#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 3.93 -0.15 1.61 0.52 -1.26 -5.01 118.95 118.59 2f1d s ARG 11 Ca 0.00 -0.33 0.01 0.00 -0.52 0.00 0.00 55.73 54.89 2f1d s ARG 11 Cb 0.00 -3.59 0.02 0.00 0.52 0.00 0.00 34.95 31.90 2f1d s ARG 11 CO 0.00 -0.14 -0.17 0.42 0.02 0.00 0.00 175.30 175.42 2f1d s ILE 12 N 1.63 1.78 0.03 1.52 1.01 -1.26 -1.72 121.20 124.18 2f1d s ILE 12 Ca 0.07 -0.78 -0.12 0.00 0.00 0.00 0.00 60.65 59.82 2f1d s ILE 12 Cb -0.15 -1.62 -0.06 0.00 0.01 0.00 0.00 42.46 40.64 2f1d s ILE 12 CO 0.09 0.49 0.38 -0.83 0.00 0.00 0.00 174.94 175.08 2f1d s GLY 13 N 1.19 2.39 -0.03 6.18 0.00 -0.32 -4.40 107.32 112.34 2f1d s GLY 13 Ca -0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 44.72 44.39 2f1d s GLY 13 CO -0.07 -0.04 0.02 1.85 0.00 0.00 0.00 173.10 174.86 2f1d s GLU 14 N -1.48 0.09 -0.17 2.90 2.12 -1.26 -2.07 118.70 118.84 2f1d s GLU 14 Ca 0.28 0.18 -0.04 0.00 0.36 0.00 0.00 54.97 55.74 2f1d s GLU 14 Cb -0.15 -0.39 0.08 0.00 0.26 0.00 0.00 34.13 33.93 2f1d s GLU 14 CO 0.15 -0.19 0.21 0.08 -0.54 0.00 0.00 175.26 174.98 2f1d s VAL 15 N 1.25 -0.32 -0.20 3.70 1.01 -0.59 -4.88 120.40 120.37 2f1d s VAL 15 Ca -0.07 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.90 2f1d s VAL 15 Cb -0.13 -0.57 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 2f1d s VAL 15 CO -0.03 -0.10 -0.05 -0.54 0.00 0.00 0.00 175.10 174.39 2f1d s LYS 16 N 2.33 3.44 -0.01 2.72 1.02 -1.26 -0.96 119.74 127.02 2f1d s LYS 16 Ca 0.05 -0.61 0.02 0.00 0.02 0.00 0.00 55.97 55.45 2f1d s LYS 16 Cb -0.15 -2.96 0.00 0.00 -0.52 0.00 0.00 37.83 34.21 2f1d s LYS 16 CO -0.10 -0.06 -0.05 0.50 -0.92 0.00 0.00 175.35 174.71 2f1d s ARG 17 N 1.14 0.52 -0.29 1.68 3.52 -0.74 -5.02 118.95 119.76 2f1d s ARG 17 Ca 0.02 -0.17 -0.02 0.00 -0.13 0.00 0.00 55.73 55.42 2f1d s ARG 17 Cb -0.15 -0.53 0.10 0.00 -1.56 0.00 0.00 34.95 32.81 2f1d s ARG 17 CO -0.01 0.07 0.10 0.08 -0.81 0.00 0.00 175.30 174.74 2f1d s VAL 18 N 0.12 0.52 0.77 7.11 1.01 -1.26 -1.70 120.40 126.97 2f1d s VAL 18 Ca -0.01 -1.09 -0.09 0.00 0.00 0.00 0.00 61.98 60.78 2f1d s VAL 18 Cb -0.05 -1.37 0.17 0.00 0.00 0.00 0.00 36.38 35.13 2f1d s VAL 18 CO -0.00 -0.64 1.04 0.35 0.00 0.00 0.00 175.10 175.85 2f1d n THR 19 N 5.00 0.00 -0.32 3.92 -2.24 -0.22 -4.95 114.28 115.47 2f1d n THR 19 Ca -0.04 -1.02 0.05 0.00 -2.27 0.00 0.00 64.05 60.78 2f1d n THR 19 Cb 0.43 -1.37 0.21 0.00 -2.10 0.00 0.00 70.33 67.50 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 0.83 0.08 -0.78 -0.00 -2.03 -3.32 116.57 111.35 2f1d h LYS 20 Ca -0.34 -0.05 -0.32 0.00 -0.00 0.00 0.00 60.65 59.94 2f1d h LYS 20 Cb 1.03 -0.19 -0.03 0.00 -0.00 0.00 0.00 32.23 33.05 2f1d h LYS 20 CO 0.28 0.55 -1.77 0.93 -0.00 0.00 0.00 179.45 179.43 2f1d h GLU 21 N 0.85 0.17 -4.99 0.07 5.08 -1.96 -3.49 114.58 110.31 2f1d h GLU 21 Ca 0.45 -0.29 -0.31 0.00 -1.00 0.00 0.00 59.36 58.21 2f1d h GLU 21 Cb 0.46 0.11 -0.15 0.00 0.50 0.00 0.00 28.75 29.67 2f1d h GLU 21 CO -0.27 0.94 -0.71 0.95 -1.00 0.00 0.00 179.01 178.92 2f1d s THR 22 N -2.59 1.08 -0.33 1.13 -4.23 -1.25 -3.40 115.64 106.06 2f1d s THR 22 Ca -0.13 -2.03 -0.01 0.00 -1.18 0.00 0.00 61.69 58.34 2f1d s THR 22 Cb 0.07 -1.81 0.11 0.00 1.34 0.00 0.00 72.50 72.20 2f1d s THR 22 CO 0.81 -0.77 0.12 0.21 -0.54 0.00 0.00 174.62 174.45 2f1d s ASN 23 N -3.14 3.93 -0.05 3.99 3.84 -0.55 -1.06 114.94 121.91 2f1d s ASN 23 Ca 0.16 -1.76 -0.00 0.00 0.21 0.00 0.00 52.86 51.47 2f1d s ASN 23 Cb 0.03 -0.85 -0.03 0.00 -0.55 0.00 0.00 41.25 39.85 2f1d s ASN 23 CO -0.00 -0.40 -0.00 -0.69 -2.79 0.00 0.00 177.10 173.22 2f1d s VAL 24 N 1.48 4.21 -0.01 -5.21 1.01 -0.69 -2.63 120.40 118.55 2f1d s VAL 24 Ca 0.11 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.68 2f1d s VAL 24 Cb -0.18 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.40 2f1d s VAL 24 CO -0.22 0.51 0.00 -0.55 0.00 0.00 0.00 175.10 174.84 2f1d s SER 25 N -1.16 0.18 -0.04 3.32 0.15 -0.58 -1.79 113.70 113.79 2f1d s SER 25 Ca 0.16 -0.01 -0.12 0.00 0.70 0.00 0.00 55.95 56.68 2f1d s SER 25 Cb -0.11 -0.07 0.02 0.00 -1.71 0.00 0.00 66.02 64.14 2f1d s SER 25 CO 0.06 -0.05 0.26 -0.69 1.20 0.00 0.00 173.24 174.02 2f1d s VAL 26 N 0.48 0.05 -0.25 4.45 1.01 -0.13 -2.11 120.40 123.91 2f1d s VAL 26 Ca -0.04 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 2f1d s VAL 26 Cb -0.07 -0.52 0.13 0.00 0.00 0.00 0.00 36.38 35.92 2f1d s VAL 26 CO -0.01 -0.22 0.32 -0.54 0.00 0.00 0.00 175.10 174.65 2f1d s LYS 27 N -0.94 0.31 0.08 2.72 1.02 -0.64 -1.54 119.74 120.74 2f1d s LYS 27 Ca -0.10 0.23 0.03 0.00 0.02 0.00 0.00 55.97 56.15 2f1d s LYS 27 Cb -0.05 -0.71 -0.04 0.00 -0.52 0.00 0.00 37.83 36.51 2f1d s LYS 27 CO 0.03 -0.78 0.10 0.42 -0.92 0.00 0.00 175.35 174.20 2f1d s ILE 28 N 2.44 4.67 -0.28 2.17 1.01 -0.88 -1.79 121.20 128.54 2f1d s ILE 28 Ca 0.10 -0.72 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 2f1d s ILE 28 Cb -0.15 -3.26 0.09 0.00 0.01 0.00 0.00 42.46 39.15 2f1d s ILE 28 CO -0.20 0.12 0.08 0.21 0.00 0.00 0.00 174.94 175.15 2f1d s ASN 29 N -2.44 3.67 0.30 3.58 3.84 -0.93 -1.17 114.94 121.79 2f1d s ASN 29 Ca 0.30 -1.37 0.02 0.00 0.21 0.00 0.00 52.86 52.02 2f1d s ASN 29 Cb -0.12 -0.72 0.57 0.00 -0.55 0.00 0.00 41.25 40.43 2f1d s ASN 29 CO 0.23 -0.39 1.88 -0.07 -2.79 0.00 0.00 177.10 175.96 2f1d h LEU 30 N 8.17 0.88 -3.91 3.21 3.38 -1.68 -2.51 115.31 122.86 2f1d h LEU 30 Ca -0.15 0.02 -0.61 0.00 0.09 0.00 0.00 57.88 57.23 2f1d h LEU 30 Cb 1.04 -0.16 -0.27 0.00 0.09 0.00 0.00 40.66 41.36 2f1d h LEU 30 CO 0.43 0.52 0.79 0.47 0.09 0.00 0.00 178.44 180.75 2f1d n ASP 31 N -4.54 7.24 -3.05 -0.43 8.00 -1.26 -4.69 116.55 117.81 2f1d n ASP 31 Ca 0.16 -3.66 0.00 0.00 0.71 0.00 0.00 54.79 52.00 2f1d n ASP 31 Cb 0.28 -0.98 0.00 0.00 -0.02 0.00 0.00 41.12 40.40 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 -0.74 0.15 0.00 0.44 0.00 -0.96 -4.93 105.19 99.15 2f1d n GLY 32 Ca 0.58 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 45.08 2f1d n GLY 32 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2f1d n THR 33 N -0.02 0.00 0.00 2.61 5.66 -1.16 -4.84 114.28 116.53 2f1d n THR 33 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2f1d n THR 33 Cb 0.00 0.02 0.00 0.00 -1.55 0.00 0.00 