#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 3.24 -0.11 1.61 0.52 -1.26 -5.01 118.95 117.94 2f1d s ARG 11 Ca 0.00 -1.38 0.01 0.00 -0.52 0.00 0.00 55.73 53.84 2f1d s ARG 11 Cb 0.00 -4.43 -0.01 0.00 0.52 0.00 0.00 34.95 31.03 2f1d s ARG 11 CO 0.00 -1.66 -0.16 0.42 0.02 0.00 0.00 175.30 173.93 2f1d s ILE 12 N 2.87 2.84 0.03 1.52 1.01 -1.26 -1.08 121.20 127.13 2f1d s ILE 12 Ca 0.20 -0.75 0.08 0.00 0.00 0.00 0.00 60.65 60.18 2f1d s ILE 12 Cb -0.16 -2.16 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 2f1d s ILE 12 CO 0.02 0.54 -0.21 -0.83 0.00 0.00 0.00 174.94 174.46 2f1d s GLY 13 N 0.21 1.48 -0.01 6.18 0.00 -0.98 -4.33 107.32 109.88 2f1d s GLY 13 Ca -0.10 -1.20 0.02 0.00 0.00 0.00 0.00 44.72 43.44 2f1d s GLY 13 CO 0.06 -1.07 -0.06 1.85 0.00 0.00 0.00 173.10 173.88 2f1d s GLU 14 N -1.25 0.54 -0.07 2.90 2.12 -1.26 -1.72 118.70 119.96 2f1d s GLU 14 Ca 0.13 -0.19 -0.03 0.00 0.36 0.00 0.00 54.97 55.24 2f1d s GLU 14 Cb -0.10 -0.54 0.04 0.00 0.26 0.00 0.00 34.13 33.79 2f1d s GLU 14 CO 0.03 0.09 0.13 0.08 -0.54 0.00 0.00 175.26 175.06 2f1d s VAL 15 N 0.06 -0.20 -0.10 3.70 1.01 0.30 -4.85 120.40 120.32 2f1d s VAL 15 Ca -0.00 0.34 -0.02 0.00 0.00 0.00 0.00 61.98 62.30 2f1d s VAL 15 Cb -0.05 -0.25 -0.03 0.00 0.00 0.00 0.00 36.38 36.05 2f1d s VAL 15 CO -0.00 0.14 -0.02 -1.59 0.00 0.00 0.00 175.10 173.64 2f1d s LYS 16 N 2.07 3.13 -0.27 2.72 0.00 -1.26 -1.02 119.74 125.12 2f1d s LYS 16 Ca 0.01 -0.45 -0.00 0.00 0.00 0.00 0.00 55.97 55.53 2f1d s LYS 16 Cb -0.12 -2.80 0.15 0.00 0.00 0.00 0.00 37.83 35.05 2f1d s LYS 16 CO -0.05 0.58 0.38 0.50 0.00 0.00 0.00 175.35 176.76 2f1d s ARG 17 N -0.55 0.38 -0.13 1.78 3.52 -0.19 -5.02 118.95 118.74 2f1d s ARG 17 Ca 0.09 0.30 -0.00 0.00 -0.13 0.00 0.00 55.73 55.98 2f1d s ARG 17 Cb -0.12 -0.42 -0.02 0.00 -1.56 0.00 0.00 34.95 32.84 2f1d s ARG 17 CO 0.02 -0.85 -0.11 0.08 -0.81 0.00 0.00 175.30 173.63 2f1d s VAL 18 N 2.53 3.21 0.41 7.11 1.01 -1.26 -2.44 120.40 130.97 2f1d s VAL 18 Ca 0.11 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.53 2f1d s VAL 18 Cb -0.14 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 2f1d s VAL 18 CO -0.24 0.53 0.16 0.42 0.00 0.00 0.00 175.10 175.97 2f1d s THR 19 N 0.23 0.44 0.48 3.92 -4.23 -0.99 -5.04 115.64 110.45 2f1d s THR 19 Ca -0.07 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.64 2f1d s THR 19 Cb -0.15 -2.32 0.37 0.00 1.34 0.00 0.00 72.50 71.74 2f1d s THR 19 CO 0.05 0.00 1.97 0.07 -0.54 0.00 0.00 174.62 176.17 2f1d h LYS 20 N 1.79 0.19 0.00 3.99 -0.00 -2.04 -3.31 116.57 117.20 2f1d h LYS 20 Ca -0.33 -0.01 -0.36 0.00 -0.00 0.00 0.00 60.65 59.95 2f1d h LYS 20 Cb 1.27 -0.04 -0.06 0.00 -0.00 0.00 0.00 32.23 33.39 2f1d h LYS 20 CO 0.52 0.13 -2.33 0.39 -0.00 0.00 0.00 179.45 178.15 2f1d n GLU 21 N -4.43 0.57 -4.43 0.07 1.02 -1.26 -5.04 120.64 107.14 2f1d n GLU 21 Ca 0.11 0.15 -0.21 0.00 -0.02 0.00 0.00 57.16 57.19 2f1d n GLU 21 Cb 0.53 -1.45 -0.10 0.00 -0.02 0.00 0.00 31.44 30.39 2f1d n GLU 21 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2f1d s THR 22 N -2.46 1.39 -0.25 2.62 -4.23 -1.25 -3.02 115.64 108.44 2f1d s THR 22 Ca -0.32 -2.05 -0.02 0.00 -1.18 0.00 0.00 61.69 58.12 2f1d s THR 22 Cb 0.09 -2.60 0.08 0.00 1.34 0.00 0.00 72.50 71.41 2f1d s THR 22 CO 0.52 -0.17 0.07 0.21 -0.54 0.00 0.00 174.62 174.70 2f1d s ASN 23 N -3.45 3.40 -0.05 3.99 3.84 0.45 -2.35 114.94 120.77 2f1d s ASN 23 Ca 0.32 -1.17 0.04 0.00 0.21 0.00 0.00 52.86 52.26 2f1d s ASN 23 Cb 0.06 -0.67 -0.00 0.00 -0.55 0.00 0.00 41.25 40.09 2f1d s ASN 23 CO 0.13 -0.36 -0.18 -0.69 -2.79 0.00 0.00 177.10 173.21 2f1d s VAL 24 N 1.80 1.50 -0.06 -5.21 1.01 -1.02 -2.15 120.40 116.26 2f1d s VAL 24 Ca 0.04 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 2f1d s VAL 24 Cb -0.17 -1.29 0.04 0.00 0.00 0.00 0.00 36.38 34.96 2f1d s VAL 24 CO -0.18 0.43 0.13 -0.55 0.00 0.00 0.00 175.10 174.94 2f1d s SER 25 N 0.06 0.25 -0.09 3.32 0.15 -0.95 -1.02 113.70 115.42 2f1d s SER 25 Ca -0.05 0.27 -0.04 0.00 0.70 0.00 0.00 55.95 56.83 2f1d s SER 25 Cb -0.12 0.17 0.05 0.00 -1.71 0.00 0.00 66.02 64.40 2f1d s SER 25 CO 0.03 -0.18 0.20 -0.69 1.20 0.00 0.00 173.24 173.79 2f1d s VAL 26 N 1.57 -0.14 -0.08 4.45 1.01 -0.18 -1.58 120.40 125.45 2f1d s VAL 26 Ca -0.05 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.16 2f1d s VAL 26 Cb -0.12 -0.32 0.02 0.00 0.00 0.00 0.00 36.38 35.96 2f1d s VAL 26 CO -0.05 0.09 -0.07 -0.54 0.00 0.00 0.00 175.10 174.53 2f1d s LYS 27 N 1.61 1.29 -0.09 2.72 1.02 -0.85 -0.54 119.74 124.89 2f1d s LYS 27 Ca -0.05 -0.21 0.03 0.00 0.02 0.00 0.00 55.97 55.76 2f1d s LYS 27 Cb -0.11 -1.31 0.01 0.00 -0.52 0.00 0.00 37.83 35.90 2f1d s LYS 27 CO -0.07 -0.17 -0.18 0.42 -0.92 0.00 0.00 175.35 174.43 2f1d s ILE 28 N 1.36 1.65 -0.32 2.17 1.01 -0.70 -1.73 121.20 124.64 2f1d s ILE 28 Ca -0.03 -0.77 -0.11 0.00 0.00 0.00 0.00 60.65 59.75 2f1d s ILE 28 Cb -0.14 -1.46 -0.01 0.00 0.01 0.00 0.00 42.46 40.86 2f1d s ILE 28 CO -0.03 0.47 0.18 0.21 0.00 0.00 0.00 174.94 175.77 2f1d s ASN 29 N 0.56 5.76 0.55 3.58 3.84 -0.57 -2.31 114.94 126.34 2f1d s ASN 29 Ca -0.15 -0.44 0.33 0.00 0.21 0.00 0.00 52.86 52.81 2f1d s ASN 29 Cb -0.17 -2.06 1.39 0.00 -0.55 0.00 0.00 41.25 39.87 2f1d s ASN 29 CO 0.05 -0.19 2.00 -0.07 -2.79 0.00 0.00 177.10 176.10 2f1d h LEU 30 N 8.40 0.00 -5.08 3.21 3.38 -1.44 -2.57 115.31 121.21 2f1d h LEU 30 Ca -0.32 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.03 2f1d h LEU 30 Cb 1.15 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.50 2f1d h LEU 30 CO 0.62 0.03 -0.44 0.47 0.09 0.00 0.00 178.44 179.20 2f1d n ASP 31 N -3.14 4.97 -1.53 -0.43 8.00 -1.26 -4.76 116.55 118.39 2f1d n ASP 31 Ca 0.00 -3.71 0.00 0.00 0.71 0.00 0.00 54.79 51.79 2f1d n ASP 31 Cb 0.30 -0.60 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 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 -0.33 0.73 0.00 0.44 0.00 -1.16 -4.66 105.19 100.21 2f1d n GLY 32 Ca 0.36 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.52 0.33 -0.91 2.61 5.66 -1.26 -4.65 114.28 115.54 2f1d n THR 33 Ca 0.00 -0.49 0.00 0.00 -3.05 0.00 0.00 64.05 60.51 2f1d n THR 33 Cb 0.00 1.01 0.00 0.00 -1.55 0.00 0.00 70.33 69.79 