#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 3.84 -0.04 1.61 0.52 -1.26 -5.00 118.95 118.62 2f1d s ARG 11 Ca 0.00 0.27 0.04 0.00 -0.52 0.00 0.00 55.73 55.52 2f1d s ARG 11 Cb 0.00 -3.76 -0.00 0.00 0.52 0.00 0.00 34.95 31.71 2f1d s ARG 11 CO 0.00 -0.65 -0.16 0.42 0.02 0.00 0.00 175.30 174.93 2f1d s ILE 12 N 2.71 1.37 -0.05 1.52 1.01 -1.26 -1.53 121.20 124.98 2f1d s ILE 12 Ca 0.26 -0.68 0.06 0.00 0.00 0.00 0.00 60.65 60.29 2f1d s ILE 12 Cb -0.15 -1.19 -0.01 0.00 0.01 0.00 0.00 42.46 41.13 2f1d s ILE 12 CO 0.13 0.40 -0.23 -0.83 0.00 0.00 0.00 174.94 174.41 2f1d s GLY 13 N 0.10 1.19 0.00 6.18 0.00 -0.86 -4.28 107.32 109.65 2f1d s GLY 13 Ca -0.05 -0.96 0.04 0.00 0.00 0.00 0.00 44.72 43.75 2f1d s GLY 13 CO 0.02 -0.61 -0.13 1.85 0.00 0.00 0.00 173.10 174.23 2f1d s GLU 14 N -0.17 1.04 -0.15 2.90 2.12 -1.26 -1.80 118.70 121.38 2f1d s GLU 14 Ca -0.02 -0.54 -0.06 0.00 0.36 0.00 0.00 54.97 54.71 2f1d s GLU 14 Cb -0.13 -1.01 0.07 0.00 0.26 0.00 0.00 34.13 33.32 2f1d s GLU 14 CO 0.03 0.27 0.32 0.08 -0.54 0.00 0.00 175.26 175.42 2f1d s VAL 15 N -0.44 -0.45 0.05 3.70 1.01 -0.60 -4.89 120.40 118.78 2f1d s VAL 15 Ca 0.04 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.25 2f1d s VAL 15 Cb -0.06 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 2f1d s VAL 15 CO -0.00 0.09 0.16 -1.59 0.00 0.00 0.00 175.10 173.76 2f1d s LYS 16 N 2.35 3.27 -0.30 2.72 0.00 -1.26 -1.67 119.74 124.85 2f1d s LYS 16 Ca -0.01 -0.48 -0.12 0.00 0.00 0.00 0.00 55.97 55.36 2f1d s LYS 16 Cb -0.12 -2.96 0.17 0.00 0.00 0.00 0.00 37.83 34.92 2f1d s LYS 16 CO -0.10 0.62 0.90 0.50 0.00 0.00 0.00 175.35 177.26 2f1d s ARG 17 N -2.30 0.35 0.06 1.78 3.52 -0.73 -5.01 118.95 116.62 2f1d s ARG 17 Ca 0.31 0.77 0.08 0.00 -0.13 0.00 0.00 55.73 56.76 2f1d s ARG 17 Cb -0.13 0.45 -0.03 0.00 -1.56 0.00 0.00 34.95 33.69 2f1d s ARG 17 CO 0.23 -0.22 -0.22 0.08 -0.81 0.00 0.00 175.30 174.37 2f1d s VAL 18 N 2.69 1.75 0.19 7.11 1.01 -1.26 -1.48 120.40 130.41 2f1d s VAL 18 Ca 0.01 -1.34 0.03 0.00 0.00 0.00 0.00 61.98 60.69 2f1d s VAL 18 Cb -0.09 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.73 2f1d s VAL 18 CO -0.17 0.14 0.11 0.35 0.00 0.00 0.00 175.10 175.53 2f1d n THR 19 N 1.59 0.00 0.22 3.92 -2.24 -0.62 -5.02 114.28 112.14 2f1d n THR 19 Ca -0.18 -1.21 0.07 0.00 -2.27 0.00 0.00 64.05 60.46 2f1d n THR 19 Cb 0.53 0.52 0.58 0.00 -2.10 0.00 0.00 70.33 69.86 2f1d n THR 19 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2f1d h LYS 20 N 0.00 0.06 0.04 -0.78 -0.00 -2.04 -3.34 116.57 110.51 2f1d h LYS 20 Ca -0.14 -0.01 -0.38 0.00 -0.00 0.00 0.00 60.65 60.12 2f1d h LYS 20 Cb 0.61 -0.01 -0.05 0.00 -0.00 0.00 0.00 32.23 32.77 2f1d h LYS 20 CO 0.21 0.09 -2.29 0.39 -0.00 0.00 0.00 179.45 177.86 2f1d n GLU 21 N -4.47 0.68 -4.14 0.07 1.02 -1.26 -5.04 120.64 107.50 2f1d n GLU 21 Ca -0.02 0.21 -0.09 0.00 -0.02 0.00 0.00 57.16 57.24 2f1d n GLU 21 Cb 0.13 -1.59 -0.10 0.00 -0.02 0.00 0.00 31.44 29.86 2f1d n GLU 21 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2f1d s THR 22 N -2.53 0.32 -0.09 2.62 -4.23 -1.26 -3.15 115.64 107.33 2f1d s THR 22 Ca -0.31 -1.88 -0.00 0.00 -1.18 0.00 0.00 61.69 58.31 2f1d s THR 22 Cb 0.09 -1.78 0.03 0.00 1.34 0.00 0.00 72.50 72.17 2f1d s THR 22 CO 0.65 -0.76 -0.04 0.21 -0.54 0.00 0.00 174.62 174.14 2f1d s ASN 23 N -3.01 1.78 -0.03 3.99 3.84 -0.57 -1.59 114.94 119.35 2f1d s ASN 23 Ca 0.15 -0.19 0.02 0.00 0.21 0.00 0.00 52.86 53.04 2f1d s ASN 23 Cb 0.07 -0.63 0.01 0.00 -0.55 0.00 0.00 41.25 40.15 2f1d s ASN 23 CO -0.04 -0.13 -0.06 -0.69 -2.79 0.00 0.00 177.10 173.39 2f1d s VAL 24 N 1.67 0.55 -0.07 -5.21 1.01 -0.55 -2.28 120.40 115.53 2f1d s VAL 24 Ca 0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 61.98 61.77 2f1d s VAL 24 Cb -0.13 -0.52 0.04 0.00 0.00 0.00 0.00 36.38 35.77 2f1d s VAL 24 CO -0.05 0.20 0.14 -0.55 0.00 0.00 0.00 175.10 174.83 2f1d s SER 25 N 0.42 0.14 -0.05 3.32 0.15 -0.65 -1.77 113.70 115.25 2f1d s SER 25 Ca -0.06 0.28 -0.02 0.00 0.70 0.00 0.00 55.95 56.86 2f1d s SER 25 Cb -0.09 0.18 0.04 0.00 -1.71 0.00 0.00 66.02 64.43 2f1d s SER 25 CO 0.00 -0.17 0.09 -0.69 1.20 0.00 0.00 173.24 173.67 2f1d s VAL 26 N 1.46 -0.15 -0.13 4.45 1.01 -0.67 -1.70 120.40 124.67 2f1d s VAL 26 Ca -0.06 0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.33 2f1d s VAL 26 Cb -0.12 -0.19 0.01 0.00 0.00 0.00 0.00 36.38 36.08 2f1d s VAL 26 CO -0.06 0.16 -0.20 -1.59 0.00 0.00 0.00 175.10 173.41 2f1d s LYS 27 N 2.11 2.81 -0.07 2.72 -2.85 -0.86 -1.56 119.74 122.02 2f1d s LYS 27 Ca 0.03 -0.78 0.01 0.00 -1.00 0.00 0.00 55.97 54.23 2f1d s LYS 27 Cb -0.12 -2.29 0.02 0.00 -2.06 0.00 0.00 37.83 33.38 2f1d s LYS 27 CO -0.04 -0.03 -0.07 0.42 0.10 0.00 0.00 175.35 175.73 2f1d s ILE 28 N 0.87 0.87 -0.34 3.79 1.01 -0.74 -1.16 121.20 125.50 2f1d s ILE 28 Ca -0.07 -0.26 -0.10 0.00 0.00 0.00 0.00 60.65 60.21 2f1d s ILE 28 Cb -0.15 -0.86 0.00 0.00 0.01 0.00 0.00 42.46 41.46 2f1d s ILE 28 CO -0.02 0.31 0.18 0.21 0.00 0.00 0.00 174.94 175.63 2f1d s ASN 29 N 1.18 5.67 0.53 3.58 3.84 -0.64 -2.02 114.94 127.08 2f1d s ASN 29 Ca -0.06 -0.68 0.32 0.00 0.21 0.00 0.00 52.86 52.65 2f1d s ASN 29 Cb -0.14 -2.03 1.27 0.00 -0.55 0.00 0.00 41.25 39.80 2f1d s ASN 29 CO -0.02 -0.27 1.95 -0.07 -2.79 0.00 0.00 177.10 175.91 2f1d h LEU 30 N 8.40 0.00 -4.49 3.21 3.38 -1.60 -2.76 115.31 121.45 2f1d h LEU 30 Ca -0.30 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.07 2f1d h LEU 30 Cb 1.13 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.48 2f1d h LEU 30 CO 0.64 0.04 -0.54 0.47 0.09 0.00 0.00 178.44 179.13 2f1d n ASP 31 N -3.15 5.04 -1.25 -0.43 8.00 -1.26 -4.76 116.55 118.74 2f1d n ASP 31 Ca 0.01 -3.74 0.00 0.00 0.71 0.00 0.00 54.79 51.77 2f1d n ASP 31 Cb 0.33 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 40.92 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 -0.51 1.67 0.22 0.44 0.00 -1.13 -4.60 105.19 101.28 2f1d n GLY 32 Ca 0.41 -2.05 0.03 0.00 0.00 0.00 0.00 46.02 44.40 2f1d n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2f1d n THR 33 N -0.62 0.21 -1.23 2.61 -2.24 -1.26 -4.67 114.28 107.08 2f1d n THR 33 Ca 0.00 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 2f1d n THR 33 Cb 0.00 