#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f4n s LEU 4 N 0.00 3.98 0.48 0.64 2.96 -1.26 -4.98 118.68 120.50 3f4n s LEU 4 Ca 0.00 1.73 -0.15 0.00 -0.22 0.00 0.00 54.13 55.49 3f4n s LEU 4 Cb 0.00 -3.53 -0.08 0.00 0.50 0.00 0.00 46.19 43.08 3f4n s LEU 4 CO 0.00 -1.18 0.92 -0.76 -1.32 0.00 0.00 176.35 174.01 3f4n s LEU 5 N 4.95 3.70 -0.16 -0.68 1.43 -0.34 -4.93 118.68 122.64 3f4n s LEU 5 Ca 0.71 1.46 0.01 0.00 -1.03 0.00 0.00 54.13 55.27 3f4n s LEU 5 Cb -0.26 -4.37 0.02 0.00 0.03 0.00 0.00 46.19 41.60 3f4n s LEU 5 CO 0.28 -0.52 -0.17 -0.22 0.23 0.00 0.00 176.35 175.95 3f4n s LEU 6 N -3.96 1.87 -0.17 1.79 2.96 -1.26 -1.69 118.68 118.22 3f4n s LEU 6 Ca 0.57 -0.55 -0.04 0.00 -0.22 0.00 0.00 54.13 53.89 3f4n s LEU 6 Cb -0.10 -1.30 -0.03 0.00 0.50 0.00 0.00 46.19 45.27 3f4n s LEU 6 CO 0.30 -0.03 -0.03 -0.83 -1.32 0.00 0.00 176.35 174.45 3f4n s GLY 7 N 1.36 1.71 -0.15 7.98 0.00 -0.48 -0.54 107.32 117.20 3f4n s GLY 7 Ca 0.04 -0.87 -0.06 0.00 0.00 0.00 0.00 44.72 43.83 3f4n s GLY 7 CO -0.11 0.02 0.06 0.14 0.00 0.00 0.00 173.10 173.21 3f4n s VAL 8 N 0.55 4.76 -0.37 1.40 1.01 0.84 -1.84 120.40 126.74 3f4n s VAL 8 Ca -0.03 -0.06 -0.13 0.00 0.00 0.00 0.00 61.98 61.77 3f4n s VAL 8 Cb -0.14 -3.09 0.01 0.00 0.00 0.00 0.00 36.38 33.15 3f4n s VAL 8 CO 0.03 0.53 0.24 0.21 0.00 0.00 0.00 175.10 176.10 3f4n s ASN 9 N -0.18 5.93 -0.12 3.32 3.84 0.11 0.63 114.94 128.47 3f4n s ASN 9 Ca 0.07 -0.73 0.14 0.00 0.21 0.00 0.00 52.86 52.55 3f4n s ASN 9 Cb -0.12 -2.10 0.61 0.00 -0.55 0.00 0.00 41.25 39.09 3f4n s ASN 9 CO 0.01 -0.34 1.48 2.30 -2.79 0.00 0.00 177.10 177.77 3f4n n ILE 10 N 5.08 1.68 -0.32 -5.21 -5.35 -0.99 -4.20 119.36 110.05 3f4n n ILE 10 Ca -0.12 -1.00 0.13 0.00 -0.27 0.00 0.00 62.75 61.49 3f4n n ILE 10 Cb 0.48 -0.04 0.36 0.00 -1.74 0.00 0.00 39.64 38.70 3f4n n ILE 10 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 3f4n h ASP 11 N 3.34 0.70 0.32 7.28 3.32 -1.94 -1.84 116.42 127.59 3f4n h ASP 11 Ca 0.00 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3f4n h ASP 11 Cb 1.35 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.84 3f4n h ASP 11 CO 0.24 0.29 -0.06 1.41 -1.72 0.00 0.00 179.24 179.41 3f4n n HIS 12 N -4.65 0.00 -0.16 4.55 8.25 -1.26 -1.07 115.22 120.88 3f4n n HIS 12 Ca 0.21 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.61 3f4n n HIS 12 Cb 0.56 -0.16 0.11 0.00 1.12 0.00 0.00 29.99 31.62 3f4n n HIS 12 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3f4n h ILE 13 N 0.45 1.25 0.03 1.59 1.08 -1.68 -2.96 117.51 117.26 3f4n h ILE 13 Ca 0.00 -1.02 -0.23 0.00 -0.39 0.00 0.00 64.86 63.22 3f4n h ILE 13 Cb 0.28 0.77 -0.03 0.00 -3.07 0.00 0.00 36.82 34.78 3f4n h ILE 13 CO 0.00 0.37 -1.14 0.00 -0.69 0.00 0.00 178.15 176.69 3f4n h ALA 14 N 1.18 0.35 0.18 1.87 0.00 -1.20 -3.07 119.26 118.56 3f4n h ALA 14 Ca 0.17 -0.97 0.01 0.00 0.00 0.00 0.00 54.91 54.11 3f4n h ALA 14 Cb 0.45 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3f4n h ALA 14 CO 0.02 1.23 -0.47 1.15 0.00 0.00 0.00 179.25 181.18 3f4n h THR 15 N 0.02 0.00 -0.97 0.00 2.02 -1.53 0.61 112.91 113.06 3f4n h THR 15 Ca -0.07 0.00 0.28 0.00 0.77 0.00 0.00 66.41 67.39 3f4n h THR 15 Cb 1.84 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 68.11 3f4n h THR 15 CO 0.14 0.00 0.49 0.25 0.37 0.00 0.00 175.52 176.76 3f4n h LEU 16 N -0.73 0.42 0.13 2.58 5.85 -1.46 -2.70 115.31 119.40 3f4n h LEU 16 Ca -0.02 0.18 -0.18 0.00 0.84 0.00 0.00 57.88 58.71 3f4n h LEU 16 Cb 0.70 0.15 0.02 0.00 0.37 0.00 0.00 40.66 41.90 3f4n h LEU 16 CO -0.22 -0.09 -0.79 -0.09 -0.34 0.00 0.00 178.44 176.92 3f4n h ARG 17 N 0.35 0.27 0.00 1.25 2.43 -1.30 -3.29 114.38 114.09 3f4n h ARG 17 Ca 0.66 -0.46 -0.04 0.00 -0.81 0.00 0.00 59.98 59.34 3f4n h ARG 17 Cb 1.42 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 31.14 3f4n h ARG 17 CO -0.59 1.22 -0.18 -0.91 -1.51 0.00 0.00 179.97 178.00 3f4n h ASN 18 N -0.43 0.00 -1.19 -3.80 2.35 -0.60 -2.25 115.58 109.67 3f4n h ASN 18 Ca -0.14 0.00 0.40 0.00 -0.55 0.00 0.00 56.30 56.01 3f4n h ASN 18 Cb 1.59 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 39.82 3f4n h ASN 18 CO 0.13 0.18 0.73 0.00 -1.65 0.00 0.00 177.43 176.82 3f4n h ALA 19 N 1.82 2.45 -4.77 -0.83 0.00 -1.56 -3.41 119.26 112.97 3f4n h ALA 19 Ca -0.00 0.15 -0.44 0.00 0.00 0.00 0.00 54.91 54.62 3f4n h ALA 19 Cb 0.34 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.25 3f4n h ALA 19 CO 0.02 -1.09 -0.31 0.54 0.00 0.00 0.00 179.25 178.41 3f4n n ARG 20 N -4.85 1.15 0.00 0.00 5.12 -0.85 -5.03 116.66 112.20 3f4n n ARG 20 Ca 0.35 -2.46 0.10 0.00 -1.93 0.00 0.00 57.85 53.91 3f4n n ARG 20 Cb 1.28 0.62 0.57 0.00 -1.16 0.00 0.00 32.46 33.77 3f4n n ARG 20 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3f4n n GLY 21 N 0.90 -0.90 3.84 -0.13 0.00 -1.26 -4.93 105.19 102.71 3f4n n GLY 21 Ca -0.13 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 3f4n n GLY 21 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3f4n s THR 22 N -2.00 3.01 -0.38 2.61 -4.23 -1.25 -4.96 115.64 108.43 3f4n s THR 22 Ca 0.29 0.33 0.22 0.00 -1.18 0.00 0.00 61.69 61.35 3f4n s THR 22 Cb 0.13 -3.20 0.25 0.00 1.34 0.00 0.00 72.50 71.03 3f4n s THR 22 CO 0.22 -0.43 1.49 -0.29 -0.54 0.00 0.00 174.62 175.07 3f4n h ILE 23 N -0.96 0.06 -3.34 2.99 6.09 -1.94 -3.46 117.51 116.95 3f4n h ILE 23 Ca -0.46 -1.09 -0.65 0.00 -1.37 0.00 0.00 64.86 61.29 3f4n h ILE 23 Cb 1.28 1.94 -0.16 0.00 0.47 0.00 0.00 36.82 40.34 3f4n h ILE 23 CO 0.62 0.03 -0.75 -0.72 -3.07 0.00 0.00 178.15 174.26 3f4n s TYR 24 N -3.22 2.62 0.46 2.19 -0.85 -1.26 -4.10 117.35 113.19 3f4n s TYR 24 Ca 0.05 -0.22 -0.13 0.00 -0.52 0.00 0.00 57.07 56.25 3f4n s TYR 24 Cb 0.06 -1.33 -0.07 0.00 0.38 0.00 0.00 41.96 41.00 3f4n s TYR 24 CO 0.70 0.46 0.88 -1.25 -1.52 0.00 0.00 175.55 174.81 3f4n s PRO 25 N -2.48 3.86 -0.21 -3.49 0.04 -1.26 -4.52 135.00 126.93 3f4n s PRO 25 Ca 0.22 0.71 -0.07 0.00 0.04 0.00 0.00 61.00 61.90 3f4n s PRO 25 Cb -0.10 -2.26 -0.03 0.00 0.04 0.00 0.00 34.50 32.15 3f4n s PRO 25 CO 0.13 -0.15 0.04 0.34 0.04 0.00 0.00 177.00 177.40 3f4n s ASP 26 N -3.12 5.22 0.38 6.66 -1.08 -1.26 -4.67 116.67 118.79 3f4n s ASP 26 Ca 0.55 -0.10 0.08 0.00 -0.52 0.00 0.00 52.55 52.56 3f4n s ASP 26 Cb -0.10 -1.90 0.82 0.00 -1.46 0.00 0.00 42.92 40.28 3f4n s ASP 26 CO 0.31 0.08 1.96 -0.65 0.52 0.00 0.00 175.17 177.40 3f4n h PRO 27 N 7.40 0.64 -0.87 4.34 0.11 -1.91 -1.09 132.00 140.60 3f4n h PRO 27 Ca -0.36 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 65.80 3f4n h PRO 27 Cb 1.18 -0.14 -0.07 0.00 0.11 0.00 0.00 31.00 32.07 3f4n h PRO 27 CO 0.63 0.42 0.52 0.28 -0.21 0.00 0.00 178.00 179.64 3f4n h VAL 28 N 0.66 0.96 -0.79 3.15 2.07 -1.92 0.11 116.25 120.49 3f4n h VAL 28 Ca 0.30 -0.31 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 3f4n h VAL 28 Cb 0.33 -0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 3f4n h VAL 28 CO -0.10 0.16 0.31 -0.61 0.02 0.00 0.00 177.57 177.36 3f4n h GLN 29 N 0.90 1.18 -0.48 1.57 4.15 -1.62 -3.10 115.11 117.70 3f4n h GLN 29 Ca 0.41 -0.21 -0.07 0.00 0.77 0.00 0.00 58.65 59.54 3f4n h GLN 29 Cb 0.32 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.80 3f4n h GLN 29 CO -0.23 0.95 -0.01 0.00 -1.93 0.00 0.00 178.83 177.62 3f4n h ALA 30 N 1.17 1.09 -0.47 3.38 0.00 -0.59 -2.43 119.26 121.41 3f4n h ALA 30 Ca 0.26 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 3f4n h ALA 30 Cb 0.22 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3f4n h ALA 30 CO -0.02 0.58 -0.13 0.00 0.00 0.00 0.00 179.25 179.68 3f4n h ALA 31 N 1.25 0.88 -0.47 0.00 0.00 -1.26 0.30 119.26 119.96 3f4n h ALA 31 Ca 0.14 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3f4n h ALA 31 Cb 0.46 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3f4n h ALA 31 CO 0.02 0.64 0.23 0.74 0.00 0.00 0.00 179.25 180.87 3f4n h PHE 32 N 0.79 0.68 -0.23 0.00 0.05 -1.41 0.40 116.94 117.22 3f4n h PHE 32 Ca 0.12 -0.03 -0.18 0.00 3.82 0.00 0.00 57.97 61.70 3f4n h PHE 32 Cb 0.65 -0.21 0.00 0.00 2.00 0.00 0.00 35.95 38.39 3f4n h PHE 32 CO 0.04 0.55 -0.55 0.82 -0.18 0.00 0.00 178.31 178.99 3f4n h ILE 33 N 0.62 1.29 -0.18 -0.55 2.04 -1.08 -2.46 117.51 117.19 3f4n h ILE 33 Ca 0.16 -1.75 -0.05 0.00 1.00 0.00 0.00 64.86 64.22 3f4n h ILE 33 Cb 0.12 1.