#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f9n n ASP 8 N 0.00 0.00 -4.87 4.31 8.00 -1.26 -4.78 116.55 117.96 3f9n n ASP 8 Ca 0.00 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.13 3f9n n ASP 8 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 3f9n n ASP 8 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3f9n s TRP 9 N -0.63 3.60 -0.10 1.24 0.52 -1.26 0.12 118.94 122.42 3f9n s TRP 9 Ca 0.00 0.56 -0.01 0.00 0.02 0.00 0.00 56.10 56.67 3f9n s TRP 9 Cb 0.00 -1.99 -0.03 0.00 -1.15 0.00 0.00 33.47 30.30 3f9n s TRP 9 CO 0.00 0.70 -0.04 -0.51 0.02 0.00 0.00 176.95 177.12 3f9n s ASP 10 N -0.94 4.82 -0.93 2.95 1.01 0.38 -4.86 116.67 119.11 3f9n s ASP 10 Ca 0.15 -0.02 -0.20 0.00 0.71 0.00 0.00 52.55 53.20 3f9n s ASP 10 Cb -0.12 -1.42 0.11 0.00 1.01 0.00 0.00 42.92 42.49 3f9n s ASP 10 CO 0.04 0.31 1.19 -0.76 0.21 0.00 0.00 175.17 176.16 3f9n s LEU 11 N -0.48 4.69 0.32 1.23 1.02 -1.26 -0.67 118.68 123.52 3f9n s LEU 11 Ca 0.07 -1.86 0.14 0.00 0.02 0.00 0.00 54.13 52.51 3f9n s LEU 11 Cb -0.12 -2.44 0.48 0.00 0.02 0.00 0.00 46.19 44.14 3f9n s LEU 11 CO 0.02 -1.18 1.66 1.62 0.02 0.00 0.00 176.35 178.49 3f9n h VAL 12 N 6.04 1.17 -1.30 -1.59 3.04 -1.22 -3.48 116.25 118.92 3f9n h VAL 12 Ca 0.14 -1.87 0.33 0.00 -1.01 0.00 0.00 66.70 64.29 3f9n h VAL 12 Cb 1.02 2.07 -0.15 0.00 -2.01 0.00 0.00 31.29 32.22 3f9n h VAL 12 CO 1.18 0.50 0.88 0.00 -1.01 0.00 0.00 177.57 179.12 3f9n s GLN 13 N -3.57 0.24 -0.22 4.17 -2.07 -1.24 -4.99 119.66 111.99 3f9n s GLN 13 Ca -0.00 -0.12 -0.21 0.00 -1.82 0.00 0.00 55.36 53.21 3f9n s GLN 13 Cb 0.12 0.09 -0.02 0.00 -1.09 0.00 0.00 33.01 32.10 3f9n s GLN 13 CO 0.73 -0.11 0.64 0.99 -1.32 0.00 0.00 175.29 176.21 3f9n s THR 14 N -2.28 5.00 -0.01 3.63 2.01 -1.26 -0.08 115.64 122.65 3f9n s THR 14 Ca 0.13 1.18 -0.05 0.00 0.31 0.00 0.00 61.69 63.26 3f9n s THR 14 Cb 0.04 -3.95 -0.28 0.00 0.01 0.00 0.00 72.50 68.31 3f9n s THR 14 CO -0.04 0.08 0.81 -0.07 -0.69 0.00 0.00 174.62 174.71 3f9n h LEU 15 N 8.47 0.45 0.00 4.42 3.38 -0.62 -3.47 115.31 127.93 3f9n h LEU 15 Ca -0.30 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.04 3f9n h LEU 15 Cb 1.13 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.74 3f9n h LEU 15 CO 0.78 1.53 0.00 0.61 0.09 0.00 0.00 178.44 181.44 3f9n n GLY 16 N 1.71 -1.66 0.00 0.83 0.00 -1.12 -5.00 105.19 99.95 3f9n n GLY 16 Ca -0.18 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3f9n n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f9n n GLY 21 N 0.00 0.00 3.45 -0.02 0.00 -1.25 -1.68 105.19 105.69 3f9n n GLY 21 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 3f9n n GLY 21 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3f9n s GLU 22 N 0.00 1.83 -0.14 1.61 -1.05 -1.11 -4.99 118.70 114.85 3f9n s GLU 22 Ca 0.00 -1.76 -0.01 0.00 -0.15 0.00 0.00 54.97 53.05 3f9n s GLU 22 Cb 0.00 0.42 0.04 0.00 -0.44 0.00 0.00 34.13 34.15 3f9n s GLU 22 CO 0.00 -0.74 -0.03 0.08 0.95 0.00 0.00 175.26 175.51 3f9n s VAL 23 N -3.22 0.87 0.17 1.83 1.01 -0.68 -0.70 120.40 119.69 3f9n s VAL 23 Ca 0.32 -0.41 0.06 0.00 0.00 0.00 0.00 61.98 61.94 3f9n s VAL 23 Cb 0.00 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 3f9n s VAL 23 CO 0.20 0.15 0.11 -1.58 0.00 0.00 0.00 175.10 173.98 3f9n s GLN 24 N 1.74 2.79 -0.27 2.72 0.74 -0.47 0.14 119.66 127.05 3f9n s GLN 24 Ca 0.02 -0.94 -0.17 0.00 0.05 0.00 0.00 55.36 54.32 3f9n s GLN 24 Cb -0.14 -2.58 -0.03 0.00 1.10 0.00 0.00 33.01 31.36 3f9n s GLN 24 CO -0.07 0.47 0.49 -1.17 -0.55 0.00 0.00 175.29 174.46 3f9n s LEU 25 N -3.12 4.06 -0.10 3.68 2.96 0.89 -1.07 118.68 125.97 3f9n s LEU 25 Ca 0.30 0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 54.64 3f9n s LEU 25 Cb -0.10 -2.62 -0.03 0.00 0.50 0.00 0.00 46.19 43.94 3f9n s LEU 25 CO 0.22 -0.28 0.01 0.00 -1.32 0.00 0.00 176.35 174.99 3f9n s ALA 26 N 2.27 3.32 -0.06 5.97 0.00 0.34 -0.58 121.76 133.02 3f9n s ALA 26 Ca 0.20 -0.79 0.02 0.00 0.00 0.00 0.00 51.96 51.39 3f9n s ALA 26 Cb -0.16 -1.55 0.01 0.00 0.00 0.00 0.00 23.12 21.42 3f9n s ALA 26 CO 0.09 0.53 -0.12 0.08 0.00 0.00 0.00 175.76 176.35 3f9n s VAL 27 N -0.71 1.12 0.12 0.00 1.01 0.15 -0.38 120.40 121.71 3f9n s VAL 27 Ca 0.11 -0.49 -0.31 0.00 0.00 0.00 0.00 61.98 61.30 3f9n s VAL 27 Cb -0.12 -1.02 -0.08 0.00 0.00 0.00 0.00 36.38 35.17 3f9n s VAL 27 CO 0.02 0.35 1.35 0.21 0.00 0.00 0.00 175.10 177.03 3f9n s ASN 28 N 0.56 6.87 0.43 3.32 3.84 0.29 -0.47 114.94 129.78 3f9n s ASN 28 Ca -0.12 2.30 0.18 0.00 0.21 0.00 0.00 52.86 55.43 3f9n s ASN 28 Cb -0.15 -2.59 0.98 0.00 -0.55 0.00 0.00 41.25 38.95 3f9n s ASN 28 CO 0.03 -0.61 1.92 0.08 -2.79 0.00 0.00 177.10 175.73 3f9n h ARG 29 N 6.53 0.00 0.00 0.43 0.11 0.54 0.54 114.38 122.53 3f9n h ARG 29 Ca -0.43 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.65 3f9n h ARG 29 Cb 1.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.29 3f9n h ARG 29 CO 0.84 0.26 -0.31 0.28 0.10 0.00 0.00 179.97 181.14 3f9n h VAL 30 N 0.00 0.00 0.00 0.08 2.07 -1.86 -3.41 116.25 113.13 3f9n h VAL 30 Ca -0.00 -0.73 -0.03 0.00 0.82 0.00 0.00 66.70 66.76 3f9n h VAL 30 Cb 0.53 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.30 3f9n h VAL 30 CO 0.03 0.00 -0.17 0.71 0.02 0.00 0.00 177.57 178.17 3f9n h THR 31 N -0.73 0.30 -0.36 2.57 1.35 -1.95 -3.47 112.91 110.63 3f9n h THR 31 Ca 0.00 -1.31 -0.15 0.00 -0.55 0.00 0.00 66.41 64.39 3f9n h THR 31 Cb 0.31 2.05 -0.06 0.00 -1.73 0.00 0.00 68.15 68.72 3f9n h THR 31 CO 0.00 0.16 -0.14 -0.62 -0.25 0.00 0.00 175.52 174.67 3f9n n GLU 32 N -3.16 -0.87 -2.60 4.72 1.02 0.18 -4.96 120.64 114.97 3f9n n GLU 32 Ca 0.03 0.69 -0.34 0.00 -0.02 0.00 0.00 57.16 57.52 3f9n n GLU 32 Cb 0.56 -4.60 -0.04 0.00 -0.02 0.00 0.00 31.44 27.33 3f9n n GLU 32 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3f9n s GLU 33 N -2.33 3.89 0.20 3.49 2.02 -1.26 -4.63 118.70 120.09 3f9n s GLU 33 Ca 0.00 1.31 0.11 0.00 0.02 0.00 0.00 54.97 56.41 3f9n s GLU 33 Cb 0.00 -2.11 -0.04 0.00 0.10 0.00 0.00 34.13 32.07 3f9n s GLU 33 CO 0.00 -0.35 -0.19 0.00 0.02 0.00 0.00 175.26 174.74 3f9n s ALA 34 N -2.03 2.68 -0.15 5.21 0.00 -1.26 0.11 121.76 126.32 3f9n s ALA 34 Ca 0.66 -1.64 -0.21 0.00 0.00 0.00 0.00 51.96 50.78 3f9n s ALA 34 Cb -0.15 -0.43 0.05 0.00 0.00 0.00 0.00 23.12 22.60 3f9n s ALA 34 CO 0.18 0.41 0.54 0.14 0.00 0.00 0.00 175.76 177.04 3f9n s VAL 35 N -1.81 0.01 -0.01 0.00 -7.23 0.49 -4.52 120.40 107.34 3f9n s VAL 35 Ca 0.23 -0.07 -0.23 0.00 -1.81 0.00 0.00 61.98 60.11 3f9n s VAL 35 Cb -0.08 -0.79 -0.05 0.00 0.56 0.00 0.00 36.38 36.03 3f9n s VAL 35 CO 0.12 -0.04 0.68 0.00 -0.31 0.00 0.00 175.10 175.55 3f9n s ALA 36 N -0.21 3.40 -0.21 1.32 0.00 -0.04 -0.50 121.76 125.53 3f9n s ALA 36 Ca -0.04 0.14 -0.01 0.00 0.00 0.00 0.00 51.96 52.04 3f9n s ALA 36 Cb -0.03 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 20.21 3f9n s ALA 36 CO 0.03 0.05 -0.11 0.08 0.00 0.00 0.00 175.76 175.81 3f9n s VAL 37 N 0.14 2.75 -0.34 0.00 1.01 -0.24 -0.98 120.40 122.74 3f9n s VAL 37 Ca 0.35 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.43 3f9n s VAL 37 Cb -0.19 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 3f9n s VAL 37 CO 0.19 0.43 0.31 -0.75 0.00 0.00 0.00 175.10 175.29 3f9n s LYS 38 N 1.38 3.54 -0.51 2.72 2.20 -0.15 -1.37 119.74 127.55 3f9n s LYS 38 Ca 0.05 -0.51 -0.19 0.00 -0.36 0.00 0.00 55.97 54.96 3f9n s LYS 38 Cb -0.14 -3.80 0.06 0.00 -1.51 0.00 0.00 37.83 32.44 3f9n s LYS 38 CO -0.07 -0.48 0.61 0.42 -0.36 0.00 0.00 175.35 175.46 3f9n s ILE 39 N 1.89 4.91 -0.63 5.43 1.09 0.13 -1.17 121.20 132.84 3f9n s ILE 39 Ca 0.09 -0.57 -0.12 0.00 -1.10 0.00 0.00 60.65 58.95 3f9n s ILE 39 Cb -0.17 -4.29 0.16 0.00 -1.06 0.00 0.00 42.46 37.10 3f9n s ILE 39 CO 0.11 -0.80 0.55 -0.69 -0.10 0.00 0.00 174.94 174.01 3f9n s VAL 40 N 2.54 4.93 -1.16 2.92 1.01 0.75 -2.73 120.40 128.65 3f9n s VAL 40 Ca 0.14 -2.07 -0.23 0.00 0.00 0.00 0.00 61.98 59.82 3f9n s VAL 40 Cb -0.20 -4.14 -0.11 0.00 0.00 0.00 0.00 36.38 31.93 3f9n s VAL 40 CO 0.11 -0.90 1.97 -1.81 0.00 0.00 0.00 175.10 174.47 3f9n s ASP 41 N 2.55 4.75 0.54 3.32 1.01 -1.26 -1.79 116.67 125.79 3f9n s ASP 41 Ca 0.10 -1.51 0.09 0.00 0.71 0.00 0.00 52.55 51.94 3f9n s ASP 41 Cb -0.21 -2.59 0.51 0.00 1.01 0.00 0.00 42.92 41.64 3f9n s ASP 41 CO -0.03 -3.36 1.22 -0.03 0.21 0.00 0.00 175.17 173.18 3f9n h MET 42 N 10.10 0.00 -1.81 8.23 4.05 -1.93 -3.47 114.93 130.10 3f9n h MET 42 Ca 0.18 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.60 3f9n h MET 42 Cb 0.95 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.75 3f9n h MET 42 CO 1.19 0.00 0.00 1.63 0.23 0.00 0.00 176.91 179.96 3f9n n LYS 43 N -2.36 0.57 0.00 0.39 4.76 -1.26 -5.15 118.16 115.11 