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.21 2f1d n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2f1d n GLY 34 N 0.22 0.61 3.52 3.38 0.00 -1.20 -4.88 105.19 106.84 2f1d n GLY 34 Ca 0.03 -0.31 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.27 4.70 -0.16 1.61 1.01 -1.22 -4.56 120.40 119.50 2f1d s VAL 35 Ca 0.00 0.23 -0.16 0.00 0.00 0.00 0.00 61.98 62.05 2f1d s VAL 35 Cb 0.00 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 2f1d s VAL 35 CO 0.00 -0.73 0.38 0.00 0.00 0.00 0.00 175.10 174.75 2f1d s ALA 36 N 3.15 3.55 -0.40 5.51 0.00 -1.26 -1.69 121.76 130.61 2f1d s ALA 36 Ca 0.26 -0.41 0.10 0.00 0.00 0.00 0.00 51.96 51.91 2f1d s ALA 36 Cb -0.13 -2.55 0.35 0.00 0.00 0.00 0.00 23.12 20.78 2f1d s ALA 36 CO 0.20 -0.08 0.91 -3.47 0.00 0.00 0.00 175.76 173.33 2f1d n ASP 37 N 3.93 -0.45 -4.41 0.00 4.64 -0.44 -4.99 116.55 114.82 2f1d n ASP 37 Ca -0.09 -3.25 -0.34 0.00 -1.38 0.00 0.00 54.79 49.74 2f1d n ASP 37 Cb 0.51 0.42 -0.13 0.00 -1.04 0.00 0.00 41.12 40.88 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 -1.98 4.42 -0.32 1.67 0.01 -1.26 -1.55 113.70 114.69 2f1d s SER 38 Ca 0.32 -0.25 -0.02 0.00 1.31 0.00 0.00 55.95 57.31 2f1d s SER 38 Cb 0.33 -1.71 0.12 0.00 0.21 0.00 0.00 66.02 64.97 2f1d s SER 38 CO -0.06 0.13 0.17 -0.55 0.41 0.00 0.00 173.24 173.34 2f1d s SER 39 N 0.58 3.19 -0.00 2.44 0.15 -0.74 -4.90 113.70 114.42 2f1d s SER 39 Ca -0.05 -1.71 0.13 0.00 0.70 0.00 0.00 55.95 55.03 2f1d s SER 39 Cb -0.15 -0.34 -0.16 0.00 -1.71 0.00 0.00 66.02 63.66 2f1d s SER 39 CO 0.03 -0.37 0.52 -1.54 1.20 0.00 0.00 173.24 173.08 2f1d n SER 40 N 4.66 0.85 0.00 5.45 3.41 -1.26 -2.07 113.62 124.66 2f1d n SER 40 Ca 0.03 -0.67 0.00 0.00 -0.26 0.00 0.00 58.87 57.97 2f1d n SER 40 Cb 0.40 1.11 0.00 0.00 -0.26 0.00 0.00 64.21 65.46 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 1.39 0.78 2.84 5.00 0.00 -1.26 -4.56 105.19 109.38 2f1d n GLY 41 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.89 1.77 0.27 -0.61 1.01 -1.26 -5.02 121.20 114.46 2f1d s ILE 42 Ca 0.00 -2.45 -0.00 0.00 0.00 0.00 0.00 60.65 58.20 2f1d s ILE 42 Cb 0.00 -2.27 0.26 0.00 0.01 0.00 0.00 42.46 40.46 2f1d s ILE 42 CO 0.00 -0.76 1.71 -0.65 0.00 0.00 0.00 174.94 175.24 2f1d h PRO 43 N 7.16 0.39 -0.42 2.79 0.11 -2.00 -2.06 132.00 137.97 2f1d h PRO 43 Ca -0.06 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.93 2f1d h PRO 43 Cb 0.96 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.97 2f1d h PRO 43 CO 0.54 0.26 -0.10 0.35 -0.21 0.00 0.00 178.00 178.83 2f1d h PHE 44 N 0.40 0.91 -0.21 0.65 3.57 -1.95 -2.90 116.94 117.42 2f1d h PHE 44 Ca 0.49 -0.20 -0.07 0.00 3.53 0.00 0.00 57.97 61.72 2f1d h PHE 44 Cb 0.85 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2f1d h PHE 44 CO -0.17 0.93 -0.17 1.25 -2.23 0.00 0.00 178.31 177.92 2f1d h LEU 45 N 0.63 0.34 -0.60 0.59 5.85 -1.83 -2.35 115.31 117.94 2f1d h LEU 45 Ca 0.11 -0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.78 2f1d h LEU 45 Cb 0.64 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.53 2f1d h LEU 45 CO 0.04 0.54 0.35 0.44 -0.34 0.00 0.00 178.44 179.46 2f1d h ASP 46 N 0.32 0.54 -0.58 1.25 3.32 -1.23 -0.76 116.42 119.28 2f1d h ASP 46 Ca 0.06 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.09 2f1d h ASP 46 Cb 0.50 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 2f1d h ASP 46 CO 0.03 0.36 0.23 -0.74 -1.72 0.00 0.00 179.24 177.40 2f1d h HIS 47 N 0.67 0.92 0.05 4.55 2.76 -1.24 0.23 115.15 123.10 2f1d h HIS 47 Ca 0.26 -0.06 -0.24 0.00 -2.20 0.00 0.00 60.37 58.13 2f1d h HIS 47 Cb 0.10 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 28.78 2f1d h HIS 47 CO -0.07 0.72 -1.05 0.52 -1.30 0.00 0.00 177.93 176.75 2f1d h MET 48 N 0.89 0.30 0.00 5.26 2.86 -1.27 -2.53 114.93 120.44 2f1d h MET 48 Ca 0.21 -0.39 -0.06 0.00 -2.06 0.00 0.00 59.70 57.40 2f1d h MET 48 Cb 0.20 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 2f1d h MET 48 CO -0.02 1.12 -0.29 -0.07 1.06 0.00 0.00 176.91 178.71 2f1d h LEU 49 N 0.13 0.00 -0.10 1.22 3.38 -0.84 -1.99 115.31 117.11 2f1d h LEU 49 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2f1d h LEU 49 Cb 1.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.48 2f1d h LEU 49 CO 0.17 0.29 0.00 0.44 0.09 0.00 0.00 178.44 179.43 2f1d h ASP 50 N 0.00 0.00 0.89 -0.43 5.19 -0.34 -2.88 116.42 118.85 2f1d h ASP 50 Ca -0.00 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.29 2f1d h ASP 50 Cb 0.73 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.22 2f1d h ASP 50 CO 0.04 0.00 -1.18 1.56 -3.12 0.00 0.00 179.24 176.54 2f1d h GLN 51 N 0.00 0.00 -0.20 3.56 1.08 -1.17 -2.73 115.11 115.65 2f1d h GLN 51 Ca 0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 2f1d h GLN 51 Cb 0.88 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.30 2f1d h GLN 51 CO 0.00 0.23 -0.02 1.25 -0.95 0.00 0.00 178.83 179.34 2f1d h LEU 52 N 0.00 0.36 -0.04 1.46 5.85 -1.19 -2.18 115.31 119.57 2f1d h LEU 52 Ca -0.10 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.27 2f1d h LEU 52 Cb 1.40 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.33 2f1d h LEU 52 CO 0.04 0.61 0.01 0.00 -0.34 0.00 0.00 178.44 178.75 2f1d h ALA 53 N 0.76 0.06 0.00 1.25 0.00 -1.66 -2.13 119.26 117.54 2f1d h ALA 53 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2f1d h ALA 53 Cb 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2f1d h ALA 53 CO 0.01 -0.30 0.00 1.03 0.00 0.00 0.00 179.25 180.00 2f1d h SER 54 N -0.18 0.00 0.00 0.00 0.87 -1.44 -1.47 113.55 111.33 2f1d h SER 54 Ca 0.01 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.42 2f1d h SER 54 Cb 0.28 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 2f1d h SER 54 CO 0.00 0.00 -1.61 1.41 -0.53 0.00 0.00 176.83 176.10 2f1d n HIS 55 N -2.97 0.00 1.23 2.24 -0.00 -0.82 -4.57 115.22 110.32 2f1d n HIS 55 Ca -0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.84 2f1d n HIS 55 Cb 0.22 -0.43 0.31 0.00 -0.00 0.00 0.00 29.99 30.08 2f1d n HIS 55 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2f1d n GLY 56 N 2.40 -0.25 3.99 -1.41 0.00 -0.80 -4.52 105.19 104.60 2f1d n GLY 56 Ca -0.14 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.22 -2.32 -4.90 0.99 4.77 -0.56 -4.76 117.00 109.99 2f1d n LEU 57 Ca 0.13 -0.88 -0.32 0.00 -0.03 0.00 0.00 56.01 54.91 2f1d n LEU 57 Cb 0.39 -2.38 -0.05 0.00 -2.33 0.00 0.00 43.42 39.05 2f1d n LEU 57 CO 0.24 0.41 -0.02 -0.36 -1.33 0.00 0.00 177.39 176.32 2f1d s PHE 58 N -3.43 3.50 -0.22 -1.77 2.99 -1.17 -2.83 117.98 115.06 2f1d s PHE 58 Ca 0.53 0.48 -0.16 0.00 0.00 0.00 0.00 56.93 57.77 2f1d s PHE 58 Cb -0.27 -1.94 -0.04 0.00 0.00 0.00 0.00 43.02 40.77 2f1d s PHE 58 CO 0.87 0.49 0.42 -0.51 -0.00 0.00 0.00 175.22 176.49 2f1d s ASP 59 N -2.39 6.42 -0.20 1.36 1.01 -1.04 -3.24 116.67 118.60 2f1d s ASP 59 Ca 0.38 0.50 0.01 0.00 0.71 0.00 0.00 52.55 54.15 2f1d s ASP 59 Cb -0.12 -2.24 0.04 0.00 1.01 0.00 0.00 42.92 41.61 2f1d s ASP 59 CO 0.25 -0.13 -0.10 -0.69 0.21 0.00 0.00 175.17 174.71 2f1d s VAL 60 N 1.57 1.65 -0.18 -1.27 1.01 -0.68 -1.63 120.40 120.87 2f1d s VAL 60 Ca 0.19 -1.