#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d3n s VAL 3 N 0.00 3.59 -0.04 5.09 1.01 -1.26 0.14 120.40 128.94 3d3n s VAL 3 Ca 0.00 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.28 3d3n s VAL 3 Cb 0.00 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.88 3d3n s VAL 3 CO 0.00 0.46 0.01 -0.70 0.00 0.00 0.00 175.10 174.88 3d3n s GLU 4 N -1.20 0.28 -0.10 2.72 2.12 -0.10 -4.99 118.70 117.43 3d3n s GLU 4 Ca 0.15 0.14 -0.05 0.00 0.36 0.00 0.00 54.97 55.56 3d3n s GLU 4 Cb -0.11 -0.57 -0.04 0.00 0.26 0.00 0.00 34.13 33.67 3d3n s GLU 4 CO 0.05 -0.20 0.11 -0.65 -0.54 0.00 0.00 175.26 174.03 3d3n s GLN 5 N 1.38 3.32 -0.02 4.30 -1.52 -1.26 -1.42 119.66 124.44 3d3n s GLN 5 Ca -0.05 -0.21 -0.19 0.00 -1.95 0.00 0.00 55.36 52.96 3d3n s GLN 5 Cb -0.13 -3.08 0.04 0.00 -0.22 0.00 0.00 33.01 29.61 3d3n s GLN 5 CO -0.03 0.75 0.41 1.03 -0.25 0.00 0.00 175.29 177.20 3d3n s ARG 6 N -1.05 0.78 -0.33 2.91 1.81 -1.08 -5.03 118.95 116.96 3d3n s ARG 6 Ca 0.15 -0.10 0.03 0.00 -1.72 0.00 0.00 55.73 54.10 3d3n s ARG 6 Cb -0.12 0.35 0.10 0.00 -0.45 0.00 0.00 34.95 34.83 3d3n s ARG 6 CO 0.04 -0.23 0.05 0.99 -0.68 0.00 0.00 175.30 175.48 3d3n s THR 7 N -1.37 2.02 0.56 0.02 2.01 -1.26 -2.04 115.64 115.58 3d3n s THR 7 Ca -0.12 -2.15 -0.04 0.00 0.31 0.00 0.00 61.69 59.69 3d3n s THR 7 Cb -0.04 -2.49 0.01 0.00 0.01 0.00 0.00 72.50 70.00 3d3n s THR 7 CO 0.05 -0.59 0.84 -0.76 -0.69 0.00 0.00 174.62 173.47 3d3n s LEU 8 N 1.04 3.31 0.01 4.42 1.43 -0.70 -4.93 118.68 123.26 3d3n s LEU 8 Ca 0.10 0.50 0.02 0.00 -1.03 0.00 0.00 54.13 53.72 3d3n s LEU 8 Cb -0.19 -3.33 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 3d3n s LEU 8 CO -0.11 -1.03 -0.06 0.21 0.23 0.00 0.00 176.35 175.59 3d3n s ASN 9 N -4.31 0.69 -0.14 2.29 2.47 -1.26 -2.05 114.94 112.62 3d3n s ASN 9 Ca 0.53 -0.20 -0.30 0.00 0.42 0.00 0.00 52.86 53.31 3d3n s ASN 9 Cb -0.10 -0.05 0.11 0.00 -1.45 0.00 0.00 41.25 39.76 3d3n s ASN 9 CO 0.42 0.01 0.91 0.28 -3.72 0.00 0.00 177.10 175.00 3d3n s THR 10 N -0.41 0.00 -0.76 -5.21 -1.32 -1.26 -4.94 115.64 101.74 3d3n s THR 10 Ca -0.01 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.47 3d3n s THR 10 Cb -0.04 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.95 3d3n s THR 10 CO -0.00 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.41 3d3n n ALA 11 N 0.92 -0.53 -1.32 11.08 0.00 -1.26 0.09 120.51 129.49 3d3n n ALA 11 Ca -0.13 0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.30 3d3n n ALA 11 Cb 0.57 -1.05 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 3d3n n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d3n n ALA 12 N -1.32 -0.17 -3.91 0.00 0.00 -1.26 -4.94 120.51 108.92 3d3n n ALA 12 Ca -0.09 0.18 -0.29 0.00 0.00 0.00 0.00 53.44 53.24 3d3n n ALA 12 Cb 0.43 -1.55 -0.13 0.00 0.00 0.00 0.00 19.45 18.20 3d3n n ALA 12 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3d3n s HIS 13 N -2.13 3.26 0.58 0.00 3.76 0.11 -5.10 115.29 115.77 3d3n s HIS 13 Ca 0.00 -3.20 -0.19 0.00 -0.15 0.00 0.00 55.06 51.52 3d3n s HIS 13 Cb 0.00 -2.70 -0.06 0.00 1.11 0.00 0.00 32.58 30.92 3d3n s HIS 13 CO 0.00 -0.66 0.82 -2.30 -0.85 0.00 0.00 174.74 171.75 3d3n n PRO 14 N 2.65 0.78 -3.68 8.40 -0.02 -1.26 -4.26 135.00 137.62 3d3n n PRO 14 Ca 0.12 0.30 -0.10 0.00 -2.02 0.00 0.00 63.50 61.80 3d3n n PRO 14 Cb 0.34 -2.00 -0.05 0.00 -0.02 0.00 0.00 33.50 31.76 3d3n n PRO 14 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3d3n s PHE 15 N -1.57 -0.13 0.15 6.00 -0.71 -0.87 -4.92 117.98 115.92 3d3n s PHE 15 Ca 0.73 -0.20 0.10 0.00 -1.04 0.00 0.00 56.93 56.52 3d3n s PHE 15 Cb -0.43 0.20 -0.04 0.00 -1.21 0.00 0.00 43.02 41.54 3d3n s PHE 15 CO 0.50 -0.68 -0.20 -0.65 -1.34 0.00 0.00 175.22 172.85 3d3n s GLN 16 N -3.82 1.66 0.11 1.99 -0.21 -1.26 -1.72 119.66 116.42 3d3n s GLN 16 Ca 0.03 -1.32 -0.01 0.00 0.02 0.00 0.00 55.36 54.09 3d3n s GLN 16 Cb 0.02 -2.00 -0.04 0.00 1.00 0.00 0.00 33.01 31.99 3d3n s GLN 16 CO -0.12 0.45 0.03 0.96 -2.12 0.00 0.00 175.29 174.49 3d3n s ILE 17 N -1.32 0.17 -0.02 1.08 -4.36 -0.86 -1.16 121.20 114.72 3d3n s ILE 17 Ca 0.19 -1.89 0.01 0.00 -0.26 0.00 0.00 60.65 58.69 3d3n s ILE 17 Cb -0.10 -1.91 0.02 0.00 1.25 0.00 0.00 42.46 41.72 3d3n s ILE 17 CO 0.10 -0.60 -0.01 -0.89 0.24 0.00 0.00 174.94 173.78 3d3n s THR 18 N -3.99 0.18 -0.09 8.37 2.01 -0.78 -2.65 115.64 118.69 3d3n s THR 18 Ca 0.20 0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.25 3d3n s THR 18 Cb 0.07 -0.23 -0.01 0.00 0.01 0.00 0.00 72.50 72.34 3d3n s THR 18 CO -0.01 0.11 -0.19 0.00 -0.69 0.00 0.00 174.62 173.85 3d3n s ALA 19 N 0.66 2.41 -0.44 7.40 0.00 -0.51 -0.10 121.76 131.18 3d3n s ALA 19 Ca -0.06 -0.96 -0.00 0.00 0.00 0.00 0.00 51.96 50.93 3d3n s ALA 19 Cb -0.09 -0.95 0.12 0.00 0.00 0.00 0.00 23.12 22.19 3d3n s ALA 19 CO -0.01 0.34 0.21 0.71 0.00 0.00 0.00 175.76 177.01 3d3n s TYR 20 N 0.08 3.56 -0.35 0.00 2.02 0.87 -0.93 117.35 122.60 3d3n s TYR 20 Ca -0.08 -2.71 -0.27 0.00 -0.37 0.00 0.00 57.07 53.65 3d3n s TYR 20 Cb -0.15 -3.10 0.01 0.00 -0.40 0.00 0.00 41.96 38.32 3d3n s TYR 20 CO 0.05 -0.92 0.96 -1.58 -1.57 0.00 0.00 175.55 172.50 3d3n s TRP 21 N 0.70 3.11 0.47 2.71 0.23 0.12 -2.69 118.94 123.60 3d3n s TRP 21 Ca 0.11 0.91 -0.24 0.00 -2.03 0.00 0.00 56.10 54.86 3d3n s TRP 21 Cb -0.22 -3.63 -0.07 0.00 0.03 0.00 0.00 33.47 29.58 3d3n s TRP 21 CO -0.05 -0.79 1.32 -1.17 0.96 0.00 0.00 176.95 177.22 3d3n s LEU 22 N 3.49 4.04 0.16 2.99 2.96 -1.26 -1.36 118.68 129.70 3d3n s LEU 22 Ca 0.40 2.67 -0.04 0.00 -0.22 0.00 0.00 54.13 56.94 3d3n s LEU 22 Cb -0.12 -4.10 -0.05 0.00 0.50 0.00 0.00 46.19 42.42 3d3n s LEU 22 CO 0.17 -1.16 0.39 -1.81 -1.32 0.00 0.00 176.35 172.62 3d3n s ASP 23 N -0.89 6.48 0.79 3.68 1.01 -1.26 -4.88 116.67 121.60 3d3n s ASP 23 Ca 0.64 0.58 -0.11 0.00 0.71 0.00 0.00 52.55 54.37 3d3n s ASP 23 Cb -0.38 -2.09 0.07 0.00 1.01 0.00 0.00 42.92 41.53 3d3n s ASP 23 CO 0.47 0.03 1.10 -1.10 0.21 0.00 0.00 175.17 175.89 3d3n s GLN 24 N -2.76 2.09 0.00 8.23 -1.52 -1.26 -5.00 119.66 119.44 3d3n s GLN 24 Ca 0.41 1.26 0.00 0.00 -1.95 0.00 0.00 55.36 55.08 3d3n s GLN 24 Cb -0.12 -1.87 0.00 0.00 -0.22 0.00 0.00 33.01 30.80 3d3n s GLN 24 CO 0.25 -1.78 0.34 -0.89 -0.25 0.00 0.00 175.29 172.96 3d3n n ILE 25 N -3.54 0.00 -4.06 1.08 2.08 -1.26 -4.78 119.36 108.88 3d3n n ILE 25 Ca 0.10 0.73 -0.34 0.00 0.56 0.00 0.00 62.75 63.79 3d3n n ILE 25 Cb 0.53 -1.51 -0.10 0.00 -0.75 0.00 0.00 39.64 37.80 3d3n n ILE 25 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 3d3n s SER 26 N -1.78 5.51 0.52 4.38 0.15 -1.26 -4.96 113.70 116.25 3d3n s SER 26 Ca 0.00 0.05 0.33 0.00 0.70 0.00 0.00 55.95 57.03 3d3n s SER 26 Cb 0.00 -1.94 1.45 0.00 -1.71 0.00 0.00 66.02 63.82 3d3n s SER 26 CO 0.00 0.17 1.99 0.44 1.20 0.00 0.00 173.24 177.04 3d3n h ASP 27 N 6.70 0.00 0.80 5.45 5.19 -2.03 -2.12 116.42 130.41 3d3n h ASP 27 Ca -0.36 0.00 -0.22 0.00 -0.62 0.00 0.00 57.03 55.83 3d3n h ASP 27 Cb 1.17 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.64 3d3n h ASP 27 CO 0.69 0.00 -1.30 0.15 -3.12 0.00 0.00 179.24 175.66 3d3n h PHE 28 N 0.00 0.00 -0.02 4.55 3.57 -2.01 -3.51 116.94 119.53 3d3n h PHE 28 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3d3n h PHE 28 Cb 0.41 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.15 3d3n h PHE 28 CO 0.00 0.83 0.00 0.39 -2.23 0.00 0.00 178.31 177.30 3d3n n GLU 29 N -3.11 3.62 -4.41 1.11 1.02 -0.80 -5.25 120.64 112.82 3d3n n GLU 29 Ca -0.08 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.86 3d3n n GLU 29 Cb 0.93 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 32.25 3d3n n GLU 29 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d3n s ALA 31 N -3.63 2.18 -0.04 0.62 0.00 -1.26 -4.99 121.76 114.63 3d3n s ALA 31 Ca 0.00 -2.00 -0.14 0.00 0.00 0.00 0.00 51.96 49.82 3d3n s ALA 31 Cb 0.00 0.74 0.03 0.00 0.00 0.00 0.00 23.12 23.89 3d3n s ALA 31 CO 0.00 -0.34 0.31 0.54 0.00 0.00 0.00 175.76 176.27 3d3n s VAL 32 N -3.41 0.04 -0.12 0.00 0.11 -1.26 -5.14 120.40 110.62 3d3n s VAL 32 Ca 0.36 -0.35 -0.28 0.00 -2.93 0.00 0.00 61.98 58.78 3d3n s VAL 32 Cb 0.08 -0.57 -0.01 0.00 -1.53 0.00 0.00 36.38 34.35 3d3n s VAL 32 CO 0.15 -0.19 0.96 -1.81 -3.33 0.00 0.00 175.10 170.88 3d3n s ASP 33 N -0.92 7.17 0.10 3.54 1.01 -1.26 -4.87 116.67 121.44 3d3n s ASP 33 Ca -0.10 1.44 0.02 0.00 0.71 0.00 0.00 52.55 54.62 3d3n s ASP 33 Cb -0.04 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 3d3n s ASP 33 CO 0.03 -0.43 0.19 -0.31 0.21 0.00 0.00 175.17 174.86 3d3n s TYR 34 N 2.05 3.39 1.02 4.23 2.02 -0.87 -4.47 117.35 124.71 