3f9n n LYS 43 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 3f9n n LYS 43 Cb 0.69 -1.22 0.00 0.00 -1.84 0.00 0.00 35.03 32.66 3f9n n LYS 43 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3f9n n ASN 51 N 1.38 0.00 -0.26 4.39 2.85 -1.26 -5.20 115.26 117.15 3f9n n ASN 51 Ca 0.00 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 54.49 3f9n n ASN 51 Cb 0.28 0.00 0.10 0.00 1.24 0.00 0.00 39.78 41.41 3f9n n ASN 51 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 3f9n h ILE 52 N 0.00 0.27 -0.13 -1.44 6.09 -1.95 2.31 117.51 122.66 3f9n h ILE 52 Ca 0.00 -0.01 -0.02 0.00 -1.37 0.00 0.00 64.86 63.46 3f9n h ILE 52 Cb 0.00 0.25 -0.00 0.00 0.47 0.00 0.00 36.82 37.54 3f9n h ILE 52 CO 0.00 0.00 0.00 0.50 -3.07 0.00 0.00 178.15 175.59 3f9n h LYS 53 N 0.02 0.23 -0.45 2.19 1.63 -1.99 -1.33 116.57 116.86 3f9n h LYS 53 Ca 0.37 -0.07 -0.10 0.00 -0.85 0.00 0.00 60.65 60.00 3f9n h LYS 53 Cb 0.59 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.18 3f9n h LYS 53 CO -0.74 0.46 -0.13 -0.22 -3.45 0.00 0.00 179.45 175.37 3f9n h LYS 54 N -0.03 0.83 -0.91 1.90 3.64 -1.65 -1.47 116.57 118.87 3f9n h LYS 54 Ca 0.04 -0.29 -0.00 0.00 -1.27 0.00 0.00 60.65 59.12 3f9n h LYS 54 Cb 0.36 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 3f9n h LYS 54 CO 0.01 0.92 0.56 1.49 -2.27 0.00 0.00 179.45 180.15 3f9n h GLU 55 N 0.75 1.23 -0.14 1.90 4.81 0.40 0.44 114.58 123.97 3f9n h GLU 55 Ca 0.12 -0.11 -0.16 0.00 -0.13 0.00 0.00 59.36 59.08 3f9n h GLU 55 Cb 0.63 -0.26 0.01 0.00 0.63 0.00 0.00 28.75 29.76 3f9n h GLU 55 CO 0.04 0.86 -0.54 0.82 -0.73 0.00 0.00 179.01 179.46 3f9n h ILE 56 N 1.25 1.33 0.39 2.32 2.04 -1.07 -1.44 117.51 122.34 3f9n h ILE 56 Ca 0.33 -1.81 -0.02 0.00 1.00 0.00 0.00 64.86 64.37 3f9n h ILE 56 Cb -0.07 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 38.06 3f9n h ILE 56 CO -0.06 0.56 -0.20 0.00 0.00 0.00 0.00 178.15 178.45 3f9n h ILE 58 N -0.54 1.03 -0.61 0.00 2.04 -0.18 -2.51 117.51 116.75 3f9n h ILE 58 Ca -0.05 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.68 3f9n h ILE 58 Cb 0.42 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 3f9n h ILE 58 CO 0.08 0.11 0.41 0.78 0.00 0.00 0.00 178.15 179.52 3f9n h ASN 59 N 0.59 0.49 0.24 1.72 2.35 -1.00 -1.53 115.58 118.43 3f9n h ASN 59 Ca 0.21 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.93 3f9n h ASN 59 Cb 0.04 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 3f9n h ASN 59 CO -0.10 0.31 -0.15 0.11 -1.65 0.00 0.00 177.43 175.94 3f9n h LYS 60 N 0.55 0.00 0.00 0.81 1.79 -0.78 -2.64 116.57 116.30 3f9n h LYS 60 Ca 0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.74 3f9n h LYS 60 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 3f9n h LYS 60 CO -0.08 0.15 -0.09 -1.33 -1.08 0.00 0.00 179.45 177.03 3f9n n MET 61 N -4.04 0.27 -3.10 3.15 2.81 -0.58 -4.92 117.12 110.71 3f9n n MET 61 Ca -0.02 0.20 -0.39 0.00 -1.81 0.00 0.00 57.70 55.67 3f9n n MET 61 Cb 0.24 -1.79 -0.05 0.00 -0.71 0.00 0.00 33.22 30.90 3f9n n MET 61 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3f9n s LEU 62 N -4.50 4.45 -0.35 4.03 1.43 -1.00 -5.04 118.68 117.71 3f9n s LEU 62 Ca 0.10 1.33 0.06 0.00 -1.03 0.00 0.00 54.13 54.58 3f9n s LEU 62 Cb 0.12 -3.08 0.19 0.00 0.03 0.00 0.00 46.19 43.45 3f9n s LEU 62 CO 0.61 0.08 0.65 0.21 0.23 0.00 0.00 176.35 178.14 3f9n s ASN 63 N -0.26 -1.48 -0.12 2.29 2.47 -1.26 -4.73 114.94 111.85 3f9n s ASN 63 Ca 0.34 -0.33 -0.26 0.00 0.42 0.00 0.00 52.86 53.04 3f9n s ASN 63 Cb -0.20 1.89 0.06 0.00 -1.45 0.00 0.00 41.25 41.56 3f9n s ASN 63 CO 0.20 -0.21 0.63 -2.28 -3.72 0.00 0.00 177.10 171.72 3f9n s HIS 64 N 2.29 -0.63 0.44 0.43 2.46 -1.26 -5.04 115.29 113.98 3f9n s HIS 64 Ca 0.14 1.28 0.40 0.00 0.47 0.00 0.00 55.06 57.36 3f9n s HIS 64 Cb -0.06 0.31 2.05 0.00 -0.13 0.00 0.00 32.58 34.76 3f9n s HIS 64 CO -0.16 -0.48 2.22 1.05 -2.47 0.00 0.00 174.74 174.90 3f9n h GLU 65 N 3.91 0.00 -0.48 2.88 9.09 -1.99 -2.28 114.58 125.71 3f9n h GLU 65 Ca -0.28 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 58.94 3f9n h GLU 65 Cb 1.15 0.00 -0.11 0.00 -1.65 0.00 0.00 28.75 28.14 3f9n h GLU 65 CO 0.27 0.00 0.10 0.09 0.05 0.00 0.00 179.01 179.53 3f9n n ASN 66 N -3.01 3.39 -3.99 3.06 4.13 -1.26 -4.83 115.26 112.74 3f9n n ASN 66 Ca -0.02 -3.47 -0.21 0.00 1.68 0.00 0.00 54.58 52.56 3f9n n ASN 66 Cb 0.13 -0.66 -0.16 0.00 -1.54 0.00 0.00 39.78 37.56 3f9n n ASN 66 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3f9n s VAL 67 N -3.11 0.85 -0.05 2.41 1.01 -0.86 -0.72 120.40 119.92 3f9n s VAL 67 Ca 0.47 -0.36 -0.35 0.00 0.00 0.00 0.00 61.98 61.74 3f9n s VAL 67 Cb 0.41 -0.77 -0.13 0.00 0.00 0.00 0.00 36.38 35.88 3f9n s VAL 67 CO 0.06 0.27 1.77 0.52 0.00 0.00 0.00 175.10 177.72 3f9n n VAL 68 N 3.53 0.39 -2.00 2.92 0.31 -0.52 -4.65 118.33 118.31 3f9n n VAL 68 Ca -0.21 -0.07 -0.40 0.00 -0.01 0.00 0.00 64.34 63.65 3f9n n VAL 68 Cb 0.53 -1.65 -0.01 0.00 -0.91 0.00 0.00 33.84 31.80 3f9n n VAL 68 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 3f9n s LYS 69 N 3.13 4.11 -0.25 5.55 2.47 -1.26 -4.80 119.74 128.69 3f9n s LYS 69 Ca 0.90 2.29 -0.07 0.00 -1.56 0.00 0.00 55.97 57.53 3f9n s LYS 69 Cb -0.76 -2.91 -0.03 0.00 -1.46 0.00 0.00 37.83 32.68 3f9n s LYS 69 CO 0.50 -0.42 0.07 0.12 0.16 0.00 0.00 175.35 175.78 3f9n s PHE 70 N -1.18 3.09 -0.11 4.03 5.36 -1.26 -0.19 117.98 127.71 3f9n s PHE 70 Ca 0.53 -0.45 -0.14 0.00 -0.96 0.00 0.00 56.93 55.91 3f9n s PHE 70 Cb -0.41 -2.24 -0.26 0.00 -0.34 0.00 0.00 43.02 39.76 3f9n s PHE 70 CO 0.54 -0.37 0.49 1.88 -1.46 0.00 0.00 175.22 176.30 3f9n h TYR 71 N 8.24 0.42 0.00 10.12 0.05 -0.48 -3.49 116.97 131.84 3f9n h TYR 71 Ca -0.38 -0.31 0.00 0.00 0.05 0.00 0.00 58.73 58.09 3f9n h TYR 71 Cb 1.17 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.90 3f9n h TYR 71 CO 0.67 1.60 0.00 0.41 -1.05 0.00 0.00 178.16 179.79 3f9n n GLY 72 N 1.77 -2.42 3.45 3.88 0.00 -1.19 -5.01 105.19 105.68 3f9n n GLY 72 Ca -0.27 -1.25 -0.22 0.00 0.00 0.00 0.00 46.02 44.27 3f9n n GLY 72 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3f9n s HIS 73 N -2.16 1.82 -0.30 1.61 -3.43 -1.26 0.22 115.29 111.78 3f9n s HIS 73 Ca 0.00 -1.14 -0.04 0.00 -0.80 0.00 0.00 55.06 53.08 3f9n s HIS 73 Cb 0.00 -1.16 0.17 0.00 -1.43 0.00 0.00 32.58 30.16 3f9n s HIS 73 CO 0.00 -0.18 0.63 0.50 -2.00 0.00 0.00 174.74 173.68 3f9n s ARG 74 N -3.84 0.57 0.02 -0.38 3.52 0.18 -4.98 118.95 114.04 3f9n s ARG 74 Ca 0.31 1.15 -0.26 0.00 -0.13 0.00 0.00 55.73 56.80 3f9n s ARG 74 Cb 0.06 0.66 -0.14 0.00 -1.56 0.00 0.00 34.95 33.97 3f9n s ARG 74 CO 0.15 -0.47 1.14 0.00 -0.81 0.00 0.00 175.30 175.31 3f9n h ARG 75 N 8.00 -0.90 -6.37 5.12 3.08 -1.85 -0.37 114.38 121.08 3f9n h ARG 75 Ca -0.21 0.06 -0.43 0.00 0.07 0.00 0.00 59.98 59.47 3f9n h ARG 75 Cb 1.14 0.21 0.04 0.00 0.08 0.00 0.00 29.97 31.44 3f9n h ARG 75 CO 0.20 -0.60 -0.89 -1.91 -1.07 0.00 0.00 179.97 175.70 3f9n n GLU 76 N -5.15 -1.09 0.00 0.04 2.13 -1.26 -3.97 120.64 111.34 3f9n n GLU 76 Ca -0.12 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.24 3f9n n GLU 76 Cb 0.37 -3.64 0.00 0.00 0.27 0.00 0.00 31.44 28.44 3f9n n GLU 76 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3f9n n GLY 77 N -1.76 1.22 0.07 8.31 0.00 -1.26 -4.16 105.19 107.60 3f9n n GLY 77 Ca -0.13 -0.96 -0.03 0.00 0.00 0.00 0.00 46.02 44.90 3f9n n GLY 77 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3f9n n ASN 78 N 3.04 0.31 -4.60 1.61 4.13 -1.26 -4.89 115.26 113.60 3f9n n ASN 78 Ca 0.00 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.83 3f9n n ASN 78 Cb 0.00 1.30 -0.03 0.00 -1.54 0.00 0.00 39.78 39.51 3f9n n ASN 78 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3f9n s ILE 79 N -2.79 4.44 0.12 2.41 1.01 -1.26 -3.35 121.20 121.78 3f9n s ILE 79 Ca -0.09 1.14 -0.27 0.00 0.00 0.00 0.00 60.65 61.44 3f9n s ILE 79 Cb 0.08 -4.45 -0.07 0.00 0.01 0.00 0.00 42.46 38.04 3f9n s ILE 79 CO 0.80 -0.74 0.83 -1.58 0.00 0.00 0.00 174.94 174.25 3f9n s GLN 80 N 3.84 4.60 -0.20 2.79 2.00 -0.74 -4.36 119.66 127.59 3f9n s GLN 80 Ca 0.41 1.22 0.00 0.00 -2.00 0.00 0.00 55.36 54.99 3f9n s GLN 80 Cb -0.10 -3.32 0.02 0.00 0.80 0.00 0.00 33.01 30.41 3f9n s GLN 80 CO 0.24 0.39 -0.15 0.71 -0.50 0.00 0.00 175.29 175.98 3f9n s TYR 81 N -0.52 2.89 -0.16 1.67 1.51 -0.15 -0.18 117.35 122.42 3f9n s TYR 81 Ca 0.40 -1.61 -0.06 0.00 -1.01 0.00 0.00 57.07 54.79 3f9n s TYR 81 Cb -0.22 -1.96 -0.04 0.00 -0.11 0.00 0.00 41.96 39.62 3f9n s TYR 81 CO 0.26 -0.77 0.04 -0.51 -1.11 0.00 0.00 175.55 173.47 3f9n s LEU 82 N 1.30 3.75 -0.33 -1.29 1.02 -0.32 -0.64 118.68 122.17 3f9n s LEU 82 Ca 0.03 0.10 -0.09 0.00 0.02 0.00 0.00 54.13 54.19 3f9n s LEU 82 Cb -0.14 -1.92 