#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f1d s ARG 11 N 0.00 2.49 0.12 1.61 0.52 -1.26 -4.97 118.95 117.46 2f1d s ARG 11 Ca 0.00 0.78 0.03 0.00 -0.52 0.00 0.00 55.73 56.02 2f1d s ARG 11 Cb 0.00 -4.45 -0.04 0.00 0.52 0.00 0.00 34.95 30.98 2f1d s ARG 11 CO 0.00 -2.89 0.17 0.42 0.02 0.00 0.00 175.30 173.03 2f1d s ILE 12 N 9.88 4.88 -0.13 1.52 1.01 -1.26 -2.24 121.20 134.86 2f1d s ILE 12 Ca 0.74 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 60.58 2f1d s ILE 12 Cb -0.14 -3.44 0.06 0.00 0.01 0.00 0.00 42.46 38.95 2f1d s ILE 12 CO 0.21 -0.00 0.11 -0.83 0.00 0.00 0.00 174.94 174.44 2f1d s GLY 13 N -2.85 0.22 0.01 6.18 0.00 -0.74 -4.29 107.32 105.86 2f1d s GLY 13 Ca 0.32 0.01 -0.01 0.00 0.00 0.00 0.00 44.72 45.05 2f1d s GLY 13 CO 0.25 1.71 0.13 1.85 0.00 0.00 0.00 173.10 177.04 2f1d s GLU 14 N 2.20 3.22 -0.16 2.90 2.12 -1.26 -2.06 118.70 125.65 2f1d s GLU 14 Ca 0.04 -0.44 -0.07 0.00 0.36 0.00 0.00 54.97 54.86 2f1d s GLU 14 Cb -0.14 -2.95 0.07 0.00 0.26 0.00 0.00 34.13 31.36 2f1d s GLU 14 CO -0.08 0.65 0.36 0.08 -0.54 0.00 0.00 175.26 175.73 2f1d s VAL 15 N -1.29 -0.41 0.08 3.70 1.01 -0.35 -4.79 120.40 118.35 2f1d s VAL 15 Ca 0.26 0.18 0.06 0.00 0.00 0.00 0.00 61.98 62.49 2f1d s VAL 15 Cb -0.12 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 2f1d s VAL 15 CO 0.18 0.08 -0.09 -1.59 0.00 0.00 0.00 175.10 173.67 2f1d s LYS 16 N 2.20 2.25 -0.25 2.72 0.00 -1.26 -1.10 119.74 124.29 2f1d s LYS 16 Ca -0.03 -0.94 -0.11 0.00 0.00 0.00 0.00 55.97 54.89 2f1d s LYS 16 Cb -0.11 -2.36 0.10 0.00 0.00 0.00 0.00 37.83 35.46 2f1d s LYS 16 CO -0.11 0.53 0.57 0.50 0.00 0.00 0.00 175.35 176.85 2f1d s ARG 17 N -1.99 0.53 -0.05 1.78 3.52 -0.48 -5.01 118.95 117.25 2f1d s ARG 17 Ca 0.20 1.20 0.04 0.00 -0.13 0.00 0.00 55.73 57.05 2f1d s ARG 17 Cb -0.11 0.42 -0.00 0.00 -1.56 0.00 0.00 34.95 33.70 2f1d s ARG 17 CO 0.12 -0.19 -0.19 0.08 -0.81 0.00 0.00 175.30 174.31 2f1d s VAL 18 N 2.26 1.59 0.39 7.11 1.01 -1.26 -1.32 120.40 130.18 2f1d s VAL 18 Ca -0.07 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.18 2f1d s VAL 18 Cb -0.10 -1.37 -0.07 0.00 0.00 0.00 0.00 36.38 34.84 2f1d s VAL 18 CO -0.17 0.45 0.03 0.42 0.00 0.00 0.00 175.10 175.83 2f1d s THR 19 N 0.10 1.71 0.41 3.92 -4.23 -0.65 -5.03 115.64 111.87 2f1d s THR 19 Ca -0.07 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.61 2f1d s THR 19 Cb -0.13 -2.90 0.38 0.00 1.34 0.00 0.00 72.50 71.19 2f1d s THR 19 CO 0.03 0.00 1.85 0.07 -0.54 0.00 0.00 174.62 176.04 2f1d h LYS 20 N 1.86 0.41 0.01 3.99 -0.00 -2.04 -3.14 116.57 117.66 2f1d h LYS 20 Ca -0.43 -0.02 -0.13 0.00 -0.00 0.00 0.00 60.65 60.07 2f1d h LYS 20 Cb 1.24 -0.09 -0.01 0.00 -0.00 0.00 0.00 32.23 33.37 2f1d h LYS 20 CO 0.77 0.27 -0.68 0.93 -0.00 0.00 0.00 179.45 180.75 2f1d h GLU 21 N 0.42 0.03 -4.92 0.07 3.07 -1.99 -3.50 114.58 107.77 2f1d h GLU 21 Ca 0.47 -0.05 -0.35 0.00 -0.50 0.00 0.00 59.36 58.93 2f1d h GLU 21 Cb 1.14 0.02 -0.14 0.00 -0.84 0.00 0.00 28.75 28.93 2f1d h GLU 21 CO -0.18 1.02 -0.62 0.95 -1.40 0.00 0.00 179.01 178.78 2f1d s THR 22 N -2.31 0.66 -0.08 1.13 -4.23 -1.19 -3.89 115.64 105.74 2f1d s THR 22 Ca -0.23 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.26 2f1d s THR 22 Cb 0.01 -2.56 0.04 0.00 1.34 0.00 0.00 72.50 71.33 2f1d s THR 22 CO 0.66 -0.09 0.05 0.21 -0.54 0.00 0.00 174.62 174.91 2f1d s ASN 23 N -3.31 1.58 0.00 3.99 3.84 -0.84 -1.63 114.94 118.57 2f1d s ASN 23 Ca 0.35 -0.14 0.03 0.00 0.21 0.00 0.00 52.86 53.31 2f1d s ASN 23 Cb 0.08 -0.28 -0.01 0.00 -0.55 0.00 0.00 41.25 40.49 2f1d s ASN 23 CO 0.12 -0.25 -0.09 -0.69 -2.79 0.00 0.00 177.10 173.40 2f1d s VAL 24 N 2.08 0.67 -0.13 -5.21 1.01 -0.43 -2.12 120.40 116.27 2f1d s VAL 24 Ca 0.04 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.48 2f1d s VAL 24 Cb -0.13 -0.58 0.04 0.00 0.00 0.00 0.00 36.38 35.71 2f1d s VAL 24 CO -0.05 0.12 0.33 -0.55 0.00 0.00 0.00 175.10 174.95 2f1d s SER 25 N -0.38 -0.37 -0.16 3.32 0.15 -0.52 -1.38 113.70 114.36 2f1d s SER 25 Ca 0.02 0.69 -0.12 0.00 0.70 0.00 0.00 55.95 57.23 2f1d s SER 25 Cb -0.04 0.61 0.05 0.00 -1.71 0.00 0.00 66.02 64.93 2f1d s SER 25 CO -0.00 -0.16 0.42 -0.69 1.20 0.00 0.00 173.24 174.01 2f1d s VAL 26 N 0.91 -0.01 -0.02 4.45 1.01 -0.26 -1.12 120.40 125.35 2f1d s VAL 26 Ca -0.06 0.04 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2f1d s VAL 26 Cb -0.07 -0.60 0.01 0.00 0.00 0.00 0.00 36.38 35.72 2f1d s VAL 26 CO -0.07 0.02 -0.05 -1.59 0.00 0.00 0.00 175.10 173.41 2f1d s LYS 27 N 0.76 0.67 -0.03 2.72 -2.85 -0.80 -1.21 119.74 119.00 2f1d s LYS 27 Ca -0.04 -0.16 0.00 0.00 -1.00 0.00 0.00 55.97 54.77 2f1d s LYS 27 Cb -0.05 -0.67 0.03 0.00 -2.06 0.00 0.00 37.83 35.08 2f1d s LYS 27 CO -0.06 0.03 -0.00 0.42 0.10 0.00 0.00 175.35 175.84 2f1d s ILE 28 N 0.38 0.19 -0.31 3.79 1.01 -0.87 -1.65 121.20 123.74 2f1d s ILE 28 Ca -0.05 0.08 -0.05 0.00 0.00 0.00 0.00 60.65 60.63 2f1d s ILE 28 Cb -0.09 -0.28 0.04 0.00 0.01 0.00 0.00 42.46 42.14 2f1d s ILE 28 CO -0.00 0.15 0.06 0.21 0.00 0.00 0.00 174.94 175.35 2f1d s ASN 29 N 1.01 5.08 0.47 3.58 3.84 -0.95 -1.79 114.94 126.18 2f1d s ASN 29 Ca -0.10 -1.09 0.23 0.00 0.21 0.00 0.00 52.86 52.11 2f1d s ASN 29 Cb -0.14 -1.81 1.17 0.00 -0.55 0.00 0.00 41.25 39.93 2f1d s ASN 29 CO -0.02 -0.27 1.96 -0.07 -2.79 0.00 0.00 177.10 175.92 2f1d h LEU 30 N 8.14 0.00 -4.80 3.21 3.38 -1.78 -2.87 115.31 120.58 2f1d h LEU 30 Ca -0.25 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.07 2f1d h LEU 30 Cb 1.08 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 41.46 2f1d h LEU 30 CO 0.58 0.20 -0.12 0.47 0.09 0.00 0.00 178.44 179.66 2f1d n ASP 31 N -3.69 5.64 0.00 -0.43 8.00 -1.26 -4.76 116.55 120.04 2f1d n ASP 31 Ca -0.01 -3.75 0.00 0.00 0.71 0.00 0.00 54.79 51.73 2f1d n ASP 31 Cb 0.32 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.74 2f1d n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2f1d n GLY 32 N -0.46 2.48 1.63 0.44 0.00 -1.15 -4.83 105.19 103.30 2f1d n GLY 32 Ca 0.43 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.54 2f1d n GLY 32 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2f1d n THR 33 N 0.00 0.17 -2.43 2.61 5.66 -1.26 -4.77 114.28 114.26 2f1d n THR 33 Ca 0.00 -1.01 -0.10 0.00 -3.05 0.00 0.00 64.05 59.89 2f1d n THR 33 Cb 0.00 0.91 0.01 0.00 -1.55 0.00 0.00 70.33 69.70 2f1d n THR 