3d3n s TYR 34 Ca 0.46 0.14 -0.12 0.00 -0.37 0.00 0.00 57.07 57.18 3d3n s TYR 34 Cb -0.18 -1.67 0.20 0.00 -0.40 0.00 0.00 41.96 39.91 3d3n s TYR 34 CO 0.16 0.54 1.08 -2.14 -1.57 0.00 0.00 175.55 173.62 3d3n s PRO 35 N -2.77 0.26 0.00 -1.71 0.02 -1.26 -1.40 135.00 128.15 3d3n s PRO 35 Ca 0.33 0.92 0.00 0.00 0.02 0.00 0.00 61.00 62.27 3d3n s PRO 35 Cb -0.12 -1.69 0.00 0.00 0.02 0.00 0.00 34.50 32.72 3d3n s PRO 35 CO 0.26 -2.95 0.00 1.51 -0.33 0.00 0.00 177.00 175.49 3d3n n ILE 36 N -4.39 0.00 -3.62 2.83 3.06 -0.99 -0.07 119.36 116.19 3d3n n ILE 36 Ca 0.06 0.00 -0.03 0.00 -2.50 0.00 0.00 62.75 60.28 3d3n n ILE 36 Cb 0.55 0.00 -0.06 0.00 0.54 0.00 0.00 39.64 40.67 3d3n n ILE 36 CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 3d3n s ILE 38 N -0.64 -0.88 -0.34 9.51 1.01 -0.16 -1.06 121.20 128.62 3d3n s ILE 38 Ca 0.00 0.05 -0.11 0.00 0.00 0.00 0.00 60.65 60.59 3d3n s ILE 38 Cb 0.00 -0.89 0.00 0.00 0.01 0.00 0.00 42.46 41.58 3d3n s ILE 38 CO 0.00 0.02 0.20 -0.63 0.00 0.00 0.00 174.94 174.53 3d3n s ILE 39 N 2.80 4.81 -0.33 2.92 1.01 0.24 -1.31 121.20 131.34 3d3n s ILE 39 Ca -0.03 -0.51 -0.17 0.00 0.00 0.00 0.00 60.65 59.94 3d3n s ILE 39 Cb -0.12 -3.54 -0.01 0.00 0.01 0.00 0.00 42.46 38.80 3d3n s ILE 39 CO -0.17 -0.06 0.48 0.00 0.00 0.00 0.00 174.94 175.19 3d3n s PRO 41 N 2.30 1.29 0.00 0.00 0.02 -1.26 -1.82 135.00 135.53 3d3n s PRO 41 Ca 0.18 0.98 0.00 0.00 0.02 0.00 0.00 61.00 62.18 3d3n s PRO 41 Cb -0.16 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.56 3d3n s PRO 41 CO 0.12 -2.26 0.00 0.41 -0.33 0.00 0.00 177.00 174.94 3d3n n GLY 42 N -0.85 0.24 0.00 0.52 0.00 -1.03 -2.24 105.19 101.83 3d3n n GLY 42 Ca 0.08 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.29 3d3n n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d3n n GLY 43 N 5.00 1.13 1.96 -0.02 0.00 -1.26 -1.45 105.19 110.55 3d3n n GLY 43 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3d3n n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d3n n GLY 44 N 0.00 0.99 2.67 -0.02 0.00 -1.26 -1.45 105.19 106.12 3d3n n GLY 44 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3d3n n GLY 44 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3d3n n PHE 45 N -1.93 0.00 -0.01 1.61 3.72 -1.26 -4.81 117.46 114.78 3d3n n PHE 45 Ca -0.12 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.33 3d3n n PHE 45 Cb 0.41 -0.77 -0.11 0.00 -0.94 0.00 0.00 39.48 38.08 3d3n n PHE 45 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3d3n n THR 46 N -2.44 0.11 -3.69 4.37 -2.24 -0.53 -1.48 114.28 108.39 3d3n n THR 46 Ca 0.00 -0.35 -0.08 0.00 -2.27 0.00 0.00 64.05 61.35 3d3n n THR 46 Cb 0.15 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 3d3n n THR 46 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d3n n TYR 47 N -2.05 -1.51 -4.00 4.78 4.11 -1.05 -4.83 117.16 112.61 3d3n n TYR 47 Ca -0.05 -1.36 -0.34 0.00 -0.00 0.00 0.00 57.90 56.15 3d3n n TYR 47 Cb 0.44 0.48 -0.15 0.00 -0.00 0.00 0.00 39.34 40.11 3d3n n TYR 47 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.86 175.85 3d3n s HIS 48 N -4.17 2.97 0.52 -3.48 3.76 -1.26 -4.32 115.29 109.30 3d3n s HIS 48 Ca 0.14 -1.46 -0.19 0.00 -0.15 0.00 0.00 55.06 53.40 3d3n s HIS 48 Cb -0.02 -2.03 -0.07 0.00 1.11 0.00 0.00 32.58 31.57 3d3n s HIS 48 CO 0.10 -0.71 1.04 0.45 -0.85 0.00 0.00 174.74 174.78 3d3n s SER 49 N 1.34 6.19 0.00 1.40 0.15 -0.53 -4.95 113.70 117.31 3d3n s SER 49 Ca 0.03 1.90 0.00 0.00 0.70 0.00 0.00 55.95 58.57 3d3n s SER 49 Cb -0.15 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 3d3n s SER 49 CO -0.07 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.09 3d3n n GLY 50 N -0.46 0.38 0.15 9.45 0.00 -1.26 -4.61 105.19 108.85 3d3n n GLY 50 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 3d3n n GLY 50 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3d3n h ARG 51 N 0.00 -0.19 0.19 1.61 2.43 -2.01 -1.14 114.38 115.27 3d3n h ARG 51 Ca 0.00 0.01 -0.35 0.00 -0.81 0.00 0.00 59.98 58.83 3d3n h ARG 51 Cb 0.00 0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.60 3d3n h ARG 51 CO 0.00 -0.13 -1.74 0.93 -1.51 0.00 0.00 179.97 177.53 3d3n h GLU 52 N -0.20 0.39 -0.36 0.20 3.07 -2.02 -3.38 114.58 112.28 3d3n h GLU 52 Ca 0.03 -0.67 0.05 0.00 -0.50 0.00 0.00 59.36 58.28 3d3n h GLU 52 Cb 0.24 0.25 -0.05 0.00 -0.84 0.00 0.00 28.75 28.35 3d3n h GLU 52 CO -0.09 1.31 0.07 0.93 -1.40 0.00 0.00 179.01 179.83 3d3n h GLU 53 N 0.11 0.19 0.05 2.33 3.07 -1.84 -2.64 114.58 115.84 3d3n h GLU 53 Ca -0.34 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.54 3d3n h GLU 53 Cb 2.10 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 29.92 3d3n h GLU 53 CO 0.18 0.12 -0.37 0.00 -1.40 0.00 0.00 179.01 177.54 3d3n h ALA 54 N 1.27 -0.61 -0.97 3.43 0.00 -1.38 -0.98 119.26 120.02 3d3n h ALA 54 Ca 0.17 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.09 3d3n h ALA 54 Cb 0.20 0.65 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 3d3n h ALA 54 CO -0.23 -0.91 0.63 -1.35 0.00 0.00 0.00 179.25 177.39 3d3n h PRO 55 N -0.56 1.14 -0.83 0.00 0.11 -1.72 -2.16 132.00 127.97 3d3n h PRO 55 Ca 0.04 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 3d3n h PRO 55 Cb 0.62 -0.26 -0.04 0.00 0.11 0.00 0.00 31.00 31.44 3d3n h PRO 55 CO -0.26 0.75 0.43 0.82 -0.21 0.00 0.00 178.00 179.53 3d3n h ILE 56 N 1.17 1.25 -0.16 4.15 2.04 -1.05 -0.95 117.51 123.96 3d3n h ILE 56 Ca 0.40 -0.64 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 3d3n h ILE 56 Cb 0.09 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 3d3n h ILE 56 CO -0.14 0.28 0.02 0.00 0.00 0.00 0.00 178.15 178.31 3d3n h ALA 57 N 1.31 0.22 -0.96 1.87 0.00 -0.70 -3.04 119.26 117.95 3d3n h ALA 57 Ca 0.29 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3d3n h ALA 57 Cb 0.06 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3d3n h ALA 57 CO -0.04 -0.11 0.61 1.15 0.00 0.00 0.00 179.25 180.86 3d3n h THR 58 N 0.05 1.26 -0.14 0.00 2.02 -1.08 -3.42 112.91 111.60 3d3n h THR 58 Ca 0.05 -0.51 -0.56 0.00 0.77 0.00 0.00 66.41 66.17 3d3n h THR 58 Cb 0.32 -0.14 0.03 0.00 -1.74 0.00 0.00 68.15 66.63 3d3n h THR 58 CO 0.00 0.26 1.89 -1.14 0.37 0.00 0.00 175.52 176.91 3d3n n ARG 59 N -4.38 1.46 0.00 6.66 3.00 -0.39 -4.81 116.66 118.20 3d3n n ARG 59 Ca 0.11 -1.99 0.00 0.00 -0.00 0.00 0.00 57.85 55.97 3d3n n ARG 59 Cb 0.03 -3.14 0.00 0.00 0.00 0.00 0.00 32.46 29.36 3d3n n ARG 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3d3n n ALA 62 N 9.59 0.00 0.77 5.13 0.00 -1.26 -4.91 120.51 129.83 3d3n n ALA 62 Ca 0.48 0.00 0.12 0.00 0.00 0.00 0.00 53.44 54.04 3d3n n ALA 62 Cb 0.42 0.00 0.50 0.00 0.00 0.00 0.00 19.45 20.37 3d3n n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d3n n ALA 63 N -0.75 2.11 0.00 0.00 0.00 -1.26 -5.23 120.51 115.38 3d3n n ALA 63 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3d3n n ALA 63 Cb 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.04 3d3n n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d3n n GLY 64 N 0.99 0.31 3.71 0.00 0.00 -1.26 -5.10 105.19 103.84 3d3n n GLY 64 Ca 0.06 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.16 3d3n n GLY 64 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3d3n s HIS 66 N 0.00 2.81 -0.03 1.61 3.76 0.91 -4.19 115.29 120.15 3d3n s HIS 66 Ca 0.00 -0.22 -0.03 0.00 -0.15 0.00 0.00 55.06 54.66 3d3n s HIS 66 Cb 0.00 -1.33 0.01 0.00 1.11 0.00 0.00 32.58 32.37 3d3n s HIS 66 CO 0.00 0.54 0.09 0.95 -0.85 0.00 0.00 174.74 175.47 3d3n s THR 67 N -2.29 0.01 -0.03 1.30 -4.23 -1.09 -4.17 115.64 105.13 3d3n s THR 67 Ca 0.33 -0.07 0.04 0.00 -1.18 0.00 0.00 61.69 60.80 3d3n s THR 67 Cb -0.06 -0.15 -0.00 0.00 1.34 0.00 0.00 72.50 73.62 3d3n s THR 67 CO 0.22 -0.04 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.43 3d3n s VAL 68 N -0.09 1.11 -0.21 2.29 1.01 -1.26 -0.09 120.40 123.17 3d3n s VAL 68 Ca -0.01 -0.57 -0.04 0.00 0.00 0.00 0.00 61.98 61.36 3d3n s VAL 68 Cb -0.01 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 3d3n s VAL 68 CO 0.00 0.33 -0.02 -0.69 0.00 0.00 0.00 175.10 174.72 3d3n s VAL 69 N -0.06 3.69 -0.38 2.92 1.01 0.85 0.82 120.40 129.26 3d3n s VAL 69 Ca 0.00 -0.40 -0.10 0.00 0.00 0.00 0.00 61.98 61.49 3d3n s VAL 69 Cb -0.08 -2.67 0.04 0.00 0.00 0.00 0.00 36.38 33.67 3d3n s VAL 69 CO 0.01 0.43 0.20 -0.22 0.00 0.00 0.00 175.10 175.51 3d3n s LEU 70 N 1.17 4.73 -1.29 3.92 2.96 -0.87 -1.87 118.68 127.43 3d3n s LEU 70 Ca 0.03 -1.12 -0.15 0.00 -0.22 0.00 0.00 54.13 52.67 3d3n s LEU 70 Cb -0.14 -1.99 0.11 0.00 0.50 0.00 0.00 46.19 44.67 3d3n s LEU 70 CO 