#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 3.30 -0.10 1.61 0.52 -1.26 -4.98 118.95 118.04 2f1d s ARG 11 Ca 0.00 0.65 0.04 0.00 -0.52 0.00 0.00 55.73 55.89 2f1d s ARG 11 Cb 0.00 -4.14 -0.00 0.00 0.52 0.00 0.00 34.95 31.33 2f1d s ARG 11 CO 0.00 -1.93 -0.22 0.42 0.02 0.00 0.00 175.30 173.59 2f1d s ILE 12 N 6.29 2.25 -0.06 1.52 1.01 -1.26 -1.57 121.20 129.37 2f1d s ILE 12 Ca 0.58 -0.96 0.03 0.00 0.00 0.00 0.00 60.65 60.30 2f1d s ILE 12 Cb -0.12 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 2f1d s ILE 12 CO 0.27 0.56 -0.15 -0.83 0.00 0.00 0.00 174.94 174.79 2f1d s GLY 13 N 0.26 1.52 0.02 6.18 0.00 -0.71 -4.23 107.32 110.36 2f1d s GLY 13 Ca -0.15 -0.97 0.03 0.00 0.00 0.00 0.00 44.72 43.63 2f1d s GLY 13 CO 0.08 -0.69 -0.11 -0.54 0.00 0.00 0.00 173.10 171.84 2f1d s GLU 14 N -0.56 0.77 -0.19 2.90 2.02 -1.26 -1.49 118.70 120.90 2f1d s GLU 14 Ca 0.08 -0.56 -0.10 0.00 0.02 0.00 0.00 54.97 54.41 2f1d s GLU 14 Cb -0.11 -0.73 0.07 0.00 0.10 0.00 0.00 34.13 33.45 2f1d s GLU 14 CO 0.01 0.18 0.45 0.08 0.02 0.00 0.00 175.26 176.00 2f1d s VAL 15 N -0.65 -0.10 -0.16 2.63 1.01 -0.38 -4.86 120.40 117.88 2f1d s VAL 15 Ca 0.00 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.09 2f1d s VAL 15 Cb -0.06 -0.67 0.01 0.00 0.00 0.00 0.00 36.38 35.66 2f1d s VAL 15 CO 0.00 0.04 -0.21 -1.59 0.00 0.00 0.00 175.10 173.34 2f1d s LYS 16 N 1.59 3.02 -0.18 2.72 -2.85 -1.26 -1.30 119.74 121.47 2f1d s LYS 16 Ca -0.09 -0.84 -0.01 0.00 -1.00 0.00 0.00 55.97 54.03 2f1d s LYS 16 Cb -0.08 -2.49 0.05 0.00 -2.06 0.00 0.00 37.83 33.24 2f1d s LYS 16 CO -0.14 -0.09 -0.03 0.50 0.10 0.00 0.00 175.35 175.70 2f1d s ARG 17 N 1.00 1.22 -0.18 1.78 3.52 -0.58 -5.03 118.95 120.68 2f1d s ARG 17 Ca -0.02 -0.52 0.01 0.00 -0.13 0.00 0.00 55.73 55.06 2f1d s ARG 17 Cb -0.15 -2.05 0.02 0.00 -1.56 0.00 0.00 34.95 31.21 2f1d s ARG 17 CO -0.06 -0.50 -0.19 0.08 -0.81 0.00 0.00 175.30 173.83 2f1d s VAL 18 N 1.67 2.20 0.49 7.11 1.01 -1.26 -2.71 120.40 128.91 2f1d s VAL 18 Ca -0.00 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2f1d s VAL 18 Cb -0.16 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2f1d s VAL 18 CO -0.07 0.53 0.01 0.42 0.00 0.00 0.00 175.10 175.99 2f1d s THR 19 N 1.22 1.27 0.50 3.92 -4.23 -0.91 -5.02 115.64 112.39 2f1d s THR 19 Ca 0.03 -2.00 0.37 0.00 -1.18 0.00 0.00 61.69 58.91 2f1d s THR 19 Cb -0.14 -2.31 0.40 0.00 1.34 0.00 0.00 72.50 71.79 2f1d s THR 19 CO -0.10 0.00 2.23 0.07 -0.54 0.00 0.00 174.62 176.27 2f1d h LYS 20 N 1.45 0.00 0.00 3.99 -0.00 -2.03 -3.27 116.57 116.71 2f1d h LYS 20 Ca -0.44 0.00 -0.43 0.00 -0.00 0.00 0.00 60.65 59.79 2f1d h LYS 20 Cb 1.30 0.00 -0.06 0.00 -0.00 0.00 0.00 32.23 33.47 2f1d h LYS 20 CO 0.74 0.02 -2.40 0.39 -0.00 0.00 0.00 179.45 178.21 2f1d n GLU 21 N -3.29 0.60 -4.24 0.07 1.02 -1.26 -5.06 120.64 108.48 2f1d n GLU 21 Ca -0.02 0.27 -0.16 0.00 -0.02 0.00 0.00 57.16 57.23 2f1d n GLU 21 Cb 0.15 -1.53 -0.11 0.00 -0.02 0.00 0.00 31.44 29.94 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 -2.50 1.25 -0.31 2.62 -4.23 -1.24 -3.72 115.64 107.52 2f1d s THR 22 Ca -0.37 -1.89 0.02 0.00 -1.18 0.00 0.00 61.69 58.28 2f1d s THR 22 Cb 0.13 -1.67 0.09 0.00 1.34 0.00 0.00 72.50 72.38 2f1d s THR 22 CO 0.53 -0.58 0.03 0.21 -0.54 0.00 0.00 174.62 174.27 2f1d s ASN 23 N -2.81 4.41 -0.14 3.99 3.84 -0.24 -2.15 114.94 121.84 2f1d s ASN 23 Ca 0.13 -1.81 -0.01 0.00 0.21 0.00 0.00 52.86 51.37 2f1d s ASN 23 Cb -0.01 -1.36 -0.02 0.00 -0.55 0.00 0.00 41.25 39.31 2f1d s ASN 23 CO 0.02 -0.35 -0.10 -0.69 -2.79 0.00 0.00 177.10 173.19 2f1d s VAL 24 N 1.18 3.31 -0.08 -5.21 1.01 -1.10 -2.90 120.40 116.61 2f1d s VAL 24 Ca 0.06 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.48 2f1d s VAL 24 Cb -0.19 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.80 2f1d s VAL 24 CO -0.12 0.51 -0.06 -0.55 0.00 0.00 0.00 175.10 174.88 2f1d s SER 25 N 0.38 1.66 -0.09 3.32 0.15 -0.40 -1.52 113.70 117.19 2f1d s SER 25 Ca -0.09 -0.21 -0.04 0.00 0.70 0.00 0.00 55.95 56.32 2f1d s SER 25 Cb -0.15 -0.65 0.05 0.00 -1.71 0.00 0.00 66.02 63.56 2f1d s SER 25 CO 0.05 -0.09 0.18 -0.69 1.20 0.00 0.00 173.24 173.89 2f1d s VAL 26 N 1.35 -0.28 -0.14 4.45 1.01 -0.42 -1.07 120.40 125.30 2f1d s VAL 26 Ca -0.03 0.33 0.02 0.00 0.00 0.00 0.00 61.98 62.30 2f1d s VAL 26 Cb -0.14 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 35.92 2f1d s VAL 26 CO -0.03 0.14 -0.20 -1.59 0.00 0.00 0.00 175.10 173.42 2f1d s LYS 27 N 2.26 3.08 -0.03 2.72 -2.85 -0.66 -1.25 119.74 123.01 2f1d s LYS 27 Ca 0.02 -0.82 0.06 0.00 -1.00 0.00 0.00 55.97 54.22 2f1d s LYS 27 Cb -0.12 -2.48 -0.01 0.00 -2.06 0.00 0.00 37.83 33.16 2f1d s LYS 27 CO -0.06 0.01 -0.21 0.42 0.10 0.00 0.00 175.35 175.61 2f1d s ILE 28 N 0.77 1.70 -0.31 3.79 1.01 -0.55 -2.00 121.20 125.59 2f1d s ILE 28 Ca -0.08 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 59.72 2f1d s ILE 28 Cb -0.16 -1.43 0.09 0.00 0.01 0.00 0.00 42.46 40.97 2f1d s ILE 28 CO -0.00 0.48 -0.00 0.21 0.00 0.00 0.00 174.94 175.62 2f1d s ASN 29 N -0.28 4.66 0.45 3.58 3.84 -0.89 -1.73 114.94 124.57 2f1d s ASN 29 Ca 0.02 -1.91 0.11 0.00 0.21 0.00 0.00 52.86 51.30 2f1d s ASN 29 Cb -0.10 -1.60 1.02 0.00 -0.55 0.00 0.00 41.25 40.01 2f1d s ASN 29 CO 0.01 -0.32 2.07 -0.07 -2.79 0.00 0.00 177.10 176.01 2f1d h LEU 30 N 7.67 0.24 -3.87 3.21 3.38 -1.62 -2.70 115.31 121.63 2f1d h LEU 30 Ca -0.09 -0.01 -0.57 0.00 0.09 0.00 0.00 57.88 57.30 2f1d h LEU 30 Cb 1.03 -0.06 -0.30 0.00 0.09 0.00 0.00 40.66 41.41 2f1d h LEU 30 CO 0.50 0.21 0.35 0.47 0.09 0.00 0.00 178.44 180.05 2f1d n ASP 31 N -4.47 5.93 -2.90 -0.43 8.00 -1.26 -4.72 116.55 116.70 2f1d n ASP 31 Ca 0.00 -3.76 0.00 0.00 0.71 0.00 0.00 54.79 51.74 2f1d n ASP 31 Cb 0.10 -0.77 0.00 0.00 -0.02 0.00 0.00 41.12 40.43 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 -0.93 -0.77 0.00 0.44 0.00 -1.14 -4.89 105.19 97.91 2f1d n GLY 32 Ca 0.55 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.18 0.60 -0.50 2.61 -2.24 -1.22 -4.75 114.28 108.61 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 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 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 -0.30 0.91 3.60 3.38 0.00 -1.13 -4.92 105.19 106.73 2f1d n GLY 34 Ca 0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.08 4.75 -0.18 1.61 1.01 -1.05 -4.56 120.40 119.91 2f1d s VAL 35 Ca 0.00 1.05 -0.08 0.00 0.00 0.00 0.00 61.98 62.95 2f1d s VAL 35 Cb 0.00 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 2f1d s VAL 35 CO 0.00 -0.35 0.10 0.00 0.00 0.00 0.00 175.10 174.85 2f1d s ALA 36 N 3.06 3.59 -0.45 5.51 0.00 -1.26 -0.05 121.76 132.15 2f1d s ALA 36 Ca 0.32 -0.71 0.05 0.00 0.00 0.00 0.00 51.96 51.63 2f1d s ALA 36 Cb -0.14 -2.03 0.28 0.00 0.00 0.00 0.00 23.12 21.23 2f1d s ALA 36 CO 0.15 0.23 1.05 -3.47 0.00 0.00 0.00 175.76 173.72 2f1d n ASP 37 N 3.32 -2.42 -4.32 0.00 4.64 -0.24 -4.97 116.55 112.55 2f1d n ASP 37 Ca -0.17 -3.23 -0.32 0.00 -1.38 0.00 0.00 54.79 49.70 2f1d n ASP 37 Cb 0.52 1.73 -0.16 0.00 -1.04 0.00 0.00 41.12 42.18 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 -1.30 3.26 -0.30 1.67 0.01 -1.26 -1.87 113.70 113.91 2f1d s SER 38 Ca 0.27 -0.44 -0.01 0.00 1.31 0.00 0.00 55.95 57.08 2f1d s SER 38 Cb 0.26 -0.70 0.13 0.00 0.21 0.00 0.00 66.02 65.91 2f1d s SER 38 CO -0.15 0.28 0.24 -0.55 0.41 0.00 0.00 173.24 173.47 2f1d s SER 39 N -0.39 2.38 0.00 2.44 0.15 -0.96 -4.92 113.70 112.40 2f1d s SER 39 Ca 0.03 -1.13 0.12 0.00 0.70 0.00 0.00 55.95 55.68 2f1d s SER 39 Cb -0.12 0.15 -0.08 0.00 -1.71 0.00 0.00 66.02 64.25 2f1d s SER 39 CO 0.02 -0.39 0.60 -1.54 1.20 0.00 0.00 173.24 173.13 2f1d n SER 40 N 5.09 0.89 0.00 5.45 3.41 -1.26 -2.22 113.62 124.98 2f1d n SER 40 Ca -0.01 -0.94 0.00 0.00 -0.26 0.00 0.00 58.87 57.65 2f1d n SER 40 Cb 0.44 0.80 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 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 1.19 0.60 2.60 5.00 0.00 -1.26 -4.57 105.19 108.74 2f1d n GLY 41 Ca 0.03 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.00 0.72 0.33 -0.61 1.01 -1.26 -5.00 121.20 114.38 2f1d s ILE 42 Ca 0.00 -1.94 0.10 0.00 0.00 0.00 0.00 60.65 58.81 2f1d s ILE 42 Cb 0.00 -1.52 0.32 0.00 0.01 0.00 0.00 42.46 41.27 2f1d s ILE 42 CO 0.00 -0.90 1.72 -0.65 0.00 0.00 0.00 174.94 175.12 2f1d h PRO 43 N 7.13 0.53 -0.07 2.79 0.11 -2.00 -1.85 132.00 138.64 2f1d h PRO 43 Ca -0.01 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.86 2f1d h PRO 43 Cb 0.96 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2f1d h PRO 43 CO 0.39 0.35 -0.82 0.35 -0.21 0.00 0.00 178.00 178.06 2f1d h PHE 44 N 0.55 0.74 -0.00 0.65 3.57 -1.96 -2.83 116.94 117.67 2f1d h PHE 44 Ca 0.65 -0.35 -0.09 0.00 3.53 0.00 0.00 57.97 61.71 2f1d h PHE 44 Cb 1.28 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.90 2f1d h PHE 44 CO -0.01 1.15 -0.43 1.25 -2.23 0.00 0.00 178.31 178.04 2f1d h LEU 45 N 0.35 0.00 -0.64 0.59 5.85 -1.80 -2.46 115.31 117.20 2f1d h LEU 45 Ca -0.06 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 2f1d h LEU 45 Cb 1.43 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 2f1d h LEU 45 CO 0.15 0.43 0.09 0.44 -0.34 0.00 0.00 178.44 179.21 2f1d h ASP 46 N 0.00 1.02 0.29 1.25 3.32 -1.34 -1.45 116.42 119.50 2f1d h ASP 46 Ca -0.00 -0.27 -0.06 0.00 0.02 0.00 0.00 57.03 56.72 2f1d h ASP 46 Cb 0.76 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2f1d h ASP 46 CO 0.06 1.03 -0.27 -0.74 -1.72 0.00 0.00 179.24 177.59 2f1d h HIS 47 N 0.97 0.00 0.00 4.55 2.76 -1.21 -1.01 115.15 121.21 2f1d h HIS 47 Ca 0.19 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.20 2f1d h HIS 47 Cb 0.45 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.38 2f1d h HIS 47 CO 0.03 0.27 -0.83 0.52 -1.30 0.00 0.00 177.93 176.62 2f1d h MET 48 N 0.00 0.00 -0.01 5.26 2.86 -1.23 -2.86 114.93 118.96 2f1d h MET 48 Ca -0.00 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.45 2f1d h MET 48 Cb 0.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 2f1d h MET 48 CO 0.04 0.65 -0.82 -0.07 1.06 0.00 0.00 176.91 177.76 2f1d h LEU 49 N 0.00 0.25 -0.73 1.22 3.38 -0.63 -2.10 115.31 116.70 2f1d h LEU 49 Ca -0.04 -0.19 -0.14 0.00 0.09 0.00 0.00 57.88 57.61 2f1d h LEU 49 Cb 1.57 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.24 2f1d h LEU 49 CO 0.09 0.97 -0.55 0.44 0.09 0.00 0.00 178.44 179.47 2f1d h ASP 50 N 0.12 0.27 -0.36 -0.43 3.32 -1.21 -1.33 116.42 116.79 2f1d h ASP 50 Ca -0.04 -0.14 -0.10 0.00 0.02 0.00 0.00 57.03 56.77 2f1d h ASP 50 Cb 1.43 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.89 2f1d h ASP 50 CO 0.13 0.76 -0.14 1.56 -1.72 0.00 0.00 179.24 179.83 2f1d h GLN 51 N 0.18 0.82 -0.43 3.56 1.08 -1.43 0.18 115.11 119.08 2f1d h GLN 51 Ca 0.00 -0.29 -0.08 0.00 -1.45 0.00 0.00 58.65 56.83 2f1d h GLN 51 Cb 1.03 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 28.39 2f1d h GLN 51 CO 0.09 0.91 -0.03 1.25 -0.95 0.00 0.00 178.83 180.09 2f1d h LEU 52 N 0.73 0.78 -1.10 1.46 5.85 -0.99 -2.03 115.31 120.02 2f1d h LEU 52 Ca 0.12 -0.33 -0.09 0.00 0.84 0.00 0.00 57.88 58.42 2f1d h LEU 52 Cb 0.64 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2f1d h LEU 52 CO 0.04 0.92 -0.29 0.00 -0.34 0.00 0.00 178.44 178.77 2f1d h ALA 53 N 0.89 1.24 0.03 1.25 0.00 -1.13 -2.85 119.26 118.69 2f1d h ALA 53 Ca 0.12 -0.33 -0.26 0.00 0.00 0.00 0.00 54.91 54.44 2f1d h ALA 53 Cb 0.54 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2f1d h ALA 53 CO 0.03 0.51 -1.31 1.03 0.00 0.00 0.00 179.25 179.51 2f1d h SER 54 N 0.24 0.11 0.00 0.00 0.87 -0.76 -2.77 113.55 111.24 2f1d h SER 54 Ca 0.03 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2f1d h SER 54 Cb 0.65 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 2f1d h SER 54 CO 0.05 1.12 -1.21 1.41 -0.53 0.00 0.00 176.83 177.67 2f1d n HIS 55 N -3.31 0.00 0.83 2.24 -0.00 -0.78 -4.09 115.22 110.11 2f1d n HIS 55 Ca -0.08 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.73 2f1d n HIS 55 Cb 1.00 -0.18 -0.04 0.00 -0.00 0.00 0.00 29.99 30.77 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 1.52 -0.22 3.83 -1.41 0.00 -1.08 -3.94 105.19 103.88 2f1d n GLY 56 Ca -0.00 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.52 -2.78 -4.92 0.99 4.77 -1.18 -4.73 117.00 108.62 2f1d n LEU 57 Ca 0.06 -0.76 -0.26 0.00 -0.03 0.00 0.00 56.01 55.03 2f1d