33 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2f1d n GLY 34 N 0.09 0.07 3.63 1.09 0.00 -1.10 -4.96 105.19 104.00 2f1d n GLY 34 Ca -0.04 -0.42 -0.43 0.00 0.00 0.00 0.00 46.02 45.13 2f1d n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f1d s VAL 35 N -2.68 4.15 -0.38 1.61 1.01 -1.22 -4.44 120.40 118.46 2f1d s VAL 35 Ca 0.08 1.28 -0.17 0.00 0.00 0.00 0.00 61.98 63.18 2f1d s VAL 35 Cb -0.04 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.15 2f1d s VAL 35 CO 0.10 -0.53 0.43 0.00 0.00 0.00 0.00 175.10 175.10 2f1d s ALA 36 N 4.42 3.46 -0.42 5.51 0.00 -1.26 -1.82 121.76 131.65 2f1d s ALA 36 Ca 0.55 -1.29 0.04 0.00 0.00 0.00 0.00 51.96 51.27 2f1d s ALA 36 Cb -0.16 -2.96 0.17 0.00 0.00 0.00 0.00 23.12 20.18 2f1d s ALA 36 CO 0.24 -1.31 0.38 -3.47 0.00 0.00 0.00 175.76 171.59 2f1d n ASP 37 N 5.56 -0.75 -3.83 0.00 4.64 -0.56 -5.02 116.55 116.58 2f1d n ASP 37 Ca -0.07 -2.42 -0.25 0.00 -1.38 0.00 0.00 54.79 50.66 2f1d n ASP 37 Cb 0.48 -0.35 -0.17 0.00 -1.04 0.00 0.00 41.12 40.04 2f1d n ASP 37 CO 0.00 0.00 0.00 -0.44 -0.82 0.00 0.00 177.20 175.94 2f1d s SER 38 N 0.10 2.02 -0.24 1.67 0.01 -1.26 -2.09 113.70 113.91 2f1d s SER 38 Ca 0.33 -0.27 -0.00 0.00 1.31 0.00 0.00 55.95 57.32 2f1d s SER 38 Cb 0.04 -0.64 0.07 0.00 0.21 0.00 0.00 66.02 65.69 2f1d s SER 38 CO -0.19 -0.17 -0.00 -0.55 0.41 0.00 0.00 173.24 172.74 2f1d s SER 39 N 1.84 3.67 0.00 2.44 0.15 -0.80 -4.87 113.70 116.13 2f1d s SER 39 Ca 0.04 -1.19 0.08 0.00 0.70 0.00 0.00 55.95 55.58 2f1d s SER 39 Cb -0.13 -1.00 0.04 0.00 -1.71 0.00 0.00 66.02 63.22 2f1d s SER 39 CO -0.07 -0.29 0.67 -1.54 1.20 0.00 0.00 173.24 173.22 2f1d n SER 40 N 4.78 1.42 0.00 5.45 3.41 -1.26 -2.84 113.62 124.57 2f1d n SER 40 Ca -0.09 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.31 2f1d n SER 40 Cb 0.44 0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.60 2f1d n SER 40 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2f1d n GLY 41 N 0.61 0.52 2.87 5.00 0.00 -1.26 -4.62 105.19 108.30 2f1d n GLY 41 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 2f1d n GLY 41 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f1d s ILE 42 N -2.36 2.04 0.27 -0.61 1.01 -1.26 -5.01 121.20 115.27 2f1d s ILE 42 Ca 0.00 -2.79 -0.00 0.00 0.00 0.00 0.00 60.65 57.86 2f1d s ILE 42 Cb 0.00 -2.44 0.25 0.00 0.01 0.00 0.00 42.46 40.28 2f1d s ILE 42 CO 0.00 -0.79 1.80 -0.65 0.00 0.00 0.00 174.94 175.30 2f1d h PRO 43 N 6.86 0.77 -0.30 2.79 0.11 -1.99 -1.65 132.00 138.59 2f1d h PRO 43 Ca -0.06 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.86 2f1d h PRO 43 Cb 0.93 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 2f1d h PRO 43 CO 0.58 0.51 -0.39 0.35 -0.21 0.00 0.00 178.00 178.84 2f1d h PHE 44 N 0.79 0.84 -0.17 0.65 3.57 -1.95 -2.76 116.94 117.91 2f1d h PHE 44 Ca 0.47 -0.24 -0.09 0.00 3.53 0.00 0.00 57.97 61.63 2f1d h PHE 44 Cb 0.55 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 2f1d h PHE 44 CO -0.05 0.98 -0.31 1.25 -2.23 0.00 0.00 178.31 177.96 2f1d h LEU 45 N 0.58 0.33 -0.34 0.59 5.85 -1.76 -2.71 115.31 117.84 2f1d h LEU 45 Ca 0.05 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 2f1d h LEU 45 Cb 0.93 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 2f1d h LEU 45 CO 0.08 0.63 0.05 0.44 -0.34 0.00 0.00 178.44 179.30 2f1d h ASP 46 N 0.28 0.55 -0.51 1.25 3.32 -1.17 -1.10 116.42 119.04 2f1d h ASP 46 Ca 0.04 -0.26 0.07 0.00 0.02 0.00 0.00 57.03 56.89 2f1d h ASP 46 Cb 0.69 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 2f1d h ASP 46 CO 0.05 0.67 0.34 -0.74 -1.72 0.00 0.00 179.24 177.84 2f1d h HIS 47 N 0.40 0.42 0.03 4.55 2.76 -1.33 0.88 115.15 122.87 2f1d h HIS 47 Ca 0.10 0.01 -0.23 0.00 -2.20 0.00 0.00 60.37 58.06 2f1d h HIS 47 Cb 0.36 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.16 2f1d h HIS 47 CO 0.02 0.22 -1.06 0.52 -1.30 0.00 0.00 177.93 176.34 2f1d h MET 48 N 0.41 0.07 0.00 5.26 2.86 -1.11 -2.62 114.93 119.80 2f1d h MET 48 Ca 0.22 -0.12 -0.15 0.00 -2.06 0.00 0.00 59.70 57.59 2f1d h MET 48 Cb 0.35 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 2f1d h MET 48 CO -0.06 1.05 -0.72 -0.07 1.06 0.00 0.00 176.91 178.18 2f1d h LEU 49 N 0.02 0.00 -0.66 1.22 3.38 -0.62 -1.52 115.31 117.13 2f1d h LEU 49 Ca -0.04 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 2f1d h LEU 49 Cb 1.81 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.53 2f1d h LEU 49 CO 0.15 0.72 0.14 0.44 0.09 0.00 0.00 178.44 179.98 2f1d h ASP 50 N 0.00 1.02 0.32 -0.43 3.32 -0.84 -1.62 116.42 118.19 2f1d h ASP 50 Ca -0.01 -0.24 -0.10 0.00 0.02 0.00 0.00 57.03 56.70 2f1d h ASP 50 Cb 1.37 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.64 2f1d h ASP 50 CO 0.09 1.00 -0.41 1.56 -1.72 0.00 0.00 179.24 179.76 2f1d h GLN 51 N 0.99 0.12 -0.41 3.56 1.08 -1.38 0.46 115.11 119.53 2f1d h GLN 51 Ca 0.20 -0.05 -0.10 0.00 -1.45 0.00 0.00 58.65 57.25 2f1d h GLN 51 Cb 0.39 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.81 2f1d h GLN 51 CO 0.01 0.51 -0.13 1.25 -0.95 0.00 0.00 178.83 179.52 2f1d h LEU 52 N 0.10 0.83 -0.14 1.46 5.85 -0.82 -2.40 115.31 120.20 2f1d h LEU 52 Ca 0.01 -0.38 -0.14 0.00 0.84 0.00 0.00 57.88 58.21 2f1d h LEU 52 Cb 0.77 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.58 2f1d h LEU 52 CO 0.06 1.02 -0.46 0.00 -0.34 0.00 0.00 178.44 178.72 2f1d h ALA 53 N 0.84 0.25 0.24 1.25 0.00 -1.18 -2.90 119.26 117.76 2f1d h ALA 53 Ca 0.10 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 2f1d h ALA 53 Cb 0.67 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2f1d h ALA 53 CO 0.05 0.40 -0.12 1.03 0.00 0.00 0.00 179.25 180.61 2f1d h SER 54 N 0.20 -0.27 1.29 0.00 0.87 -0.92 -1.22 113.55 113.49 2f1d h SER 54 Ca -0.02 -0.05 -0.13 0.00 -1.23 0.00 0.00 61.79 60.36 2f1d h SER 54 Cb 1.09 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.10 2f1d h SER 54 CO 0.10 -0.13 -0.73 0.45 -0.53 0.00 0.00 176.83 175.99 2f1d h HIS 55 N -0.40 0.00 -0.01 2.24 -0.00 -1.57 -3.26 115.15 112.15 2f1d h HIS 55 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.34 2f1d h HIS 55 Cb 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.72 2f1d h HIS 55 CO -0.04 0.58 -0.52 0.41 -0.00 0.00 0.00 177.93 178.37 2f1d n GLY 56 N 1.27 -0.46 3.87 2.45 0.00 -1.09 -4.53 105.19 106.69 2f1d n GLY 56 Ca -0.00 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 