70.33 68.80 2f1d n THR 33 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2f1d n GLY 34 N 0.18 0.61 3.45 1.09 0.00 -1.24 -4.87 105.19 104.41 2f1d n GLY 34 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.61 4.62 -0.24 1.61 1.01 -1.16 -4.43 120.40 121.20 2f1d s VAL 35 Ca 0.00 -1.27 -0.29 0.00 0.00 0.00 0.00 61.98 60.42 2f1d s VAL 35 Cb 0.00 -4.75 -0.02 0.00 0.00 0.00 0.00 36.38 31.61 2f1d s VAL 35 CO 0.00 -1.49 1.50 0.00 0.00 0.00 0.00 175.10 175.11 2f1d s ALA 36 N 3.04 3.32 -0.44 5.51 0.00 -1.26 -2.61 121.76 129.32 2f1d s ALA 36 Ca 0.30 0.36 0.06 0.00 0.00 0.00 0.00 51.96 52.68 2f1d s ALA 36 Cb -0.08 -3.82 0.22 0.00 0.00 0.00 0.00 23.12 19.44 2f1d s ALA 36 CO -0.05 -1.85 0.59 -3.47 0.00 0.00 0.00 175.76 170.98 2f1d n ASP 37 N 8.08 -1.27 -3.89 0.00 4.64 -1.07 -5.03 116.55 118.01 2f1d n ASP 37 Ca 0.17 -2.78 -0.27 0.00 -1.38 0.00 0.00 54.79 50.54 2f1d n ASP 37 Cb 0.46 0.31 -0.17 0.00 -1.04 0.00 0.00 41.12 40.68 2f1d n ASP 37 CO 0.00 0.00 0.00 -0.44 -0.82 0.00 0.00 177.20 175.94 2f1d s SER 38 N -0.63 2.22 -0.15 1.67 0.01 -1.26 -2.37 113.70 113.19 2f1d s SER 38 Ca 0.33 -0.34 0.02 0.00 1.31 0.00 0.00 55.95 57.27 2f1d s SER 38 Cb 0.12 -0.81 0.01 0.00 0.21 0.00 0.00 66.02 65.56 2f1d s SER 38 CO -0.15 -0.14 -0.19 -0.55 0.41 0.00 0.00 173.24 172.61 2f1d s SER 39 N 1.73 2.95 0.00 2.44 0.15 -0.85 -4.86 113.70 115.25 2f1d s SER 39 Ca 0.04 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 56.12 2f1d s SER 39 Cb -0.13 -1.36 0.00 0.00 -1.71 0.00 0.00 66.02 62.82 2f1d s SER 39 CO -0.08 0.03 0.00 -1.54 1.20 0.00 0.00 173.24 172.85 2f1d n SER 40 N 4.31 2.78 0.00 5.45 3.41 -1.26 -2.65 113.62 125.66 2f1d n SER 40 Ca -0.20 -0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.27 2f1d n SER 40 Cb 0.51 0.83 0.00 0.00 -0.26 0.00 0.00 64.21 65.29 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 1.67 0.71 2.78 5.00 0.00 -1.26 -4.45 105.19 109.63 2f1d n GLY 41 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.77 1.69 0.27 -0.61 1.01 -1.26 -5.03 121.20 114.49 2f1d s ILE 42 Ca 0.00 -2.66 -0.02 0.00 0.00 0.00 0.00 60.65 57.96 2f1d s ILE 42 Cb 0.00 -2.19 0.27 0.00 0.01 0.00 0.00 42.46 40.55 2f1d s ILE 42 CO 0.00 -0.85 1.89 -0.65 0.00 0.00 0.00 174.94 175.33 2f1d h PRO 43 N 6.79 1.16 -0.56 2.79 0.11 -2.00 -1.23 132.00 139.05 2f1d h PRO 43 Ca -0.04 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 65.98 2f1d h PRO 43 Cb 0.93 -0.26 -0.03 0.00 0.11 0.00 0.00 31.00 31.75 2f1d h PRO 43 CO 0.53 0.76 0.24 0.35 -0.21 0.00 0.00 178.00 179.68 2f1d h PHE 44 N 1.19 0.84 -0.12 0.65 3.57 -1.96 -2.03 116.94 119.07 2f1d h PHE 44 Ca 0.43 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.83 2f1d h PHE 44 Cb 0.15 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 2f1d h PHE 44 CO -0.00 0.66 -0.13 1.25 -2.23 0.00 0.00 178.31 177.86 2f1d h LEU 45 N 0.77 0.18 -0.65 0.59 5.85 -1.67 -1.09 115.31 119.28 2f1d h LEU 45 Ca 0.19 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.76 2f1d h LEU 45 Cb 0.17 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2f1d h LEU 45 CO -0.02 0.33 -0.16 0.44 -0.34 0.00 0.00 178.44 178.69 2f1d h ASP 46 N 0.18 0.89 0.04 1.25 3.32 -1.16 0.12 116.42 121.06 2f1d h ASP 46 Ca 0.04 -0.30 -0.05 0.00 0.02 0.00 0.00 57.03 56.74 2f1d h ASP 46 Cb 0.35 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2f1d h ASP 46 CO 0.02 1.04 -0.13 -0.74 -1.72 0.00 0.00 179.24 177.71 2f1d h HIS 47 N 0.78 0.22 0.16 4.55 2.76 -0.52 0.04 115.15 123.14 2f1d h HIS 47 Ca 0.12 -0.02 -0.30 0.00 -2.20 0.00 0.00 60.37 57.96 2f1d h HIS 47 Cb 0.69 -0.06 0.02 0.00 1.55 0.00 0.00 27.41 29.61 2f1d h HIS 47 CO 0.04 0.34 -1.30 0.52 -1.30 0.00 0.00 177.93 176.24 2f1d h MET 48 N 0.20 0.50 0.00 5.26 2.86 -0.92 -3.04 114.93 119.79 2f1d h MET 48 Ca 0.04 -0.75 -0.06 0.00 -2.06 0.00 0.00 59.70 56.87 2f1d h MET 48 Cb 0.36 0.26 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 2f1d h MET 48 CO 0.02 1.34 -0.31 -0.07 1.06 0.00 0.00 176.91 178.96 2f1d h LEU 49 N 0.19 0.00 -0.67 1.22 3.38 -0.51 -1.74 115.31 117.18 2f1d h LEU 49 Ca -0.19 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.64 2f1d h LEU 49 Cb 1.98 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.72 2f1d h LEU 49 CO 0.24 0.31 -0.56 0.44 0.09 0.00 0.00 178.44 178.96 2f1d h ASP 50 N 0.00 0.35 0.70 -0.43 3.32 -1.02 -2.60 116.42 116.74 2f1d h ASP 50 Ca -0.00 -0.19 -0.11 0.00 0.02 0.00 0.00 57.03 56.75 2f1d h ASP 50 Cb 0.63 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 2f1d h ASP 50 CO 0.04 0.84 -0.51 1.56 -1.72 0.00 0.00 179.24 179.44 2f1d h GLN 51 N 0.24 0.00 -0.14 3.56 1.08 -1.34 -1.88 115.11 116.64 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 1.05 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.48 2f1d h GLN 51 CO 0.09 0.51 -0.09 1.25 -0.95 0.00 0.00 178.83 179.65 2f1d h LEU 52 N 0.00 0.31 -0.59 1.46 5.85 -1.07 -2.31 115.31 118.96 2f1d h LEU 52 Ca -0.01 -0.44 -0.11 0.00 0.84 0.00 0.00 57.88 58.17 2f1d h LEU 52 Cb 1.00 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 2f1d h LEU 52 CO 0.07 0.68 -0.07 0.00 -0.34 0.00 0.00 178.44 178.78 2f1d h ALA 53 N 0.64 0.79 -0.18 1.25 0.00 -1.47 -2.74 119.26 117.55 2f1d h ALA 53 Ca 0.03 -0.34 -0.21 0.00 0.00 0.00 0.00 54.91 54.39 2f1d h ALA 53 Cb 0.58 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.16 2f1d h ALA 53 CO 0.02 0.67 -0.72 1.03 0.00 0.00 0.00 179.25 180.26 2f1d h SER 54 N 0.95 0.93 0.46 0.00 0.87 -1.33 -1.07 113.55 114.36 2f1d h SER 54 Ca 0.15 -0.58 -0.30 0.00 -1.23 0.00 0.00 61.79 59.84 2f1d h SER 54 Cb 0.63 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 62.28 2f1d h SER 54 CO 0.04 1.38 -1.70 0.45 -0.53 0.00 0.00 176.83 176.47 2f1d h HIS 55 N 0.56 0.10 0.00 2.24 -0.00 -1.52 -3.34 115.15 113.19 2f1d h HIS 55 Ca -0.04 -0.07 0.00 0.00 -0.00 0.00 0.00 60.37 60.26 2f1d h HIS 55 Cb 1.34 -0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.75 2f1d h HIS 55 CO 0.08 1.14 -0.49 0.41 -0.00 0.00 0.00 177.93 179.07 2f1d n GLY 56 N 1.61 -1.30 3.81 2.45 0.00 -1.03 -4.43 105.19 106.30 2f1d n GLY 56 Ca -0.18 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.61 -2.65 -4.90 0.99 4.77 -0.46 -4.73 117.00 108.42 2f1d n LEU 57 Ca 0.05 -0.71 -0.29 