#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 3.80 0.11 1.61 0.52 -1.26 -4.95 118.95 118.77 2f1d s ARG 11 Ca 0.00 1.50 0.10 0.00 -0.52 0.00 0.00 55.73 56.81 2f1d s ARG 11 Cb 0.00 -4.00 -0.04 0.00 0.52 0.00 0.00 34.95 31.43 2f1d s ARG 11 CO 0.00 -1.29 -0.24 0.42 0.02 0.00 0.00 175.30 174.21 2f1d s ILE 12 N 5.06 2.02 -0.09 1.52 1.01 -1.26 -1.54 121.20 127.92 2f1d s ILE 12 Ca 0.67 -1.62 0.02 0.00 0.00 0.00 0.00 60.65 59.72 2f1d s ILE 12 Cb -0.22 -1.79 0.02 0.00 0.01 0.00 0.00 42.46 40.47 2f1d s ILE 12 CO 0.28 0.06 -0.13 -0.83 0.00 0.00 0.00 174.94 174.32 2f1d s GLY 13 N -1.89 0.93 -0.04 6.18 0.00 -0.85 -3.80 107.32 107.85 2f1d s GLY 13 Ca 0.11 -0.60 0.03 0.00 0.00 0.00 0.00 44.72 44.25 2f1d s GLY 13 CO 0.05 0.26 -0.11 -0.54 0.00 0.00 0.00 173.10 172.76 2f1d s GLU 14 N 0.97 2.57 -0.18 2.90 2.02 -1.26 -1.91 118.70 123.80 2f1d s GLU 14 Ca -0.08 -0.66 -0.07 0.00 0.02 0.00 0.00 54.97 54.18 2f1d s GLU 14 Cb -0.15 -2.46 0.08 0.00 0.10 0.00 0.00 34.13 31.71 2f1d s GLU 14 CO -0.00 0.63 0.39 0.08 0.02 0.00 0.00 175.26 176.38 2f1d s VAL 15 N -0.80 -0.53 -0.18 2.63 1.01 -0.54 -4.87 120.40 117.12 2f1d s VAL 15 Ca 0.13 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.26 2f1d s VAL 15 Cb -0.11 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.64 2f1d s VAL 15 CO 0.02 0.07 -0.09 -1.59 0.00 0.00 0.00 175.10 173.51 2f1d s LYS 16 N 2.41 3.35 -0.14 2.72 -2.85 -1.26 -1.71 119.74 122.26 2f1d s LYS 16 Ca -0.02 -0.67 0.00 0.00 -1.00 0.00 0.00 55.97 54.28 2f1d s LYS 16 Cb -0.12 -2.81 0.02 0.00 -2.06 0.00 0.00 37.83 32.87 2f1d s LYS 16 CO -0.12 -0.03 -0.12 0.50 0.10 0.00 0.00 175.35 175.69 2f1d s ARG 17 N 0.99 2.01 -0.12 1.78 3.52 -0.16 -5.03 118.95 121.93 2f1d s ARG 17 Ca -0.01 -0.45 0.02 0.00 -0.13 0.00 0.00 55.73 55.16 2f1d s ARG 17 Cb -0.15 -1.93 0.01 0.00 -1.56 0.00 0.00 34.95 31.33 2f1d s ARG 17 CO -0.01 -0.25 -0.20 0.08 -0.81 0.00 0.00 175.30 174.11 2f1d s VAL 18 N 1.57 1.86 0.49 7.11 1.01 -1.26 -1.75 120.40 129.44 2f1d s VAL 18 Ca 0.05 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.18 2f1d s VAL 18 Cb -0.13 -1.66 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 2f1d s VAL 18 CO -0.10 0.51 0.02 0.42 0.00 0.00 0.00 175.10 175.95 2f1d s THR 19 N 0.80 1.15 0.55 3.92 -4.23 -0.68 -5.01 115.64 112.14 2f1d s THR 19 Ca -0.09 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 58.64 2f1d s THR 19 Cb -0.16 -2.24 0.31 0.00 1.34 0.00 0.00 72.50 71.75 2f1d s THR 19 CO -0.00 0.00 2.19 0.07 -0.54 0.00 0.00 174.62 176.34 2f1d h LYS 20 N 1.43 0.00 0.01 3.99 -0.00 -2.03 -3.29 116.57 116.68 2f1d h LYS 20 Ca -0.43 0.00 -0.37 0.00 -0.00 0.00 0.00 60.65 59.85 2f1d h LYS 20 Cb 1.31 0.00 -0.06 0.00 -0.00 0.00 0.00 32.23 33.47 2f1d h LYS 20 CO 0.73 0.00 -2.34 0.39 -0.00 0.00 0.00 179.45 178.23 2f1d n GLU 21 N -4.25 0.67 -4.06 0.07 4.71 -1.26 -5.02 120.64 111.51 2f1d n GLU 21 Ca -0.03 0.12 -0.13 0.00 -0.01 0.00 0.00 57.16 57.11 2f1d n GLU 21 Cb 0.10 -1.56 -0.11 0.00 -1.01 0.00 0.00 31.44 28.85 2f1d n GLU 21 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 2f1d s THR 22 N -2.52 0.50 -0.21 2.62 -4.23 -1.24 -2.97 115.64 107.59 2f1d s THR 22 Ca -0.22 -1.04 0.01 0.00 -1.18 0.00 0.00 61.69 59.26 2f1d s THR 22 Cb 0.08 -0.57 0.03 0.00 1.34 0.00 0.00 72.50 73.38 2f1d s THR 22 CO 0.72 -0.38 -0.15 0.21 -0.54 0.00 0.00 174.62 174.48 2f1d s ASN 23 N -1.53 3.71 -0.04 3.99 3.84 0.03 -1.69 114.94 123.25 2f1d s ASN 23 Ca -0.10 -0.90 0.01 0.00 0.21 0.00 0.00 52.86 52.07 2f1d s ASN 23 Cb -0.10 -1.53 0.02 0.00 -0.55 0.00 0.00 41.25 39.09 2f1d s ASN 23 CO 0.00 -0.07 -0.04 -0.69 -2.79 0.00 0.00 177.10 173.51 2f1d s VAL 24 N 1.24 0.45 -0.08 -5.21 1.01 -0.72 -1.73 120.40 115.36 2f1d s VAL 24 Ca 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 2f1d s VAL 24 Cb -0.16 -0.49 0.04 0.00 0.00 0.00 0.00 36.38 35.78 2f1d s VAL 24 CO -0.09 0.20 0.18 -0.55 0.00 0.00 0.00 175.10 174.84 2f1d s SER 25 N 0.84 0.12 -0.06 3.32 0.15 -0.46 -0.99 113.70 116.62 2f1d s SER 25 Ca -0.11 0.38 -0.02 0.00 0.70 0.00 0.00 55.95 56.90 2f1d s SER 25 Cb -0.14 0.30 0.04 0.00 -1.71 0.00 0.00 66.02 64.52 2f1d s SER 25 CO -0.00 -0.19 0.10 -0.69 1.20 0.00 0.00 173.24 173.66 2f1d s VAL 26 N 1.59 -0.15 -0.06 4.45 1.01 -0.69 -1.17 120.40 125.38 2f1d s VAL 26 Ca -0.05 0.35 0.04 0.00 0.00 0.00 0.00 61.98 62.32 2f1d s VAL 26 Cb -0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 36.38 36.04 2f1d s VAL 26 CO -0.07 0.15 -0.18 -1.59 0.00 0.00 0.00 175.10 173.41 2f1d s LYS 27 N 1.95 2.58 0.01 2.72 -2.85 -0.83 -1.47 119.74 121.85 2f1d s LYS 27 Ca 0.01 -0.77 0.01 0.00 -1.00 0.00 0.00 55.97 54.21 2f1d s LYS 27 Cb -0.12 -2.32 -0.01 0.00 -2.06 0.00 0.00 37.83 33.32 2f1d s LYS 27 CO -0.04 0.50 -0.03 0.42 0.10 0.00 0.00 175.35 176.30 2f1d s ILE 28 N -0.44 0.25 -0.25 3.79 1.01 -0.80 -1.54 121.20 123.22 2f1d s ILE 28 Ca 0.05 -0.33 0.02 0.00 0.00 0.00 0.00 60.65 60.39 2f1d s ILE 28 Cb -0.12 -0.25 0.06 0.00 0.01 0.00 0.00 42.46 42.16 2f1d s ILE 28 CO 0.02 -0.06 -0.06 0.21 0.00 0.00 0.00 174.94 175.05 2f1d s ASN 29 N -0.41 4.12 0.52 3.58 3.84 -0.79 -2.00 114.94 123.80 2f1d s ASN 29 Ca -0.02 -1.33 0.16 0.00 0.21 0.00 0.00 52.86 51.87 2f1d s ASN 29 Cb -0.03 -1.32 1.26 0.00 -0.55 0.00 0.00 41.25 40.61 2f1d s ASN 29 CO -0.00 -0.24 2.15 -0.07 -2.79 0.00 0.00 177.10 176.15 2f1d h LEU 30 N 7.87 0.00 -4.04 3.21 3.38 -1.61 -2.83 115.31 121.29 2f1d h LEU 30 Ca -0.17 -0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.20 2f1d h LEU 30 Cb 1.06 -0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.41 2f1d h LEU 30 CO 0.44 0.01 -0.37 0.47 0.09 0.00 0.00 178.44 179.08 2f1d n ASP 31 N -4.53 5.56 -1.97 -0.43 8.00 -1.26 -4.75 116.55 117.16 2f1d n ASP 31 Ca -0.03 -3.76 0.00 0.00 0.71 0.00 0.00 54.79 51.71 2f1d n ASP 31 Cb 0.09 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 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 -0.69 0.87 0.57 0.44 0.00 -1.16 -4.71 105.19 100.51 2f1d n GLY 32 Ca 0.47 -1.68 0.02 0.00 0.00 0.00 0.00 46.02 44.83 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 0.00 0.36 -1.99 2.61 -2.24 -1.25 -4.76 114.28 107.01 2f1d n THR 33 Ca 0.00 -0.58 -0.03 0.00 -2.27 0.00 0.00 64.05 61.18 2f1d n THR 33 Cb 0.00 0.43 0.01 0.00 -2.10 0.00 