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.13 2f1d s VAL 60 Cb -0.15 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.50 2f1d s VAL 60 CO 0.09 0.15 -0.13 -2.28 0.00 0.00 0.00 175.10 172.93 2f1d s HIS 61 N 1.39 2.84 -0.03 5.22 2.46 -0.31 -1.32 115.29 125.53 2f1d s HIS 61 Ca -0.02 -1.16 0.02 0.00 0.47 0.00 0.00 55.06 54.37 2f1d s HIS 61 Cb -0.16 -1.96 0.01 0.00 -0.13 0.00 0.00 32.58 30.33 2f1d s HIS 61 CO -0.08 -0.58 -0.07 0.08 -2.47 0.00 0.00 174.74 171.63 2f1d s VAL 62 N 1.13 0.63 -0.03 0.89 1.01 -0.60 -2.04 120.40 121.39 2f1d s VAL 62 Ca 0.01 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.76 2f1d s VAL 62 Cb -0.14 -0.60 0.02 0.00 0.00 0.00 0.00 36.38 35.66 2f1d s VAL 62 CO -0.04 0.22 -0.04 -0.60 0.00 0.00 0.00 175.10 174.64 2f1d s ARG 63 N 0.46 0.64 -0.07 2.72 6.06 -0.69 -1.80 118.95 126.27 2f1d s ARG 63 Ca -0.07 -0.10 -0.31 0.00 -2.50 0.00 0.00 55.73 52.76 2f1d s ARG 63 Cb -0.10 -0.67 0.08 0.00 0.06 0.00 0.00 34.95 34.31 2f1d s ARG 63 CO 0.00 -0.03 0.72 0.00 -2.50 0.00 0.00 175.30 173.49 2f1d s ALA 64 N 0.64 -1.79 -0.01 6.12 0.00 -0.88 -1.64 121.76 124.20 2f1d s ALA 64 Ca -0.08 1.39 0.03 0.00 0.00 0.00 0.00 51.96 53.29 2f1d s ALA 64 Cb -0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 23.12 22.87 2f1d s ALA 64 CO -0.00 -0.36 -0.08 0.99 0.00 0.00 0.00 175.76 176.30 2f1d s THR 65 N -1.10 0.67 0.35 0.00 2.01 -0.97 -4.32 115.64 112.28 2f1d s THR 65 Ca -0.09 -0.35 -0.06 0.00 0.31 0.00 0.00 61.69 61.49 2f1d s THR 65 Cb -0.00 -0.57 0.03 0.00 0.01 0.00 0.00 72.50 71.97 2f1d s THR 65 CO 0.09 0.19 0.57 0.61 -0.69 0.00 0.00 174.62 175.39 2f1d n GLY 66 N 2.95 1.74 0.92 4.40 0.00 -1.26 -1.51 105.19 112.42 2f1d n GLY 66 Ca -0.14 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.59 1.37 -0.48 1.61 10.43 -1.19 -4.57 116.55 122.13 2f1d n ASP 67 Ca -0.03 -1.03 0.40 0.00 2.57 0.00 0.00 54.79 56.71 2f1d n ASP 67 Cb 0.56 -0.26 0.68 0.00 1.84 0.00 0.00 41.12 43.94 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 0.40 0.05 -0.40 2.53 2.07 -1.93 0.34 116.25 119.32 2f1d h VAL 68 Ca 0.00 -0.01 0.11 0.00 0.82 0.00 0.00 66.70 67.62 2f1d h VAL 68 Cb 0.47 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2f1d h VAL 68 CO 0.00 0.01 0.36 1.12 0.02 0.00 0.00 177.57 179.07 2f1d h HIS 69 N 0.03 0.00 0.00 1.57 2.07 -2.01 -2.90 115.15 113.91 2f1d h HIS 69 Ca 0.86 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.38 2f1d h HIS 69 Cb 2.83 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.81 2f1d h HIS 69 CO -0.01 0.00 -0.11 0.82 -3.07 0.00 0.00 177.93 175.57 2f1d h ILE 70 N 0.00 0.00 -2.86 6.12 2.04 -0.70 -3.51 117.51 118.61 2f1d h ILE 70 Ca 0.19 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 65.14 2f1d h ILE 70 Cb 0.90 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.87 2f1d h ILE 70 CO -0.00 0.00 0.27 -0.62 0.00 0.00 0.00 178.15 177.80 2f1d s ASP 71 N -5.41 -0.48 0.00 1.72 2.15 -1.10 -5.03 116.67 108.51 2f1d s ASP 71 Ca -0.03 -0.10 0.28 0.00 0.43 0.00 0.00 52.55 53.14 2f1d s ASP 71 Cb 0.00 0.58 1.15 0.00 -0.30 0.00 0.00 42.92 44.35 2f1d s ASP 71 CO 0.05 -0.96 1.80 0.47 -0.17 0.00 0.00 175.17 176.36 2f1d n ASP 72 N -0.37 1.16 -0.16 -0.34 8.00 -1.26 -3.71 116.55 119.87 2f1d n ASP 72 Ca -0.14 -1.30 -0.08 0.00 0.71 0.00 0.00 54.79 53.99 2f1d n ASP 72 Cb 0.64 0.01 0.01 0.00 -0.02 0.00 0.00 41.12 41.76 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 1.76 0.65 -0.20 1.24 2.76 -1.95 -1.88 115.15 117.55 2f1d h HIS 73 Ca 0.00 -0.01 -0.20 0.00 -2.20 0.00 0.00 60.37 57.96 2f1d h HIS 73 Cb 0.42 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.17 2f1d h HIS 73 CO 0.00 0.48 -0.66 0.45 -1.30 0.00 0.00 177.93 176.90 2f1d h HIS 74 N 0.64 0.96 -0.03 5.26 3.86 -1.96 -2.36 115.15 121.52 2f1d h HIS 74 Ca 0.17 -0.38 -0.24 0.00 -1.16 0.00 0.00 60.37 58.76 2f1d h HIS 74 Cb 0.03 -0.16 0.01 0.00 1.06 0.00 0.00 27.41 28.35 2f1d h HIS 74 CO -0.02 1.19 -0.95 1.15 0.86 0.00 0.00 177.93 180.15 2f1d h THR 75 N 0.54 1.33 -0.60 2.45 2.02 -1.84 -1.57 112.91 115.24 2f1d h THR 75 Ca -0.02 -2.27 -0.10 0.00 0.77 0.00 0.00 66.41 64.79 2f1d h THR 75 Cb 1.26 2.32 -0.02 0.00 -1.74 0.00 0.00 68.15 69.97 2f1d h THR 75 CO 0.13 0.69 -0.01 -1.13 0.37 0.00 0.00 175.52 175.58 2f1d h ASN 76 N 0.35 1.03 -0.21 4.18 -0.73 -1.40 -2.24 115.58 116.57 2f1d h ASN 76 Ca -0.10 -0.30 -0.12 0.00 1.87 0.00 0.00 56.30 57.65 2f1d h ASN 76 Cb 1.59 -0.28 -0.00 0.00 0.27 0.00 0.00 38.32 39.91 2f1d h ASN 76 CO 0.18 1.09 -0.35 -0.08 -0.37 0.00 0.00 177.43 177.89 2f1d h GLU 77 N 0.96 0.61 -0.08 6.67 4.81 -1.39 -2.58 114.58 123.58 2f1d h GLU 77 Ca 0.17 -0.38 -0.20 0.00 -0.13 0.00 0.00 59.36 58.83 2f1d h GLU 77 Cb 0.57 0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.00 2f1d h GLU 77 CO 0.03 0.99 -0.71 -0.44 -0.73 0.00 0.00 179.01 178.15 2f1d h ASP 78 N 0.30 0.78 -0.07 1.04 3.32 -1.28 -1.63 116.42 118.88 2f1d h ASP 78 Ca 0.02 -0.67 0.04 0.00 0.02 0.00 0.00 57.03 56.43 2f1d h ASP 78 Cb 0.95 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 40.22 2f1d h ASP 78 CO 0.08 1.33 -0.20 0.40 -1.72 0.00 0.00 179.24 179.14 2f1d h ILE 79 N 0.28 0.52 -0.92 0.35 2.04 -1.53 -1.73 117.51 116.53 2f1d h ILE 79 Ca -0.07 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.91 2f1d h ILE 79 Cb 1.37 0.52 -0.07 0.00 -0.74 0.00 0.00 36.82 37.90 2f1d h ILE 79 