n LEU 57 Cb 0.35 -2.64 -0.00 0.00 -2.33 0.00 0.00 43.42 38.80 2f1d n LEU 57 CO 0.27 0.48 0.32 -0.36 -1.33 0.00 0.00 177.39 176.77 2f1d s PHE 58 N -3.38 3.52 -0.18 -1.77 0.40 -1.05 -2.87 117.98 112.65 2f1d s PHE 58 Ca 0.52 0.57 -0.08 0.00 -0.60 0.00 0.00 56.93 57.35 2f1d s PHE 58 Cb -0.26 -2.12 -0.04 0.00 0.51 0.00 0.00 43.02 41.11 2f1d s PHE 58 CO 0.81 -0.11 0.07 -0.51 0.70 0.00 0.00 175.22 176.18 2f1d s ASP 59 N -4.08 5.70 -0.20 1.36 1.01 -1.03 -2.52 116.67 116.92 2f1d s ASP 59 Ca 0.44 0.11 -0.00 0.00 0.71 0.00 0.00 52.55 53.80 2f1d s ASP 59 Cb -0.10 -1.97 0.05 0.00 1.01 0.00 0.00 42.92 41.91 2f1d s ASP 59 CO 0.41 0.18 -0.04 -0.69 0.21 0.00 0.00 175.17 175.24 2f1d s VAL 60 N 0.33 1.20 -0.22 -1.27 1.01 0.92 -2.09 120.40 120.28 2f1d s VAL 60 Ca 0.04 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.16 2f1d s VAL 60 Cb -0.12 -1.46 0.03 0.00 0.00 0.00 0.00 36.38 34.83 2f1d s VAL 60 CO -0.00 -0.01 -0.14 -2.28 0.00 0.00 0.00 175.10 172.67 2f1d s HIS 61 N 1.57 2.97 0.00 5.22 5.04 -0.85 -1.07 115.29 128.17 2f1d s HIS 61 Ca -0.02 -1.74 0.03 0.00 -1.54 0.00 0.00 55.06 51.79 2f1d s HIS 61 Cb -0.17 -1.96 -0.01 0.00 0.04 0.00 0.00 32.58 30.47 2f1d s HIS 61 CO -0.07 -0.79 -0.11 0.08 -2.34 0.00 0.00 174.74 171.51 2f1d s VAL 62 N 1.26 0.85 -0.14 0.89 1.01 -0.78 -1.65 120.40 121.83 2f1d s VAL 62 Ca 0.01 -0.56 -0.06 0.00 0.00 0.00 0.00 61.98 61.37 2f1d s VAL 62 Cb -0.16 -0.73 0.07 0.00 0.00 0.00 0.00 36.38 35.56 2f1d s VAL 62 CO -0.09 0.17 0.31 -0.60 0.00 0.00 0.00 175.10 174.89 2f1d s ARG 63 N -0.45 0.22 -0.01 2.72 6.06 -0.23 -2.27 118.95 124.99 2f1d s ARG 63 Ca 0.03 0.77 -0.06 0.00 -2.50 0.00 0.00 55.73 53.98 2f1d s ARG 63 Cb -0.05 0.03 0.00 0.00 0.06 0.00 0.00 34.95 34.99 2f1d s ARG 63 CO -0.00 -0.24 0.12 0.00 -2.50 0.00 0.00 175.30 172.68 2f1d s ALA 64 N 2.13 -0.28 -0.09 6.12 0.00 -0.94 -1.27 121.76 127.42 2f1d s ALA 64 Ca -0.03 -0.00 -0.04 0.00 0.00 0.00 0.00 51.96 51.89 2f1d s ALA 64 Cb -0.11 -0.00 0.05 0.00 0.00 0.00 0.00 23.12 23.05 2f1d s ALA 64 CO -0.10 -0.15 0.19 0.99 0.00 0.00 0.00 175.76 176.69 2f1d s THR 65 N -0.89 -0.22 0.00 0.00 2.01 -1.14 -4.39 115.64 111.00 2f1d s THR 65 Ca -0.10 0.27 0.00 0.00 0.31 0.00 0.00 61.69 62.18 2f1d s THR 65 Cb -0.06 -0.33 0.00 0.00 0.01 0.00 0.00 72.50 72.12 2f1d s THR 65 CO 0.01 0.11 0.00 0.61 -0.69 0.00 0.00 174.62 174.66 2f1d n GLY 66 N 4.94 3.74 0.72 4.40 0.00 -1.26 -1.08 105.19 116.66 2f1d n GLY 66 Ca -0.12 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 1.38 0.11 1.61 8.00 -1.24 -4.59 116.55 121.81 2f1d n ASP 67 Ca 0.00 -1.46 0.16 0.00 0.71 0.00 0.00 54.79 54.20 2f1d n ASP 67 Cb 0.00 -0.37 0.44 0.00 -0.02 0.00 0.00 41.12 41.17 2f1d n ASP 67 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2f1d h VAL 68 N 0.12 0.07 0.00 2.53 2.07 -1.95 0.33 116.25 119.42 2f1d h VAL 68 Ca 0.00 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.39 2f1d h VAL 68 Cb 0.53 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2f1d h VAL 68 CO 0.00 0.00 -0.61 1.12 0.02 0.00 0.00 177.57 178.10 2f1d h HIS 69 N 0.00 0.00 0.06 1.57 2.07 -2.00 -3.33 115.15 113.52 2f1d h HIS 69 Ca 0.20 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.72 2f1d h HIS 69 Cb 1.88 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.86 2f1d h HIS 69 CO 0.00 0.61 -0.03 0.82 -3.07 0.00 0.00 177.93 176.26 2f1d h ILE 70 N 0.00 0.00 -4.77 6.12 2.04 -0.74 -3.50 117.51 116.66 2f1d h ILE 70 Ca -0.01 -0.16 -0.44 0.00 1.00 0.00 0.00 64.86 65.26 2f1d h ILE 70 Cb 1.10 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 37.05 2f1d h ILE 70 CO 0.08 0.00 -0.44 -0.62 0.00 0.00 0.00 178.15 177.16 2f1d s ASP 71 N -3.25 1.52 0.00 1.72 -1.08 -1.16 -5.04 116.67 109.38 2f1d s ASP 71 Ca -0.01 -1.71 0.20 0.00 -0.52 0.00 0.00 52.55 50.51 2f1d s ASP 71 Cb 0.00 0.57 -0.05 0.00 -1.46 0.00 0.00 42.92 41.99 2f1d s ASP 71 CO 0.03 -1.10 0.97 0.47 0.52 0.00 0.00 175.17 176.06 2f1d n ASP 72 N -1.50 1.71 -0.10 -0.34 8.00 -1.26 -3.64 116.55 119.41 2f1d n ASP 72 Ca 0.06 -1.35 -0.08 0.00 0.71 0.00 0.00 54.79 54.13 2f1d n ASP 72 Cb 0.62 0.57 -0.01 0.00 -0.02 0.00 0.00 41.12 42.29 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 1.80 0.42 -0.26 1.24 2.76 -1.96 -1.34 115.15 117.81 2f1d h HIS 73 Ca 0.00 0.01 -0.17 0.00 -2.20 0.00 0.00 60.37 58.01 2f1d h HIS 73 Cb 0.64 -0.14 -0.00 0.00 1.55 0.00 0.00 27.41 29.46 2f1d h HIS 73 CO 0.00 0.26 -0.52 0.45 -1.30 0.00 0.00 177.93 176.82 2f1d h HIS 74 N 0.45 0.93 -0.13 5.26 3.86 -1.95 -2.43 115.15 121.15 2f1d h HIS 74 Ca 0.13 -0.32 -0.04 0.00 -1.16 0.00 0.00 60.37 58.98 2f1d h HIS 74 Cb -0.04 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.25 2f1d h HIS 74 CO -0.06 1.11 -0.07 1.15 0.86 0.00 0.00 177.93 180.92 2f1d h THR 75 N 0.58 1.32 -0.86 2.45 2.02 -1.89 -2.29 112.91 114.24 2f1d h THR 75 Ca 0.02 -1.13 0.14 0.00 0.77 0.00 0.00 66.41 66.20 2f1d h THR 75 Cb 1.10 1.79 -0.09 0.00 -1.74 0.00 0.00 68.15 69.21 2f1d h THR 75 CO 0.11 0.33 0.47 -1.13 0.37 0.00 0.00 175.52 175.66 2f1d h ASN 76 N -0.07 0.60 0.23 4.18 -0.73 -1.16 -1.34 115.58 117.28 2f1d h ASN 76 Ca 0.03 0.08 -0.34 0.00 1.87 0.00 0.00 56.30 57.94 2f1d h ASN 76 Cb 0.55 -0.02 0.03 0.00 0.27 0.00 0.00 38.32 39.15 2f1d h ASN 76 CO 0.02 0.27 -1.59 -0.08 -0.37 0.00 0.00 177.43 175.68 2f1d h GLU 77 N 0.68 0.48 -0.15 6.67 4.81 -1.45 -2.97 114.58 122.65 2f1d h GLU 77 Ca 0.46 -0.82 -0.09 0.00 -0.13 0.00 0.00 59.36 58.78 2f1d h GLU 77 Cb 0.61 0.30 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 2f1d h GLU 77 CO -0.34 1.39 -0.33 -0.44 -0.73 0.00 0.00 179.01 178.57 2f1d h ASP 78 N 0.11 0.31 -0.14 1.04 3.32 -1.20 -1.43 116.42 118.43 2f1d h ASP 78 Ca -0.29 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 56.61 2f1d h ASP 78 Cb 2.13 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 41.59 2f1d h ASP 78 CO 0.23 0.62 -0.05 0.40 -1.72 0.00 0.00 179.24 178.73 2f1d h ILE 79 N 0.26 1.30 0.00 0.35 2.04 -1.32 -2.55 117.51 117.60 2f1d h ILE 79 Ca 0.03 -1.03 -0.07 0.00 1.00 0.00 0.00 64.86 64.79 2f1d h ILE 79 Cb 0.71 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.48 2f1d h ILE 79 CO 0.05 0.30 -0.33 0.00 0.00 0.00 0.00 178.15 178.17 