0.01 0.00 0.02 0.00 0.00 46.19 44.15 3f9n s LEU 82 CO -0.10 0.23 0.15 -0.36 0.02 0.00 0.00 176.35 176.29 3f9n s PHE 83 N 0.02 3.20 0.15 0.29 0.40 0.13 -0.98 117.98 121.20 3f9n s PHE 83 Ca 0.05 -0.86 0.08 0.00 -0.60 0.00 0.00 56.93 55.60 3f9n s PHE 83 Cb -0.12 -2.35 -0.04 0.00 0.51 0.00 0.00 43.02 41.01 3f9n s PHE 83 CO 0.01 -0.57 -0.18 -0.51 0.70 0.00 0.00 175.22 174.68 3f9n s LEU 84 N 1.55 2.42 0.21 -0.37 1.43 -0.16 0.34 118.68 124.10 3f9n s LEU 84 Ca 0.03 -0.84 -0.32 0.00 -1.03 0.00 0.00 54.13 51.96 3f9n s LEU 84 Cb -0.18 -0.78 -0.14 0.00 0.03 0.00 0.00 46.19 45.13 3f9n s LEU 84 CO 0.05 -0.05 1.47 1.21 0.23 0.00 0.00 176.35 179.26 3f9n n GLU 85 N 0.38 2.04 -3.13 1.70 2.13 0.73 -0.86 120.64 123.63 3f9n n GLU 85 Ca -0.14 0.73 -0.39 0.00 0.66 0.00 0.00 57.16 58.02 3f9n n GLU 85 Cb 0.57 -2.43 -0.05 0.00 0.27 0.00 0.00 31.44 29.80 3f9n n GLU 85 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 3f9n s TYR 86 N 0.31 3.55 -0.50 4.31 5.04 -1.26 -4.51 117.35 124.29 3f9n s TYR 86 Ca 0.73 1.12 -0.01 0.00 -2.44 0.00 0.00 57.07 56.47 3f9n s TYR 86 Cb -0.67 -2.72 0.13 0.00 0.35 0.00 0.00 41.96 39.05 3f9n s TYR 86 CO 0.45 0.11 0.28 0.00 -1.34 0.00 0.00 175.55 175.05 3f9n h SER 88 N 7.37 0.00 0.94 0.00 4.64 -1.83 -2.84 113.55 121.84 3f9n h SER 88 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 3f9n h SER 88 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3f9n h SER 88 CO 0.68 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 177.28 3f9n n GLY 89 N -0.87 -1.38 4.19 -0.77 0.00 0.10 -4.93 105.19 101.53 3f9n n GLY 89 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3f9n n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f9n n GLY 90 N 0.73 -1.22 3.86 -0.02 0.00 -1.07 -4.68 105.19 102.79 3f9n n GLY 90 Ca 0.05 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.19 3f9n n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3f9n s GLU 91 N 0.00 3.77 0.42 1.61 2.02 -1.26 0.13 118.70 125.38 3f9n s GLU 91 Ca 0.00 0.19 0.10 0.00 0.02 0.00 0.00 54.97 55.28 3f9n s GLU 91 Cb 0.00 -3.02 0.92 0.00 0.10 0.00 0.00 34.13 32.13 3f9n s GLU 91 CO 0.00 0.58 2.02 1.25 0.02 0.00 0.00 175.26 179.12 3f9n h LEU 92 N 3.83 0.44 -1.12 1.80 5.85 -0.34 -1.00 115.31 124.78 3f9n h LEU 92 Ca -0.49 -0.00 0.24 0.00 0.84 0.00 0.00 57.88 58.46 3f9n h LEU 92 Cb 1.20 -0.10 -0.11 0.00 0.37 0.00 0.00 40.66 42.02 3f9n h LEU 92 CO 0.66 0.30 0.62 0.15 -0.34 0.00 0.00 178.44 179.82 3f9n h PHE 93 N 0.51 0.92 0.00 1.25 3.04 -1.70 0.33 116.94 121.28 3f9n h PHE 93 Ca 0.22 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.20 3f9n h PHE 93 Cb 0.22 -0.27 0.00 0.00 2.56 0.00 0.00 35.95 38.47 3f9n h PHE 93 CO -0.00 0.11 0.00 -0.25 -2.02 0.00 0.00 178.31 176.15 3f9n n ASP 94 N -4.78 0.00 -0.71 0.41 10.43 -0.38 -2.79 116.55 118.74 3f9n n ASP 94 Ca 0.25 -0.73 0.11 0.00 2.57 0.00 0.00 54.79 56.99 3f9n n ASP 94 Cb 0.74 -0.07 0.05 0.00 1.84 0.00 0.00 41.12 43.68 3f9n n ASP 94 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3f9n n ARG 95 N -1.07 1.75 -3.48 -1.24 5.12 0.11 -4.86 116.66 113.00 3f9n n ARG 95 Ca 0.20 -1.43 -0.40 0.00 -1.93 0.00 0.00 57.85 54.29 3f9n n ARG 95 Cb 0.13 -1.45 -0.10 0.00 -1.16 0.00 0.00 32.46 29.88 3f9n n ARG 95 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3f9n s ILE 96 N -2.17 5.24 -0.15 0.55 1.01 -1.12 -4.73 121.20 119.83 3f9n s ILE 96 Ca 0.22 -0.01 -0.28 0.00 0.00 0.00 0.00 60.65 60.59 3f9n s ILE 96 Cb 0.18 -3.73 -0.01 0.00 0.01 0.00 0.00 42.46 38.92 3f9n s ILE 96 CO 0.42 0.01 0.95 -0.70 0.00 0.00 0.00 174.94 175.62 3f9n s GLU 97 N 1.86 4.35 0.23 2.79 2.56 -0.64 -4.88 118.70 124.97 3f9n s GLU 97 Ca 0.09 1.25 -0.31 0.00 0.00 0.00 0.00 54.97 56.00 3f9n s GLU 97 Cb -0.17 -3.57 -0.14 0.00 2.00 0.00 0.00 34.13 32.25 3f9n s GLU 97 CO 0.11 -0.38 1.36 -2.30 -0.56 0.00 0.00 175.26 173.49 3f9n n PRO 98 N 5.35 1.89 -0.13 4.30 -0.02 -1.26 -0.55 135.00 144.59 3f9n n PRO 98 Ca 0.08 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3f9n n PRO 98 Cb 0.48 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 3f9n n PRO 98 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3f9n n ASP 99 N 2.10 0.00 -0.02 2.55 2.03 0.71 -4.70 116.55 119.21 3f9n n ASP 99 Ca 0.12 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.38 3f9n n ASP 99 Cb 0.30 -0.57 -0.02 0.00 -0.72 0.00 0.00 41.12 40.11 3f9n n ASP 99 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 3f9n n ILE 100 N -2.00 0.31 0.00 5.18 5.41 0.29 -4.68 119.36 123.87 3f9n n ILE 100 Ca 0.00 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.69 3f9n n ILE 100 Cb 0.00 -1.57 0.00 0.00 -0.71 0.00 0.00 39.64 37.36 3f9n n ILE 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3f9n n GLY 101 N 2.70 0.82 3.76 7.39 0.00 -0.15 -3.93 105.19 115.78 3f9n n GLY 101 Ca -0.10 -1.42 -0.08 0.00 0.00 0.00 0.00 46.02 44.42 3f9n n GLY 101 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3f9n s MET 102 N 0.00 1.68 0.36 1.61 0.23 -0.20 -1.62 119.30 121.37 3f9n s MET 102 Ca 0.00 -0.93 -0.28 0.00 -1.03 0.00 0.00 55.69 53.44 3f9n s MET 102 Cb 0.00 0.59 -0.11 0.00 -1.53 0.00 0.00 34.83 33.78 3f9n s MET 102 CO 0.00 -0.76 1.49 -2.14 -2.03 0.00 0.00 175.02 171.58 3f9n s PRO 103 N -3.90 4.13 0.29 3.16 0.02 -1.26 -4.79 135.00 132.65 3f9n s PRO 103 Ca 0.10 2.54 0.03 0.00 0.02 0.00 0.00 61.00 63.70 3f9n s PRO 103 Cb -0.05 -2.98 0.68 0.00 0.02 0.00 0.00 34.50 32.17 3f9n s PRO 103 CO 0.04 -0.52 1.74 1.49 -0.33 0.00 0.00 177.00 179.42 3f9n h GLU 104 N 3.26 0.57 -0.76 5.54 4.81 -1.97 -1.10 114.58 124.94 3f9n h GLU 104 Ca -0.50 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.66 3f9n h GLU 104 Cb 1.24 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 3f9n h GLU 104 CO 0.66 0.38 0.34 -1.35 -0.73 0.00 0.00 179.01 178.31 3f9n h PRO 105 N 0.59 1.09 -0.36 0.92 0.11 -1.89 0.24 132.00 132.69 3f9n h PRO 105 Ca 0.54 -0.17 -0.10 0.00 0.11 0.00 0.00 66.00 66.38 3f9n h PRO 105 Cb 0.89 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 3f9n h PRO 105 CO -0.43 0.86 -0.17 -0.44 -0.21 0.00 0.00 178.00 177.61 3f9n h ASP 106 N 1.08 0.78 -0.55 -2.05 3.45 -1.60 -2.06 116.42 115.47 3f9n h ASP 106 Ca 0.26 -0.40 -0.01 0.00 0.43 0.00 0.00 57.03 57.31 3f9n h ASP 106 Cb 0.14 -0.21 -0.03 0.00 -0.56 0.00 0.00 39.33 38.67 3f9n h ASP 106 CO -0.03 1.01 0.32 0.00 -1.57 0.00 0.00 179.24 178.97 3f9n h ALA 107 N 0.80 0.71 -0.75 3.45 0.00 -0.68 -1.04 119.26 121.74 3f9n h ALA 107 Ca 0.08 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3f9n h ALA 107 Cb 0.71 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 3f9n h ALA 107 CO 0.05 0.21 0.43 0.37 0.00 0.00 0.00 179.25 180.31 3f9n h GLN 108 N 0.74 1.04 -0.55 0.00 4.15 -0.40 0.84 115.11 120.93 3f9n h GLN 108 Ca 0.20 -0.11 -0.05 0.00 0.77 0.00 0.00 58.65 59.46 3f9n h GLN 108 Cb 0.01 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.47 3f9n h GLN 108 CO -0.03 0.76 0.16 -0.09 -1.93 0.00 0.00 178.83 177.70 3f9n h ARG 109 N 1.04 0.86 -0.68 1.69 2.43 -1.09 0.16 114.38 118.79 3f9n h ARG 109 Ca 0.27 -0.19 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 3f9n h ARG 109 Cb 0.01 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 3f9n h ARG 109 CO -0.05 0.79 0.14 0.74 -1.51 0.00 0.00 179.97 180.08 3f9n h PHE 110 N 0.76 1.15 -0.62 2.20 0.04 -0.99 -1.79 116.94 117.69 3f9n h PHE 110 Ca 0.17 -0.15 -0.08 0.00 2.80 0.00 0.00 57.97 60.71 3f9n h PHE 110 Cb 0.30 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 3f9n h PHE 110 CO 0.02 0.95 0.05 0.35 -0.60 0.00 0.00 178.31 179.08 3f9n h PHE 111 N 1.03 1.12 -0.57 -0.55 3.57 -0.41 0.12 116.94 121.26 3f9n h PHE 111 Ca 0.21 -0.17 0.03 0.00 3.53 0.00 0.00 57.97 61.57 3f9n h PHE 111 Cb 0.40 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 3f9n h PHE 111 CO 0.03 0.97 0.34 0.45 -2.23 0.00 0.00 178.31 177.87 3f9n h HIS 112 N 0.97 0.64 -0.37 0.41 3.86 -0.27 -1.16 115.15 119.24 3f9n h HIS 112 Ca 0.18 0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.28 3f9n h HIS 112 Cb 0.48 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 3f9n h HIS 112 CO 0.03 0.36 -0.31 1.96 0.86 0.00 0.00 177.93 180.83 3f9n h GLN 113 N 0.67 0.80 -0.65 2.45 4.20 -1.00 -1.53 115.11 120.05 3f9n h GLN 113 Ca 0.23 -0.38 0.01 0.00 0.06 0.00 0.00 58.65 58.57 3f9n h GLN 113 Cb 0.03 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 3f9n h GLN 113 CO -0.10 1.01 0.43 1.25 -0.67 0.00 0.00 178.83 180.74 3f9n h LEU 114 N 0.68 0.75 -0.71 1.46 5.85 -0.48 -1.17 115.31 121.69 3f9n h LEU 114 Ca 0.07 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.67 3f9n h LEU 114 Cb 0.86 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 3f9n h LEU 114 CO 0.08 0.55 -0.06 