#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 3.50 -0.11 1.61 0.52 -1.26 -5.01 118.95 118.20 2f1d s ARG 11 Ca 0.00 0.11 0.01 0.00 -0.52 0.00 0.00 55.73 55.34 2f1d s ARG 11 Cb 0.00 -3.97 0.02 0.00 0.52 0.00 0.00 34.95 31.52 2f1d s ARG 11 CO 0.00 -1.36 -0.13 0.42 0.02 0.00 0.00 175.30 174.25 2f1d s ILE 12 N 4.02 1.37 -0.18 1.52 -1.09 -1.26 -0.84 121.20 124.74 2f1d s ILE 12 Ca 0.37 -0.56 -0.01 0.00 -2.23 0.00 0.00 60.65 58.23 2f1d s ILE 12 Cb -0.10 -1.28 0.01 0.00 -1.58 0.00 0.00 42.46 39.51 2f1d s ILE 12 CO 0.25 0.42 -0.14 -0.83 -1.23 0.00 0.00 174.94 173.41 2f1d s GLY 13 N 1.09 1.47 0.04 6.18 0.00 -0.19 -4.38 107.32 111.53 2f1d s GLY 13 Ca -0.05 -1.15 0.07 0.00 0.00 0.00 0.00 44.72 43.59 2f1d s GLY 13 CO -0.03 0.24 -0.20 -0.54 0.00 0.00 0.00 173.10 172.58 2f1d s GLU 14 N 1.20 2.02 -0.18 2.90 2.02 -1.26 -1.28 118.70 124.12 2f1d s GLU 14 Ca 0.02 -1.00 -0.08 0.00 0.02 0.00 0.00 54.97 53.93 2f1d s GLU 14 Cb -0.14 -2.15 0.07 0.00 0.10 0.00 0.00 34.13 32.01 2f1d s GLU 14 CO -0.06 0.54 0.40 0.08 0.02 0.00 0.00 175.26 176.23 2f1d s VAL 15 N -0.90 -0.26 -0.15 2.63 1.01 -0.86 -4.83 120.40 117.03 2f1d s VAL 15 Ca 0.14 0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 2f1d s VAL 15 Cb -0.10 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.64 2f1d s VAL 15 CO 0.05 0.05 -0.06 -1.59 0.00 0.00 0.00 175.10 173.55 2f1d s LYS 16 N 1.87 3.58 -0.07 2.72 0.00 -1.26 -2.37 119.74 124.21 2f1d s LYS 16 Ca -0.06 -0.57 -0.02 0.00 0.00 0.00 0.00 55.97 55.31 2f1d s LYS 16 Cb -0.10 -2.84 0.04 0.00 0.00 0.00 0.00 37.83 34.93 2f1d s LYS 16 CO -0.12 0.21 0.06 0.50 0.00 0.00 0.00 175.35 175.99 2f1d s ARG 17 N 0.41 0.07 -0.19 1.78 3.52 -0.66 -5.04 118.95 118.84 2f1d s ARG 17 Ca -0.06 0.23 -0.00 0.00 -0.13 0.00 0.00 55.73 55.77 2f1d s ARG 17 Cb -0.15 -0.87 0.01 0.00 -1.56 0.00 0.00 34.95 32.38 2f1d s ARG 17 CO 0.04 -0.40 -0.15 0.08 -0.81 0.00 0.00 175.30 174.06 2f1d s VAL 18 N 2.12 2.49 0.19 7.11 1.01 -1.26 -1.92 120.40 130.13 2f1d s VAL 18 Ca 0.04 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.25 2f1d s VAL 18 Cb -0.13 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.20 2f1d s VAL 18 CO -0.05 0.50 0.20 0.35 0.00 0.00 0.00 175.10 176.10 2f1d n THR 19 N 4.63 0.00 0.70 3.92 -2.24 -0.87 -5.02 114.28 115.39 2f1d n THR 19 Ca -0.20 -0.68 0.12 0.00 -2.27 0.00 0.00 64.05 61.02 2f1d n THR 19 Cb 0.50 -0.58 0.48 0.00 -2.10 0.00 0.00 70.33 68.63 2f1d n THR 19 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2f1d n LYS 20 N -1.16 0.10 -0.02 -0.78 0.00 -1.26 -4.03 118.16 111.01 2f1d n LYS 20 Ca 0.02 0.18 -0.01 0.00 -0.00 0.00 0.00 58.31 58.50 2f1d n LYS 20 Cb 0.20 -1.64 -0.05 0.00 -0.00 0.00 0.00 35.03 33.54 2f1d n LYS 20 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2f1d n GLU 21 N -1.82 2.27 -4.14 -1.58 1.02 -1.26 -5.08 120.64 110.05 2f1d n GLU 21 Ca 0.05 -0.02 -0.09 0.00 -0.02 0.00 0.00 57.16 57.08 2f1d n GLU 21 Cb 0.31 -1.16 -0.10 0.00 -0.02 0.00 0.00 31.44 30.47 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 -2.23 0.29 -0.25 2.62 -4.23 -1.26 -3.17 115.64 107.41 2f1d s THR 22 Ca -0.03 -1.88 -0.03 0.00 -1.18 0.00 0.00 61.69 58.57 2f1d s THR 22 Cb 0.02 -1.78 0.08 0.00 1.34 0.00 0.00 72.50 72.17 2f1d s THR 22 CO 0.26 -0.75 0.09 0.21 -0.54 0.00 0.00 174.62 173.89 2f1d s ASN 23 N -3.01 3.33 -0.08 3.99 3.84 -0.40 -2.06 114.94 120.56 2f1d s ASN 23 Ca 0.15 -1.16 0.04 0.00 0.21 0.00 0.00 52.86 52.11 2f1d s ASN 23 Cb 0.07 -0.54 -0.01 0.00 -0.55 0.00 0.00 41.25 40.23 2f1d s ASN 23 CO -0.04 -0.38 -0.22 -0.69 -2.79 0.00 0.00 177.10 172.98 2f1d s VAL 24 N 1.91 2.34 -0.03 -5.21 1.01 -0.81 -2.05 120.40 117.57 2f1d s VAL 24 Ca 0.05 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.10 2f1d s VAL 24 Cb -0.17 -1.89 0.01 0.00 0.00 0.00 0.00 36.38 34.33 2f1d s VAL 24 CO -0.22 0.56 -0.04 -0.55 0.00 0.00 0.00 175.10 174.86 2f1d s SER 25 N -0.03 0.68 -0.04 3.32 0.15 -0.68 -1.65 113.70 115.45 2f1d s SER 25 Ca -0.07 -0.09 -0.03 0.00 0.70 0.00 0.00 55.95 56.46 2f1d s SER 25 Cb -0.15 -0.26 0.01 0.00 -1.71 0.00 0.00 66.02 63.92 2f1d s SER 25 CO 0.05 -0.02 0.10 -0.69 1.20 0.00 0.00 173.24 173.87 2f1d s VAL 26 N 0.58 -0.00 -0.01 4.45 1.01 -1.00 -1.26 120.40 124.17 2f1d s VAL 26 Ca -0.07 0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.93 2f1d s VAL 26 Cb -0.10 -0.15 0.02 0.00 0.00 0.00 0.00 36.38 36.14 2f1d s VAL 26 CO -0.00 0.01 0.00 -0.54 0.00 0.00 0.00 175.10 174.56 2f1d s LYS 27 N 0.14 0.13 -0.05 2.72 1.02 0.00 -2.03 119.74 121.68 2f1d s LYS 27 Ca -0.01 0.05 0.01 0.00 0.02 0.00 0.00 55.97 56.05 2f1d s LYS 27 Cb -0.02 -0.26 0.02 0.00 -0.52 0.00 0.00 37.83 37.05 2f1d s LYS 27 CO -0.00 -0.07 -0.06 0.42 -0.92 0.00 0.00 175.35 174.71 2f1d s ILE 28 N 0.58 0.66 -0.32 2.17 1.01 -0.41 -1.45 121.20 123.44 2f1d s ILE 28 Ca -0.05 -0.20 -0.06 0.00 0.00 0.00 0.00 60.65 60.33 2f1d s ILE 28 Cb -0.08 -0.65 0.03 0.00 0.01 0.00 0.00 42.46 41.77 2f1d s ILE 28 CO -0.01 0.25 0.09 0.21 0.00 0.00 0.00 174.94 175.47 2f1d s ASN 29 N 0.80 5.21 0.52 3.58 3.84 -0.99 -1.02 114.94 126.88 2f1d s ASN 29 Ca -0.12 -0.98 0.31 0.00 0.21 0.00 0.00 52.86 52.28 2f1d s ASN 29 Cb -0.14 -1.86 1.27 0.00 -0.55 0.00 0.00 41.25 39.96 2f1d s ASN 29 CO 0.01 -0.27 1.95 -0.07 -2.79 0.00 0.00 177.10 175.93 2f1d h LEU 30 N 8.22 0.00 -4.92 3.21 3.38 -1.34 -2.79 115.31 121.07 2f1d h LEU 30 Ca -0.26 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.05 2f1d h LEU 30 Cb 1.10 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 41.48 2f1d h LEU 30 CO 0.60 0.07 -0.07 0.47 0.09 0.00 0.00 178.44 179.60 2f1d n ASP 31 N -3.21 5.68 -2.49 -0.43 8.00 -1.26 -4.81 116.55 118.03 2f1d n ASP 31 Ca 0.00 -3.75 0.00 0.00 0.71 0.00 0.00 54.79 51.76 2f1d n ASP 31 Cb 0.33 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.73 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 -0.43 0.69 0.00 0.44 0.00 -1.07 -4.87 105.19 99.96 2f1d n GLY 32 Ca 0.43 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 0.00 0.00 -0.50 2.61 5.66 -1.22 -4.85 114.28 115.98 2f1d n THR 33 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2f1d n THR 33 Cb 0.00 1.03 0.00 0.00 -1.55 0.00 0.00 70.33 69.81 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 0.00 1.20 3.64 1.09 0.00 -1.23 -4.94 105.19 104.95 2f1d n GLY 34 Ca 0.00 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.15 5.00 -0.34 1.61 1.01 -1.21 -4.29 120.40 120.03 2f1d s VAL 35 Ca 0.00 1.16 -0.13 0.00 0.00 0.00 0.00 61.98 63.02 2f1d s VAL 35 Cb 0.00 -3.