2f1d h ALA 80 N 0.68 1.04 -0.25 1.87 0.00 -1.44 -1.49 119.26 119.67 2f1d h ALA 80 Ca 0.03 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.45 2f1d h ALA 80 Cb 0.49 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2f1d h ALA 80 CO 0.02 0.42 -0.57 -0.07 0.00 0.00 0.00 179.25 179.04 2f1d h LEU 81 N 0.00 0.93 -0.21 0.00 3.38 -1.24 -2.53 115.31 115.64 2f1d h LEU 81 Ca -0.00 -0.56 -0.00 0.00 0.09 0.00 0.00 57.88 57.41 2f1d h LEU 81 Cb 0.83 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2f1d h LEU 81 CO 0.04 1.31 0.12 0.00 0.09 0.00 0.00 178.44 180.01 2f1d h ALA 82 N 0.64 0.27 -0.76 1.53 0.00 -1.19 -2.68 119.26 117.06 2f1d h ALA 82 Ca -0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2f1d h ALA 82 Cb 1.18 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2f1d h ALA 82 CO 0.12 -0.22 0.41 0.82 0.00 0.00 0.00 179.25 180.39 2f1d h ILE 83 N 0.25 1.22 -0.80 0.00 2.04 -1.23 0.11 117.51 119.09 2f1d h ILE 83 Ca 0.07 -0.55 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 2f1d h ILE 83 Cb 0.03 0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 36.28 2f1d h ILE 83 CO -0.01 0.25 0.43 1.23 0.00 0.00 0.00 178.15 180.04 2f1d h GLY 84 N 1.09 1.21 1.56 5.37 0.00 -1.36 -1.45 103.07 109.48 2f1d h GLY 84 Ca 0.27 -0.56 -0.13 0.00 0.00 0.00 0.00 47.33 46.91 2f1d h GLY 84 CO -0.04 0.53 -0.40 -0.84 0.00 0.00 0.00 176.54 175.79 2f1d h THR 85 N 1.12 1.30 0.00 4.70 2.02 -0.84 -2.02 112.91 119.18 2f1d h THR 85 Ca 0.28 -1.55 -0.10 0.00 0.77 0.00 0.00 66.41 65.81 2f1d h THR 85 Cb 0.05 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 2f1d h THR 85 CO -0.04 0.48 -0.47 0.00 0.37 0.00 0.00 175.52 175.86 2f1d h ALA 86 N 1.17 1.10 -0.17 6.16 0.00 -0.61 -2.27 119.26 124.64 2f1d h ALA 86 Ca 0.04 -0.43 -0.18 0.00 0.00 0.00 0.00 54.91 54.34 2f1d h ALA 86 Cb 0.88 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2f1d h ALA 86 CO 0.07 0.59 -0.62 1.25 0.00 0.00 0.00 179.25 180.55 2f1d h LEU 87 N 0.00 0.67 -0.14 0.00 5.85 -0.91 -2.91 115.31 117.87 2f1d h LEU 87 Ca -0.00 -0.39 -0.23 0.00 0.84 0.00 0.00 57.88 58.09 2f1d h LEU 87 Cb 0.90 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 41.74 2f1d h LEU 87 CO 0.06 1.13 -0.90 0.25 -0.34 0.00 0.00 178.44 178.64 2f1d h LEU 88 N 0.44 0.80 -0.35 2.25 5.85 -0.96 -1.90 115.31 121.44 2f1d h LEU 88 Ca -0.01 -0.58 -0.04 0.00 0.84 0.00 0.00 57.88 58.08 2f1d h LEU 88 Cb 1.18 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 2f1d h LEU 88 CO 0.12 1.38 0.04 0.11 -0.34 0.00 0.00 178.44 179.75 2f1d h LYS 89 N 0.40 0.59 -0.21 1.25 1.57 -1.51 -3.06 116.57 115.59 2f1d h LYS 89 Ca -0.08 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.48 2f1d h LYS 89 Cb 1.53 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.76 2f1d h LYS 89 CO 0.17 0.67 -0.11 0.00 -0.57 0.00 0.00 179.45 179.61 2f1d h ALA 90 N 0.89 1.42 -0.21 3.86 0.00 -1.47 -3.01 119.26 120.74 2f1d h ALA 90 Ca 0.10 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 2f1d h ALA 90 Cb 0.38 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2f1d h ALA 90 CO 0.01 0.40 -0.50 -0.07 0.00 0.00 0.00 179.25 179.10 2f1d h LEU 91 N 0.32 0.81 0.00 0.00 3.38 -1.32 -3.40 115.31 115.09 2f1d h LEU 91 Ca 0.06 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2f1d h LEU 91 Cb 0.40 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2f1d h LEU 91 CO 0.02 1.22 0.00 0.61 0.09 0.00 0.00 178.44 180.39 2f1d n GLY 92 N 0.46 1.33 0.11 0.83 0.00 -1.14 -2.97 105.19 103.81 2f1d n GLY 92 Ca -0.06 -0.72 0.11 0.00 0.00 0.00 0.00 46.02 45.36 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 12.74 0.17 -2.76 1.61 -0.00 -1.26 -4.89 120.64 126.24 2f1d n GLU 93 Ca 0.00 0.37 -0.07 0.00 -0.00 0.00 0.00 57.16 57.46 2f1d n GLU 93 Cb 0.00 -1.80 0.02 0.00 -0.00 0.00 0.00 31.44 29.66 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 -2.12 -2.10 -2.41 3.44 1.74 -1.16 -4.97 116.66 109.08 2f1d n ARG 94 Ca 0.03 0.23 -0.42 0.00 -0.77 0.00 0.00 57.85 56.91 2f1d n ARG 94 Cb 0.25 -3.46 -0.03 0.00 -1.02 0.00 0.00 32.46 28.19 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 -5.30 4.32 -1.18 5.56 -0.14 -1.26 -3.88 119.74 117.86 2f1d s LYS 95 Ca 0.15 1.73 -0.04 0.00 -1.36 0.00 0.00 55.97 56.45 2f1d s LYS 95 Cb -0.07 -3.59 0.03 0.00 -1.68 0.00 0.00 37.83 32.51 2f1d s LYS 95 CO 0.19 -0.51 0.24 0.41 -0.76 0.00 0.00 175.35 174.91 2f1d n GLY 96 N 3.46 -0.50 3.93 -3.33 0.00 -1.26 -4.99 105.19 102.50 2f1d n GLY 96 Ca 0.12 0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.78 4.41 0.28 -0.61 -4.36 -1.25 -2.07 121.20 114.82 2f1d s ILE 97 Ca 0.17 -0.19 -0.00 0.00 -0.26 0.00 0.00 60.65 60.37 2f1d s ILE 97 Cb -0.09 -3.66 0.13 0.00 1.25 0.00 0.00 42.46 40.09 2f1d s ILE 97 CO 0.22 -0.55 1.80 0.78 0.24 0.00 0.00 174.94 177.42 2f1d h ASN 98 N 0.30 0.71 0.00 4.36 2.35 -1.41 -3.44 115.58 118.46 2f1d h ASN 98 Ca -0.47 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.13 2f1d h ASN 98 Cb 1.23 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.42 2f1d h ASN 98 CO 0.60 0.75 0.00 -1.14 -1.65 0.00 0.00 177.43 175.99 2f1d n ARG 99 N -4.24 0.00 -3.52 0.81 0.63 -0.67 -4.89 116.66 104.77 2f1d n ARG 99 Ca 0.03 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.59 2f1d n ARG 99 Cb 0.27 -0.01 -0.08 0.00 0.45 0.00 0.00 32.46 33.08 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 3.36 -0.06 -0.14 0.40 -1.26 -1.76 117.98 118.52 2f1d s PHE 100 Ca 0.00 0.45 0.04 0.00 -0.60 0.00 0.00 56.93 56.82 2f1d s PHE 100 Cb 0.00 -2.39 -0.00 0.00 0.51 0.00 0.00 43.02 41.13 2f1d s PHE 100 CO 0.00 0.06 -0.19 0.20 0.70 0.00 0.00 175.22 175.99 2f1d s GLY 101 N 0.96 1.03 -0.11 4.36 0.00 -0.82 -4.24 107.32 108.51 2f1d s GLY 101 Ca 0.14 -0.75 -0.03 0.00 0.00 0.00 0.00 44.72 44.08 2f1d s GLY 101 CO 0.06 -0.30 0.13 -0.35 0.00 0.00 0.00 173.10 172.64 2f1d s ASP 102 N 0.19 1.23 -0.17 1.64 2.15 -1.26 -1.18 116.67 119.27 2f1d s ASP 102 Ca -0.09 0.02 -0.11 0.00 0.43 0.00 0.00 52.55 52.80 2f1d s ASP 102 Cb -0.14 0.09 0.05 0.00 -0.30 0.00 0.00 42.92 42.63 2f1d s ASP 102 CO 0.04 -0.28 0.42 0.12 -0.17 0.00 0.00 175.17 175.30 2f1d s PHE 103 N 2.24 -0.57 -0.24 -5.34 5.36 -1.08 -4.89 117.98 113.47 2f1d