0.00 -0.40 1.74 0.59 -1.32 0.00 0.00 176.35 176.96 3d3n n ASN 71 N 4.95 4.88 -4.61 3.68 3.02 -0.31 -4.39 115.26 122.49 3d3n n ASN 71 Ca -0.12 -2.95 -0.32 0.00 -0.03 0.00 0.00 54.58 51.16 3d3n n ASN 71 Cb 0.45 -1.64 0.15 0.00 -0.61 0.00 0.00 39.78 38.13 3d3n n ASN 71 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3d3n n TYR 72 N 6.58 0.32 -1.64 3.10 0.18 -1.26 -4.02 117.16 120.43 3d3n n TYR 72 Ca 0.44 0.36 -0.56 0.00 1.88 0.00 0.00 57.90 60.02 3d3n n TYR 72 Cb 0.43 -1.96 -0.07 0.00 -0.38 0.00 0.00 39.34 37.35 3d3n n TYR 72 CO 0.00 0.00 0.00 0.94 -2.08 0.00 0.00 176.86 175.72 3d3n n GLN 73 N -3.42 0.94 -3.19 -3.48 -0.06 -1.26 -5.00 117.38 101.91 3d3n n GLN 73 Ca 0.11 0.34 -0.20 0.00 -2.00 0.00 0.00 57.00 55.25 3d3n n GLN 73 Cb 0.52 -1.98 0.04 0.00 -4.06 0.00 0.00 30.24 24.76 3d3n n GLN 73 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 3d3n s LEU 74 N 1.82 3.15 0.06 1.69 1.43 -1.26 -4.65 118.68 120.92 3d3n s LEU 74 Ca 0.92 -0.83 0.27 0.00 -1.03 0.00 0.00 54.13 53.46 3d3n s LEU 74 Cb -1.07 -1.77 0.92 0.00 0.03 0.00 0.00 46.19 44.30 3d3n s LEU 74 CO 0.58 -1.16 1.74 2.30 0.23 0.00 0.00 176.35 180.03 3d3n n ILE 75 N -2.06 0.18 -1.21 -0.59 -5.35 -0.55 -4.51 119.36 105.27 3d3n n ILE 75 Ca 0.11 -0.10 -0.38 0.00 -0.27 0.00 0.00 62.75 62.12 3d3n n ILE 75 Cb 0.62 -0.35 0.03 0.00 -1.74 0.00 0.00 39.64 38.20 3d3n n ILE 75 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 3d3n n VAL 76 N -1.74 0.45 -2.64 7.28 0.24 -1.26 -0.32 118.33 120.33 3d3n n VAL 76 Ca 0.06 -0.48 -0.21 0.00 -2.04 0.00 0.00 64.34 61.67 3d3n n VAL 76 Cb 0.37 -0.17 0.01 0.00 -1.47 0.00 0.00 33.84 32.58 3d3n n VAL 76 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d3n n GLY 77 N 2.53 -0.48 3.75 7.63 0.00 -1.26 -2.58 105.19 114.79 3d3n n GLY 77 Ca 0.06 0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 3d3n n GLY 77 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3d3n n ASP 78 N -2.11 -1.96 -4.76 1.61 2.03 -1.04 -5.00 116.55 105.33 3d3n n ASP 78 Ca -0.19 -0.81 -0.23 0.00 0.52 0.00 0.00 54.79 54.08 3d3n n ASP 78 Cb 0.66 -4.00 -0.06 0.00 -0.72 0.00 0.00 41.12 37.00 3d3n n ASP 78 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3d3n s GLN 79 N -6.14 2.42 -0.02 -0.67 -0.21 0.56 -5.12 119.66 110.48 3d3n s GLN 79 Ca 0.15 -1.54 -0.01 0.00 0.02 0.00 0.00 55.36 53.99 3d3n s GLN 79 Cb -0.07 -2.21 -0.04 0.00 1.00 0.00 0.00 33.01 31.69 3d3n s GLN 79 CO 0.82 0.08 0.07 -1.12 -2.12 0.00 0.00 175.29 173.01 3d3n s SER 80 N -3.89 5.61 0.02 5.90 0.01 -1.26 -4.31 113.70 115.79 3d3n s SER 80 Ca 0.39 0.15 -0.25 0.00 1.31 0.00 0.00 55.95 57.55 3d3n s SER 80 Cb -0.02 -1.61 -0.18 0.00 0.21 0.00 0.00 66.02 64.41 3d3n s SER 80 CO 0.23 0.30 1.41 0.58 0.41 0.00 0.00 173.24 176.17 3d3n h VAL 81 N 3.43 1.10 -2.25 3.43 2.07 -0.84 -3.45 116.25 119.74 3d3n h VAL 81 Ca -0.50 -0.66 -0.46 0.00 0.82 0.00 0.00 66.70 65.90 3d3n h VAL 81 Cb 1.19 1.53 -0.00 0.00 -1.52 0.00 0.00 31.29 32.48 3d3n h VAL 81 CO 0.60 0.16 -0.37 -0.31 0.02 0.00 0.00 177.57 177.68 3d3n s TYR 82 N -4.95 3.41 -1.85 1.57 2.02 -1.06 -1.08 117.35 115.42 3d3n s TYR 82 Ca -0.15 0.02 0.30 0.00 -0.37 0.00 0.00 57.07 56.87 3d3n s TYR 82 Cb 0.03 -1.70 1.39 0.00 -0.40 0.00 0.00 41.96 41.28 3d3n s TYR 82 CO 0.64 0.30 1.95 -0.35 -1.57 0.00 0.00 175.55 176.53 3d3n n PRO 83 N -1.52 0.89 -0.26 -1.71 -0.04 -1.26 -4.83 135.00 126.26 3d3n n PRO 83 Ca -0.07 -0.27 0.05 0.00 -0.04 0.00 0.00 63.50 63.18 3d3n n PRO 83 Cb 0.57 -1.49 0.15 0.00 -0.04 0.00 0.00 33.50 32.69 3d3n n PRO 83 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3d3n h TRP 84 N 0.65 -0.09 -0.58 0.54 -0.00 -1.84 -2.16 115.95 112.47 3d3n h TRP 84 Ca 0.00 0.06 0.11 0.00 -0.00 0.00 0.00 58.89 59.05 3d3n h TRP 84 Cb 0.28 0.16 -0.11 0.00 -0.00 0.00 0.00 29.16 29.49 3d3n h TRP 84 CO 0.00 -0.25 -0.31 0.00 -0.00 0.00 0.00 178.44 177.88 3d3n h ALA 85 N 1.72 0.02 -0.75 1.49 0.00 -1.44 0.16 119.26 120.45 3d3n h ALA 85 Ca 0.41 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.49 3d3n h ALA 85 Cb 0.72 0.73 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 3d3n h ALA 85 CO -0.68 -0.64 0.46 -0.07 0.00 0.00 0.00 179.25 178.31 3d3n h LEU 86 N -0.15 0.90 -1.13 0.00 3.38 -1.68 -1.47 115.31 115.16 3d3n h LEU 86 Ca 0.24 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 3d3n h LEU 86 Cb 0.54 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3d3n h LEU 86 CO -0.66 0.69 0.16 1.56 0.09 0.00 0.00 178.44 180.28 3d3n h GLN 87 N 1.03 0.77 -0.10 1.13 4.20 -1.05 -0.88 115.11 120.20 3d3n h GLN 87 Ca 0.27 -0.14 -0.14 0.00 0.06 0.00 0.00 58.65 58.70 3d3n h GLN 87 Cb -0.05 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 3d3n h GLN 87 CO -0.05 0.67 -0.55 1.96 -0.67 0.00 0.00 178.83 180.19 3d3n h GLN 88 N 0.75 0.31 -0.16 1.46 4.20 -0.13 -1.75 115.11 119.79 3d3n h GLN 88 Ca 0.17 -0.19 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 3d3n h GLN 88 Cb 0.23 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.03 3d3n h GLN 88 CO -0.01 0.78 -0.31 1.25 -0.67 0.00 0.00 178.83 179.87 3d3n h LEU 89 N 0.24 0.55 -0.91 1.46 5.85 -0.78 -1.57 115.31 120.14 3d3n h LEU 89 Ca 0.00 -0.55 -0.02 0.00 0.84 0.00 0.00 57.88 58.15 3d3n h LEU 89 Cb 1.04 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 3d3n h LEU 89 CO 0.09 1.00 0.46 1.23 -0.34 0.00 0.00 178.44 180.88 3d3n h GLY 90 N 0.12 1.32 0.95 3.75 0.00 -1.14 -1.43 103.07 106.64 3d3n h GLY 90 Ca 0.01 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 3d3n h GLY 90 CO 0.07 0.59 0.17 0.00 0.00 0.00 0.00 176.54 177.37 3d3n h ALA 91 N 1.27 0.46 -0.38 3.60 0.00 -1.24 0.10 119.26 123.07 3d3n h ALA 91 Ca 0.31 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.16 3d3n h ALA 91 Cb 0.06 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 3d3n h ALA 91 CO -0.05 0.03 0.11 1.15 0.00 0.00 0.00 179.25 180.49 3d3n h THR 92 N 0.44 0.85 -0.60 0.00 2.02 -0.94 0.92 112.91 115.60 3d3n h THR 92 Ca 0.12 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 3d3n h THR 92 Cb 0.12 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 3d3n h THR 92 CO -0.02 0.05 0.26 0.40 0.37 0.00 0.00 175.52 176.58 3d3n h ILE 93 N 0.25 1.21 -0.49 3.11 2.04 -0.95 0.51 117.51 123.19 3d3n h ILE 93 Ca 0.18 -0.61 -0.05 0.00 1.00 0.00 0.00 64.86 65.38 3d3n h ILE 93 Cb 0.19 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 3d3n h ILE 93 CO -0.21 0.25 0.12 -0.78 0.00 0.00 0.00 178.15 177.53 3d3n h ASP 94 N 0.85 0.75 -0.37 1.72 1.82 0.16 -2.16 116.42 119.19 3d3n h ASP 94 Ca 0.21 -0.23 -0.07 0.00 -0.39 0.00 0.00 57.03 56.54 3d3n h ASP 94 Cb 0.13 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 39.92 3d3n h ASP 94 CO -0.02 0.78 -0.02 -0.25 -1.61 0.00 0.00 179.24 178.12 3d3n h TRP 95 N 0.68 0.80 -0.46 0.28 7.01 0.15 -2.68 115.95 121.72 3d3n h TRP 95 Ca 0.15 -0.11 -0.06 0.00 2.11 0.00 0.00 58.89 60.98 3d3n h TRP 95 Cb 0.33 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.15 3d3n h TRP 95 CO 0.02 0.76 0.05 0.82 -2.79 0.00 0.00 178.44 177.29 3d3n h ILE 96 N 0.70 1.25 -0.07 2.65 2.04 -0.69 -2.29 117.51 121.10 3d3n h ILE 96 Ca 0.14 -0.96 0.02 0.00 1.00 0.00 0.00 64.86 65.06 3d3n h ILE 96 Cb 0.46 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.52 3d3n h ILE 96 CO 0.02 0.33 0.12 0.71 0.00 0.00 0.00 178.15 179.33 3d3n h THR 97 N 0.63 0.32 -0.01 -0.27 1.35 -1.05 0.34 112.91 114.22 3d3n h THR 97 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 3d3n h THR 97 Cb 0.43 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 3d3n h THR 97 CO 0.01 0.00 -0.08 0.35 -0.25 0.00 0.00 175.52 175.55 3d3n n THR 98 N -3.54 0.00 0.05 6.82 -2.24 -0.87 -3.78 114.28 110.73 3d3n n THR 98 Ca -0.01 -0.15 0.01 0.00 -2.27 0.00 0.00 64.05 61.63 3d3n n THR 98 Cb 0.21 0.22 -0.02 0.00 -2.10 0.00 0.00 70.33 68.64 3d3n n THR 98 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d3n n GLN 99 N -0.41 2.32 -0.30 -0.78 1.13 0.99 -4.72 117.38 115.61 3d3n n GLN 99 Ca 0.17 -0.02 0.28 0.00 -1.94 0.00 0.00 57.00 55.49 3d3n n GLN 99 Cb 0.31 -0.91 0.63 0.00 0.11 0.00 0.00 30.24 30.37 3d3n n GLN 99 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3d3n h ALA 100 N 0.33 2.64 0.00 -1.58 0.00 -1.07 -0.00 119.26 119.59 3d3n h ALA 100 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d3n h ALA 100 Cb 0.11 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3d3n h ALA 100 CO 0.00 -1.00 -0.27 0.77 0.00 0.00 0.00 179.25 178.76 3d3n h SER 101 N 0.19 0.00 0.47 0.00 0.02 -1.84 0.73 113.55 113.12 3d3n h SER 101 Ca 0.55 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.48 