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.98 3f4n h ILE 33 CO -0.02 0.56 -0.08 0.00 0.00 0.00 0.00 178.15 178.61 3f4n h ALA 34 N 0.62 0.25 -0.54 1.87 0.00 -0.30 -2.27 119.26 118.89 3f4n h ALA 34 Ca -0.00 -0.27 0.13 0.00 0.00 0.00 0.00 54.91 54.76 3f4n h ALA 34 Cb 1.16 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 3f4n h ALA 34 CO 0.12 0.06 0.38 0.93 0.00 0.00 0.00 179.25 180.74 3f4n h GLU 35 N 0.06 0.16 0.00 0.00 5.08 -0.93 -1.53 114.58 117.42 3f4n h GLU 35 Ca 0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3f4n h GLU 35 Cb 0.55 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.76 3f4n h GLU 35 CO 0.02 0.11 -0.44 1.96 -1.00 0.00 0.00 179.01 179.66 3f4n h GLN 36 N 0.17 0.00 -0.20 2.33 4.20 -1.11 -3.30 115.11 117.20 3f4n h GLN 36 Ca 0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.97 3f4n h GLN 36 Cb 0.80 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.58 3f4n h GLN 36 CO -0.04 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.12 3f4n n ALA 37 N -1.96 2.43 0.00 3.87 0.00 -0.77 -4.93 120.51 119.15 3f4n n ALA 37 Ca 0.03 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.63 3f4n n ALA 37 Cb 0.48 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.14 3f4n n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f4n n GLY 38 N 1.34 0.49 3.75 0.00 0.00 -1.11 -3.34 105.19 106.31 3f4n n GLY 38 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3f4n n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f4n s ALA 39 N -1.47 3.45 -1.82 4.61 0.00 -0.65 -4.73 121.76 121.15 3f4n s ALA 39 Ca 0.00 1.00 0.25 0.00 0.00 0.00 0.00 51.96 53.20 3f4n s ALA 39 Cb 0.00 -3.41 0.38 0.00 0.00 0.00 0.00 23.12 20.10 3f4n s ALA 39 CO 0.00 -0.37 1.33 -0.25 0.00 0.00 0.00 175.76 176.47 3f4n n ASP 40 N 1.95 1.44 -3.56 0.00 8.00 0.30 -4.57 116.55 120.11 3f4n n ASP 40 Ca 0.03 -1.14 -0.06 0.00 0.71 0.00 0.00 54.79 54.32 3f4n n ASP 40 Cb 0.44 0.32 -0.02 0.00 -0.02 0.00 0.00 41.12 41.84 3f4n n ASP 40 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3f4n s GLY 41 N -2.53 -0.36 -0.14 0.44 0.00 -1.14 -4.25 107.32 99.34 3f4n s GLY 41 Ca 0.21 1.31 0.02 0.00 0.00 0.00 0.00 44.72 46.27 3f4n s GLY 41 CO 0.56 0.43 -0.22 -0.42 0.00 0.00 0.00 173.10 173.46 3f4n s ILE 42 N -2.71 2.12 -0.04 0.90 -1.09 -0.86 -0.11 121.20 119.40 3f4n s ILE 42 Ca 0.08 -0.96 0.01 0.00 -2.23 0.00 0.00 60.65 57.54 3f4n s ILE 42 Cb -0.01 -1.85 -0.03 0.00 -1.58 0.00 0.00 42.46 38.99 3f4n s ILE 42 CO -0.06 0.55 -0.03 -0.89 -1.23 0.00 0.00 174.94 173.28 3f4n s THR 43 N 0.75 4.00 -0.02 2.92 2.01 0.21 0.09 115.64 125.61 3f4n s THR 43 Ca -0.08 -0.50 0.00 0.00 0.31 0.00 0.00 61.69 61.42 3f4n s THR 43 Cb -0.16 -2.71 0.02 0.00 0.01 0.00 0.00 72.50 69.65 3f4n s THR 43 CO -0.00 0.50 -0.00 0.68 -0.69 0.00 0.00 174.62 175.10 3f4n s VAL 44 N -0.95 0.11 -0.46 3.82 -7.23 -0.33 -2.34 120.40 113.02 3f4n s VAL 44 Ca 0.16 0.05 -0.16 0.00 -1.81 0.00 0.00 61.98 60.21 3f4n s VAL 44 Cb -0.11 -0.16 0.05 0.00 0.56 0.00 0.00 36.38 36.72 3f4n s VAL 44 CO 0.05 0.09 0.40 -2.28 -0.31 0.00 0.00 175.10 173.05 3f4n s HIS 45 N 0.57 3.22 -0.68 2.82 2.46 -1.26 -0.35 115.29 122.07 3f4n s HIS 45 Ca -0.05 -0.77 -0.24 0.00 0.47 0.00 0.00 55.06 54.47 3f4n s HIS 45 Cb -0.08 -3.04 0.06 0.00 -0.13 0.00 0.00 32.58 29.39 3f4n s HIS 45 CO -0.01 -0.76 1.05 -1.17 -2.47 0.00 0.00 174.74 171.38 3f4n s LEU 46 N 1.78 4.04 0.40 8.88 2.96 -0.80 -4.24 118.68 131.69 3f4n s LEU 46 Ca 0.06 -0.83 -0.23 0.00 -0.22 0.00 0.00 54.13 52.91 3f4n s LEU 46 Cb -0.22 -2.47 -0.10 0.00 0.50 0.00 0.00 46.19 43.90 3f4n s LEU 46 CO 0.08 -1.55 0.98 -0.13 -1.32 0.00 0.00 176.35 174.41 3f4n s ARG 47 N 4.53 4.26 0.56 1.98 0.52 -1.26 -4.63 118.95 124.91 3f4n s ARG 47 Ca 0.26 1.29 0.32 0.00 -0.52 0.00 0.00 55.73 57.07 3f4n s ARG 47 Cb -0.14 -2.41 1.47 0.00 0.52 0.00 0.00 34.95 34.38 3f4n s ARG 47 CO 0.12 -0.02 1.84 1.49 0.02 0.00 0.00 175.30 178.75 3f4n h GLU 48 N 2.33 0.00 -0.03 3.54 4.81 -1.96 0.31 114.58 123.58 3f4n h GLU 48 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3f4n h GLU 48 Cb 1.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.58 3f4n h GLU 48 CO 0.62 0.00 -0.06 -0.40 -0.73 0.00 0.00 179.01 178.44 3f4n n ASP 49 N -4.02 2.64 -4.21 1.04 5.68 -1.26 -4.99 116.55 111.43 3f4n n ASP 49 Ca 0.17 -1.85 -0.32 0.00 -0.50 0.00 0.00 54.79 52.29 3f4n n ASP 49 Cb 0.97 0.05 -0.06 0.00 -1.14 0.00 0.00 41.12 40.95 3f4n n ASP 49 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3f4n n ARG 50 N 1.00 -2.13 0.11 0.11 5.12 0.11 -4.83 116.66 116.14 3f4n n ARG 50 Ca 0.14 0.26 -0.02 0.00 -1.93 0.00 0.00 57.85 56.30 3f4n n ARG 50 Cb 0.55 -4.36 0.19 0.00 -1.16 0.00 0.00 32.46 27.68 3f4n n ARG 50 CO 0.00 0.00 0.00 0.07 -1.93 0.00 0.00 177.63 175.77 3f4n h ARG 51 N -1.62 0.14 0.00 5.56 0.11 -1.94 -3.43 114.38 113.20 3f4n h ARG 51 Ca -0.63 -0.08 0.00 0.00 0.10 0.00 0.00 59.98 59.37 3f4n h ARG 51 Cb 1.39 0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.47 3f4n h ARG 51 CO 0.72 0.64 0.00 -2.39 0.10 0.00 0.00 179.97 179.04 3f4n n HIS 52 N -3.92 0.00 -1.88 4.08 1.44 -1.26 -4.72 115.22 108.97 3f4n n HIS 52 Ca -0.02 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.28 3f4n n HIS 52 Cb 0.56 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.64 3f4n n HIS 52 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3f4n s ILE 53 N 0.00 2.40 0.44 0.61 -1.09 -1.26 -4.71 121.20 117.59 3f4n s ILE 53 Ca 0.00 0.30 0.07 0.00 -2.23 0.00 0.00 60.65 58.80 3f4n s ILE 53 Cb 0.00 -3.19 -0.01 0.00 -1.58 0.00 0.00 42.46 37.67 3f4n s ILE 53 CO 0.00 0.03 0.38 0.42 -1.23 0.00 0.00 174.94 174.54 3f4n s THR 54 N 0.68 2.45 0.37 2.92 -4.23 -1.26 -4.47 115.64 112.09 3f4n s THR 54 Ca 0.67 -1.39 0.07 0.00 -1.18 0.00 0.00 61.69 59.87 3f4n s THR 54 Cb -0.45 -2.83 0.17 0.00 1.34 0.00 0.00 72.50 70.72 3f4n s THR 54 CO 0.37 0.00 1.91 0.44 -0.54 0.00 0.00 174.62 176.80 3f4n h ASP 55 N 0.99 0.36 0.25 3.99 3.32 -1.97 -1.33 116.42 122.03 3f4n h ASP 55 Ca -0.40 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3f4n h ASP 55 Cb 1.27 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.70 3f4n h ASP 55 CO 0.58 0.46 -0.28 -0.09 -1.72 0.00 0.00 179.24 178.18 3f4n h ARG 56 N 0.37 -0.56 -0.17 3.56 1.12 -1.98 0.16 114.38 116.88 3f4n h ARG 56 Ca 0.08 0.04 0.05 0.00 -1.11 0.00 0.00 59.98 59.04 3f4n h ARG 56 Cb 0.32 0.13 -0.05 0.00 -0.01 0.00 0.00 29.97 30.36 3f4n h ARG 56 CO 0.01 -0.37 -0.14 -0.44 -3.11 0.00 0.00 179.97 175.92 3f4n h ASP 57 N -0.58 -0.46 -0.52 -3.80 3.45 -1.77 -0.65 116.42 112.09 3f4n h ASP 57 Ca -0.00 0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.55 3f4n h ASP 57 Cb 0.55 0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 39.52 3f4n h ASP 57 CO -0.08 -0.19 0.34 0.58 -1.57 0.00 0.00 179.24 178.33 3f4n h VAL 58 N -0.16 1.13 -0.79 -1.35 2.07 -1.19 -0.72 116.25 115.25 3f4n h VAL 58 Ca 0.11 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 3f4n h VAL 58 Cb 0.32 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 3f4n h VAL 58 CO -0.27 0.13 0.39 -0.09 0.02 0.00 0.00 177.57 177.75 3f4n h ARG 59 N 0.70 1.13 0.01 1.57 2.43 0.50 -2.68 114.38 118.04 3f4n h ARG 59 Ca 0.19 -0.15 -0.16 0.00 -0.81 0.00 0.00 59.98 59.05 3f4n h ARG 59 Cb -0.08 -0.21 0.01 0.00 -0.42 0.00 0.00 29.97 29.27 3f4n h ARG 59 CO -0.04 0.86 -0.61 0.82 -1.51 0.00 0.00 179.97 179.49 3f4n h ILE 60 N 1.12 1.43 -0.77 1.20 2.04 -0.85 -3.32 117.51 118.37 3f4n h ILE 60 Ca 0.27 -2.11 0.10 0.00 1.00 0.00 0.00 64.86 64.12 3f4n h ILE 60 Cb 0.09 2.63 -0.05 0.00 -0.74 0.00 0.00 36.82 38.76 3f4n h ILE 60 CO -0.04 0.61 0.50 -0.07 0.00 0.00 0.00 178.15 179.16 3f4n h LEU 61 N -0.12 0.62 -2.21 1.44 3.38 -1.08 0.33 115.31 117.66 3f4n h LEU 61 Ca -0.08 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 3f4n h LEU 61 Cb 1.33 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.97 3f4n h LEU 61 CO 0.12 0.37 -0.01 -0.09 0.09 0.00 0.00 178.44 178.92 3f4n h ARG 62 N 0.69 0.00 0.00 1.13 9.65 -1.57 0.29 114.38 124.57 3f4n h ARG 62 Ca 0.35 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.23 3f4n h ARG 62 Cb 0.46 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.04 3f4n h ARG 62 CO -0.13 0.01 -1.08 1.04 2.80 0.00 0.00 179.97 182.61 3f4n n GLN 63 N -3.13 0.16 0.00 0.20 6.02 0.11 -4.65 117.38 116.09 3f4n n GLN 63 Ca -0.01 