0.00 -0.03 0.00 0.00 56.01 55.04 2f1d n LEU 57 Cb 0.35 -2.63 -0.03 0.00 -2.33 0.00 0.00 43.42 38.78 2f1d n LEU 57 CO 0.35 0.48 0.31 -0.36 -1.33 0.00 0.00 177.39 176.83 2f1d s PHE 58 N -3.28 3.49 -0.45 -1.77 2.99 -0.86 -2.99 117.98 115.11 2f1d s PHE 58 Ca 0.64 0.76 -0.17 0.00 0.00 0.00 0.00 56.93 58.16 2f1d s PHE 58 Cb -0.31 -2.22 0.04 0.00 0.00 0.00 0.00 43.02 40.53 2f1d s PHE 58 CO 0.78 0.02 0.48 -0.51 -0.00 0.00 0.00 175.22 176.00 2f1d s ASP 59 N -3.35 6.19 -0.16 1.36 1.01 -1.13 -3.01 116.67 117.58 2f1d s ASP 59 Ca 0.46 -0.88 -0.07 0.00 0.71 0.00 0.00 52.55 52.77 2f1d s ASP 59 Cb -0.10 -2.23 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 2f1d s ASP 59 CO 0.33 -0.68 0.07 -0.69 0.21 0.00 0.00 175.17 174.41 2f1d s VAL 60 N 2.16 4.88 -0.10 -1.27 1.01 -1.07 -2.19 120.40 123.82 2f1d s VAL 60 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 61.98 62.08 2f1d s VAL 60 Cb -0.19 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 33.04 2f1d s VAL 60 CO 0.12 0.50 -0.06 -2.28 0.00 0.00 0.00 175.10 173.37 2f1d s HIS 61 N 0.02 1.26 -0.01 5.22 2.46 -0.74 -2.60 115.29 120.90 2f1d s HIS 61 Ca 0.06 -0.57 0.01 0.00 0.47 0.00 0.00 55.06 55.03 2f1d s HIS 61 Cb -0.12 -1.09 0.01 0.00 -0.13 0.00 0.00 32.58 31.25 2f1d s HIS 61 CO 0.01 -0.43 -0.01 0.08 -2.47 0.00 0.00 174.74 171.91 2f1d s VAL 62 N 1.61 0.18 -0.12 0.89 1.01 -1.00 -1.62 120.40 121.35 2f1d s VAL 62 Ca 0.02 -0.02 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 2f1d s VAL 62 Cb -0.13 -0.20 0.06 0.00 0.00 0.00 0.00 36.38 36.11 2f1d s VAL 62 CO -0.06 0.09 0.22 -0.60 0.00 0.00 0.00 175.10 174.76 2f1d s ARG 63 N 0.39 0.11 0.04 2.72 6.06 -0.90 -2.01 118.95 125.36 2f1d s ARG 63 Ca -0.04 0.67 -0.06 0.00 -2.50 0.00 0.00 55.73 53.80 2f1d s ARG 63 Cb -0.06 -0.15 -0.01 0.00 0.06 0.00 0.00 34.95 34.79 2f1d s ARG 63 CO -0.01 -0.30 0.11 0.00 -2.50 0.00 0.00 175.30 172.60 2f1d s ALA 64 N 2.37 -0.12 -0.03 6.12 0.00 -1.08 -1.53 121.76 127.48 2f1d s ALA 64 Ca 0.02 -0.49 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 2f1d s ALA 64 Cb -0.12 0.25 0.01 0.00 0.00 0.00 0.00 23.12 23.25 2f1d s ALA 64 CO -0.08 -0.32 0.10 0.99 0.00 0.00 0.00 175.76 176.45 2f1d s THR 65 N -2.53 0.00 0.00 0.00 2.01 -1.08 -4.45 115.64 109.59 2f1d s THR 65 Ca -0.06 -0.03 0.00 0.00 0.31 0.00 0.00 61.69 61.91 2f1d s THR 65 Cb -0.02 -0.15 0.00 0.00 0.01 0.00 0.00 72.50 72.34 2f1d s THR 65 CO -0.04 -0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.48 2f1d n GLY 66 N 2.97 2.26 1.76 4.40 0.00 -1.26 -1.49 105.19 113.83 2f1d n GLY 66 Ca -0.13 -0.91 -0.03 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.61 4.24 -0.24 1.61 10.43 -1.22 -4.64 116.55 126.12 2f1d n ASP 67 Ca 0.00 -2.18 0.20 0.00 2.57 0.00 0.00 54.79 55.39 2f1d n ASP 67 Cb 0.00 -0.98 0.54 0.00 1.84 0.00 0.00 41.12 42.52 2f1d n ASP 67 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 2f1d h VAL 68 N 1.53 0.65 -0.93 2.53 2.07 -1.94 0.18 116.25 120.34 2f1d h VAL 68 Ca 0.05 -0.12 0.14 0.00 0.82 0.00 0.00 66.70 67.59 2f1d h VAL 68 Cb 0.93 0.26 -0.08 0.00 -1.52 0.00 0.00 31.29 30.89 2f1d h VAL 68 CO 0.09 0.07 0.59 1.12 0.02 0.00 0.00 177.57 179.46 2f1d h HIS 69 N 0.36 0.92 0.32 1.57 2.07 -2.01 -2.96 115.15 115.42 2f1d h HIS 69 Ca 0.47 0.03 -0.02 0.00 -2.85 0.00 0.00 60.37 58.00 2f1d h HIS 69 Cb 1.25 -0.29 0.00 0.00 2.57 0.00 0.00 27.41 30.94 2f1d h HIS 69 CO -0.00 0.34 -0.15 0.82 -3.07 0.00 0.00 177.93 175.86 2f1d h ILE 70 N 0.78 0.00 -1.77 6.12 2.04 -1.04 -3.50 117.51 120.14 2f1d h ILE 70 Ca 0.47 -0.33 0.04 0.00 1.00 0.00 0.00 64.86 66.05 2f1d h ILE 70 Cb 0.67 0.00 -0.21 0.00 -0.74 0.00 0.00 36.82 36.54 2f1d h ILE 70 CO -0.23 0.00 0.44 -0.62 0.00 0.00 0.00 178.15 177.73 2f1d s ASP 71 N -3.96 -0.45 0.00 1.72 -1.08 -1.05 -5.02 116.67 106.82 2f1d s ASP 71 Ca -0.06 0.45 0.32 0.00 -0.52 0.00 0.00 52.55 52.73 2f1d s ASP 71 Cb 0.01 0.38 1.89 0.00 -1.46 0.00 0.00 42.92 43.74 2f1d s ASP 71 CO 0.19 -0.45 2.22 0.47 0.52 0.00 0.00 175.17 178.12 2f1d n ASP 72 N 0.67 0.00 0.39 -0.34 9.92 -1.26 -3.95 116.55 121.99 2f1d n ASP 72 Ca -0.13 -0.97 -0.17 0.00 -0.53 0.00 0.00 54.79 53.00 2f1d n ASP 72 Cb 0.58 -0.01 -0.08 0.00 -0.64 0.00 0.00 41.12 40.97 2f1d n ASP 72 CO 0.00 0.00 0.00 -0.74 0.13 0.00 0.00 177.20 176.59 2f1d h HIS 73 N 0.00 -0.94 -0.35 1.24 2.76 -1.95 -1.33 115.15 114.59 2f1d h HIS 73 Ca 0.00 -0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.21 2f1d h HIS 73 Cb 0.01 0.31 -0.05 0.00 1.55 0.00 0.00 27.41 29.23 2f1d h HIS 73 CO 0.00 -0.57 0.02 0.45 -1.30 0.00 0.00 177.93 176.54 2f1d h HIS 74 N -1.18 0.03 -0.12 5.26 3.86 -1.95 -1.39 115.15 119.66 2f1d h HIS 74 Ca -0.10 0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.01 2f1d h HIS 74 Cb 0.80 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.29 2f1d h HIS 74 CO -0.00 -0.04 -0.45 1.15 0.86 0.00 0.00 177.93 179.45 2f1d h THR 75 N 0.13 1.32 -0.34 2.45 2.02 -1.84 -2.18 112.91 114.47 2f1d h THR 75 Ca 0.17 -1.62 -0.13 0.00 0.77 0.00 0.00 66.41 65.60 2f1d h THR 75 Cb 0.22 1.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 2f1d h THR 75 CO -0.26 0.49 -0.30 -1.13 0.37 0.00 0.00 175.52 174.68 2f1d h ASN 76 N 0.23 0.76 0.03 4.18 -0.73 -0.70 -2.76 115.58 116.58 2f1d h ASN 76 Ca 0.02 -0.30 -0.00 0.00 1.87 0.00 0.00 56.30 57.88 2f1d h ASN 76 Cb 0.89 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 39.27 2f1d h ASN 76 CO 0.07 1.01 -0.01 -0.08 -0.37 0.00 0.00 177.43 178.05 2f1d h GLU 77 N 0.62 -0.04 -0.60 6.67 4.81 -1.02 -2.82 114.58 122.21 2f1d h GLU 77 Ca 0.07 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.26 2f1d h GLU 77 Cb 0.82 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.19 2f1d h GLU 77 CO 0.07 0.57 0.20 -0.44 -0.73 0.00 0.00 179.01 178.68 2f1d h ASP 78 N -0.69 0.86 -0.58 1.04 3.32 -1.46 0.16 116.42 119.08 2f1d h ASP 78 Ca -0.00 -0.20 0.04 0.00 0.02 0.00 0.00 57.03 56.89 2f1d h ASP 78 Cb 0.63 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.91 2f1d h ASP 78 CO 0.01 0.83 0.32 0.40 -1.72 0.00 0.00 179.24 179.08 2f1d h ILE 79 N 0.84 0.99 -0.51 0.35 2.04 -1.59 0.14 117.51 119.78 2f1d h ILE 79 Ca 0.19 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 2f1d h ILE 79 Cb 0.27 