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 -0.16 0.66 3.66 1.09 0.00 -1.18 -4.93 105.19 104.32 2f1d n GLY 34 Ca 0.00 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 2f1d n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f1d s VAL 35 N -2.05 4.78 -0.43 1.61 1.01 -1.23 -4.61 120.40 119.49 2f1d s VAL 35 Ca 0.00 1.77 -0.15 0.00 0.00 0.00 0.00 61.98 63.60 2f1d s VAL 35 Cb 0.00 -4.20 0.04 0.00 0.00 0.00 0.00 36.38 32.22 2f1d s VAL 35 CO 0.00 -0.09 0.34 0.00 0.00 0.00 0.00 175.10 175.34 2f1d s ALA 36 N 2.82 3.51 -0.40 5.51 0.00 -1.26 -1.87 121.76 130.06 2f1d s ALA 36 Ca 0.39 -1.88 0.06 0.00 0.00 0.00 0.00 51.96 50.53 2f1d s ALA 36 Cb -0.16 -2.96 0.21 0.00 0.00 0.00 0.00 23.12 20.22 2f1d s ALA 36 CO 0.08 -1.57 0.45 -3.47 0.00 0.00 0.00 175.76 171.26 2f1d n ASP 37 N 5.17 -0.28 -4.28 0.00 4.64 -0.73 -5.03 116.55 116.03 2f1d n ASP 37 Ca -0.12 -2.57 -0.31 0.00 -1.38 0.00 0.00 54.79 50.42 2f1d n ASP 37 Cb 0.46 -0.49 -0.16 0.00 -1.04 0.00 0.00 41.12 39.89 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 -0.60 3.01 -0.30 1.67 0.01 -1.26 -1.83 113.70 114.39 2f1d s SER 38 Ca 0.34 -0.48 -0.02 0.00 1.31 0.00 0.00 55.95 57.10 2f1d s SER 38 Cb 0.11 -0.55 0.12 0.00 0.21 0.00 0.00 66.02 65.91 2f1d s SER 38 CO -0.15 0.28 0.19 -0.55 0.41 0.00 0.00 173.24 173.42 2f1d s SER 39 N -0.41 2.95 -0.03 2.44 0.15 -0.83 -4.96 113.70 113.02 2f1d s SER 39 Ca 0.04 -1.35 0.15 0.00 0.70 0.00 0.00 55.95 55.49 2f1d s SER 39 Cb -0.11 -0.14 -0.23 0.00 -1.71 0.00 0.00 66.02 63.83 2f1d s SER 39 CO 0.01 -0.40 0.32 -1.54 1.20 0.00 0.00 173.24 172.83 2f1d n SER 40 N 5.01 1.59 0.00 5.45 3.41 -1.26 -1.37 113.62 126.45 2f1d n SER 40 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 2f1d n SER 40 Cb 0.42 1.65 0.00 0.00 -0.26 0.00 0.00 64.21 66.02 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 1.68 0.63 2.93 5.00 0.00 -1.26 -4.42 105.19 109.74 2f1d n GLY 41 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.50 2.69 0.32 -0.61 1.01 -1.26 -5.00 121.20 115.84 2f1d s ILE 42 Ca 0.00 -3.70 0.11 0.00 0.00 0.00 0.00 60.65 57.07 2f1d s ILE 42 Cb 0.00 -2.83 0.36 0.00 0.01 0.00 0.00 42.46 40.01 2f1d s ILE 42 CO 0.00 -0.88 1.49 -2.65 0.00 0.00 0.00 174.94 172.90 2f1d n PRO 43 N 2.66 -0.07 -0.06 2.79 -0.02 -1.26 -1.36 135.00 137.69 2f1d n PRO 43 Ca 0.11 1.36 -0.15 0.00 -2.02 0.00 0.00 63.50 62.80 2f1d n PRO 43 Cb 0.33 -2.31 -0.06 0.00 -0.02 0.00 0.00 33.50 31.44 2f1d n PRO 43 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2f1d h PHE 44 N 0.00 0.81 -0.08 6.00 3.57 -1.94 -2.44 116.94 122.85 2f1d h PHE 44 Ca 0.70 -0.30 -0.02 0.00 3.53 0.00 0.00 57.97 61.88 2f1d h PHE 44 Cb 1.68 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 40.27 2f1d h PHE 44 CO -0.24 1.06 -0.04 1.25 -2.23 0.00 0.00 178.31 178.12 2f1d h LEU 45 N 0.32 0.10 -0.35 0.59 5.85 -1.65 -1.85 115.31 118.31 2f1d h LEU 45 Ca 0.00 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 2f1d h LEU 45 Cb 1.03 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 2f1d h LEU 45 CO 0.09 0.16 0.05 0.44 -0.34 0.00 0.00 178.44 178.85 2f1d h ASP 46 N 0.11 0.57 -0.78 1.25 3.32 -1.10 -1.77 116.42 118.01 2f1d h ASP 46 Ca 0.03 -0.26 0.07 0.00 0.02 0.00 0.00 57.03 56.88 2f1d h ASP 46 Cb 0.15 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.50 2f1d h ASP 46 CO 0.01 0.69 0.51 -0.74 -1.72 0.00 0.00 179.24 177.98 2f1d h HIS 47 N 0.42 0.84 0.02 4.55 2.76 -0.91 -1.06 115.15 121.78 2f1d h HIS 47 Ca 0.11 0.02 -0.21 0.00 -2.20 0.00 0.00 60.37 58.09 2f1d h HIS 47 Cb 0.37 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 29.03 2f1d h HIS 47 CO 0.03 0.44 -0.95 0.52 -1.30 0.00 0.00 177.93 176.66 2f1d h MET 48 N 0.83 0.13 0.00 5.26 2.86 -1.07 -2.86 114.93 120.07 2f1d h MET 48 Ca 0.34 -0.17 -0.12 0.00 -2.06 0.00 0.00 59.70 57.69 2f1d h MET 48 Cb 0.26 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 2f1d h MET 48 CO -0.12 0.98 -0.55 -0.07 1.06 0.00 0.00 176.91 178.21 2f1d h LEU 49 N 0.06 0.00 -0.75 1.22 3.38 -1.01 -2.44 115.31 115.77 2f1d h LEU 49 Ca -0.04 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 2f1d h LEU 49 Cb 1.63 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.36 2f1d h LEU 49 CO 0.14 0.55 -0.26 0.44 0.09 0.00 0.00 178.44 179.40 2f1d h ASP 50 N 0.00 0.68 0.74 -0.43 3.32 -1.06 -2.77 116.42 116.90 2f1d h ASP 50 Ca -0.01 -0.25 -0.13 0.00 0.02 0.00 0.00 57.03 56.67 2f1d h ASP 50 Cb 1.17 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 2f1d h ASP 50 CO 0.07 0.91 -0.60 1.56 -1.72 0.00 0.00 179.24 179.47 2f1d h GLN 51 N 0.58 0.00 -0.16 3.56 1.08 -1.34 -1.68 115.11 117.15 2f1d h GLN 51 Ca 0.08 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.27 2f1d h GLN 51 Cb 0.74 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.17 2f1d h GLN 51 CO 0.06 0.60 0.07 1.25 -0.95 0.00 0.00 178.83 179.85 2f1d h LEU 52 N 0.00 0.23 -0.72 1.46 5.85 -1.32 -2.20 115.31 118.60 2f1d h LEU 52 Ca -0.01 -0.16 -0.13 0.00 0.84 0.00 0.00 57.88 58.43 2f1d h LEU 52 Cb 1.13 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 2f1d h LEU 52 CO 0.08 0.32 -0.41 0.00 -0.34 0.00 0.00 178.44 178.10 2f1d h ALA 53 N 0.91 0.90 0.00 1.25 0.00 -1.38 -1.85 119.26 119.09 2f1d h ALA 53 Ca 0.05 -0.44 -0.18 0.00 0.00 0.00 0.00 54.91 54.35 2f1d h ALA 53 Cb 0.17 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2f1d h ALA 53 CO -0.00 0.64 -0.85 1.03 0.00 0.00 0.00 179.25 180.06 2f1d h SER 54 N 0.42 0.00 0.00 0.00 0.87 -1.28 -2.76 113.55 110.80 2f1d h SER 54 Ca 0.04 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.41 2f1d h SER 54 Cb 0.89 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.81 2f1d h SER 54 CO 0.08 0.85 -2.08 1.41 -0.53 0.00 0.00 176.83 176.56 2f1d n HIS 55 N -3.41 0.00 0.96 2.24 8.25 -0.83 -4.41 115.22 118.01 2f1d n HIS 55 Ca 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.58 2f1d n HIS 55 Cb 0.85 -0.70 0.13 0.00 1.12 0.00 0.00 29.99 31.39 2f1d n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2f1d n GLY 56 N 1.69 1.03 4.07 -1.41 0.00 -0.70 -4.49 105.19 105.38 2f1d n GLY 56 Ca -0.18 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 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 1.32 -1.45 -4.80 0.99 4.77 -1.05 -4.73 