CO 0.15 0.00 0.59 0.00 0.00 0.00 0.00 178.15 178.88 2f1d h ALA 80 N 0.67 1.66 -0.21 1.87 0.00 -1.35 -0.25 119.26 121.65 2f1d h ALA 80 Ca 0.08 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 2f1d h ALA 80 Cb 0.39 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2f1d h ALA 80 CO -0.23 0.12 -0.54 -0.07 0.00 0.00 0.00 179.25 178.53 2f1d h LEU 81 N 0.86 0.71 -0.24 0.00 3.38 -1.06 -2.77 115.31 116.20 2f1d h LEU 81 Ca 0.44 -0.38 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 2f1d h LEU 81 Cb 0.51 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2f1d h LEU 81 CO -0.20 1.11 -0.26 0.00 0.09 0.00 0.00 178.44 179.18 2f1d h ALA 82 N 0.90 0.35 -0.88 1.53 0.00 -0.41 -2.61 119.26 118.13 2f1d h ALA 82 Ca 0.01 -0.38 0.03 0.00 0.00 0.00 0.00 54.91 54.57 2f1d h ALA 82 Cb 1.10 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 2f1d h ALA 82 CO 0.11 0.33 0.57 0.82 0.00 0.00 0.00 179.25 181.08 2f1d h ILE 83 N 0.29 1.14 -0.62 0.00 2.04 -1.04 0.21 117.51 119.54 2f1d h ILE 83 Ca 0.04 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.42 2f1d h ILE 83 Cb 0.82 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 2f1d h ILE 83 CO 0.06 0.20 0.03 1.23 0.00 0.00 0.00 178.15 179.67 2f1d h GLY 84 N 1.11 1.17 1.14 5.37 0.00 -1.47 0.18 103.07 110.57 2f1d h GLY 84 Ca 0.35 -0.84 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 2f1d h GLY 84 CO -0.12 0.77 0.10 -0.84 0.00 0.00 0.00 176.54 176.46 2f1d h THR 85 N 0.99 1.26 -0.33 4.70 2.02 -1.04 -2.20 112.91 118.30 2f1d h THR 85 Ca 0.18 -1.02 -0.13 0.00 0.77 0.00 0.00 66.41 66.21 2f1d h THR 85 Cb 0.53 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 2f1d h THR 85 CO 0.03 0.38 -0.31 0.00 0.37 0.00 0.00 175.52 175.99 2f1d h ALA 86 N 1.11 0.49 -0.10 6.16 0.00 -0.33 -2.57 119.26 124.02 2f1d h ALA 86 Ca 0.20 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2f1d h ALA 86 Cb 0.43 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2f1d h ALA 86 CO 0.01 0.53 0.07 1.25 0.00 0.00 0.00 179.25 181.10 2f1d h LEU 87 N 0.58 0.10 0.03 0.00 5.85 -0.53 -2.62 115.31 118.72 2f1d h LEU 87 Ca 0.06 -0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.58 2f1d h LEU 87 Cb 0.88 -0.03 0.02 0.00 0.37 0.00 0.00 40.66 41.91 2f1d h LEU 87 CO 0.08 0.07 -0.77 0.25 -0.34 0.00 0.00 178.44 177.73 2f1d h LEU 88 N 0.12 0.62 -0.04 2.25 5.85 -1.16 -2.68 115.31 120.27 2f1d h LEU 88 Ca 0.04 -0.79 -0.00 0.00 0.84 0.00 0.00 57.88 57.97 2f1d h LEU 88 Cb 0.01 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 40.84 2f1d h LEU 88 CO -0.01 1.34 0.02 0.11 -0.34 0.00 0.00 178.44 179.56 2f1d h LYS 89 N -0.02 0.06 -0.70 1.25 1.57 -1.35 -2.71 116.57 114.67 2f1d h LYS 89 Ca -0.11 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 2f1d h LYS 89 Cb 1.49 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.75 2f1d h LYS 89 CO 0.15 0.13 0.34 0.00 -0.57 0.00 0.00 179.45 179.50 2f1d h ALA 90 N 0.93 0.90 -0.92 3.86 0.00 -1.53 -1.60 119.26 120.91 2f1d h ALA 90 Ca 0.01 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.83 2f1d h ALA 90 Cb 0.08 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.54 2f1d h ALA 90 CO -0.00 0.47 0.60 -0.07 0.00 0.00 0.00 179.25 180.24 2f1d h LEU 91 N 0.98 0.95 0.00 0.00 3.38 -1.51 -3.41 115.31 115.70 2f1d h LEU 91 Ca 0.24 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2f1d h LEU 91 Cb 0.11 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2f1d h LEU 91 CO -0.03 0.63 0.00 0.61 0.09 0.00 0.00 178.44 179.74 2f1d n GLY 92 N -1.39 4.07 0.07 0.83 0.00 -0.60 -2.01 105.19 106.16 2f1d n GLY 92 Ca 0.13 0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.45 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 13.24 0.13 -3.25 1.61 -0.00 -1.26 -4.91 120.64 126.20 2f1d n GLU 93 Ca 0.00 0.25 -0.22 0.00 -0.00 0.00 0.00 57.16 57.19 2f1d n GLU 93 Cb 0.00 -1.70 0.05 0.00 -0.00 0.00 0.00 31.44 29.79 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 -1.94 -6.10 -2.29 3.44 1.74 -0.85 -4.91 116.66 105.74 2f1d n ARG 94 Ca 0.04 0.84 -0.41 0.00 -0.77 0.00 0.00 57.85 57.55 2f1d n ARG 94 Cb 0.29 -5.70 -0.03 0.00 -1.02 0.00 0.00 32.46 26.00 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 -5.94 3.18 -0.64 5.56 3.01 -1.26 -3.93 119.74 119.72 2f1d s LYS 95 Ca 0.42 0.56 0.00 0.00 -1.01 0.00 0.00 55.97 55.94 2f1d s LYS 95 Cb -0.18 -4.18 0.00 0.00 -1.01 0.00 0.00 37.83 32.46 2f1d s LYS 95 CO 0.52 -2.08 0.00 0.41 0.51 0.00 0.00 175.35 174.71 2f1d n GLY 96 N 5.36 0.47 3.92 -3.33 0.00 -1.26 -5.02 105.19 105.32 2f1d n GLY 96 Ca 0.15 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.30 3.75 0.31 -0.61 -4.36 -1.25 -2.86 121.20 113.89 2f1d s ILE 97 Ca 0.00 0.02 -0.01 0.00 -0.26 0.00 0.00 60.65 60.40 2f1d s ILE 97 Cb 0.00 -3.48 0.25 0.00 1.25 0.00 0.00 42.46 40.48 2f1d s ILE 97 CO 0.00 -0.50 1.97 0.78 0.24 0.00 0.00 174.94 177.43 2f1d h ASN 98 N -0.14 0.86 0.00 4.36 2.35 -1.40 -3.44 115.58 118.16 2f1d h ASN 98 Ca -0.45 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.26 2f1d h ASN 98 Cb 1.25 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.41 2f1d h ASN 98 CO 0.61 0.64 0.00 -1.14 -1.65 0.00 0.00 177.43 175.89 2f1d n ARG 99 N -4.41 0.00 -3.79 0.81 0.63 -0.57 -4.91 116.66 104.42 2f1d n ARG 99 Ca 0.08 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.64 2f1d n ARG 99 Cb 0.05 -0.06 -0.06 0.00 0.45 0.00 0.00 32.46 32.84 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 0.00 3.63 -0.00 -0.14 0.40 -1.26 -1.32 117.98 119.29 2f1d s PHE 100 Ca 0.00 0.63 0.04 0.00 -0.60 0.00 0.00 56.93 57.00 2f1d s PHE 100 Cb 0.00 -2.02 -0.01 0.00 0.51 0.00 0.00 43.02 41.50 2f1d s PHE 100 CO 0.00 0.72 -0.12 0.20 0.70 0.00 0.00 175.22 176.71 2f1d s GLY 101 N -1.07 0.63 -0.04 4.36 0.00 -0.75 -3.76 107.32 106.69 2f1d s GLY 101 Ca 0.17 -0.58 -0.02 0.00 0.00 0.00 0.00 44.72 44.30 2f1d s GLY 101 CO 0.07 -0.50 0.06 -0.35 0.00 0.00 0.00 173.10 172.37 2f1d s ASP 102 N -0.45 1.11 -0.22 1.64 2.15 -1.26 -1.35 116.67 118.29 2f1d s ASP 102 Ca 0.04 0.07 -0.09 0.00 0.43 0.00 0.00 52.55 53.00 2f1d s ASP 102 Cb -0.05 -0.14 0.09 0.00 -0.30 0.00 0.00 42.92 42.51 2f1d s ASP 102 CO -0.00 -0.24 0.50 0.12 -0.17 0.00 0.00 175.17 175.38 2f1d s PHE 103 N 2.13 -0.90 -0.14 -5.34 5.36 -0.83 -4.89 117.98 113.36 2f1d s PHE 103 Ca 0.04 1.72 -0.15 0.00 -0.96 0.00 0.00 56.93 57.58 2f1d s PHE 103 Cb -0.12 0.44 -0.05 0.00 -0.34 0.00 0.00 43.02 42.96 2f1d s PHE 103 CO -0.03 -0.49 0.34 0.99 -1.46 0.00 0.00 175.22 174.57 2f1d s THR 104 N 2.22 5.27 -0.08 0.12 2.01 -1.26 -2.03 115.64 121.90 2f1d s THR 104 Ca -0.06 0.65 0.02 0.00 0.31 0.00 0.00 61.69 62.61 2f1d s THR 104 Cb -0.10 -3.67 0.01 0.00 0.01 0.00 0.00 72.50 68.75 2f1d s THR 104 CO -0.15 0.39 -0.12 0.00 -0.69 0.00 0.00 174.62 174.05 2f1d s ALA 105 N 0.41 1.32 0.09 7.40 0.00 -0.30 -4.97 121.76 125.71 2f1d s ALA 105 Ca 0.19 -0.47 -0.09 0.00 0.00 0.00 0.00 51.96 51.58 2f1d s ALA 105 Cb -0.14 -0.65 -0.06 0.00 0.00 0.00 0.00 23.12 22.28 2f1d s ALA 105 CO 0.06 0.02 0.40 -1.25 0.00 0.00 0.00 175.76 174.98 2f1d s PRO 106 N 0.85 3.74 -0.29 0.00 0.04 -1.26 -1.82 135.00 136.26 2f1d s PRO 106 Ca -0.11 0.15 -0.02 0.00 0.04 0.00 0.00 61.00 61.05 2f1d s PRO 106 Cb -0.15 -2.97 0.10 0.00 0.04 0.00 0.00 34.50 31.51 2f1d s PRO 106 CO 0.01 0.55 0.11 -1.17 0.04 0.00 0.00 177.00 176.54 2f1d s LEU 107 N -2.01 1.41 0.00 -3.56 2.96 -0.94 -5.01 118.68 111.54 2f1d s LEU 107 Ca 0.34 -1.42 0.00 0.00 -0.22 0.00 0.00 54.13 52.83 2f1d s LEU 107 Cb -0.14 -0.62 0.00 0.00 0.50 0.00 0.00 46.19 45.94 2f1d s LEU 107 CO 0.19 -0.42 0.00 0.47 -1.32 0.00 0.00 176.35 175.27 2f1d n ASP 108 N 5.04 0.00 0.14 3.68 8.00 -1.26 -2.32 116.55 129.84 2f1d n ASP 108 Ca -0.04 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.48 2f1d n ASP 108 Cb 0.42 0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.60 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 -6.99 -1.24 9.09 -1.98 -3.46 114.58 110.01 2f1d h GLU 109 Ca 0.00 0.00 -0.47 0.00 0.05 0.00 0.00 59.36 58.94 2f1d h GLU 109 Cb 0.00 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.11 2f1d h GLU 109 CO 0.00 0.52 0.38 0.00 0.05 0.00 0.00 179.01 179.97 2f1d s ALA 110 N -3.06 3.05 -0.22 1.06 0.00 -0.98 -3.46 121.76 118.15 2f1d s ALA 110 Ca 0.03 0.59 -0.03 0.00 0.00 0.00 0.00 51.96 52.55 2f1d s ALA 110 Cb 0.08 -3.23 0.12 0.00 0.00 0.00 0.00 23.12 20.09 2f1d s ALA 110 CO 0.74 -0.10 0.32 -1.17 0.00 0.00 0.00 175.76 175.55 2f1d s LEU 111 N -2.82 -0.45 -0.09 0.00 2.96 -0.92 -2.21 118.68 115.15 2f1d s LEU 111 Ca 0.59 0.13 0.04 0.00 -0.22 0.00 0.00 54.13 54.68 2f1d s LEU 111 Cb -0.18 0.88 -0.00 0.00 0.50 0.00 0.00 46.19 47.39 2f1d s LEU 111 CO 0.22 -0.30 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.08 2f1d s ILE 112 N 2.47 2.05 -0.06 6.68 -1.09 -0.76 -1.58 121.20 128.92 2f1d s ILE 112 Ca 0.10 -1.02 -0.12 0.00 -2.23 0.00 0.00 60.65 57.38 2f1d s ILE 112 Cb -0.15 -1.77 -0.05 0.00 -1.58 0.00 0.00 42.46 38.91 2f1d s ILE 112 CO -0.14 0.56 0.30 -2.28 -1.23 0.00 0.00 174.94 172.15 2f1d s HIS 113 N 0.28 3.65 -0.11 3.97 5.65 -0.63 -1.15 115.29 126.95 2f1d s HIS 113 Ca -0.17 0.78 -0.01 0.00 0.25 0.00 0.00 55.06 55.91 2f1d s HIS 113 Cb -0.17 -2.18 0.03 0.00 -1.18 0.00 0.00 32.58 29.08 2f1d s HIS 113 CO 0.08 0.62 -0.03 0.08 -0.65 0.00 0.00 174.74 174.84 2f1d s VAL 114 N -0.84 0.74 -0.13 0.89 1.01 -0.86 -1.68 120.40 119.52 2f1d s VAL 114 Ca 0.20 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.02 2f1d s VAL 114 Cb -0.15 -0.86 -0.00 0.00 0.00 0.00 0.00 36.38 35.37 2f1d s VAL 114 CO 0.09 0.26 -0.18 -0.55 0.00 0.00 0.00 175.10 174.72 2f1d s SER 115 N 1.82 3.50 0.18 3.32 0.15 -0.48 -1.96 113.70 120.23 2f1d s SER 115 Ca 0.04 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.21 2f1d s SER 115 Cb -0.13 -1.51 -0.04 0.00 -1.71 0.00 0.00 66.02 62.62 2f1d s SER 115 CO -0.07 0.12 0.06 -1.48 1.20 0.00 0.00 173.24 173.07 2f1d s LEU 116 N 0.58 1.77 -0.26 3.45 0.05 -0.46 -0.06 118.68 123.76 2f1d s LEU 116 Ca -0.11 -1.25 -0.02 0.00 0.05 0.00 0.00 54.13 52.80 2f1d s LEU 116 Cb -0.16 0.15 0.15 0.00 -2.05 0.00 0.00 46.19 44.28 2f1d s LEU 116 CO 0.03 -0.69 0.42 -0.62 -0.55 0.00 0.00 176.35 174.94 2f1d s ASP 117 N -3.15 -0.01 -1.13 1.48 2.15 -0.33 -1.81 116.67 113.88 2f1d s ASP 117 Ca 0.29 0.23 -0.23 0.00 0.43 0.00 0.00 52.55 53.27 2f1d s ASP 117 Cb 0.07 1.29 -0.07 0.00 -0.30 0.00 0.00 42.92 43.91 2f1d s ASP 117 CO 0.06 -0.30 1.92 -0.76 -0.17 0.00 0.00 175.17 175.92 2f1d s LEU 118 N 2.60 3.11 -0.21 -1.34 1.43 -0.44 -1.83 118.68 122.00 2f1d s LEU 118 Ca 0.13 -1.48 0.06 0.00 -1.03 0.00 0.00 54.13 51.81 2f1d s LEU 118 Cb -0.15 -2.58 -0.21 0.00 0.03 0.00 0.00 46.19 43.28 2f1d s LEU 118 CO -0.19 -2.91 -0.02 -1.54 0.23 0.00 0.00 176.35 171.92 2f1d n SER 119 N 13.99 1.39 0.00 2.29 3.41 -1.05 -4.99 113.62 128.65 2f1d n SER 119 Ca 0.44 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2f1d n SER 119 Cb 0.47 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 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 2.05 2.91 3.34 5.00 0.00 0.18 -5.04 105.19 113.62 2f1d n GLY 120 Ca -0.39 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.58 3.40 0.20 1.61 0.52 -1.21 -4.70 118.95 118.19 2f1d s ARG 121 Ca 0.00 -0.64 -0.30 0.00 -0.52 0.00 0.00 55.73 54.27 2f1d s ARG 121 Cb 0.00 -2.86 -0.08 0.00 0.52 0.00 0.00 34.95 32.53 2f1d s ARG 121 CO 0.00 -0.01 1.14 -1.25 0.02 0.00 0.00 175.30 175.19 2f1d s PRO 122 N 0.97 4.57 -0.22 3.54 0.04 -1.26 -3.83 135.00 138.81 2f1d s PRO 122 Ca -0.01 1.80 -0.12 0.00 0.04 0.00 0.00 61.00 62.71 2f1d s PRO 122 Cb -0.15 -3.24 0.07 0.00 0.04 0.00 0.00 34.50 31.22 2f1d s PRO 122 CO -0.00 0.05 0.53 -0.47 0.04 0.00 0.00 177.00 177.14 2f1d s TYR 123 N -0.39 -0.84 -0.27 0.56 5.04 -0.60 -4.94 117.35 115.90 2f1d s TYR 123 Ca 0.49 1.69 -0.02 0.00 -2.44 0.00 0.00 57.07 56.79 2f1d s TYR 123 Cb -0.31 0.44 0.04 0.00 0.35 0.00 0.00 41.96 42.48 2f1d s TYR 123 CO 0.37 -0.45 -0.03 -1.17 -1.34 0.00 0.00 175.55 172.94 2f1d s LEU 124 N 1.69 3.54 -0.37 6.97 2.96 -1.26 -1.04 118.68 131.18 2f1d s LEU 124 Ca -0.09 -1.04 -0.17 0.00 -0.22 0.00 0.00 54.13 52.61 2f1d s LEU 124 Cb -0.08 -1.70 0.00 0.00 0.50 0.00 0.00 46.19 44.92 2f1d s LEU 124 CO -0.16 -0.19 0.44 -0.83 -1.32 0.00 0.00 176.35 174.30 2f1d s GLY 125 N 1.30 1.86 -0.22 7.98 0.00 -0.74 -5.04 107.32 112.46 2f1d s GLY 125 Ca -0.02 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.45 2f1d s GLY 125 CO -0.03 1.16 -0.05 -0.47 0.00 0.00 0.00 173.10 