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 3f4n n GLN 63 Cb 0.19 -1.52 0.00 0.00 1.02 0.00 0.00 30.24 29.93 3f4n n GLN 63 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3f4n n THR 64 N -1.71 0.00 -1.78 5.09 -2.24 -0.49 -5.02 114.28 108.12 3f4n n THR 64 Ca 0.03 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.39 3f4n n THR 64 Cb 0.39 0.19 -0.01 0.00 -2.10 0.00 0.00 70.33 68.80 3f4n n THR 64 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3f4n s ILE 65 N -1.74 2.07 -0.52 2.28 1.01 -0.03 -4.91 121.20 119.36 3f4n s ILE 65 Ca 0.00 0.06 0.11 0.00 0.00 0.00 0.00 60.65 60.82 3f4n s ILE 65 Cb 0.00 -3.04 -0.12 0.00 0.01 0.00 0.00 42.46 39.32 3f4n s ILE 65 CO 0.00 0.01 0.46 0.00 0.00 0.00 0.00 174.94 175.41 3f4n n GLN 66 N 1.85 3.40 0.00 2.79 6.02 -1.26 -4.86 117.38 125.32 3f4n n GLN 66 Ca 0.07 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 3f4n n GLN 66 Cb 0.38 -1.01 0.00 0.00 1.02 0.00 0.00 30.24 30.62 3f4n n GLN 66 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3f4n n THR 67 N -1.25 0.00 -3.71 5.09 -2.24 -1.26 -5.10 114.28 105.81 3f4n n THR 67 Ca 0.02 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.66 3f4n n THR 67 Cb 0.17 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.31 3f4n n THR 67 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f4n s ARG 68 N 1.24 0.59 0.07 -0.78 3.03 -1.26 -5.04 118.95 116.79 3f4n s ARG 68 Ca 0.00 0.46 -0.27 0.00 2.03 0.00 0.00 55.73 57.95 3f4n s ARG 68 Cb 0.00 0.28 -0.06 0.00 -1.03 0.00 0.00 34.95 34.14 3f4n s ARG 68 CO 0.00 -0.10 0.83 1.41 -1.13 0.00 0.00 175.30 176.31 3f4n s MET 69 N -0.13 4.56 -0.35 3.89 -2.45 -1.26 -2.04 119.30 121.53 3f4n s MET 69 Ca -0.03 1.19 -0.01 0.00 -1.25 0.00 0.00 55.69 55.60 3f4n s MET 69 Cb -0.03 -3.37 0.09 0.00 1.25 0.00 0.00 34.83 32.77 3f4n s MET 69 CO 0.02 0.26 0.08 1.21 1.05 0.00 0.00 175.02 177.64 3f4n s ASN 70 N -0.05 4.97 -0.33 1.11 2.47 0.11 -2.28 114.94 120.94 3f4n s ASN 70 Ca 0.41 -1.78 -0.24 0.00 0.42 0.00 0.00 52.86 51.68 3f4n s ASN 70 Cb -0.21 -1.73 0.01 0.00 -1.45 0.00 0.00 41.25 37.87 3f4n s ASN 70 CO 0.25 -0.39 0.82 -0.22 -3.72 0.00 0.00 177.10 173.84 3f4n s LEU 71 N 1.12 4.08 -0.12 3.21 2.96 0.16 -1.19 118.68 128.90 3f4n s LEU 71 Ca 0.03 0.58 -0.17 0.00 -0.22 0.00 0.00 54.13 54.35 3f4n s LEU 71 Cb -0.21 -3.12 -0.04 0.00 0.50 0.00 0.00 46.19 43.32 3f4n s LEU 71 CO -0.04 -0.70 0.44 -1.61 -1.32 0.00 0.00 176.35 173.11 3f4n s GLU 72 N 3.12 4.30 0.16 1.98 2.02 0.52 0.14 118.70 130.93 3f4n s GLU 72 Ca 0.34 0.38 -0.21 0.00 0.02 0.00 0.00 54.97 55.49 3f4n s GLU 72 Cb -0.13 -3.42 0.06 0.00 0.10 0.00 0.00 34.13 30.74 3f4n s GLU 72 CO 0.15 0.21 0.56 0.00 0.02 0.00 0.00 175.26 176.20 3f4n s MET 73 N 0.48 1.27 0.64 1.61 0.23 -0.84 -1.91 119.30 120.77 3f4n s MET 73 Ca 0.24 -0.55 -0.11 0.00 -1.03 0.00 0.00 55.69 54.24 3f4n s MET 73 Cb -0.15 0.57 -0.03 0.00 -1.53 0.00 0.00 34.83 33.69 3f4n s MET 73 CO 0.09 -0.55 1.04 0.00 -2.03 0.00 0.00 175.02 173.58 3f4n s ALA 74 N -3.77 3.02 -0.97 3.16 0.00 -1.26 -1.53 121.76 120.42 3f4n s ALA 74 Ca 0.02 -0.09 -0.16 0.00 0.00 0.00 0.00 51.96 51.73 3f4n s ALA 74 Cb -0.01 -3.09 0.17 0.00 0.00 0.00 0.00 23.12 20.19 3f4n s ALA 74 CO -0.12 -0.80 1.10 0.08 0.00 0.00 0.00 175.76 176.02 3f4n s VAL 75 N -3.18 5.06 0.14 0.00 1.01 -1.26 -4.66 120.40 117.51 3f4n s VAL 75 Ca 0.56 -2.08 -0.01 0.00 0.00 0.00 0.00 61.98 60.45 3f4n s VAL 75 Cb -0.11 -4.72 -0.04 0.00 0.00 0.00 0.00 36.38 31.50 3f4n s VAL 75 CO 0.54 -1.40 0.07 0.42 0.00 0.00 0.00 175.10 174.73 3f4n s THR 76 N 1.69 0.09 0.07 3.92 -4.23 -1.26 -5.04 115.64 110.87 3f4n s THR 76 Ca 0.31 -1.90 -0.33 0.00 -1.18 0.00 0.00 61.69 58.59 3f4n s THR 76 Cb -0.06 -2.08 -0.19 0.00 1.34 0.00 0.00 72.50 71.51 3f4n s THR 76 CO -0.08 -0.41 1.62 0.44 -0.54 0.00 0.00 174.62 175.65 3f4n h ASP 77 N 2.83 -0.84 -0.39 3.99 5.19 -1.99 -0.03 116.42 125.18 3f4n h ASP 77 Ca -0.35 0.03 0.04 0.00 -0.62 0.00 0.00 57.03 56.13 3f4n h ASP 77 Cb 1.21 0.22 -0.05 0.00 0.18 0.00 0.00 39.33 40.89 3f4n h ASP 77 CO 0.58 -0.58 -0.23 1.21 -3.12 0.00 0.00 179.24 177.10 3f4n n GLU 78 N -5.51 -0.17 -0.18 3.56 2.13 -1.26 -0.87 120.64 118.34 3f4n n GLU 78 Ca -0.14 1.10 -0.08 0.00 0.66 0.00 0.00 57.16 58.70 3f4n n GLU 78 Cb 0.39 -1.63 0.01 0.00 0.27 0.00 0.00 31.44 30.48 3f4n n GLU 78 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 3f4n h MET 79 N 0.00 0.79 -0.71 5.31 2.86 -1.79 0.68 114.93 122.06 3f4n h MET 79 Ca 0.06 -0.15 0.12 0.00 -2.06 0.00 0.00 59.70 57.67 3f4n h MET 79 Cb 0.16 -0.12 -0.08 0.00 0.06 0.00 0.00 31.60 31.61 3f4n h MET 79 CO -0.37 0.70 0.30 0.28 1.06 0.00 0.00 176.91 178.88 3f4n h VAL 80 N 0.71 0.73 -0.64 -2.22 2.07 -0.77 -0.08 116.25 116.04 3f4n h VAL 80 Ca 0.17 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 3f4n h VAL 80 Cb 0.22 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 3f4n h VAL 80 CO -0.01 0.09 0.25 0.44 0.02 0.00 0.00 177.57 178.36 3f4n h ASP 81 N 0.48 0.88 -0.45 0.57 5.19 0.10 0.15 116.42 123.34 3f4n h ASP 81 Ca 0.37 -0.17 0.06 0.00 -0.62 0.00 0.00 57.03 56.67 3f4n h ASP 81 Cb 0.50 -0.23 -0.05 0.00 0.18 0.00 0.00 39.33 39.73 3f4n h ASP 81 CO -0.35 0.81 0.15 0.40 -3.12 0.00 0.00 179.24 177.13 3f4n h ILE 82 N 0.89 0.84 0.00 0.35 1.08 -0.38 -2.81 117.51 117.48 3f4n h ILE 82 Ca 0.21 -0.11 -0.19 0.00 -0.39 0.00 0.00 64.86 64.39 3f4n h ILE 82 Cb 0.21 0.50 -0.02 0.00 -3.07 0.00 0.00 36.82 34.44 3f4n h ILE 82 CO -0.02 0.06 -0.85 0.00 -0.69 0.00 0.00 178.15 176.65 3f4n h ALA 83 N 1.31 0.58 0.00 1.87 0.00 -0.41 0.14 119.26 122.75 3f4n h ALA 83 Ca 0.21 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3f4n h ALA 83 Cb 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3f4n h ALA 83 CO -0.23 0.96 0.00 0.00 0.00 0.00 0.00 179.25 179.98 3f4n n ASP 85 N -2.99 1.73 0.08 0.00 9.92 -0.66 -4.27 116.55 120.35 3f4n n ASP 85 Ca -0.01 -0.23 -0.04 0.00 -0.53 0.00 0.00 54.79 53.99 3f4n n ASP 85 Cb 0.20 1.39 -0.07 0.00 -0.64 0.00 0.00 41.12 42.00 3f4n n ASP 85 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 3f4n h ILE 86 N 0.00 1.30 -6.70 0.53 2.04 -0.74 -3.49 117.51 110.44 3f4n h ILE 86 Ca 0.00 -2.89 -0.52 0.00 1.00 0.00 0.00 64.86 62.45 3f4n h ILE 86 Cb 0.48 2.63 0.01 0.00 -0.74 0.00 0.00 36.82 39.19 3f4n h ILE 86 CO 0.00 0.74 -0.99 0.29 0.00 0.00 0.00 178.15 178.19 3f4n n LYS 87 N -3.25 -0.80 -1.26 2.37 5.02 0.75 -4.94 118.16 116.05 3f4n n LYS 87 Ca -0.01 0.38 -0.30 0.00 -2.02 0.00 0.00 58.31 56.35 3f4n n LYS 87 Cb 0.88 -2.86 0.11 0.00 -0.02 0.00 0.00 35.03 33.14 3f4n n LYS 87 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3f4n s PRO 88 N -6.34 1.83 0.18 1.97 0.04 -1.26 -4.94 135.00 126.48 3f4n s PRO 88 Ca 0.34 0.99 -0.09 0.00 0.04 0.00 0.00 61.00 62.28 3f4n s PRO 88 Cb -0.17 -1.86 0.07 0.00 0.04 0.00 0.00 34.50 32.58 3f4n s PRO 88 CO 0.92 -1.89 1.64 0.45 0.04 0.00 0.00 177.00 178.17 3f4n h HIS 89 N -1.30 1.18 -4.19 0.56 3.86 -1.91 -3.43 115.15 109.91 3f4n h HIS 89 Ca -0.46 -0.21 -0.56 0.00 -1.16 0.00 0.00 60.37 57.99 3f4n h HIS 89 Cb 1.26 -0.31 -0.26 0.00 1.06 0.00 0.00 27.41 29.15 3f4n h HIS 89 CO 0.51 1.03 -0.83 -0.06 0.86 0.00 0.00 177.93 179.44 3f4n s PHE 90 N -5.02 1.69 -0.03 2.45 0.40 -0.97 -1.85 117.98 114.66 3f4n s PHE 90 Ca -0.12 -0.36 0.07 0.00 -0.60 0.00 0.00 56.93 55.92 3f4n s PHE 90 Cb 0.14 -1.02 -0.02 0.00 0.51 0.00 0.00 43.02 42.63 3f4n s PHE 90 CO 0.86 0.06 -0.23 0.00 0.70 0.00 0.00 175.22 176.61 3f4n s LEU 93 N 1.24 4.15 0.10 0.00 1.43 0.15 -1.99 118.68 123.76 3f4n s LEU 93 Ca 0.03 0.83 0.03 0.00 -1.03 0.00 0.00 54.13 53.99 3f4n s LEU 93 Cb -0.14 -2.88 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 3f4n s LEU 93 CO -0.08 -0.26 -0.09 0.68 0.23 0.00 0.00 176.35 176.83 3f4n s VAL 94 N 1.85 0.92 0.11 -1.59 -7.23 -0.58 -2.06 120.40 111.82 3f4n s VAL 94 Ca 0.28 -1.73 -0.09 0.00 -1.81 0.00 0.00 61.98 58.64 3f4n s VAL 94 Cb -0.16 -1.46 -0.06 0.00 0.56 0.00 0.00 36.38 35.26 3f4n s VAL 94 CO 0.10 -0.63 0.41 -2.16 -0.31 0.00 0.00 175.10 172.51 3f4n s PRO 95 N -3.07 3.73 0.00 4.82 0.04 -1.26 -4.03 135.00 135.23 3f4n s PRO 95 Ca 0.08 0.12 0.00 0.00 0.04 0.00 0.00 61.00 61.24 3f4n s PRO 95 Cb -0.01 -2.93 0.00 0.00 0.04 0.00 0.00 34.50 31.60 3f4n s PRO 95 CO -0.01 0.52 0.00 0.39 0.04 0.00 0.00 177.00 177.94 3f4n n GLU 96 N 0.63 2.61 -4.09 4.56 