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2f1d h ILE 79 CO -0.01 0.11 0.19 0.00 0.00 0.00 0.00 178.15 178.44 2f1d h ALA 80 N 1.29 1.38 -0.05 1.87 0.00 -1.10 -0.32 119.26 122.34 2f1d h ALA 80 Ca 0.25 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 2f1d h ALA 80 Cb 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2f1d h ALA 80 CO -0.15 0.47 -0.63 -0.07 0.00 0.00 0.00 179.25 178.87 2f1d h LEU 81 N 0.73 0.20 0.06 0.00 3.38 -0.01 -2.77 115.31 116.90 2f1d h LEU 81 Ca 0.17 -0.12 -0.25 0.00 0.09 0.00 0.00 57.88 57.78 2f1d h LEU 81 Cb 0.17 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 40.89 2f1d h LEU 81 CO -0.01 0.77 -1.01 0.00 0.09 0.00 0.00 178.44 178.28 2f1d h ALA 82 N 1.23 0.04 -0.57 1.53 0.00 -0.60 -2.86 119.26 118.02 2f1d h ALA 82 Ca -0.01 -0.70 -0.05 0.00 0.00 0.00 0.00 54.91 54.15 2f1d h ALA 82 Cb 1.14 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2f1d h ALA 82 CO 0.09 0.58 0.15 0.82 0.00 0.00 0.00 179.25 180.89 2f1d h ILE 83 N 0.17 1.23 0.36 0.00 2.04 -1.08 -1.18 117.51 119.05 2f1d h ILE 83 Ca -0.14 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 2f1d h ILE 83 Cb 1.70 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 2f1d h ILE 83 CO 0.20 0.31 -0.17 1.23 0.00 0.00 0.00 178.15 179.71 2f1d h GLY 84 N 0.99 -0.51 0.81 5.37 0.00 -1.56 -1.75 103.07 106.42 2f1d h GLY 84 Ca 0.19 0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.75 2f1d h GLY 84 CO -0.00 -0.19 0.45 -0.84 0.00 0.00 0.00 176.54 175.96 2f1d h THR 85 N -0.59 1.06 -0.11 4.70 2.02 -1.24 -1.70 112.91 117.06 2f1d h THR 85 Ca -0.05 -0.29 -0.12 0.00 0.77 0.00 0.00 66.41 66.72 2f1d h THR 85 Cb 0.44 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 2f1d h THR 85 CO 0.08 0.16 -0.45 0.00 0.37 0.00 0.00 175.52 175.68 2f1d h ALA 86 N 1.33 1.03 -0.44 6.16 0.00 -1.23 -0.24 119.26 125.88 2f1d h ALA 86 Ca 0.30 -0.44 0.05 0.00 0.00 0.00 0.00 54.91 54.82 2f1d h ALA 86 Cb 0.08 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 2f1d h ALA 86 CO -0.13 0.62 0.17 1.25 0.00 0.00 0.00 179.25 181.17 2f1d h LEU 87 N 0.22 0.21 0.43 0.00 5.85 -0.85 -1.70 115.31 119.45 2f1d h LEU 87 Ca 0.01 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2f1d h LEU 87 Cb 0.89 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.93 2f1d h LEU 87 CO 0.07 0.16 -0.21 0.25 -0.34 0.00 0.00 178.44 178.37 2f1d h LEU 88 N 0.36 -0.49 -1.63 2.25 5.85 -0.45 -2.04 115.31 119.16 2f1d h LEU 88 Ca 0.20 -0.07 0.21 0.00 0.84 0.00 0.00 57.88 59.07 2f1d h LEU 88 Cb 0.17 0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.27 2f1d h LEU 88 CO -0.19 -0.22 0.59 0.11 -0.34 0.00 0.00 178.44 178.40 2f1d h LYS 89 N -0.75 0.30 -0.01 1.25 1.57 -1.04 -0.57 116.57 117.32 2f1d h LYS 89 Ca -0.06 -0.02 -0.21 0.00 -1.87 0.00 0.00 60.65 58.50 2f1d h LYS 89 Cb 0.53 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 2f1d h LYS 89 CO 0.10 0.20 -0.88 0.00 -0.57 0.00 0.00 179.45 178.29 2f1d h ALA 90 N 1.61 0.48 -0.44 3.86 0.00 -1.06 -3.22 119.26 120.48 2f1d h ALA 90 Ca 0.45 -0.70 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 2f1d h ALA 90 Cb 1.27 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 2f1d h ALA 90 CO -0.14 0.85 -0.02 -0.07 0.00 0.00 0.00 179.25 179.88 2f1d h LEU 91 N 0.17 0.78 0.00 0.00 3.38 -0.38 -3.42 115.31 115.85 2f1d h LEU 91 Ca -0.06 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2f1d h LEU 91 Cb 1.50 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2f1d h LEU 91 CO 0.14 0.91 0.00 0.61 0.09 0.00 0.00 178.44 180.19 2f1d n GLY 92 N -0.34 3.60 0.15 0.83 0.00 -1.01 -3.07 105.19 105.34 2f1d n GLY 92 Ca -0.00 0.06 0.15 0.00 0.00 0.00 0.00 46.02 46.23 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 11.65 1.00 -3.76 1.61 -0.00 -1.26 -4.92 120.64 124.96 2f1d n GLU 93 Ca 0.00 -0.29 -0.24 0.00 -0.00 0.00 0.00 57.16 56.63 2f1d n GLU 93 Cb 0.00 -1.49 0.03 0.00 -0.00 0.00 0.00 31.44 29.98 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 -0.74 -5.09 -3.26 3.44 1.74 -1.18 -4.93 116.66 106.65 2f1d n ARG 94 Ca 0.19 0.61 -0.38 0.00 -0.77 0.00 0.00 57.85 57.50 2f1d n ARG 94 Cb 0.23 -5.25 -0.06 0.00 -1.02 0.00 0.00 32.46 26.36 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 -6.15 4.35 0.00 5.56 -0.14 -1.26 -4.36 119.74 117.73 2f1d s LYS 95 Ca 0.17 0.53 0.00 0.00 -1.36 0.00 0.00 55.97 55.31 2f1d s LYS 95 Cb -0.09 -3.45 0.00 0.00 -1.68 0.00 0.00 37.83 32.62 2f1d s LYS 95 CO 0.82 0.12 0.00 0.41 -0.76 0.00 0.00 175.35 175.93 2f1d n GLY 96 N 3.28 0.26 3.91 -3.33 0.00 -1.26 -5.00 105.19 103.05 2f1d n GLY 96 Ca -0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.58 4.98 0.13 -0.61 -4.36 -1.26 -1.48 121.20 117.02 2f1d s ILE 97 Ca 0.00 0.06 -0.20 0.00 -0.26 0.00 0.00 60.65 60.25 2f1d s ILE 97 Cb 0.00 -3.80 -0.01 0.00 1.25 0.00 0.00 42.46 39.90 2f1d s ILE 97 CO 0.00 -0.54 1.69 0.78 0.24 0.00 0.00 174.94 177.10 2f1d h ASN 98 N 1.03 -0.31 0.00 4.36 2.35 -1.27 -3.45 115.58 118.29 2f1d h ASN 98 Ca -0.48 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 2f1d h ASN 98 Cb 1.20 0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.74 2f1d h ASN 98 CO 0.64 -0.12 0.00 -1.14 -1.65 0.00 0.00 177.43 175.15 2f1d n ARG 99 N -5.25 0.00 -3.67 0.81 0.63 -0.26 -4.96 116.66 103.97 2f1d n ARG 99 Ca -0.02 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.58 2f1d n ARG 99 Cb 0.17 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.03 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 -0.58 3.54 -0.07 -0.14 0.40 -1.26 -1.89 117.98 117.98 2f1d s PHE 100 Ca 0.00 0.63 -0.04 0.00 -0.60 0.00 0.00 56.93 56.92 2f1d s PHE 100 Cb 0.00 -2.05 0.03 0.00 0.51 0.00 0.00 43.02 41.52 2f1d s PHE 100 CO 0.00 0.51 0.16 0.20 0.70 0.00 0.00 175.22 176.79 2f1d s GLY 101 N -2.03 -0.07 -0.14 4.36 0.00 -0.65 -3.46 107.32 105.33 2f1d s GLY 101 Ca 0.35 0.68 -0.04 0.00 0.00 0.00 0.00 44.72 45.71 2f1d s GLY 101 CO 0.20 0.90 0.13 -0.35 0.00 0.00 0.00 173.10 173.98 2f1d s ASP 102 N 0.94 1.60 -0.09 1.64 2.15 -1.26 0.01 116.67 121.67 2f1d s ASP 102 Ca -0.07 -0.22 -0.08 0.00 0.43 0.00 0.00 52.55 52.62 2f1d s ASP 102 Cb -0.09 0.01 0.03 0.00 -0.30 0.00 0.00 42.92 42.57 2f1d s ASP 102 CO -0.05 -0.31 0.23 0.12 -0.17 0.00 0.00 175.17 175.00 2f1d s PHE 