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 2f1d s VAL 35 CO 0.00 0.07 0.24 0.00 0.00 0.00 0.00 175.10 175.41 2f1d s ALA 36 N 2.22 3.50 -0.40 5.51 0.00 -1.26 -1.94 121.76 129.39 2f1d s ALA 36 Ca 0.27 -1.40 0.10 0.00 0.00 0.00 0.00 51.96 50.94 2f1d s ALA 36 Cb -0.16 -2.67 0.33 0.00 0.00 0.00 0.00 23.12 20.62 2f1d s ALA 36 CO 0.09 -0.99 0.73 -3.47 0.00 0.00 0.00 175.76 172.12 2f1d n ASP 37 N 5.11 1.25 -4.32 0.00 4.64 -0.76 -5.04 116.55 117.43 2f1d n ASP 37 Ca -0.13 -3.06 -0.35 0.00 -1.38 0.00 0.00 54.79 49.88 2f1d n ASP 37 Cb 0.50 -0.62 -0.14 0.00 -1.04 0.00 0.00 41.12 39.82 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 -2.39 4.28 -0.28 1.67 0.01 -1.26 -2.15 113.70 113.59 2f1d s SER 38 Ca 0.40 -0.38 0.01 0.00 1.31 0.00 0.00 55.95 57.29 2f1d s SER 38 Cb 0.31 -1.73 0.08 0.00 0.21 0.00 0.00 66.02 64.89 2f1d s SER 38 CO -0.09 -0.01 0.02 -0.55 0.41 0.00 0.00 173.24 173.02 2f1d s SER 39 N 1.39 4.04 -0.00 2.44 0.15 -1.05 -4.89 113.70 115.78 2f1d s SER 39 Ca 0.05 -1.50 0.08 0.00 0.70 0.00 0.00 55.95 55.28 2f1d s SER 39 Cb -0.14 -1.15 -0.09 0.00 -1.71 0.00 0.00 66.02 62.93 2f1d s SER 39 CO -0.03 -0.32 0.33 -1.54 1.20 0.00 0.00 173.24 172.88 2f1d n SER 40 N 4.65 0.42 0.00 5.45 3.41 -1.26 -2.70 113.62 123.59 2f1d n SER 40 Ca -0.06 -0.67 0.00 0.00 -0.26 0.00 0.00 58.87 57.88 2f1d n SER 40 Cb 0.43 1.01 0.00 0.00 -0.26 0.00 0.00 64.21 65.39 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 1.20 0.84 2.68 5.00 0.00 -1.26 -4.62 105.19 109.03 2f1d n GLY 41 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 2f1d n GLY 41 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f1d s ILE 42 N -3.21 1.10 0.39 -0.61 1.01 -1.26 -5.01 121.20 113.62 2f1d s ILE 42 Ca 0.00 -2.18 0.12 0.00 0.00 0.00 0.00 60.65 58.60 2f1d s ILE 42 Cb 0.00 -1.79 0.34 0.00 0.01 0.00 0.00 42.46 41.02 2f1d s ILE 42 CO 0.00 -0.86 1.90 -0.65 0.00 0.00 0.00 174.94 175.33 2f1d h PRO 43 N 7.07 0.53 -0.19 2.79 0.11 -1.99 -1.91 132.00 138.40 2f1d h PRO 43 Ca -0.03 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.86 2f1d h PRO 43 Cb 0.95 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2f1d h PRO 43 CO 0.45 0.35 -0.64 0.35 -0.21 0.00 0.00 178.00 178.30 2f1d h PHE 44 N 0.55 0.90 -0.02 0.65 3.57 -1.95 -2.85 116.94 117.78 2f1d h PHE 44 Ca 0.40 -0.35 -0.14 0.00 3.53 0.00 0.00 57.97 61.40 2f1d h PHE 44 Cb 0.75 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.32 2f1d h PHE 44 CO -0.00 1.15 -0.66 1.25 -2.23 0.00 0.00 178.31 177.82 2f1d h LEU 45 N 0.51 0.09 -0.38 0.59 5.85 -1.92 -1.93 115.31 118.12 2f1d h LEU 45 Ca -0.01 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.69 2f1d h LEU 45 Cb 1.23 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 2f1d h LEU 45 CO 0.13 0.72 0.14 0.44 -0.34 0.00 0.00 178.44 179.53 2f1d h ASP 46 N 0.06 0.16 -0.09 1.25 5.19 -1.35 -0.27 116.42 121.37 2f1d h ASP 46 Ca -0.01 0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.41 2f1d h ASP 46 Cb 1.17 0.02 -0.01 0.00 0.18 0.00 0.00 39.33 40.69 2f1d h ASP 46 CO 0.09 0.13 -0.02 -0.74 -3.12 0.00 0.00 179.24 175.58 2f1d h HIS 47 N 0.30 0.30 0.00 4.55 2.76 -1.22 -0.32 115.15 121.53 2f1d h HIS 47 Ca 0.17 -0.02 -0.24 0.00 -2.20 0.00 0.00 60.37 58.08 2f1d h HIS 47 Cb 0.14 -0.09 0.01 0.00 1.55 0.00 0.00 27.41 29.02 2f1d h HIS 47 CO -0.14 0.33 -0.99 0.52 -1.30 0.00 0.00 177.93 176.36 2f1d h MET 48 N 0.29 0.51 0.00 5.26 2.86 -0.75 -2.83 114.93 120.28 2f1d h MET 48 Ca 0.07 -0.56 -0.10 0.00 -2.06 0.00 0.00 59.70 57.05 2f1d h MET 48 Cb 0.24 0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 2f1d h MET 48 CO 0.01 1.19 -0.49 -0.07 1.06 0.00 0.00 176.91 178.61 2f1d h LEU 49 N 0.28 0.00 -0.78 1.22 3.38 -0.74 -1.27 115.31 117.40 2f1d h LEU 49 Ca -0.10 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 2f1d h LEU 49 Cb 1.63 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.36 2f1d h LEU 49 CO 0.18 0.49 0.01 0.44 0.09 0.00 0.00 178.44 179.65 2f1d h ASP 50 N 0.00 0.91 0.12 -0.43 5.19 -1.02 -1.57 116.42 119.62 2f1d h ASP 50 Ca -0.00 -0.23 -0.13 0.00 -0.62 0.00 0.00 57.03 56.04 2f1d h ASP 50 Cb 0.88 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 40.14 2f1d h ASP 50 CO 0.06 0.96 -0.44 1.56 -3.12 0.00 0.00 179.24 178.26 2f1d h GLN 51 N 0.87 0.40 -0.49 3.56 1.08 -1.29 -2.47 115.11 116.77 2f1d h GLN 51 Ca 0.16 -0.21 -0.02 0.00 -1.45 0.00 0.00 58.65 57.13 2f1d h GLN 51 Cb 0.49 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 2f1d h GLN 51 CO 0.02 0.76 0.21 1.25 -0.95 0.00 0.00 178.83 180.12 2f1d h LEU 52 N 0.32 0.66 0.29 1.46 5.85 -0.50 -1.26 115.31 122.13 2f1d h LEU 52 Ca 0.02 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 2f1d h LEU 52 Cb 0.90 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.77 2f1d h LEU 52 CO 0.08 0.64 -0.14 0.00 -0.34 0.00 0.00 178.44 178.67 2f1d h ALA 53 N 1.05 -0.39 -0.58 1.25 0.00 -1.35 -2.94 119.26 116.30 2f1d h ALA 53 Ca 0.16 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2f1d h ALA 53 Cb 0.17 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2f1d h ALA 53 CO -0.02 -0.53 0.39 1.03 0.00 0.00 0.00 179.25 180.12 2f1d h SER 54 N -0.76 0.51 0.13 0.00 0.87 -1.40 0.38 113.55 113.27 2f1d h SER 54 Ca -0.04 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2f1d h SER 54 Cb 0.50 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2f1d h SER 54 CO 0.07 0.34 -1.87 1.41 -0.53 0.00 0.00 176.83 176.24 2f1d n HIS 55 N -4.47 0.12 0.31 2.24 -0.00 -0.48 -4.02 115.22 108.93 2f1d n HIS 55 Ca 0.08 0.04 0.08 0.00 -0.00 0.00 0.00 57.72 57.91 2f1d n HIS 55 Cb 0.21 -0.56 0.12 0.00 -0.00 0.00 0.00 29.99 29.76 2f1d n HIS 55 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2f1d n GLY 56 N 1.25 1.05 4.11 -1.41 0.00 -1.11 -4.17 105.19 104.90 2f1d n GLY 56 Ca -0.03 -0.47 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 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 0.87 -1.98 -4.92 0.99 4.77 0.12 -4.71 117.00 112.15 2f1d n LEU 57 Ca 0.12 -0.97 -0.28 0.00 -0.03 0.00 0.00 56.01 54.84 2f1d n LEU 57 Cb 0.42 -2.20 -0.03 0.00 -2.33 0.00 0.00 43.42 39.28 2f1d n LEU 57 CO 0.10 0.36 0.08 -0.36 -1.33 0.00 0.00 177.39 176.24 2f1d s PHE 58 N -3.47 3.48 -0.43 -1.77 0.40 -0.66 -2.58 117.98 112.95 2f1d s PHE 58 Ca 0.54 0.45 -0.13 0.00 -0.60 0.00 0.00 56.93 57.18 2f1d s PHE 58 Cb -0.29 -1.94 0.06 0.00 0.51 0.00 0.00 43.02 41.36 2f1d s PHE 58 CO 0.90 0.32 0.31 -0.51 0.70 0.00 0.00 175.22 176.94 2f1d s ASP 59 N -3.13 5.94 -0.24 1.36 1.01 -1.06 -3.32 116.67 117.23 2f1d s ASP 59 Ca 0.40 -1.24 -0.05 0.00 0.71 0.00 0.00 52.55 52.37 2f1d s ASP 59 Cb -0.11 -2.10 -0.01 0.00 1.01 0.00 0.00 42.92 41.71 2f1d s ASP 59 CO 0.29 -0.54 -0.00 -0.69 0.21 0.00 0.00 175.17 174.44 2f1d s VAL 60 N 1.58 3.65 -0.22 -1.27 1.01 -0.82 -2.35 120.40 121.97 2f1d s VAL 60 Ca 0.04 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.58 2f1d s VAL 60 Cb -0.22 -2.71 0.05 0.00 0.00 0.00 0.00 36.38 33.50 2f1d s VAL 60 CO 0.06 0.36 -0.13 -2.28 0.00 0.00 0.00 175.10 173.11 2f1d s HIS 61 N 1.51 2.91 -0.02 5.22 2.46 -0.53 -1.83 115.29 125.00 2f1d s HIS 61 Ca 0.05 -1.96 0.04 0.00 0.47 0.00 0.00 55.06 53.66 2f1d s HIS 61 Cb -0.15 -1.84 -0.01 0.00 -0.13 0.00 0.00 32.58 30.45 2f1d s HIS 61 CO -0.01 -0.83 -0.14 0.08 -2.47 0.00 0.00 174.74 171.37 2f1d s VAL 62 N 1.23 1.17 -0.10 0.89 1.01 -0.91 -0.82 120.40 122.87 2f1d s VAL 62 Ca -0.03 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 2f1d s VAL 62 Cb -0.17 -0.99 0.05 0.00 0.00 0.00 0.00 36.38 35.27 2f1d s VAL 62 CO -0.08 0.34 0.16 -0.60 0.00 0.00 0.00 175.10 174.92 2f1d s ARG 63 N -0.13 0.05 0.04 2.72 6.06 -0.39 -2.52 118.95 124.79 2f1d s ARG 63 Ca 0.01 0.50 -0.01 0.00 -2.50 0.00 0.00 55.73 53.73 2f1d s ARG 63 Cb -0.08 -0.44 -0.04 0.00 0.06 0.00 0.00 34.95 34.45 2f1d s ARG 63 CO 0.00 -0.36 -0.03 0.00 -2.50 0.00 0.00 175.30 172.42 2f1d s ALA 64 N 2.29 0.42 -0.11 6.12 0.00 -1.10 -1.69 121.76 127.70 2f1d s ALA 64 Ca 0.03 -1.07 -0.04 0.00 0.00 0.00 0.00 51.96 50.88 2f1d s ALA 64 Cb -0.13 0.25 0.06 0.00 0.00 0.00 0.00 23.12 23.30 2f1d s ALA 64 CO -0.07 -0.33 0.21 0.99 0.00 0.00 0.00 175.76 176.57 2f1d s THR 65 N -3.42 -0.34 0.00 0.00 2.01 -0.87 -4.55 115.64 108.47 2f1d s THR 65 Ca 0.02 0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.34 2f1d s THR 65 Cb 0.04 -0.37 0.00 0.00 0.01 0.00 0.00 72.50 72.18 2f1d s THR 65 CO -0.08 0.13 0.00 0.61 -0.69 0.00 0.00 174.62 174.59 2f1d n GLY 66 N 5.33 4.30 0.26 4.40 0.00 -1.26 -1.28 105.19 116.94 2f1d n GLY 66 Ca -0.06 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.41 2f1d n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f1d n ASP 67 N -2.00 0.36 -0.62 1.61 8.00 -1.19 -4.68 116.55 118.03 2f1d n ASP 67 Ca 0.00 -1.37 0.48 0.00 0.71 0.00 0.00 54.79 54.61 2f1d n ASP 67 Cb 0.00 -0.18 0.74 0.00 -0.02 0.00 0.00 41.12 41.66 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 -0.16 0.00 -0.36 2.53 0.31 -1.24 0.10 118.33 119.53 2f1d n VAL 68 Ca 0.00 1.42 0.10 0.00 -0.01 0.00 0.00 64.34 65.85 2f1d n VAL 68 Cb 0.09 -2.39 0.28 0.00 -0.91 0.00 0.00 33.84 30.92 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 1.09 0.16 3.52 2.07 -2.00 -3.23 115.15 116.77 2f1d h HIS 69 Ca 0.85 0.03 -0.01 0.00 -2.85 0.00 0.00 60.37 58.40 2f1d h HIS 69 Cb 3.57 -0.34 0.00 0.00 2.57 0.00 0.00 27.41 33.21 2f1d h HIS 69 CO 0.00 0.32 -0.08 0.82 -3.07 0.00 0.00 177.93 175.92 2f1d h ILE 70 N 0.86 0.00 -3.72 6.12 2.04 0.29 -3.49 117.51 119.60 2f1d h ILE 70 Ca 0.54 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 66.12 2f1d h ILE 70 Cb 0.72 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.70 2f1d h ILE 70 CO -0.33 0.00 -0.18 -0.62 0.00 0.00 0.00 178.15 177.01 2f1d s ASP 71 N -3.40 -0.07 0.00 1.72 -1.08 -1.22 -5.02 116.67 107.61 2f1d s ASP 71 Ca -0.03 -0.87 0.26 0.00 -0.52 0.00 0.00 52.55 51.39 2f1d s ASP 71 Cb 0.00 0.53 0.68 0.00 -1.46 0.00 0.00 42.92 42.67 2f1d s ASP 71 CO 0.10 -1.04 1.53 0.47 0.52 0.00 0.00 175.17 176.75 2f1d n ASP 72 N -0.32 2.08 0.18 -0.34 8.00 -1.26 -3.58 116.55 121.30 2f1d n ASP 72 Ca -0.04 -1.67 -0.13 0.00 0.71 0.00 0.00 54.79 53.66 2f1d n ASP 72 Cb 0.62 0.02 -0.07 0.00 -0.02 0.00 0.00 41.12 41.67 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 3.23 -1.03 -0.83 1.24 2.76 -1.96 -0.19 115.15 118.37 2f1d h HIS 73 Ca 0.00 0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.22 2f1d h HIS 73 Cb 0.70 0.41 -0.05 0.00 1.55 0.00 0.00 27.41 30.02 2f1d h HIS 73 CO 0.00 -0.47 0.55 0.45 -1.30 0.00 0.00 177.93 177.16 2f1d h HIS 74 N -0.69 0.99 -0.27 5.26 3.86 -1.98 -0.71 115.15 121.61 2f1d h HIS 74 Ca -0.04 0.02 -0.19 0.00 -1.16 0.00 0.00 60.37 59.01 2f1d h HIS 74 Cb 0.61 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 28.75 2f1d h HIS 74 CO -0.24 0.56 -0.57 1.15 0.86 0.00 0.00 177.93 179.68 2f1d h THR 75 N 1.01 1.28 -0.56 2.45 2.02 -1.86 -1.94 112.91 115.30 2f1d h THR 75 Ca 0.34 -1.76 -0.04 0.00 0.77 0.00 0.00 66.41 65.72 2f1d h THR 75 Cb 0.07 1.67 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 2f1d h THR 75 CO -0.10 0.57 0.20 -1.13 0.37 0.00 0.00 175.52 175.43 2f1d h ASN 76 N 0.64 0.80 -0.11 4.18 -0.73 -0.45 -2.31 115.58 117.60 2f1d h ASN 76 Ca 0.01 -0.19 -0.09 0.00 1.87 0.00 0.00 56.30 57.90 2f1d h ASN 76 Cb 1.18 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 39.56 2f1d h ASN 76 CO 0.12 0.77 -0.27 -0.08 -0.37 0.00 0.00 177.43 177.61 2f1d h GLU 77 N 0.78 0.37 -0.30 6.67 4.81 -1.09 -2.51 114.58 123.31 2f1d h GLU 77 Ca 0.19 -0.26 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 2f1d h GLU 77 Cb 0.24 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2f1d h GLU 77 CO -0.01 0.87 -0.21 -0.44 -0.73 0.00 0.00 179.01 178.49 2f1d h ASP 78 N -0.07 0.56 -0.42 1.04 3.32 -1.39 0.25 116.42 119.71 2f1d h ASP 78 Ca -0.00 -0.18 -0.07 0.00 0.02 0.00 0.00 57.03 56.80 2f1d h ASP 78 Cb 0.88 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 2f1d h ASP 78 CO 0.06 0.78 0.00 0.40 -1.72 0.00 0.00 179.24 178.76 2f1d h ILE 79 N 0.50 1.26 -0.78 0.35 2.04 -1.47 -1.44 117.51 117.98 2f1d h ILE 79 Ca 0.08 -1.02 0.04 0.00 1.00 0.00 0.00 64.86 64.95 2f1d h ILE 79 Cb 0.64 