1.02 -1.26 -5.00 120.64 119.11 3f4n n GLU 96 Ca -0.06 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.76 3f4n n GLU 96 Cb 0.52 -0.89 -0.07 0.00 -0.02 0.00 0.00 31.44 30.98 3f4n n GLU 96 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3f4n s LYS 97 N -1.72 2.95 0.54 3.49 1.02 -1.26 -5.03 119.74 119.74 3f4n s LYS 97 Ca 0.00 -0.59 0.28 0.00 0.02 0.00 0.00 55.97 55.68 3f4n s LYS 97 Cb 0.00 -2.78 1.45 0.00 -0.52 0.00 0.00 37.83 35.98 3f4n s LYS 97 CO 0.00 0.61 1.94 0.00 -0.92 0.00 0.00 175.35 176.98 3f4n h ARG 98 N 3.73 0.00 -0.16 1.68 3.08 -1.97 -0.87 114.38 119.88 3f4n h ARG 98 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 3f4n h ARG 98 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.22 3f4n h ARG 98 CO 0.64 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.54 3f4n n GLN 99 N -4.24 1.39 0.00 0.04 0.00 -1.26 -3.14 117.38 110.17 3f4n n GLN 99 Ca 0.13 -0.60 0.06 0.00 0.00 0.00 0.00 57.00 56.59 3f4n n GLN 99 Cb 0.76 -1.17 -0.06 0.00 0.00 0.00 0.00 30.24 29.77 3f4n n GLN 99 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 3f4n n GLU 100 N -0.04 2.61 -3.99 2.61 1.02 -0.33 -4.99 120.64 117.53 3f4n n GLU 100 Ca 0.07 -0.15 -0.22 0.00 -0.02 0.00 0.00 57.16 56.84 3f4n n GLU 100 Cb 0.15 -1.12 -0.03 0.00 -0.02 0.00 0.00 31.44 30.43 3f4n n GLU 100 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3f4n s VAL 101 N -2.09 5.16 0.40 2.62 1.01 -1.19 -0.62 120.40 125.69 3f4n s VAL 101 Ca 0.06 -0.99 0.08 0.00 0.00 0.00 0.00 61.98 61.13 3f4n s VAL 101 Cb 0.10 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.71 3f4n s VAL 101 CO 0.48 -0.28 0.53 0.42 0.00 0.00 0.00 175.10 176.25 3f4n s THR 102 N -1.95 3.23 0.32 3.92 -4.23 -0.67 -4.60 115.64 111.67 3f4n s THR 102 Ca 0.34 -1.02 0.10 0.00 -1.18 0.00 0.00 61.69 59.93 3f4n s THR 102 Cb -0.09 -3.10 0.32 0.00 1.34 0.00 0.00 72.50 70.97 3f4n s THR 102 CO 0.28 -0.04 1.72 0.00 -0.54 0.00 0.00 174.62 176.04 3f4n h THR 103 N 0.73 0.50 0.00 3.99 1.03 -1.98 -1.23 112.91 115.95 3f4n h THR 103 Ca -0.41 -0.19 0.00 0.00 -0.01 0.00 0.00 66.41 65.80 3f4n h THR 103 Cb 1.27 -0.09 0.00 0.00 -1.07 0.00 0.00 68.15 68.26 3f4n h THR 103 CO 0.48 0.10 -0.60 -0.08 -0.01 0.00 0.00 175.52 175.40 3f4n h GLU 104 N 0.54 0.00 0.00 0.00 4.81 -2.03 -3.48 114.58 114.43 3f4n h GLU 104 Ca 0.66 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.89 3f4n h GLU 104 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 3f4n h GLU 104 CO -0.49 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.20 3f4n n GLY 105 N 1.32 0.65 3.72 1.92 0.00 -0.46 -4.90 105.19 107.43 3f4n n GLY 105 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 3f4n n GLY 105 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3f4n s GLY 106 N -1.20 1.57 0.25 -0.02 0.00 -1.26 -4.73 107.32 101.92 3f4n s GLY 106 Ca 0.00 -0.46 -0.30 0.00 0.00 0.00 0.00 44.72 43.96 3f4n s GLY 106 CO 0.00 0.14 1.50 -2.27 0.00 0.00 0.00 173.10 172.47 3f4n s LEU 107 N -6.29 4.37 -1.25 0.66 2.96 0.12 -1.67 118.68 117.59 3f4n s LEU 107 Ca 0.65 2.74 -0.12 0.00 -0.22 0.00 0.00 54.13 57.18 3f4n s LEU 107 Cb -0.17 -3.62 0.16 0.00 0.50 0.00 0.00 46.19 43.06 3f4n s LEU 107 CO 0.56 -0.78 1.63 -0.67 -1.32 0.00 0.00 176.35 175.77 3f4n n ASP 108 N 2.49 5.14 0.07 3.68 4.64 0.21 -4.67 116.55 128.11 3f4n n ASP 108 Ca 0.08 -3.02 -0.03 0.00 -1.38 0.00 0.00 54.79 50.44 3f4n n ASP 108 Cb 0.39 -1.54 0.22 0.00 -1.04 0.00 0.00 41.12 39.14 3f4n n ASP 108 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 3f4n h VAL 109 N 4.33 1.29 0.00 5.18 2.07 -1.91 -3.01 116.25 124.19 3f4n h VAL 109 Ca 0.36 -1.42 -0.10 0.00 0.82 0.00 0.00 66.70 66.36 3f4n h VAL 109 Cb 0.78 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 3f4n h VAL 109 CO 1.41 0.43 -0.46 0.00 0.02 0.00 0.00 177.57 178.97 3f4n h ALA 110 N 1.35 0.79 0.00 1.67 0.00 -1.86 -2.61 119.26 118.59 3f4n h ALA 110 Ca 0.03 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3f4n h ALA 110 Cb 0.77 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3f4n h ALA 110 CO 0.06 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.29 3f4n n GLY 111 N 0.81 -1.22 2.65 0.00 0.00 -1.14 -4.15 105.19 102.14 3f4n n GLY 111 Ca 0.01 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 3f4n n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3f4n n GLN 112 N -1.95 1.12 -0.07 1.61 6.02 -1.00 -5.03 117.38 118.07 3f4n n GLN 112 Ca 0.03 -2.24 -0.12 0.00 -0.01 0.00 0.00 57.00 54.66 3f4n n GLN 112 Cb 0.23 -0.68 -0.05 0.00 1.02 0.00 0.00 30.24 30.75 3f4n n GLN 112 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3f4n h VAL 113 N 2.34 1.28 -0.32 5.09 2.07 -1.68 -1.67 116.25 123.36 3f4n h VAL 113 Ca -0.16 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.34 3f4n h VAL 113 Cb 1.19 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 3f4n h VAL 113 CO 0.14 0.30 0.04 0.44 0.02 0.00 0.00 177.57 178.51 3f4n h ASP 114 N 0.09 0.52 -0.31 0.57 3.32 -1.95 0.59 116.42 119.25 3f4n h ASP 114 Ca 0.05 -0.27 0.05 0.00 0.02 0.00 0.00 57.03 56.88 3f4n h ASP 114 Cb 0.46 -0.14 -0.08 0.00 0.22 0.00 0.00 39.33 39.80 3f4n h ASP 114 CO 0.02 0.66 -0.50 0.50 -1.72 0.00 0.00 179.24 178.20 3f4n h LYS 115 N 0.36 -0.41 -0.87 3.56 3.64 -1.95 0.62 116.57 121.52 3f4n h LYS 115 Ca 0.10 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.55 3f4n h LYS 115 Cb 0.37 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.23 3f4n h LYS 115 CO 0.01 -0.28 0.57 0.52 -2.27 0.00 0.00 179.45 178.00 3f4n h MET 116 N -0.43 1.00 -0.54 1.90 2.86 -1.14 -2.46 114.93 116.12 3f4n h MET 116 Ca 0.09 -0.06 0.06 0.00 -2.06 0.00 0.00 59.70 57.73 3f4n h MET 116 Cb 0.62 -0.23 -0.06 0.00 0.06 0.00 0.00 31.60 32.00 3f4n h MET 116 CO -0.53 0.66 0.24 1.15 1.06 0.00 0.00 176.91 179.49 3f4n h THR 117 N 1.03 0.88 -0.53 2.22 2.02 0.96 -1.02 112.91 118.48 3f4n h THR 117 Ca 0.36 -0.16 -0.08 0.00 0.77 0.00 0.00 66.41 67.30 3f4n h THR 117 Cb 0.11 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 3f4n h THR 117 CO -0.12 0.08 0.00 -0.07 0.37 0.00 0.00 175.52 175.78 3f4n h LEU 118 N 0.46 0.91 -0.27 2.58 3.38 -0.63 -0.68 115.31 121.06 3f4n h LEU 118 Ca 0.26 -0.31 -0.20 0.00 0.09 0.00 0.00 57.88 57.72 3f4n h LEU 118 Cb 0.23 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3f4n h LEU 118 CO -0.22 1.00 -0.61 0.00 0.09 0.00 0.00 178.44 178.70 3f4n h ALA 119 N 0.95 0.44 -0.35 1.53 0.00 -1.15 -1.47 119.26 119.21 3f4n h ALA 119 Ca 0.15 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 3f4n h ALA 119 Cb 0.53 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3f4n h ALA 119 CO 0.03 0.68 0.14 0.28 0.00 0.00 0.00 179.25 180.38 3f4n h VAL 120 N 0.63 1.18 -0.52 0.00 2.07 -1.14 -0.37 116.25 118.10 3f4n h VAL 120 Ca -0.00 -0.56 0.08 0.00 0.82 0.00 0.00 66.70 67.04 3f4n h VAL 120 Cb 1.22 0.91 -0.07 0.00 -1.52 0.00 0.00 31.29 31.83 3f4n h VAL 120 CO 0.13 0.20 0.15 1.23 0.02 0.00 0.00 177.57 179.30 3f4n h GLY 121 N 0.41 0.67 0.91 2.17 0.00 -1.08 0.49 103.07 106.64 3f4n h GLY 121 Ca 0.12 -0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.38 3f4n h GLY 121 CO -0.01 -0.04 0.05 -0.09 0.00 0.00 0.00 176.54 176.46 3f4n h ARG 122 N 0.31 0.16 -0.36 4.80 2.43 -0.80 -1.27 114.38 119.64 3f4n h ARG 122 Ca 0.26 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.32 3f4n h ARG 122 Cb 0.32 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 3f4n h ARG 122 CO -0.30 0.22 -0.15 -0.07 -1.51 0.00 0.00 179.97 178.17 3f4n h LEU 123 N 0.06 0.65 -0.37 3.80 3.38 -0.70 -3.03 115.31 119.09 3f4n h LEU 123 Ca 0.04 -0.19 -0.18 0.00 0.09 0.00 0.00 57.88 57.63 3f4n h LEU 123 Cb 0.11 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3f4n h LEU 123 CO -0.01 0.81 -0.58 0.00 0.09 0.00 0.00 178.44 178.76 3f4n h ALA 124 N 1.25 0.54 -0.57 1.53 0.00 -0.63 -1.50 119.26 119.88 3f4n h ALA 124 Ca 0.10 -0.53 0.12 0.00 0.00 0.00 0.00 54.91 54.60 3f4n h ALA 124 Cb 0.59 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 3f4n h ALA 124 CO 0.04 0.69 0.39 -0.44 0.00 0.00 0.00 179.25 179.93 3f4n h ASP 125 N 0.55 0.23 0.08 0.00 3.32 -1.11 0.31 116.42 119.80 3f4n h ASP 125 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3f4n h ASP 125 Cb 1.16 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.67 3f4n h ASP 125 CO 0.12 0.13 -0.03 0.52 -1.72 0.00 