3d3n h SER 101 Cb 1.79 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.33 3d3n h SER 101 CO -0.14 0.01 -1.54 0.00 -1.14 0.00 0.00 176.83 174.01 3d3n n ALA 102 N -2.06 2.63 -0.64 3.77 0.00 -0.11 -4.28 120.51 119.82 3d3n n ALA 102 Ca 0.03 -0.41 0.06 0.00 0.00 0.00 0.00 53.44 53.13 3d3n n ALA 102 Cb 0.51 -0.91 0.11 0.00 0.00 0.00 0.00 19.45 19.16 3d3n n ALA 102 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3d3n n HIS 103 N -2.48 0.12 -3.38 0.00 8.25 -0.62 -5.02 115.22 112.10 3d3n n HIS 103 Ca -0.03 -0.79 -0.11 0.00 -0.26 0.00 0.00 57.72 56.53 3d3n n HIS 103 Cb 0.58 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.57 3d3n n HIS 103 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3d3n n HIS 104 N -0.91 -2.57 -4.39 4.41 8.25 -0.81 -4.86 115.22 114.34 3d3n n HIS 104 Ca 0.11 1.00 -0.34 0.00 -0.26 0.00 0.00 57.72 58.23 3d3n n HIS 104 Cb 0.52 -3.55 -0.13 0.00 1.12 0.00 0.00 29.99 27.95 3d3n n HIS 104 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3d3n s VAL 105 N -3.01 3.65 -0.80 1.59 1.01 0.19 -2.05 120.40 120.98 3d3n s VAL 105 Ca 0.01 -0.44 -0.21 0.00 0.00 0.00 0.00 61.98 61.35 3d3n s VAL 105 Cb -0.00 -2.60 0.09 0.00 0.00 0.00 0.00 36.38 33.87 3d3n s VAL 105 CO 0.81 0.48 1.06 -0.62 0.00 0.00 0.00 175.10 176.84 3d3n s ASP 106 N 0.57 6.39 0.00 3.32 -1.08 -0.49 -4.81 116.67 120.57 3d3n s ASP 106 Ca -0.04 -1.47 0.10 0.00 -0.52 0.00 0.00 52.55 50.63 3d3n s ASP 106 Cb -0.15 -2.42 0.58 0.00 -1.46 0.00 0.00 42.92 39.47 3d3n s ASP 106 CO 0.03 -1.28 1.13 0.00 0.52 0.00 0.00 175.17 175.57 3d3n n GLN 108 N -1.13 1.67 -3.08 0.00 1.13 -1.26 -4.36 117.38 110.35 3d3n n GLN 108 Ca 0.07 -1.18 -0.20 0.00 -1.94 0.00 0.00 57.00 53.74 3d3n n GLN 108 Cb 0.06 -1.48 -0.03 0.00 0.11 0.00 0.00 30.24 28.90 3d3n n GLN 108 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3d3n n ARG 109 N 0.37 1.67 -3.57 -1.09 1.74 0.54 -4.76 116.66 111.56 3d3n n ARG 109 Ca 0.15 -3.82 -0.40 0.00 -0.77 0.00 0.00 57.85 53.02 3d3n n ARG 109 Cb 0.44 -1.85 -0.11 0.00 -1.02 0.00 0.00 32.46 29.93 3d3n n ARG 109 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3d3n s ILE 110 N -3.11 5.07 -0.13 0.55 1.01 -1.26 -2.35 121.20 120.99 3d3n s ILE 110 Ca 0.42 -0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.76 3d3n s ILE 110 Cb 0.34 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 3d3n s ILE 110 CO -0.09 0.03 0.06 -0.63 0.00 0.00 0.00 174.94 174.31 3d3n s ILE 111 N 1.69 4.84 -0.29 2.92 1.01 -0.23 -1.51 121.20 129.63 3d3n s ILE 111 Ca 0.06 -0.03 -0.08 0.00 0.00 0.00 0.00 60.65 60.60 3d3n s ILE 111 Cb -0.17 -3.11 -0.00 0.00 0.01 0.00 0.00 42.46 39.19 3d3n s ILE 111 CO 0.09 0.56 0.10 -0.76 0.00 0.00 0.00 174.94 174.93 3d3n s LEU 112 N -0.52 3.83 -0.19 2.97 1.43 -0.47 -0.99 118.68 124.73 3d3n s LEU 112 Ca 0.10 -0.56 -0.03 0.00 -1.03 0.00 0.00 54.13 52.61 3d3n s LEU 112 Cb -0.12 -1.92 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 3d3n s LEU 112 CO 0.02 -0.16 -0.07 0.00 0.23 0.00 0.00 176.35 176.37 3d3n s ALA 113 N 1.55 2.77 0.02 4.21 0.00 -0.43 0.34 121.76 130.22 3d3n s ALA 113 Ca 0.04 -1.07 0.08 0.00 0.00 0.00 0.00 51.96 51.01 3d3n s ALA 113 Cb -0.17 -1.55 -0.02 0.00 0.00 0.00 0.00 23.12 21.38 3d3n s ALA 113 CO 0.04 -0.20 -0.24 0.20 0.00 0.00 0.00 175.76 175.56 3d3n s GLY 114 N 1.08 1.22 -0.02 0.00 0.00 -0.39 -0.20 107.32 109.02 3d3n s GLY 114 Ca 0.01 -1.11 0.05 0.00 0.00 0.00 0.00 44.72 43.66 3d3n s GLY 114 CO -0.01 -0.98 -0.16 -1.36 0.00 0.00 0.00 173.10 170.58 3d3n s PHE 115 N -0.70 1.52 0.00 1.90 0.08 -0.76 -1.63 117.98 118.39 3d3n s PHE 115 Ca 0.10 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 56.79 3d3n s PHE 115 Cb -0.09 -1.00 0.00 0.00 -0.57 0.00 0.00 43.02 41.36 3d3n s PHE 115 CO 0.01 -0.08 0.00 0.45 -0.10 0.00 0.00 175.22 175.50 3d3n n SER 116 N 2.90 0.00 0.17 1.36 2.88 -0.91 0.14 113.62 120.15 3d3n n SER 116 Ca -0.16 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.49 3d3n n SER 116 Cb 0.54 0.00 0.63 0.00 -0.75 0.00 0.00 64.21 64.63 3d3n n SER 116 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3d3n h ALA 117 N -0.58 2.10 0.00 -1.46 0.00 -1.86 0.12 119.26 117.59 3d3n h ALA 117 Ca 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3d3n h ALA 117 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3d3n h ALA 117 CO 0.00 -0.15 -0.31 0.78 0.00 0.00 0.00 179.25 179.57 3d3n h GLY 118 N 0.05 0.00 1.81 0.00 0.00 0.16 -2.14 103.07 102.95 3d3n h GLY 118 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.36 3d3n h GLY 118 CO -0.01 0.00 -0.13 -1.33 0.00 0.00 0.00 176.54 175.07 3d3n h GLY 119 N 1.00 0.25 1.00 4.60 0.00 -0.54 -1.12 103.07 108.27 3d3n h GLY 119 Ca -0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.10 3d3n h GLY 119 CO 0.04 0.15 0.05 0.84 0.00 0.00 0.00 176.54 177.62 3d3n h HIS 120 N 0.22 0.91 0.33 5.60 2.76 -1.32 0.50 115.15 124.16 3d3n h HIS 120 Ca 0.05 -0.14 -0.01 0.00 -2.20 0.00 0.00 60.37 58.07 3d3n h HIS 120 Cb 0.38 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.09 3d3n h HIS 120 CO 0.01 0.84 -0.23 0.28 -1.30 0.00 0.00 177.93 177.53 3d3n h VAL 121 N 0.72 0.52 -0.66 5.26 2.07 -1.32 0.70 116.25 123.54 3d3n h VAL 121 Ca 0.15 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.60 3d3n h VAL 121 Cb 0.44 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 3d3n h VAL 121 CO 0.02 0.00 0.12 0.58 0.02 0.00 0.00 177.57 178.31 3d3n h VAL 122 N -0.55 1.26 -0.43 2.57 2.07 -1.04 -0.01 116.25 120.11 3d3n h VAL 122 Ca -0.03 -1.00 -0.09 0.00 0.82 0.00 0.00 66.70 66.40 3d3n h VAL 122 Cb 0.47 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3d3n h VAL 122 CO 0.02 0.38 -0.10 0.00 0.02 0.00 0.00 177.57 177.88 3d3n h ALA 123 N 1.12 1.01 -0.12 1.67 0.00 0.16 -0.62 119.26 122.47 3d3n h ALA 123 Ca 0.20 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 3d3n h ALA 123 Cb 0.41 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3d3n h ALA 123 CO 0.01 0.60 -0.20 1.15 0.00 0.00 0.00 179.25 180.81 3d3n h THR 124 N 0.70 1.37 -0.79 0.00 2.02 -0.59 -3.09 112.91 112.54 3d3n h THR 124 Ca 0.12 -1.43 0.03 0.00 0.77 0.00 0.00 66.41 65.90 3d3n h THR 124 Cb 0.58 2.01 -0.04 0.00 -1.74 0.00 0.00 68.15 68.95 3d3n h THR 124 CO 0.04 0.42 0.52 0.22 0.37 0.00 0.00 175.52 177.08 3d3n h TYR 125 N -0.06 0.93 0.00 3.16 3.20 -0.88 0.12 116.97 123.45 3d3n h TYR 125 Ca 0.01 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 3d3n h TYR 125 Cb 0.76 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 38.72 3d3n h TYR 125 CO 0.10 0.54 -0.04 -0.97 -1.64 0.00 0.00 178.16 176.15 3d3n h ASN 126 N 0.97 0.00 0.05 -2.11 -1.24 -1.03 -1.05 115.58 111.16 3d3n h ASN 126 Ca 0.31 0.00 -0.32 0.00 0.71 0.00 0.00 56.30 57.01 3d3n h ASN 126 Cb 0.05 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.06 3d3n h ASN 126 CO -0.09 0.04 -1.76 0.61 -1.29 0.00 0.00 177.43 174.94 3d3n n GLY 127 N -1.21 -0.66 0.20 1.57 0.00 0.09 -4.13 105.19 101.05 3d3n n GLY 127 Ca -0.03 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.80 3d3n n GLY 127 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3d3n h VAL 128 N -0.54 1.28 0.00 1.61 2.07 -0.77 -3.14 116.25 116.76 3d3n h VAL 128 Ca -0.43 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 65.98 3d3n h VAL 128 Cb 1.65 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 32.75 3d3n h VAL 128 CO -0.12 0.36 0.00 0.00 0.02 0.00 0.00 177.57 177.83 3d3n h ALA 129 N 0.81 1.00 -0.61 1.67 0.00 -1.42 -2.82 119.26 117.89 3d3n h ALA 129 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3d3n h ALA 129 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3d3n h ALA 129 CO 0.03 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.53 3d3n n THR 130 N -2.75 1.39 -3.90 0.00 -2.24 -1.19 -4.85 114.28 100.73 3d3n n THR 130 Ca 0.01 -1.00 -0.24 0.00 -2.27 0.00 0.00 64.05 60.55 3d3n n THR 130 Cb 0.29 0.20 -0.17 0.00 -2.10 0.00 0.00 70.33 68.55 3d3n n THR 130 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3d3n s GLN 131 N -1.59 1.08 0.04 -0.78 -0.21 -1.07 -4.78 119.66 112.36 3d3n s GLN 131 Ca 0.45 -0.09 -0.11 0.00 0.02 0.00 0.00 55.36 55.63 3d3n s GLN 131 Cb 0.27 -1.25 -0.04 0.00 1.00 0.00 0.00 33.01 32.99 3d3n s GLN 131 CO 0.25 -0.25 1.18 -1.35 -2.12 0.00 0.00 175.29 172.99 3d3n h PRO 132 N 8.10 -0.17 -0.71 2.91 0.11 -1.88 0.93 132.00 141.29 3d3n h PRO 132 Ca -0.26 0.01 0.16 0.00 0.11 0.00 0.00 66.00 66.02 3d3n h PRO 132 Cb 1.13 0.04 -0.12 0.00 0.11 0.00 0.00 31.00 32.16 3d3n h PRO 132 CO 0.35 -0.11 -0.01 1.49 -0.21 0.00 0.00 178.00 179.51 3d3n h GLU 133 N -0.18 0.10 -0.31 1.05 