173.71 2f1d s TYR 126 N 2.21 2.21 -0.59 1.90 5.04 -1.26 -0.98 117.35 125.88 2f1d s TYR 126 Ca 0.14 -1.60 0.06 0.00 -2.44 0.00 0.00 57.07 53.23 2f1d s TYR 126 Cb -0.16 -1.51 0.21 0.00 0.35 0.00 0.00 41.96 40.85 2f1d s TYR 126 CO 0.13 -0.74 0.57 0.09 -1.34 0.00 0.00 175.55 174.26 2f1d n ASN 127 N 4.72 2.31 -3.71 4.32 4.13 -0.57 -5.02 115.26 121.44 2f1d n ASN 127 Ca -0.12 -3.09 -0.24 0.00 1.68 0.00 0.00 54.58 52.81 2f1d n ASN 127 Cb 0.45 -0.68 -0.17 0.00 -1.54 0.00 0.00 39.78 37.84 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 -1.56 0.58 -0.34 3.41 2.96 -1.26 -1.11 118.68 121.35 2f1d s LEU 128 Ca 0.33 -0.32 -0.11 0.00 -0.22 0.00 0.00 54.13 53.82 2f1d s LEU 128 Cb 0.07 -0.37 0.01 0.00 0.50 0.00 0.00 46.19 46.40 2f1d s LEU 128 CO -0.11 -0.26 0.19 -1.83 -1.32 0.00 0.00 176.35 173.02 2f1d s GLU 129 N 2.02 3.14 -0.40 1.98 -1.05 -1.26 -5.06 118.70 118.07 2f1d s GLU 129 Ca 0.03 -0.86 -0.11 0.00 -0.15 0.00 0.00 54.97 53.88 2f1d s GLU 129 Cb -0.14 -3.67 0.05 0.00 -0.44 0.00 0.00 34.13 29.93 2f1d s GLU 129 CO -0.06 -0.54 0.24 0.42 0.95 0.00 0.00 175.26 176.27 2f1d s ILE 130 N 1.60 4.55 0.56 1.83 1.01 -1.26 -5.01 121.20 124.48 2f1d s ILE 130 Ca 0.04 -1.05 0.30 0.00 0.00 0.00 0.00 60.65 59.94 2f1d s ILE 130 Cb -0.18 -3.63 0.34 0.00 0.01 0.00 0.00 42.46 39.00 2f1d s ILE 130 CO 0.07 -0.36 2.22 1.55 0.00 0.00 0.00 174.94 178.42 2f1d h PRO 131 N 8.47 0.00 -6.25 2.79 0.13 -1.96 -3.42 132.00 131.75 2f1d h PRO 131 Ca -0.25 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.22 2f1d h PRO 131 Cb 1.10 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.10 2f1d h PRO 131 CO 0.72 0.03 -0.65 0.95 -0.23 0.00 0.00 178.00 178.81 2f1d s THR 132 N -4.53 4.11 -0.48 1.56 -4.23 -1.26 -5.03 115.64 105.78 2f1d s THR 132 Ca -0.05 -0.80 0.26 0.00 -1.18 0.00 0.00 61.69 59.93 2f1d s THR 132 Cb 0.15 -2.90 0.31 0.00 1.34 0.00 0.00 72.50 71.40 2f1d s THR 132 CO 0.55 0.24 1.75 1.56 -0.54 0.00 0.00 174.62 178.18 2f1d h GLN 133 N 3.84 0.00 -3.24 3.99 4.20 -1.97 -3.45 115.11 118.49 2f1d h GLN 133 Ca -0.48 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.01 2f1d h GLN 133 Cb 1.17 0.00 -0.30 0.00 0.30 0.00 0.00 27.48 28.65 2f1d h GLN 133 CO 0.59 0.00 -0.56 1.03 -0.67 0.00 0.00 178.83 179.23 2f1d s ARG 134 N -3.26 0.14 -0.28 1.46 0.52 -1.26 -2.47 118.95 113.80 2f1d s ARG 134 Ca 0.07 0.36 0.03 0.00 -0.52 0.00 0.00 55.73 55.66 2f1d s ARG 134 Cb 0.09 -0.08 0.07 0.00 0.52 0.00 0.00 34.95 35.55 2f1d s ARG 134 CO 0.57 -0.12 -0.04 0.14 0.02 0.00 0.00 175.30 175.87 2f1d s VAL 135 N 0.85 2.03 0.00 3.52 -7.23 -1.12 -4.94 120.40 113.51 2f1d s VAL 135 Ca -0.06 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 2f1d s VAL 135 Cb -0.08 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.58 2f1d s VAL 135 CO -0.05 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.12 2f1d n GLY 136 N 4.44 2.02 0.16 2.32 0.00 -1.26 -2.43 105.19 110.44 2f1d n GLY 136 Ca -0.08 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 45.94 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 1.27 -3.39 2.61 -2.24 -1.26 -5.03 114.28 106.23 2f1d n THR 137 Ca 0.00 -1.50 -0.40 0.00 -2.27 0.00 0.00 64.05 59.88 2f1d n THR 137 Cb 0.00 0.07 -0.09 0.00 -2.10 0.00 0.00 70.33 68.21 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 -1.87 3.22 0.18 4.78 5.04 -1.02 -5.00 117.35 122.68 2f1d s TYR 138 Ca 0.20 0.15 -0.33 0.00 -2.44 0.00 0.00 57.07 54.64 2f1d s TYR 138 Cb 0.17 -2.65 -0.13 0.00 0.35 0.00 0.00 41.96 39.70 2f1d s TYR 138 CO 0.02 -0.36 1.60 -3.47 -1.34 0.00 0.00 175.55 172.00 2f1d n ASP 139 N 5.39 3.32 0.21 4.32 -0.08 -1.26 -2.79 116.55 125.66 2f1d n ASP 139 Ca -0.09 1.08 0.11 0.00 -1.51 0.00 0.00 54.79 54.39 2f1d n ASP 139 Cb 0.50 -1.47 0.16 0.00 2.34 0.00 0.00 41.12 42.65 2f1d n ASP 139 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 2f1d h THR 140 N 3.62 0.11 0.00 5.18 2.02 -1.78 -2.65 112.91 119.40 2f1d h THR 140 Ca -0.44 -1.14 0.00 0.00 0.77 0.00 0.00 66.41 65.59 2f1d h THR 140 Cb 1.24 2.04 0.00 0.00 -1.74 0.00 0.00 68.15 69.69 2f1d h THR 140 CO 0.89 0.06 0.00 1.56 0.37 0.00 0.00 175.52 178.41 2f1d h GLN 141 N 0.00 0.00 -0.00 6.66 4.20 -1.90 -3.10 115.11 120.98 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 1.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.82 2f1d h GLN 141 CO 0.01 0.00 -0.20 1.28 -0.67 0.00 0.00 178.83 179.24 2f1d n LEU 142 N -2.34 0.37 0.01 1.46 4.32 -1.00 -3.35 117.00 116.47 2f1d n LEU 142 Ca 0.01 0.13 -0.10 0.00 -0.02 0.00 0.00 56.01 56.03 2f1d n LEU 142 Cb 0.20 -0.29 0.04 0.00 -1.62 0.00 0.00 43.42 41.75 2f1d n LEU 142 CO 0.19 0.08 0.43 0.58 -1.22 0.00 0.00 177.39 177.45 2f1d h VAL 143 N 0.26 1.33 -0.08 4.08 2.07 -1.73 -1.74 116.25 120.44 2f1d h VAL 143 Ca 0.00 -1.88 -0.19 0.00 0.82 0.00 0.00 66.70 65.45 2f1d h VAL 143 Cb 0.45 1.86 -0.00 0.00 -1.52 0.00 0.00 31.29 32.07 2f1d h VAL 143 CO 0.00 0.58 -0.74 -0.08 0.02 0.00 0.00 177.57 177.35 2f1d h GLU 144 N 0.41 0.45 0.00 1.57 4.81 -1.78 -3.11 114.58 116.94 2f1d h GLU 144 Ca -0.00 -0.37 -0.03 0.00 -0.13 0.00 0.00 59.36 58.82 2f1d h GLU 144 Cb 1.17 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.62 2f1d h GLU 144 CO 0.11 1.01 -0.14 1.25 -0.73 0.00 0.00 179.01 180.51 2f1d h HIS 145 N 0.30 0.00 -0.01 0.92 2.76 -1.57 -2.05 115.15 115.50 2f1d h HIS 145 Ca -0.04 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.10 2f1d h HIS 145 Cb 1.33 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.29 2f1d h HIS 145 CO 0.05 0.14 -0.12 0.35 -1.30 0.00 0.00 177.93 177.05 2f1d h PHE 146 N 0.00 0.14 0.00 5.26 3.57 -1.32 -2.63 116.94 121.97 2f1d h PHE 146 Ca -0.00 -0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.39 2f1d h PHE 146 Cb 0.82 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 2f1d h PHE 146 CO 0.00 0.82 -0.19 0.74 -2.23 0.00 0.00 178.31 177.45 2f1d h PHE 147 N -0.57 0.00 -0.06 0.41 -1.00 -1.54 -1.26 116.94 112.92 2f1d h PHE 147 Ca -0.01 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.52 2f1d h PHE 147 Cb 0.84 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.42 2f1d h PHE 147 CO 0.17 0.19 -0.93 0.37 -1.61 0.00 0.00 178.31 176.50 2f1d h GLN 148 N 0.00 0.72 -0.03 1.51 5.75 -1.43 -1.88 115.11 119.74 2f1d