2f1d n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2f1d n LEU 57 N -0.62 -2.18 -4.76 0.99 4.77 -0.50 -4.76 117.00 109.93 2f1d n LEU 57 Ca 0.09 -1.06 -0.23 0.00 -0.03 0.00 0.00 56.01 54.78 2f1d n LEU 57 Cb 0.40 -2.19 -0.05 0.00 -2.33 0.00 0.00 43.42 39.24 2f1d n LEU 57 CO 0.31 0.50 -0.23 -0.36 -1.33 0.00 0.00 177.39 176.29 2f1d s PHE 58 N -3.71 2.99 -0.18 -1.77 0.40 -0.95 -2.94 117.98 111.81 2f1d s PHE 58 Ca 0.27 -0.13 -0.11 0.00 -0.60 0.00 0.00 56.93 56.36 2f1d s PHE 58 Cb -0.11 -1.35 -0.05 0.00 0.51 0.00 0.00 43.02 42.02 2f1d s PHE 58 CO 0.89 0.55 0.17 -0.51 0.70 0.00 0.00 175.22 177.02 2f1d s ASP 59 N -3.68 6.28 -0.18 1.36 1.01 -1.08 -2.72 116.67 117.66 2f1d s ASP 59 Ca 0.32 0.32 0.00 0.00 0.71 0.00 0.00 52.55 53.90 2f1d s ASP 59 Cb -0.08 -2.11 0.04 0.00 1.01 0.00 0.00 42.92 41.78 2f1d s ASP 59 CO 0.23 0.19 -0.09 -0.69 0.21 0.00 0.00 175.17 175.02 2f1d s VAL 60 N 0.23 1.42 -0.15 -1.27 1.01 -0.75 -2.24 120.40 118.65 2f1d s VAL 60 Ca 0.11 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.29 2f1d s VAL 60 Cb -0.12 -1.51 -0.00 0.00 0.00 0.00 0.00 36.38 34.75 2f1d s VAL 60 CO -0.00 0.20 -0.15 -2.28 0.00 0.00 0.00 175.10 172.87 2f1d s HIS 61 N 1.50 2.78 -0.10 5.22 2.46 -0.66 -1.50 115.29 124.99 2f1d s HIS 61 Ca 0.01 -0.96 -0.04 0.00 0.47 0.00 0.00 55.06 54.54 2f1d s HIS 61 Cb -0.15 -1.87 0.05 0.00 -0.13 0.00 0.00 32.58 30.47 2f1d s HIS 61 CO -0.08 -0.42 0.21 0.08 -2.47 0.00 0.00 174.74 172.06 2f1d s VAL 62 N 0.71 -0.19 -0.02 0.89 1.01 -0.89 -1.90 120.40 120.00 2f1d s VAL 62 Ca -0.07 0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.18 2f1d s VAL 62 Cb -0.16 -0.35 -0.00 0.00 0.00 0.00 0.00 36.38 35.87 2f1d s VAL 62 CO 0.02 0.10 -0.11 -0.60 0.00 0.00 0.00 175.10 174.50 2f1d s ARG 63 N 1.78 1.09 0.02 2.72 6.06 -0.28 -1.90 118.95 128.45 2f1d s ARG 63 Ca -0.04 -0.40 -0.27 0.00 -2.50 0.00 0.00 55.73 52.52 2f1d s ARG 63 Cb -0.11 -1.01 0.07 0.00 0.06 0.00 0.00 34.95 33.95 2f1d s ARG 63 CO -0.07 0.19 0.63 0.00 -2.50 0.00 0.00 175.30 173.55 2f1d s ALA 64 N -0.00 -1.65 -0.01 6.12 0.00 -1.13 -1.44 121.76 123.65 2f1d s ALA 64 Ca -0.00 0.98 0.02 0.00 0.00 0.00 0.00 51.96 52.95 2f1d s ALA 64 Cb -0.08 0.31 -0.00 0.00 0.00 0.00 0.00 23.12 23.35 2f1d s ALA 64 CO 0.00 -0.50 -0.06 0.99 0.00 0.00 0.00 175.76 176.19 2f1d s THR 65 N -2.08 0.48 0.29 0.00 2.01 -0.90 -4.30 115.64 111.13 2f1d s THR 65 Ca -0.07 -0.25 -0.07 0.00 0.31 0.00 0.00 61.69 61.61 2f1d s THR 65 Cb -0.00 -0.41 0.03 0.00 0.01 0.00 0.00 72.50 72.12 2f1d s THR 65 CO 0.02 0.14 0.51 0.61 -0.69 0.00 0.00 174.62 175.21 2f1d n GLY 66 N 3.01 1.68 1.63 4.40 0.00 -1.26 -1.99 105.19 112.67 2f1d n GLY 66 Ca -0.14 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.53 2f1d n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f1d n ASP 67 N -1.54 1.73 0.23 1.61 10.43 -1.25 -4.49 116.55 123.27 2f1d n ASP 67 Ca -0.04 -1.33 0.16 0.00 2.57 0.00 0.00 54.79 56.15 2f1d n ASP 67 Cb 0.45 -0.35 0.74 0.00 1.84 0.00 0.00 41.12 43.79 2f1d n ASP 67 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 2f1d h VAL 68 N 1.41 0.00 0.00 2.53 2.07 -1.96 0.41 116.25 120.72 2f1d h VAL 68 Ca 0.00 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.27 2f1d h VAL 68 Cb 0.36 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2f1d h VAL 68 CO 0.00 0.00 -0.23 1.12 0.02 0.00 0.00 177.57 178.48 2f1d h HIS 69 N 0.00 0.00 0.00 1.57 2.07 -2.01 -3.27 115.15 113.51 2f1d h HIS 69 Ca 0.00 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.47 2f1d h HIS 69 Cb 0.23 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.21 2f1d h HIS 69 CO 0.00 0.23 -0.32 0.82 -3.07 0.00 0.00 177.93 175.59 2f1d h ILE 70 N 0.00 1.12 -1.51 6.12 2.04 -0.55 -3.50 117.51 121.22 2f1d h ILE 70 Ca -0.00 -1.95 0.12 0.00 1.00 0.00 0.00 64.86 64.03 2f1d h ILE 70 Cb 0.65 2.23 -0.23 0.00 -0.74 0.00 0.00 36.82 38.73 2f1d h ILE 70 CO 0.03 0.38 0.64 -0.62 0.00 0.00 0.00 178.15 178.58 2f1d s ASP 71 N -6.20 -0.29 0.00 1.72 2.15 -1.04 -5.02 116.67 107.99 2f1d s ASP 71 Ca -0.17 0.28 0.31 0.00 0.43 0.00 0.00 52.55 53.39 2f1d s ASP 71 Cb -0.00 0.25 1.66 0.00 -0.30 0.00 0.00 42.92 44.53 2f1d s ASP 71 CO 0.50 -0.30 2.11 0.47 -0.17 0.00 0.00 175.17 177.79 2f1d n ASP 72 N 0.56 0.00 -0.14 -0.34 8.00 -1.26 -3.86 116.55 119.51 2f1d n ASP 72 Ca -0.07 -0.47 -0.11 0.00 0.71 0.00 0.00 54.79 54.85 2f1d n ASP 72 Cb 0.58 -0.18 -0.02 0.00 -0.02 0.00 0.00 41.12 41.49 2f1d n ASP 72 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 2f1d h HIS 73 N 0.00 0.80 -0.10 1.24 2.76 -1.95 -2.64 115.15 115.26 2f1d h HIS 73 Ca 0.00 -0.15 -0.05 0.00 -2.20 0.00 0.00 60.37 57.97 2f1d h HIS 73 Cb 0.17 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 28.93 2f1d h HIS 73 CO 0.00 0.82 -0.15 0.45 -1.30 0.00 0.00 177.93 177.75 2f1d h HIS 74 N 0.54 0.34 -0.72 5.26 3.86 -1.94 -2.65 115.15 119.85 2f1d h HIS 74 Ca 0.11 -0.12 -0.05 0.00 -1.16 0.00 0.00 60.37 59.15 2f1d h HIS 74 Cb 0.53 -0.07 -0.03 0.00 1.06 0.00 0.00 27.41 28.90 2f1d h HIS 74 CO 0.04 0.74 0.25 1.15 0.86 0.00 0.00 177.93 180.98 2f1d h THR 75 N -0.16 1.25 -0.65 2.45 2.02 -1.86 -2.14 112.91 113.83 2f1d h THR 75 Ca 0.01 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.33 2f1d h THR 75 Cb 0.71 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 2f1d h THR 75 CO 0.03 0.33 0.32 -1.13 0.37 0.00 0.00 175.52 175.45 2f1d h ASN 76 N 1.06 0.84 -0.09 4.18 -0.73 -1.49 -1.84 115.58 117.50 2f1d h ASN 76 Ca 0.24 -0.13 -0.02 0.00 1.87 0.00 0.00 56.30 58.26 2f1d h ASN 76 Cb 0.26 -0.22 -0.00 0.00 0.27 0.00 0.00 38.32 38.63 2f1d h ASN 76 CO -0.01 0.73 -0.00 -0.08 -0.37 0.00 0.00 177.43 177.69 2f1d h GLU 77 N 0.89 0.17 0.00 6.67 4.81 -1.08 -2.25 114.58 123.79 2f1d h GLU 77 Ca 0.22 -0.06 -0.23 0.00 -0.13 0.00 0.00 59.36 59.16 2f1d h GLU 77 Cb 0.11 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.48 2f1d h GLU 77 CO -0.03 0.44 -0.96 -0.44 -0.73 0.00 0.00 179.01 177.29 2f1d h ASP 78 N -0.12 0.60 -0.92 1.04 3.32 -1.40 -0.68 116.42 118.27 2f1d h ASP 78 Ca 0.03 -0.48 0.03 0.00 0.02 0.00 0.00 57.03 56.63 2f1d h ASP 78 Cb 0.37 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.68 2f1d h ASP 78 CO 0.01 1.28 0.60 0.40 -1.72 0.00 0.00 179.24 179.80 2f1d h ILE 79 N 0.26 1.16 -0.15 0.35 2.04 -1.40 0.15 117.51 119.92 2f1d h ILE 79 Ca -0.09 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 