0.24 -0.34 0.00 0.00 178.44 178.90 3f9n h MET 115 N 0.88 0.92 -0.45 1.25 2.86 -1.02 0.11 114.93 119.49 3f9n h MET 115 Ca 0.24 -0.30 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 3f9n h MET 115 Cb -0.09 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 3f9n h MET 115 CO -0.05 0.96 0.26 0.00 1.06 0.00 0.00 176.91 179.14 3f9n h ALA 116 N 1.08 0.57 -0.44 6.32 0.00 -0.84 0.18 119.26 126.12 3f9n h ALA 116 Ca 0.14 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 3f9n h ALA 116 Cb 0.59 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3f9n h ALA 116 CO 0.04 -0.06 0.02 0.78 0.00 0.00 0.00 179.25 180.03 3f9n h GLY 117 N 0.52 0.83 1.02 0.00 0.00 -0.71 -2.30 103.07 102.43 3f9n h GLY 117 Ca 0.18 -0.60 -0.09 0.00 0.00 0.00 0.00 47.33 46.82 3f9n h GLY 117 CO -0.09 0.55 -0.05 -2.08 0.00 0.00 0.00 176.54 174.87 3f9n h VAL 118 N 0.62 1.27 -0.60 4.60 2.07 -0.48 -1.58 116.25 122.15 3f9n h VAL 118 Ca 0.13 -1.15 0.07 0.00 0.82 0.00 0.00 66.70 66.57 3f9n h VAL 118 Cb 0.46 1.05 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 3f9n h VAL 118 CO 0.02 0.40 0.29 0.58 0.02 0.00 0.00 177.57 178.88 3f9n h VAL 119 N 0.73 0.89 -0.03 2.57 2.07 -0.60 0.14 116.25 122.02 3f9n h VAL 119 Ca 0.13 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 3f9n h VAL 119 Cb 0.58 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3f9n h VAL 119 CO 0.03 0.10 0.02 0.22 0.02 0.00 0.00 177.57 177.96 3f9n h TYR 120 N 0.53 0.04 0.13 1.57 3.20 -1.06 0.13 116.97 121.50 3f9n h TYR 120 Ca 0.28 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.15 3f9n h TYR 120 Cb 0.25 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.50 3f9n h TYR 120 CO -0.12 0.06 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.33 3f9n h LEU 121 N 0.00 -0.16 -1.46 2.82 3.38 -0.93 -1.76 115.31 117.20 3f9n h LEU 121 Ca 0.01 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3f9n h LEU 121 Cb 0.03 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3f9n h LEU 121 CO -0.00 -0.11 -0.12 0.45 0.09 0.00 0.00 178.44 178.75 3f9n h HIS 122 N -0.18 0.21 -0.16 1.13 3.86 -0.66 0.38 115.15 119.72 3f9n h HIS 122 Ca -0.02 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.17 3f9n h HIS 122 Cb 0.14 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 3f9n h HIS 122 CO -0.07 0.33 0.10 0.78 0.86 0.00 0.00 177.93 179.92 3f9n h GLY 123 N 0.68 0.23 -2.57 2.45 0.00 0.13 -0.94 103.07 103.05 3f9n h GLY 123 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3f9n h GLY 123 CO 0.02 0.09 0.00 0.29 0.00 0.00 0.00 176.54 176.94 3f9n n ILE 124 N -4.51 0.95 -1.19 2.60 -5.35 -0.86 -4.95 119.36 106.06 3f9n n ILE 124 Ca -0.01 -0.97 0.00 0.00 -0.27 0.00 0.00 62.75 61.50 3f9n n ILE 124 Cb 0.08 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 38.53 3f9n n ILE 124 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3f9n n GLY 125 N 1.56 0.45 3.58 3.28 0.00 -0.36 -4.91 105.19 108.79 3f9n n GLY 125 Ca 0.23 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.95 3f9n n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f9n s ILE 126 N -2.00 3.85 -0.07 -0.61 1.01 0.07 -0.85 121.20 122.59 3f9n s ILE 126 Ca 0.00 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.27 3f9n s ILE 126 Cb 0.00 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.84 3f9n s ILE 126 CO 0.00 0.57 -0.14 0.28 0.00 0.00 0.00 174.94 175.66 3f9n s THR 127 N -0.53 3.07 -0.02 2.92 -1.32 -0.59 -3.24 115.64 115.94 3f9n s THR 127 Ca 0.08 -0.71 -0.20 0.00 -1.21 0.00 0.00 61.69 59.66 3f9n s THR 127 Cb -0.12 -2.22 -0.32 0.00 -1.51 0.00 0.00 72.50 68.33 3f9n s THR 127 CO 0.02 0.58 0.95 -0.74 -2.21 0.00 0.00 174.62 173.21 3f9n h HIS 128 N 5.64 0.68 0.00 9.09 2.76 -1.91 -1.95 115.15 129.46 3f9n h HIS 128 Ca -0.42 -0.48 0.00 0.00 -2.20 0.00 0.00 60.37 57.27 3f9n h HIS 128 Cb 1.17 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 30.09 3f9n h HIS 128 CO 0.50 1.37 0.00 0.54 -1.30 0.00 0.00 177.93 179.04 3f9n n ARG 129 N -4.02 0.00 -2.72 5.26 1.74 -1.26 -3.11 116.66 112.54 3f9n n ARG 129 Ca -0.14 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 56.89 3f9n n ARG 129 Cb 0.89 -2.99 0.07 0.00 -1.02 0.00 0.00 32.46 29.40 3f9n n ARG 129 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3f9n n ASP 130 N 0.00 0.35 -4.70 0.55 4.64 -1.26 -3.63 116.55 112.51 3f9n n ASP 130 Ca 0.00 -2.37 -0.42 0.00 -1.38 0.00 0.00 54.79 50.62 3f9n n ASP 130 Cb 0.00 -0.01 -0.03 0.00 -1.04 0.00 0.00 41.12 40.04 3f9n n ASP 130 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 3f9n s ILE 131 N -2.15 3.51 0.06 5.18 1.01 -1.26 -4.83 121.20 122.72 3f9n s ILE 131 Ca 0.23 0.97 -0.27 0.00 0.00 0.00 0.00 60.65 61.57 3f9n s ILE 131 Cb 0.40 -3.62 0.09 0.00 0.01 0.00 0.00 42.46 39.34 3f9n s ILE 131 CO -0.04 0.02 0.97 -1.59 0.00 0.00 0.00 174.94 174.30 3f9n s LYS 132 N 2.05 0.93 0.59 2.79 -2.85 -1.26 -4.80 119.74 117.20 3f9n s LYS 132 Ca 0.65 -0.45 0.36 0.00 -1.00 0.00 0.00 55.97 55.53 3f9n s LYS 132 Cb -0.34 0.36 1.83 0.00 -2.06 0.00 0.00 37.83 37.62 3f9n s LYS 132 CO 0.28 -0.42 2.18 -1.35 0.10 0.00 0.00 175.35 176.14 3f9n h PRO 133 N 2.00 0.00 0.00 1.78 0.11 -1.93 -0.17 132.00 133.79 3f9n h PRO 133 Ca -0.23 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.82 3f9n h PRO 133 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3f9n h PRO 133 CO 0.28 0.04 -0.27 0.93 -0.21 0.00 0.00 178.00 178.76 3f9n h GLU 134 N 0.00 0.00 -0.70 1.05 3.07 -1.95 -2.61 114.58 113.44 3f9n h GLU 134 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3f9n h GLU 134 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 3f9n h GLU 134 CO 0.00 0.27 0.00 0.09 -1.40 0.00 0.00 179.01 177.97 3f9n n ASN 135 N -3.70 3.86 -4.06 1.42 3.02 -0.08 -4.75 115.26 110.96 3f9n n ASN 135 Ca -0.01 -2.00 -0.33 0.00 -0.03 0.00 0.00 54.58 52.21 3f9n n ASN 135 Cb 0.38 -0.46 -0.14 0.00 -0.61 0.00 0.00 39.78 38.95 3f9n n ASN 135 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3f9n s LEU 136 N -1.05 4.68 0.41 3.41 1.43 -1.05 -0.23 118.68 126.28 3f9n s LEU 136 Ca 0.48 -1.98 0.03 0.00 -1.03 0.00 0.00 54.13 51.63 3f9n s LEU 136 Cb 0.25 -1.68 -0.00 0.00 0.03 0.00 0.00 46.19 44.79 3f9n s LEU 136 CO 0.33 -0.39 0.60 -0.76 0.23 0.00 0.00 176.35 176.36 3f9n s LEU 137 N 1.01 3.76 -0.05 1.79 1.43 0.27 -0.01 118.68 126.88 3f9n s LEU 137 Ca 0.07 0.10 0.05 0.00 -1.03 0.00 0.00 54.13 53.32 3f9n s LEU 137 Cb -0.20 -3.00 -0.01 0.00 0.03 0.00 0.00 46.19 43.01 3f9n s LEU 137 CO -0.06 -0.62 -0.20 -0.76 0.23 0.00 0.00 176.35 174.94 3f9n s LEU 138 N -4.42 1.98 0.00 1.79 1.43 0.12 0.18 118.68 119.76 3f9n s LEU 138 Ca 0.47 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 53.14 3f9n s LEU 138 Cb -0.10 -1.15 0.01 0.00 0.03 0.00 0.00 46.19 44.98 3f9n s LEU 138 CO 0.35 0.18 0.09 -0.90 0.23 0.00 0.00 176.35 176.31 3f9n n ASP 139 N 3.12 0.05 -0.16 2.29 3.85 -0.61 0.01 116.55 125.11 3f9n n ASP 139 Ca -0.18 -1.06 0.07 0.00 -0.71 0.00 0.00 54.79 52.91 3f9n n ASP 139 Cb 0.53 -0.06 0.37 0.00 -1.35 0.00 0.00 41.12 40.60 3f9n n ASP 139 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 3f9n h GLU 140 N 0.00 0.69 -0.77 0.11 9.09 -1.91 -0.64 114.58 121.15 3f9n h GLU 140 Ca -0.03 -0.04 -0.09 0.00 0.05 0.00 0.00 59.36 59.25 3f9n h GLU 140 Cb 0.09 -0.16 -0.06 0.00 -1.65 0.00 0.00 28.75 26.98 3f9n h GLU 140 CO 0.02 0.45 0.12 0.54 0.05 0.00 0.00 179.01 180.20 3f9n n ARG 141 N -4.48 3.42 -2.88 1.06 1.74 -1.26 -4.91 116.66 109.35 3f9n n ARG 141 Ca 0.10 -2.31 -0.22 0.00 -0.77 0.00 0.00 57.85 54.65 3f9n n ARG 141 Cb 0.22 -2.02 0.02 0.00 -1.02 0.00 0.00 32.46 29.66 3f9n n ARG 141 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3f9n n ASP 142 N 0.17 -5.86 -4.74 0.55 9.92 -0.25 -4.97 116.55 111.38 3f9n n ASP 142 Ca 0.26 -0.22 -0.39 0.00 -0.53 0.00 0.00 54.79 53.92 3f9n n ASP 142 Cb 1.06 -4.78 -0.05 0.00 -0.64 0.00 0.00 41.12 36.71 3f9n n ASP 142 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 3f9n s ASN 143 N -2.53 6.97 0.25 -2.24 0.02 -1.26 -4.80 114.94 111.34 3f9n s ASN 143 Ca 0.23 1.16 -0.30 0.00 -1.02 0.00 0.00 52.86 52.94 3f9n s ASN 143 Cb -0.10 -2.38 -0.09 0.00 0.02 0.00 0.00 41.25 38.69 3f9n s ASN 143 CO 0.29 0.00 1.03 -0.22 0.02 0.00 0.00 177.10 178.22 3f9n s LEU 144 N 0.27 4.58 -0.06 0.60 0.20 -1.26 -1.57 118.68 121.44 3f9n s LEU 144 Ca 0.34 2.11 0.00 0.00 0.69 0.00 0.00 54.13 57.27 3f9n s LEU 144 Cb -0.18 -3.62 0.02 0.00 -0.43 0.00 0.00 46.19 41.99 3f9n s LEU 144 CO 0.17 -0.03 -0.05 -0.54 -0.29 0.00 0.00 176.35 175.61 3f9n s LYS 145 N -1.17 1.03 0.01 1.98 -0.14 0.13 -4.42 119.74 117.16 3f9n s LYS 145 Ca 0.44 -0.13 -0.30 0.00 -1.36 0.00 0.00 55.97 54.62 3f9n s LYS 145 Cb -0.29 -1.08 -0.05 0.00 -1.68 