0.00 70.33 68.67 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 -0.19 0.46 3.49 3.38 0.00 -1.19 -4.90 105.19 106.23 2f1d n GLY 34 Ca 0.04 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.06 5.16 -0.31 1.61 1.01 -1.15 -4.52 120.40 119.14 2f1d s VAL 35 Ca 0.04 -0.39 -0.21 0.00 0.00 0.00 0.00 61.98 61.41 2f1d s VAL 35 Cb -0.01 -3.96 -0.00 0.00 0.00 0.00 0.00 36.38 32.41 2f1d s VAL 35 CO 0.12 -0.33 0.69 0.00 0.00 0.00 0.00 175.10 175.58 2f1d s ALA 36 N 1.96 3.52 -0.39 5.51 0.00 -1.26 -1.11 121.76 129.99 2f1d s ALA 36 Ca 0.09 -0.58 0.09 0.00 0.00 0.00 0.00 51.96 51.57 2f1d s ALA 36 Cb -0.18 -3.18 0.29 0.00 0.00 0.00 0.00 23.12 20.05 2f1d s ALA 36 CO 0.12 -1.15 0.61 -3.47 0.00 0.00 0.00 175.76 171.87 2f1d n ASP 37 N 6.02 0.29 -4.31 0.00 4.64 0.24 -5.00 116.55 118.43 2f1d n ASP 37 Ca 0.01 -2.83 -0.32 0.00 -1.38 0.00 0.00 54.79 50.26 2f1d n ASP 37 Cb 0.49 -0.54 -0.16 0.00 -1.04 0.00 0.00 41.12 39.87 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 -1.63 3.54 -0.14 1.67 0.01 -1.26 -1.56 113.70 114.32 2f1d s SER 38 Ca 0.37 -0.43 -0.04 0.00 1.31 0.00 0.00 55.95 57.16 2f1d s SER 38 Cb 0.24 -1.35 0.06 0.00 0.21 0.00 0.00 66.02 65.18 2f1d s SER 38 CO -0.10 0.19 0.13 -0.55 0.41 0.00 0.00 173.24 173.33 2f1d s SER 39 N 0.17 1.58 0.00 2.44 0.15 -0.61 -4.94 113.70 112.48 2f1d s SER 39 Ca -0.11 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.34 2f1d s SER 39 Cb -0.16 0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.20 2f1d s SER 39 CO 0.06 -0.31 0.49 -1.54 1.20 0.00 0.00 173.24 173.14 2f1d n SER 40 N 5.30 0.96 -0.37 5.45 3.41 -1.26 -2.11 113.62 125.00 2f1d n SER 40 Ca -0.06 -1.09 -0.05 0.00 -0.26 0.00 0.00 58.87 57.41 2f1d n SER 40 Cb 0.49 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.42 2f1d n SER 40 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2f1d n GLY 41 N -0.05 0.67 2.77 5.00 0.00 -1.26 -4.62 105.19 107.71 2f1d n GLY 41 Ca 0.00 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.88 1.77 0.35 -0.61 1.01 -1.26 -5.02 121.20 115.56 2f1d s ILE 42 Ca 0.00 -2.88 0.15 0.00 0.00 0.00 0.00 60.65 57.91 2f1d s ILE 42 Cb 0.00 -2.23 0.34 0.00 0.01 0.00 0.00 42.46 40.58 2f1d s ILE 42 CO 0.00 -0.89 1.69 -0.65 0.00 0.00 0.00 174.94 175.09 2f1d h PRO 43 N 6.53 0.38 0.09 2.79 0.11 -2.00 -1.92 132.00 137.97 2f1d h PRO 43 Ca -0.00 -0.02 -0.28 0.00 0.11 0.00 0.00 66.00 65.81 2f1d h PRO 43 Cb 0.90 -0.09 0.02 0.00 0.11 0.00 0.00 31.00 31.95 2f1d h PRO 43 CO 0.55 0.25 -1.16 0.35 -0.21 0.00 0.00 178.00 177.78 2f1d h PHE 44 N 0.39 0.84 -0.48 0.65 3.57 -1.96 -3.12 116.94 116.84 2f1d h PHE 44 Ca 0.70 -0.52 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 2f1d h PHE 44 Cb 1.58 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 40.23 2f1d h PHE 44 CO -0.01 1.36 0.25 1.25 -2.23 0.00 0.00 178.31 178.93 2f1d h LEU 45 N 0.24 0.59 -0.69 0.59 5.85 -1.80 -1.91 115.31 118.17 2f1d h LEU 45 Ca -0.15 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.45 2f1d h LEU 45 Cb 1.83 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.69 2f1d h LEU 45 CO 0.21 0.49 0.13 0.44 -0.34 0.00 0.00 178.44 179.37 2f1d h ASP 46 N 0.66 1.08 -0.85 1.25 3.32 -1.45 0.15 116.42 120.59 2f1d h ASP 46 Ca 0.17 -0.25 0.01 0.00 0.02 0.00 0.00 57.03 56.97 2f1d h ASP 46 Cb 0.04 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 39.26 2f1d h ASP 46 CO -0.03 1.06 0.55 -0.74 -1.72 0.00 0.00 179.24 178.37 2f1d h HIS 47 N 1.06 1.08 -0.06 4.55 2.76 -1.37 -1.25 115.15 121.91 2f1d h HIS 47 Ca 0.21 0.02 -0.18 0.00 -2.20 0.00 0.00 60.37 58.22 2f1d h HIS 47 Cb 0.43 -0.36 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 2f1d h HIS 47 CO 0.03 0.69 -0.74 0.52 -1.30 0.00 0.00 177.93 177.13 2f1d h MET 48 N 1.16 0.35 0.00 5.26 2.86 -0.71 -2.92 114.93 120.93 2f1d h MET 48 Ca 0.31 -0.30 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 2f1d h MET 48 Cb -0.12 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 2f1d h MET 48 CO -0.07 0.95 -0.17 -0.07 1.06 0.00 0.00 176.91 178.61 2f1d h LEU 49 N 0.24 0.00 -0.55 1.22 3.38 -0.56 -2.44 115.31 116.59 2f1d h LEU 49 Ca -0.03 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 2f1d h LEU 49 Cb 1.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 2f1d h LEU 49 CO 0.12 0.17 -0.70 0.44 0.09 0.00 0.00 178.44 178.56 2f1d h ASP 50 N 0.00 0.15 0.38 -0.43 3.32 -1.12 -3.00 116.42 115.72 2f1d h ASP 50 Ca -0.00 -0.10 -0.20 0.00 0.02 0.00 0.00 57.03 56.75 2f1d h ASP 50 Cb 0.73 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 2f1d h ASP 50 CO 0.02 0.81 -0.83 1.56 -1.72 0.00 0.00 179.24 179.08 2f1d h GLN 51 N 0.09 0.34 -0.97 3.56 1.08 -1.29 -1.43 115.11 116.48 2f1d h GLN 51 Ca -0.02 -0.32 0.02 0.00 -1.45 0.00 0.00 58.65 56.88 2f1d h GLN 51 Cb 1.25 0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 28.71 2f1d h GLN 51 CO 0.10 0.99 0.64 1.25 -0.95 0.00 0.00 178.83 180.87 2f1d h LEU 52 N 0.21 1.09 0.03 1.46 5.85 -1.44 -2.06 115.31 120.44 2f1d h LEU 52 Ca -0.05 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2f1d h LEU 52 Cb 1.43 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2f1d h LEU 52 CO 0.14 0.77 -0.01 0.00 -0.34 0.00 0.00 178.44 179.00 2f1d h ALA 53 N 1.37 -0.04 0.21 1.25 0.00 -1.37 -1.74 119.26 118.95 2f1d h ALA 53 Ca 0.37 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2f1d h ALA 53 Cb -0.