117.00 112.05 2f1d n LEU 57 Ca 0.15 -1.16 -0.23 0.00 -0.03 0.00 0.00 56.01 54.73 2f1d n LEU 57 Cb 0.59 -1.90 -0.05 0.00 -2.33 0.00 0.00 43.42 39.73 2f1d n LEU 57 CO 0.15 0.53 -0.20 -0.36 -1.33 0.00 0.00 177.39 176.19 2f1d s PHE 58 N -3.95 3.08 -0.21 -1.77 0.40 -1.19 -2.99 117.98 111.34 2f1d s PHE 58 Ca 0.17 -0.10 -0.09 0.00 -0.60 0.00 0.00 56.93 56.30 2f1d s PHE 58 Cb -0.08 -1.41 -0.05 0.00 0.51 0.00 0.00 43.02 42.00 2f1d s PHE 58 CO 0.94 0.53 0.12 -0.51 0.70 0.00 0.00 175.22 177.00 2f1d s ASP 59 N -3.64 5.92 -0.16 1.36 1.01 -0.97 -3.10 116.67 117.09 2f1d s ASP 59 Ca 0.32 0.11 -0.00 0.00 0.71 0.00 0.00 52.55 53.69 2f1d s ASP 59 Cb -0.08 -2.04 0.04 0.00 1.01 0.00 0.00 42.92 41.84 2f1d s ASP 59 CO 0.24 0.12 -0.07 -0.69 0.21 0.00 0.00 175.17 174.99 2f1d s VAL 60 N 0.70 1.17 -0.13 -1.27 1.01 -0.78 -1.51 120.40 119.60 2f1d s VAL 60 Ca 0.06 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.46 2f1d s VAL 60 Cb -0.13 -1.30 0.00 0.00 0.00 0.00 0.00 36.38 34.96 2f1d s VAL 60 CO 0.01 0.19 -0.21 -2.28 0.00 0.00 0.00 175.10 172.82 2f1d s HIS 61 N 1.61 2.66 0.01 5.22 2.46 -0.71 -1.77 115.29 124.77 2f1d s HIS 61 Ca 0.01 -1.11 0.00 0.00 0.47 0.00 0.00 55.06 54.43 2f1d s HIS 61 Cb -0.15 -1.79 -0.01 0.00 -0.13 0.00 0.00 32.58 30.50 2f1d s HIS 61 CO -0.08 -0.48 -0.01 0.08 -2.47 0.00 0.00 174.74 171.78 2f1d s VAL 62 N 0.59 0.04 -0.11 0.89 1.01 -0.76 -2.02 120.40 120.04 2f1d s VAL 62 Ca -0.12 -0.24 -0.04 0.00 0.00 0.00 0.00 61.98 61.59 2f1d s VAL 62 Cb -0.16 -0.08 0.06 0.00 0.00 0.00 0.00 36.38 36.19 2f1d s VAL 62 CO 0.03 -0.12 0.23 -0.60 0.00 0.00 0.00 175.10 174.64 2f1d s ARG 63 N -0.37 0.11 0.02 2.72 6.06 -0.61 -1.96 118.95 124.91 2f1d s ARG 63 Ca -0.04 0.68 0.00 0.00 -2.50 0.00 0.00 55.73 53.87 2f1d s ARG 63 Cb -0.03 -0.11 -0.02 0.00 0.06 0.00 0.00 34.95 34.86 2f1d s ARG 63 CO -0.00 -0.29 -0.02 0.00 -2.50 0.00 0.00 175.30 172.49 2f1d s ALA 64 N 2.33 0.09 -0.04 6.12 0.00 -0.47 -2.23 121.76 127.56 2f1d s ALA 64 Ca 0.01 -0.45 -0.02 0.00 0.00 0.00 0.00 51.96 51.51 2f1d s ALA 64 Cb -0.12 0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.14 2f1d s ALA 64 CO -0.08 -0.12 0.10 0.99 0.00 0.00 0.00 175.76 176.65 2f1d s THR 65 N -1.10 -0.04 0.08 0.00 2.01 -0.91 -4.47 115.64 111.21 2f1d s THR 65 Ca -0.12 0.16 -0.02 0.00 0.31 0.00 0.00 61.69 62.02 2f1d s THR 65 Cb -0.08 -0.17 0.01 0.00 0.01 0.00 0.00 72.50 72.28 2f1d s THR 65 CO -0.01 0.07 0.15 0.61 -0.69 0.00 0.00 174.62 174.75 2f1d n GLY 66 N 4.01 2.22 0.93 4.40 0.00 -1.26 -0.41 105.19 115.08 2f1d n GLY 66 Ca -0.25 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2f1d n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f1d n ASP 67 N -1.47 0.78 -0.48 1.61 8.00 -1.17 -4.54 116.55 119.27 2f1d n ASP 67 Ca -0.01 -0.57 0.40 0.00 0.71 0.00 0.00 54.79 55.32 2f1d n ASP 67 Cb 0.13 -0.14 0.68 0.00 -0.02 0.00 0.00 41.12 41.77 2f1d n ASP 67 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2f1d h VAL 68 N 0.62 0.08 -0.94 2.53 2.07 -1.93 0.32 116.25 119.00 2f1d h VAL 68 Ca 0.00 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.59 2f1d h VAL 68 Cb 0.26 0.03 -0.07 0.00 -1.52 0.00 0.00 31.29 29.99 2f1d h VAL 68 CO 0.00 0.01 0.61 1.12 0.02 0.00 0.00 177.57 179.33 2f1d h HIS 69 N 0.05 1.07 0.30 1.57 2.07 -2.01 -3.05 115.15 115.15 2f1d h HIS 69 Ca 0.85 0.03 -0.01 0.00 -2.85 0.00 0.00 60.37 58.38 2f1d h HIS 69 Cb 2.80 -0.35 0.00 0.00 2.57 0.00 0.00 27.41 32.44 2f1d h HIS 69 CO -0.00 0.50 -0.15 0.82 -3.07 0.00 0.00 177.93 176.03 2f1d h ILE 70 N 1.00 0.00 -2.71 6.12 2.04 -0.74 -3.50 117.51 119.72 2f1d h ILE 70 Ca 0.43 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 66.32 2f1d h ILE 70 Cb 0.34 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.33 2f1d h ILE 70 CO -0.19 0.00 0.33 -0.62 0.00 0.00 0.00 178.15 177.67 2f1d s ASP 71 N -2.90 -0.32 0.03 1.72 2.15 -1.15 -5.05 116.67 111.15 2f1d s ASP 71 Ca -0.06 -0.33 0.27 0.00 0.43 0.00 0.00 52.55 52.86 2f1d s ASP 71 Cb 0.01 0.58 0.85 0.00 -0.30 0.00 0.00 42.92 44.06 2f1d s ASP 71 CO 0.18 -1.03 1.67 0.47 -0.17 0.00 0.00 175.17 176.28 2f1d n ASP 72 N -0.41 0.32 -0.10 -0.34 8.00 -1.26 -3.91 116.55 118.85 2f1d n ASP 72 Ca -0.08 0.20 -0.06 0.00 0.71 0.00 0.00 54.79 55.56 2f1d n ASP 72 Cb 0.61 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 2f1d n ASP 72 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 2f1d h HIS 73 N 0.00 -0.44 -0.35 1.24 2.76 -1.95 -1.33 115.15 115.08 2f1d h HIS 73 Ca 0.00 0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.14 2f1d h HIS 73 Cb 0.55 0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.74 2f1d h HIS 73 CO 0.00 -0.25 -0.04 0.45 -1.30 0.00 0.00 177.93 176.79 2f1d h HIS 74 N -0.12 0.72 -0.55 5.26 3.86 -1.96 -1.97 115.15 120.40 2f1d h HIS 74 Ca 0.18 -0.14 -0.08 0.00 -1.16 0.00 0.00 60.37 59.17 2f1d h HIS 74 Cb 0.39 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 2f1d h HIS 74 CO -0.40 0.78 0.05 1.15 0.86 0.00 0.00 177.93 180.37 2f1d h THR 75 N 0.45 1.26 -0.49 2.45 2.02 -1.81 -2.06 112.91 114.72 2f1d h THR 75 Ca 0.09 -1.04 -0.08 0.00 0.77 0.00 0.00 66.41 66.16 2f1d h THR 75 Cb 0.52 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 2f1d h THR 75 CO 0.03 0.37 -0.01 -1.13 0.37 0.00 0.00 175.52 175.14 2f1d h ASN 76 N 0.82 0.80 0.05 4.18 -0.73 -1.14 -1.86 115.58 117.69 2f1d h ASN 76 Ca 0.16 -0.20 -0.13 0.00 1.87 0.00 0.00 56.30 58.00 2f1d h ASN 76 Cb 0.47 -0.21 0.01 0.00 0.27 0.00 0.00 38.32 38.86 2f1d h ASN 76 CO 0.02 0.87 -0.55 -0.08 -0.37 0.00 0.00 177.43 177.33 2f1d h GLU 77 N 0.77 0.28 -0.37 6.67 4.81 -1.31 -2.85 114.58 122.56 2f1d h GLU 77 Ca 0.15 -0.37 -0.06 0.00 -0.13 0.00 0.00 59.36 58.94 2f1d h GLU 77 Cb 0.48 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 2f1d h GLU 77 CO 0.02 1.11 -0.04 -0.44 -0.73 0.00 0.00 179.01 178.93 2f1d h ASP 78 N -0.38 0.58 -0.38 1.04 3.32 -1.38 0.42 116.42 119.64 2f1d h ASP 78 Ca -0.08 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 56.73 2f1d h ASP 78 Cb 1.34 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2f1d h ASP 78 CO 0.10 0.68 -0.18 0.40 -1.72 0.00 0.00 179.24 178.52 2f1d h ILE 79 N 0.57 1.28 -0.55 0.35 2.04 -1.43 -1.99 117.51 117.78 2f1d h ILE 79 Ca 0.11 -1.31 -0.07 0.00 1.00 0.00 0.00 64.86 64.59 2f1d h ILE 79 Cb 0.42 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 2f1d h ILE 79 CO 0.02 0.43 0.05 0.00 0.00 0.00 0.00 178.15 178.66 2f1d h ALA 80 N 0.80 0.74 -0.11 1.87 0.00 -1.21 -1.93 119.26 119.42 2f1d h ALA 80 Ca 0.08 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 2f1d h ALA 80 Cb 0.73 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2f1d h ALA 80 CO 0.05 0.52 -0.29 -0.07 0.00 0.00 0.00 179.25 179.47 2f1d h LEU 81 N 0.83 0.20 -0.47 0.00 3.38 -0.85 -2.04 115.31 116.37 2f1d h LEU 81 Ca 0.16 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.90 2f1d h LEU 81 Cb 0.46 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 2f1d h LEU 81 CO 0.02 0.49 -0.63 0.00 0.09 0.00 0.00 178.44 178.41 2f1d h ALA 82 N 1.53 0.65 -0.27 1.53 0.00 -1.14 -2.86 119.26 118.69 2f1d h ALA 82 Ca 0.03 -0.55 -0.11 0.00 0.00 0.00 0.00 54.91 54.27 2f1d h ALA 82 Cb 0.61 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2f1d h ALA 82 CO 0.04 0.72 -0.30 0.82 0.00 0.00 0.00 179.25 180.53 2f1d h ILE 83 N 0.36 1.28 -0.20 0.00 2.04 -0.78 -0.69 117.51 119.52 2f1d h ILE 83 Ca -0.01 -1.40 -0.15 0.00 1.00 0.00 0.00 64.86 64.30 2f1d h ILE 83 Cb 1.19 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 2f1d h ILE 83 CO 0.11 0.44 -0.50 1.23 0.00 0.00 0.00 178.15 179.44 2f1d h GLY 84 N 1.03 0.61 0.72 5.37 0.00 -1.41 -0.41 103.07 108.98 2f1d h GLY 84 Ca 0.06 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 46.68 2f1d h GLY 84 CO 0.06 0.61 -0.06 -0.84 0.00 0.00 0.00 176.54 176.31 2f1d h THR 85 N 0.44 1.32 -0.53 4.70 2.02 -1.38 -2.03 112.91 117.45 2f1d h THR 85 Ca 0.02 -1.09 0.02 0.00 0.77 0.00 0.00 66.41 66.13 2f1d h THR 85 Cb 1.03 1.78 -0.03 0.00 -1.74 0.00 0.00 68.15 69.19 2f1d h THR 85 CO 0.10 0.31 0.35 0.00 0.37 0.00 0.00 175.52 176.65 2f1d h ALA 86 N 0.65 1.69 -0.01 6.16 0.00 -1.10 -1.55 119.26 125.10 2f1d h ALA 86 Ca 0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2f1d h ALA 86 Cb 0.52 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2f1d h ALA 86 CO 0.02 0.27 0.00 1.25 0.00 0.00 0.00 179.25 180.79 2f1d h LEU 87 N 0.65 0.01 -0.35 0.00 5.85 -0.92 -1.78 115.31 118.77 2f1d h LEU 87 Ca 0.20 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.72 2f1d h LEU 87 Cb 0.02 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2f1d h LEU 87 CO -0.05 0.24 0.17 0.25 -0.34 0.00 0.00 178.44 178.70 2f1d h LEU 88 N -0.21 0.24 -0.06 2.25 5.85 -0.69 -1.89 115.31 120.80 2f1d h LEU 88 Ca 0.00 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.75 2f1d h LEU 88 Cb 0.23 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2f1d h LEU 88 CO 0.00 0.18 0.02 0.11 -0.34 0.00 0.00 178.44 178.40 2f1d h LYS 89 N 0.35 0.04 -0.05 1.25 1.57 -1.28 -2.61 116.57 115.83 2f1d h LYS 89 Ca 0.15 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.94 2f1d h LYS 89 Cb 0.07 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 2f1d h LYS 89 CO -0.11 0.03 0.04 0.00 -0.57 0.00 0.00 179.45 178.84 2f1d h ALA 90 N 1.04 1.95 0.00 3.86 0.00 -0.97 -2.75 119.26 122.38 2f1d h ALA 90 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2f1d h ALA 90 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2f1d h ALA 90 CO -0.03 -0.07 0.00 -0.07 0.00 0.00 0.00 179.25 179.08 2f1d h LEU 91 N 0.00 0.00 0.00 0.00 3.38 -0.95 -3.40 115.31 114.33 2f1d h LEU 91 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2f1d h LEU 91 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2f1d h LEU 91 CO -0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2f1d n GLY 92 N 1.12 1.30 1.26 0.83 0.00 -1.04 -2.00 105.19 106.66 2f1d n GLY 92 Ca 0.05 -0.55 -0.01 0.00 0.00 0.00 0.00 46.02 45.51 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 2.65 2.36 -3.48 1.61 0.00 -1.26 -4.93 120.64 117.59 2f1d n GLU 93 Ca 0.00 -1.38 -0.18 0.00 0.00 0.00 0.00 57.16 55.60 2f1d n GLU 93 Cb 0.00 -1.74 0.07 0.00 0.00 0.00 0.00 31.44 29.77 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 0.11 -5.32 -2.74 3.44 1.74 -0.85 -4.93 116.66 108.13 2f1d n ARG 94 Ca 0.17 0.78 -0.42 0.00 -0.77 0.00 0.00 57.85 57.61 2f1d n ARG 94 Cb 0.79 -5.63 -0.03 0.00 -1.02 0.00 0.00 32.46 26.56 2f1d n ARG 94 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2f1d s LYS 95 N -5.38 4.41 -1.94 5.56 -0.14 -1.26 -4.29 119.74 116.70 2f1d s LYS 95 Ca 0.09 1.31 0.00 0.00 -1.36 0.00 0.00 55.97 56.01 2f1d s LYS 95 Cb -0.02 -3.54 0.00 0.00 -1.68 0.00 0.00 37.83 32.59 2f1d s LYS 95 CO 0.76 -0.29 0.00 0.41 -0.76 0.00 0.00 175.35 175.46 2f1d n GLY 96 N 3.15 1.19 3.87 -3.33 0.00 -1.26 -4.97 105.19 103.83 2f1d n GLY 96 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.73 4.77 0.28 -0.61 -4.36 -1.26 -1.29 121.20 116.00 2f1d s ILE 97 Ca 0.00 0.68 0.01 0.00 -0.26 0.00 0.00 60.65 61.08 2f1d s ILE 97 Cb 0.00 -3.70 0.27 0.00 1.25 0.00 0.00 42.46 40.28 2f1d s ILE 97 CO 0.00 -0.42 1.82 0.78 0.24 0.00 0.00 174.94 177.36 2f1d h ASN 98 N 1.55 0.83 0.00 4.36 2.35 -1.46 -3.43 115.58 119.78 2f1d h ASN 98 Ca -0.47 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 2f1d h ASN 98 Cb 1.18 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.45 2f1d h ASN 98 CO 0.64 0.42 0.00 -1.14 -1.65 0.00 0.00 177.43 175.70 2f1d n ARG 99 N -4.68 0.00 -4.33 0.81 0.63 -0.96 -4.93 116.66 103.20 2f1d n ARG 99 Ca 0.19 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.86 2f1d n ARG 99 Cb 0.39 -1.33 -0.09 0.00 0.45 0.00 0.00 32.46 31.88 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 -0.40 2.56 -0.04 -0.14 0.40 -1.26 -1.02 117.98 118.09 2f1d s PHE 100 Ca 0.00 -0.25 -0.04 0.00 -0.60 0.00 0.00 56.93 56.04 2f1d s PHE 100 Cb 0.00 -1.22 0.01 0.00 0.51 0.00 0.00 43.02 42.32 2f1d s PHE 100 CO 0.00 0.55 0.10 0.20 0.70 0.00 0.00 175.22 176.77 2f1d s GLY 101 N -3.01 -0.07 -0.17 4.36 0.00 -0.26 -3.39 107.32 104.79 2f1d s GLY 101 Ca 0.26 0.27 -0.06 0.00 0.00 0.00 0.00 44.72 45.19 2f1d s GLY 101 CO 0.15 0.22 0.34 -0.35 0.00 0.00 0.00 173.10 173.46 2f1d s ASP 102 N -0.02 0.07 -0.25 1.64 2.15 -1.26 -0.90 116.67 118.10 2f1d s ASP 102 Ca -0.01 0.77 -0.17 0.00 0.43 0.00 0.00 52.55 53.57 2f1d s ASP 102 Cb -0.01 1.02 0.07 0.00 -0.30 0.00 0.00 42.92 43.69 2f1d