s PHE 103 Ca 0.04 1.25 -0.08 0.00 -0.96 0.00 0.00 56.93 57.18 2f1d s PHE 103 Cb -0.13 0.24 -0.04 0.00 -0.34 0.00 0.00 43.02 42.75 2f1d s PHE 103 CO -0.07 -0.31 0.11 0.99 -1.46 0.00 0.00 175.22 174.48 2f1d s THR 104 N 1.00 4.74 -0.04 0.12 2.01 -1.26 -1.93 115.64 120.29 2f1d s THR 104 Ca -0.06 -0.03 0.04 0.00 0.31 0.00 0.00 61.69 61.95 2f1d s THR 104 Cb -0.06 -3.21 -0.00 0.00 0.01 0.00 0.00 72.50 69.23 2f1d s THR 104 CO -0.08 0.34 -0.16 0.00 -0.69 0.00 0.00 174.62 174.03 2f1d s ALA 105 N 1.34 1.44 0.24 7.40 0.00 -0.76 -4.99 121.76 126.43 2f1d s ALA 105 Ca 0.06 -0.66 -0.02 0.00 0.00 0.00 0.00 51.96 51.33 2f1d s ALA 105 Cb -0.15 -0.46 -0.05 0.00 0.00 0.00 0.00 23.12 22.47 2f1d s ALA 105 CO 0.05 0.28 0.46 -1.25 0.00 0.00 0.00 175.76 175.29 2f1d s PRO 106 N -0.03 3.56 -0.30 0.00 0.04 -1.26 -2.64 135.00 134.37 2f1d s PRO 106 Ca -0.02 -0.21 -0.02 0.00 0.04 0.00 0.00 61.00 60.79 2f1d s PRO 106 Cb -0.10 -2.76 0.12 0.00 0.04 0.00 0.00 34.50 31.80 2f1d s PRO 106 CO 0.01 0.33 0.21 -1.17 0.04 0.00 0.00 177.00 176.42 2f1d s LEU 107 N -3.43 0.30 0.00 -3.56 2.96 -1.07 -4.95 118.68 108.93 2f1d s LEU 107 Ca 0.41 -1.23 0.00 0.00 -0.22 0.00 0.00 54.13 53.08 2f1d s LEU 107 Cb -0.11 -0.02 0.00 0.00 0.50 0.00 0.00 46.19 46.56 2f1d s LEU 107 CO 0.29 -0.40 0.00 0.47 -1.32 0.00 0.00 176.35 175.40 2f1d n ASP 108 N 5.08 0.00 0.16 3.68 8.00 -1.26 -2.28 116.55 129.92 2f1d n ASP 108 Ca -0.02 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.61 2f1d n ASP 108 Cb 0.43 0.00 0.53 0.00 -0.02 0.00 0.00 41.12 42.06 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 -6.55 -1.24 9.09 -1.98 -3.45 114.58 110.45 2f1d h GLU 109 Ca 0.00 0.00 -0.51 0.00 0.05 0.00 0.00 59.36 58.90 2f1d h GLU 109 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 2f1d h GLU 109 CO 0.00 0.00 -0.10 0.00 0.05 0.00 0.00 179.01 178.96 2f1d s ALA 110 N -3.39 3.58 -0.29 1.06 0.00 -0.97 -3.66 121.76 118.10 2f1d s ALA 110 Ca 0.03 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.51 2f1d s ALA 110 Cb 0.09 -2.36 0.18 0.00 0.00 0.00 0.00 23.12 21.03 2f1d s ALA 110 CO 0.41 0.20 0.55 -1.17 0.00 0.00 0.00 175.76 175.76 2f1d s LEU 111 N -3.59 -1.34 -0.11 0.00 2.96 -1.09 -2.58 118.68 112.93 2f1d s LEU 111 Ca 0.45 0.44 0.01 0.00 -0.22 0.00 0.00 54.13 54.81 2f1d s LEU 111 Cb -0.11 1.91 -0.02 0.00 0.50 0.00 0.00 46.19 48.47 2f1d s LEU 111 CO 0.30 -0.29 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.27 2f1d s ILE 112 N 2.78 2.97 -0.10 6.68 -1.09 -1.08 -0.79 121.20 130.57 2f1d s ILE 112 Ca 0.15 -0.71 -0.03 0.00 -2.23 0.00 0.00 60.65 57.83 2f1d s ILE 112 Cb -0.13 -2.22 -0.03 0.00 -1.58 0.00 0.00 42.46 38.50 2f1d s ILE 112 CO -0.23 0.54 0.02 -2.28 -1.23 0.00 0.00 174.94 171.77 2f1d s HIS 113 N 0.08 3.22 -0.31 3.97 5.65 0.07 -1.82 115.29 126.16 2f1d s HIS 113 Ca -0.06 0.20 -0.02 0.00 0.25 0.00 0.00 55.06 55.43 2f1d s HIS 113 Cb -0.15 -1.85 0.12 0.00 -1.18 0.00 0.00 32.58 29.52 2f1d s HIS 113 CO 0.05 0.44 0.20 0.08 -0.65 0.00 0.00 174.74 174.86 2f1d s VAL 114 N -0.70 -0.13 -0.18 0.89 1.01 -0.81 -1.05 120.40 119.43 2f1d s VAL 114 Ca 0.11 -0.88 -0.07 0.00 0.00 0.00 0.00 61.98 61.14 2f1d s VAL 114 Cb -0.12 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 2f1d s VAL 114 CO 0.02 -0.71 0.06 -0.55 0.00 0.00 0.00 175.10 173.92 2f1d s SER 115 N 1.93 5.59 0.17 3.32 0.15 -0.98 -2.62 113.70 121.26 2f1d s SER 115 Ca 0.11 0.07 -0.03 0.00 0.70 0.00 0.00 55.95 56.81 2f1d s SER 115 Cb -0.17 -1.95 -0.03 0.00 -1.71 0.00 0.00 66.02 62.16 2f1d s SER 115 CO -0.27 0.18 0.13 -1.48 1.20 0.00 0.00 173.24 173.00 2f1d s LEU 116 N 0.35 1.36 -0.25 3.45 0.05 -0.32 -1.31 118.68 122.00 2f1d s LEU 116 Ca 0.03 -1.22 -0.03 0.00 0.05 0.00 0.00 54.13 52.95 2f1d s LEU 116 Cb -0.12 0.51 0.14 0.00 -2.05 0.00 0.00 46.19 44.67 2f1d s LEU 116 CO 0.00 -0.81 0.45 -0.62 -0.55 0.00 0.00 176.35 174.82 2f1d s ASP 117 N -3.08 -0.32 -1.22 1.48 2.15 -0.36 -1.94 116.67 113.38 2f1d s ASP 117 Ca 0.29 0.57 -0.21 0.00 0.43 0.00 0.00 52.55 53.63 2f1d s ASP 117 Cb 0.06 1.48 -0.05 0.00 -0.30 0.00 0.00 42.92 44.11 2f1d s ASP 117 CO 0.06 -0.28 1.88 -0.76 -0.17 0.00 0.00 175.17 175.91 2f1d s LEU 118 N 2.65 3.25 -0.09 -1.34 1.43 -0.72 -1.92 118.68 121.94 2f1d s LEU 118 Ca 0.12 -1.88 0.15 0.00 -1.03 0.00 0.00 54.13 51.49 2f1d s LEU 118 Cb -0.15 -2.59 -0.23 0.00 0.03 0.00 0.00 46.19 43.26 2f1d s LEU 118 CO -0.17 -2.60 0.47 -1.54 0.23 0.00 0.00 176.35 172.73 2f1d n SER 119 N 12.88 0.54 0.00 2.29 3.41 -1.20 -4.97 113.62 126.57 2f1d n SER 119 Ca 0.46 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 59.32 2f1d n SER 119 Cb 0.46 0.40 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 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 1.60 0.92 3.26 5.00 0.00 0.27 -5.04 105.19 111.20 2f1d n GLY 120 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.89 3.21 0.10 1.61 0.52 -1.23 -4.79 118.95 117.48 2f1d s ARG 121 Ca 0.00 -0.75 -0.29 0.00 -0.52 0.00 0.00 55.73 54.17 2f1d s ARG 121 Cb 0.00 -2.62 -0.06 0.00 0.52 0.00 0.00 34.95 32.79 2f1d s ARG 121 CO 0.00 0.02 0.91 -1.25 0.02 0.00 0.00 175.30 175.00 2f1d s PRO 122 N 0.82 4.65 -0.23 3.54 0.04 -1.26 -3.74 135.00 138.82 2f1d s PRO 122 Ca -0.05 1.36 -0.19 0.00 0.04 0.00 0.00 61.00 62.15 2f1d s PRO 122 Cb -0.15 -3.37 0.06 0.00 0.04 0.00 0.00 34.50 31.08 2f1d s PRO 122 CO -0.00 0.24 0.59 -0.47 0.04 0.00 0.00 177.00 177.40 2f1d s TYR 123 N -0.03 -0.70 -0.28 0.56 5.04 -0.24 -4.94 117.35 116.76 2f1d s TYR 123 Ca 0.45 1.64 0.00 0.00 -2.44 0.00 0.00 57.07 56.72 2f1d s TYR 123 Cb -0.23 0.27 0.09 0.00 0.35 0.00 0.00 41.96 42.44 2f1d s TYR 123 CO 0.28 -0.34 0.04 -1.17 -1.34 0.00 0.00 175.55 173.02 2f1d s LEU 124 N 0.55 2.73 -0.42 6.97 2.96 -1.26 -1.03 118.68 129.18 2f1d s LEU 124 Ca -0.02 -1.54 -0.20 0.00 -0.22 0.00 0.00 54.13 52.15 2f1d s LEU 124 Cb -0.05 -1.07 0.02 0.00 0.50 0.00 0.00 46.19 45.59 2f1d s LEU 124 CO -0.03 -0.35 0.58 -0.83 -1.32 0.00 0.00 176.35 174.40 2f1d s GLY 125 N 1.44 1.77 -0.19 7.98 0.00 -0.95 -5.04 107.32 112.34 2f1d s GLY 125 Ca 0.05 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.52 2f1d s GLY 125 CO -0.15 1.41 -0.09 -0.47 0.00 0.00 0.00 173.10 173.80 2f1d