4.57 -1.97 0.38 114.58 118.21 3d3n h GLU 133 Ca 0.01 -0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.04 3d3n h GLU 133 Cb 0.21 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 3d3n h GLU 133 CO -0.15 0.06 -0.39 -0.07 -1.18 0.00 0.00 179.01 177.29 3d3n h LEU 134 N 0.10 0.79 -1.87 1.64 3.38 -1.73 -0.72 115.31 116.89 3d3n h LEU 134 Ca 0.38 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3d3n h LEU 134 Cb 0.65 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 3d3n h LEU 134 CO -0.63 1.08 -0.12 -0.09 0.09 0.00 0.00 178.44 178.77 3d3n h ARG 135 N 0.61 0.00 0.03 1.13 2.43 0.29 -2.33 114.38 116.55 3d3n h ARG 135 Ca 0.05 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.91 3d3n h ARG 135 Cb 0.93 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.44 3d3n h ARG 135 CO 0.09 0.12 -1.76 1.15 -1.51 0.00 0.00 179.97 178.06 3d3n h THR 136 N 0.00 0.82 0.00 0.20 2.02 -0.97 0.75 112.91 115.72 3d3n h THR 136 Ca -0.00 -2.63 -0.03 0.00 0.77 0.00 0.00 66.41 64.52 3d3n h THR 136 Cb 0.25 2.46 -0.00 0.00 -1.74 0.00 0.00 68.15 69.11 3d3n h THR 136 CO 0.02 0.60 -0.14 -0.09 0.37 0.00 0.00 175.52 176.28 3d3n h ARG 137 N 0.02 0.00 -0.25 6.66 2.43 -0.62 -2.80 114.38 119.83 3d3n h ARG 137 Ca -0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 3d3n h ARG 137 Cb 2.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.57 3d3n h ARG 137 CO 0.08 0.14 0.00 0.66 -1.51 0.00 0.00 179.97 179.34 3d3n n TYR 138 N -3.71 0.86 -3.34 2.20 4.01 -0.95 -5.01 117.16 111.22 3d3n n TYR 138 Ca -0.02 -0.86 -0.15 0.00 -0.16 0.00 0.00 57.90 56.70 3d3n n TYR 138 Cb 0.25 -0.29 0.04 0.00 -0.31 0.00 0.00 39.34 39.03 3d3n n TYR 138 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 3d3n n HIS 139 N -0.52 -2.45 0.00 -0.72 8.25 -1.06 -4.76 115.22 113.97 3d3n n HIS 139 Ca 0.20 0.84 0.00 0.00 -0.26 0.00 0.00 57.72 58.50 3d3n n HIS 139 Cb 0.85 -3.85 0.00 0.00 1.12 0.00 0.00 29.99 28.11 3d3n n HIS 139 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3d3n n LEU 140 N -2.98 0.00 0.27 2.41 4.77 0.25 -4.70 117.00 117.01 3d3n n LEU 140 Ca -0.07 -0.37 0.16 0.00 -0.03 0.00 0.00 56.01 55.70 3d3n n LEU 140 Cb 0.58 0.00 0.78 0.00 -2.33 0.00 0.00 43.42 42.46 3d3n n LEU 140 CO 0.60 0.00 1.14 0.44 -1.33 0.00 0.00 177.39 178.23 3d3n h ASP 141 N 0.00 0.00 0.26 -1.43 3.32 -1.88 0.09 116.42 116.78 3d3n h ASP 141 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3d3n h ASP 141 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3d3n h ASP 141 CO 0.00 0.00 -0.26 0.00 -1.72 0.00 0.00 179.24 177.26 3d3n n HIS 142 N -3.11 0.00 -3.37 4.55 1.44 -1.26 -4.92 115.22 108.55 3d3n n HIS 142 Ca 0.01 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.33 3d3n n HIS 142 Cb 0.46 -0.13 -0.06 0.00 0.12 0.00 0.00 29.99 30.38 3d3n n HIS 142 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 3d3n s TYR 143 N -2.52 3.77 0.34 -1.40 2.02 0.02 -5.08 117.35 114.49 3d3n s TYR 143 Ca 0.24 1.15 -0.02 0.00 -0.37 0.00 0.00 57.07 58.08 3d3n s TYR 143 Cb 0.19 -2.41 -0.04 0.00 -0.40 0.00 0.00 41.96 39.30 3d3n s TYR 143 CO 0.53 0.61 0.57 -0.65 -1.57 0.00 0.00 175.55 175.03 3d3n s GLN 144 N -1.07 3.53 0.00 -0.62 -1.52 -1.26 -5.00 119.66 113.72 3d3n s GLN 144 Ca 0.27 -0.19 0.00 0.00 -1.95 0.00 0.00 55.36 53.49 3d3n s GLN 144 Cb -0.18 -2.63 0.00 0.00 -0.22 0.00 0.00 33.01 29.98 3d3n s GLN 144 CO 0.17 0.13 0.00 0.41 -0.25 0.00 0.00 175.29 175.75 3d3n n GLY 145 N -1.59 -1.18 3.44 3.09 0.00 -1.26 -3.23 105.19 104.47 3d3n n GLY 145 Ca -0.03 -1.61 -0.17 0.00 0.00 0.00 0.00 46.02 44.21 3d3n n GLY 145 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3d3n s GLN 146 N -2.42 0.94 0.42 1.61 -2.07 -1.26 -4.93 119.66 111.95 3d3n s GLN 146 Ca 0.00 0.16 -0.08 0.00 -1.82 0.00 0.00 55.36 53.62 3d3n s GLN 146 Cb 0.00 0.44 -0.05 0.00 -1.09 0.00 0.00 33.01 32.31 3d3n s GLN 146 CO 0.00 -0.28 0.75 -3.38 -1.32 0.00 0.00 175.29 171.06 3d3n s HIS 147 N -1.17 3.50 -0.09 9.60 -3.43 -1.26 -4.67 115.29 117.77 3d3n s HIS 147 Ca -0.11 0.91 0.17 0.00 -0.80 0.00 0.00 55.06 55.23 3d3n s HIS 147 Cb -0.02 -2.35 -0.25 0.00 -1.43 0.00 0.00 32.58 28.53 3d3n s HIS 147 CO 0.08 -0.14 0.25 0.00 -2.00 0.00 0.00 174.74 172.93 3d3n n ALA 148 N -1.60 2.19 -3.72 -1.38 0.00 -0.57 -4.96 120.51 110.47 3d3n n ALA 148 Ca 0.01 -0.74 -0.07 0.00 0.00 0.00 0.00 53.44 52.64 3d3n n ALA 148 Cb 0.54 -0.40 -0.02 0.00 0.00 0.00 0.00 19.45 19.58 3d3n n ALA 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d3n s ALA 149 N -2.89 -1.44 0.00 0.00 0.00 -1.25 -3.97 121.76 112.22 3d3n s ALA 149 Ca -0.07 0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.94 3d3n s ALA 149 Cb 0.09 0.78 -0.00 0.00 0.00 0.00 0.00 23.12 23.98 3d3n s ALA 149 CO 0.73 -0.96 -0.02 0.96 0.00 0.00 0.00 175.76 176.47 3d3n s ILE 150 N -3.69 0.16 0.05 0.00 -4.36 -0.34 -1.37 121.20 111.64 3d3n s ILE 150 Ca 0.09 -0.22 0.04 0.00 -0.26 0.00 0.00 60.65 60.31 3d3n s ILE 150 Cb -0.04 -0.16 -0.04 0.00 1.25 0.00 0.00 42.46 43.47 3d3n s ILE 150 CO 0.01 -0.04 -0.05 -0.63 0.24 0.00 0.00 174.94 174.47 3d3n s ILE 151 N -0.26 3.73 -0.03 8.37 1.01 0.15 -1.17 121.20 133.01 3d3n s ILE 151 Ca -0.02 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.70 3d3n s ILE 151 Cb -0.02 -2.70 0.03 0.00 0.01 0.00 0.00 42.46 39.78 3d3n s ILE 151 CO -0.00 0.25 0.01 -0.76 0.00 0.00 0.00 174.94 174.43 3d3n s LEU 152 N -1.86 1.04 -0.19 2.97 1.43 0.09 -1.26 118.68 120.90 3d3n s LEU 152 Ca 0.21 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 3d3n s LEU 152 Cb -0.11 -0.23 0.02 0.00 0.03 0.00 0.00 46.19 45.90 3d3n s LEU 152 CO 0.12 -0.12 -0.17 -0.83 0.23 0.00 0.00 176.35 175.58 3d3n s GLY 153 N 1.19 1.44 -1.02 -3.19 0.00 -0.65 -1.02 107.32 104.07 3d3n s GLY 153 Ca -0.07 -1.26 -0.11 0.00 0.00 0.00 0.00 44.72 43.28 3d3n s GLY 153 CO -0.02 0.33 0.20 1.58 0.00 0.00 0.00 173.10 175.19 3d3n n TYR 154 N 4.63 -0.94 -2.42 1.90 4.11 0.52 -2.15 117.16 122.80 3d3n n TYR 154 Ca -0.20 0.27 -0.29 0.00 -0.00 0.00 0.00 57.90 57.68 3d3n n TYR 154 Cb 0.49 -2.00 -0.00 0.00 -0.00 0.00 0.00 39.34 37.83 3d3n n TYR 154 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 3d3n s PRO 155 N -6.44 3.61 -0.10 -3.48 0.04 -1.26 -2.99 135.00 124.39 3d3n s PRO 155 Ca 0.15 0.43 -0.21 0.00 0.04 0.00 0.00 61.00 61.41 3d3n s PRO 155 Cb -0.08 -2.28 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 3d3n s PRO 155 CO 0.71 -0.30 0.58 0.08 0.04 0.00 0.00 177.00 178.12 3d3n s VAL 156 N -2.82 5.12 -0.06 -0.36 1.01 -1.06 -4.57 120.40 117.66 3d3n s VAL 156 Ca 0.51 1.18 -0.01 0.00 0.00 0.00 0.00 61.98 63.65 3d3n s VAL 156 Cb -0.10 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 3d3n s VAL 156 CO 0.45 0.29 -0.07 -0.38 0.00 0.00 0.00 175.10 175.40 3d3n n ILE 157 N 3.73 0.35 -4.05 2.22 2.08 -1.26 -3.11 119.36 119.31 3d3n n ILE 157 Ca -0.04 -0.11 -0.33 0.00 0.56 0.00 0.00 62.75 62.82 3d3n n ILE 157 Cb 0.51 -1.12 -0.15 0.00 -0.75 0.00 0.00 39.64 38.13 3d3n n ILE 157 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3d3n s ASP 158 N -5.05 3.86 0.00 4.38 -1.08 -1.26 -1.50 116.67 116.02 3d3n s ASP 158 Ca -0.09 -0.90 0.00 0.00 -0.52 0.00 0.00 52.55 51.04 3d3n s ASP 158 Cb 0.03 -1.56 0.00 0.00 -1.46 0.00 0.00 42.92 39.93 3d3n s ASP 158 CO 0.13 -0.09 0.56 0.18 0.52 0.00 0.00 175.17 176.47 3d3n n LEU 159 N 4.59 0.26 0.00 -1.34 4.77 -0.43 -2.54 117.00 122.31 3d3n n LEU 159 Ca -0.18 -0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 3d3n n LEU 159 Cb 0.47 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3d3n n LEU 159 CO 0.25 0.06 0.27 0.35 -1.33 0.00 0.00 177.39 176.99 3d3n n THR 160 N -0.26 0.29 -3.31 -5.08 -2.24 -1.26 -4.45 114.28 97.97 3d3n n THR 160 Ca 0.00 -0.39 -0.26 0.00 -2.27 0.00 0.00 64.05 61.13 3d3n n THR 160 Cb 0.06 1.07 -0.07 0.00 -2.10 0.00 0.00 70.33 69.29 3d3n n THR 160 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d3n n ALA 161 N -0.14 3.48 0.00 6.98 0.00 -1.05 -4.99 120.51 124.79 3d3n n ALA 161 Ca 0.00 -4.26 0.00 0.00 0.00 0.00 0.00 53.44 49.18 3d3n n ALA 161 Cb 0.27 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.86 3d3n n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d3n n GLY 162 N 0.96 2.12 3.50 0.00 0.00 -1.26 -4.74 105.19 105.77 3d3n n GLY 162 Ca 0.27 -0.68 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 3d3n n GLY 162 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3d3n s PHE 163 N 0.00 3.02 0.41 1.61 5.36 -1.26 -3.74 117.98 123.38 3d3n s PHE 163 Ca 0.00 -0.30 -0.07 0.00 -0.96 0.00 0.00 56.93 55.61 3d3n s PHE 163 Cb 0.00 -1.95 0.10 0.00 -0.34 0.00 0.00 43.02 40.82 3d3n s PHE 163 CO 0.00 -0.03 0.52 -0.35 -1.46 0.00 0.00 175.22 173.90 3d3n n PRO 164 N 3.50 -0.73 0.01 10.12 -0.04 -1.26 -4.43 135.00 142.17 3d3n n PRO 164 Ca -0.17 -0.81 -0.22 0.00 -0.04 0.00 0.00 63.50 62.26 3d3n n PRO 164 Cb 0.52 -0.57 -0.14 0.00 -0.04 0.00 0.00 33.50 33.28 3d3n n PRO 164 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3d3n h THR 165 N -1.42 0.66 -2.48 0.52 1.35 -1.96 -3.46 112.91 106.13 3d3n h THR 165 Ca -0.17 -2.36 -0.46 0.00 -0.55 0.00 0.00 66.41 62.86 3d3n h THR 165 Cb 0.48 2.54 0.01 0.00 -1.73 0.00 0.00 68.15 69.45 3d3n h THR 165 CO 0.12 0.90 -0.25 0.28 -0.25 0.00 0.00 175.52 176.32 3d3n s THR 166 N -2.56 4.74 -0.29 6.82 -1.32 -1.26 -5.01 115.64 116.75 3d3n s THR 166 Ca -0.22 -0.68 0.19 0.00 -1.21 0.00 0.00 61.69 59.78 3d3n s THR 166 Cb 0.06 -3.71 0.17 0.00 -1.51 0.00 0.00 72.50 67.52 3d3n s THR 166 CO 0.78 -0.39 1.44 0.77 -2.21 0.00 0.00 174.62 175.01 3d3n h SER 167 N 0.80 0.00 -0.03 8.08 4.64 -1.97 -3.29 113.55 121.78 3d3n h SER 167 Ca -0.49 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.82 3d3n h SER 167 Cb 1.