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 2f1d h ILE 79 CO 0.05 0.35 0.49 0.00 0.00 0.00 0.00 178.15 179.04 2f1d h ALA 80 N 0.90 1.03 0.00 1.87 0.00 -1.06 -1.18 119.26 120.82 2f1d h ALA 80 Ca 0.12 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 2f1d h ALA 80 Cb 0.48 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2f1d h ALA 80 CO 0.02 0.29 -0.71 -0.07 0.00 0.00 0.00 179.25 178.78 2f1d h LEU 81 N 0.95 0.00 -0.35 0.00 3.38 -0.87 -2.94 115.31 115.48 2f1d h LEU 81 Ca 0.32 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.10 2f1d h LEU 81 Cb 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2f1d h LEU 81 CO -0.12 0.71 -0.72 0.00 0.09 0.00 0.00 178.44 178.40 2f1d h ALA 82 N 1.29 0.53 -0.56 1.53 0.00 -0.85 -2.91 119.26 118.28 2f1d h ALA 82 Ca -0.01 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.23 2f1d h ALA 82 Cb 1.32 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2f1d h ALA 82 CO 0.09 0.73 0.04 0.82 0.00 0.00 0.00 179.25 180.93 2f1d h ILE 83 N 0.37 1.25 -0.46 0.00 2.04 -1.15 -0.30 117.51 119.26 2f1d h ILE 83 Ca -0.03 -1.04 -0.12 0.00 1.00 0.00 0.00 64.86 64.66 2f1d h ILE 83 Cb 1.30 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 2f1d h ILE 83 CO 0.13 0.38 -0.20 1.23 0.00 0.00 0.00 178.15 179.69 2f1d h GLY 84 N 1.01 1.02 1.51 5.37 0.00 -1.52 0.15 103.07 110.62 2f1d h GLY 84 Ca 0.17 -0.91 -0.14 0.00 0.00 0.00 0.00 47.33 46.45 2f1d h GLY 84 CO 0.02 0.83 -0.44 -0.84 0.00 0.00 0.00 176.54 176.10 2f1d h THR 85 N 0.79 1.31 0.00 4.70 2.02 -1.43 -1.27 112.91 119.02 2f1d h THR 85 Ca 0.10 -1.63 -0.06 0.00 0.77 0.00 0.00 66.41 65.59 2f1d h THR 85 Cb 0.77 1.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.80 2f1d h THR 85 CO 0.06 0.51 -0.30 0.00 0.37 0.00 0.00 175.52 176.17 2f1d h ALA 86 N 1.09 1.17 0.22 6.16 0.00 -0.75 -2.75 119.26 124.39 2f1d h ALA 86 Ca 0.03 -0.27 -0.33 0.00 0.00 0.00 0.00 54.91 54.34 2f1d h ALA 86 Cb 0.95 -0.05 0.03 0.00 0.00 0.00 0.00 17.79 18.72 2f1d h ALA 86 CO 0.08 0.37 -1.49 1.25 0.00 0.00 0.00 179.25 179.47 2f1d h LEU 87 N 0.00 0.72 -0.58 0.00 5.85 -0.38 -2.96 115.31 117.96 2f1d h LEU 87 Ca -0.00 -0.82 -0.01 0.00 0.84 0.00 0.00 57.88 57.89 2f1d h LEU 87 Cb 0.68 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 2f1d h LEU 87 CO 0.04 1.65 0.32 0.25 -0.34 0.00 0.00 178.44 180.36 2f1d h LEU 88 N 0.13 0.72 0.14 2.25 5.85 -1.04 -2.65 115.31 120.70 2f1d h LEU 88 Ca -0.25 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 2f1d h LEU 88 Cb 2.12 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.97 2f1d h LEU 88 CO 0.25 0.60 -0.07 0.11 -0.34 0.00 0.00 178.44 178.99 2f1d h LYS 89 N 0.78 -0.18 -1.32 1.25 1.57 -1.59 -2.80 116.57 114.28 2f1d h LYS 89 Ca 0.20 0.01 0.39 0.00 -1.87 0.00 0.00 60.65 59.39 2f1d h LYS 89 Cb 0.04 0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.29 2f1d h LYS 89 CO -0.03 0.15 0.89 0.00 -0.57 0.00 0.00 179.45 179.89 2f1d h ALA 90 N 0.27 2.88 0.07 3.86 0.00 -1.43 0.19 119.26 125.09 2f1d h ALA 90 Ca -0.02 0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.68 2f1d h ALA 90 Cb 0.41 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2f1d h ALA 90 CO 0.03 -1.38 -1.19 -0.07 0.00 0.00 0.00 179.25 176.64 2f1d h LEU 91 N 0.13 0.22 0.00 0.00 3.38 -1.22 -3.41 115.31 114.41 2f1d h LEU 91 Ca 0.73 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.45 2f1d h LEU 91 Cb 2.43 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 43.11 2f1d h LEU 91 CO -0.23 1.20 0.00 0.61 0.09 0.00 0.00 178.44 180.10 2f1d n GLY 92 N 1.47 4.34 0.99 0.83 0.00 0.05 -2.35 105.19 110.53 2f1d n GLY 92 Ca -0.06 0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.21 2f1d n GLY 92 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2f1d n GLU 93 N 13.88 2.29 -3.06 1.61 -0.00 -1.26 -4.97 120.64 129.13 2f1d n GLU 93 Ca 0.00 -1.96 -0.22 0.00 -0.00 0.00 0.00 57.16 54.98 2f1d n GLU 93 Cb 0.00 -1.47 0.04 0.00 -0.00 0.00 0.00 31.44 30.01 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 1.14 -5.12 -3.21 3.44 1.74 -0.99 -4.93 116.66 108.74 2f1d n ARG 94 Ca 0.19 0.88 -0.40 0.00 -0.77 0.00 0.00 57.85 57.75 2f1d n ARG 94 Cb 0.51 -5.70 -0.07 0.00 -1.02 0.00 0.00 32.46 26.18 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 -5.73 4.18 -0.05 5.56 -0.14 -1.26 -4.26 119.74 118.03 2f1d s LYS 95 Ca 0.33 0.46 0.00 0.00 -1.36 0.00 0.00 55.97 55.40 2f1d s LYS 95 Cb -0.14 -3.58 0.00 0.00 -1.68 0.00 0.00 37.83 32.43 2f1d s LYS 95 CO 0.40 -0.20 0.00 0.41 -0.76 0.00 0.00 175.35 175.20 2f1d n GLY 96 N 3.92 0.35 3.54 -3.33 0.00 -1.26 -5.03 105.19 103.39 2f1d n GLY 96 Ca -0.04 -0.89 -0.31 0.00 0.00 0.00 0.00 46.02 44.78 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 -2.03 3.31 0.35 -0.61 -4.36 -1.26 -1.73 121.20 114.88 2f1d s ILE 97 Ca 0.00 -0.96 0.17 0.00 -0.26 0.00 0.00 60.65 59.60 2f1d s ILE 97 Cb 0.00 -2.43 0.35 0.00 1.25 0.00 0.00 42.46 41.63 2f1d s ILE 97 CO 0.00 0.35 1.60 0.78 0.24 0.00 0.00 174.94 177.91 2f1d h ASN 98 N 4.46 0.27 0.00 4.36 2.35 -1.44 -3.45 115.58 122.13 2f1d h ASN 98 Ca -0.48 0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 2f1d h ASN 98 Cb 1.16 0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.79 2f1d h ASN 98 CO 0.51 -0.35 0.00 -1.14 -1.65 0.00 0.00 177.43 174.80 2f1d n ARG 99 N -5.23 0.00 -3.82 0.81 0.63 -0.41 -4.88 116.66 103.75 2f1d n ARG 99 Ca 0.34 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.92 2f1d n ARG 99 Cb 1.14 -0.01 -0.10 0.00 0.45 0.00 0.00 32.46 33.94 2f1d n ARG 99 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2f1d s PHE 100 N 0.00 3.24 0.23 -0.14 0.40 -1.26 -2.12 117.98 118.33 2f1d s PHE 100 Ca 0.00 0.04 0.08 0.00 -0.60 0.00 0.00 56.93 56.45 2f1d s PHE 100 Cb 0.00 -2.19 -0.04 0.00 0.51 0.00 0.00 43.02 41.30 2f1d s PHE 100 CO 0.00 0.02 0.01 0.20 0.70 0.00 0.00 175.22 176.15 2f1d s GLY 101 N 0.90 1.66 -0.31 4.36 0.00 -1.07 -4.40 107.32 108.46 2f1d s GLY 101 Ca 0.05 -1.51 0.06 0.00 0.00 0.00 0.00 44.72 43.31 2f1d s GLY 101 CO 0.03 -1.56 0.62 -0.35 0.00 0.00 0.00 173.10 171.84 2f1d s ASP 102 N -3.37 -1.57 0.02 1.64 2.15 -1.26 -2.45 116.67 111.83 2f1d s ASP 102 Ca 0.30 0.04 0.04 0.00 0.43 0.00 0.00 52.55 53.35 2f1d s ASP 102 Cb -0.08 