2f1d h ILE 79 Cb 1.60 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2f1d h ILE 79 CO 0.17 0.21 0.05 0.00 0.00 0.00 0.00 178.15 178.59 2f1d h ALA 80 N 1.37 0.20 -0.20 1.87 0.00 -1.06 -1.57 119.26 119.86 2f1d h ALA 80 Ca 0.36 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 2f1d h ALA 80 Cb -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2f1d h ALA 80 CO -0.11 -0.20 -0.14 -0.07 0.00 0.00 0.00 179.25 178.73 2f1d h LEU 81 N 0.08 0.32 0.08 0.00 3.38 -0.91 -2.80 115.31 115.46 2f1d h LEU 81 Ca 0.05 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2f1d h LEU 81 Cb 0.20 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2f1d h LEU 81 CO -0.00 0.49 -0.04 0.00 0.09 0.00 0.00 178.44 178.98 2f1d h ALA 82 N 1.55 -0.11 -0.76 1.53 0.00 -0.50 -2.82 119.26 118.15 2f1d h ALA 82 Ca 0.06 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2f1d h ALA 82 Cb 0.44 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2f1d h ALA 82 CO 0.03 -0.43 0.47 0.82 0.00 0.00 0.00 179.25 180.14 2f1d h ILE 83 N -0.37 1.08 -0.40 0.00 2.04 -1.09 -0.41 117.51 118.37 2f1d h ILE 83 Ca -0.01 -0.31 -0.11 0.00 1.00 0.00 0.00 64.86 65.43 2f1d h ILE 83 Cb 0.31 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2f1d h ILE 83 CO 0.02 0.17 -0.20 1.23 0.00 0.00 0.00 178.15 179.36 2f1d h GLY 84 N 0.91 0.84 1.00 5.37 0.00 -1.55 -1.12 103.07 108.51 2f1d h GLY 84 Ca 0.31 -0.70 -0.06 0.00 0.00 0.00 0.00 47.33 46.89 2f1d h GLY 84 CO -0.13 0.64 0.11 -0.84 0.00 0.00 0.00 176.54 176.32 2f1d h THR 85 N 0.68 1.25 -0.65 4.70 2.02 -1.13 -1.11 112.91 118.67 2f1d h THR 85 Ca 0.10 -0.91 0.02 0.00 0.77 0.00 0.00 66.41 66.39 2f1d h THR 85 Cb 0.70 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 2f1d h THR 85 CO 0.05 0.33 0.43 0.00 0.37 0.00 0.00 175.52 176.70 2f1d h ALA 86 N 1.00 1.60 -0.26 6.16 0.00 -0.83 -1.86 119.26 125.07 2f1d h ALA 86 Ca 0.16 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 2f1d h ALA 86 Cb 0.37 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2f1d h ALA 86 CO 0.01 0.34 -0.50 1.25 0.00 0.00 0.00 179.25 180.35 2f1d h LEU 87 N 0.81 0.89 -1.04 0.00 5.85 -0.86 -2.04 115.31 118.93 2f1d h LEU 87 Ca 0.25 -0.54 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 2f1d h LEU 87 Cb 0.01 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.76 2f1d h LEU 87 CO -0.06 1.26 0.15 0.25 -0.34 0.00 0.00 178.44 179.69 2f1d h LEU 88 N 0.56 0.78 -0.19 2.25 5.85 -0.70 -0.91 115.31 122.95 2f1d h LEU 88 Ca 0.01 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.53 2f1d h LEU 88 Cb 1.11 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.93 2f1d h LEU 88 CO 0.11 0.75 -0.14 0.11 -0.34 0.00 0.00 178.44 178.93 2f1d h LYS 89 N 0.81 0.44 -0.39 1.25 1.57 -1.32 -3.09 116.57 115.83 2f1d h LYS 89 Ca 0.18 -0.21 -0.07 0.00 -1.87 0.00 0.00 60.65 58.68 2f1d h LYS 89 Cb 0.28 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2f1d h LYS 89 CO -0.00 0.76 -0.03 0.00 -0.57 0.00 0.00 179.45 179.61 2f1d h ALA 90 N 0.66 0.52 -0.59 3.86 0.00 -0.97 -2.65 119.26 120.09 2f1d h ALA 90 Ca 0.04 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.68 2f1d h ALA 90 Cb 0.66 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 2f1d h ALA 90 CO 0.04 0.33 0.39 -0.07 0.00 0.00 0.00 179.25 179.93 2f1d h LEU 91 N 0.52 0.68 0.00 0.00 3.38 -1.29 -3.44 115.31 115.16 2f1d h LEU 91 Ca 0.11 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2f1d h LEU 91 Cb 0.51 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2f1d h LEU 91 CO 0.03 0.50 0.00 0.61 0.09 0.00 0.00 178.44 179.66 2f1d n GLY 92 N -1.44 3.54 0.14 0.83 0.00 -1.00 -2.11 105.19 105.15 2f1d n GLY 92 Ca 0.06 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.17 2f1d n GLY 92 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2f1d n GLU 93 N 14.00 0.17 -3.33 1.61 -0.00 -1.26 -4.87 120.64 126.96 2f1d n GLU 93 Ca 0.00 0.51 -0.18 0.00 -0.00 0.00 0.00 57.16 57.49 2f1d n GLU 93 Cb 0.00 -1.90 0.06 0.00 -0.00 0.00 0.00 31.44 29.60 2f1d n GLU 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2f1d n ARG 94 N -2.23 -6.16 -2.93 3.44 1.74 -0.90 -4.96 116.66 104.66 2f1d n ARG 94 Ca 0.01 0.66 -0.40 0.00 -0.77 0.00 0.00 57.85 57.34 2f1d n ARG 94 Cb 0.14 -5.17 -0.04 0.00 -1.02 0.00 0.00 32.46 26.37 2f1d n ARG 94 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2f1d s LYS 95 N -5.90 4.50 -1.53 5.56 -0.14 -1.26 -4.29 119.74 116.68 2f1d s LYS 95 Ca 0.40 1.09 -0.04 0.00 -1.36 0.00 0.00 55.97 56.06 2f1d s LYS 95 Cb -0.17 -3.42 0.01 0.00 -1.68 0.00 0.00 37.83 32.57 2f1d s LYS 95 CO 0.58 0.11 0.40 0.41 -0.76 0.00 0.00 175.35 176.08 2f1d n GLY 96 N 2.80 -0.51 3.80 -3.33 0.00 -1.26 -4.99 105.19 101.71 2f1d n GLY 96 Ca 0.00 0.08 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 2f1d n GLY 96 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2f1d s ILE 97 N -3.06 4.60 0.21 -0.61 -4.36 -1.26 -1.85 121.20 114.86 2f1d s ILE 97 Ca 0.22 -0.91 -0.10 0.00 -0.26 0.00 0.00 60.65 59.60 2f1d s ILE 97 Cb -0.10 -3.30 0.14 0.00 1.25 0.00 0.00 42.46 40.46 2f1d s ILE 97 CO 0.27 -0.01 1.74 0.78 0.24 0.00 0.00 174.94 177.96 2f1d h ASN 98 N 2.74 0.20 0.00 4.36 2.35 -1.48 -3.44 115.58 120.31 2f1d h ASN 98 Ca -0.47 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.36 2f1d h ASN 98 Cb 1.18 0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.62 2f1d h ASN 98 CO 0.65 0.12 0.00 -1.14 -1.65 0.00 0.00 177.43 175.41 2f1d n ARG 99 N -5.01 0.00 -3.74 0.81 0.63 -0.92 -4.96 116.66 103.48 2f1d n ARG 99 Ca 0.08 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.66 2f1d n ARG 99 Cb 0.27 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.13 2f1d n ARG 99 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2f1d s PHE 100 N -0.28 3.59 0.08 -0.14 0.40 -1.26 -1.89 117.98 118.49 2f1d s PHE 100 Ca 0.00 0.62 0.07 0.00 -0.60 0.00 0.00 56.93 57.02 2f1d s PHE 100 Cb 0.00 -2.02 -0.03 0.00 0.51 0.00 0.00 43.02 41.48 2f1d s PHE 100 CO 0.00 0.62 -0.18 0.20 0.70 0.00 0.00 175.22 176.57 2f1d s GLY 101 N -1.58 1.06 -0.30 4.36 0.00 -0.57 -3.55 107.32 106.74 2f1d s GLY 101 Ca 0.26 -1.12 -0.02 0.00 0.00 0.00 0.00 44.72 43.84 2f1d s GLY 101 CO 0.15 -1.13 0.63 -0.35 0.00 0.00 0.00 173.10 172.40 2f1d s ASP 102 N -1.78 -1.32 -0.19 1.64 2.15 -1.26 -1.23 116.67 114.68 2f1d s ASP 102 Ca 0.03 0.90 -0.14 