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2f1d h ALA 53 CO -0.10 -0.19 -0.10 1.03 0.00 0.00 0.00 179.25 179.89 2f1d h SER 54 N -0.70 -0.24 1.73 0.00 0.87 -1.29 -1.01 113.55 112.90 2f1d h SER 54 Ca -0.00 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 2f1d h SER 54 Cb 0.64 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 2f1d h SER 54 CO 0.01 -0.06 -0.01 0.45 -0.53 0.00 0.00 176.83 176.68 2f1d h HIS 55 N -0.41 0.00 -0.01 2.24 3.86 -1.50 -3.18 115.15 116.14 2f1d h HIS 55 Ca -0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2f1d h HIS 55 Cb 0.32 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.79 2f1d h HIS 55 CO -0.03 0.00 -0.54 0.41 0.86 0.00 0.00 177.93 178.63 2f1d n GLY 56 N 1.20 -0.10 4.13 2.45 0.00 -0.65 -4.08 105.19 108.14 2f1d n GLY 56 Ca 0.05 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 45.11 2f1d n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2f1d n LEU 57 N -0.22 -1.88 -4.80 0.99 4.77 -0.42 -4.71 117.00 110.72 2f1d n LEU 57 Ca 0.08 -1.00 -0.32 0.00 -0.03 0.00 0.00 56.01 54.74 2f1d n LEU 57 Cb 0.45 -2.14 -0.06 0.00 -2.33 0.00 0.00 43.42 39.33 2f1d n LEU 57 CO 0.30 0.35 -0.24 -0.36 -1.33 0.00 0.00 177.39 176.11 2f1d s PHE 58 N -3.50 3.30 -0.26 -1.77 0.40 -1.01 -2.99 117.98 112.16 2f1d s PHE 58 Ca 0.52 0.18 -0.20 0.00 -0.60 0.00 0.00 56.93 56.84 2f1d s PHE 58 Cb -0.28 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.51 2f1d s PHE 58 CO 0.91 0.55 0.60 -0.51 0.70 0.00 0.00 175.22 177.47 2f1d s ASP 59 N -2.00 6.54 -0.17 1.36 1.01 -1.08 -2.94 116.67 119.38 2f1d s ASP 59 Ca 0.26 0.65 -0.01 0.00 0.71 0.00 0.00 52.55 54.16 2f1d s ASP 59 Cb -0.12 -2.32 -0.00 0.00 1.01 0.00 0.00 42.92 41.49 2f1d s ASP 59 CO 0.18 -0.35 -0.13 -0.69 0.21 0.00 0.00 175.17 174.39 2f1d s VAL 60 N 2.45 2.82 -0.13 -1.27 1.01 -0.27 -1.88 120.40 123.13 2f1d s VAL 60 Ca 0.25 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 2f1d s VAL 60 Cb -0.16 -2.22 0.02 0.00 0.00 0.00 0.00 36.38 34.03 2f1d s VAL 60 CO 0.09 0.49 -0.11 -2.28 0.00 0.00 0.00 175.10 173.30 2f1d s HIS 61 N 1.03 1.80 -0.03 5.22 2.46 -0.59 -0.60 115.29 124.59 2f1d s HIS 61 Ca -0.01 -0.96 0.01 0.00 0.47 0.00 0.00 55.06 54.57 2f1d s HIS 61 Cb -0.15 -1.40 0.02 0.00 -0.13 0.00 0.00 32.58 30.93 2f1d s HIS 61 CO -0.03 -0.59 -0.01 0.08 -2.47 0.00 0.00 174.74 171.73 2f1d s VAL 62 N 1.61 0.23 -0.09 0.89 1.01 -0.60 -1.96 120.40 121.48 2f1d s VAL 62 Ca 0.05 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.02 2f1d s VAL 62 Cb -0.13 -0.29 0.04 0.00 0.00 0.00 0.00 36.38 36.00 2f1d s VAL 62 CO -0.09 0.14 0.06 -0.60 0.00 0.00 0.00 175.10 174.60 2f1d s ARG 63 N 0.77 0.12 0.02 2.72 6.06 -0.32 -1.58 118.95 126.74 2f1d s ARG 63 Ca -0.08 0.16 -0.01 0.00 -2.50 0.00 0.00 55.73 53.30 2f1d s ARG 63 Cb -0.11 -1.06 -0.02 0.00 0.06 0.00 0.00 34.95 33.82 2f1d s ARG 63 CO -0.01 -0.44 -0.01 0.00 -2.50 0.00 0.00 175.30 172.33 2f1d s ALA 64 N 2.11 0.07 -0.10 6.12 0.00 -0.90 -1.35 121.76 127.72 2f1d s ALA 64 Ca 0.04 -0.50 -0.05 0.00 0.00 0.00 0.00 51.96 51.44 2f1d s ALA 64 Cb -0.13 0.13 0.04 0.00 0.00 0.00 0.00 23.12 23.16 2f1d s ALA 64 CO -0.05 -0.15 0.23 0.99 0.00 0.00 0.00 175.76 176.77 2f1d s THR 65 N -1.34 -0.04 0.00 0.00 2.01 -0.71 -4.32 115.64 111.25 2f1d s THR 65 Ca -0.15 0.14 0.00 0.00 0.31 0.00 0.00 61.69 61.99 2f1d s THR 65 Cb -0.09 -0.35 0.00 0.00 0.01 0.00 0.00 72.50 72.07 2f1d s THR 65 CO -0.01 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.59 2f1d n GLY 66 N 4.08 3.22 0.00 4.40 0.00 -1.26 -0.78 105.19 114.84 2f1d n GLY 66 Ca -0.24 -0.44 0.02 0.00 0.00 0.00 0.00 46.02 45.37 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 0.00 0.00 1.61 8.00 -1.16 -4.55 116.55 120.46 2f1d n ASP 67 Ca 0.00 -0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.31 2f1d n ASP 67 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2f1d n ASP 67 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2f1d n VAL 68 N -0.94 0.00 -0.24 2.53 0.31 -1.24 0.14 118.33 118.90 2f1d n VAL 68 Ca 0.03 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.50 2f1d n VAL 68 Cb 0.02 0.00 0.42 0.00 -0.91 0.00 0.00 33.84 33.37 2f1d n VAL 68 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 2f1d h HIS 69 N 0.00 0.71 0.09 3.52 2.07 -2.00 -2.82 115.15 116.72 2f1d h HIS 69 Ca 0.00 0.02 -0.00 0.00 -2.85 0.00 0.00 60.37 57.54 2f1d h HIS 69 Cb 0.00 -0.22 0.00 0.00 2.57 0.00 0.00 27.41 29.76 2f1d h HIS 69 CO 0.00 0.26 -0.04 0.82 -3.07 0.00 0.00 177.93 175.89 2f1d h ILE 70 N 0.60 1.15 -2.29 6.12 2.04 0.89 -3.50 117.51 122.53 2f1d h ILE 70 Ca 0.43 -1.20 0.20 0.00 1.00 0.00 0.00 64.86 65.29 2f1d h ILE 70 Cb 0.79 1.89 -0.07 0.00 -0.74 0.00 0.00 36.82 38.70 2f1d h ILE 70 CO -0.18 0.28 0.59 -0.62 0.00 0.00 0.00 178.15 178.22 2f1d s ASP 71 N -5.60 -0.08 0.00 1.72 -1.08 -1.06 -5.03 116.67 105.54 2f1d s ASP 71 Ca -0.15 -0.47 0.18 0.00 -0.52 0.00 0.00 52.55 51.59 2f1d s ASP 71 Cb 0.01 0.44 0.13 0.00 -1.46 0.00 0.00 42.92 42.04 2f1d s ASP 71 CO 0.59 -0.83 1.06 0.47 0.52 0.00 0.00 175.17 176.98 2f1d n ASP 72 N -0.81 2.46 0.24 -0.34 8.00 -1.26 -3.59 116.55 121.25 2f1d n ASP 72 Ca -0.05 -1.73 -0.16 0.00 0.71 0.00 0.00 54.79 53.57 2f1d n ASP 72 Cb 0.60 0.04 -0.08 0.00 -0.02 0.00 0.00 41.12 41.66 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 3.46 -0.91 -0.55 1.24 2.76 -1.96 -1.36 115.15 117.83 2f1d h HIS 73 Ca 0.00 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.09 2f1d h HIS 73 Cb 0.75 0.35 -0.02 0.00 1.55 0.00 0.00 27.41 30.03 2f1d h HIS 73 CO 0.00 -0.49 0.03 0.45 -1.30 0.00 0.00 177.93 176.62 2f1d h HIS 74 N -0.74 0.99 -0.08 5.26 3.86 -1.97 -1.04 115.15 121.42 2f1d h HIS 74 Ca -0.03 -0.14 -0.10 0.00 -1.16 0.00 0.00 60.37 58.94 2f1d h HIS 74 Cb 0.65 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.85 2f1d h HIS 74 CO -0.17 0.88 -0.33 1.15 0.86 0.00 0.00 177.93 180.32 2f1d h THR 75 N 0.86 1.41 -0.32 2.45 2.02 -1.88 -2.61 112.91 114.84 2f1d h THR 75 Ca 0.17 -1.70 0.07 0.00 0.77 0.00 0.00 66.41 65.71 2f1d h THR 75 Cb 0.47 2.27 -0.08 0.00 -1.74 0.00 0.00 68.15 69.06 2f1d h THR 75 CO 0.02 0.49 -0.32 -1.13 0.37 0.00 0.00 175.52 174.95 2f1d h ASN 76 N -0.10 -1.05 0.17 4.18 -0.73 -1.09 -1.89 115.58 115.07 2f1d h ASN 76 Ca -0.02 0.18 -0.00 0.00 1.87 0.00 0.00 56.30 58.33 2f1d h ASN 76 Cb 0.97 0.48 -0.01 0.00 0.27 0.00 0.00 38.32 40.03 2f1d h ASN 76 CO 0.07 -0.33 -0.14 -0.08 -0.37 0.00 0.00 177.43 176.58 2f1d h GLU 77 N -0.29 -0.31 -0.37 6.67 4.81 -1.22 -2.43 114.58 121.45 2f1d h GLU 77 Ca 0.15 0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.28 2f1d h GLU 77 Cb 0.54 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 2f1d h GLU 77 CO -0.48 -0.21 -0.26 -0.44 -0.73 0.00 0.00 179.01 176.89 2f1d h ASP 78 N -0.32 0.79 -0.26 1.04 3.32 -1.35 -0.39 116.42 119.25 2f1d h ASP 78 Ca -0.01 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2f1d h ASP 78 Cb 0.29 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2f1d h ASP 78 CO -0.01 1.01 0.17 0.40 -1.72 0.00 0.00 179.24 179.09 2f1d h ILE 79 N 0.66 1.07 -0.34 0.35 2.04 -1.35 -2.16 117.51 117.78 2f1d h ILE 79 Ca 0.08 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 