s ASP 102 CO 0.00 -0.24 0.63 0.12 -0.17 0.00 0.00 175.17 175.52 2f1d s PHE 103 N 2.51 -0.88 -0.36 -5.34 5.36 -0.80 -4.92 117.98 113.56 2f1d s PHE 103 Ca 0.00 1.87 -0.03 0.00 -0.96 0.00 0.00 56.93 57.81 2f1d s PHE 103 Cb -0.12 0.45 0.08 0.00 -0.34 0.00 0.00 43.02 43.08 2f1d s PHE 103 CO -0.11 -0.44 0.11 0.99 -1.46 0.00 0.00 175.22 174.32 2f1d s THR 104 N 1.16 3.26 -0.08 0.12 2.01 -1.26 -1.59 115.64 119.26 2f1d s THR 104 Ca -0.06 -1.65 -0.14 0.00 0.31 0.00 0.00 61.69 60.14 2f1d s THR 104 Cb -0.05 -3.04 -0.05 0.00 0.01 0.00 0.00 72.50 69.36 2f1d s THR 104 CO -0.12 -0.39 0.35 0.00 -0.69 0.00 0.00 174.62 173.78 2f1d s ALA 105 N 1.23 3.65 0.18 7.40 0.00 -0.79 -4.92 121.76 128.50 2f1d s ALA 105 Ca 0.02 -0.33 0.04 0.00 0.00 0.00 0.00 51.96 51.68 2f1d s ALA 105 Cb -0.21 -2.39 -0.03 0.00 0.00 0.00 0.00 23.12 20.49 2f1d s ALA 105 CO -0.02 0.30 0.25 -1.25 0.00 0.00 0.00 175.76 175.04 2f1d s PRO 106 N -0.32 3.26 -0.35 0.00 0.04 -1.26 -1.39 135.00 134.97 2f1d s PRO 106 Ca 0.21 -0.74 0.01 0.00 0.04 0.00 0.00 61.00 60.52 2f1d s PRO 106 Cb -0.15 -2.83 0.14 0.00 0.04 0.00 0.00 34.50 31.70 2f1d s PRO 106 CO 0.09 0.48 0.30 -1.17 0.04 0.00 0.00 177.00 176.74 2f1d s LEU 107 N -3.39 0.29 0.00 -3.56 2.96 -0.87 -4.97 118.68 109.14 2f1d s LEU 107 Ca 0.33 -1.65 0.00 0.00 -0.22 0.00 0.00 54.13 52.59 2f1d s LEU 107 Cb -0.10 0.19 0.00 0.00 0.50 0.00 0.00 46.19 46.78 2f1d s LEU 107 CO 0.27 -0.30 0.00 0.47 -1.32 0.00 0.00 176.35 175.47 2f1d n ASP 108 N 4.38 0.00 -0.01 3.68 8.00 -1.26 -2.49 116.55 128.85 2f1d n ASP 108 Ca 0.09 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.72 2f1d n ASP 108 Cb 0.42 0.00 0.57 0.00 -0.02 0.00 0.00 41.12 42.10 2f1d n ASP 108 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2f1d n GLU 109 N 14.00 0.11 -2.56 -1.24 0.00 -1.26 -4.80 120.64 124.89 2f1d n GLU 109 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 57.16 56.86 2f1d n GLU 109 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 29.94 2f1d n GLU 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2f1d s ALA 110 N -2.90 3.37 -0.30 -1.84 0.00 -1.04 -3.30 121.76 115.75 2f1d s ALA 110 Ca 0.17 -0.47 -0.07 0.00 0.00 0.00 0.00 51.96 51.58 2f1d s ALA 110 Cb 0.19 -2.63 0.16 0.00 0.00 0.00 0.00 23.12 20.84 2f1d s ALA 110 CO 0.55 -0.39 0.71 -1.17 0.00 0.00 0.00 175.76 175.45 2f1d s LEU 111 N -4.79 -1.11 -0.04 0.00 2.96 -1.03 -2.06 118.68 112.60 2f1d s LEU 111 Ca 0.48 1.11 0.05 0.00 -0.22 0.00 0.00 54.13 55.55 2f1d s LEU 111 Cb -0.10 2.10 -0.01 0.00 0.50 0.00 0.00 46.19 48.68 2f1d s LEU 111 CO 0.46 -0.21 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.46 2f1d s ILE 112 N 2.83 1.58 -0.17 6.68 -1.09 -0.49 -1.33 121.20 129.22 2f1d s ILE 112 Ca 0.05 -0.81 -0.04 0.00 -2.23 0.00 0.00 60.65 57.62 2f1d s ILE 112 Cb -0.12 -1.35 -0.02 0.00 -1.58 0.00 0.00 42.46 39.38 2f1d s ILE 112 CO -0.19 0.45 -0.03 -2.28 -1.23 0.00 0.00 174.94 171.66 2f1d s HIS 113 N -0.07 3.01 -0.12 3.97 5.65 -0.69 -1.89 115.29 125.15 2f1d s HIS 113 Ca -0.02 -0.39 -0.01 0.00 0.25 0.00 0.00 55.06 54.89 2f1d s HIS 113 Cb -0.11 -1.99 0.03 0.00 -1.18 0.00 0.00 32.58 29.33 2f1d s HIS 113 CO 0.02 -0.12 -0.05 0.08 -0.65 0.00 0.00 174.74 174.02 2f1d s VAL 114 N 0.57 0.92 -0.20 0.89 1.01 -0.62 -2.36 120.40 120.61 2f1d s VAL 114 Ca -0.03 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 61.64 2f1d s VAL 114 Cb -0.14 -1.02 0.05 0.00 0.00 0.00 0.00 36.38 35.26 2f1d s VAL 114 CO 0.03 0.26 -0.08 -0.55 0.00 0.00 0.00 175.10 174.76 2f1d s SER 115 N 1.74 3.43 0.31 3.32 0.15 -0.96 -1.91 113.70 119.78 2f1d s SER 115 Ca 0.04 -0.93 0.07 0.00 0.70 0.00 0.00 55.95 55.83 2f1d s SER 115 Cb -0.13 -1.18 -0.06 0.00 -1.71 0.00 0.00 66.02 62.94 2f1d s SER 115 CO -0.08 -0.17 -0.04 -1.48 1.20 0.00 0.00 173.24 172.67 2f1d s LEU 116 N 1.43 2.52 -0.17 3.45 0.05 -0.08 -1.37 118.68 124.52 2f1d s LEU 116 Ca -0.02 -1.23 -0.07 0.00 0.05 0.00 0.00 54.13 52.86 2f1d s LEU 116 Cb -0.17 -0.69 0.07 0.00 -2.05 0.00 0.00 46.19 43.35 2f1d s LEU 116 CO -0.08 -0.36 0.37 -0.62 -0.55 0.00 0.00 176.35 175.11 2f1d s ASP 117 N -3.50 -0.20 -1.09 1.48 2.15 0.00 -1.10 116.67 114.41 2f1d s ASP 117 Ca 0.31 0.83 -0.19 0.00 0.43 0.00 0.00 52.55 53.93 2f1d s ASP 117 Cb 0.05 0.95 0.09 0.00 -0.30 0.00 0.00 42.92 43.71 2f1d s ASP 117 CO 0.14 -0.22 1.43 -0.76 -0.17 0.00 0.00 175.17 175.59 2f1d s LEU 118 N 2.10 4.23 -0.02 -1.34 1.43 -0.19 -1.67 118.68 123.22 2f1d s LEU 118 Ca -0.04 -2.08 0.17 0.00 -1.03 0.00 0.00 54.13 51.15 2f1d s LEU 118 Cb -0.11 -2.50 -0.25 0.00 0.03 0.00 0.00 46.19 43.36 2f1d s LEU 118 CO -0.11 -1.19 0.43 -1.54 0.23 0.00 0.00 176.35 174.16 2f1d n SER 119 N 7.65 1.07 0.00 2.29 3.41 -1.19 -4.96 113.62 121.89 2f1d n SER 119 Ca 0.35 -0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 2f1d n SER 119 Cb 0.48 1.64 0.00 0.00 -0.26 0.00 0.00 64.21 66.07 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 1.52 0.41 2.76 5.00 0.00 -0.65 -4.99 105.19 109.23 2f1d n GLY 120 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.45 0.82 0.13 1.61 0.52 -1.25 -4.93 118.95 115.41 2f1d s ARG 121 Ca 0.00 -0.78 -0.30 0.00 -0.52 0.00 0.00 55.73 54.13 2f1d s ARG 121 Cb 0.00 -2.12 -0.07 0.00 0.52 0.00 0.00 34.95 33.28 2f1d s ARG 121 CO 0.00 -0.78 1.08 -1.25 0.02 0.00 0.00 175.30 174.36 2f1d s PRO 122 N 1.69 4.59 -0.22 3.54 0.04 -1.26 -3.89 135.00 139.50 2f1d s PRO 122 Ca 0.03 1.65 -0.21 0.00 0.04 0.00 0.00 61.00 62.50 2f1d s PRO 122 Cb -0.17 -3.32 0.06 0.00 0.04 0.00 0.00 34.50 31.10 2f1d s PRO 122 CO -0.15 0.05 0.61 -0.47 0.04 0.00 0.00 177.00 177.07 2f1d s TYR 123 N 0.09 -0.66 -0.23 0.56 5.04 -0.70 -4.96 117.35 116.50 2f1d s TYR 123 Ca 0.50 1.59 0.02 0.00 -2.44 0.00 0.00 57.07 56.74 2f1d s TYR 123 Cb -0.28 0.23 0.05 0.00 0.35 0.00 0.00 41.96 42.32 2f1d s TYR 123 CO 0.32 -0.34 -0.12 -1.17 -1.34 0.00 0.00 175.55 172.91 2f1d s LEU 124 N 0.22 2.78 -0.21 6.97 2.96 -1.26 -2.43 118.68 127.71 2f1d s LEU 124 Ca -0.01 -1.10 -0.14 0.00 -0.22 0.00 0.00 54.13 52.66 2f1d s LEU 124 Cb -0.04 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 2f1d s LEU 124 CO 0.01 -0.15 0.31 -0.83 -1.32 0.00 0.00 176.35 174.37 2f1d s GLY 125 N 1.25 2.07 -0.20 7.98 0.00 -0.76 -5.04 107.32 112.62 2f1d