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3d3n h SER 167 CO 0.59 0.23 -0.02 0.00 -0.87 0.00 0.00 176.83 176.76 3d3n h ALA 168 N 1.77 0.05 -0.08 5.18 0.00 -2.00 -2.71 119.26 121.47 3d3n h ALA 168 Ca -0.01 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.68 3d3n h ALA 168 Cb 1.18 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 3d3n h ALA 168 CO 0.03 -0.21 0.15 0.00 0.00 0.00 0.00 179.25 179.23 3d3n h ALA 169 N 0.57 1.48 0.22 0.00 0.00 -1.99 -0.59 119.26 118.95 3d3n h ALA 169 Ca 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3d3n h ALA 169 Cb 0.48 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3d3n h ALA 169 CO 0.01 -0.19 -0.11 -0.09 0.00 0.00 0.00 179.25 178.86 3d3n h ARG 170 N 0.00 -0.29 -0.02 0.00 2.43 -1.57 -2.32 114.38 112.62 3d3n h ARG 170 Ca 0.04 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 3d3n h ARG 170 Cb 0.34 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 3d3n h ARG 170 CO -0.00 -0.01 0.02 -0.91 -1.51 0.00 0.00 179.97 177.56 3d3n h ASN 171 N -1.00 0.00 -0.04 -3.80 2.35 -1.12 -0.93 115.58 111.04 3d3n h ASN 171 Ca -0.03 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 3d3n h ASN 171 Cb 0.41 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.78 3d3n h ASN 171 CO 0.05 0.00 -0.00 -0.61 -1.65 0.00 0.00 177.43 175.22 3d3n h GLN 172 N 0.00 0.07 -0.99 0.81 5.75 -1.13 -2.73 115.11 116.89 3d3n h GLN 172 Ca 0.01 -0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.58 3d3n h GLN 172 Cb 0.04 -0.01 -0.07 0.00 1.07 0.00 0.00 27.48 28.51 3d3n h GLN 172 CO -0.00 0.36 0.63 0.82 -2.65 0.00 0.00 178.83 177.99 3d3n h ILE 173 N -0.24 1.01 -1.05 2.39 2.04 -0.62 -3.37 117.51 117.68 3d3n h ILE 173 Ca 0.01 -0.37 0.20 0.00 1.00 0.00 0.00 64.86 65.70 3d3n h ILE 173 Cb 0.33 -0.16 -0.33 0.00 -0.74 0.00 0.00 36.82 35.91 3d3n h ILE 173 CO 0.00 0.20 0.82 0.28 0.00 0.00 0.00 178.15 179.45 3d3n s THR 174 N -6.01 0.00 -2.18 -0.27 -1.32 -0.67 -0.32 115.64 104.87 3d3n s THR 174 Ca -0.12 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 60.53 3d3n s THR 174 Cb 0.21 -1.00 0.42 0.00 -1.51 0.00 0.00 72.50 70.62 3d3n s THR 174 CO 0.81 0.00 1.42 0.35 -2.21 0.00 0.00 174.62 174.99 3d3n n THR 175 N 2.41 0.42 -3.10 5.08 -2.24 -1.12 -3.98 114.28 111.75 3d3n n THR 175 Ca -0.14 -0.51 -0.45 0.00 -2.27 0.00 0.00 64.05 60.68 3d3n n THR 175 Cb 0.56 0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 3d3n n THR 175 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d3n s ASP 176 N -1.30 6.64 0.64 3.42 -1.08 -1.26 -4.87 116.67 118.86 3d3n s ASP 176 Ca 0.32 -2.24 0.31 0.00 -0.52 0.00 0.00 52.55 50.41 3d3n s ASP 176 Cb 0.17 -2.31 1.69 0.00 -1.46 0.00 0.00 42.92 41.00 3d3n s ASP 176 CO 0.24 -0.87 1.99 0.00 0.52 0.00 0.00 175.17 177.04 3d3n h ALA 177 N 8.45 1.53 0.00 3.66 0.00 -2.00 0.12 119.26 131.01 3d3n h ALA 177 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3d3n h ALA 177 Cb 1.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3d3n h ALA 177 CO 0.96 -0.37 0.00 -2.13 0.00 0.00 0.00 179.25 177.72 3d3n n ARG 178 N -3.20 0.12 -0.45 0.00 0.63 -1.26 -2.19 116.66 110.31 3d3n n ARG 178 Ca 0.00 0.48 0.06 0.00 -0.92 0.00 0.00 57.85 57.48 3d3n n ARG 178 Cb 0.39 -1.79 0.19 0.00 0.45 0.00 0.00 32.46 31.70 3d3n n ARG 178 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3d3n n LEU 179 N -2.03 2.80 -0.04 6.15 4.77 0.41 -4.72 117.00 124.35 3d3n n LEU 179 Ca 0.01 -3.61 -0.22 0.00 -0.03 0.00 0.00 56.01 52.16 3d3n n LEU 179 Cb 0.12 -0.51 -0.13 0.00 -2.33 0.00 0.00 43.42 40.57 3d3n n LEU 179 CO 0.12 1.15 -0.69 0.79 -1.33 0.00 0.00 177.39 177.44 3d3n n TRP 180 N -1.19 1.17 -3.85 -1.77 8.01 -0.93 -4.78 117.44 114.11 3d3n n TRP 180 Ca 0.20 0.34 -0.34 0.00 -1.31 0.00 0.00 57.50 56.39 3d3n n TRP 180 Cb 0.72 -1.14 -0.12 0.00 -2.01 0.00 0.00 31.31 28.76 3d3n n TRP 180 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3d3n s ALA 181 N -2.48 3.24 0.49 6.99 0.00 -1.25 -1.31 121.76 127.44 3d3n s ALA 181 Ca -0.25 -2.87 0.18 0.00 0.00 0.00 0.00 51.96 49.02 3d3n s ALA 181 Cb 0.06 -2.33 1.22 0.00 0.00 0.00 0.00 23.12 22.07 3d3n s ALA 181 CO 0.70 -1.90 2.03 0.00 0.00 0.00 0.00 175.76 176.59 3d3n h ALA 182 N 7.39 2.18 0.00 0.00 0.00 -1.57 -1.18 119.26 126.08 3d3n h ALA 182 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3d3n h ALA 182 Cb 0.99 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3d3n h ALA 182 CO 0.66 -0.28 0.04 -0.56 0.00 0.00 0.00 179.25 179.11 3d3n h GLN 183 N 0.16 0.00 -0.01 0.00 -0.00 -1.89 0.28 115.11 113.66 3d3n h GLN 183 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.84 3d3n h GLN 183 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.04 3d3n h GLN 183 CO -0.03 0.00 -0.13 0.54 -0.00 0.00 0.00 178.83 179.21 3d3n n ARG 184 N -2.94 1.32 0.00 0.06 1.74 -0.45 -3.62 116.66 112.77 3d3n n ARG 184 Ca -0.03 -0.81 0.10 0.00 -0.77 0.00 0.00 57.85 56.35 3d3n n ARG 184 Cb 0.10 -1.48 0.06 0.00 -1.02 0.00 0.00 32.46 30.12 3d3n n ARG 184 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3d3n n LEU 185 N -0.14 2.46 -4.73 0.55 4.77 0.99 -4.96 117.00 115.95 3d3n n LEU 185 Ca 0.15 -0.94 -0.41 0.00 -0.03 0.00 0.00 56.01 54.78 3d3n n LEU 185 Cb 0.37 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 3d3n n LEU 185 CO 0.21 0.43 0.87 -0.69 -1.33 0.00 0.00 177.39 176.88 3d3n s VAL 186 N -1.82 3.79 0.18 4.08 1.01 -1.19 -4.58 120.40 121.87 3d3n s VAL 186 Ca 0.22 1.41 -0.06 0.00 0.00 0.00 0.00 61.98 63.55 3d3n s VAL 186 Cb 0.17 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 3d3n s VAL 186 CO 0.31 0.18 0.24 0.42 0.00 0.00 0.00 175.10 176.26 3d3n s THR 187 N 0.35 0.04 -0.50 3.92 -4.23 -1.26 -4.99 115.64 108.98 3d3n s THR 187 Ca 0.55 -1.64 0.00 0.00 -1.18 0.00 0.00 61.69 59.42 3d3n s THR 187 Cb -0.31 -2.11 0.00 0.00 1.34 0.00 0.00 72.50 71.42 3d3n s THR 187 CO 0.33 -0.19 0.77 -2.65 -0.54 0.00 0.00 174.62 172.34 3d3n n PRO 188 N -0.24 0.00 0.09 3.99 -0.02 -1.26 -0.16 135.00 137.40 3d3n n PRO 188 Ca -0.04 0.27 0.08 0.00 -2.02 0.00 0.00 63.50 61.79 3d3n n PRO 188 Cb 0.64 -1.75 -0.01 0.00 -0.02 0.00 0.00 33.50 32.35 3d3n n PRO 188 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d3n h ALA 189 N 1.03 0.58 -2.63 3.55 0.00 -1.91 -3.48 119.26 116.40 3d3n h ALA 189 Ca 0.00 -0.26 -0.57 0.00 0.00 0.00 0.00 54.91 54.08 3d3n h ALA 189 Cb 0.49 0.08 0.17 0.00 0.00 0.00 0.00 17.79 18.53 3d3n h ALA 189 CO 0.00 0.28 -0.18 0.43 0.00 0.00 0.00 179.25 179.78 3d3n n SER 190 N -2.78 -0.34 -4.89 0.00 7.64 0.77 -4.89 113.62 109.13 3d3n n SER 190 Ca -0.02 0.73 -0.29 0.00 1.01 0.00 0.00 58.87 60.30 3d3n n SER 190 Cb 0.64 -1.27 -0.01 0.00 -1.01 0.00 0.00 64.21 62.55 3d3n n SER 190 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3d3n s LYS 191 N -2.50 3.64 0.38 1.43 -0.14 -1.26 -4.92 119.74 116.37 3d3n s LYS 191 Ca 0.71 0.33 -0.26 0.00 -1.36 0.00 0.00 55.97 55.39 3d3n s LYS 191 Cb -0.41 -2.38 -0.11 0.00 -1.68 0.00 0.00 37.83 33.25 3d3n s LYS 191 CO 0.52 -0.14 1.15 -2.30 -0.76 0.00 0.00 175.35 173.81 3d3n n PRO 192 N -1.86 1.70 -4.11 -1.68 -0.02 -1.25 -4.68 135.00 123.09 3d3n n PRO 192 Ca 0.01 0.60 -0.18 0.00 -2.02 0.00 0.00 63.50 61.92 3d3n n PRO 192 Cb 0.55 -2.18 -0.16 0.00 -0.02 0.00 0.00 33.50 31.69 3d3n n PRO 192 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d3n s ALA 193 N -1.18 0.51 -0.31 3.55 0.00 -0.96 -1.20 121.76 122.18 3d3n s ALA 193 Ca 0.60 -0.05 -0.11 0.00 0.00 0.00 0.00 51.96 52.40 3d3n s ALA 193 Cb -0.57 