1.99 -0.02 0.00 -0.30 0.00 0.00 42.92 44.51 2f1d s ASP 102 CO 0.20 -0.27 -0.12 0.12 -0.17 0.00 0.00 175.17 174.92 2f1d s PHE 103 N 2.68 1.10 -0.23 -5.34 5.36 -0.71 -4.99 117.98 115.85 2f1d s PHE 103 Ca 0.12 -0.29 0.00 0.00 -0.96 0.00 0.00 56.93 55.79 2f1d s PHE 103 Cb -0.09 -0.67 0.03 0.00 -0.34 0.00 0.00 43.02 41.95 2f1d s PHE 103 CO -0.23 0.01 -0.11 0.99 -1.46 0.00 0.00 175.22 174.41 2f1d s THR 104 N -0.64 2.49 -0.09 0.12 2.01 -1.26 -1.66 115.64 116.61 2f1d s THR 104 Ca 0.02 -1.10 0.04 0.00 0.31 0.00 0.00 61.69 60.96 2f1d s THR 104 Cb -0.06 -2.23 0.00 0.00 0.01 0.00 0.00 72.50 70.21 2f1d s THR 104 CO 0.00 0.27 -0.23 0.00 -0.69 0.00 0.00 174.62 173.98 2f1d s ALA 105 N 1.28 2.09 0.49 7.40 0.00 -0.67 -4.97 121.76 127.37 2f1d s ALA 105 Ca 0.00 -0.92 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 2f1d s ALA 105 Cb -0.16 -0.78 -0.03 0.00 0.00 0.00 0.00 23.12 22.15 2f1d s ALA 105 CO -0.07 0.28 0.79 -1.25 0.00 0.00 0.00 175.76 175.50 2f1d s PRO 106 N 0.34 3.45 -0.26 0.00 0.04 -1.26 -2.39 135.00 134.93 2f1d s PRO 106 Ca -0.18 0.13 -0.04 0.00 0.04 0.00 0.00 61.00 60.95 2f1d s PRO 106 Cb -0.18 -2.38 0.09 0.00 0.04 0.00 0.00 34.50 32.07 2f1d s PRO 106 CO 0.08 -0.25 0.12 -1.17 0.04 0.00 0.00 177.00 175.82 2f1d s LEU 107 N -4.75 0.52 0.00 -3.56 2.96 -0.95 -4.93 118.68 107.97 2f1d s LEU 107 Ca 0.48 -1.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.26 2f1d s LEU 107 Cb -0.10 -0.33 0.00 0.00 0.50 0.00 0.00 46.19 46.25 2f1d s LEU 107 CO 0.44 -0.42 0.00 0.47 -1.32 0.00 0.00 176.35 175.53 2f1d n ASP 108 N 5.25 0.00 0.23 3.68 8.00 -1.26 -1.97 116.55 130.48 2f1d n ASP 108 Ca -0.06 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.56 2f1d n ASP 108 Cb 0.44 0.00 0.40 0.00 -0.02 0.00 0.00 41.12 41.94 2f1d n ASP 108 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2f1d h GLU 109 N 0.00 0.00 -7.30 -1.24 9.09 -1.97 -3.44 114.58 109.72 2f1d h GLU 109 Ca 0.00 0.00 -0.50 0.00 0.05 0.00 0.00 59.36 58.91 2f1d h GLU 109 Cb 0.00 0.00 0.05 0.00 -1.65 0.00 0.00 28.75 27.15 2f1d h GLU 109 CO 0.00 0.10 0.40 0.00 0.05 0.00 0.00 179.01 179.56 2f1d s ALA 110 N -3.44 3.01 -0.30 1.06 0.00 -0.83 -3.77 121.76 117.49 2f1d s ALA 110 Ca 0.03 0.04 -0.00 0.00 0.00 0.00 0.00 51.96 52.03 2f1d s ALA 110 Cb 0.08 -3.11 0.19 0.00 0.00 0.00 0.00 23.12 20.27 2f1d s ALA 110 CO 0.63 -0.65 0.60 -1.17 0.00 0.00 0.00 175.76 175.16 2f1d s LEU 111 N -4.89 -1.42 0.05 0.00 2.96 -0.70 -2.24 118.68 112.45 2f1d s LEU 111 Ca 0.57 0.79 0.07 0.00 -0.22 0.00 0.00 54.13 55.33 2f1d s LEU 111 Cb -0.11 2.15 -0.03 0.00 0.50 0.00 0.00 46.19 48.69 2f1d s LEU 111 CO 0.47 -0.27 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.45 2f1d s ILE 112 N 2.85 3.02 -0.33 6.68 -1.09 -1.00 -1.73 121.20 129.61 2f1d s ILE 112 Ca 0.20 -1.17 0.03 0.00 -2.23 0.00 0.00 60.65 57.48 2f1d s ILE 112 Cb -0.14 -2.32 0.10 0.00 -1.58 0.00 0.00 42.46 38.52 2f1d s ILE 112 CO -0.22 0.28 0.05 -2.28 -1.23 0.00 0.00 174.94 171.55 2f1d s HIS 113 N -1.01 3.35 -0.01 3.97 5.65 -0.52 -1.67 115.29 125.05 2f1d s HIS 113 Ca 0.16 -2.73 -0.16 0.00 0.25 0.00 0.00 55.06 52.59 2f1d s HIS 113 Cb -0.11 -2.65 -0.06 0.00 -1.18 0.00 0.00 32.58 28.59 2f1d s HIS 113 CO 0.07 -0.93 0.44 0.08 -0.65 0.00 0.00 174.74 173.75 2f1d s VAL 114 N 1.05 5.02 -0.35 0.89 1.01 -0.66 -2.16 120.40 125.20 2f1d s VAL 114 Ca 0.10 0.90 0.02 0.00 0.00 0.00 0.00 61.98 62.99 2f1d s VAL 114 Cb -0.19 -3.75 0.15 0.00 0.00 0.00 0.00 36.38 32.59 2f1d s VAL 114 CO -0.11 0.53 0.31 -0.55 0.00 0.00 0.00 175.10 175.28 2f1d s SER 115 N -0.78 1.81 0.55 3.32 0.15 -0.58 -1.74 113.70 116.43 2f1d s SER 115 Ca 0.25 -1.64 0.08 0.00 0.70 0.00 0.00 55.95 55.34 2f1d s SER 115 Cb -0.17 0.26 0.06 0.00 -1.71 0.00 0.00 66.02 64.47 2f1d s SER 115 CO 0.13 -0.29 0.66 -1.48 1.20 0.00 0.00 173.24 173.46 2f1d s LEU 116 N 1.47 3.04 -0.30 3.45 0.05 -1.03 -3.06 118.68 122.30 2f1d s LEU 116 Ca 0.16 -0.92 -0.11 0.00 0.05 0.00 0.00 54.13 53.31 2f1d s LEU 116 Cb -0.17 -1.59 0.13 0.00 -2.05 0.00 0.00 46.19 42.50 2f1d s LEU 116 CO -0.07 -1.21 0.68 -0.62 -0.55 0.00 0.00 176.35 174.58 2f1d s ASP 117 N -4.52 -1.08 -1.25 1.48 2.15 -0.32 -2.58 116.67 110.55 2f1d s ASP 117 Ca 0.53 1.50 -0.18 0.00 0.43 0.00 0.00 52.55 54.84 2f1d s ASP 117 Cb -0.05 2.17 0.09 0.00 -0.30 0.00 0.00 42.92 44.83 2f1d s ASP 117 CO 0.33 -0.21 1.65 -0.76 -0.17 0.00 0.00 175.17 176.01 2f1d s LEU 118 N 2.75 4.05 -0.01 -1.34 1.43 -0.90 -0.93 118.68 123.73 2f1d s LEU 118 Ca -0.06 -2.44 0.20 0.00 -1.03 0.00 0.00 54.13 50.80 2f1d s LEU 118 Cb -0.11 -2.54 -0.24 0.00 0.03 0.00 0.00 46.19 43.32 2f1d s LEU 118 CO -0.19 -1.13 0.76 -1.54 0.23 0.00 0.00 176.35 174.49 2f1d n SER 119 N 7.92 0.78 0.00 2.29 3.41 -1.11 -4.94 113.62 121.97 2f1d n SER 119 Ca 0.45 -0.74 0.00 0.00 -0.26 0.00 0.00 58.87 58.31 2f1d n SER 119 Cb 0.46 1.23 0.00 0.00 -0.26 0.00 0.00 64.21 65.64 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 1.44 0.22 2.89 5.00 0.00 0.19 -4.99 105.19 109.94 2f1d n GLY 120 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.13 1.40 -0.16 1.61 0.52 -1.03 -4.81 118.95 115.36 2f1d s ARG 121 Ca 0.00 -0.62 -0.29 0.00 -0.52 0.00 0.00 55.73 54.30 2f1d s ARG 121 Cb 0.00 -2.16 -0.02 0.00 0.52 0.00 0.00 34.95 33.29 2f1d s ARG 121 CO 0.00 -0.49 1.29 -1.25 0.02 0.00 0.00 175.30 174.87 2f1d s PRO 122 N 1.60 4.23 -0.10 3.54 0.04 -1.26 -3.92 135.00 139.13 2f1d s PRO 122 Ca -0.01 1.70 -0.10 0.00 0.04 0.00 0.00 61.00 62.63 2f1d s PRO 122 Cb -0.16 -3.78 0.03 0.00 0.04 0.00 0.00 34.50 30.62 2f1d s PRO 122 CO -0.07 -0.72 0.29 -0.47 0.04 0.00 0.00 177.00 176.07 2f1d s TYR 123 N 3.53 -0.31 -0.15 0.56 5.04 -1.04 -5.00 117.35 119.98 2f1d s TYR 123 Ca 0.56 0.73 0.02 0.00 -2.44 0.00 0.00 57.07 55.94 2f1d s TYR 123 Cb -0.23 0.11 0.01 0.00 0.35 0.00 0.00 41.96 42.20 2f1d s TYR 123 CO 0.16 -0.17 -0.20 -1.17 -1.34 0.00 0.00 175.55 172.82 2f1d s LEU 124 N 0.03 2.05 -0.30 6.97 2.96 -1.26 -1.37 118.68 127.76 2f1d s LEU 124 Ca -0.01 -0.59 -0.12 0.00 -0.22 0.00 0.00 54.13 53.18 2f1d s LEU 124 Cb -0.02 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.22 2f1d s LEU 124 CO 0.01 0.04 0.23 -0.83 -1.32 0.00 0.00 176.35 174.48 2f1d s GLY 125 N 1.02 1.93 -0.26 7.98 0.00 -0.06 -5.02 107.32 112.92 2f1d s GLY 125 Ca -0.02 -1.14 -0.01 0.00 0.00 0.00 0.00 44.72 43.54 2f1d s GLY 125 CO -0.06 0.73 0.06 -0.47 0.00 0.00 0.00 173.10 173.36 2f1d s TYR 126 N 1.80 1.51 -0.53 1.90 5.04 -1.26 -0.43 117.35 125.37 2f1d s TYR 126 Ca 0.08 -1.38 0.07 0.00 -2.44 0.00 0.00 57.07 53.39 2f1d s TYR 126 Cb -0.16 -1.42 0.33 0.00 0.35 0.00 0.00 41.96 41.06 2f1d s TYR 126 CO 0.11 -0.76 0.86 0.09 -1.34 0.00 0.00 175.55 174.50 2f1d n ASN 127 N 4.91 3.41 -4.09 4.32 4.13 -0.83 -5.03 115.26 122.08 2f1d n ASN 127 Ca -0.06 -3.46 -0.29 0.00 1.68 0.00 0.00 54.58 52.44 2f1d n ASN 127 Cb 0.44 -0.59 -0.17 0.00 -1.54 0.00 0.00 39.78 37.92 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 -3.02 1.81 -0.38 3.41 2.96 -1.26 -2.54 118.68 119.66 2f1d s LEU 128 Ca 0.45 -0.46 -0.02 0.00 -0.22 0.00 0.00 54.13 53.89 2f1d s LEU 128 Cb 0.27 -1.15 0.09 0.00 0.50 0.00 0.00 46.19 45.91 2f1d s LEU 128 CO -0.11 0.04 0.14 -1.83 -1.32 0.00 0.00 176.35 173.28 2f1d s GLU 129 N 0.86 2.07 -0.35 1.98 -1.05 -1.26 -5.07 118.70 115.88 2f1d s GLU 129 Ca -0.09 -1.68 -0.19 0.00 -0.15 0.00 0.00 54.97 52.86 2f1d s GLU 129 Cb -0.15 -3.46 -0.00 0.00 -0.44 0.00 0.00 34.13 30.08 2f1d s GLU 129 CO 0.00 -0.95 0.57 0.42 0.95 0.00 0.00 175.26 176.25 2f1d s ILE 130 N 1.15 4.96 -1.62 1.83 1.01 -1.26 -4.99 121.20 122.29 2f1d s ILE 130 Ca 0.05 0.44 0.24 0.00 0.00 0.00 0.00 60.65 61.38 2f1d s ILE 130 Cb -0.22 -4.01 0.50 0.00 0.01 0.00 0.00 42.46 38.74 2f1d s ILE 130 CO -0.04 -0.26 1.78 -0.81 0.00 0.00 0.00 174.94 175.61 2f1d n PRO 131 N 5.87 0.47 -4.37 2.79 -0.04 -1.26 -4.77 135.00 133.70 2f1d n PRO 131 Ca -0.03 0.04 -0.23 0.00 -0.04 0.00 0.00 63.50 63.24 2f1d n PRO 131 Cb 0.49 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.34 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 -2.38 2.01 -0.21 0.52 -4.23 -1.26 -5.05 115.64 105.03 2f1d s THR 132 Ca 0.27 -2.02 0.18 0.00 -1.18 0.00 0.00 61.69 58.94 2f1d s THR 132 Cb 0.16 -1.97 0.04 0.00 1.34 0.00 0.00 72.50 72.06 2f1d s THR 132 CO 0.33 -0.30 1.20 1.56 -0.54 0.00 0.00 174.62 176.87 2f1d h GLN 133 N 3.08 0.00 -3.40 3.99 4.20 -1.95 -3.44 115.11 117.58 2f1d h GLN 133 Ca -0.43 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.03 2f1d h GLN 133 Cb 1.21 0.00 -0.31 0.00 0.30 0.00 0.00 27.48 28.68 2f1d h GLN 133 CO 0.52 0.25 -0.65 1.03 -0.67 0.00 0.00 178.83 179.31 2f1d s ARG 134 N -3.08 0.05 -0.40 1.46 0.52 -1.26 -2.07 118.95 114.17 2f1d s ARG 134 Ca 0.01 0.25 -0.08 0.00 -0.52 0.00 0.00 55.73 55.40 2f1d s ARG 134 Cb 0.08 -0.15 0.08 0.00 0.52 0.00 0.00 34.95 35.48 2f1d s ARG 134 CO 0.76 -0.13 0.22 0.14 0.02 0.00 0.00 175.30 176.31 2f1d s VAL 135 N 0.88 3.98 0.00 3.52 -7.23 -0.92 -4.92 120.40 115.72 2f1d s VAL 135 Ca -0.07 -1.47 0.00 0.00 -1.81 0.00 0.00 61.98 58.63 2f1d s VAL 135 Cb -0.09 -3.45 0.00 0.00 0.56 0.00 0.00 36.38 33.39 2f1d s VAL 135 CO -0.04 -0.48 0.00 0.61 -0.31 0.00 0.00 175.10 174.88 2f1d n GLY 136 N 4.84 2.35 0.77 2.32 0.00 -1.26 -2.07 105.19 112.15 2f1d n GLY 136 Ca -0.09 -0.36 0.12 0.00 0.00 0.00 0.00 46.02 45.68 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 0.00 -2.71 2.61 -2.24 -1.26 -5.00 114.28 105.68 2f1d n THR 137 Ca 0.00 -0.40 -0.43 0.00 -2.27 0.00 0.00 64.05 60.95 2f1d n THR 137 Cb 0.00 1.26 -0.02 0.00 -2.10 0.00 0.00 70.33 69.47 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 -2.11 3.34 -0.01 4.78 5.04 -0.88 -4.99 117.35 122.52 2f1d s TYR 138 Ca 0.27 1.41 -0.30 0.00 -2.44 0.00 0.00 57.07 56.01 2f1d s TYR 138 Cb 0.20 -3.22 -0.07 0.00 0.35 0.00 0.00 41.96 39.22 2f1d s TYR 138 CO 0.37 -0.45 1.80 0.34 -1.34 0.00 0.00 175.55 176.26 2f1d s ASP 139 N 1.22 6.57 0.48 4.32 -1.08 -1.26 -2.15 116.67 124.77 2f1d s ASP 139 Ca 0.42 2.43 0.23 0.00 -0.52 0.00 0.00 52.55 55.12 2f1d s ASP 139 Cb -0.15 -2.53 1.24 0.00 -1.46 0.00 0.00 42.92 40.02 2f1d s ASP 139 CO 0.07 -0.98 2.01 0.74 0.52 0.00 0.00 175.17 177.52 2f1d h THR 140 N 5.60 0.74 0.00 1.71 2.02 -1.71 -2.15 112.91 119.12 2f1d h THR 140 Ca -0.44 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.03 2f1d h THR 140 Cb 1.20 1.43 -0.00 0.00 -1.74 0.00 0.00 68.15 69.04 2f1d h THR 140 CO 0.95 0.17 -0.05 1.56 0.37 0.00 0.00 175.52 178.52 2f1d h GLN 141 N 0.00 0.00 0.00 6.66 4.20 -1.90 -2.86 115.11 121.21 2f1d h GLN 141 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2f1d h GLN 141 Cb 0.41 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 2f1d h GLN 141 CO 0.02 0.05 -0.04 -0.07 -0.67 0.00 0.00 178.83 178.12 2f1d h LEU 142 N 0.00 0.00 -0.12 1.46 4.07 -1.78 -2.84 115.31 116.10 2f1d h LEU 142 Ca -0.00 0.00 0.03 0.00 0.08 0.00 0.00 57.88 57.99 2f1d h LEU 142 Cb 0.09 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.80 2f1d h LEU 142 CO 0.01 0.04 -0.07 0.58 -1.08 0.00 0.00 178.44 177.92 2f1d h VAL 143 N 0.00 0.79 -0.10 1.22 2.07 -1.71 0.16 116.25 118.69 2f1d h VAL 143 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 2f1d h VAL 143 Cb 0.15 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 2f1d h VAL 143 CO 0.01 0.00 -0.11 -0.08 0.02 0.00 0.00 177.57 177.41 2f1d h GLU 144 N -0.06 -0.13 -0.38 1.57 4.81 -1.73 -2.87 114.58 115.80 2f1d h GLU 144 Ca 0.07 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 2f1d h GLU 144 Cb 0.17 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 2f1d h GLU 144 CO -0.16 -0.09 -0.06 1.25 -0.73 0.00 0.00 179.01 179.22 2f1d h HIS 145 N -0.14 0.67 0.65 0.92 2.76 -1.44 0.24 115.15 118.80 2f1d h HIS 145 Ca 0.07 -0.10 -0.03 0.00 -2.20 0.00 0.00 60.37 58.12 2f1d h HIS 145 Cb 0.24 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.01 2f1d h HIS 145 CO -0.21 0.68 -0.42 0.35 -1.30 0.00 0.00 177.93 177.02 2f1d h PHE 146 N 0.58 -1.13 -0.14 5.26 3.57 -0.65 -1.08 116.94 123.35 2f1d h PHE 146 Ca 0.11 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.57 2f1d h PHE 146 Cb 0.46 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 39.60 2f1d h PHE 146 CO 0.02 -0.63 -0.08 0.74 -2.23 0.00 0.00 178.31 176.13 2f1d h PHE 147 N -1.02 0.22 -0.47 0.41 -1.00 -1.20 0.24 116.94 114.11 2f1d h PHE 147 Ca -0.08 -0.02 -0.08 0.00 2.81 0.00 0.00 57.97 60.60 2f1d h PHE 147 Cb 0.83 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.31 2f1d h PHE 