103 N 2.21 -0.27 -0.29 -5.34 5.36 -0.15 -4.92 117.98 114.58 2f1d s PHE 103 Ca 0.04 0.65 -0.01 0.00 -0.96 0.00 0.00 56.93 56.65 2f1d s PHE 103 Cb -0.14 0.08 0.05 0.00 -0.34 0.00 0.00 43.02 42.66 2f1d s PHE 103 CO -0.08 -0.14 -0.03 0.99 -1.46 0.00 0.00 175.22 174.50 2f1d s THR 104 N 0.33 2.85 -0.11 0.12 2.01 -1.26 -0.78 115.64 118.80 2f1d s THR 104 Ca -0.02 -1.38 -0.02 0.00 0.31 0.00 0.00 61.69 60.59 2f1d s THR 104 Cb -0.03 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 2f1d s THR 104 CO -0.01 -0.06 -0.03 0.00 -0.69 0.00 0.00 174.62 173.83 2f1d s ALA 105 N 1.24 3.10 0.18 7.40 0.00 -0.87 -4.95 121.76 127.85 2f1d s ALA 105 Ca -0.05 -0.83 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 2f1d s ALA 105 Cb -0.19 -1.46 -0.06 0.00 0.00 0.00 0.00 23.12 21.41 2f1d s ALA 105 CO -0.02 0.43 0.42 -1.25 0.00 0.00 0.00 175.76 175.34 2f1d s PRO 106 N -0.34 3.64 -0.31 0.00 0.04 -1.26 -2.32 135.00 134.45 2f1d s PRO 106 Ca 0.06 -0.05 -0.01 0.00 0.04 0.00 0.00 61.00 61.04 2f1d s PRO 106 Cb -0.12 -2.80 0.10 0.00 0.04 0.00 0.00 34.50 31.72 2f1d s PRO 106 CO 0.02 0.41 0.11 -1.17 0.04 0.00 0.00 177.00 176.42 2f1d s LEU 107 N -2.83 1.91 0.00 -3.56 2.96 -0.82 -4.96 118.68 111.38 2f1d s LEU 107 Ca 0.42 -1.62 0.00 0.00 -0.22 0.00 0.00 54.13 52.71 2f1d s LEU 107 Cb -0.12 -0.76 0.00 0.00 0.50 0.00 0.00 46.19 45.81 2f1d s LEU 107 CO 0.25 -0.41 0.00 0.47 -1.32 0.00 0.00 176.35 175.34 2f1d n ASP 108 N 4.86 0.00 0.19 3.68 8.00 -1.26 -1.79 116.55 130.23 2f1d n ASP 108 Ca -0.02 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.60 2f1d n ASP 108 Cb 0.42 0.00 0.23 0.00 -0.02 0.00 0.00 41.12 41.75 2f1d n ASP 108 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2f1d h GLU 109 N 0.00 0.00 -7.19 -1.24 9.09 -1.97 -3.46 114.58 109.81 2f1d h GLU 109 Ca 0.00 0.00 -0.49 0.00 0.05 0.00 0.00 59.36 58.92 2f1d h GLU 109 Cb 0.00 0.00 0.05 0.00 -1.65 0.00 0.00 28.75 27.15 2f1d h GLU 109 CO 0.00 0.00 0.38 0.00 0.05 0.00 0.00 179.01 179.44 2f1d s ALA 110 N -3.19 2.84 -0.30 1.06 0.00 -0.74 -3.70 121.76 117.73 2f1d s ALA 110 Ca 0.08 0.34 -0.00 0.00 0.00 0.00 0.00 51.96 52.37 2f1d s ALA 110 Cb 0.07 -3.20 0.19 0.00 0.00 0.00 0.00 23.12 20.18 2f1d s ALA 110 CO 0.65 -0.62 0.67 -1.17 0.00 0.00 0.00 175.76 175.29 2f1d s LEU 111 N -4.33 -1.33 -0.05 0.00 2.96 -0.91 -1.94 118.68 113.08 2f1d s LEU 111 Ca 0.62 0.52 0.06 0.00 -0.22 0.00 0.00 54.13 55.11 2f1d s LEU 111 Cb -0.14 1.99 -0.01 0.00 0.50 0.00 0.00 46.19 48.53 2f1d s LEU 111 CO 0.35 -0.25 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.26 2f1d s ILE 112 N 2.86 1.98 -0.14 6.68 -1.09 -0.98 -1.29 121.20 129.22 2f1d s ILE 112 Ca 0.15 -1.03 -0.02 0.00 -2.23 0.00 0.00 60.65 57.52 2f1d s ILE 112 Cb -0.12 -1.67 -0.02 0.00 -1.58 0.00 0.00 42.46 39.07 2f1d s ILE 112 CO -0.22 0.55 -0.07 -2.28 -1.23 0.00 0.00 174.94 171.69 2f1d s HIS 113 N -0.21 2.95 -0.19 3.97 5.65 -0.49 -2.06 115.29 124.92 2f1d s HIS 113 Ca -0.02 -0.38 -0.00 0.00 0.25 0.00 0.00 55.06 54.91 2f1d s HIS 113 Cb -0.13 -1.90 0.05 0.00 -1.18 0.00 0.00 32.58 29.42 2f1d s HIS 113 CO 0.03 -0.06 -0.06 0.08 -0.65 0.00 0.00 174.74 174.08 2f1d s VAL 114 N 0.26 1.26 -0.13 0.89 1.01 0.04 -1.88 120.40 121.85 2f1d s VAL 114 Ca -0.05 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 2f1d s VAL 114 Cb -0.14 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 2f1d s VAL 114 CO 0.04 0.08 -0.06 -0.44 0.00 0.00 0.00 175.10 174.72 2f1d s SER 115 N 1.55 4.65 0.23 3.32 0.01 -1.01 -0.98 113.70 121.47 2f1d s SER 115 Ca -0.01 -0.12 -0.04 0.00 1.31 0.00 0.00 55.95 57.09 2f1d s SER 115 Cb -0.16 -1.58 -0.03 0.00 0.21 0.00 0.00 66.02 64.46 2f1d s SER 115 CO -0.08 0.23 0.25 -1.48 0.41 0.00 0.00 173.24 172.57 2f1d s LEU 116 N 0.01 0.95 -0.22 2.44 0.05 0.10 -0.80 118.68 121.22 2f1d s LEU 116 Ca -0.00 -1.29 -0.08 0.00 0.05 0.00 0.00 54.13 52.81 2f1d s LEU 116 Cb -0.14 0.82 0.10 0.00 -2.05 0.00 0.00 46.19 44.92 2f1d s LEU 116 CO 0.03 -0.96 0.47 -0.62 -0.55 0.00 0.00 176.35 174.72 2f1d s ASP 117 N -3.14 -0.44 -1.20 1.48 2.15 0.33 -1.64 116.67 114.21 2f1d s ASP 117 Ca 0.34 1.11 -0.20 0.00 0.43 0.00 0.00 52.55 54.24 2f1d s ASP 117 Cb 0.04 1.54 0.06 0.00 -0.30 0.00 0.00 42.92 44.26 2f1d s ASP 117 CO 0.12 -0.23 1.66 -0.76 -0.17 0.00 0.00 175.17 175.80 2f1d s LEU 118 N 2.65 3.69 -0.01 -1.34 1.43 -0.79 -0.61 118.68 123.70 2f1d s LEU 118 Ca -0.03 -2.08 0.12 0.00 -1.03 0.00 0.00 54.13 51.11 2f1d s LEU 118 Cb -0.12 -2.58 -0.18 0.00 0.03 0.00 0.00 46.19 43.35 2f1d s LEU 118 CO -0.14 -1.37 0.29 -1.54 0.23 0.00 0.00 176.35 173.82 2f1d n SER 119 N 8.86 2.05 0.00 2.29 3.41 -1.21 -4.99 113.62 124.03 2f1d n SER 119 Ca 0.44 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 2f1d n SER 119 Cb 0.48 1.48 0.00 0.00 -0.26 0.00 0.00 64.21 65.91 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 1.75 1.80 3.12 5.00 0.00 -0.07 -5.04 105.19 111.75 2f1d n GLY 120 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.54 2.78 0.20 1.61 0.52 -0.63 -4.73 118.95 118.16 2f1d s ARG 121 Ca 0.00 -0.98 -0.30 0.00 -0.52 0.00 0.00 55.73 53.93 2f1d s ARG 121 Cb 0.00 -2.70 -0.09 0.00 0.52 0.00 0.00 34.95 32.68 2f1d s ARG 121 CO 0.00 -0.33 1.28 -1.25 0.02 0.00 0.00 175.30 175.02 2f1d s PRO 122 N 1.24 4.42 -0.28 3.54 0.04 -1.26 -3.82 135.00 138.88 2f1d s PRO 122 Ca 0.01 2.01 -0.18 0.00 0.04 0.00 0.00 61.00 62.88 2f1d s PRO 122 Cb -0.15 -3.20 0.11 0.00 0.04 0.00 0.00 34.50 31.29 2f1d s PRO 122 CO -0.10 -0.20 0.82 -0.47 0.04 0.00 0.00 177.00 177.09 2f1d s TYR 123 N 0.01 -0.82 -0.23 0.56 5.04 -0.70 -4.96 117.35 116.25 2f1d s TYR 123 Ca 0.55 1.69 0.00 0.00 -2.44 0.00 0.00 57.07 56.87 2f1d s TYR 123 Cb -0.36 0.48 0.06 0.00 0.35 0.00 0.00 41.96 42.50 2f1d s TYR 123 CO 0.38 -0.40 -0.02 -1.17 -1.34 0.00 0.00 175.55 173.00 2f1d s LEU 124 N 1.30 2.33 -0.28 6.97 2.96 -1.26 -1.05 118.68 129.66 2f1d s LEU 124 Ca -0.08 -1.16 -0.20 0.00 -0.22 0.00 0.00 54.13 52.47 2f1d s LEU 124 Cb -0.05 -1.05 -0.01 0.00 0.50 0.00 0.00 46.19 45.58 2f1d s LEU 124 CO -0.15 -0.27 0.63 -0.83 -1.32 0.00 0.00 176.35 174.41 2f1d s GLY 125 N 1.49 1.80 -0.36 7.98 0.00 -0.73 -5.04 107.32 112.46 2f1d s GLY 125 Ca -0.03 -0.54 0.01 0.00 0.00 0.00 0.00 44.72 44.17 2f1d s GLY 125 CO -0.08 1.45 