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.24 3d3n s ALA 193 CO 0.59 0.02 0.18 0.12 0.00 0.00 0.00 175.76 176.67 3d3n s PHE 194 N 0.60 3.19 -0.04 0.00 2.19 -0.31 -2.23 117.98 121.37 3d3n s PHE 194 Ca -0.07 -0.27 0.05 0.00 0.33 0.00 0.00 56.93 56.97 3d3n s PHE 194 Cb -0.10 -2.39 -0.02 0.00 -1.31 0.00 0.00 43.02 39.20 3d3n s PHE 194 CO -0.00 -0.34 -0.19 0.08 1.83 0.00 0.00 175.22 176.60 3d3n s VAL 195 N 1.68 2.66 0.07 3.12 1.01 -0.25 -0.73 120.40 127.96 3d3n s VAL 195 Ca 0.06 -0.88 -0.14 0.00 0.00 0.00 0.00 61.98 61.03 3d3n s VAL 195 Cb -0.17 -2.00 0.02 0.00 0.00 0.00 0.00 36.38 34.23 3d3n s VAL 195 CO 0.08 0.59 0.31 -1.66 0.00 0.00 0.00 175.10 174.42 3d3n s TRP 196 N -0.65 -0.09 0.00 5.22 1.48 -0.19 -0.87 118.94 123.85 3d3n s TRP 196 Ca 0.10 -0.12 0.00 0.00 -1.06 0.00 0.00 56.10 55.02 3d3n s TRP 196 Cb -0.11 0.10 0.00 0.00 -1.16 0.00 0.00 33.47 32.31 3d3n s TRP 196 CO 0.00 -0.55 0.00 0.94 -4.06 0.00 0.00 176.95 173.28 3d3n n GLN 197 N 0.33 0.00 -3.58 3.25 7.27 -0.93 -0.36 117.38 123.36 3d3n n GLN 197 Ca -0.18 0.00 -0.34 0.00 0.07 0.00 0.00 57.00 56.55 3d3n n GLN 197 Cb 0.61 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 33.20 3d3n n GLN 197 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 3d3n s THR 198 N -2.00 5.10 0.21 1.69 -4.23 -1.26 -1.37 115.64 113.78 3d3n s THR 198 Ca 0.00 0.41 0.09 0.00 -1.18 0.00 0.00 61.69 61.01 3d3n s THR 198 Cb 0.00 -3.64 -0.09 0.00 1.34 0.00 0.00 72.50 70.11 3d3n s THR 198 CO 0.00 0.25 1.48 0.00 -0.54 0.00 0.00 174.62 175.82 3d3n h ALA 199 N 3.60 0.73 0.00 3.99 0.00 -1.57 -3.14 119.26 122.87 3d3n h ALA 199 Ca -0.49 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 53.73 3d3n h ALA 199 Cb 1.19 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3d3n h ALA 199 CO 0.67 0.95 0.00 -2.37 0.00 0.00 0.00 179.25 178.50 3d3n n THR 200 N -3.61 0.27 -1.93 0.00 5.66 -1.26 -4.79 114.28 108.62 3d3n n THR 200 Ca -0.01 0.07 -0.43 0.00 -3.05 0.00 0.00 64.05 60.64 3d3n n THR 200 Cb 0.74 -0.68 -0.03 0.00 -1.55 0.00 0.00 70.33 68.81 3d3n n THR 200 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3d3n s ASP 201 N -2.59 6.34 -0.10 1.09 3.68 -1.19 -4.86 116.67 119.05 3d3n s ASP 201 Ca 0.22 2.03 0.19 0.00 2.13 0.00 0.00 52.55 57.11 3d3n s ASP 201 Cb 0.16 -2.53 -0.25 0.00 -1.45 0.00 0.00 42.92 38.85 3d3n s ASP 201 CO 0.36 -1.22 0.35 -1.84 0.13 0.00 0.00 175.17 172.94 3d3n n GLU 202 N 7.64 0.67 -0.24 4.34 0.00 -1.26 -4.34 120.64 127.44 3d3n n GLU 202 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.41 3d3n n GLU 202 Cb 0.44 -1.59 0.17 0.00 0.00 0.00 0.00 31.44 30.46 3d3n n GLU 202 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 3d3n h SER 203 N 0.00 -0.01 -3.16 -1.84 0.02 -2.01 -3.36 113.55 103.19 3d3n h SER 203 Ca -0.32 0.15 -0.51 0.00 -0.84 0.00 0.00 61.79 60.27 3d3n h SER 203 Cb 1.79 0.20 -0.40 0.00 0.14 0.00 0.00 62.40 64.13 3d3n h SER 203 CO 0.03 -0.04 -0.76 0.54 -1.14 0.00 0.00 176.83 175.45 3d3n s VAL 204 N -6.05 0.32 -0.12 2.27 0.11 -1.26 -4.73 120.40 110.93 3d3n s VAL 204 Ca -0.13 -0.51 -0.41 0.00 -2.93 0.00 0.00 61.98 58.00 3d3n s VAL 204 Cb 0.21 -0.93 -0.19 0.00 -1.53 0.00 0.00 36.38 33.94 3d3n s VAL 204 CO 0.75 -0.30 1.35 -2.65 -3.33 0.00 0.00 175.10 170.92 3d3n n PRO 205 N 5.12 0.46 0.03 1.54 -0.02 -1.26 -4.86 135.00 136.01 3d3n n PRO 205 Ca -0.08 0.17 0.16 0.00 -2.02 0.00 0.00 63.50 61.73 3d3n n PRO 205 Cb 0.47 -1.73 0.63 0.00 -0.02 0.00 0.00 33.50 32.85 3d3n n PRO 205 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3d3n h PRO 206 N 4.43 0.10 -1.18 0.52 0.11 -1.87 -2.39 132.00 131.71 3d3n h PRO 206 Ca -0.48 -0.01 0.34 0.00 0.11 0.00 0.00 66.00 65.96 3d3n h PRO 206 Cb 1.38 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.41 3d3n h PRO 206 CO 0.80 0.06 0.84 0.97 -0.21 0.00 0.00 178.00 180.46 3d3n h ILE 207 N 0.10 0.41 -0.14 4.15 6.09 -1.94 -0.58 117.51 125.60 3d3n h ILE 207 Ca 0.21 -0.02 0.03 0.00 -1.37 0.00 0.00 64.86 63.71 3d3n h ILE 207 Cb 0.69 0.35 -0.03 0.00 0.47 0.00 0.00 36.82 38.29 3d3n h ILE 207 CO -0.02 0.01 -0.08 0.78 -3.07 0.00 0.00 178.15 175.77 3d3n h ASN 208 N 0.06 -0.25 0.10 2.19 -0.26 -1.75 -1.44 115.58 114.24 3d3n h ASN 208 Ca 0.58 0.06 0.02 0.00 -0.56 0.00 0.00 56.30 56.40 3d3n h ASN 208 Cb 2.19 0.14 -0.04 0.00 -1.06 0.00 0.00 38.32 39.55 3d3n h ASN 208 CO -0.06 -0.10 -0.27 0.28 -1.06 0.00 0.00 177.43 176.21 3d3n h SER 209 N -0.07 -0.79 -0.59 5.81 0.02 -1.32 -2.31 113.55 114.30 3d3n h SER 209 Ca 0.08 0.09 0.12 0.00 -0.84 0.00 0.00 61.79 61.24 3d3n h SER 209 Cb 0.19 0.30 -0.10 0.00 0.14 0.00 0.00 62.40 62.93 3d3n h SER 209 CO -0.18 -0.36 0.02 -0.07 -1.14 0.00 0.00 176.83 175.10 3d3n h LEU 210 N -0.48 -0.21 -0.80 5.07 3.38 -1.48 0.80 115.31 121.60 3d3n h LEU 210 Ca 0.04 0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.19 3d3n h LEU 210 Cb 0.51 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.45 3d3n h LEU 210 CO -0.17 -0.09 0.50 0.11 0.09 0.00 0.00 178.44 178.88 3d3n h LYS 211 N 0.14 0.91 -0.21 1.13 1.57 -0.83 0.18 116.57 119.47 3d3n h LYS 211 Ca 0.31 -0.05 -0.20 0.00 -1.87 0.00 0.00 60.65 58.83 3d3n h LYS 211 Cb 0.48 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3d3n h LYS 211 CO -0.48 0.60 -0.67 -0.92 -0.57 0.00 0.00 179.45 177.41 3d3n h TYR 212 N 0.94 1.03 -0.53 -1.35 3.20 -0.77 -2.74 116.97 116.75 3d3n h TYR 212 Ca 0.33 -0.41 -0.08 0.00 3.14 0.00 0.00 58.73 61.71 3d3n h TYR 212 Cb 0.09 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 3d3n h TYR 212 CO -0.04 1.23 -0.01 0.28 -1.64 0.00 0.00 178.16 177.99 3d3n h VAL 213 N 0.57 1.25 -0.55 1.81 2.07 -0.40 -2.71 116.25 118.30 3d3n h VAL 213 Ca -0.02 -1.08 -0.04 0.00 0.82 0.00 0.00 66.70 66.37 3d3n h VAL 213 Cb 1.28 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 3d3n h VAL 213 CO 0.14 0.39 0.16 -0.61 0.02 0.00 0.00 177.57 177.66 3d3n h GLN 214 N 0.83 0.82 -0.76 1.57 -0.00 -0.63 -0.78 115.11 116.16 3d3n h GLN 214 Ca 0.15 -0.15 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3d3n h GLN 214 Cb 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 27.48 27.86 3d3n h GLN 214 CO 0.03 0.72 0.00 0.00 0.00 0.00 0.00 178.83 179.58 3d3n n ALA 215 N -2.46 1.81 0.00 3.38 0.00 -1.02 -1.14 120.51 121.09 3d3n n ALA 215 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3d3n n ALA 215 Cb 0.21 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.66 3d3n n ALA 215 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3d3n n LEU 217 N 0.38 0.00 -0.20 0.00 4.77 -0.30 -1.69 117.00 119.97 3d3n n LEU 217 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3d3n n LEU 217 Cb 0.16 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.34 3d3n n LEU 217 CO 0.00 0.00 0.83 -0.61 -1.33 0.00 0.00 177.39 176.28 3d3n h GLN 218 N 0.00 0.11 -0.76 3.23 5.75 -1.37 0.13 115.11 122.20 3d3n h GLN 218 Ca 0.00 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 3d3n h GLN 218 Cb 0.00 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.52 3d3n h GLN 218 CO 0.00 0.07 0.00 0.72 -2.65 0.00 0.00 178.83 176.97 3d3n n HIS 219 N -5.27 1.19 -3.96 3.99 8.25 -0.68 -4.92 115.22 113.81 3d3n n HIS 219 Ca 0.08 -0.41 -0.27 0.00 -0.26 0.00 0.00 57.72 56.86 3d3n n HIS 219 Cb 0.34 -0.34 -0.01 0.00 1.12 0.00 0.00 29.99 31.11 3d3n n HIS 219 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3d3n n GLN 220 N 0.36 -3.85 -3.84 -0.41 6.02 0.46 -4.34 117.38 111.78 3d3n n GLN 220 Ca 0.16 0.46 -0.35 0.00 -0.01 0.00 0.00 57.00 57.26 3d3n n GLN 220 Cb 0.79 -4.88 -0.08 0.00 1.02 0.00 0.00 30.24 27.08 3d3n n GLN 220 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3d3n s VAL 221 N -3.69 5.20 -0.11 5.09 1.01 -1.26 -5.02 120.40 121.61 3d3n s VAL 221 Ca 0.24 0.11 -0.38 0.00 0.00 0.00 0.00 61.98 61.96 3d3n s VAL 221 Cb -0.13 -3.35 -0.15 0.00 0.00 0.00 0.00 36.38 32.75 3d3n s VAL 221 CO 0.88 0.46 1.65 0.00 0.00 0.00 0.00 175.10 178.09 3d3n n ALA 222 N 3.39 -0.09 -3.50 5.51 0.00 -1.26 -4.47 120.51 120.10 3d3n n ALA 222 Ca -0.16 0.41 -0.16 0.00 0.00 0.00 0.00 53.44 53.53 3d3n n ALA 222 Cb 0.52 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.66 3d3n n ALA 222 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3d3n s THR 223 N 2.60 0.01 0.09 0.00 -1.32 -1.26 -2.26 115.64 113.50 3d3n s THR 223 Ca 0.92 -0.06 0.08 0.00 -1.21 0.00 0.00 61.69 61.42 3d3n s THR 223 Cb -0.94 -0.91 -0.03 0.00 -1.51 0.00 0.00 72.50 69.11 3d3n s THR 223 CO 0.56 -0.03 -0.20 0.00 -2.21 0.00 0.00 174.62 172.74 3d3n s ALA 224 N -0.51 1.70 -0.04 11.08 0.00 -0.95 -5.00 121.76 128.03 3d3n s ALA 224 Ca -0.06 -1.19 -0.02 0.00 0.00 0.00 