0.00 0.43 0.00 0.00 52.55 53.77 2f1d s ASP 102 Cb -0.10 2.14 0.06 0.00 -0.30 0.00 0.00 42.92 44.71 2f1d s ASP 102 CO 0.03 -0.25 0.49 0.12 -0.17 0.00 0.00 175.17 175.39 2f1d s PHE 103 N 2.87 -0.65 -0.16 -5.34 5.36 -0.29 -4.88 117.98 114.89 2f1d s PHE 103 Ca 0.18 1.43 -0.01 0.00 -0.96 0.00 0.00 56.93 57.57 2f1d s PHE 103 Cb -0.14 0.29 -0.01 0.00 -0.34 0.00 0.00 43.02 42.81 2f1d s PHE 103 CO -0.20 -0.33 -0.12 0.99 -1.46 0.00 0.00 175.22 174.09 2f1d s THR 104 N 0.94 2.99 -0.04 0.12 2.01 -1.26 -1.06 115.64 119.34 2f1d s THR 104 Ca -0.05 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.30 2f1d s THR 104 Cb -0.06 -2.28 0.02 0.00 0.01 0.00 0.00 72.50 70.19 2f1d s THR 104 CO -0.08 0.50 -0.06 0.00 -0.69 0.00 0.00 174.62 174.30 2f1d s ALA 105 N 0.71 0.71 0.10 7.40 0.00 -0.61 -4.93 121.76 125.14 2f1d s ALA 105 Ca -0.06 -0.11 -0.15 0.00 0.00 0.00 0.00 51.96 51.64 2f1d s ALA 105 Cb -0.15 -0.39 -0.07 0.00 0.00 0.00 0.00 23.12 22.51 2f1d s ALA 105 CO 0.02 0.03 0.52 -1.25 0.00 0.00 0.00 175.76 175.07 2f1d s PRO 106 N 0.73 4.00 -0.31 0.00 0.04 -1.26 -2.32 135.00 135.88 2f1d s PRO 106 Ca -0.10 0.51 0.02 0.00 0.04 0.00 0.00 61.00 61.47 2f1d s PRO 106 Cb -0.13 -3.06 0.09 0.00 0.04 0.00 0.00 34.50 31.44 2f1d s PRO 106 CO 0.01 0.56 0.04 -1.17 0.04 0.00 0.00 177.00 176.47 2f1d s LEU 107 N -1.61 3.70 0.00 -3.56 2.96 -1.04 -4.99 118.68 114.14 2f1d s LEU 107 Ca 0.33 -1.83 0.00 0.00 -0.22 0.00 0.00 54.13 52.41 2f1d s LEU 107 Cb -0.16 -1.36 0.00 0.00 0.50 0.00 0.00 46.19 45.17 2f1d s LEU 107 CO 0.18 -0.36 0.00 0.47 -1.32 0.00 0.00 176.35 175.32 2f1d n ASP 108 N 4.48 0.00 0.14 3.68 8.00 -1.26 -1.85 116.55 129.75 2f1d n ASP 108 Ca -0.01 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.52 2f1d n ASP 108 Cb 0.42 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.56 2f1d n ASP 108 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2f1d h GLU 109 N 0.00 0.00 -7.26 -1.24 9.09 -1.98 -3.46 114.58 109.73 2f1d h GLU 109 Ca 0.00 0.00 -0.50 0.00 0.05 0.00 0.00 59.36 58.91 2f1d h GLU 109 Cb 0.00 0.00 0.08 0.00 -1.65 0.00 0.00 28.75 27.18 2f1d h GLU 109 CO 0.00 0.47 0.37 0.00 0.05 0.00 0.00 179.01 179.90 2f1d s ALA 110 N -2.98 2.71 -0.30 1.06 0.00 -0.77 -3.47 121.76 118.01 2f1d s ALA 110 Ca 0.04 0.25 -0.08 0.00 0.00 0.00 0.00 51.96 52.17 2f1d s ALA 110 Cb 0.07 -3.20 0.14 0.00 0.00 0.00 0.00 23.12 20.13 2f1d s ALA 110 CO 0.74 -1.01 0.65 -1.17 0.00 0.00 0.00 175.76 174.97 2f1d s LEU 111 N -5.00 -1.19 -0.08 0.00 2.96 -1.10 -2.48 118.68 111.79 2f1d s LEU 111 Ca 0.61 1.41 0.01 0.00 -0.22 0.00 0.00 54.13 55.94 2f1d s LEU 111 Cb -0.15 2.26 0.02 0.00 0.50 0.00 0.00 46.19 48.82 2f1d s LEU 111 CO 0.45 -0.23 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.53 2f1d s ILE 112 N 2.88 1.04 -0.26 6.68 -1.09 -0.98 -1.80 121.20 127.67 2f1d s ILE 112 Ca 0.00 -0.38 -0.11 0.00 -2.23 0.00 0.00 60.65 57.93 2f1d s ILE 112 Cb -0.13 -0.99 -0.05 0.00 -1.58 0.00 0.00 42.46 39.72 2f1d s ILE 112 CO -0.19 0.34 0.17 -2.28 -1.23 0.00 0.00 174.94 171.75 2f1d s HIS 113 N 0.98 3.26 -0.12 3.97 5.65 -0.86 -1.57 115.29 126.60 2f1d s HIS 113 Ca -0.09 0.16 -0.00 0.00 0.25 0.00 0.00 55.06 55.38 2f1d s HIS 113 Cb -0.15 -2.33 -0.02 0.00 -1.18 0.00 0.00 32.58 28.90 2f1d s HIS 113 CO -0.00 -0.07 -0.11 0.08 -0.65 0.00 0.00 174.74 173.99 2f1d s VAL 114 N 1.46 3.21 -0.15 0.89 1.01 -0.22 -1.33 120.40 125.26 2f1d s VAL 114 Ca 0.07 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 2f1d s VAL 114 Cb -0.15 -2.35 0.05 0.00 0.00 0.00 0.00 36.38 33.93 2f1d s VAL 114 CO 0.08 0.53 0.02 -0.55 0.00 0.00 0.00 175.10 175.19 2f1d s SER 115 N 0.15 2.48 0.32 3.32 0.15 -0.63 -1.14 113.70 118.34 2f1d s SER 115 Ca -0.06 -0.58 0.07 0.00 0.70 0.00 0.00 55.95 56.08 2f1d s SER 115 Cb -0.15 -0.55 -0.06 0.00 -1.71 0.00 0.00 66.02 63.55 2f1d s SER 115 CO 0.04 -0.27 -0.03 -1.48 1.20 0.00 0.00 173.24 172.70 2f1d s LEU 116 N 1.90 2.53 -0.26 3.45 0.05 -0.36 -1.79 118.68 124.19 2f1d s LEU 116 Ca 0.01 -1.25 -0.02 0.00 0.05 0.00 0.00 54.13 52.92 2f1d s LEU 116 Cb -0.15 -0.69 0.15 0.00 -2.05 0.00 0.00 46.19 43.44 2f1d s LEU 116 CO -0.07 -0.38 0.43 -0.62 -0.55 0.00 0.00 176.35 175.16 2f1d s ASP 117 N -3.52 -0.14 -1.08 1.48 2.15 0.68 -1.52 116.67 114.72 2f1d s ASP 117 Ca 0.32 0.35 -0.24 0.00 0.43 0.00 0.00 52.55 53.41 2f1d s ASP 117 Cb 0.05 1.36 -0.09 0.00 -0.30 0.00 0.00 42.92 43.94 2f1d s ASP 117 CO 0.14 -0.29 1.98 -0.76 -0.17 0.00 0.00 175.17 176.07 2f1d s LEU 118 N 2.62 3.00 -0.09 -1.34 1.43 -0.79 -1.37 118.68 122.13 2f1d s LEU 118 Ca 0.14 -1.25 0.17 0.00 -1.03 0.00 0.00 54.13 52.16 2f1d s LEU 118 Cb -0.15 -2.58 -0.25 0.00 0.03 0.00 0.00 46.19 43.23 2f1d s LEU 118 CO -0.18 -3.20 0.24 -1.54 0.23 0.00 0.00 176.35 171.90 2f1d n SER 119 N 15.02 0.73 0.00 2.29 3.41 -1.11 -4.98 113.62 128.98 2f1d n SER 119 Ca 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 2f1d n SER 119 Cb 0.47 1.41 0.00 0.00 -0.26 0.00 0.00 64.21 65.83 2f1d n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2f1d n GLY 120 N 1.68 0.75 2.94 5.00 0.00 0.13 -5.04 105.19 110.64 2f1d n GLY 120 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 2f1d n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2f1d s ARG 121 N -0.74 1.72 0.38 1.61 0.52 -1.21 -4.85 118.95 116.38 2f1d s ARG 121 Ca 0.00 -0.45 -0.25 0.00 -0.52 0.00 0.00 55.73 54.51 2f1d s ARG 121 Cb 0.00 -1.90 -0.09 0.00 0.52 0.00 0.00 34.95 33.48 2f1d s ARG 121 CO 0.00 -0.32 1.07 -1.25 0.02 0.00 0.00 175.30 174.82 2f1d s PRO 122 N 1.61 4.23 -0.29 3.54 0.04 -1.26 -3.76 135.00 139.10 2f1d s PRO 122 Ca 0.03 1.61 -0.15 0.00 0.04 0.00 0.00 61.00 62.52 2f1d s PRO 122 Cb -0.14 -2.67 0.14 0.00 0.04 0.00 0.00 34.50 31.87 2f1d s PRO 122 CO -0.09 -0.11 0.91 -0.47 0.04 0.00 0.00 177.00 177.28 2f1d s TYR 123 N -1.54 -0.73 -0.23 0.56 5.04 -1.00 -4.91 117.35 114.54 2f1d s TYR 123 Ca 0.55 1.40 0.01 0.00 -2.44 0.00 0.00 57.07 56.60 2f1d s TYR 123 Cb -0.25 0.44 0.04 0.00 0.35 0.00 0.00 41.96 42.54 2f1d s TYR 123 CO 0.31 -0.36 -0.12 -1.17 -1.34 0.00 0.00 175.55 172.87 2f1d s LEU 124 N 1.72 3.00 -0.44 6.97 2.96 -1.26 -0.55 118.68 131.08 2f1d s LEU 124 Ca -0.08 -1.04 -0.16 0.00 -0.22 0.00 0.00 54.13 52.63 2f1d s LEU 124 Cb -0.05 -1.56 0.04 0.00 0.50 0.00 0.00 46.19 45.12 2f1d s LEU 124 CO -0.17 -0.12 0.40 -0.83 -1.32 0.00 0.00 176.35 174.32 2f1d s GLY 125 N 1.22 