0.00 0.00 37.83 34.73 3f9n s LYS 145 CO 0.36 -0.14 1.26 0.42 -0.76 0.00 0.00 175.35 176.49 3f9n s ILE 146 N 1.24 3.97 0.19 2.17 1.01 0.10 -0.56 121.20 129.31 3f9n s ILE 146 Ca -0.06 1.37 0.11 0.00 0.00 0.00 0.00 60.65 62.08 3f9n s ILE 146 Cb -0.14 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 3f9n s ILE 146 CO -0.02 0.05 -0.24 -0.55 0.00 0.00 0.00 174.94 174.18 3f9n s SER 147 N 1.40 3.39 -0.09 3.58 0.15 0.67 -1.44 113.70 121.36 3f9n s SER 147 Ca 0.59 -0.86 -0.02 0.00 0.70 0.00 0.00 55.95 56.37 3f9n s SER 147 Cb -0.29 -0.25 0.01 0.00 -1.71 0.00 0.00 66.02 63.78 3f9n s SER 147 CO 0.26 0.12 0.03 -0.67 1.20 0.00 0.00 173.24 174.18 3f9n n ASP 148 N 0.32 -3.12 -2.05 5.45 4.64 -1.26 -4.80 116.55 115.73 3f9n n ASP 148 Ca -0.13 0.48 -0.10 0.00 -1.38 0.00 0.00 54.79 53.66 3f9n n ASP 148 Cb 0.56 -2.48 0.28 0.00 -1.04 0.00 0.00 41.12 38.44 3f9n n ASP 148 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 3f9n n PHE 149 N 0.36 2.60 0.21 -0.67 3.01 -1.26 -4.46 117.46 117.26 3f9n n PHE 149 Ca -0.05 -1.36 0.06 0.00 1.01 0.00 0.00 57.45 57.11 3f9n n PHE 149 Cb 0.08 -0.75 0.48 0.00 -0.01 0.00 0.00 39.48 39.28 3f9n n PHE 149 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3f9n h GLY 150 N 2.27 0.00 -1.38 1.37 0.00 -1.91 -2.68 103.07 100.74 3f9n h GLY 150 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 3f9n h GLY 150 CO 0.83 0.00 -0.05 1.04 0.00 0.00 0.00 176.54 178.35 3f9n n LEU 151 N -3.97 2.41 -4.78 3.11 4.77 -1.26 -4.27 117.00 113.02 3f9n n LEU 151 Ca -0.02 -0.96 -0.33 0.00 -0.03 0.00 0.00 56.01 54.67 3f9n n LEU 151 Cb 0.34 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.47 3f9n n LEU 151 CO 0.36 0.42 0.73 0.00 -1.33 0.00 0.00 177.39 177.57 3f9n s ALA 152 N -1.61 2.51 0.20 -1.18 0.00 -1.01 -4.67 121.76 115.99 3f9n s ALA 152 Ca 0.20 0.44 -0.13 0.00 0.00 0.00 0.00 51.96 52.48 3f9n s ALA 152 Cb 0.15 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 20.00 3f9n s ALA 152 CO 0.26 -1.24 0.42 -0.08 0.00 0.00 0.00 175.76 175.13 3f9n s THR 153 N -2.49 0.04 -0.10 0.00 -1.32 -0.73 -4.90 115.64 106.13 3f9n s THR 153 Ca 0.65 -1.15 -0.21 0.00 -1.21 0.00 0.00 61.69 59.77 3f9n s THR 153 Cb -0.19 -1.81 -0.04 0.00 -1.51 0.00 0.00 72.50 68.95 3f9n s THR 153 CO 0.43 -0.16 0.58 -0.69 -2.21 0.00 0.00 174.62 172.57 3f9n s VAL 154 N -3.94 5.12 -0.34 5.08 1.01 -1.26 -1.54 120.40 124.52 3f9n s VAL 154 Ca 0.15 1.18 0.05 0.00 0.00 0.00 0.00 61.98 63.36 3f9n s VAL 154 Cb 0.01 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 3f9n s VAL 154 CO 0.01 0.28 0.34 2.22 0.00 0.00 0.00 175.10 177.95 3f9n n PHE 155 N 3.79 0.00 -3.74 5.22 -1.74 -0.03 -4.93 117.46 116.03 3f9n n PHE 155 Ca -0.04 0.00 -0.15 0.00 -0.56 0.00 0.00 57.45 56.69 3f9n n PHE 155 Cb 0.51 0.00 -0.16 0.00 1.52 0.00 0.00 39.48 41.36 3f9n n PHE 155 CO 0.00 0.00 0.00 0.50 -0.56 0.00 0.00 176.76 176.70 3f9n s ARG 156 N -1.09 -0.01 -0.13 3.97 3.52 -1.17 -0.27 118.95 123.77 3f9n s ARG 156 Ca 0.03 0.29 -0.08 0.00 -0.13 0.00 0.00 55.73 55.84 3f9n s ARG 156 Cb 0.04 -0.27 0.05 0.00 -1.56 0.00 0.00 34.95 33.20 3f9n s ARG 156 CO 0.14 -0.20 0.32 -0.47 -0.81 0.00 0.00 175.30 174.28 3f9n s TYR 157 N 1.34 -0.43 -1.48 5.12 5.04 -0.59 -4.67 117.35 121.69 3f9n s TYR 157 Ca -0.06 0.97 -0.11 0.00 -2.44 0.00 0.00 57.07 55.43 3f9n s TYR 157 Cb -0.12 0.14 0.06 0.00 0.35 0.00 0.00 41.96 42.39 3f9n s TYR 157 CO -0.04 -0.26 0.91 0.09 -1.34 0.00 0.00 175.55 174.92 3f9n n ASN 158 N 3.96 -5.14 -1.19 4.32 5.03 -1.26 -1.31 115.26 119.67 3f9n n ASN 158 Ca -0.22 -0.63 -0.16 0.00 0.87 0.00 0.00 54.58 54.45 3f9n n ASN 158 Cb 0.55 -4.11 -0.07 0.00 -1.02 0.00 0.00 39.78 35.13 3f9n n ASN 158 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 3f9n n ASN 159 N -2.76 -5.26 -4.27 6.41 5.15 -1.26 -4.97 115.26 108.30 3f9n n ASN 159 Ca 0.01 0.39 -0.33 0.00 -0.60 0.00 0.00 54.58 54.05 3f9n n ASN 159 Cb 0.54 -4.13 -0.16 0.00 -0.53 0.00 0.00 39.78 35.50 3f9n n ASN 159 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3f9n s ARG 160 N -3.28 3.19 0.06 1.20 1.81 -0.42 -5.11 118.95 116.40 3f9n s ARG 160 Ca 0.00 -0.78 -0.21 0.00 -1.72 0.00 0.00 55.73 53.02 3f9n s ARG 160 Cb 0.00 -2.50 -0.06 0.00 -0.45 0.00 0.00 34.95 31.94 3f9n s ARG 160 CO 0.00 0.13 0.61 -2.00 -0.68 0.00 0.00 175.30 173.37 3f9n s GLU 161 N 0.50 4.30 -0.13 3.54 2.12 -1.26 -1.54 118.70 126.23 3f9n s GLU 161 Ca -0.12 0.81 -0.02 0.00 0.36 0.00 0.00 54.97 56.00 3f9n s GLU 161 Cb -0.16 -3.28 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 3f9n s GLU 161 CO 0.05 0.53 -0.06 -0.98 -0.54 0.00 0.00 175.26 174.26 3f9n s ARG 162 N -0.77 3.43 0.47 4.30 1.70 0.62 -4.98 118.95 123.72 3f9n s ARG 162 Ca 0.31 -0.54 -0.22 0.00 -0.47 0.00 0.00 55.73 54.80 3f9n s ARG 162 Cb -0.20 -2.81 -0.08 0.00 -0.57 0.00 0.00 34.95 31.30 3f9n s ARG 162 CO 0.20 0.34 1.12 -0.51 -1.08 0.00 0.00 175.30 175.36 3f9n s LEU 163 N 0.09 3.97 0.34 -1.89 1.43 -1.26 -4.72 118.68 116.63 3f9n s LEU 163 Ca -0.01 2.18 0.05 0.00 -1.03 0.00 0.00 54.13 55.32 3f9n s LEU 163 Cb -0.14 -4.33 -0.01 0.00 0.03 0.00 0.00 46.19 41.74 3f9n s LEU 163 CO 0.03 -0.87 0.48 -0.76 0.23 0.00 0.00 176.35 175.46 3f9n s LEU 164 N -3.15 3.98 0.00 1.79 1.43 0.29 -4.85 118.68 118.16 3f9n s LEU 164 Ca 0.65 -0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.67 3f9n s LEU 164 Cb -0.25 -2.83 0.00 0.00 0.03 0.00 0.00 46.19 43.14 3f9n s LEU 164 CO 0.30 -0.42 0.00 -0.46 0.23 0.00 0.00 176.35 176.00 3f9n n ASN 165 N -1.67 0.00 -4.73 2.29 0.23 -1.26 -0.88 115.26 109.23 3f9n n ASN 165 Ca -0.01 0.00 -0.41 0.00 -0.53 0.00 0.00 54.58 53.63 3f9n n ASN 165 Cb 0.58 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.24 3f9n n ASN 165 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 3f9n s LYS 166 N 0.00 4.60 -0.46 -3.83 2.20 -1.26 -4.92 119.74 116.07 3f9n s LYS 166 Ca 0.00 1.67 -0.29 0.00 -0.36 0.00 0.00 55.97 57.00 3f9n s LYS 166 Cb 0.00 -3.30 0.02 0.00 -1.51 0.00 0.00 37.83 33.04 3f9n s LYS 166 CO 0.00 0.08 1.35 -1.64 -0.36 0.00 0.00 175.35 174.78 3f9n s MET 167 N -0.22 3.55 0.04 4.03 -1.94 -1.26 -4.98 119.30 118.52 3f9n s MET 167 Ca 0.49 0.76 0.01 0.00 -1.71 0.00 0.00 55.69 55.24 3f9n s MET 167 Cb -0.28 -4.02 -0.03 0.00 2.01 0.00 0.00 34.83 32.51 3f9n s MET 167 CO 0.34 -1.60 -0.05 0.00 -0.01 0.00 0.00 175.02 173.70 3f9n n GLY 169 N 1.17 0.45 2.82 0.00 0.00 -1.24 -4.95 105.19 103.43 3f9n n GLY 169 Ca -0.21 -2.28 -0.23 0.00 0.00 0.00 0.00 46.02 43.30 3f9n n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f9n s THR 170 N -0.08 0.53 0.25 2.61 2.01 -1.26 -5.04 115.64 114.65 3f9n s THR 170 Ca 0.00 0.00 -0.12 0.00 0.31 0.00 0.00 61.69 61.89 3f9n s THR 170 Cb 0.00 -0.63 0.36 0.00 0.01 0.00 0.00 72.50 72.23 3f9n s THR 170 CO 0.00 0.27 1.57 -0.07 -0.69 0.00 0.00 174.62 175.70 3f9n h LEU 171 N 8.10 -1.01 -2.36 4.42 3.38 -1.95 0.57 115.31 126.45 3f9n h LEU 171 Ca -0.25 0.28 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3f9n h LEU 171 Cb 1.13 0.62 -0.00 0.00 0.09 0.00 0.00 40.66 42.50 3f9n h LEU 171 CO 0.32 -0.30 -0.02 -0.65 0.09 0.00 0.00 178.44 177.88 3f9n h PRO 172 N -0.01 0.00 0.00 1.13 0.11 -1.77 -2.69 132.00 128.77 3f9n h PRO 172 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 3f9n h PRO 172 Cb 0.65 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.76 3f9n h PRO 172 CO -0.95 0.02 -0.99 0.66 -0.21 0.00 0.00 178.00 176.53 3f9n n TYR 173 N -3.89 0.00 -2.64 0.65 4.01 0.12 -4.82 117.16 110.59 3f9n n TYR 173 Ca -0.03 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.34 3f9n n TYR 173 Cb 0.10 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.07 3f9n n TYR 173 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3f9n s VAL 174 N -2.95 3.90 0.46 -0.72 0.11 -0.76 -3.72 120.40 116.70 3f9n s VAL 174 Ca 0.07 1.58 -0.22 0.00 -2.93 0.00 0.00 61.98 60.48 3f9n s VAL 174 Cb 0.15 -3.88 -0.08 0.00 -1.53 0.00 0.00 36.38 31.05 3f9n s VAL 174 CO 0.84 0.13 1.10 0.00 -3.33 0.00 0.00 175.10 173.85 3f9n s ALA 175 N -1.55 2.95 0.47 1.54 0.00 -1.26 -4.59 121.76 119.31 3f9n s ALA 175 Ca 0.52 0.79 0.14 0.00 0.00 0.00 0.00 51.96 53.41 3f9n s ALA 175 Cb -0.22 -3.32 1.08 0.00 0.00 0.00 0.00 23.12 20.66 3f9n s ALA 175 CO 0.28 -0.47 2.05 -1.00 0.00 0.00 0.00 175.76 176.62 3f9n h PRO 176 N 1.97 0.05 0.00 0.00 0.13 -1.87 -2.46 132.00 129.81 3f9n h PRO 176 Ca -0.49 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.62 3f9n h PRO 176 Cb 1.23 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 3f9n h PRO 176 CO 0.60 0.14 -0.08 1.05 -0.23 0.00 0.00 178.00 179.48 3f9n h GLU 177 N 0.05 0.00 -0.08 0.86 9.09 -1.91 -1.38 114.58 121.20 3f9n h GLU 177 Ca 0.01 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 59.35 