0.00 179.24 178.26 3f4n n VAL 126 N -4.45 0.00 -0.39 -1.35 0.31 -1.12 -4.92 118.33 106.42 3f4n n VAL 126 Ca 0.10 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 3f4n n VAL 126 Cb 0.46 -0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.38 3f4n n VAL 126 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3f4n n GLY 127 N 1.14 0.79 3.83 2.92 0.00 0.11 -5.02 105.19 108.96 3f4n n GLY 127 Ca 0.20 -0.11 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 3f4n n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f4n s ILE 128 N -2.00 4.72 -0.20 -0.61 1.01 -0.58 -4.95 121.20 118.60 3f4n s ILE 128 Ca 0.00 1.04 -0.17 0.00 0.00 0.00 0.00 60.65 61.52 3f4n s ILE 128 Cb 0.00 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 3f4n s ILE 128 CO 0.00 0.23 0.44 -0.76 0.00 0.00 0.00 174.94 174.85 3f4n s LEU 129 N -1.96 4.16 -0.13 2.97 1.43 -0.77 -3.94 118.68 120.44 3f4n s LEU 129 Ca 0.40 0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 54.04 3f4n s LEU 129 Cb -0.16 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 3f4n s LEU 129 CO 0.20 -0.11 0.01 -0.69 0.23 0.00 0.00 176.35 175.99 3f4n s VAL 130 N 1.39 4.38 0.07 -1.59 1.01 -1.26 -1.75 120.40 122.65 3f4n s VAL 130 Ca 0.21 -0.20 0.09 0.00 0.00 0.00 0.00 61.98 62.08 3f4n s VAL 130 Cb -0.15 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 3f4n s VAL 130 CO 0.09 0.54 -0.25 -0.55 0.00 0.00 0.00 175.10 174.93 3f4n s SER 131 N -0.25 3.34 -0.14 3.32 0.15 -0.23 -1.59 113.70 118.30 3f4n s SER 131 Ca 0.06 -0.60 -0.01 0.00 0.70 0.00 0.00 55.95 56.10 3f4n s SER 131 Cb -0.12 -0.33 -0.02 0.00 -1.71 0.00 0.00 66.02 63.84 3f4n s SER 131 CO 0.02 0.23 -0.11 -0.76 1.20 0.00 0.00 173.24 173.82 3f4n s LEU 132 N -1.53 2.81 -0.56 3.45 1.43 -0.97 -0.67 118.68 122.63 3f4n s LEU 132 Ca 0.13 -0.30 -0.24 0.00 -1.03 0.00 0.00 54.13 52.69 3f4n s LEU 132 Cb -0.10 -1.64 0.04 0.00 0.03 0.00 0.00 46.19 44.52 3f4n s LEU 132 CO 0.04 0.16 0.94 0.12 0.23 0.00 0.00 176.35 177.84 3f4n s PHE 133 N 0.40 2.78 0.19 0.29 5.99 -0.87 -1.02 117.98 125.73 3f4n s PHE 133 Ca -0.09 -0.08 0.06 0.00 0.00 0.00 0.00 56.93 56.82 3f4n s PHE 133 Cb -0.16 -4.10 -0.05 0.00 0.00 0.00 0.00 43.02 38.72 3f4n s PHE 133 CO 0.05 -1.39 -0.12 0.96 -0.00 0.00 0.00 175.22 174.72 3f4n s ILE 134 N 3.97 1.52 0.84 3.12 -4.36 -0.03 0.12 121.20 126.37 3f4n s ILE 134 Ca 0.29 -2.15 -0.11 0.00 -0.26 0.00 0.00 60.65 58.42 3f4n s ILE 134 Cb -0.13 -2.02 0.10 0.00 1.25 0.00 0.00 42.46 41.66 3f4n s ILE 134 CO 0.18 -0.62 1.09 -1.81 0.24 0.00 0.00 174.94 174.03 3f4n s ASP 135 N -3.28 3.93 -0.96 4.36 -0.00 -1.26 -0.39 116.67 119.07 3f4n s ASP 135 Ca 0.21 1.71 -0.21 0.00 -0.00 0.00 0.00 52.55 54.26 3f4n s ASP 135 Cb 0.01 -2.38 -0.11 0.00 -0.00 0.00 0.00 42.92 40.44 3f4n s ASP 135 CO 0.05 -2.38 1.95 0.00 -0.00 0.00 0.00 175.17 174.79 3f4n n ALA 136 N -3.74 3.30 -3.70 5.23 0.00 -1.26 -4.73 120.51 115.61 3f4n n ALA 136 Ca 0.08 -3.35 -0.19 0.00 0.00 0.00 0.00 53.44 49.97 3f4n n ALA 136 Cb 0.54 -3.59 -0.17 0.00 0.00 0.00 0.00 19.45 16.22 3f4n n ALA 136 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3f4n s ASP 137 N 5.03 0.98 0.30 0.00 -1.08 -1.26 -4.84 116.67 115.80 3f4n s ASP 137 Ca 0.58 0.04 -0.01 0.00 -0.52 0.00 0.00 52.55 52.64 3f4n s ASP 137 Cb 0.11 -0.18 0.46 0.00 -1.46 0.00 0.00 42.92 41.85 3f4n s ASP 137 CO 0.10 -0.21 1.93 -0.26 0.52 0.00 0.00 175.17 177.24 3f4n h PHE 138 N 8.15 0.95 -0.54 -5.34 -1.00 -1.97 -1.43 116.94 115.76 3f4n h PHE 138 Ca -0.21 -0.01 -0.08 0.00 2.81 0.00 0.00 57.97 60.48 3f4n h PHE 138 Cb 1.12 -0.31 -0.02 0.00 3.61 0.00 0.00 35.95 40.35 3f4n h PHE 138 CO 0.49 0.66 0.02 -0.09 -1.61 0.00 0.00 178.31 177.77 3f4n h ARG 139 N 0.98 0.90 -0.18 1.51 2.43 -1.97 -2.20 114.38 115.86 3f4n h ARG 139 Ca 0.25 -0.25 -0.16 0.00 -0.81 0.00 0.00 59.98 59.01 3f4n h ARG 139 Cb 0.02 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 3f4n h ARG 139 CO -0.04 0.89 -0.54 1.96 -1.51 0.00 0.00 179.97 180.72 3f4n h GLN 140 N 0.84 0.53 -0.04 0.20 1.08 -1.69 -2.45 115.11 113.58 3f4n h GLN 140 Ca 0.16 -0.33 0.01 0.00 -1.45 0.00 0.00 58.65 57.04 3f4n h GLN 140 Cb 0.47 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 3f4n h GLN 140 CO 0.02 0.93 -0.00 0.82 -0.95 0.00 0.00 178.83 179.65 3f4n h ILE 141 N 0.41 0.97 -0.42 2.54 2.04 -1.05 -0.04 117.51 121.95 3f4n h ILE 141 Ca 0.01 -0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.96 3f4n h ILE 141 Cb 1.08 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 3f4n h ILE 141 CO 0.10 0.00 0.29 0.44 0.00 0.00 0.00 178.15 178.98 3f4n h ASP 142 N 0.01 0.15 -0.25 1.72 3.32 -1.39 -0.09 116.42 119.89 3f4n h ASP 142 Ca 0.02 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.98 3f4n h ASP 142 Cb 0.02 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 3f4n h ASP 142 CO -0.03 0.09 -0.21 0.00 -1.72 0.00 0.00 179.24 177.37 3f4n h ALA 143 N 1.79 0.36 -0.49 3.45 0.00 -0.90 -0.95 119.26 122.51 3f4n h ALA 143 Ca 0.20 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3f4n h ALA 143 Cb 0.56 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3f4n h ALA 143 CO -0.03 0.30 0.11 0.00 0.00 0.00 0.00 179.25 179.63 3f4n h ALA 144 N 0.69 1.27 0.41 0.00 0.00 0.71 0.31 119.26 122.65 3f4n h ALA 144 Ca 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3f4n h ALA 144 Cb 0.75 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3f4n h ALA 144 CO 0.05 0.51 -0.20 0.28 0.00 0.00 0.00 179.25 179.89 3f4n h VAL 145 N 0.72 0.59 -0.82 0.00 2.07 -1.11 -2.32 116.25 115.38 3f4n h VAL 145 Ca 0.16 -0.28 0.18 0.00 0.82 0.00 0.00 66.70 67.58 3f4n h VAL 145 Cb 0.28 0.72 -0.15 0.00 -1.52 0.00 0.00 31.29 30.62 3f4n h VAL 145 CO -0.00 0.05 -0.10 0.00 0.02 0.00 0.00 177.57 177.54 3f4n h ALA 146 N -0.19 0.70 0.00 1.67 0.00 -0.31 0.66 119.26 121.79 3f4n h ALA 146 Ca -0.06 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3f4n h ALA 146 Cb 0.51 0.55 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3f4n h ALA 146 CO 0.09 -0.43 0.00 0.00 0.00 0.00 0.00 179.25 178.91 3f4n n ALA 147 N -3.19 1.81 -1.01 0.00 0.00 0.10 -4.88 120.51 113.35 3f4n n ALA 147 Ca 0.14 -0.07 -0.00 0.00 0.00 0.00 0.00 53.44 53.51 3f4n n ALA 147 Cb 0.48 -1.25 -0.00 0.00 0.00 0.00 0.00 19.45 18.67 3f4n n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f4n n GLY 148 N 0.07 0.47 3.75 0.00 0.00 0.23 -4.27 105.19 105.44 3f4n n GLY 148 Ca 0.06 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 3f4n n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f4n s ALA 149 N -1.98 3.51 -0.18 4.61 0.00 -0.90 -4.96 121.76 121.86 3f4n s ALA 149 Ca 0.00 1.13 0.20 0.00 0.00 0.00 0.00 51.96 53.29 3f4n s ALA 149 Cb 0.00 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.58 3f4n s ALA 149 CO 0.00 -0.52 0.90 -0.35 0.00 0.00 0.00 175.76 175.79 3f4n n PRO 150 N 1.94 0.62 -4.34 0.00 -0.04 -1.19 -4.62 135.00 127.36 3f4n n PRO 150 Ca 0.04 0.13 -0.29 0.00 -0.04 0.00 0.00 63.50 63.33 3f4n n PRO 150 Cb 0.43 -1.79 -0.12 0.00 -0.04 0.00 0.00 33.50 31.98 3f4n n PRO 150 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3f4n s TYR 151 N -3.21 2.44 0.17 0.54 2.02 -0.62 -1.10 117.35 117.59 3f4n s TYR 151 Ca -0.02 -0.31 0.04 0.00 -0.37 0.00 0.00 57.07 56.40 3f4n s TYR 151 Cb 0.10 -1.30 -0.05 0.00 -0.40 0.00 0.00 41.96 40.31 3f4n s TYR 151 CO 0.81 0.38 -0.05 0.96 -1.57 0.00 0.00 175.55 176.08 3f4n s ILE 152 N -1.17 1.01 -0.16 2.71 -4.36 -0.65 -2.30 121.20 116.28 3f4n s ILE 152 Ca 0.17 -2.03 -0.01 0.00 -0.26 0.00 0.00 60.65 58.52 3f4n s ILE 152 Cb -0.10 -2.03 0.04 0.00 1.25 0.00 0.00 42.46 41.62 3f4n s ILE 152 CO 0.09 -0.58 -0.05 -0.70 0.24 0.00 0.00 174.94 173.93 3f4n s GLU 153 N -3.82 1.43 0.01 0.37 2.12 -0.19 -0.55 118.70 118.07 3f4n s GLU 153 Ca 0.21 -0.50 -0.30 0.00 0.36 0.00 0.00 54.97 54.74 3f4n s GLU 153 Cb 0.04 -1.99 -0.03 0.00 0.26 0.00 0.00 34.13 32.41 3f4n s GLU 153 CO 0.03 -0.43 0.96 0.42 -0.54 0.00 0.00 175.26 175.70 3f4n s ILE 154 N 1.64 4.84 -0.23 -3.70 1.01 -0.47 -0.85 121.20 123.43 3f4n s ILE 154 Ca 0.01 2.02 -0.29 0.00 0.00 0.00 0.00 60.65 62.39 3f4n s ILE 154 Cb -0.15 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 37.99 3f4n s ILE 154 CO -0.08 0.19 1.63 -2.28 0.00 0.00 0.00 174.94 174.40 3f4n s HIS 155 N 0.86 2.07 -2.46 3.97 5.65 0.48 -2.07 115.29 123.79 3f4n s HIS 155 