2f1d h ILE 79 Cb 0.78 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2f1d h ILE 79 CO 0.06 0.06 0.06 0.00 0.00 0.00 0.00 178.15 178.34 2f1d h ALA 80 N 1.09 1.48 -0.09 1.87 0.00 -0.95 -1.44 119.26 121.22 2f1d h ALA 80 Ca 0.09 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 2f1d h ALA 80 Cb -0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 2f1d h ALA 80 CO -0.02 0.38 -0.73 -0.07 0.00 0.00 0.00 179.25 178.81 2f1d h LEU 81 N 0.49 0.52 -0.04 0.00 3.38 -0.96 -2.90 115.31 115.80 2f1d h LEU 81 Ca 0.11 -0.34 -0.21 0.00 0.09 0.00 0.00 57.88 57.53 2f1d h LEU 81 Cb 0.22 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2f1d h LEU 81 CO -0.00 1.08 -1.00 0.00 0.09 0.00 0.00 178.44 178.61 2f1d h ALA 82 N 0.91 0.37 -0.50 1.53 0.00 -1.08 -2.56 119.26 117.93 2f1d h ALA 82 Ca -0.03 -0.88 -0.07 0.00 0.00 0.00 0.00 54.91 53.93 2f1d h ALA 82 Cb 1.30 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2f1d h ALA 82 CO 0.13 1.19 0.05 0.82 0.00 0.00 0.00 179.25 181.44 2f1d h ILE 83 N 0.01 1.25 -0.66 0.00 2.04 -1.29 0.12 117.51 118.98 2f1d h ILE 83 Ca -0.02 -0.98 -0.03 0.00 1.00 0.00 0.00 64.86 64.82 2f1d h ILE 83 Cb 1.74 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 38.72 2f1d h ILE 83 CO 0.13 0.35 0.29 1.23 0.00 0.00 0.00 178.15 180.15 2f1d h GLY 84 N 0.71 1.04 1.77 5.37 0.00 -1.50 0.45 103.07 110.91 2f1d h GLY 84 Ca 0.15 -0.55 -0.13 0.00 0.00 0.00 0.00 47.33 46.80 2f1d h GLY 84 CO 0.01 0.52 -0.54 -0.84 0.00 0.00 0.00 176.54 175.69 2f1d h THR 85 N 0.93 1.36 -0.19 4.70 2.02 -1.29 -1.90 112.91 118.54 2f1d h THR 85 Ca 0.22 -1.83 -0.10 0.00 0.77 0.00 0.00 66.41 65.48 2f1d h THR 85 Cb 0.17 1.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 2f1d h THR 85 CO -0.02 0.54 -0.31 0.00 0.37 0.00 0.00 175.52 176.10 2f1d h ALA 86 N 1.25 1.11 -0.26 6.16 0.00 -0.55 -2.42 119.26 124.55 2f1d h ALA 86 Ca 0.00 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 2f1d h ALA 86 Cb 1.01 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2f1d h ALA 86 CO 0.08 0.56 -0.32 1.25 0.00 0.00 0.00 179.25 180.82 2f1d h LEU 87 N 0.34 0.57 -0.10 0.00 5.85 -0.26 -2.41 115.31 119.31 2f1d h LEU 87 Ca 0.04 -0.22 -0.17 0.00 0.84 0.00 0.00 57.88 58.37 2f1d h LEU 87 Cb 0.72 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.60 2f1d h LEU 87 CO 0.05 0.86 -0.58 0.25 -0.34 0.00 0.00 178.44 178.68 2f1d h LEU 88 N 0.47 0.69 -0.50 2.25 5.85 -1.14 -1.68 115.31 121.25 2f1d h LEU 88 Ca 0.06 -0.65 -0.01 0.00 0.84 0.00 0.00 57.88 58.11 2f1d h LEU 88 Cb 0.79 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 2f1d h LEU 88 CO 0.06 1.23 0.28 0.11 -0.34 0.00 0.00 178.44 179.78 2f1d h LYS 89 N 0.19 0.70 -0.89 1.25 1.57 -1.45 -2.76 116.57 115.19 2f1d h LYS 89 Ca -0.04 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 2f1d h LYS 89 Cb 1.23 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 33.36 2f1d h LYS 89 CO 0.12 0.55 0.53 0.00 -0.57 0.00 0.00 179.45 180.08 2f1d h ALA 90 N 1.12 1.27 0.00 3.86 0.00 -1.37 -3.11 119.26 121.03 2f1d h ALA 90 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2f1d h ALA 90 Cb 0.05 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.48 2f1d h ALA 90 CO -0.03 0.63 0.00 -0.07 0.00 0.00 0.00 179.25 179.78 2f1d h LEU 91 N 1.22 0.00 0.00 0.00 3.38 -1.00 -3.42 115.31 115.50 2f1d h LEU 91 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2f1d h LEU 91 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2f1d h LEU 91 CO -0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.08 2f1d n GLY 92 N 0.04 1.76 0.00 0.83 0.00 -1.18 -2.02 105.19 104.62 2f1d n GLY 92 Ca 0.01 -0.55 0.13 0.00 0.00 0.00 0.00 46.02 45.61 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 6.90 0.78 -2.93 1.61 -0.00 -1.26 -4.93 120.64 120.81 2f1d n GLU 93 Ca 0.00 0.01 -0.11 0.00 -0.00 0.00 0.00 57.16 57.05 2f1d n GLU 93 Cb 0.00 -1.50 0.06 0.00 -0.00 0.00 0.00 31.44 30.00 2f1d n GLU 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2f1d n ARG 94 N -1.04 -4.23 -3.05 3.44 1.74 -0.86 -4.98 116.66 107.68 2f1d n ARG 94 Ca 0.19 0.57 -0.43 0.00 -0.77 0.00 0.00 57.85 57.41 2f1d n ARG 94 Cb 0.11 -4.72 -0.06 0.00 -1.02 0.00 0.00 32.46 26.77 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 -4.84 3.24 -0.74 5.56 -0.14 -1.26 -4.29 119.74 117.27 2f1d s LYS 95 Ca 0.02 -0.52 0.00 0.00 -1.36 0.00 0.00 55.97 54.11 2f1d s LYS 95 Cb -0.00 -4.03 0.00 0.00 -1.68 0.00 0.00 37.83 32.12 2f1d s LYS 95 CO 0.49 -1.21 0.00 0.41 -0.76 0.00 0.00 175.35 174.28 2f1d n GLY 96 N 5.10 0.61 3.84 -3.33 0.00 -1.26 -4.99 105.19 105.16 2f1d n GLY 96 Ca -0.02 -0.66 -0.33 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.32 4.57 0.26 -0.61 -4.36 -1.26 -1.25 121.20 116.24 2f1d s ILE 97 Ca 0.00 1.15 -0.01 0.00 -0.26 0.00 0.00 60.65 61.53 2f1d s ILE 97 Cb 0.00 -3.63 0.24 0.00 1.25 0.00 0.00 42.46 40.33 2f1d s ILE 97 CO 0.00 -0.20 1.75 0.78 0.24 0.00 0.00 174.94 177.51 2f1d h ASN 98 N 2.21 0.48 0.00 4.36 2.35 -1.40 -3.44 115.58 120.14 2f1d h ASN 98 Ca -0.48 0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 2f1d h ASN 98 Cb 1.18 0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.57 2f1d h ASN 98 CO 0.64 0.19 0.00 -1.14 -1.65 0.00 0.00 177.43 175.47 2f1d n ARG 99 N -4.90 0.00 -4.26 0.81 0.63 -0.42 -4.94 116.66 103.57 2f1d n ARG 99 Ca 0.17 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.75 2f1d n ARG 99 Cb 0.45 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.26 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 -0.35 3.19 0.27 -0.14 0.40 -1.26 -1.94 117.98 118.16 2f1d s PHE 100 Ca 0.00 0.12 0.08 0.00 -0.60 0.00 0.00 56.93 56.53 2f1d s PHE 100 Cb 0.00 -1.89 -0.05 0.00 0.51 0.00 0.00 43.02 41.59 2f1d s PHE 100 CO 0.00 0.35 -0.11 0.20 0.70 0.00 0.00 175.22 176.36 2f1d s GLY 101 N -0.44 1.79 -0.30 4.36 0.00 -0.65 -3.72 107.32 108.36 2f1d s GLY 101 Ca 0.08 -1.86 -0.08 0.00 0.00 0.00 0.00 44.72 42.86 2f1d s GLY 101 CO 0.02 -1.87 0.90 -0.35 0.00 0.00 0.00 173.10 171.80 2f1d s ASP 102 N -3.45 -0.79 -0.04 1.64 2.15 -1.25 -1.10 116.67 113.82 2f1d s ASP 102 Ca 0.28 0.36 -0.02 0.00 0.43 0.00 0.00 52.55 53.60 2f1d s ASP 102 Cb 0.01 1.61 0.02 0.00 -0.30 0.00 0.00 42.92 44.26 2f1d s ASP 102 CO 0.12 -0.15 0.10 0.12 -0.17 0.00 0.00 175.17 175.19 2f1d s PHE 103 N 2.92 -0.10 -0.31 -5.34 5.36 -0.81 -4.91 117.98 114.79 2f1d s PHE 103 Ca 0.11 0.31 -0.08 0.00 -0.96 0.00 0.00 56.93 56.30 2f1d s PHE 103 Cb -0.10 -0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.53 2f1d s PHE 103 CO -0.17 -0.10 0.12 0.99 -1.46 0.00 0.00 175.22 174.60 2f1d s THR 104 N 0.66 4.29 -0.04 0.12 2.01 -1.26 -1.06 115.64 120.36 2f1d s THR 104 Ca -0.05 -0.59 0.06 0.00 0.31 0.00 0.00 61.69 61.42 2f1d s THR 104 Cb -0.07 -3.