3f9n h GLU 177 Cb 0.18 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.27 3f9n h GLU 177 CO 0.01 0.08 -0.30 1.25 0.05 0.00 0.00 179.01 180.10 3f9n h LEU 178 N 0.00 0.14 0.00 3.06 6.46 -1.74 0.20 115.31 123.44 3f9n h LEU 178 Ca -0.00 -0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.72 3f9n h LEU 178 Cb 0.15 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.04 3f9n h LEU 178 CO 0.01 0.44 -0.42 0.18 -0.62 0.00 0.00 178.44 178.03 3f9n n LEU 179 N -4.14 0.51 0.00 2.25 4.77 -0.56 -4.42 117.00 115.40 3f9n n LEU 179 Ca -0.01 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 3f9n n LEU 179 Cb 0.38 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3f9n n LEU 179 CO 0.39 0.02 -0.35 2.29 -1.33 0.00 0.00 177.39 178.40 3f9n n LYS 180 N -1.77 2.02 -4.37 3.23 2.85 -0.79 -5.05 118.16 114.27 3f9n n LYS 180 Ca 0.05 0.00 -0.30 0.00 -1.05 0.00 0.00 58.31 57.01 3f9n n LYS 180 Cb 0.38 -0.85 -0.11 0.00 -0.65 0.00 0.00 35.03 33.79 3f9n n LYS 180 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 3f9n s ARG 181 N -1.71 1.86 0.18 -1.58 1.81 0.65 -5.03 118.95 115.15 3f9n s ARG 181 Ca 0.00 -1.13 0.01 0.00 -1.72 0.00 0.00 55.73 52.89 3f9n s ARG 181 Cb 0.00 -2.14 0.07 0.00 -0.45 0.00 0.00 34.95 32.43 3f9n s ARG 181 CO 0.00 0.49 1.43 -0.09 -0.68 0.00 0.00 175.30 176.46 3f9n h ARG 182 N 3.89 0.31 -4.80 3.54 2.43 -1.92 -3.45 114.38 114.37 3f9n h ARG 182 Ca -0.49 -0.27 -0.34 0.00 -0.81 0.00 0.00 59.98 58.06 3f9n h ARG 182 Cb 1.17 0.06 -0.23 0.00 -0.42 0.00 0.00 29.97 30.54 3f9n h ARG 182 CO 0.47 0.93 -0.76 -1.21 -1.51 0.00 0.00 179.97 177.89 3f9n s GLU 183 N -3.50 0.65 0.07 0.20 2.02 -1.26 -4.39 118.70 112.49 3f9n s GLU 183 Ca -0.04 -0.68 -0.22 0.00 0.02 0.00 0.00 54.97 54.04 3f9n s GLU 183 Cb 0.11 -0.54 0.05 0.00 0.10 0.00 0.00 34.13 33.85 3f9n s GLU 183 CO 0.83 0.12 0.53 -0.59 0.02 0.00 0.00 175.26 176.17 3f9n s PHE 184 N -1.01 -0.43 0.28 1.61 -0.12 -0.06 -4.94 117.98 113.30 3f9n s PHE 184 Ca -0.04 0.43 -0.29 0.00 -0.05 0.00 0.00 56.93 56.97 3f9n s PHE 184 Cb -0.08 0.37 -0.09 0.00 -0.63 0.00 0.00 43.02 42.59 3f9n s PHE 184 CO 0.01 -0.68 1.17 -1.01 -0.05 0.00 0.00 175.22 174.65 3f9n s HIS 185 N -2.74 3.42 0.06 3.49 3.76 -1.26 -0.55 115.29 121.48 3f9n s HIS 185 Ca -0.04 1.58 -0.19 0.00 -0.15 0.00 0.00 55.06 56.26 3f9n s HIS 185 Cb -0.00 -3.41 -0.11 0.00 1.11 0.00 0.00 32.58 30.16 3f9n s HIS 185 CO -0.04 -1.00 1.42 0.00 -0.85 0.00 0.00 174.74 174.27 3f9n h ALA 186 N 3.96 0.28 -0.60 -1.40 0.00 -1.95 -3.36 119.26 116.19 3f9n h ALA 186 Ca -0.47 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.18 3f9n h ALA 186 Cb 1.22 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 3f9n h ALA 186 CO 0.68 0.11 0.36 0.93 0.00 0.00 0.00 179.25 181.33 3f9n h GLU 187 N 0.11 0.69 0.00 0.00 5.08 -1.98 -2.47 114.58 116.00 3f9n h GLU 187 Ca 0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3f9n h GLU 187 Cb 0.58 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3f9n h GLU 187 CO 0.03 0.46 0.00 -1.35 -1.00 0.00 0.00 179.01 177.15 3f9n h PRO 188 N 0.71 0.00 -0.25 2.33 0.11 -1.91 -1.64 132.00 131.34 3f9n h PRO 188 Ca 0.24 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.24 3f9n h PRO 188 Cb 0.03 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.14 3f9n h PRO 188 CO -0.10 0.00 -0.29 0.28 -0.21 0.00 0.00 178.00 177.68 3f9n h VAL 189 N 0.00 1.31 -0.15 3.15 2.07 -1.59 -1.46 116.25 119.58 3f9n h VAL 189 Ca 0.00 -1.47 -0.12 0.00 0.82 0.00 0.00 66.70 65.93 3f9n h VAL 189 Cb 0.33 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 3f9n h VAL 189 CO 0.00 0.46 -0.43 0.44 0.02 0.00 0.00 177.57 178.06 3f9n h ASP 190 N 0.35 0.37 -0.15 0.57 3.32 -1.38 -2.06 116.42 117.45 3f9n h ASP 190 Ca 0.03 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.92 3f9n h ASP 190 Cb 0.86 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 3f9n h ASP 190 CO 0.07 0.76 0.09 0.58 -1.72 0.00 0.00 179.24 179.02 3f9n h VAL 191 N 0.29 1.06 -0.13 -1.35 2.07 -1.19 -2.03 116.25 114.97 3f9n h VAL 191 Ca 0.02 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.46 3f9n h VAL 191 Cb 0.88 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 3f9n h VAL 191 CO 0.07 0.05 -0.12 -0.25 0.02 0.00 0.00 177.57 177.34 3f9n h TRP 192 N 0.18 -0.31 -0.72 1.57 2.91 -0.99 -1.58 115.95 117.01 3f9n h TRP 192 Ca 0.05 0.02 0.06 0.00 1.13 0.00 0.00 58.89 60.15 3f9n h TRP 192 Cb 0.01 0.16 -0.04 0.00 -0.51 0.00 0.00 29.16 28.77 3f9n h TRP 192 CO -0.06 -0.19 0.47 0.66 -1.03 0.00 0.00 178.44 178.30 3f9n h SER 193 N -0.15 0.67 -0.40 2.65 4.64 -1.27 -0.09 113.55 119.61 3f9n h SER 193 Ca 0.09 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.36 3f9n h SER 193 Cb 0.28 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 3f9n h SER 193 CO -0.22 0.44 0.07 0.00 -0.87 0.00 0.00 176.83 176.25 3f9n h GLY 195 N 0.94 1.21 1.46 0.00 0.00 -0.09 -0.42 103.07 106.17 3f9n h GLY 195 Ca 0.15 -0.79 -0.11 0.00 0.00 0.00 0.00 47.33 46.58 3f9n h GLY 195 CO 0.01 0.73 -0.25 -2.22 0.00 0.00 0.00 176.54 174.81 3f9n h ILE 196 N 1.05 1.27 -0.46 2.60 1.08 -0.50 -1.19 117.51 121.36 3f9n h ILE 196 Ca 0.21 -1.33 -0.01 0.00 -0.39 0.00 0.00 64.86 63.34 3f9n h ILE 196 Cb 0.42 1.31 -0.02 0.00 -3.07 0.00 0.00 36.82 35.46 3f9n h ILE 196 CO 0.01 0.43 0.24 0.58 -0.69 0.00 0.00 178.15 178.72 3f9n h VAL 197 N 0.54 1.17 -0.46 1.67 2.07 -0.68 -1.35 116.25 119.21 3f9n h VAL 197 Ca 0.07 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 67.15 3f9n h VAL 197 Cb 0.72 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 3f9n h VAL 197 CO 0.06 0.19 0.28 0.25 0.02 0.00 0.00 177.57 178.36 3f9n h LEU 198 N 0.61 0.46 -0.39 2.57 5.85 -0.78 0.37 115.31 124.00 3f9n h LEU 198 Ca 0.16 -0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.95 3f9n h LEU 198 Cb 0.08 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 3f9n h LEU 198 CO -0.02 0.33 -0.02 0.74 -0.34 0.00 0.00 178.44 179.13 3f9n h THR 199 N 0.57 0.69 -0.87 1.05 2.02 -0.97 -0.55 112.91 114.84 3f9n h THR 199 Ca 0.18 -0.03 -0.02 0.00 0.77 0.00 0.00 66.41 67.31 3f9n h THR 199 Cb -0.01 0.60 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 3f9n h THR 199 CO -0.07 0.01 0.44 0.00 0.37 0.00 0.00 175.52 176.28 3f9n h ALA 200 N 1.35 1.15 -0.58 6.16 0.00 -0.67 0.98 119.26 127.65 3f9n h ALA 200 Ca 0.19 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3f9n h ALA 200 Cb 0.27 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3f9n h ALA 200 CO -0.33 0.66 0.09 0.52 0.00 0.00 0.00 179.25 180.19 3f9n h MET 201 N 1.22 0.93 0.00 0.00 2.07 -0.39 0.12 114.93 118.88 3f9n h MET 201 Ca 0.30 -0.22 0.00 0.00 -2.07 0.00 0.00 59.70 57.71 3f9n h MET 201 Cb 0.08 -0.12 0.00 0.00 -1.87 0.00 0.00 31.60 29.68 3f9n h MET 201 CO -0.04 0.86 -0.57 1.28 1.07 0.00 0.00 176.91 179.50 3f9n n LEU 202 N -4.23 0.55 0.00 1.22 4.77 -0.26 -1.03 117.00 118.01 3f9n n LEU 202 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3f9n n LEU 202 Cb 0.27 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3f9n n LEU 202 CO 0.41 0.11 0.03 0.00 -1.33 0.00 0.00 177.39 176.61 3f9n n ALA 203 N -1.56 0.73 -2.61 -1.18 0.00 0.28 -4.67 120.51 111.50 3f9n n ALA 203 Ca 0.05 -0.06 -0.18 0.00 0.00 0.00 0.00 53.44 53.24 3f9n n ALA 203 Cb 0.35 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.80 3f9n n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f9n n GLY 204 N 0.21 -0.50 3.37 0.00 0.00 0.41 -3.26 105.19 105.42 3f9n n GLY 204 Ca 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 3f9n n GLY 204 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3f9n s GLU 205 N -5.24 0.65 0.05 1.61 2.12 -1.26 -0.21 118.70 116.42 3f9n s GLU 205 Ca 0.09 0.45 -0.16 0.00 0.36 0.00 0.00 54.97 55.71 3f9n s GLU 205 Cb -0.04 0.31 -0.06 0.00 0.26 0.00 0.00 34.13 34.59 3f9n s GLU 205 CO 0.11 -0.12 0.48 -0.51 -0.54 0.00 0.00 175.26 174.67 3f9n s LEU 206 N -0.24 4.47 0.33 2.70 1.43 -1.26 -3.90 118.68 122.21 3f9n s LEU 206 Ca -0.04 1.07 0.16 0.00 -1.03 0.00 0.00 54.13 54.28 3f9n s LEU 206 Cb -0.03 -2.79 0.51 0.00 0.03 0.00 0.00 46.19 43.91 3f9n s LEU 206 CO 0.03 0.28 1.66 1.55 0.23 0.00 0.00 176.35 180.09 3f9n h PRO 207 N 4.46 0.00 -2.78 1.29 0.13 -1.93 -3.46 132.00 129.71 3f9n h PRO 207 Ca -0.50 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.58 3f9n h PRO 207 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.20 3f9n h PRO 207 CO 0.63 0.47 0.13 1.67 -0.23 0.00 0.00 178.00 180.67 3f9n s TRP 208 N -3.51 -0.50 0.27 1.56 -2.14 -1.26 -4.67 118.94 108.69 3f9n s TRP 208 Ca 0.00 0.48 -0.02 0.00 2.66 0.00 0.00 56.10 59.22 3f9n s TRP 208 Cb 0.11 0.44 0.36 0.00 -3.10 0.00 0.00 33.47 31.28 3f9n s TRP 208 CO 0.72 -0.73 1.81 -0.44 -2.66 0.00 0.00 176.95 175.65 3f9n h ASP 209 N 2.45 0.81 -4.62 -2.66 5.19 -1.92 -3.42 116.42 112.26 3f9n h ASP 209 Ca -0.32 -0.15 0.05 0.00 -0.62 0.00 0.00 57.03 55.99 3f9n h ASP 209 Cb 1.24 -0.21 -0.18 0.00 0.18 0.00 0.00 39.33 40.37 3f9n h ASP 209 CO 0.40 0.80 0.41 0.00 -3.12 0.00 0.00 179.24 177.72 3f9n s GLN 210 N -5.22 0.87 -1.25 3.56 -2.07 -1.26 -2.89 119.66 111.40 3f9n s GLN 210 Ca -0.10 -0.10 -0.11 0.00 -1.82 0.00 0.00 55.36 53.24 3f9n s GLN 210 Cb 0.15 0.40 0.17 0.00 -1.09 0.00 0.00 33.01 32.65 3f9n s GLN 210 CO 0.81 -0.33 1.72 -0.35 -1.32 0.00 0.00 175.29 175.81 3f9n n PRO 211 N 0.22 3.57 -4.16 9.60 -0.04 -1.26 -4.75 135.00 138.18 3f9n n PRO 211 Ca -0.12 -3.67 -0.18 0.00 -0.04 0.00 0.00 63.50 59.49 3f9n n PRO 211 Cb 0.60 -2.94 -0.12 0.00 -0.04 0.00 0.00 33.50 31.00 3f9n n PRO 211 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3f9n s SER 212 N 1.38 1.53 0.63 3.54 1.04 -1.26 -4.55 113.70 116.01 3f9n s SER 212 Ca 0.40 -0.59 0.37 0.00 0.48 0.00 0.00 55.95 56.61 3f9n s SER 212 Cb 0.05 -0.04 2.10 0.00 0.10 0.00 0.00 66.02 68.24 3f9n s SER 212 CO 0.01 -0.09 2.30 0.44 0.98 0.00 0.00 173.24 176.88 3f9n h ASP 213 N 4.37 0.00 0.61 7.02 3.32 -1.96 0.55 116.42 130.33 3f9n h ASP 213 Ca -0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.65 3f9n h ASP 213 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3f9n h ASP 213 CO 0.40 0.01 0.00 -1.54 -1.72 0.00 0.00 179.24 176.39 3f9n n SER 214 N -3.44 0.00 -4.52 6.45 3.41 -1.26 -4.53 113.62 109.73 3f9n n SER 214 Ca -0.03 0.24 -0.42 0.00 -0.26 0.00 0.00 58.87 58.40 3f9n n SER 214 Cb 0.09 -0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 3f9n n SER 214 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f9n h GLN 216 N 8.59 0.30 -0.84 0.00 5.75 -1.84 -1.70 115.11 125.37 3f9n h GLN 216 Ca -0.28 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.19 3f9n h GLN 216 Cb 1.12 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 29.57 3f9n h GLN 216 CO 0.76 0.20 0.46 0.93 -2.65 0.00 0.00 178.83 178.53 3f9n h GLU 217 N 0.31 1.17 -0.45 1.69 3.07 -1.93 -0.13 114.58 118.32 3f9n h GLU 217 Ca 0.35 -0.14 -0.14 0.00 -0.50 0.00 0.00 59.36 58.93 3f9n h GLU 217 Cb 0.52 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 3f9n h GLU 217 CO -0.40 0.86 -0.27 -0.92 -1.40 0.00 0.00 179.01 176.88 3f9n h TYR 218 N 1.18 1.11 -0.60 4.33 3.20 -1.63 -2.05 116.97 122.51 3f9n h TYR 218 Ca 0.30 -0.29 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 3f9n h TYR 218 Cb 0.03 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.02 3f9n h TYR 218 CO 0.01 1.11 0.26 0.77 -1.64 0.00 0.00 178.16 178.67 3f9n h SER 219 N 0.82 0.80 -0.84 -2.11 0.02 -0.91 -1.92 113.55 109.42 3f9n h SER 219 Ca 0.09 -0.15 0.03 0.00 -0.84 0.00 0.00 61.79 60.92 3f9n h SER 219 Cb 0.85 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 63.13 3f9n h SER 219 CO 0.07 0.74 0.54 0.44 -1.14 0.00 0.00 176.83 177.48 3f9n h ASP 220 N 0.82 0.89 -0.35 3.07 3.45 -0.83 -1.66 116.42 121.80 3f9n h ASP 220 Ca 0.20 -0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.65 3f9n h ASP 220 Cb 0.17 -0.20 -0.02 0.00 -0.56 0.00 0.00 39.33 38.72 3f9n h ASP 220 CO -0.02 0.61 0.20 -0.25 -1.57 0.00 0.00 179.24 178.21 3f9n h TRP 221 N 1.04 0.48 0.00 4.55 2.91 -1.09 -1.66 115.95 122.18 3f9n h TRP 221 Ca 0.34 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.33 3f9n h TRP 221 Cb 0.01 -0.15 -0.00 0.00 -0.51 0.00 0.00 29.16 28.51 3f9n h TRP 221 CO -0.02 0.37 -0.07 0.87 -1.03 0.00 0.00 178.44 178.56 3f9n h LYS 222 N 0.45 0.00 -0.51 2.65 1.57 -0.93 -0.00 116.57 119.79 3f9n h LYS 222 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3f9n h LYS 222 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 3f9n h LYS 222 CO -0.02 0.07 0.00 0.39 -0.57 0.00 0.00 179.45 179.32 3f9n n GLU 223 N -3.57 2.30 -2.50 3.15 1.02 -0.66 -4.94 120.64 115.43 3f9n n GLU 223 Ca -0.02 -1.58 -0.20 0.00 -0.02 0.00 0.00 57.16 55.34 3f9n n GLU 223 Cb 0.18 -1.49 -0.00 0.00 -0.02 0.00 0.00 31.44 30.11 3f9n n GLU 223 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3f9n n LYS 224 N 0.63 -2.22 -1.95 3.49 4.76 -0.01 -4.90 118.16 117.95 3f9n n LYS 224 Ca 0.14 0.94 -0.42 0.00 -2.87 0.00 0.00 58.31 56.10 3f9n n LYS 224 Cb 0.47 -5.57 0.00 0.00 -1.84 0.00 0.00 35.03 28.09 3f9n n LYS 224 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3f9n n LYS 225 N -3.10 3.20 0.00 1.97 5.02 -0.70 -4.68 118.16 119.88 3f9n n LYS 225 Ca -0.21 -2.96 0.14 0.00 -2.02 0.00 0.00 58.31 53.26 3f9n n LYS 225 Cb 0.67 -3.12 0.81 0.00 -0.02 0.00 0.00 35.03 33.36 3f9n n LYS 225 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3f9n n THR 226 N 4.31 0.00 1.46 -0.18 -2.24 -1.26 -2.67 114.28 113.70 3f9n n THR 226 Ca 0.48 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 62.41 3f9n n THR 226 Cb 0.37 -0.55 0.74 0.00 -2.10 0.00 0.00 70.33 68.80 3f9n n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f9n n TYR 227 N -0.99 0.00 -3.32 4.78 0.18 -1.26 -2.72 117.16 113.84 3f9n n TYR 227 Ca 0.20 0.00 -0.22 0.00 1.88 0.00 0.00 57.90 59.76 3f9n n TYR 227 Cb 0.09 -0.24 -0.00 0.00 -0.38 0.00 0.00 39.34 38.81 3f9n n TYR 227 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3f9n s LEU 228 N -2.51 3.91 0.56 -3.48 1.43 -1.09 -4.66 118.68 112.84 3f9n s LEU 228 Ca 0.30 0.25 -0.18 0.00 -1.03 0.00 0.00 54.13 53.47 3f9n s LEU 228 Cb 0.20 -3.12 -0.05 0.00 0.03 0.00 0.00 46.19 43.26 3f9n s LEU 228 CO 0.46 -0.44 1.07 0.20 0.23 0.00 0.00 176.35 177.88 3f9n s ASN 229 N -4.12 5.84 0.00 2.29 0.01 -1.26 -1.66 114.94 116.04 3f9n s ASN 229 Ca 0.43 1.94 0.29 0.00 -0.71 0.00 0.00 52.86 54.82 3f9n s ASN 229 Cb -0.10 -2.55 1.31 0.00 0.41 0.00 0.00 41.25 40.32 3f9n s ASN 229 CO 0.35 -1.13 1.95 -0.81 -1.51 0.00 0.00 177.10 175.95 3f9n n PRO 230 N -1.64 0.22 -0.26 -0.60 -0.04 -1.26 -4.87 135.00 126.55 3f9n n PRO 230 Ca 0.10 -0.02 0.10 0.00 -0.04 0.00 0.00 63.50 63.64 3f9n n PRO 230 Cb 0.52 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.84 3f9n n PRO 230 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3f9n h TRP 231 N 0.04 0.85 0.00 0.54 4.06 -1.64 -1.61 115.95 118.19 3f9n h TRP 231 Ca 0.00 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.97 3f9n h TRP 231 Cb 0.41 -0.27 -0.00 0.00 -1.00 0.00 0.00 29.16 28.30 3f9n h TRP 231 CO 0.00 0.35 -0.04 1.57 -3.56 0.00 0.00 178.44 176.77 3f9n h LYS 232 N 0.75 0.00 -0.00 0.49 2.10 -1.11 -1.33 116.57 117.47 3f9n h LYS 232 Ca 0.42 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.07 3f9n h LYS 232 Cb 0.57 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.90 3f9n h LYS 232 CO -0.18 0.04 -0.08 1.63 -2.00 0.00 0.00 179.45 178.85 3f9n n LYS 233 N -3.30 0.83 -4.18 0.07 5.02 -0.60 -4.87 118.16 111.12 3f9n n LYS 233 Ca -0.02 -0.28 -0.34 0.00 -2.02 0.00 0.00 58.31 55.65 3f9n n LYS 233 Cb 0.18 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.60 3f9n n LYS 233 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3f9n s ILE 234 N -2.37 4.47 0.80 -0.18 1.01 -0.50 -4.89 121.20 119.54 3f9n s ILE 234 Ca 0.32 -0.16 -0.14 0.00 0.00 0.00 0.00 60.65 60.68 3f9n s ILE 234 Cb 0.20 -2.97 0.08 0.00 0.01 0.00 0.00 42.46 39.78 3f9n s ILE 234 CO 0.45 0.50 1.21 -0.67 0.00 0.00 0.00 174.94 176.43 3f9n n ASP 235 N 3.22 1.11 -0.07 3.58 -0.08 -1.26 -4.75 116.55 118.30 3f9n n ASP 235 Ca -0.17 0.60 0.02 0.00 -1.51 0.00 0.00 54.79 53.73 3f9n n ASP 235 Cb 0.53 -1.51 0.35 0.00 2.34 0.00 0.00 41.12 42.82 3f9n n ASP 235 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3f9n h SER 236 N -0.82 0.60 0.27 1.67 4.64 -1.98 -1.74 113.55 116.19 3f9n h SER 236 Ca -0.47 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 60.81 3f9n h SER 236 Cb 1.30 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3f9n h SER 236 CO 0.46 0.46 -0.13 0.00 -0.87 0.00 0.00 176.83 176.76 3f9n h ALA 237 N 1.64 -0.36 0.00 5.18 0.00 -2.00 -0.62 119.26 123.09 3f9n h ALA 237 Ca 0.18 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3f9n h ALA 237 Cb -0.02 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3f9n h ALA 237 CO -0.03 -0.52 -0.31 -1.00 0.00 0.00 0.00 179.25 177.38 3f9n h PRO 238 N -0.72 0.00 -0.38 0.00 0.13 -1.92 -2.48 132.00 126.62 3f9n h PRO 238 Ca -0.04 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.02 3f9n h PRO 238 Cb 0.49 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.60 3f9n h PRO 238 CO 0.06 0.31 -0.07 1.25 -0.23 0.00 0.00 178.00 179.32 3f9n h LEU 239 N 0.00 0.62 -1.12 1.56 5.85 -1.22 -0.37 115.31 120.63 3f9n h LEU 239 Ca -0.00 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 3f9n h LEU 239 Cb 0.61 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 3f9n h LEU 239 