1.95 -0.21 7.98 0.00 -0.72 -5.03 107.32 112.52 2f1d s GLY 125 Ca -0.02 -1.74 0.02 0.00 0.00 0.00 0.00 44.72 42.97 2f1d s GLY 125 CO -0.07 1.09 -0.17 -0.47 0.00 0.00 0.00 173.10 173.48 2f1d s TYR 126 N 1.93 2.94 -0.53 1.90 5.04 -1.26 -1.37 117.35 126.00 2f1d s TYR 126 Ca 0.08 -1.87 0.07 0.00 -2.44 0.00 0.00 57.07 52.92 2f1d s TYR 126 Cb -0.20 -1.92 0.27 0.00 0.35 0.00 0.00 41.96 40.46 2f1d s TYR 126 CO 0.11 -0.83 0.69 0.09 -1.34 0.00 0.00 175.55 174.26 2f1d n ASN 127 N 4.56 2.38 -3.82 4.32 4.13 -0.85 -5.03 115.26 120.95 2f1d n ASN 127 Ca -0.19 -3.18 -0.24 0.00 1.68 0.00 0.00 54.58 52.65 2f1d n ASN 127 Cb 0.47 -0.65 -0.17 0.00 -1.54 0.00 0.00 39.78 37.90 2f1d n ASN 127 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2f1d s LEU 128 N -2.13 0.82 -0.41 3.41 2.96 -1.26 -2.11 118.68 119.97 2f1d s LEU 128 Ca 0.39 -0.17 -0.03 0.00 -0.22 0.00 0.00 54.13 54.10 2f1d s LEU 128 Cb 0.18 -0.60 0.11 0.00 0.50 0.00 0.00 46.19 46.38 2f1d s LEU 128 CO -0.06 -0.16 0.20 -1.83 -1.32 0.00 0.00 176.35 173.18 2f1d s GLU 129 N 1.87 2.08 -0.22 1.98 -1.05 -1.26 -5.07 118.70 117.03 2f1d s GLU 129 Ca 0.05 -1.77 -0.20 0.00 -0.15 0.00 0.00 54.97 52.89 2f1d s GLU 129 Cb -0.12 -3.59 -0.02 0.00 -0.44 0.00 0.00 34.13 29.95 2f1d s GLU 129 CO -0.06 -1.05 0.62 0.42 0.95 0.00 0.00 175.26 176.14 2f1d s ILE 130 N 1.17 5.01 -0.19 1.83 1.01 -1.26 -4.99 121.20 123.79 2f1d s ILE 130 Ca 0.07 1.15 0.26 0.00 0.00 0.00 0.00 60.65 62.13 2f1d s ILE 130 Cb -0.23 -3.93 0.33 0.00 0.01 0.00 0.00 42.46 38.64 2f1d s ILE 130 CO -0.04 0.09 1.74 1.55 0.00 0.00 0.00 174.94 178.28 2f1d h PRO 131 N 7.63 0.00 -6.30 2.79 0.13 -1.96 -3.45 132.00 130.85 2f1d h PRO 131 Ca -0.30 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.17 2f1d h PRO 131 Cb 1.14 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.13 2f1d h PRO 131 CO 0.77 0.06 -0.67 0.95 -0.23 0.00 0.00 178.00 178.88 2f1d s THR 132 N -3.38 3.90 -0.90 1.56 -4.23 -1.26 -5.03 115.64 106.30 2f1d s THR 132 Ca 0.04 -0.85 0.27 0.00 -1.18 0.00 0.00 61.69 59.98 2f1d s THR 132 Cb 0.07 -2.78 0.25 0.00 1.34 0.00 0.00 72.50 71.37 2f1d s THR 132 CO 0.63 0.26 1.84 0.00 -0.54 0.00 0.00 174.62 176.82 2f1d n GLN 133 N 1.07 0.09 -3.70 3.99 6.02 -1.26 -4.78 117.38 118.81 2f1d n GLN 133 Ca -0.13 0.10 -0.11 0.00 -0.01 0.00 0.00 57.00 56.84 2f1d n GLN 133 Cb 0.52 -1.60 -0.12 0.00 1.02 0.00 0.00 30.24 30.06 2f1d n GLN 133 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2f1d s ARG 134 N -3.04 0.32 -0.39 -1.09 0.52 -1.26 -2.57 118.95 111.44 2f1d s ARG 134 Ca 0.12 0.71 -0.05 0.00 -0.52 0.00 0.00 55.73 55.99 2f1d s ARG 134 Cb 0.16 -0.05 0.08 0.00 0.52 0.00 0.00 34.95 35.67 2f1d s ARG 134 CO 0.53 -0.17 0.17 0.14 0.02 0.00 0.00 175.30 175.99 2f1d s VAL 135 N 1.43 3.55 0.00 3.52 -7.23 -1.04 -4.88 120.40 115.75 2f1d s VAL 135 Ca -0.09 -1.66 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 2f1d s VAL 135 Cb -0.09 -3.25 0.00 0.00 0.56 0.00 0.00 36.38 33.60 2f1d s VAL 135 CO -0.11 -0.49 0.00 0.61 -0.31 0.00 0.00 175.10 174.80 2f1d n GLY 136 N 4.71 2.31 0.54 2.32 0.00 -1.26 -2.47 105.19 111.34 2f1d n GLY 136 Ca -0.08 -0.10 0.07 0.00 0.00 0.00 0.00 46.02 45.91 2f1d n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2f1d n THR 137 N 0.00 1.81 -3.71 2.61 -2.24 -1.26 -5.03 114.28 106.46 2f1d n THR 137 Ca 0.00 -2.62 -0.37 0.00 -2.27 0.00 0.00 64.05 58.79 2f1d n THR 137 Cb 0.00 -0.09 -0.12 0.00 -2.10 0.00 0.00 70.33 68.03 2f1d n THR 137 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2f1d s TYR 138 N -2.68 3.16 0.13 4.78 5.04 -1.03 -4.99 117.35 121.76 2f1d s TYR 138 Ca 0.34 -0.13 -0.31 0.00 -2.44 0.00 0.00 57.07 54.53 2f1d s TYR 138 Cb 0.33 -2.28 -0.10 0.00 0.35 0.00 0.00 41.96 40.26 2f1d s TYR 138 CO -0.05 -0.21 1.72 0.34 -1.34 0.00 0.00 175.55 176.01 2f1d s ASP 139 N 1.52 6.49 0.35 4.32 -1.08 -1.26 -2.51 116.67 124.49 2f1d s ASP 139 Ca 0.06 2.69 0.14 0.00 -0.52 0.00 0.00 52.55 54.92 2f1d s ASP 139 Cb -0.15 -2.58 0.64 0.00 -1.46 0.00 0.00 42.92 39.37 2f1d s ASP 139 CO 0.06 -0.94 1.75 0.74 0.52 0.00 0.00 175.17 177.31 2f1d h THR 140 N 4.42 1.22 0.00 1.71 2.02 -1.80 -2.57 112.91 117.91 2f1d h THR 140 Ca -0.44 -1.55 0.00 0.00 0.77 0.00 0.00 66.41 65.19 2f1d h THR 140 Cb 1.21 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 69.48 2f1d h THR 140 CO 0.94 0.43 0.00 1.56 0.37 0.00 0.00 175.52 178.82 2f1d h GLN 141 N 0.00 0.00 0.00 6.66 4.20 -1.89 -2.98 115.11 121.10 2f1d h GLN 141 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2f1d h GLN 141 Cb 0.82 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.60 2f1d h GLN 141 CO 0.06 0.00 0.00 -0.07 -0.67 0.00 0.00 178.83 178.15 2f1d h LEU 142 N 0.00 0.00 -0.25 1.46 4.07 -1.85 -3.17 115.31 115.58 2f1d h LEU 142 Ca 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 2f1d h LEU 142 Cb 0.11 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 2f1d h LEU 142 CO 0.00 0.00 0.14 0.58 -1.08 0.00 0.00 178.44 178.08 2f1d h VAL 143 N 0.00 1.11 -0.64 1.22 2.07 -1.72 0.16 116.25 118.45 2f1d h VAL 143 Ca 0.00 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 2f1d h VAL 143 Cb 0.82 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 2f1d h VAL 143 CO 0.00 0.11 0.27 -0.08 0.02 0.00 0.00 177.57 177.89 2f1d h GLU 144 N 0.30 0.94 0.00 1.57 4.81 -1.77 -2.70 114.58 117.74 2f1d h GLU 144 Ca 0.09 -0.16 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 2f1d h GLU 144 Cb 0.04 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 2f1d h GLU 144 CO -0.02 0.78 -0.37 1.25 -0.73 0.00 0.00 179.01 179.92 2f1d h HIS 145 N 0.89 0.00 -0.05 0.92 2.76 -1.49 -1.75 115.15 116.43 2f1d h HIS 145 Ca 0.21 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.37 2f1d h HIS 145 Cb 0.17 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.13 2f1d h HIS 145 CO 0.01 0.37 -0.01 0.35 -1.30 0.00 0.00 177.93 177.35 2f1d h PHE 146 N 0.00 0.11 0.00 5.26 3.57 -0.42 -2.30 116.94 123.16 2f1d h PHE 146 Ca -0.00 -0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.38 2f1d h PHE 146 Cb 0.70 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 2f1d h PHE 146 CO 0.00 0.42 -0.47 0.74 -2.23 0.00 0.00 178.31 176.78 2f1d h PHE 147 N -0.24 0.00 -0.06 0.41 -1.00 -1.36 -0.97 116.94 113.73 2f1d h PHE 147 Ca 0.01 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 2f1d h PHE 147 Cb 0.39 