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.20 2f1d s THR 104 CO -0.03 0.05 -0.21 0.00 -0.69 0.00 0.00 174.62 173.74 2f1d s ALA 105 N 1.55 2.34 0.17 7.40 0.00 -0.80 -4.94 121.76 127.49 2f1d s ALA 105 Ca 0.03 -1.05 -0.00 0.00 0.00 0.00 0.00 51.96 50.94 2f1d s ALA 105 Cb -0.17 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.16 2f1d s ALA 105 CO 0.04 0.50 0.34 -1.25 0.00 0.00 0.00 175.76 175.40 2f1d s PRO 106 N -0.50 3.50 -0.21 0.00 0.04 -1.26 -2.09 135.00 134.48 2f1d s PRO 106 Ca 0.06 -0.40 -0.02 0.00 0.04 0.00 0.00 61.00 60.69 2f1d s PRO 106 Cb -0.11 -2.89 0.06 0.00 0.04 0.00 0.00 34.50 31.60 2f1d s PRO 106 CO 0.01 0.46 0.03 -1.17 0.04 0.00 0.00 177.00 176.37 2f1d s LEU 107 N -3.17 1.45 0.00 -3.56 2.96 -0.95 -4.98 118.68 110.43 2f1d s LEU 107 Ca 0.37 -0.95 0.00 0.00 -0.22 0.00 0.00 54.13 53.33 2f1d s LEU 107 Cb -0.11 -0.69 0.00 0.00 0.50 0.00 0.00 46.19 45.89 2f1d s LEU 107 CO 0.28 -0.31 0.00 0.47 -1.32 0.00 0.00 176.35 175.47 2f1d n ASP 108 N 4.99 0.00 0.11 3.68 8.00 -1.26 -1.80 116.55 130.27 2f1d n ASP 108 Ca -0.09 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.38 2f1d n ASP 108 Cb 0.46 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.65 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 0.02 -7.11 -1.24 9.09 -1.97 -3.45 114.58 109.92 2f1d h GLU 109 Ca 0.00 -0.02 -0.50 0.00 0.05 0.00 0.00 59.36 58.89 2f1d h GLU 109 Cb 0.00 0.00 0.08 0.00 -1.65 0.00 0.00 28.75 27.18 2f1d h GLU 109 CO 0.00 0.74 0.42 0.00 0.05 0.00 0.00 179.01 180.22 2f1d s ALA 110 N -3.38 2.65 -0.27 1.06 0.00 -0.74 -3.96 121.76 117.11 2f1d s ALA 110 Ca -0.01 0.77 -0.05 0.00 0.00 0.00 0.00 51.96 52.67 2f1d s ALA 110 Cb 0.12 -3.35 0.15 0.00 0.00 0.00 0.00 23.12 20.03 2f1d s ALA 110 CO 0.78 -0.88 0.54 -1.17 0.00 0.00 0.00 175.76 175.03 2f1d s LEU 111 N -4.03 -1.05 -0.07 0.00 2.96 -0.85 -2.25 118.68 113.40 2f1d s LEU 111 Ca 0.72 0.93 0.02 0.00 -0.22 0.00 0.00 54.13 55.58 2f1d s LEU 111 Cb -0.23 1.85 0.01 0.00 0.50 0.00 0.00 46.19 48.32 2f1d s LEU 111 CO 0.30 -0.25 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.31 2f1d s ILE 112 N 2.76 1.28 -0.13 6.68 -1.09 -0.89 -1.16 121.20 128.65 2f1d s ILE 112 Ca 0.09 -0.55 -0.07 0.00 -2.23 0.00 0.00 60.65 57.89 2f1d s ILE 112 Cb -0.14 -1.16 -0.04 0.00 -1.58 0.00 0.00 42.46 39.54 2f1d s ILE 112 CO -0.18 0.39 0.13 -2.28 -1.23 0.00 0.00 174.94 171.76 2f1d s HIS 113 N 0.69 3.53 -0.29 3.97 5.65 -0.09 -1.90 115.29 126.85 2f1d s HIS 113 Ca -0.14 0.47 -0.03 0.00 0.25 0.00 0.00 55.06 55.61 2f1d s HIS 113 Cb -0.16 -1.96 0.10 0.00 -1.18 0.00 0.00 32.58 29.38 2f1d s HIS 113 CO 0.04 0.65 0.12 0.08 -0.65 0.00 0.00 174.74 174.97 2f1d s VAL 114 N -0.82 0.24 -0.10 0.89 1.01 -0.22 -1.37 120.40 120.04 2f1d s VAL 114 Ca 0.14 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.14 2f1d s VAL 114 Cb -0.12 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 2f1d s VAL 114 CO 0.03 -0.68 0.10 -0.55 0.00 0.00 0.00 175.10 174.00 2f1d s SER 115 N 1.95 6.02 0.13 3.32 0.15 -0.94 -1.93 113.70 122.40 2f1d s SER 115 Ca 0.09 0.35 -0.12 0.00 0.70 0.00 0.00 55.95 56.96 2f1d s SER 115 Cb -0.16 -1.87 0.01 0.00 -1.71 0.00 0.00 66.02 62.29 2f1d s SER 115 CO -0.31 0.38 0.33 -1.48 1.20 0.00 0.00 173.24 173.36 2f1d s LEU 116 N -1.08 0.78 -0.21 3.45 0.05 -0.26 -1.49 118.68 119.92 2f1d s LEU 116 Ca 0.16 -0.57 -0.04 0.00 0.05 0.00 0.00 54.13 53.73 2f1d s LEU 116 Cb -0.12 1.50 0.11 0.00 -2.05 0.00 0.00 46.19 45.63 2f1d s LEU 116 CO 0.05 -0.86 0.33 -0.62 -0.55 0.00 0.00 176.35 174.71 2f1d s ASP 117 N -2.87 0.41 -1.20 1.48 2.15 -0.79 -1.63 116.67 114.22 2f1d s ASP 117 Ca 0.08 0.33 -0.21 0.00 0.43 0.00 0.00 52.55 53.17 2f1d s ASP 117 Cb 0.03 0.93 -0.03 0.00 -0.30 0.00 0.00 42.92 43.55 2f1d s ASP 117 CO -0.08 -0.28 1.85 -0.76 -0.17 0.00 0.00 175.17 175.73 2f1d s LEU 118 N 2.49 3.34 -0.09 -1.34 1.43 -0.82 -2.06 118.68 121.64 2f1d s LEU 118 Ca 0.07 -1.85 0.18 0.00 -1.03 0.00 0.00 54.13 51.51 2f1d s LEU 118 Cb -0.14 -2.58 -0.28 0.00 0.03 0.00 0.00 46.19 43.22 2f1d s LEU 118 CO -0.13 -2.35 0.29 -1.54 0.23 0.00 0.00 176.35 172.85 2f1d n SER 119 N 12.11 0.50 0.00 2.29 3.41 -1.14 -4.97 113.62 125.82 2f1d n SER 119 Ca 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 2f1d n SER 119 Cb 0.47 1.54 0.00 0.00 -0.26 0.00 0.00 64.21 65.95 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 1.57 0.72 3.13 5.00 0.00 -0.14 -5.04 105.19 110.43 2f1d n GLY 120 Ca -0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.76 2.64 -0.10 1.61 0.52 -1.23 -4.83 118.95 116.80 2f1d s ARG 121 Ca 0.00 -1.09 -0.30 0.00 -0.52 0.00 0.00 55.73 53.83 2f1d s ARG 121 Cb 0.00 -2.86 -0.03 0.00 0.52 0.00 0.00 34.95 32.59 2f1d s ARG 121 CO 0.00 -0.42 1.26 -1.25 0.02 0.00 0.00 175.30 174.91 2f1d s PRO 122 N 1.23 4.29 0.00 3.54 0.04 -1.26 -3.74 135.00 139.11 2f1d s PRO 122 Ca -0.02 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.73 2f1d s PRO 122 Cb -0.17 -3.66 -0.00 0.00 0.04 0.00 0.00 34.50 30.70 2f1d s PRO 122 CO -0.07 -0.59 -0.02 -0.47 0.04 0.00 0.00 177.00 175.90 2f1d s TYR 123 N 2.85 0.17 -0.27 0.56 5.04 -0.25 -4.94 117.35 120.50 2f1d s TYR 123 Ca 0.57 -0.12 -0.00 0.00 -2.44 0.00 0.00 57.07 55.08 2f1d s TYR 123 Cb -0.24 -0.11 0.08 0.00 0.35 0.00 0.00 41.96 42.04 2f1d s TYR 123 CO 0.19 -0.03 0.05 -1.17 -1.34 0.00 0.00 175.55 173.25 2f1d s LEU 124 N -0.30 2.31 -0.04 6.97 2.96 -1.26 -0.68 118.68 128.63 2f1d s LEU 124 Ca -0.02 -1.41 -0.24 0.00 -0.22 0.00 0.00 54.13 52.24 2f1d s LEU 124 Cb -0.02 -0.94 -0.04 0.00 0.50 0.00 0.00 46.19 45.68 2f1d s LEU 124 CO -0.00 -0.35 0.71 -0.83 -1.32 0.00 0.00 176.35 174.56 2f1d s GLY 125 N 1.56 2.66 -0.28 7.98 0.00 -0.91 -5.03 107.32 113.29 2f1d s GLY 125 Ca 0.04 0.16 -0.03 0.00 0.00 0.00 0.00 44.72 