0.00 51.96 50.69 3d3n s ALA 224 Cb -0.03 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.89 3d3n s ALA 224 CO 0.05 0.33 0.10 -0.47 0.00 0.00 0.00 175.76 175.77 3d3n s TYR 225 N -1.14 -0.09 -0.31 0.00 5.04 -1.26 -1.09 117.35 118.49 3d3n s TYR 225 Ca 0.05 0.32 -0.02 0.00 -2.44 0.00 0.00 57.07 54.99 3d3n s TYR 225 Cb -0.10 -0.09 0.11 0.00 0.35 0.00 0.00 41.96 42.22 3d3n s TYR 225 CO 0.04 -0.11 0.13 -1.01 -1.34 0.00 0.00 175.55 173.25 3d3n s HIS 226 N 0.85 1.14 -0.54 4.97 3.76 -0.05 -5.00 115.29 120.41 3d3n s HIS 226 Ca -0.07 -1.46 -0.17 0.00 -0.15 0.00 0.00 55.06 53.22 3d3n s HIS 226 Cb -0.09 -1.36 0.12 0.00 1.11 0.00 0.00 32.58 32.35 3d3n s HIS 226 CO -0.04 -0.85 0.53 -1.17 -0.85 0.00 0.00 174.74 172.36 3d3n s LEU 227 N 1.67 5.97 0.25 0.89 2.96 -1.26 -2.18 118.68 126.99 3d3n s LEU 227 Ca 0.11 -1.66 -0.30 0.00 -0.22 0.00 0.00 54.13 52.06 3d3n s LEU 227 Cb -0.18 -2.23 -0.09 0.00 0.50 0.00 0.00 46.19 44.19 3d3n s LEU 227 CO -0.26 -0.88 1.10 -0.36 -1.32 0.00 0.00 176.35 174.63 3d3n s PHE 228 N 1.81 3.59 0.16 5.38 0.08 -0.47 -4.83 117.98 123.71 3d3n s PHE 228 Ca 0.05 1.68 -0.10 0.00 0.12 0.00 0.00 56.93 58.67 3d3n s PHE 228 Cb -0.28 -3.28 0.02 0.00 -0.57 0.00 0.00 43.02 38.91 3d3n s PHE 228 CO 0.04 -0.55 1.57 0.78 -0.10 0.00 0.00 175.22 176.96 3d3n h GLY 229 N 4.14 1.10 -3.95 4.36 0.00 -1.97 -1.97 103.07 104.79 3d3n h GLY 229 Ca -0.46 -0.92 -0.54 0.00 0.00 0.00 0.00 47.33 45.41 3d3n h GLY 229 CO 0.68 0.84 -0.00 -0.45 0.00 0.00 0.00 176.54 177.61 3d3n s SER 230 N -6.66 6.93 0.00 0.19 0.15 -1.26 -4.32 113.70 108.74 3d3n s SER 230 Ca -0.12 1.23 0.31 0.00 0.70 0.00 0.00 55.95 58.07 3d3n s SER 230 Cb 0.13 -2.35 1.63 0.00 -1.71 0.00 0.00 66.02 63.72 3d3n s SER 230 CO 0.87 0.08 2.08 0.61 1.20 0.00 0.00 173.24 178.07 3d3n n GLY 231 N 0.82 -0.77 0.13 9.45 0.00 -1.26 -3.74 105.19 109.82 3d3n n GLY 231 Ca -0.04 -0.26 -0.07 0.00 0.00 0.00 0.00 46.02 45.65 3d3n n GLY 231 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3d3n h ILE 232 N 0.61 1.48 -3.72 -0.61 2.10 -1.97 -3.49 117.51 111.91 3d3n h ILE 232 Ca 0.00 -2.49 -0.44 0.00 1.08 0.00 0.00 64.86 63.00 3d3n h ILE 232 Cb 0.16 2.36 0.17 0.00 -1.09 0.00 0.00 36.82 38.43 3d3n h ILE 232 CO 0.00 0.73 0.15 -1.00 -1.08 0.00 0.00 178.15 176.95 3d3n s HIS 233 N -3.33 1.79 0.00 2.19 3.76 -1.25 -5.08 115.29 113.39 3d3n s HIS 233 Ca -0.03 0.94 0.00 0.00 -0.15 0.00 0.00 55.06 55.82 3d3n s HIS 233 Cb 0.11 -3.26 0.00 0.00 1.11 0.00 0.00 32.58 30.54 3d3n s HIS 233 CO 0.81 -3.21 0.00 0.98 -0.85 0.00 0.00 174.74 172.47 3d3n n TYR 250 N -4.39 0.00 -3.43 1.40 4.19 -1.26 -4.80 117.16 108.87 3d3n n TYR 250 Ca 0.05 0.00 -0.40 0.00 3.31 0.00 0.00 57.90 60.86 3d3n n TYR 250 Cb 0.57 0.00 -0.10 0.00 0.49 0.00 0.00 39.34 40.31 3d3n n TYR 250 CO 0.00 0.00 0.00 -1.17 0.91 0.00 0.00 176.86 176.60 3d3n s LEU 251 N 0.00 4.29 0.31 2.98 2.96 -1.26 -5.05 118.68 122.92 3d3n s LEU 251 Ca 0.00 -0.08 -0.26 0.00 -0.22 0.00 0.00 54.13 53.57 3d3n s LEU 251 Cb 0.00 -2.32 -0.15 0.00 0.50 0.00 0.00 46.19 44.22 3d3n s LEU 251 CO 0.00 -0.26 0.62 0.59 -1.32 0.00 0.00 176.35 175.98 3d3n n ASN 252 N 5.32 -0.58 -3.75 3.68 4.13 -1.26 -5.19 115.26 117.61 3d3n n ASN 252 Ca -0.10 1.04 -0.41 0.00 1.68 0.00 0.00 54.58 56.80 3d3n n ASN 252 Cb 0.50 -1.09 0.01 0.00 -1.54 0.00 0.00 39.78 37.66 3d3n n ASN 252 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 3d3n n ASP 253 N 1.58 6.90 -3.90 6.41 8.00 -1.26 -4.89 116.55 129.40 3d3n n ASP 253 Ca 0.13 -3.59 -0.27 0.00 0.71 0.00 0.00 54.79 51.77 3d3n n ASP 253 Cb 0.33 -1.18 0.21 0.00 -0.02 0.00 0.00 41.12 40.45 3d3n n ASP 253 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d3n n ALA 256 N 0.46 -3.23 -0.02 2.24 0.00 -1.26 -5.27 120.51 113.42 3d3n n ALA 256 Ca 0.39 -1.36 -0.04 0.00 0.00 0.00 0.00 53.44 52.43 3d3n n ALA 256 Cb 0.29 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.31 3d3n n ALA 256 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3d3n n ILE 257 N -4.83 0.28 -0.35 0.00 5.41 -1.26 -4.71 119.36 113.90 3d3n n ILE 257 Ca 0.05 -0.10 0.04 0.00 1.00 0.00 0.00 62.75 63.74 3d3n n ILE 257 Cb 0.53 -0.92 0.19 0.00 -0.71 0.00 0.00 39.64 38.72 3d3n n ILE 257 CO 0.00 0.00 0.00 4.11 0.00 0.00 0.00 176.55 180.66 3d3n h TRP 258 N -0.05 1.11 -0.96 1.39 5.08 -1.99 -0.81 115.95 119.71 3d3n h TRP 258 Ca -0.11 0.03 0.14 0.00 1.08 0.00 0.00 58.89 60.03 3d3n h TRP 258 Cb 1.15 -0.36 -0.09 0.00 -3.00 0.00 0.00 29.16 26.86 3d3n h TRP 258 CO -0.00 0.52 0.58 -1.35 -1.28 0.00 0.00 178.44 176.91 3d3n h PRO 259 N 1.04 0.84 0.17 0.12 0.11 -2.00 0.34 132.00 132.63 3d3n h PRO 259 Ca 0.44 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.50 3d3n h PRO 259 Cb 0.29 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 3d3n h PRO 259 CO -0.21 0.55 -0.12 1.96 -0.21 0.00 0.00 178.00 179.97 3d3n h GLN 260 N 0.86 -0.28 0.21 1.05 4.20 -1.44 -0.54 115.11 119.17 3d3n h GLN 260 Ca 0.50 0.02 0.01 0.00 0.06 0.00 0.00 58.65 59.24 3d3n h GLN 260 Cb 0.61 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.42 3d3n h GLN 260 CO -0.31 -0.19 -0.31 -0.07 -0.67 0.00 0.00 178.83 177.28 3d3n h LEU 261 N -0.29 -0.86 -0.83 1.46 3.38 -0.88 -1.49 115.31 115.80 3d3n h LEU 261 Ca -0.01 0.09 0.18 0.00 0.09 0.00 0.00 57.88 58.23 3d3n h LEU 261 Cb 0.26 0.31 -0.11 0.00 0.09 0.00 0.00 40.66 41.21 3d3n h LEU 261 CO 0.00 -0.42 0.33 0.00 0.09 0.00 0.00 178.44 178.45 3d3n h ALA 262 N 0.03 1.23 -0.53 1.53 0.00 -0.84 0.20 119.26 120.88 3d3n h ALA 262 Ca 0.01 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3d3n h ALA 262 Cb 0.57 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3d3n h ALA 262 CO -0.12 -0.27 0.26 -0.07 0.00 0.00 0.00 179.25 179.05 3d3n h LEU 263 N 0.42 0.69 -0.13 0.00 3.38 -0.58 0.21 115.31 119.29 3d3n h LEU 263 Ca 0.48 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.35 3d3n h LEU 263 Cb 0.83 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 3d3n h LEU 263 CO -0.47 0.61 0.04 -0.09 0.09 0.00 0.00 178.44 178.61 3d3n h ARG 264 N 0.71 0.10 -0.55 1.13 9.65 -0.09 -0.15 114.38 125.17 3d3n h ARG 264 Ca 0.18 -0.01 0.10 0.00 -1.10 0.00 0.00 59.98 59.15 3d3n h ARG 264 Cb 0.10 -0.02 -0.08 0.00 -1.39 0.00 0.00 29.97 28.58 3d3n h ARG 264 CO -0.02 0.06 0.13 2.35 2.80 0.00 0.00 179.97 185.29 3d3n h TRP 265 N 0.10 0.21 -0.35 2.20 7.01 -0.38 0.12 115.95 124.87 3d3n h TRP 265 Ca 0.06 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.03 3d3n h TRP 265 Cb 0.04 -0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.07 3d3n h TRP 265 CO -0.11 0.00 -0.03 -0.07 -2.79 0.00 0.00 178.44 175.45 3d3n h LEU 266 N 0.27 0.53 0.02 0.65 3.38 -0.59 0.16 115.31 119.72 3d3n h LEU 266 Ca 0.28 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 3d3n h LEU 266 Cb 0.39 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3d3n h LEU 266 CO -0.35 0.61 -0.01 -0.61 0.09 0.00 0.00 178.44 178.18 3d3n h GLN 267 N 0.53 -0.02 -0.82 1.13 4.15 0.94 0.80 115.11 121.81 3d3n h GLN 267 Ca 0.11 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.49 3d3n h GLN 267 Cb 0.38 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.04 3d3n h GLN 267 CO 0.02 0.21 0.36 0.93 -1.93 0.00 0.00 178.83 178.42 3d3n h GLU 268 N -0.25 1.21 0.00 1.69 5.08 -0.60 -0.01 114.58 121.70 3d3n h GLU 268 Ca -0.00 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 3d3n h GLU 268 Cb 0.24 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3d3n h GLU 268 CO 0.00 0.95 0.00 1.04 -1.00 0.00 0.00 179.01 180.01 3d3n n GLN 269 N -4.29 0.21 -1.89 2.33 1.13 0.52 -4.80 117.38 110.60 3d3n n GLN 269 Ca 0.08 0.11 -0.18 0.00 -1.94 0.00 0.00 57.00 55.07 3d3n n GLN 269 Cb 0.16 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 28.97 3d3n n GLN 269 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3d3n n GLY 270 N -0.44 0.78 0.00 1.08 0.00 -0.02 -4.84 105.19 101.76 3d3n n GLY 270 Ca 0.06 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.00 3d3n n GLY 270 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d3n n LEU 271 N -2.24 0.61 -2.27 0.99 4.77 0.20 -4.33 117.00 114.72 3d3n n LEU 271 Ca -0.19 -0.37 -0.31 0.00 -0.03 0.00 0.00 56.01 55.11 3d3n n LEU 271 Cb 0.62 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.81 3d3n n LEU 271 CO 0.26 0.15 1.36 -0.11 -1.33 0.00 0.00 177.39 177.72 3d3n n LEU 272 N -1.60 7.31 0.00 2.23 7.94 -0.83 -4.81 117.00 127.24 3d3n n LEU 272 Ca 0.02 -4.12 0.14 0.00 -1.11 0.00 0.00 56.01 50.94 3d3n n LEU 272 Cb 0.32 -0.92 0.85 0.00 0.53 0.00 0.00 43.42 44.20 3d3n n LEU 272 CO 0.36 1.38 1.02 0.00 -1.11 0.00 0.00 177.39 179.04