.92 1loa s GLN 155 Cb -1.13 -3.82 -0.12 0.00 1.00 0.00 0.00 33.01 28.94 1loa s GLN 155 CO 0.65 -1.17 1.53 -1.71 -2.12 0.00 0.00 175.29 172.47 1loa n ASN 156 N 4.23 3.48 0.00 5.90 5.15 -1.26 -2.33 115.26 130.42 1loa n ASN 156 Ca 0.01 1.14 0.00 0.00 -0.60 0.00 0.00 54.58 55.14 1loa n ASN 156 Cb 0.40 -1.54 0.00 0.00 -0.53 0.00 0.00 39.78 38.12 1loa n ASN 156 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1loa n GLY 157 N 2.18 2.77 3.93 8.20 0.00 -0.06 -5.00 105.19 117.21 1loa n GLY 157 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 1loa n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1loa s LYS 158 N -0.21 3.24 0.01 1.61 1.02 -0.98 -4.90 119.74 119.52 1loa s LYS 158 Ca 0.00 -0.18 -0.04 0.00 0.02 0.00 0.00 55.97 55.77 1loa s LYS 158 Cb 0.00 -2.47 -0.04 0.00 -0.52 0.00 0.00 37.83 34.80 1loa s LYS 158 CO 0.00 -0.26 0.23 -1.21 -0.92 0.00 0.00 175.35 173.19 1loa s GLU 159 N -4.65 3.51 -0.06 1.68 2.02 -1.26 -4.45 118.70 115.49 1loa s GLU 159 Ca 0.48 -0.20 0.05 0.00 0.02 0.00 0.00 54.97 55.32 1loa s GLU 159 Cb -0.10 -3.08 -0.01 0.00 0.10 0.00 0.00 34.13 31.05 1loa s GLU 159 CO 0.41 0.65 -0.22 0.00 0.02 0.00 0.00 175.26 176.12 1loa s ALA 160 N -1.33 1.95 -0.21 5.21 0.00 -0.08 -4.62 121.76 122.67 1loa s ALA 160 Ca 0.28 -0.92 -0.11 0.00 0.00 0.00 0.00 51.96 51.21 1loa s ALA 160 Cb -0.13 -0.63 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 1loa s ALA 160 CO 0.18 0.36 0.16 -0.80 0.00 0.00 0.00 175.76 175.66 1loa s ASN 161 N -0.06 6.20 0.07 0.00 -0.87 -0.13 -2.21 114.94 117.94 1loa s ASN 161 Ca -0.05 0.22 0.06 0.00 -1.57 0.00 0.00 52.86 51.51 1loa s ASN 161 Cb -0.13 -2.11 -0.03 0.00 -0.02 0.00 0.00 41.25 38.96 1loa s ASN 161 CO 0.04 0.13 -0.15 0.68 -2.57 0.00 0.00 177.10 175.22 1loa s VAL 162 N 0.65 1.20 -0.04 1.60 -7.23 -0.25 -0.96 120.40 115.37 1loa s VAL 162 Ca 0.09 -1.28 0.05 0.00 -1.81 0.00 0.00 61.98 59.02 1loa s VAL 162 Cb -0.12 -1.13 -0.01 0.00 0.56 0.00 0.00 36.38 35.68 1loa s VAL 162 CO 0.01 -0.16 -0.19 -0.69 -0.31 0.00 0.00 175.10 173.76 1loa s VAL 163 N -1.18 1.58 -0.00 1.32 1.01 -1.07 -1.54 120.40 120.52 1loa s VAL 163 Ca -0.00 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.20 1loa s VAL 163 Cb -0.10 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1loa s VAL 163 CO 0.02 0.45 -0.12 -0.63 0.00 0.00 0.00 175.10 174.83 1loa s ILE 164 N -0.13 0.92 -0.04 2.22 1.01 -0.22 -1.79 121.20 123.17 1loa s ILE 164 Ca -0.01 -0.55 -0.11 0.00 0.00 0.00 0.00 60.65 59.98 1loa s ILE 164 Cb -0.11 -0.78 0.02 0.00 0.01 0.00 0.00 42.46 41.60 1loa s ILE 164 CO 0.02 0.22 0.26 0.00 0.00 0.00 0.00 174.94 175.44 1loa s ALA 165 N -0.34 -0.65 0.06 9.38 0.00 0.55 -1.57 121.76 129.19 1loa s ALA 165 Ca 0.04 0.40 0.06 0.00 0.00 0.00 0.00 51.96 52.46 1loa s ALA 165 Cb -0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 1loa s ALA 165 CO -0.00 -0.20 -0.16 0.12 0.00 0.00 0.00 175.76 175.51 1loa s PHE 166 N -0.79 1.41 -0.21 0.00 5.36 -0.71 -0.75 117.98 122.28 1loa s PHE 166 Ca -0.09 -0.39 -0.02 0.00 -0.96 0.00 0.00 56.93 55.48 1loa s PHE 166 Cb -0.05 -0.82 0.06 0.00 -0.34 0.00 0.00 43.02 41.88 1loa s PHE 166 CO 0.02 0.07 0.01 1.21 -1.46 0.00 0.00 175.22 175.08 1loa s ASN 167 N -1.37 3.27 0.31 6.13 2.47 -0.84 -2.36 114.94 122.55 1loa s ASN 167 Ca 0.03 -0.98 0.00 0.00 0.42 0.00 0.00 52.86 52.33 1loa s ASN 167 Cb -0.09 -0.80 0.49 0.00 -1.45 0.00 0.00 41.25 39.41 1loa s ASN 167 CO 0.02 -0.29 1.90 0.00 -3.72 0.00 0.00 177.10 175.01 