44.89 2f1d s GLY 125 CO -0.16 1.13 0.16 -0.47 0.00 0.00 0.00 173.10 173.76 2f1d s TYR 126 N 0.55 0.16 -0.77 1.90 5.04 -1.26 -1.81 117.35 121.15 2f1d s TYR 126 Ca 0.37 -0.68 0.03 0.00 -2.44 0.00 0.00 57.07 54.35 2f1d s TYR 126 Cb -0.18 -0.79 0.25 0.00 0.35 0.00 0.00 41.96 41.58 2f1d s TYR 126 CO 0.19 -0.82 0.87 0.09 -1.34 0.00 0.00 175.55 174.54 2f1d n ASN 127 N 5.26 4.27 -3.90 4.32 4.13 -0.45 -5.00 115.26 123.89 2f1d n ASN 127 Ca -0.05 -3.37 -0.23 0.00 1.68 0.00 0.00 54.58 52.61 2f1d n ASN 127 Cb 0.43 -0.86 -0.17 0.00 -1.54 0.00 0.00 39.78 37.65 2f1d n ASN 127 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2f1d s LEU 128 N -2.26 1.20 -0.32 3.41 2.96 -1.26 -2.00 118.68 120.41 2f1d s LEU 128 Ca 0.35 -0.20 0.01 0.00 -0.22 0.00 0.00 54.13 54.07 2f1d s LEU 128 Cb 0.07 -0.63 0.08 0.00 0.50 0.00 0.00 46.19 46.21 2f1d s LEU 128 CO -0.02 -0.08 0.02 -1.83 -1.32 0.00 0.00 176.35 173.12 2f1d s GLU 129 N 1.29 1.99 -0.30 1.98 -1.05 -1.26 -5.08 118.70 116.27 2f1d s GLU 129 Ca -0.04 -1.59 -0.15 0.00 -0.15 0.00 0.00 54.97 53.03 2f1d s GLU 129 Cb -0.14 -3.18 -0.03 0.00 -0.44 0.00 0.00 34.13 30.34 2f1d s GLU 129 CO -0.02 -0.79 0.39 0.42 0.95 0.00 0.00 175.26 176.21 2f1d s ILE 130 N 1.07 5.15 -1.01 1.83 1.01 -1.26 -5.00 121.20 122.99 2f1d s ILE 130 Ca 0.02 0.42 0.18 0.00 0.00 0.00 0.00 60.65 61.26 2f1d s ILE 130 Cb -0.20 -3.77 0.15 0.00 0.01 0.00 0.00 42.46 38.65 2f1d s ILE 130 CO -0.05 0.04 1.57 -0.81 0.00 0.00 0.00 174.94 175.69 2f1d n PRO 131 N 5.41 0.01 -4.46 2.79 -0.04 -1.26 -4.77 135.00 132.68 2f1d n PRO 131 Ca -0.08 0.19 -0.24 0.00 -0.04 0.00 0.00 63.50 63.33 2f1d n PRO 131 Cb 0.50 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 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 -2.99 2.42 -0.88 0.52 -4.23 -1.26 -5.05 115.64 104.17 2f1d s THR 132 Ca 0.09 -2.36 0.26 0.00 -1.18 0.00 0.00 61.69 58.50 2f1d s THR 132 Cb 0.12 -2.26 0.10 0.00 1.34 0.00 0.00 72.50 71.79 2f1d s THR 132 CO 0.32 -0.38 1.55 0.00 -0.54 0.00 0.00 174.62 175.57 2f1d n GLN 133 N -0.51 0.10 -3.66 3.99 6.02 -1.26 -4.74 117.38 117.32 2f1d n GLN 133 Ca -0.06 0.04 -0.09 0.00 -0.01 0.00 0.00 57.00 56.88 2f1d n GLN 133 Cb 0.60 -1.58 -0.08 0.00 1.02 0.00 0.00 30.24 30.20 2f1d n GLN 133 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2f1d s ARG 134 N -3.05 0.63 -0.22 -1.09 3.52 -1.26 -2.36 118.95 115.12 2f1d s ARG 134 Ca 0.10 1.03 -0.03 0.00 -0.13 0.00 0.00 55.73 56.71 2f1d s ARG 134 Cb 0.16 0.15 0.00 0.00 -1.56 0.00 0.00 34.95 33.70 2f1d s ARG 134 CO 0.66 -0.14 -0.07 0.14 -0.81 0.00 0.00 175.30 175.08 2f1d s VAL 135 N 1.27 3.06 0.00 7.11 -7.23 -1.08 -4.91 120.40 118.63 2f1d s VAL 135 Ca -0.08 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 59.43 2f1d s VAL 135 Cb -0.06 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.48 2f1d s VAL 135 CO -0.13 0.40 0.00 0.61 -0.31 0.00 0.00 175.10 175.67 2f1d n GLY 136 N 4.75 2.02 0.19 2.32 0.00 -1.26 -1.54 105.19 111.67 2f1d n GLY 136 Ca -0.18 0.37 0.02 0.00 0.00 0.00 0.00 46.02 46.22 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 0.62 -3.09 2.61 -2.24 -1.26 -5.01 114.28 105.91 2f1d n THR 137 Ca 0.00 -0.81 -0.42 0.00 -2.27 0.00 0.00 64.05 60.55 2f1d n THR 137 Cb 0.00 0.72 -0.06 0.00 -2.10 0.00 0.00 70.33 68.88 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 -0.74 3.17 0.07 4.78 5.04 -0.59 -4.99 117.35 124.08 2f1d s TYR 138 Ca 0.06 0.45 -0.33 0.00 -2.44 0.00 0.00 57.07 54.81 2f1d s TYR 138 Cb 0.04 -3.13 -0.13 0.00 0.35 0.00 0.00 41.96 39.09 2f1d s TYR 138 CO 0.05 -0.59 1.73 -3.47 -1.34 0.00 0.00 175.55 171.92 2f1d n ASP 139 N 6.05 3.40 0.21 4.32 -0.08 -1.26 -2.64 116.55 126.54 2f1d n ASP 139 Ca -0.01 1.03 0.14 0.00 -1.51 0.00 0.00 54.79 54.44 2f1d n ASP 139 Cb 0.49 -1.43 0.46 0.00 2.34 0.00 0.00 41.12 42.98 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 4.43 0.00 0.00 5.18 2.02 -1.76 -2.61 112.91 120.17 2f1d h THR 140 Ca -0.46 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.12 2f1d h THR 140 Cb 1.25 1.54 0.00 0.00 -1.74 0.00 0.00 68.15 69.21 2f1d h THR 140 CO 0.92 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.81 2f1d n GLN 141 N -2.81 0.09 0.03 6.66 6.02 -1.26 -3.26 117.38 122.84 2f1d n GLN 141 Ca 0.03 0.31 0.13 0.00 -0.01 0.00 0.00 57.00 57.45 2f1d n GLN 141 Cb 0.37 -1.66 0.38 0.00 1.02 0.00 0.00 30.24 30.35 2f1d n GLN 141 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2f1d n LEU 142 N -1.83 0.43 -0.17 1.08 4.32 -0.98 -3.38 117.00 116.47 2f1d n LEU 142 Ca 0.03 0.30 -0.10 0.00 -0.02 0.00 0.00 56.01 56.22 2f1d n LEU 142 Cb 0.21 -0.33 0.00 0.00 -1.62 0.00 0.00 43.42 41.68 2f1d n LEU 142 CO 0.17 0.00 0.77 0.58 -1.22 0.00 0.00 177.39 177.69 2f1d h VAL 143 N 0.00 1.27 -0.11 4.08 2.07 -1.75 -0.46 116.25 121.34 2f1d h VAL 143 Ca 0.00 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 2f1d h VAL 143 Cb 0.59 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 2f1d h VAL 143 CO 0.00 0.40 0.02 -0.08 0.02 0.00 0.00 177.57 177.93 2f1d h GLU 144 N 0.74 0.18 -0.20 1.57 4.81 -1.78 -2.80 114.58 117.10 2f1d h GLU 144 Ca 0.13 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2f1d h GLU 144 Cb 0.58 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 2f1d h GLU 144 CO 0.04 0.36 0.05 1.25 -0.73 0.00 0.00 179.01 179.98 2f1d h HIS 145 N -0.04 0.28 -0.32 0.92 2.76 -1.55 -1.13 115.15 116.07 2f1d h HIS 145 Ca 0.03 -0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.12 2f1d h HIS 145 Cb 0.27 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 2f1d h HIS 145 CO 0.01 0.25 -0.09 0.35 -1.30 0.00 0.00 177.93 177.15 2f1d h PHE 146 N 0.28 0.71 0.00 5.26 3.57 -0.97 -1.96 116.94 123.83 2f1d h PHE 146 Ca 0.07 -0.16 -0.08 0.00 3.53 0.00 0.00 57.97 61.33 2f1d h PHE 146 Cb 0.11 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 2f1d h PHE 146 CO 0.00 0.82 -0.40 0.74 -2.23 0.00 0.00 178.31 177.24 2f1d h PHE 147 N 0.40 0.00 -0.10 0.41 -1.00 -1.22 -2.51 116.94 112.93 2f1d h PHE 147 Ca 0.08 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.76 2f1d h PHE 147 Cb 0.60 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.16 2f1d h PHE 147 CO 0.05 0.40 -0.33 0.37 -1.61 0.00 0.00 178.31 177.19 2f1d h GLN 148 N 0.00 0.40 -0.19 1.51 5.75 -1.07 -2.23 