h GLN 148 Ca -0.00 -0.69 -0.14 0.00 -0.15 0.00 0.00 58.65 57.67 2f1d h GLN 148 Cb 0.77 0.18 -0.02 0.00 1.07 0.00 0.00 27.48 29.48 2f1d h GLN 148 CO 0.02 1.28 -0.61 0.77 -2.65 0.00 0.00 178.83 177.64 2f1d h SER 149 N 0.44 0.13 0.10 -0.69 0.02 -1.36 -2.37 113.55 109.83 2f1d h SER 149 Ca -0.10 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 2f1d h SER 149 Cb 1.57 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 64.07 2f1d h SER 149 CO 0.18 0.71 -0.05 0.25 -1.14 0.00 0.00 176.83 176.79 2f1d h LEU 150 N 0.09 -0.12 -1.01 5.07 6.46 -1.15 -3.02 115.31 121.62 2f1d h LEU 150 Ca -0.01 -0.29 0.07 0.00 -0.12 0.00 0.00 57.88 57.53 2f1d h LEU 150 Cb 1.10 0.03 -0.07 0.00 -0.73 0.00 0.00 40.66 40.99 2f1d h LEU 150 CO 0.09 0.24 0.65 0.58 -0.62 0.00 0.00 178.44 179.38 2f1d h VAL 151 N -0.49 1.08 -0.43 1.05 2.07 -1.39 -0.87 116.25 117.27 2f1d h VAL 151 Ca -0.01 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 2f1d h VAL 151 Cb 0.40 -0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 29.96 2f1d h VAL 151 CO 0.02 0.21 0.23 0.78 0.02 0.00 0.00 177.57 178.83 2f1d h ASN 152 N 1.17 0.54 1.06 0.57 4.21 -1.30 -1.66 115.58 120.16 2f1d h ASN 152 Ca 0.44 -0.10 -0.15 0.00 1.21 0.00 0.00 56.30 57.70 2f1d h ASN 152 Cb 0.19 -0.14 -0.02 0.00 -1.12 0.00 0.00 38.32 37.23 2f1d h ASN 152 CO -0.18 0.48 -1.00 0.71 -1.29 0.00 0.00 177.43 176.15 2f1d h THR 153 N 0.55 0.81 0.00 2.81 1.35 -1.53 -3.37 112.91 113.54 2f1d h THR 153 Ca 0.15 -2.29 -0.10 0.00 -0.55 0.00 0.00 66.41 63.62 2f1d h THR 153 Cb 0.07 2.31 -0.01 0.00 -1.73 0.00 0.00 68.15 68.79 2f1d h THR 153 CO -0.02 0.46 -0.46 -1.28 -0.25 0.00 0.00 175.52 173.97 2f1d h SER 154 N 0.00 0.00 -3.99 5.36 0.87 -0.78 -3.40 113.55 111.62 2f1d h SER 154 Ca -0.08 0.00 -0.32 0.00 -1.23 0.00 0.00 61.79 60.15 2f1d h SER 154 Cb 1.55 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 63.57 2f1d h SER 154 CO 0.07 0.46 -0.50 0.61 -0.53 0.00 0.00 176.83 176.93 2f1d n GLY 155 N 0.24 -0.27 3.81 5.77 0.00 -0.66 -4.80 105.19 109.28 2f1d n GLY 155 Ca -0.01 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 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 -5.62 3.15 -0.33 1.61 -2.45 -1.21 0.51 119.30 114.96 2f1d s MET 156 Ca 0.30 -0.46 -0.07 0.00 -1.25 0.00 0.00 55.69 54.21 2f1d s MET 156 Cb -0.13 -2.91 0.03 0.00 1.25 0.00 0.00 34.83 33.07 2f1d s MET 156 CO 0.38 0.64 0.11 0.99 1.05 0.00 0.00 175.02 178.19 2f1d s THR 157 N -1.25 3.96 -0.10 10.11 2.01 -0.76 -1.56 115.64 128.05 2f1d s THR 157 Ca 0.25 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 61.33 2f1d s THR 157 Cb -0.12 -3.17 0.02 0.00 0.01 0.00 0.00 72.50 69.24 2f1d s THR 157 CO 0.16 -0.09 -0.13 -0.22 -0.69 0.00 0.00 174.62 173.65 2f1d s LEU 158 N 1.46 1.59 -0.17 4.42 2.96 -0.20 -1.18 118.68 127.56 2f1d s LEU 158 Ca 0.00 -0.36 -0.03 0.00 -0.22 0.00 0.00 54.13 53.52 2f1d s LEU 158 Cb -0.19 -0.96 -0.02 0.00 0.50 0.00 0.00 46.19 45.53 2f1d s LEU 158 CO 0.03 -0.01 -0.06 -1.00 -1.32 0.00 0.00 176.35 173.99 2f1d s HIS 159 N 1.04 2.95 -0.14 5.38 3.76 0.92 -1.79 115.29 127.40 2f1d s HIS 159 Ca -0.07 -0.55 0.02 0.00 -0.15 0.00 0.00 55.06 54.31 2f1d s HIS 159 Cb -0.15 -1.97 0.00 0.00 1.11 0.00 0.00 32.58 31.58 2f1d s HIS 159 CO -0.01 -0.21 -0.19 0.42 -0.85 0.00 0.00 174.74 173.89 2f1d s ILE 160 N 0.65 2.34 -0.08 0.60 1.01 -0.15 -1.38 121.20 124.19 2f1d s ILE 160 Ca -0.04 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.74 2f1d s ILE 160 Cb -0.15 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 40.39 2f1d s ILE 160 CO 0.02 0.54 -0.10 -0.13 0.00 0.00 0.00 174.94 175.27 2f1d s ARG 161 N 0.76 1.59 -0.14 2.79 0.52 -0.68 -1.51 118.95 122.27 2f1d s ARG 161 Ca -0.08 -0.33 -0.28 0.00 -0.52 0.00 0.00 55.73 54.53 2f1d s ARG 161 Cb -0.16 -1.45 -0.01 0.00 0.52 0.00 0.00 34.95 33.85 2f1d s ARG 161 CO 0.00 -0.10 0.93 -1.14 0.02 0.00 0.00 175.30 175.01 2f1d s GLN 162 N 1.10 4.36 -0.23 3.54 0.74 -0.27 -1.60 119.66 127.30 2f1d s GLN 162 Ca -0.06 1.22 -0.05 0.00 0.05 0.00 0.00 55.36 56.51 2f1d s GLN 162 Cb -0.14 -3.56 -0.12 0.00 1.10 0.00 0.00 33.01 30.28 2f1d s GLN 162 CO -0.01 -0.33 -0.25 1.28 -0.55 0.00 0.00 175.29 175.43 2f1d n LEU 163 N 5.16 2.31 -4.19 3.68 4.77 -0.61 -4.98 117.00 123.14 2f1d n LEU 163 Ca 0.07 0.09 -0.11 0.00 -0.03 0.00 0.00 56.01 56.02 2f1d n LEU 163 Cb 0.49 -0.73 -0.10 0.00 -2.33 0.00 0.00 43.42 40.75 2f1d n LEU 163 CO 0.50 0.68 -0.35 0.00 -1.33 0.00 0.00 177.39 176.89 2f1d s ALA 164 N -2.43 1.06 0.00 -1.18 0.00 -1.01 -4.95 121.76 113.24 2f1d s ALA 164 Ca -0.31 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.21 2f1d s ALA 164 Cb 0.10 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.61 2f1d s ALA 164 CO 0.46 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.32 2f1d n GLY 165 N -0.11 4.10 1.13 0.00 0.00 -1.22 -2.17 105.19 106.93 2f1d n GLY 165 Ca -0.09 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.94 0.00 -2.63 1.61 1.02 -1.26 -4.96 120.64 113.48 2f1d n GLU 166 Ca 0.00 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.74 2f1d n GLU 166 Cb 0.00 -0.45 -0.05 0.00 -0.02 0.00 0.00 31.44 30.92 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 -5.50 7.46 -0.02 1.62 3.84 -1.26 -4.70 114.94 116.38 2f1d s ASN 167 Ca 0.00 2.06 -0.22 0.00 0.21 0.00 0.00 52.86 54.92 2f1d s ASN 167 Cb 0.00 -2.61 -0.24 0.00 -0.55 0.00 0.00 41.25 37.85 2f1d s ASN 167 CO 0.00 -0.00 1.06 0.28 -2.79 0.00 0.00 177.10 175.65 2f1d h SER 168 N 4.25 0.41 -0.48 -4.21 0.02 -1.98 -2.59 113.55 108.96 2f1d h SER 168 Ca -0.45 -0.78 0.10 0.00 -0.84 0.00 0.00 61.79 59.82 2f1d h SER 168 Cb 1.21 -0.12 -0.10 0.00 0.14 0.00 0.00 62.40 63.52 2f1d h SER 168 CO 0.68 1.13 -0.21 -0.74 -1.14 0.00 0.00 176.83 176.55 2f1d h HIS 169 N -0.28 -0.54 -0.62 3.45 -0.00 -1.97 -2.33 115.15 112.87 2f1d h HIS 169 Ca -0.06 0.05 0.02 0.00 -0.00 0.00 0.00 60.37 60.38 2f1d h HIS 169 Cb 1.21 0.31 -0.03 0.00 -0.00 0.00 0.00 27.41 28.89 2f1d h HIS 169 CO 0.16 -0.30 0.40 0.45 -0.00 0.00 0.00 177.93 178.64 2f1d h HIS 170 N -0.11 0.75 -0.06 5.26 3.86 -1.90 -1.26 115.15 121.69 2f1d h HIS 170 Ca 0.23 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.45 2f1d h HIS 170 Cb 0.46 -0.25 -0.00 0.00 1.06 0.00 0.00 27.41 28.68 2f1d h HIS 170 CO -0.49 0.46 0.01 0.82 0.86 0.00 0.00 177.93 179.59 2f1d h ILE 171 N 0.80 1.21 -0.05 2.45 2.04 -1.11 0.17 117.51 123.02 2f1d h ILE 171 Ca 0.24 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 2f1d h ILE 171 Cb -0.05 1.