0.12 -0.47 0.00 0.00 0.00 173.10 174.12 2f1d s TYR 126 N 2.55 2.45 -0.88 1.90 5.04 -1.26 -0.90 117.35 126.25 2f1d s TYR 126 Ca 0.26 -2.34 -0.01 0.00 -2.44 0.00 0.00 57.07 52.54 2f1d s TYR 126 Cb -0.15 -2.17 0.22 0.00 0.35 0.00 0.00 41.96 40.21 2f1d s TYR 126 CO 0.10 -0.87 0.79 0.09 -1.34 0.00 0.00 175.55 174.32 2f1d n ASN 127 N 4.30 4.18 -3.31 4.32 4.13 -0.15 -4.99 115.26 123.73 2f1d n ASN 127 Ca 0.02 -3.17 -0.11 0.00 1.68 0.00 0.00 54.58 53.01 2f1d n ASN 127 Cb 0.40 -1.02 -0.06 0.00 -1.54 0.00 0.00 39.78 37.56 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 -1.50 -0.54 -0.53 3.41 2.96 -1.26 -1.21 118.68 120.00 2f1d s LEU 128 Ca 0.28 -1.22 -0.22 0.00 -0.22 0.00 0.00 54.13 52.76 2f1d s LEU 128 Cb -0.05 1.00 0.05 0.00 0.50 0.00 0.00 46.19 47.69 2f1d s LEU 128 CO -0.12 -0.25 0.79 -1.83 -1.32 0.00 0.00 176.35 173.63 2f1d s GLU 129 N 1.68 3.23 -0.34 1.98 -1.05 -1.26 -5.02 118.70 117.91 2f1d s GLU 129 Ca 0.16 -0.58 -0.17 0.00 -0.15 0.00 0.00 54.97 54.22 2f1d s GLU 129 Cb -0.12 -4.08 -0.01 0.00 -0.44 0.00 0.00 34.13 29.48 2f1d s GLU 129 CO -0.08 -1.37 0.48 0.42 0.95 0.00 0.00 175.26 175.66 2f1d s ILE 130 N 3.33 5.05 -0.33 1.83 1.01 -1.26 -4.98 121.20 125.85 2f1d s ILE 130 Ca 0.23 0.31 0.26 0.00 0.00 0.00 0.00 60.65 61.45 2f1d s ILE 130 Cb -0.16 -3.92 0.28 0.00 0.01 0.00 0.00 42.46 38.67 2f1d s ILE 130 CO 0.15 -0.17 1.78 1.55 0.00 0.00 0.00 174.94 178.26 2f1d h PRO 131 N 8.43 0.00 -6.65 2.79 0.13 -1.95 -3.44 132.00 131.31 2f1d h PRO 131 Ca -0.28 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.19 2f1d h PRO 131 Cb 1.13 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.08 2f1d h PRO 131 CO 0.75 0.00 -0.81 0.95 -0.23 0.00 0.00 178.00 178.66 2f1d s THR 132 N -3.41 2.57 -1.28 1.56 -4.23 -1.26 -5.04 115.64 104.55 2f1d s THR 132 Ca 0.03 -1.83 0.27 0.00 -1.18 0.00 0.00 61.69 58.99 2f1d s THR 132 Cb 0.09 -2.22 0.23 0.00 1.34 0.00 0.00 72.50 71.94 2f1d s THR 132 CO 0.42 -0.04 1.69 0.00 -0.54 0.00 0.00 174.62 176.15 2f1d n GLN 133 N 0.43 0.31 -3.58 3.99 6.02 -1.26 -4.73 117.38 118.56 2f1d n GLN 133 Ca -0.14 -0.13 -0.01 0.00 -0.01 0.00 0.00 57.00 56.71 2f1d n GLN 133 Cb 0.55 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.26 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 -2.78 0.50 -0.36 -1.09 0.52 -1.26 -2.71 118.95 111.77 2f1d s ARG 134 Ca 0.19 1.17 -0.10 0.00 -0.52 0.00 0.00 55.73 56.46 2f1d s ARG 134 Cb 0.19 0.59 0.03 0.00 0.52 0.00 0.00 34.95 36.27 2f1d s ARG 134 CO 0.57 -0.16 0.18 0.14 0.02 0.00 0.00 175.30 176.06 2f1d s VAL 135 N 2.47 4.45 0.00 3.52 -7.23 -1.06 -4.87 120.40 117.67 2f1d s VAL 135 Ca -0.06 -0.86 0.00 0.00 -1.81 0.00 0.00 61.98 59.25 2f1d s VAL 135 Cb -0.09 -3.47 0.00 0.00 0.56 0.00 0.00 36.38 33.39 2f1d s VAL 135 CO -0.18 -0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.02 2f1d n GLY 136 N 4.97 3.92 0.67 2.32 0.00 -1.26 -2.08 105.19 113.72 2f1d n GLY 136 Ca -0.12 0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.02 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 0.76 -3.14 2.61 -2.24 -1.26 -4.96 114.28 106.05 2f1d n THR 137 Ca 0.00 -0.88 -0.43 0.00 -2.27 0.00 0.00 64.05 60.48 2f1d n THR 137 Cb 0.00 0.68 -0.07 0.00 -2.10 0.00 0.00 70.33 68.84 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 -1.01 3.10 0.03 4.78 5.04 -0.88 -4.98 117.35 123.43 2f1d s TYR 138 Ca 0.23 0.04 -0.36 0.00 -2.44 0.00 0.00 57.07 54.55 2f1d s TYR 138 Cb 0.13 -3.23 -0.15 0.00 0.35 0.00 0.00 41.96 39.06 2f1d s TYR 138 CO 0.17 -0.77 1.58 -3.47 -1.34 0.00 0.00 175.55 171.73 2f1d n ASP 139 N 6.12 2.61 0.19 4.32 -0.08 -1.26 -2.57 116.55 125.88 2f1d n ASP 139 Ca -0.02 1.07 0.13 0.00 -1.51 0.00 0.00 54.79 54.46 2f1d n ASP 139 Cb 0.48 -1.30 0.33 0.00 2.34 0.00 0.00 41.12 42.97 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 4.10 0.00 0.00 5.18 2.02 -1.80 -2.76 112.91 119.65 2f1d h THR 140 Ca -0.47 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 65.97 2f1d h THR 140 Cb 1.29 1.72 -0.00 0.00 -1.74 0.00 0.00 68.15 69.42 2f1d h THR 140 CO 0.88 0.00 -0.04 1.56 0.37 0.00 0.00 175.52 178.28 2f1d h GLN 141 N 0.00 0.00 0.00 6.66 4.20 -1.89 -3.18 115.11 120.90 2f1d h GLN 141 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2f1d h GLN 141 Cb 0.82 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.60 2f1d h GLN 141 CO 0.00 0.04 0.00 1.28 -0.67 0.00 0.00 178.83 179.48 2f1d n LEU 142 N -3.21 0.21 -0.10 1.46 4.32 -1.04 -2.86 117.00 115.79 2f1d n LEU 142 Ca -0.01 0.53 -0.12 0.00 -0.02 0.00 0.00 56.01 56.39 2f1d n LEU 142 Cb 0.25 -0.48 -0.04 0.00 -1.62 0.00 0.00 43.42 41.54 2f1d n LEU 142 CO 0.27 -0.16 0.66 0.58 -1.22 0.00 0.00 177.39 177.51 2f1d h VAL 143 N 0.00 1.29 -0.21 4.08 2.07 -1.77 -1.86 116.25 119.86 2f1d h VAL 143 Ca 0.00 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.27 2f1d h VAL 143 Cb 0.46 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2f1d h VAL 143 CO 0.00 0.40 0.13 -0.08 0.02 0.00 0.00 177.57 178.04 2f1d h GLU 144 N 0.37 0.27 0.00 1.57 4.81 -1.76 -2.93 114.58 116.91 2f1d h GLU 144 Ca 0.06 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2f1d h GLU 144 Cb 0.67 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.99 2f1d h GLU 144 CO 0.04 0.18 -0.14 1.25 -0.73 0.00 0.00 179.01 179.61 2f1d h HIS 145 N 0.28 0.00 0.00 0.92 2.76 -1.53 -1.26 115.15 116.32 2f1d h HIS 145 Ca 0.08 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.25 2f1d h HIS 145 Cb -0.03 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.93 2f1d h HIS 145 CO -0.07 0.14 -0.00 0.35 -1.30 0.00 0.00 177.93 177.05 2f1d h PHE 146 N 0.00 -0.00 0.00 5.26 3.57 -1.16 -2.48 116.94 122.13 2f1d h PHE 146 Ca -0.00 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 2f1d h PHE 146 Cb 0.32 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2f1d h PHE 146 CO 0.00 0.67 -0.32 0.74 -2.23 0.00 0.00 178.31 177.17 2f1d h PHE 147 N -0.69 0.00 0.04 0.41 -1.00 -1.42 -0.62 116.94 113.66 2f1d h PHE 147 Ca -0.00 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 2f1d h PHE 147 Cb 0.68 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.24 2f1d h PHE 147 CO 0.16 0.32 -0.02 0.37 -1.61 0.00 0.00 178.31 177.53 2f1d h GLN 148 N 0.00 -0.06 -0.18 1.51 5.75 -1.28 -2.44 115.11 118.42 2f1d h GLN 148 Ca -0.00 0.00 -0.13 0.00 -0.15 0.00 0.00 58.65 58.37 2f1d h GLN 148 Cb 0.78 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 2f1d h GLN 148 CO 0.04 0.24 -0.47 0.77 -2.65 0.00 0.00 178.83 176.77 2f1d h SER 149 N -0.36 0.48 -0.09 -0.69 0.02 -1.35 -2.58 113.55 108.99 2f1d h SER 149 Ca -0.01 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 60.67 2f1d h SER 149 Cb 0.33 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 2f1d h SER 149 CO 0.01 0.88 -0.07 0.25 -1.14 0.00 0.00 176.83 176.76 2f1d h LEU 150 N 0.36 0.33 0.11 5.07 6.46 -1.10 -3.22 115.31 123.31 2f1d h LEU 150 Ca 0.02 -0.06 -0.27 0.00 -0.12 0.00 0.00 57.88 57.45 2f1d h LEU 150 Cb 0.96 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 40.80 2f1d h LEU 150 CO 0.08 0.44 -1.24 0.58 -0.62 0.00 0.00 178.44 177.68 2f1d h VAL 151 N 0.33 1.49 0.18 1.05 2.07 -1.09 -2.67 116.25 117.62 2f1d h VAL 151 Ca 0.07 -3.09 -0.01 0.00 0.82 0.00 0.00 66.70 64.50 2f1d h VAL 151 Cb 0.33 2.91 0.00 0.00 -1.52 0.00 0.00 31.29 33.02 2f1d h VAL 151 CO 0.02 0.89 -0.09 0.78 0.02 0.00 0.00 177.57 179.19 2f1d h ASN 152 N 0.06 -0.20 -0.03 0.57 2.35 -1.48 -2.02 115.58 114.82 2f1d h ASN 152 Ca -0.13 -0.22 -0.13 0.00 -0.55 0.00 0.00 56.30 55.27 2f1d h ASN 152 Cb 1.95 0.05 -0.01 0.00 0.05 0.00 0.00 38.32 40.36 2f1d h ASN 152 CO 0.19 0.12 -0.42 0.71 -1.65 0.00 0.00 177.43 176.38 2f1d h THR 153 N -0.55 1.30 0.00 2.81 1.35 -1.70 -3.14 112.91 112.99 2f1d h THR 153 Ca -0.02 -1.59 -0.05 0.00 -0.55 0.00 0.00 66.41 64.20 2f1d h THR 153 Cb 0.41 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 68.40 2f1d h THR 153 CO 0.04 0.50 -0.22 -1.28 -0.25 0.00 0.00 175.52 174.31 2f1d h SER 154 N 0.46 0.00 -0.92 5.36 0.87 -1.47 -3.41 113.55 114.43 2f1d h SER 154 Ca 0.04 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.36 2f1d h SER 154 Cb 0.92 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.81 2f1d h SER 154 CO 0.08 0.22 -0.25 0.61 -0.53 0.00 0.00 176.83 176.96 2f1d n GLY 155 N 0.01 0.83 3.83 5.77 0.00 -0.78 -4.77 105.19 110.09 2f1d n GLY 155 Ca -0.00 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.21 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 -3.51 4.14 -0.25 1.61 -2.45 -1.09 -0.89 119.30 116.85 2f1d s MET 156 Ca 0.00 0.74 -0.09 0.00 -1.25 0.00 0.00 55.69 55.09 2f1d s MET 156 Cb 0.00 -2.78 -0.04 0.00 1.25 0.00 0.00 34.83 33.26 2f1d s MET 156 CO 0.00 0.35 0.12 0.99 1.05 0.00 0.00 175.02 177.54 2f1d s THR 157 N -1.63 4.81 -0.05 10.11 2.01 0.22 -1.72 115.64 129.40 2f1d s THR 157 Ca 0.45 -0.00 -0.02 0.00 0.31 0.00 0.00 61.69 62.43 2f1d s THR 157 Cb -0.15 -3.26 0.03 0.00 0.01 0.00 0.00 72.50 69.13 2f1d s THR 157 CO 0.20 0.31 0.04 -0.22 -0.69 0.00 0.00 174.62 174.26 2f1d s LEU 158 N 1.53 0.29 -0.22 4.42 2.96 -0.21 -0.51 118.68 126.94 2f1d s LEU 158 Ca 0.06 0.01 -0.05 0.00 -0.22 0.00 0.00 54.13 53.93 2f1d s LEU 158 Cb -0.15 -0.24 -0.02 0.00 0.50 0.00 0.00 46.19 46.28 2f1d s LEU 158 CO 0.06 -0.23 0.01 -1.00 -1.32 0.00 0.00 176.35 173.87 2f1d s HIS 159 N 2.10 3.03 -0.23 5.38 3.76 0.02 -1.78 115.29 127.58 2f1d s HIS 159 Ca 0.05 -0.56 -0.03 0.00 -0.15 0.00 0.00 55.06 54.37 2f1d s HIS 159 Cb -0.12 -2.12 0.00 0.00 1.11 0.00 0.00 32.58 31.45 2f1d s HIS 159 CO -0.04 -0.34 -0.04 0.42 -0.85 0.00 0.00 174.74 173.89 2f1d s ILE 160 N 1.25 3.23 -0.13 0.60 1.01 -0.07 -2.40 121.20 124.69 2f1d s ILE 160 Ca 0.04 -0.67 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 2f1d s ILE 160 Cb -0.15 -2.53 0.03 0.00 0.01 0.00 0.00 42.46 39.82 2f1d s ILE 160 CO 0.01 0.34 -0.09 -0.13 0.00 0.00 0.00 174.94 175.07 2f1d s ARG 161 N 1.43 1.71 -0.35 2.79 0.52 -0.79 -0.98 118.95 123.28 2f1d s ARG 161 Ca 0.04 -0.36 -0.23 0.00 -0.52 0.00 0.00 55.73 54.66 2f1d s ARG 161 Cb -0.15 -1.77 0.01 0.00 0.52 0.00 0.00 34.95 33.56 2f1d s ARG 161 CO -0.04 -0.28 0.76 -1.14 0.02 0.00 0.00 175.30 174.63 2f1d s GLN 162 N 1.64 3.78 0.05 3.54 0.74 -0.35 -1.39 119.66 127.68 2f1d s GLN 162 Ca 0.04 0.32 0.22 0.00 0.05 0.00 0.00 55.36 56.00 2f1d s GLN 162 Cb -0.13 -3.79 -0.18 0.00 1.10 0.00 0.00 33.01 30.00 2f1d s GLN 162 CO -0.09 -0.80 0.74 1.28 -0.55 0.00 0.00 175.29 175.87 2f1d n LEU 163 N 6.33 0.38 -3.55 3.68 4.77 -0.41 -4.96 117.00 123.23 2f1d n LEU 163 Ca 0.02 0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 55.99 2f1d n LEU 163 Cb 0.48 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.50 2f1d n LEU 163 CO 0.52 -0.05 0.72 0.00 -1.33 0.00 0.00 177.39 177.26 2f1d s ALA 164 N -3.42 -1.88 0.00 -1.18 0.00 -1.16 -4.95 121.76 109.17 2f1d s ALA 164 Ca -0.04 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.28 2f1d s ALA 164 Cb 0.13 -0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.01 2f1d s ALA 164 CO 0.86 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 176.57 2f1d n GLY 165 N 0.37 3.86 0.95 0.00 0.00 -1.24 -2.14 105.19 106.97 2f1d n GLY 165 Ca -0.10 -0.26 -0.02 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.67 0.05 -2.29 1.61 1.02 -1.26 -4.98 120.64 114.13 2f1d n GLU 166 Ca 0.00 0.02 -0.42 0.00 -0.02 0.00 0.00 57.16 56.74 2f1d n GLU 166 Cb 0.00 -0.59 -0.03 0.00 -0.02 0.00 0.00 31.44 30.80 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 -5.68 6.92 0.23 1.62 3.84 -1.26 -4.69 114.94 115.91 2f1d s ASN 167 Ca -0.03 2.08 -0.06 0.00 0.21 0.00 0.00 52.86 55.06 2f1d s ASN 167 Cb 0.01 -2.57 0.21 0.00 -0.55 0.00 0.00 41.25 38.35 2f1d s ASN 167 CO 0.04 -0.64 1.74 0.28 -2.79 0.00 0.00 177.10 175.73 2f1d h SER 168 N 7.43 0.95 0.47 -4.21 0.02 -1.98 -2.04 113.55 114.20 2f1d h SER 168 Ca -0.38 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.34 2f1d h SER 168 Cb 1.19 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 2f1d h SER 168 CO 0.88 0.95 -0.34 -0.74 -1.14 0.00 0.00 176.83 176.44 2f1d h HIS 169 N 0.94 -0.90 -0.55 3.45 6.17 -1.99 -2.91 115.15 119.36 2f1d h HIS 169 Ca 0.19 -0.00 0.07 0.00 0.71 0.00 0.00 60.37 61.34 2f1d h HIS 169 Cb 0.41 0.33 -0.03 0.00 2.52 0.00 0.00 27.41 30.64 2f1d h HIS 169 CO 0.03 -0.50 0.37 0.45 0.71 0.00 0.00 177.93 178.98 2f1d h HIS 170 N -0.79 0.47 -0.12 5.26 3.86 -1.86 -1.47 115.15 120.51 2f1d h HIS 170 Ca -0.05 0.01 -0.06 0.00 -1.16 0.00 0.00 60.37 59.11 2f1d h HIS 170 