115.11 119.29 2f1d h GLN 148 Ca -0.00 -0.30 -0.05 0.00 -0.15 0.00 0.00 58.65 58.14 2f1d h GLN 148 Cb 1.14 0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.74 2f1d h GLN 148 CO 0.05 0.92 -0.09 0.77 -2.65 0.00 0.00 178.83 177.83 2f1d h SER 149 N -0.04 0.41 -0.67 -0.69 0.02 -1.43 -1.85 113.55 109.31 2f1d h SER 149 Ca -0.01 -0.41 0.08 0.00 -0.84 0.00 0.00 61.79 60.61 2f1d h SER 149 Cb 0.96 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.34 2f1d h SER 149 CO 0.07 0.73 0.44 0.25 -1.14 0.00 0.00 176.83 177.19 2f1d h LEU 150 N 0.08 0.52 -0.43 5.07 6.46 -1.46 -2.02 115.31 123.54 2f1d h LEU 150 Ca 0.04 0.01 -0.17 0.00 -0.12 0.00 0.00 57.88 57.64 2f1d h LEU 150 Cb 0.58 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.39 2f1d h LEU 150 CO 0.03 0.32 -0.78 0.58 -0.62 0.00 0.00 178.44 177.97 2f1d h VAL 151 N 0.59 1.49 -0.01 1.05 2.07 -1.11 -2.77 116.25 117.56 2f1d h VAL 151 Ca 0.30 -2.49 -0.00 0.00 0.82 0.00 0.00 66.70 65.33 2f1d h VAL 151 Cb 0.41 2.35 -0.00 0.00 -1.52 0.00 0.00 31.29 32.53 2f1d h VAL 151 CO -0.10 0.72 -0.00 0.78 0.02 0.00 0.00 177.57 178.99 2f1d h ASN 152 N 0.08 0.02 0.64 0.57 2.35 -0.57 -2.68 115.58 115.99 2f1d h ASN 152 Ca -0.02 -0.35 -0.21 0.00 -0.55 0.00 0.00 56.30 55.17 2f1d h ASN 152 Cb 1.37 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.72 2f1d h ASN 152 CO 0.11 0.36 -0.94 0.71 -1.65 0.00 0.00 177.43 176.03 2f1d h THR 153 N -0.32 1.52 0.00 2.81 1.35 -1.68 -3.33 112.91 113.26 2f1d h THR 153 Ca 0.00 -2.78 -0.07 0.00 -0.55 0.00 0.00 66.41 63.01 2f1d h THR 153 Cb 0.35 2.58 -0.01 0.00 -1.73 0.00 0.00 68.15 69.34 2f1d h THR 153 CO 0.00 0.81 -0.35 -1.28 -0.25 0.00 0.00 175.52 174.45 2f1d h SER 154 N 0.09 0.00 -2.71 5.36 0.87 -1.51 -3.41 113.55 112.24 2f1d h SER 154 Ca -0.05 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.34 2f1d h SER 154 Cb 1.60 0.00 0.05 0.00 -0.44 0.00 0.00 62.40 63.61 2f1d h SER 154 CO 0.14 0.35 -0.27 0.61 -0.53 0.00 0.00 176.83 177.13 2f1d n GLY 155 N -0.18 0.27 3.60 5.77 0.00 -1.02 -4.76 105.19 108.87 2f1d n GLY 155 Ca -0.01 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 2f1d n GLY 155 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2f1d s MET 156 N -5.35 2.76 -0.27 1.61 -2.45 -1.16 -0.96 119.30 113.47 2f1d s MET 156 Ca 0.20 -0.55 -0.11 0.00 -1.25 0.00 0.00 55.69 53.98 2f1d s MET 156 Cb -0.09 -2.61 -0.05 0.00 1.25 0.00 0.00 34.83 33.33 2f1d s MET 156 CO 0.25 0.66 0.21 0.99 1.05 0.00 0.00 175.02 178.18 2f1d s THR 157 N -0.85 5.30 -0.10 10.11 2.01 -0.88 -1.09 115.64 130.14 2f1d s THR 157 Ca 0.13 0.22 -0.03 0.00 0.31 0.00 0.00 61.69 62.31 2f1d s THR 157 Cb -0.11 -3.55 0.04 0.00 0.01 0.00 0.00 72.50 68.90 2f1d s THR 157 CO 0.03 0.25 0.07 -0.22 -0.69 0.00 0.00 174.62 174.06 2f1d s LEU 158 N 1.71 0.23 -0.21 4.42 2.96 0.14 -1.88 118.68 126.06 2f1d s LEU 158 Ca 0.08 -0.24 -0.06 0.00 -0.22 0.00 0.00 54.13 53.68 2f1d s LEU 158 Cb -0.16 -0.19 -0.03 0.00 0.50 0.00 0.00 46.19 46.32 2f1d s LEU 158 CO 0.10 -0.30 0.04 -1.00 -1.32 0.00 0.00 176.35 173.87 2f1d s HIS 159 N 2.16 3.09 -0.24 5.38 3.76 -0.56 -2.14 115.29 126.74 2f1d s HIS 159 Ca 0.04 -0.34 0.02 0.00 -0.15 0.00 0.00 55.06 54.62 2f1d s HIS 159 Cb -0.14 -2.14 0.05 0.00 1.11 0.00 0.00 32.58 31.46 2f1d s HIS 159 CO -0.06 -0.21 -0.13 0.42 -0.85 0.00 0.00 174.74 173.92 2f1d s ILE 160 N 1.10 2.19 -0.13 0.60 1.01 -0.75 -2.21 121.20 123.01 2f1d s ILE 160 Ca 0.03 -1.44 0.01 0.00 0.00 0.00 0.00 60.65 59.25 2f1d s ILE 160 Cb -0.14 -2.20 -0.01 0.00 0.01 0.00 0.00 42.46 40.12 2f1d s ILE 160 CO 0.02 0.11 -0.16 -0.13 0.00 0.00 0.00 174.94 174.79 2f1d s ARG 161 N 1.16 3.29 -0.30 2.79 0.52 -0.47 -1.35 118.95 124.59 2f1d s ARG 161 Ca -0.05 -0.74 -0.20 0.00 -0.52 0.00 0.00 55.73 54.22 2f1d s ARG 161 Cb -0.18 -2.56 -0.01 0.00 0.52 0.00 0.00 34.95 32.72 2f1d s ARG 161 CO -0.07 0.17 0.63 -1.14 0.02 0.00 0.00 175.30 174.92 2f1d s GLN 162 N 0.43 3.92 0.03 3.54 0.74 -0.85 -0.91 119.66 126.56 2f1d s GLN 162 Ca -0.12 0.32 0.21 0.00 0.05 0.00 0.00 55.36 55.83 2f1d s GLN 162 Cb -0.16 -3.72 -0.21 0.00 1.10 0.00 0.00 33.01 30.02 2f1d s GLN 162 CO 0.05 -0.56 0.65 1.28 -0.55 0.00 0.00 175.29 176.16 2f1d n LEU 163 N 5.88 0.36 -3.52 3.68 4.77 -0.31 -5.01 117.00 122.85 2f1d n LEU 163 Ca -0.01 0.14 -0.08 0.00 -0.03 0.00 0.00 56.01 56.04 2f1d n LEU 163 Cb 0.49 0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 2f1d n LEU 163 CO 0.46 0.01 0.71 0.00 -1.33 0.00 0.00 177.39 177.24 2f1d s ALA 164 N -3.31 -1.83 0.00 -1.18 0.00 -1.06 -4.93 121.76 109.45 2f1d s ALA 164 Ca -0.05 1.01 0.00 0.00 0.00 0.00 0.00 51.96 52.91 2f1d s ALA 164 Cb 0.11 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.62 2f1d s ALA 164 CO 0.86 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 176.32 2f1d n GLY 165 N -0.25 4.31 1.38 0.00 0.00 -1.25 -2.01 105.19 107.38 2f1d n GLY 165 Ca -0.08 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2f1d n GLY 165 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2f1d n GLU 166 N -1.28 0.00 -2.33 1.61 1.02 -1.26 -4.96 120.64 113.44 2f1d n GLU 166 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 2f1d n GLU 166 Cb 0.00 -0.32 -0.03 0.00 -0.02 0.00 0.00 31.44 31.07 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 -5.31 6.99 0.18 1.62 3.84 -1.26 -4.75 114.94 116.25 2f1d s ASN 167 Ca 0.00 2.13 -0.07 0.00 0.21 0.00 0.00 52.86 55.13 2f1d s ASN 167 Cb 0.00 -2.58 0.08 0.00 -0.55 0.00 0.00 41.25 38.20 2f1d s ASN 167 CO 0.00 -0.54 1.55 0.28 -2.79 0.00 0.00 177.10 175.61 2f1d h SER 168 N 6.77 0.88 -0.59 -4.21 0.02 -1.98 -2.32 113.55 112.11 2f1d h SER 168 Ca -0.42 -0.36 0.03 0.00 -0.84 0.00 0.00 61.79 60.20 2f1d h SER 168 Cb 1.21 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.47 2f1d h SER 168 CO 0.83 1.11 0.35 -0.74 -1.14 0.00 0.00 176.83 177.25 2f1d h HIS 169 N 0.71 0.66 -0.49 3.45 6.17 -1.98 -2.72 115.15 120.95 2f1d h HIS 169 Ca 0.08 0.02 -0.10 0.00 0.71 0.00 0.00 60.37 61.08 2f1d h HIS 169 Cb 0.86 -0.21 -0.02 0.00 2.52 0.00 0.00 27.41 30.57 2f1d h HIS 169 CO 0.05 0.36 -0.09 0.45 0.71 0.00 0.00 177.93 179.42 2f1d h HIS 170 N 0.69 1.02 0.13 5.26 3.86 -1.89 -2.10 115.15 122.13 2f1d h HIS 170 Ca 0.24 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 59.24 2f1d h HIS 