s GLY 125 Ca -0.04 -0.63 -0.04 0.00 0.00 0.00 0.00 44.72 44.01 2f1d s GLY 125 CO -0.07 0.63 0.09 -0.47 0.00 0.00 0.00 173.10 173.27 2f1d s TYR 126 N 1.11 0.44 -0.59 1.90 5.04 -1.26 -1.46 117.35 122.52 2f1d s TYR 126 Ca 0.15 -0.57 0.06 0.00 -2.44 0.00 0.00 57.07 54.27 2f1d s TYR 126 Cb -0.14 -0.83 0.26 0.00 0.35 0.00 0.00 41.96 41.60 2f1d s TYR 126 CO 0.06 -0.60 0.74 0.09 -1.34 0.00 0.00 175.55 174.50 2f1d n ASN 127 N 5.21 3.32 -4.65 4.32 4.13 -0.75 -5.02 115.26 121.83 2f1d n ASN 127 Ca -0.07 -3.37 -0.27 0.00 1.68 0.00 0.00 54.58 52.55 2f1d n ASN 127 Cb 0.47 -0.65 -0.08 0.00 -1.54 0.00 0.00 39.78 37.98 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 -2.43 3.25 -0.33 3.41 2.96 -1.26 -1.39 118.68 122.88 2f1d s LEU 128 Ca 0.40 -0.41 -0.00 0.00 -0.22 0.00 0.00 54.13 53.90 2f1d s LEU 128 Cb 0.17 -1.92 0.13 0.00 0.50 0.00 0.00 46.19 45.07 2f1d s LEU 128 CO -0.04 0.10 0.24 -1.83 -1.32 0.00 0.00 176.35 173.50 2f1d s GLU 129 N -2.86 0.46 -0.38 1.98 -1.05 -1.26 -5.03 118.70 110.55 2f1d s GLU 129 Ca 0.27 -0.92 -0.20 0.00 -0.15 0.00 0.00 54.97 53.96 2f1d s GLU 129 Cb -0.09 -1.07 0.01 0.00 -0.44 0.00 0.00 34.13 32.53 2f1d s GLU 129 CO 0.18 -1.15 0.60 0.42 0.95 0.00 0.00 175.26 176.26 2f1d s ILE 130 N 1.51 4.91 0.20 1.83 1.01 -1.26 -4.98 121.20 124.42 2f1d s ILE 130 Ca 0.15 0.33 0.32 0.00 0.00 0.00 0.00 60.65 61.46 2f1d s ILE 130 Cb -0.19 -4.09 0.36 0.00 0.01 0.00 0.00 42.46 38.55 2f1d s ILE 130 CO -0.12 -0.38 2.00 1.55 0.00 0.00 0.00 174.94 177.99 2f1d h PRO 131 N 8.61 0.00 -6.24 2.79 0.13 -1.96 -3.44 132.00 131.88 2f1d h PRO 131 Ca -0.26 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.28 2f1d h PRO 131 Cb 1.11 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.16 2f1d h PRO 131 CO 0.84 0.05 -0.60 0.95 -0.23 0.00 0.00 178.00 179.01 2f1d s THR 132 N -3.77 4.23 -0.95 1.56 -4.23 -1.26 -5.04 115.64 106.19 2f1d s THR 132 Ca 0.00 -1.19 0.27 0.00 -1.18 0.00 0.00 61.69 59.58 2f1d s THR 132 Cb 0.10 -3.15 0.12 0.00 1.34 0.00 0.00 72.50 70.92 2f1d s THR 132 CO 0.55 -0.11 1.64 0.00 -0.54 0.00 0.00 174.62 176.16 2f1d n GLN 133 N -0.26 0.05 -3.70 3.99 6.02 -1.26 -4.82 117.38 117.39 2f1d n GLN 133 Ca -0.09 0.02 -0.11 0.00 -0.01 0.00 0.00 57.00 56.81 2f1d n GLN 133 Cb 0.55 -1.54 -0.10 0.00 1.02 0.00 0.00 30.24 30.17 2f1d n GLN 133 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2f1d s ARG 134 N -3.02 0.44 -0.30 -1.09 0.52 -1.26 -2.98 118.95 111.25 2f1d s ARG 134 Ca 0.12 0.74 -0.05 0.00 -0.52 0.00 0.00 55.73 56.02 2f1d s ARG 134 Cb 0.17 0.07 0.03 0.00 0.52 0.00 0.00 34.95 35.75 2f1d s ARG 134 CO 0.63 -0.13 0.05 0.14 0.02 0.00 0.00 175.30 176.01 2f1d s VAL 135 N 1.02 3.55 0.00 3.52 -7.23 -1.12 -4.92 120.40 115.22 2f1d s VAL 135 Ca -0.06 -1.03 0.00 0.00 -1.81 0.00 0.00 61.98 59.08 2f1d s VAL 135 Cb -0.06 -2.93 0.00 0.00 0.56 0.00 0.00 36.38 33.95 2f1d s VAL 135 CO -0.09 -0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.29 2f1d n GLY 136 N 4.77 4.18 0.67 2.32 0.00 -1.26 -1.42 105.19 114.45 2f1d n GLY 136 Ca -0.14 0.16 0.06 0.00 0.00 0.00 0.00 46.02 46.10 2f1d n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2f1d n THR 137 N 0.00 1.01 -2.78 2.61 -2.24 -1.26 -4.96 114.28 106.65 2f1d n THR 137 Ca 0.00 -1.01 -0.43 0.00 -2.27 0.00 0.00 64.05 60.35 2f1d n THR 137 Cb 0.00 0.49 -0.04 0.00 -2.10 0.00 0.00 70.33 68.69 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 2.99 0.14 4.78 5.04 -0.51 -5.00 117.35 123.79 2f1d s TYR 138 Ca 0.24 0.64 -0.34 0.00 -2.44 0.00 0.00 57.07 55.17 2f1d s TYR 138 Cb 0.13 -3.85 -0.15 0.00 0.35 0.00 0.00 41.96 38.43 2f1d s TYR 138 CO 0.16 -0.97 1.43 -3.47 -1.34 0.00 0.00 175.55 171.36 2f1d n ASP 139 N 7.04 2.36 0.05 4.32 -0.08 -1.26 -2.81 116.55 126.17 2f1d n ASP 139 Ca 0.07 1.11 0.12 0.00 -1.51 0.00 0.00 54.79 54.58 2f1d n ASP 139 Cb 0.48 -1.32 0.18 0.00 2.34 0.00 0.00 41.12 42.80 2f1d n ASP 139 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2f1d n THR 140 N 2.73 0.30 0.23 5.18 -1.04 -1.16 -3.13 114.28 117.39 2f1d n THR 140 Ca 0.17 -0.24 0.11 0.00 -2.04 0.00 0.00 64.05 62.04 2f1d n THR 140 Cb 0.25 -0.07 0.56 0.00 -1.82 0.00 0.00 70.33 69.25 2f1d n THR 140 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 2f1d h GLN 141 N 0.00 0.00 0.00 -2.82 4.20 -1.90 -3.23 115.11 111.36 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 0.71 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.49 2f1d h GLN 141 CO 0.00 0.20 0.00 -0.07 -0.67 0.00 0.00 178.83 178.29 2f1d h LEU 142 N 0.00 0.00 -0.17 1.46 4.07 -1.94 -2.76 115.31 115.98 2f1d h LEU 142 Ca -0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 2f1d h LEU 142 Cb 0.59 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.33 2f1d h LEU 142 CO 0.03 0.00 0.05 0.58 -1.08 0.00 0.00 178.44 178.01 2f1d h VAL 143 N 0.00 1.19 -0.96 1.22 2.07 -1.79 -0.40 116.25 117.59 2f1d h VAL 143 Ca 0.00 -0.61 0.02 0.00 0.82 0.00 0.00 66.70 66.92 2f1d h VAL 143 Cb 0.31 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 2f1d h VAL 143 CO 0.00 0.19 0.63 -0.08 0.02 0.00 0.00 177.57 178.33 2f1d h GLU 144 N 0.08 1.24 0.00 1.57 4.81 -1.73 -2.75 114.58 117.81 2f1d h GLU 144 Ca 0.05 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.11 2f1d h GLU 144 Cb 0.25 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2f1d h GLU 144 CO -0.00 0.82 -0.48 1.25 -0.73 0.00 0.00 179.01 179.87 2f1d h HIS 145 N 1.28 0.00 -0.06 0.92 2.76 -1.44 -2.13 115.15 116.48 2f1d h HIS 145 Ca 0.36 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.50 2f1d h HIS 145 Cb -0.12 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 28.84 2f1d h HIS 145 CO -0.00 0.48 -0.06 0.35 -1.30 0.00 0.00 177.93 177.39 2f1d h PHE 146 N 0.00 0.18 0.00 5.26 3.57 -0.79 -1.91 116.94 123.24 2f1d h PHE 146 Ca -0.00 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.40 2f1d h PHE 146 Cb 0.92 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 2f1d h PHE 146 CO 0.00 0.60 -0.20 0.74 -2.23 0.00 0.00 178.31 177.23 2f1d h PHE 147 N -0.30 0.00 0.07 0.41 -1.00 -1.47 -1.48 116.94 113.17 2f1d h PHE 147 Ca 0.01 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.79 2f1d h PHE 147 Cb 0.57 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.13 