s TYR 126 N 2.60 2.22 -0.51 1.90 5.04 -1.26 -1.03 117.35 126.31 2f1d s TYR 126 Ca 0.20 -1.43 0.06 0.00 -2.44 0.00 0.00 57.07 53.46 2f1d s TYR 126 Cb -0.15 -1.56 0.22 0.00 0.35 0.00 0.00 41.96 40.82 2f1d s TYR 126 CO 0.17 -0.70 0.53 0.09 -1.34 0.00 0.00 175.55 174.29 2f1d n ASN 127 N 4.74 1.34 -3.82 4.32 4.13 -0.75 -5.02 115.26 120.19 2f1d n ASN 127 Ca -0.14 -2.88 -0.24 0.00 1.68 0.00 0.00 54.58 53.00 2f1d n ASN 127 Cb 0.47 -0.64 -0.17 0.00 -1.54 0.00 0.00 39.78 37.89 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 -1.24 0.81 -0.41 3.41 2.96 -1.26 -2.31 118.68 120.64 2f1d s LEU 128 Ca 0.34 -0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 54.04 2f1d s LEU 128 Cb 0.10 -0.57 0.09 0.00 0.50 0.00 0.00 46.19 46.31 2f1d s LEU 128 CO -0.12 -0.16 0.21 -1.83 -1.32 0.00 0.00 176.35 173.13 2f1d s GLU 129 N 1.84 2.30 -0.31 1.98 -1.05 -1.26 -5.06 118.70 117.14 2f1d s GLU 129 Ca 0.04 -1.64 -0.21 0.00 -0.15 0.00 0.00 54.97 53.02 2f1d s GLU 129 Cb -0.12 -3.64 -0.01 0.00 -0.44 0.00 0.00 34.13 29.92 2f1d s GLU 129 CO -0.06 -1.00 0.65 0.42 0.95 0.00 0.00 175.26 176.22 2f1d s ILE 130 N 1.27 4.92 -0.91 1.83 1.01 -1.26 -4.98 121.20 123.09 2f1d s ILE 130 Ca 0.05 0.87 0.25 0.00 0.00 0.00 0.00 60.65 61.81 2f1d s ILE 130 Cb -0.23 -4.02 0.22 0.00 0.01 0.00 0.00 42.46 38.44 2f1d s ILE 130 CO -0.01 -0.16 1.78 -0.81 0.00 0.00 0.00 174.94 175.73 2f1d n PRO 131 N 5.92 0.06 -4.12 2.79 -0.04 -1.26 -4.78 135.00 133.58 2f1d n PRO 131 Ca -0.01 0.13 -0.23 0.00 -0.04 0.00 0.00 63.50 63.36 2f1d n PRO 131 Cb 0.49 -1.59 -0.06 0.00 -0.04 0.00 0.00 33.50 32.30 2f1d n PRO 131 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2f1d s THR 132 N -3.05 3.04 -2.89 0.52 -4.23 -1.26 -5.05 115.64 102.73 2f1d s THR 132 Ca 0.11 -1.71 0.24 0.00 -1.18 0.00 0.00 61.69 59.15 2f1d s THR 132 Cb 0.15 -2.97 0.25 0.00 1.34 0.00 0.00 72.50 71.27 2f1d s THR 132 CO 0.47 -0.19 1.32 0.00 -0.54 0.00 0.00 174.62 175.68 2f1d n GLN 133 N -1.13 2.29 -3.62 3.99 6.02 -1.26 -4.76 117.38 118.91 2f1d n GLN 133 Ca -0.03 -1.88 -0.03 0.00 -0.01 0.00 0.00 57.00 55.05 2f1d n GLN 133 Cb 0.61 -1.47 -0.05 0.00 1.02 0.00 0.00 30.24 30.35 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 -1.94 0.57 -0.26 -1.09 0.52 -1.26 -3.21 118.95 112.28 2f1d s ARG 134 Ca 0.30 1.25 -0.09 0.00 -0.52 0.00 0.00 55.73 56.67 2f1d s ARG 134 Cb 0.20 0.56 -0.04 0.00 0.52 0.00 0.00 34.95 36.19 2f1d s ARG 134 CO 0.30 -0.17 0.13 0.14 0.02 0.00 0.00 175.30 175.73 2f1d s VAL 135 N 2.37 4.83 0.00 3.52 -7.23 -1.03 -4.92 120.40 117.94 2f1d s VAL 135 Ca -0.07 0.01 0.00 0.00 -1.81 0.00 0.00 61.98 60.11 2f1d s VAL 135 Cb -0.09 -3.28 0.00 0.00 0.56 0.00 0.00 36.38 33.57 2f1d s VAL 135 CO -0.19 0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 2f1d n GLY 136 N 4.92 3.63 0.45 2.32 0.00 -1.26 -0.57 105.19 114.69 2f1d n GLY 136 Ca -0.15 0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 2.11 -3.70 2.61 -2.24 -1.26 -5.00 114.28 106.80 2f1d n THR 137 Ca 0.00 -2.70 -0.39 0.00 -2.27 0.00 0.00 64.05 58.70 2f1d n THR 137 Cb 0.00 -0.25 -0.12 0.00 -2.10 0.00 0.00 70.33 67.86 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 -3.06 3.22 -0.06 4.78 5.04 0.27 -5.00 117.35 122.53 2f1d s TYR 138 Ca 0.36 -1.09 -0.37 0.00 -2.44 0.00 0.00 57.07 53.53 2f1d s TYR 138 Cb 0.33 -2.33 -0.16 0.00 0.35 0.00 0.00 41.96 40.16 2f1d s TYR 138 CO -0.01 -0.64 1.57 -3.47 -1.34 0.00 0.00 175.55 171.66 2f1d n ASP 139 N 4.90 2.25 0.05 4.32 -0.08 -1.26 -2.46 116.55 124.26 2f1d n ASP 139 Ca -0.13 1.08 0.10 0.00 -1.51 0.00 0.00 54.79 54.34 2f1d n ASP 139 Cb 0.46 -1.21 0.42 0.00 2.34 0.00 0.00 41.12 43.13 2f1d n ASP 139 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2f1d n THR 140 N 3.64 0.75 0.20 5.18 -1.04 -1.20 -2.53 114.28 119.29 2f1d n THR 140 Ca 0.22 0.15 0.09 0.00 -2.04 0.00 0.00 64.05 62.47 2f1d n THR 140 Cb 0.19 -0.93 0.27 0.00 -1.82 0.00 0.00 70.33 68.04 2f1d n THR 140 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 2f1d h GLN 141 N 0.00 0.00 0.00 -2.82 4.20 -1.88 -3.28 115.11 111.32 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 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2f1d h GLN 141 CO 0.00 0.22 0.00 -0.07 -0.67 0.00 0.00 178.83 178.31 2f1d h LEU 142 N 0.00 0.00 -0.15 1.46 4.07 -1.87 -3.08 115.31 115.73 2f1d h LEU 142 Ca -0.00 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 2f1d h LEU 142 Cb 0.98 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.72 2f1d h LEU 142 CO 0.03 0.00 0.08 0.58 -1.08 0.00 0.00 178.44 178.04 2f1d h VAL 143 N 0.00 1.11 -0.30 1.22 2.07 -1.76 -0.12 116.25 118.47 2f1d h VAL 143 Ca 0.00 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 2f1d h VAL 143 Cb 0.54 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 2f1d h VAL 143 CO 0.00 0.10 0.14 -0.08 0.02 0.00 0.00 177.57 177.75 2f1d h GLU 144 N 0.13 0.43 0.00 1.57 4.81 -1.78 -2.55 114.58 117.18 2f1d h GLU 144 Ca 0.05 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2f1d h GLU 144 Cb 0.09 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 2f1d h GLU 144 CO -0.01 0.42 -0.18 1.25 -0.73 0.00 0.00 179.01 179.76 2f1d h HIS 145 N 0.34 0.00 0.07 0.92 2.76 -1.52 0.12 115.15 117.84 2f1d h HIS 145 Ca 0.10 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.27 2f1d h HIS 145 Cb 0.13 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.09 2f1d h HIS 145 CO -0.02 0.18 -0.03 0.35 -1.30 0.00 0.00 177.93 177.11 2f1d h PHE 146 N 0.00 -0.09 0.00 5.26 3.57 -0.81 -2.06 116.94 122.80 2f1d h PHE 146 Ca -0.00 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 2f1d h PHE 146 Cb 0.35 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 2f1d h PHE 146 CO 0.00 0.35 -0.25 0.74 -2.23 0.00 0.00 178.31 176.92 2f1d h PHE 147 N -0.56 0.00 -0.12 0.41 -1.00 -1.15 -1.87 116.94 112.64 2f1d h PHE 147 Ca -0.01 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.59 2f1d h PHE 147 Cb 0.48 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.03 2f1d h PHE 147 CO 0.08 0.25 -0.66 0.37 -1.61 0.00 0.00 178.31 176.73 2f1d h GLN 148 N 0.00 0.49 0.00 1.51 5.75 -0.70 -2.63 115.11 119.53 2f1d h GLN 148 Ca -0.00 -0.36 -0.00 0.00 -0.15 0.00 