Ca 0.50 0.55 0.23 0.00 0.25 0.00 0.00 55.06 56.59 3f4n s HIS 155 Cb -0.21 -4.00 0.59 0.00 -1.18 0.00 0.00 32.58 27.78 3f4n s HIS 155 CO 0.28 -2.94 1.48 0.25 -0.65 0.00 0.00 174.74 173.15 3f4n n THR 156 N 6.51 0.27 -0.00 0.89 -2.24 -0.34 -4.56 114.28 114.81 3f4n n THR 156 Ca 0.19 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.38 3f4n n THR 156 Cb 0.45 0.74 -0.03 0.00 -2.10 0.00 0.00 70.33 69.40 3f4n n THR 156 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3f4n h GLY 157 N 4.80 -0.14 0.82 3.38 0.00 -1.67 -0.82 103.07 109.43 3f4n h GLY 157 Ca 0.00 0.23 0.09 0.00 0.00 0.00 0.00 47.33 47.65 3f4n h GLY 157 CO 0.00 -0.18 0.55 0.00 0.00 0.00 0.00 176.54 176.91 3f4n h ALA 158 N 0.79 1.66 -0.31 3.60 0.00 -1.89 0.35 119.26 123.45 3f4n h ALA 158 Ca 0.10 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 3f4n h ALA 158 Cb 0.39 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3f4n h ALA 158 CO -0.28 0.18 -0.07 -0.92 0.00 0.00 0.00 179.25 178.16 3f4n h TYR 159 N 0.85 0.67 -1.00 0.00 5.03 -1.69 -0.12 116.97 120.70 3f4n h TYR 159 Ca 0.38 -0.14 0.12 0.00 2.58 0.00 0.00 58.73 61.67 3f4n h TYR 159 Cb 0.36 -0.16 -0.08 0.00 1.55 0.00 0.00 36.73 38.40 3f4n h TYR 159 CO -0.00 0.77 0.63 0.00 -1.32 0.00 0.00 178.16 178.24 3f4n h ALA 160 N 0.80 1.51 0.00 1.82 0.00 -0.02 -3.21 119.26 120.17 3f4n h ALA 160 Ca 0.08 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3f4n h ALA 160 Cb 0.55 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3f4n h ALA 160 CO 0.03 0.23 -0.83 -0.25 0.00 0.00 0.00 179.25 178.43 3f4n n ASP 161 N -4.62 0.63 -3.60 0.00 8.00 0.11 -4.95 116.55 112.12 3f4n n ASP 161 Ca 0.19 -0.20 -0.49 0.00 0.71 0.00 0.00 54.79 55.00 3f4n n ASP 161 Cb 0.35 0.56 -0.07 0.00 -0.02 0.00 0.00 41.12 41.94 3f4n n ASP 161 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3f4n n ALA 162 N -1.73 -2.22 0.07 2.24 0.00 -0.08 -4.86 120.51 113.92 3f4n n ALA 162 Ca 0.03 0.44 0.09 0.00 0.00 0.00 0.00 53.44 54.00 3f4n n ALA 162 Cb 0.41 -1.43 -0.05 0.00 0.00 0.00 0.00 19.45 18.38 3f4n n ALA 162 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3f4n n SER 163 N 1.95 0.67 -4.68 0.00 7.64 -1.26 -4.82 113.62 113.11 3f4n n SER 163 Ca 0.19 0.27 -0.30 0.00 1.01 0.00 0.00 58.87 60.04 3f4n n SER 163 Cb 0.02 0.71 -0.09 0.00 -1.01 0.00 0.00 64.21 63.83 3f4n n SER 163 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3f4n s THR 164 N -3.30 1.72 0.23 0.44 -4.23 -1.26 -5.05 115.64 104.19 3f4n s THR 164 Ca -0.03 -1.97 -0.02 0.00 -1.18 0.00 0.00 61.69 58.49 3f4n s THR 164 Cb 0.10 -2.69 0.03 0.00 1.34 0.00 0.00 72.50 71.28 3f4n s THR 164 CO 0.82 0.00 1.64 0.58 -0.54 0.00 0.00 174.62 177.12 3f4n h VAL 165 N 1.59 1.28 -0.15 2.29 2.07 -1.99 -2.34 116.25 118.99 3f4n h VAL 165 Ca -0.44 -1.37 -0.13 0.00 0.82 0.00 0.00 66.70 65.58 3f4n h VAL 165 Cb 1.27 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 3f4n h VAL 165 CO 0.78 0.45 -0.47 -0.07 0.02 0.00 0.00 177.57 178.27 3f4n h LEU 166 N 0.57 0.40 0.54 2.57 3.38 -1.99 -2.70 115.31 118.08 3f4n h LEU 166 Ca 0.07 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3f4n h LEU 166 Cb 0.76 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.40 3f4n h LEU 166 CO 0.06 0.81 -0.26 -0.33 0.09 0.00 0.00 178.44 178.82 3f4n h GLU 167 N 0.30 -0.70 -0.55 1.13 5.08 -1.96 -2.21 114.58 115.67 3f4n h GLU 167 Ca 0.02 0.05 0.11 0.00 -1.00 0.00 0.00 59.36 58.54 3f4n h GLU 167 Cb 0.94 0.16 -0.11 0.00 0.50 0.00 0.00 28.75 30.25 3f4n h GLU 167 CO 0.08 -0.40 -0.14 -0.09 -1.00 0.00 0.00 179.01 177.45 3f4n h ARG 168 N -0.90 -0.01 -0.63 2.33 2.43 -1.47 -0.51 114.38 115.62 3f4n h ARG 168 Ca -0.07 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 3f4n h ARG 168 Cb 0.62 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.14 3f4n h ARG 168 CO 0.12 -0.00 0.16 0.37 -1.51 0.00 0.00 179.97 179.11 3f4n h GLN 169 N -0.01 1.01 -0.44 0.20 5.75 -1.49 0.74 115.11 120.86 3f4n h GLN 169 Ca 0.26 -0.24 -0.13 0.00 -0.15 0.00 0.00 58.65 58.39 3f4n h GLN 169 Cb 0.41 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.81 3f4n h GLN 169 CO -0.57 0.91 -0.25 0.00 -2.65 0.00 0.00 178.83 176.27 3f4n h ALA 170 N 1.05 0.73 -0.97 3.38 0.00 -0.68 -1.32 119.26 121.45 3f4n h ALA 170 Ca 0.20 -0.40 0.02 0.00 0.00 0.00 0.00 54.91 54.73 3f4n h ALA 170 Cb 0.35 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 3f4n h ALA 170 CO 0.00 0.67 0.64 0.93 0.00 0.00 0.00 179.25 181.49 3f4n h GLU 171 N 0.79 1.24 0.62 0.00 4.39 -0.83 0.13 114.58 120.92 3f4n h GLU 171 Ca 0.10 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.69 3f4n h GLU 171 Cb 0.81 -0.28 0.01 0.00 -0.10 0.00 0.00 28.75 29.19 3f4n h GLU 171 CO 0.07 0.82 -0.30 1.25 -1.16 0.00 0.00 179.01 179.69 3f4n h LEU 172 N 1.28 -0.70 -0.54 1.33 5.85 -0.50 -2.09 115.31 119.93 3f4n h LEU 172 Ca 0.37 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 59.17 3f4n h LEU 172 Cb -0.09 0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 3f4n h LEU 172 CO -0.09 -0.44 0.15 -0.03 -0.34 0.00 0.00 178.44 177.68 3f4n h MET 173 N -0.92 0.29 -0.76 1.25 4.05 -1.05 0.13 114.93 117.91 3f4n h MET 173 Ca -0.08 -0.02 0.16 0.00 -0.28 0.00 0.00 59.70 59.48 3f4n h MET 173 Cb 0.67 -0.06 -0.11 0.00 -0.80 0.00 0.00 31.60 31.29 3f4n h MET 173 CO 0.14 0.19 0.22 -0.09 0.23 0.00 0.00 176.91 177.60 3f4n h ARG 174 N 0.30 0.30 -0.27 0.39 2.43 -0.59 0.73 114.38 117.65 3f4n h ARG 174 Ca 0.27 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.31 3f4n h ARG 174 Cb 0.35 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 3f4n h ARG 174 CO -0.32 0.20 -0.28 0.82 -1.51 0.00 0.00 179.97 178.87 3f4n h ILE 175 N 0.31 1.31 -0.38 1.20 2.04 -0.42 -1.43 117.51 120.14 3f4n h ILE 175 Ca 0.43 -1.45 0.03 0.00 1.00 0.00 0.00 64.86 64.87 3f4n h ILE 175 Cb 0.73 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 3f4n h ILE 175 CO -0.50 0.46 0.18 0.00 0.00 0.00 0.00 178.15 178.29 3f4n h ALA 176 N 0.69 0.46 0.32 1.87 0.00 -0.07 0.19 119.26 122.73 3f4n h ALA 176 Ca 0.04 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3f4n h ALA 176 Cb 0.85 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3f4n h ALA 176 CO 0.07 -0.19 -0.21 0.87 0.00 0.00 0.00 179.25 179.79 3f4n h LYS 177 N 0.37 -0.50 -0.80 0.00 1.57 -0.87 -1.10 116.57 115.24 3f4n h LYS 177 Ca 0.16 0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.98 3f4n h LYS 177 Cb 0.08 0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 3f4n h LYS 177 CO -0.12 -0.33 0.52 0.00 -0.57 0.00 0.00 179.45 178.95 3f4n h ALA 178 N 0.13 1.02 -0.13 3.86 0.00 -0.95 -0.58 119.26 122.61 3f4n h ALA 178 Ca -0.03 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.84 3f4n h ALA 178 Cb 0.44 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3f4n h ALA 178 CO 0.02 0.45 0.01 0.00 0.00 0.00 0.00 179.25 179.72 3f4n h ALA 179 N 1.29 0.12 -0.18 0.00 0.00 -0.41 0.32 119.26 120.39 3f4n h ALA 179 Ca 0.29 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 3f4n h ALA 179 Cb -0.11 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3f4n h ALA 179 CO -0.06 -0.44 0.10 1.15 0.00 0.00 0.00 179.25 180.00 3f4n h THR 180 N 0.06 1.09 0.26 0.00 2.02 -0.88 -1.41 112.91 114.04 3f4n h THR 180 Ca 0.06 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 67.01 3f4n h THR 180 Cb 0.06 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 3f4n h THR 180 CO -0.09 0.08 -0.30 0.22 0.37 0.00 0.00 175.52 175.80 3f4n h TYR 181 N 0.20 -0.80 -0.95 3.16 3.20 -0.94 -0.63 116.97 120.22 3f4n h TYR 181 Ca 0.06 0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.07 3f4n h TYR 181 Cb 0.04 0.32 -0.09 0.00 1.54 0.00 0.00 36.73 38.55 3f4n h TYR 181 CO -0.05 -0.42 0.57 0.00 -1.64 0.00 0.00 178.16 176.62 3f4n h ALA 182 N -0.01 1.44 -0.30 1.82 0.00 -0.27 -2.15 119.26 119.79 3f4n h ALA 182 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3f4n h ALA 182 Cb 0.57 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3f4n h ALA 182 CO -0.09 0.11 0.19 0.00 0.00 0.00 0.00 179.25 179.47 3f4n h ALA 183 N 1.54 0.38 -0.31 0.00 0.00 -0.75 -1.52 119.26 118.61 3f4n h ALA 183 Ca 0.49 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.46 3f4n h ALA 183 Cb 0.55 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3f4n h ALA 183 CO -0.29 -0.14 0.40 0.78 0.00 0.00 0.00 