2f1d h PHE 147 CO 0.09 0.20 -0.03 0.37 -1.61 0.00 0.00 178.31 177.32 2f1d h GLN 148 N 0.00 -0.09 -0.77 1.51 5.75 -1.31 -2.48 115.11 117.71 2f1d h GLN 148 Ca -0.00 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 2f1d h GLN 148 Cb 0.59 0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.13 2f1d h GLN 148 CO 0.03 0.47 0.39 0.77 -2.65 0.00 0.00 178.83 177.84 2f1d h SER 149 N -0.83 0.98 -0.63 -0.69 0.02 -1.35 -1.33 113.55 109.72 2f1d h SER 149 Ca -0.01 -0.10 0.04 0.00 -0.84 0.00 0.00 61.79 60.89 2f1d h SER 149 Cb 0.61 -0.25 -0.05 0.00 0.14 0.00 0.00 62.40 62.86 2f1d h SER 149 CO 0.02 0.81 0.36 0.25 -1.14 0.00 0.00 176.83 177.13 2f1d h LEU 150 N 1.09 0.56 -0.60 5.07 6.46 -1.34 -2.83 115.31 123.71 2f1d h LEU 150 Ca 0.27 0.02 -0.15 0.00 -0.12 0.00 0.00 57.88 57.90 2f1d h LEU 150 Cb 0.07 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.90 2f1d h LEU 150 CO -0.04 0.38 -0.55 0.58 -0.62 0.00 0.00 178.44 178.19 2f1d h VAL 151 N 0.69 1.34 -0.07 1.05 2.07 -0.91 -1.62 116.25 118.82 2f1d h VAL 151 Ca 0.27 -1.83 -0.16 0.00 0.82 0.00 0.00 66.70 65.80 2f1d h VAL 151 Cb 0.11 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2f1d h VAL 151 CO -0.14 0.56 -0.67 0.78 0.02 0.00 0.00 177.57 178.11 2f1d h ASN 152 N 0.33 0.34 0.78 0.57 2.35 -1.02 -1.20 115.58 117.73 2f1d h ASN 152 Ca 0.00 -0.21 -0.20 0.00 -0.55 0.00 0.00 56.30 55.35 2f1d h ASN 152 Cb 1.07 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 39.31 2f1d h ASN 152 CO 0.10 0.91 -1.33 0.71 -1.65 0.00 0.00 177.43 176.17 2f1d h THR 153 N 0.21 0.77 0.01 2.81 1.35 -1.57 -3.38 112.91 113.11 2f1d h THR 153 Ca -0.02 -2.36 -0.22 0.00 -0.55 0.00 0.00 66.41 63.26 2f1d h THR 153 Cb 1.21 2.27 -0.00 0.00 -1.73 0.00 0.00 68.15 69.90 2f1d h THR 153 CO 0.11 0.44 -0.95 -1.28 -0.25 0.00 0.00 175.52 173.59 2f1d h SER 154 N 0.00 0.41 -3.96 5.36 0.87 -1.15 -3.39 113.55 111.69 2f1d h SER 154 Ca -0.16 -0.34 -0.10 0.00 -1.23 0.00 0.00 61.79 59.96 2f1d h SER 154 Cb 1.69 -0.13 0.08 0.00 -0.44 0.00 0.00 62.40 63.61 2f1d h SER 154 CO 0.07 1.15 -0.35 0.61 -0.53 0.00 0.00 176.83 177.79 2f1d n GLY 155 N 0.98 0.08 3.13 5.77 0.00 -0.46 -4.68 105.19 110.01 2f1d n GLY 155 Ca -0.06 0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.62 1.45 -0.27 1.61 -2.45 -1.19 -1.64 119.30 113.19 2f1d s MET 156 Ca 0.18 -0.57 -0.11 0.00 -1.25 0.00 0.00 55.69 53.93 2f1d s MET 156 Cb -0.02 -1.35 -0.05 0.00 1.25 0.00 0.00 34.83 34.66 2f1d s MET 156 CO 0.30 0.30 0.18 0.99 1.05 0.00 0.00 175.02 177.83 2f1d s THR 157 N -0.21 5.28 -0.14 10.11 2.01 -0.67 -1.72 115.64 130.30 2f1d s THR 157 Ca 0.02 0.16 -0.04 0.00 0.31 0.00 0.00 61.69 62.14 2f1d s THR 157 Cb -0.08 -3.50 0.07 0.00 0.01 0.00 0.00 72.50 69.00 2f1d s THR 157 CO 0.00 0.28 0.17 -0.22 -0.69 0.00 0.00 174.62 174.17 2f1d s LEU 158 N 1.53 -0.03 -0.30 4.42 2.96 -1.02 -0.82 118.68 125.43 2f1d s LEU 158 Ca 0.07 -0.01 -0.06 0.00 -0.22 0.00 0.00 54.13 53.91 2f1d s LEU 158 Cb -0.15 0.24 0.02 0.00 0.50 0.00 0.00 46.19 46.80 2f1d s LEU 158 CO 0.09 -0.29 0.08 -1.00 -1.32 0.00 0.00 176.35 173.90 2f1d s HIS 159 N 2.28 3.17 -0.12 5.38 3.76 -0.47 -1.84 115.29 127.45 2f1d s HIS 159 Ca 0.04 -1.13 -0.06 0.00 -0.15 0.00 0.00 55.06 53.77 2f1d s HIS 159 Cb -0.14 -2.25 -0.04 0.00 1.11 0.00 0.00 32.58 31.27 2f1d s HIS 159 CO -0.09 -0.63 0.09 0.42 -0.85 0.00 0.00 174.74 173.69 2f1d s ILE 160 N 1.46 5.05 -0.06 0.60 1.01 -0.54 -2.26 121.20 126.46 2f1d s ILE 160 Ca 0.01 0.04 -0.02 0.00 0.00 0.00 0.00 60.65 60.68 2f1d s ILE 160 Cb -0.18 -3.20 0.04 0.00 0.01 0.00 0.00 42.46 39.13 2f1d s ILE 160 CO 0.02 0.58 0.13 -0.13 0.00 0.00 0.00 174.94 175.54 2f1d s ARG 161 N -0.70 0.07 -0.29 2.79 0.52 -0.99 -1.81 118.95 118.53 2f1d s ARG 161 Ca 0.12 0.35 -0.20 0.00 -0.52 0.00 0.00 55.73 55.48 2f1d s ARG 161 Cb -0.12 -0.20 -0.01 0.00 0.52 0.00 0.00 34.95 35.14 2f1d s ARG 161 CO 0.03 -0.17 0.59 -1.14 0.02 0.00 0.00 175.30 174.63 2f1d s GLN 162 N 1.19 3.95 0.06 3.54 0.74 -0.49 -1.70 119.66 126.96 2f1d s GLN 162 Ca -0.09 0.31 0.17 0.00 0.05 0.00 0.00 55.36 55.80 2f1d s GLN 162 Cb -0.12 -3.70 -0.13 0.00 1.10 0.00 0.00 33.01 30.16 2f1d s GLN 162 CO -0.05 -0.50 0.83 -0.07 -0.55 0.00 0.00 175.29 174.95 2f1d h LEU 163 N 9.03 0.00 -7.06 3.68 3.38 -1.55 -3.49 115.31 119.29 2f1d h LEU 163 Ca -0.27 0.00 0.15 0.00 0.09 0.00 0.00 57.88 57.85 2f1d h LEU 163 Cb 1.12 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.72 2f1d h LEU 163 CO 0.77 0.58 0.58 0.00 0.09 0.00 0.00 178.44 180.46 2f1d s ALA 164 N -2.92 -1.88 0.00 1.53 0.00 -1.17 -4.95 121.76 112.36 2f1d s ALA 164 Ca -0.03 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.00 2f1d s ALA 164 Cb 0.09 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.52 2f1d s ALA 164 CO 0.81 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 176.28 2f1d n GLY 165 N -0.23 4.77 1.13 0.00 0.00 -1.21 -2.48 105.19 107.17 2f1d n GLY 165 Ca -0.06 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 -1.91 0.00 -2.59 1.61 1.02 -1.26 -4.97 120.64 112.54 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 -0.44 -0.03 0.00 -0.02 0.00 0.00 31.44 30.96 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 -5.01 7.21 0.22 1.62 3.84 -1.26 -4.71 114.94 116.85 2f1d s ASN 167 Ca 0.00 1.72 -0.08 0.00 0.21 0.00 0.00 52.86 54.70 2f1d s ASN 167 Cb 0.00 -2.56 0.24 0.00 -0.55 0.00 0.00 41.25 38.38 2f1d s ASN 167 CO 0.00 -0.43 1.84 0.28 -2.79 0.00 0.00 177.10 176.00 2f1d h SER 168 N 7.05 0.70 -0.27 -4.21 0.02 -1.97 -1.85 113.55 113.02 2f1d h SER 168 Ca -0.36 0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 60.55 2f1d h SER 168 Cb 1.18 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 2f1d h SER 168 CO 0.82 0.46 0.00 -0.74 -1.14 0.00 0.00 176.83 176.24 2f1d h HIS 169 N 0.84 0.60 -0.28 3.45 6.17 -1.98 -2.47 115.15 121.48 2f1d h HIS 169 Ca 0.31 -0.06 -0.16 0.00 0.71 0.00 0.00 60.37 61.16 2f1d h HIS 169 Cb 0.11 -0.17 -0.00 0.00 2.52 0.00 0.00 27.41 29.86 2f1d h HIS 169 CO -0.05 0.58 -0.48 0.45 0.71 0.00 0.00 177.93 179.14 2f1d h HIS 170 N 0.55 0.94 -0.21 5.26 3.86 -1.77 -2.77 115.15 121.02 2f1d h HIS 170 Ca 0.12 -0.31 -0.05 0.00 -1.16 0.00 0.00 60.37 58.96 2f1d h HIS 170 Cb 0.35 