0.00 58.65 58.14 2f1d h GLN 148 Cb 0.59 0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.21 2f1d h GLN 148 CO 0.03 0.98 -0.00 0.77 -2.65 0.00 0.00 178.83 177.96 2f1d h SER 149 N 0.35 -0.00 -0.64 -0.69 0.02 -1.19 -2.68 113.55 108.71 2f1d h SER 149 Ca -0.02 -0.88 0.19 0.00 -0.84 0.00 0.00 61.79 60.24 2f1d h SER 149 Cb 1.22 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.74 2f1d h SER 149 CO 0.12 0.91 0.70 0.25 -1.14 0.00 0.00 176.83 177.66 2f1d h LEU 150 N -0.95 0.00 0.13 5.07 6.46 -1.33 -1.84 115.31 122.86 2f1d h LEU 150 Ca -0.00 0.00 -0.35 0.00 -0.12 0.00 0.00 57.88 57.41 2f1d h LEU 150 Cb 0.88 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.80 2f1d h LEU 150 CO 0.00 0.00 -1.88 0.58 -0.62 0.00 0.00 178.44 176.52 2f1d h VAL 151 N 0.00 0.75 -0.99 1.05 2.07 -1.43 -3.21 116.25 114.49 2f1d h VAL 151 Ca 0.31 -2.45 0.04 0.00 0.82 0.00 0.00 66.70 65.42 2f1d h VAL 151 Cb 1.70 2.58 -0.06 0.00 -1.52 0.00 0.00 31.29 33.99 2f1d h VAL 151 CO -0.00 0.85 0.65 0.78 0.02 0.00 0.00 177.57 179.86 2f1d h ASN 152 N 0.07 1.07 0.15 0.57 2.35 -0.98 -1.50 115.58 117.31 2f1d h ASN 152 Ca -0.38 -0.01 -0.30 0.00 -0.55 0.00 0.00 56.30 55.06 2f1d h ASN 152 Cb 2.05 -0.24 -0.06 0.00 0.05 0.00 0.00 38.32 40.12 2f1d h ASN 152 CO 0.11 0.72 -2.14 0.35 -1.65 0.00 0.00 177.43 174.83 2f1d n THR 153 N -4.45 1.27 0.24 2.81 -2.24 -1.20 -4.22 114.28 106.49 2f1d n THR 153 Ca 0.14 -0.80 0.08 0.00 -2.27 0.00 0.00 64.05 61.20 2f1d n THR 153 Cb 0.11 -0.54 0.60 0.00 -2.10 0.00 0.00 70.33 68.40 2f1d n THR 153 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2f1d h SER 154 N 0.00 0.00 -5.02 3.42 0.87 -1.55 -3.42 113.55 107.85 2f1d h SER 154 Ca -0.41 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 59.91 2f1d h SER 154 Cb 2.02 0.00 0.15 0.00 -0.44 0.00 0.00 62.40 64.13 2f1d h SER 154 CO 0.04 0.16 -0.67 0.61 -0.53 0.00 0.00 176.83 176.44 2f1d n GLY 155 N -0.87 -0.49 3.29 5.77 0.00 -0.57 -4.81 105.19 107.51 2f1d n GLY 155 Ca -0.02 0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 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 -4.67 1.50 -0.23 1.61 -2.45 -1.17 -0.56 119.30 113.33 2f1d s MET 156 Ca 0.18 -1.04 -0.07 0.00 -1.25 0.00 0.00 55.69 53.50 2f1d s MET 156 Cb -0.02 -1.68 -0.03 0.00 1.25 0.00 0.00 34.83 34.35 2f1d s MET 156 CO 0.61 0.43 0.07 0.99 1.05 0.00 0.00 175.02 178.17 2f1d s THR 157 N -0.85 4.51 -0.15 10.11 2.01 -0.81 -1.08 115.64 129.38 2f1d s THR 157 Ca 0.09 -0.11 -0.04 0.00 0.31 0.00 0.00 61.69 61.94 2f1d s THR 157 Cb -0.09 -3.09 0.07 0.00 0.01 0.00 0.00 72.50 69.40 2f1d s THR 157 CO 0.02 0.37 0.22 -0.22 -0.69 0.00 0.00 174.62 174.33 2f1d s LEU 158 N 1.24 -0.18 -0.15 4.42 2.96 -0.20 -1.23 118.68 125.55 2f1d s LEU 158 Ca 0.05 0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 54.12 2f1d s LEU 158 Cb -0.14 0.48 -0.03 0.00 0.50 0.00 0.00 46.19 47.00 2f1d s LEU 158 CO 0.04 -0.28 -0.02 -1.00 -1.32 0.00 0.00 176.35 173.77 2f1d s HIS 159 N 2.36 3.07 -0.28 5.38 3.76 -0.43 -2.24 115.29 126.91 2f1d s HIS 159 Ca 0.04 -0.17 0.02 0.00 -0.15 0.00 0.00 55.06 54.80 2f1d s HIS 159 Cb -0.14 -1.94 0.08 0.00 1.11 0.00 0.00 32.58 31.69 2f1d s HIS 159 CO -0.09 0.07 -0.01 0.42 -0.85 0.00 0.00 174.74 174.27 2f1d s ILE 160 N 0.16 1.78 -0.20 0.60 1.01 -0.20 -2.31 121.20 122.05 2f1d s ILE 160 Ca -0.00 -1.65 -0.05 0.00 0.00 0.00 0.00 60.65 58.94 2f1d s ILE 160 Cb -0.13 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.18 2f1d s ILE 160 CO 0.02 -0.31 0.00 -0.13 0.00 0.00 0.00 174.94 174.53 2f1d s ARG 161 N 1.23 3.64 -0.15 2.79 0.52 -0.21 -1.82 118.95 124.95 2f1d s ARG 161 Ca 0.00 -0.51 -0.25 0.00 -0.52 0.00 0.00 55.73 54.46 2f1d s ARG 161 Cb -0.19 -3.08 -0.02 0.00 0.52 0.00 0.00 34.95 32.18 2f1d s ARG 161 CO -0.09 0.04 0.79 -1.14 0.02 0.00 0.00 175.30 174.92 2f1d s GLN 162 N 0.94 4.32 -0.04 3.54 0.74 -0.98 -0.75 119.66 127.44 2f1d s GLN 162 Ca 0.01 0.96 0.17 0.00 0.05 0.00 0.00 55.36 56.56 2f1d s GLN 162 Cb -0.14 -3.55 -0.27 0.00 1.10 0.00 0.00 33.01 30.15 2f1d s GLN 162 CO 0.02 -0.25 0.36 1.28 -0.55 0.00 0.00 175.29 176.15 2f1d n LEU 163 N 4.94 0.00 -3.58 3.68 4.77 0.03 -4.99 117.00 121.86 2f1d n LEU 163 Ca 0.03 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.93 2f1d n LEU 163 Cb 0.49 0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 2f1d n LEU 163 CO 0.48 0.03 0.59 0.00 -1.33 0.00 0.00 177.39 177.16 2f1d s ALA 164 N -3.15 -1.65 0.00 -1.18 0.00 -1.14 -4.91 121.76 109.72 2f1d s ALA 164 Ca -0.07 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.41 2f1d s ALA 164 Cb 0.11 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.87 2f1d s ALA 164 CO 0.73 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 176.07 2f1d n GLY 165 N -0.36 4.11 0.83 0.00 0.00 -1.24 -2.66 105.19 105.87 2f1d n GLY 165 Ca -0.10 -0.50 -0.03 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.52 0.12 -2.16 1.61 1.02 -1.26 -4.99 120.64 114.46 2f1d n GLU 166 Ca 0.00 0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.77 2f1d n GLU 166 Cb 0.00 -0.72 -0.03 0.00 -0.02 0.00 0.00 31.44 30.68 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 -5.93 6.81 0.03 1.62 3.84 -1.26 -4.69 114.94 115.36 2f1d s ASN 167 Ca -0.07 2.29 -0.25 0.00 0.21 0.00 0.00 52.86 55.04 2f1d s ASN 167 Cb 0.01 -2.58 -0.17 0.00 -0.55 0.00 0.00 41.25 37.96 2f1d s ASN 167 CO 0.10 -0.69 1.43 0.28 -2.79 0.00 0.00 177.10 175.43 2f1d h SER 168 N 7.18 -0.14 -0.71 -4.21 0.02 -1.99 -1.95 113.55 111.76 2f1d h SER 168 Ca -0.41 -0.22 0.14 0.00 -0.84 0.00 0.00 61.79 60.46 2f1d h SER 168 Cb 1.20 0.04 -0.13 0.00 0.14 0.00 0.00 62.40 63.64 2f1d h SER 168 CO 0.88 0.14 -0.22 -0.74 -1.14 0.00 0.00 176.83 175.75 2f1d h HIS 169 N -0.42 -0.52 -0.65 3.45 6.17 -1.97 -0.80 115.15 120.41 2f1d h HIS 169 Ca -0.02 0.07 0.03 0.00 0.71 0.00 0.00 60.37 61.16 2f1d h HIS 169 Cb 0.34 0.34 -0.04 0.00 2.52 0.00 0.00 27.41 30.57 2f1d h HIS 169 CO 0.01 -0.33 0.40 0.45 0.71 0.00 0.00 177.93 179.17 2f1d h HIS 170 N -0.04 0.76 -0.03 5.26 3.86 -1.87 -1.65 115.15 121.45 2f1d h HIS 170 Ca 0.33 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.56 2f1d h HIS 170 Cb 0.54 -0.25 -0.00 0.00 1.06 0.00 0.00 27.41 28.76 2f1d h HIS 170 CO -0.60 0.44 0.01 0.82 0.86 0.00 0.00 177.93 179.46 2f1d h ILE 171 N 0.80 1.09 -0.28 2.45 2.04 -0.37 -0.16 117.51 123.08 2f1d h ILE 171 Ca 0.26 -0.26 -0.14 0.00 1.00 0.00 0.00 64.86 65.72 2f1d h ILE 171 Cb 0.01 1.