170 Cb 0.05 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.27 2f1d h HIS 170 CO -0.06 0.98 -0.06 0.82 0.86 0.00 0.00 177.93 180.47 2f1d h ILE 171 N 0.77 0.96 -0.50 2.45 2.04 -1.33 0.32 117.51 122.22 2f1d h ILE 171 Ca 0.13 -0.33 -0.07 0.00 1.00 0.00 0.00 64.86 65.59 2f1d h ILE 171 Cb 0.63 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 2f1d h ILE 171 CO 0.04 0.08 0.05 0.40 0.00 0.00 0.00 178.15 178.72 2f1d h ILE 172 N -0.33 1.26 -0.27 -0.67 2.04 -1.51 -0.89 117.51 117.13 2f1d h ILE 172 Ca -0.02 -0.99 -0.10 0.00 1.00 0.00 0.00 64.86 64.75 2f1d h ILE 172 Cb 0.26 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2f1d h ILE 172 CO 0.03 0.35 -0.26 -0.08 0.00 0.00 0.00 178.15 178.19 2f1d h GLU 173 N 0.71 0.53 -0.16 2.37 4.81 -1.30 -2.49 114.58 119.06 2f1d h GLU 173 Ca 0.15 -0.21 -0.13 0.00 -0.13 0.00 0.00 59.36 59.04 2f1d h GLU 173 Cb 0.45 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2f1d h GLU 173 CO 0.02 0.75 -0.44 0.00 -0.73 0.00 0.00 179.01 178.60 2f1d h ALA 174 N 1.25 0.94 -0.49 2.92 0.00 0.05 -1.41 119.26 122.52 2f1d h ALA 174 Ca 0.07 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 2f1d h ALA 174 Cb 0.70 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2f1d h ALA 174 CO 0.05 0.64 -0.11 1.15 0.00 0.00 0.00 179.25 180.98 2f1d h THR 175 N 0.32 1.26 -0.03 0.00 2.02 -0.95 -2.09 112.91 113.45 2f1d h THR 175 Ca 0.02 -1.23 -0.18 0.00 0.77 0.00 0.00 66.41 65.79 2f1d h THR 175 Cb 0.91 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 2f1d h THR 175 CO 0.08 0.43 -0.78 -0.26 0.37 0.00 0.00 175.52 175.35 2f1d h PHE 176 N 0.81 0.35 -0.59 3.16 -1.00 -1.21 -1.62 116.94 116.84 2f1d h PHE 176 Ca 0.13 -0.17 -0.10 0.00 2.81 0.00 0.00 57.97 60.64 2f1d h PHE 176 Cb 0.64 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 40.13 2f1d h PHE 176 CO 0.04 0.93 -0.02 0.87 -1.61 0.00 0.00 178.31 178.52 2f1d h LYS 177 N 0.16 1.05 0.00 1.51 1.57 -1.11 -1.31 116.57 118.44 2f1d h LYS 177 Ca -0.03 -0.34 -0.06 0.00 -1.87 0.00 0.00 60.65 58.35 2f1d h LYS 177 Cb 1.37 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.57 2f1d h LYS 177 CO 0.12 1.03 -0.35 0.00 -0.57 0.00 0.00 179.45 179.68 2f1d h ALA 178 N 1.01 0.80 -0.06 3.86 0.00 -1.38 -2.73 119.26 120.75 2f1d h ALA 178 Ca 0.17 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2f1d h ALA 178 Cb 0.57 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2f1d h ALA 178 CO 0.03 0.37 -0.16 0.35 0.00 0.00 0.00 179.25 179.84 2f1d h PHE 179 N 0.00 0.28 -0.33 0.00 3.57 -1.15 -2.47 116.94 116.84 2f1d h PHE 179 Ca -0.01 -0.11 -0.07 0.00 3.53 0.00 0.00 57.97 61.32 2f1d h PHE 179 Cb 1.23 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.90 2f1d h PHE 179 CO 0.00 0.77 -0.08 0.00 -2.23 0.00 0.00 178.31 176.76 2f1d h ALA 180 N 0.46 1.24 0.00 2.41 0.00 -1.23 0.12 119.26 122.26 2f1d h ALA 180 Ca -0.00 -0.26 -0.20 0.00 0.00 0.00 0.00 54.91 54.46 2f1d h ALA 180 Cb 0.76 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2f1d h ALA 180 CO 0.03 0.50 -1.15 0.00 0.00 0.00 0.00 179.25 178.63 2f1d h ARG 181 N 0.52 0.00 -0.15 0.00 3.08 -1.58 -2.71 114.38 113.54 2f1d h ARG 181 Ca 0.10 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.98 2f1d h ARG 181 Cb 0.46 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2f1d h ARG 181 CO 0.02 0.60 -0.61 0.00 -1.07 0.00 0.00 179.97 178.91 2f1d h ALA 182 N 1.21 0.67 -0.29 0.04 0.00 -1.09 -3.02 119.26 116.79 2f1d h ALA 182 Ca -0.11 -0.54 -0.10 0.00 0.00 0.00 0.00 54.91 54.16 2f1d h ALA 182 Cb 1.70 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 2f1d h ALA 182 CO 0.08 0.71 -0.20 1.25 0.00 0.00 0.00 179.25 181.09 2f1d h LEU 183 N 0.37 0.67 -0.26 0.00 6.46 -0.79 -2.61 115.31 119.15 2f1d h LEU 183 Ca -0.01 -0.44 0.06 0.00 -0.12 0.00 0.00 57.88 57.38 2f1d h LEU 183 Cb 1.16 -0.19 -0.07 0.00 -0.73 0.00 0.00 40.66 40.83 2f1d h LEU 183 CO 0.11 0.97 -0.20 -0.09 -0.62 0.00 0.00 178.44 178.62 2f1d h ARG 184 N 0.38 -0.18 -0.85 1.25 2.43 -1.54 -0.50 114.38 115.39 2f1d h ARG 184 Ca 0.06 0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.35 2f1d h ARG 184 Cb 0.75 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 30.26 2f1d h ARG 184 CO 0.05 -0.12 0.48 0.37 -1.51 0.00 0.00 179.97 179.25 2f1d h GLN 185 N -0.18 0.74 0.00 0.20 4.15 -1.43 -0.65 115.11 117.94 2f1d h GLN 185 Ca 0.14 -0.04 -0.14 0.00 0.77 0.00 0.00 58.65 59.38 2f1d h GLN 185 Cb 0.40 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.91 2f1d h GLN 185 CO -0.37 0.49 -0.66 0.00 -1.93 0.00 0.00 178.83 176.36 2f1d h ALA 186 N 1.49 0.76 0.00 3.38 0.00 -0.98 -3.23 119.26 120.68 2f1d h ALA 186 Ca 0.43 -0.60 -0.18 0.00 0.00 0.00 0.00 54.91 54.55 2f1d h ALA 186 Cb 0.46 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2f1d h ALA 186 CO -0.28 0.82 -1.24 1.79 0.00 0.00 0.00 179.25 180.34 2f1d h THR 187 N 0.00 0.75 -4.05 0.00 1.35 -0.81 -1.12 112.91 109.04 2f1d h THR 187 Ca -0.01 -2.31 -0.50 0.00 -0.55 0.00 0.00 66.41 63.05 2f1d h THR 187 Cb 1.29 2.26 0.19 0.00 -1.73 0.00 0.00 68.15 70.16 2f1d h THR 187 CO 0.09 0.43 0.19 -1.61 -0.25 0.00 0.00 175.52 174.36 2f1d s GLU 188 N -2.85 0.73 0.27 4.72 2.02 -0.28 -4.74 118.70 118.57 2f1d s GLU 188 Ca -0.01 1.32 -0.04 0.00 0.02 0.00 0.00 54.97 56.25 2f1d s GLU 188 Cb 0.08 -1.71 -0.05 0.00 0.10 0.00 0.00 34.13 32.55 2f1d s GLU 188 CO 0.80 -2.75 0.52 0.95 0.02 0.00 0.00 175.26 174.80 2f1d s THR 189 N -2.65 5.05 -0.19 3.63 -4.23 -1.26 -1.75 115.64 114.23 2f1d s THR 189 Ca 0.66 -0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 61.14 2f1d s THR 189 Cb -0.22 -3.73 -0.01 0.00 1.34 0.00 0.00 72.50 69.88 2f1d s THR 189 CO 0.59 -0.28 -0.06 -0.62 -0.54 0.00 0.00 174.62 173.71 2f1d s ASP 190 N -3.12 4.31 -0.91 3.99 -1.08 -0.38 -4.72 116.67 114.75 2f1d s ASP 190 Ca 0.43 -0.34 -0.26 0.00 -0.52 0.00 0.00 52.55 51.86 2f1d s ASP 190 Cb -0.11 -1.72 -0.15 0.00 -1.46 0.00 0.00 42.92 39.48 2f1d s ASP 190 CO 0.29 0.05 2.25 -2.84 0.52 0.00 0.00 175.17 175.45 2f1d s PRO 191 N 1.07 1.59 0.00 4.34 0.02 -1.26 -4.89 135.00 135.87 2f1d s PRO 191 Ca 0.01 0.06 0.28 0.00 0.02 0.00 0.00 61.00 61.37 2f1d s PRO 191 Cb -0.15 -4.89 1.13 0.00 0.02 0.00 0.00 34.50 30.62 2f1d s PRO 191 CO -0.01 -4.67 1.79 0.54 -0.33 0.00 0.00 177.00 174.33