Cb 0.67 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 28.98 2f1d h HIS 170 CO -0.14 0.25 -0.18 0.82 0.86 0.00 0.00 177.93 179.54 2f1d h ILE 171 N 0.47 1.37 -0.35 2.45 2.04 -1.33 -2.19 117.51 119.97 2f1d h ILE 171 Ca 0.24 -1.41 -0.15 0.00 1.00 0.00 0.00 64.86 64.54 2f1d h ILE 171 Cb 0.36 2.01 -0.00 0.00 -0.74 0.00 0.00 36.82 38.45 2f1d h ILE 171 CO -0.07 0.41 -0.38 0.40 0.00 0.00 0.00 178.15 178.51 2f1d h ILE 172 N -0.08 1.28 -0.13 -0.67 2.04 -1.23 -2.24 117.51 116.48 2f1d h ILE 172 Ca 0.01 -1.55 -0.09 0.00 1.00 0.00 0.00 64.86 64.22 2f1d h ILE 172 Cb 0.74 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 2f1d h ILE 172 CO 0.04 0.51 -0.29 -0.08 0.00 0.00 0.00 178.15 178.34 2f1d h GLU 173 N 0.68 0.42 -0.58 2.37 4.81 -1.35 -1.03 114.58 119.91 2f1d h GLU 173 Ca 0.05 -0.28 0.09 0.00 -0.13 0.00 0.00 59.36 59.09 2f1d h GLU 173 Cb 0.97 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.36 2f1d h GLU 173 CO 0.09 0.89 0.39 0.00 -0.73 0.00 0.00 179.01 179.65 2f1d h ALA 174 N 0.53 1.99 -0.51 2.92 0.00 -1.46 0.97 119.26 123.70 2f1d h ALA 174 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2f1d h ALA 174 Cb 0.89 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2f1d h ALA 174 CO 0.06 -0.11 -0.18 1.15 0.00 0.00 0.00 179.25 180.17 2f1d h THR 175 N 0.42 1.27 0.00 0.00 2.02 -0.92 -1.60 112.91 114.10 2f1d h THR 175 Ca 0.27 -1.35 -0.03 0.00 0.77 0.00 0.00 66.41 66.07 2f1d h THR 175 Cb 0.49 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.96 2f1d h THR 175 CO -0.07 0.47 -0.13 -0.26 0.37 0.00 0.00 175.52 175.90 2f1d h PHE 176 N 0.89 0.00 0.01 3.16 -1.00 -0.14 -1.18 116.94 118.68 2f1d h PHE 176 Ca 0.12 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.85 2f1d h PHE 176 Cb 0.76 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.33 2f1d h PHE 176 CO 0.05 0.13 -0.21 0.87 -1.61 0.00 0.00 178.31 177.54 2f1d h LYS 177 N 0.00 0.12 -0.09 1.51 1.57 -0.57 -2.79 116.57 116.32 2f1d h LYS 177 Ca -0.00 -0.15 -0.16 0.00 -1.87 0.00 0.00 60.65 58.47 2f1d h LYS 177 Cb 0.76 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 2f1d h LYS 177 CO 0.02 0.94 -0.64 0.00 -0.57 0.00 0.00 179.45 179.20 2f1d h ALA 178 N 0.19 0.74 -0.22 3.86 0.00 -1.31 -2.35 119.26 120.17 2f1d h ALA 178 Ca -0.03 -0.56 0.03 0.00 0.00 0.00 0.00 54.91 54.35 2f1d h ALA 178 Cb 1.02 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 2f1d h ALA 178 CO 0.04 0.73 0.05 0.35 0.00 0.00 0.00 179.25 180.43 2f1d h PHE 179 N 0.25 0.09 -0.05 0.00 3.57 -1.31 -2.73 116.94 116.76 2f1d h PHE 179 Ca -0.01 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.53 2f1d h PHE 179 Cb 1.17 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.87 2f1d h PHE 179 CO 0.03 0.03 -0.11 0.00 -2.23 0.00 0.00 178.31 176.04 2f1d h ALA 180 N 1.15 -0.08 -0.01 2.41 0.00 -1.31 -1.25 119.26 120.18 2f1d h ALA 180 Ca 0.10 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2f1d h ALA 180 Cb 0.09 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2f1d h ALA 180 CO -0.12 -0.58 -0.57 0.00 0.00 0.00 0.00 179.25 177.98 2f1d h ARG 181 N -0.16 0.04 0.01 0.00 3.08 -1.42 -1.68 114.38 114.25 2f1d h ARG 181 Ca 0.06 -0.03 -0.24 0.00 0.07 0.00 0.00 59.98 59.84 2f1d h ARG 181 Cb 0.24 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2f1d h ARG 181 CO -0.14 0.60 -1.23 0.00 -1.07 0.00 0.00 179.97 178.12 2f1d h ALA 182 N 1.40 0.47 -0.23 0.04 0.00 -1.47 -2.99 119.26 116.49 2f1d h ALA 182 Ca -0.00 -1.08 -0.14 0.00 0.00 0.00 0.00 54.91 53.68 2f1d h ALA 182 Cb 1.01 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2f1d h ALA 182 CO 0.08 1.35 -0.44 1.25 0.00 0.00 0.00 179.25 181.48 2f1d h LEU 183 N 0.00 0.62 0.48 0.00 6.46 -0.90 -2.40 115.31 119.57 2f1d h LEU 183 Ca -0.10 -0.29 -0.01 0.00 -0.12 0.00 0.00 57.88 57.35 2f1d h LEU 183 Cb 1.85 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 41.60 2f1d h LEU 183 CO 0.12 0.98 -0.36 -0.09 -0.62 0.00 0.00 178.44 178.46 2f1d h ARG 184 N 0.47 -0.79 -0.90 1.25 2.43 -1.38 -1.86 114.38 113.60 2f1d h ARG 184 Ca 0.03 0.05 0.22 0.00 -0.81 0.00 0.00 59.98 59.47 2f1d h ARG 184 Cb 0.95 0.18 -0.16 0.00 -0.42 0.00 0.00 29.97 30.52 2f1d h ARG 184 CO 0.09 -0.53 -0.04 0.37 -1.51 0.00 0.00 179.97 178.34 2f1d h GLN 185 N -0.82 0.04 -0.13 0.20 4.15 -1.36 -0.15 115.11 117.04 2f1d h GLN 185 Ca -0.05 -0.00 -0.18 0.00 0.77 0.00 0.00 58.65 59.19 2f1d h GLN 185 Cb 0.70 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.38 2f1d h GLN 185 CO 0.01 0.03 -0.67 0.00 -1.93 0.00 0.00 178.83 176.27 2f1d h ALA 186 N 1.88 0.59 0.00 3.38 0.00 -1.17 -3.13 119.26 120.81 2f1d h ALA 186 Ca 0.50 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2f1d h ALA 186 Cb 0.92 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2f1d h ALA 186 CO -0.84 0.72 -0.27 1.79 0.00 0.00 0.00 179.25 180.65 2f1d h THR 187 N 0.37 0.09 -4.06 0.00 1.35 -0.49 -0.68 112.91 109.50 2f1d h THR 187 Ca -0.02 -1.13 -0.54 0.00 -0.55 0.00 0.00 66.41 64.18 2f1d h THR 187 Cb 1.24 1.94 0.12 0.00 -1.73 0.00 0.00 68.15 69.71 2f1d h THR 187 CO 0.12 0.05 0.54 -1.61 -0.25 0.00 0.00 175.52 174.37 2f1d s GLU 188 N -3.21 3.18 0.60 4.72 2.02 -0.15 -4.76 118.70 121.08 2f1d s GLU 188 Ca 0.05 2.01 -0.16 0.00 0.02 0.00 0.00 54.97 56.90 2f1d s GLU 188 Cb 0.06 -2.16 -0.03 0.00 0.10 0.00 0.00 34.13 32.09 2f1d s GLU 188 CO 0.70 -1.09 1.06 0.95 0.02 0.00 0.00 175.26 176.90 2f1d s THR 189 N -1.44 3.80 -0.07 3.63 -4.23 -1.26 -1.49 115.64 114.58 2f1d s THR 189 Ca 0.72 0.85 0.04 0.00 -1.18 0.00 0.00 61.69 62.13 2f1d s THR 189 Cb -0.35 -3.38 -0.01 0.00 1.34 0.00 0.00 72.50 70.10 2f1d s THR 189 CO 0.40 -0.51 -0.21 -0.62 -0.54 0.00 0.00 174.62 173.14 2f1d s ASP 190 N -2.80 3.37 -0.84 3.99 2.15 -0.55 -4.72 116.67 117.28 2f1d s ASP 190 Ca 0.64 -0.44 -0.25 0.00 0.43 0.00 0.00 52.55 52.93 2f1d s ASP 190 Cb -0.16 -1.03 -0.04 0.00 -0.30 0.00 0.00 42.92 41.39 2f1d s ASP 190 CO 0.37 0.24 1.91 -2.16 -0.17 0.00 0.00 175.17 175.36 2f1d s PRO 191 N -0.11 2.61 0.00 4.34 0.04 -1.26 -4.84 135.00 135.78 2f1d s PRO 191 Ca -0.04 -0.11 0.14 0.00 0.04 0.00 0.00 61.00 61.03 2f1d s PRO 191 Cb -0.14 -4.91 0.85 0.00 0.04 0.00 0.00 34.50 30.34 2f1d s PRO 191 CO 0.04 -3.19 1.27 0.54 0.04 0.00 0.00 177.00 175.71