CO 0.04 0.74 0.27 0.00 -0.34 0.00 0.00 178.44 179.16 3f9n h ALA 240 N 1.33 1.31 -0.35 1.25 0.00 -0.65 0.13 119.26 122.29 3f9n h ALA 240 Ca 0.11 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3f9n h ALA 240 Cb 0.48 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3f9n h ALA 240 CO 0.03 0.52 -0.13 1.25 0.00 0.00 0.00 179.25 180.92 3f9n h LEU 241 N 0.89 0.72 -1.49 0.00 5.85 -1.16 -2.93 115.31 117.17 3f9n h LEU 241 Ca 0.21 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 3f9n h LEU 241 Cb 0.13 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3f9n h LEU 241 CO -0.02 0.95 0.18 -0.07 -0.34 0.00 0.00 178.44 179.13 3f9n h LEU 242 N 0.48 0.46 -1.65 2.25 3.38 -0.31 -0.23 115.31 119.70 3f9n h LEU 242 Ca 0.08 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3f9n h LEU 242 Cb 0.66 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3f9n h LEU 242 CO 0.04 0.40 -0.16 0.45 0.09 0.00 0.00 178.44 179.26 3f9n h HIS 243 N 0.53 0.02 0.00 1.13 3.86 -0.60 -0.31 115.15 119.77 3f9n h HIS 243 Ca 0.13 -0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.11 3f9n h HIS 243 Cb 0.06 -0.01 -0.04 0.00 1.06 0.00 0.00 27.41 28.49 3f9n h HIS 243 CO 0.00 0.18 -1.21 0.87 0.86 0.00 0.00 177.93 178.64 3f9n h LYS 244 N 0.02 0.00 0.04 2.45 1.57 -0.95 -3.38 116.57 116.32 3f9n h LYS 244 Ca 0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 3f9n h LYS 244 Cb 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 3f9n h LYS 244 CO 0.02 0.80 -0.48 0.82 -0.57 0.00 0.00 179.45 180.04 3f9n h ILE 245 N 0.00 1.54 -0.89 1.86 2.04 -0.91 -2.49 117.51 118.67 3f9n h ILE 245 Ca -0.10 -2.37 -0.70 0.00 1.00 0.00 0.00 64.86 62.70 3f9n h ILE 245 Cb 1.82 3.12 -0.10 0.00 -0.74 0.00 0.00 36.82 40.93 3f9n h ILE 245 CO 0.11 0.60 2.48 0.18 0.00 0.00 0.00 178.15 181.52 3f9n n LEU 246 N -4.42 8.02 -4.61 1.44 4.77 -0.16 -4.71 117.00 117.33 3f9n n LEU 246 Ca -0.15 -4.68 -0.35 0.00 -0.03 0.00 0.00 56.01 50.79 3f9n n LEU 246 Cb 0.62 -1.39 -0.10 0.00 -2.33 0.00 0.00 43.42 40.21 3f9n n LEU 246 CO 0.35 2.03 -0.24 -0.69 -1.33 0.00 0.00 177.39 177.52 3f9n s VAL 247 N -0.53 4.86 0.18 4.08 1.01 -1.26 -4.95 120.40 123.79 3f9n s VAL 247 Ca 0.58 -0.00 -0.14 0.00 0.00 0.00 0.00 61.98 62.42 3f9n s VAL 247 Cb 0.20 -3.23 0.09 0.00 0.00 0.00 0.00 36.38 33.44 3f9n s VAL 247 CO -0.10 0.41 1.73 -0.08 0.00 0.00 0.00 175.10 177.06 3f9n h GLU 248 N 7.19 0.24 -6.44 2.72 4.81 -1.96 -3.40 114.58 117.74 3f9n h GLU 248 Ca -0.37 -0.01 -0.57 0.00 -0.13 0.00 0.00 59.36 58.27 3f9n h GLU 248 Cb 1.17 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.45 3f9n h GLU 248 CO 0.67 0.16 1.04 1.21 -0.73 0.00 0.00 179.01 181.35 3f9n s ASN 249 N -5.33 6.47 0.61 1.04 3.04 -1.26 -4.64 114.94 114.87 3f9n s ASN 249 Ca -0.13 1.04 0.39 0.00 0.04 0.00 0.00 52.86 54.20 3f9n s ASN 249 Cb 0.15 -2.54 1.88 0.00 -1.54 0.00 0.00 41.25 39.20 3f9n s ASN 249 CO 0.72 -1.28 2.17 1.55 -3.04 0.00 0.00 177.10 177.22 3f9n h PRO 250 N 10.16 0.00 0.00 0.43 0.13 -1.97 -0.64 132.00 140.11 3f9n h PRO 250 Ca -0.27 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.81 3f9n h PRO 250 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 3f9n h PRO 250 CO 1.06 0.00 -0.23 0.77 -0.23 0.00 0.00 178.00 179.37 3f9n h SER 251 N 0.00 0.00 0.30 1.44 0.02 -1.94 -3.15 113.55 110.22 3f9n h SER 251 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3f9n h SER 251 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 3f9n h SER 251 CO 0.00 0.23 -1.14 0.00 -1.14 0.00 0.00 176.83 174.78 3f9n n ALA 252 N -2.18 3.57 -1.76 3.77 0.00 -0.31 -4.96 120.51 118.64 3f9n n ALA 252 Ca 0.02 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.62 3f9n n ALA 252 Cb 0.53 -0.91 0.02 0.00 0.00 0.00 0.00 19.45 19.10 3f9n n ALA 252 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3f9n s ARG 253 N -3.20 3.37 0.52 0.00 3.52 -0.83 -4.97 118.95 117.37 3f9n s ARG 253 Ca 0.03 2.07 -0.22 0.00 -0.13 0.00 0.00 55.73 57.48 3f9n s ARG 253 Cb 0.15 -2.32 -0.06 0.00 -1.56 0.00 0.00 34.95 31.16 3f9n s ARG 253 CO 0.83 -0.95 1.30 -1.50 -0.81 0.00 0.00 175.30 174.16 3f9n s ILE 254 N -1.39 2.38 0.37 4.11 2.07 -0.94 -5.01 121.20 122.79 3f9n s ILE 254 Ca 0.68 0.29 0.06 0.00 -1.41 0.00 0.00 60.65 60.27 3f9n s ILE 254 Cb -0.36 -3.14 -0.00 0.00 0.13 0.00 0.00 42.46 39.08 3f9n s ILE 254 CO 0.43 -0.00 0.52 0.42 -1.91 0.00 0.00 174.94 174.40 3f9n s THR 255 N -1.38 3.88 0.19 4.00 -4.23 -1.26 -4.93 115.64 111.91 3f9n s THR 255 Ca 0.69 -0.92 -0.12 0.00 -1.18 0.00 0.00 61.69 60.16 3f9n s THR 255 Cb -0.37 -3.35 0.09 0.00 1.34 0.00 0.00 72.50 70.21 3f9n s THR 255 CO 0.44 -0.15 1.77 0.40 -0.54 0.00 0.00 174.62 176.54 3f9n h ILE 256 N 0.77 0.90 -0.89 2.99 2.04 -1.96 -0.46 117.51 120.90 3f9n h ILE 256 Ca -0.45 -0.16 0.10 0.00 1.00 0.00 0.00 64.86 65.35 3f9n h ILE 256 Cb 1.26 0.40 -0.06 0.00 -0.74 0.00 0.00 36.82 37.67 3f9n h ILE 256 CO 0.52 0.08 0.57 -0.65 0.00 0.00 0.00 178.15 178.68 3f9n h PRO 257 N 0.47 0.85 -0.06 2.37 0.11 -1.99 -0.86 132.00 132.89 3f9n h PRO 257 Ca 0.24 -0.05 -0.20 0.00 0.11 0.00 0.00 66.00 66.11 3f9n h PRO 257 Cb 0.20 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 3f9n h PRO 257 CO -0.20 0.56 -0.79 -0.44 -0.21 0.00 0.00 178.00 176.92 3f9n h ASP 258 N 0.88 0.49 -0.67 -2.05 3.45 -1.87 -3.07 116.42 113.58 3f9n h ASP 258 Ca 0.41 -0.34 0.05 0.00 0.43 0.00 0.00 57.03 57.57 3f9n h ASP 258 Cb 0.41 -0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 38.98 3f9n h ASP 258 CO -0.17 1.10 0.39 0.40 -1.57 0.00 0.00 179.24 179.39 3f9n h ILE 259 N 0.26 1.02 0.00 0.35 2.04 -0.02 -1.10 117.51 120.07 3f9n h ILE 259 Ca -0.04 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.56 3f9n h ILE 259 Cb 1.39 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 3f9n h ILE 259 CO 0.14 0.14 0.00 0.29 0.00 0.00 0.00 178.15 178.71 3f9n n LYS 260 N -4.74 0.10 -0.06 2.37 5.02 -0.43 -1.11 118.16 119.31 3f9n n LYS 260 Ca 0.08 0.53 0.08 0.00 -2.02 0.00 0.00 58.31 56.98 3f9n n LYS 260 Cb 0.13 -1.78 0.10 0.00 -0.02 0.00 0.00 35.03 33.46 3f9n n LYS 260 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3f9n n LYS 261 N -1.98 1.58 -1.86 1.97 5.02 -0.46 -4.80 118.16 117.64 3f9n n LYS 261 Ca -0.00 -1.64 -0.35 0.00 -2.02 0.00 0.00 58.31 54.30 3f9n n LYS 261 Cb 0.07 -1.33 0.05 0.00 -0.02 0.00 0.00 35.03 33.80 3f9n n LYS 261 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3f9n s ASP 262 N -1.27 4.99 0.10 4.39 -1.08 -0.26 -4.91 116.67 118.63 3f9n s ASP 262 Ca 0.22 2.30 -0.20 0.00 -0.52 0.00 0.00 52.55 54.34 3f9n s ASP 262 Cb 0.14 -2.59 -0.09 0.00 -1.46 0.00 0.00 42.92 38.93 3f9n s ASP 262 CO 0.21 -1.72 1.70 -0.09 0.52 0.00 0.00 175.17 175.79 3f9n h ARG 263 N 0.50 0.24 -0.39 4.34 2.43 -1.93 -2.27 114.38 117.30 3f9n h ARG 263 Ca -0.49 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.52 3f9n h ARG 263 Cb 1.29 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 3f9n h ARG 263 CO 0.54 0.24 -0.27 2.35 -1.51 0.00 0.00 179.97 181.31 3f9n h TRP 264 N 0.18 0.94 -0.77 2.20 7.01 -1.93 -2.17 115.95 121.42 3f9n h TRP 264 Ca 0.06 -0.24 0.10 0.00 2.11 0.00 0.00 58.89 60.92 3f9n h TRP 264 Cb 0.07 -0.22 -0.05 0.00 -2.10 0.00 0.00 29.16 26.86 3f9n h TRP 264 CO -0.04 0.99 0.50 -0.92 -2.79 0.00 0.00 178.44 176.19 3f9n h TYR 265 N 0.70 0.72 -0.67 2.65 5.03 -1.81 -0.78 116.97 122.82 3f9n h TYR 265 Ca 0.08 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.41 3f9n h TYR 265 Cb 0.81 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.86 3f9n h TYR 265 CO 0.04 0.34 0.00 0.09 -1.32 0.00 0.00 178.16 177.31 3f9n n ASN 266 N -4.50 4.83 -4.73 -2.11 3.02 -0.87 -4.97 115.26 105.94 3f9n n ASN 266 Ca 0.13 -2.45 -0.41 0.00 -0.03 0.00 0.00 54.58 51.83 3f9n n ASN 266 Cb 0.34 -0.59 -0.04 0.00 -0.61 0.00 0.00 39.78 38.88 3f9n n ASN 266 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3f9n s LYS 267 N -1.85 4.54 0.05 3.52 2.20 -0.30 -4.99 119.74 122.90 3f9n s LYS 267 Ca 0.52 1.18 -0.30 0.00 -0.36 0.00 0.00 55.97 57.01 3f9n s LYS 267 Cb 0.33 -3.40 -0.05 0.00 -1.51 0.00 0.00 37.83 33.20 3f9n s LYS 267 CO 0.25 0.16 1.19 -2.14 -0.36 0.00 0.00 175.35 174.45 3f9n s PRO 268 N 0.32 4.43 0.04 4.03 0.02 -1.26 -5.00 135.00 137.58 3f9n s PRO 268 Ca 0.43 1.74 0.03 0.00 0.02 0.00 0.00 61.00 63.22 3f9n s PRO 268 Cb -0.21 -3.37 -0.02 0.00 0.02 0.00 0.00 34.50 30.92 3f9n s PRO 268 CO 0.24 -0.27 -0.09 -0.51 -0.33 0.00 0.00 177.00 176.05 3f9n s LEU 269 N 1.18 2.21 0.00 -5.54 1.43 -1.26 -5.17 118.68 111.53 3f9n s LEU 269 Ca 0.58 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 3f9n s LEU 269 Cb -0.29 -0.25 0.00 0.00 0.03 0.00 0.00 46.19 45.68 3f9n s LEU 269 CO 0.28 -0.13 0.17 1.17 0.23 0.00 0.00 176.35 178.08