1loa h ALA 168 N 8.14 1.35 -0.26 1.71 0.00 -1.86 0.33 119.26 128.67 1loa h ALA 168 Ca -0.16 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.62 1loa h ALA 168 Cb 1.10 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1loa h ALA 168 CO 0.37 0.50 0.18 0.00 0.00 0.00 0.00 179.25 180.29 1loa h ALA 169 N 1.45 1.86 0.00 0.00 0.00 -1.94 -2.12 119.26 118.51 1loa h ALA 169 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1loa h ALA 169 Cb 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1loa h ALA 169 CO -0.02 0.12 -0.59 0.25 0.00 0.00 0.00 179.25 179.00 1loa n THR 170 N -4.50 0.00 -1.86 0.00 -2.24 -0.71 -4.99 114.28 99.98 1loa n THR 170 Ca 0.01 -0.29 -0.16 0.00 -2.27 0.00 0.00 64.05 61.34 1loa n THR 170 Cb 0.10 0.83 -0.05 0.00 -2.10 0.00 0.00 70.33 69.12 1loa n THR 170 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1loa n ASN 171 N -1.32 -4.55 -4.78 3.42 5.03 0.11 -4.96 115.26 108.21 1loa n ASN 171 Ca 0.01 0.28 -0.39 0.00 0.87 0.00 0.00 54.58 55.35 1loa n ASN 171 Cb 0.13 -3.99 -0.06 0.00 -1.02 0.00 0.00 39.78 34.84 1loa n ASN 171 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1loa s VAL 172 N -2.56 4.52 -0.03 2.41 1.01 -1.23 -4.86 120.40 119.65 1loa s VAL 172 Ca 0.00 1.57 -0.01 0.00 0.00 0.00 0.00 61.98 63.54 1loa s VAL 172 Cb 0.00 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 1loa s VAL 172 CO 0.00 0.50 0.05 -0.22 0.00 0.00 0.00 175.10 175.44 1loa s LEU 173 N -0.94 3.80 0.01 3.92 2.96 -1.26 -1.98 118.68 125.19 1loa s LEU 173 Ca 0.34 0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.42 1loa s LEU 173 Cb -0.22 -2.10 -0.01 0.00 0.50 0.00 0.00 46.19 44.36 1loa s LEU 173 CO 0.24 0.31 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.63 1loa s THR 174 N -1.09 0.49 -0.02 3.68 2.01 0.07 -4.96 115.64 115.81 1loa s THR 174 Ca 0.19 -0.42 0.01 0.00 0.31 0.00 0.00 61.69 61.78 1loa s THR 174 Cb -0.12 -0.44 0.02 0.00 0.01 0.00 0.00 72.50 71.97 1loa s THR 174 CO 0.10 0.03 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.36 1loa s VAL 175 N -0.38 0.22 0.01 3.82 1.01 -1.26 -0.33 120.40 123.49 1loa s VAL 175 Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1loa s VAL 175 Cb -0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 36.38 36.05 1loa s VAL 175 CO -0.00 0.14 -0.02 -0.55 0.00 0.00 0.00 175.10 174.67 1loa s SER 176 N 0.78 0.20 -0.04 3.32 0.15 -0.74 -5.00 113.70 112.36 1loa s SER 176 Ca -0.08 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.43 1loa s SER 176 Cb -0.11 0.01 0.03 0.00 -1.71 0.00 0.00 66.02 64.23 1loa s SER 176 CO -0.01 -0.06 -0.01 -0.22 1.20 0.00 0.00 173.24 174.14 1loa s LEU 177 N -0.39 1.09 0.05 3.45 2.96 -1.26 -2.59 118.68 121.98 1loa s LEU 177 Ca -0.03 -0.07 0.06 0.00 -0.22 0.00 0.00 54.13 53.86 1loa s LEU 177 Cb -0.03 -0.34 -0.02 0.00 0.50 0.00 0.00 46.19 46.30 1loa s LEU 177 CO -0.00 -0.10 -0.16 0.42 -1.32 0.00 0.00 176.35 175.18 1loa s THR 178 N 1.19 1.26 -0.09 3.68 -4.23 -0.13 -4.94 115.64 112.38 1loa s THR 178 Ca -0.07 -1.10 -0.03 0.00 -1.18 0.00 0.00 61.69 59.31 1loa s THR 178 Cb -0.14 -1.13 -0.03 0.00 1.34 0.00 0.00 72.50 72.54 1loa s THR 178 CO -0.02 0.02 0.02 -0.31 -0.54 0.00 0.00 174.62 173.80 1loa s TYR 179 N -0.89 3.22 -2.00 3.99 2.02 -1.26 -0.96 117.35 121.47 1loa s TYR 179 Ca 0.03 0.24 0.04 0.00 -0.37 0.00 0.00 57.07 57.01 1loa s TYR 179 Cb -0.08 -1.81 0.26 0.00 -0.40 0.00 0.00 41.96 39.92 1loa s TYR 179 CO 0.02 0.50 0.73 -2.30 -1.57 0.00 0.00 175.55 172.93