179.25 180.00 3f4n h GLY 184 N 0.40 0.00 -0.59 0.00 0.00 -0.48 0.25 103.07 102.64 3f4n h GLY 184 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3f4n h GLY 184 CO -0.02 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.80 3f4n n LYS 185 N -3.54 1.70 -0.01 4.80 5.02 -0.61 -4.91 118.16 120.61 3f4n n LYS 185 Ca 0.05 -1.03 0.00 0.00 -2.02 0.00 0.00 58.31 55.31 3f4n n LYS 185 Cb 0.55 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 3f4n n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3f4n n GLY 186 N 1.17 0.28 3.79 0.72 0.00 0.86 -5.07 105.19 106.95 3f4n n GLY 186 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 3f4n n GLY 186 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f4n s LEU 187 N 0.00 3.75 0.01 0.99 1.43 -0.98 -5.01 118.68 118.87 3f4n s LEU 187 Ca 0.00 1.95 -0.18 0.00 -1.03 0.00 0.00 54.13 54.88 3f4n s LEU 187 Cb 0.00 -4.56 -0.06 0.00 0.03 0.00 0.00 46.19 41.60 3f4n s LEU 187 CO 0.00 -0.95 0.50 -0.54 0.23 0.00 0.00 176.35 175.59 3f4n s LYS 188 N -3.43 4.13 -0.25 1.70 3.01 -0.26 -4.29 119.74 120.36 3f4n s LYS 188 Ca 0.68 0.58 0.02 0.00 -1.01 0.00 0.00 55.97 56.24 3f4n s LYS 188 Cb -0.18 -3.27 0.06 0.00 -1.01 0.00 0.00 37.83 33.43 3f4n s LYS 188 CO 0.25 0.56 -0.11 0.08 0.51 0.00 0.00 175.35 176.64 3f4n s VAL 189 N -0.77 2.05 0.52 3.17 1.01 -1.26 -1.64 120.40 123.48 3f4n s VAL 189 Ca 0.27 -1.49 0.09 0.00 0.00 0.00 0.00 61.98 60.84 3f4n s VAL 189 Cb -0.18 -2.15 0.06 0.00 0.00 0.00 0.00 36.38 34.11 3f4n s VAL 189 CO 0.16 0.02 0.67 0.20 0.00 0.00 0.00 175.10 176.15 3f4n s ASN 190 N 1.17 5.22 0.06 3.32 0.01 0.29 0.16 114.94 125.17 3f4n s ASN 190 Ca -0.07 -0.75 -0.20 0.00 -0.71 0.00 0.00 52.86 51.13 3f4n s ASN 190 Cb -0.19 -0.02 0.04 0.00 0.41 0.00 0.00 41.25 41.50 3f4n s ASN 190 CO -0.06 -1.12 0.47 0.00 -1.51 0.00 0.00 177.10 174.88 3f4n s ALA 191 N -2.57 -1.16 0.00 0.60 0.00 -0.79 -1.37 121.76 116.47 3f4n s ALA 191 Ca 0.57 0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.92 3f4n s ALA 191 Cb -0.07 0.44 0.00 0.00 0.00 0.00 0.00 23.12 23.50 3f4n s ALA 191 CO 0.35 -0.52 0.00 0.41 0.00 0.00 0.00 175.76 176.00 3f4n n GLY 192 N 0.31 0.69 0.13 0.00 0.00 -0.88 -0.66 105.19 104.78 3f4n n GLY 192 Ca -0.18 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 44.88 3f4n n GLY 192 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3f4n n HIS 193 N -0.38 0.00 -0.94 1.61 -0.00 -1.25 -1.20 115.22 113.07 3f4n n HIS 193 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 3f4n n HIS 193 Cb 0.00 -0.34 0.00 0.00 -0.12 0.00 0.00 29.99 29.53 3f4n n HIS 193 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3f4n n GLY 194 N 2.49 0.78 3.77 1.57 0.00 -1.26 -2.31 105.19 110.23 3f4n n GLY 194 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3f4n n GLY 194 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f4n s LEU 195 N 0.00 4.24 0.06 0.99 1.43 -1.26 -4.73 118.68 119.40 3f4n s LEU 195 Ca 0.00 2.30 -0.05 0.00 -1.03 0.00 0.00 54.13 55.34 3f4n s LEU 195 Cb 0.00 -3.99 -0.02 0.00 0.03 0.00 0.00 46.19 42.22 3f4n s LEU 195 CO 0.00 -0.57 0.09 -0.89 0.23 0.00 0.00 176.35 175.21 3f4n s THR 196 N -1.41 0.16 0.60 5.49 2.01 -1.26 -4.42 115.64 116.81 3f4n s THR 196 Ca 0.55 -1.33 0.30 0.00 0.31 0.00 0.00 61.69 61.52 3f4n s THR 196 Cb -0.30 -1.23 0.36 0.00 0.01 0.00 0.00 72.50 71.34 3f4n s THR 196 CO 0.37 -0.74 2.13 1.88 -0.69 0.00 0.00 174.62 177.58 3f4n h TYR 197 N 3.19 0.00 -0.01 4.92 -1.99 -1.95 -1.14 116.97 120.00 3f4n h TYR 197 Ca -0.33 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.40 3f4n h TYR 197 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.91 3f4n h TYR 197 CO 0.50 0.00 -0.69 0.72 -0.00 0.00 0.00 178.16 178.68 3f4n n HIS 198 N -3.68 0.00 -0.02 4.88 8.25 -1.26 -4.37 115.22 119.02 3f4n n HIS 198 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3f4n n HIS 198 Cb 0.28 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.39 3f4n n HIS 198 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3f4n n ASN 199 N -0.90 1.38 0.15 0.41 2.04 -0.90 -4.79 115.26 112.65 3f4n n ASN 199 Ca 0.05 -1.40 0.01 0.00 -0.44 0.00 0.00 54.58 52.80 3f4n n ASN 199 Cb 0.34 0.00 0.18 0.00 -2.53 0.00 0.00 39.78 37.76 3f4n n ASN 199 CO 0.00 0.00 0.00 1.62 -0.44 0.00 0.00 177.26 178.44 3f4n h VAL 200 N 0.04 1.21 -0.39 3.53 3.04 -1.43 -3.36 116.25 118.89 3f4n h VAL 200 Ca 0.00 -2.09 -0.16 0.00 -1.01 0.00 0.00 66.70 63.44 3f4n h VAL 200 Cb 0.22 2.19 -0.01 0.00 -2.01 0.00 0.00 31.29 31.68 3f4n h VAL 200 CO 0.00 0.56 -0.38 1.56 -1.01 0.00 0.00 177.57 178.29 3f4n h GLN 201 N 0.00 0.94 -0.35 4.17 4.20 -1.86 -0.88 115.11 121.32 3f4n h GLN 201 Ca -0.01 -0.50 -0.01 0.00 0.06 0.00 0.00 58.65 58.20 3f4n h GLN 201 Cb 1.15 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.93 3f4n h GLN 201 CO 0.07 1.15 0.19 -1.35 -0.67 0.00 0.00 178.83 178.23 3f4n h PRO 202 N 0.77 0.48 -0.12 1.46 0.11 -1.96 -0.30 132.00 132.45 3f4n h PRO 202 Ca 0.06 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.05 3f4n h PRO 202 Cb 0.98 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.99 3f4n h PRO 202 CO 0.10 0.36 -0.23 0.82 -0.21 0.00 0.00 178.00 178.83 3f4n h ILE 203 N 0.49 1.38 0.00 4.15 1.08 -1.71 -3.20 117.51 119.70 3f4n h ILE 203 Ca 0.13 -1.51 -0.03 0.00 -0.39 0.00 0.00 64.86 63.05 3f4n h ILE 203 Cb 0.02 2.08 -0.00 0.00 -3.07 0.00 0.00 36.82 35.84 3f4n h ILE 203 CO -0.02 0.44 -0.16 0.00 -0.69 0.00 0.00 178.15 177.72 3f4n h ALA 204 N 0.53 1.11 0.00 1.87 0.00 -0.58 -2.27 119.26 119.92 3f4n h ALA 204 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3f4n h ALA 204 Cb 0.82 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3f4n h ALA 204 CO 0.05 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.50 3f4n h ALA 205 N 1.84 1.00 -2.25 0.00 0.00 -1.09 -3.43 119.26 115.33 3f4n h ALA 205 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 3f4n h ALA 205 Cb 0.55 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.35 3f4n h ALA 205 CO 0.02 0.00 1.24 -0.51 0.00 0.00 0.00 179.25 180.00 3f4n s LEU 206 N -6.01 4.22 0.50 0.00 1.43 -0.86 -4.90 118.68 113.06 3f4n s LEU 206 Ca 0.05 2.38 0.16 0.00 -1.03 0.00 0.00 54.13 55.69 3f4n s LEU 206 Cb 0.07 -3.53 1.21 0.00 0.03 0.00 0.00 46.19 43.97 3f4n s LEU 206 CO 0.62 -1.19 2.10 1.55 0.23 0.00 0.00 176.35 179.66 3f4n h PRO 207 N 11.08 0.00 -0.00 1.29 0.13 -1.89 -2.64 132.00 139.98 3f4n h PRO 207 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3f4n h PRO 207 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3f4n h PRO 207 CO 0.95 0.06 -0.01 0.39 -0.23 0.00 0.00 178.00 179.16 3f4n n GLU 208 N -4.43 0.08 -1.99 0.86 4.71 -1.26 -4.86 120.64 113.75 3f4n n GLU 208 Ca -0.03 -0.00 -0.42 0.00 -0.01 0.00 0.00 57.16 56.70 3f4n n GLU 208 Cb 0.14 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.04 3f4n n GLU 208 CO 0.00 0.00 0.00 -1.64 0.09 0.00 0.00 177.13 175.58 3f4n s MET 209 N -2.92 4.23 -0.13 3.49 -1.94 -1.00 -4.28 119.30 116.75 3f4n s MET 209 Ca 0.17 2.27 -0.07 0.00 -1.71 0.00 0.00 55.69 56.34 3f4n s MET 209 Cb 0.19 -3.43 -0.03 0.00 2.01 0.00 0.00 34.83 33.57 3f4n s MET 209 CO 0.52 -0.65 -0.11 1.25 -0.01 0.00 0.00 175.02 176.03 3f4n h HIS 210 N 7.66 0.00 -3.60 -0.03 2.76 0.12 -3.45 115.15 118.60 3f4n h HIS 210 Ca -0.42 0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 57.55 3f4n h HIS 210 Cb 1.20 0.00 -0.26 0.00 1.55 0.00 0.00 27.41 29.90 3f4n h HIS 210 CO 0.72 0.06 -0.64 -2.00 -1.30 0.00 0.00 177.93 174.78 3f4n s GLU 211 N -2.06 0.13 -0.24 5.26 2.12 -1.25 -1.20 118.70 121.45 3f4n s GLU 211 Ca -0.11 -0.01 -0.11 0.00 0.36 0.00 0.00 54.97 55.09 3f4n s GLU 211 Cb 0.02 0.06 -0.05 0.00 0.26 0.00 0.00 34.13 34.41 3f4n s GLU 211 CO 0.18 -0.02 0.20 -0.51 -0.54 0.00 0.00 175.26 174.57 3f4n s LEU 212 N -0.21 4.11 -0.33 2.70 1.43 -0.68 -1.88 118.68 123.82 3f4n s LEU 212 Ca -0.03 0.16 -0.17 0.00 -1.03 0.00 0.00 54.13 53.06 3f4n s LEU 212 Cb -0.02 -2.17 -0.01 0.00 0.03 0.00 0.00 46.19 44.01 3f4n s LEU 212 CO 0.00 0.02 0.45 0.20 0.23 0.00 0.00 176.35 177.26 3f4n s ASN 213 N 1.16 6.28 -0.03 2.29 0.01 0.17 -1.38 114.94 123.44 3f4n s ASN 213 Ca 0.09 0.01 0.03 0.00 -0.71 0.00 0.00 52.86 52.28 3f4n s ASN 213 Cb -0.14 -2.24 0.00 0.00 0.41 0.00 0.00 41.25 39.28 3f4n s ASN 213 CO 0.06 -0.38 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.53 