147 CO -0.12 0.30 -0.02 0.37 -1.61 0.00 0.00 178.31 177.23 2f1d h GLN 148 N 0.21 0.85 0.00 1.51 5.75 -0.46 -2.69 115.11 120.27 2f1d h GLN 148 Ca 0.05 -0.28 -0.15 0.00 -0.15 0.00 0.00 58.65 58.11 2f1d h GLN 148 Cb 0.28 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 2f1d h GLN 148 CO 0.01 0.91 -0.72 0.77 -2.65 0.00 0.00 178.83 177.15 2f1d h SER 149 N 0.70 0.00 -0.30 -0.69 0.02 -0.26 -2.56 113.55 110.45 2f1d h SER 149 Ca 0.13 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.94 2f1d h SER 149 Cb 0.54 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 2f1d h SER 149 CO 0.03 0.72 -0.36 0.25 -1.14 0.00 0.00 176.83 176.33 2f1d h LEU 150 N 0.00 0.84 -0.78 5.07 6.46 -0.98 -3.21 115.31 122.70 2f1d h LEU 150 Ca -0.01 -0.49 -0.13 0.00 -0.12 0.00 0.00 57.88 57.14 2f1d h LEU 150 Cb 1.31 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.99 2f1d h LEU 150 CO 0.09 1.16 -0.51 0.58 -0.62 0.00 0.00 178.44 179.14 2f1d h VAL 151 N 0.54 1.35 -0.30 1.05 2.07 -1.40 -2.57 116.25 116.99 2f1d h VAL 151 Ca 0.04 -1.76 -0.13 0.00 0.82 0.00 0.00 66.70 65.67 2f1d h VAL 151 Cb 0.94 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 32.55 2f1d h VAL 151 CO 0.09 0.52 -0.32 0.78 0.02 0.00 0.00 177.57 178.66 2f1d h ASN 152 N 0.20 0.81 0.32 0.57 2.35 -1.46 -1.44 115.58 116.92 2f1d h ASN 152 Ca 0.01 -0.48 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 2f1d h ASN 152 Cb 0.97 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.11 2f1d h ASN 152 CO 0.08 1.12 -0.45 0.35 -1.65 0.00 0.00 177.43 176.88 2f1d n THR 153 N -4.21 0.00 -0.05 2.81 -2.24 -1.23 -4.12 114.28 105.24 2f1d n THR 153 Ca -0.04 -0.07 -0.04 0.00 -2.27 0.00 0.00 64.05 61.64 2f1d n THR 153 Cb 0.50 0.44 -0.15 0.00 -2.10 0.00 0.00 70.33 69.02 2f1d n THR 153 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2f1d n SER 154 N -1.07 0.23 -2.24 3.42 2.88 -0.97 -3.88 113.62 111.99 2f1d n SER 154 Ca 0.08 0.10 -0.12 0.00 -1.33 0.00 0.00 58.87 57.60 2f1d n SER 154 Cb 0.35 0.96 0.05 0.00 -0.75 0.00 0.00 64.21 64.81 2f1d n SER 154 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2f1d n GLY 155 N 1.57 0.10 3.60 0.46 0.00 -0.55 -4.74 105.19 105.63 2f1d n GLY 155 Ca -0.22 -0.16 -0.26 0.00 0.00 0.00 0.00 46.02 45.38 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 -5.52 2.18 -0.35 1.61 -2.45 -1.19 0.57 119.30 114.14 2f1d s MET 156 Ca 0.26 -1.24 -0.05 0.00 -1.25 0.00 0.00 55.69 53.41 2f1d s MET 156 Cb -0.11 -2.22 0.06 0.00 1.25 0.00 0.00 34.83 33.81 2f1d s MET 156 CO 0.40 0.43 0.12 0.99 1.05 0.00 0.00 175.02 178.01 2f1d s THR 157 N -1.78 3.51 -0.16 10.11 2.01 -0.11 -2.51 115.64 126.73 2f1d s THR 157 Ca 0.26 -1.44 0.01 0.00 0.31 0.00 0.00 61.69 60.84 2f1d s THR 157 Cb -0.09 -3.11 0.02 0.00 0.01 0.00 0.00 72.50 69.33 2f1d s THR 157 CO 0.17 -0.32 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.37 2f1d s LEU 158 N 1.31 2.00 -0.16 4.42 2.96 -0.47 -1.17 118.68 127.57 2f1d s LEU 158 Ca 0.00 -0.59 -0.02 0.00 -0.22 0.00 0.00 54.13 53.30 2f1d s LEU 158 Cb -0.21 -1.38 -0.02 0.00 0.50 0.00 0.00 46.19 45.09 2f1d s LEU 158 CO 0.00 0.01 -0.08 -1.00 -1.32 0.00 0.00 176.35 173.96 2f1d s HIS 159 N 1.18 2.90 -0.17 5.38 3.76 -1.17 -0.88 115.29 126.29 2f1d s HIS 159 Ca 0.01 -0.67 0.01 0.00 -0.15 0.00 0.00 55.06 54.26 2f1d s HIS 159 Cb -0.14 -1.95 0.02 0.00 1.11 0.00 0.00 32.58 31.62 2f1d s HIS 159 CO -0.09 -0.28 -0.20 0.42 -0.85 0.00 0.00 174.74 173.74 2f1d s ILE 160 N 0.70 2.04 -0.17 0.60 1.01 0.42 -1.53 121.20 124.26 2f1d s ILE 160 Ca -0.04 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.67 2f1d s ILE 160 Cb -0.15 -1.83 0.04 0.00 0.01 0.00 0.00 42.46 40.53 2f1d s ILE 160 CO 0.02 0.54 -0.09 -0.13 0.00 0.00 0.00 174.94 175.28 2f1d s ARG 161 N 1.16 1.81 -0.26 2.79 0.52 -0.92 -1.97 118.95 122.09 2f1d s ARG 161 Ca 0.02 -0.64 -0.29 0.00 -0.52 0.00 0.00 55.73 54.30 2f1d s ARG 161 Cb -0.14 -2.16 0.01 0.00 0.52 0.00 0.00 34.95 33.18 2f1d s ARG 161 CO -0.10 -0.39 1.11 -1.14 0.02 0.00 0.00 175.30 174.81 2f1d s GLN 162 N 1.52 4.15 -0.10 3.54 0.74 -1.05 -1.44 119.66 127.01 2f1d s GLN 162 Ca 0.01 1.28 0.18 0.00 0.05 0.00 0.00 55.36 56.87 2f1d s GLN 162 Cb -0.15 -3.72 -0.24 0.00 1.10 0.00 0.00 33.01 30.00 2f1d s GLN 162 CO -0.08 -0.80 0.37 1.28 -0.55 0.00 0.00 175.29 175.51 2f1d n LEU 163 N 6.71 0.29 -3.51 3.68 4.77 -0.70 -4.97 117.00 123.26 2f1d n LEU 163 Ca 0.13 0.13 -0.13 0.00 -0.03 0.00 0.00 56.01 56.11 2f1d n LEU 163 Cb 0.46 0.29 -0.04 0.00 -2.33 0.00 0.00 43.42 41.80 2f1d n LEU 163 CO 0.56 0.33 0.57 0.00 -1.33 0.00 0.00 177.39 177.53 2f1d s ALA 164 N -2.76 -1.79 0.00 -1.18 0.00 -1.17 -4.96 121.76 109.89 2f1d s ALA 164 Ca -0.08 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.06 2f1d s ALA 164 Cb 0.08 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.26 2f1d s ALA 164 CO 0.84 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 176.52 2f1d n GLY 165 N 0.39 4.23 1.04 0.00 0.00 -1.25 -1.72 105.19 107.88 2f1d n GLY 165 Ca -0.14 -0.42 -0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.24 0.00 -2.21 1.61 1.02 -1.26 -4.97 120.64 113.59 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 -0.43 -0.03 0.00 -0.02 0.00 0.00 31.44 30.97 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 -5.84 6.85 0.13 1.62 3.84 -1.26 -4.67 114.94 115.62 2f1d s ASN 167 Ca -0.00 2.19 -0.14 0.00 0.21 0.00 0.00 52.86 55.12 2f1d s ASN 167 Cb 0.00 -2.57 -0.02 0.00 -0.55 0.00 0.00 41.25 38.11 2f1d s ASN 167 CO 0.00 -0.68 1.57 0.28 -2.79 0.00 0.00 177.10 175.49 2f1d h SER 168 N 7.40 0.72 -0.52 -4.21 0.02 -1.98 -2.21 113.55 112.76 2f1d h SER 168 Ca -0.40 -0.31 0.10 0.00 -0.84 0.00 0.00 61.79 60.34 2f1d h SER 168 Cb 1.19 -0.19 -0.08 0.00 0.14 0.00 0.00 62.40 63.45 2f1d h SER 168 CO 0.88 0.86 0.02 -0.74 -1.14 0.00 0.00 176.83 176.71 2f1d h HIS 169 N 0.57 0.00 -0.40 3.45 6.17 -1.98 -1.59 115.15 121.38 2f1d h HIS 169 Ca 0.12 0.04 -0.05 0.00 0.71 0.00 0.00 60.37 61.19 2f1d h HIS 169 Cb 0.49 0.08 -0.02 0.00 2.52 0.00 0.00 27.41 30.48 2f1d h HIS 169 CO 0.04 -0.10 0.05 0.45 0.71 0.00 0.00 177.93 179.07 2f1d h HIS 170 N 0.14 0.62 -0.11 5.26 3.86 -1.86 -1.88 115.15 121.19 2f1d h HIS 170 Ca 0.27 -0.06 -0.17 0.00 -1.16 0.00 0.00 60.37 59.25 