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2f1d h ILE 171 CO -0.07 0.18 0.02 0.40 0.00 0.00 0.00 178.15 178.68 2f1d h ILE 172 N -0.13 1.13 -0.76 -0.67 2.04 -1.37 -2.17 117.51 115.57 2f1d h ILE 172 Ca 0.02 -0.39 0.03 0.00 1.00 0.00 0.00 64.86 65.52 2f1d h ILE 172 Cb 0.28 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 2f1d h ILE 172 CO 0.00 0.11 0.50 -0.08 0.00 0.00 0.00 178.15 178.68 2f1d h GLU 173 N -0.07 0.94 0.00 2.37 4.81 -1.05 -1.98 114.58 119.59 2f1d h GLU 173 Ca 0.02 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 2f1d h GLU 173 Cb 0.16 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2f1d h GLU 173 CO -0.00 0.62 -0.45 0.00 -0.73 0.00 0.00 179.01 178.45 2f1d h ALA 174 N 1.55 0.88 -0.49 2.92 0.00 -0.50 -0.30 119.26 123.31 2f1d h ALA 174 Ca 0.30 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 2f1d h ALA 174 Cb -0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2f1d h ALA 174 CO -0.08 0.56 -0.18 1.15 0.00 0.00 0.00 179.25 180.70 2f1d h THR 175 N 0.00 1.27 -0.02 0.00 2.02 -0.72 -1.71 112.91 113.75 2f1d h THR 175 Ca -0.00 -1.34 -0.20 0.00 0.77 0.00 0.00 66.41 65.64 2f1d h THR 175 Cb 1.07 1.07 -0.00 0.00 -1.74 0.00 0.00 68.15 68.55 2f1d h THR 175 CO 0.06 0.46 -0.85 -0.26 0.37 0.00 0.00 175.52 175.30 2f1d h PHE 176 N 0.86 0.49 -0.02 3.16 -1.00 -0.87 -0.49 116.94 119.06 2f1d h PHE 176 Ca 0.12 -0.25 -0.00 0.00 2.81 0.00 0.00 57.97 60.65 2f1d h PHE 176 Cb 0.75 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 40.25 2f1d h PHE 176 CO 0.05 1.04 0.00 0.87 -1.61 0.00 0.00 178.31 178.66 2f1d h LYS 177 N 0.20 0.03 -0.48 1.51 1.57 -1.10 -1.97 116.57 116.33 2f1d h LYS 177 Ca -0.05 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2f1d h LYS 177 Cb 1.46 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.75 2f1d h LYS 177 CO 0.14 0.26 0.23 0.00 -0.57 0.00 0.00 179.45 179.51 2f1d h ALA 178 N 0.77 0.62 -0.40 3.86 0.00 -1.23 -2.70 119.26 120.18 2f1d h ALA 178 Ca 0.00 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 2f1d h ALA 178 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2f1d h ALA 178 CO 0.00 0.19 -0.15 0.35 0.00 0.00 0.00 179.25 179.64 2f1d h PHE 179 N 0.64 0.81 -0.05 0.00 3.57 -1.11 -2.59 116.94 118.21 2f1d h PHE 179 Ca 0.17 -0.16 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2f1d h PHE 179 Cb 0.13 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.66 2f1d h PHE 179 CO -0.01 0.84 -0.00 0.00 -2.23 0.00 0.00 178.31 176.91 2f1d h ALA 180 N 1.18 0.06 0.00 2.41 0.00 -1.12 -0.38 119.26 121.41 2f1d h ALA 180 Ca 0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2f1d h ALA 180 Cb 0.63 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2f1d h ALA 180 CO 0.04 -0.25 -0.05 0.00 0.00 0.00 0.00 179.25 178.99 2f1d h ARG 181 N -0.23 0.00 0.00 0.00 3.08 -1.52 -1.52 114.38 114.19 2f1d h ARG 181 Ca 0.01 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.90 2f1d h ARG 181 Cb 0.36 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.38 2f1d h ARG 181 CO 0.00 0.05 -1.16 0.00 -1.07 0.00 0.00 179.97 177.80 2f1d h ALA 182 N 1.95 0.64 -0.11 0.04 0.00 -1.19 -2.98 119.26 117.62 2f1d h ALA 182 Ca -0.00 -0.80 -0.24 0.00 0.00 0.00 0.00 54.91 53.87 2f1d h ALA 182 Cb 0.33 0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.30 2f1d h ALA 182 CO 0.01 0.92 -0.86 1.25 0.00 0.00 0.00 179.25 180.57 2f1d h LEU 183 N 0.00 0.93 0.07 0.00 6.46 -0.66 -2.72 115.31 119.39 2f1d h LEU 183 Ca -0.12 -0.65 -0.00 0.00 -0.12 0.00 0.00 57.88 56.99 2f1d h LEU 183 Cb 1.58 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 41.23 2f1d h LEU 183 CO 0.06 1.46 -0.03 -0.09 -0.62 0.00 0.00 178.44 179.21 2f1d h ARG 184 N 0.50 -0.09 -0.89 1.25 2.43 -1.39 -0.66 114.38 115.52 2f1d h ARG 184 Ca -0.08 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.19 2f1d h ARG 184 Cb 1.50 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 31.00 2f1d h ARG 184 CO 0.17 0.04 0.54 0.37 -1.51 0.00 0.00 179.97 179.58 2f1d h GLN 185 N -0.21 0.88 0.00 0.20 4.15 -1.61 -1.97 115.11 116.55 2f1d h GLN 185 Ca -0.01 -0.05 -0.10 0.00 0.77 0.00 0.00 58.65 59.26 2f1d h GLN 185 Cb 0.18 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 2f1d h GLN 185 CO 0.02 0.58 -0.49 0.00 -1.93 0.00 0.00 178.83 177.01 2f1d h ALA 186 N 1.47 0.77 0.00 3.38 0.00 -1.11 -3.22 119.26 120.55 2f1d h ALA 186 Ca 0.42 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2f1d h ALA 186 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2f1d h ALA 186 CO -0.23 0.61 -0.69 0.25 0.00 0.00 0.00 179.25 179.19 2f1d n THR 187 N -3.35 0.12 -1.50 0.00 -2.24 -0.30 -1.51 114.28 105.51 2f1d n THR 187 Ca 0.01 -0.12 -0.30 0.00 -2.27 0.00 0.00 64.05 61.37 2f1d n THR 187 Cb 0.66 0.21 0.10 0.00 -2.10 0.00 0.00 70.33 69.19 2f1d n THR 187 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2f1d s GLU 188 N -3.08 2.01 -0.11 -0.78 2.02 -0.78 -4.81 118.70 113.17 2f1d s GLU 188 Ca 0.08 0.68 -0.15 0.00 0.02 0.00 0.00 54.97 55.61 2f1d s GLU 188 Cb 0.16 -1.91 -0.05 0.00 0.10 0.00 0.00 34.13 32.43 2f1d s GLU 188 CO 0.74 -1.69 0.36 0.95 0.02 0.00 0.00 175.26 175.65 2f1d s THR 189 N -3.12 5.22 -0.14 3.63 -4.23 -1.26 -1.75 115.64 113.99 2f1d s THR 189 Ca 0.61 0.71 -0.07 0.00 -1.18 0.00 0.00 61.69 61.76 2f1d s THR 189 Cb -0.15 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 69.96 2f1d s THR 189 CO 0.55 0.43 0.13 -0.62 -0.54 0.00 0.00 174.62 174.57 2f1d s ASP 190 N 0.03 6.28 -0.76 3.99 2.15 -1.13 -4.89 116.67 122.32 2f1d s ASP 190 Ca 0.21 0.39 -0.27 0.00 0.43 0.00 0.00 52.55 53.31 2f1d s ASP 190 Cb -0.14 -2.05 -0.24 0.00 -0.30 0.00 0.00 42.92 40.19 2f1d s ASP 190 CO 0.08 0.35 1.92 -2.65 -0.17 0.00 0.00 175.17 174.69 2f1d n PRO 191 N 2.39 0.49 0.00 4.34 -0.02 -1.26 -4.88 135.00 136.06 2f1d n PRO 191 Ca -0.19 -1.66 0.14 0.00 -2.02 0.00 0.00 63.50 59.77 2f1d n PRO 191 Cb 0.54 -3.39 0.61 0.00 -0.02 0.00 0.00 33.50 31.24 2f1d n PRO 191 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02