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.95 2f1d h PHE 147 CO 0.05 0.47 -0.04 0.37 -1.61 0.00 0.00 178.31 177.55 2f1d h GLN 148 N 0.00 0.12 -0.25 1.51 5.75 -1.30 -0.66 115.11 120.28 2f1d h GLN 148 Ca -0.00 -0.06 -0.18 0.00 -0.15 0.00 0.00 58.65 58.26 2f1d h GLN 148 Cb 0.95 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.50 2f1d h GLN 148 CO 0.06 0.53 -0.55 0.77 -2.65 0.00 0.00 178.83 176.99 2f1d h SER 149 N -0.28 0.92 -0.46 -0.69 0.02 -1.38 -1.93 113.55 109.75 2f1d h SER 149 Ca 0.01 -0.55 0.09 0.00 -0.84 0.00 0.00 61.79 60.50 2f1d h SER 149 Cb 0.50 -0.27 -0.08 0.00 0.14 0.00 0.00 62.40 62.69 2f1d h SER 149 CO 0.01 1.30 -0.02 0.25 -1.14 0.00 0.00 176.83 177.23 2f1d h LEU 150 N 0.58 -0.24 -0.86 5.07 6.46 -1.23 -2.85 115.31 122.25 2f1d h LEU 150 Ca 0.00 0.12 -0.00 0.00 -0.12 0.00 0.00 57.88 57.88 2f1d h LEU 150 Cb 1.16 0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 41.26 2f1d h LEU 150 CO 0.12 -0.08 0.53 0.58 -0.62 0.00 0.00 178.44 178.97 2f1d h VAL 151 N 0.09 1.24 -0.08 1.05 2.07 -0.62 -2.51 116.25 117.49 2f1d h VAL 151 Ca 0.23 -0.50 -0.18 0.00 0.82 0.00 0.00 66.70 67.07 2f1d h VAL 151 Cb 0.35 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2f1d h VAL 151 CO -0.40 0.24 -0.70 0.78 0.02 0.00 0.00 177.57 177.51 2f1d h ASN 152 N 1.18 0.44 0.09 0.57 2.35 -1.12 -1.40 115.58 117.69 2f1d h ASN 152 Ca 0.31 -0.28 -0.14 0.00 -0.55 0.00 0.00 56.30 55.64 2f1d h ASN 152 Cb -0.06 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.19 2f1d h ASN 152 CO -0.06 1.00 -0.62 0.71 -1.65 0.00 0.00 177.43 176.81 2f1d h THR 153 N 0.26 1.55 -0.96 2.81 1.35 -1.60 -3.36 112.91 112.97 2f1d h THR 153 Ca -0.02 -2.46 0.12 0.00 -0.55 0.00 0.00 66.41 63.49 2f1d h THR 153 Cb 1.26 3.20 -0.08 0.00 -1.73 0.00 0.00 68.15 70.81 2f1d h THR 153 CO 0.12 0.67 0.61 -1.28 -0.25 0.00 0.00 175.52 175.39 2f1d h SER 154 N -0.58 0.85 -2.41 5.36 0.87 -1.42 -3.42 113.55 112.80 2f1d h SER 154 Ca -0.12 0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.40 2f1d h SER 154 Cb 1.45 -0.13 0.04 0.00 -0.44 0.00 0.00 62.40 63.31 2f1d h SER 154 CO 0.09 0.46 -0.17 0.61 -0.53 0.00 0.00 176.83 177.30 2f1d n GLY 155 N -1.38 0.47 3.33 5.77 0.00 -0.54 -4.69 105.19 108.14 2f1d n GLY 155 Ca 0.18 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 2f1d n GLY 155 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2f1d s MET 156 N -4.90 2.93 -0.41 1.61 -2.45 -1.17 -0.70 119.30 114.22 2f1d s MET 156 Ca 0.08 -0.79 -0.24 0.00 -1.25 0.00 0.00 55.69 53.48 2f1d s MET 156 Cb -0.04 -2.38 0.02 0.00 1.25 0.00 0.00 34.83 33.68 2f1d s MET 156 CO 0.17 0.32 0.85 0.99 1.05 0.00 0.00 175.02 178.40 2f1d s THR 157 N 0.02 4.61 -0.11 10.11 2.01 -0.47 -2.38 115.64 129.43 2f1d s THR 157 Ca -0.07 0.84 -0.01 0.00 0.31 0.00 0.00 61.69 62.76 2f1d s THR 157 Cb -0.15 -4.32 0.03 0.00 0.01 0.00 0.00 72.50 68.07 2f1d s THR 157 CO 0.05 -0.61 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.09 2f1d s LEU 158 N 3.39 1.09 -0.15 4.42 2.96 0.29 -0.23 118.68 130.46 2f1d s LEU 158 Ca 0.34 -0.31 -0.04 0.00 -0.22 0.00 0.00 54.13 53.90 2f1d s LEU 158 Cb -0.12 -0.75 -0.03 0.00 0.50 0.00 0.00 46.19 45.79 2f1d s LEU 158 CO 0.21 -0.15 -0.01 -1.00 -1.32 0.00 0.00 176.35 174.08 2f1d s HIS 159 N 1.77 3.11 -0.16 5.38 3.76 -0.74 -1.75 115.29 126.66 2f1d s HIS 159 Ca 0.04 -0.10 0.02 0.00 -0.15 0.00 0.00 55.06 54.87 2f1d s HIS 159 Cb -0.13 -1.95 0.01 0.00 1.11 0.00 0.00 32.58 31.63 2f1d s HIS 159 CO -0.07 0.12 -0.21 0.42 -0.85 0.00 0.00 174.74 174.15 2f1d s ILE 160 N 0.08 2.06 -0.05 0.60 1.01 -0.47 -1.60 121.20 122.83 2f1d s ILE 160 Ca 0.01 -0.96 0.05 0.00 0.00 0.00 0.00 60.65 59.75 2f1d s ILE 160 Cb -0.13 -1.84 -0.01 0.00 0.01 0.00 0.00 42.46 40.50 2f1d s ILE 160 CO 0.02 0.55 -0.21 -0.13 0.00 0.00 0.00 174.94 175.17 2f1d s ARG 161 N 1.00 2.19 -0.10 2.79 0.52 -0.44 -2.00 118.95 122.91 2f1d s ARG 161 Ca -0.02 -0.75 -0.20 0.00 -0.52 0.00 0.00 55.73 54.24 2f1d s ARG 161 Cb -0.15 -1.86 -0.04 0.00 0.52 0.00 0.00 34.95 33.42 2f1d s ARG 161 CO -0.06 0.29 0.56 -1.14 0.02 0.00 0.00 175.30 174.97 2f1d s GLN 162 N -0.02 4.37 -0.05 3.54 0.74 -0.90 -2.03 119.66 125.32 2f1d s GLN 162 Ca -0.05 0.60 0.09 0.00 0.05 0.00 0.00 55.36 56.05 2f1d s GLN 162 Cb -0.13 -3.44 -0.13 0.00 1.10 0.00 0.00 33.01 30.41 2f1d s GLN 162 CO 0.03 0.13 0.12 1.28 -0.55 0.00 0.00 175.29 176.30 2f1d n LEU 163 N 3.69 0.00 -3.79 3.68 4.77 -0.74 -5.00 117.00 119.60 2f1d n LEU 163 Ca -0.05 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.87 2f1d n LEU 163 Cb 0.51 0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.70 2f1d n LEU 163 CO 0.44 0.11 0.58 0.00 -1.33 0.00 0.00 177.39 177.20 2f1d s ALA 164 N -2.43 -1.43 0.00 -1.18 0.00 -1.17 -4.93 121.76 110.61 2f1d s ALA 164 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 51.96 51.86 2f1d s ALA 164 Cb 0.04 0.75 0.00 0.00 0.00 0.00 0.00 23.12 23.91 2f1d s ALA 164 CO 0.38 -1.02 0.00 0.41 0.00 0.00 0.00 175.76 175.53 2f1d n GLY 165 N -0.46 4.72 1.63 0.00 0.00 -1.23 -2.72 105.19 107.13 2f1d n GLY 165 Ca -0.05 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.89 2f1d n GLY 165 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2f1d n GLU 166 N -1.92 0.00 -2.32 1.61 1.02 -1.26 -4.94 120.64 112.83 2f1d n GLU 166 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 2f1d n GLU 166 Cb 0.00 -0.19 -0.03 0.00 -0.02 0.00 0.00 31.44 31.20 2f1d n GLU 166 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2f1d s ASN 167 N -5.04 6.98 0.06 1.62 3.84 -1.26 -4.68 114.94 116.45 2f1d s ASN 167 Ca 0.00 2.15 -0.22 0.00 0.21 0.00 0.00 52.86 55.01 2f1d s ASN 167 Cb 0.00 -2.58 -0.13 0.00 -0.55 0.00 0.00 41.25 37.99 2f1d s ASN 167 CO 0.00 -0.54 1.51 0.28 -2.79 0.00 0.00 177.10 175.56 2f1d h SER 168 N 6.71 0.21 -0.47 -4.21 0.02 -1.97 -2.67 113.55 111.17 2f1d h SER 168 Ca -0.42 -0.28 0.09 0.00 -0.84 0.00 0.00 61.79 60.35 2f1d h SER 168 Cb 1.21 -0.06 -0.09 0.00 0.14 0.00 0.00 62.40 63.60 2f1d h SER 168 CO 0.83 0.43 -0.15 -0.74 -1.14 0.00 0.00 176.83 176.06 2f1d h HIS 169 N -0.02 -0.36 -0.74 3.45 6.17 -1.98 -1.94 115.15 119.73 2f1d h HIS 169 Ca 0.04 0.05 0.04 0.00 0.71 0.00 0.00 60.37 61.20 2f1d h HIS 169 Cb 0.32 0.23 -0.05 0.00 2.52 0.00 0.00 27.41 30.43 2f1d h HIS 169 CO 0.02 -0.24 0.46 0.45 0.71 0.00 0.00 177.93 179.33 2f1d h HIS 170 N -0.05 0.85 -0.23 5.26 3.86 -1.88 0.01 115.15 122.97 2f1d h HIS 170 Ca 0.22 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.43 2f1d h HIS 170 Cb 0.39 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 2f1d h HIS 170 CO -0.43 0.47 0.03 0.82 0.86 0.00 0.00 177.93 179.68 2f1d h ILE 171 N 0.87 1.23 -0.18 2.45 2.04 -1.02 0.20 117.51 123.10 2f1d h ILE 171 Ca 0.31 -0.77 -0.13 0.00 1.00 0.00 0.00 64.86 65.27 2f1d h ILE 171 Cb 0.07 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 2f1d h ILE 171 CO -0.13 0.24 -0.38 0.40 0.00 0.00 0.00 178.15 178.28 2f1d h ILE 172 N 0.19 1.34 -0.65 -0.67 2.04 -1.25 -2.19 117.51 116.31 2f1d h ILE 172 Ca 0.07 -1.62 -0.06 0.00 1.00 0.00 0.00 64.86 64.25 2f1d h ILE 172 Cb 0.33 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 38.30 2f1d h ILE 172 CO 0.01 0.50 0.16 -0.08 0.00 0.00 0.00 178.15 178.73 2f1d h GLU 173 N 0.23 1.03 0.00 2.37 4.81 -0.96 -2.68 114.58 119.38 2f1d h GLU 173 Ca 0.00 -0.23 -0.07 0.00 -0.13 0.00 0.00 59.36 58.93 2f1d h GLU 173 Cb 0.98 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 2f1d h GLU 173 CO 0.08 0.91 -0.33 0.00 -0.73 0.00 0.00 179.01 178.94 2f1d h ALA 174 N 1.19 1.13 -0.23 2.92 0.00 -0.54 -1.33 119.26 122.39 2f1d h ALA 174 Ca 0.21 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 2f1d h ALA 174 Cb 0.34 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2f1d h ALA 174 CO 0.00 0.42 -0.59 1.15 0.00 0.00 0.00 179.25 180.23 2f1d h THR 175 N 0.00 1.30 -0.00 0.00 2.02 -1.08 -2.00 112.91 113.15 2f1d h THR 175 Ca -0.00 -1.81 -0.19 0.00 0.77 0.00 0.00 66.41 65.18 2f1d h THR 175 Cb 0.75 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.89 2f1d h THR 175 CO 0.04 0.58 -0.83 -0.26 0.37 0.00 0.00 175.52 175.42 2f1d h PHE 176 N 0.55 0.24 -0.40 3.16 -1.00 -1.19 0.14 116.94 118.44 2f1d h PHE 176 Ca 0.00 -0.13 -0.04 0.00 2.81 0.00 0.00 57.97 60.62 2f1d h PHE 176 Cb 1.18 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 40.69 2f1d h PHE 176 CO 0.06 0.92 0.11 0.87 -1.61 0.00 0.00 178.31 178.66 2f1d h LYS 177 N 0.09 0.63 0.00 1.51 1.57 -1.25 -1.72 116.57 117.40 2f1d h LYS 177 Ca -0.03 -0.15 -0.13 0.00 -1.87 0.00 0.00 60.65 58.47 2f1d h LYS 177 Cb 1.44 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.65 2f1d h LYS 177 CO 0.12 0.65 -0.62 0.00 -0.57 0.00 0.00 179.45 179.03 2f1d h ALA 178 N 0.96 0.72 -0.07 3.86 0.00 -1.27 -3.01 119.26 120.44 2f1d h ALA 178 Ca 0.13 -0.57 -0.21 0.00 0.00 0.00 0.00 54.91 54.26 2f1d h ALA 178 Cb 0.29 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2f1d h ALA 178 CO -0.00 0.78 -0.82 0.35 0.00 0.00 0.00 179.25 179.56 2f1d h PHE 179 N 0.00 0.75 -0.24 0.00 3.57 -0.62 -3.02 116.94 117.38 2f1d h PHE 179 Ca -0.01 -0.35 -0.19 0.00 3.53 0.00 0.00 57.97 60.95 2f1d h PHE 179 Cb 1.31 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.95 2f1d h PHE 179 CO 0.00 1.15 -0.60 0.00 -2.23 0.00 0.00 178.31 176.64 2f1d h ALA 180 N 0.74 0.47 0.00 2.41 0.00 -1.28 -1.26 119.26 120.34 2f1d h ALA 180 Ca -0.06 -0.53 -0.13 0.00 0.00 0.00 0.00 54.91 54.19 2f1d h ALA 180 Cb 1.43 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 2f1d h ALA 180 CO 0.15 0.69 -0.61 0.00 0.00 0.00 0.00 179.25 179.48 2f1d h ARG 181 N 0.60 0.00 0.00 0.00 3.08 -1.61 -1.85 114.38 114.61 2f1d h ARG 181 Ca -0.00 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.82 2f1d h ARG 181 Cb 1.20 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.22 2f1d h ARG 181 CO 0.13 0.61 -1.14 0.00 -1.07 0.00 0.00 179.97 178.49 2f1d h ALA 182 N 1.39 0.43 0.37 0.04 0.00 -1.48 -2.44 119.26 117.58 2f1d h ALA 182 Ca -0.01 -1.02 -0.02 0.00 0.00 0.00 0.00 54.91 53.87 2f1d h ALA 182 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2f1d h ALA 182 CO 0.08 1.31 -0.18 1.25 0.00 0.00 0.00 179.25 181.71 2f1d h LEU 183 N 0.00 -0.42 -0.89 0.00 6.46 -1.16 -2.64 115.31 116.66 2f1d h LEU 183 Ca -0.07 -0.14 0.17 0.00 -0.12 0.00 0.00 57.88 57.72 2f1d h LEU 183 Cb 1.82 0.11 -0.16 0.00 -0.73 0.00 0.00 40.66 41.70 2f1d h LEU 183 CO 0.12 -0.01 -0.26 -0.09 -0.62 0.00 0.00 178.44 177.59 2f1d h ARG 184 N -0.94 -0.01 -0.43 1.25 2.43 -1.45 0.11 114.38 115.35 2f1d h ARG 184 Ca -0.05 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.17 2f1d h ARG 184 Cb 0.54 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.04 2f1d h ARG 184 CO 0.08 -0.01 0.16 0.37 -1.51 0.00 0.00 179.97 179.07 2f1d h GLN 185 N -0.01 0.32 -0.20 0.20 4.15 -1.38 -0.55 115.11 117.65 2f1d h GLN 185 Ca 0.40 -0.02 -0.08 0.00 0.77 0.00 0.00 58.65 59.73 2f1d h GLN 185 Cb 0.64 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.24 2f1d h GLN 185 CO -0.91 0.21 -0.22 0.00 -1.93 0.00 0.00 178.83 175.98 2f1d h ALA 186 N 1.28 1.26 0.00 3.38 0.00 -0.50 -3.01 119.26 121.67 2f1d h ALA 186 Ca 0.20 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2f1d h ALA 186 Cb 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2f1d h ALA 186 CO -0.20 0.49 -0.26 1.79 0.00 0.00 0.00 179.25 181.07 2f1d h THR 187 N 0.32 0.00 -4.24 0.00 1.35 -0.02 -2.43 112.91 107.89 2f1d h THR 187 Ca 0.05 -0.77 -0.50 0.00 -0.55 0.00 0.00 66.41 64.64 2f1d h THR 187 Cb 0.57 1.62 0.14 0.00 -1.73 0.00 0.00 68.15 68.75 2f1d h THR 187 CO 0.04 0.00 0.30 -1.61 -0.25 0.00 0.00 175.52 174.00 2f1d s GLU 188 N -3.20 1.94 0.20 4.72 2.02 -0.31 -4.86 118.70 119.21 2f1d s GLU 188 Ca 0.07 1.06 -0.07 0.00 0.02 0.00 0.00 54.97 56.05 2f1d s GLU 188 Cb 0.09 -1.87 -0.06 0.00 0.10 0.00 0.00 34.13 32.39 2f1d s GLU 188 CO 0.68 -1.83 0.47 0.95 0.02 0.00 0.00 175.26 175.54 2f1d s THR 189 N -2.92 5.05 -0.25 3.63 -4.23 -1.26 -2.23 115.64 113.44 2f1d s THR 189 Ca 0.62 0.21 -0.07 0.00 -1.18 0.00 0.00 61.69 61.26 2f1d s THR 189 Cb -0.17 -3.63 -0.03 0.00 1.34 0.00 0.00 72.50 70.00 2f1d s THR 189 CO 0.56 -0.05 0.07 -0.62 -0.54 0.00 0.00 174.62 174.04 2f1d s ASP 190 N -2.49 5.11 -0.83 3.99 2.15 -0.77 -4.77 116.67 119.05 2f1d s ASP 190 Ca 0.44 -0.21 -0.20 0.00 0.43 0.00 0.00 52.55 53.01 2f1d s ASP 190 Cb -0.12 -1.92 -0.19 0.00 -0.30 0.00 0.00 42.92 40.39 2f1d s ASP 190 CO 0.24 -0.03 2.22 -2.65 -0.17 0.00 0.00 175.17 174.78 2f1d n PRO 191 N 4.90 0.32 0.00 4.34 -0.02 -1.26 -4.87 135.00 138.42 2f1d n PRO 191 Ca -0.16 -0.72 0.05 0.00 -2.02 0.00 0.00 63.50 60.65 2f1d n PRO 191 Cb 0.51 -2.91 0.04 0.00 -0.02 0.00 0.00 33.50 31.12 2f1d n PRO 191 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02