2f1d h HIS 170 Cb 0.40 -0.18 0.01 0.00 1.06 0.00 0.00 27.41 28.70 2f1d h HIS 170 CO -0.31 0.57 -0.58 0.82 0.86 0.00 0.00 177.93 179.29 2f1d h ILE 171 N 0.59 1.35 -0.14 2.45 2.04 -0.75 -1.91 117.51 121.14 2f1d h ILE 171 Ca 0.13 -1.88 -0.14 0.00 1.00 0.00 0.00 64.86 63.97 2f1d h ILE 171 Cb 0.30 2.17 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 2f1d h ILE 171 CO 0.00 0.57 -0.45 0.40 0.00 0.00 0.00 178.15 178.67 2f1d h ILE 172 N 0.21 1.35 -0.71 -0.67 2.04 -1.28 -2.32 117.51 116.13 2f1d h ILE 172 Ca -0.04 -1.74 -0.05 0.00 1.00 0.00 0.00 64.86 64.03 2f1d h ILE 172 Cb 1.22 2.06 -0.03 0.00 -0.74 0.00 0.00 36.82 39.33 2f1d h ILE 172 CO 0.12 0.53 0.26 -0.08 0.00 0.00 0.00 178.15 178.97 2f1d h GLU 173 N 0.19 1.07 0.00 2.37 4.81 -1.42 -1.85 114.58 119.75 2f1d h GLU 173 Ca -0.02 -0.21 -0.07 0.00 -0.13 0.00 0.00 59.36 58.93 2f1d h GLU 173 Cb 1.08 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 2f1d h GLU 173 CO 0.10 0.90 -0.33 0.00 -0.73 0.00 0.00 179.01 178.95 2f1d h ALA 174 N 1.12 1.11 -0.12 2.92 0.00 -1.38 -0.80 119.26 122.10 2f1d h ALA 174 Ca 0.23 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2f1d h ALA 174 Cb 0.25 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2f1d h ALA 174 CO -0.01 0.41 -0.08 1.15 0.00 0.00 0.00 179.25 180.72 2f1d h THR 175 N 0.00 1.33 0.00 0.00 2.02 -0.81 -2.12 112.91 113.32 2f1d h THR 175 Ca -0.00 -1.14 -0.06 0.00 0.77 0.00 0.00 66.41 65.97 2f1d h THR 175 Cb 0.76 1.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.98 2f1d h THR 175 CO 0.04 0.33 -0.29 -0.26 0.37 0.00 0.00 175.52 175.71 2f1d h PHE 176 N -0.09 0.00 0.64 3.16 -1.00 -1.12 0.79 116.94 119.32 2f1d h PHE 176 Ca 0.03 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.77 2f1d h PHE 176 Cb 0.55 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.12 2f1d h PHE 176 CO 0.07 0.29 -0.31 0.87 -1.61 0.00 0.00 178.31 177.63 2f1d h LYS 177 N 0.00 -0.83 -0.66 1.51 1.57 -1.11 -2.58 116.57 114.47 2f1d h LYS 177 Ca -0.00 0.06 0.10 0.00 -1.87 0.00 0.00 60.65 58.93 2f1d h LYS 177 Cb 0.59 0.19 -0.07 0.00 0.08 0.00 0.00 32.23 33.01 2f1d h LYS 177 CO 0.04 -0.55 0.28 0.00 -0.57 0.00 0.00 179.45 178.65 2f1d h ALA 178 N -1.25 0.89 -0.71 3.86 0.00 -1.28 -1.73 119.26 119.04 2f1d h ALA 178 Ca -0.09 0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2f1d h ALA 178 Cb 0.66 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2f1d h ALA 178 CO 0.14 -0.14 0.47 0.35 0.00 0.00 0.00 179.25 180.08 2f1d h PHE 179 N 0.49 0.89 -0.10 0.00 3.57 -0.92 -2.74 116.94 118.13 2f1d h PHE 179 Ca 0.34 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.71 2f1d h PHE 179 Cb 0.40 -0.30 0.01 0.00 2.79 0.00 0.00 35.95 38.85 2f1d h PHE 179 CO -0.14 0.55 -0.49 0.00 -2.23 0.00 0.00 178.31 175.99 2f1d h ALA 180 N 1.56 0.19 0.00 2.41 0.00 -0.92 -1.66 119.26 120.84 2f1d h ALA 180 Ca 0.26 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2f1d h ALA 180 Cb -0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2f1d h ALA 180 CO -0.06 0.37 -0.10 0.00 0.00 0.00 0.00 179.25 179.46 2f1d h ARG 181 N 0.09 0.00 0.00 0.00 3.08 -1.20 -0.85 114.38 115.50 2f1d h ARG 181 Ca -0.03 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.82 2f1d h ARG 181 Cb 1.14 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.16 2f1d h ARG 181 CO 0.10 0.10 -1.94 0.00 -1.07 0.00 0.00 179.97 177.16 2f1d n ALA 182 N -2.18 2.04 -0.11 0.04 0.00 -1.05 -2.76 120.51 116.49 2f1d n ALA 182 Ca -0.01 -0.83 -0.13 0.00 0.00 0.00 0.00 53.44 52.48 2f1d n ALA 182 Cb 0.30 -0.61 -0.03 0.00 0.00 0.00 0.00 19.45 19.10 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 0.75 -0.71 0.00 6.46 -1.00 -2.33 115.31 118.48 2f1d h LEU 183 Ca -0.26 -0.44 0.03 0.00 -0.12 0.00 0.00 57.88 57.10 2f1d h LEU 183 Cb 1.65 -0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 41.33 2f1d h LEU 183 CO 0.03 1.03 0.44 -0.09 -0.62 0.00 0.00 178.44 179.23 2f1d h ARG 184 N 0.48 0.84 -0.47 1.25 2.43 -1.29 -1.44 114.38 116.18 2f1d h ARG 184 Ca 0.06 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.09 2f1d h ARG 184 Cb 0.78 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 2f1d h ARG 184 CO 0.06 0.56 -0.05 0.37 -1.51 0.00 0.00 179.97 179.40 2f1d h GLN 185 N 0.87 0.87 -0.30 0.20 4.15 -1.46 -1.61 115.11 117.83 2f1d h GLN 185 Ca 0.28 -0.30 -0.13 0.00 0.77 0.00 0.00 58.65 59.27 2f1d h GLN 185 Cb 0.01 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 2f1d h GLN 185 CO -0.11 0.94 -0.34 0.00 -1.93 0.00 0.00 178.83 177.39 2f1d h ALA 186 N 0.90 0.85 0.00 3.38 0.00 -1.22 -3.08 119.26 120.10 2f1d h ALA 186 Ca 0.13 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2f1d h ALA 186 Cb 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2f1d h ALA 186 CO 0.03 0.64 -0.34 1.79 0.00 0.00 0.00 179.25 181.37 2f1d h THR 187 N 0.55 0.00 -3.35 0.00 1.35 -1.16 -1.07 112.91 109.23 2f1d h THR 187 Ca 0.06 -0.90 -0.45 0.00 -0.55 0.00 0.00 66.41 64.57 2f1d h THR 187 Cb 0.85 1.72 0.22 0.00 -1.73 0.00 0.00 68.15 69.20 2f1d h THR 187 CO 0.07 0.00 -0.03 -0.62 -0.25 0.00 0.00 175.52 174.69 2f1d n GLU 188 N -2.80 -2.11 -3.51 4.72 1.02 -0.62 -4.78 120.64 112.57 2f1d n GLU 188 Ca 0.03 -0.58 -0.31 0.00 -0.02 0.00 0.00 57.16 56.28 2f1d n GLU 188 Cb 0.52 -2.18 -0.05 0.00 -0.02 0.00 0.00 31.44 29.71 2f1d n GLU 188 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2f1d s THR 189 N -2.43 5.03 -0.21 2.62 -4.23 -1.26 -2.32 115.64 112.83 2f1d s THR 189 Ca 0.68 0.26 -0.06 0.00 -1.18 0.00 0.00 61.69 61.39 2f1d s THR 189 Cb -0.25 -3.63 -0.03 0.00 1.34 0.00 0.00 72.50 69.94 2f1d s THR 189 CO 0.64 -0.05 0.02 -0.62 -0.54 0.00 0.00 174.62 174.07 2f1d s ASP 190 N -2.47 4.98 -0.82 3.99 -1.08 -0.70 -4.71 116.67 115.86 2f1d s ASP 190 Ca 0.45 -0.18 -0.16 0.00 -0.52 0.00 0.00 52.55 52.14 2f1d s ASP 190 Cb -0.11 -1.86 -0.22 0.00 -1.46 0.00 0.00 42.92 39.26 2f1d s ASP 190 CO 0.23 0.04 2.11 -2.65 0.52 0.00 0.00 175.17 175.43 2f1d n PRO 191 N 4.38 0.20 0.00 4.34 -0.02 -1.26 -4.79 135.00 137.85 2f1d n PRO 191 Ca -0.17 -0.45 0.10 0.00 -2.02 0.00 0.00 63.50 60.96 2f1d n PRO 191 Cb 0.52 -2.21 0.58 0.00 -0.02 0.00 0.00 33.50 32.36 2f1d n PRO 191 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02