3f4n s ILE 214 N 2.24 0.88 0.15 0.60 1.01 -0.77 -3.77 121.20 121.54 3f4n s ILE 214 Ca 0.16 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.40 3f4n s ILE 214 Cb -0.16 -0.78 0.00 0.00 0.01 0.00 0.00 42.46 41.53 3f4n s ILE 214 CO 0.12 0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.94 3f4n n GLY 215 N 3.29 -0.17 0.19 6.18 0.00 -1.26 0.09 105.19 113.51 3f4n n GLY 215 Ca -0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.69 3f4n n GLY 215 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3f4n h HIS 216 N 0.00 -0.37 -0.73 1.61 -0.00 -1.90 0.89 115.15 114.64 3f4n h HIS 216 Ca 0.00 -0.01 0.06 0.00 -0.00 0.00 0.00 60.37 60.42 3f4n h HIS 216 Cb 0.00 0.13 -0.05 0.00 -0.00 0.00 0.00 27.41 27.49 3f4n h HIS 216 CO 0.00 -0.23 0.48 0.00 -0.00 0.00 0.00 177.93 178.18 3f4n h ALA 217 N 0.34 1.68 -0.13 5.26 0.00 -1.94 0.33 119.26 124.80 3f4n h ALA 217 Ca -0.04 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 3f4n h ALA 217 Cb 0.30 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3f4n h ALA 217 CO 0.05 0.21 -0.21 0.82 0.00 0.00 0.00 179.25 180.12 3f4n h ILE 218 N 0.78 1.37 -0.36 0.00 2.04 -1.61 -1.66 117.51 118.07 3f4n h ILE 218 Ca 0.31 -1.46 -0.11 0.00 1.00 0.00 0.00 64.86 64.60 3f4n h ILE 218 Cb 0.24 2.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 3f4n h ILE 218 CO -0.10 0.43 -0.22 0.40 0.00 0.00 0.00 178.15 178.65 3f4n h ILE 219 N -0.04 1.27 -0.51 -0.67 1.08 0.08 0.15 117.51 118.87 3f4n h ILE 219 Ca 0.01 -1.32 -0.05 0.00 -0.39 0.00 0.00 64.86 63.11 3f4n h ILE 219 Cb 0.79 1.23 -0.02 0.00 -3.07 0.00 0.00 36.82 35.75 3f4n h ILE 219 CO 0.05 0.44 0.11 1.23 -0.69 0.00 0.00 178.15 179.28 3f4n h GLY 220 N 0.98 0.90 1.27 5.37 0.00 -0.36 -1.89 103.07 109.34 3f4n h GLY 220 Ca 0.09 -0.58 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 3f4n h GLY 220 CO 0.06 0.54 -0.12 -1.61 0.00 0.00 0.00 176.54 175.40 3f4n h GLN 221 N 0.72 0.86 -0.87 4.80 5.75 -1.22 -3.25 115.11 121.91 3f4n h GLN 221 Ca 0.16 -0.30 0.02 0.00 -0.15 0.00 0.00 58.65 58.38 3f4n h GLN 221 Cb 0.36 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.80 3f4n h GLN 221 CO 0.01 0.94 0.57 0.00 -2.65 0.00 0.00 178.83 177.69 3f4n h ALA 222 N 1.08 1.13 -0.00 3.38 0.00 -0.32 -1.90 119.26 122.63 3f4n h ALA 222 Ca 0.12 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3f4n h ALA 222 Cb 0.64 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3f4n h ALA 222 CO 0.04 0.44 0.01 -0.39 0.00 0.00 0.00 179.25 179.36 3f4n h VAL 223 N 1.12 0.18 0.04 0.00 -1.51 -1.39 0.05 116.25 114.74 3f4n h VAL 223 Ca 0.34 0.00 -0.31 0.00 -1.23 0.00 0.00 66.70 65.50 3f4n h VAL 223 Cb -0.05 0.99 -0.04 0.00 -2.13 0.00 0.00 31.29 30.07 3f4n h VAL 223 CO -0.10 0.00 -1.72 0.23 -1.23 0.00 0.00 177.57 174.75 3f4n n MET 224 N -3.34 0.63 0.00 5.19 2.00 -0.78 -4.78 117.12 116.03 3f4n n MET 224 Ca -0.03 0.42 0.00 0.00 0.00 0.00 0.00 57.70 58.09 3f4n n MET 224 Cb 0.08 -1.69 0.00 0.00 0.00 0.00 0.00 33.22 31.62 3f4n n MET 224 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 3f4n n THR 225 N -4.07 0.19 0.00 2.03 -2.24 -0.80 -5.12 114.28 104.27 3f4n n THR 225 Ca -0.36 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.05 3f4n n THR 225 Cb 0.83 1.20 0.00 0.00 -2.10 0.00 0.00 70.33 70.26 3f4n n THR 225 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f4n n GLY 226 N -0.10 2.54 0.30 3.38 0.00 -0.01 -4.68 105.19 106.62 3f4n n GLY 226 Ca 0.00 -1.59 0.03 0.00 0.00 0.00 0.00 46.02 44.45 3f4n n GLY 226 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3f4n h LEU 227 N 0.00 0.51 -0.11 0.99 5.85 -1.91 -0.46 115.31 120.19 3f4n h LEU 227 Ca 0.00 -0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 3f4n h LEU 227 Cb 0.00 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.90 3f4n h LEU 227 CO 0.00 0.43 -0.23 0.00 -0.34 0.00 0.00 178.44 178.29 3f4n h ALA 228 N 1.66 0.17 -0.64 1.25 0.00 -1.91 -1.36 119.26 118.44 3f4n h ALA 228 Ca 0.15 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 3f4n h ALA 228 Cb 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3f4n h ALA 228 CO -0.02 0.14 0.26 0.00 0.00 0.00 0.00 179.25 179.63 3f4n h ALA 229 N 0.51 0.83 -0.77 0.00 0.00 -1.82 -0.34 119.26 117.67 3f4n h ALA 229 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.75 3f4n h ALA 229 Cb 0.83 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3f4n h ALA 229 CO 0.05 0.44 0.51 0.00 0.00 0.00 0.00 179.25 180.25 3f4n h ALA 230 N 1.11 0.97 -0.16 0.00 0.00 -1.06 -0.29 119.26 119.83 3f4n h ALA 230 Ca 0.21 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 3f4n h ALA 230 Cb 0.20 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3f4n h ALA 230 CO -0.02 0.39 -0.45 0.28 0.00 0.00 0.00 179.25 179.45 3f4n h VAL 231 N 1.04 1.34 -0.75 0.00 2.07 -1.10 -3.00 116.25 115.84 3f4n h VAL 231 Ca 0.28 -1.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.07 3f4n h VAL 231 Cb -0.12 2.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 3f4n h VAL 231 CO -0.06 0.53 0.41 0.74 0.02 0.00 0.00 177.57 179.21 3f4n h THR 232 N 0.24 1.22 0.00 2.57 2.02 -0.90 -2.28 112.91 115.78 3f4n h THR 232 Ca -0.01 -0.56 -0.09 0.00 0.77 0.00 0.00 66.41 66.52 3f4n h THR 232 Cb 1.07 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 3f4n h THR 232 CO 0.10 0.25 -0.43 0.44 0.37 0.00 0.00 175.52 176.24 3f4n h ASP 233 N 1.05 0.00 0.05 4.18 3.32 -1.05 -1.70 116.42 122.27 3f4n h ASP 233 Ca 0.27 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.25 3f4n h ASP 233 Cb 0.03 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.58 3f4n h ASP 233 CO -0.04 0.43 -0.31 -0.03 -1.72 0.00 0.00 179.24 177.57 3f4n h MET 234 N 0.00 0.12 -0.84 3.56 4.05 -1.37 -2.96 114.93 117.50 3f4n h MET 234 Ca -0.00 -0.20 0.11 0.00 -0.28 0.00 0.00 59.70 59.33 3f4n h MET 234 Cb 0.89 0.07 -0.08 0.00 -0.80 0.00 0.00 31.60 31.68 3f4n h MET 234 CO 0.06 1.07 0.46 -0.22 0.23 0.00 0.00 176.91 178.51 3f4n h LYS 235 N -0.72 0.71 0.13 0.39 1.63 -1.36 -1.06 116.57 116.29 3f4n h LYS 235 Ca -0.05 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.70 3f4n h LYS 235 Cb 1.22 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.68 3f4n h LYS 235 CO 0.06 0.47 -0.09 0.28 -3.45 0.00 0.00 179.45 176.72 3f4n h VAL 236 N 0.73 0.80 -0.75 2.00 2.07 -1.37 -0.22 116.25 119.52 3f4n h VAL 236 Ca 0.42 0.00 0.16 0.00 0.82 0.00 0.00 66.70 68.11 3f4n h VAL 236 Cb 0.47 0.80 -0.11 0.00 -1.52 0.00 0.00 31.29 30.94 3f4n h VAL 236 CO -0.29 0.00 0.19 -0.07 0.02 0.00 0.00 177.57 177.42 3f4n h LEU 237 N -0.22 0.03 -0.60 2.57 3.38 -1.31 -0.11 115.31 119.05 3f4n h LEU 237 Ca -0.01 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3f4n h LEU 237 Cb 0.19 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3f4n h LEU 237 CO 0.00 -0.03 0.34 0.24 0.09 0.00 0.00 178.44 179.07 3f4n h MET 238 N 0.28 0.83 -0.68 1.13 2.86 -0.69 -1.77 114.93 116.88 3f4n h MET 238 Ca 0.42 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.95 3f4n h MET 238 Cb 0.73 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 32.19 3f4n h MET 238 CO -0.51 0.62 0.35 0.00 1.06 0.00 0.00 176.91 178.43 3f4n h ARG 239 N 0.81 0.97 0.00 1.72 3.08 -0.46 -2.77 114.38 117.72 3f4n h ARG 239 Ca 0.21 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.10 3f4n h ARG 239 Cb 0.03 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 3f4n h ARG 239 CO -0.04 0.75 -0.16 1.49 -1.07 0.00 0.00 179.97 180.94 3f4n h GLU 240 N 0.94 0.00 -0.01 0.04 4.57 -0.81 -2.62 114.58 116.69 3f4n h GLU 240 Ca 0.24 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.32 3f4n h GLU 240 Cb 0.08 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 3f4n h GLU 240 CO -0.03 0.16 -0.47 0.00 -1.18 0.00 0.00 179.01 177.49 3f4n h ALA 241 N 1.84 1.21 -0.57 2.92 0.00 -1.03 -3.09 119.26 120.55 3f4n h ALA 241 Ca -0.00 -0.43 -0.31 0.00 0.00 0.00 0.00 54.91 54.17 3f4n h ALA 241 Cb 0.56 -0.08 -0.17 0.00 0.00 0.00 0.00 17.79 18.10 3f4n h ALA 241 CO 0.02 0.59 0.40 0.54 0.00 0.00 0.00 179.25 180.80 3f4n n ARG 242 N -3.98 1.75 0.00 0.00 5.12 -0.99 -4.39 116.66 114.18 3f4n n ARG 242 Ca -0.02 -1.74 0.07 0.00 -1.93 0.00 0.00 57.85 54.23 3f4n n ARG 242 Cb 0.49 -1.68 0.06 0.00 -1.16 0.00 0.00 32.46 30.17 3f4n n ARG 242 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24