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2f1d h ILE 171 CO -0.10 0.07 -0.37 0.40 0.00 0.00 0.00 178.15 178.15 2f1d h ILE 172 N -0.06 1.30 -0.05 -0.67 2.04 -1.33 -1.53 117.51 117.21 2f1d h ILE 172 Ca 0.01 -1.55 -0.07 0.00 1.00 0.00 0.00 64.86 64.24 2f1d h ILE 172 Cb 0.10 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2f1d h ILE 172 CO -0.00 0.50 -0.31 -0.08 0.00 0.00 0.00 178.15 178.26 2f1d h GLU 173 N 0.48 0.09 -0.11 2.37 4.81 -1.21 -1.00 114.58 120.02 2f1d h GLU 173 Ca 0.03 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.07 2f1d h GLU 173 Cb 0.96 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 2f1d h GLU 173 CO 0.09 0.40 -0.62 0.00 -0.73 0.00 0.00 179.01 178.14 2f1d h ALA 174 N 1.61 0.73 -0.58 2.92 0.00 -0.91 -1.31 119.26 121.71 2f1d h ALA 174 Ca 0.01 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 2f1d h ALA 174 Cb 0.59 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2f1d h ALA 174 CO 0.04 0.72 0.15 1.15 0.00 0.00 0.00 179.25 181.31 2f1d h THR 175 N 0.28 1.25 0.00 0.00 2.02 -0.37 -2.02 112.91 114.07 2f1d h THR 175 Ca -0.01 -0.88 -0.09 0.00 0.77 0.00 0.00 66.41 66.20 2f1d h THR 175 Cb 1.15 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.26 2f1d h THR 175 CO 0.11 0.33 -0.43 -0.26 0.37 0.00 0.00 175.52 175.63 2f1d h PHE 176 N 0.84 0.00 -0.06 3.16 -1.00 -1.13 0.31 116.94 119.06 2f1d h PHE 176 Ca 0.18 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.83 2f1d h PHE 176 Cb 0.34 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.91 2f1d h PHE 176 CO 0.02 0.43 -0.48 0.87 -1.61 0.00 0.00 178.31 177.54 2f1d h LYS 177 N 0.00 0.43 -0.04 1.51 1.57 -1.09 -2.49 116.57 116.46 2f1d h LYS 177 Ca -0.00 -0.38 -0.17 0.00 -1.87 0.00 0.00 60.65 58.22 2f1d h LYS 177 Cb 0.99 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 2f1d h LYS 177 CO 0.06 1.03 -0.73 0.00 -0.57 0.00 0.00 179.45 179.24 2f1d h ALA 178 N 0.40 0.70 -0.36 3.86 0.00 -1.33 -2.36 119.26 120.17 2f1d h ALA 178 Ca -0.04 -0.63 -0.03 0.00 0.00 0.00 0.00 54.91 54.21 2f1d h ALA 178 Cb 1.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2f1d h ALA 178 CO 0.10 0.81 0.11 0.35 0.00 0.00 0.00 179.25 180.62 2f1d h PHE 179 N 0.15 0.57 0.10 0.00 3.57 -1.00 -2.65 116.94 117.68 2f1d h PHE 179 Ca -0.02 -0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.42 2f1d h PHE 179 Cb 1.29 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.86 2f1d h PHE 179 CO 0.02 0.56 -0.05 0.00 -2.23 0.00 0.00 178.31 176.61 2f1d h ALA 180 N 0.95 -0.14 0.00 2.41 0.00 -1.37 -1.01 119.26 120.11 2f1d h ALA 180 Ca 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2f1d h ALA 180 Cb 0.25 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2f1d h ALA 180 CO -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 179.25 178.66 2f1d h ARG 181 N -0.15 0.00 0.02 0.00 3.08 -1.43 -1.89 114.38 114.02 2f1d h ARG 181 Ca -0.01 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.74 2f1d h ARG 181 Cb 0.12 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 2f1d h ARG 181 CO 0.02 0.00 -1.72 0.00 -1.07 0.00 0.00 179.97 177.20 2f1d h ALA 182 N 2.00 0.70 -0.51 0.04 0.00 -1.27 -3.20 119.26 117.02 2f1d h ALA 182 Ca 0.00 -1.43 -0.12 0.00 0.00 0.00 0.00 54.91 53.36 2f1d h ALA 182 Cb 0.50 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2f1d h ALA 182 CO 0.00 1.53 -0.16 1.25 0.00 0.00 0.00 179.25 181.87 2f1d h LEU 183 N 0.01 1.02 -0.49 0.00 6.46 -0.96 -2.76 115.31 118.59 2f1d h LEU 183 Ca -0.29 -0.36 0.07 0.00 -0.12 0.00 0.00 57.88 57.18 2f1d h LEU 183 Cb 2.01 -0.28 -0.06 0.00 -0.73 0.00 0.00 40.66 41.60 2f1d h LEU 183 CO 0.08 1.15 0.15 -0.09 -0.62 0.00 0.00 178.44 179.11 2f1d h ARG 184 N 0.88 0.30 -0.19 1.25 2.43 -1.47 -1.78 114.38 115.80 2f1d h ARG 184 Ca 0.13 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.21 2f1d h ARG 184 Cb 0.73 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 2f1d h ARG 184 CO 0.06 0.20 -0.18 0.37 -1.51 0.00 0.00 179.97 178.90 2f1d h GLN 185 N 0.31 0.32 0.00 0.20 4.15 -1.50 -0.91 115.11 117.67 2f1d h GLN 185 Ca 0.24 -0.09 -0.17 0.00 0.77 0.00 0.00 58.65 59.39 2f1d h GLN 185 Cb 0.27 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.90 2f1d h GLN 185 CO -0.27 0.50 -1.23 0.00 -1.93 0.00 0.00 178.83 175.90 2f1d h ALA 186 N 1.52 0.65 0.00 3.38 0.00 -1.21 -3.32 119.26 120.28 2f1d h ALA 186 Ca 0.05 -0.85 -0.03 0.00 0.00 0.00 0.00 54.91 54.08 2f1d h ALA 186 Cb 0.50 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2f1d h ALA 186 CO 0.03 0.97 -1.14 0.25 0.00 0.00 0.00 179.25 179.37 2f1d n THR 187 N -3.02 0.69 -0.86 0.00 -2.24 -0.70 -1.67 114.28 106.49 2f1d n THR 187 Ca -0.07 -0.57 -0.29 0.00 -2.27 0.00 0.00 64.05 60.84 2f1d n THR 187 Cb 0.85 -0.39 0.19 0.00 -2.10 0.00 0.00 70.33 68.88 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 -3.29 0.39 0.04 -0.78 2.02 -0.36 -4.79 118.70 111.92 2f1d s GLU 188 Ca -0.01 0.98 -0.10 0.00 0.02 0.00 0.00 54.97 55.86 2f1d s GLU 188 Cb 0.10 -1.70 -0.05 0.00 0.10 0.00 0.00 34.13 32.58 2f1d s GLU 188 CO 0.80 -2.88 0.36 0.95 0.02 0.00 0.00 175.26 174.51 2f1d s THR 189 N -2.70 5.15 -0.20 3.63 -4.23 -1.26 -2.31 115.64 113.71 2f1d s THR 189 Ca 0.66 0.44 -0.09 0.00 -1.18 0.00 0.00 61.69 61.52 2f1d s THR 189 Cb -0.22 -3.63 -0.05 0.00 1.34 0.00 0.00 72.50 69.95 2f1d s THR 189 CO 0.60 0.37 0.11 -0.62 -0.54 0.00 0.00 174.62 174.54 2f1d s ASP 190 N -1.59 5.92 -0.89 3.99 2.15 -0.88 -4.83 116.67 120.54 2f1d s ASP 190 Ca 0.29 0.13 -0.25 0.00 0.43 0.00 0.00 52.55 53.15 2f1d s ASP 190 Cb -0.14 -2.04 -0.11 0.00 -0.30 0.00 0.00 42.92 40.33 2f1d s ASP 190 CO 0.16 0.15 2.18 -2.84 -0.17 0.00 0.00 175.17 174.65 2f1d s PRO 191 N 0.55 1.95 0.00 4.34 0.02 -1.26 -4.90 135.00 135.70 2f1d s PRO 191 Ca 0.06 -0.01 0.24 0.00 0.02 0.00 0.00 61.00 61.31 2f1d s PRO 191 Cb -0.12 -4.94 0.19 0.00 0.02 0.00 0.00 34.50 29.65 2f1d s PRO 191 CO 0.00 -4.17 1.25 0.54 -0.33 0.00 0.00 177.00 174.30