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 2f1d h HIS 170 CO 0.01 1.10 -0.07 0.82 0.86 0.00 0.00 177.93 180.65 2f1d h ILE 171 N 0.61 1.29 -0.17 2.45 2.04 -0.97 -0.79 117.51 121.97 2f1d h ILE 171 Ca 0.03 -1.08 -0.08 0.00 1.00 0.00 0.00 64.86 64.73 2f1d h ILE 171 Cb 1.05 1.56 -0.00 0.00 -0.74 0.00 0.00 36.82 38.69 2f1d h ILE 171 CO 0.10 0.33 -0.20 0.40 0.00 0.00 0.00 178.15 178.78 2f1d h ILE 172 N 0.15 1.35 -0.61 -0.67 2.04 -1.56 -1.34 117.51 116.85 2f1d h ILE 172 Ca 0.05 -1.40 -0.03 0.00 1.00 0.00 0.00 64.86 64.48 2f1d h ILE 172 Cb 0.54 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.46 2f1d h ILE 172 CO 0.02 0.42 0.25 -0.08 0.00 0.00 0.00 178.15 178.76 2f1d h GLU 173 N 0.07 0.92 -0.34 2.37 4.81 -1.52 -0.76 114.58 120.13 2f1d h GLU 173 Ca 0.02 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 59.04 2f1d h GLU 173 Cb 0.76 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 2f1d h GLU 173 CO 0.05 0.78 0.00 0.00 -0.73 0.00 0.00 179.01 179.11 2f1d h ALA 174 N 1.09 1.38 -0.39 2.92 0.00 -1.14 -1.19 119.26 121.92 2f1d h ALA 174 Ca 0.20 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 2f1d h ALA 174 Cb 0.20 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2f1d h ALA 174 CO -0.02 0.44 -0.12 1.15 0.00 0.00 0.00 179.25 180.70 2f1d h THR 175 N 0.50 1.25 0.00 0.00 2.02 -0.60 -1.92 112.91 114.16 2f1d h THR 175 Ca 0.11 -1.15 -0.07 0.00 0.77 0.00 0.00 66.41 66.07 2f1d h THR 175 Cb 0.32 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 2f1d h THR 175 CO 0.01 0.39 -0.33 -0.26 0.37 0.00 0.00 175.52 175.70 2f1d h PHE 176 N 0.64 0.00 -0.03 3.16 -1.00 -0.68 -2.59 116.94 116.44 2f1d h PHE 176 Ca 0.11 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.78 2f1d h PHE 176 Cb 0.57 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.14 2f1d h PHE 176 CO 0.03 0.33 -0.42 0.87 -1.61 0.00 0.00 178.31 177.51 2f1d h LYS 177 N 0.00 0.33 -0.87 1.51 1.57 -0.93 -2.73 116.57 115.46 2f1d h LYS 177 Ca -0.00 -0.32 -0.02 0.00 -1.87 0.00 0.00 60.65 58.44 2f1d h LYS 177 Cb 1.10 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.45 2f1d h LYS 177 CO 0.04 0.99 0.47 0.00 -0.57 0.00 0.00 179.45 180.39 2f1d h ALA 178 N 0.35 1.20 -0.19 3.86 0.00 -1.40 -2.60 119.26 120.48 2f1d h ALA 178 Ca -0.04 -0.13 -0.20 0.00 0.00 0.00 0.00 54.91 54.54 2f1d h ALA 178 Cb 1.12 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2f1d h ALA 178 CO 0.08 0.64 -0.66 0.35 0.00 0.00 0.00 179.25 179.67 2f1d h PHE 179 N 1.21 0.93 -0.02 0.00 3.57 -1.48 -1.05 116.94 120.10 2f1d h PHE 179 Ca 0.30 -0.37 -0.11 0.00 3.53 0.00 0.00 57.97 61.32 2f1d h PHE 179 Cb 0.03 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 2f1d h PHE 179 CO 0.01 1.18 -0.49 0.00 -2.23 0.00 0.00 178.31 176.77 2f1d h ALA 180 N 0.73 1.15 0.00 2.41 0.00 -1.48 -0.60 119.26 121.47 2f1d h ALA 180 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2f1d h ALA 180 Cb 1.26 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2f1d h ALA 180 CO 0.13 0.63 -0.25 0.00 0.00 0.00 0.00 179.25 179.76 2f1d h ARG 181 N 0.04 0.00 0.00 0.00 3.08 -1.17 -2.31 114.38 114.02 2f1d h ARG 181 Ca -0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.81 2f1d h ARG 181 Cb 0.89 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.90 2f1d h ARG 181 CO 0.07 0.00 -1.65 0.00 -1.07 0.00 0.00 179.97 177.31 2f1d n ALA 182 N -2.10 1.71 0.15 0.04 0.00 -0.42 -3.09 120.51 116.80 2f1d n ALA 182 Ca 0.03 -0.72 -0.00 0.00 0.00 0.00 0.00 53.44 52.75 2f1d n ALA 182 Cb 0.53 -0.84 0.21 0.00 0.00 0.00 0.00 19.45 19.36 2f1d n ALA 182 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2f1d h LEU 183 N 0.00 0.00 0.13 0.00 6.46 -1.10 -2.89 115.31 117.91 2f1d h LEU 183 Ca -0.25 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.50 2f1d h LEU 183 Cb 1.83 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.77 2f1d h LEU 183 CO 0.06 0.56 -0.06 -0.09 -0.62 0.00 0.00 178.44 178.29 2f1d h ARG 184 N 0.00 -0.17 -1.00 1.25 2.43 -1.53 -2.27 114.38 113.10 2f1d h ARG 184 Ca -0.01 0.01 0.26 0.00 -0.81 0.00 0.00 59.98 59.44 2f1d h ARG 184 Cb 1.02 0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 30.47 2f1d h ARG 184 CO 0.07 0.27 0.58 0.37 -1.51 0.00 0.00 179.97 179.75 2f1d h GLN 185 N -0.91 0.49 0.06 0.20 4.15 -1.56 -0.54 115.11 117.01 2f1d h GLN 185 Ca -0.02 -0.03 -0.25 0.00 0.77 0.00 0.00 58.65 59.12 2f1d h GLN 185 Cb 0.52 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.08 2f1d h GLN 185 CO 0.03 0.33 -1.21 0.00 -1.93 0.00 0.00 178.83 176.05 2f1d h ALA 186 N 1.76 0.28 0.00 3.38 0.00 -1.52 -3.30 119.26 119.87 2f1d h ALA 186 Ca 0.66 -0.97 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 2f1d h ALA 186 Cb 1.33 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 2f1d h ALA 186 CO -0.51 1.17 -0.59 1.79 0.00 0.00 0.00 179.25 181.10 2f1d h THR 187 N 0.03 1.31 -4.17 0.00 1.35 -0.51 -2.55 112.91 108.39 2f1d h THR 187 Ca -0.10 -2.11 -0.51 0.00 -0.55 0.00 0.00 66.41 63.14 2f1d h THR 187 Cb 1.89 2.17 0.18 0.00 -1.73 0.00 0.00 68.15 70.66 2f1d h THR 187 CO 0.16 0.58 0.23 -1.61 -0.25 0.00 0.00 175.52 174.62 2f1d s GLU 188 N -3.49 1.14 0.03 4.72 2.02 -0.68 -4.79 118.70 117.64 2f1d s GLU 188 Ca -0.01 1.33 -0.20 0.00 0.02 0.00 0.00 54.97 56.11 2f1d s GLU 188 Cb 0.12 -1.76 -0.06 0.00 0.10 0.00 0.00 34.13 32.53 2f1d s GLU 188 CO 0.75 -2.48 0.60 0.95 0.02 0.00 0.00 175.26 175.10 2f1d s THR 189 N -2.71 4.82 -0.01 3.63 -4.23 -1.26 -2.30 115.64 113.57 2f1d s THR 189 Ca 0.65 1.26 -0.27 0.00 -1.18 0.00 0.00 61.69 62.15 2f1d s THR 189 Cb -0.21 -3.93 -0.04 0.00 1.34 0.00 0.00 72.50 69.66 2f1d s THR 189 CO 0.58 0.47 0.85 -0.62 -0.54 0.00 0.00 174.62 175.37 2f1d s ASP 190 N -0.56 7.22 -1.08 3.99 -1.08 -0.41 -4.83 116.67 119.92 2f1d s ASP 190 Ca 0.31 1.47 -0.24 0.00 -0.52 0.00 0.00 52.55 53.57 2f1d s ASP 190 Cb -0.19 -2.50 -0.10 0.00 -1.46 0.00 0.00 42.92 38.67 2f1d s ASP 190 CO 0.18 -0.17 1.99 -2.84 0.52 0.00 0.00 175.17 174.85 2f1d s PRO 191 N 0.78 2.28 0.00 4.34 0.02 -1.26 -4.84 135.00 136.32 2f1d s PRO 191 Ca 0.45 -0.77 0.31 0.00 0.02 0.00 0.00 61.00 61.01 2f1d s PRO 191 Cb -0.20 -5.14 1.86 0.00 0.02 0.00 0.00 34.50 31.04 2f1d s PRO 191 CO 0.24 -4.07 2.18 0.54 -0.33 0.00 0.00 177.00 175.56